#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 0.31 0.50 0.44 1.01 -1.26 -5.02 120.40 116.38 2q3r s VAL 10 Ca 0.00 -1.53 0.41 0.00 0.00 0.00 0.00 61.98 60.86 2q3r s VAL 10 Cb 0.00 -1.24 0.62 0.00 0.00 0.00 0.00 36.38 35.76 2q3r s VAL 10 CO 0.00 -0.88 1.58 -0.65 0.00 0.00 0.00 175.10 175.15 2q3r h PRO 11 N 7.45 0.01 -0.10 2.72 0.11 -1.97 0.13 132.00 140.35 2q3r h PRO 11 Ca -0.04 -0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.96 2q3r h PRO 11 Cb 0.98 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.09 2q3r h PRO 11 CO 0.36 0.01 -0.37 -0.07 -0.21 0.00 0.00 178.00 177.71 2q3r h LEU 12 N 0.01 0.50 -1.11 2.35 3.38 -1.89 -3.29 115.31 115.25 2q3r h LEU 12 Ca 0.90 -0.62 -0.00 0.00 0.09 0.00 0.00 57.88 58.25 2q3r h LEU 12 Cb 3.29 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 43.89 2q3r h LEU 12 CO -0.23 1.04 0.00 0.18 0.09 0.00 0.00 178.44 179.51 2q3r n LEU 13 N -4.36 1.22 -4.53 1.67 7.99 0.44 0.12 117.00 119.56 2q3r n LEU 13 Ca -0.08 -0.61 -0.34 0.00 -0.01 0.00 0.00 56.01 54.97 2q3r n LEU 13 Cb 0.53 -0.50 -0.12 0.00 -0.11 0.00 0.00 43.42 43.21 2q3r n LEU 13 CO 0.43 0.27 -0.37 0.42 -1.51 0.00 0.00 177.39 176.64 2q3r s THR 14 N -0.96 3.75 0.93 -5.08 -4.23 -1.23 -4.68 115.64 104.14 2q3r s THR 14 Ca 0.01 -0.43 -0.15 0.00 -1.18 0.00 0.00 61.69 59.94 2q3r s THR 14 Cb 0.01 -2.59 -0.05 0.00 1.34 0.00 0.00 72.50 71.21 2q3r s THR 14 CO 0.00 0.54 -0.05 -2.65 -0.54 0.00 0.00 174.62 171.93 2q3r n PRO 15 N 2.94 -0.12 -3.51 3.99 -0.02 -0.66 -4.11 135.00 133.51 2q3r n PRO 15 Ca -0.18 -0.01 -0.17 0.00 -2.02 0.00 0.00 63.50 61.13 2q3r n PRO 15 Cb 0.53 -1.51 -0.05 0.00 -0.02 0.00 0.00 33.50 32.44 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 -2.19 -0.62 -0.19 6.00 5.04 0.11 -4.86 117.35 120.64 2q3r s TYR 16 Ca 0.51 0.95 -0.03 0.00 -2.44 0.00 0.00 57.07 56.06 2q3r s TYR 16 Cb -0.22 0.43 -0.02 0.00 0.35 0.00 0.00 41.96 42.50 2q3r s TYR 16 CO 0.72 -0.65 -0.05 0.15 -1.34 0.00 0.00 175.55 174.38 2q3r s LYS 17 N -1.69 3.47 -0.79 4.97 1.02 -1.26 -0.16 119.74 125.31 2q3r s LYS 17 Ca -0.09 -0.60 0.02 0.00 0.02 0.00 0.00 55.97 55.33 2q3r s LYS 17 Cb -0.00 -2.92 0.21 0.00 -0.52 0.00 0.00 37.83 34.60 2q3r s LYS 17 CO 0.05 0.01 0.71 -0.12 -0.92 0.00 0.00 175.35 175.08 2q3r n MET 18 N 4.20 2.43 0.00 1.68 0.00 -0.65 -4.99 117.12 119.80 2q3r n MET 18 Ca -0.18 -4.53 0.00 0.00 -0.00 0.00 0.00 57.70 52.99 2q3r n MET 18 Cb 0.52 -2.34 0.00 0.00 0.00 0.00 0.00 33.22 31.40 2q3r n MET 18 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2q3r n GLY 19 N 1.80 1.95 0.90 -5.12 0.00 -1.26 -3.26 105.19 100.19 2q3r n GLY 19 Ca 0.23 -0.50 0.11 0.00 0.00 0.00 0.00 46.02 45.86 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 12.01 2.19 -4.20 1.61 3.00 -1.26 -4.88 116.66 125.13 2q3r n ARG 20 Ca 0.00 -1.78 -0.34 0.00 -0.00 0.00 0.00 57.85 55.72 2q3r n ARG 20 Cb 0.00 -1.46 -0.11 0.00 0.00 0.00 0.00 32.46 30.88 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 -1.65 3.11 -0.26 -0.14 0.40 -1.20 -5.09 117.98 113.14 2q3r s PHE 21 Ca 0.35 -0.20 -0.15 0.00 -0.60 0.00 0.00 56.93 56.34 2q3r s PHE 21 Cb 0.20 -2.03 -0.04 0.00 0.51 0.00 0.00 43.02 41.67 2q3r s PHE 21 CO 0.29 -0.01 0.36 -0.80 0.70 0.00 0.00 175.22 175.76 2q3r s ASN 22 N 0.49 6.27 -0.19 1.36 -0.87 -1.26 -1.63 114.94 119.11 2q3r s ASN 22 Ca -0.01 0.30 -0.09 0.00 -1.57 0.00 0.00 52.86 51.50 2q3r s ASN 22 Cb -0.14 -2.21 -0.05 0.00 -0.02 0.00 0.00 41.25 38.84 2q3r s ASN 22 CO 0.02 -0.15 0.10 -0.76 -2.57 0.00 0.00 177.10 173.74 2q3r s LEU 23 N 1.89 4.02 0.51 0.60 1.43 0.77 -4.67 118.68 123.23 2q3r s LEU 23 Ca 0.15 0.16 0.30 0.00 -1.03 0.00 0.00 54.13 53.71 2q3r s LEU 23 Cb -0.16 -2.03 1.22 0.00 0.03 0.00 0.00 46.19 45.26 2q3r s LEU 23 CO 0.09 0.18 1.94 0.28 0.23 0.00 0.00 176.35 179.07 2q3r h SER 24 N 6.63 0.00 -5.10 2.29 0.02 -1.26 0.30 113.55 116.44 2q3r h SER 24 Ca -0.39 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.53 2q3r h SER 24 Cb 1.16 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.66 2q3r h SER 24 CO 0.73 0.09 0.15 -1.38 -1.14 0.00 0.00 176.83 175.28 2q3r s HIS 25 N -3.70 0.17 -1.90 3.45 0.00 -1.26 -1.66 115.29 110.39 2q3r s HIS 25 Ca 0.01 -0.69 0.21 0.00 -3.00 0.00 0.00 55.06 51.59 2q3r s HIS 25 Cb 0.10 0.60 0.55 0.00 -4.00 0.00 0.00 32.58 29.82 2q3r s HIS 25 CO 0.58 -1.34 1.46 0.54 -1.00 0.00 0.00 174.74 174.98 2q3r n ARG 26 N -0.49 2.67 -2.82 -0.38 1.74 0.12 -4.77 116.66 112.73 2q3r n ARG 26 Ca -0.05 -2.48 -0.43 0.00 -0.77 0.00 0.00 57.85 54.12 2q3r n ARG 26 Cb 0.60 -1.51 -0.04 0.00 -1.02 0.00 0.00 32.46 30.50 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 -1.09 4.30 0.15 1.55 1.01 -1.26 -1.54 120.40 123.51 2q3r s VAL 27 Ca 0.43 -0.47 -0.10 0.00 0.00 0.00 0.00 61.98 61.84 2q3r s VAL 27 Cb 0.23 -4.74 -0.06 0.00 0.00 0.00 0.00 36.38 31.80 2q3r s VAL 27 CO 0.30 -1.53 0.48 -0.69 0.00 0.00 0.00 175.10 173.66 2q3r s VAL 28 N 4.09 4.99 -0.39 2.92 1.01 -0.37 -4.56 120.40 128.09 2q3r s VAL 28 Ca 0.26 0.50 -0.24 0.00 0.00 0.00 0.00 61.98 62.50 2q3r s VAL 28 Cb -0.13 -3.66 0.01 0.00 0.00 0.00 0.00 36.38 32.60 2q3r s VAL 28 CO 0.07 0.14 0.85 -0.22 0.00 0.00 0.00 175.10 175.94 2q3r s LEU 29 N -2.28 4.08 1.30 3.92 2.96 -0.22 -1.88 118.68 126.56 2q3r s LEU 29 Ca 0.39 0.36 -0.20 0.00 -0.22 0.00 0.00 54.13 54.46 2q3r s LEU 29 Cb -0.13 -3.12 0.32 0.00 0.50 0.00 0.00 46.19 43.76 2q3r s LEU 29 CO 0.20 -0.83 1.02 0.00 -1.32 0.00 0.00 176.35 175.42 2q3r s ALA 30 N 3.32 -0.10 -0.25 5.97 0.00 -1.09 -2.12 121.76 127.50 2q3r s ALA 30 Ca 0.34 -0.81 -0.21 0.00 0.00 0.00 0.00 51.96 51.28 2q3r s ALA 30 Cb -0.12 -2.95 -0.02 0.00 0.00 0.00 0.00 23.12 20.04 2q3r s ALA 30 CO 0.19 -4.06 0.65 -1.25 0.00 0.00 0.00 175.76 171.29 2q3r s PRO 31 N -5.17 4.11 -0.26 0.00 0.04 -1.26 -4.56 135.00 127.91 2q3r s PRO 31 Ca 0.70 0.59 -0.01 0.00 0.04 0.00 0.00 61.00 62.31 2q3r s PRO 31 Cb -0.13 -3.65 0.08 0.00 0.04 0.00 0.00 34.50 30.84 2q3r s PRO 31 CO 0.58 -0.43 0.03 -0.51 0.04 0.00 0.00 177.00 176.71 2q3r s LEU 32 N 2.55 2.16 0.13 -3.56 1.43 -1.26 -4.80 118.68 115.34 2q3r s LEU 32 Ca 0.27 -1.30 -0.31 0.00 -1.03 0.00 0.00 54.13 51.76 2q3r s LEU 32 Cb -0.15 -0.91 -0.11 0.00 0.03 0.00 0.00 46.19 45.04 2q3r s LEU 32 CO 0.08 -0.33 1.82 0.41 0.23 0.00 0.00 176.35 178.56 2q3r n THR 33 N 4.82 0.31 0.00 5.49 -1.04 -1.26 -4.42 114.28 118.19 2q3r n THR 33 Ca -0.06 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 2q3r n THR 33 Cb 0.44 -2.10 0.00 0.00 -1.82 0.00 0.00 70.33 66.85 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 5.39 2.13 -3.70 -2.82 5.12 -1.26 -4.68 116.66 116.84 2q3r n ARG 34 Ca 0.18 0.00 -0.31 0.00 -1.93 0.00 0.00 57.85 55.79 2q3r n ARG 34 Cb 0.37 -0.81 0.04 0.00 -1.16 0.00 0.00 32.46 30.89 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 -1.22 -1.13 0.00 5.56 6.02 -1.26 -4.23 117.38 121.12 2q3r n GLN 35 Ca 0.00 0.49 0.00 0.00 -0.01 0.00 0.00 57.00 57.48 2q3r n GLN 35 Cb 0.00 -3.91 0.00 0.00 1.02 0.00 0.00 30.24 27.35 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 -4.05 0.59 -2.27 -1.09 1.74 -1.23 -4.40 116.66 105.95 2q3r n ARG 36 Ca -0.10 -0.07 -0.33 0.00 -0.77 0.00 0.00 57.85 56.58 2q3r n ARG 36 Cb 0.59 -0.40 -0.04 0.00 -1.02 0.00 0.00 32.46 31.59 2q3r n ARG 36 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2q3r s SER 37 N -0.10 5.73 -0.24 0.55 0.01 -0.93 -4.88 113.70 113.83 2q3r s SER 37 Ca 0.00 -1.46 -0.36 0.00 1.31 0.00 0.00 55.95 55.44 2q3r s SER 37 Cb 0.00 -2.57 -0.12 0.00 0.21 0.00 0.00 66.02 63.53 2q3r s SER 37 CO 0.00 -2.27 1.97 -1.22 0.41 0.00 0.00 173.24 172.13 2q3r n TYR 38 N 11.92 1.99 -0.97 2.43 0.53 -1.26 -0.29 117.16 131.50 2q3r n TYR 38 Ca 0.42 0.24 0.00 0.00 -1.02 0.00 0.00 57.90 57.54 2q3r n TYR 38 Cb 0.48 -2.56 0.00 0.00 -1.03 0.00 0.00 39.34 36.22 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 5.17 0.98 1.82 2.72 0.00 -1.26 -3.08 105.19 111.54 2q3r n GLY 39 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.33 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 0.00 -2.73 -4.55 1.61 4.13 0.60 -5.00 115.26 109.32 2q3r n ASN 40 Ca 0.00 0.00 -0.35 0.00 1.68 0.00 0.00 54.58 55.91 2q3r n ASN 40 Cb 0.00 -0.45 -0.11 0.00 -1.54 0.00 0.00 39.78 37.68 2q3r n ASN 40 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2q3r s VAL 41 N -2.00 4.60 0.40 2.41 1.01 -1.18 -3.31 120.40 122.34 2q3r s VAL 41 Ca 0.00 -0.09 -0.23 0.00 0.00 0.00 0.00 61.98 61.66 2q3r s VAL 41 Cb 0.00 -3.11 -0.12 0.00 0.00 0.00 0.00 36.38 33.15 2q3r s VAL 41 CO 0.00 0.40 0.65 -2.65 0.00 0.00 0.00 175.10 173.50 2q3r n PRO 42 N 4.16 0.71 -4.40 2.72 -0.02 -1.26 -4.19 135.00 132.72 2q3r n PRO 42 Ca -0.16 0.26 -0.28 0.00 -2.02 0.00 0.00 63.50 61.30 2q3r n PRO 42 Cb 0.52 -1.59 -0.12 0.00 -0.02 0.00 0.00 33.50 32.28 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 -1.62 1.45 0.66 -0.52 -1.52 -1.26 -4.95 119.66 111.89 2q3r s GLN 43 Ca 0.63 -1.43 0.33 0.00 -1.95 0.00 0.00 55.36 52.95 2q3r s GLN 43 Cb -0.62 -1.86 1.80 0.00 -0.22 0.00 0.00 33.01 32.11 2q3r s GLN 43 CO 0.58 0.42 2.03 -1.35 -0.25 0.00 0.00 175.29 176.72 2q3r h PRO 44 N 3.58 0.00 0.00 2.91 0.11 -1.94 0.33 132.00 136.99 2q3r h PRO 44 Ca -0.49 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 2q3r h PRO 44 Cb 1.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 2q3r h PRO 44 CO 0.43 0.00 -0.05 1.12 -0.21 0.00 0.00 178.00 179.29 2q3r h HIS 45 N 0.00 0.00 -0.01 0.65 2.07 -1.95 -2.02 115.15 113.90 2q3r h HIS 45 Ca 0.01 0.00 -0.17 0.00 -2.85 0.00 0.00 60.37 57.36 2q3r h HIS 45 Cb 0.53 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.50 2q3r h HIS 45 CO 0.00 0.05 -0.78 0.00 -3.07 0.00 0.00 177.93 174.13 2q3r h ALA 46 N 1.95 0.68 -0.72 6.11 0.00 -0.68 -2.54 119.26 124.06 2q3r h ALA 46 Ca -0.00 -0.69 0.04 0.00 0.00 0.00 0.00 54.91 54.26 2q3r h ALA 46 Cb 0.43 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 2q3r h ALA 46 CO 0.01 0.91 0.47 0.00 0.00 0.00 0.00 179.25 180.64 2q3r h ALA 47 N 1.14 1.61 0.01 0.00 0.00 -1.43 -1.92 119.26 118.66 2q3r h ALA 47 Ca -0.02 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2q3r h ALA 47 Cb 1.37 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2q3r h ALA 47 CO 0.11 0.31 -0.03 0.82 0.00 0.00 0.00 179.25 180.46 2q3r h ILE 48 N 0.85 1.79 -0.89 0.00 1.08 -1.59 -2.98 117.51 115.77 2q3r h ILE 48 Ca 0.29 -2.35 0.13 0.00 -0.39 0.00 0.00 64.86 62.53 2q3r h ILE 48 Cb 0.09 3.39 -0.14 0.00 -3.07 0.00 0.00 36.82 37.09 2q3r h ILE 48 CO -0.09 0.61 -0.43 0.22 -0.69 0.00 0.00 178.15 177.78 2q3r h TYR 49 N -0.97 -1.26 0.27 1.37 3.20 -1.20 0.42 116.97 118.80 2q3r h TYR 49 Ca -0.01 0.10 -0.01 0.00 3.14 0.00 0.00 58.73 61.95 2q3r h TYR 49 Cb 1.03 0.68 0.00 0.00 1.54 0.00 0.00 36.73 39.97 2q3r h TYR 49 CO 0.28 -0.40 -0.13 1.88 -1.64 0.00 0.00 178.16 178.15 2q3r h TYR 50 N -0.06 -0.34 -0.99 -3.82 0.05 -1.52 -3.18 116.97 107.11 2q3r h TYR 50 Ca 0.27 -0.01 0.32 0.00 0.05 0.00 0.00 58.73 59.37 2q3r h TYR 50 Cb 0.55 0.11 -0.18 0.00 1.01 0.00 0.00 36.73 38.22 2q3r h TYR 50 CO -0.85 -0.01 0.21 0.77 -1.05 0.00 0.00 178.16 177.22 2q3r h SER 51 N -0.97 -0.19 0.97 3.88 0.02 -1.26 2.82 113.55 118.80 2q3r h SER 51 Ca -0.04 0.27 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 2q3r h SER 51 Cb 0.47 0.41 0.00 0.00 0.14 0.00 0.00 62.40 63.42 2q3r h SER 51 CO 0.06 -0.38 0.00 0.06 -1.14 0.00 0.00 176.83 175.43 2q3r h GLN 52 N 0.01 0.00 -0.62 3.45 3.07 -0.24 -2.63 115.11 118.15 2q3r h GLN 52 Ca 0.69 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.43 2q3r h GLN 52 Cb 1.58 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.14 2q3r h GLN 52 CO -0.87 0.00 0.00 0.54 0.09 0.00 0.00 178.83 178.59 2q3r n ARG 53 N -2.77 2.66 -2.55 0.06 1.74 0.94 -3.74 116.66 112.99 2q3r n ARG 53 Ca 0.01 -2.55 -0.23 0.00 -0.77 0.00 0.00 57.85 54.32 2q3r n ARG 53 Cb 0.29 -1.56 0.09 0.00 -1.02 0.00 0.00 32.46 30.26 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 -1.18 2.29 -0.07 0.55 2.01 -0.74 -4.91 115.64 113.59 2q3r s THR 54 Ca 0.46 -0.57 -0.29 0.00 0.31 0.00 0.00 61.69 61.60 2q3r s THR 54 Cb 0.25 -2.71 0.07 0.00 0.01 0.00 0.00 72.50 70.11 2q3r s THR 54 CO 0.33 0.00 0.64 0.42 -0.69 0.00 0.00 174.62 175.32 2q3r s THR 55 N -3.06 0.01 0.13 -0.82 -4.23 -1.26 -4.96 115.64 101.45 2q3r s THR 55 Ca 0.63 -0.05 -0.31 0.00 -1.18 0.00 0.00 61.69 60.79 2q3r s THR 55 Cb -0.07 -0.96 -0.10 0.00 1.34 0.00 0.00 72.50 72.71 2q3r s THR 55 CO 0.43 -0.03 1.70 -2.84 -0.54 0.00 0.00 174.62 173.34 2q3r s PRO 56 N -1.05 4.17 0.00 3.99 0.02 -1.25 0.07 135.00 140.95 2q3r s PRO 56 Ca -0.10 2.47 0.00 0.00 0.02 0.00 0.00 61.00 63.38 2q3r s PRO 56 Cb -0.01 -3.41 0.00 0.00 0.02 0.00 0.00 34.50 31.10 2q3r s PRO 56 CO 0.09 -0.74 0.00 0.41 -0.33 0.00 0.00 177.00 176.42 2q3r n GLY 57 N 4.01 1.31 3.77 0.52 0.00 -0.27 -4.38 105.19 110.16 2q3r n GLY 57 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.93 1.62 -0.12 -0.02 0.00 0.11 -0.98 107.32 105.98 2q3r s GLY 58 Ca 0.00 -0.19 0.02 0.00 0.00 0.00 0.00 44.72 44.55 2q3r s GLY 58 CO 0.00 0.27 -0.17 -0.12 0.00 0.00 0.00 173.10 173.08 2q3r s PHE 59 N -3.09 2.20 -0.05 1.90 5.99 -1.26 -0.68 117.98 122.99 2q3r s PHE 59 Ca 0.62 -1.09 0.03 0.00 0.00 0.00 0.00 56.93 56.49 2q3r s PHE 59 Cb -0.16 -1.56 0.01 0.00 0.00 0.00 0.00 43.02 41.31 2q3r s PHE 59 CO 0.55 -0.54 -0.14 -0.51 -0.00 0.00 0.00 175.22 174.57 2q3r s LEU 60 N 1.00 1.79 0.39 6.12 1.02 0.50 -1.06 118.68 128.44 2q3r s LEU 60 Ca -0.05 -0.32 0.08 0.00 0.02 0.00 0.00 54.13 53.85 2q3r s LEU 60 Cb -0.15 -0.89 -0.04 0.00 0.02 0.00 0.00 46.19 45.14 2q3r s LEU 60 CO -0.03 0.09 0.24 -0.63 0.02 0.00 0.00 176.35 176.04 2q3r s ILE 61 N 0.35 2.65 0.33 -0.59 1.01 -0.90 -0.69 121.20 123.36 2q3r s ILE 61 Ca -0.10 -1.57 0.05 0.00 0.00 0.00 0.00 60.65 59.03 2q3r s ILE 61 Cb -0.14 -3.00 -0.02 0.00 0.01 0.00 0.00 42.46 39.32 2q3r s ILE 61 CO 0.03 -0.05 0.48 0.42 0.00 0.00 0.00 174.94 175.82 2q3r s THR 62 N -2.50 4.46 0.00 2.92 -4.23 -0.53 -4.68 115.64 111.07 2q3r s THR 62 Ca 0.42 -0.87 -0.01 0.00 -1.18 0.00 0.00 61.69 60.06 2q3r s THR 62 Cb -0.00 -3.58 -0.00 0.00 1.34 0.00 0.00 72.50 70.26 2q3r s THR 62 CO 0.24 -0.26 1.01 -0.33 -0.54 0.00 0.00 174.62 174.74 2q3r h GLU 63 N 0.87 -0.01 0.00 3.99 5.08 -1.86 -3.37 114.58 119.28 2q3r h GLU 63 Ca -0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 2q3r h GLU 63 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2q3r h GLU 63 CO 0.56 -0.01 0.00 0.00 -1.00 0.00 0.00 179.01 178.57 2q3r n ALA 64 N -2.65 0.00 -2.23 3.43 0.00 -1.22 -4.22 120.51 113.62 2q3r n ALA 64 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.11 2q3r n ALA 64 Cb 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.40 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 0.00 4.76 0.32 0.00 2.01 0.69 -4.58 115.64 118.83 2q3r s THR 65 Ca 0.00 0.81 -0.28 0.00 0.31 0.00 0.00 61.69 62.52 2q3r s THR 65 Cb 0.00 -3.62 -0.10 0.00 0.01 0.00 0.00 72.50 68.79 2q3r s THR 65 CO 0.00 -0.13 1.20 -0.83 -0.69 0.00 0.00 174.62 174.17 2q3r s GLY 66 N -2.27 3.01 0.00 4.40 0.00 0.62 0.18 107.32 113.27 2q3r s GLY 66 Ca 0.51 1.06 0.27 0.00 0.00 0.00 0.00 44.72 46.57 2q3r s GLY 66 CO 0.19 1.67 1.67 3.33 0.00 0.00 0.00 173.10 179.96 2q3r n VAL 67 N 0.85 0.00 0.00 1.40 0.24 -1.06 -2.75 118.33 117.02 2q3r n VAL 67 Ca 0.00 -0.02 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 2q3r n VAL 67 Cb 0.44 -0.04 0.00 0.00 -1.47 0.00 0.00 33.84 32.77 2q3r n VAL 67 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2q3r n SER 68 N -1.34 0.00 0.00 -1.34 3.41 -1.26 -4.63 113.62 108.45 2q3r n SER 68 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 2q3r n SER 68 Cb 0.33 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.28 2q3r n SER 68 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2q3r n ASP 69 N 0.00 0.00 -0.56 4.04 5.68 -1.26 0.65 116.55 125.10 2q3r n ASP 69 Ca 0.00 0.10 0.09 0.00 -0.50 0.00 0.00 54.79 54.47 2q3r n ASP 69 Cb 0.00 -0.10 0.04 0.00 -1.14 0.00 0.00 41.12 39.92 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 -0.97 0.00 1.33 2.12 -2.24 -1.26 -4.55 114.28 108.71 2q3r n THR 70 Ca 0.00 -0.42 0.13 0.00 -2.27 0.00 0.00 64.05 61.49 2q3r n THR 70 Cb 0.21 1.29 0.43 0.00 -2.10 0.00 0.00 70.33 70.17 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 0.51 2.90 -2.25 6.98 0.00 0.21 -4.50 120.51 124.36 2q3r n ALA 71 Ca 0.09 -0.42 -0.31 0.00 0.00 0.00 0.00 53.44 52.80 2q3r n ALA 71 Cb 0.40 -1.15 -0.04 0.00 0.00 0.00 0.00 19.45 18.66 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 -2.32 3.83 0.00 0.00 1.11 -1.26 -0.81 119.66 120.21 2q3r s GLN 72 Ca 0.29 0.44 0.00 0.00 0.01 0.00 0.00 55.36 56.10 2q3r s GLN 72 Cb 0.20 -2.48 0.00 0.00 -1.01 0.00 0.00 33.01 29.72 2q3r s GLN 72 CO 0.45 0.11 0.66 0.41 0.01 0.00 0.00 175.29 176.93 2q3r n GLY 73 N -0.78 0.49 3.53 3.09 0.00 -1.26 -4.71 105.19 105.55 2q3r n GLY 73 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.45 0.79 1.61 2.02 -1.26 -4.33 117.35 115.72 2q3r s TYR 74 Ca 0.00 0.62 -0.15 0.00 -0.37 0.00 0.00 57.07 57.17 2q3r s TYR 74 Cb 0.00 0.47 0.01 0.00 -0.40 0.00 0.00 41.96 42.05 2q3r s TYR 74 CO 0.00 -0.51 0.75 0.94 -1.57 0.00 0.00 175.55 175.17 2q3r n GLN 75 N 0.42 0.20 -3.30 -0.62 7.27 -1.26 -4.01 117.38 116.08 2q3r n GLN 75 Ca -0.13 0.12 0.00 0.00 0.07 0.00 0.00 57.00 57.07 2q3r n GLN 75 Cb 0.59 -2.06 0.00 0.00 2.41 0.00 0.00 30.24 31.19 2q3r n GLN 75 CO 0.00 0.00 0.00 -0.40 0.07 0.00 0.00 177.06 176.73 2q3r n ASP 76 N -1.47 0.00 -4.69 1.69 3.85 -1.26 -4.76 116.55 109.91 2q3r n ASP 76 Ca 0.11 0.00 -0.34 0.00 -0.71 0.00 0.00 54.79 53.85 2q3r n ASP 76 Cb 0.51 0.00 -0.09 0.00 -1.35 0.00 0.00 41.12 40.19 2q3r n ASP 76 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.20 176.61 2q3r s THR 77 N -4.36 4.26 0.60 2.12 -4.23 -1.26 -2.20 115.64 110.58 2q3r s THR 77 Ca 0.00 -0.40 -0.15 0.00 -1.18 0.00 0.00 61.69 59.95 2q3r s THR 77 Cb 0.00 -2.85 -0.04 0.00 1.34 0.00 0.00 72.50 70.96 2q3r s THR 77 CO 0.00 0.50 1.05 -2.16 -0.54 0.00 0.00 174.62 173.47 2q3r s PRO 78 N -1.21 3.32 0.45 3.99 0.04 -1.26 -4.45 135.00 135.89 2q3r s PRO 78 Ca 0.16 1.17 0.05 0.00 0.04 0.00 0.00 61.00 62.43 2q3r s PRO 78 Cb -0.11 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.34 2q3r s PRO 78 CO 0.06 -0.80 0.03 0.20 0.04 0.00 0.00 177.00 176.53 2q3r s GLY 79 N -2.87 2.70 -0.36 0.56 0.00 -1.21 -0.27 107.32 105.87 2q3r s GLY 79 Ca 0.63 -1.49 0.10 0.00 0.00 0.00 0.00 44.72 43.96 2q3r s GLY 79 CO 0.38 -2.12 1.39 4.51 0.00 0.00 0.00 173.10 177.26 2q3r n ILE 80 N -1.13 0.00 0.53 0.90 3.06 -1.11 -4.69 119.36 116.93 2q3r n ILE 80 Ca -0.10 -1.24 0.05 0.00 -2.50 0.00 0.00 62.75 58.96 2q3r n ILE 80 Cb 0.67 0.97 -0.05 0.00 0.54 0.00 0.00 39.64 41.77 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 -0.93 0.00 -4.29 9.51 2.14 -1.26 -4.46 117.44 118.14 2q3r n TRP 81 Ca -0.10 0.00 -0.29 0.00 2.07 0.00 0.00 57.50 59.19 2q3r n TRP 81 Cb 0.84 0.00 -0.11 0.00 -0.81 0.00 0.00 31.31 31.24 2q3r n TRP 81 CO 0.00 0.00 0.00 0.95 2.07 0.00 0.00 177.69 180.71 2q3r s THR 82 N -1.95 2.99 0.38 -1.67 -4.23 -1.26 -4.96 115.64 104.95 2q3r s THR 82 Ca 0.06 -1.53 0.07 0.00 -1.18 0.00 0.00 61.69 59.11 2q3r s THR 82 Cb 0.09 -2.41 0.29 0.00 1.34 0.00 0.00 72.50 71.81 2q3r s THR 82 CO 0.43 0.04 2.00 0.11 -0.54 0.00 0.00 174.62 176.66 2q3r h LYS 83 N 3.49 0.65 0.44 3.99 6.56 -1.99 -1.05 116.57 128.66 2q3r h LYS 83 Ca -0.49 -0.04 -0.01 0.00 -1.06 0.00 0.00 60.65 59.05 2q3r h LYS 83 Cb 1.18 -0.15 -0.02 0.00 -0.57 0.00 0.00 32.23 32.67 2q3r h LYS 83 CO 0.49 0.43 -0.48 1.49 -2.06 0.00 0.00 179.45 179.32 2q3r h GLU 84 N 0.67 -0.89 -0.92 3.15 4.22 -1.99 0.15 114.58 118.96 2q3r h GLU 84 Ca 0.25 0.06 0.19 0.00 0.08 0.00 0.00 59.36 59.94 2q3r h GLU 84 Cb 0.15 0.20 -0.07 0.00 0.50 0.00 0.00 28.75 29.52 2q3r h GLU 84 CO -0.07 -0.60 0.60 0.45 -2.18 0.00 0.00 179.01 177.21 2q3r h HIS 85 N -0.93 0.69 0.13 0.92 3.86 -1.72 0.51 115.15 118.60 2q3r h HIS 85 Ca -0.05 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.18 2q3r h HIS 85 Cb 0.82 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 29.06 2q3r h HIS 85 CO -0.27 0.19 -0.14 0.28 0.86 0.00 0.00 177.93 178.85 2q3r h VAL 86 N 0.52 0.67 -0.56 2.45 2.07 -0.10 -1.63 116.25 119.68 2q3r h VAL 86 Ca 0.49 0.00 0.06 0.00 0.82 0.00 0.00 66.70 68.06 2q3r h VAL 86 Cb 1.04 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 2q3r h VAL 86 CO -0.22 0.00 0.37 -0.33 0.02 0.00 0.00 177.57 177.41 2q3r h GLU 87 N -0.31 0.52 -0.03 1.57 4.39 0.27 -2.57 114.58 118.42 2q3r h GLU 87 Ca 0.01 -0.03 -0.16 0.00 0.34 0.00 0.00 59.36 59.52 2q3r h GLU 87 Cb 0.30 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.82 2q3r h GLU 87 CO -0.05 0.34 -0.69 0.00 -1.16 0.00 0.00 179.01 177.45 2q3r h ALA 88 N 1.70 0.78 0.00 3.43 0.00 -0.28 -3.25 119.26 121.64 2q3r h ALA 88 Ca 0.24 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2q3r h ALA 88 Cb 0.26 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2q3r h ALA 88 CO -0.07 0.81 0.00 -1.49 0.00 0.00 0.00 179.25 178.50 2q3r h TRP 89 N 0.11 0.00 0.30 0.00 4.06 -0.90 -3.36 115.95 116.15 2q3r h TRP 89 Ca -0.02 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.94 2q3r h TRP 89 Cb 1.23 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.37 2q3r h TRP 89 CO 0.02 0.00 -0.31 0.87 -3.56 0.00 0.00 178.44 175.45 2q3r h LYS 90 N 0.00 -0.62 0.00 0.49 1.57 -1.57 -1.23 116.57 115.21 2q3r h LYS 90 Ca 0.00 0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 2q3r h LYS 90 Cb 0.81 0.14 -0.00 0.00 0.08 0.00 0.00 32.23 33.26 2q3r h LYS 90 CO 0.00 -0.42 -0.04 -1.00 -0.57 0.00 0.00 179.45 177.43 2q3r h PRO 91 N -0.65 0.00 -0.01 3.15 0.13 -1.78 0.11 132.00 132.95 2q3r h PRO 91 Ca -0.01 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.11 2q3r h PRO 91 Cb 0.60 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.73 2q3r h PRO 91 CO -0.07 0.04 -0.01 0.82 -0.23 0.00 0.00 178.00 178.54 2q3r h ILE 92 N 0.00 1.42 -0.73 -3.56 2.04 -1.64 -1.70 117.51 113.34 2q3r h ILE 92 Ca -0.00 -1.25 0.00 0.00 1.00 0.00 0.00 64.86 64.61 2q3r h ILE 92 Cb 0.16 2.24 -0.04 0.00 -0.74 0.00 0.00 36.82 38.45 2q3r h ILE 92 CO 0.01 0.33 0.46 0.58 0.00 0.00 0.00 178.15 179.52 2q3r h VAL 93 N -0.49 1.20 -0.54 1.67 2.07 -0.80 -2.65 116.25 116.70 2q3r h VAL 93 Ca 0.00 -0.40 -0.09 0.00 0.82 0.00 0.00 66.70 67.03 2q3r h VAL 93 Cb 0.55 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 2q3r h VAL 93 CO 0.00 0.20 -0.03 0.44 0.02 0.00 0.00 177.57 178.20 2q3r h ASP 94 N 1.00 0.93 0.30 0.57 5.19 -0.70 0.83 116.42 124.54 2q3r h ASP 94 Ca 0.26 -0.26 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2q3r h ASP 94 Cb -0.07 -0.25 0.00 0.00 0.18 0.00 0.00 39.33 39.19 2q3r h ASP 94 CO -0.05 1.01 0.00 0.00 -3.12 0.00 0.00 179.24 177.07 2q3r n ALA 95 N -2.48 1.84 -0.08 3.45 0.00 -0.65 -1.05 120.51 121.54 2q3r n ALA 95 Ca 0.02 -0.07 -0.10 0.00 0.00 0.00 0.00 53.44 53.29 2q3r n ALA 95 Cb 0.35 -1.25 -0.09 0.00 0.00 0.00 0.00 19.45 18.46 2q3r n ALA 95 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2q3r n VAL 96 N -1.30 0.96 0.13 0.00 0.31 -0.68 -3.98 118.33 113.78 2q3r n VAL 96 Ca 0.07 -0.45 -0.01 0.00 -0.01 0.00 0.00 64.34 63.94 2q3r n VAL 96 Cb 0.12 -0.94 0.20 0.00 -0.91 0.00 0.00 33.84 32.31 2q3r n VAL 96 CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 2q3r h HIS 97 N 0.00 0.09 0.00 3.52 -0.00 -0.59 -0.96 115.15 117.21 2q3r h HIS 97 Ca -0.38 -0.03 0.00 0.00 -0.00 0.00 0.00 60.37 59.96 2q3r h HIS 97 Cb 1.68 -0.02 0.00 0.00 -0.00 0.00 0.00 27.41 29.07 2q3r h HIS 97 CO 0.01 0.61 -0.29 0.00 -0.00 0.00 0.00 177.93 178.26 2q3r n ALA 98 N -2.45 2.59 1.07 2.45 0.00 -0.22 -3.09 120.51 120.87 2q3r n ALA 98 Ca -0.02 -0.13 0.12 0.00 0.00 0.00 0.00 53.44 53.41 2q3r n ALA 98 Cb 0.57 -1.33 0.27 0.00 0.00 0.00 0.00 19.45 18.95 2q3r n ALA 98 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2q3r n LYS 99 N -2.16 0.26 0.00 0.00 4.76 -0.90 -4.99 118.16 115.12 2q3r n LYS 99 Ca 0.05 -0.15 0.00 0.00 -2.87 0.00 0.00 58.31 55.33 2q3r n LYS 99 Cb 0.43 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.12 2q3r n LYS 99 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2q3r n GLY 100 N 1.45 0.92 3.80 0.72 0.00 -0.46 -3.78 105.19 107.84 2q3r n GLY 100 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 2q3r n GLY 100 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2q3r s GLY 101 N -2.24 1.83 -0.14 -0.02 0.00 -0.62 -1.11 107.32 105.01 2q3r s GLY 101 Ca 0.00 0.23 -0.06 0.00 0.00 0.00 0.00 44.72 44.89 2q3r s GLY 101 CO 0.00 0.55 0.06 -0.42 0.00 0.00 0.00 173.10 173.29 2q3r s ILE 102 N -2.81 4.82 -0.12 0.90 1.09 0.14 -4.47 121.20 120.75 2q3r s ILE 102 Ca 0.61 -0.04 -0.01 0.00 -1.10 0.00 0.00 60.65 60.11 2q3r s ILE 102 Cb -0.16 -3.12 0.03 0.00 -1.06 0.00 0.00 42.46 38.15 2q3r s ILE 102 CO 0.49 0.53 -0.05 0.12 -0.10 0.00 0.00 174.94 175.93 2q3r s PHE 103 N -0.25 1.38 -0.08 3.97 5.36 -1.25 -0.37 117.98 126.73 2q3r s PHE 103 Ca 0.08 -0.73 -0.00 0.00 -0.96 0.00 0.00 56.93 55.32 2q3r s PHE 103 Cb -0.12 -1.17 -0.03 0.00 -0.34 0.00 0.00 43.02 41.36 2q3r s PHE 103 CO 0.01 -0.51 -0.05 -0.06 -1.46 0.00 0.00 175.22 173.15 2q3r s PHE 104 N 1.74 2.99 -0.31 10.12 0.40 0.13 -0.10 117.98 132.95 2q3r s PHE 104 Ca 0.04 0.02 -0.19 0.00 -0.60 0.00 0.00 56.93 56.20 2q3r s PHE 104 Cb -0.13 -1.75 -0.01 0.00 0.51 0.00 0.00 43.02 41.64 2q3r s PHE 104 CO -0.08 0.32 0.57 0.00 0.70 0.00 0.00 175.22 176.74 2q3r s GLN 106 N 2.49 3.49 -0.10 0.00 0.74 -1.25 -1.40 119.66 123.62 2q3r s GLN 106 Ca 0.22 0.01 -0.10 0.00 0.05 0.00 0.00 55.36 55.55 2q3r s GLN 106 Cb -0.15 -3.92 -0.05 0.00 1.10 0.00 0.00 33.01 30.00 2q3r s GLN 106 CO 0.12 -1.10 0.23 0.96 -0.55 0.00 0.00 175.29 174.95 2q3r s ILE 107 N 3.36 5.34 0.03 -2.34 -4.36 -0.14 0.25 121.20 123.33 2q3r s ILE 107 Ca 0.32 0.42 -0.01 0.00 -0.26 0.00 0.00 60.65 61.12 2q3r s ILE 107 Cb -0.12 -3.52 -0.02 0.00 1.25 0.00 0.00 42.46 40.05 2q3r s ILE 107 CO 0.23 0.56 -0.02 -1.66 0.24 0.00 0.00 174.94 174.29 2q3r s TRP 108 N -0.73 0.33 -0.18 1.37 1.48 0.47 -1.53 118.94 120.14 2q3r s TRP 108 Ca 0.17 -0.67 0.01 0.00 -1.06 0.00 0.00 56.10 54.54 2q3r s TRP 108 Cb -0.13 -0.24 0.02 0.00 -1.16 0.00 0.00 33.47 31.96 2q3r s TRP 108 CO 0.06 -0.26 -0.17 -1.58 -4.06 0.00 0.00 176.95 170.95 2q3r s HIS 109 N -2.22 2.60 0.03 1.66 2.46 -1.26 -2.56 115.29 116.00 2q3r s HIS 109 Ca -0.09 -1.56 -0.18 0.00 0.47 0.00 0.00 55.06 53.70 2q3r s HIS 109 Cb -0.04 -1.80 -0.20 0.00 -0.13 0.00 0.00 32.58 30.40 2q3r s HIS 109 CO -0.04 -0.77 1.18 -0.39 -2.47 0.00 0.00 174.74 172.26 2q3r h VAL 110 N 6.06 1.39 0.00 0.89 -1.51 -1.23 0.61 116.25 122.44 2q3r h VAL 110 Ca -0.41 -1.92 0.00 0.00 -1.23 0.00 0.00 66.70 63.14 2q3r h VAL 110 Cb 1.13 2.34 0.00 0.00 -2.13 0.00 0.00 31.29 32.63 2q3r h VAL 110 CO 0.58 0.57 0.00 0.61 -1.23 0.00 0.00 177.57 178.10 2q3r n GLY 111 N 0.84 0.75 0.27 5.19 0.00 -1.26 -2.60 105.19 108.39 2q3r n GLY 111 Ca -0.09 -0.95 0.14 0.00 0.00 0.00 0.00 46.02 45.13 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 -3.97 1.61 0.11 -1.88 -3.37 114.38 106.88 2q3r h ARG 112 Ca 0.00 0.00 -0.46 0.00 0.10 0.00 0.00 59.98 59.62 2q3r h ARG 112 Cb 0.00 0.00 0.03 0.00 1.11 0.00 0.00 29.97 31.11 2q3r h ARG 112 CO 0.00 0.09 2.30 0.28 0.10 0.00 0.00 179.97 182.74 2q3r n VAL 113 N -3.52 1.88 -2.77 0.08 0.31 -1.26 -4.66 118.33 108.39 2q3r n VAL 113 Ca -0.02 -1.32 0.00 0.00 -0.01 0.00 0.00 64.34 63.00 2q3r n VAL 113 Cb 0.23 -2.15 0.00 0.00 -0.91 0.00 0.00 33.84 31.01 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 5.78 0.00 -2.09 4.52 2.88 -1.26 -4.05 113.62 119.40 2q3r n SER 114 Ca 0.43 -0.60 -0.02 0.00 -1.33 0.00 0.00 58.87 57.35 2q3r n SER 114 Cb 0.24 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.71 2q3r n SER 114 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2q3r n ASN 115 N -0.81 -0.88 -0.30 -3.46 2.04 -1.26 -3.23 115.26 107.36 2q3r n ASN 115 Ca 0.00 -1.48 0.12 0.00 -0.44 0.00 0.00 54.58 52.77 2q3r n ASN 115 Cb 0.00 1.44 0.29 0.00 -2.53 0.00 0.00 39.78 38.97 2q3r n ASN 115 CO 0.00 0.00 0.00 -1.28 -0.44 0.00 0.00 177.26 175.54 2q3r h SER 116 N 0.96 0.39 0.00 0.53 0.87 -1.87 0.12 113.55 114.55 2q3r h SER 116 Ca -0.14 0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2q3r h SER 116 Cb 0.59 0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.64 2q3r h SER 116 CO 0.18 0.06 0.00 0.61 -0.53 0.00 0.00 176.83 177.15 2q3r n GLY 117 N -1.33 1.36 0.00 5.77 0.00 -1.26 -3.21 105.19 106.52 2q3r n GLY 117 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 2q3r n GLY 117 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2q3r n PHE 118 N 0.08 0.00 -5.24 1.61 3.72 0.02 -5.01 117.46 112.64 2q3r n PHE 118 Ca 0.00 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.09 2q3r n PHE 118 Cb 0.24 0.00 -0.16 0.00 -0.94 0.00 0.00 39.48 38.61 2q3r n PHE 118 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 2q3r s GLN 119 N -0.08 2.23 0.68 -1.08 -1.52 -1.18 -4.78 119.66 113.93 2q3r s GLN 119 Ca 0.00 -0.89 -0.17 0.00 -1.95 0.00 0.00 55.36 52.36 2q3r s GLN 119 Cb 0.00 -2.03 -0.02 0.00 -0.22 0.00 0.00 33.01 30.75 2q3r s GLN 119 CO 0.00 0.46 0.93 -2.30 -0.25 0.00 0.00 175.29 174.13 2q3r n PRO 120 N 2.69 0.62 -0.98 2.91 -0.02 -1.26 -1.30 135.00 137.66 2q3r n PRO 120 Ca -0.17 0.26 -0.06 0.00 -2.02 0.00 0.00 63.50 61.52 2q3r n PRO 120 Cb 0.52 -2.17 -0.03 0.00 -0.02 0.00 0.00 33.50 31.80 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 -1.26 -3.68 -1.44 2.55 3.02 -1.26 -1.34 115.26 111.85 2q3r n ASN 121 Ca 0.13 0.15 -0.18 0.00 -0.03 0.00 0.00 54.58 54.65 2q3r n ASN 121 Cb 0.49 -2.80 -0.08 0.00 -0.61 0.00 0.00 39.78 36.78 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 0.24 1.72 3.72 7.41 0.00 -0.42 -4.96 105.19 112.89 2q3r n GLY 122 Ca -0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.52 0.83 0.57 1.61 1.02 -0.45 -4.84 119.74 114.95 2q3r s LYS 123 Ca 0.00 0.50 -0.19 0.00 0.02 0.00 0.00 55.97 56.30 2q3r s LYS 123 Cb 0.00 -1.79 -0.04 0.00 -0.52 0.00 0.00 37.83 35.48 2q3r s LYS 123 CO 0.00 -2.46 1.20 0.00 -0.92 0.00 0.00 175.35 173.17 2q3r s ALA 124 N -3.06 2.62 0.89 5.17 0.00 -1.26 -4.65 121.76 121.46 2q3r s ALA 124 Ca 0.64 0.99 -0.11 0.00 0.00 0.00 0.00 51.96 53.49 2q3r s ALA 124 Cb -0.17 -3.44 0.12 0.00 0.00 0.00 0.00 23.12 19.63 2q3r s ALA 124 CO 0.56 -1.07 1.10 -2.14 0.00 0.00 0.00 175.76 174.22 2q3r s PRO 125 N -3.24 1.31 0.17 0.00 0.02 -1.26 -4.73 135.00 127.27 2q3r s PRO 125 Ca 0.75 1.16 0.08 0.00 0.02 0.00 0.00 61.00 63.01 2q3r s PRO 125 Cb -0.30 -1.79 -0.04 0.00 0.02 0.00 0.00 34.50 32.39 2q3r s PRO 125 CO 0.33 -2.30 -0.08 0.96 -0.33 0.00 0.00 177.00 175.58 2q3r s ILE 126 N -2.79 3.32 0.19 2.83 -4.36 -1.26 -1.19 121.20 117.94 2q3r s ILE 126 Ca 0.64 -1.55 -0.05 0.00 -0.26 0.00 0.00 60.65 59.43 2q3r s ILE 126 Cb -0.20 -2.64 0.02 0.00 1.25 0.00 0.00 42.46 40.90 2q3r s ILE 126 CO 0.58 -0.08 0.35 -0.24 0.24 0.00 0.00 174.94 175.79 2q3r n SER 127 N 0.11 -1.01 0.17 4.36 2.88 -0.99 -3.07 113.62 116.07 2q3r n SER 127 Ca -0.11 -1.87 0.09 0.00 -1.33 0.00 0.00 58.87 55.65 2q3r n SER 127 Cb 0.55 1.73 0.09 0.00 -0.75 0.00 0.00 64.21 65.83 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 -3.04 -0.16 -1.30 0.00 7.64 -1.26 -4.47 113.62 111.03 2q3r n SER 129 Ca 0.02 -1.95 -0.07 0.00 1.01 0.00 0.00 58.87 57.88 2q3r n SER 129 Cb 0.60 0.70 0.19 0.00 -1.01 0.00 0.00 64.21 64.69 2q3r n SER 129 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2q3r n ASP 130 N -2.36 2.63 -4.66 6.43 5.75 -1.26 -3.85 116.55 119.23 2q3r n ASP 130 Ca 0.03 -3.78 -0.42 0.00 -0.01 0.00 0.00 54.79 50.61 2q3r n ASP 130 Cb 0.26 -0.66 -0.04 0.00 -1.03 0.00 0.00 41.12 39.66 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 4.26 0.46 0.11 1.02 -1.26 -4.80 119.74 116.26 2q3r s LYS 131 Ca 0.46 1.04 -0.24 0.00 0.02 0.00 0.00 55.97 57.25 2q3r s LYS 131 Cb 0.42 -3.60 -0.07 0.00 -0.52 0.00 0.00 37.83 34.05 2q3r s LYS 131 CO 0.01 -0.42 1.28 -1.25 -0.92 0.00 0.00 175.35 174.05 2q3r s PRO 132 N 2.48 3.66 -0.21 -1.68 0.04 -1.26 -4.68 135.00 133.34 2q3r s PRO 132 Ca 0.38 2.08 -0.09 0.00 0.04 0.00 0.00 61.00 63.41 2q3r s PRO 132 Cb -0.16 -2.51 -0.05 0.00 0.04 0.00 0.00 34.50 31.83 2q3r s PRO 132 CO 0.10 -0.72 0.12 -1.17 0.04 0.00 0.00 177.00 175.36 2q3r s LEU 133 N -2.93 3.98 -1.50 -3.56 2.96 -1.26 -4.57 118.68 111.80 2q3r s LEU 133 Ca 0.63 0.10 -0.05 0.00 -0.22 0.00 0.00 54.13 54.58 2q3r s LEU 133 Cb -0.36 -2.04 0.05 0.00 0.50 0.00 0.00 46.19 44.33 2q3r s LEU 133 CO 0.45 0.11 0.52 0.23 -1.32 0.00 0.00 176.35 176.34 2q3r n MET 134 N 3.96 -3.24 -0.36 1.98 2.81 -1.26 -4.44 117.12 116.56 2q3r n MET 134 Ca -0.16 0.39 0.27 0.00 -1.81 0.00 0.00 57.70 56.39 2q3r n MET 134 Cb 0.52 -4.67 0.54 0.00 -0.71 0.00 0.00 33.22 28.90 2q3r n MET 134 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 2q3r h PRO 135 N -1.76 0.28 0.00 0.03 0.13 -1.94 0.53 132.00 129.28 2q3r h PRO 135 Ca -0.62 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.49 2q3r h PRO 135 Cb 1.38 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2q3r h PRO 135 CO 0.67 0.19 0.00 -0.56 -0.23 0.00 0.00 178.00 178.07 2q3r h GLN 136 N 0.29 0.00 -4.99 0.86 -0.00 -1.99 -3.41 115.11 105.87 2q3r h GLN 136 Ca 0.70 0.00 -0.66 0.00 -0.00 0.00 0.00 58.65 58.69 2q3r h GLN 136 Cb 1.86 0.00 -0.27 0.00 -0.00 0.00 0.00 27.48 29.07 2q3r h GLN 136 CO -0.41 0.00 -0.71 0.42 -0.00 0.00 0.00 178.83 178.13 2q3r s ILE 137 N -3.59 3.50 0.21 1.86 1.01 0.19 -5.09 121.20 119.29 2q3r s ILE 137 Ca -0.01 -0.45 0.08 0.00 0.00 0.00 0.00 60.65 60.26 2q3r s ILE 137 Cb 0.08 -2.60 -0.04 0.00 0.01 0.00 0.00 42.46 39.91 2q3r s ILE 137 CO 0.27 0.41 0.03 -0.13 0.00 0.00 0.00 174.94 175.53 2q3r s ARG 138 N 1.50 2.47 0.73 2.79 3.00 -1.26 -0.99 118.95 127.19 2q3r s ARG 138 Ca 0.06 -1.18 -0.15 0.00 0.00 0.00 0.00 55.73 54.45 2q3r s ARG 138 Cb -0.14 -2.34 0.04 0.00 0.00 0.00 0.00 34.95 32.50 2q3r s ARG 138 CO -0.02 0.42 1.21 0.45 0.00 0.00 0.00 175.30 177.35 2q3r s SER 139 N -3.31 4.22 -0.37 0.23 0.15 -0.75 -4.63 113.70 109.23 2q3r s SER 139 Ca 0.30 2.35 -0.44 0.00 0.70 0.00 0.00 55.95 58.86 2q3r s SER 139 Cb -0.08 -2.59 -0.18 0.00 -1.71 0.00 0.00 66.02 61.46 2q3r s SER 139 CO 0.20 -2.25 1.63 0.59 1.20 0.00 0.00 173.24 174.61 2q3r n ASN 140 N -2.71 1.63 0.00 5.45 5.03 -1.26 -3.67 115.26 119.73 2q3r n ASN 140 Ca 0.13 1.14 0.00 0.00 0.87 0.00 0.00 54.58 56.72 2q3r n ASN 140 Cb 0.50 -0.99 0.00 0.00 -1.02 0.00 0.00 39.78 38.27 2q3r n ASN 140 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2q3r n GLY 141 N 3.92 0.93 3.48 7.41 0.00 -1.26 -5.00 105.19 114.67 2q3r n GLY 141 Ca 0.28 -0.53 -0.38 0.00 0.00 0.00 0.00 46.02 45.39 2q3r n GLY 141 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2q3r n ILE 142 N 0.00 2.34 0.56 -0.61 5.41 -1.24 -4.82 119.36 121.00 2q3r n ILE 142 Ca 0.00 -0.50 0.02 0.00 1.00 0.00 0.00 62.75 63.27 2q3r n ILE 142 Cb 0.00 -0.72 0.11 0.00 -0.71 0.00 0.00 39.64 38.32 2q3r n ILE 142 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 2q3r n ASP 143 N 0.45 2.19 -4.66 4.38 5.68 -1.26 -4.30 116.55 119.03 2q3r n ASP 143 Ca 0.12 -2.23 -0.43 0.00 -0.50 0.00 0.00 54.79 51.75 2q3r n ASP 143 Cb 0.47 -0.52 -0.03 0.00 -1.14 0.00 0.00 41.12 39.91 2q3r n ASP 143 CO 0.00 0.00 0.00 -0.70 -1.33 0.00 0.00 177.20 175.17 2q3r s GLU 144 N -1.50 4.27 0.23 0.11 2.12 -1.26 -4.92 118.70 117.74 2q3r s GLU 144 Ca 0.15 1.27 -0.28 0.00 0.36 0.00 0.00 54.97 56.47 2q3r s GLU 144 Cb 0.11 -3.63 -0.16 0.00 0.26 0.00 0.00 34.13 30.72 2q3r s GLU 144 CO 0.05 -0.55 0.74 0.00 -0.54 0.00 0.00 175.26 174.95 2q3r n ALA 145 N 6.04 -1.78 -0.04 6.30 0.00 -1.26 -1.81 120.51 127.96 2q3r n ALA 145 Ca 0.10 0.42 -0.11 0.00 0.00 0.00 0.00 53.44 53.85 2q3r n ALA 145 Cb 0.47 -1.78 -0.05 0.00 0.00 0.00 0.00 19.45 18.08 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 1.47 0.22 -8.48 0.00 5.85 -1.32 -3.37 115.31 109.68 2q3r h LEU 146 Ca -0.33 -0.17 -0.72 0.00 0.84 0.00 0.00 57.88 57.50 2q3r h LEU 146 Cb 1.40 -0.06 -0.21 0.00 0.37 0.00 0.00 40.66 42.16 2q3r h LEU 146 CO 0.59 0.33 -0.38 -0.36 -0.34 0.00 0.00 178.44 178.28 2q3r s PHE 147 N -5.54 3.23 -0.03 1.25 0.40 -1.26 -4.57 117.98 111.46 2q3r s PHE 147 Ca -0.14 -0.61 -0.34 0.00 -0.60 0.00 0.00 56.93 55.25 2q3r s PHE 147 Cb 0.07 -2.72 -0.12 0.00 0.51 0.00 0.00 43.02 40.76 2q3r s PHE 147 CO 0.70 -0.64 1.85 2.41 0.70 0.00 0.00 175.22 180.25 2q3r n THR 148 N 5.21 0.53 -1.59 0.64 -1.04 -1.20 -4.61 114.28 112.21 2q3r n THR 148 Ca -0.11 -0.09 -0.47 0.00 -2.04 0.00 0.00 64.05 61.34 2q3r n THR 148 Cb 0.47 -1.90 -0.03 0.00 -1.82 0.00 0.00 70.33 67.05 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 6.32 1.33 -2.59 -2.82 -0.02 -1.26 -4.41 135.00 131.55 2q3r n PRO 149 Ca 0.21 0.47 -0.33 0.00 -2.02 0.00 0.00 63.50 61.84 2q3r n PRO 149 Cb 0.31 -1.93 -0.05 0.00 -0.02 0.00 0.00 33.50 31.81 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 -0.84 3.99 -0.13 0.52 0.04 -1.26 -4.42 135.00 132.90 2q3r s PRO 150 Ca 0.67 1.13 -0.20 0.00 0.04 0.00 0.00 61.00 62.64 2q3r s PRO 150 Cb -0.77 -2.14 -0.04 0.00 0.04 0.00 0.00 34.50 31.60 2q3r s PRO 150 CO 0.55 -0.24 0.57 0.50 0.04 0.00 0.00 177.00 178.41 2q3r s ARG 151 N -3.51 4.33 -0.12 4.56 3.52 -0.33 -4.51 118.95 122.89 2q3r s ARG 151 Ca 0.62 0.59 -0.29 0.00 -0.13 0.00 0.00 55.73 56.52 2q3r s ARG 151 Cb -0.11 -3.48 -0.04 0.00 -1.56 0.00 0.00 34.95 29.76 2q3r s ARG 151 CO 0.21 0.03 1.51 0.50 -0.81 0.00 0.00 175.30 176.75 2q3r s ARG 152 N 1.00 4.13 0.14 5.12 3.52 -1.25 -2.34 118.95 129.27 2q3r s ARG 152 Ca 0.29 1.92 -0.32 0.00 -0.13 0.00 0.00 55.73 57.48 2q3r s ARG 152 Cb -0.16 -3.92 -0.12 0.00 -1.56 0.00 0.00 34.95 29.19 2q3r s ARG 152 CO 0.12 -0.88 1.74 1.28 -0.81 0.00 0.00 175.30 176.75 2q3r n LEU 153 N 7.18 3.70 -4.74 -0.88 4.77 -0.76 -4.96 117.00 121.32 2q3r n LEU 153 Ca 0.16 1.03 -0.41 0.00 -0.03 0.00 0.00 56.01 56.76 2q3r n LEU 153 Cb 0.44 -1.50 -0.02 0.00 -2.33 0.00 0.00 43.42 40.00 2q3r n LEU 153 CO 0.61 0.02 1.11 -0.83 -1.33 0.00 0.00 177.39 176.97 2q3r s GLY 154 N 1.90 2.25 0.58 -0.72 0.00 -1.26 -4.85 107.32 105.22 2q3r s GLY 154 Ca 0.80 1.31 0.28 0.00 0.00 0.00 0.00 44.72 47.11 2q3r s GLY 154 CO 0.37 2.30 2.05 1.19 0.00 0.00 0.00 173.10 179.02 2q3r h ILE 155 N 3.61 0.49 -0.24 0.90 2.10 -2.01 -0.36 117.51 122.00 2q3r h ILE 155 Ca -0.45 0.00 -0.13 0.00 1.08 0.00 0.00 64.86 65.36 2q3r h ILE 155 Cb 1.22 0.79 -0.01 0.00 -1.09 0.00 0.00 36.82 37.73 2q3r h ILE 155 CO 0.79 0.00 -0.38 -0.33 -1.08 0.00 0.00 178.15 177.16 2q3r h GLU 156 N 0.00 0.55 -0.95 2.19 4.39 -2.03 -3.09 114.58 115.64 2q3r h GLU 156 Ca 0.12 -0.27 -0.17 0.00 0.34 0.00 0.00 59.36 59.39 2q3r h GLU 156 Cb 0.65 -0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.19 2q3r h GLU 156 CO -0.00 0.84 0.22 -0.85 -1.16 0.00 0.00 179.01 178.06 2q3r n GLU 157 N -4.04 1.91 -0.10 2.33 0.28 -0.15 -4.17 120.64 116.71 2q3r n GLU 157 Ca -0.01 -1.39 -0.15 0.00 -0.16 0.00 0.00 57.16 55.45 2q3r n GLU 157 Cb 0.50 -1.63 -0.09 0.00 1.43 0.00 0.00 31.44 31.65 2q3r n GLU 157 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 2q3r n ILE 158 N -0.10 1.10 0.18 3.84 5.41 -1.17 -4.29 119.36 124.34 2q3r n ILE 158 Ca 0.23 -0.40 0.12 0.00 1.00 0.00 0.00 62.75 63.70 2q3r n ILE 158 Cb 0.94 -1.27 0.67 0.00 -0.71 0.00 0.00 39.64 39.27 2q3r n ILE 158 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 2q3r h PRO 159 N -0.11 0.00 -0.30 0.38 0.11 -1.76 -0.88 132.00 129.43 2q3r h PRO 159 Ca -0.44 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.64 2q3r h PRO 159 Cb 1.63 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.73 2q3r h PRO 159 CO -0.11 0.00 0.07 0.78 -0.21 0.00 0.00 178.00 178.53 2q3r h GLY 160 N 0.00 0.53 1.34 -0.55 0.00 -1.82 -0.79 103.07 101.77 2q3r h GLY 160 Ca 0.08 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.07 2q3r h GLY 160 CO -0.00 0.31 0.41 -2.22 0.00 0.00 0.00 176.54 175.05 2q3r h ILE 161 N 0.33 1.18 -0.80 2.60 2.04 -1.38 0.31 117.51 121.79 2q3r h ILE 161 Ca 0.09 -0.37 -0.02 0.00 1.00 0.00 0.00 64.86 65.56 2q3r h ILE 161 Cb 0.30 0.23 -0.04 0.00 -0.74 0.00 0.00 36.82 36.58 2q3r h ILE 161 CO 0.00 0.18 0.40 0.58 0.00 0.00 0.00 178.15 179.32 2q3r h VAL 162 N 0.91 1.25 0.00 1.67 2.07 -0.90 0.50 116.25 121.75 2q3r h VAL 162 Ca 0.24 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 67.09 2q3r h VAL 162 Cb -0.06 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 29.92 2q3r h VAL 162 CO -0.05 0.29 0.00 -3.20 0.02 0.00 0.00 177.57 174.63 2q3r n ASN 163 N -4.37 0.78 -0.22 0.57 4.05 -0.02 -2.68 115.26 113.37 2q3r n ASN 163 Ca 0.08 0.63 -0.08 0.00 0.45 0.00 0.00 54.58 55.65 2q3r n ASN 163 Cb 0.12 -0.82 0.03 0.00 1.23 0.00 0.00 39.78 40.35 2q3r n ASN 163 CO 0.00 0.00 0.00 0.44 -3.05 0.00 0.00 177.26 174.65 2q3r h ASP 164 N 0.00 0.87 -0.18 1.20 3.32 0.18 0.03 116.42 121.85 2q3r h ASP 164 Ca 0.00 -0.20 -0.09 0.00 0.02 0.00 0.00 57.03 56.76 2q3r h ASP 164 Cb 0.57 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.89 2q3r h ASP 164 CO 0.00 0.84 -0.25 -0.26 -1.72 0.00 0.00 179.24 177.84 2q3r h PHE 165 N 0.85 0.60 -0.95 4.55 -1.00 -1.26 -1.97 116.94 117.76 2q3r h PHE 165 Ca 0.20 -0.20 0.09 0.00 2.81 0.00 0.00 57.97 60.87 2q3r h PHE 165 Cb 0.27 -0.12 -0.07 0.00 3.61 0.00 0.00 35.95 39.64 2q3r h PHE 165 CO 0.02 0.89 0.59 -0.09 -1.61 0.00 0.00 178.31 178.11 2q3r h ARG 166 N 0.14 0.98 0.44 1.51 2.43 -1.39 0.13 114.38 118.61 2q3r h ARG 166 Ca 0.02 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 2q3r h ARG 166 Cb 0.82 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 2q3r h ARG 166 CO 0.06 0.65 -0.21 1.25 -1.51 0.00 0.00 179.97 180.20 2q3r h LEU 167 N 1.01 -0.50 -1.72 3.80 5.85 -0.90 0.18 115.31 123.02 2q3r h LEU 167 Ca 0.44 -0.08 0.17 0.00 0.84 0.00 0.00 57.88 59.25 2q3r h LEU 167 Cb 0.33 0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.44 2q3r h LEU 167 CO -0.22 -0.19 0.51 0.00 -0.34 0.00 0.00 178.44 178.19 2q3r h ALA 168 N -0.37 2.32 0.29 1.25 0.00 -1.06 0.14 119.26 121.83 2q3r h ALA 168 Ca -0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2q3r h ALA 168 Cb 0.55 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2q3r h ALA 168 CO 0.10 -0.53 -0.14 0.00 0.00 0.00 0.00 179.25 178.68 2q3r h ALA 169 N 1.65 -0.39 -0.79 0.00 0.00 -0.14 -1.19 119.26 118.41 2q3r h ALA 169 Ca 0.37 -0.18 0.18 0.00 0.00 0.00 0.00 54.91 55.27 2q3r h ALA 169 Cb 1.05 0.15 -0.12 0.00 0.00 0.00 0.00 17.79 18.88 2q3r h ALA 169 CO -0.09 -0.54 0.22 -0.09 0.00 0.00 0.00 179.25 178.75 2q3r h ARG 170 N -0.74 0.28 -0.11 0.00 9.65 0.11 0.48 114.38 124.06 2q3r h ARG 170 Ca -0.04 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.82 2q3r h ARG 170 Cb 0.50 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 29.01 2q3r h ARG 170 CO 0.07 0.19 0.07 -0.91 2.80 0.00 0.00 179.97 182.18 2q3r h ASN 171 N 0.29 0.12 -0.95 -3.80 4.21 -0.64 -1.87 115.58 112.95 2q3r h ASN 171 Ca 0.46 -0.01 0.29 0.00 1.21 0.00 0.00 56.30 58.25 2q3r h ASN 171 Cb 0.81 -0.03 -0.15 0.00 -1.12 0.00 0.00 38.32 37.83 2q3r h ASN 171 CO -0.53 0.10 0.39 0.00 -1.29 0.00 0.00 177.43 176.10 2q3r h ALA 172 N 1.03 1.64 -0.39 -0.83 0.00 0.35 2.30 119.26 123.36 2q3r h ALA 172 Ca 0.04 0.22 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 2q3r h ALA 172 Cb -0.01 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2q3r h ALA 172 CO -0.01 -0.56 0.18 0.52 0.00 0.00 0.00 179.25 179.38 2q3r h MET 173 N 0.23 0.58 -0.36 0.00 2.86 -0.75 0.41 114.93 117.90 2q3r h MET 173 Ca 0.66 -0.09 -0.02 0.00 -2.06 0.00 0.00 59.70 58.18 2q3r h MET 173 Cb 1.45 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 33.00 2q3r h MET 173 CO -0.66 0.52 0.14 1.49 1.06 0.00 0.00 176.91 179.46 2q3r h GLU 174 N 0.49 0.51 0.00 1.72 4.81 0.39 0.42 114.58 122.93 2q3r h GLU 174 Ca 0.13 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2q3r h GLU 174 Cb 0.15 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.43 2q3r h GLU 174 CO -0.01 0.43 -0.02 0.00 -0.73 0.00 0.00 179.01 178.68 2q3r h ALA 175 N 1.64 1.00 0.00 2.92 0.00 0.17 -3.47 119.26 121.52 2q3r h ALA 175 Ca 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2q3r h ALA 175 Cb 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2q3r h ALA 175 CO -0.01 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.67 2q3r n GLY 176 N 0.40 0.88 3.56 0.00 0.00 0.15 -4.48 105.19 105.71 2q3r n GLY 176 Ca 0.02 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.55 2q3r n GLY 176 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2q3r s PHE 177 N -2.00 1.13 -1.83 1.61 0.40 -0.25 -4.93 117.98 112.10 2q3r s PHE 177 Ca 0.00 0.82 0.25 0.00 -0.60 0.00 0.00 56.93 57.40 2q3r s PHE 177 Cb 0.00 -3.23 0.51 0.00 0.51 0.00 0.00 43.02 40.81 2q3r s PHE 177 CO 0.00 -3.70 1.41 -0.25 0.70 0.00 0.00 175.22 173.39 2q3r n ASP 178 N -4.72 1.33 0.00 1.36 8.00 0.86 -4.75 116.55 118.63 2q3r n ASP 178 Ca 0.08 -1.08 0.00 0.00 0.71 0.00 0.00 54.79 54.49 2q3r n ASP 178 Cb 0.58 0.25 0.00 0.00 -0.02 0.00 0.00 41.12 41.93 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 1.37 -0.94 3.54 0.44 0.00 -1.25 -4.67 105.19 103.68 2q3r n GLY 179 Ca 0.11 -1.12 -0.30 0.00 0.00 0.00 0.00 46.02 44.71 2q3r n GLY 179 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2q3r s VAL 180 N -3.00 3.16 -0.34 1.61 1.01 0.41 -2.40 120.40 120.85 2q3r s VAL 180 Ca 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 61.98 60.61 2q3r s VAL 180 Cb 0.00 -2.47 0.11 0.00 0.00 0.00 0.00 36.38 34.02 2q3r s VAL 180 CO 0.00 0.10 0.13 -0.70 0.00 0.00 0.00 175.10 174.63 2q3r s GLU 181 N -2.19 0.89 -0.02 2.72 -6.30 -0.49 0.94 118.70 114.25 2q3r s GLU 181 Ca 0.20 -1.34 -0.30 0.00 -2.50 0.00 0.00 54.97 51.03 2q3r s GLU 181 Cb -0.11 -2.14 -0.04 0.00 0.00 0.00 0.00 34.13 31.84 2q3r s GLU 181 CO 0.12 -1.03 1.25 0.42 0.02 0.00 0.00 175.26 176.05 2q3r s ILE 182 N 1.28 4.07 -1.01 -3.70 1.01 -0.93 -0.97 121.20 120.95 2q3r s ILE 182 Ca 0.12 1.43 -0.13 0.00 0.00 0.00 0.00 60.65 62.07 2q3r s ILE 182 Cb -0.19 -3.92 0.21 0.00 0.01 0.00 0.00 42.46 38.57 2q3r s ILE 182 CO -0.18 0.02 1.08 -2.28 0.00 0.00 0.00 174.94 173.58 2q3r s HIS 183 N 2.06 3.75 -0.49 3.97 5.65 -0.58 -2.12 115.29 127.52 2q3r s HIS 183 Ca 0.58 -2.13 0.02 0.00 0.25 0.00 0.00 55.06 53.79 2q3r s HIS 183 Cb -0.27 -4.01 0.49 0.00 -1.18 0.00 0.00 32.58 27.60 2q3r s HIS 183 CO 0.24 -1.15 1.73 0.41 -0.65 0.00 0.00 174.74 175.32 2q3r n GLY 184 N 3.89 5.70 0.00 1.59 0.00 -1.25 -4.50 105.19 110.62 2q3r n GLY 184 Ca 0.23 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 44.16 2q3r n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q3r n ALA 185 N -0.93 0.00 -4.32 4.61 0.00 -1.26 -2.85 120.51 115.77 2q3r n ALA 185 Ca 0.54 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.62 2q3r n ALA 185 Cb 0.92 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.31 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 -1.12 -1.22 -0.01 0.00 3.02 -1.26 -2.00 115.26 112.66 2q3r n ASN 186 Ca 0.00 -1.16 -0.00 0.00 -0.03 0.00 0.00 54.58 53.39 2q3r n ASN 186 Cb 0.00 -2.10 -0.00 0.00 -0.61 0.00 0.00 39.78 37.07 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 -1.70 0.28 0.00 7.41 0.00 -1.24 -4.73 105.19 105.22 2q3r n GLY 187 Ca -0.08 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.55 -0.93 0.19 1.61 4.01 -0.85 -4.63 117.16 114.02 2q3r n TYR 188 Ca -0.00 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.59 2q3r n TYR 188 Cb 0.23 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.19 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 -0.81 -0.55 7.72 5.85 -0.61 -1.15 115.31 125.76 2q3r h LEU 189 Ca 0.00 0.07 -0.06 0.00 0.84 0.00 0.00 57.88 58.73 2q3r h LEU 189 Cb 0.00 0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 2q3r h LEU 189 CO 0.00 -0.43 0.10 0.40 -0.34 0.00 0.00 178.44 178.17 2q3r h ILE 190 N -0.63 1.25 -0.03 4.05 2.04 -1.79 -3.00 117.51 119.41 2q3r h ILE 190 Ca -0.01 -0.95 0.02 0.00 1.00 0.00 0.00 64.86 64.92 2q3r h ILE 190 Cb 0.58 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.43 2q3r h ILE 190 CO -0.06 0.34 -0.12 -0.78 0.00 0.00 0.00 178.15 177.53 2q3r h ASP 191 N 0.80 -0.34 0.00 1.72 3.58 -1.45 -0.11 116.42 120.62 2q3r h ASP 191 Ca 0.17 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.68 2q3r h ASP 191 Cb 0.40 0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.60 2q3r h ASP 191 CO 0.01 -0.16 0.27 1.56 -2.88 0.00 0.00 179.24 178.03 2q3r h GLN 192 N -0.18 0.00 0.14 0.28 4.20 -1.08 -0.19 115.11 118.28 2q3r h GLN 192 Ca 0.05 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.55 2q3r h GLN 192 Cb 0.25 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.05 2q3r h GLN 192 CO -0.14 0.00 -1.00 0.74 -0.67 0.00 0.00 178.83 177.76 2q3r h PHE 193 N 0.00 0.53 -0.19 2.96 0.05 -0.88 -3.32 116.94 116.10 2q3r h PHE 193 Ca 0.00 -0.39 -0.15 0.00 3.82 0.00 0.00 57.97 61.26 2q3r h PHE 193 Cb 0.53 -0.02 -0.01 0.00 2.00 0.00 0.00 35.95 38.45 2q3r h PHE 193 CO 0.00 1.39 -0.50 0.52 -0.18 0.00 0.00 178.31 179.54 2q3r h MET 194 N -0.34 0.50 -6.17 1.51 2.86 -0.93 -3.41 114.93 108.96 2q3r h MET 194 Ca -0.19 -0.30 -0.57 0.00 -2.06 0.00 0.00 59.70 56.59 2q3r h MET 194 Cb 1.69 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 33.34 2q3r h MET 194 CO 0.13 0.89 0.90 0.15 1.06 0.00 0.00 176.91 180.04 2q3r s LYS 195 N -4.06 4.24 0.00 1.72 -0.14 -0.84 -4.83 119.74 115.83 2q3r s LYS 195 Ca -0.07 1.69 0.00 0.00 -1.36 0.00 0.00 55.97 56.24 2q3r s LYS 195 Cb 0.12 -3.76 0.00 0.00 -1.68 0.00 0.00 37.83 32.51 2q3r s LYS 195 CO 0.83 -0.70 0.59 -0.40 -0.76 0.00 0.00 175.35 174.91 2q3r n ASP 196 N 6.53 0.25 -0.13 2.83 5.75 -1.26 -2.29 116.55 128.22 2q3r n ASP 196 Ca 0.14 -1.43 0.05 0.00 -0.01 0.00 0.00 54.79 53.54 2q3r n ASP 196 Cb 0.45 -0.13 -0.03 0.00 -1.03 0.00 0.00 41.12 40.38 2q3r n ASP 196 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2q3r n THR 197 N -0.27 0.00 -0.05 2.12 -2.24 -1.23 -4.67 114.28 107.94 2q3r n THR 197 Ca 0.00 -0.33 -0.07 0.00 -2.27 0.00 0.00 64.05 61.38 2q3r n THR 197 Cb 0.06 1.07 -0.06 0.00 -2.10 0.00 0.00 70.33 69.30 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 -0.69 0.64 -3.28 2.28 0.31 -0.97 -4.94 118.33 111.69 2q3r n VAL 198 Ca 0.03 -0.30 -0.43 0.00 -0.01 0.00 0.00 64.34 63.63 2q3r n VAL 198 Cb 0.19 -0.85 -0.08 0.00 -0.91 0.00 0.00 33.84 32.19 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 -4.75 6.20 -0.28 4.52 2.47 -1.15 -4.51 114.94 117.44 2q3r s ASN 199 Ca -0.12 -0.83 0.09 0.00 0.42 0.00 0.00 52.86 52.42 2q3r s ASN 199 Cb 0.04 -2.24 0.47 0.00 -1.45 0.00 0.00 41.25 38.07 2q3r s ASN 199 CO 0.30 -0.69 1.37 -0.90 -3.72 0.00 0.00 177.10 173.46 2q3r n ASP 200 N 5.72 2.71 -4.77 -4.21 5.75 -1.26 -4.61 116.55 115.88 2q3r n ASP 200 Ca -0.08 -3.83 -0.36 0.00 -0.01 0.00 0.00 54.79 50.51 2q3r n ASP 200 Cb 0.46 -0.58 0.01 0.00 -1.03 0.00 0.00 41.12 39.98 2q3r n ASP 200 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2q3r s ARG 201 N -3.32 3.43 -0.13 0.11 0.52 -1.26 -4.88 118.95 113.42 2q3r s ARG 201 Ca 0.44 1.74 0.15 0.00 -0.52 0.00 0.00 55.73 57.55 2q3r s ARG 201 Cb 0.40 -2.16 0.42 0.00 0.52 0.00 0.00 34.95 34.13 2q3r s ARG 201 CO -0.02 -0.82 1.32 0.25 0.02 0.00 0.00 175.30 176.05 2q3r n THR 202 N -1.03 1.94 -2.03 0.02 -2.24 -1.26 -2.44 114.28 107.24 2q3r n THR 202 Ca 0.10 -1.77 0.00 0.00 -2.27 0.00 0.00 64.05 60.11 2q3r n THR 202 Cb 0.49 -0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.63 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 -0.54 0.52 0.08 3.42 3.85 -1.26 -5.01 116.55 117.61 2q3r n ASP 203 Ca 0.18 0.00 0.12 0.00 -0.71 0.00 0.00 54.79 54.38 2q3r n ASP 203 Cb 0.73 0.00 0.46 0.00 -1.35 0.00 0.00 41.12 40.97 2q3r n ASP 203 CO 0.00 0.00 0.00 -1.84 -1.01 0.00 0.00 177.20 174.35 2q3r n GLU 204 N 0.00 0.16 -0.46 0.11 0.28 -1.26 -3.26 120.64 116.21 2q3r n GLU 204 Ca 0.00 0.22 0.07 0.00 -0.16 0.00 0.00 57.16 57.30 2q3r n GLU 204 Cb 0.00 -1.72 0.27 0.00 1.43 0.00 0.00 31.44 31.43 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 -2.00 1.11 -3.77 -1.84 4.01 -1.26 -4.64 117.16 108.77 2q3r n TYR 205 Ca 0.05 -0.45 -0.03 0.00 -0.16 0.00 0.00 57.90 57.31 2q3r n TYR 205 Cb 0.33 -0.18 -0.00 0.00 -0.31 0.00 0.00 39.34 39.18 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 -0.82 -0.17 0.00 2.72 0.00 -1.20 -4.26 107.32 103.58 2q3r s GLY 206 Ca 0.39 0.09 0.00 0.00 0.00 0.00 0.00 44.72 45.20 2q3r s GLY 206 CO 0.20 0.67 0.00 0.61 0.00 0.00 0.00 173.10 174.57 2q3r n GLY 207 N -0.54 0.55 3.59 0.20 0.00 -1.02 -4.31 105.19 103.67 2q3r n GLY 207 Ca -0.06 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.00 -0.27 0.15 1.61 1.04 -1.26 -4.99 113.70 107.98 2q3r s SER 208 Ca 0.00 -0.13 -0.18 0.00 0.48 0.00 0.00 55.95 56.12 2q3r s SER 208 Cb 0.00 0.38 0.04 0.00 0.10 0.00 0.00 66.02 66.54 2q3r s SER 208 CO 0.00 -0.65 1.70 0.25 0.98 0.00 0.00 173.24 175.52 2q3r h LEU 209 N 2.00 -0.19 -0.17 2.42 5.85 -1.96 0.45 115.31 123.70 2q3r h LEU 209 Ca -0.22 0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.63 2q3r h LEU 209 Cb 1.23 0.15 -0.06 0.00 0.37 0.00 0.00 40.66 42.35 2q3r h LEU 209 CO 0.28 -0.06 -0.25 1.56 -0.34 0.00 0.00 178.44 179.64 2q3r h GLN 210 N 0.05 -0.28 -0.70 1.25 4.20 -1.98 -1.00 115.11 116.66 2q3r h GLN 210 Ca 0.15 0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.81 2q3r h GLN 210 Cb 0.21 0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.03 2q3r h GLN 210 CO -0.28 -0.19 0.17 -0.91 -0.67 0.00 0.00 178.83 176.96 2q3r h ASN 211 N -0.29 1.05 -0.79 1.46 2.35 -1.67 -2.23 115.58 115.46 2q3r h ASN 211 Ca 0.11 -0.22 0.07 0.00 -0.55 0.00 0.00 56.30 55.71 2q3r h ASN 211 Cb 0.46 -0.28 -0.06 0.00 0.05 0.00 0.00 38.32 38.49 2q3r h ASN 211 CO -0.34 1.01 0.47 0.03 -1.65 0.00 0.00 177.43 176.95 2q3r h ARG 212 N 1.05 0.82 -0.01 0.81 3.08 0.71 -1.13 114.38 119.72 2q3r h ARG 212 Ca 0.22 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2q3r h ARG 212 Cb 0.37 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.23 2q3r h ARG 212 CO 0.00 0.55 -0.10 0.00 -1.07 0.00 0.00 179.97 179.34 2q3r n LYS 214 N -0.62 0.00 -0.04 0.00 3.00 -0.43 -2.75 118.16 117.32 2q3r n LYS 214 Ca 0.16 0.27 -0.05 0.00 -0.00 0.00 0.00 58.31 58.70 2q3r n LYS 214 Cb 0.29 -1.66 -0.02 0.00 0.00 0.00 0.00 35.03 33.65 2q3r n LYS 214 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 2q3r n PHE 215 N -1.24 0.00 0.06 5.64 7.35 -1.25 -4.37 117.46 123.64 2q3r n PHE 215 Ca 0.00 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.56 2q3r n PHE 215 Cb 0.16 -0.25 -0.08 0.00 0.35 0.00 0.00 39.48 39.65 2q3r n PHE 215 CO 0.00 0.00 0.00 -1.00 -0.76 0.00 0.00 176.76 175.00 2q3r h PRO 216 N -0.51 -0.55 -0.53 -7.13 0.13 -1.79 -0.23 132.00 121.40 2q3r h PRO 216 Ca 0.00 0.04 0.09 0.00 -0.87 0.00 0.00 66.00 65.26 2q3r h PRO 216 Cb 0.51 0.13 -0.11 0.00 0.13 0.00 0.00 31.00 31.66 2q3r h PRO 216 CO 0.00 -0.37 -0.35 -0.07 -0.23 0.00 0.00 178.00 176.99 2q3r h LEU 217 N -0.57 -1.18 -0.11 1.56 3.38 -1.84 0.26 115.31 116.81 2q3r h LEU 217 Ca 0.00 0.22 0.03 0.00 0.09 0.00 0.00 57.88 58.22 2q3r h LEU 217 Cb 0.60 0.57 -0.06 0.00 0.09 0.00 0.00 40.66 41.86 2q3r h LEU 217 CO -0.27 -0.31 -0.50 -0.33 0.09 0.00 0.00 178.44 177.12 2q3r h GLU 218 N -0.20 -0.53 -1.45 1.13 5.08 -1.67 0.30 114.58 117.24 2q3r h GLU 218 Ca 0.21 0.04 0.49 0.00 -1.00 0.00 0.00 59.36 59.09 2q3r h GLU 218 Cb 0.55 0.12 -0.13 0.00 0.50 0.00 0.00 28.75 29.79 2q3r h GLU 218 CO -0.64 -0.36 0.95 -0.89 -1.00 0.00 0.00 179.01 177.08 2q3r n ILE 219 N -5.22 -0.22 -0.15 3.13 5.41 -0.07 0.39 119.36 122.63 2q3r n ILE 219 Ca -0.06 1.75 -0.08 0.00 1.00 0.00 0.00 62.75 65.36 2q3r n ILE 219 Cb 0.35 -2.87 0.07 0.00 -0.71 0.00 0.00 39.64 36.49 2q3r n ILE 219 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 2q3r h VAL 220 N 0.00 1.26 -0.31 1.39 2.07 0.11 -1.93 116.25 118.85 2q3r h VAL 220 Ca 0.88 -1.18 -0.15 0.00 0.82 0.00 0.00 66.70 67.08 2q3r h VAL 220 Cb 2.94 0.94 -0.00 0.00 -1.52 0.00 0.00 31.29 33.64 2q3r h VAL 220 CO -0.40 0.41 -0.37 -0.78 0.02 0.00 0.00 177.57 176.45 2q3r h ASP 221 N 0.84 0.87 0.55 0.57 3.58 0.80 -2.33 116.42 121.29 2q3r h ASP 221 Ca 0.14 -0.49 -0.03 0.00 0.42 0.00 0.00 57.03 57.08 2q3r h ASP 221 Cb 0.59 -0.25 0.01 0.00 1.72 0.00 0.00 39.33 41.40 2q3r h ASP 221 CO 0.04 1.18 -0.26 0.00 -2.88 0.00 0.00 179.24 177.32 2q3r h ALA 222 N 0.71 -0.73 -0.47 -0.78 0.00 -1.07 -1.68 119.26 115.24 2q3r h ALA 222 Ca 0.04 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 54.81 2q3r h ALA 222 Cb 0.96 0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.99 2q3r h ALA 222 CO 0.09 -0.77 0.18 0.28 0.00 0.00 0.00 179.25 179.03 2q3r h VAL 223 N -1.02 0.87 -0.00 0.00 2.07 -1.46 0.10 116.25 116.81 2q3r h VAL 223 Ca -0.08 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.32 2q3r h VAL 223 Cb 0.63 0.47 -0.00 0.00 -1.52 0.00 0.00 31.29 30.88 2q3r h VAL 223 CO 0.12 0.07 0.00 0.00 0.02 0.00 0.00 177.57 177.78 2q3r h ALA 224 N 1.30 1.83 0.08 1.67 0.00 -1.44 -0.60 119.26 122.10 2q3r h ALA 224 Ca 0.22 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.99 2q3r h ALA 224 Cb 0.20 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.01 2q3r h ALA 224 CO -0.21 -0.00 -0.60 -0.22 0.00 0.00 0.00 179.25 178.22 2q3r h LYS 225 N 0.00 0.25 0.30 0.00 3.64 -0.11 0.25 116.57 120.90 2q3r h LYS 225 Ca 0.00 -0.39 -0.01 0.00 -1.27 0.00 0.00 60.65 58.98 2q3r h LYS 225 Cb 0.00 0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 2q3r h LYS 225 CO -0.00 1.15 -0.15 1.49 -2.27 0.00 0.00 179.45 179.68 2q3r h GLU 226 N -0.45 -0.39 -0.01 1.90 4.57 -0.59 -3.34 114.58 116.28 2q3r h GLU 226 Ca -0.10 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 2q3r h GLU 226 Cb 1.43 0.09 0.00 0.00 -0.16 0.00 0.00 28.75 30.11 2q3r h GLU 226 CO 0.11 -0.16 -0.55 0.44 -1.18 0.00 0.00 179.01 177.67 2q3r n ILE 227 N -5.20 0.00 0.00 2.32 -5.35 -0.27 -4.99 119.36 105.87 2q3r n ILE 227 Ca -0.10 -0.22 0.00 0.00 -0.27 0.00 0.00 62.75 62.16 2q3r n ILE 227 Cb 0.23 1.13 0.00 0.00 -1.74 0.00 0.00 39.64 39.25 2q3r n ILE 227 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2q3r n GLY 228 N 1.31 1.14 0.15 3.28 0.00 0.59 -4.64 105.19 107.01 2q3r n GLY 228 Ca 0.06 -1.13 0.05 0.00 0.00 0.00 0.00 46.02 44.99 2q3r n GLY 228 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2q3r n PRO 229 N 2.99 0.07 0.00 1.61 -0.04 0.39 -0.00 135.00 140.01 2q3r n PRO 229 Ca 0.00 0.51 0.15 0.00 -0.04 0.00 0.00 63.50 64.12 2q3r n PRO 229 Cb 0.00 -2.10 0.70 0.00 -0.04 0.00 0.00 33.50 32.06 2q3r n PRO 229 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2q3r n ASP 230 N -1.91 0.08 -1.10 3.54 5.68 -1.26 -3.26 116.55 118.32 2q3r n ASP 230 Ca -0.01 -0.09 -0.02 0.00 -0.50 0.00 0.00 54.79 54.18 2q3r n ASP 230 Cb 0.40 -0.28 0.14 0.00 -1.14 0.00 0.00 41.12 40.24 2q3r n ASP 230 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2q3r n ARG 231 N -1.29 1.94 -5.23 0.11 1.74 1.00 -4.74 116.66 110.19 2q3r n ARG 231 Ca 0.13 -3.41 -0.30 0.00 -0.77 0.00 0.00 57.85 53.50 2q3r n ARG 231 Cb 0.27 -1.64 -0.16 0.00 -1.02 0.00 0.00 32.46 29.91 2q3r n ARG 231 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2q3r s VAL 232 N -3.30 1.95 -0.29 1.55 1.01 -1.20 0.16 120.40 120.27 2q3r s VAL 232 Ca 0.40 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 61.36 2q3r s VAL 232 Cb 0.38 -1.63 0.16 0.00 0.00 0.00 0.00 36.38 35.29 2q3r s VAL 232 CO -0.05 0.55 0.41 -0.83 0.00 0.00 0.00 175.10 175.18 2q3r s GLY 233 N -0.46 -0.58 0.22 4.51 0.00 0.27 -2.72 107.32 108.56 2q3r s GLY 233 Ca 0.06 0.22 -0.08 0.00 0.00 0.00 0.00 44.72 44.93 2q3r s GLY 233 CO 0.00 3.05 0.51 -1.50 0.00 0.00 0.00 173.10 175.17 2q3r s ILE 234 N 2.54 5.00 -0.02 0.90 2.07 -1.26 -2.20 121.20 128.23 2q3r s ILE 234 Ca 0.10 0.29 0.01 0.00 -1.41 0.00 0.00 60.65 59.64 2q3r s ILE 234 Cb -0.12 -3.64 -0.03 0.00 0.13 0.00 0.00 42.46 38.79 2q3r s ILE 234 CO -0.30 -0.10 -0.02 -0.60 -1.91 0.00 0.00 174.94 172.01 2q3r s ARG 235 N -2.93 2.79 0.19 3.50 3.52 -0.90 -3.29 118.95 121.82 2q3r s ARG 235 Ca 0.45 -0.58 0.11 0.00 -0.13 0.00 0.00 55.73 55.58 2q3r s ARG 235 Cb -0.11 -2.66 -0.04 0.00 -1.56 0.00 0.00 34.95 30.57 2q3r s ARG 235 CO 0.24 0.64 -0.23 -0.51 -0.81 0.00 0.00 175.30 174.62 2q3r s LEU 236 N -1.33 2.43 -0.40 -0.88 1.43 0.20 -3.97 118.68 116.16 2q3r s LEU 236 Ca 0.17 -0.86 0.10 0.00 -1.03 0.00 0.00 54.13 52.51 2q3r s LEU 236 Cb -0.11 -1.12 0.38 0.00 0.03 0.00 0.00 46.19 45.37 2q3r s LEU 236 CO 0.07 0.10 1.22 -0.24 0.23 0.00 0.00 176.35 177.74 2q3r n SER 237 N 0.30 -1.38 0.18 2.29 2.88 -1.26 -1.19 113.62 115.44 2q3r n SER 237 Ca -0.13 -2.77 0.14 0.00 -1.33 0.00 0.00 58.87 54.77 2q3r n SER 237 Cb 0.56 0.90 0.60 0.00 -0.75 0.00 0.00 64.21 65.52 2q3r n SER 237 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2q3r h PRO 238 N 2.39 0.00 -0.01 -1.46 0.13 -1.90 -2.96 132.00 128.20 2q3r h PRO 238 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 2q3r h PRO 238 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2q3r h PRO 238 CO 0.08 0.00 -0.47 1.19 -0.23 0.00 0.00 178.00 178.57 2q3r n PHE 239 N -2.46 0.00 -2.75 1.56 3.01 -1.26 -4.48 117.46 111.08 2q3r n PHE 239 Ca 0.01 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.26 2q3r n PHE 239 Cb 0.19 -0.09 0.05 0.00 -0.01 0.00 0.00 39.48 39.62 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 -2.65 4.08 -0.02 4.37 0.00 -1.12 -4.87 121.76 121.55 2q3r s ALA 240 Ca 0.18 -1.60 0.06 0.00 0.00 0.00 0.00 51.96 50.60 2q3r s ALA 240 Cb 0.18 -1.90 0.10 0.00 0.00 0.00 0.00 23.12 21.51 2q3r s ALA 240 CO 0.62 -0.85 1.05 -0.40 0.00 0.00 0.00 175.76 176.17 2q3r n ASP 241 N -2.36 0.44 -4.62 0.00 5.68 -1.26 -4.05 116.55 110.38 2q3r n ASP 241 Ca 0.11 -2.16 -0.49 0.00 -0.50 0.00 0.00 54.79 51.74 2q3r n ASP 241 Cb 0.60 -0.25 -0.05 0.00 -1.14 0.00 0.00 41.12 40.28 2q3r n ASP 241 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2q3r n TYR 242 N -0.11 1.84 -3.33 2.11 9.36 -1.26 -1.84 117.16 123.91 2q3r n TYR 242 Ca 0.03 0.48 -0.16 0.00 3.32 0.00 0.00 57.90 61.57 2q3r n TYR 242 Cb 0.76 -2.42 0.08 0.00 -0.63 0.00 0.00 39.34 37.13 2q3r n TYR 242 CO 0.00 0.00 0.00 -1.33 0.22 0.00 0.00 176.86 175.75 2q3r n MET 243 N 2.81 -4.89 -4.09 2.98 2.81 -1.26 -3.36 117.12 112.12 2q3r n MET 243 Ca 0.17 0.84 -0.38 0.00 -1.81 0.00 0.00 57.70 56.52 2q3r n MET 243 Cb 0.24 -5.79 -0.02 0.00 -0.71 0.00 0.00 33.22 26.94 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 -3.74 -0.92 -0.71 0.03 1.02 -0.77 -4.85 120.64 110.69 2q3r n GLU 244 Ca -0.20 0.16 0.06 0.00 -0.02 0.00 0.00 57.16 57.16 2q3r n GLU 244 Cb 0.65 -3.26 0.18 0.00 -0.02 0.00 0.00 31.44 28.99 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 -2.53 1.62 -4.77 1.62 3.41 -0.99 -4.78 113.62 107.20 2q3r n SER 245 Ca -0.20 -3.62 -0.31 0.00 -0.26 0.00 0.00 58.87 54.48 2q3r n SER 245 Cb 0.62 -0.49 0.08 0.00 -0.26 0.00 0.00 64.21 64.16 2q3r n SER 245 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2q3r s GLY 246 N -3.05 1.77 -0.06 5.00 0.00 -1.26 -4.53 107.32 105.18 2q3r s GLY 246 Ca 0.37 0.32 0.05 0.00 0.00 0.00 0.00 44.72 45.46 2q3r s GLY 246 CO -0.08 0.67 -0.21 -0.35 0.00 0.00 0.00 173.10 173.13 2q3r s ASP 247 N -3.24 2.68 0.52 1.64 -1.08 -1.26 -3.48 116.67 112.45 2q3r s ASP 247 Ca 0.62 -0.46 0.29 0.00 -0.52 0.00 0.00 52.55 52.49 2q3r s ASP 247 Cb -0.18 -0.89 1.35 0.00 -1.46 0.00 0.00 42.92 41.74 2q3r s ASP 247 CO 0.53 0.18 2.00 0.71 0.52 0.00 0.00 175.17 179.11 2q3r h THR 248 N 5.34 0.39 -2.05 1.71 1.35 -1.95 -3.24 112.91 114.45 2q3r h THR 248 Ca -0.29 -0.67 -0.54 0.00 -0.55 0.00 0.00 66.41 64.36 2q3r h THR 248 Cb 1.19 1.49 -0.40 0.00 -1.73 0.00 0.00 68.15 68.70 2q3r h THR 248 CO 0.47 0.12 -1.04 -3.20 -0.25 0.00 0.00 175.52 171.62 2q3r n ASN 249 N -3.39 1.27 0.30 5.36 2.85 -1.26 -4.95 115.26 115.45 2q3r n ASN 249 Ca -0.01 -3.00 0.18 0.00 -0.11 0.00 0.00 54.58 51.64 2q3r n ASN 249 Cb 0.30 -0.63 1.00 0.00 1.24 0.00 0.00 39.78 41.69 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 3.51 0.00 -0.31 1.20 0.13 -1.80 -1.82 132.00 132.91 2q3r h PRO 250 Ca 0.10 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.08 2q3r h PRO 250 Cb 0.85 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.98 2q3r h PRO 250 CO 0.55 0.00 -0.39 0.78 -0.23 0.00 0.00 178.00 178.72 2q3r h GLY 251 N 0.00 0.88 0.96 1.56 0.00 -1.92 -2.57 103.07 101.98 2q3r h GLY 251 Ca 0.02 -0.94 -0.06 0.00 0.00 0.00 0.00 47.33 46.34 2q3r h GLY 251 CO -0.00 0.85 0.02 0.00 0.00 0.00 0.00 176.54 177.41 2q3r h ALA 252 N 0.71 0.58 -0.58 3.60 0.00 -1.77 -2.60 119.26 119.20 2q3r h ALA 252 Ca 0.04 -0.26 0.07 0.00 0.00 0.00 0.00 54.91 54.76 2q3r h ALA 252 Cb 0.98 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.55 2q3r h ALA 252 CO 0.09 0.35 0.27 1.25 0.00 0.00 0.00 179.25 181.21 2q3r h LEU 253 N 0.59 0.35 0.00 0.00 5.85 -1.52 -2.72 115.31 117.85 2q3r h LEU 253 Ca 0.12 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.89 2q3r h LEU 253 Cb 0.46 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.48 2q3r h LEU 253 CO 0.02 0.23 0.00 0.61 -0.34 0.00 0.00 178.44 178.95 2q3r n GLY 254 N -1.27 -3.34 0.24 3.75 0.00 -0.97 -2.23 105.19 101.36 2q3r n GLY 254 Ca 0.07 0.48 0.02 0.00 0.00 0.00 0.00 46.02 46.59 2q3r n GLY 254 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2q3r h LEU 255 N 0.00 -0.01 -0.91 0.99 4.07 -1.62 0.08 115.31 117.90 2q3r h LEU 255 Ca 0.00 0.12 0.25 0.00 0.08 0.00 0.00 57.88 58.34 2q3r h LEU 255 Cb 0.00 0.17 -0.14 0.00 1.08 0.00 0.00 40.66 41.77 2q3r h LEU 255 CO 0.00 -0.01 0.33 0.22 -1.08 0.00 0.00 178.44 177.91 2q3r h TYR 256 N 0.26 0.52 -0.00 1.13 3.20 -1.44 0.97 116.97 121.60 2q3r h TYR 256 Ca 0.34 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 62.24 2q3r h TYR 256 Cb 0.52 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.71 2q3r h TYR 256 CO -0.26 -0.19 -0.04 0.52 -1.64 0.00 0.00 178.16 176.56 2q3r h MET 257 N 0.25 0.03 0.56 1.82 2.86 -0.57 -2.92 114.93 116.97 2q3r h MET 257 Ca 0.60 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 58.18 2q3r h MET 257 Cb 1.25 0.01 0.01 0.00 0.06 0.00 0.00 31.60 32.92 2q3r h MET 257 CO -0.63 0.75 -0.27 0.00 1.06 0.00 0.00 176.91 177.82 2q3r h ALA 258 N 0.28 -0.75 -0.77 6.32 0.00 0.19 -2.06 119.26 122.47 2q3r h ALA 258 Ca -0.00 -0.17 0.17 0.00 0.00 0.00 0.00 54.91 54.91 2q3r h ALA 258 Cb 0.77 0.29 -0.12 0.00 0.00 0.00 0.00 17.79 18.73 2q3r h ALA 258 CO 0.01 -0.91 0.18 0.93 0.00 0.00 0.00 179.25 179.46 2q3r h GLU 259 N -0.77 0.25 0.00 0.00 5.08 0.75 0.43 114.58 120.32 2q3r h GLU 259 Ca -0.08 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2q3r h GLU 259 Cb 0.59 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.78 2q3r h GLU 259 CO 0.13 0.16 0.00 0.43 -1.00 0.00 0.00 179.01 178.73 2q3r n SER 260 N -5.17 0.00 0.02 1.42 7.64 -1.04 -2.54 113.62 113.94 2q3r n SER 260 Ca 0.15 -0.25 0.12 0.00 1.01 0.00 0.00 58.87 59.90 2q3r n SER 260 Cb 0.50 -0.20 0.16 0.00 -1.01 0.00 0.00 64.21 63.66 2q3r n SER 260 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2q3r n LEU 261 N -1.20 0.59 -0.04 -3.43 4.77 0.15 -3.99 117.00 113.86 2q3r n LEU 261 Ca 0.13 -0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.97 2q3r n LEU 261 Cb 0.15 -0.19 -0.09 0.00 -2.33 0.00 0.00 43.42 40.96 2q3r n LEU 261 CO 0.16 0.09 0.54 0.78 -1.33 0.00 0.00 177.39 177.63 2q3r h ASN 262 N 0.00 0.27 -0.71 -1.43 -0.26 -1.39 -2.08 115.58 109.98 2q3r h ASN 262 Ca 0.00 -0.57 0.21 0.00 -0.56 0.00 0.00 56.30 55.37 2q3r h ASN 262 Cb 0.59 -0.08 -0.03 0.00 -1.06 0.00 0.00 38.32 37.74 2q3r h ASN 262 CO 0.00 0.80 0.59 0.50 -1.06 0.00 0.00 177.43 178.25 2q3r h LYS 263 N -0.24 0.00 0.00 0.81 3.11 -1.72 0.27 116.57 118.81 2q3r h LYS 263 Ca 0.00 0.00 -0.21 0.00 -2.81 0.00 0.00 60.65 57.63 2q3r h LYS 263 Cb 0.76 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.95 2q3r h LYS 263 CO 0.04 0.00 -1.28 1.88 -2.81 0.00 0.00 179.45 177.28 2q3r h TYR 264 N 0.00 0.00 -5.09 1.91 0.99 -1.65 -3.49 116.97 109.64 2q3r h TYR 264 Ca 0.34 0.00 -0.10 0.00 2.00 0.00 0.00 58.73 60.96 2q3r h TYR 264 Cb 1.50 0.00 0.08 0.00 1.00 0.00 0.00 36.73 39.32 2q3r h TYR 264 CO 0.00 0.83 -0.36 0.41 -0.00 0.00 0.00 178.16 179.04 2q3r n GLY 265 N 1.42 -1.01 3.99 3.88 0.00 0.95 -4.88 105.19 109.53 2q3r n GLY 265 Ca -0.08 0.42 -0.21 0.00 0.00 0.00 0.00 46.02 46.16 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 -3.16 2.22 0.00 -0.61 -4.36 -1.26 -4.50 121.20 109.53 2q3r s ILE 266 Ca 0.19 -1.14 -0.02 0.00 -0.26 0.00 0.00 60.65 59.42 2q3r s ILE 266 Cb -0.02 -2.36 -0.01 0.00 1.25 0.00 0.00 42.46 41.32 2q3r s ILE 266 CO 0.65 0.00 0.82 0.25 0.24 0.00 0.00 174.94 176.89 2q3r h LEU 267 N 0.45 -0.06 -9.05 0.37 5.85 -1.53 -3.43 115.31 107.90 2q3r h LEU 267 Ca -0.34 0.00 -0.43 0.00 0.84 0.00 0.00 57.88 57.96 2q3r h LEU 267 Cb 1.29 0.02 -0.14 0.00 0.37 0.00 0.00 40.66 42.19 2q3r h LEU 267 CO 0.46 -0.04 -0.63 -0.72 -0.34 0.00 0.00 178.44 177.17 2q3r s TYR 268 N -2.74 1.77 -0.17 1.25 -0.85 -1.25 0.23 117.35 115.57 2q3r s TYR 268 Ca -0.01 -0.94 0.01 0.00 -0.52 0.00 0.00 57.07 55.61 2q3r s TYR 268 Cb 0.00 -1.08 0.02 0.00 0.38 0.00 0.00 41.96 41.28 2q3r s TYR 268 CO 0.03 -0.02 -0.20 0.00 -1.52 0.00 0.00 175.55 173.84 2q3r s HIS 270 N 1.22 3.41 0.02 0.00 5.04 -1.21 0.75 115.29 124.52 2q3r s HIS 270 Ca 0.03 -2.90 0.02 0.00 -1.54 0.00 0.00 55.06 50.67 2q3r s HIS 270 Cb -0.13 -3.01 -0.04 0.00 0.04 0.00 0.00 32.58 29.44 2q3r s HIS 270 CO -0.11 -0.84 -0.01 0.08 -2.34 0.00 0.00 174.74 171.52 2q3r s VAL 271 N 0.17 4.06 -0.18 0.89 1.01 -1.01 -0.62 120.40 124.71 2q3r s VAL 271 Ca 0.15 -0.70 -0.14 0.00 0.00 0.00 0.00 61.98 61.29 2q3r s VAL 271 Cb -0.23 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.28 2q3r s VAL 271 CO -0.03 0.33 0.31 -0.63 0.00 0.00 0.00 175.10 175.08 2q3r s ILE 272 N -1.12 5.28 0.67 2.22 1.01 -0.33 -3.15 121.20 125.78 2q3r s ILE 272 Ca 0.20 0.56 -0.15 0.00 0.00 0.00 0.00 60.65 61.26 2q3r s ILE 272 Cb -0.11 -3.65 0.01 0.00 0.01 0.00 0.00 42.46 38.72 2q3r s ILE 272 CO 0.11 0.35 1.13 -0.70 0.00 0.00 0.00 174.94 175.83 2q3r s GLU 273 N 0.74 2.69 0.00 2.79 2.56 -1.00 -4.77 118.70 121.71 2q3r s GLU 273 Ca 0.16 1.46 0.00 0.00 0.00 0.00 0.00 54.97 56.60 2q3r s GLU 273 Cb -0.13 -1.93 0.00 0.00 2.00 0.00 0.00 34.13 34.07 2q3r s GLU 273 CO 0.05 -1.35 0.00 0.00 -0.56 0.00 0.00 175.26 173.40 2q3r n ALA 274 N -2.44 0.00 1.62 6.30 0.00 -1.26 -4.92 120.51 119.81 2q3r n ALA 274 Ca 0.11 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.69 2q3r n ALA 274 Cb 0.52 0.00 0.66 0.00 0.00 0.00 0.00 19.45 20.62 2q3r n ALA 274 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2q3r n ARG 275 N 0.00 1.29 0.00 0.00 1.74 -1.26 -5.10 116.66 113.33 2q3r n ARG 275 Ca 0.00 -0.55 0.00 0.00 -0.77 0.00 0.00 57.85 56.53 2q3r n ARG 275 Cb 0.00 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 29.95 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 -0.38 0.00 0.00 5.56 0.00 -1.26 -5.27 117.12 115.77 2q3r n MET 276 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.90 2q3r n MET 276 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.49 2q3r n MET 276 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 175.97 176.69 2q3r n HIS 287 N 0.00 0.00 0.00 3.17 -0.00 -1.26 -5.10 115.22 112.03 2q3r n HIS 287 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2q3r n HIS 287 Cb 0.00 -0.46 0.00 0.00 -0.00 0.00 0.00 29.99 29.53 2q3r n HIS 287 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.34 173.97 2q3r n THR 288 N 0.24 0.00 0.12 1.59 5.66 -1.26 -4.70 114.28 115.93 2q3r n THR 288 Ca 0.00 0.32 -0.21 0.00 -3.05 0.00 0.00 64.05 61.11 2q3r n THR 288 Cb 0.00 -1.31 -0.15 0.00 -1.55 0.00 0.00 70.33 67.32 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 0.65 -0.58 1.09 4.07 -1.99 -3.37 115.31 115.18 2q3r h LEU 289 Ca 0.00 -0.72 0.12 0.00 0.08 0.00 0.00 57.88 57.36 2q3r h LEU 289 Cb 0.00 -0.21 -0.09 0.00 1.08 0.00 0.00 40.66 41.44 2q3r h LEU 289 CO 0.00 1.56 0.03 0.24 -1.08 0.00 0.00 178.44 179.20 2q3r h MET 290 N 0.11 0.14 -0.52 1.13 2.86 -1.89 0.91 114.93 117.68 2q3r h MET 290 Ca -0.22 -0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.45 2q3r h MET 290 Cb 2.08 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 33.68 2q3r h MET 290 CO 0.24 0.10 0.34 -1.35 1.06 0.00 0.00 176.91 177.30 2q3r h PRO 291 N 0.15 0.56 0.01 -0.22 0.11 -1.84 0.66 132.00 131.43 2q3r h PRO 291 Ca 0.30 -0.03 -0.17 0.00 0.11 0.00 0.00 66.00 66.21 2q3r h PRO 291 Cb 0.47 -0.13 0.01 0.00 0.11 0.00 0.00 31.00 31.47 2q3r h PRO 291 CO -0.47 0.37 -0.67 0.52 -0.21 0.00 0.00 178.00 177.54 2q3r h MET 292 N 0.58 0.44 0.08 1.05 2.86 -0.88 -0.23 114.93 118.84 2q3r h MET 292 Ca 0.21 -0.49 -0.00 0.00 -2.06 0.00 0.00 59.70 57.36 2q3r h MET 292 Cb 0.11 0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.92 2q3r h MET 292 CO -0.05 1.14 -0.04 -0.09 1.06 0.00 0.00 176.91 178.93 2q3r h ARG 293 N -0.05 -0.11 -0.80 1.72 1.12 0.13 0.50 114.38 116.90 2q3r h ARG 293 Ca -0.09 0.01 -0.02 0.00 -1.11 0.00 0.00 59.98 58.77 2q3r h ARG 293 Cb 1.38 0.02 -0.04 0.00 -0.01 0.00 0.00 29.97 31.33 2q3r h ARG 293 CO 0.13 0.06 0.41 0.87 -3.11 0.00 0.00 179.97 178.33 2q3r h LYS 294 N -0.26 1.12 0.59 0.20 1.57 0.23 -3.23 116.57 116.80 2q3r h LYS 294 Ca -0.01 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 58.60 2q3r h LYS 294 Cb 0.22 -0.21 0.01 0.00 0.08 0.00 0.00 32.23 32.32 2q3r h LYS 294 CO 0.02 0.84 -0.29 0.00 -0.57 0.00 0.00 179.45 179.46 2q3r h ALA 295 N 1.33 -1.02 -2.55 3.86 0.00 -0.48 -3.44 119.26 116.96 2q3r h ALA 295 Ca 0.28 -0.17 -0.53 0.00 0.00 0.00 0.00 54.91 54.49 2q3r h ALA 295 Cb 0.07 0.31 0.04 0.00 0.00 0.00 0.00 17.79 18.20 2q3r h ALA 295 CO -0.04 -0.96 0.97 0.12 0.00 0.00 0.00 179.25 179.34 2q3r s PHE 296 N -4.43 2.70 -0.95 0.00 5.36 0.17 -4.73 117.98 116.10 2q3r s PHE 296 Ca -0.12 0.40 -0.17 0.00 -0.96 0.00 0.00 56.93 56.08 2q3r s PHE 296 Cb 0.01 -4.00 0.15 0.00 -0.34 0.00 0.00 43.02 38.85 2q3r s PHE 296 CO 0.35 -3.88 1.11 0.15 -1.46 0.00 0.00 175.22 171.49 2q3r s LYS 297 N 1.87 3.68 0.00 10.12 -0.14 -1.26 -4.83 119.74 129.18 2q3r s LYS 297 Ca 0.73 -2.02 0.00 0.00 -1.36 0.00 0.00 55.97 53.32 2q3r s LYS 297 Cb -0.43 -4.85 0.00 0.00 -1.68 0.00 0.00 37.83 30.87 2q3r s LYS 297 CO 0.32 -1.68 0.00 0.41 -0.76 0.00 0.00 175.35 173.64 2q3r n GLY 298 N 5.00 -2.07 3.50 -3.33 0.00 -1.26 -4.76 105.19 102.27 2q3r n GLY 298 Ca 0.24 -1.18 -0.36 0.00 0.00 0.00 0.00 46.02 44.71 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 0.83 2.10 -3.81 2.61 -1.04 0.13 -4.73 114.28 110.37 2q3r n THR 299 Ca 0.00 -0.40 -0.15 0.00 -2.04 0.00 0.00 64.05 61.46 2q3r n THR 299 Cb 0.00 -0.82 -0.16 0.00 -1.82 0.00 0.00 70.33 67.53 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 -1.86 0.07 -0.07 -1.42 5.36 -1.26 0.77 117.98 119.58 2q3r s PHE 300 Ca 0.68 0.09 0.05 0.00 -0.96 0.00 0.00 56.93 56.78 2q3r s PHE 300 Cb -0.36 -0.23 -0.00 0.00 -0.34 0.00 0.00 43.02 42.09 2q3r s PHE 300 CO 0.56 -0.08 -0.21 0.42 -1.46 0.00 0.00 175.22 174.44 2q3r s ILE 301 N 0.91 1.79 0.08 3.12 1.01 0.23 0.15 121.20 128.48 2q3r s ILE 301 Ca -0.08 -0.89 0.02 0.00 0.00 0.00 0.00 60.65 59.70 2q3r s ILE 301 Cb -0.11 -1.54 -0.04 0.00 0.01 0.00 0.00 42.46 40.78 2q3r s ILE 301 CO -0.02 0.50 0.16 -0.44 0.00 0.00 0.00 174.94 175.14 2q3r s SER 302 N 0.15 5.98 -0.02 3.58 0.01 0.40 -2.39 113.70 121.41 2q3r s SER 302 Ca -0.10 0.13 -0.29 0.00 1.31 0.00 0.00 55.95 57.00 2q3r s SER 302 Cb -0.15 -1.74 0.08 0.00 0.21 0.00 0.00 66.02 64.42 2q3r s SER 302 CO 0.05 0.16 0.74 0.00 0.41 0.00 0.00 173.24 174.60 2q3r s ALA 303 N -1.49 -1.77 0.00 1.44 0.00 -1.19 0.70 121.76 119.46 2q3r s ALA 303 Ca 0.32 1.16 0.00 0.00 0.00 0.00 0.00 51.96 53.45 2q3r s ALA 303 Cb -0.12 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.10 2q3r s ALA 303 CO 0.25 -0.47 0.00 0.41 0.00 0.00 0.00 175.76 175.95 2q3r n GLY 304 N 0.50 1.47 2.49 0.00 0.00 -1.26 -2.36 105.19 106.02 2q3r n GLY 304 Ca -0.16 -0.55 -0.19 0.00 0.00 0.00 0.00 46.02 45.12 2q3r n GLY 304 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q3r n GLY 305 N 0.00 1.28 3.77 -0.02 0.00 -1.26 -4.79 105.19 104.16 2q3r n GLY 305 Ca 0.00 -0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 2q3r n GLY 305 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2q3r s PHE 306 N -2.75 3.07 0.34 1.61 0.40 -1.26 -5.04 117.98 114.35 2q3r s PHE 306 Ca 0.00 1.52 0.08 0.00 -0.60 0.00 0.00 56.93 57.92 2q3r s PHE 306 Cb 0.00 -3.49 -0.03 0.00 0.51 0.00 0.00 43.02 40.01 2q3r s PHE 306 CO 0.00 -1.49 0.23 0.95 0.70 0.00 0.00 175.22 175.62 2q3r s THR 307 N -1.31 3.25 0.16 0.64 -4.23 -1.26 -4.97 115.64 107.93 2q3r s THR 307 Ca 0.54 -1.51 -0.15 0.00 -1.18 0.00 0.00 61.69 59.39 2q3r s THR 307 Cb -0.34 -3.09 0.05 0.00 1.34 0.00 0.00 72.50 70.46 2q3r s THR 307 CO 0.43 -0.17 1.75 -0.09 -0.54 0.00 0.00 174.62 176.00 2q3r h ARG 308 N 1.36 0.28 0.06 3.99 2.43 -1.99 -0.38 114.38 120.13 2q3r h ARG 308 Ca -0.44 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 2q3r h ARG 308 Cb 1.25 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.74 2q3r h ARG 308 CO 0.61 0.18 -0.06 0.93 -1.51 0.00 0.00 179.97 180.12 2q3r h GLU 309 N 0.28 -0.13 -0.66 0.20 3.07 -2.00 -0.80 114.58 114.55 2q3r h GLU 309 Ca 0.19 0.01 0.08 0.00 -0.50 0.00 0.00 59.36 59.13 2q3r h GLU 309 Cb 0.18 0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 28.08 2q3r h GLU 309 CO -0.20 -0.08 0.44 -0.44 -1.40 0.00 0.00 179.01 177.32 2q3r h ASP 310 N -0.13 0.53 0.65 1.42 3.32 -1.89 -1.60 116.42 118.73 2q3r h ASP 310 Ca 0.00 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 2q3r h ASP 310 Cb 0.13 -0.11 0.01 0.00 0.22 0.00 0.00 39.33 39.58 2q3r h ASP 310 CO -0.02 0.34 -0.31 1.23 -1.72 0.00 0.00 179.24 178.76 2q3r h GLY 311 N 0.60 -0.92 0.24 2.75 0.00 -0.06 -0.83 103.07 104.85 2q3r h GLY 311 Ca 0.29 0.34 0.13 0.00 0.00 0.00 0.00 47.33 48.09 2q3r h GLY 311 CO -0.09 -0.33 0.34 3.43 0.00 0.00 0.00 176.54 179.88 2q3r h ASN 312 N -1.01 0.36 0.27 0.19 2.35 -0.91 -1.49 115.58 115.34 2q3r h ASN 312 Ca -0.09 0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2q3r h ASN 312 Cb 0.71 0.05 -0.02 0.00 0.05 0.00 0.00 38.32 39.11 2q3r h ASN 312 CO 0.15 0.16 -0.24 -0.08 -1.65 0.00 0.00 177.43 175.77 2q3r h GLU 313 N 0.51 -0.51 -0.66 0.81 4.57 -1.12 0.16 114.58 118.34 2q3r h GLU 313 Ca 0.41 0.03 0.06 0.00 -1.18 0.00 0.00 59.36 58.68 2q3r h GLU 313 Cb 0.57 0.12 -0.05 0.00 -0.16 0.00 0.00 28.75 29.22 2q3r h GLU 313 CO -0.37 -0.34 0.37 0.00 -1.18 0.00 0.00 179.01 177.50 2q3r h ALA 314 N 0.13 0.89 0.06 2.92 0.00 -0.81 0.06 119.26 122.50 2q3r h ALA 314 Ca -0.01 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2q3r h ALA 314 Cb 0.48 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2q3r h ALA 314 CO -0.03 0.05 -0.03 0.28 0.00 0.00 0.00 179.25 179.52 2q3r h VAL 315 N 0.68 1.12 -0.70 0.00 2.07 -1.03 -1.55 116.25 116.85 2q3r h VAL 315 Ca 0.30 -0.62 0.01 0.00 0.82 0.00 0.00 66.70 67.21 2q3r h VAL 315 Cb 0.18 1.53 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 2q3r h VAL 315 CO -0.18 0.15 0.46 0.77 0.02 0.00 0.00 177.57 178.80 2q3r h SER 316 N -0.35 0.80 0.52 0.57 4.64 -0.38 -2.03 113.55 117.32 2q3r h SER 316 Ca -0.01 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2q3r h SER 316 Cb 0.31 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 2q3r h SER 316 CO 0.01 0.58 0.00 0.29 -0.87 0.00 0.00 176.83 176.84 2q3r n LYS 317 N -4.60 0.25 -1.11 4.77 4.76 -0.02 -4.90 118.16 117.30 2q3r n LYS 317 Ca 0.06 0.08 -0.04 0.00 -2.87 0.00 0.00 58.31 55.54 2q3r n LYS 317 Cb 0.02 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 31.69 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 0.73 0.68 0.22 0.72 0.00 -0.76 -4.90 105.19 101.87 2q3r n GLY 318 Ca 0.10 -0.56 0.01 0.00 0.00 0.00 0.00 46.02 45.57 2q3r n GLY 318 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2q3r n ARG 319 N -2.56 1.21 0.00 1.61 1.74 -0.64 -4.84 116.66 113.18 2q3r n ARG 319 Ca -0.04 -0.28 0.00 0.00 -0.77 0.00 0.00 57.85 56.76 2q3r n ARG 319 Cb 0.17 -1.14 0.00 0.00 -1.02 0.00 0.00 32.46 30.47 2q3r n ARG 319 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 2q3r n THR 320 N -0.23 0.00 -0.12 0.55 5.66 -1.24 -4.87 114.28 114.03 2q3r n THR 320 Ca 0.03 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.77 2q3r n THR 320 Cb 0.11 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 68.78 2q3r n THR 320 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2q3r n ASP 321 N 0.00 1.96 -4.67 1.09 8.00 0.39 -4.38 116.55 118.93 2q3r n ASP 321 Ca 0.00 0.25 -0.32 0.00 0.71 0.00 0.00 54.79 55.43 2q3r n ASP 321 Cb 0.00 -0.77 -0.07 0.00 -0.02 0.00 0.00 41.12 40.25 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 -7.35 2.21 -0.07 0.64 1.43 0.27 -4.90 118.68 110.91 2q3r s LEU 322 Ca -0.35 -1.68 -0.03 0.00 -1.03 0.00 0.00 54.13 51.04 2q3r s LEU 322 Cb 0.11 -0.63 0.04 0.00 0.03 0.00 0.00 46.19 45.75 2q3r s LEU 322 CO 0.56 -0.89 0.11 -0.69 0.23 0.00 0.00 176.35 175.66 2q3r s VAL 323 N -2.93 -0.18 -0.17 -1.59 1.01 -0.59 -0.45 120.40 115.49 2q3r s VAL 323 Ca 0.06 0.35 -0.16 0.00 0.00 0.00 0.00 61.98 62.23 2q3r s VAL 323 Cb 0.01 -0.25 -0.04 0.00 0.00 0.00 0.00 36.38 36.10 2q3r s VAL 323 CO 0.04 0.13 0.39 0.00 0.00 0.00 0.00 175.10 175.66 2q3r s ALA 324 N 2.23 3.54 -0.11 5.51 0.00 0.22 -1.24 121.76 131.92 2q3r s ALA 324 Ca 0.04 -0.42 -0.00 0.00 0.00 0.00 0.00 51.96 51.58 2q3r s ALA 324 Cb -0.12 -2.58 -0.02 0.00 0.00 0.00 0.00 23.12 20.40 2q3r s ALA 324 CO -0.05 -0.12 -0.10 0.71 0.00 0.00 0.00 175.76 176.20 2q3r s TYR 325 N 0.92 2.86 0.00 0.00 2.02 -0.79 -4.29 117.35 118.08 2q3r s TYR 325 Ca 0.20 -0.35 0.00 0.00 -0.37 0.00 0.00 57.07 56.56 2q3r s TYR 325 Cb -0.14 -1.80 0.00 0.00 -0.40 0.00 0.00 41.96 39.61 2q3r s TYR 325 CO 0.07 0.01 0.00 0.41 -1.57 0.00 0.00 175.55 174.47 2q3r n GLY 326 N 3.04 -0.26 0.33 0.71 0.00 -1.26 -2.67 105.19 105.08 2q3r n GLY 326 Ca -0.18 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.90 2q3r n GLY 326 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2q3r h ARG 327 N 0.00 0.58 -0.03 1.61 3.08 -1.98 0.11 114.38 117.75 2q3r h ARG 327 Ca 0.00 -0.03 -0.21 0.00 0.07 0.00 0.00 59.98 59.81 2q3r h ARG 327 Cb 0.00 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 29.92 2q3r h ARG 327 CO 0.00 0.38 -0.85 -1.49 -1.07 0.00 0.00 179.97 176.94 2q3r h TRP 328 N 0.60 0.54 0.01 3.04 -0.00 -1.95 -2.52 115.95 115.67 2q3r h TRP 328 Ca 0.21 -0.27 -0.21 0.00 -0.00 0.00 0.00 58.89 58.63 2q3r h TRP 328 Cb 0.11 -0.07 -0.01 0.00 -0.00 0.00 0.00 29.16 29.19 2q3r h TRP 328 CO -0.00 1.07 -0.91 0.35 -0.00 0.00 0.00 178.44 178.95 2q3r h PHE 329 N 0.23 0.32 -0.75 0.49 3.04 -1.68 -1.55 116.94 117.04 2q3r h PHE 329 Ca -0.06 -0.18 0.08 0.00 3.98 0.00 0.00 57.97 61.80 2q3r h PHE 329 Cb 1.47 -0.03 -0.07 0.00 2.56 0.00 0.00 35.95 39.88 2q3r h PHE 329 CO 0.05 1.01 0.42 1.25 -2.02 0.00 0.00 178.31 179.02 2q3r h LEU 330 N 0.11 0.59 -1.77 0.59 6.46 -0.72 -2.13 115.31 118.45 2q3r h LEU 330 Ca -0.05 0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.75 2q3r h LEU 330 Cb 1.55 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 41.42 2q3r h LEU 330 CO 0.14 0.35 0.00 0.00 -0.62 0.00 0.00 178.44 178.31 2q3r n ALA 331 N -2.38 2.43 -3.21 1.25 0.00 -0.96 -4.71 120.51 112.94 2q3r n ALA 331 Ca 0.11 -0.83 -0.10 0.00 0.00 0.00 0.00 53.44 52.62 2q3r n ALA 331 Cb 0.24 -0.97 -0.04 0.00 0.00 0.00 0.00 19.45 18.68 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 -1.10 -0.13 0.24 0.00 0.01 -0.60 -4.26 114.94 109.10 2q3r s ASN 332 Ca 0.33 -1.52 -0.07 0.00 -0.71 0.00 0.00 52.86 50.89 2q3r s ASN 332 Cb 0.18 1.14 0.42 0.00 0.41 0.00 0.00 41.25 43.40 2q3r s ASN 332 CO 0.24 -0.18 1.67 1.55 -1.51 0.00 0.00 177.10 178.86 2q3r h PRO 333 N 6.51 0.18 -0.94 -0.60 0.13 -1.80 0.63 132.00 136.10 2q3r h PRO 333 Ca 0.08 -0.01 -0.12 0.00 -0.87 0.00 0.00 66.00 65.08 2q3r h PRO 333 Cb 1.09 -0.04 -0.07 0.00 0.13 0.00 0.00 31.00 32.11 2q3r h PRO 333 CO 0.15 0.12 0.15 -0.40 -0.23 0.00 0.00 178.00 177.79 2q3r n ASP 334 N -5.24 3.09 -0.30 1.44 3.85 -1.25 -3.81 116.55 114.34 2q3r n ASP 334 Ca 0.13 -2.50 0.03 0.00 -0.71 0.00 0.00 54.79 51.73 2q3r n ASP 334 Cb 0.44 -0.60 0.08 0.00 -1.35 0.00 0.00 41.12 39.69 2q3r n ASP 334 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.20 176.08 2q3r n LEU 335 N 0.02 -0.37 0.08 -2.12 7.94 0.22 -0.18 117.00 122.58 2q3r n LEU 335 Ca 0.18 1.39 -0.12 0.00 -1.11 0.00 0.00 56.01 56.34 2q3r n LEU 335 Cb 0.81 -0.38 -0.05 0.00 0.53 0.00 0.00 43.42 44.32 2q3r n LEU 335 CO 0.19 -1.30 0.65 -0.65 -1.11 0.00 0.00 177.39 175.16 2q3r h PRO 336 N 0.00 -0.48 0.00 1.96 0.11 -1.84 0.15 132.00 131.90 2q3r h PRO 336 Ca 0.35 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.49 2q3r h PRO 336 Cb 0.55 0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.77 2q3r h PRO 336 CO -0.81 -0.32 0.05 1.17 -0.21 0.00 0.00 178.00 177.87 2q3r n LYS 337 N -5.42 0.00 -0.11 1.05 4.81 0.74 -1.90 118.16 117.34 2q3r n LYS 337 Ca -0.06 0.33 -0.24 0.00 -0.87 0.00 0.00 58.31 57.48 2q3r n LYS 337 Cb 0.33 -1.55 -0.11 0.00 0.02 0.00 0.00 35.03 33.72 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 -1.32 0.57 0.30 1.64 1.74 0.46 -4.14 116.66 115.91 2q3r n ARG 338 Ca 0.00 0.48 0.15 0.00 -0.77 0.00 0.00 57.85 57.71 2q3r n ARG 338 Cb 0.05 -1.67 0.91 0.00 -1.02 0.00 0.00 32.46 30.73 2q3r n ARG 338 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 2q3r h PHE 339 N -1.00 0.00 -0.01 -1.55 0.04 -0.64 0.54 116.94 114.32 2q3r h PHE 339 Ca -0.45 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.32 2q3r h PHE 339 Cb 1.39 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.54 2q3r h PHE 339 CO 0.04 0.01 -0.01 0.94 -0.60 0.00 0.00 178.31 178.69 2q3r n GLN 340 N -3.80 -0.00 -3.20 1.51 7.27 -0.87 -2.15 117.38 116.15 2q3r n GLN 340 Ca -0.03 0.31 -0.24 0.00 0.07 0.00 0.00 57.00 57.12 2q3r n GLN 340 Cb 0.10 -0.47 -0.06 0.00 2.41 0.00 0.00 30.24 32.22 2q3r n GLN 340 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 2q3r n VAL 341 N -2.38 0.89 -3.60 1.69 0.31 -1.23 -4.96 118.33 109.06 2q3r n VAL 341 Ca 0.00 -4.75 -0.20 0.00 -0.01 0.00 0.00 64.34 59.39 2q3r n VAL 341 Cb 0.00 -1.47 0.01 0.00 -0.91 0.00 0.00 33.84 31.47 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 0.68 -2.31 -4.92 4.52 -0.08 -0.91 -4.93 116.55 108.60 2q3r n ASP 342 Ca 0.26 -0.62 -0.26 0.00 -1.51 0.00 0.00 54.79 52.66 2q3r n ASP 342 Cb 0.51 -0.83 0.04 0.00 2.34 0.00 0.00 41.12 43.17 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 -3.47 3.31 0.58 -1.67 0.00 0.18 -5.02 121.76 115.67 2q3r s ALA 343 Ca 0.15 -0.79 -0.18 0.00 0.00 0.00 0.00 51.96 51.13 2q3r s ALA 343 Cb -0.08 -2.56 -0.04 0.00 0.00 0.00 0.00 23.12 20.43 2q3r s ALA 343 CO 0.50 -0.90 1.15 -1.25 0.00 0.00 0.00 175.76 175.26 2q3r s PRO 344 N -5.02 3.13 -0.01 0.00 0.04 -1.26 -4.75 135.00 127.13 2q3r s PRO 344 Ca 0.55 1.65 0.08 0.00 0.04 0.00 0.00 61.00 63.32 2q3r s PRO 344 Cb -0.11 -1.97 -0.02 0.00 0.04 0.00 0.00 34.50 32.44 2q3r s PRO 344 CO 0.44 -1.04 -0.24 -0.51 0.04 0.00 0.00 177.00 175.70 2q3r s LEU 345 N -4.07 2.21 0.39 -3.56 1.43 -1.26 -4.98 118.68 108.83 2q3r s LEU 345 Ca 0.73 -0.46 -0.26 0.00 -1.03 0.00 0.00 54.13 53.11 2q3r s LEU 345 Cb -0.25 -1.37 -0.09 0.00 0.03 0.00 0.00 46.19 44.51 2q3r s LEU 345 CO 0.31 0.31 1.24 0.20 0.23 0.00 0.00 176.35 178.64 2q3r s ASN 346 N -0.82 6.48 0.54 2.29 0.01 -1.26 -4.99 114.94 117.19 2q3r s ASN 346 Ca 0.11 2.52 -0.18 0.00 -0.71 0.00 0.00 52.86 54.60 2q3r s ASN 346 Cb -0.10 -2.63 -0.06 0.00 0.41 0.00 0.00 41.25 38.87 2q3r s ASN 346 CO 0.00 -0.72 1.06 -0.54 -1.51 0.00 0.00 177.10 175.40 2q3r s LYS 347 N -2.17 3.50 -0.24 -0.60 1.02 -1.26 -4.79 119.74 115.19 2q3r s LYS 347 Ca 0.56 1.34 -0.13 0.00 0.02 0.00 0.00 55.97 57.75 2q3r s LYS 347 Cb -0.35 -2.05 -0.04 0.00 -0.52 0.00 0.00 37.83 34.86 2q3r s LYS 347 CO 0.45 -0.68 0.28 1.52 -0.92 0.00 0.00 175.35 176.00 2q3r s TYR 348 N -2.15 3.31 -0.84 3.18 -0.85 -1.26 -4.89 117.35 113.85 2q3r s TYR 348 Ca 0.67 0.38 -0.22 0.00 -0.52 0.00 0.00 57.07 57.37 2q3r s TYR 348 Cb -0.17 -2.42 0.08 0.00 0.38 0.00 0.00 41.96 39.82 2q3r s TYR 348 CO 0.29 -0.04 1.18 0.34 -1.52 0.00 0.00 175.55 175.80 2q3r s ASP 349 N 1.23 6.38 0.22 -0.18 2.15 -1.26 -4.91 116.67 120.30 2q3r s ASP 349 Ca 0.13 -1.31 -0.08 0.00 0.43 0.00 0.00 52.55 51.72 2q3r s ASP 349 Cb -0.15 -2.47 0.31 0.00 -0.30 0.00 0.00 42.92 40.31 2q3r s ASP 349 CO 0.07 -1.42 1.78 -0.09 -0.17 0.00 0.00 175.17 175.34 2q3r h ARG 350 N 9.49 0.57 0.00 4.34 2.43 -2.01 -1.19 114.38 128.02 2q3r h ARG 350 Ca -0.04 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2q3r h ARG 350 Cb 1.04 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.46 2q3r h ARG 350 CO 1.24 0.38 0.15 -2.30 -1.51 0.00 0.00 179.97 177.93 2q3r n PRO 351 N -4.87 0.00 -0.11 0.20 -0.02 -1.26 -0.24 135.00 128.70 2q3r n PRO 351 Ca 0.10 0.35 0.06 0.00 -2.02 0.00 0.00 63.50 61.99 2q3r n PRO 351 Cb 0.26 -1.65 0.11 0.00 -0.02 0.00 0.00 33.50 32.20 2q3r n PRO 351 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2q3r n THR 352 N -1.35 1.58 0.04 3.45 -2.24 -0.45 -4.49 114.28 110.83 2q3r n THR 352 Ca 0.00 -1.69 -0.13 0.00 -2.27 0.00 0.00 64.05 59.96 2q3r n THR 352 Cb 0.15 0.06 -0.09 0.00 -2.10 0.00 0.00 70.33 68.36 2q3r n THR 352 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 2q3r h PHE 353 N 0.45 -0.09 -0.29 4.78 -1.00 -0.62 -3.35 116.94 116.82 2q3r h PHE 353 Ca 0.00 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2q3r h PHE 353 Cb 0.88 0.03 0.00 0.00 3.61 0.00 0.00 35.95 40.47 2q3r h PHE 353 CO 0.09 0.23 0.00 0.66 -1.61 0.00 0.00 178.31 177.69 2q3r n TYR 354 N -4.98 0.47 -1.39 -0.55 4.01 -1.26 -4.30 117.16 109.16 2q3r n TYR 354 Ca -0.08 -0.56 -0.30 0.00 -0.16 0.00 0.00 57.90 56.80 2q3r n TYR 354 Cb 0.20 -0.07 0.11 0.00 -0.31 0.00 0.00 39.34 39.27 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 -1.28 2.94 -0.19 -0.72 -4.23 -1.26 -4.66 115.64 106.25 2q3r s THR 355 Ca 0.23 0.31 -0.02 0.00 -1.18 0.00 0.00 61.69 61.03 2q3r s THR 355 Cb 0.14 -2.93 -0.01 0.00 1.34 0.00 0.00 72.50 71.05 2q3r s THR 355 CO 0.13 -0.40 -0.08 -0.94 -0.54 0.00 0.00 174.62 172.79 2q3r s SER 356 N -3.67 4.13 -0.30 3.99 1.04 -1.26 -4.65 113.70 112.98 2q3r s SER 356 Ca 0.62 -0.39 -0.29 0.00 0.48 0.00 0.00 55.95 56.37 2q3r s SER 356 Cb -0.16 -1.68 0.20 0.00 0.10 0.00 0.00 66.02 64.48 2q3r s SER 356 CO 0.55 0.04 1.40 -0.62 0.98 0.00 0.00 173.24 175.60 2q3r s ASP 357 N 1.11 -0.01 0.33 7.02 2.15 -1.26 -4.98 116.67 121.03 2q3r s ASP 357 Ca 0.01 0.01 0.07 0.00 0.43 0.00 0.00 52.55 53.07 2q3r s ASP 357 Cb -0.15 0.01 0.58 0.00 -0.30 0.00 0.00 42.92 43.06 2q3r s ASP 357 CO -0.02 -0.00 1.80 -0.65 -0.17 0.00 0.00 175.17 176.12 2q3r h PRO 358 N 2.10 0.29 0.00 4.34 0.11 -1.97 -3.38 132.00 133.49 2q3r h PRO 358 Ca -0.09 -0.10 -0.15 0.00 0.11 0.00 0.00 66.00 65.77 2q3r h PRO 358 Cb 1.19 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 2q3r h PRO 358 CO 0.21 0.53 -1.53 0.28 -0.21 0.00 0.00 178.00 177.29 2q3r n VAL 359 N -4.15 0.52 -1.62 3.15 0.31 -1.26 -4.59 118.33 110.69 2q3r n VAL 359 Ca -0.01 -0.16 -0.57 0.00 -0.01 0.00 0.00 64.34 63.59 2q3r n VAL 359 Cb 0.37 -1.27 -0.07 0.00 -0.91 0.00 0.00 33.84 31.96 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 -3.13 0.07 -2.42 2.52 0.31 -1.26 -0.49 118.33 113.94 2q3r n VAL 360 Ca -0.18 -0.01 -0.04 0.00 -0.01 0.00 0.00 64.34 64.10 2q3r n VAL 360 Cb 0.65 -0.68 -0.00 0.00 -0.91 0.00 0.00 33.84 32.89 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 2.87 -0.46 1.10 2.92 0.00 -1.26 -4.69 105.19 105.67 2q3r n GLY 361 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 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 -2.69 -0.12 -0.65 1.61 9.36 0.36 -4.82 117.16 120.19 2q3r n TYR 362 Ca -0.04 0.02 0.04 0.00 3.32 0.00 0.00 57.90 61.24 2q3r n TYR 362 Cb 0.51 0.04 0.06 0.00 -0.63 0.00 0.00 39.34 39.32 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 -3.37 1.26 0.25 2.97 -2.24 -1.04 -4.74 114.28 107.38 2q3r n THR 363 Ca 0.00 -1.43 0.12 0.00 -2.27 0.00 0.00 64.05 60.47 2q3r n THR 363 Cb 0.11 0.21 0.25 0.00 -2.10 0.00 0.00 70.33 68.80 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 -0.84 3.42 -4.75 3.42 3.85 -1.25 -4.92 116.55 115.48 2q3r n ASP 364 Ca 0.07 -1.98 -0.41 0.00 -0.71 0.00 0.00 54.79 51.76 2q3r n ASP 364 Cb 0.46 -0.29 -0.03 0.00 -1.35 0.00 0.00 41.12 39.91 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 -1.42 3.36 0.55 2.11 2.02 -1.26 -5.00 117.35 117.71 2q3r s TYR 365 Ca 0.40 1.50 -0.14 0.00 -0.37 0.00 0.00 57.07 58.46 2q3r s TYR 365 Cb 0.23 -3.47 -0.06 0.00 -0.40 0.00 0.00 41.96 38.26 2q3r s TYR 365 CO 0.32 -1.23 0.99 -1.25 -1.57 0.00 0.00 175.55 172.81 2q3r s PRO 366 N -1.09 3.79 0.66 -1.71 0.04 -1.26 -4.65 135.00 130.78 2q3r s PRO 366 Ca 0.49 0.83 -0.02 0.00 0.04 0.00 0.00 61.00 62.34 2q3r s PRO 366 Cb -0.35 -2.13 0.08 0.00 0.04 0.00 0.00 34.50 32.14 2q3r s PRO 366 CO 0.43 -0.38 0.93 -0.06 0.04 0.00 0.00 177.00 177.96 2q3r s PHE 367 N -2.84 2.43 0.89 0.56 0.40 -1.26 -4.55 117.98 113.61 2q3r s PHE 367 Ca 0.57 0.03 -0.12 0.00 -0.60 0.00 0.00 56.93 56.81 2q3r s PHE 367 Cb -0.10 -3.00 0.13 0.00 0.51 0.00 0.00 43.02 40.55 2q3r s PHE 367 CO 0.41 -1.34 1.10 -0.51 0.70 0.00 0.00 175.22 175.57 2q3r s LEU 368 N -5.05 2.21 0.00 -0.37 1.43 -1.26 -5.07 118.68 110.56 2q3r s LEU 368 Ca 0.61 1.37 0.00 0.00 -1.03 0.00 0.00 54.13 55.09 2q3r s LEU 368 Cb -0.09 -3.79 0.00 0.00 0.03 0.00 0.00 46.19 42.35 2q3r s LEU 368 CO 0.42 -2.58 0.00 -0.62 0.23 0.00 0.00 176.35 173.81