#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 4.92 0.24 2.46 1.01 -1.26 -4.98 120.40 122.79 2q3r s VAL 10 Ca 0.00 1.39 -0.14 0.00 0.00 0.00 0.00 61.98 63.23 2q3r s VAL 10 Cb 0.00 -4.04 0.31 0.00 0.00 0.00 0.00 36.38 32.65 2q3r s VAL 10 CO 0.00 0.00 1.57 -0.65 0.00 0.00 0.00 175.10 176.03 2q3r h PRO 11 N 7.64 -0.02 0.00 2.72 0.11 -1.96 0.25 132.00 140.74 2q3r h PRO 11 Ca -0.27 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.82 2q3r h PRO 11 Cb 1.12 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 2q3r h PRO 11 CO 0.82 -0.02 -0.14 -0.07 -0.21 0.00 0.00 178.00 178.38 2q3r h LEU 12 N -0.02 0.00 -2.48 2.35 3.38 -1.84 -2.19 115.31 114.50 2q3r h LEU 12 Ca 0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.35 2q3r h LEU 12 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 2q3r h LEU 12 CO -0.91 0.14 0.00 0.18 0.09 0.00 0.00 178.44 177.94 2q3r n LEU 13 N -4.02 3.76 -4.81 1.67 7.99 0.84 -1.02 117.00 121.40 2q3r n LEU 13 Ca -0.02 -1.90 -0.38 0.00 -0.01 0.00 0.00 56.01 53.70 2q3r n LEU 13 Cb 0.23 -0.51 -0.06 0.00 -0.11 0.00 0.00 43.42 42.97 2q3r n LEU 13 CO 0.33 0.63 0.07 0.42 -1.51 0.00 0.00 177.39 177.34 2q3r s THR 14 N -1.79 5.13 0.88 -5.08 -4.23 -0.83 -4.70 115.64 105.02 2q3r s THR 14 Ca 0.39 0.76 -0.12 0.00 -1.18 0.00 0.00 61.69 61.53 2q3r s THR 14 Cb 0.25 -3.68 0.09 0.00 1.34 0.00 0.00 72.50 70.50 2q3r s THR 14 CO 0.18 0.53 0.93 -2.65 -0.54 0.00 0.00 174.62 173.07 2q3r n PRO 15 N 2.30 -0.20 -3.78 3.99 -0.02 -0.99 -3.91 135.00 132.39 2q3r n PRO 15 Ca -0.13 0.01 -0.12 0.00 -2.02 0.00 0.00 63.50 61.24 2q3r n PRO 15 Cb 0.52 -2.23 -0.08 0.00 -0.02 0.00 0.00 33.50 31.70 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 -2.39 -0.09 -0.48 6.00 5.04 0.07 -4.88 117.35 120.62 2q3r s TYR 16 Ca 0.66 -0.01 -0.01 0.00 -2.44 0.00 0.00 57.07 55.28 2q3r s TYR 16 Cb -0.25 0.07 0.13 0.00 0.35 0.00 0.00 41.96 42.25 2q3r s TYR 16 CO 0.58 -0.45 0.26 0.21 -1.34 0.00 0.00 175.55 174.82 2q3r s LYS 17 N -2.21 2.09 -0.73 4.97 2.20 -1.26 -0.89 119.74 123.92 2q3r s LYS 17 Ca -0.07 -2.19 -0.26 0.00 -0.36 0.00 0.00 55.97 53.09 2q3r s LYS 17 Cb -0.02 -3.53 0.04 0.00 -1.51 0.00 0.00 37.83 32.81 2q3r s LYS 17 CO -0.01 -1.09 1.21 1.41 -0.36 0.00 0.00 175.35 176.51 2q3r s MET 18 N 0.49 3.19 5.59 4.03 -2.45 -0.33 -4.84 119.30 124.98 2q3r s MET 18 Ca 0.13 -0.42 0.00 0.00 -1.25 0.00 0.00 55.69 54.14 2q3r s MET 18 Cb -0.22 -4.24 0.00 0.00 1.25 0.00 0.00 34.83 31.62 2q3r s MET 18 CO -0.04 -2.07 0.00 0.41 1.05 0.00 0.00 175.02 174.37 2q3r n GLY 19 N 5.42 3.51 0.29 2.11 0.00 -1.26 0.25 105.19 115.51 2q3r n GLY 19 Ca 0.03 0.24 0.13 0.00 0.00 0.00 0.00 46.02 46.41 2q3r n GLY 19 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2q3r n ARG 20 N 12.42 1.00 -3.49 1.61 3.00 -1.26 -4.89 116.66 125.04 2q3r n ARG 20 Ca 0.00 -0.59 -0.37 0.00 -0.00 0.00 0.00 57.85 56.89 2q3r n ARG 20 Cb 0.00 -1.49 -0.06 0.00 0.00 0.00 0.00 32.46 30.91 2q3r n ARG 20 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 2q3r s PHE 21 N -2.41 3.69 -0.54 -0.14 0.40 0.14 -5.06 117.98 114.07 2q3r s PHE 21 Ca 0.27 0.97 -0.12 0.00 -0.60 0.00 0.00 56.93 57.45 2q3r s PHE 21 Cb 0.20 -2.28 0.13 0.00 0.51 0.00 0.00 43.02 41.58 2q3r s PHE 21 CO 0.49 0.60 0.45 -0.80 0.70 0.00 0.00 175.22 176.66 2q3r s ASN 22 N -1.28 6.00 -0.00 1.36 0.01 -1.26 -1.19 114.94 118.58 2q3r s ASN 22 Ca 0.27 -1.95 -0.15 0.00 -0.71 0.00 0.00 52.86 50.32 2q3r s ASN 22 Cb -0.16 -2.11 -0.06 0.00 0.41 0.00 0.00 41.25 39.33 2q3r s ASN 22 CO 0.15 -0.75 0.42 -0.76 -1.51 0.00 0.00 177.10 174.65 2q3r s LEU 23 N 1.33 4.47 0.28 0.60 1.43 -0.06 -4.64 118.68 122.08 2q3r s LEU 23 Ca 0.06 0.97 0.18 0.00 -1.03 0.00 0.00 54.13 54.31 2q3r s LEU 23 Cb -0.26 -2.61 0.10 0.00 0.03 0.00 0.00 46.19 43.44 2q3r s LEU 23 CO 0.00 0.30 1.37 0.28 0.23 0.00 0.00 176.35 178.54 2q3r h SER 24 N 4.82 0.00 -5.08 2.29 0.02 -1.56 0.23 113.55 114.28 2q3r h SER 24 Ca -0.51 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 60.46 2q3r h SER 24 Cb 1.22 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.70 2q3r h SER 24 CO 0.62 0.36 0.12 -1.38 -1.14 0.00 0.00 176.83 175.41 2q3r s HIS 25 N -3.04 0.01 -0.83 3.45 0.00 -1.26 -2.35 115.29 111.28 2q3r s HIS 25 Ca 0.03 -0.45 0.16 0.00 -3.00 0.00 0.00 55.06 51.80 2q3r s HIS 25 Cb 0.07 0.55 0.62 0.00 -4.00 0.00 0.00 32.58 29.82 2q3r s HIS 25 CO 0.74 -1.19 1.54 0.54 -1.00 0.00 0.00 174.74 175.37 2q3r n ARG 26 N -0.44 3.52 -2.80 -0.38 3.00 -0.19 -4.76 116.66 114.61 2q3r n ARG 26 Ca -0.03 -2.76 -0.43 0.00 -0.01 0.00 0.00 57.85 54.61 2q3r n ARG 26 Cb 0.60 -1.81 -0.04 0.00 0.00 0.00 0.00 32.46 31.21 2q3r n ARG 26 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2q3r s VAL 27 N -1.98 4.44 -0.17 1.55 1.01 -1.26 -1.81 120.40 122.18 2q3r s VAL 27 Ca 0.45 0.76 -0.05 0.00 0.00 0.00 0.00 61.98 63.13 2q3r s VAL 27 Cb 0.30 -4.46 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 2q3r s VAL 27 CO 0.19 -0.88 -0.00 -0.69 0.00 0.00 0.00 175.10 173.72 2q3r s VAL 28 N 3.85 4.17 -0.16 2.92 1.01 -0.04 -4.47 120.40 127.68 2q3r s VAL 28 Ca 0.38 -0.25 -0.29 0.00 0.00 0.00 0.00 61.98 61.81 2q3r s VAL 28 Cb -0.10 -2.85 -0.03 0.00 0.00 0.00 0.00 36.38 33.39 2q3r s VAL 28 CO 0.26 0.47 1.55 -0.22 0.00 0.00 0.00 175.10 177.16 2q3r s LEU 29 N 0.50 4.09 0.46 3.92 2.96 -1.19 0.11 118.68 129.54 2q3r s LEU 29 Ca -0.01 1.83 -0.22 0.00 -0.22 0.00 0.00 54.13 55.51 2q3r s LEU 29 Cb -0.14 -3.53 -0.08 0.00 0.50 0.00 0.00 46.19 42.94 2q3r s LEU 29 CO 0.02 -1.04 1.10 0.00 -1.32 0.00 0.00 176.35 175.11 2q3r s ALA 30 N 4.45 2.93 0.13 5.97 0.00 -0.13 -2.63 121.76 132.48 2q3r s ALA 30 Ca 0.68 0.78 -0.33 0.00 0.00 0.00 0.00 51.96 53.09 2q3r s ALA 30 Cb -0.27 -3.32 -0.13 0.00 0.00 0.00 0.00 23.12 19.41 2q3r s ALA 30 CO 0.26 -0.48 1.70 -0.35 0.00 0.00 0.00 175.76 176.90 2q3r n PRO 31 N -0.62 2.43 -3.74 0.00 -0.04 -1.24 -4.81 135.00 126.98 2q3r n PRO 31 Ca 0.08 0.88 -0.29 0.00 -0.04 0.00 0.00 63.50 64.12 2q3r n PRO 31 Cb 0.50 -2.70 -0.15 0.00 -0.04 0.00 0.00 33.50 31.11 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 1.72 2.06 0.00 1.53 1.43 -1.26 -4.85 118.68 119.31 2q3r s LEU 32 Ca 0.80 -1.47 -0.31 0.00 -1.03 0.00 0.00 54.13 52.13 2q3r s LEU 32 Cb -0.60 -0.83 -0.09 0.00 0.03 0.00 0.00 46.19 44.69 2q3r s LEU 32 CO 0.38 -0.39 1.97 0.41 0.23 0.00 0.00 176.35 178.96 2q3r n THR 33 N 4.88 0.72 0.13 5.49 -1.04 -1.26 -4.33 114.28 118.87 2q3r n THR 33 Ca -0.04 -0.15 0.01 0.00 -2.04 0.00 0.00 64.05 61.84 2q3r n THR 33 Cb 0.43 -2.26 -0.01 0.00 -1.82 0.00 0.00 70.33 66.68 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 7.46 3.74 -3.68 -2.82 5.12 -1.26 -4.80 116.66 120.41 2q3r n ARG 34 Ca 0.21 -0.24 -0.29 0.00 -1.93 0.00 0.00 57.85 55.60 2q3r n ARG 34 Cb 0.39 -0.78 0.04 0.00 -1.16 0.00 0.00 32.46 30.95 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 -0.63 -1.78 -0.53 5.56 6.02 -1.26 -4.49 117.38 120.28 2q3r n GLN 35 Ca 0.01 0.49 0.00 0.00 -0.01 0.00 0.00 57.00 57.49 2q3r n GLN 35 Cb 0.05 -4.35 0.00 0.00 1.02 0.00 0.00 30.24 26.97 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 -4.16 0.02 -3.23 -1.09 1.74 -0.85 -4.43 116.66 104.67 2q3r n ARG 36 Ca -0.13 -1.06 -0.41 0.00 -0.77 0.00 0.00 57.85 55.48 2q3r n ARG 36 Cb 0.61 -0.50 -0.01 0.00 -1.02 0.00 0.00 32.46 31.53 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 -0.01 5.58 -4.58 0.55 7.64 -0.54 -4.63 113.62 117.63 2q3r n SER 37 Ca 0.01 -3.28 -0.60 0.00 1.01 0.00 0.00 58.87 56.01 2q3r n SER 37 Cb 0.71 -1.20 -0.08 0.00 -1.01 0.00 0.00 64.21 62.63 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 1.75 1.08 -1.23 1.43 0.53 -1.23 0.30 117.16 119.79 2q3r n TYR 38 Ca 0.25 0.98 -0.08 0.00 -1.02 0.00 0.00 57.90 58.04 2q3r n TYR 38 Cb 0.36 -2.18 -0.03 0.00 -1.03 0.00 0.00 39.34 36.46 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 2.31 0.92 2.15 2.72 0.00 -1.26 -1.33 105.19 110.70 2q3r n GLY 39 Ca 0.22 -0.22 -0.01 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.42 -3.47 -4.68 1.61 3.02 0.15 -4.98 115.26 106.49 2q3r n ASN 40 Ca -0.08 0.02 -0.36 0.00 -0.03 0.00 0.00 54.58 54.12 2q3r n ASN 40 Cb 0.40 -1.02 -0.09 0.00 -0.61 0.00 0.00 39.78 38.46 2q3r n ASN 40 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2q3r s VAL 41 N -1.89 5.36 0.65 2.41 1.01 -0.44 -0.81 120.40 126.69 2q3r s VAL 41 Ca 0.00 0.23 -0.17 0.00 0.00 0.00 0.00 61.98 62.04 2q3r s VAL 41 Cb 0.00 -3.51 -0.05 0.00 0.00 0.00 0.00 36.38 32.82 2q3r s VAL 41 CO 0.00 0.37 0.69 -2.65 0.00 0.00 0.00 175.10 173.50 2q3r n PRO 42 N 4.06 0.53 -4.35 2.72 -0.02 -1.26 -3.51 135.00 133.17 2q3r n PRO 42 Ca -0.15 0.22 -0.20 0.00 -2.02 0.00 0.00 63.50 61.35 2q3r n PRO 42 Cb 0.52 -1.92 -0.10 0.00 -0.02 0.00 0.00 33.50 31.98 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 -2.62 1.35 0.24 -0.52 -1.52 -1.26 -4.87 119.66 110.45 2q3r s GLN 43 Ca 0.70 -1.54 -0.05 0.00 -1.95 0.00 0.00 55.36 52.52 2q3r s GLN 43 Cb -0.39 -1.28 0.42 0.00 -0.22 0.00 0.00 33.01 31.54 2q3r s GLN 43 CO 0.53 0.24 1.73 -1.35 -0.25 0.00 0.00 175.29 176.18 2q3r h PRO 44 N 2.81 0.40 -0.25 2.91 0.11 -1.94 -1.04 132.00 134.99 2q3r h PRO 44 Ca -0.40 -0.02 0.07 0.00 0.11 0.00 0.00 66.00 65.75 2q3r h PRO 44 Cb 1.22 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2q3r h PRO 44 CO 0.57 0.26 0.18 1.12 -0.21 0.00 0.00 178.00 179.92 2q3r h HIS 45 N 0.41 0.04 -0.61 0.65 2.07 -1.96 -0.17 115.15 115.58 2q3r h HIS 45 Ca 0.39 0.00 0.09 0.00 -2.85 0.00 0.00 60.37 58.00 2q3r h HIS 45 Cb 0.59 -0.01 -0.04 0.00 2.57 0.00 0.00 27.41 30.52 2q3r h HIS 45 CO -0.18 0.02 0.41 0.00 -3.07 0.00 0.00 177.93 175.11 2q3r h ALA 46 N 1.87 1.95 -0.11 6.11 0.00 -1.54 0.21 119.26 127.75 2q3r h ALA 46 Ca 0.12 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 2q3r h ALA 46 Cb 0.43 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2q3r h ALA 46 CO -0.01 -0.07 -0.22 0.00 0.00 0.00 0.00 179.25 178.95 2q3r h ALA 47 N 1.69 1.42 -0.07 0.00 0.00 -1.10 -0.61 119.26 120.59 2q3r h ALA 47 Ca 0.28 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 2q3r h ALA 47 Cb 0.47 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.18 2q3r h ALA 47 CO -0.08 0.41 -0.37 0.82 0.00 0.00 0.00 179.25 180.02 2q3r h ILE 48 N 0.18 1.42 0.34 0.00 1.08 -0.71 -2.63 117.51 117.18 2q3r h ILE 48 Ca 0.03 -1.79 -0.00 0.00 -0.39 0.00 0.00 64.86 62.71 2q3r h ILE 48 Cb 0.49 2.35 -0.02 0.00 -3.07 0.00 0.00 36.82 36.58 2q3r h ILE 48 CO 0.03 0.52 -0.30 0.22 -0.69 0.00 0.00 178.15 177.93 2q3r h TYR 49 N -0.12 -0.81 0.00 1.37 3.20 -0.52 -1.18 116.97 118.91 2q3r h TYR 49 Ca -0.03 0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.76 2q3r h TYR 49 Cb 1.03 0.31 -0.01 0.00 1.54 0.00 0.00 36.73 39.60 2q3r h TYR 49 CO 0.13 -0.44 -0.43 1.88 -1.64 0.00 0.00 178.16 177.66 2q3r h TYR 50 N -0.66 0.00 -0.32 -3.82 0.05 -1.25 -3.15 116.97 107.82 2q3r h TYR 50 Ca -0.02 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.69 2q3r h TYR 50 Cb 0.59 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.32 2q3r h TYR 50 CO -0.17 0.43 -0.07 1.03 -1.05 0.00 0.00 178.16 178.33 2q3r h SER 51 N 0.00 0.61 -0.36 3.88 0.87 -1.28 -2.63 113.55 114.64 2q3r h SER 51 Ca -0.00 -0.36 -0.00 0.00 -1.23 0.00 0.00 61.79 60.19 2q3r h SER 51 Cb 0.94 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.72 2q3r h SER 51 CO 0.06 0.83 0.22 1.56 -0.53 0.00 0.00 176.83 178.97 2q3r h GLN 52 N 0.38 0.49 -0.44 2.24 4.20 -1.18 -2.08 115.11 118.72 2q3r h GLN 52 Ca 0.08 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2q3r h GLN 52 Cb 0.56 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.23 2q3r h GLN 52 CO 0.03 0.34 0.00 0.54 -0.67 0.00 0.00 178.83 179.07 2q3r n ARG 53 N -4.46 2.05 -3.53 1.46 1.74 -1.11 -4.50 116.66 108.30 2q3r n ARG 53 Ca 0.02 -1.62 -0.36 0.00 -0.77 0.00 0.00 57.85 55.12 2q3r n ARG 53 Cb 0.08 -1.36 -0.07 0.00 -1.02 0.00 0.00 32.46 30.09 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 -1.42 5.30 0.05 0.55 2.01 -0.79 -4.99 115.64 116.36 2q3r s THR 54 Ca 0.31 0.55 0.06 0.00 0.31 0.00 0.00 61.69 62.93 2q3r s THR 54 Cb 0.16 -3.63 -0.03 0.00 0.01 0.00 0.00 72.50 69.01 2q3r s THR 54 CO 0.21 0.39 -0.18 0.42 -0.69 0.00 0.00 174.62 174.78 2q3r s THR 55 N 0.46 1.40 0.09 -0.82 -4.23 -1.26 -4.96 115.64 106.33 2q3r s THR 55 Ca 0.17 -1.16 -0.31 0.00 -1.18 0.00 0.00 61.69 59.20 2q3r s THR 55 Cb -0.13 -1.25 -0.10 0.00 1.34 0.00 0.00 72.50 72.36 2q3r s THR 55 CO 0.04 0.06 1.81 -2.84 -0.54 0.00 0.00 174.62 173.15 2q3r s PRO 56 N -1.29 4.15 0.00 3.99 0.02 -0.91 -0.68 135.00 140.29 2q3r s PRO 56 Ca 0.04 2.53 0.00 0.00 0.02 0.00 0.00 61.00 63.59 2q3r s PRO 56 Cb -0.09 -3.69 0.00 0.00 0.02 0.00 0.00 34.50 30.74 2q3r s PRO 56 CO 0.02 -0.84 0.00 0.41 -0.33 0.00 0.00 177.00 176.26 2q3r n GLY 57 N 4.23 1.80 3.79 0.52 0.00 0.14 -4.54 105.19 111.12 2q3r n GLY 57 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.07 2.57 -0.19 -0.02 0.00 0.15 -1.66 107.32 106.10 2q3r s GLY 58 Ca 0.00 0.67 -0.07 0.00 0.00 0.00 0.00 44.72 45.32 2q3r s GLY 58 CO 0.00 1.01 0.05 -0.12 0.00 0.00 0.00 173.10 174.04 2q3r s PHE 59 N -1.88 3.18 -0.06 1.90 5.99 -1.26 -1.30 117.98 124.55 2q3r s PHE 59 Ca 0.67 -0.07 0.05 0.00 0.00 0.00 0.00 56.93 57.58 2q3r s PHE 59 Cb -0.19 -2.08 -0.02 0.00 0.00 0.00 0.00 43.02 40.73 2q3r s PHE 59 CO 0.23 0.04 -0.22 -0.51 -0.00 0.00 0.00 175.22 174.75 2q3r s LEU 60 N 0.58 2.25 -0.16 6.12 1.02 0.57 -3.17 118.68 125.89 2q3r s LEU 60 Ca 0.02 -0.43 0.00 0.00 0.02 0.00 0.00 54.13 53.74 2q3r s LEU 60 Cb -0.13 -1.43 0.00 0.00 0.02 0.00 0.00 46.19 44.65 2q3r s LEU 60 CO 0.01 0.27 -0.15 -0.63 0.02 0.00 0.00 176.35 175.87 2q3r s ILE 61 N -0.28 2.61 0.84 -0.59 1.01 -1.08 -1.21 121.20 122.50 2q3r s ILE 61 Ca 0.00 -0.78 -0.11 0.00 0.00 0.00 0.00 60.65 59.76 2q3r s ILE 61 Cb -0.13 -2.11 0.10 0.00 0.01 0.00 0.00 42.46 40.33 2q3r s ILE 61 CO 0.03 0.51 1.09 0.42 0.00 0.00 0.00 174.94 176.99 2q3r s THR 62 N 0.96 2.95 0.92 2.92 -4.23 -0.66 -3.73 115.64 114.76 2q3r s THR 62 Ca -0.03 0.31 -0.10 0.00 -1.18 0.00 0.00 61.69 60.69 2q3r s THR 62 Cb -0.15 -2.79 0.15 0.00 1.34 0.00 0.00 72.50 71.05 2q3r s THR 62 CO -0.03 -0.40 1.14 -1.83 -0.54 0.00 0.00 174.62 172.96 2q3r s GLU 63 N -4.92 1.01 0.39 3.99 -1.05 -1.26 -4.16 118.70 112.70 2q3r s GLU 63 Ca 0.62 1.51 -0.27 0.00 -0.15 0.00 0.00 54.97 56.68 2q3r s GLU 63 Cb -0.18 -1.73 -0.11 0.00 -0.44 0.00 0.00 34.13 31.68 2q3r s GLU 63 CO 0.57 -2.63 1.45 0.00 0.95 0.00 0.00 175.26 175.60 2q3r n ALA 64 N -4.23 2.15 -3.81 -0.84 0.00 -1.26 -4.39 120.51 108.13 2q3r n ALA 64 Ca 0.11 0.33 -0.28 0.00 0.00 0.00 0.00 53.44 53.60 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 -1.13 0.88 0.52 0.00 2.01 -0.22 -4.24 115.64 113.45 2q3r s THR 65 Ca 0.55 -0.75 -0.20 0.00 0.31 0.00 0.00 61.69 61.61 2q3r s THR 65 Cb -0.48 -1.27 -0.10 0.00 0.01 0.00 0.00 72.50 70.65 2q3r s THR 65 CO 0.62 -0.13 0.57 0.61 -0.69 0.00 0.00 174.62 175.60 2q3r n GLY 66 N 4.92 -1.38 0.45 4.40 0.00 0.48 -2.98 105.19 111.08 2q3r n GLY 66 Ca -0.10 -0.08 0.08 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.36 0.00 -3.82 1.61 0.24 -1.14 -0.43 118.33 113.43 2q3r n VAL 67 Ca 0.11 -0.37 -0.08 0.00 -2.04 0.00 0.00 64.34 61.96 2q3r n VAL 67 Cb 0.45 1.23 0.02 0.00 -1.47 0.00 0.00 33.84 34.07 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 -1.81 -0.02 0.00 -1.34 1.04 -1.26 -4.56 113.70 105.75 2q3r s SER 68 Ca 0.15 -1.06 0.27 0.00 0.48 0.00 0.00 55.95 55.79 2q3r s SER 68 Cb 0.13 0.82 1.49 0.00 0.10 0.00 0.00 66.02 68.56 2q3r s SER 68 CO 0.37 -1.61 1.94 -0.90 0.98 0.00 0.00 173.24 174.01 2q3r n ASP 69 N -1.30 0.00 0.00 7.02 5.75 -1.26 -2.85 116.55 123.91 2q3r n ASP 69 Ca -0.08 -0.49 0.00 0.00 -0.01 0.00 0.00 54.79 54.22 2q3r n ASP 69 Cb 0.60 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.55 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 -1.14 0.81 0.34 2.12 -2.24 -1.26 -4.33 114.28 108.59 2q3r n THR 70 Ca 0.17 -0.88 0.06 0.00 -2.27 0.00 0.00 64.05 61.13 2q3r n THR 70 Cb 0.15 0.60 0.21 0.00 -2.10 0.00 0.00 70.33 69.20 2q3r n THR 70 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2q3r n ALA 71 N -0.41 2.70 -2.53 6.98 0.00 -1.13 -4.81 120.51 121.31 2q3r n ALA 71 Ca 0.00 -0.91 -0.32 0.00 0.00 0.00 0.00 53.44 52.22 2q3r n ALA 71 Cb 0.23 -1.00 -0.11 0.00 0.00 0.00 0.00 19.45 18.57 2q3r n ALA 71 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2q3r s GLN 72 N -1.59 2.38 0.00 0.00 1.11 -1.26 -2.87 119.66 117.42 2q3r s GLN 72 Ca 0.31 -0.81 0.00 0.00 0.01 0.00 0.00 55.36 54.87 2q3r s GLN 72 Cb 0.19 -2.38 0.00 0.00 -1.01 0.00 0.00 33.01 29.81 2q3r s GLN 72 CO 0.17 0.58 0.24 0.41 0.01 0.00 0.00 175.29 176.71 2q3r n GLY 73 N 1.63 -0.96 3.05 3.09 0.00 -1.26 -4.62 105.19 106.12 2q3r n GLY 73 Ca -0.16 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 2q3r n GLY 73 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2q3r s TYR 74 N 0.00 0.58 0.64 1.61 2.02 -1.26 -4.75 117.35 116.19 2q3r s TYR 74 Ca 0.00 -0.58 -0.17 0.00 -0.37 0.00 0.00 57.07 55.95 2q3r s TYR 74 Cb 0.00 -0.36 -0.01 0.00 -0.40 0.00 0.00 41.96 41.19 2q3r s TYR 74 CO 0.00 -0.13 1.23 1.14 -1.57 0.00 0.00 175.55 176.21 2q3r s GLN 75 N -1.89 2.64 -0.68 -0.62 -2.07 -1.26 -3.99 119.66 111.79 2q3r s GLN 75 Ca -0.08 1.85 -0.13 0.00 -1.82 0.00 0.00 55.36 55.18 2q3r s GLN 75 Cb -0.08 -1.88 0.02 0.00 -1.09 0.00 0.00 33.01 29.98 2q3r s GLN 75 CO -0.01 -1.47 0.24 -0.25 -1.32 0.00 0.00 175.29 172.48 2q3r n ASP 76 N -1.99 -1.30 -4.89 12.60 8.00 -1.26 -4.64 116.55 123.07 2q3r n ASP 76 Ca 0.14 -0.67 -0.34 0.00 0.71 0.00 0.00 54.79 54.63 2q3r n ASP 76 Cb 0.49 -0.81 -0.05 0.00 -0.02 0.00 0.00 41.12 40.73 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 -4.08 5.41 0.46 -3.53 -4.23 -1.26 -1.47 115.64 106.94 2q3r s THR 77 Ca 0.18 -0.08 -0.24 0.00 -1.18 0.00 0.00 61.69 60.36 2q3r s THR 77 Cb -0.10 -3.48 -0.07 0.00 1.34 0.00 0.00 72.50 70.18 2q3r s THR 77 CO 0.50 0.40 1.25 -2.16 -0.54 0.00 0.00 174.62 174.07 2q3r s PRO 78 N -1.70 3.72 0.38 3.99 0.04 -1.26 -4.13 135.00 136.04 2q3r s PRO 78 Ca 0.24 1.99 0.08 0.00 0.04 0.00 0.00 61.00 63.35 2q3r s PRO 78 Cb -0.12 -2.51 -0.06 0.00 0.04 0.00 0.00 34.50 31.85 2q3r s PRO 78 CO 0.15 -0.64 0.11 0.20 0.04 0.00 0.00 177.00 176.85 2q3r s GLY 79 N -1.07 2.24 -0.28 0.56 0.00 0.01 0.18 107.32 108.97 2q3r s GLY 79 Ca 0.63 -2.06 0.20 0.00 0.00 0.00 0.00 44.72 43.48 2q3r s GLY 79 CO 0.42 -1.92 1.24 4.51 0.00 0.00 0.00 173.10 177.35 2q3r n ILE 80 N -1.11 0.89 0.63 0.90 3.06 0.43 -4.70 119.36 119.45 2q3r n ILE 80 Ca -0.03 -2.34 0.07 0.00 -2.50 0.00 0.00 62.75 57.95 2q3r n ILE 80 Cb 0.64 1.22 0.02 0.00 0.54 0.00 0.00 39.64 42.05 2q3r n ILE 80 CO 0.00 0.00 0.00 -2.67 -2.50 0.00 0.00 176.55 171.38 2q3r n TRP 81 N -0.88 0.00 -4.39 9.51 2.14 -1.26 -4.32 117.44 118.24 2q3r n TRP 81 Ca -0.00 0.00 -0.27 0.00 2.07 0.00 0.00 57.50 59.30 2q3r n TRP 81 Cb 0.82 0.00 -0.11 0.00 -0.81 0.00 0.00 31.31 31.21 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 -1.57 2.55 0.29 -1.67 -4.23 -1.26 -4.98 115.64 104.77 2q3r s THR 82 Ca 0.14 -1.93 0.03 0.00 -1.18 0.00 0.00 61.69 58.74 2q3r s THR 82 Cb 0.12 -2.23 0.28 0.00 1.34 0.00 0.00 72.50 72.01 2q3r s THR 82 CO 0.30 -0.11 1.80 0.50 -0.54 0.00 0.00 174.62 176.57 2q3r h LYS 83 N 3.16 0.81 -0.69 3.99 3.64 -2.00 0.54 116.57 126.02 2q3r h LYS 83 Ca -0.47 -0.05 0.08 0.00 -1.27 0.00 0.00 60.65 58.94 2q3r h LYS 83 Cb 1.21 -0.18 -0.04 0.00 -0.41 0.00 0.00 32.23 32.80 2q3r h LYS 83 CO 0.49 0.53 0.46 1.49 -2.27 0.00 0.00 179.45 180.15 2q3r h GLU 84 N 0.83 0.64 0.12 1.90 4.81 -1.99 -0.66 114.58 120.23 2q3r h GLU 84 Ca 0.53 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.71 2q3r h GLU 84 Cb 0.70 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.94 2q3r h GLU 84 CO -0.33 0.42 -0.06 0.45 -0.73 0.00 0.00 179.01 178.76 2q3r h HIS 85 N 0.66 -0.15 -0.19 0.92 3.86 -0.28 -2.33 115.15 117.64 2q3r h HIS 85 Ca 0.31 -0.00 0.05 0.00 -1.16 0.00 0.00 60.37 59.56 2q3r h HIS 85 Cb 0.34 0.05 -0.07 0.00 1.06 0.00 0.00 27.41 28.79 2q3r h HIS 85 CO -0.00 0.19 -0.44 0.28 0.86 0.00 0.00 177.93 178.82 2q3r h VAL 86 N -0.52 0.12 -0.74 2.45 2.07 -0.45 -1.00 116.25 118.18 2q3r h VAL 86 Ca -0.02 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.57 2q3r h VAL 86 Cb 0.41 0.12 -0.05 0.00 -1.52 0.00 0.00 31.29 30.25 2q3r h VAL 86 CO 0.03 0.00 0.49 -0.33 0.02 0.00 0.00 177.57 177.77 2q3r h GLU 87 N -0.47 0.73 0.00 1.57 4.39 -1.18 -1.55 114.58 118.07 2q3r h GLU 87 Ca 0.08 -0.04 -0.12 0.00 0.34 0.00 0.00 59.36 59.62 2q3r h GLU 87 Cb 0.63 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 29.10 2q3r h GLU 87 CO -0.44 0.48 -0.55 0.00 -1.16 0.00 0.00 179.01 177.34 2q3r h ALA 88 N 1.60 0.95 0.04 3.43 0.00 -0.78 -3.23 119.26 121.28 2q3r h ALA 88 Ca 0.32 -0.50 -0.27 0.00 0.00 0.00 0.00 54.91 54.46 2q3r h ALA 88 Cb 0.30 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.02 2q3r h ALA 88 CO -0.11 0.69 -1.10 -1.49 0.00 0.00 0.00 179.25 177.24 2q3r h TRP 89 N 0.00 0.94 -0.96 0.00 4.06 -0.25 -3.37 115.95 116.38 2q3r h TRP 89 Ca -0.01 -0.54 0.14 0.00 2.06 0.00 0.00 58.89 60.54 2q3r h TRP 89 Cb 1.07 -0.10 -0.15 0.00 -1.00 0.00 0.00 29.16 28.98 2q3r h TRP 89 CO 0.00 1.38 -0.43 0.87 -3.56 0.00 0.00 178.44 176.70 2q3r h LYS 90 N 0.32 -0.02 0.00 0.49 1.57 -1.39 0.45 116.57 117.98 2q3r h LYS 90 Ca -0.14 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.63 2q3r h LYS 90 Cb 1.76 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 34.07 2q3r h LYS 90 CO 0.21 -0.01 -0.07 -1.00 -0.57 0.00 0.00 179.45 178.01 2q3r h PRO 91 N -0.02 0.00 -0.15 3.15 0.13 -1.74 0.17 132.00 133.54 2q3r h PRO 91 Ca 0.30 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.36 2q3r h PRO 91 Cb 0.56 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.68 2q3r h PRO 91 CO -0.95 0.07 -0.15 0.82 -0.23 0.00 0.00 178.00 177.56 2q3r h ILE 92 N 0.00 1.34 -0.52 -3.56 2.04 -0.34 -2.34 117.51 114.13 2q3r h ILE 92 Ca -0.00 -1.30 -0.04 0.00 1.00 0.00 0.00 64.86 64.52 2q3r h ILE 92 Cb 0.19 1.86 -0.02 0.00 -0.74 0.00 0.00 36.82 38.11 2q3r h ILE 92 CO 0.01 0.38 0.19 0.58 0.00 0.00 0.00 178.15 179.31 2q3r h VAL 93 N -0.00 1.22 -0.77 1.67 2.07 -0.69 -2.64 116.25 117.11 2q3r h VAL 93 Ca 0.02 -0.72 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 2q3r h VAL 93 Cb 0.68 0.72 -0.04 0.00 -1.52 0.00 0.00 31.29 31.12 2q3r h VAL 93 CO 0.04 0.27 0.44 0.44 0.02 0.00 0.00 177.57 178.77 2q3r h ASP 94 N 0.71 0.94 -0.28 0.57 3.32 -0.96 -1.12 116.42 119.61 2q3r h ASP 94 Ca 0.17 -0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 2q3r h ASP 94 Cb 0.23 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 2q3r h ASP 94 CO -0.01 0.75 0.16 0.00 -1.72 0.00 0.00 179.24 178.42 2q3r h ALA 95 N 1.41 0.35 0.18 3.45 0.00 -1.20 0.11 119.26 123.56 2q3r h ALA 95 Ca 0.27 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 2q3r h ALA 95 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2q3r h ALA 95 CO -0.05 -0.14 -0.08 0.28 0.00 0.00 0.00 179.25 179.26 2q3r h VAL 96 N 0.34 0.84 -0.19 0.00 2.07 -1.10 -1.83 116.25 116.39 2q3r h VAL 96 Ca 0.10 -0.06 0.05 0.00 0.82 0.00 0.00 66.70 67.61 2q3r h VAL 96 Cb 0.03 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 2q3r h VAL 96 CO -0.02 0.02 0.14 0.45 0.02 0.00 0.00 177.57 178.17 2q3r h HIS 97 N -0.27 0.00 -0.97 1.57 -0.00 -1.07 -1.33 115.15 113.09 2q3r h HIS 97 Ca -0.02 0.00 0.09 0.00 -0.00 0.00 0.00 60.37 60.44 2q3r h HIS 97 Cb 0.21 0.00 -0.07 0.00 -0.00 0.00 0.00 27.41 27.54 2q3r h HIS 97 CO -0.06 0.00 0.62 0.00 -0.00 0.00 0.00 177.93 178.49 2q3r h ALA 98 N 1.90 1.51 -0.53 2.45 0.00 0.12 0.13 119.26 124.84 2q3r h ALA 98 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2q3r h ALA 98 Cb 0.36 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2q3r h ALA 98 CO -0.00 0.30 0.00 1.63 0.00 0.00 0.00 179.25 181.18 2q3r n LYS 99 N -4.54 3.91 -2.99 0.00 5.02 -0.53 -4.96 118.16 114.07 2q3r n LYS 99 Ca 0.16 -2.62 -0.12 0.00 -2.02 0.00 0.00 58.31 53.71 2q3r n LYS 99 Cb 0.27 -2.00 0.06 0.00 -0.02 0.00 0.00 35.03 33.34 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 0.79 -0.31 3.71 0.72 0.00 0.46 -2.15 105.19 108.41 2q3r n GLY 100 Ca 0.23 0.08 -0.28 0.00 0.00 0.00 0.00 46.02 46.05 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 -3.79 1.82 -0.21 -0.02 0.00 -1.06 0.26 107.32 104.32 2q3r s GLY 101 Ca 0.11 -1.21 -0.14 0.00 0.00 0.00 0.00 44.72 43.48 2q3r s GLY 101 CO 0.55 -1.21 0.32 -0.42 0.00 0.00 0.00 173.10 172.35 2q3r s ILE 102 N -1.54 5.25 -0.19 0.90 1.09 -0.42 -4.48 121.20 121.81 2q3r s ILE 102 Ca 0.28 0.55 0.00 0.00 -1.10 0.00 0.00 60.65 60.38 2q3r s ILE 102 Cb -0.11 -3.66 0.04 0.00 -1.06 0.00 0.00 42.46 37.68 2q3r s ILE 102 CO 0.20 0.29 -0.08 0.12 -0.10 0.00 0.00 174.94 175.37 2q3r s PHE 103 N 1.14 2.09 -0.07 3.97 5.36 -1.26 -0.32 117.98 128.88 2q3r s PHE 103 Ca 0.16 -1.37 -0.00 0.00 -0.96 0.00 0.00 56.93 54.76 2q3r s PHE 103 Cb -0.14 -1.49 -0.03 0.00 -0.34 0.00 0.00 43.02 41.02 2q3r s PHE 103 CO 0.06 -0.69 -0.03 -0.06 -1.46 0.00 0.00 175.22 173.05 2q3r s PHE 104 N 1.51 3.05 -0.31 10.12 0.40 -0.35 -1.37 117.98 131.03 2q3r s PHE 104 Ca -0.01 0.11 -0.17 0.00 -0.60 0.00 0.00 56.93 56.26 2q3r s PHE 104 Cb -0.16 -1.75 -0.02 0.00 0.51 0.00 0.00 43.02 41.61 2q3r s PHE 104 CO -0.08 0.41 0.48 0.00 0.70 0.00 0.00 175.22 176.73 2q3r s GLN 106 N 2.30 3.79 -0.13 0.00 0.74 -1.26 -1.67 119.66 123.43 2q3r s GLN 106 Ca 0.18 0.57 -0.09 0.00 0.05 0.00 0.00 55.36 56.07 2q3r s GLN 106 Cb -0.16 -3.84 -0.04 0.00 1.10 0.00 0.00 33.01 30.07 2q3r s GLN 106 CO 0.11 -1.10 0.18 0.96 -0.55 0.00 0.00 175.29 174.90 2q3r s ILE 107 N 3.79 5.41 0.16 -2.34 -4.36 -0.53 -1.06 121.20 122.27 2q3r s ILE 107 Ca 0.41 0.31 -0.08 0.00 -0.26 0.00 0.00 60.65 61.04 2q3r s ILE 107 Cb -0.10 -3.48 -0.01 0.00 1.25 0.00 0.00 42.46 40.12 2q3r s ILE 107 CO 0.23 0.55 0.25 -1.66 0.24 0.00 0.00 174.94 174.55 2q3r s TRP 108 N -0.57 0.44 -0.08 1.37 1.48 -1.16 -1.20 118.94 119.23 2q3r s TRP 108 Ca 0.15 -0.81 -0.01 0.00 -1.06 0.00 0.00 56.10 54.37 2q3r s TRP 108 Cb -0.12 -0.11 0.03 0.00 -1.16 0.00 0.00 33.47 32.10 2q3r s TRP 108 CO 0.04 -0.69 -0.02 -1.58 -4.06 0.00 0.00 176.95 170.64 2q3r s HIS 109 N -3.97 0.82 -0.93 1.66 2.46 -1.26 -2.89 115.29 111.18 2q3r s HIS 109 Ca 0.17 -0.27 0.08 0.00 0.47 0.00 0.00 55.06 55.51 2q3r s HIS 109 Cb 0.04 -0.86 0.35 0.00 -0.13 0.00 0.00 32.58 31.98 2q3r s HIS 109 CO -0.00 -0.35 1.25 1.33 -2.47 0.00 0.00 174.74 174.50 2q3r n VAL 110 N 4.98 1.51 -3.10 0.89 0.24 -1.14 -2.31 118.33 119.40 2q3r n VAL 110 Ca -0.10 0.41 0.00 0.00 -2.04 0.00 0.00 64.34 62.61 2q3r n VAL 110 Cb 0.50 -1.31 0.00 0.00 -1.47 0.00 0.00 33.84 31.56 2q3r n VAL 110 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2q3r n GLY 111 N -0.84 3.01 0.00 7.63 0.00 -1.26 -1.26 105.19 112.47 2q3r n GLY 111 Ca 0.01 -0.27 0.05 0.00 0.00 0.00 0.00 46.02 45.82 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 14.00 0.05 -2.67 1.61 1.85 -1.21 -4.15 116.66 126.13 2q3r n ARG 112 Ca 0.00 0.27 -0.43 0.00 -1.00 0.00 0.00 57.85 56.69 2q3r n ARG 112 Cb 0.00 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 29.91 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 -1.44 4.12 -3.97 8.89 0.31 -0.39 -4.77 118.33 121.08 2q3r n VAL 113 Ca 0.03 -4.39 0.00 0.00 -0.01 0.00 0.00 64.34 59.98 2q3r n VAL 113 Cb 0.12 -2.43 0.00 0.00 -0.91 0.00 0.00 33.84 30.62 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 6.21 -0.10 -3.29 4.52 2.88 -1.26 -4.37 113.62 118.21 2q3r n SER 114 Ca 0.42 -1.00 -0.11 0.00 -1.33 0.00 0.00 58.87 56.85 2q3r n SER 114 Cb 0.42 0.14 -0.02 0.00 -0.75 0.00 0.00 64.21 64.01 2q3r n SER 114 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2q3r s ASN 115 N -1.27 0.29 0.44 -3.46 6.03 -1.26 -3.38 114.94 112.33 2q3r s ASN 115 Ca 0.03 -1.19 0.12 0.00 -1.03 0.00 0.00 52.86 50.79 2q3r s ASN 115 Cb -0.00 0.73 0.99 0.00 -3.03 0.00 0.00 41.25 39.94 2q3r s ASN 115 CO -0.00 -1.43 2.03 0.77 -2.03 0.00 0.00 177.10 176.43 2q3r h SER 116 N 2.08 0.16 0.10 3.54 4.64 -1.86 -2.15 113.55 120.06 2q3r h SER 116 Ca -0.29 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.00 2q3r h SER 116 Cb 1.25 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2q3r h SER 116 CO 0.37 0.22 -0.09 1.23 -0.87 0.00 0.00 176.83 177.70 2q3r h GLY 117 N 0.44 0.00 -1.88 -0.77 0.00 -1.88 -0.14 103.07 98.83 2q3r h GLY 117 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 2q3r h GLY 117 CO 0.01 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.24 2q3r n PHE 118 N -4.35 0.47 -4.56 5.60 3.72 -0.83 -4.91 117.46 112.59 2q3r n PHE 118 Ca -0.03 -0.23 -0.34 0.00 -0.05 0.00 0.00 57.45 56.80 2q3r n PHE 118 Cb 0.17 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.60 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 -1.53 2.88 0.25 -1.08 -1.52 -0.07 -4.67 119.66 113.92 2q3r s GLN 119 Ca 0.37 -0.52 -0.31 0.00 -1.95 0.00 0.00 55.36 52.95 2q3r s GLN 119 Cb 0.21 -2.65 -0.13 0.00 -0.22 0.00 0.00 33.01 30.21 2q3r s GLN 119 CO 0.29 0.63 1.44 -2.30 -0.25 0.00 0.00 175.29 175.10 2q3r n PRO 120 N 2.34 2.15 -1.39 2.91 -0.02 -1.26 -0.66 135.00 139.07 2q3r n PRO 120 Ca -0.18 0.77 -0.13 0.00 -2.02 0.00 0.00 63.50 61.93 2q3r n PRO 120 Cb 0.53 -2.44 -0.06 0.00 -0.02 0.00 0.00 33.50 31.51 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 2.11 -5.67 -1.76 2.55 3.02 -1.26 -1.74 115.26 112.50 2q3r n ASN 121 Ca 0.11 0.33 -0.15 0.00 -0.03 0.00 0.00 54.58 54.84 2q3r n ASN 121 Cb 0.33 -4.36 -0.00 0.00 -0.61 0.00 0.00 39.78 35.14 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 -0.24 3.22 7.41 0.00 0.16 -5.01 105.19 110.82 2q3r n GLY 122 Ca -0.13 -0.24 -0.28 0.00 0.00 0.00 0.00 46.02 45.36 2q3r n GLY 122 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2q3r n LYS 123 N -2.51 -3.26 -4.08 1.61 5.02 -0.71 -4.75 118.16 109.48 2q3r n LYS 123 Ca -0.17 -1.59 -0.33 0.00 -2.02 0.00 0.00 58.31 54.20 2q3r n LYS 123 Cb 0.63 -1.56 -0.07 0.00 -0.02 0.00 0.00 35.03 34.01 2q3r n LYS 123 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2q3r s ALA 124 N -2.88 3.62 0.59 7.82 0.00 -1.26 -3.81 121.76 125.84 2q3r s ALA 124 Ca 0.66 -0.86 -0.20 0.00 0.00 0.00 0.00 51.96 51.55 2q3r s ALA 124 Cb -0.07 -1.61 -0.03 0.00 0.00 0.00 0.00 23.12 21.41 2q3r s ALA 124 CO 0.51 0.70 1.34 -2.14 0.00 0.00 0.00 175.76 176.17 2q3r s PRO 125 N -1.77 2.89 -0.10 0.00 0.02 -1.26 -4.89 135.00 129.90 2q3r s PRO 125 Ca 0.23 2.19 -0.01 0.00 0.02 0.00 0.00 61.00 63.43 2q3r s PRO 125 Cb -0.12 -2.09 -0.03 0.00 0.02 0.00 0.00 34.50 32.28 2q3r s PRO 125 CO 0.14 -1.37 -0.04 0.96 -0.33 0.00 0.00 177.00 176.36 2q3r s ILE 126 N -1.33 3.94 0.27 2.83 -4.36 -1.26 -2.34 121.20 118.95 2q3r s ILE 126 Ca 0.76 -0.37 -0.01 0.00 -0.26 0.00 0.00 60.65 60.76 2q3r s ILE 126 Cb -0.40 -2.66 -0.02 0.00 1.25 0.00 0.00 42.46 40.63 2q3r s ILE 126 CO 0.45 0.57 0.30 -0.55 0.24 0.00 0.00 174.94 175.95 2q3r s SER 127 N -0.46 0.64 0.00 4.36 0.15 -0.78 -3.31 113.70 114.29 2q3r s SER 127 Ca 0.07 -1.42 0.16 0.00 0.70 0.00 0.00 55.95 55.47 2q3r s SER 127 Cb -0.12 0.52 0.84 0.00 -1.71 0.00 0.00 66.02 65.55 2q3r s SER 127 CO 0.02 -1.05 1.47 0.00 1.20 0.00 0.00 173.24 174.89 2q3r n SER 129 N -1.27 -0.42 -0.22 0.00 3.41 -1.26 -4.62 113.62 109.24 2q3r n SER 129 Ca 0.08 -1.55 0.02 0.00 -0.26 0.00 0.00 58.87 57.16 2q3r n SER 129 Cb 0.13 0.77 0.05 0.00 -0.26 0.00 0.00 64.21 64.90 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 -1.93 2.13 -4.66 4.04 5.75 -1.24 -2.84 116.55 117.81 2q3r n ASP 130 Ca -0.00 -1.83 -0.42 0.00 -0.01 0.00 0.00 54.79 52.53 2q3r n ASP 130 Cb 0.17 -0.07 -0.03 0.00 -1.03 0.00 0.00 41.12 40.17 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 -0.87 4.12 0.61 0.11 1.02 -1.26 -3.89 119.74 119.59 2q3r s LYS 131 Ca 0.08 2.50 -0.19 0.00 0.02 0.00 0.00 55.97 58.37 2q3r s LYS 131 Cb 0.04 -4.13 -0.02 0.00 -0.52 0.00 0.00 37.83 33.20 2q3r s LYS 131 CO 0.06 -0.97 1.29 -1.25 -0.92 0.00 0.00 175.35 173.56 2q3r s PRO 132 N 4.42 2.77 -0.22 -1.68 0.04 -1.26 -4.11 135.00 134.96 2q3r s PRO 132 Ca 0.85 2.06 -0.08 0.00 0.04 0.00 0.00 61.00 63.87 2q3r s PRO 132 Cb -0.40 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.14 2q3r s PRO 132 CO 0.39 -1.43 0.10 -1.17 0.04 0.00 0.00 177.00 174.93 2q3r s LEU 133 N -4.11 3.77 -1.31 -3.56 2.96 -1.26 -4.64 118.68 110.54 2q3r s LEU 133 Ca 0.79 -0.01 -0.18 0.00 -0.22 0.00 0.00 54.13 54.50 2q3r s LEU 133 Cb -0.37 -1.99 0.03 0.00 0.50 0.00 0.00 46.19 44.35 2q3r s LEU 133 CO 0.40 0.06 0.35 0.23 -1.32 0.00 0.00 176.35 176.08 2q3r n MET 134 N 4.28 -0.55 -0.17 1.98 2.81 -1.26 -4.48 117.12 119.72 2q3r n MET 134 Ca -0.16 0.05 0.29 0.00 -1.81 0.00 0.00 57.70 56.07 2q3r n MET 134 Cb 0.52 -2.79 0.72 0.00 -0.71 0.00 0.00 33.22 30.96 2q3r n MET 134 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 2q3r h PRO 135 N -2.07 0.00 0.00 0.03 0.13 -1.92 0.13 132.00 128.30 2q3r h PRO 135 Ca -0.66 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.47 2q3r h PRO 135 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 2q3r h PRO 135 CO 0.58 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.35 2q3r n GLN 136 N -4.06 0.05 -4.01 0.86 0.00 -1.26 -4.67 117.38 104.28 2q3r n GLN 136 Ca 0.19 0.30 -0.35 0.00 0.00 0.00 0.00 57.00 57.14 2q3r n GLN 136 Cb 1.02 -1.50 -0.11 0.00 0.00 0.00 0.00 30.24 29.65 2q3r n GLN 136 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 2q3r s ILE 137 N -2.84 4.47 0.19 -0.39 1.01 0.46 -5.08 121.20 119.02 2q3r s ILE 137 Ca 0.06 -0.14 0.08 0.00 0.00 0.00 0.00 60.65 60.64 2q3r s ILE 137 Cb 0.06 -3.03 -0.04 0.00 0.01 0.00 0.00 42.46 39.45 2q3r s ILE 137 CO 0.15 0.43 -0.15 -0.13 0.00 0.00 0.00 174.94 175.24 2q3r s ARG 138 N 0.76 1.28 0.88 2.79 3.00 -1.26 -0.71 118.95 125.68 2q3r s ARG 138 Ca 0.02 -1.52 -0.11 0.00 0.00 0.00 0.00 55.73 54.13 2q3r s ARG 138 Cb -0.14 -1.11 0.13 0.00 0.00 0.00 0.00 34.95 33.83 2q3r s ARG 138 CO 0.02 0.19 1.15 -1.12 0.00 0.00 0.00 175.30 175.55 2q3r s SER 139 N -3.13 3.16 -0.43 0.23 0.01 -1.12 -4.78 113.70 107.63 2q3r s SER 139 Ca 0.20 2.19 -0.44 0.00 1.31 0.00 0.00 55.95 59.21 2q3r s SER 139 Cb -0.02 -2.57 -0.18 0.00 0.21 0.00 0.00 66.02 63.46 2q3r s SER 139 CO 0.06 -2.95 1.75 0.59 0.41 0.00 0.00 173.24 173.10 2q3r n ASN 140 N -4.02 1.51 0.00 2.44 3.02 -1.26 -1.95 115.26 115.01 2q3r n ASN 140 Ca 0.12 1.05 0.00 0.00 -0.03 0.00 0.00 54.58 55.72 2q3r n ASN 140 Cb 0.52 -0.97 0.00 0.00 -0.61 0.00 0.00 39.78 38.72 2q3r n ASN 140 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2q3r n GLY 141 N 4.68 0.96 3.69 7.41 0.00 -1.26 -4.91 105.19 115.76 2q3r n GLY 141 Ca 0.34 -0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.92 2q3r n GLY 141 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2q3r n ILE 142 N 0.00 0.99 -0.28 -0.61 5.41 -0.82 -4.85 119.36 119.20 2q3r n ILE 142 Ca 0.00 -0.25 -0.03 0.00 1.00 0.00 0.00 62.75 63.47 2q3r n ILE 142 Cb 0.00 -1.62 0.20 0.00 -0.71 0.00 0.00 39.64 37.51 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 2.13 3.81 -4.69 4.38 3.85 -1.26 -3.65 116.55 121.11 2q3r n ASP 143 Ca 0.11 -2.76 -0.37 0.00 -0.71 0.00 0.00 54.79 51.06 2q3r n ASP 143 Cb 0.33 -0.66 -0.08 0.00 -1.35 0.00 0.00 41.12 39.37 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 -2.11 4.20 0.32 0.11 2.12 -1.26 -5.01 118.70 117.08 2q3r s GLU 144 Ca 0.35 0.11 -0.26 0.00 0.36 0.00 0.00 54.97 55.53 2q3r s GLU 144 Cb 0.28 -3.49 -0.14 0.00 0.26 0.00 0.00 34.13 31.04 2q3r s GLU 144 CO 0.09 0.08 0.76 0.00 -0.54 0.00 0.00 175.26 175.65 2q3r n ALA 145 N 4.09 -1.15 0.05 6.30 0.00 -1.26 -2.78 120.51 125.76 2q3r n ALA 145 Ca -0.10 0.32 -0.15 0.00 0.00 0.00 0.00 53.44 53.50 2q3r n ALA 145 Cb 0.51 -1.86 -0.06 0.00 0.00 0.00 0.00 19.45 18.05 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 1.37 0.67 -7.96 0.00 5.85 -1.24 -3.42 115.31 110.58 2q3r h LEU 146 Ca -0.38 -0.52 -0.67 0.00 0.84 0.00 0.00 57.88 57.15 2q3r h LEU 146 Cb 1.38 -0.20 -0.35 0.00 0.37 0.00 0.00 40.66 41.85 2q3r h LEU 146 CO 0.57 1.31 -0.78 -0.36 -0.34 0.00 0.00 178.44 178.84 2q3r s PHE 147 N -3.36 3.19 -0.35 1.25 0.40 -1.26 -4.72 117.98 113.13 2q3r s PHE 147 Ca -0.07 -2.06 -0.28 0.00 -0.60 0.00 0.00 56.93 53.92 2q3r s PHE 147 Cb 0.08 -1.99 -0.03 0.00 0.51 0.00 0.00 43.02 41.60 2q3r s PHE 147 CO 0.88 -0.84 1.99 0.99 0.70 0.00 0.00 175.22 178.95 2q3r s THR 148 N 1.18 3.28 0.17 0.64 2.01 -1.22 -4.40 115.64 117.30 2q3r s THR 148 Ca -0.06 0.26 -0.19 0.00 0.31 0.00 0.00 61.69 62.01 2q3r s THR 148 Cb -0.19 -3.44 -0.12 0.00 0.01 0.00 0.00 72.50 68.76 2q3r s THR 148 CO -0.05 -0.32 0.33 -2.65 -0.69 0.00 0.00 174.62 171.24 2q3r n PRO 149 N 8.68 0.00 -1.74 4.92 -0.02 -1.26 -4.47 135.00 141.10 2q3r n PRO 149 Ca 0.26 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.41 2q3r n PRO 149 Cb 0.48 -0.72 0.05 0.00 -0.02 0.00 0.00 33.50 33.29 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 -0.72 2.75 -0.18 0.52 0.04 -1.25 -4.64 135.00 131.52 2q3r s PRO 150 Ca 0.46 1.44 -0.08 0.00 0.04 0.00 0.00 61.00 62.86 2q3r s PRO 150 Cb -0.64 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 31.92 2q3r s PRO 150 CO 0.41 -1.30 0.08 0.50 0.04 0.00 0.00 177.00 176.74 2q3r s ARG 151 N -4.04 3.95 -0.86 4.56 3.52 -0.99 -3.64 118.95 121.45 2q3r s ARG 151 Ca 0.68 -0.29 -0.25 0.00 -0.13 0.00 0.00 55.73 55.74 2q3r s ARG 151 Cb -0.22 -3.25 -0.04 0.00 -1.56 0.00 0.00 34.95 29.88 2q3r s ARG 151 CO 0.41 0.35 1.91 0.50 -0.81 0.00 0.00 175.30 177.66 2q3r s ARG 152 N 0.18 2.60 0.18 5.12 3.52 -1.13 -1.86 118.95 127.57 2q3r s ARG 152 Ca 0.06 -0.17 -0.28 0.00 -0.13 0.00 0.00 55.73 55.21 2q3r s ARG 152 Cb -0.12 -4.96 -0.17 0.00 -1.56 0.00 0.00 34.95 28.15 2q3r s ARG 152 CO -0.00 -3.23 0.53 1.28 -0.81 0.00 0.00 175.30 173.07 2q3r n LEU 153 N 13.59 -1.14 -4.74 -0.88 4.77 -0.41 -4.89 117.00 123.30 2q3r n LEU 153 Ca 0.36 1.09 -0.31 0.00 -0.03 0.00 0.00 56.01 57.12 2q3r n LEU 153 Cb 0.48 -0.92 0.11 0.00 -2.33 0.00 0.00 43.42 40.76 2q3r n LEU 153 CO 0.62 -2.83 0.71 -0.83 -1.33 0.00 0.00 177.39 173.73 2q3r s GLY 154 N -0.91 1.77 0.54 -0.72 0.00 -1.26 -4.89 107.32 101.85 2q3r s GLY 154 Ca 0.63 0.42 0.33 0.00 0.00 0.00 0.00 44.72 46.11 2q3r s GLY 154 CO 0.54 0.79 2.00 1.19 0.00 0.00 0.00 173.10 177.62 2q3r h ILE 155 N -1.16 0.11 -0.22 0.90 2.10 -2.03 -2.37 117.51 114.84 2q3r h ILE 155 Ca -0.44 -0.56 0.00 0.00 1.08 0.00 0.00 64.86 64.94 2q3r h ILE 155 Cb 1.25 1.50 0.00 0.00 -1.09 0.00 0.00 36.82 38.48 2q3r h ILE 155 CO 0.49 0.04 0.00 -0.62 -1.08 0.00 0.00 178.15 176.98 2q3r n GLU 156 N -3.16 2.06 0.06 2.19 1.02 -1.26 -4.06 120.64 117.49 2q3r n GLU 156 Ca 0.00 -1.58 0.12 0.00 -0.02 0.00 0.00 57.16 55.67 2q3r n GLU 156 Cb 0.30 -1.45 0.08 0.00 -0.02 0.00 0.00 31.44 30.35 2q3r n GLU 156 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2q3r n GLU 157 N 0.82 0.38 -0.02 3.49 1.02 -0.89 -4.28 120.64 121.16 2q3r n GLU 157 Ca 0.17 0.06 -0.10 0.00 -0.02 0.00 0.00 57.16 57.28 2q3r n GLU 157 Cb 0.46 -1.69 -0.04 0.00 -0.02 0.00 0.00 31.44 30.14 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 0.00 0.95 -0.82 -3.67 2.04 -1.71 -2.28 117.51 112.02 2q3r h ILE 158 Ca 0.00 -0.03 0.12 0.00 1.00 0.00 0.00 64.86 65.95 2q3r h ILE 158 Cb 0.81 0.85 -0.08 0.00 -0.74 0.00 0.00 36.82 37.66 2q3r h ILE 158 CO 0.00 0.02 0.43 -0.65 0.00 0.00 0.00 178.15 177.95 2q3r h PRO 159 N 0.09 0.64 -0.32 2.37 0.11 -1.87 0.25 132.00 133.27 2q3r h PRO 159 Ca 0.06 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.08 2q3r h PRO 159 Cb 0.05 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.00 2q3r h PRO 159 CO -0.08 0.43 -0.00 0.78 -0.21 0.00 0.00 178.00 178.91 2q3r h GLY 160 N 0.66 0.62 1.33 -0.55 0.00 -1.73 0.43 103.07 103.83 2q3r h GLY 160 Ca 0.43 -0.46 -0.12 0.00 0.00 0.00 0.00 47.33 47.18 2q3r h GLY 160 CO -0.32 0.42 -0.23 -2.22 0.00 0.00 0.00 176.54 174.20 2q3r h ILE 161 N 0.38 1.27 0.00 2.60 2.04 -1.02 -0.85 117.51 121.93 2q3r h ILE 161 Ca 0.09 -1.34 -0.01 0.00 1.00 0.00 0.00 64.86 64.61 2q3r h ILE 161 Cb 0.45 1.22 -0.00 0.00 -0.74 0.00 0.00 36.82 37.75 2q3r h ILE 161 CO 0.02 0.45 -0.03 0.58 0.00 0.00 0.00 178.15 179.16 2q3r h VAL 162 N 0.67 0.96 -0.66 1.67 2.07 -0.32 -1.17 116.25 119.47 2q3r h VAL 162 Ca 0.09 -0.12 -0.06 0.00 0.82 0.00 0.00 66.70 67.43 2q3r h VAL 162 Cb 0.74 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 31.54 2q3r h VAL 162 CO 0.06 0.03 0.16 -1.13 0.02 0.00 0.00 177.57 176.72 2q3r h ASN 163 N 0.00 0.98 -0.06 0.57 -0.00 0.57 -1.97 115.58 115.68 2q3r h ASN 163 Ca -0.00 -0.20 -0.08 0.00 -0.00 0.00 0.00 56.30 56.02 2q3r h ASN 163 Cb 0.06 -0.26 -0.01 0.00 -0.00 0.00 0.00 38.32 38.11 2q3r h ASN 163 CO 0.00 0.95 -0.18 0.44 -0.00 0.00 0.00 177.43 178.64 2q3r h ASP 164 N 1.00 0.42 0.14 1.15 3.32 -1.00 0.58 116.42 122.02 2q3r h ASP 164 Ca 0.21 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2q3r h ASP 164 Cb 0.35 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.78 2q3r h ASP 164 CO 0.00 0.62 0.00 0.49 -1.72 0.00 0.00 179.24 178.63 2q3r n PHE 165 N -4.18 0.00 -0.07 4.55 3.01 -0.75 -1.45 117.46 118.57 2q3r n PHE 165 Ca -0.00 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.39 2q3r n PHE 165 Cb 0.35 -0.17 -0.10 0.00 -0.01 0.00 0.00 39.48 39.55 2q3r n PHE 165 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 2q3r n ARG 166 N -1.17 1.60 -0.13 -1.08 0.63 0.06 -3.89 116.66 112.68 2q3r n ARG 166 Ca 0.07 0.01 -0.12 0.00 -0.92 0.00 0.00 57.85 56.90 2q3r n ARG 166 Cb 0.08 -1.33 -0.02 0.00 0.45 0.00 0.00 32.46 31.63 2q3r n ARG 166 CO 0.00 0.00 0.00 1.25 -2.51 0.00 0.00 177.63 176.37 2q3r h LEU 167 N 0.00 0.88 -0.26 6.15 5.85 -0.33 -1.16 115.31 126.44 2q3r h LEU 167 Ca -0.36 -0.41 -0.04 0.00 0.84 0.00 0.00 57.88 57.91 2q3r h LEU 167 Cb 1.76 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 42.54 2q3r h LEU 167 CO 0.01 1.10 -0.00 0.00 -0.34 0.00 0.00 178.44 179.20 2q3r h ALA 168 N 0.81 0.35 -0.59 1.25 0.00 -1.44 -0.62 119.26 119.02 2q3r h ALA 168 Ca 0.09 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 54.80 2q3r h ALA 168 Cb 0.78 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 2q3r h ALA 168 CO 0.06 0.09 0.35 0.00 0.00 0.00 0.00 179.25 179.75 2q3r h ALA 169 N 0.82 0.76 -0.37 0.00 0.00 -1.66 0.21 119.26 119.02 2q3r h ALA 169 Ca 0.07 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.99 2q3r h ALA 169 Cb 0.42 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2q3r h ALA 169 CO 0.01 0.07 0.23 -0.09 0.00 0.00 0.00 179.25 179.47 2q3r h ARG 170 N 0.68 0.45 -0.30 0.00 9.65 -0.95 -1.75 114.38 122.16 2q3r h ARG 170 Ca 0.24 -0.03 -0.05 0.00 -1.10 0.00 0.00 59.98 59.05 2q3r h ARG 170 Cb 0.05 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.51 2q3r h ARG 170 CO -0.11 0.30 -0.03 -0.91 2.80 0.00 0.00 179.97 182.02 2q3r h ASN 171 N 0.47 0.44 0.26 -3.80 4.21 -0.44 -1.53 115.58 115.19 2q3r h ASN 171 Ca 0.14 -0.08 0.00 0.00 1.21 0.00 0.00 56.30 57.57 2q3r h ASN 171 Cb -0.02 -0.12 -0.02 0.00 -1.12 0.00 0.00 38.32 37.04 2q3r h ASN 171 CO -0.05 0.53 -0.28 0.00 -1.29 0.00 0.00 177.43 176.33 2q3r h ALA 172 N 1.53 -0.58 -0.85 -0.83 0.00 0.26 0.30 119.26 119.09 2q3r h ALA 172 Ca 0.10 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 54.99 2q3r h ALA 172 Cb 0.34 0.42 -0.06 0.00 0.00 0.00 0.00 17.79 18.48 2q3r h ALA 172 CO 0.01 -0.86 0.52 0.52 0.00 0.00 0.00 179.25 179.44 2q3r h MET 173 N -0.58 0.91 -0.54 0.00 2.86 -1.11 -0.74 114.93 115.73 2q3r h MET 173 Ca -0.00 -0.05 0.04 0.00 -2.06 0.00 0.00 59.70 57.62 2q3r h MET 173 Cb 0.55 -0.20 -0.03 0.00 0.06 0.00 0.00 31.60 31.97 2q3r h MET 173 CO -0.08 0.60 0.36 1.49 1.06 0.00 0.00 176.91 180.34 2q3r h GLU 174 N 0.93 0.58 0.00 1.72 4.81 -0.53 0.12 114.58 122.21 2q3r h GLU 174 Ca 0.37 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.57 2q3r h GLU 174 Cb 0.20 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.45 2q3r h GLU 174 CO -0.18 0.38 0.00 0.00 -0.73 0.00 0.00 179.01 178.48 2q3r n ALA 175 N -2.48 2.27 0.00 2.92 0.00 0.02 -4.93 120.51 118.32 2q3r n ALA 175 Ca 0.06 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2q3r n ALA 175 Cb 0.16 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.15 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 1.34 0.58 3.63 0.00 0.00 0.03 -3.92 105.19 106.86 2q3r n GLY 176 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 2q3r n GLY 176 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2q3r n PHE 177 N -1.41 1.23 0.08 1.61 3.01 -0.97 -4.92 117.46 116.08 2q3r n PHE 177 Ca 0.00 0.48 -0.13 0.00 1.01 0.00 0.00 57.45 58.81 2q3r n PHE 177 Cb 0.00 -2.22 -0.06 0.00 -0.01 0.00 0.00 39.48 37.19 2q3r n PHE 177 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 2q3r h ASP 178 N 1.16 0.46 -1.67 4.37 3.32 -1.57 -3.41 116.42 119.07 2q3r h ASP 178 Ca -0.47 -0.39 -0.02 0.00 0.02 0.00 0.00 57.03 56.17 2q3r h ASP 178 Cb 1.34 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.75 2q3r h ASP 178 CO 0.55 1.21 0.06 0.61 -1.72 0.00 0.00 179.24 179.95 2q3r n GLY 179 N 1.05 1.85 3.00 2.75 0.00 -1.18 -4.85 105.19 107.81 2q3r n GLY 179 Ca -0.06 -1.13 -0.17 0.00 0.00 0.00 0.00 46.02 44.65 2q3r n GLY 179 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2q3r s VAL 180 N -2.71 0.59 -0.22 1.61 1.01 -0.21 -1.18 120.40 119.29 2q3r s VAL 180 Ca 0.05 -0.38 -0.01 0.00 0.00 0.00 0.00 61.98 61.64 2q3r s VAL 180 Cb -0.01 -0.51 0.02 0.00 0.00 0.00 0.00 36.38 35.88 2q3r s VAL 180 CO 0.04 0.12 -0.12 -0.70 0.00 0.00 0.00 175.10 174.45 2q3r s GLU 181 N -0.29 2.95 -0.26 2.72 2.12 -0.67 -0.36 118.70 124.92 2q3r s GLU 181 Ca 0.02 -0.88 -0.29 0.00 0.36 0.00 0.00 54.97 54.18 2q3r s GLU 181 Cb -0.03 -2.82 0.00 0.00 0.26 0.00 0.00 34.13 31.54 2q3r s GLU 181 CO -0.00 -0.30 1.22 0.42 -0.54 0.00 0.00 175.26 176.05 2q3r s ILE 182 N 1.32 4.31 -1.24 -3.70 1.01 0.11 -1.45 121.20 121.57 2q3r s ILE 182 Ca 0.02 1.54 -0.21 0.00 0.00 0.00 0.00 60.65 62.00 2q3r s ILE 182 Cb -0.15 -4.18 -0.02 0.00 0.01 0.00 0.00 42.46 38.12 2q3r s ILE 182 CO -0.08 -0.35 1.85 -2.28 0.00 0.00 0.00 174.94 174.08 2q3r s HIS 183 N 3.85 2.32 -0.41 3.97 2.46 -0.34 -1.44 115.29 125.70 2q3r s HIS 183 Ca 0.52 -0.45 0.05 0.00 0.47 0.00 0.00 55.06 55.65 2q3r s HIS 183 Cb -0.17 -4.33 0.65 0.00 -0.13 0.00 0.00 32.58 28.60 2q3r s HIS 183 CO 0.17 -1.47 1.84 0.41 -2.47 0.00 0.00 174.74 173.23 2q3r n GLY 184 N 5.63 4.16 1.28 1.59 0.00 -0.33 -4.53 105.19 113.00 2q3r n GLY 184 Ca 0.47 -1.01 -0.11 0.00 0.00 0.00 0.00 46.02 45.37 2q3r n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q3r n ALA 185 N -0.84 0.19 -3.86 4.61 0.00 -0.91 -3.50 120.51 116.21 2q3r n ALA 185 Ca 0.53 -0.80 -0.26 0.00 0.00 0.00 0.00 53.44 52.91 2q3r n ALA 185 Cb 1.55 0.49 0.02 0.00 0.00 0.00 0.00 19.45 21.50 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 -1.51 -2.39 -0.47 0.00 3.02 -1.26 -2.62 115.26 110.04 2q3r n ASN 186 Ca -0.05 -0.85 -0.06 0.00 -0.03 0.00 0.00 54.58 53.59 2q3r n ASN 186 Cb 0.23 -3.73 -0.03 0.00 -0.61 0.00 0.00 39.78 35.65 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 -1.68 0.63 3.00 7.41 0.00 -1.25 -4.80 105.19 108.49 2q3r n GLY 187 Ca -0.16 -0.03 -0.20 0.00 0.00 0.00 0.00 46.02 45.62 2q3r n GLY 187 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2q3r n TYR 188 N -2.21 -3.49 -0.33 1.61 4.01 -1.08 -4.66 117.16 111.02 2q3r n TYR 188 Ca -0.06 -1.15 0.27 0.00 -0.16 0.00 0.00 57.90 56.80 2q3r n TYR 188 Cb 0.51 -0.67 0.52 0.00 -0.31 0.00 0.00 39.34 39.38 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 0.37 0.04 7.72 5.85 -1.48 -1.98 115.31 125.83 2q3r h LEU 189 Ca -0.29 0.23 -0.10 0.00 0.84 0.00 0.00 57.88 58.56 2q3r h LEU 189 Cb 0.93 0.22 -0.00 0.00 0.37 0.00 0.00 40.66 42.18 2q3r h LEU 189 CO 0.26 -0.29 -0.49 0.40 -0.34 0.00 0.00 178.44 177.97 2q3r h ILE 190 N 0.15 1.53 -0.62 4.05 2.04 -1.80 -3.35 117.51 119.52 2q3r h ILE 190 Ca 0.78 -2.37 0.13 0.00 1.00 0.00 0.00 64.86 64.40 2q3r h ILE 190 Cb 1.92 3.11 -0.10 0.00 -0.74 0.00 0.00 36.82 41.01 2q3r h ILE 190 CO -0.70 0.59 0.00 -0.78 0.00 0.00 0.00 178.15 177.27 2q3r h ASP 191 N -0.81 -0.27 -1.11 1.72 1.82 -1.48 0.24 116.42 116.54 2q3r h ASP 191 Ca -0.11 0.15 0.32 0.00 -0.39 0.00 0.00 57.03 57.00 2q3r h ASP 191 Cb 1.25 0.27 -0.11 0.00 0.68 0.00 0.00 39.33 41.41 2q3r h ASP 191 CO 0.00 -0.11 0.70 1.56 -1.61 0.00 0.00 179.24 179.78 2q3r h GLN 192 N 0.12 0.31 -0.52 0.28 4.20 -1.52 0.58 115.11 118.56 2q3r h GLN 192 Ca 0.32 -0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.95 2q3r h GLN 192 Cb 0.52 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.21 2q3r h GLN 192 CO -0.53 0.20 0.08 0.74 -0.67 0.00 0.00 178.83 178.65 2q3r h PHE 193 N 0.31 0.86 -0.04 2.96 -1.00 -1.07 -3.01 116.94 115.94 2q3r h PHE 193 Ca 0.68 -0.10 -0.25 0.00 2.81 0.00 0.00 57.97 61.11 2q3r h PHE 193 Cb 1.79 -0.24 0.02 0.00 3.61 0.00 0.00 35.95 41.12 2q3r h PHE 193 CO -0.00 0.75 -0.95 0.52 -1.61 0.00 0.00 178.31 177.01 2q3r h MET 194 N 0.78 0.68 -6.19 1.51 2.86 -0.75 -3.39 114.93 110.43 2q3r h MET 194 Ca 0.16 -0.68 -0.57 0.00 -2.06 0.00 0.00 59.70 56.56 2q3r h MET 194 Cb 0.36 0.18 -0.05 0.00 0.06 0.00 0.00 31.60 32.15 2q3r h MET 194 CO 0.01 1.27 0.87 0.15 1.06 0.00 0.00 176.91 180.27 2q3r s LYS 195 N -3.44 4.15 0.51 1.72 -0.14 -1.01 -4.68 119.74 116.86 2q3r s LYS 195 Ca -0.09 1.39 0.25 0.00 -1.36 0.00 0.00 55.97 56.15 2q3r s LYS 195 Cb 0.08 -3.74 1.39 0.00 -1.68 0.00 0.00 37.83 33.87 2q3r s LYS 195 CO 0.91 -0.79 2.07 0.38 -0.76 0.00 0.00 175.35 177.16 2q3r h ASP 196 N 8.14 0.00 0.86 2.83 3.04 -1.78 0.74 116.42 130.25 2q3r h ASP 196 Ca -0.23 0.00 -0.02 0.00 -3.24 0.00 0.00 57.03 53.54 2q3r h ASP 196 Cb 1.08 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.37 2q3r h ASP 196 CO 1.00 0.12 -0.08 0.71 -2.04 0.00 0.00 179.24 178.95 2q3r h THR 197 N 0.00 0.22 0.00 1.15 1.35 -1.92 -3.30 112.91 110.41 2q3r h THR 197 Ca -0.00 -0.66 -0.42 0.00 -0.55 0.00 0.00 66.41 64.78 2q3r h THR 197 Cb 0.29 1.54 -0.06 0.00 -1.73 0.00 0.00 68.15 68.19 2q3r h THR 197 CO 0.02 0.08 -2.39 0.52 -0.25 0.00 0.00 175.52 173.49 2q3r n VAL 198 N -3.24 1.40 -2.80 6.82 0.31 -0.47 -4.85 118.33 115.50 2q3r n VAL 198 Ca -0.00 -0.34 -0.43 0.00 -0.01 0.00 0.00 64.34 63.56 2q3r n VAL 198 Cb 0.32 -1.86 -0.03 0.00 -0.91 0.00 0.00 33.84 31.36 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 -7.26 6.25 -0.16 4.52 2.47 0.24 -4.73 114.94 116.28 2q3r s ASN 199 Ca -0.35 -1.06 0.18 0.00 0.42 0.00 0.00 52.86 52.04 2q3r s ASN 199 Cb 0.13 -2.45 0.40 0.00 -1.45 0.00 0.00 41.25 37.88 2q3r s ASN 199 CO 0.45 -1.46 1.27 -0.90 -3.72 0.00 0.00 177.10 172.73 2q3r n ASP 200 N 7.90 2.96 -4.27 -4.21 5.75 -1.26 -4.45 116.55 118.96 2q3r n ASP 200 Ca 0.03 -3.10 -0.33 0.00 -0.01 0.00 0.00 54.79 51.37 2q3r n ASP 200 Cb 0.47 -0.49 0.15 0.00 -1.03 0.00 0.00 41.12 40.22 2q3r n ASP 200 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2q3r n ARG 201 N -1.05 -1.16 0.00 0.11 1.74 -1.26 -4.60 116.66 110.43 2q3r n ARG 201 Ca 0.19 -0.32 0.03 0.00 -0.77 0.00 0.00 57.85 56.98 2q3r n ARG 201 Cb 0.75 -1.64 -0.00 0.00 -1.02 0.00 0.00 32.46 30.55 2q3r n ARG 201 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2q3r n THR 202 N -4.13 0.00 -1.42 0.55 -2.24 -1.26 -1.57 114.28 104.22 2q3r n THR 202 Ca 0.01 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 2q3r n THR 202 Cb 0.62 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.91 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 -0.40 0.00 -0.52 3.42 3.85 -1.26 -4.82 116.55 116.82 2q3r n ASP 203 Ca 0.02 -0.48 0.00 0.00 -0.71 0.00 0.00 54.79 53.62 2q3r n ASP 203 Cb 0.12 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.89 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 -0.48 0.80 0.00 0.11 0.28 -1.26 -2.41 120.64 117.68 2q3r n GLU 204 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2q3r n GLU 204 Cb 0.00 -1.39 0.00 0.00 1.43 0.00 0.00 31.44 31.48 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 0.12 0.00 -1.83 -1.84 4.01 -1.24 -4.48 117.16 111.89 2q3r n TYR 205 Ca 0.00 -0.27 0.00 0.00 -0.16 0.00 0.00 57.90 57.47 2q3r n TYR 205 Cb 0.21 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.21 2q3r n TYR 205 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2q3r n GLY 206 N -0.27 3.21 4.79 2.72 0.00 -1.01 -3.01 105.19 111.62 2q3r n GLY 206 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.29 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 0.00 0.40 3.39 -0.02 0.00 -0.61 -4.46 105.19 103.89 2q3r n GLY 207 Ca 0.00 0.00 -0.10 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 -1.73 -0.22 0.11 1.61 1.04 -1.26 -5.04 113.70 108.22 2q3r s SER 208 Ca 0.00 -0.43 -0.13 0.00 0.48 0.00 0.00 55.95 55.88 2q3r s SER 208 Cb 0.00 0.50 -0.10 0.00 0.10 0.00 0.00 66.02 66.53 2q3r s SER 208 CO 0.00 -0.92 1.39 0.25 0.98 0.00 0.00 173.24 174.94 2q3r h LEU 209 N 2.33 0.91 -1.57 2.42 5.85 -1.96 -1.24 115.31 122.05 2q3r h LEU 209 Ca -0.32 -0.53 -0.04 0.00 0.84 0.00 0.00 57.88 57.83 2q3r h LEU 209 Cb 1.26 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 2q3r h LEU 209 CO 0.44 1.27 -0.20 1.56 -0.34 0.00 0.00 178.44 181.17 2q3r h GLN 210 N 0.59 0.00 0.17 1.25 4.20 -1.97 -2.38 115.11 116.96 2q3r h GLN 210 Ca 0.02 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.41 2q3r h GLN 210 Cb 1.09 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.88 2q3r h GLN 210 CO 0.11 0.20 -1.53 -0.91 -0.67 0.00 0.00 178.83 176.02 2q3r h ASN 211 N 0.00 0.56 -0.32 1.46 2.35 -1.73 -3.30 115.58 114.60 2q3r h ASN 211 Ca -0.00 -0.71 -0.07 0.00 -0.55 0.00 0.00 56.30 54.97 2q3r h ASN 211 Cb 0.51 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.68 2q3r h ASN 211 CO 0.03 1.58 -0.02 0.03 -1.65 0.00 0.00 177.43 177.40 2q3r h ARG 212 N 0.10 0.69 -0.57 0.81 3.08 -1.07 -2.68 114.38 114.74 2q3r h ARG 212 Ca -0.26 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 59.62 2q3r h ARG 212 Cb 2.07 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 32.03 2q3r h ARG 212 CO 0.20 0.72 0.00 0.00 -1.07 0.00 0.00 179.97 179.82 2q3r h LYS 214 N 2.33 0.06 -0.21 0.00 3.64 -1.55 -3.32 116.57 117.53 2q3r h LYS 214 Ca 0.00 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.37 2q3r h LYS 214 Cb 0.89 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.68 2q3r h LYS 214 CO 0.12 0.57 -0.22 0.35 -2.27 0.00 0.00 179.45 177.99 2q3r h PHE 215 N -0.43 -0.69 -0.87 1.91 3.57 -1.77 -0.24 116.94 118.41 2q3r h PHE 215 Ca 0.00 0.04 0.24 0.00 3.53 0.00 0.00 57.97 61.78 2q3r h PHE 215 Cb 0.56 0.33 -0.04 0.00 2.79 0.00 0.00 35.95 39.59 2q3r h PHE 215 CO 0.10 -0.18 0.62 -1.00 -2.23 0.00 0.00 178.31 175.62 2q3r h PRO 216 N -0.12 0.05 -0.12 6.41 0.13 -1.87 -0.46 132.00 136.01 2q3r h PRO 216 Ca 0.04 -0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.12 2q3r h PRO 216 Cb 0.22 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.34 2q3r h PRO 216 CO -0.27 0.03 -0.11 -0.07 -0.23 0.00 0.00 178.00 177.36 2q3r h LEU 217 N 0.05 0.30 -2.05 1.56 3.38 -1.17 0.65 115.31 118.03 2q3r h LEU 217 Ca 0.42 -0.47 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2q3r h LEU 217 Cb 1.59 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 42.25 2q3r h LEU 217 CO -0.03 0.71 -0.09 -0.33 0.09 0.00 0.00 178.44 178.79 2q3r h GLU 218 N -0.11 0.00 0.14 1.13 5.08 -0.13 -1.49 114.58 119.20 2q3r h GLU 218 Ca 0.02 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.13 2q3r h GLU 218 Cb 0.62 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.90 2q3r h GLU 218 CO 0.03 0.09 -1.07 0.82 -1.00 0.00 0.00 179.01 177.88 2q3r h ILE 219 N 0.00 1.37 0.00 3.13 2.04 -0.97 -2.03 117.51 121.04 2q3r h ILE 219 Ca -0.00 -2.47 0.00 0.00 1.00 0.00 0.00 64.86 63.39 2q3r h ILE 219 Cb 0.24 2.90 0.00 0.00 -0.74 0.00 0.00 36.82 39.22 2q3r h ILE 219 CO 0.01 0.73 0.00 0.52 0.00 0.00 0.00 178.15 179.41 2q3r n VAL 220 N -3.94 1.80 -0.11 1.67 0.31 0.20 -2.08 118.33 116.18 2q3r n VAL 220 Ca -0.14 0.52 -0.20 0.00 -0.01 0.00 0.00 64.34 64.51 2q3r n VAL 220 Cb 0.92 -1.51 -0.09 0.00 -0.91 0.00 0.00 33.84 32.25 2q3r n VAL 220 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2q3r n ASP 221 N -1.62 1.89 -0.30 4.52 2.03 -0.65 -4.00 116.55 118.42 2q3r n ASP 221 Ca -0.00 0.43 -0.05 0.00 0.52 0.00 0.00 54.79 55.68 2q3r n ASP 221 Cb 0.01 -0.89 0.07 0.00 -0.72 0.00 0.00 41.12 39.60 2q3r n ASP 221 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2q3r h ALA 222 N -0.77 1.05 -0.24 -1.67 0.00 -0.97 -2.08 119.26 114.58 2q3r h ALA 222 Ca -0.36 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.31 2q3r h ALA 222 Cb 1.23 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2q3r h ALA 222 CO -0.22 0.63 -0.13 0.28 0.00 0.00 0.00 179.25 179.81 2q3r h VAL 223 N 1.16 1.30 -0.60 0.00 2.07 -1.67 -2.90 116.25 115.62 2q3r h VAL 223 Ca 0.28 -1.22 -0.02 0.00 0.82 0.00 0.00 66.70 66.56 2q3r h VAL 223 Cb 0.13 1.58 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 2q3r h VAL 223 CO -0.03 0.38 0.28 0.00 0.02 0.00 0.00 177.57 178.22 2q3r h ALA 224 N 0.72 0.78 0.00 1.67 0.00 -1.67 -0.73 119.26 120.02 2q3r h ALA 224 Ca 0.05 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2q3r h ALA 224 Cb 0.64 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2q3r h ALA 224 CO 0.04 0.34 0.00 0.87 0.00 0.00 0.00 179.25 180.50 2q3r h LYS 225 N 0.82 0.00 0.00 0.00 1.57 -1.37 1.75 116.57 119.35 2q3r h LYS 225 Ca 0.21 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.72 2q3r h LYS 225 Cb 0.13 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.39 2q3r h LYS 225 CO -0.03 0.00 -2.08 -1.91 -0.57 0.00 0.00 179.45 174.87 2q3r n GLU 226 N -2.38 0.67 0.00 3.15 4.07 -0.39 -4.73 120.64 121.02 2q3r n GLU 226 Ca -0.00 0.04 0.00 0.00 -0.06 0.00 0.00 57.16 57.13 2q3r n GLU 226 Cb 0.11 -1.60 0.00 0.00 -0.06 0.00 0.00 31.44 29.89 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 -2.73 0.00 0.00 6.31 -5.35 -0.57 -4.93 119.36 112.10 2q3r n ILE 227 Ca -0.22 -0.11 0.00 0.00 -0.27 0.00 0.00 62.75 62.15 2q3r n ILE 227 Cb 1.00 0.64 0.00 0.00 -1.74 0.00 0.00 39.64 39.54 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 0.67 2.63 0.29 3.28 0.00 0.59 -4.80 105.19 107.86 2q3r n GLY 228 Ca 0.00 -1.23 0.06 0.00 0.00 0.00 0.00 46.02 44.86 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 0.47 0.00 1.61 0.13 -1.89 -1.04 132.00 131.28 2q3r h PRO 229 Ca 0.00 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 2q3r h PRO 229 Cb 0.00 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.02 2q3r h PRO 229 CO 0.00 0.31 0.00 -0.40 -0.23 0.00 0.00 178.00 177.68 2q3r n ASP 230 N -4.97 0.00 -0.69 1.44 3.85 -1.26 -0.31 116.55 114.60 2q3r n ASP 230 Ca 0.16 0.08 0.06 0.00 -0.71 0.00 0.00 54.79 54.38 2q3r n ASP 230 Cb 0.44 -0.08 0.16 0.00 -1.35 0.00 0.00 41.12 40.28 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 -1.08 1.19 -4.58 0.11 1.74 -0.39 -4.67 116.66 108.98 2q3r n ARG 231 Ca 0.00 -2.88 -0.24 0.00 -0.77 0.00 0.00 57.85 53.95 2q3r n ARG 231 Cb 0.00 -1.26 -0.17 0.00 -1.02 0.00 0.00 32.46 30.01 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 -2.47 1.12 0.18 1.55 1.01 0.58 -1.04 120.40 121.32 2q3r s VAL 232 Ca 0.35 -0.47 0.06 0.00 0.00 0.00 0.00 61.98 61.92 2q3r s VAL 232 Cb 0.35 -1.02 -0.05 0.00 0.00 0.00 0.00 36.38 35.66 2q3r s VAL 232 CO -0.07 0.35 -0.12 -0.83 0.00 0.00 0.00 175.10 174.43 2q3r s GLY 233 N 0.64 1.26 -0.01 4.51 0.00 0.52 -1.05 107.32 113.18 2q3r s GLY 233 Ca -0.14 -1.58 0.01 0.00 0.00 0.00 0.00 44.72 43.01 2q3r s GLY 233 CO 0.04 -1.67 -0.04 -1.50 0.00 0.00 0.00 173.10 169.93 2q3r s ILE 234 N -3.17 0.35 -0.15 0.90 2.07 -1.04 0.08 121.20 120.24 2q3r s ILE 234 Ca 0.20 -0.13 -0.05 0.00 -1.41 0.00 0.00 60.65 59.26 2q3r s ILE 234 Cb 0.01 -0.34 -0.04 0.00 0.13 0.00 0.00 42.46 42.23 2q3r s ILE 234 CO 0.04 0.13 0.03 -0.60 -1.91 0.00 0.00 174.94 172.62 2q3r s ARG 235 N 0.25 3.61 0.08 3.50 3.52 -0.52 -0.38 118.95 129.00 2q3r s ARG 235 Ca -0.03 -0.39 0.03 0.00 -0.13 0.00 0.00 55.73 55.22 2q3r s ARG 235 Cb -0.06 -3.03 -0.03 0.00 -1.56 0.00 0.00 34.95 30.27 2q3r s ARG 235 CO -0.00 0.41 -0.10 -0.51 -0.81 0.00 0.00 175.30 174.29 2q3r s LEU 236 N -0.05 2.35 -0.40 -0.88 1.43 0.81 -1.19 118.68 120.75 2q3r s LEU 236 Ca 0.05 -0.72 0.07 0.00 -1.03 0.00 0.00 54.13 52.49 2q3r s LEU 236 Cb -0.12 -0.27 0.23 0.00 0.03 0.00 0.00 46.19 46.06 2q3r s LEU 236 CO 0.02 -0.24 0.53 -1.54 0.23 0.00 0.00 176.35 175.35 2q3r n SER 237 N 0.88 -0.27 0.10 2.29 3.41 -1.26 -2.31 113.62 116.45 2q3r n SER 237 Ca -0.18 -2.70 0.10 0.00 -0.26 0.00 0.00 58.87 55.83 2q3r n SER 237 Cb 0.57 -0.37 0.44 0.00 -0.26 0.00 0.00 64.21 64.59 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 1.69 0.13 -0.01 4.33 -0.04 -1.26 -2.65 135.00 137.20 2q3r n PRO 238 Ca 0.21 0.44 0.11 0.00 -0.04 0.00 0.00 63.50 64.23 2q3r n PRO 238 Cb 0.53 -1.79 -0.15 0.00 -0.04 0.00 0.00 33.50 32.05 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 -2.04 0.02 -2.75 0.54 3.01 -1.26 -4.55 117.46 110.43 2q3r n PHE 239 Ca 0.01 0.01 -0.30 0.00 1.01 0.00 0.00 57.45 58.18 2q3r n PHE 239 Cb 0.16 -0.40 -0.03 0.00 -0.01 0.00 0.00 39.48 39.20 2q3r n PHE 239 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2q3r s ALA 240 N -3.40 3.31 -0.10 4.37 0.00 -1.08 -4.95 121.76 119.91 2q3r s ALA 240 Ca -0.04 -0.18 0.13 0.00 0.00 0.00 0.00 51.96 51.87 2q3r s ALA 240 Cb 0.14 -2.75 0.25 0.00 0.00 0.00 0.00 23.12 20.76 2q3r s ALA 240 CO 0.90 -0.09 1.12 -0.40 0.00 0.00 0.00 175.76 177.29 2q3r n ASP 241 N -1.47 1.52 -4.59 0.00 5.68 -1.26 -4.22 116.55 112.21 2q3r n ASP 241 Ca 0.03 -2.85 -0.48 0.00 -0.50 0.00 0.00 54.79 50.99 2q3r n ASP 241 Cb 0.54 -0.38 -0.04 0.00 -1.14 0.00 0.00 41.12 40.11 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 -0.85 1.44 -3.51 2.11 9.36 -1.26 -1.77 117.16 122.67 2q3r n TYR 242 Ca 0.11 0.64 -0.21 0.00 3.32 0.00 0.00 57.90 61.76 2q3r n TYR 242 Cb 0.71 -2.31 0.06 0.00 -0.63 0.00 0.00 39.34 37.16 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 1.84 -3.28 -4.07 2.98 2.81 -1.26 -3.22 117.12 112.93 2q3r n MET 243 Ca 0.15 0.69 -0.46 0.00 -1.81 0.00 0.00 57.70 56.27 2q3r n MET 243 Cb 0.25 -5.22 0.02 0.00 -0.71 0.00 0.00 33.22 27.56 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 -3.87 -0.31 -0.65 0.03 1.02 -0.73 -4.89 120.64 111.23 2q3r n GLU 244 Ca -0.17 0.11 0.06 0.00 -0.02 0.00 0.00 57.16 57.14 2q3r n GLU 244 Cb 0.64 -2.45 0.14 0.00 -0.02 0.00 0.00 31.44 29.74 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 -2.17 1.55 -4.74 1.62 3.41 -0.81 -4.82 113.62 107.66 2q3r n SER 245 Ca -0.13 -3.16 -0.31 0.00 -0.26 0.00 0.00 58.87 55.01 2q3r n SER 245 Cb 0.57 -0.43 0.11 0.00 -0.26 0.00 0.00 64.21 64.20 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 -2.70 1.68 -0.06 5.00 0.00 -1.26 -4.54 107.32 105.43 2q3r s GLY 246 Ca 0.32 0.35 0.05 0.00 0.00 0.00 0.00 44.72 45.44 2q3r s GLY 246 CO -0.06 0.71 -0.23 -0.35 0.00 0.00 0.00 173.10 173.17 2q3r s ASP 247 N -3.20 2.86 0.48 1.64 -1.08 -1.26 -3.35 116.67 112.75 2q3r s ASP 247 Ca 0.63 -0.48 0.16 0.00 -0.52 0.00 0.00 52.55 52.33 2q3r s ASP 247 Cb -0.19 -0.91 1.13 0.00 -1.46 0.00 0.00 42.92 41.49 2q3r s ASP 247 CO 0.57 0.20 2.05 0.71 0.52 0.00 0.00 175.17 179.22 2q3r h THR 248 N 5.26 1.05 -2.05 1.71 1.35 -1.95 -3.24 112.91 115.05 2q3r h THR 248 Ca -0.29 -0.42 -0.56 0.00 -0.55 0.00 0.00 66.41 64.58 2q3r h THR 248 Cb 1.19 1.23 -0.40 0.00 -1.73 0.00 0.00 68.15 68.44 2q3r h THR 248 CO 0.47 0.12 -1.01 -3.20 -0.25 0.00 0.00 175.52 171.66 2q3r n ASN 249 N -4.33 1.06 -0.14 5.36 2.85 -1.26 -4.97 115.26 113.82 2q3r n ASN 249 Ca -0.03 -2.90 -0.09 0.00 -0.11 0.00 0.00 54.58 51.45 2q3r n ASN 249 Cb 0.20 -0.64 -0.00 0.00 1.24 0.00 0.00 39.78 40.57 2q3r n ASN 249 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2q3r h PRO 250 N 3.90 0.64 -0.92 1.20 0.13 -1.80 -2.31 132.00 132.85 2q3r h PRO 250 Ca 0.10 -0.13 0.19 0.00 -0.87 0.00 0.00 66.00 65.29 2q3r h PRO 250 Cb 0.84 -0.10 -0.11 0.00 0.13 0.00 0.00 31.00 31.76 2q3r h PRO 250 CO 0.55 0.62 0.48 0.78 -0.23 0.00 0.00 178.00 180.20 2q3r h GLY 251 N 0.54 1.58 2.00 1.56 0.00 -1.92 0.21 103.07 107.04 2q3r h GLY 251 Ca 0.14 -0.26 -0.12 0.00 0.00 0.00 0.00 47.33 47.10 2q3r h GLY 251 CO -0.01 -0.14 -0.55 0.00 0.00 0.00 0.00 176.54 175.84 2q3r h ALA 252 N 1.65 0.65 -0.32 3.60 0.00 -1.97 -2.92 119.26 119.95 2q3r h ALA 252 Ca 0.54 -0.50 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 2q3r h ALA 252 Cb 0.91 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2q3r h ALA 252 CO -0.43 0.69 -0.45 1.25 0.00 0.00 0.00 179.25 180.31 2q3r h LEU 253 N 0.00 0.89 0.16 0.00 5.85 -0.10 -2.99 115.31 119.12 2q3r h LEU 253 Ca -0.01 -0.43 -0.01 0.00 0.84 0.00 0.00 57.88 58.28 2q3r h LEU 253 Cb 1.41 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 42.19 2q3r h LEU 253 CO 0.07 1.20 -0.08 1.23 -0.34 0.00 0.00 178.44 180.52 2q3r h GLY 254 N 0.84 -0.23 -0.97 3.75 0.00 -1.06 -2.92 103.07 102.48 2q3r h GLY 254 Ca 0.04 0.08 0.41 0.00 0.00 0.00 0.00 47.33 47.86 2q3r h GLY 254 CO 0.10 -0.08 0.68 -2.00 0.00 0.00 0.00 176.54 175.23 2q3r h LEU 255 N -0.73 0.33 0.00 3.11 5.85 -1.66 -0.34 115.31 121.86 2q3r h LEU 255 Ca -0.02 0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.89 2q3r h LEU 255 Cb 0.17 0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.38 2q3r h LEU 255 CO 0.04 -0.28 0.00 0.00 -0.34 0.00 0.00 178.44 177.86 2q3r n TYR 256 N -4.99 0.00 -0.21 1.25 9.36 -1.13 -2.69 117.16 118.75 2q3r n TYR 256 Ca 0.37 0.00 0.04 0.00 3.32 0.00 0.00 57.90 61.62 2q3r n TYR 256 Cb 1.29 -0.33 0.09 0.00 -0.63 0.00 0.00 39.34 39.76 2q3r n TYR 256 CO 0.00 0.00 0.00 -1.33 0.22 0.00 0.00 176.86 175.75 2q3r n MET 257 N -1.50 -0.05 -0.14 2.98 2.81 -0.18 0.22 117.12 121.26 2q3r n MET 257 Ca 0.00 0.91 -0.07 0.00 -1.81 0.00 0.00 57.70 56.73 2q3r n MET 257 Cb 0.00 -1.36 0.02 0.00 -0.71 0.00 0.00 33.22 31.17 2q3r n MET 257 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2q3r h ALA 258 N 1.17 0.55 -0.03 3.04 0.00 -1.51 0.16 119.26 122.64 2q3r h ALA 258 Ca 0.28 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.21 2q3r h ALA 258 Cb 0.44 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2q3r h ALA 258 CO -0.60 -0.07 -0.09 1.49 0.00 0.00 0.00 179.25 179.98 2q3r h GLU 259 N 0.51 -0.14 -0.14 0.00 4.57 0.29 -2.54 114.58 117.14 2q3r h GLU 259 Ca 0.18 0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.34 2q3r h GLU 259 Cb 0.02 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.63 2q3r h GLU 259 CO -0.08 -0.09 -0.05 0.77 -1.18 0.00 0.00 179.01 178.37 2q3r h SER 260 N -0.14 0.18 0.00 1.04 0.02 -0.58 -2.55 113.55 111.52 2q3r h SER 260 Ca 0.04 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2q3r h SER 260 Cb 0.20 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.70 2q3r h SER 260 CO -0.11 0.27 0.00 0.18 -1.14 0.00 0.00 176.83 176.03 2q3r n LEU 261 N -4.36 0.30 -0.03 5.07 4.77 0.50 -3.48 117.00 119.78 2q3r n LEU 261 Ca -0.01 -0.15 -0.22 0.00 -0.03 0.00 0.00 56.01 55.60 2q3r n LEU 261 Cb 0.20 -0.15 -0.13 0.00 -2.33 0.00 0.00 43.42 41.00 2q3r n LEU 261 CO 0.36 0.08 -0.63 0.78 -1.33 0.00 0.00 177.39 176.65 2q3r h ASN 262 N 0.10 0.28 -0.98 -1.43 2.35 -1.50 -3.26 115.58 111.14 2q3r h ASN 262 Ca 0.00 -0.79 0.30 0.00 -0.55 0.00 0.00 56.30 55.25 2q3r h ASN 262 Cb 0.15 -0.09 -0.14 0.00 0.05 0.00 0.00 38.32 38.28 2q3r h ASN 262 CO 0.00 1.69 0.50 0.50 -1.65 0.00 0.00 177.43 178.48 2q3r h LYS 263 N -0.35 0.32 0.00 0.81 3.64 -1.78 0.43 116.57 119.64 2q3r h LYS 263 Ca -0.37 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 58.94 2q3r h LYS 263 Cb 1.75 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 33.49 2q3r h LYS 263 CO -0.01 0.21 -0.31 1.88 -2.27 0.00 0.00 179.45 178.96 2q3r h TYR 264 N 0.33 0.00 -6.10 1.91 -1.99 -1.80 -3.48 116.97 105.84 2q3r h TYR 264 Ca 0.69 0.00 -0.41 0.00 2.00 0.00 0.00 58.73 61.01 2q3r h TYR 264 Cb 1.51 0.00 0.07 0.00 2.00 0.00 0.00 36.73 40.31 2q3r h TYR 264 CO -0.06 0.23 -0.87 0.41 -0.00 0.00 0.00 178.16 177.87 2q3r n GLY 265 N 1.17 -0.58 3.92 3.88 0.00 0.15 -4.91 105.19 108.82 2q3r n GLY 265 Ca 0.03 0.27 -0.28 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.62 2.10 0.09 -0.61 -4.36 -1.26 -4.51 121.20 109.03 2q3r s ILE 266 Ca 0.18 -0.12 -0.22 0.00 -0.26 0.00 0.00 60.65 60.24 2q3r s ILE 266 Cb -0.05 -2.98 -0.12 0.00 1.25 0.00 0.00 42.46 40.55 2q3r s ILE 266 CO 0.83 0.00 1.68 0.25 0.24 0.00 0.00 174.94 177.94 2q3r h LEU 267 N -0.97 0.12 -7.69 0.37 5.85 -0.79 -3.47 115.31 108.72 2q3r h LEU 267 Ca -0.45 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.14 2q3r h LEU 267 Cb 1.31 -0.03 -0.11 0.00 0.37 0.00 0.00 40.66 42.20 2q3r h LEU 267 CO 0.59 0.17 -0.06 -0.72 -0.34 0.00 0.00 178.44 178.07 2q3r s TYR 268 N -5.86 -0.04 -0.15 1.25 -0.85 -1.15 -3.83 117.35 106.73 2q3r s TYR 268 Ca -0.13 -0.30 0.01 0.00 -0.52 0.00 0.00 57.07 56.12 2q3r s TYR 268 Cb 0.06 0.28 0.02 0.00 0.38 0.00 0.00 41.96 42.70 2q3r s TYR 268 CO 0.68 -0.83 -0.17 0.00 -1.52 0.00 0.00 175.55 173.71 2q3r s HIS 270 N 1.26 2.99 -0.01 0.00 2.46 0.49 -2.34 115.29 120.14 2q3r s HIS 270 Ca 0.02 -0.97 0.04 0.00 0.47 0.00 0.00 55.06 54.61 2q3r s HIS 270 Cb -0.14 -2.12 -0.01 0.00 -0.13 0.00 0.00 32.58 30.18 2q3r s HIS 270 CO -0.09 -0.56 -0.14 0.08 -2.47 0.00 0.00 174.74 171.57 2q3r s VAL 271 N 1.47 1.08 0.21 0.89 1.01 -0.84 -0.13 120.40 124.09 2q3r s VAL 271 Ca 0.05 -0.58 -0.27 0.00 0.00 0.00 0.00 61.98 61.19 2q3r s VAL 271 Cb -0.15 -0.91 -0.09 0.00 0.00 0.00 0.00 36.38 35.24 2q3r s VAL 271 CO -0.03 0.31 0.85 -0.63 0.00 0.00 0.00 175.10 175.60 2q3r s ILE 272 N -0.26 4.25 0.40 2.22 1.01 -0.98 -2.66 121.20 125.19 2q3r s ILE 272 Ca 0.04 1.85 -0.26 0.00 0.00 0.00 0.00 60.65 62.27 2q3r s ILE 272 Cb -0.06 -4.19 -0.09 0.00 0.01 0.00 0.00 42.46 38.13 2q3r s ILE 272 CO -0.00 0.48 1.30 -0.70 0.00 0.00 0.00 174.94 176.01 2q3r s GLU 273 N -1.25 3.99 0.00 2.79 2.56 0.19 -4.84 118.70 122.14 2q3r s GLU 273 Ca 0.39 2.15 0.00 0.00 0.00 0.00 0.00 54.97 57.51 2q3r s GLU 273 Cb -0.24 -2.77 0.00 0.00 2.00 0.00 0.00 34.13 33.12 2q3r s GLU 273 CO 0.28 -0.47 0.91 0.00 -0.56 0.00 0.00 175.26 175.43 2q3r n ALA 274 N 0.17 -0.42 -2.85 6.30 0.00 -1.26 -4.76 120.51 117.68 2q3r n ALA 274 Ca 0.03 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.39 2q3r n ALA 274 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 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 -1.80 0.56 0.00 0.00 1.74 -1.26 -4.86 116.66 111.03 2q3r n ARG 275 Ca 0.00 -2.16 0.00 0.00 -0.77 0.00 0.00 57.85 54.92 2q3r n ARG 275 Cb 0.00 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 29.96 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 2.58 0.00 -0.72 5.56 0.00 -1.26 -5.17 117.12 118.11 2q3r n MET 276 Ca 0.18 0.00 -0.05 0.00 0.00 0.00 0.00 57.70 57.83 2q3r n MET 276 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.79 2q3r n MET 276 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 175.97 177.55 2q3r n HIS 287 N 0.00 -1.17 0.00 3.17 -0.00 -1.26 -4.85 115.22 111.11 2q3r n HIS 287 Ca 0.00 0.62 0.00 0.00 -0.00 0.00 0.00 57.72 58.34 2q3r n HIS 287 Cb 0.00 -1.27 0.00 0.00 -0.00 0.00 0.00 29.99 28.72 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 -2.82 0.00 -4.02 3.57 5.66 -1.26 -5.11 114.28 110.30 2q3r n THR 288 Ca -0.00 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.69 2q3r n THR 288 Cb 0.10 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 68.73 2q3r n THR 288 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 2q3r s LEU 289 N 0.00 4.37 0.00 1.09 2.96 -1.26 -4.88 118.68 120.96 2q3r s LEU 289 Ca 0.00 -1.96 0.00 0.00 -0.22 0.00 0.00 54.13 51.95 2q3r s LEU 289 Cb 0.00 -1.58 0.00 0.00 0.50 0.00 0.00 46.19 45.11 2q3r s LEU 289 CO 0.00 -0.34 0.00 0.80 -1.32 0.00 0.00 176.35 175.49 2q3r n MET 290 N 4.31 0.00 -0.15 1.98 1.56 -1.26 -4.89 117.12 118.67 2q3r n MET 290 Ca -0.00 0.00 0.12 0.00 -0.27 0.00 0.00 57.70 57.55 2q3r n MET 290 Cb 0.42 -0.01 0.45 0.00 2.15 0.00 0.00 33.22 36.23 2q3r n MET 290 CO 0.00 0.00 0.00 -1.35 -0.73 0.00 0.00 175.97 173.89 2q3r h PRO 291 N 0.00 0.51 -0.54 2.12 0.11 -1.96 -0.21 132.00 132.04 2q3r h PRO 291 Ca 0.00 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.08 2q3r h PRO 291 Cb 0.00 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 30.97 2q3r h PRO 291 CO 0.00 0.33 0.32 0.52 -0.21 0.00 0.00 178.00 178.96 2q3r h MET 292 N 0.52 0.73 -0.51 1.05 2.86 -1.86 0.40 114.93 118.13 2q3r h MET 292 Ca 0.34 -0.07 0.06 0.00 -2.06 0.00 0.00 59.70 57.96 2q3r h MET 292 Cb 0.61 -0.15 -0.05 0.00 0.06 0.00 0.00 31.60 32.06 2q3r h MET 292 CO -0.11 0.54 0.22 -0.09 1.06 0.00 0.00 176.91 178.53 2q3r h ARG 293 N 0.72 0.42 0.39 1.72 9.65 -1.37 -2.04 114.38 123.87 2q3r h ARG 293 Ca 0.19 -0.03 -0.02 0.00 -1.10 0.00 0.00 59.98 59.03 2q3r h ARG 293 Cb -0.00 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 28.48 2q3r h ARG 293 CO -0.04 0.28 -0.19 0.87 2.80 0.00 0.00 179.97 183.70 2q3r h LYS 294 N 0.44 -0.50 -0.70 0.20 1.57 -0.56 -3.31 116.57 113.70 2q3r h LYS 294 Ca 0.23 0.03 0.07 0.00 -1.87 0.00 0.00 60.65 59.12 2q3r h LYS 294 Cb 0.19 0.11 -0.10 0.00 0.08 0.00 0.00 32.23 32.52 2q3r h LYS 294 CO -0.20 -0.21 -0.55 0.00 -0.57 0.00 0.00 179.45 177.92 2q3r h ALA 295 N -0.30 -0.64 -2.51 3.86 0.00 0.06 -3.37 119.26 116.35 2q3r h ALA 295 Ca -0.05 0.06 -0.56 0.00 0.00 0.00 0.00 54.91 54.36 2q3r h ALA 295 Cb 0.53 1.25 -0.05 0.00 0.00 0.00 0.00 17.79 19.52 2q3r h ALA 295 CO 0.09 -0.98 0.27 0.12 0.00 0.00 0.00 179.25 178.75 2q3r s PHE 296 N -5.47 3.55 -1.17 0.00 5.36 -0.79 -4.48 117.98 114.97 2q3r s PHE 296 Ca -0.13 1.37 -0.09 0.00 -0.96 0.00 0.00 56.93 57.12 2q3r s PHE 296 Cb 0.09 -2.96 0.23 0.00 -0.34 0.00 0.00 43.02 40.05 2q3r s PHE 296 CO 0.59 -0.05 1.44 1.63 -1.46 0.00 0.00 175.22 177.37 2q3r n LYS 297 N 4.29 3.71 -1.68 10.12 4.76 -1.26 -4.78 118.16 133.33 2q3r n LYS 297 Ca 0.03 -4.12 -0.00 0.00 -2.87 0.00 0.00 58.31 51.34 2q3r n LYS 297 Cb 0.50 -2.76 0.00 0.00 -1.84 0.00 0.00 35.03 30.94 2q3r n LYS 297 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2q3r n GLY 298 N 2.82 1.14 3.62 0.72 0.00 -1.26 -5.12 105.19 107.11 2q3r n GLY 298 Ca 0.31 -0.92 -0.46 0.00 0.00 0.00 0.00 46.02 44.95 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 -0.06 1.21 -4.78 2.61 -1.04 -1.25 -4.93 114.28 106.04 2q3r n THR 299 Ca -0.00 -0.30 -0.27 0.00 -2.04 0.00 0.00 64.05 61.44 2q3r n THR 299 Cb 0.04 -1.13 -0.17 0.00 -1.82 0.00 0.00 70.33 67.26 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 -0.38 1.75 -0.14 -1.42 5.36 -1.26 -3.07 117.98 118.81 2q3r s PHE 300 Ca 0.67 -0.63 0.00 0.00 -0.96 0.00 0.00 56.93 56.01 2q3r s PHE 300 Cb -0.74 -1.22 -0.01 0.00 -0.34 0.00 0.00 43.02 40.71 2q3r s PHE 300 CO 0.54 -0.28 -0.14 0.42 -1.46 0.00 0.00 175.22 174.29 2q3r s ILE 301 N 0.43 2.82 0.10 3.12 1.01 -0.99 0.43 121.20 128.12 2q3r s ILE 301 Ca -0.13 -0.73 0.06 0.00 0.00 0.00 0.00 60.65 59.85 2q3r s ILE 301 Cb -0.15 -2.19 -0.04 0.00 0.01 0.00 0.00 42.46 40.09 2q3r s ILE 301 CO 0.04 0.52 -0.05 -0.44 0.00 0.00 0.00 174.94 175.01 2q3r s SER 302 N 0.62 4.70 0.17 3.58 0.01 0.20 -1.98 113.70 121.00 2q3r s SER 302 Ca -0.08 -0.28 -0.19 0.00 1.31 0.00 0.00 55.95 56.71 2q3r s SER 302 Cb -0.16 -1.01 0.04 0.00 0.21 0.00 0.00 66.02 65.10 2q3r s SER 302 CO 0.03 0.18 0.52 0.00 0.41 0.00 0.00 173.24 174.38 2q3r s ALA 303 N -1.26 -1.10 0.00 1.44 0.00 -1.09 0.20 121.76 119.95 2q3r s ALA 303 Ca 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 51.96 52.17 2q3r s ALA 303 Cb -0.11 0.82 0.00 0.00 0.00 0.00 0.00 23.12 23.83 2q3r s ALA 303 CO 0.16 -0.77 0.00 0.41 0.00 0.00 0.00 175.76 175.56 2q3r n GLY 304 N -0.33 0.97 2.77 0.00 0.00 -1.26 0.54 105.19 107.89 2q3r n GLY 304 Ca -0.13 -0.91 -0.04 0.00 0.00 0.00 0.00 46.02 44.94 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 1.70 0.45 3.77 -0.02 0.00 -1.26 -4.63 105.19 105.20 2q3r n GLY 305 Ca 0.00 -0.04 -0.38 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.49 3.13 0.44 1.61 0.40 -1.26 -5.04 117.98 115.77 2q3r s PHE 306 Ca 0.00 1.57 0.07 0.00 -0.60 0.00 0.00 56.93 57.97 2q3r s PHE 306 Cb 0.00 -3.36 -0.04 0.00 0.51 0.00 0.00 43.02 40.14 2q3r s PHE 306 CO 0.00 -1.18 0.20 0.95 0.70 0.00 0.00 175.22 175.88 2q3r s THR 307 N -1.42 2.12 0.10 0.64 -4.23 -1.26 -4.97 115.64 106.63 2q3r s THR 307 Ca 0.56 -1.69 -0.29 0.00 -1.18 0.00 0.00 61.69 59.09 2q3r s THR 307 Cb -0.30 -2.81 -0.11 0.00 1.34 0.00 0.00 72.50 70.62 2q3r s THR 307 CO 0.38 0.00 1.63 -0.09 -0.54 0.00 0.00 174.62 175.99 2q3r h ARG 308 N 1.32 -0.56 -0.35 3.99 2.43 -1.99 -0.99 114.38 118.23 2q3r h ARG 308 Ca -0.42 0.04 0.05 0.00 -0.81 0.00 0.00 59.98 58.84 2q3r h ARG 308 Cb 1.26 0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 30.89 2q3r h ARG 308 CO 0.68 -0.38 0.05 0.93 -1.51 0.00 0.00 179.97 179.75 2q3r h GLU 309 N -0.59 0.16 -0.81 0.20 3.07 -1.99 0.25 114.58 114.88 2q3r h GLU 309 Ca 0.00 -0.01 0.12 0.00 -0.50 0.00 0.00 59.36 58.97 2q3r h GLU 309 Cb 0.56 -0.04 -0.08 0.00 -0.84 0.00 0.00 28.75 28.36 2q3r h GLU 309 CO -0.11 0.11 0.42 -0.44 -1.40 0.00 0.00 179.01 177.59 2q3r h ASP 310 N 0.17 0.53 -0.24 1.42 3.32 -1.89 -0.87 116.42 118.86 2q3r h ASP 310 Ca 0.17 0.07 -0.18 0.00 0.02 0.00 0.00 57.03 57.11 2q3r h ASP 310 Cb 0.20 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2q3r h ASP 310 CO -0.24 0.27 -0.57 1.23 -1.72 0.00 0.00 179.24 178.21 2q3r h GLY 311 N 0.65 0.89 0.79 2.75 0.00 -0.20 -0.91 103.07 107.04 2q3r h GLY 311 Ca 0.42 -1.09 0.05 0.00 0.00 0.00 0.00 47.33 46.70 2q3r h GLY 311 CO -0.31 0.98 0.47 3.43 0.00 0.00 0.00 176.54 181.11 2q3r h ASN 312 N 0.56 0.76 0.04 0.19 2.35 0.10 -1.85 115.58 117.72 2q3r h ASN 312 Ca -0.00 0.01 -0.25 0.00 -0.55 0.00 0.00 56.30 55.50 2q3r h ASN 312 Cb 1.19 -0.15 0.02 0.00 0.05 0.00 0.00 38.32 39.42 2q3r h ASN 312 CO 0.12 0.51 -0.99 -0.08 -1.65 0.00 0.00 177.43 175.34 2q3r h GLU 313 N 0.90 0.67 -0.74 0.81 4.81 -1.15 0.21 114.58 120.07 2q3r h GLU 313 Ca 0.32 -0.69 0.04 0.00 -0.13 0.00 0.00 59.36 58.91 2q3r h GLU 313 Cb 0.09 0.19 -0.05 0.00 0.63 0.00 0.00 28.75 29.61 2q3r h GLU 313 CO -0.14 1.28 0.46 0.00 -0.73 0.00 0.00 179.01 179.87 2q3r h ALA 314 N 0.49 0.99 0.02 2.92 0.00 -1.00 0.14 119.26 122.82 2q3r h ALA 314 Ca -0.11 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 2q3r h ALA 314 Cb 1.63 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 19.22 2q3r h ALA 314 CO 0.19 0.21 -0.22 0.28 0.00 0.00 0.00 179.25 179.72 2q3r h VAL 315 N 0.87 1.64 0.00 0.00 2.07 -1.36 1.35 116.25 120.82 2q3r h VAL 315 Ca 0.31 -2.16 -0.00 0.00 0.82 0.00 0.00 66.70 65.67 2q3r h VAL 315 Cb 0.09 3.07 -0.00 0.00 -1.52 0.00 0.00 31.29 32.92 2q3r h VAL 315 CO -0.14 0.58 -0.02 0.77 0.02 0.00 0.00 177.57 178.78 2q3r h SER 316 N -0.69 0.00 -0.43 0.57 4.64 -0.80 -0.40 113.55 116.44 2q3r h SER 316 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2q3r h SER 316 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2q3r h SER 316 CO 0.04 0.02 0.00 0.29 -0.87 0.00 0.00 176.83 176.31 2q3r n LYS 317 N -3.86 3.60 -1.46 4.77 4.76 0.48 -4.96 118.16 121.49 2q3r n LYS 317 Ca -0.03 -2.85 -0.16 0.00 -2.87 0.00 0.00 58.31 52.40 2q3r n LYS 317 Cb 0.11 -1.90 -0.07 0.00 -1.84 0.00 0.00 35.03 31.33 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 0.21 1.55 0.17 0.72 0.00 -0.16 -4.87 105.19 102.81 2q3r n GLY 318 Ca 0.23 -0.11 0.03 0.00 0.00 0.00 0.00 46.02 46.16 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 0.02 0.00 -3.60 1.61 2.47 0.15 -3.46 114.38 111.58 2q3r h ARG 319 Ca -0.32 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 58.33 2q3r h ARG 319 Cb 1.16 0.00 -0.11 0.00 -1.65 0.00 0.00 29.97 29.37 2q3r h ARG 319 CO 0.47 0.46 -0.15 -0.08 0.56 0.00 0.00 179.97 181.23 2q3r s THR 320 N -3.72 0.05 -0.26 2.04 -1.32 -0.81 -4.99 115.64 106.63 2q3r s THR 320 Ca -0.01 -1.09 -0.05 0.00 -1.21 0.00 0.00 61.69 59.34 2q3r s THR 320 Cb 0.12 -1.70 -0.16 0.00 -1.51 0.00 0.00 72.50 69.26 2q3r s THR 320 CO 0.72 -0.22 -0.24 0.47 -2.21 0.00 0.00 174.62 173.14 2q3r n ASP 321 N -0.27 1.98 -4.23 8.08 8.00 0.12 -4.10 116.55 126.13 2q3r n ASP 321 Ca -0.09 0.06 -0.18 0.00 0.71 0.00 0.00 54.79 55.29 2q3r n ASP 321 Cb 0.63 -0.59 -0.11 0.00 -0.02 0.00 0.00 41.12 41.02 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 -6.93 2.39 -0.11 0.64 1.43 0.17 -4.83 118.68 111.44 2q3r s LEU 322 Ca -0.36 -0.79 0.00 0.00 -1.03 0.00 0.00 54.13 51.96 2q3r s LEU 322 Cb 0.11 -0.53 0.02 0.00 0.03 0.00 0.00 46.19 45.83 2q3r s LEU 322 CO 0.57 -0.15 -0.09 -0.69 0.23 0.00 0.00 176.35 176.22 2q3r s VAL 323 N -2.06 1.10 -0.10 -1.59 1.01 -0.75 0.60 120.40 118.60 2q3r s VAL 323 Ca 0.07 -0.35 -0.19 0.00 0.00 0.00 0.00 61.98 61.51 2q3r s VAL 323 Cb -0.05 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 2q3r s VAL 323 CO 0.03 0.38 0.52 0.00 0.00 0.00 0.00 175.10 176.03 2q3r s ALA 324 N 1.54 3.45 -0.16 5.51 0.00 0.13 -0.86 121.76 131.38 2q3r s ALA 324 Ca 0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 51.96 51.86 2q3r s ALA 324 Cb -0.13 -2.71 -0.01 0.00 0.00 0.00 0.00 23.12 20.27 2q3r s ALA 324 CO -0.07 -0.01 -0.13 0.71 0.00 0.00 0.00 175.76 176.26 2q3r s TYR 325 N 0.63 2.82 0.00 0.00 2.02 0.31 -4.16 117.35 118.96 2q3r s TYR 325 Ca 0.28 -0.88 0.00 0.00 -0.37 0.00 0.00 57.07 56.10 2q3r s TYR 325 Cb -0.16 -1.91 0.00 0.00 -0.40 0.00 0.00 41.96 39.50 2q3r s TYR 325 CO 0.12 -0.39 0.00 0.41 -1.57 0.00 0.00 175.55 174.12 2q3r n GLY 326 N 3.97 -0.28 0.36 0.71 0.00 -1.26 -0.96 105.19 107.73 2q3r n GLY 326 Ca -0.19 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.86 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 0.98 0.00 1.61 3.08 -1.96 0.28 114.38 118.37 2q3r h ARG 327 Ca 0.00 -0.06 -0.14 0.00 0.07 0.00 0.00 59.98 59.85 2q3r h ARG 327 Cb 0.00 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.81 2q3r h ARG 327 CO 0.00 0.65 -0.66 -1.49 -1.07 0.00 0.00 179.97 177.40 2q3r h TRP 328 N 1.01 0.00 0.00 3.04 -0.00 -1.94 -2.92 115.95 115.15 2q3r h TRP 328 Ca 0.35 0.00 -0.20 0.00 -0.00 0.00 0.00 58.89 59.04 2q3r h TRP 328 Cb 0.10 0.00 -0.03 0.00 -0.00 0.00 0.00 29.16 29.23 2q3r h TRP 328 CO -0.00 0.66 -1.07 0.35 -0.00 0.00 0.00 178.44 178.38 2q3r h PHE 329 N 0.00 0.00 -0.28 0.49 3.04 -1.58 -2.98 116.94 115.62 2q3r h PHE 329 Ca -0.01 0.00 0.02 0.00 3.98 0.00 0.00 57.97 61.96 2q3r h PHE 329 Cb 1.22 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 39.70 2q3r h PHE 329 CO 0.00 0.83 0.13 1.25 -2.02 0.00 0.00 178.31 178.50 2q3r h LEU 330 N 0.00 0.19 -2.96 0.59 6.46 -0.37 -2.78 115.31 116.44 2q3r h LEU 330 Ca -0.08 0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.69 2q3r h LEU 330 Cb 1.70 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 41.61 2q3r h LEU 330 CO 0.09 0.15 0.00 0.00 -0.62 0.00 0.00 178.44 178.06 2q3r n ALA 331 N -2.24 3.56 -3.06 1.25 0.00 -1.11 -4.67 120.51 114.24 2q3r n ALA 331 Ca -0.01 -1.47 -0.07 0.00 0.00 0.00 0.00 53.44 51.90 2q3r n ALA 331 Cb 0.07 -1.10 -0.02 0.00 0.00 0.00 0.00 19.45 18.41 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 -0.60 -0.81 0.39 0.00 0.01 -1.05 -4.68 114.94 108.21 2q3r s ASN 332 Ca 0.42 -1.54 0.20 0.00 -0.71 0.00 0.00 52.86 51.23 2q3r s ASN 332 Cb 0.32 1.49 1.17 0.00 0.41 0.00 0.00 41.25 44.64 2q3r s ASN 332 CO 0.12 -0.13 1.71 1.55 -1.51 0.00 0.00 177.10 178.84 2q3r h PRO 333 N 6.01 0.31 -3.51 -0.60 0.13 -1.82 -2.92 132.00 129.60 2q3r h PRO 333 Ca 0.08 -0.02 -0.76 0.00 -0.87 0.00 0.00 66.00 64.43 2q3r h PRO 333 Cb 1.10 -0.07 -0.31 0.00 0.13 0.00 0.00 31.00 31.86 2q3r h PRO 333 CO 0.10 0.20 0.19 0.16 -0.23 0.00 0.00 178.00 178.43 2q3r s ASP 334 N -5.00 6.71 -0.26 1.44 3.84 -1.26 -4.19 116.67 117.96 2q3r s ASP 334 Ca -0.09 -3.51 -0.14 0.00 -0.00 0.00 0.00 52.55 48.81 2q3r s ASP 334 Cb 0.27 -2.09 -0.14 0.00 -1.38 0.00 0.00 42.92 39.59 2q3r s ASP 334 CO 0.80 -0.28 -0.25 -0.11 -0.00 0.00 0.00 175.17 175.33 2q3r n LEU 335 N 2.74 2.05 -0.10 2.11 7.94 -1.10 -3.93 117.00 126.70 2q3r n LEU 335 Ca 0.21 0.31 0.26 0.00 -1.11 0.00 0.00 56.01 55.67 2q3r n LEU 335 Cb 0.39 -0.86 0.72 0.00 0.53 0.00 0.00 43.42 44.20 2q3r n LEU 335 CO 0.41 0.57 1.23 -0.65 -1.11 0.00 0.00 177.39 177.85 2q3r h PRO 336 N -0.89 0.00 -0.02 1.96 0.11 -1.89 0.17 132.00 131.43 2q3r h PRO 336 Ca -0.64 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.28 2q3r h PRO 336 Cb 1.61 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.73 2q3r h PRO 336 CO -0.36 0.00 -0.72 -0.22 -0.21 0.00 0.00 178.00 176.49 2q3r h LYS 337 N 0.00 0.53 0.63 1.05 1.63 -1.96 -2.67 116.57 115.77 2q3r h LYS 337 Ca 0.35 -0.54 -0.02 0.00 -0.85 0.00 0.00 60.65 59.59 2q3r h LYS 337 Cb 1.49 0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 33.26 2q3r h LYS 337 CO -0.00 1.17 -0.48 0.00 -3.45 0.00 0.00 179.45 176.69 2q3r h ARG 338 N 0.10 -1.02 0.00 1.90 3.08 -0.86 1.48 114.38 119.06 2q3r h ARG 338 Ca -0.08 0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2q3r h ARG 338 Cb 1.40 0.23 0.00 0.00 0.08 0.00 0.00 29.97 31.69 2q3r h ARG 338 CO 0.14 -0.68 0.03 1.19 -1.07 0.00 0.00 179.97 179.58 2q3r n PHE 339 N -5.39 0.00 -0.09 3.04 3.72 -0.39 -0.63 117.46 117.71 2q3r n PHE 339 Ca -0.13 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.13 2q3r n PHE 339 Cb 0.46 -0.18 -0.08 0.00 -0.94 0.00 0.00 39.48 38.73 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 -1.14 0.46 -0.84 -1.08 7.27 0.45 -4.56 117.38 117.95 2q3r n GLN 340 Ca 0.00 0.12 0.02 0.00 0.07 0.00 0.00 57.00 57.21 2q3r n GLN 340 Cb 0.03 -1.36 0.33 0.00 2.41 0.00 0.00 30.24 31.65 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 -3.16 2.51 -0.43 1.69 0.31 0.48 -4.91 118.33 114.82 2q3r n VAL 341 Ca -0.34 -1.30 0.00 0.00 -0.01 0.00 0.00 64.34 62.69 2q3r n VAL 341 Cb 0.84 -0.34 0.00 0.00 -0.91 0.00 0.00 33.84 33.43 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 0.32 -0.96 -4.77 4.52 9.92 0.18 -4.90 116.55 120.86 2q3r n ASP 342 Ca 0.29 0.00 -0.40 0.00 -0.53 0.00 0.00 54.79 54.15 2q3r n ASP 342 Cb 1.16 -1.94 -0.00 0.00 -0.64 0.00 0.00 41.12 39.69 2q3r n ASP 342 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2q3r s ALA 343 N -0.70 3.32 1.18 2.24 0.00 -1.10 -4.98 121.76 121.72 2q3r s ALA 343 Ca 0.00 1.30 -0.15 0.00 0.00 0.00 0.00 51.96 53.10 2q3r s ALA 343 Cb 0.00 -3.51 0.28 0.00 0.00 0.00 0.00 23.12 19.89 2q3r s ALA 343 CO 0.00 -0.87 1.04 -1.25 0.00 0.00 0.00 175.76 174.68 2q3r s PRO 344 N -2.19 -0.99 0.29 0.00 0.04 -1.26 -4.59 135.00 126.29 2q3r s PRO 344 Ca 0.56 0.48 0.09 0.00 0.04 0.00 0.00 61.00 62.17 2q3r s PRO 344 Cb -0.40 -1.57 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 2q3r s PRO 344 CO 0.52 -3.68 0.07 -0.51 0.04 0.00 0.00 177.00 173.44 2q3r s LEU 345 N -7.09 3.31 0.12 -3.56 1.43 -1.26 -4.98 118.68 106.65 2q3r s LEU 345 Ca 0.68 -0.62 -0.14 0.00 -1.03 0.00 0.00 54.13 53.02 2q3r s LEU 345 Cb -0.19 -1.82 -0.07 0.00 0.03 0.00 0.00 46.19 44.14 2q3r s LEU 345 CO 0.61 -0.10 0.51 0.20 0.23 0.00 0.00 176.35 177.80 2q3r s ASN 346 N -3.75 6.80 0.15 2.29 0.01 -1.26 -5.06 114.94 114.11 2q3r s ASN 346 Ca 0.34 1.03 -0.30 0.00 -0.71 0.00 0.00 52.86 53.21 2q3r s ASN 346 Cb -0.05 -2.27 -0.07 0.00 0.41 0.00 0.00 41.25 39.27 2q3r s ASN 346 CO 0.22 0.14 1.06 -0.54 -1.51 0.00 0.00 177.10 176.46 2q3r s LYS 347 N -1.86 4.62 0.71 -0.60 -0.14 -1.26 -4.86 119.74 116.35 2q3r s LYS 347 Ca 0.36 1.63 -0.12 0.00 -1.36 0.00 0.00 55.97 56.48 2q3r s LYS 347 Cb -0.15 -3.32 0.02 0.00 -1.68 0.00 0.00 37.83 32.71 2q3r s LYS 347 CO 0.19 0.10 1.08 1.52 -0.76 0.00 0.00 175.35 177.48 2q3r s TYR 348 N -0.06 2.75 -0.70 3.18 -0.85 -1.26 -4.98 117.35 115.43 2q3r s TYR 348 Ca 0.49 1.52 -0.02 0.00 -0.52 0.00 0.00 57.07 58.55 2q3r s TYR 348 Cb -0.27 -3.03 0.18 0.00 0.38 0.00 0.00 41.96 39.21 2q3r s TYR 348 CO 0.33 -1.57 0.52 0.34 -1.52 0.00 0.00 175.55 173.65 2q3r s ASP 349 N -3.23 5.34 0.28 -0.18 2.15 -1.26 -4.98 116.67 114.78 2q3r s ASP 349 Ca 0.62 -3.18 0.02 0.00 0.43 0.00 0.00 52.55 50.44 2q3r s ASP 349 Cb -0.17 -1.84 0.65 0.00 -0.30 0.00 0.00 42.92 41.26 2q3r s ASP 349 CO 0.50 -0.29 1.73 0.03 -0.17 0.00 0.00 175.17 176.97 2q3r h ARG 350 N 6.59 0.49 -0.55 4.34 3.08 -2.00 -2.09 114.38 124.23 2q3r h ARG 350 Ca 0.04 -0.03 0.16 0.00 0.07 0.00 0.00 59.98 60.22 2q3r h ARG 350 Cb 0.90 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.81 2q3r h ARG 350 CO 0.75 0.32 0.53 -1.35 -1.07 0.00 0.00 179.97 179.15 2q3r h PRO 351 N 0.50 0.00 -0.36 0.04 0.11 -2.02 -1.00 132.00 129.27 2q3r h PRO 351 Ca 0.52 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.46 2q3r h PRO 351 Cb 0.88 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 31.90 2q3r h PRO 351 CO -0.45 0.00 -0.03 0.25 -0.21 0.00 0.00 178.00 177.56 2q3r n THR 352 N -3.81 2.53 0.04 -1.15 -2.24 -0.79 -4.59 114.28 104.28 2q3r n THR 352 Ca 0.11 -2.55 -0.13 0.00 -2.27 0.00 0.00 64.05 59.20 2q3r n THR 352 Cb 0.75 -0.32 -0.09 0.00 -2.10 0.00 0.00 70.33 68.57 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 1.13 -0.11 -0.43 4.78 -1.00 -1.23 -3.36 116.94 116.71 2q3r h PHE 353 Ca 0.20 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.98 2q3r h PHE 353 Cb 1.68 0.04 0.00 0.00 3.61 0.00 0.00 35.95 41.27 2q3r h PHE 353 CO 0.96 0.30 0.00 0.66 -1.61 0.00 0.00 178.31 178.62 2q3r n TYR 354 N -4.94 1.04 -1.59 -0.55 4.01 -1.26 -4.65 117.16 109.22 2q3r n TYR 354 Ca -0.09 -0.67 -0.29 0.00 -0.16 0.00 0.00 57.90 56.69 2q3r n TYR 354 Cb 0.24 -0.22 0.12 0.00 -0.31 0.00 0.00 39.34 39.17 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 -1.97 2.26 -0.91 -0.72 -4.23 -1.26 -4.79 115.64 104.02 2q3r s THR 355 Ca 0.40 0.08 0.15 0.00 -1.18 0.00 0.00 61.69 61.15 2q3r s THR 355 Cb 0.28 -2.87 0.52 0.00 1.34 0.00 0.00 72.50 71.77 2q3r s THR 355 CO 0.17 -0.11 1.44 -1.54 -0.54 0.00 0.00 174.62 174.03 2q3r n SER 356 N -3.62 3.82 -4.76 3.99 3.41 -1.26 -4.73 113.62 110.47 2q3r n SER 356 Ca 0.07 -2.37 -0.41 0.00 -0.26 0.00 0.00 58.87 55.90 2q3r n SER 356 Cb 0.59 -0.43 -0.03 0.00 -0.26 0.00 0.00 64.21 64.07 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 -1.18 6.98 0.50 4.04 2.15 -1.26 -4.91 116.67 122.99 2q3r s ASP 357 Ca 0.39 2.48 0.20 0.00 0.43 0.00 0.00 52.55 56.05 2q3r s ASP 357 Cb 0.25 -2.63 1.28 0.00 -0.30 0.00 0.00 42.92 41.52 2q3r s ASP 357 CO 0.19 -0.38 2.08 -0.65 -0.17 0.00 0.00 175.17 176.23 2q3r h PRO 358 N 3.88 0.00 0.00 4.34 0.11 -1.95 -3.38 132.00 135.00 2q3r h PRO 358 Ca -0.47 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 2q3r h PRO 358 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2q3r h PRO 358 CO 0.68 0.11 -1.09 0.28 -0.21 0.00 0.00 178.00 177.76 2q3r n VAL 359 N -4.14 0.17 -1.68 3.15 0.31 -1.26 -4.49 118.33 110.39 2q3r n VAL 359 Ca -0.03 -0.02 -0.43 0.00 -0.01 0.00 0.00 64.34 63.86 2q3r n VAL 359 Cb 0.19 -1.54 -0.03 0.00 -0.91 0.00 0.00 33.84 31.55 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 -3.12 0.43 -1.10 2.52 0.31 -1.26 -0.80 118.33 115.32 2q3r n VAL 360 Ca -0.05 -0.08 -0.03 0.00 -0.01 0.00 0.00 64.34 64.17 2q3r n VAL 360 Cb 0.52 -2.14 -0.01 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 4.28 0.49 0.55 2.92 0.00 -1.26 -4.65 105.19 107.53 2q3r n GLY 361 Ca 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2q3r n GLY 361 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2q3r n TYR 362 N -2.45 0.00 0.81 1.61 9.36 0.02 -4.76 117.16 121.76 2q3r n TYR 362 Ca -0.03 0.00 0.11 0.00 3.32 0.00 0.00 57.90 61.29 2q3r n TYR 362 Cb 0.34 0.03 0.10 0.00 -0.63 0.00 0.00 39.34 39.17 2q3r n TYR 362 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 2q3r n THR 363 N -1.76 0.06 -0.10 2.97 -2.24 -0.48 -4.50 114.28 108.23 2q3r n THR 363 Ca 0.00 -0.53 0.01 0.00 -2.27 0.00 0.00 64.05 61.26 2q3r n THR 363 Cb 0.00 1.39 0.21 0.00 -2.10 0.00 0.00 70.33 69.83 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 1.21 3.64 -4.66 3.42 3.85 -1.11 -4.84 116.55 118.05 2q3r n ASP 364 Ca 0.13 -2.59 -0.40 0.00 -0.71 0.00 0.00 54.79 51.22 2q3r n ASP 364 Cb 0.53 -0.62 -0.06 0.00 -1.35 0.00 0.00 41.12 39.63 2q3r n ASP 364 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 2q3r s TYR 365 N -1.97 3.39 0.36 2.11 2.02 -1.26 -4.91 117.35 117.08 2q3r s TYR 365 Ca 0.31 0.98 -0.25 0.00 -0.37 0.00 0.00 57.07 57.74 2q3r s TYR 365 Cb 0.24 -2.83 -0.10 0.00 -0.40 0.00 0.00 41.96 38.87 2q3r s TYR 365 CO 0.08 -0.18 0.98 -1.25 -1.57 0.00 0.00 175.55 173.61 2q3r s PRO 366 N 1.91 4.40 0.67 -1.71 0.04 -1.26 -4.61 135.00 134.44 2q3r s PRO 366 Ca 0.30 1.34 -0.11 0.00 0.04 0.00 0.00 61.00 62.57 2q3r s PRO 366 Cb -0.16 -2.61 -0.01 0.00 0.04 0.00 0.00 34.50 31.76 2q3r s PRO 366 CO 0.11 0.11 1.07 -0.06 0.04 0.00 0.00 177.00 178.26 2q3r s PHE 367 N -1.73 3.44 -0.85 0.56 0.40 -1.26 -4.66 117.98 113.87 2q3r s PHE 367 Ca 0.54 1.15 -0.27 0.00 -0.60 0.00 0.00 56.93 57.75 2q3r s PHE 367 Cb -0.18 -2.93 -0.19 0.00 0.51 0.00 0.00 43.02 40.24 2q3r s PHE 367 CO 0.23 -0.99 2.55 1.28 0.70 0.00 0.00 175.22 178.99 2q3r n LEU 368 N -2.91 0.73 0.00 -0.37 4.77 -1.26 -5.08 117.00 112.87 2q3r n LEU 368 Ca 0.07 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 2q3r n LEU 368 Cb 0.56 -1.10 0.00 0.00 -2.33 0.00 0.00 43.42 40.55 2q3r n LEU 368 CO 0.58 -1.12 0.09 1.21 -1.33 0.00 0.00 177.39 176.82