#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 2.39 0.18 0.44 1.01 -1.26 -4.81 120.40 118.36 2q3r s VAL 10 Ca 0.00 0.38 -0.22 0.00 0.00 0.00 0.00 61.98 62.14 2q3r s VAL 10 Cb 0.00 -3.24 0.10 0.00 0.00 0.00 0.00 36.38 33.24 2q3r s VAL 10 CO 0.00 0.08 1.57 -0.65 0.00 0.00 0.00 175.10 176.11 2q3r h PRO 11 N 3.59 -0.16 -0.92 2.72 0.11 -1.93 0.07 132.00 135.48 2q3r h PRO 11 Ca -0.49 0.01 0.16 0.00 0.11 0.00 0.00 66.00 65.79 2q3r h PRO 11 Cb 1.23 0.04 -0.08 0.00 0.11 0.00 0.00 31.00 32.30 2q3r h PRO 11 CO 0.68 -0.11 0.59 -0.07 -0.21 0.00 0.00 178.00 178.88 2q3r h LEU 12 N -0.17 0.64 -0.99 2.35 3.38 -1.80 -0.63 115.31 118.09 2q3r h LEU 12 Ca 0.22 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2q3r h LEU 12 Cb 0.56 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2q3r h LEU 12 CO -0.72 0.29 -0.05 0.18 0.09 0.00 0.00 178.44 178.24 2q3r n LEU 13 N -4.59 1.59 -4.76 1.67 7.99 -0.15 0.27 117.00 119.03 2q3r n LEU 13 Ca 0.19 -0.52 -0.41 0.00 -0.01 0.00 0.00 56.01 55.26 2q3r n LEU 13 Cb 0.53 -0.02 -0.03 0.00 -0.11 0.00 0.00 43.42 43.79 2q3r n LEU 13 CO 0.28 0.27 0.88 0.42 -1.51 0.00 0.00 177.39 177.73 2q3r s THR 14 N -2.08 3.24 1.04 -5.08 -4.23 -0.25 -4.52 115.64 103.77 2q3r s THR 14 Ca 0.35 1.20 -0.11 0.00 -1.18 0.00 0.00 61.69 61.94 2q3r s THR 14 Cb 0.21 -3.76 0.21 0.00 1.34 0.00 0.00 72.50 70.49 2q3r s THR 14 CO 0.36 0.27 1.07 -2.65 -0.54 0.00 0.00 174.62 173.13 2q3r n PRO 15 N 1.36 -1.40 -3.66 3.99 -0.02 -1.23 -4.01 135.00 130.03 2q3r n PRO 15 Ca 0.01 -0.36 -0.09 0.00 -2.02 0.00 0.00 63.50 61.04 2q3r n PRO 15 Cb 0.44 -2.27 -0.09 0.00 -0.02 0.00 0.00 33.50 31.56 2q3r n PRO 15 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2q3r s TYR 16 N -2.53 -0.86 -0.81 6.00 5.04 -0.76 -4.93 117.35 118.51 2q3r s TYR 16 Ca 0.68 1.75 -0.15 0.00 -2.44 0.00 0.00 57.07 56.91 2q3r s TYR 16 Cb -0.24 0.47 0.19 0.00 0.35 0.00 0.00 41.96 42.73 2q3r s TYR 16 CO 0.61 -0.44 0.81 0.21 -1.34 0.00 0.00 175.55 175.40 2q3r s LYS 17 N 1.50 3.53 -0.42 4.97 2.20 -1.26 -1.61 119.74 128.65 2q3r s LYS 17 Ca -0.10 -2.22 -0.28 0.00 -0.36 0.00 0.00 55.97 53.01 2q3r s LYS 17 Cb -0.06 -4.50 0.00 0.00 -1.51 0.00 0.00 37.83 31.76 2q3r s LYS 17 CO -0.16 -1.39 1.54 1.41 -0.36 0.00 0.00 175.35 176.39 2q3r s MET 18 N 0.85 3.42 5.02 4.03 -2.45 -0.87 -4.74 119.30 124.55 2q3r s MET 18 Ca 0.19 0.99 0.00 0.00 -1.25 0.00 0.00 55.69 55.62 2q3r s MET 18 Cb -0.11 -4.11 0.00 0.00 1.25 0.00 0.00 34.83 31.86 2q3r s MET 18 CO -0.07 -1.76 0.00 0.41 1.05 0.00 0.00 175.02 174.64 2q3r n GLY 19 N 5.24 3.48 0.84 2.11 0.00 -1.26 0.12 105.19 115.71 2q3r n GLY 19 Ca 0.18 0.23 0.12 0.00 0.00 0.00 0.00 46.02 46.56 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 13.43 2.14 -2.98 1.61 3.00 -1.26 -4.94 116.66 127.66 2q3r n ARG 20 Ca 0.00 -1.68 -0.33 0.00 -0.00 0.00 0.00 57.85 55.84 2q3r n ARG 20 Cb 0.00 -1.47 -0.07 0.00 0.00 0.00 0.00 32.46 30.93 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 -2.02 3.36 -0.40 -0.14 0.40 0.32 -5.05 117.98 114.46 2q3r s PHE 21 Ca 0.30 1.43 -0.09 0.00 -0.60 0.00 0.00 56.93 57.96 2q3r s PHE 21 Cb 0.20 -2.70 0.06 0.00 0.51 0.00 0.00 43.02 41.10 2q3r s PHE 21 CO 0.32 0.01 0.23 -0.80 0.70 0.00 0.00 175.22 175.68 2q3r s ASN 22 N -2.19 5.62 -0.12 1.36 0.01 -1.26 -2.06 114.94 116.30 2q3r s ASN 22 Ca 0.57 -1.35 -0.04 0.00 -0.71 0.00 0.00 52.86 51.33 2q3r s ASN 22 Cb -0.10 -1.98 -0.04 0.00 0.41 0.00 0.00 41.25 39.54 2q3r s ASN 22 CO 0.16 -0.48 0.03 -0.76 -1.51 0.00 0.00 177.10 174.54 2q3r s LEU 23 N 1.45 3.70 0.15 0.60 1.43 -0.63 -4.65 118.68 120.73 2q3r s LEU 23 Ca 0.02 0.14 0.09 0.00 -1.03 0.00 0.00 54.13 53.36 2q3r s LEU 23 Cb -0.22 -1.88 -0.15 0.00 0.03 0.00 0.00 46.19 43.98 2q3r s LEU 23 CO 0.03 0.31 1.29 0.28 0.23 0.00 0.00 176.35 178.50 2q3r h SER 24 N 5.65 0.00 -5.26 2.29 0.02 -1.51 -2.01 113.55 112.73 2q3r h SER 24 Ca -0.46 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.39 2q3r h SER 24 Cb 1.19 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.66 2q3r h SER 24 CO 0.59 0.88 -0.05 -1.38 -1.14 0.00 0.00 176.83 175.73 2q3r s HIS 25 N -2.77 0.49 -1.45 3.45 0.00 -1.26 -3.49 115.29 110.26 2q3r s HIS 25 Ca 0.01 -0.87 0.19 0.00 -3.00 0.00 0.00 55.06 51.39 2q3r s HIS 25 Cb 0.09 0.26 0.60 0.00 -4.00 0.00 0.00 32.58 29.54 2q3r s HIS 25 CO 0.80 -1.15 1.51 0.54 -1.00 0.00 0.00 174.74 175.44 2q3r n ARG 26 N -0.47 3.07 -2.99 -0.38 1.74 0.14 -4.77 116.66 113.01 2q3r n ARG 26 Ca -0.02 -2.63 -0.43 0.00 -0.77 0.00 0.00 57.85 54.00 2q3r n ARG 26 Cb 0.61 -1.62 -0.05 0.00 -1.02 0.00 0.00 32.46 30.38 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 -1.32 4.59 -0.11 1.55 1.01 -1.25 0.14 120.40 125.01 2q3r s VAL 27 Ca 0.45 -0.32 -0.08 0.00 0.00 0.00 0.00 61.98 62.03 2q3r s VAL 27 Cb 0.26 -4.49 -0.04 0.00 0.00 0.00 0.00 36.38 32.10 2q3r s VAL 27 CO 0.27 -1.10 0.17 -0.69 0.00 0.00 0.00 175.10 173.74 2q3r s VAL 28 N 3.36 5.46 -0.28 2.92 1.01 0.33 -4.50 120.40 128.70 2q3r s VAL 28 Ca 0.21 0.28 -0.29 0.00 0.00 0.00 0.00 61.98 62.17 2q3r s VAL 28 Cb -0.17 -3.44 0.01 0.00 0.00 0.00 0.00 36.38 32.78 2q3r s VAL 28 CO 0.13 0.61 1.15 -0.22 0.00 0.00 0.00 175.10 176.76 2q3r s LEU 29 N -0.96 3.99 0.45 3.92 2.96 -0.89 0.25 118.68 128.40 2q3r s LEU 29 Ca 0.16 1.24 -0.23 0.00 -0.22 0.00 0.00 54.13 55.08 2q3r s LEU 29 Cb -0.12 -3.54 -0.08 0.00 0.50 0.00 0.00 46.19 42.95 2q3r s LEU 29 CO 0.05 -0.87 1.11 0.00 -1.32 0.00 0.00 176.35 175.31 2q3r s ALA 30 N 3.72 2.97 0.17 5.97 0.00 -0.81 -1.89 121.76 131.88 2q3r s ALA 30 Ca 0.49 0.81 -0.32 0.00 0.00 0.00 0.00 51.96 52.94 2q3r s ALA 30 Cb -0.15 -3.33 -0.12 0.00 0.00 0.00 0.00 23.12 19.52 2q3r s ALA 30 CO 0.15 -0.48 1.76 -0.35 0.00 0.00 0.00 175.76 176.84 2q3r n PRO 31 N -0.48 2.73 -3.71 0.00 -0.04 -1.25 -4.80 135.00 127.44 2q3r n PRO 31 Ca 0.07 0.99 -0.29 0.00 -0.04 0.00 0.00 63.50 64.22 2q3r n PRO 31 Cb 0.49 -2.85 -0.15 0.00 -0.04 0.00 0.00 33.50 30.96 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 1.79 1.90 -0.01 1.53 1.43 -1.26 -4.86 118.68 119.20 2q3r s LEU 32 Ca 0.78 -1.51 -0.31 0.00 -1.03 0.00 0.00 54.13 52.07 2q3r s LEU 32 Cb -0.51 -0.77 -0.09 0.00 0.03 0.00 0.00 46.19 44.85 2q3r s LEU 32 CO 0.35 -0.41 1.99 0.41 0.23 0.00 0.00 176.35 178.92 2q3r n THR 33 N 4.92 0.70 0.17 5.49 -1.04 -1.26 -4.34 114.28 118.93 2q3r n THR 33 Ca -0.03 -0.16 0.02 0.00 -2.04 0.00 0.00 64.05 61.83 2q3r n THR 33 Cb 0.42 -2.26 -0.02 0.00 -1.82 0.00 0.00 70.33 66.65 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 7.51 5.56 -3.55 -2.82 5.12 -1.26 -4.81 116.66 122.40 2q3r n ARG 34 Ca 0.21 -0.03 -0.25 0.00 -1.93 0.00 0.00 57.85 55.86 2q3r n ARG 34 Cb 0.39 -0.69 0.06 0.00 -1.16 0.00 0.00 32.46 31.07 2q3r n ARG 34 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 2q3r n GLN 35 N -1.03 -7.00 -0.22 5.56 6.02 -1.26 -4.58 117.38 114.87 2q3r n GLN 35 Ca 0.01 0.80 0.09 0.00 -0.01 0.00 0.00 57.00 57.88 2q3r n GLN 35 Cb 0.06 -5.79 0.17 0.00 1.02 0.00 0.00 30.24 25.70 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 -4.78 1.69 -3.24 -1.09 3.00 -0.78 -4.64 116.66 106.81 2q3r n ARG 36 Ca -0.00 -2.71 -0.39 0.00 -0.01 0.00 0.00 57.85 54.74 2q3r n ARG 36 Cb 0.56 -1.60 -0.02 0.00 0.00 0.00 0.00 32.46 31.40 2q3r n ARG 36 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2q3r n SER 37 N -1.20 5.38 -4.62 0.55 7.64 0.25 -4.62 113.62 117.00 2q3r n SER 37 Ca 0.18 -3.33 -0.54 0.00 1.01 0.00 0.00 58.87 56.20 2q3r n SER 37 Cb 0.71 -1.12 -0.06 0.00 -1.01 0.00 0.00 64.21 62.73 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 1.56 1.65 -1.59 1.43 0.53 -1.24 -0.69 117.16 118.80 2q3r n TYR 38 Ca 0.26 0.61 -0.10 0.00 -1.02 0.00 0.00 57.90 57.65 2q3r n TYR 38 Cb 0.36 -2.36 -0.03 0.00 -1.03 0.00 0.00 39.34 36.28 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 2.97 0.76 3.28 2.72 0.00 -1.26 -2.26 105.19 111.40 2q3r n GLY 39 Ca 0.21 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 0.25 -1.20 -4.73 1.61 5.03 0.13 -4.94 115.26 111.41 2q3r n ASN 40 Ca -0.11 0.00 -0.38 0.00 0.87 0.00 0.00 54.58 54.97 2q3r n ASN 40 Cb 0.42 -1.55 -0.06 0.00 -1.02 0.00 0.00 39.78 37.57 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 -2.14 5.19 0.10 2.41 1.01 -0.96 0.12 120.40 126.14 2q3r s VAL 41 Ca 0.00 0.87 -0.31 0.00 0.00 0.00 0.00 61.98 62.54 2q3r s VAL 41 Cb 0.00 -3.78 -0.09 0.00 0.00 0.00 0.00 36.38 32.51 2q3r s VAL 41 CO 0.00 0.36 1.67 -2.84 0.00 0.00 0.00 175.10 174.29 2q3r s PRO 42 N 0.46 4.19 0.38 2.72 0.02 -1.26 -3.72 135.00 137.77 2q3r s PRO 42 Ca 0.24 2.39 0.04 0.00 0.02 0.00 0.00 61.00 63.70 2q3r s PRO 42 Cb -0.15 -3.50 -0.01 0.00 0.02 0.00 0.00 34.50 30.87 2q3r s PRO 42 CO 0.09 -0.73 0.54 -0.65 -0.33 0.00 0.00 177.00 175.92 2q3r s GLN 43 N 2.33 3.10 0.20 5.54 -1.52 -1.26 -4.66 119.66 123.39 2q3r s GLN 43 Ca 0.74 -0.82 -0.06 0.00 -1.95 0.00 0.00 55.36 53.27 2q3r s GLN 43 Cb -0.42 -2.73 0.15 0.00 -0.22 0.00 0.00 33.01 29.79 2q3r s GLN 43 CO 0.33 -0.06 1.64 -1.35 -0.25 0.00 0.00 175.29 175.60 2q3r h PRO 44 N 0.72 0.90 -0.19 2.91 0.11 -1.94 -2.99 132.00 131.51 2q3r h PRO 44 Ca -0.46 -0.32 0.05 0.00 0.11 0.00 0.00 66.00 65.38 2q3r h PRO 44 Cb 1.26 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2q3r h PRO 44 CO 0.54 0.97 0.18 1.12 -0.21 0.00 0.00 178.00 180.60 2q3r h HIS 45 N 0.80 0.00 -0.15 0.65 2.07 -1.95 0.56 115.15 117.13 2q3r h HIS 45 Ca 0.13 0.00 0.04 0.00 -2.85 0.00 0.00 60.37 57.68 2q3r h HIS 45 Cb 0.66 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.63 2q3r h HIS 45 CO 0.04 0.00 0.11 0.00 -3.07 0.00 0.00 177.93 175.01 2q3r h ALA 46 N 1.82 2.11 -0.57 6.11 0.00 -1.89 0.04 119.26 126.88 2q3r h ALA 46 Ca 0.09 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 2q3r h ALA 46 Cb 0.45 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 2q3r h ALA 46 CO -0.00 -0.14 -0.06 0.00 0.00 0.00 0.00 179.25 179.05 2q3r h ALA 47 N 1.92 0.83 -0.74 0.00 0.00 -1.04 -1.11 119.26 119.12 2q3r h ALA 47 Ca 0.07 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 2q3r h ALA 47 Cb 0.24 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2q3r h ALA 47 CO -0.00 0.67 0.24 0.82 0.00 0.00 0.00 179.25 180.98 2q3r h ILE 48 N 0.93 1.26 0.58 0.00 1.08 -1.09 -1.42 117.51 118.85 2q3r h ILE 48 Ca 0.16 -0.88 -0.03 0.00 -0.39 0.00 0.00 64.86 63.72 2q3r h ILE 48 Cb 0.61 0.43 0.01 0.00 -3.07 0.00 0.00 36.82 34.79 2q3r h ILE 48 CO 0.04 0.35 -0.28 0.22 -0.69 0.00 0.00 178.15 177.79 2q3r h TYR 49 N 1.09 -0.72 0.00 1.37 3.20 -0.81 -2.50 116.97 118.59 2q3r h TYR 49 Ca 0.24 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.06 2q3r h TYR 49 Cb 0.28 0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.79 2q3r h TYR 49 CO 0.02 -0.39 -0.18 1.88 -1.64 0.00 0.00 178.16 177.85 2q3r h TYR 50 N -0.98 0.00 -0.18 -3.82 0.05 -1.26 -3.15 116.97 107.63 2q3r h TYR 50 Ca -0.08 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.66 2q3r h TYR 50 Cb 0.66 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.39 2q3r h TYR 50 CO -0.00 0.18 -0.04 1.03 -1.05 0.00 0.00 178.16 178.27 2q3r h SER 51 N 0.00 0.36 0.15 3.88 0.87 -1.24 -2.70 113.55 114.87 2q3r h SER 51 Ca -0.00 -0.37 -0.01 0.00 -1.23 0.00 0.00 61.79 60.18 2q3r h SER 51 Cb 0.73 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.59 2q3r h SER 51 CO 0.02 0.64 -0.07 1.56 -0.53 0.00 0.00 176.83 178.45 2q3r h GLN 52 N 0.07 0.00 -0.62 2.24 4.20 -1.40 -2.20 115.11 117.39 2q3r h GLN 52 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2q3r h GLN 52 Cb 0.48 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.26 2q3r h GLN 52 CO 0.02 0.07 0.00 0.54 -0.67 0.00 0.00 178.83 178.79 2q3r n ARG 53 N -3.95 2.51 -3.60 1.46 1.74 -1.10 -4.15 116.66 109.56 2q3r n ARG 53 Ca -0.03 -2.34 -0.36 0.00 -0.77 0.00 0.00 57.85 54.36 2q3r n ARG 53 Cb 0.16 -1.51 -0.08 0.00 -1.02 0.00 0.00 32.46 30.01 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 -1.17 5.34 0.10 0.55 2.01 -0.83 -4.97 115.64 116.66 2q3r s THR 54 Ca 0.43 0.40 0.08 0.00 0.31 0.00 0.00 61.69 62.91 2q3r s THR 54 Cb 0.23 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 69.13 2q3r s THR 54 CO 0.30 0.39 -0.20 0.42 -0.69 0.00 0.00 174.62 174.84 2q3r s THR 55 N 0.58 1.65 0.11 -0.82 -4.23 -1.26 -4.94 115.64 106.74 2q3r s THR 55 Ca 0.13 -1.50 -0.31 0.00 -1.18 0.00 0.00 61.69 58.83 2q3r s THR 55 Cb -0.13 -1.50 -0.09 0.00 1.34 0.00 0.00 72.50 72.12 2q3r s THR 55 CO 0.02 -0.06 1.71 -2.84 -0.54 0.00 0.00 174.62 172.92 2q3r s PRO 56 N -1.84 4.17 0.00 3.99 0.02 -0.91 -0.69 135.00 139.74 2q3r s PRO 56 Ca 0.06 2.45 0.00 0.00 0.02 0.00 0.00 61.00 63.53 2q3r s PRO 56 Cb -0.10 -3.51 0.00 0.00 0.02 0.00 0.00 34.50 30.91 2q3r s PRO 56 CO 0.04 -0.76 0.00 0.41 -0.33 0.00 0.00 177.00 176.36 2q3r n GLY 57 N 4.05 1.95 3.79 0.52 0.00 0.15 -4.54 105.19 111.11 2q3r n GLY 57 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.99 2.05 -0.16 -0.02 0.00 0.14 -1.52 107.32 105.82 2q3r s GLY 58 Ca 0.00 0.42 -0.00 0.00 0.00 0.00 0.00 44.72 45.14 2q3r s GLY 58 CO 0.00 0.75 -0.14 -0.12 0.00 0.00 0.00 173.10 173.59 2q3r s PHE 59 N -2.51 2.80 -0.05 1.90 5.99 -1.26 -1.01 117.98 123.85 2q3r s PHE 59 Ca 0.64 -0.96 0.06 0.00 0.00 0.00 0.00 56.93 56.68 2q3r s PHE 59 Cb -0.18 -1.90 -0.01 0.00 0.00 0.00 0.00 43.02 40.93 2q3r s PHE 59 CO 0.43 -0.43 -0.24 -0.51 -0.00 0.00 0.00 175.22 174.47 2q3r s LEU 60 N 0.78 2.05 -0.13 6.12 1.02 0.41 -2.09 118.68 126.84 2q3r s LEU 60 Ca -0.05 -0.48 -0.01 0.00 0.02 0.00 0.00 54.13 53.61 2q3r s LEU 60 Cb -0.15 -1.31 -0.02 0.00 0.02 0.00 0.00 46.19 44.73 2q3r s LEU 60 CO 0.01 0.25 -0.10 -0.63 0.02 0.00 0.00 176.35 175.90 2q3r s ILE 61 N -0.25 3.32 0.82 -0.59 1.01 -0.79 -1.34 121.20 123.37 2q3r s ILE 61 Ca -0.00 -0.57 -0.11 0.00 0.00 0.00 0.00 60.65 59.96 2q3r s ILE 61 Cb -0.12 -2.40 0.08 0.00 0.01 0.00 0.00 42.46 40.02 2q3r s ILE 61 CO 0.02 0.53 1.09 0.42 0.00 0.00 0.00 174.94 177.00 2q3r s THR 62 N 0.18 3.07 0.91 2.92 -4.23 -0.20 -3.96 115.64 114.34 2q3r s THR 62 Ca -0.06 0.35 -0.10 0.00 -1.18 0.00 0.00 61.69 60.70 2q3r s THR 62 Cb -0.15 -2.95 0.14 0.00 1.34 0.00 0.00 72.50 70.88 2q3r s THR 62 CO 0.04 -0.45 1.13 -1.83 -0.54 0.00 0.00 174.62 172.96 2q3r s GLU 63 N -5.02 1.10 0.37 3.99 -1.05 -1.26 -3.98 118.70 112.85 2q3r s GLU 63 Ca 0.61 1.41 -0.28 0.00 -0.15 0.00 0.00 54.97 56.56 2q3r s GLU 63 Cb -0.16 -1.75 -0.11 0.00 -0.44 0.00 0.00 34.13 31.67 2q3r s GLU 63 CO 0.56 -2.52 1.43 0.00 0.95 0.00 0.00 175.26 175.67 2q3r n ALA 64 N -4.15 2.06 -3.82 -0.84 0.00 -1.26 -4.30 120.51 108.20 2q3r n ALA 64 Ca 0.11 0.35 -0.27 0.00 0.00 0.00 0.00 53.44 53.62 2q3r n ALA 64 Cb 0.52 -2.37 -0.17 0.00 0.00 0.00 0.00 19.45 17.44 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 -1.10 0.81 0.40 0.00 2.01 -0.54 -4.33 115.64 112.90 2q3r s THR 65 Ca 0.54 -0.54 -0.24 0.00 0.31 0.00 0.00 61.69 61.76 2q3r s THR 65 Cb -0.50 -1.12 -0.12 0.00 0.01 0.00 0.00 72.50 70.77 2q3r s THR 65 CO 0.63 -0.01 0.80 0.61 -0.69 0.00 0.00 174.62 175.97 2q3r n GLY 66 N 4.96 -0.79 0.38 4.40 0.00 0.45 -3.41 105.19 111.18 2q3r n GLY 66 Ca -0.10 0.12 0.10 0.00 0.00 0.00 0.00 46.02 46.14 2q3r n GLY 66 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2q3r n VAL 67 N -0.59 0.00 -3.82 1.61 0.24 -1.16 0.82 118.33 115.43 2q3r n VAL 67 Ca 0.11 -0.25 -0.09 0.00 -2.04 0.00 0.00 64.34 62.06 2q3r n VAL 67 Cb 0.38 1.20 0.02 0.00 -1.47 0.00 0.00 33.84 33.97 2q3r n VAL 67 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2q3r s SER 68 N -2.33 0.07 0.00 -1.34 1.04 -1.26 -4.56 113.70 105.32 2q3r s SER 68 Ca 0.15 -1.19 0.26 0.00 0.48 0.00 0.00 55.95 55.64 2q3r s SER 68 Cb 0.16 0.85 1.27 0.00 0.10 0.00 0.00 66.02 68.40 2q3r s SER 68 CO 0.55 -1.69 1.86 -0.90 0.98 0.00 0.00 173.24 174.03 2q3r n ASP 69 N -1.47 0.00 -0.08 7.02 5.68 -1.26 -2.87 116.55 123.57 2q3r n ASP 69 Ca -0.08 -0.02 0.01 0.00 -0.50 0.00 0.00 54.79 54.20 2q3r n ASP 69 Cb 0.60 -0.31 0.02 0.00 -1.14 0.00 0.00 41.12 40.29 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 -1.31 0.62 1.33 2.12 -2.24 -1.26 -4.29 114.28 109.26 2q3r n THR 70 Ca 0.12 -0.81 0.07 0.00 -2.27 0.00 0.00 64.05 61.16 2q3r n THR 70 Cb 0.21 0.70 0.28 0.00 -2.10 0.00 0.00 70.33 69.43 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 -0.18 2.51 -2.71 6.98 0.00 -1.14 -4.78 120.51 121.19 2q3r n ALA 71 Ca 0.01 -0.42 -0.35 0.00 0.00 0.00 0.00 53.44 52.69 2q3r n ALA 71 Cb 0.19 -1.07 -0.09 0.00 0.00 0.00 0.00 19.45 18.48 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 -1.76 3.01 0.00 0.00 1.11 -1.26 -2.40 119.66 118.35 2q3r s GLN 72 Ca 0.24 -0.41 0.00 0.00 0.01 0.00 0.00 55.36 55.20 2q3r s GLN 72 Cb 0.13 -2.82 0.00 0.00 -1.01 0.00 0.00 33.01 29.31 2q3r s GLN 72 CO 0.19 0.70 0.13 0.41 0.01 0.00 0.00 175.29 176.72 2q3r n GLY 73 N 1.95 0.37 3.09 3.09 0.00 -1.26 -4.62 105.19 107.81 2q3r n GLY 73 Ca -0.18 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.14 0.82 0.22 1.61 2.02 -1.26 -4.69 117.35 115.93 2q3r s TYR 74 Ca 0.00 -0.46 -0.28 0.00 -0.37 0.00 0.00 57.07 55.96 2q3r s TYR 74 Cb 0.00 -0.48 -0.09 0.00 -0.40 0.00 0.00 41.96 40.99 2q3r s TYR 74 CO 0.00 -0.04 0.88 1.14 -1.57 0.00 0.00 175.55 175.96 2q3r s GLN 75 N -1.53 4.73 -1.07 -0.62 -2.07 -1.26 -4.00 119.66 113.84 2q3r s GLN 75 Ca -0.07 1.36 0.00 0.00 -1.82 0.00 0.00 55.36 54.83 2q3r s GLN 75 Cb -0.10 -3.22 0.00 0.00 -1.09 0.00 0.00 33.01 28.60 2q3r s GLN 75 CO 0.01 0.51 0.00 -0.25 -1.32 0.00 0.00 175.29 174.24 2q3r n ASP 76 N 1.43 -4.12 -4.81 12.60 8.00 -1.26 -4.69 116.55 123.69 2q3r n ASP 76 Ca -0.03 0.21 -0.38 0.00 0.71 0.00 0.00 54.79 55.30 2q3r n ASP 76 Cb 0.48 -2.67 -0.06 0.00 -0.02 0.00 0.00 41.12 38.85 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 -2.41 4.90 0.61 -3.53 -4.23 -1.26 0.84 115.64 110.56 2q3r s THR 77 Ca 0.00 1.06 -0.19 0.00 -1.18 0.00 0.00 61.69 61.39 2q3r s THR 77 Cb 0.00 -3.83 -0.03 0.00 1.34 0.00 0.00 72.50 69.98 2q3r s THR 77 CO 0.00 0.53 1.23 -2.16 -0.54 0.00 0.00 174.62 173.68 2q3r s PRO 78 N -0.84 2.86 0.38 3.99 0.04 -1.26 -4.16 135.00 136.01 2q3r s PRO 78 Ca 0.27 1.88 0.08 0.00 0.04 0.00 0.00 61.00 63.27 2q3r s PRO 78 Cb -0.18 -1.91 -0.06 0.00 0.04 0.00 0.00 34.50 32.39 2q3r s PRO 78 CO 0.16 -1.31 0.08 0.20 0.04 0.00 0.00 177.00 176.17 2q3r s GLY 79 N -1.55 2.26 -0.22 0.56 0.00 0.33 0.17 107.32 108.86 2q3r s GLY 79 Ca 0.79 -2.09 0.22 0.00 0.00 0.00 0.00 44.72 43.64 2q3r s GLY 79 CO 0.35 -1.94 1.13 4.51 0.00 0.00 0.00 173.10 177.14 2q3r n ILE 80 N -1.07 1.16 0.61 0.90 3.06 0.24 -4.59 119.36 119.67 2q3r n ILE 80 Ca -0.03 -2.70 0.07 0.00 -2.50 0.00 0.00 62.75 57.58 2q3r n ILE 80 Cb 0.64 1.08 0.00 0.00 0.54 0.00 0.00 39.64 41.91 2q3r n ILE 80 CO 0.00 0.00 0.00 -2.67 -2.50 0.00 0.00 176.55 171.38 2q3r n TRP 81 N -0.44 0.00 -4.29 9.51 2.14 -1.25 -4.75 117.44 118.36 2q3r n TRP 81 Ca 0.09 0.00 -0.30 0.00 2.07 0.00 0.00 57.50 59.37 2q3r n TRP 81 Cb 0.86 0.00 -0.11 0.00 -0.81 0.00 0.00 31.31 31.26 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 -1.65 3.07 0.31 -1.67 -4.23 -1.26 -4.97 115.64 105.24 2q3r s THR 82 Ca 0.12 -1.38 0.07 0.00 -1.18 0.00 0.00 61.69 59.32 2q3r s THR 82 Cb 0.11 -2.41 0.31 0.00 1.34 0.00 0.00 72.50 71.85 2q3r s THR 82 CO 0.33 0.12 1.68 0.11 -0.54 0.00 0.00 174.62 176.32 2q3r h LYS 83 N 3.74 0.34 -0.34 3.99 1.57 -1.99 1.99 116.57 125.87 2q3r h LYS 83 Ca -0.49 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.28 2q3r h LYS 83 Cb 1.17 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.38 2q3r h LYS 83 CO 0.49 0.23 0.22 1.49 -0.57 0.00 0.00 179.45 181.31 2q3r h GLU 84 N 0.35 0.41 0.26 3.15 4.81 -1.98 0.43 114.58 122.01 2q3r h GLU 84 Ca 0.62 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.82 2q3r h GLU 84 Cb 1.28 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.57 2q3r h GLU 84 CO -0.58 0.27 -0.12 0.45 -0.73 0.00 0.00 179.01 178.30 2q3r h HIS 85 N 0.42 -0.32 -0.20 0.92 3.86 0.28 -1.67 115.15 118.44 2q3r h HIS 85 Ca 0.13 -0.01 0.05 0.00 -1.16 0.00 0.00 60.37 59.38 2q3r h HIS 85 Cb 0.00 0.11 -0.07 0.00 1.06 0.00 0.00 27.41 28.51 2q3r h HIS 85 CO -0.00 0.04 -0.40 0.28 0.86 0.00 0.00 177.93 178.71 2q3r h VAL 86 N -0.82 0.16 -0.80 2.45 2.07 -0.65 -0.22 116.25 118.45 2q3r h VAL 86 Ca -0.04 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.57 2q3r h VAL 86 Cb 0.51 0.16 -0.05 0.00 -1.52 0.00 0.00 31.29 30.39 2q3r h VAL 86 CO 0.06 0.00 0.52 -0.33 0.02 0.00 0.00 177.57 177.84 2q3r h GLU 87 N -0.43 0.77 0.00 1.57 4.39 -0.99 -1.56 114.58 118.33 2q3r h GLU 87 Ca 0.10 -0.05 -0.07 0.00 0.34 0.00 0.00 59.36 59.68 2q3r h GLU 87 Cb 0.60 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 2q3r h GLU 87 CO -0.43 0.51 -0.34 0.00 -1.16 0.00 0.00 179.01 177.59 2q3r h ALA 88 N 1.59 0.92 0.00 3.43 0.00 -0.26 -3.20 119.26 121.74 2q3r h ALA 88 Ca 0.36 -0.31 -0.18 0.00 0.00 0.00 0.00 54.91 54.78 2q3r h ALA 88 Cb 0.36 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2q3r h ALA 88 CO -0.13 0.42 -0.86 -1.49 0.00 0.00 0.00 179.25 177.19 2q3r h TRP 89 N 0.00 0.02 -0.21 0.00 -0.00 -0.06 -3.36 115.95 112.34 2q3r h TRP 89 Ca -0.00 -0.01 0.06 0.00 -0.00 0.00 0.00 58.89 58.93 2q3r h TRP 89 Cb 0.97 -0.00 -0.07 0.00 -0.00 0.00 0.00 29.16 30.06 2q3r h TRP 89 CO 0.00 0.86 -0.28 0.87 -0.00 0.00 0.00 178.44 179.89 2q3r h LYS 90 N 0.00 -0.29 0.00 0.49 1.57 -1.48 -0.99 116.57 115.87 2q3r h LYS 90 Ca -0.01 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2q3r h LYS 90 Cb 1.51 0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.89 2q3r h LYS 90 CO 0.11 -0.20 -0.06 -1.00 -0.57 0.00 0.00 179.45 177.74 2q3r h PRO 91 N -0.31 0.00 -0.20 3.15 0.13 -1.75 0.89 132.00 133.91 2q3r h PRO 91 Ca 0.12 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.14 2q3r h PRO 91 Cb 0.50 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.63 2q3r h PRO 91 CO -0.38 0.06 -0.31 0.82 -0.23 0.00 0.00 178.00 177.95 2q3r h ILE 92 N 0.00 1.33 -0.43 -3.56 2.04 -1.46 -2.37 117.51 113.06 2q3r h ILE 92 Ca -0.00 -1.52 -0.07 0.00 1.00 0.00 0.00 64.86 64.27 2q3r h ILE 92 Cb 0.14 1.83 -0.02 0.00 -0.74 0.00 0.00 36.82 38.04 2q3r h ILE 92 CO 0.01 0.47 -0.01 0.58 0.00 0.00 0.00 178.15 179.20 2q3r h VAL 93 N 0.23 1.26 -0.69 1.67 2.07 -0.58 -2.75 116.25 117.45 2q3r h VAL 93 Ca 0.02 -1.05 -0.02 0.00 0.82 0.00 0.00 66.70 66.48 2q3r h VAL 93 Cb 0.89 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.71 2q3r h VAL 93 CO 0.07 0.36 0.37 0.44 0.02 0.00 0.00 177.57 178.83 2q3r h ASP 94 N 0.61 0.86 -0.16 0.57 3.32 -0.84 -1.10 116.42 119.69 2q3r h ASP 94 Ca 0.12 -0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 2q3r h ASP 94 Cb 0.50 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 2q3r h ASP 94 CO 0.02 0.71 0.09 0.00 -1.72 0.00 0.00 179.24 178.34 2q3r h ALA 95 N 1.43 0.20 0.31 3.45 0.00 -1.29 0.10 119.26 123.47 2q3r h ALA 95 Ca 0.24 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 2q3r h ALA 95 Cb 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2q3r h ALA 95 CO -0.04 -0.29 -0.15 0.28 0.00 0.00 0.00 179.25 179.05 2q3r h VAL 96 N 0.18 0.70 -0.34 0.00 2.07 -1.17 -1.84 116.25 115.85 2q3r h VAL 96 Ca 0.06 -0.04 0.10 0.00 0.82 0.00 0.00 66.70 67.63 2q3r h VAL 96 Cb 0.03 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 2q3r h VAL 96 CO -0.01 0.01 0.25 0.45 0.02 0.00 0.00 177.57 178.29 2q3r h HIS 97 N -0.44 0.00 -0.98 1.57 -0.00 -1.10 -1.06 115.15 113.15 2q3r h HIS 97 Ca -0.04 0.00 0.09 0.00 -0.00 0.00 0.00 60.37 60.42 2q3r h HIS 97 Cb 0.34 0.00 -0.07 0.00 -0.00 0.00 0.00 27.41 27.67 2q3r h HIS 97 CO -0.05 0.00 0.62 0.00 -0.00 0.00 0.00 177.93 178.50 2q3r h ALA 98 N 1.82 1.41 -0.51 2.45 0.00 0.10 0.11 119.26 124.63 2q3r h ALA 98 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2q3r h ALA 98 Cb 0.66 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2q3r h ALA 98 CO -0.00 0.32 0.00 1.63 0.00 0.00 0.00 179.25 181.19 2q3r n LYS 99 N -4.58 3.88 -2.96 0.00 5.02 -0.43 -4.96 118.16 114.13 2q3r n LYS 99 Ca 0.16 -2.55 -0.12 0.00 -2.02 0.00 0.00 58.31 53.78 2q3r n LYS 99 Cb 0.26 -2.00 0.06 0.00 -0.02 0.00 0.00 35.03 33.33 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 0.73 -0.43 3.65 0.72 0.00 0.37 -2.15 105.19 108.09 2q3r n GLY 100 Ca 0.23 0.18 -0.28 0.00 0.00 0.00 0.00 46.02 46.14 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 -3.66 1.80 -0.22 -0.02 0.00 -1.10 0.30 107.32 104.43 2q3r s GLY 101 Ca 0.18 -1.26 -0.15 0.00 0.00 0.00 0.00 44.72 43.49 2q3r s GLY 101 CO 0.56 -1.25 0.35 -0.42 0.00 0.00 0.00 173.10 172.34 2q3r s ILE 102 N -1.48 5.22 -0.20 0.90 1.09 -0.18 -4.47 121.20 122.08 2q3r s ILE 102 Ca 0.26 0.59 0.00 0.00 -1.10 0.00 0.00 60.65 60.40 2q3r s ILE 102 Cb -0.10 -3.68 0.05 0.00 -1.06 0.00 0.00 42.46 37.66 2q3r s ILE 102 CO 0.17 0.25 -0.06 0.12 -0.10 0.00 0.00 174.94 175.32 2q3r s PHE 103 N 1.39 2.09 -0.10 3.97 5.36 -1.26 -0.44 117.98 128.98 2q3r s PHE 103 Ca 0.16 -1.43 -0.02 0.00 -0.96 0.00 0.00 56.93 54.69 2q3r s PHE 103 Cb -0.15 -1.48 -0.03 0.00 -0.34 0.00 0.00 43.02 41.03 2q3r s PHE 103 CO 0.08 -0.70 -0.02 -0.06 -1.46 0.00 0.00 175.22 173.05 2q3r s PHE 104 N 1.50 3.07 -0.24 10.12 0.40 -0.45 -1.03 117.98 131.36 2q3r s PHE 104 Ca -0.02 0.03 -0.16 0.00 -0.60 0.00 0.00 56.93 56.19 2q3r s PHE 104 Cb -0.17 -1.82 -0.04 0.00 0.51 0.00 0.00 43.02 41.51 2q3r s PHE 104 CO -0.07 0.30 0.40 0.00 0.70 0.00 0.00 175.22 176.55 2q3r s GLN 106 N 1.76 4.39 -0.11 0.00 0.74 -1.26 -1.50 119.66 123.69 2q3r s GLN 106 Ca 0.17 1.55 -0.01 0.00 0.05 0.00 0.00 55.36 57.12 2q3r s GLN 106 Cb -0.15 -3.54 -0.03 0.00 1.10 0.00 0.00 33.01 30.39 2q3r s GLN 106 CO 0.09 -0.38 -0.07 0.96 -0.55 0.00 0.00 175.29 175.34 2q3r s ILE 107 N 2.07 3.63 0.19 -2.34 -4.36 0.52 -1.46 121.20 119.45 2q3r s ILE 107 Ca 0.53 -0.48 0.02 0.00 -0.26 0.00 0.00 60.65 60.46 2q3r s ILE 107 Cb -0.22 -2.52 -0.01 0.00 1.25 0.00 0.00 42.46 40.96 2q3r s ILE 107 CO 0.20 0.55 0.21 -2.67 0.24 0.00 0.00 174.94 173.47 2q3r n TRP 108 N 2.88 -0.68 -3.66 1.37 4.27 -1.22 -0.67 117.44 119.73 2q3r n TRP 108 Ca -0.18 -1.50 -0.07 0.00 -3.89 0.00 0.00 57.50 51.86 2q3r n TRP 108 Cb 0.53 0.23 -0.08 0.00 -1.36 0.00 0.00 31.31 30.62 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 -3.18 -0.94 -1.00 -2.67 2.46 -1.26 -2.99 115.29 105.71 2q3r s HIS 109 Ca 0.20 1.80 0.15 0.00 0.47 0.00 0.00 55.06 57.68 2q3r s HIS 109 Cb 0.00 0.49 0.63 0.00 -0.13 0.00 0.00 32.58 33.58 2q3r s HIS 109 CO 0.14 -0.51 1.47 1.33 -2.47 0.00 0.00 174.74 174.71 2q3r n VAL 110 N 4.93 0.98 -1.17 0.89 0.24 -1.01 -2.31 118.33 120.87 2q3r n VAL 110 Ca -0.15 0.24 0.00 0.00 -2.04 0.00 0.00 64.34 62.39 2q3r n VAL 110 Cb 0.53 -0.99 0.00 0.00 -1.47 0.00 0.00 33.84 31.91 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 0.03 3.02 0.16 7.63 0.00 -1.26 -0.93 105.19 113.84 2q3r n GLY 111 Ca 0.04 -0.16 0.12 0.00 0.00 0.00 0.00 46.02 46.02 2q3r n GLY 111 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2q3r h ARG 112 N 0.00 0.00 -4.05 1.61 0.11 -1.75 -3.35 114.38 106.95 2q3r h ARG 112 Ca 0.00 0.00 -0.72 0.00 0.10 0.00 0.00 59.98 59.36 2q3r h ARG 112 Cb 0.00 0.00 -0.07 0.00 1.11 0.00 0.00 29.97 31.01 2q3r h ARG 112 CO 0.00 0.00 2.80 0.28 0.10 0.00 0.00 179.97 183.15 2q3r n VAL 113 N -2.34 3.69 -2.37 0.08 0.31 -0.11 -4.79 118.33 112.81 2q3r n VAL 113 Ca 0.00 -3.42 0.00 0.00 -0.01 0.00 0.00 64.34 60.92 2q3r n VAL 113 Cb 0.14 -2.53 0.00 0.00 -0.91 0.00 0.00 33.84 30.54 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 5.79 0.00 -3.69 4.52 2.88 -1.26 -4.24 113.62 117.63 2q3r n SER 114 Ca 0.49 -0.28 -0.12 0.00 -1.33 0.00 0.00 58.87 57.63 2q3r n SER 114 Cb 0.39 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.79 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 1.10 -0.21 0.40 -3.46 2.47 -1.26 -3.96 114.94 110.01 2q3r s ASN 115 Ca 0.00 -0.15 0.11 0.00 0.42 0.00 0.00 52.86 53.25 2q3r s ASN 115 Cb 0.00 0.41 0.93 0.00 -1.45 0.00 0.00 41.25 41.14 2q3r s ASN 115 CO 0.00 -0.70 1.94 0.77 -3.72 0.00 0.00 177.10 175.40 2q3r h SER 116 N 2.91 0.49 0.34 -4.21 4.64 -1.86 0.92 113.55 116.78 2q3r h SER 116 Ca -0.32 0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.00 2q3r h SER 116 Cb 1.21 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2q3r h SER 116 CO 0.45 0.29 -0.07 1.23 -0.87 0.00 0.00 176.83 177.86 2q3r h GLY 117 N 0.54 0.00 -0.98 -0.77 0.00 -1.86 -0.91 103.07 99.09 2q3r h GLY 117 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.67 2q3r h GLY 117 CO -0.11 0.00 -0.04 0.69 0.00 0.00 0.00 176.54 177.08 2q3r n PHE 118 N -3.48 0.00 -4.29 5.60 3.72 0.30 -4.92 117.46 114.40 2q3r n PHE 118 Ca -0.02 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.05 2q3r n PHE 118 Cb 0.20 -0.01 -0.09 0.00 -0.94 0.00 0.00 39.48 38.64 2q3r n PHE 118 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 2q3r s GLN 119 N -2.05 2.88 0.32 -1.08 -1.52 -0.35 -4.65 119.66 113.21 2q3r s GLN 119 Ca 0.33 -0.53 -0.29 0.00 -1.95 0.00 0.00 55.36 52.91 2q3r s GLN 119 Cb 0.20 -2.73 -0.12 0.00 -0.22 0.00 0.00 33.01 30.15 2q3r s GLN 119 CO 0.34 0.65 1.54 -2.30 -0.25 0.00 0.00 175.29 175.28 2q3r n PRO 120 N 1.59 2.65 -1.50 2.91 -0.02 -1.26 -1.34 135.00 138.03 2q3r n PRO 120 Ca -0.16 0.94 -0.17 0.00 -2.02 0.00 0.00 63.50 62.10 2q3r n PRO 120 Cb 0.53 -2.69 -0.07 0.00 -0.02 0.00 0.00 33.50 31.25 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 1.55 -5.00 -1.53 2.55 3.02 -1.26 -1.98 115.26 112.61 2q3r n ASN 121 Ca 0.06 0.40 -0.20 0.00 -0.03 0.00 0.00 54.58 54.81 2q3r n ASN 121 Cb 0.37 -3.96 -0.09 0.00 -0.61 0.00 0.00 39.78 35.49 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 -0.94 1.90 3.50 7.41 0.00 -0.45 -4.95 105.19 111.66 2q3r n GLY 122 Ca -0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.69 -1.00 0.39 1.61 1.02 -0.84 -4.77 119.74 112.47 2q3r s LYS 123 Ca 0.00 0.65 -0.22 0.00 0.02 0.00 0.00 55.97 56.42 2q3r s LYS 123 Cb 0.00 -1.56 -0.11 0.00 -0.52 0.00 0.00 37.83 35.65 2q3r s LYS 123 CO 0.00 -3.73 0.93 0.00 -0.92 0.00 0.00 175.35 171.63 2q3r s ALA 124 N -2.54 3.10 0.81 5.17 0.00 -1.26 -4.26 121.76 122.79 2q3r s ALA 124 Ca 0.68 0.41 -0.13 0.00 0.00 0.00 0.00 51.96 52.92 2q3r s ALA 124 Cb -0.23 -3.13 0.09 0.00 0.00 0.00 0.00 23.12 19.85 2q3r s ALA 124 CO 0.63 0.16 1.19 -2.14 0.00 0.00 0.00 175.76 175.60 2q3r s PRO 125 N -2.88 1.60 0.16 0.00 0.02 -1.26 -4.74 135.00 127.90 2q3r s PRO 125 Ca 0.58 1.71 0.08 0.00 0.02 0.00 0.00 61.00 63.39 2q3r s PRO 125 Cb -0.11 -1.78 -0.04 0.00 0.02 0.00 0.00 34.50 32.59 2q3r s PRO 125 CO 0.16 -2.23 -0.04 0.96 -0.33 0.00 0.00 177.00 175.52 2q3r s ILE 126 N -2.23 3.56 0.16 2.83 -4.36 -1.26 -1.34 121.20 118.56 2q3r s ILE 126 Ca 0.72 -1.44 -0.05 0.00 -0.26 0.00 0.00 60.65 59.61 2q3r s ILE 126 Cb -0.27 -2.76 0.02 0.00 1.25 0.00 0.00 42.46 40.69 2q3r s ILE 126 CO 0.51 -0.07 0.31 -0.24 0.24 0.00 0.00 174.94 175.69 2q3r n SER 127 N 0.05 -0.90 0.20 4.36 2.88 -1.04 -2.14 113.62 117.03 2q3r n SER 127 Ca -0.10 -1.68 0.09 0.00 -1.33 0.00 0.00 58.87 55.84 2q3r n SER 127 Cb 0.55 1.52 0.23 0.00 -0.75 0.00 0.00 64.21 65.76 2q3r n SER 127 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2q3r n SER 129 N -3.21 -0.60 -1.58 0.00 3.41 -1.26 -4.54 113.62 105.84 2q3r n SER 129 Ca 0.02 -2.26 -0.12 0.00 -0.26 0.00 0.00 58.87 56.25 2q3r n SER 129 Cb 0.56 1.25 0.19 0.00 -0.26 0.00 0.00 64.21 65.95 2q3r n SER 129 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2q3r n ASP 130 N -2.04 2.96 -4.62 4.04 5.75 -1.26 -3.75 116.55 117.62 2q3r n ASP 130 Ca 0.03 -3.72 -0.43 0.00 -0.01 0.00 0.00 54.79 50.66 2q3r n ASP 130 Cb 0.36 -0.72 -0.02 0.00 -1.03 0.00 0.00 41.12 39.71 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 -3.27 3.94 0.30 0.11 1.02 -1.26 -4.65 119.74 115.93 2q3r s LYS 131 Ca 0.49 0.85 -0.29 0.00 0.02 0.00 0.00 55.97 57.04 2q3r s LYS 131 Cb 0.44 -3.79 -0.10 0.00 -0.52 0.00 0.00 37.83 33.86 2q3r s LYS 131 CO 0.04 -1.01 1.43 -1.25 -0.92 0.00 0.00 175.35 173.64 2q3r s PRO 132 N 3.77 4.25 -0.19 -1.68 0.04 -1.26 -4.62 135.00 135.30 2q3r s PRO 132 Ca 0.44 2.36 -0.08 0.00 0.04 0.00 0.00 61.00 63.76 2q3r s PRO 132 Cb -0.11 -3.06 -0.04 0.00 0.04 0.00 0.00 34.50 31.32 2q3r s PRO 132 CO 0.19 -0.40 0.09 -1.17 0.04 0.00 0.00 177.00 175.75 2q3r s LEU 133 N -1.08 3.96 -1.17 -3.56 2.96 -1.26 -4.58 118.68 113.95 2q3r s LEU 133 Ca 0.56 0.13 -0.24 0.00 -0.22 0.00 0.00 54.13 54.36 2q3r s LEU 133 Cb -0.43 -2.01 0.01 0.00 0.50 0.00 0.00 46.19 44.26 2q3r s LEU 133 CO 0.50 0.18 0.74 0.23 -1.32 0.00 0.00 176.35 176.68 2q3r n MET 134 N 3.53 -1.04 0.23 1.98 2.81 -1.26 -4.65 117.12 118.72 2q3r n MET 134 Ca -0.16 0.35 0.14 0.00 -1.81 0.00 0.00 57.70 56.21 2q3r n MET 134 Cb 0.52 -3.70 0.77 0.00 -0.71 0.00 0.00 33.22 30.10 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 -2.10 0.00 0.00 0.03 0.13 -1.94 -2.14 132.00 125.97 2q3r h PRO 135 Ca -0.68 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.45 2q3r h PRO 135 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 2q3r h PRO 135 CO 0.50 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.27 2q3r n GLN 136 N -4.15 0.05 -3.35 0.86 0.00 -1.26 -4.54 117.38 104.98 2q3r n GLN 136 Ca -0.00 0.42 -0.44 0.00 0.00 0.00 0.00 57.00 56.98 2q3r n GLN 136 Cb 0.20 -1.62 -0.08 0.00 0.00 0.00 0.00 30.24 28.74 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 -3.13 5.15 -0.07 -0.39 1.01 -0.81 -5.03 121.20 117.93 2q3r s ILE 137 Ca 0.03 -0.80 -0.00 0.00 0.00 0.00 0.00 60.65 59.87 2q3r s ILE 137 Cb 0.06 -4.12 0.02 0.00 0.01 0.00 0.00 42.46 38.43 2q3r s ILE 137 CO 0.18 -0.56 -0.03 -0.13 0.00 0.00 0.00 174.94 174.40 2q3r s ARG 138 N 1.90 0.93 0.78 2.79 3.00 -1.26 -0.81 118.95 126.28 2q3r s ARG 138 Ca 0.07 -0.05 -0.16 0.00 0.00 0.00 0.00 55.73 55.59 2q3r s ARG 138 Cb -0.22 -1.11 -0.08 0.00 0.00 0.00 0.00 34.95 33.54 2q3r s ARG 138 CO 0.09 -0.23 0.03 0.43 0.00 0.00 0.00 175.30 175.62 2q3r n SER 139 N 4.77 -3.11 -4.22 0.23 7.64 -1.26 -4.84 113.62 112.85 2q3r n SER 139 Ca -0.13 0.46 -0.37 0.00 1.01 0.00 0.00 58.87 59.83 2q3r n SER 139 Cb 0.50 -1.02 0.03 0.00 -1.01 0.00 0.00 64.21 62.72 2q3r n SER 139 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2q3r n ASN 140 N 1.14 -3.89 0.00 6.43 3.02 -1.26 -4.23 115.26 116.47 2q3r n ASN 140 Ca 0.06 0.50 0.00 0.00 -0.03 0.00 0.00 54.58 55.11 2q3r n ASN 140 Cb 0.51 -0.90 0.00 0.00 -0.61 0.00 0.00 39.78 38.79 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 2.63 1.55 3.28 7.41 0.00 -1.26 -4.88 105.19 113.91 2q3r n GLY 141 Ca 0.05 -0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 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 0.70 -0.76 -0.61 5.41 -1.26 -4.85 119.36 117.99 2q3r n ILE 142 Ca 0.00 -0.47 0.02 0.00 1.00 0.00 0.00 62.75 63.30 2q3r n ILE 142 Cb 0.00 -0.27 0.34 0.00 -0.71 0.00 0.00 39.64 39.00 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 1.70 5.07 -4.67 4.38 3.85 -1.26 -4.63 116.55 121.01 2q3r n ASP 143 Ca 0.07 -2.94 -0.43 0.00 -0.71 0.00 0.00 54.79 50.79 2q3r n ASP 143 Cb 0.50 -0.69 -0.02 0.00 -1.35 0.00 0.00 41.12 39.55 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 -2.66 4.27 0.46 0.11 2.12 -1.26 -4.97 118.70 116.78 2q3r s GLU 144 Ca 0.50 1.54 -0.23 0.00 0.36 0.00 0.00 54.97 57.15 2q3r s GLU 144 Cb 0.39 -3.68 -0.10 0.00 0.26 0.00 0.00 34.13 31.00 2q3r s GLU 144 CO 0.14 -0.62 0.91 0.00 -0.54 0.00 0.00 175.26 175.14 2q3r n ALA 145 N 6.22 -0.13 0.16 6.30 0.00 -1.26 -3.98 120.51 127.83 2q3r n ALA 145 Ca 0.13 0.17 0.07 0.00 0.00 0.00 0.00 53.44 53.80 2q3r n ALA 145 Cb 0.46 -2.03 0.07 0.00 0.00 0.00 0.00 19.45 17.95 2q3r n ALA 145 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2q3r h LEU 146 N 1.18 0.00 -7.47 0.00 5.85 -1.30 -3.36 115.31 110.20 2q3r h LEU 146 Ca -0.45 0.00 -0.76 0.00 0.84 0.00 0.00 57.88 57.51 2q3r h LEU 146 Cb 1.35 0.00 -0.31 0.00 0.37 0.00 0.00 40.66 42.07 2q3r h LEU 146 CO 0.54 0.24 0.21 -0.36 -0.34 0.00 0.00 178.44 178.74 2q3r s PHE 147 N -3.11 4.10 -0.53 1.25 0.40 -1.26 -4.77 117.98 114.06 2q3r s PHE 147 Ca 0.04 -2.81 -0.40 0.00 -0.60 0.00 0.00 56.93 53.16 2q3r s PHE 147 Cb 0.07 -3.59 -0.17 0.00 0.51 0.00 0.00 43.02 39.83 2q3r s PHE 147 CO 0.73 -0.86 2.23 2.41 0.70 0.00 0.00 175.22 180.43 2q3r n THR 148 N 2.59 0.04 -1.50 0.64 -1.04 -1.25 -4.60 114.28 109.15 2q3r n THR 148 Ca 0.22 -0.08 -0.55 0.00 -2.04 0.00 0.00 64.05 61.61 2q3r n THR 148 Cb 0.38 -0.80 -0.06 0.00 -1.82 0.00 0.00 70.33 68.03 2q3r n THR 148 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2q3r n PRO 149 N 7.82 0.26 -2.39 -2.82 -0.02 -1.26 -4.47 135.00 132.12 2q3r n PRO 149 Ca 0.53 0.09 -0.36 0.00 -2.02 0.00 0.00 63.50 61.74 2q3r n PRO 149 Cb 0.04 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.00 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 -0.22 3.89 -0.19 0.52 0.04 -1.26 -4.55 135.00 133.22 2q3r s PRO 150 Ca 0.82 1.63 -0.18 0.00 0.04 0.00 0.00 61.00 63.31 2q3r s PRO 150 Cb -1.11 -2.40 -0.03 0.00 0.04 0.00 0.00 34.50 30.99 2q3r s PRO 150 CO 0.55 -0.41 0.51 0.50 0.04 0.00 0.00 177.00 178.20 2q3r s ARG 151 N -2.71 4.20 -0.14 4.56 3.52 -0.45 -4.08 118.95 123.86 2q3r s ARG 151 Ca 0.62 0.42 -0.29 0.00 -0.13 0.00 0.00 55.73 56.35 2q3r s ARG 151 Cb -0.25 -3.55 -0.03 0.00 -1.56 0.00 0.00 34.95 29.56 2q3r s ARG 151 CO 0.30 -0.12 1.49 0.50 -0.81 0.00 0.00 175.30 176.66 2q3r s ARG 152 N 1.55 4.12 0.26 5.12 3.52 -1.25 -2.49 118.95 129.78 2q3r s ARG 152 Ca 0.24 1.86 -0.29 0.00 -0.13 0.00 0.00 55.73 57.40 2q3r s ARG 152 Cb -0.15 -3.91 -0.09 0.00 -1.56 0.00 0.00 34.95 29.23 2q3r s ARG 152 CO 0.10 -0.89 1.24 -0.51 -0.81 0.00 0.00 175.30 174.43 2q3r s LEU 153 N 4.07 4.46 0.63 -0.88 1.43 -1.09 -4.99 118.68 122.30 2q3r s LEU 153 Ca 0.65 2.45 -0.16 0.00 -1.03 0.00 0.00 54.13 56.04 2q3r s LEU 153 Cb -0.27 -3.63 -0.01 0.00 0.03 0.00 0.00 46.19 42.31 2q3r s LEU 153 CO 0.24 -0.41 1.10 -0.83 0.23 0.00 0.00 176.35 176.68 2q3r s GLY 154 N -0.28 2.22 0.46 -3.19 0.00 -1.26 -4.92 107.32 100.35 2q3r s GLY 154 Ca 0.50 0.56 0.18 0.00 0.00 0.00 0.00 44.72 45.96 2q3r s GLY 154 CO 0.44 0.91 2.00 1.19 0.00 0.00 0.00 173.10 177.63 2q3r h ILE 155 N 0.26 0.98 0.00 0.90 2.10 -2.02 -0.40 117.51 119.33 2q3r h ILE 155 Ca -0.47 -0.66 0.00 0.00 1.08 0.00 0.00 64.86 64.80 2q3r h ILE 155 Cb 1.24 1.37 0.00 0.00 -1.09 0.00 0.00 36.82 38.35 2q3r h ILE 155 CO 0.55 0.18 0.00 -0.62 -1.08 0.00 0.00 178.15 177.18 2q3r n GLU 156 N -4.10 0.27 -0.01 2.19 1.02 -1.26 -2.85 120.64 115.91 2q3r n GLU 156 Ca -0.02 0.11 -0.15 0.00 -0.02 0.00 0.00 57.16 57.08 2q3r n GLU 156 Cb 0.26 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.04 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 -1.26 0.70 -0.21 3.49 1.02 -0.16 -4.41 120.64 119.79 2q3r n GLU 157 Ca 0.09 0.28 0.02 0.00 -0.02 0.00 0.00 57.16 57.53 2q3r n GLU 157 Cb 0.13 -1.75 0.13 0.00 -0.02 0.00 0.00 31.44 29.93 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 0.04 0.59 -1.00 -3.67 2.04 -1.55 -2.14 117.51 111.81 2q3r h ILE 158 Ca -0.36 -0.09 0.22 0.00 1.00 0.00 0.00 64.86 65.64 2q3r h ILE 158 Cb 2.03 0.32 -0.10 0.00 -0.74 0.00 0.00 36.82 38.32 2q3r h ILE 158 CO 0.08 0.05 0.62 -0.65 0.00 0.00 0.00 178.15 178.25 2q3r h PRO 159 N 0.25 0.59 -0.05 2.37 0.11 -1.77 0.30 132.00 133.81 2q3r h PRO 159 Ca 0.35 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.42 2q3r h PRO 159 Cb 0.54 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.52 2q3r h PRO 159 CO -0.45 0.39 0.00 0.41 -0.21 0.00 0.00 178.00 178.14 2q3r n GLY 160 N -1.38 -0.75 0.30 -0.55 0.00 -0.81 -2.63 105.19 99.37 2q3r n GLY 160 Ca 0.24 -0.10 -0.05 0.00 0.00 0.00 0.00 46.02 46.11 2q3r n GLY 160 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2q3r n ILE 161 N -0.44 0.32 0.28 -0.61 5.41 0.85 -4.20 119.36 120.97 2q3r n ILE 161 Ca 0.07 -0.11 0.16 0.00 1.00 0.00 0.00 62.75 63.86 2q3r n ILE 161 Cb 0.07 -1.01 0.78 0.00 -0.71 0.00 0.00 39.64 38.77 2q3r n ILE 161 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 2q3r h VAL 162 N -0.07 0.00 0.00 1.39 2.07 -1.03 -0.92 116.25 117.69 2q3r h VAL 162 Ca -0.13 -0.13 -0.17 0.00 0.82 0.00 0.00 66.70 67.08 2q3r h VAL 162 Cb 1.17 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.82 2q3r h VAL 162 CO -0.04 0.00 -1.32 -1.13 0.02 0.00 0.00 177.57 175.10 2q3r h ASN 163 N 0.00 0.00 0.58 0.57 -0.73 -1.73 -3.02 115.58 111.25 2q3r h ASN 163 Ca 0.00 0.00 -0.07 0.00 1.87 0.00 0.00 56.30 58.10 2q3r h ASN 163 Cb 0.16 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.74 2q3r h ASN 163 CO 0.00 0.61 -0.32 0.44 -0.37 0.00 0.00 177.43 177.79 2q3r h ASP 164 N 0.00 0.00 0.06 1.15 3.32 -1.34 -0.68 116.42 118.94 2q3r h ASP 164 Ca -0.15 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.76 2q3r h ASP 164 Cb 1.59 0.00 0.01 0.00 0.22 0.00 0.00 39.33 41.16 2q3r h ASP 164 CO 0.05 0.32 -0.58 -0.26 -1.72 0.00 0.00 179.24 177.05 2q3r h PHE 165 N 0.00 0.46 -0.96 4.55 -1.00 -1.61 -1.56 116.94 116.83 2q3r h PHE 165 Ca -0.00 -0.30 0.02 0.00 2.81 0.00 0.00 57.97 60.50 2q3r h PHE 165 Cb 0.69 -0.03 -0.05 0.00 3.61 0.00 0.00 35.95 40.17 2q3r h PHE 165 CO 0.00 1.17 0.63 -0.09 -1.61 0.00 0.00 178.31 178.41 2q3r h ARG 166 N -0.38 1.21 0.25 1.51 2.43 -1.38 -1.46 114.38 116.56 2q3r h ARG 166 Ca -0.09 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 58.99 2q3r h ARG 166 Cb 1.38 -0.27 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 2q3r h ARG 166 CO 0.11 0.80 -0.12 1.25 -1.51 0.00 0.00 179.97 180.50 2q3r h LEU 167 N 1.25 -0.28 -1.31 3.80 5.85 -1.16 -2.46 115.31 121.00 2q3r h LEU 167 Ca 0.37 -0.10 0.24 0.00 0.84 0.00 0.00 57.88 59.23 2q3r h LEU 167 Cb -0.06 0.07 -0.09 0.00 0.37 0.00 0.00 40.66 40.95 2q3r h LEU 167 CO -0.10 -0.07 0.64 0.00 -0.34 0.00 0.00 178.44 178.57 2q3r h ALA 168 N 0.23 2.11 -0.23 1.25 0.00 -0.83 0.51 119.26 122.29 2q3r h ALA 168 Ca -0.03 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2q3r h ALA 168 Cb 0.36 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2q3r h ALA 168 CO 0.06 -0.49 0.10 0.00 0.00 0.00 0.00 179.25 178.91 2q3r h ALA 169 N 1.63 0.30 -0.59 0.00 0.00 -0.86 0.21 119.26 119.94 2q3r h ALA 169 Ca 0.57 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.43 2q3r h ALA 169 Cb 1.33 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.98 2q3r h ALA 169 CO -0.30 -0.12 0.32 -0.09 0.00 0.00 0.00 179.25 179.06 2q3r h ARG 170 N 0.23 0.59 -0.25 0.00 9.65 0.32 -1.68 114.38 123.24 2q3r h ARG 170 Ca 0.08 -0.04 -0.07 0.00 -1.10 0.00 0.00 59.98 58.85 2q3r h ARG 170 Cb 0.15 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.59 2q3r h ARG 170 CO -0.01 0.39 -0.14 -0.91 2.80 0.00 0.00 179.97 182.10 2q3r h ASN 171 N 0.61 0.41 -0.05 -3.80 4.21 -0.40 -1.08 115.58 115.48 2q3r h ASN 171 Ca 0.26 -0.10 0.00 0.00 1.21 0.00 0.00 56.30 57.67 2q3r h ASN 171 Cb 0.15 -0.11 -0.00 0.00 -1.12 0.00 0.00 38.32 37.24 2q3r h ASN 171 CO -0.17 0.58 0.02 0.00 -1.29 0.00 0.00 177.43 176.57 2q3r h ALA 172 N 1.46 0.05 -0.82 -0.83 0.00 0.24 -1.34 119.26 118.02 2q3r h ALA 172 Ca 0.07 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.03 2q3r h ALA 172 Cb 0.49 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 2q3r h ALA 172 CO 0.03 -0.46 0.52 0.52 0.00 0.00 0.00 179.25 179.85 2q3r h MET 173 N 0.04 0.95 -0.84 0.00 2.86 -0.93 -1.49 114.93 115.51 2q3r h MET 173 Ca 0.02 -0.06 0.08 0.00 -2.06 0.00 0.00 59.70 57.68 2q3r h MET 173 Cb 0.01 -0.21 -0.06 0.00 0.06 0.00 0.00 31.60 31.40 2q3r h MET 173 CO -0.02 0.63 0.55 1.49 1.06 0.00 0.00 176.91 180.61 2q3r h GLU 174 N 0.98 0.84 0.00 1.72 4.81 -0.42 0.30 114.58 122.81 2q3r h GLU 174 Ca 0.34 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 2q3r h GLU 174 Cb 0.08 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.28 2q3r h GLU 174 CO -0.14 0.56 0.00 0.00 -0.73 0.00 0.00 179.01 178.69 2q3r n ALA 175 N -2.42 2.20 -0.01 2.92 0.00 -0.58 -4.93 120.51 117.69 2q3r n ALA 175 Ca 0.13 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2q3r n ALA 175 Cb 0.27 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.28 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 1.19 0.84 3.69 0.00 0.00 0.11 -4.08 105.19 106.93 2q3r n GLY 176 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 2q3r n GLY 176 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2q3r n PHE 177 N -2.01 1.26 0.87 1.61 3.01 -0.88 -4.90 117.46 116.41 2q3r n PHE 177 Ca 0.00 0.40 0.13 0.00 1.01 0.00 0.00 57.45 59.00 2q3r n PHE 177 Cb 0.00 -2.12 0.50 0.00 -0.01 0.00 0.00 39.48 37.86 2q3r n PHE 177 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2q3r n ASP 178 N -3.01 0.32 0.00 4.37 8.00 -0.20 -4.61 116.55 121.42 2q3r n ASP 178 Ca 0.14 0.44 0.00 0.00 0.71 0.00 0.00 54.79 56.08 2q3r n ASP 178 Cb 0.50 -0.49 0.00 0.00 -0.02 0.00 0.00 41.12 41.11 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 1.43 -1.27 3.03 0.44 0.00 -1.25 -4.79 105.19 102.79 2q3r n GLY 179 Ca 0.06 -1.06 -0.14 0.00 0.00 0.00 0.00 46.02 44.89 2q3r n GLY 179 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2q3r s VAL 180 N -3.00 0.52 -0.24 1.61 0.11 -1.00 -1.67 120.40 116.73 2q3r s VAL 180 Ca 0.00 -0.80 -0.06 0.00 -2.93 0.00 0.00 61.98 58.19 2q3r s VAL 180 Cb 0.00 -0.54 -0.02 0.00 -1.53 0.00 0.00 36.38 34.29 2q3r s VAL 180 CO 0.00 -0.21 0.03 -0.70 -3.33 0.00 0.00 175.10 170.89 2q3r s GLU 181 N -1.09 3.54 -0.29 1.54 2.12 -0.56 -2.18 118.70 121.77 2q3r s GLU 181 Ca -0.06 -0.54 -0.29 0.00 0.36 0.00 0.00 54.97 54.45 2q3r s GLU 181 Cb -0.07 -3.21 -0.00 0.00 0.26 0.00 0.00 34.13 31.11 2q3r s GLU 181 CO 0.00 -0.20 1.35 0.42 -0.54 0.00 0.00 175.26 176.29 2q3r s ILE 182 N 1.56 4.07 -1.17 -3.70 1.01 0.10 -0.35 121.20 122.72 2q3r s ILE 182 Ca 0.06 1.21 -0.21 0.00 0.00 0.00 0.00 60.65 61.71 2q3r s ILE 182 Cb -0.15 -4.10 0.02 0.00 0.01 0.00 0.00 42.46 38.24 2q3r s ILE 182 CO 0.01 -0.46 1.73 -2.28 0.00 0.00 0.00 174.94 173.94 2q3r s HIS 183 N 4.53 2.45 -0.45 3.97 2.46 0.16 -1.56 115.29 126.85 2q3r s HIS 183 Ca 0.58 -0.78 0.04 0.00 0.47 0.00 0.00 55.06 55.37 2q3r s HIS 183 Cb -0.18 -4.52 0.64 0.00 -0.13 0.00 0.00 32.58 28.39 2q3r s HIS 183 CO 0.24 -1.71 1.87 0.41 -2.47 0.00 0.00 174.74 173.09 2q3r n GLY 184 N 5.99 4.65 0.00 1.59 0.00 -0.81 -4.59 105.19 112.02 2q3r n GLY 184 Ca 0.43 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 45.26 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 -1.13 0.00 -4.25 4.61 0.00 -1.17 -4.15 120.51 114.42 2q3r n ALA 185 Ca 0.57 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.66 2q3r n ALA 185 Cb 1.54 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.94 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 -1.29 -2.06 0.00 0.00 3.02 -1.26 -2.28 115.26 111.39 2q3r n ASN 186 Ca 0.00 -1.09 0.00 0.00 -0.03 0.00 0.00 54.58 53.46 2q3r n ASN 186 Cb 0.00 -2.45 0.00 0.00 -0.61 0.00 0.00 39.78 36.72 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 -1.56 0.24 3.88 7.41 0.00 -1.24 -4.76 105.19 109.15 2q3r n GLY 187 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.68 2q3r n GLY 187 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2q3r s TYR 188 N -1.53 3.43 0.00 1.61 2.02 -0.97 -4.57 117.35 117.34 2q3r s TYR 188 Ca 0.00 0.87 0.00 0.00 -0.37 0.00 0.00 57.07 57.57 2q3r s TYR 188 Cb 0.00 -2.26 0.00 0.00 -0.40 0.00 0.00 41.96 39.30 2q3r s TYR 188 CO 0.00 0.21 0.00 -0.11 -1.57 0.00 0.00 175.55 174.08 2q3r n LEU 189 N -0.40 0.00 -0.01 -1.29 7.94 -0.98 0.16 117.00 122.42 2q3r n LEU 189 Ca 0.00 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.78 2q3r n LEU 189 Cb 0.53 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.41 2q3r n LEU 189 CO 0.46 0.00 0.77 0.40 -1.11 0.00 0.00 177.39 177.91 2q3r h ILE 190 N 0.00 1.20 -0.10 1.96 2.04 -1.81 -2.35 117.51 118.45 2q3r h ILE 190 Ca 0.00 -0.61 -0.00 0.00 1.00 0.00 0.00 64.86 65.25 2q3r h ILE 190 Cb 0.00 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 2q3r h ILE 190 CO 0.00 0.17 0.04 -0.78 0.00 0.00 0.00 178.15 177.58 2q3r h ASP 191 N -0.12 0.11 -0.76 1.72 3.58 0.14 -2.03 116.42 119.07 2q3r h ASP 191 Ca 0.02 -0.00 0.05 0.00 0.42 0.00 0.00 57.03 57.51 2q3r h ASP 191 Cb 0.26 -0.03 -0.05 0.00 1.72 0.00 0.00 39.33 41.23 2q3r h ASP 191 CO 0.00 0.10 0.46 1.56 -2.88 0.00 0.00 179.24 178.49 2q3r h GLN 192 N 0.13 0.85 0.00 0.28 4.20 -0.95 -1.32 115.11 118.31 2q3r h GLN 192 Ca 0.03 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.61 2q3r h GLN 192 Cb 0.02 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.60 2q3r h GLN 192 CO -0.00 0.57 -0.38 0.74 -0.67 0.00 0.00 178.83 179.08 2q3r h PHE 193 N 0.88 0.00 0.10 2.96 -1.00 -1.15 -3.24 116.94 115.48 2q3r h PHE 193 Ca 0.32 0.00 -0.27 0.00 2.81 0.00 0.00 57.97 60.83 2q3r h PHE 193 Cb 0.09 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.65 2q3r h PHE 193 CO -0.04 0.38 -1.27 0.52 -1.61 0.00 0.00 178.31 176.29 2q3r h MET 194 N 0.00 0.22 -6.25 1.51 2.86 -1.15 -3.42 114.93 108.70 2q3r h MET 194 Ca -0.00 -0.37 -0.56 0.00 -2.06 0.00 0.00 59.70 56.71 2q3r h MET 194 Cb 0.86 0.14 -0.04 0.00 0.06 0.00 0.00 31.60 32.62 2q3r h MET 194 CO 0.05 1.15 0.53 0.15 1.06 0.00 0.00 176.91 179.85 2q3r s LYS 195 N -2.66 4.43 0.26 1.72 -0.14 -0.58 -4.86 119.74 117.91 2q3r s LYS 195 Ca -0.04 1.36 -0.04 0.00 -1.36 0.00 0.00 55.97 55.90 2q3r s LYS 195 Cb 0.08 -3.54 0.38 0.00 -1.68 0.00 0.00 37.83 33.07 2q3r s LYS 195 CO 0.87 -0.29 1.87 0.38 -0.76 0.00 0.00 175.35 177.42 2q3r h ASP 196 N 7.08 0.95 0.71 2.83 3.04 -1.84 0.55 116.42 129.74 2q3r h ASP 196 Ca -0.32 0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.49 2q3r h ASP 196 Cb 1.15 -0.19 0.00 0.00 -1.04 0.00 0.00 39.33 39.26 2q3r h ASP 196 CO 0.84 0.60 0.00 0.35 -2.04 0.00 0.00 179.24 179.00 2q3r n THR 197 N -4.56 0.84 -0.12 1.15 -2.24 -1.26 -3.48 114.28 104.61 2q3r n THR 197 Ca 0.14 0.24 -0.22 0.00 -2.27 0.00 0.00 64.05 61.94 2q3r n THR 197 Cb 0.19 -1.17 -0.09 0.00 -2.10 0.00 0.00 70.33 67.16 2q3r n THR 197 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2q3r n VAL 198 N -2.22 1.28 -3.26 2.28 0.31 -0.06 -4.94 118.33 111.73 2q3r n VAL 198 Ca 0.02 -0.38 -0.39 0.00 -0.01 0.00 0.00 64.34 63.58 2q3r n VAL 198 Cb 0.22 -1.65 -0.07 0.00 -0.91 0.00 0.00 33.84 31.44 2q3r n VAL 198 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2q3r s ASN 199 N -6.80 6.48 -0.08 4.52 2.47 0.17 -4.56 114.94 117.15 2q3r s ASN 199 Ca -0.32 0.58 0.18 0.00 0.42 0.00 0.00 52.86 53.72 2q3r s ASN 199 Cb 0.11 -2.28 0.39 0.00 -1.45 0.00 0.00 41.25 38.02 2q3r s ASN 199 CO 0.44 -0.22 1.17 -0.90 -3.72 0.00 0.00 177.10 173.88 2q3r n ASP 200 N 5.13 1.24 -4.76 -4.21 5.75 -1.26 -4.60 116.55 113.85 2q3r n ASP 200 Ca -0.05 -2.72 -0.35 0.00 -0.01 0.00 0.00 54.79 51.66 2q3r n ASP 200 Cb 0.50 -0.38 0.04 0.00 -1.03 0.00 0.00 41.12 40.25 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 -1.28 2.92 -0.24 0.11 0.52 -1.26 -4.82 118.95 114.89 2q3r s ARG 201 Ca 0.33 1.70 0.12 0.00 -0.52 0.00 0.00 55.73 57.36 2q3r s ARG 201 Cb 0.35 -1.94 0.49 0.00 0.52 0.00 0.00 34.95 34.37 2q3r s ARG 201 CO -0.11 -1.22 1.41 0.25 0.02 0.00 0.00 175.30 175.65 2q3r n THR 202 N -1.82 2.40 -4.27 0.02 -2.24 -1.26 -1.92 114.28 105.20 2q3r n THR 202 Ca 0.13 -2.45 -0.13 0.00 -2.27 0.00 0.00 64.05 59.32 2q3r n THR 202 Cb 0.50 -0.29 -0.03 0.00 -2.10 0.00 0.00 70.33 68.42 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 -0.97 2.52 0.14 3.42 3.85 -1.26 -5.00 116.55 119.25 2q3r n ASP 203 Ca 0.27 -1.91 0.08 0.00 -0.71 0.00 0.00 54.79 52.53 2q3r n ASP 203 Cb 0.94 0.13 0.44 0.00 -1.35 0.00 0.00 41.12 41.29 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 -0.56 0.11 -0.41 0.11 0.28 -1.26 -1.51 120.64 117.40 2q3r n GLU 204 Ca -0.08 0.59 0.10 0.00 -0.16 0.00 0.00 57.16 57.61 2q3r n GLU 204 Cb 0.26 -1.92 0.31 0.00 1.43 0.00 0.00 31.44 31.52 2q3r n GLU 204 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 2q3r n TYR 205 N -2.08 1.05 -3.88 -1.84 4.01 -1.26 -4.45 117.16 108.71 2q3r n TYR 205 Ca -0.01 -0.48 -0.04 0.00 -0.16 0.00 0.00 57.90 57.21 2q3r n TYR 205 Cb 0.10 -0.07 0.02 0.00 -0.31 0.00 0.00 39.34 39.07 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 -0.95 0.15 0.00 2.72 0.00 -0.57 -4.05 107.32 104.62 2q3r s GLY 206 Ca 0.46 -0.40 0.00 0.00 0.00 0.00 0.00 44.72 44.77 2q3r s GLY 206 CO 0.28 2.14 0.00 0.61 0.00 0.00 0.00 173.10 176.13 2q3r n GLY 207 N -0.68 0.76 3.53 0.20 0.00 -0.81 -4.30 105.19 103.89 2q3r n GLY 207 Ca -0.04 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.84 -0.33 0.16 1.61 1.04 -1.26 -5.02 113.70 107.06 2q3r s SER 208 Ca 0.00 0.08 -0.18 0.00 0.48 0.00 0.00 55.95 56.33 2q3r s SER 208 Cb 0.00 0.33 0.07 0.00 0.10 0.00 0.00 66.02 66.52 2q3r s SER 208 CO 0.00 -0.51 1.67 0.25 0.98 0.00 0.00 173.24 175.63 2q3r h LEU 209 N 2.11 -0.40 0.53 2.42 5.85 -1.95 0.56 115.31 124.43 2q3r h LEU 209 Ca -0.19 0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 2q3r h LEU 209 Cb 1.21 0.25 0.00 0.00 0.37 0.00 0.00 40.66 42.49 2q3r h LEU 209 CO 0.30 -0.14 -0.29 1.56 -0.34 0.00 0.00 178.44 179.52 2q3r h GLN 210 N -0.03 -0.74 -0.61 1.25 4.20 -1.98 -1.72 115.11 115.48 2q3r h GLN 210 Ca 0.17 0.05 0.13 0.00 0.06 0.00 0.00 58.65 59.07 2q3r h GLN 210 Cb 0.30 0.17 -0.03 0.00 0.30 0.00 0.00 27.48 28.21 2q3r h GLN 210 CO -0.38 -0.49 0.42 -0.91 -0.67 0.00 0.00 178.83 176.80 2q3r h ASN 211 N -0.76 0.23 0.46 1.46 4.21 -1.70 -0.81 115.58 118.66 2q3r h ASN 211 Ca -0.07 0.01 -0.17 0.00 1.21 0.00 0.00 56.30 57.29 2q3r h ASN 211 Cb 0.61 -0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 37.76 2q3r h ASN 211 CO 0.09 0.12 -0.71 0.03 -1.29 0.00 0.00 177.43 175.67 2q3r h ARG 212 N 0.25 0.21 -0.01 0.81 3.08 -0.41 -3.09 114.38 115.22 2q3r h ARG 212 Ca 0.29 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 60.17 2q3r h ARG 212 Cb 0.82 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.90 2q3r h ARG 212 CO -0.06 0.84 -0.14 0.00 -1.07 0.00 0.00 179.97 179.54 2q3r h LYS 214 N 1.13 1.30 0.47 0.00 3.64 -1.27 -1.85 116.57 119.99 2q3r h LYS 214 Ca 0.00 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 59.25 2q3r h LYS 214 Cb 0.42 -0.28 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 2q3r h LYS 214 CO 0.00 0.89 -0.23 0.35 -2.27 0.00 0.00 179.45 178.20 2q3r h PHE 215 N 1.32 -0.58 -0.75 1.91 3.57 -1.76 -0.23 116.94 120.41 2q3r h PHE 215 Ca 0.35 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.82 2q3r h PHE 215 Cb -0.08 0.19 -0.04 0.00 2.79 0.00 0.00 35.95 38.82 2q3r h PHE 215 CO 0.00 -0.33 0.41 -1.00 -2.23 0.00 0.00 178.31 175.16 2q3r h PRO 216 N -0.70 1.05 -0.11 6.41 0.13 -1.79 -2.14 132.00 134.85 2q3r h PRO 216 Ca -0.06 -0.13 -0.03 0.00 -0.87 0.00 0.00 66.00 64.91 2q3r h PRO 216 Cb 0.52 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 31.44 2q3r h PRO 216 CO 0.11 0.78 -0.08 -0.07 -0.23 0.00 0.00 178.00 178.51 2q3r h LEU 217 N 1.04 0.15 -1.10 1.56 3.38 -1.24 -0.53 115.31 118.56 2q3r h LEU 217 Ca 0.26 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.17 2q3r h LEU 217 Cb 0.04 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2q3r h LEU 217 CO -0.04 0.26 -0.19 -0.33 0.09 0.00 0.00 178.44 178.23 2q3r h GLU 218 N 0.16 0.00 0.17 1.13 5.08 -0.40 -1.72 114.58 119.00 2q3r h GLU 218 Ca 0.04 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.08 2q3r h GLU 218 Cb 0.25 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.51 2q3r h GLU 218 CO 0.01 0.19 -1.52 0.82 -1.00 0.00 0.00 179.01 177.51 2q3r h ILE 219 N 0.00 1.07 -0.57 3.13 2.04 -0.68 -2.96 117.51 119.54 2q3r h ILE 219 Ca -0.00 -2.50 0.04 0.00 1.00 0.00 0.00 64.86 63.39 2q3r h ILE 219 Cb 0.73 2.83 -0.04 0.00 -0.74 0.00 0.00 36.82 39.60 2q3r h ILE 219 CO 0.02 0.79 0.33 0.58 0.00 0.00 0.00 178.15 179.88 2q3r h VAL 220 N -0.06 1.02 0.50 1.67 2.07 -1.06 -2.13 116.25 118.26 2q3r h VAL 220 Ca -0.30 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 2q3r h VAL 220 Cb 1.96 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 2q3r h VAL 220 CO 0.15 0.12 -0.43 -0.78 0.02 0.00 0.00 177.57 176.65 2q3r h ASP 221 N 0.64 -1.15 0.50 0.57 3.58 -1.39 -2.09 116.42 117.08 2q3r h ASP 221 Ca 0.24 0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.76 2q3r h ASP 221 Cb 0.08 0.37 -0.02 0.00 1.72 0.00 0.00 39.33 41.48 2q3r h ASP 221 CO -0.13 -0.61 -0.51 0.00 -2.88 0.00 0.00 179.24 175.11 2q3r h ALA 222 N -0.65 -1.16 -0.67 -0.78 0.00 -1.35 -1.73 119.26 112.92 2q3r h ALA 222 Ca -0.05 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 54.81 2q3r h ALA 222 Cb 0.80 0.74 -0.12 0.00 0.00 0.00 0.00 17.79 19.21 2q3r h ALA 222 CO -0.02 -1.19 -0.01 0.28 0.00 0.00 0.00 179.25 178.31 2q3r h VAL 223 N -1.01 0.43 -0.34 0.00 2.07 -1.44 -0.84 116.25 115.11 2q3r h VAL 223 Ca -0.06 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 2q3r h VAL 223 Cb 0.88 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 2q3r h VAL 223 CO -0.07 0.02 0.13 0.00 0.02 0.00 0.00 177.57 177.67 2q3r h ALA 224 N 1.62 0.44 0.00 1.67 0.00 -1.24 -0.53 119.26 121.23 2q3r h ALA 224 Ca 0.36 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2q3r h ALA 224 Cb 0.59 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2q3r h ALA 224 CO -0.59 0.06 0.00 1.63 0.00 0.00 0.00 179.25 180.35 2q3r n LYS 225 N -4.68 0.04 -0.08 0.00 5.02 -0.66 0.21 118.16 118.00 2q3r n LYS 225 Ca -0.01 0.44 -0.11 0.00 -2.02 0.00 0.00 58.31 56.61 2q3r n LYS 225 Cb 0.15 -1.60 -0.15 0.00 -0.02 0.00 0.00 35.03 33.41 2q3r n LYS 225 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2q3r n GLU 226 N -1.67 0.68 0.00 1.97 4.07 -0.35 -4.73 120.64 120.61 2q3r n GLU 226 Ca 0.01 0.08 0.00 0.00 -0.06 0.00 0.00 57.16 57.19 2q3r n GLU 226 Cb 0.07 -1.58 0.00 0.00 -0.06 0.00 0.00 31.44 29.87 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 -2.88 0.00 0.00 6.31 -5.35 -0.40 -4.83 119.36 112.21 2q3r n ILE 227 Ca -0.31 -0.25 0.00 0.00 -0.27 0.00 0.00 62.75 61.92 2q3r n ILE 227 Cb 1.12 1.04 0.00 0.00 -1.74 0.00 0.00 39.64 40.05 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 0.47 2.09 0.27 3.28 0.00 0.57 -4.75 105.19 107.12 2q3r n GLY 228 Ca 0.00 -1.32 0.04 0.00 0.00 0.00 0.00 46.02 44.74 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 0.46 0.00 1.61 0.13 -1.92 -1.61 132.00 130.67 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 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.03 2q3r h PRO 229 CO 0.00 0.30 0.08 -0.40 -0.23 0.00 0.00 178.00 177.75 2q3r n ASP 230 N -4.98 0.00 -0.44 1.44 3.85 -1.26 0.44 116.55 115.60 2q3r n ASP 230 Ca 0.13 0.26 0.07 0.00 -0.71 0.00 0.00 54.79 54.54 2q3r n ASP 230 Cb 0.38 -0.26 0.18 0.00 -1.35 0.00 0.00 41.12 40.07 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 -1.22 1.41 -5.13 0.11 1.74 -0.61 -4.73 116.66 108.23 2q3r n ARG 231 Ca 0.00 -2.98 -0.30 0.00 -0.77 0.00 0.00 57.85 53.80 2q3r n ARG 231 Cb 0.08 -1.51 -0.17 0.00 -1.02 0.00 0.00 32.46 29.84 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 -2.96 1.89 0.10 1.55 1.01 0.17 -2.38 120.40 119.78 2q3r s VAL 232 Ca 0.35 -0.95 0.03 0.00 0.00 0.00 0.00 61.98 61.41 2q3r s VAL 232 Cb 0.33 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 2q3r s VAL 232 CO -0.04 0.53 -0.10 -0.83 0.00 0.00 0.00 175.10 174.66 2q3r s GLY 233 N 0.07 0.84 -0.02 4.51 0.00 -0.93 -1.71 107.32 110.09 2q3r s GLY 233 Ca -0.09 -1.21 0.01 0.00 0.00 0.00 0.00 44.72 43.42 2q3r s GLY 233 CO 0.05 -1.29 -0.02 -1.50 0.00 0.00 0.00 173.10 170.34 2q3r s ILE 234 N -2.61 0.23 -0.12 0.90 2.07 -0.94 0.01 121.20 120.75 2q3r s ILE 234 Ca 0.06 -0.04 -0.05 0.00 -1.41 0.00 0.00 60.65 59.21 2q3r s ILE 234 Cb -0.02 -0.26 -0.04 0.00 0.13 0.00 0.00 42.46 42.28 2q3r s ILE 234 CO -0.01 0.11 0.06 -0.60 -1.91 0.00 0.00 174.94 172.60 2q3r s ARG 235 N 0.43 3.35 0.09 3.50 3.52 -0.60 0.45 118.95 129.69 2q3r s ARG 235 Ca -0.04 -0.30 0.03 0.00 -0.13 0.00 0.00 55.73 55.29 2q3r s ARG 235 Cb -0.07 -3.02 -0.04 0.00 -1.56 0.00 0.00 34.95 30.26 2q3r s ARG 235 CO -0.01 0.64 -0.08 -0.51 -0.81 0.00 0.00 175.30 174.53 2q3r s LEU 236 N -0.67 2.41 -0.41 -0.88 1.43 0.42 -1.92 118.68 119.05 2q3r s LEU 236 Ca 0.12 -0.83 0.09 0.00 -1.03 0.00 0.00 54.13 52.47 2q3r s LEU 236 Cb -0.12 -0.20 0.30 0.00 0.03 0.00 0.00 46.19 46.20 2q3r s LEU 236 CO 0.02 -0.32 0.80 -1.54 0.23 0.00 0.00 176.35 175.54 2q3r n SER 237 N 0.51 -0.65 0.33 2.29 3.41 -1.26 -2.60 113.62 115.65 2q3r n SER 237 Ca -0.16 -3.14 0.22 0.00 -0.26 0.00 0.00 58.87 55.52 2q3r n SER 237 Cb 0.58 0.35 1.17 0.00 -0.26 0.00 0.00 64.21 66.06 2q3r n SER 237 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 2q3r h PRO 238 N 3.39 0.00 -0.00 4.33 0.13 -1.90 -2.42 132.00 135.53 2q3r h PRO 238 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 2q3r h PRO 238 Cb 0.99 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.12 2q3r h PRO 238 CO 0.38 0.00 -0.87 1.19 -0.23 0.00 0.00 178.00 178.47 2q3r n PHE 239 N -3.18 0.00 -2.34 1.56 3.01 -1.26 -4.41 117.46 110.83 2q3r n PHE 239 Ca -0.03 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 58.18 2q3r n PHE 239 Cb 0.08 -0.06 0.05 0.00 -0.01 0.00 0.00 39.48 39.54 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 -2.99 3.30 -0.01 4.37 0.00 -0.91 -4.74 121.76 120.77 2q3r s ALA 240 Ca 0.09 -0.87 0.04 0.00 0.00 0.00 0.00 51.96 51.22 2q3r s ALA 240 Cb 0.16 -2.54 0.07 0.00 0.00 0.00 0.00 23.12 20.82 2q3r s ALA 240 CO 0.82 -1.02 1.03 -0.40 0.00 0.00 0.00 175.76 176.19 2q3r n ASP 241 N -2.71 0.31 -4.62 0.00 5.75 -1.26 -3.75 116.55 110.27 2q3r n ASP 241 Ca 0.06 -2.11 -0.51 0.00 -0.01 0.00 0.00 54.79 52.23 2q3r n ASP 241 Cb 0.59 -0.23 -0.05 0.00 -1.03 0.00 0.00 41.12 40.39 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 -0.08 1.80 -3.35 2.11 9.36 -1.26 -1.40 117.16 124.34 2q3r n TYR 242 Ca 0.02 0.50 -0.16 0.00 3.32 0.00 0.00 57.90 61.58 2q3r n TYR 242 Cb 0.74 -2.41 0.08 0.00 -0.63 0.00 0.00 39.34 37.11 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 3.13 -4.39 -4.26 2.98 2.81 -1.26 -3.17 117.12 112.96 2q3r n MET 243 Ca 0.19 0.85 -0.35 0.00 -1.81 0.00 0.00 57.70 56.58 2q3r n MET 243 Cb 0.22 -5.83 -0.07 0.00 -0.71 0.00 0.00 33.22 26.83 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 -3.68 -0.81 -0.29 0.03 1.02 -0.49 -4.84 120.64 111.57 2q3r n GLU 244 Ca -0.18 0.09 0.07 0.00 -0.02 0.00 0.00 57.16 57.12 2q3r n GLU 244 Cb 0.64 -3.33 0.20 0.00 -0.02 0.00 0.00 31.44 28.93 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 -2.71 3.30 -4.76 1.62 3.41 -0.87 -4.78 113.62 108.83 2q3r n SER 245 Ca -0.28 -2.59 -0.41 0.00 -0.26 0.00 0.00 58.87 55.33 2q3r n SER 245 Cb 0.67 -0.39 -0.03 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 -1.61 2.93 -0.02 5.00 0.00 -1.25 -4.59 107.32 107.79 2q3r s GLY 246 Ca 0.32 1.13 -0.01 0.00 0.00 0.00 0.00 44.72 46.16 2q3r s GLY 246 CO 0.10 1.81 0.07 -0.35 0.00 0.00 0.00 173.10 174.74 2q3r s ASP 247 N -0.46 5.65 0.00 1.64 -1.08 -1.26 -4.23 116.67 116.92 2q3r s ASP 247 Ca 0.49 0.16 0.07 0.00 -0.52 0.00 0.00 52.55 52.74 2q3r s ASP 247 Cb -0.37 -1.63 0.41 0.00 -1.46 0.00 0.00 42.92 39.88 2q3r s ASP 247 CO 0.47 0.29 1.26 0.35 0.52 0.00 0.00 175.17 178.06 2q3r n THR 248 N 1.32 0.00 -2.84 1.71 -2.24 -1.26 -3.90 114.28 107.07 2q3r n THR 248 Ca -0.14 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.53 2q3r n THR 248 Cb 0.53 -0.11 0.03 0.00 -2.10 0.00 0.00 70.33 68.67 2q3r n THR 248 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2q3r n ASN 249 N -0.61 -2.19 0.15 3.42 3.02 -1.26 -4.99 115.26 112.80 2q3r n ASN 249 Ca 0.05 -3.21 0.01 0.00 -0.03 0.00 0.00 54.58 51.39 2q3r n ASN 249 Cb 0.02 1.31 0.22 0.00 -0.61 0.00 0.00 39.78 40.73 2q3r n ASN 249 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2q3r h PRO 250 N 3.90 0.00 -0.18 3.52 0.13 -1.77 -2.70 132.00 134.91 2q3r h PRO 250 Ca -0.10 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.96 2q3r h PRO 250 Cb 1.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.13 2q3r h PRO 250 CO 0.34 0.55 -0.16 0.78 -0.23 0.00 0.00 178.00 179.27 2q3r h GLY 251 N 1.83 0.46 1.01 1.56 0.00 -1.94 -0.97 103.07 105.02 2q3r h GLY 251 Ca -0.01 -0.47 -0.06 0.00 0.00 0.00 0.00 47.33 46.80 2q3r h GLY 251 CO 0.07 0.42 0.11 0.00 0.00 0.00 0.00 176.54 177.14 2q3r h ALA 252 N 0.64 0.73 0.38 3.60 0.00 -1.98 -0.95 119.26 121.67 2q3r h ALA 252 Ca 0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 2q3r h ALA 252 Cb 0.70 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2q3r h ALA 252 CO 0.04 0.46 -0.18 1.25 0.00 0.00 0.00 179.25 180.81 2q3r h LEU 253 N 0.80 -0.44 -1.22 0.00 5.85 -1.51 0.49 115.31 119.27 2q3r h LEU 253 Ca 0.17 -0.02 0.11 0.00 0.84 0.00 0.00 57.88 58.98 2q3r h LEU 253 Cb 0.38 0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.46 2q3r h LEU 253 CO 0.01 -0.26 0.57 1.23 -0.34 0.00 0.00 178.44 179.64 2q3r h GLY 254 N -0.57 1.26 0.20 3.75 0.00 -0.97 -1.51 103.07 105.23 2q3r h GLY 254 Ca -0.05 -0.35 -0.00 0.00 0.00 0.00 0.00 47.33 46.93 2q3r h GLY 254 CO 0.09 0.18 -0.02 -2.00 0.00 0.00 0.00 176.54 174.78 2q3r h LEU 255 N 0.83 -0.05 -0.74 3.11 5.85 -1.01 -1.64 115.31 121.66 2q3r h LEU 255 Ca 0.42 -0.62 0.14 0.00 0.84 0.00 0.00 57.88 58.66 2q3r h LEU 255 Cb 0.47 0.01 -0.09 0.00 0.37 0.00 0.00 40.66 41.42 2q3r h LEU 255 CO -0.18 0.67 0.29 0.22 -0.34 0.00 0.00 178.44 179.10 2q3r h TYR 256 N -0.87 0.49 -0.21 1.25 3.20 -0.66 0.48 116.97 120.66 2q3r h TYR 256 Ca -0.01 0.04 -0.20 0.00 3.14 0.00 0.00 58.73 61.70 2q3r h TYR 256 Cb 0.67 -0.10 0.01 0.00 1.54 0.00 0.00 36.73 38.84 2q3r h TYR 256 CO 0.16 0.06 -0.65 0.52 -1.64 0.00 0.00 178.16 176.61 2q3r h MET 257 N 0.43 0.81 0.00 1.82 2.86 -1.38 0.15 114.93 119.61 2q3r h MET 257 Ca 0.41 -0.59 0.00 0.00 -2.06 0.00 0.00 59.70 57.46 2q3r h MET 257 Cb 0.61 0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.37 2q3r h MET 257 CO -0.40 1.21 0.00 0.00 1.06 0.00 0.00 176.91 178.78 2q3r n ALA 258 N -2.58 1.56 -0.11 6.32 0.00 -0.55 -2.01 120.51 123.12 2q3r n ALA 258 Ca -0.06 0.01 -0.17 0.00 0.00 0.00 0.00 53.44 53.22 2q3r n ALA 258 Cb 0.68 -1.26 -0.10 0.00 0.00 0.00 0.00 19.45 18.76 2q3r n ALA 258 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2q3r n GLU 259 N -1.77 0.56 0.24 0.00 1.02 0.05 -1.41 120.64 119.32 2q3r n GLU 259 Ca 0.02 0.15 0.08 0.00 -0.02 0.00 0.00 57.16 57.39 2q3r n GLU 259 Cb 0.16 -1.44 0.60 0.00 -0.02 0.00 0.00 31.44 30.74 2q3r n GLU 259 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 2q3r h SER 260 N -0.14 0.00 0.00 1.62 0.02 -0.50 -2.39 113.55 112.16 2q3r h SER 260 Ca -0.52 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.43 2q3r h SER 260 Cb 1.74 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.28 2q3r h SER 260 CO -0.13 0.14 0.00 0.18 -1.14 0.00 0.00 176.83 175.89 2q3r n LEU 261 N -4.13 0.00 0.03 5.07 4.77 -0.85 -3.39 117.00 118.49 2q3r n LEU 261 Ca -0.02 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.74 2q3r n LEU 261 Cb 0.22 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.17 2q3r n LEU 261 CO 0.34 0.00 -0.35 0.78 -1.33 0.00 0.00 177.39 176.83 2q3r h ASN 262 N 0.00 0.43 -1.06 -1.43 2.35 -1.70 -3.14 115.58 111.04 2q3r h ASN 262 Ca 0.00 -0.88 0.33 0.00 -0.55 0.00 0.00 56.30 55.20 2q3r h ASN 262 Cb 0.00 -0.14 -0.14 0.00 0.05 0.00 0.00 38.32 38.09 2q3r h ASN 262 CO 0.00 1.60 0.63 0.50 -1.65 0.00 0.00 177.43 178.51 2q3r h LYS 263 N -0.26 0.29 0.00 0.81 3.64 -1.77 0.53 116.57 119.81 2q3r h LYS 263 Ca -0.28 -0.02 -0.17 0.00 -1.27 0.00 0.00 60.65 58.92 2q3r h LYS 263 Cb 1.79 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 33.52 2q3r h LYS 263 CO 0.09 0.19 -0.88 1.88 -2.27 0.00 0.00 179.45 178.47 2q3r h TYR 264 N 0.30 0.00 -5.73 1.91 -1.99 -1.78 -3.48 116.97 106.19 2q3r h TYR 264 Ca 0.73 0.00 -0.35 0.00 2.00 0.00 0.00 58.73 61.11 2q3r h TYR 264 Cb 1.79 0.00 0.15 0.00 2.00 0.00 0.00 36.73 40.67 2q3r h TYR 264 CO -0.01 0.75 -0.75 0.41 -0.00 0.00 0.00 178.16 178.56 2q3r n GLY 265 N 1.32 -0.40 3.86 3.88 0.00 0.18 -4.92 105.19 109.11 2q3r n GLY 265 Ca -0.01 0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.37 1.95 0.09 -0.61 -4.36 -1.26 -4.62 121.20 109.02 2q3r s ILE 266 Ca 0.15 0.00 -0.16 0.00 -0.26 0.00 0.00 60.65 60.37 2q3r s ILE 266 Cb -0.06 -2.89 -0.08 0.00 1.25 0.00 0.00 42.46 40.67 2q3r s ILE 266 CO 0.74 0.00 1.44 0.25 0.24 0.00 0.00 174.94 177.61 2q3r h LEU 267 N -1.63 0.62 -7.47 0.37 5.85 -1.37 -3.46 115.31 108.22 2q3r h LEU 267 Ca -0.46 -0.42 -0.03 0.00 0.84 0.00 0.00 57.88 57.81 2q3r h LEU 267 Cb 1.28 -0.17 -0.11 0.00 0.37 0.00 0.00 40.66 42.02 2q3r h LEU 267 CO 0.47 0.91 0.03 -0.72 -0.34 0.00 0.00 178.44 178.79 2q3r s TYR 268 N -4.54 -0.22 -0.42 1.25 -0.85 -1.18 -2.38 117.35 109.01 2q3r s TYR 268 Ca -0.13 -0.09 0.02 0.00 -0.52 0.00 0.00 57.07 56.35 2q3r s TYR 268 Cb 0.08 0.38 0.12 0.00 0.38 0.00 0.00 41.96 42.93 2q3r s TYR 268 CO 0.80 -0.84 0.19 0.00 -1.52 0.00 0.00 175.55 174.18 2q3r s HIS 270 N 0.47 3.02 -0.04 0.00 2.46 0.17 -4.43 115.29 116.95 2q3r s HIS 270 Ca 0.15 1.04 0.05 0.00 0.47 0.00 0.00 55.06 56.78 2q3r s HIS 270 Cb -0.23 -3.52 -0.01 0.00 -0.13 0.00 0.00 32.58 28.69 2q3r s HIS 270 CO -0.05 -1.78 -0.20 0.08 -2.47 0.00 0.00 174.74 170.32 2q3r s VAL 271 N 2.41 1.66 -0.04 0.89 1.01 -1.20 -0.44 120.40 124.70 2q3r s VAL 271 Ca 0.59 -0.86 -0.15 0.00 0.00 0.00 0.00 61.98 61.55 2q3r s VAL 271 Cb -0.27 -1.40 -0.05 0.00 0.00 0.00 0.00 36.38 34.66 2q3r s VAL 271 CO 0.23 0.47 0.40 -0.63 0.00 0.00 0.00 175.10 175.57 2q3r s ILE 272 N -0.20 5.10 0.53 2.22 1.01 -1.07 -3.70 121.20 125.09 2q3r s ILE 272 Ca 0.00 0.81 -0.21 0.00 0.00 0.00 0.00 60.65 61.26 2q3r s ILE 272 Cb -0.11 -3.71 -0.05 0.00 0.01 0.00 0.00 42.46 38.59 2q3r s ILE 272 CO 0.01 0.52 1.22 -0.70 0.00 0.00 0.00 174.94 175.99 2q3r s GLU 273 N -0.63 3.32 0.18 2.79 2.56 -1.11 -4.86 118.70 120.96 2q3r s GLU 273 Ca 0.23 1.88 -0.03 0.00 0.00 0.00 0.00 54.97 57.05 2q3r s GLU 273 Cb -0.16 -2.18 0.04 0.00 2.00 0.00 0.00 34.13 33.84 2q3r s GLU 273 CO 0.12 -0.94 0.24 0.00 -0.56 0.00 0.00 175.26 174.12 2q3r n ALA 274 N -1.05 -0.31 -1.23 6.30 0.00 -1.26 -4.88 120.51 118.08 2q3r n ALA 274 Ca 0.10 -0.31 -0.36 0.00 0.00 0.00 0.00 53.44 52.87 2q3r n ALA 274 Cb 0.48 -0.02 -0.02 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 -1.56 2.63 0.00 0.00 1.74 -1.26 -5.10 116.66 113.12 2q3r n ARG 275 Ca 0.03 -2.04 0.00 0.00 -0.77 0.00 0.00 57.85 55.07 2q3r n ARG 275 Cb 0.10 -2.85 0.00 0.00 -1.02 0.00 0.00 32.46 28.69 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 5.05 0.00 -1.49 5.56 0.00 -1.26 -5.24 117.12 119.74 2q3r n MET 276 Ca 0.57 0.00 -0.40 0.00 0.00 0.00 0.00 57.70 57.87 2q3r n MET 276 Cb 0.28 0.00 0.02 0.00 0.00 0.00 0.00 33.22 33.52 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 -0.26 0.03 3.17 -0.00 -1.26 -5.06 115.22 111.84 2q3r n HIS 287 Ca 0.00 0.53 0.00 0.00 -0.00 0.00 0.00 57.72 58.25 2q3r n HIS 287 Cb 0.00 -2.02 0.00 0.00 -0.00 0.00 0.00 29.99 27.97 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 -1.13 0.00 0.05 3.57 5.66 -1.26 -5.02 114.28 116.15 2q3r n THR 288 Ca 0.11 0.00 -0.03 0.00 -3.05 0.00 0.00 64.05 61.08 2q3r n THR 288 Cb 0.43 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.12 2q3r n THR 288 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 2q3r h LEU 289 N 0.00 0.00 -0.46 1.09 4.07 -2.01 -3.40 115.31 114.61 2q3r h LEU 289 Ca 0.00 0.00 0.09 0.00 0.08 0.00 0.00 57.88 58.05 2q3r h LEU 289 Cb 0.00 0.00 -0.10 0.00 1.08 0.00 0.00 40.66 41.64 2q3r h LEU 289 CO 0.00 0.77 -0.24 0.24 -1.08 0.00 0.00 178.44 178.13 2q3r h MET 290 N 0.00 -0.14 -0.75 1.13 2.86 -1.95 0.59 114.93 116.67 2q3r h MET 290 Ca -0.12 0.01 0.13 0.00 -2.06 0.00 0.00 59.70 57.65 2q3r h MET 290 Cb 1.70 0.03 -0.09 0.00 0.06 0.00 0.00 31.60 33.30 2q3r h MET 290 CO 0.08 -0.09 0.33 -1.35 1.06 0.00 0.00 176.91 176.93 2q3r h PRO 291 N -0.14 0.49 -0.20 -0.22 0.11 -1.99 0.17 132.00 130.21 2q3r h PRO 291 Ca 0.21 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 66.20 2q3r h PRO 291 Cb 0.48 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.48 2q3r h PRO 291 CO -0.54 0.32 -0.25 0.52 -0.21 0.00 0.00 178.00 177.83 2q3r h MET 292 N 0.50 0.52 0.00 1.05 2.86 -1.46 0.53 114.93 118.94 2q3r h MET 292 Ca 0.40 -0.30 -0.00 0.00 -2.06 0.00 0.00 59.70 57.74 2q3r h MET 292 Cb 0.56 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.24 2q3r h MET 292 CO -0.36 0.89 -0.00 -0.09 1.06 0.00 0.00 176.91 178.40 2q3r h ARG 293 N 0.19 0.00 0.00 1.72 9.65 0.12 -1.50 114.38 124.56 2q3r h ARG 293 Ca 0.02 0.00 -0.36 0.00 -1.10 0.00 0.00 59.98 58.54 2q3r h ARG 293 Cb 0.82 0.00 -0.07 0.00 -1.39 0.00 0.00 29.97 29.33 2q3r h ARG 293 CO 0.06 0.00 -2.37 1.63 2.80 0.00 0.00 179.97 182.10 2q3r n LYS 294 N -3.13 0.70 0.37 0.20 5.02 0.49 -4.67 118.16 117.15 2q3r n LYS 294 Ca -0.02 0.09 -0.14 0.00 -2.02 0.00 0.00 58.31 56.22 2q3r n LYS 294 Cb 0.13 -1.49 -0.07 0.00 -0.02 0.00 0.00 35.03 33.58 2q3r n LYS 294 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2q3r h ALA 295 N 0.30 -1.25 -2.63 7.82 0.00 0.62 -3.43 119.26 120.70 2q3r h ALA 295 Ca -0.54 -0.20 -0.53 0.00 0.00 0.00 0.00 54.91 53.64 2q3r h ALA 295 Cb 1.96 0.38 0.04 0.00 0.00 0.00 0.00 17.79 20.16 2q3r h ALA 295 CO -0.05 -1.18 0.81 0.12 0.00 0.00 0.00 179.25 178.95 2q3r s PHE 296 N -5.06 3.09 -0.85 0.00 5.36 -0.50 -4.79 117.98 115.22 2q3r s PHE 296 Ca -0.14 0.80 -0.17 0.00 -0.96 0.00 0.00 56.93 56.47 2q3r s PHE 296 Cb 0.01 -3.84 0.16 0.00 -0.34 0.00 0.00 43.02 39.01 2q3r s PHE 296 CO 0.42 -2.99 0.93 0.15 -1.46 0.00 0.00 175.22 172.27 2q3r s LYS 297 N 0.72 3.53 0.00 10.12 -0.14 -1.26 -4.88 119.74 127.83 2q3r s LYS 297 Ca 0.66 -1.98 0.00 0.00 -1.36 0.00 0.00 55.97 53.29 2q3r s LYS 297 Cb -0.42 -4.64 0.00 0.00 -1.68 0.00 0.00 37.83 31.09 2q3r s LYS 297 CO 0.34 -1.55 0.00 0.41 -0.76 0.00 0.00 175.35 173.79 2q3r n GLY 298 N 4.86 -1.97 3.53 -3.33 0.00 -1.26 -4.91 105.19 102.11 2q3r n GLY 298 Ca 0.16 -1.19 -0.38 0.00 0.00 0.00 0.00 46.02 44.61 2q3r n GLY 298 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2q3r n THR 299 N 2.61 2.90 -3.73 2.61 -1.04 -1.00 -4.95 114.28 111.68 2q3r n THR 299 Ca 0.00 -0.50 -0.15 0.00 -2.04 0.00 0.00 64.05 61.36 2q3r n THR 299 Cb 0.00 -0.88 -0.15 0.00 -1.82 0.00 0.00 70.33 67.48 2q3r n THR 299 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 2q3r s PHE 300 N -1.64 -0.09 -0.09 -1.42 5.36 -1.26 -3.76 117.98 115.08 2q3r s PHE 300 Ca 0.72 0.40 0.03 0.00 -0.96 0.00 0.00 56.93 57.11 2q3r s PHE 300 Cb -0.43 -0.20 -0.02 0.00 -0.34 0.00 0.00 43.02 42.04 2q3r s PHE 300 CO 0.51 -0.17 -0.17 0.42 -1.46 0.00 0.00 175.22 174.35 2q3r s ILE 301 N 1.47 2.74 0.09 3.12 1.01 -1.26 -0.06 121.20 128.32 2q3r s ILE 301 Ca -0.05 -0.81 0.02 0.00 0.00 0.00 0.00 60.65 59.81 2q3r s ILE 301 Cb -0.12 -2.08 -0.04 0.00 0.01 0.00 0.00 42.46 40.23 2q3r s ILE 301 CO -0.05 0.56 0.15 -0.44 0.00 0.00 0.00 174.94 175.16 2q3r s SER 302 N -0.11 5.88 0.01 3.58 0.01 0.19 -3.21 113.70 120.06 2q3r s SER 302 Ca -0.03 0.08 -0.29 0.00 1.31 0.00 0.00 55.95 57.03 2q3r s SER 302 Cb -0.14 -1.68 0.10 0.00 0.21 0.00 0.00 66.02 64.51 2q3r s SER 302 CO 0.04 0.14 0.98 0.00 0.41 0.00 0.00 173.24 174.81 2q3r s ALA 303 N -1.52 -1.85 0.00 1.44 0.00 -1.24 0.15 121.76 118.74 2q3r s ALA 303 Ca 0.32 0.82 0.00 0.00 0.00 0.00 0.00 51.96 53.10 2q3r s ALA 303 Cb -0.12 0.40 0.00 0.00 0.00 0.00 0.00 23.12 23.40 2q3r s ALA 303 CO 0.25 -0.81 0.00 0.41 0.00 0.00 0.00 175.76 175.61 2q3r n GLY 304 N -0.31 -0.69 3.18 0.00 0.00 -1.26 -2.75 105.19 103.37 2q3r n GLY 304 Ca -0.07 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.25 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 0.68 0.85 3.76 -0.02 0.00 -1.26 -4.48 105.19 104.71 2q3r n GLY 305 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.47 3.47 0.45 1.61 0.40 -1.26 -5.05 117.98 114.13 2q3r s PHE 306 Ca 0.00 1.66 0.08 0.00 -0.60 0.00 0.00 56.93 58.06 2q3r s PHE 306 Cb 0.00 -3.32 0.00 0.00 0.51 0.00 0.00 43.02 40.21 2q3r s PHE 306 CO 0.00 -0.74 0.45 0.95 0.70 0.00 0.00 175.22 176.57 2q3r s THR 307 N -1.21 2.47 0.10 0.64 -4.23 -1.26 -4.95 115.64 107.20 2q3r s THR 307 Ca 0.47 -1.30 -0.31 0.00 -1.18 0.00 0.00 61.69 59.37 2q3r s THR 307 Cb -0.32 -2.77 -0.13 0.00 1.34 0.00 0.00 72.50 70.62 2q3r s THR 307 CO 0.41 0.00 1.61 -0.09 -0.54 0.00 0.00 174.62 176.01 2q3r h ARG 308 N 0.85 -0.70 -0.36 3.99 2.43 -1.98 -1.33 114.38 117.27 2q3r h ARG 308 Ca -0.39 0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 58.78 2q3r h ARG 308 Cb 1.28 0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 30.97 2q3r h ARG 308 CO 0.54 -0.47 0.05 0.93 -1.51 0.00 0.00 179.97 179.51 2q3r h GLU 309 N -0.73 0.55 -0.41 0.20 3.07 -1.96 0.79 114.58 116.08 2q3r h GLU 309 Ca -0.02 -0.10 0.08 0.00 -0.50 0.00 0.00 59.36 58.82 2q3r h GLU 309 Cb 0.66 -0.09 -0.09 0.00 -0.84 0.00 0.00 28.75 28.39 2q3r h GLU 309 CO -0.07 0.54 -0.28 -0.44 -1.40 0.00 0.00 179.01 177.35 2q3r h ASP 310 N 0.53 -0.95 1.51 1.42 3.32 -1.78 -0.62 116.42 119.85 2q3r h ASP 310 Ca 0.12 0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.35 2q3r h ASP 310 Cb 0.27 0.46 0.00 0.00 0.22 0.00 0.00 39.33 40.28 2q3r h ASP 310 CO 0.00 -0.29 -0.46 1.23 -1.72 0.00 0.00 179.24 178.01 2q3r h GLY 311 N -0.21 0.00 1.63 2.75 0.00 -0.50 -0.25 103.07 106.49 2q3r h GLY 311 Ca 0.19 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.49 2q3r h GLY 311 CO -0.53 0.00 0.08 3.43 0.00 0.00 0.00 176.54 179.52 2q3r h ASN 312 N 0.00 0.44 0.00 0.19 2.35 0.18 -2.73 115.58 116.01 2q3r h ASN 312 Ca 0.00 -0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 55.66 2q3r h ASN 312 Cb 0.99 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 39.24 2q3r h ASN 312 CO 0.00 0.44 -1.98 -0.62 -1.65 0.00 0.00 177.43 173.63 2q3r n GLU 313 N -4.36 0.65 -0.28 0.81 -0.58 -0.36 -4.27 120.64 112.26 2q3r n GLU 313 Ca 0.02 -0.17 -0.05 0.00 -0.42 0.00 0.00 57.16 56.54 2q3r n GLU 313 Cb 0.17 -1.49 0.06 0.00 -0.57 0.00 0.00 31.44 29.62 2q3r n GLU 313 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2q3r h ALA 314 N 1.77 0.97 0.00 0.62 0.00 -0.72 -3.11 119.26 118.79 2q3r h ALA 314 Ca -0.06 -0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.59 2q3r h ALA 314 Cb 1.07 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 2q3r h ALA 314 CO 0.00 0.43 -1.20 0.28 0.00 0.00 0.00 179.25 178.76 2q3r h VAL 315 N 1.04 0.75 0.00 0.00 2.07 -1.75 -3.29 116.25 115.07 2q3r h VAL 315 Ca 0.27 -2.29 0.00 0.00 0.82 0.00 0.00 66.70 65.50 2q3r h VAL 315 Cb -0.04 2.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.98 2q3r h VAL 315 CO -0.05 0.43 0.00 -1.54 0.02 0.00 0.00 177.57 176.43 2q3r n SER 316 N -3.04 0.25 -0.77 0.57 3.41 -1.18 -1.17 113.62 111.70 2q3r n SER 316 Ca -0.07 0.60 0.08 0.00 -0.26 0.00 0.00 58.87 59.22 2q3r n SER 316 Cb 0.86 -0.64 0.14 0.00 -0.26 0.00 0.00 64.21 64.30 2q3r n SER 316 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2q3r n LYS 317 N -1.82 1.95 -1.00 4.33 4.76 -1.24 -4.97 118.16 120.17 2q3r n LYS 317 Ca 0.00 -1.84 0.00 0.00 -2.87 0.00 0.00 58.31 53.61 2q3r n LYS 317 Cb 0.06 -1.34 0.00 0.00 -1.84 0.00 0.00 35.03 31.90 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 0.93 0.39 0.14 0.72 0.00 -0.31 -4.88 105.19 102.18 2q3r n GLY 318 Ca 0.13 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.27 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 0.80 0.00 -3.39 1.61 3.08 -1.77 -3.46 114.38 111.25 2q3r h ARG 319 Ca 0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 2q3r h ARG 319 Cb 0.22 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 30.11 2q3r h ARG 319 CO 0.00 0.00 -0.25 -0.08 -1.07 0.00 0.00 179.97 178.57 2q3r s THR 320 N -3.15 0.09 -0.16 2.04 -1.32 -1.24 -4.94 115.64 106.96 2q3r s THR 320 Ca 0.09 -0.74 0.03 0.00 -1.21 0.00 0.00 61.69 59.86 2q3r s THR 320 Cb 0.10 -1.02 -0.12 0.00 -1.51 0.00 0.00 72.50 69.95 2q3r s THR 320 CO 0.64 -0.41 -0.11 0.47 -2.21 0.00 0.00 174.62 173.00 2q3r n ASP 321 N 0.40 2.55 -4.25 8.08 8.00 0.92 -4.44 116.55 127.82 2q3r n ASP 321 Ca -0.18 -0.07 -0.14 0.00 0.71 0.00 0.00 54.79 55.11 2q3r n ASP 321 Cb 0.60 -0.03 -0.10 0.00 -0.02 0.00 0.00 41.12 41.57 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 -5.74 2.39 -0.12 0.64 1.43 -0.63 -4.79 118.68 111.86 2q3r s LEU 322 Ca -0.19 -1.08 0.00 0.00 -1.03 0.00 0.00 54.13 51.84 2q3r s LEU 322 Cb 0.05 -0.23 0.02 0.00 0.03 0.00 0.00 46.19 46.06 2q3r s LEU 322 CO 0.41 -0.43 -0.11 -0.69 0.23 0.00 0.00 176.35 175.76 2q3r s VAL 323 N -3.45 1.27 -0.26 -1.59 1.01 0.37 0.54 120.40 118.29 2q3r s VAL 323 Ca 0.19 -0.46 -0.12 0.00 0.00 0.00 0.00 61.98 61.59 2q3r s VAL 323 Cb 0.04 -1.22 -0.05 0.00 0.00 0.00 0.00 36.38 35.15 2q3r s VAL 323 CO 0.02 0.41 0.25 0.00 0.00 0.00 0.00 175.10 175.77 2q3r s ALA 324 N 1.43 3.56 -0.15 5.51 0.00 0.39 0.12 121.76 132.62 2q3r s ALA 324 Ca 0.01 -0.91 -0.04 0.00 0.00 0.00 0.00 51.96 51.03 2q3r s ALA 324 Cb -0.13 -2.51 -0.03 0.00 0.00 0.00 0.00 23.12 20.45 2q3r s ALA 324 CO -0.07 -0.45 -0.02 0.71 0.00 0.00 0.00 175.76 175.93 2q3r s TYR 325 N 1.58 3.06 0.00 0.00 2.02 0.14 -4.13 117.35 120.02 2q3r s TYR 325 Ca 0.10 -0.23 0.00 0.00 -0.37 0.00 0.00 57.07 56.58 2q3r s TYR 325 Cb -0.15 -1.96 0.00 0.00 -0.40 0.00 0.00 41.96 39.45 2q3r s TYR 325 CO 0.09 0.01 0.00 0.41 -1.57 0.00 0.00 175.55 174.49 2q3r n GLY 326 N 3.46 -0.30 0.30 0.71 0.00 -1.26 -1.93 105.19 106.17 2q3r n GLY 326 Ca -0.17 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.02 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 0.01 1.61 3.08 -1.96 0.53 114.38 117.65 2q3r h ARG 327 Ca 0.00 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.77 2q3r h ARG 327 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 2q3r h ARG 327 CO 0.00 0.03 -1.62 -1.49 -1.07 0.00 0.00 179.97 175.83 2q3r h TRP 328 N 0.00 0.04 0.07 3.04 -0.00 -1.94 -3.18 115.95 113.98 2q3r h TRP 328 Ca -0.00 -0.03 -0.24 0.00 -0.00 0.00 0.00 58.89 58.62 2q3r h TRP 328 Cb 0.12 -0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 29.27 2q3r h TRP 328 CO 0.00 1.05 -1.11 0.35 -0.00 0.00 0.00 178.44 178.73 2q3r h PHE 329 N 0.01 0.36 -0.28 0.49 3.04 -1.66 0.01 116.94 118.90 2q3r h PHE 329 Ca -0.25 -0.25 0.05 0.00 3.98 0.00 0.00 57.97 61.50 2q3r h PHE 329 Cb 1.98 -0.02 -0.04 0.00 2.56 0.00 0.00 35.95 40.43 2q3r h PHE 329 CO 0.01 1.16 0.01 1.25 -2.02 0.00 0.00 178.31 178.71 2q3r h LEU 330 N 0.07 -0.10 0.00 0.59 6.46 -1.02 -2.66 115.31 118.66 2q3r h LEU 330 Ca -0.09 0.06 -0.00 0.00 -0.12 0.00 0.00 57.88 57.73 2q3r h LEU 330 Cb 1.82 0.11 -0.00 0.00 -0.73 0.00 0.00 40.66 41.86 2q3r h LEU 330 CO 0.17 -0.02 -0.14 0.00 -0.62 0.00 0.00 178.44 177.83 2q3r h ALA 331 N 1.24 0.93 -3.11 1.25 0.00 -1.55 -3.42 119.26 114.59 2q3r h ALA 331 Ca 0.14 -0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.42 2q3r h ALA 331 Cb 0.17 -0.00 -0.40 0.00 0.00 0.00 0.00 17.79 17.56 2q3r h ALA 331 CO -0.22 0.00 -0.71 -0.80 0.00 0.00 0.00 179.25 177.52 2q3r s ASN 332 N -6.09 3.86 0.26 0.00 0.01 -0.02 -4.59 114.94 108.37 2q3r s ASN 332 Ca 0.06 -2.67 -0.02 0.00 -0.71 0.00 0.00 52.86 49.52 2q3r s ASN 332 Cb 0.06 -1.20 0.52 0.00 0.41 0.00 0.00 41.25 41.04 2q3r s ASN 332 CO 0.69 -0.27 1.74 1.55 -1.51 0.00 0.00 177.10 179.30 2q3r h PRO 333 N 6.75 0.49 -1.20 -0.60 0.13 -1.78 0.12 132.00 135.91 2q3r h PRO 333 Ca -0.03 -0.03 -0.43 0.00 -0.87 0.00 0.00 66.00 64.64 2q3r h PRO 333 Cb 0.92 -0.11 -0.20 0.00 0.13 0.00 0.00 31.00 31.74 2q3r h PRO 333 CO 0.53 0.33 0.55 -0.40 -0.23 0.00 0.00 178.00 178.78 2q3r n ASP 334 N -4.96 5.74 -0.25 1.44 3.85 -1.26 -3.96 116.55 117.17 2q3r n ASP 334 Ca 0.16 -3.27 0.05 0.00 -0.71 0.00 0.00 54.79 51.03 2q3r n ASP 334 Cb 0.45 -0.92 0.17 0.00 -1.35 0.00 0.00 41.12 39.48 2q3r n ASP 334 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.20 176.44 2q3r h LEU 335 N 1.85 -0.04 -0.37 -2.12 5.85 -1.08 -1.20 115.31 118.20 2q3r h LEU 335 Ca 0.43 0.15 0.05 0.00 0.84 0.00 0.00 57.88 59.35 2q3r h LEU 335 Cb 1.37 0.22 -0.05 0.00 0.37 0.00 0.00 40.66 42.58 2q3r h LEU 335 CO 0.98 -0.06 0.10 -0.65 -0.34 0.00 0.00 178.44 178.47 2q3r h PRO 336 N 0.24 0.23 -0.05 5.25 0.11 -1.85 -0.09 132.00 135.84 2q3r h PRO 336 Ca 0.41 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.51 2q3r h PRO 336 Cb 0.70 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.76 2q3r h PRO 336 CO -0.53 0.15 0.00 1.17 -0.21 0.00 0.00 178.00 178.58 2q3r n LYS 337 N -5.06 0.08 0.04 1.05 4.81 -0.46 -2.60 118.16 116.03 2q3r n LYS 337 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.46 2q3r n LYS 337 Cb 0.15 -1.02 0.00 0.00 0.02 0.00 0.00 35.03 34.18 2q3r n LYS 337 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2q3r n ARG 338 N 0.06 0.00 0.00 1.64 1.74 -0.08 -4.66 116.66 115.35 2q3r n ARG 338 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2q3r n ARG 338 Cb 0.01 -0.36 0.00 0.00 -1.02 0.00 0.00 32.46 31.09 2q3r n ARG 338 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2q3r n PHE 339 N -3.21 0.00 0.09 -1.55 3.72 -0.98 0.11 117.46 115.64 2q3r n PHE 339 Ca 0.00 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.33 2q3r n PHE 339 Cb 0.16 -0.10 -0.01 0.00 -0.94 0.00 0.00 39.48 38.59 2q3r n PHE 339 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 2q3r h GLN 340 N 0.00 0.12 -0.11 -1.08 4.20 -1.80 -3.37 115.11 113.07 2q3r h GLN 340 Ca 0.00 -0.14 -0.19 0.00 0.06 0.00 0.00 58.65 58.38 2q3r h GLN 340 Cb 0.01 0.04 -0.35 0.00 0.30 0.00 0.00 27.48 27.48 2q3r h GLN 340 CO 0.00 0.92 -0.94 0.28 -0.67 0.00 0.00 178.83 178.42 2q3r n VAL 341 N -3.60 0.33 -3.89 -0.54 0.31 0.12 -5.01 118.33 106.04 2q3r n VAL 341 Ca -0.03 -1.39 -0.34 0.00 -0.01 0.00 0.00 64.34 62.58 2q3r n VAL 341 Cb 0.82 1.02 0.01 0.00 -0.91 0.00 0.00 33.84 34.78 2q3r n VAL 341 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2q3r n ASP 342 N 0.06 -3.71 -4.73 4.52 -0.08 0.01 -4.94 116.55 107.68 2q3r n ASP 342 Ca 0.01 -1.03 -0.24 0.00 -1.51 0.00 0.00 54.79 52.03 2q3r n ASP 342 Cb 1.00 -1.35 0.09 0.00 2.34 0.00 0.00 41.12 43.20 2q3r n ASP 342 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2q3r s ALA 343 N -3.42 3.51 0.65 -1.67 0.00 -1.04 -5.02 121.76 114.77 2q3r s ALA 343 Ca 0.27 -1.45 -0.16 0.00 0.00 0.00 0.00 51.96 50.62 2q3r s ALA 343 Cb -0.15 -2.20 -0.00 0.00 0.00 0.00 0.00 23.12 20.77 2q3r s ALA 343 CO 0.81 -1.37 1.16 -1.25 0.00 0.00 0.00 175.76 175.11 2q3r s PRO 344 N -5.15 2.71 -0.01 0.00 0.04 -1.26 -4.89 135.00 126.45 2q3r s PRO 344 Ca 0.64 1.62 0.05 0.00 0.04 0.00 0.00 61.00 63.35 2q3r s PRO 344 Cb -0.07 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.54 2q3r s PRO 344 CO 0.44 -1.36 -0.15 -0.51 0.04 0.00 0.00 177.00 175.46 2q3r s LEU 345 N -4.64 2.03 0.20 -3.56 1.43 -1.26 -4.97 118.68 107.92 2q3r s LEU 345 Ca 0.72 -0.27 -0.30 0.00 -1.03 0.00 0.00 54.13 53.25 2q3r s LEU 345 Cb -0.26 -0.75 -0.09 0.00 0.03 0.00 0.00 46.19 45.13 2q3r s LEU 345 CO 0.39 0.17 1.34 0.20 0.23 0.00 0.00 176.35 178.68 2q3r s ASN 346 N -0.38 6.84 0.49 2.29 0.01 -1.26 -4.98 114.94 117.94 2q3r s ASN 346 Ca 0.05 2.45 -0.20 0.00 -0.71 0.00 0.00 52.86 54.46 2q3r s ASN 346 Cb -0.06 -2.61 -0.08 0.00 0.41 0.00 0.00 41.25 38.91 2q3r s ASN 346 CO -0.00 -0.57 1.03 -1.59 -1.51 0.00 0.00 177.10 174.45 2q3r s LYS 347 N -0.08 3.81 0.38 -0.60 -2.85 -1.26 -4.65 119.74 114.49 2q3r s LYS 347 Ca 0.58 1.33 -0.22 0.00 -1.00 0.00 0.00 55.97 56.66 2q3r s LYS 347 Cb -0.38 -2.10 -0.10 0.00 -2.06 0.00 0.00 37.83 33.19 2q3r s LYS 347 CO 0.39 -0.42 0.92 1.52 0.10 0.00 0.00 175.35 177.86 2q3r s TYR 348 N -2.02 3.46 -0.66 1.78 -0.85 -1.26 -4.92 117.35 112.87 2q3r s TYR 348 Ca 0.67 1.63 -0.04 0.00 -0.52 0.00 0.00 57.07 58.80 2q3r s TYR 348 Cb -0.16 -2.84 0.17 0.00 0.38 0.00 0.00 41.96 39.52 2q3r s TYR 348 CO 0.20 0.04 0.49 0.34 -1.52 0.00 0.00 175.55 175.10 2q3r s ASP 349 N -1.97 5.41 0.24 -0.18 2.15 -1.26 -4.98 116.67 116.08 2q3r s ASP 349 Ca 0.56 -2.90 -0.07 0.00 0.43 0.00 0.00 52.55 50.58 2q3r s ASP 349 Cb -0.13 -1.89 0.41 0.00 -0.30 0.00 0.00 42.92 41.01 2q3r s ASP 349 CO 0.17 -0.38 1.65 0.03 -0.17 0.00 0.00 175.17 176.48 2q3r h ARG 350 N 7.04 0.14 0.00 4.34 3.08 -2.01 -0.73 114.38 126.24 2q3r h ARG 350 Ca 0.01 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2q3r h ARG 350 Cb 0.95 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.97 2q3r h ARG 350 CO 0.72 0.09 0.53 -1.35 -1.07 0.00 0.00 179.97 178.89 2q3r h PRO 351 N 0.15 0.00 -0.18 0.04 0.11 -2.03 0.22 132.00 130.31 2q3r h PRO 351 Ca 0.39 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.46 2q3r h PRO 351 Cb 0.67 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.76 2q3r h PRO 351 CO -0.59 0.00 -0.07 0.25 -0.21 0.00 0.00 178.00 177.38 2q3r n THR 352 N -2.76 2.23 0.03 -1.15 -2.24 -0.28 -4.55 114.28 105.56 2q3r n THR 352 Ca -0.01 -2.33 -0.13 0.00 -2.27 0.00 0.00 64.05 59.31 2q3r n THR 352 Cb 0.56 -0.27 -0.09 0.00 -2.10 0.00 0.00 70.33 68.43 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 1.01 -0.10 -0.23 4.78 -1.00 -0.58 -3.37 116.94 117.46 2q3r h PHE 353 Ca 0.05 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.83 2q3r h PHE 353 Cb 1.33 0.03 0.00 0.00 3.61 0.00 0.00 35.95 40.92 2q3r h PHE 353 CO 0.51 0.35 0.00 0.66 -1.61 0.00 0.00 178.31 178.21 2q3r n TYR 354 N -4.92 0.72 -1.93 -0.55 4.01 -1.26 -4.69 117.16 108.55 2q3r n TYR 354 Ca -0.08 -0.83 -0.32 0.00 -0.16 0.00 0.00 57.90 56.51 2q3r n TYR 354 Cb 0.25 -0.24 0.02 0.00 -0.31 0.00 0.00 39.34 39.05 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 -2.52 3.95 -0.16 -0.72 -4.23 -1.26 -4.85 115.64 105.86 2q3r s THR 355 Ca 0.37 0.83 0.01 0.00 -1.18 0.00 0.00 61.69 61.72 2q3r s THR 355 Cb 0.29 -3.42 0.24 0.00 1.34 0.00 0.00 72.50 70.94 2q3r s THR 355 CO 0.09 -0.64 1.34 -1.20 -0.54 0.00 0.00 174.62 173.67 2q3r n SER 356 N -2.34 3.32 -4.27 3.99 7.64 -1.26 -4.83 113.62 115.87 2q3r n SER 356 Ca 0.08 -2.58 -0.39 0.00 1.01 0.00 0.00 58.87 56.99 2q3r n SER 356 Cb 0.53 -0.63 -0.11 0.00 -1.01 0.00 0.00 64.21 63.00 2q3r n SER 356 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2q3r s ASP 357 N 0.19 5.54 0.00 6.43 3.68 -1.26 -4.95 116.67 126.30 2q3r s ASP 357 Ca 0.20 -1.41 0.00 0.00 2.13 0.00 0.00 52.55 53.48 2q3r s ASP 357 Cb 0.17 -1.95 0.00 0.00 -1.45 0.00 0.00 42.92 39.69 2q3r s ASP 357 CO 0.04 -0.47 0.55 -2.65 0.13 0.00 0.00 175.17 172.76 2q3r n PRO 358 N 4.88 0.00 0.07 4.34 -0.02 -1.26 -3.31 135.00 139.70 2q3r n PRO 358 Ca -0.10 0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 2q3r n PRO 358 Cb 0.43 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.25 2q3r n PRO 358 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2q3r n VAL 359 N -1.05 0.81 -1.95 -1.45 0.31 -1.26 -4.62 118.33 109.12 2q3r n VAL 359 Ca 0.00 0.27 -0.42 0.00 -0.01 0.00 0.00 64.34 64.17 2q3r n VAL 359 Cb 0.16 -1.22 -0.03 0.00 -0.91 0.00 0.00 33.84 31.84 2q3r n VAL 359 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2q3r s VAL 360 N -1.92 3.47 -0.52 2.52 1.01 -1.21 -1.20 120.40 122.55 2q3r s VAL 360 Ca 0.00 0.56 0.00 0.00 0.00 0.00 0.00 61.98 62.54 2q3r s VAL 360 Cb 0.00 -3.40 0.00 0.00 0.00 0.00 0.00 36.38 32.98 2q3r s VAL 360 CO 0.00 -0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.62 2q3r n GLY 361 N 4.38 0.76 0.02 4.51 0.00 -1.26 -4.71 105.19 108.88 2q3r n GLY 361 Ca 0.19 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.82 0.00 -0.36 1.61 9.36 -0.59 -4.76 117.16 119.60 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 0.18 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.89 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 -1.91 0.00 1.10 2.97 -2.24 -0.34 -4.81 114.28 109.05 2q3r n THR 363 Ca 0.00 -0.16 0.07 0.00 -2.27 0.00 0.00 64.05 61.70 2q3r n THR 363 Cb 0.20 1.36 0.25 0.00 -2.10 0.00 0.00 70.33 70.04 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 -0.15 1.65 -4.62 3.42 3.85 -1.17 -4.80 116.55 114.72 2q3r n ASP 364 Ca 0.00 -1.86 -0.43 0.00 -0.71 0.00 0.00 54.79 51.79 2q3r n ASP 364 Cb 0.09 -0.17 -0.02 0.00 -1.35 0.00 0.00 41.12 39.67 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 -1.67 2.54 0.49 2.11 2.02 -1.26 -4.95 117.35 116.63 2q3r s TYR 365 Ca 0.26 0.78 -0.22 0.00 -0.37 0.00 0.00 57.07 57.52 2q3r s TYR 365 Cb 0.14 -4.05 -0.07 0.00 -0.40 0.00 0.00 41.96 37.58 2q3r s TYR 365 CO 0.20 -1.90 1.17 -1.25 -1.57 0.00 0.00 175.55 172.19 2q3r s PRO 366 N 4.46 3.60 0.65 -1.71 0.04 -1.26 -4.46 135.00 136.32 2q3r s PRO 366 Ca 0.59 1.76 -0.11 0.00 0.04 0.00 0.00 61.00 63.28 2q3r s PRO 366 Cb -0.16 -2.28 -0.02 0.00 0.04 0.00 0.00 34.50 32.07 2q3r s PRO 366 CO 0.27 -0.68 1.05 -0.06 0.04 0.00 0.00 177.00 177.62 2q3r s PHE 367 N -1.59 3.49 -0.87 0.56 0.40 -1.26 -4.69 117.98 114.02 2q3r s PHE 367 Ca 0.67 1.26 -0.26 0.00 -0.60 0.00 0.00 56.93 58.00 2q3r s PHE 367 Cb -0.28 -2.81 -0.20 0.00 0.51 0.00 0.00 43.02 40.24 2q3r s PHE 367 CO 0.33 -0.87 2.53 1.28 0.70 0.00 0.00 175.22 179.19 2q3r n LEU 368 N -2.86 0.60 0.00 -0.37 4.77 -1.26 -5.08 117.00 112.80 2q3r n LEU 368 Ca 0.06 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 2q3r n LEU 368 Cb 0.55 -1.07 0.00 0.00 -2.33 0.00 0.00 43.42 40.57 2q3r n LEU 368 CO 0.58 -1.16 0.14 -0.62 -1.33 0.00 0.00 177.39 174.99