#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d6r s VAL 17 N 0.00 4.96 -0.88 1.39 1.01 0.76 -4.22 120.40 123.42 1d6r s VAL 17 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.02 1d6r s VAL 17 Cb 0.00 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 33.10 1d6r s VAL 17 CO 0.00 0.40 0.00 0.61 0.00 0.00 0.00 175.10 176.11 1d6r n GLY 18 N 4.03 0.92 0.00 4.51 0.00 -1.25 -0.64 105.19 112.77 1d6r n GLY 18 Ca -0.16 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1d6r n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d6r n GLY 19 N -1.84 1.41 3.30 -0.02 0.00 -1.26 -4.89 105.19 101.88 1d6r n GLY 19 Ca -0.09 -2.03 -0.16 0.00 0.00 0.00 0.00 46.02 43.75 1d6r n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1d6r s TYR 20 N 0.93 1.47 -0.27 1.61 -0.85 0.61 -4.91 117.35 115.94 1d6r s TYR 20 Ca 0.00 -0.71 -0.29 0.00 -0.52 0.00 0.00 57.07 55.55 1d6r s TYR 20 Cb 0.00 -0.74 -0.02 0.00 0.38 0.00 0.00 41.96 41.59 1d6r s TYR 20 CO 0.00 0.17 1.57 0.99 -1.52 0.00 0.00 175.55 176.76 1d6r s THR 21 N -3.21 3.75 0.18 -3.49 2.01 -1.26 0.25 115.64 113.88 1d6r s THR 21 Ca 0.20 0.83 -0.17 0.00 0.31 0.00 0.00 61.69 62.86 1d6r s THR 21 Cb 0.02 -3.82 0.14 0.00 0.01 0.00 0.00 72.50 68.85 1d6r s THR 21 CO 0.04 -0.39 1.64 0.00 -0.69 0.00 0.00 174.62 175.21 1d6r n GLY 23 N -1.38 2.62 3.66 0.00 0.00 -1.26 -4.84 105.19 103.99 1d6r n GLY 23 Ca 0.04 -1.46 -0.54 0.00 0.00 0.00 0.00 46.02 44.06 1d6r n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d6r n ALA 24 N 1.54 -0.36 -1.68 4.61 0.00 -1.26 -2.01 120.51 121.35 1d6r n ALA 24 Ca 0.00 0.44 -0.18 0.00 0.00 0.00 0.00 53.44 53.70 1d6r n ALA 24 Cb 0.00 -2.19 -0.06 0.00 0.00 0.00 0.00 19.45 17.20 1d6r n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1d6r n ASN 25 N 4.14 -5.11 0.18 0.00 3.02 -1.26 -4.87 115.26 111.35 1d6r n ASN 25 Ca 0.22 0.34 0.07 0.00 -0.03 0.00 0.00 54.58 55.18 1d6r n ASN 25 Cb 0.18 -4.16 0.15 0.00 -0.61 0.00 0.00 39.78 35.33 1d6r n ASN 25 CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 1d6r h THR 26 N 0.00 0.51 -2.22 3.41 1.35 -1.73 -3.34 112.91 110.90 1d6r h THR 26 Ca -0.37 -1.63 -0.60 0.00 -0.55 0.00 0.00 66.41 63.26 1d6r h THR 26 Cb 1.18 2.17 -0.42 0.00 -1.73 0.00 0.00 68.15 69.35 1d6r h THR 26 CO 0.52 0.28 -0.57 0.52 -0.25 0.00 0.00 175.52 176.01 1d6r n VAL 27 N -3.20 2.54 0.00 6.82 0.31 -1.26 -4.96 118.33 118.58 1d6r n VAL 27 Ca 0.02 -5.30 0.00 0.00 -0.01 0.00 0.00 64.34 59.06 1d6r n VAL 27 Cb 0.62 -1.99 0.00 0.00 -0.91 0.00 0.00 33.84 31.56 1d6r n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1d6r n PRO 28 N 0.67 0.00 0.00 5.55 -0.04 -1.26 -1.37 135.00 138.55 1d6r n PRO 28 Ca 0.30 0.31 0.10 0.00 -0.04 0.00 0.00 63.50 64.17 1d6r n PRO 28 Cb 0.41 -1.51 -0.04 0.00 -0.04 0.00 0.00 33.50 32.31 1d6r n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1d6r n TYR 29 N -1.31 0.00 -2.13 0.54 0.18 -1.19 -1.69 117.16 111.57 1d6r n TYR 29 Ca 0.00 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.36 1d6r n TYR 29 Cb 0.01 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 38.94 1d6r n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1d6r s GLN 30 N -2.47 4.29 0.25 -3.48 2.00 -0.47 -1.18 119.66 118.59 1d6r s GLN 30 Ca 0.13 2.12 0.12 0.00 -2.00 0.00 0.00 55.36 55.73 1d6r s GLN 30 Cb 0.16 -3.31 -0.05 0.00 0.80 0.00 0.00 33.01 30.61 1d6r s GLN 30 CO 0.61 -0.50 -0.21 0.14 -0.50 0.00 0.00 175.29 174.83 1d6r s VAL 31 N 1.42 2.44 -0.14 1.34 -7.23 -0.56 -4.59 120.40 113.07 1d6r s VAL 31 Ca 0.66 -2.29 -0.03 0.00 -1.81 0.00 0.00 61.98 58.51 1d6r s VAL 31 Cb -0.37 -2.24 -0.03 0.00 0.56 0.00 0.00 36.38 34.30 1d6r s VAL 31 CO 0.30 -0.31 -0.05 -0.55 -0.31 0.00 0.00 175.10 174.17 1d6r s SER 32 N -3.25 4.68 -0.22 4.85 0.15 -0.39 -2.46 113.70 117.06 1d6r s SER 32 Ca 0.27 -0.14 -0.13 0.00 0.70 0.00 0.00 55.95 56.65 1d6r s SER 32 Cb -0.06 -1.68 -0.04 0.00 -1.71 0.00 0.00 66.02 62.53 1d6r s SER 32 CO 0.13 0.20 0.27 -0.76 1.20 0.00 0.00 173.24 174.28 1d6r s LEU 33 N 0.18 4.14 -0.04 3.45 1.43 0.86 -1.87 118.68 126.82 1d6r s LEU 33 Ca -0.03 0.32 0.06 0.00 -1.03 0.00 0.00 54.13 53.45 1d6r s LEU 33 Cb -0.14 -2.30 -0.02 0.00 0.03 0.00 0.00 46.19 43.76 1d6r s LEU 33 CO 0.03 0.01 -0.21 0.21 0.23 0.00 0.00 176.35 176.62 1d6r s ASN 34 N 0.99 3.43 -0.28 2.29 3.84 -0.06 -1.25 114.94 123.90 1d6r s ASN 34 Ca 0.13 -0.38 0.21 0.00 0.21 0.00 0.00 52.86 53.03 1d6r s ASN 34 Cb -0.14 -0.69 0.49 0.00 -0.55 0.00 0.00 41.25 40.36 1d6r s ASN 34 CO 0.06 0.30 1.08 -1.54 -2.79 0.00 0.00 177.10 174.21 1d6r n SER 37 N 2.58 1.35 0.00 -4.21 3.41 -1.26 -1.37 113.62 114.12 1d6r n SER 37 Ca -0.17 -2.24 0.00 0.00 -0.26 0.00 0.00 58.87 56.20 1d6r n SER 37 Cb 0.52 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 64.04 1d6r n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1d6r n GLY 38 N -0.47 0.40 3.56 5.00 0.00 -1.26 -4.99 105.19 107.43 1d6r n GLY 38 Ca 0.06 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.02 1d6r n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1d6r s TYR 39 N -2.01 -0.24 0.00 1.61 1.13 -1.26 -5.15 117.35 111.43 1d6r s TYR 39 Ca 0.00 0.21 -0.30 0.00 -1.41 0.00 0.00 57.07 55.56 1d6r s TYR 39 Cb 0.00 0.51 -0.06 0.00 -1.10 0.00 0.00 41.96 41.31 1d6r s TYR 39 CO 0.00 -0.35 1.52 -1.58 -2.51 0.00 0.00 175.55 172.63 1d6r s HIS 40 N -2.46 2.56 0.00 -3.49 5.65 -1.26 -4.25 115.29 112.04 1d6r s HIS 40 Ca 0.06 0.56 0.00 0.00 0.25 0.00 0.00 55.06 55.93 1d6r s HIS 40 Cb -0.01 -3.79 0.00 0.00 -1.18 0.00 0.00 32.58 27.60 1d6r s HIS 40 CO -0.06 -3.11 0.00 1.97 -0.65 0.00 0.00 174.74 172.90 1d6r n PHE 41 N 5.83 0.00 -3.80 3.88 1.16 -0.38 -4.97 117.46 119.18 1d6r n PHE 41 Ca 0.15 0.00 -0.06 0.00 -1.87 0.00 0.00 57.45 55.67 1d6r n PHE 41 Cb 0.43 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.28 1d6r n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1d6r n GLY 43 N -0.46 2.54 3.92 0.00 0.00 0.14 -0.10 105.19 111.23 1d6r n GLY 43 Ca -0.05 -2.26 -0.01 0.00 0.00 0.00 0.00 46.02 43.70 1d6r n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1d6r s GLY 44 N -4.01 0.01 -0.03 -0.02 0.00 -1.03 -4.03 107.32 98.21 1d6r s GLY 44 Ca 0.35 -0.17 0.01 0.00 0.00 0.00 0.00 44.72 44.90 1d6r s GLY 44 CO 0.22 3.75 -0.02 -0.56 0.00 0.00 0.00 173.10 176.50 1d6r s SER 45 N -3.57 0.54 -0.23 1.64 0.01 -0.51 -1.50 113.70 110.07 1d6r s SER 45 Ca 0.25 -0.06 -0.29 0.00 1.31 0.00 0.00 55.95 57.16 1d6r s SER 45 Cb -0.02 -0.24 0.00 0.00 0.21 0.00 0.00 66.02 65.98 1d6r s SER 45 CO 0.03 -0.05 1.16 -0.22 0.41 0.00 0.00 173.24 174.57 1d6r s LEU 46 N 0.73 4.07 -0.02 2.44 2.96 -0.33 -0.60 118.68 127.93 1d6r s LEU 46 Ca -0.08 1.41 0.18 0.00 -0.22 0.00 0.00 54.13 55.42 1d6r s LEU 46 Cb -0.11 -3.54 -0.28 0.00 0.50 0.00 0.00 46.19 42.76 1d6r s LEU 46 CO -0.01 -0.80 0.41 2.30 -1.32 0.00 0.00 176.35 176.93 1d6r n ILE 47 N 5.56 0.00 -3.65 6.68 -5.35 -0.50 -0.79 119.36 121.30 1d6r n ILE 47 Ca 0.13 -0.40 -0.07 0.00 -0.27 0.00 0.00 62.75 62.14 1d6r n ILE 47 Cb 0.46 0.12 0.02 0.00 -1.74 0.00 0.00 39.64 38.50 1d6r n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1d6r n ASN 48 N -2.10 -1.84 0.31 7.28 2.04 -1.17 -4.46 115.26 115.33 1d6r n ASN 48 Ca -0.03 -2.29 0.19 0.00 -0.44 0.00 0.00 54.58 52.01 1d6r n ASN 48 Cb 0.46 3.06 1.04 0.00 -2.53 0.00 0.00 39.78 41.82 1d6r n ASN 48 CO 0.00 0.00 0.00 0.77 -0.44 0.00 0.00 177.26 177.59 1d6r h SER 49 N 1.59 0.00 0.00 0.53 4.64 -1.95 -3.24 113.55 115.12 1d6r h SER 49 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1d6r h SER 49 Cb 1.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 1d6r h SER 49 CO 0.34 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 176.31 1d6r n GLN 50 N -3.45 -0.44 -4.23 4.77 6.02 -1.26 -0.32 117.38 118.47 1d6r n GLN 50 Ca -0.03 -0.38 -0.19 0.00 -0.01 0.00 0.00 57.00 56.39 1d6r n GLN 50 Cb 0.10 -0.88 -0.15 0.00 1.02 0.00 0.00 30.24 30.32 1d6r n GLN 50 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1d6r s TRP 51 N -0.05 0.72 0.08 1.08 0.52 -1.22 0.14 118.94 120.20 1d6r s TRP 51 Ca 0.00 -0.17 0.07 0.00 0.02 0.00 0.00 56.10 56.02 1d6r s TRP 51 Cb 0.00 -0.56 -0.04 0.00 -1.15 0.00 0.00 33.47 31.73 1d6r s TRP 51 CO 0.00 -0.10 -0.14 0.08 0.02 0.00 0.00 176.95 176.80 1d6r s VAL 52 N 0.38 3.09 -0.14 4.03 1.01 -0.20 -1.42 120.40 127.15 1d6r s VAL 52 Ca -0.05 -1.25 0.00 0.00 0.00 0.00 0.00 61.98 60.68 1d6r s VAL 52 Cb -0.09 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 33.90 1d6r s VAL 52 CO 0.00 0.21 -0.14 0.54 0.00 0.00 0.00 175.10 175.71 1d6r s VAL 53 N -1.08 2.88 0.00 2.92 0.11 0.23 -1.10 120.40 124.36 1d6r s VAL 53 Ca 0.18 -0.71 0.00 0.00 -2.93 0.00 0.00 61.98 58.52 1d6r s VAL 53 Cb -0.11 -2.21 0.00 0.00 -1.53 0.00 0.00 36.38 32.53 1d6r s VAL 53 CO 0.09 0.52 0.00 -0.24 -3.33 0.00 0.00 175.10 172.14 1d6r n SER 54 N 3.75 1.18 -4.84 3.54 2.88 -0.74 -1.43 113.62 117.96 1d6r n SER 54 Ca -0.18 -0.38 -0.37 0.00 -1.33 0.00 0.00 58.87 56.60 1d6r n SER 54 Cb 0.52 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.92 1d6r n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1d6r s ALA 55 N -2.00 3.69 0.47 -1.46 0.00 -1.26 -1.82 121.76 119.38 1d6r s ALA 55 Ca 0.00 -0.23 0.18 0.00 0.00 0.00 0.00 51.96 51.91 1d6r s ALA 55 Cb 0.00 -2.38 1.18 0.00 0.00 0.00 0.00 23.12 21.92 1d6r s ALA 55 CO 0.00 0.49 2.05 0.00 0.00 0.00 0.00 175.76 178.30 1d6r h ALA 56 N 4.42 1.67 0.00 0.00 0.00 -1.72 0.48 119.26 124.12 1d6r h ALA 56 Ca -0.51 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1d6r h ALA 56 Cb 1.21 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1d6r h ALA 56 CO 0.63 0.16 0.00 -2.39 0.00 0.00 0.00 179.25 177.65 1d6r n HIS 57 N -4.22 0.06 1.68 0.00 1.44 -1.26 -1.58 115.22 111.33 1d6r n HIS 57 Ca -0.02 0.02 0.14 0.00 -2.01 0.00 0.00 57.72 55.84 1d6r n HIS 57 Cb 0.20 -0.53 0.65 0.00 0.12 0.00 0.00 29.99 30.43 1d6r n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1d6r n TYR 59 N -0.29 2.66 -3.57 0.00 9.36 -0.62 -4.98 117.16 119.72 1d6r n TYR 59 Ca 0.20 0.40 -0.07 0.00 3.32 0.00 0.00 57.90 61.74 1d6r n TYR 59 Cb 0.24 -2.52 -0.02 0.00 -0.63 0.00 0.00 39.34 36.41 1d6r n TYR 59 CO 0.00 0.00 0.00 0.21 0.22 0.00 0.00 176.86 177.29 1d6r s LYS 60 N -1.20 0.99 0.32 2.98 2.20 -1.26 -5.16 119.74 118.62 1d6r s LYS 60 Ca 0.60 -0.43 0.05 0.00 -0.36 0.00 0.00 55.97 55.83 1d6r s LYS 60 Cb -0.53 0.41 -0.02 0.00 -1.51 0.00 0.00 37.83 36.19 1d6r s LYS 60 CO 0.56 -0.44 0.46 -1.54 -0.36 0.00 0.00 175.35 174.02 1d6r s SER 61 N -2.65 6.08 -0.89 1.43 1.04 -1.26 -4.59 113.70 112.86 1d6r s SER 61 Ca 0.07 -0.05 -0.04 0.00 0.48 0.00 0.00 55.95 56.41 1d6r s SER 61 Cb -0.01 -1.48 -0.05 0.00 0.10 0.00 0.00 66.02 64.58 1d6r s SER 61 CO -0.06 -0.34 0.78 0.61 0.98 0.00 0.00 173.24 175.21 1d6r n GLY 62 N -1.61 -0.96 3.74 7.32 0.00 -1.26 -5.00 105.19 107.41 1d6r n GLY 62 Ca -0.03 0.47 -0.34 0.00 0.00 0.00 0.00 46.02 46.12 1d6r n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1d6r s ILE 63 N -3.29 4.57 -0.07 -0.61 1.01 -1.26 -4.72 121.20 116.83 1d6r s ILE 63 Ca 0.34 -0.26 0.04 0.00 0.00 0.00 0.00 60.65 60.77 1d6r s ILE 63 Cb -0.04 -2.99 -0.02 0.00 0.01 0.00 0.00 42.46 39.42 1d6r s ILE 63 CO 0.66 0.52 -0.19 -1.58 0.00 0.00 0.00 174.94 174.34 1d6r s GLN 64 N -1.19 2.70 -0.14 2.79 0.74 -0.47 -2.43 119.66 121.66 1d6r s GLN 64 Ca 0.17 -0.79 -0.12 0.00 0.05 0.00 0.00 55.36 54.66 1d6r s GLN 64 Cb -0.12 -2.33 -0.05 0.00 1.10 0.00 0.00 33.01 31.62 1d6r s GLN 64 CO 0.06 0.43 0.26 0.08 -0.55 0.00 0.00 175.29 175.58 1d6r s VAL 65 N -0.25 5.31 -0.25 1.34 1.01 0.91 -0.88 120.40 127.59 1d6r s VAL 65 Ca 0.00 0.49 -0.00 0.00 0.00 0.00 0.00 61.98 62.47 1d6r s VAL 65 Cb -0.13 -3.59 0.04 0.00 0.00 0.00 0.00 36.38 32.70 1d6r s VAL 65 CO 0.03 0.46 -0.08 -0.13 0.00 0.00 0.00 175.10 175.37 1d6r s ARG 66 N -0.00 2.66 0.25 2.72 0.52 -0.78 -1.21 118.95 123.11 1d6r s ARG 66 Ca 0.16 -1.08 0.07 0.00 -0.52 0.00 0.00 55.73 54.36 1d6r s ARG 66 Cb -0.13 -2.93 -0.04 0.00 0.52 0.00 0.00 34.95 32.37 1d6r s ARG 66 CO 0.04 -0.44 0.21 -0.51 0.02 0.00 0.00 175.30 174.62 1d6r s LEU 67 N 1.26 3.84 -1.79 2.53 1.43 0.20 -1.26 118.68 124.89 1d6r s LEU 67 Ca -0.02 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.84 1d6r s LEU 67 Cb -0.17 -2.38 0.00 0.00 0.03 0.00 0.00 46.19 43.67 1d6r s LEU 67 CO -0.05 -0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.09 1d6r n GLY 69 N -1.20 1.64 3.82 -3.19 0.00 -1.26 -2.37 105.19 102.63 1d6r n GLY 69 Ca -0.08 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 1d6r n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1d6r s GLU 70 N -3.41 4.07 0.00 1.61 0.41 -1.26 -4.10 118.70 116.02 1d6r s GLU 70 Ca 0.00 1.14 0.00 0.00 -0.41 0.00 0.00 54.97 55.70 1d6r s GLU 70 Cb 0.00 -2.15 0.00 0.00 -1.78 0.00 0.00 34.13 30.20 1d6r s GLU 70 CO 0.00 -0.17 0.00 -3.47 -0.49 0.00 0.00 175.26 171.13 1d6r n ASP 71 N -0.90 0.00 -4.51 -0.19 2.03 -1.26 -4.63 116.55 107.09 1d6r n ASP 71 Ca 0.07 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.95 1d6r n ASP 71 Cb 0.54 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.87 1d6r n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1d6r s ASN 72 N -3.35 6.29 0.00 1.67 3.84 -1.26 -3.48 114.94 118.65 1d6r s ASN 72 Ca 0.00 -0.45 0.12 0.00 0.21 0.00 0.00 52.86 52.73 1d6r s ASN 72 Cb 0.00 -2.30 0.59 0.00 -0.55 0.00 0.00 41.25 38.99 1d6r s ASN 72 CO 0.00 -0.77 1.26 2.30 -2.79 0.00 0.00 177.10 177.11 1d6r n ILE 73 N 5.77 0.67 0.75 -5.21 -5.35 -0.56 -2.40 119.36 113.03 1d6r n ILE 73 Ca -0.03 0.17 0.09 0.00 -0.27 0.00 0.00 62.75 62.70 1d6r n ILE 73 Cb 0.48 -0.98 0.02 0.00 -1.74 0.00 0.00 39.64 37.42 1d6r n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1d6r n ASN 74 N -1.27 1.95 -3.94 7.28 5.03 -1.26 -4.96 115.26 118.10 1d6r n ASN 74 Ca 0.06 -1.47 -0.22 0.00 0.87 0.00 0.00 54.58 53.81 1d6r n ASN 74 Cb 0.09 0.32 -0.16 0.00 -1.02 0.00 0.00 39.78 39.00 1d6r n ASN 74 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1d6r s VAL 75 N -1.82 0.76 -0.43 2.41 1.01 -1.01 -5.10 120.40 116.22 1d6r s VAL 75 Ca 0.16 -0.25 -0.29 0.00 0.00 0.00 0.00 61.98 61.61 1d6r s VAL 75 Cb 0.14 -0.75 0.02 0.00 0.00 0.00 0.00 36.38 35.80 1d6r s VAL 75 CO 0.36 0.28 1.24 -0.69 0.00 0.00 0.00 175.10 176.29 1d6r s VAL 76 N 0.88 4.12 -1.86 2.92 1.01 -1.26 -4.64 120.40 121.56 1d6r s VAL 76 Ca -0.11 1.16 0.20 0.00 0.00 0.00 0.00 61.98 63.23 1d6r s VAL 76 Cb -0.15 -4.43 0.00 0.00 0.00 0.00 0.00 36.38 31.81 1d6r s VAL 76 CO 0.01 -0.85 1.00 -0.62 0.00 0.00 0.00 175.10 174.64 1d6r n GLU 77 N 7.82 1.45 -0.32 2.72 1.02 -1.26 -5.00 120.64 127.07 1d6r n GLU 77 Ca 0.14 -0.98 0.00 0.00 -0.02 0.00 0.00 57.16 56.30 1d6r n GLU 77 Cb 0.48 -1.39 0.00 0.00 -0.02 0.00 0.00 31.44 30.51 1d6r n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1d6r n GLY 78 N 1.30 0.81 0.00 0.62 0.00 -1.26 -4.92 105.19 101.73 1d6r n GLY 78 Ca 0.08 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1d6r n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1d6r n ASN 79 N 0.52 0.78 -4.81 1.61 3.02 -1.26 -5.05 115.26 110.07 1d6r n ASN 79 Ca 0.00 -0.91 -0.33 0.00 -0.03 0.00 0.00 54.58 53.30 1d6r n ASN 79 Cb 0.00 0.15 -0.06 0.00 -0.61 0.00 0.00 39.78 39.26 1d6r n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1d6r s GLU 80 N -0.15 4.08 -0.09 3.52 8.01 -1.26 -4.39 118.70 128.43 1d6r s GLU 80 Ca 0.00 1.19 0.00 0.00 0.01 0.00 0.00 54.97 56.18 1d6r s GLU 80 Cb 0.00 -2.15 0.02 0.00 -4.31 0.00 0.00 34.13 27.69 1d6r s GLU 80 CO 0.00 -0.17 -0.08 -0.65 0.01 0.00 0.00 175.26 174.37 1d6r s GLN 81 N -3.22 1.46 -0.29 1.61 -0.21 -1.00 -4.98 119.66 113.02 1d6r s GLN 81 Ca 0.64 -0.27 -0.04 0.00 0.02 0.00 0.00 55.36 55.71 1d6r s GLN 81 Cb -0.11 -1.42 0.03 0.00 1.00 0.00 0.00 33.01 32.50 1d6r s GLN 81 CO 0.16 -0.16 0.02 -0.06 -2.12 0.00 0.00 175.29 173.12 1d6r s PHE 82 N 1.34 3.17 -0.04 0.91 2.99 -1.26 -0.63 117.98 124.46 1d6r s PHE 82 Ca -0.02 -1.47 0.02 0.00 0.00 0.00 0.00 56.93 55.45 1d6r s PHE 82 Cb -0.14 -2.16 0.01 0.00 0.00 0.00 0.00 43.02 40.73 1d6r s PHE 82 CO -0.04 -0.71 -0.09 0.42 -0.00 0.00 0.00 175.22 174.80 1d6r s ILE 83 N 1.36 0.83 0.50 0.64 1.01 -0.35 -4.97 121.20 120.22 1d6r s ILE 83 Ca -0.01 -0.35 -0.19 0.00 0.00 0.00 0.00 60.65 60.11 1d6r s ILE 83 Cb -0.18 -0.76 -0.08 0.00 0.01 0.00 0.00 42.46 41.45 1d6r s ILE 83 CO -0.01 0.27 1.01 -0.44 0.00 0.00 0.00 174.94 175.78 1d6r s SER 84 N 0.43 6.42 0.30 3.58 0.01 -1.26 -0.07 113.70 123.12 1d6r s SER 84 Ca -0.07 1.78 -0.28 0.00 1.31 0.00 0.00 55.95 58.69 1d6r s SER 84 Cb -0.11 -2.54 -0.09 0.00 0.21 0.00 0.00 66.02 63.48 1d6r s SER 84 CO 0.01 -0.72 1.00 0.00 0.41 0.00 0.00 173.24 173.94 1d6r s ALA 85 N -2.26 3.27 -0.07 1.44 0.00 -1.02 0.98 121.76 124.10 1d6r s ALA 85 Ca 0.64 0.67 0.21 0.00 0.00 0.00 0.00 51.96 53.48 1d6r s ALA 85 Cb -0.13 -3.24 -0.31 0.00 0.00 0.00 0.00 23.12 19.44 1d6r s ALA 85 CO 0.24 0.03 0.40 -1.13 0.00 0.00 0.00 175.76 175.31 1d6r n SER 86 N 0.85 0.03 -3.54 0.00 3.41 0.39 -4.65 113.62 110.11 1d6r n SER 86 Ca 0.01 0.01 -0.15 0.00 -0.26 0.00 0.00 58.87 58.48 1d6r n SER 86 Cb 0.48 1.71 -0.06 0.00 -0.26 0.00 0.00 64.21 66.08 1d6r n SER 86 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1d6r s LYS 87 N -3.27 0.86 -0.03 4.33 -2.85 -1.22 -5.02 119.74 112.55 1d6r s LYS 87 Ca -0.08 0.21 0.03 0.00 -1.00 0.00 0.00 55.97 55.12 1d6r s LYS 87 Cb 0.12 0.41 0.00 0.00 -2.06 0.00 0.00 37.83 36.30 1d6r s LYS 87 CO 0.89 -0.27 -0.11 -1.12 0.10 0.00 0.00 175.35 174.84 1d6r s SER 88 N -1.17 1.47 -0.25 0.03 0.01 -1.26 0.00 113.70 112.54 1d6r s SER 88 Ca -0.07 -0.23 -0.01 0.00 1.31 0.00 0.00 55.95 56.95 1d6r s SER 88 Cb -0.00 -0.43 0.07 0.00 0.21 0.00 0.00 66.02 65.87 1d6r s SER 88 CO 0.06 0.08 0.02 -0.63 0.41 0.00 0.00 173.24 173.18 1d6r s ILE 89 N 0.22 1.07 0.35 1.44 1.01 0.76 -4.99 121.20 121.07 1d6r s ILE 89 Ca -0.04 -1.11 -0.26 0.00 0.00 0.00 0.00 60.65 59.24 1d6r s ILE 89 Cb -0.10 -1.56 -0.09 0.00 0.01 0.00 0.00 42.46 40.71 1d6r s ILE 89 CO 0.01 -0.31 1.01 -0.69 0.00 0.00 0.00 174.94 174.96 1d6r s VAL 90 N 1.58 3.88 0.16 2.92 1.01 -1.26 -1.15 120.40 127.54 1d6r s VAL 90 Ca 0.01 1.55 -0.33 0.00 0.00 0.00 0.00 61.98 63.20 1d6r s VAL 90 Cb -0.18 -3.85 -0.16 0.00 0.00 0.00 0.00 36.38 32.19 1d6r s VAL 90 CO -0.12 0.11 1.25 1.57 0.00 0.00 0.00 175.10 177.92 1d6r n HIS 91 N 0.37 1.51 0.11 5.22 -0.00 -0.84 -4.85 115.22 116.74 1d6r n HIS 91 Ca 0.03 0.62 0.20 0.00 0.46 0.00 0.00 57.72 59.02 1d6r n HIS 91 Cb 0.49 -2.33 0.75 0.00 -0.12 0.00 0.00 29.99 28.78 1d6r n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1d6r h PRO 92 N 3.87 0.00 -0.21 1.57 0.13 -1.93 -2.25 132.00 133.18 1d6r h PRO 92 Ca -0.44 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.65 1d6r h PRO 92 Cb 1.33 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.44 1d6r h PRO 92 CO 0.73 0.00 -0.04 0.43 -0.23 0.00 0.00 178.00 178.90 1d6r n SER 93 N -3.66 3.14 -4.70 1.44 7.64 -1.26 -5.01 113.62 111.22 1d6r n SER 93 Ca 0.06 -3.23 -0.43 0.00 1.01 0.00 0.00 58.87 56.28 1d6r n SER 93 Cb 0.59 -0.54 -0.03 0.00 -1.01 0.00 0.00 64.21 63.22 1d6r n SER 93 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1d6r n TYR 94 N -0.89 2.58 -3.91 1.43 -0.00 -0.85 -4.66 117.16 110.87 1d6r n TYR 94 Ca 0.22 0.16 -0.34 0.00 -0.00 0.00 0.00 57.90 57.94 1d6r n TYR 94 Cb 0.86 -2.61 -0.14 0.00 -0.00 0.00 0.00 39.34 37.45 1d6r n TYR 94 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.86 178.07 1d6r s ASN 95 N 0.96 4.91 0.00 2.98 3.84 -0.43 -4.98 114.94 122.22 1d6r s ASN 95 Ca 0.75 -1.57 0.19 0.00 0.21 0.00 0.00 52.86 52.44 1d6r s ASN 95 Cb -0.57 -1.71 0.92 0.00 -0.55 0.00 0.00 41.25 39.34 1d6r s ASN 95 CO 0.37 -0.33 1.61 -1.54 -2.79 0.00 0.00 177.10 174.42 1d6r n SER 96 N 4.55 0.00 -0.01 -4.21 3.41 -1.26 0.67 113.62 116.78 1d6r n SER 96 Ca -0.09 0.21 -0.21 0.00 -0.26 0.00 0.00 58.87 58.52 1d6r n SER 96 Cb 0.43 -0.37 -0.14 0.00 -0.26 0.00 0.00 64.21 63.87 1d6r n SER 96 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1d6r h ASN 97 N 0.00 0.34 0.00 4.04 -0.73 -1.96 -3.39 115.58 113.88 1d6r h ASN 97 Ca 0.00 -0.83 0.00 0.00 1.87 0.00 0.00 56.30 57.34 1d6r h ASN 97 Cb 0.25 -0.11 0.00 0.00 0.27 0.00 0.00 38.32 38.73 1d6r h ASN 97 CO 0.00 1.61 -0.89 0.35 -0.37 0.00 0.00 177.43 178.13 1d6r n THR 98 N -3.95 0.00 -1.95 -3.57 -2.24 -1.19 -4.97 114.28 96.41 1d6r n THR 98 Ca -0.26 -0.14 -0.10 0.00 -2.27 0.00 0.00 64.05 61.28 1d6r n THR 98 Cb 0.88 0.90 -0.02 0.00 -2.10 0.00 0.00 70.33 70.00 1d6r n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1d6r n LEU 99 N -1.47 -1.27 -4.75 3.22 4.77 0.21 -5.01 117.00 112.71 1d6r n LEU 99 Ca 0.02 0.06 -0.40 0.00 -0.03 0.00 0.00 56.01 55.66 1d6r n LEU 99 Cb 0.28 -1.69 -0.06 0.00 -2.33 0.00 0.00 43.42 39.63 1d6r n LEU 99 CO 0.34 -0.22 0.67 0.21 -1.33 0.00 0.00 177.39 177.05 1d6r s ASN 100 N -2.63 7.60 -1.03 -1.43 3.04 -1.14 -3.59 114.94 115.76 1d6r s ASN 100 Ca 0.00 1.97 -0.00 0.00 0.04 0.00 0.00 52.86 54.87 1d6r s ASN 100 Cb 0.00 -2.61 -0.01 0.00 -1.54 0.00 0.00 41.25 37.09 1d6r s ASN 100 CO 0.00 0.11 0.86 0.59 -3.04 0.00 0.00 177.10 175.62 1d6r n ASN 101 N 1.56 -2.37 -4.00 -4.21 3.02 -1.26 -1.31 115.26 106.69 1d6r n ASN 101 Ca -0.02 -0.54 -0.43 0.00 -0.03 0.00 0.00 54.58 53.56 1d6r n ASN 101 Cb 0.47 -4.52 0.00 0.00 -0.61 0.00 0.00 39.78 35.12 1d6r n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1d6r n ASP 102 N -2.86 4.63 -3.78 6.41 2.03 -1.24 -4.07 116.55 117.67 1d6r n ASP 102 Ca -0.24 -2.96 -0.13 0.00 0.52 0.00 0.00 54.79 51.98 1d6r n ASP 102 Cb 0.64 -1.60 -0.10 0.00 -0.72 0.00 0.00 41.12 39.35 1d6r n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1d6r s ILE 103 N 2.18 0.04 -0.01 5.18 2.07 -1.26 -3.84 121.20 125.55 1d6r s ILE 103 Ca 0.45 -0.31 -0.13 0.00 -1.41 0.00 0.00 60.65 59.25 1d6r s ILE 103 Cb 0.09 -0.50 0.02 0.00 0.13 0.00 0.00 42.46 42.19 1d6r s ILE 103 CO -0.02 -0.17 0.27 -0.32 -1.91 0.00 0.00 174.94 172.79 1d6r s MET 104 N -0.71 0.64 -0.06 3.50 -2.45 -0.76 -1.98 119.30 117.49 1d6r s MET 104 Ca -0.08 -0.26 0.03 0.00 -1.25 0.00 0.00 55.69 54.13 1d6r s MET 104 Cb -0.04 0.28 -0.03 0.00 1.25 0.00 0.00 34.83 36.29 1d6r s MET 104 CO 0.02 -0.17 -0.13 -0.51 1.05 0.00 0.00 175.02 175.28 1d6r s LEU 105 N -1.38 2.82 -0.08 4.11 1.02 -0.30 -1.79 118.68 123.07 1d6r s LEU 105 Ca -0.13 -0.16 0.01 0.00 0.02 0.00 0.00 54.13 53.87 1d6r s LEU 105 Cb -0.05 -1.58 0.02 0.00 0.02 0.00 0.00 46.19 44.59 1d6r s LEU 105 CO 0.03 0.34 -0.11 -0.63 0.02 0.00 0.00 176.35 176.01 1d6r s ILE 106 N -0.72 1.12 -0.17 -0.59 1.01 -0.26 -0.17 121.20 121.43 1d6r s ILE 106 Ca 0.11 -0.43 -0.11 0.00 0.00 0.00 0.00 60.65 60.22 1d6r s ILE 106 Cb -0.11 -1.06 -0.05 0.00 0.01 0.00 0.00 42.46 41.25 1d6r s ILE 106 CO 0.01 0.36 0.20 -0.75 0.00 0.00 0.00 174.94 174.76 1d6r s LYS 107 N 1.01 4.09 0.48 2.79 2.20 0.10 -1.04 119.74 129.38 1d6r s LYS 107 Ca -0.08 -0.07 -0.21 0.00 -0.36 0.00 0.00 55.97 55.25 1d6r s LYS 107 Cb -0.15 -3.38 -0.08 0.00 -1.51 0.00 0.00 37.83 32.71 1d6r s LYS 107 CO -0.01 0.36 1.07 -0.51 -0.36 0.00 0.00 175.35 175.91 1d6r s LEU 108 N 0.14 3.89 0.35 5.43 1.43 0.37 0.15 118.68 130.42 1d6r s LEU 108 Ca 0.13 2.04 0.04 0.00 -1.03 0.00 0.00 54.13 55.30 1d6r s LEU 108 Cb -0.12 -4.48 0.63 0.00 0.03 0.00 0.00 46.19 42.25 1d6r s LEU 108 CO 0.02 -0.85 1.91 0.50 0.23 0.00 0.00 176.35 178.16 1d6r h LYS 109 N 1.67 0.57 -3.67 1.70 1.63 0.36 -3.39 116.57 115.44 1d6r h LYS 109 Ca -0.49 -0.10 -0.11 0.00 -0.85 0.00 0.00 60.65 59.10 1d6r h LYS 109 Cb 1.23 -0.10 -0.17 0.00 -0.60 0.00 0.00 32.23 32.60 1d6r h LYS 109 CO 0.59 0.54 -0.42 -1.54 -3.45 0.00 0.00 179.45 175.17 1d6r s SER 110 N -6.70 0.09 0.24 4.20 1.04 -1.26 -4.96 113.70 106.35 1d6r s SER 110 Ca -0.08 -0.47 -0.30 0.00 0.48 0.00 0.00 55.95 55.58 1d6r s SER 110 Cb 0.16 0.29 -0.10 0.00 0.10 0.00 0.00 66.02 66.46 1d6r s SER 110 CO 0.76 -0.58 1.46 0.00 0.98 0.00 0.00 173.24 175.86 1d6r s ALA 111 N -2.87 3.65 0.71 5.32 0.00 -1.26 -4.88 121.76 122.43 1d6r s ALA 111 Ca -0.03 1.35 -0.12 0.00 0.00 0.00 0.00 51.96 53.16 1d6r s ALA 111 Cb 0.00 -3.57 0.02 0.00 0.00 0.00 0.00 23.12 19.58 1d6r s ALA 111 CO -0.06 -0.76 1.09 0.00 0.00 0.00 0.00 175.76 176.03 1d6r s ALA 112 N 0.10 2.43 -0.40 0.00 0.00 0.57 -4.97 121.76 119.50 1d6r s ALA 112 Ca 0.61 0.32 -0.15 0.00 0.00 0.00 0.00 51.96 52.74 1d6r s ALA 112 Cb -0.42 -3.26 0.01 0.00 0.00 0.00 0.00 23.12 19.45 1d6r s ALA 112 CO 0.42 -1.45 0.31 -1.12 0.00 0.00 0.00 175.76 173.92 1d6r s SER 113 N -3.19 6.11 0.31 0.00 0.01 -1.26 -4.90 113.70 110.78 1d6r s SER 113 Ca 0.62 -0.81 -0.27 0.00 1.31 0.00 0.00 55.95 56.81 1d6r s SER 113 Cb -0.17 -2.16 -0.10 0.00 0.21 0.00 0.00 66.02 63.80 1d6r s SER 113 CO 0.50 -0.43 0.95 -0.76 0.41 0.00 0.00 173.24 173.90 1d6r s LEU 114 N 1.74 4.39 0.00 2.44 1.43 -1.26 -4.84 118.68 122.58 1d6r s LEU 114 Ca 0.06 1.86 0.00 0.00 -1.03 0.00 0.00 54.13 55.02 1d6r s LEU 114 Cb -0.19 -3.95 0.00 0.00 0.03 0.00 0.00 46.19 42.09 1d6r s LEU 114 CO 0.10 -0.03 0.00 -0.46 0.23 0.00 0.00 176.35 176.19 1d6r n ASN 115 N 0.71 0.00 -0.24 2.29 2.04 0.40 -4.96 115.26 115.50 1d6r n ASN 115 Ca 0.01 -0.56 0.04 0.00 -0.44 0.00 0.00 54.58 53.63 1d6r n ASN 115 Cb 0.50 0.00 0.16 0.00 -2.53 0.00 0.00 39.78 37.91 1d6r n ASN 115 CO 0.00 0.00 0.00 0.77 -0.44 0.00 0.00 177.26 177.59 1d6r h SER 116 N 0.00 0.29 -0.14 0.53 4.64 -2.00 -1.76 113.55 115.12 1d6r h SER 116 Ca 0.00 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1d6r h SER 116 Cb 0.00 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1d6r h SER 116 CO 0.00 0.13 0.00 0.54 -0.87 0.00 0.00 176.83 176.63 1d6r n ARG 117 N -4.98 2.23 -3.44 4.77 1.74 -1.26 -4.73 116.66 110.99 1d6r n ARG 117 Ca 0.13 -1.82 -0.24 0.00 -0.77 0.00 0.00 57.85 55.15 1d6r n ARG 117 Cb 0.36 -1.47 -0.11 0.00 -1.02 0.00 0.00 32.46 30.22 1d6r n ARG 117 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1d6r s VAL 118 N -1.85 -0.11 0.12 1.55 1.01 -0.66 -4.35 120.40 116.11 1d6r s VAL 118 Ca 0.33 -1.13 0.03 0.00 0.00 0.00 0.00 61.98 61.21 1d6r s VAL 118 Cb 0.21 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.59 1d6r s VAL 118 CO 0.31 -0.75 -0.09 0.00 0.00 0.00 0.00 175.10 174.57 1d6r s ALA 119 N 1.59 1.24 0.49 5.51 0.00 -0.68 -0.45 121.76 129.45 1d6r s ALA 119 Ca 0.14 -1.41 0.01 0.00 0.00 0.00 0.00 51.96 50.71 1d6r s ALA 119 Cb -0.18 0.09 0.02 0.00 0.00 0.00 0.00 23.12 23.04 1d6r s ALA 119 CO -0.14 -0.14 0.71 -1.54 0.00 0.00 0.00 175.76 174.65 1d6r s SER 120 N -3.04 5.55 -0.03 0.00 1.04 -1.26 -3.15 113.70 112.80 1d6r s SER 120 Ca 0.14 0.08 0.03 0.00 0.48 0.00 0.00 55.95 56.68 1d6r s SER 120 Cb 0.03 -1.14 -0.03 0.00 0.10 0.00 0.00 66.02 64.98 1d6r s SER 120 CO -0.02 -0.91 -0.12 -0.51 0.98 0.00 0.00 173.24 172.66 1d6r s ILE 121 N -2.63 3.29 0.45 -1.02 1.10 0.03 -4.88 121.20 117.53 1d6r s ILE 121 Ca 0.53 -0.74 -0.23 0.00 -0.51 0.00 0.00 60.65 59.70 1d6r s ILE 121 Cb -0.10 -2.34 -0.08 0.00 0.15 0.00 0.00 42.46 40.09 1d6r s ILE 121 CO 0.38 0.52 1.15 -0.44 -2.11 0.00 0.00 174.94 174.44 1d6r s SER 122 N -0.97 6.23 0.23 4.50 0.01 -1.26 -4.64 113.70 117.80 1d6r s SER 122 Ca 0.13 2.27 -0.08 0.00 1.31 0.00 0.00 55.95 59.58 1d6r s SER 122 Cb -0.11 -2.60 -0.07 0.00 0.21 0.00 0.00 66.02 63.46 1d6r s SER 122 CO 0.03 -0.87 0.53 -0.76 0.41 0.00 0.00 173.24 172.57 1d6r s LEU 123 N -2.99 4.16 0.71 2.44 1.02 -1.26 -1.34 118.68 121.41 1d6r s LEU 123 Ca 0.63 0.85 -0.13 0.00 0.02 0.00 0.00 54.13 55.49 1d6r s LEU 123 Cb -0.28 -3.62 0.02 0.00 0.02 0.00 0.00 46.19 42.34 1d6r s LEU 123 CO 0.34 -0.08 1.11 -2.16 0.02 0.00 0.00 176.35 175.58 1d6r s PRO 124 N -2.92 2.54 0.00 1.29 0.04 -1.25 -4.81 135.00 129.89 1d6r s PRO 124 Ca 0.46 1.35 0.08 0.00 0.04 0.00 0.00 61.00 62.93 1d6r s PRO 124 Cb -0.11 -1.92 0.04 0.00 0.04 0.00 0.00 34.50 32.55 1d6r s PRO 124 CO 0.23 -1.45 0.68 0.25 0.04 0.00 0.00 177.00 176.75 1d6r n THR 125 N -2.83 0.00 -3.50 1.26 -2.24 -1.26 -4.95 114.28 100.75 1d6r n THR 125 Ca 0.10 -0.47 -0.09 0.00 -2.27 0.00 0.00 64.05 61.32 1d6r n THR 125 Cb 0.52 1.14 -0.02 0.00 -2.10 0.00 0.00 70.33 69.87 1d6r n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1d6r s SER 127 N -0.84 -0.38 0.30 3.42 1.04 -1.26 -5.14 113.70 110.84 1d6r s SER 127 Ca 0.08 -0.01 -0.29 0.00 0.48 0.00 0.00 55.95 56.22 1d6r s SER 127 Cb 0.07 0.40 -0.09 0.00 0.10 0.00 0.00 66.02 66.49 1d6r s SER 127 CO 0.13 -0.65 1.09 0.00 0.98 0.00 0.00 173.24 174.79 1d6r s ALA 129 N -1.24 2.95 0.17 0.00 0.00 -1.26 -5.05 121.76 117.33 1d6r s ALA 129 Ca 0.46 0.17 0.04 0.00 0.00 0.00 0.00 51.96 52.63 1d6r s ALA 129 Cb -0.30 -3.14 -0.04 0.00 0.00 0.00 0.00 23.12 19.63 1d6r s ALA 129 CO 0.39 -0.58 0.21 -1.54 0.00 0.00 0.00 175.76 174.24 1d6r s SER 130 N -3.31 5.90 0.42 0.00 1.04 -1.26 -5.06 113.70 111.42 1d6r s SER 130 Ca 0.59 -0.00 -0.23 0.00 0.48 0.00 0.00 55.95 56.79 1d6r s SER 130 Cb -0.12 -1.65 -0.12 0.00 0.10 0.00 0.00 66.02 64.22 1d6r s SER 130 CO 0.40 0.05 0.63 0.00 0.98 0.00 0.00 173.24 175.29 1d6r n ALA 132 N -0.55 -1.23 0.00 5.32 0.00 -1.26 -2.21 120.51 120.58 1d6r n ALA 132 Ca -0.08 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1d6r n ALA 132 Cb 0.55 -1.82 0.00 0.00 0.00 0.00 0.00 19.45 18.17 1d6r n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1d6r n GLY 133 N 1.69 3.09 3.77 0.00 0.00 0.36 -4.93 105.19 109.17 1d6r n GLY 133 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1d6r n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1d6r s THR 134 N -1.86 2.01 -0.18 2.61 2.01 -0.94 -4.58 115.64 114.71 1d6r s THR 134 Ca 0.00 0.01 -0.22 0.00 0.31 0.00 0.00 61.69 61.78 1d6r s THR 134 Cb 0.00 -3.00 -0.02 0.00 0.01 0.00 0.00 72.50 69.48 1d6r s THR 134 CO 0.00 0.00 0.70 -1.10 -0.69 0.00 0.00 174.62 173.53 1d6r s GLN 135 N -1.68 4.25 0.27 4.92 -1.52 -1.26 -1.44 119.66 123.20 1d6r s GLN 135 Ca 0.56 0.76 0.08 0.00 -1.95 0.00 0.00 55.36 54.80 1d6r s GLN 135 Cb -0.47 -3.57 -0.05 0.00 -0.22 0.00 0.00 33.01 28.70 1d6r s GLN 135 CO 0.60 -0.24 -0.10 0.00 -0.25 0.00 0.00 175.29 175.29 1d6r s LEU 137 N -3.43 2.88 -0.07 0.00 2.96 0.95 -0.83 118.68 121.13 1d6r s LEU 137 Ca 0.28 -0.32 0.04 0.00 -0.22 0.00 0.00 54.13 53.91 1d6r s LEU 137 Cb 0.01 -1.69 -0.01 0.00 0.50 0.00 0.00 46.19 45.00 1d6r s LEU 137 CO 0.11 0.09 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.40 1d6r s ILE 138 N 0.79 2.46 0.01 6.68 1.01 -0.55 0.36 121.20 131.96 1d6r s ILE 138 Ca -0.03 -0.92 -0.03 0.00 0.00 0.00 0.00 60.65 59.67 1d6r s ILE 138 Cb -0.15 -1.94 -0.01 0.00 0.01 0.00 0.00 42.46 40.37 1d6r s ILE 138 CO 0.01 0.57 0.05 -0.94 0.00 0.00 0.00 174.94 174.63 1d6r s SER 139 N -0.17 0.14 -0.01 3.58 1.04 -1.24 -1.00 113.70 116.03 1d6r s SER 139 Ca -0.02 -0.36 -0.30 0.00 0.48 0.00 0.00 55.95 55.75 1d6r s SER 139 Cb -0.14 0.15 0.12 0.00 0.10 0.00 0.00 66.02 66.25 1d6r s SER 139 CO 0.04 -0.33 1.29 -0.83 0.98 0.00 0.00 173.24 174.39 1d6r s GLY 140 N -1.40 -0.40 -0.29 7.32 0.00 -0.73 -4.45 107.32 107.37 1d6r s GLY 140 Ca -0.15 0.65 0.12 0.00 0.00 0.00 0.00 44.72 45.34 1d6r s GLY 140 CO 0.00 0.43 1.78 0.79 0.00 0.00 0.00 173.10 176.10 1d6r n TRP 141 N -0.51 2.28 -1.17 1.90 8.01 -1.26 -2.44 117.44 124.24 1d6r n TRP 141 Ca -0.08 -1.00 -0.29 0.00 -1.31 0.00 0.00 57.50 54.82 1d6r n TRP 141 Cb 0.63 -0.61 0.20 0.00 -2.01 0.00 0.00 31.31 29.51 1d6r n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1d6r s GLY 142 N -0.96 1.57 0.44 6.99 0.00 -1.24 -4.38 107.32 109.75 1d6r s GLY 142 Ca 0.55 -0.60 -0.23 0.00 0.00 0.00 0.00 44.72 44.44 1d6r s GLY 142 CO 0.14 0.11 0.82 -2.01 0.00 0.00 0.00 173.10 172.17 1d6r n ASN 143 N -4.37 0.37 -0.66 1.64 4.05 0.89 -3.39 115.26 113.79 1d6r n ASN 143 Ca 0.08 0.96 0.09 0.00 0.45 0.00 0.00 54.58 56.16 1d6r n ASN 143 Cb 0.58 -1.26 0.05 0.00 1.23 0.00 0.00 39.78 40.38 1d6r n ASN 143 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 177.26 174.62 1d6r n THR 144 N -0.78 0.00 -5.18 -0.44 -1.04 -0.09 -1.21 114.28 105.54 1d6r n THR 144 Ca 0.11 -0.44 -0.30 0.00 -2.04 0.00 0.00 64.05 61.38 1d6r n THR 144 Cb 0.40 1.34 -0.16 0.00 -1.82 0.00 0.00 70.33 70.09 1d6r n THR 144 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1d6r s LYS 145 N -1.76 2.26 0.12 -2.82 1.02 -1.26 -4.44 119.74 112.86 1d6r s LYS 145 Ca 0.20 -0.84 -0.04 0.00 0.02 0.00 0.00 55.97 55.31 1d6r s LYS 145 Cb 0.16 -1.98 -0.11 0.00 -0.52 0.00 0.00 37.83 35.37 1d6r s LYS 145 CO 0.31 0.40 1.29 0.66 -0.92 0.00 0.00 175.35 177.08 1d6r h SER 146 N 5.95 0.50 -3.27 2.83 4.64 -1.94 -3.41 113.55 118.85 1d6r h SER 146 Ca -0.35 -0.42 -0.56 0.00 -0.47 0.00 0.00 61.79 60.00 1d6r h SER 146 Cb 1.16 -0.15 -0.37 0.00 -0.31 0.00 0.00 62.40 62.72 1d6r h SER 146 CO 0.47 1.23 -0.80 -0.94 -0.87 0.00 0.00 176.83 175.92 1d6r s SER 147 N -7.08 2.68 0.00 4.97 1.04 -1.26 -4.41 113.70 109.64 1d6r s SER 147 Ca -0.05 -0.57 0.00 0.00 0.48 0.00 0.00 55.95 55.81 1d6r s SER 147 Cb 0.09 -0.94 0.00 0.00 0.10 0.00 0.00 66.02 65.26 1d6r s SER 147 CO 0.87 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 175.55 1d6r n GLY 148 N 4.87 0.12 3.19 7.32 0.00 -1.26 -5.03 105.19 114.41 1d6r n GLY 148 Ca -0.13 -2.26 -0.10 0.00 0.00 0.00 0.00 46.02 43.53 1d6r n GLY 148 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1d6r s THR 149 N 0.00 -0.53 -0.30 2.61 -1.32 -1.26 -4.79 115.64 110.05 1d6r s THR 149 Ca 0.00 0.19 -0.02 0.00 -1.21 0.00 0.00 61.69 60.65 1d6r s THR 149 Cb 0.00 -0.60 0.18 0.00 -1.51 0.00 0.00 72.50 70.57 1d6r s THR 149 CO 0.00 0.08 0.60 -0.55 -2.21 0.00 0.00 174.62 172.54 1d6r s SER 150 N 2.45 -1.33 -0.13 8.08 0.15 -1.26 -5.00 113.70 116.66 1d6r s SER 150 Ca -0.02 0.97 -0.13 0.00 0.70 0.00 0.00 55.95 57.47 1d6r s SER 150 Cb -0.12 2.17 -0.05 0.00 -1.71 0.00 0.00 66.02 66.32 1d6r s SER 150 CO -0.12 -0.26 0.30 -0.31 1.20 0.00 0.00 173.24 174.06 1d6r s TYR 151 N 2.86 3.51 0.61 3.44 2.02 -1.26 -0.91 117.35 127.61 1d6r s TYR 151 Ca 0.17 0.65 -0.11 0.00 -0.37 0.00 0.00 57.07 57.41 1d6r s TYR 151 Cb -0.15 -2.30 -0.04 0.00 -0.40 0.00 0.00 41.96 39.07 1d6r s TYR 151 CO -0.21 0.34 1.01 -1.25 -1.57 0.00 0.00 175.55 173.87 1d6r s PRO 152 N 0.13 3.60 -0.02 -1.71 0.04 -1.26 -4.98 135.00 130.80 1d6r s PRO 152 Ca 0.17 0.71 0.17 0.00 0.04 0.00 0.00 61.00 62.09 1d6r s PRO 152 Cb -0.13 -2.10 -0.24 0.00 0.04 0.00 0.00 34.50 32.07 1d6r s PRO 152 CO 0.05 -0.53 0.46 -0.25 0.04 0.00 0.00 177.00 176.77 1d6r n ASP 153 N -2.69 1.05 -4.75 6.66 10.43 -1.26 -4.93 116.55 121.06 1d6r n ASP 153 Ca 0.06 -0.26 -0.24 0.00 2.57 0.00 0.00 54.79 56.91 1d6r n ASP 153 Cb 0.54 1.54 -0.06 0.00 1.84 0.00 0.00 41.12 44.98 1d6r n ASP 153 CO 0.00 0.00 0.00 0.68 -1.07 0.00 0.00 177.20 176.81 1d6r s VAL 154 N -2.98 4.10 0.13 2.53 -7.23 -1.26 -1.50 120.40 114.21 1d6r s VAL 154 Ca -0.02 -1.45 -0.31 0.00 -1.81 0.00 0.00 61.98 58.38 1d6r s VAL 154 Cb 0.11 -3.16 -0.08 0.00 0.56 0.00 0.00 36.38 33.81 1d6r s VAL 154 CO 0.69 -0.26 1.42 -0.22 -0.31 0.00 0.00 175.10 176.42 1d6r s LEU 155 N -3.48 4.37 -0.05 1.32 2.96 -1.23 -4.82 118.68 117.77 1d6r s LEU 155 Ca 0.31 2.40 -0.00 0.00 -0.22 0.00 0.00 54.13 56.62 1d6r s LEU 155 Cb -0.08 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 42.98 1d6r s LEU 155 CO 0.22 -0.68 -0.00 -0.54 -1.32 0.00 0.00 176.35 174.03 1d6r s LYS 156 N 0.99 2.88 0.24 1.98 -0.14 -1.02 -1.26 119.74 123.40 1d6r s LYS 156 Ca 0.65 -0.51 0.11 0.00 -1.36 0.00 0.00 55.97 54.86 1d6r s LYS 156 Cb -0.38 -2.72 -0.05 0.00 -1.68 0.00 0.00 37.83 33.00 1d6r s LYS 156 CO 0.31 0.66 -0.17 0.00 -0.76 0.00 0.00 175.35 175.39 1d6r s LEU 158 N -3.22 0.79 -0.22 0.00 0.20 -0.17 -0.28 118.68 115.78 1d6r s LEU 158 Ca 0.27 0.53 -0.09 0.00 0.69 0.00 0.00 54.13 55.53 1d6r s LEU 158 Cb -0.06 0.85 -0.04 0.00 -0.43 0.00 0.00 46.19 46.50 1d6r s LEU 158 CO 0.14 -0.12 0.11 -0.54 -0.29 0.00 0.00 176.35 175.66 1d6r s LYS 159 N 0.53 3.97 0.01 1.98 1.02 -1.26 -1.49 119.74 124.50 1d6r s LYS 159 Ca -0.03 -0.33 -0.20 0.00 0.02 0.00 0.00 55.97 55.43 1d6r s LYS 159 Cb -0.05 -3.39 0.04 0.00 -0.52 0.00 0.00 37.83 33.91 1d6r s LYS 159 CO -0.03 0.10 0.44 0.00 -0.92 0.00 0.00 175.35 174.93 1d6r s ALA 160 N 0.91 -1.10 0.25 5.17 0.00 -0.01 -4.94 121.76 122.03 1d6r s ALA 160 Ca 0.06 0.51 0.03 0.00 0.00 0.00 0.00 51.96 52.56 1d6r s ALA 160 Cb -0.13 0.21 -0.03 0.00 0.00 0.00 0.00 23.12 23.16 1d6r s ALA 160 CO 0.03 -0.39 0.40 -1.25 0.00 0.00 0.00 175.76 174.55 1d6r s PRO 161 N -1.91 3.46 -0.21 0.00 0.04 -1.26 -0.55 135.00 134.57 1d6r s PRO 161 Ca -0.09 -0.61 -0.29 0.00 0.04 0.00 0.00 61.00 60.05 1d6r s PRO 161 Cb -0.02 -2.84 0.00 0.00 0.04 0.00 0.00 34.50 31.68 1d6r s PRO 161 CO 0.02 0.38 1.07 0.42 0.04 0.00 0.00 177.00 178.93 1d6r s ILE 162 N -2.02 4.62 0.44 0.56 1.01 -0.52 -0.18 121.20 125.11 1d6r s ILE 162 Ca 0.36 1.95 -0.18 0.00 0.00 0.00 0.00 60.65 62.78 1d6r s ILE 162 Cb -0.10 -4.26 -0.10 0.00 0.01 0.00 0.00 42.46 38.02 1d6r s ILE 162 CO 0.30 -0.16 0.92 -0.76 0.00 0.00 0.00 174.94 175.24 1d6r s LEU 163 N 3.17 3.86 0.64 2.97 1.43 -0.17 0.14 118.68 130.72 1d6r s LEU 163 Ca 0.46 1.57 -0.17 0.00 -1.03 0.00 0.00 54.13 54.96 1d6r s LEU 163 Cb -0.16 -4.44 -0.01 0.00 0.03 0.00 0.00 46.19 41.61 1d6r s LEU 163 CO 0.08 -0.40 1.15 -0.94 0.23 0.00 0.00 176.35 176.47 1d6r s SER 164 N -2.49 5.06 0.21 2.29 1.04 -1.26 -4.56 113.70 113.99 1d6r s SER 164 Ca 0.59 2.19 -0.09 0.00 0.48 0.00 0.00 55.95 59.12 1d6r s SER 164 Cb -0.09 -2.57 0.26 0.00 0.10 0.00 0.00 66.02 63.71 1d6r s SER 164 CO 0.20 -1.67 1.79 0.44 0.98 0.00 0.00 173.24 174.98 1d6r h ASP 165 N 0.38 0.49 -1.00 7.02 5.19 -1.96 0.27 116.42 126.81 1d6r h ASP 165 Ca -0.48 0.04 0.03 0.00 -0.62 0.00 0.00 57.03 56.00 1d6r h ASP 165 Cb 1.27 -0.05 -0.06 0.00 0.18 0.00 0.00 39.33 40.67 1d6r h ASP 165 CO 0.54 0.31 0.66 -1.28 -3.12 0.00 0.00 179.24 176.35 1d6r h SER 166 N 0.63 1.10 -0.32 6.45 0.87 -1.98 0.48 113.55 120.78 1d6r h SER 166 Ca 0.31 -0.01 -0.06 0.00 -1.23 0.00 0.00 61.79 60.80 1d6r h SER 166 Cb 0.25 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.94 1d6r h SER 166 CO -0.21 0.76 -0.02 0.28 -0.53 0.00 0.00 176.83 177.11 1d6r h SER 167 N 1.28 0.58 -0.03 6.23 0.02 -1.51 -1.04 113.55 119.07 1d6r h SER 167 Ca 0.39 -0.33 0.03 0.00 -0.84 0.00 0.00 61.79 61.05 1d6r h SER 167 Cb -0.03 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.31 1d6r h SER 167 CO -0.11 0.77 -0.22 0.00 -1.14 0.00 0.00 176.83 176.12 1d6r h LYS 169 N -0.33 0.00 -0.26 0.00 1.57 -0.04 -2.24 116.57 115.27 1d6r h LYS 169 Ca 0.07 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.73 1d6r h LYS 169 Cb 0.43 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 1d6r h LYS 169 CO -0.22 0.18 -0.33 0.66 -0.57 0.00 0.00 179.45 179.17 1d6r h SER 170 N 0.00 0.57 -0.23 0.86 4.64 -0.70 -2.54 113.55 116.15 1d6r h SER 170 Ca -0.00 -0.23 -0.02 0.00 -0.47 0.00 0.00 61.79 61.07 1d6r h SER 170 Cb 0.35 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1d6r h SER 170 CO 0.02 0.87 0.07 0.00 -0.87 0.00 0.00 176.83 176.91 1d6r h ALA 171 N 1.17 0.31 -2.37 5.18 0.00 -0.93 -3.37 119.26 119.25 1d6r h ALA 171 Ca 0.05 -0.15 -0.59 0.00 0.00 0.00 0.00 54.91 54.22 1d6r h ALA 171 Cb 0.80 -0.09 -0.40 0.00 0.00 0.00 0.00 17.79 18.10 1d6r h ALA 171 CO 0.07 -0.06 -0.80 0.66 0.00 0.00 0.00 179.25 179.12 1d6r n TYR 172 N -4.75 1.58 -1.72 0.00 4.02 -0.89 -4.93 117.16 110.46 1d6r n TYR 172 Ca -0.03 -3.86 -0.42 0.00 -0.01 0.00 0.00 57.90 53.57 1d6r n TYR 172 Cb 0.16 -0.36 -0.03 0.00 -0.02 0.00 0.00 39.34 39.10 1d6r n TYR 172 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 176.86 173.71 1d6r s PRO 173 N -1.42 4.12 0.00 -0.72 0.02 -0.96 -1.60 135.00 134.44 1d6r s PRO 173 Ca 0.34 2.62 0.00 0.00 0.02 0.00 0.00 61.00 63.98 1d6r s PRO 173 Cb 0.09 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.55 1d6r s PRO 173 CO -0.11 -0.75 0.00 0.41 -0.33 0.00 0.00 177.00 176.22 1d6r n GLY 174 N 3.84 1.43 0.05 0.52 0.00 -1.26 -4.89 105.19 104.89 1d6r n GLY 174 Ca 0.15 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.19 1d6r n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1d6r n GLN 175 N -2.00 3.86 -3.46 1.61 6.02 -0.63 -5.00 117.38 117.78 1d6r n GLN 175 Ca 0.00 -0.23 -0.37 0.00 -0.01 0.00 0.00 57.00 56.38 1d6r n GLN 175 Cb 0.00 -0.80 -0.06 0.00 1.02 0.00 0.00 30.24 30.40 1d6r n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1d6r s ILE 176 N -1.02 5.20 0.56 5.09 -1.09 -1.24 -5.05 121.20 123.65 1d6r s ILE 176 Ca 0.02 0.76 0.07 0.00 -2.23 0.00 0.00 60.65 59.27 1d6r s ILE 176 Cb 0.03 -3.71 0.06 0.00 -1.58 0.00 0.00 42.46 37.26 1d6r s ILE 176 CO 0.11 0.42 0.58 0.42 -1.23 0.00 0.00 174.94 175.25 1d6r s THR 177 N 0.07 1.84 -1.24 2.92 -4.23 -1.26 -4.98 115.64 108.77 1d6r s THR 177 Ca 0.22 -1.28 0.15 0.00 -1.18 0.00 0.00 61.69 59.60 1d6r s THR 177 Cb -0.15 -2.12 0.21 0.00 1.34 0.00 0.00 72.50 71.78 1d6r s THR 177 CO 0.09 0.00 1.46 -1.54 -0.54 0.00 0.00 174.62 174.08 1d6r n SER 178 N -1.98 0.00 -1.26 3.99 3.41 -1.26 -2.38 113.62 114.14 1d6r n SER 178 Ca 0.06 0.26 0.02 0.00 -0.26 0.00 0.00 58.87 58.95 1d6r n SER 178 Cb 0.63 -0.38 0.26 0.00 -0.26 0.00 0.00 64.21 64.46 1d6r n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1d6r n ASN 179 N -1.38 3.84 -4.11 4.04 3.02 -1.26 -4.90 115.26 114.50 1d6r n ASN 179 Ca 0.06 -3.25 -0.12 0.00 -0.03 0.00 0.00 54.58 51.24 1d6r n ASN 179 Cb 0.15 -0.62 -0.11 0.00 -0.61 0.00 0.00 39.78 38.59 1d6r n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1d6r s MET 180 N -2.97 0.65 0.05 3.52 -1.94 -1.00 -0.77 119.30 116.84 1d6r s MET 180 Ca 0.46 -1.00 -0.13 0.00 -1.71 0.00 0.00 55.69 53.31 1d6r s MET 180 Cb 0.38 -0.24 0.02 0.00 2.01 0.00 0.00 34.83 37.00 1d6r s MET 180 CO 0.08 0.02 0.28 -0.59 -0.01 0.00 0.00 175.02 174.79 1d6r s PHE 181 N -2.37 -0.06 -0.02 -0.03 -0.12 -0.96 -4.73 117.98 109.70 1d6r s PHE 181 Ca -0.01 -0.12 -0.02 0.00 -0.05 0.00 0.00 56.93 56.74 1d6r s PHE 181 Cb -0.03 0.06 -0.04 0.00 -0.63 0.00 0.00 43.02 42.38 1d6r s PHE 181 CO -0.02 -0.49 0.13 0.00 -0.05 0.00 0.00 175.22 174.78 1d6r s ALA 183 N -1.23 0.27 0.00 0.00 0.00 -0.86 -1.00 121.76 118.94 1d6r s ALA 183 Ca 0.24 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.56 1d6r s ALA 183 Cb -0.12 0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.11 1d6r s ALA 183 CO 0.15 -0.11 0.00 0.41 0.00 0.00 0.00 175.76 176.21 1d6r n GLY 184 N 1.58 0.42 2.86 0.00 0.00 0.75 -2.90 105.19 107.90 1d6r n GLY 184 Ca -0.23 -1.91 -0.23 0.00 0.00 0.00 0.00 46.02 43.65 1d6r n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1d6r s TYR 184 N -1.32 0.93 0.40 1.61 1.51 -1.26 -4.37 117.35 114.85 1d6r s TYR 184 Ca 0.00 -0.33 0.18 0.00 -1.01 0.00 0.00 57.07 55.91 1d6r s TYR 184 Cb 0.00 -0.86 1.05 0.00 -0.11 0.00 0.00 41.96 42.04 1d6r s TYR 184 CO 0.00 -0.31 1.96 -0.07 -1.11 0.00 0.00 175.55 176.02 1d6r h LEU 185 N 7.78 0.00 -0.54 -1.29 3.38 -1.97 -1.14 115.31 121.54 1d6r h LEU 185 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1d6r h LEU 185 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1d6r h LEU 185 CO 0.38 0.22 0.00 -0.62 0.09 0.00 0.00 178.44 178.51 1d6r n GLU 186 N -4.01 0.21 0.00 1.13 4.71 -1.26 0.56 120.64 121.99 1d6r n GLU 186 Ca -0.02 0.37 0.00 0.00 -0.01 0.00 0.00 57.16 57.50 1d6r n GLU 186 Cb 0.30 -1.86 0.00 0.00 -1.01 0.00 0.00 31.44 28.87 1d6r n GLU 186 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1d6r n GLY 187 N 0.32 -1.89 1.64 0.62 0.00 -0.43 -4.45 105.19 101.00 1d6r n GLY 187 Ca 0.03 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.57 1d6r n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d6r n GLY 188 N 0.00 2.90 2.86 -0.02 0.00 -0.70 -4.87 105.19 105.36 1d6r n GLY 188 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 1d6r n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d6r s LYS 188 N -0.12 0.71 0.06 1.61 1.02 -1.26 -3.88 119.74 117.89 1d6r s LYS 188 Ca 0.00 -0.05 -0.27 0.00 0.02 0.00 0.00 55.97 55.67 1d6r s LYS 188 Cb 0.00 -0.80 0.09 0.00 -0.52 0.00 0.00 37.83 36.61 1d6r s LYS 188 CO 0.00 -0.12 1.16 0.34 -0.92 0.00 0.00 175.35 175.81 1d6r s ASP 189 N 1.06 -0.07 0.64 2.83 3.68 0.19 -4.44 116.67 120.56 1d6r s ASP 189 Ca -0.09 -0.30 -0.08 0.00 2.13 0.00 0.00 52.55 54.20 1d6r s ASP 189 Cb -0.14 0.30 0.01 0.00 -1.45 0.00 0.00 42.92 41.65 1d6r s ASP 189 CO -0.01 -0.58 0.98 -0.94 0.13 0.00 0.00 175.17 174.76 1d6r s SER 190 N -3.14 5.52 0.25 -0.34 1.04 -1.26 -0.17 113.70 115.60 1d6r s SER 190 Ca 0.17 0.88 -0.05 0.00 0.48 0.00 0.00 55.95 57.43 1d6r s SER 190 Cb 0.01 -1.79 0.02 0.00 0.10 0.00 0.00 66.02 64.37 1d6r s SER 190 CO -0.00 -1.19 0.41 0.00 0.98 0.00 0.00 173.24 173.44 1d6r n GLN 192 N -0.39 1.70 0.00 0.00 3.00 -1.26 -0.77 117.38 119.66 1d6r n GLN 192 Ca -0.02 0.61 0.00 0.00 -0.01 0.00 0.00 57.00 57.58 1d6r n GLN 192 Cb 0.41 -2.33 0.00 0.00 0.00 0.00 0.00 30.24 28.31 1d6r n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1d6r n GLY 193 N 3.20 1.44 0.04 1.08 0.00 -1.26 -0.08 105.19 109.61 1d6r n GLY 193 Ca 0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.32 1d6r n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1d6r n ASP 194 N 0.00 0.64 -4.53 1.61 10.43 0.05 -3.71 116.55 121.03 1d6r n ASP 194 Ca 0.00 -0.11 -0.43 0.00 2.57 0.00 0.00 54.79 56.82 1d6r n ASP 194 Cb 0.00 0.50 0.00 0.00 1.84 0.00 0.00 41.12 43.46 1d6r n ASP 194 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 1d6r n SER 195 N -1.95 0.33 0.00 -2.24 7.64 -1.26 -2.32 113.62 113.82 1d6r n SER 195 Ca 0.03 1.03 0.00 0.00 1.01 0.00 0.00 58.87 60.94 1d6r n SER 195 Cb 0.42 -1.22 0.00 0.00 -1.01 0.00 0.00 64.21 62.40 1d6r n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1d6r n GLY 196 N 1.46 3.14 3.71 0.23 0.00 -0.28 0.25 105.19 113.70 1d6r n GLY 196 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1d6r n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1d6r s GLY 197 N -1.98 1.57 0.38 -0.02 0.00 -0.98 -3.15 107.32 103.14 1d6r s GLY 197 Ca 0.00 -0.52 -0.17 0.00 0.00 0.00 0.00 44.72 44.03 1d6r s GLY 197 CO 0.00 0.11 0.84 2.56 0.00 0.00 0.00 173.10 176.62 1d6r s PRO 198 N -5.15 4.09 -0.31 2.90 0.04 -1.26 -1.31 135.00 133.99 1d6r s PRO 198 Ca 0.66 0.87 0.02 0.00 0.04 0.00 0.00 61.00 62.59 1d6r s PRO 198 Cb -0.16 -2.30 0.09 0.00 0.04 0.00 0.00 34.50 32.17 1d6r s PRO 198 CO 0.56 0.04 0.03 0.08 0.04 0.00 0.00 177.00 177.75 1d6r s VAL 199 N -2.13 1.77 -0.17 -0.36 1.01 -0.69 -3.68 120.40 116.15 1d6r s VAL 199 Ca 0.58 -1.85 -0.04 0.00 0.00 0.00 0.00 61.98 60.67 1d6r s VAL 199 Cb -0.10 -2.24 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 1d6r s VAL 199 CO 0.17 -0.49 -0.03 -0.69 0.00 0.00 0.00 175.10 174.06 1d6r s VAL 200 N 1.19 3.90 -0.05 2.92 1.01 0.16 -0.94 120.40 128.59 1d6r s VAL 200 Ca 0.06 -0.35 0.00 0.00 0.00 0.00 0.00 61.98 61.70 1d6r s VAL 200 Cb -0.19 -2.73 0.02 0.00 0.00 0.00 0.00 36.38 33.49 1d6r s VAL 200 CO -0.12 0.47 -0.03 0.00 0.00 0.00 0.00 175.10 175.42 1d6r n SER 202 N 4.30 -1.52 -1.67 0.00 7.64 -1.26 -1.76 113.62 119.35 1d6r n SER 202 Ca -0.21 -0.84 -0.19 0.00 1.01 0.00 0.00 58.87 58.64 1d6r n SER 202 Cb 0.51 -3.90 -0.06 0.00 -1.01 0.00 0.00 64.21 59.75 1d6r n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1d6r n GLY 203 N -1.64 1.11 3.17 0.23 0.00 -1.26 -4.99 105.19 101.81 1d6r n GLY 203 Ca -0.26 -0.11 -0.19 0.00 0.00 0.00 0.00 46.02 45.46 1d6r n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d6r s LYS 204 N -4.03 0.89 -0.52 1.61 -0.14 -0.72 -4.29 119.74 112.53 1d6r s LYS 204 Ca 0.00 -0.92 -0.28 0.00 -1.36 0.00 0.00 55.97 53.41 1d6r s LYS 204 Cb 0.00 -0.92 0.02 0.00 -1.68 0.00 0.00 37.83 35.25 1d6r s LYS 204 CO 0.00 0.21 1.29 -1.17 -0.76 0.00 0.00 175.35 174.92 1d6r s LEU 209 N -1.58 3.49 -0.15 3.17 2.96 -0.45 -0.79 118.68 125.34 1d6r s LEU 209 Ca -0.00 0.36 0.15 0.00 -0.22 0.00 0.00 54.13 54.42 1d6r s LEU 209 Cb -0.09 -3.28 -0.21 0.00 0.50 0.00 0.00 46.19 43.11 1d6r s LEU 209 CO 0.02 -1.50 0.09 0.00 -1.32 0.00 0.00 176.35 173.64 1d6r n GLN 210 N 8.33 1.26 -4.29 1.98 1.13 -0.12 -3.91 117.38 121.77 1d6r n GLN 210 Ca 0.12 -0.02 -0.16 0.00 -1.94 0.00 0.00 57.00 54.99 1d6r n GLN 210 Cb 0.49 -1.42 -0.10 0.00 0.11 0.00 0.00 30.24 29.32 1d6r n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1d6r s GLY 211 N -4.91 1.82 -0.05 1.08 0.00 -0.89 -1.66 107.32 102.70 1d6r s GLY 211 Ca -0.08 -1.79 -0.00 0.00 0.00 0.00 0.00 44.72 42.85 1d6r s GLY 211 CO 0.67 -1.54 -0.01 -0.42 0.00 0.00 0.00 173.10 171.80 1d6r s ILE 212 N -3.78 0.39 -0.07 0.90 1.01 -1.18 -1.71 121.20 116.76 1d6r s ILE 212 Ca 0.37 0.04 -0.35 0.00 0.00 0.00 0.00 60.65 60.71 1d6r s ILE 212 Cb 0.06 -0.49 -0.13 0.00 0.01 0.00 0.00 42.46 41.91 1d6r s ILE 212 CO 0.15 0.23 1.79 0.52 0.00 0.00 0.00 174.94 177.63 1d6r n VAL 213 N 4.60 0.43 0.00 2.92 0.31 -0.43 -1.72 118.33 124.44 1d6r n VAL 213 Ca -0.16 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 1d6r n VAL 213 Cb 0.50 -1.68 0.00 0.00 -0.91 0.00 0.00 33.84 31.76 1d6r n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1d6r n SER 214 N 5.79 0.00 -3.27 4.52 2.88 -1.07 -1.13 113.62 121.34 1d6r n SER 214 Ca 0.22 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.60 1d6r n SER 214 Cb 0.26 -0.01 -0.05 0.00 -0.75 0.00 0.00 64.21 63.66 1d6r n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1d6r s TRP 215 N -0.24 1.24 -0.10 0.66 1.48 -0.83 -4.92 118.94 116.24 1d6r s TRP 215 Ca 0.00 -1.39 -0.31 0.00 -1.06 0.00 0.00 56.10 53.33 1d6r s TRP 215 Cb 0.00 -0.24 0.11 0.00 -1.16 0.00 0.00 33.47 32.18 1d6r s TRP 215 CO 0.00 -1.07 1.39 0.20 -4.06 0.00 0.00 176.95 173.41 1d6r s GLY 216 N -3.27 -0.28 -0.40 3.67 0.00 -1.26 -1.76 107.32 104.02 1d6r s GLY 216 Ca 0.33 0.32 -0.08 0.00 0.00 0.00 0.00 44.72 45.29 1d6r s GLY 216 CO 0.22 5.71 0.22 -0.45 0.00 0.00 0.00 173.10 178.80 1d6r s SER 217 N -3.79 5.55 0.94 1.64 0.15 -1.26 -5.00 113.70 111.92 1d6r s SER 217 Ca 0.29 -1.42 0.00 0.00 0.70 0.00 0.00 55.95 55.52 1d6r s SER 217 Cb 0.02 -1.95 0.00 0.00 -1.71 0.00 0.00 66.02 62.37 1d6r s SER 217 CO -0.04 -0.48 0.00 0.61 1.20 0.00 0.00 173.24 174.53 1d6r n GLY 219 N 4.88 0.97 2.93 9.45 0.00 -1.26 -4.56 105.19 117.59 1d6r n GLY 219 Ca -0.10 -0.73 -0.18 0.00 0.00 0.00 0.00 46.02 45.01 1d6r n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d6r n ALA 221 N 3.46 -0.55 -1.88 0.00 0.00 -1.26 -4.48 120.51 115.81 1d6r n ALA 221 Ca -0.19 0.21 -0.33 0.00 0.00 0.00 0.00 53.44 53.13 1d6r n ALA 221 Cb 0.54 -2.15 -0.06 0.00 0.00 0.00 0.00 19.45 17.78 1d6r n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1d6r s GLN 221 N -4.73 4.11 0.09 0.00 -1.52 -1.26 -1.73 119.66 114.63 1d6r s GLN 221 Ca 0.00 1.00 -0.31 0.00 -1.95 0.00 0.00 55.36 54.10 1d6r s GLN 221 Cb 0.00 -2.20 -0.09 0.00 -0.22 0.00 0.00 33.01 30.49 1d6r s GLN 221 CO 0.00 -0.08 1.77 0.21 -0.25 0.00 0.00 175.29 176.94 1d6r s LYS 222 N -3.43 4.16 -1.20 2.91 2.47 -1.26 -1.36 119.74 122.02 1d6r s LYS 222 Ca 0.60 2.48 0.00 0.00 -1.56 0.00 0.00 55.97 57.49 1d6r s LYS 222 Cb -0.09 -3.65 0.00 0.00 -1.46 0.00 0.00 37.83 32.63 1d6r s LYS 222 CO 0.19 -0.81 0.00 0.09 0.16 0.00 0.00 175.35 174.98 1d6r n ASN 223 N 5.83 -4.32 -3.21 1.43 3.02 0.19 -4.93 115.26 113.28 1d6r n ASN 223 Ca 0.17 0.25 -0.23 0.00 -0.03 0.00 0.00 54.58 54.74 1d6r n ASN 223 Cb 0.39 -2.93 -0.06 0.00 -0.61 0.00 0.00 39.78 36.57 1d6r n ASN 223 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1d6r n LYS 224 N -2.59 1.19 -1.00 3.52 4.76 -0.47 -4.72 118.16 118.85 1d6r n LYS 224 Ca -0.12 -3.57 -0.30 0.00 -2.87 0.00 0.00 58.31 51.46 1d6r n LYS 224 Cb 0.41 -1.55 0.24 0.00 -1.84 0.00 0.00 35.03 32.29 1d6r n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1d6r s PRO 225 N -1.82 -1.26 0.32 1.97 0.04 -1.26 -4.03 135.00 128.96 1d6r s PRO 225 Ca 0.38 0.03 -0.16 0.00 0.04 0.00 0.00 61.00 61.28 1d6r s PRO 225 Cb 0.22 -1.58 -0.09 0.00 0.04 0.00 0.00 34.50 33.09 1d6r s PRO 225 CO -0.09 -3.76 0.76 0.20 0.04 0.00 0.00 177.00 174.15 1d6r s GLY 226 N -3.74 2.38 -0.16 0.56 0.00 -1.14 -4.64 107.32 100.59 1d6r s GLY 226 Ca 0.70 0.11 -0.04 0.00 0.00 0.00 0.00 44.72 45.48 1d6r s GLY 226 CO 0.57 0.34 -0.02 0.14 0.00 0.00 0.00 173.10 174.13 1d6r s VAL 227 N -1.94 4.01 0.16 1.40 1.01 -0.72 -2.03 120.40 122.28 1d6r s VAL 227 Ca 0.54 -0.31 0.09 0.00 0.00 0.00 0.00 61.98 62.29 1d6r s VAL 227 Cb -0.11 -2.77 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 1d6r s VAL 227 CO 0.17 0.48 -0.20 -0.31 0.00 0.00 0.00 175.10 175.25 1d6r s TYR 228 N 0.41 1.94 -0.02 5.22 2.02 -0.04 -1.97 117.35 124.91 1d6r s TYR 228 Ca -0.03 -0.43 -0.30 0.00 -0.37 0.00 0.00 57.07 55.94 1d6r s TYR 228 Cb -0.14 -0.98 -0.03 0.00 -0.40 0.00 0.00 41.96 40.41 1d6r s TYR 228 CO 0.03 0.35 1.06 0.99 -1.57 0.00 0.00 175.55 176.41 1d6r s THR 229 N -1.80 4.59 -0.99 -0.71 2.01 -0.70 -2.26 115.64 115.79 1d6r s THR 229 Ca 0.15 1.86 -0.23 0.00 0.31 0.00 0.00 61.69 63.79 1d6r s THR 229 Cb -0.07 -4.20 0.06 0.00 0.01 0.00 0.00 72.50 68.30 1d6r s THR 229 CO 0.07 0.09 1.39 -0.75 -0.69 0.00 0.00 174.62 174.74 1d6r s LYS 230 N 1.40 3.56 0.28 4.92 2.20 0.05 -3.08 119.74 129.08 1d6r s LYS 230 Ca 0.53 -1.16 -0.00 0.00 -0.36 0.00 0.00 55.97 54.98 1d6r s LYS 230 Cb -0.23 -5.22 0.49 0.00 -1.51 0.00 0.00 37.83 31.36 1d6r s LYS 230 CO 0.25 -2.14 1.87 0.28 -0.36 0.00 0.00 175.35 175.25 1d6r h VAL 231 N 6.62 1.03 -0.36 4.02 2.07 -1.63 -1.99 116.25 126.00 1d6r h VAL 231 Ca 0.16 -0.37 0.10 0.00 0.82 0.00 0.00 66.70 67.42 1d6r h VAL 231 Cb 1.01 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 1d6r h VAL 231 CO 1.38 0.20 0.37 0.00 0.02 0.00 0.00 177.57 179.54 1d6r n ASN 233 N -3.81 0.00 0.00 0.00 5.03 -0.75 -3.96 115.26 111.77 1d6r n ASN 233 Ca 0.06 -0.92 0.00 0.00 0.87 0.00 0.00 54.58 54.59 1d6r n ASN 233 Cb 0.54 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.30 1d6r n ASN 233 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1d6r n TYR 234 N -1.00 0.00 -0.28 3.10 4.01 0.45 -4.81 117.16 118.64 1d6r n TYR 234 Ca 0.22 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 58.04 1d6r n TYR 234 Cb 0.10 0.00 0.20 0.00 -0.31 0.00 0.00 39.34 39.34 1d6r n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1d6r h VAL 235 N 0.04 0.32 -0.05 -0.72 2.07 -1.68 0.60 116.25 116.82 1d6r h VAL 235 Ca 0.00 -0.05 -0.00 0.00 0.82 0.00 0.00 66.70 67.47 1d6r h VAL 235 Cb 0.02 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 29.96 1d6r h VAL 235 CO 0.00 0.02 0.02 0.77 0.02 0.00 0.00 177.57 178.40 1d6r h SER 236 N 0.14 0.07 -0.88 0.57 4.64 -1.89 -0.66 113.55 115.53 1d6r h SER 236 Ca 0.47 -0.17 0.06 0.00 -0.47 0.00 0.00 61.79 61.67 1d6r h SER 236 Cb 0.87 -0.02 -0.05 0.00 -0.31 0.00 0.00 62.40 62.88 1d6r h SER 236 CO -0.68 0.22 0.57 -0.25 -0.87 0.00 0.00 176.83 175.83 1d6r h TRP 237 N -0.09 1.02 0.62 4.77 7.01 -1.73 0.13 115.95 127.69 1d6r h TRP 237 Ca 0.02 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.02 1d6r h TRP 237 Cb 0.18 -0.34 -0.00 0.00 -2.10 0.00 0.00 29.16 26.89 1d6r h TRP 237 CO -0.02 0.56 -0.37 0.82 -2.79 0.00 0.00 178.44 176.64 1d6r h ILE 238 N 1.02 0.25 -0.48 2.65 2.04 -0.28 -0.69 117.51 122.02 1d6r h ILE 238 Ca 0.37 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.32 1d6r h ILE 238 Cb 0.15 0.25 -0.07 0.00 -0.74 0.00 0.00 36.82 36.41 1d6r h ILE 238 CO -0.13 0.00 0.05 0.11 0.00 0.00 0.00 178.15 178.18 1d6r h LYS 239 N -0.93 0.16 -0.46 2.37 1.57 -0.64 -1.42 116.57 117.23 1d6r h LYS 239 Ca -0.08 -0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 58.58 1d6r h LYS 239 Cb 0.75 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.00 1d6r h LYS 239 CO 0.09 0.11 -0.17 1.96 -0.57 0.00 0.00 179.45 180.87 1d6r h GLN 240 N 0.17 0.89 -0.39 3.15 7.50 -0.62 -2.56 115.11 123.24 1d6r h GLN 240 Ca 0.24 -0.34 -0.03 0.00 0.50 0.00 0.00 58.65 59.02 1d6r h GLN 240 Cb 0.34 -0.05 -0.02 0.00 0.05 0.00 0.00 27.48 27.81 1d6r h GLN 240 CO -0.36 0.99 0.11 1.15 -1.50 0.00 0.00 178.83 179.22 1d6r h THR 241 N 0.78 1.22 -0.49 -0.54 2.02 -0.36 -2.89 112.91 112.66 1d6r h THR 241 Ca 0.11 -0.73 -0.01 0.00 0.77 0.00 0.00 66.41 66.56 1d6r h THR 241 Cb 0.70 0.96 -0.02 0.00 -1.74 0.00 0.00 68.15 68.05 1d6r h THR 241 CO 0.05 0.26 0.28 0.40 0.37 0.00 0.00 175.52 176.88 1d6r h ILE 242 N 0.48 1.16 -0.07 3.11 2.04 -1.28 -2.11 117.51 120.85 1d6r h ILE 242 Ca 0.12 -0.39 0.02 0.00 1.00 0.00 0.00 64.86 65.61 1d6r h ILE 242 Cb 0.28 0.54 -0.00 0.00 -0.74 0.00 0.00 36.82 36.89 1d6r h ILE 242 CO -0.00 0.17 0.05 0.00 0.00 0.00 0.00 178.15 178.37 1d6r h ALA 243 N 1.12 2.02 -0.02 1.87 0.00 -1.34 -3.11 119.26 119.81 1d6r h ALA 243 Ca 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1d6r h ALA 243 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1d6r h ALA 243 CO -0.03 -0.08 -0.26 -1.13 0.00 0.00 0.00 179.25 177.75 1d6r n SER 244 N -4.45 2.48 0.00 0.00 3.41 -0.83 -5.12 113.62 109.11 1d6r n SER 244 Ca -0.01 -1.74 0.00 0.00 -0.26 0.00 0.00 58.87 56.85 1d6r n SER 244 Cb 0.15 0.26 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 1d6r n SER 244 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47