#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d65 s VAL 17 N 0.00 4.47 -0.01 1.39 1.01 0.63 -3.95 120.40 123.93 3d65 s VAL 17 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 61.98 61.82 3d65 s VAL 17 Cb 0.00 -2.98 0.00 0.00 0.00 0.00 0.00 36.38 33.40 3d65 s VAL 17 CO 0.00 0.49 0.00 0.61 0.00 0.00 0.00 175.10 176.20 3d65 n GLY 18 N 3.34 0.47 0.00 4.51 0.00 -1.23 -1.31 105.19 110.97 3d65 n GLY 18 Ca -0.17 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.56 3d65 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d65 n GLY 19 N -2.92 0.46 3.11 -0.02 0.00 -1.26 -4.88 105.19 99.67 3d65 n GLY 19 Ca -0.00 -1.82 -0.09 0.00 0.00 0.00 0.00 46.02 44.11 3d65 n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3d65 s TYR 20 N 0.89 0.65 -0.02 1.61 -0.85 -0.04 -4.93 117.35 114.66 3d65 s TYR 20 Ca 0.00 -0.94 -0.30 0.00 -0.52 0.00 0.00 57.07 55.31 3d65 s TYR 20 Cb 0.00 -0.42 -0.07 0.00 0.38 0.00 0.00 41.96 41.84 3d65 s TYR 20 CO 0.00 -0.26 1.90 0.99 -1.52 0.00 0.00 175.55 176.66 3d65 s THR 21 N -3.48 3.18 0.21 -3.49 2.01 -1.26 -0.14 115.64 112.66 3d65 s THR 21 Ca 0.06 0.21 -0.10 0.00 0.31 0.00 0.00 61.69 62.17 3d65 s THR 21 Cb 0.05 -3.15 0.16 0.00 0.01 0.00 0.00 72.50 69.57 3d65 s THR 21 CO -0.07 -0.03 1.88 0.00 -0.69 0.00 0.00 174.62 175.72 3d65 n GLY 23 N -1.31 1.82 3.67 0.00 0.00 -1.26 -4.81 105.19 103.30 3d65 n GLY 23 Ca 0.08 -1.52 -0.48 0.00 0.00 0.00 0.00 46.02 44.10 3d65 n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d65 n ALA 24 N 2.02 0.98 -1.37 4.61 0.00 -1.26 -2.21 120.51 123.28 3d65 n ALA 24 Ca 0.00 0.37 -0.13 0.00 0.00 0.00 0.00 53.44 53.68 3d65 n ALA 24 Cb 0.00 -2.40 -0.05 0.00 0.00 0.00 0.00 19.45 16.99 3d65 n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3d65 n ASN 25 N 4.95 -5.26 0.10 0.00 3.02 -1.26 -4.86 115.26 111.96 3d65 n ASN 25 Ca 0.20 0.32 0.12 0.00 -0.03 0.00 0.00 54.58 55.19 3d65 n ASN 25 Cb 0.28 -3.88 0.46 0.00 -0.61 0.00 0.00 39.78 36.02 3d65 n ASN 25 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3d65 n THR 26 N -2.39 0.70 -3.38 3.41 -2.24 -0.94 -3.64 114.28 105.81 3d65 n THR 26 Ca -0.13 0.03 -0.26 0.00 -2.27 0.00 0.00 64.05 61.41 3d65 n THR 26 Cb 0.54 -0.90 -0.08 0.00 -2.10 0.00 0.00 70.33 67.79 3d65 n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3d65 n VAL 27 N -2.15 1.85 0.71 2.28 0.31 -1.26 -4.97 118.33 115.09 3d65 n VAL 27 Ca 0.04 -5.02 0.08 0.00 -0.01 0.00 0.00 64.34 59.43 3d65 n VAL 27 Cb 0.31 -2.07 0.40 0.00 -0.91 0.00 0.00 33.84 31.57 3d65 n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 3d65 n PRO 28 N 0.93 0.15 0.00 5.55 -0.04 -1.24 -1.29 135.00 139.06 3d65 n PRO 28 Ca 0.28 0.16 0.12 0.00 -0.04 0.00 0.00 63.50 64.02 3d65 n PRO 28 Cb 0.43 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.59 3d65 n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 3d65 n TYR 29 N -1.36 0.00 -2.30 0.54 0.18 -1.14 -2.06 117.16 111.01 3d65 n TYR 29 Ca 0.07 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.42 3d65 n TYR 29 Cb 0.16 -0.19 -0.03 0.00 -0.38 0.00 0.00 39.34 38.89 3d65 n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 3d65 s GLN 30 N -2.95 4.33 0.28 -3.48 2.00 -0.41 -0.99 119.66 118.44 3d65 s GLN 30 Ca 0.12 1.89 0.11 0.00 -2.00 0.00 0.00 55.36 55.48 3d65 s GLN 30 Cb 0.17 -3.47 -0.05 0.00 0.80 0.00 0.00 33.01 30.47 3d65 s GLN 30 CO 0.71 -0.46 -0.11 0.14 -0.50 0.00 0.00 175.29 175.07 3d65 s VAL 31 N 1.86 2.86 -0.17 1.34 -7.23 -0.45 -4.50 120.40 114.12 3d65 s VAL 31 Ca 0.61 -2.19 -0.06 0.00 -1.81 0.00 0.00 61.98 58.54 3d65 s VAL 31 Cb -0.31 -2.55 -0.03 0.00 0.56 0.00 0.00 36.38 34.05 3d65 s VAL 31 CO 0.27 -0.38 0.02 -0.55 -0.31 0.00 0.00 175.10 174.15 3d65 s SER 32 N -3.59 5.25 -0.07 4.85 0.15 -0.50 -2.18 113.70 117.62 3d65 s SER 32 Ca 0.31 -0.01 -0.14 0.00 0.70 0.00 0.00 55.95 56.80 3d65 s SER 32 Cb -0.05 -1.88 -0.05 0.00 -1.71 0.00 0.00 66.02 62.33 3d65 s SER 32 CO 0.17 0.17 0.37 -0.76 1.20 0.00 0.00 173.24 174.39 3d65 s LEU 33 N 0.36 4.38 -0.06 3.45 1.43 0.42 -0.65 118.68 128.01 3d65 s LEU 33 Ca -0.00 0.79 -0.01 0.00 -1.03 0.00 0.00 54.13 53.88 3d65 s LEU 33 Cb -0.13 -2.51 0.03 0.00 0.03 0.00 0.00 46.19 43.61 3d65 s LEU 33 CO 0.01 0.22 -0.00 0.21 0.23 0.00 0.00 176.35 177.03 3d65 s ASN 34 N -0.41 1.22 -0.29 2.29 3.84 0.03 -1.64 114.94 119.97 3d65 s ASN 34 Ca 0.22 -0.06 0.09 0.00 0.21 0.00 0.00 52.86 53.31 3d65 s ASN 34 Cb -0.15 -0.37 0.47 0.00 -0.55 0.00 0.00 41.25 40.64 3d65 s ASN 34 CO 0.10 -0.16 1.18 -1.54 -2.79 0.00 0.00 177.10 173.89 3d65 n SER 37 N 4.78 4.51 0.00 -4.21 3.41 -1.26 -1.05 113.62 119.80 3d65 n SER 37 Ca -0.13 -3.54 0.00 0.00 -0.26 0.00 0.00 58.87 54.94 3d65 n SER 37 Cb 0.50 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 3d65 n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d65 n GLY 38 N -0.69 3.49 3.26 5.00 0.00 -1.26 -5.05 105.19 109.93 3d65 n GLY 38 Ca 0.39 -1.03 -0.10 0.00 0.00 0.00 0.00 46.02 45.28 3d65 n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3d65 s TYR 39 N 0.00 0.73 0.19 1.61 1.13 -1.26 -5.13 117.35 114.62 3d65 s TYR 39 Ca 0.00 -1.07 -0.31 0.00 -1.41 0.00 0.00 57.07 54.28 3d65 s TYR 39 Cb 0.00 -0.30 -0.11 0.00 -1.10 0.00 0.00 41.96 40.45 3d65 s TYR 39 CO 0.00 -0.65 1.60 -1.58 -2.51 0.00 0.00 175.55 172.42 3d65 s HIS 40 N -4.04 2.99 0.00 -3.49 5.65 -1.26 -4.34 115.29 110.80 3d65 s HIS 40 Ca 0.24 0.60 0.00 0.00 0.25 0.00 0.00 55.06 56.15 3d65 s HIS 40 Cb 0.05 -3.99 0.00 0.00 -1.18 0.00 0.00 32.58 27.47 3d65 s HIS 40 CO 0.04 -3.61 0.00 1.97 -0.65 0.00 0.00 174.74 172.49 3d65 n PHE 41 N 3.70 0.00 -3.56 3.88 1.16 -0.65 -4.97 117.46 117.01 3d65 n PHE 41 Ca 0.13 0.00 -0.15 0.00 -1.87 0.00 0.00 57.45 55.57 3d65 n PHE 41 Cb 0.38 0.00 -0.05 0.00 -1.61 0.00 0.00 39.48 38.19 3d65 n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3d65 n GLY 43 N 0.55 1.16 3.79 0.00 0.00 0.23 -0.44 105.19 110.49 3d65 n GLY 43 Ca -0.19 -2.11 -0.04 0.00 0.00 0.00 0.00 46.02 43.69 3d65 n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d65 s GLY 44 N -4.86 -0.11 -0.07 -0.02 0.00 -0.92 -3.53 107.32 97.82 3d65 s GLY 44 Ca 0.63 -0.05 0.04 0.00 0.00 0.00 0.00 44.72 45.33 3d65 s GLY 44 CO 0.41 0.59 -0.18 -0.56 0.00 0.00 0.00 173.10 173.36 3d65 s SER 45 N -3.07 2.39 -0.21 1.64 0.01 0.24 -1.34 113.70 113.35 3d65 s SER 45 Ca 0.15 -0.41 -0.29 0.00 1.31 0.00 0.00 55.95 56.71 3d65 s SER 45 Cb -0.02 -0.91 0.00 0.00 0.21 0.00 0.00 66.02 65.30 3d65 s SER 45 CO 0.04 0.13 1.15 -0.22 0.41 0.00 0.00 173.24 174.74 3d65 s LEU 46 N 0.28 4.11 -0.00 2.44 2.96 -0.16 -0.40 118.68 127.91 3d65 s LEU 46 Ca -0.11 1.47 0.13 0.00 -0.22 0.00 0.00 54.13 55.40 3d65 s LEU 46 Cb -0.15 -3.54 -0.15 0.00 0.50 0.00 0.00 46.19 42.85 3d65 s LEU 46 CO 0.05 -0.75 0.48 2.30 -1.32 0.00 0.00 176.35 177.11 3d65 n ILE 47 N 5.43 0.00 -3.69 6.68 -5.35 -0.67 -0.74 119.36 121.02 3d65 n ILE 47 Ca 0.13 -0.22 -0.02 0.00 -0.27 0.00 0.00 62.75 62.36 3d65 n ILE 47 Cb 0.46 0.82 0.01 0.00 -1.74 0.00 0.00 39.64 39.19 3d65 n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 3d65 n ASN 48 N -1.45 -1.15 0.31 7.28 2.04 -1.19 -4.62 115.26 116.49 3d65 n ASN 48 Ca 0.01 -1.63 0.19 0.00 -0.44 0.00 0.00 54.58 52.71 3d65 n ASN 48 Cb 0.23 1.87 1.02 0.00 -2.53 0.00 0.00 39.78 40.37 3d65 n ASN 48 CO 0.00 0.00 0.00 0.77 -0.44 0.00 0.00 177.26 177.59 3d65 h SER 49 N 1.24 0.00 0.00 0.53 4.64 -1.96 -3.01 113.55 114.99 3d65 h SER 49 Ca -0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 3d65 h SER 49 Cb 0.76 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 3d65 h SER 49 CO 0.24 0.02 -0.01 0.00 -0.87 0.00 0.00 176.83 176.20 3d65 n GLN 50 N -3.35 2.31 -3.98 4.77 10.64 -1.26 0.14 117.38 126.65 3d65 n GLN 50 Ca -0.02 -1.43 -0.13 0.00 -1.83 0.00 0.00 57.00 53.59 3d65 n GLN 50 Cb 0.12 -0.96 -0.13 0.00 -0.86 0.00 0.00 30.24 28.41 3d65 n GLN 50 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.06 173.65 3d65 s TRP 51 N -0.99 0.23 -0.03 2.61 0.52 -1.14 -0.87 118.94 119.27 3d65 s TRP 51 Ca 0.03 -0.16 0.03 0.00 0.02 0.00 0.00 56.10 56.01 3d65 s TRP 51 Cb 0.03 -0.15 0.00 0.00 -1.15 0.00 0.00 33.47 32.20 3d65 s TRP 51 CO 0.00 -0.04 -0.10 0.08 0.02 0.00 0.00 176.95 176.91 3d65 s VAL 52 N -0.42 0.84 -0.16 4.03 1.01 0.08 -1.67 120.40 124.12 3d65 s VAL 52 Ca -0.03 -0.40 -0.11 0.00 0.00 0.00 0.00 61.98 61.44 3d65 s VAL 52 Cb -0.03 -0.75 -0.05 0.00 0.00 0.00 0.00 36.38 35.55 3d65 s VAL 52 CO -0.00 0.26 0.20 -0.69 0.00 0.00 0.00 175.10 174.87 3d65 s VAL 53 N 0.16 5.37 0.00 2.92 1.01 0.46 -0.57 120.40 129.76 3d65 s VAL 53 Ca -0.03 0.34 0.00 0.00 0.00 0.00 0.00 61.98 62.30 3d65 s VAL 53 Cb -0.09 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.77 3d65 s VAL 53 CO 0.01 0.46 0.00 -0.24 0.00 0.00 0.00 175.10 175.33 3d65 n SER 54 N 3.17 0.00 -4.86 3.32 2.88 -0.25 -0.60 113.62 117.28 3d65 n SER 54 Ca -0.15 -0.67 -0.35 0.00 -1.33 0.00 0.00 58.87 56.37 3d65 n SER 54 Cb 0.52 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.93 3d65 n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3d65 s ALA 55 N -1.85 3.70 0.33 -1.46 0.00 -1.26 -1.27 121.76 119.95 3d65 s ALA 55 Ca 0.00 -0.33 0.01 0.00 0.00 0.00 0.00 51.96 51.65 3d65 s ALA 55 Cb 0.00 -2.32 0.58 0.00 0.00 0.00 0.00 23.12 21.37 3d65 s ALA 55 CO 0.00 0.54 1.99 0.00 0.00 0.00 0.00 175.76 178.29 3d65 h ALA 56 N 3.71 1.52 0.00 0.00 0.00 -1.67 -1.70 119.26 121.12 3d65 h ALA 56 Ca -0.49 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.37 3d65 h ALA 56 Cb 1.19 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.71 3d65 h ALA 56 CO 0.66 0.43 0.00 -2.39 0.00 0.00 0.00 179.25 177.95 3d65 n HIS 57 N -4.44 0.00 1.57 0.00 1.44 -1.26 -1.87 115.22 110.66 3d65 n HIS 57 Ca 0.08 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 55.93 3d65 n HIS 57 Cb 0.07 -0.32 0.59 0.00 0.12 0.00 0.00 29.99 30.45 3d65 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3d65 n TYR 59 N -0.02 2.55 -3.94 0.00 4.19 -0.78 -5.00 117.16 114.15 3d65 n TYR 59 Ca 0.20 0.17 -0.10 0.00 3.31 0.00 0.00 57.90 61.48 3d65 n TYR 59 Cb 0.31 -2.61 -0.10 0.00 0.49 0.00 0.00 39.34 37.43 3d65 n TYR 59 CO 0.00 0.00 0.00 0.15 0.91 0.00 0.00 176.86 177.92 3d65 s LYS 60 N 0.82 0.49 0.44 2.98 1.02 -1.26 -5.14 119.74 119.09 3d65 s LYS 60 Ca 0.75 -0.65 -0.22 0.00 0.02 0.00 0.00 55.97 55.87 3d65 s LYS 60 Cb -0.58 0.19 -0.09 0.00 -0.52 0.00 0.00 37.83 36.83 3d65 s LYS 60 CO 0.37 -0.11 1.04 -1.54 -0.92 0.00 0.00 175.35 174.19 3d65 s SER 61 N -1.80 6.55 -0.49 2.83 1.04 -1.26 -4.24 113.70 116.33 3d65 s SER 61 Ca -0.10 1.97 0.00 0.00 0.48 0.00 0.00 55.95 58.30 3d65 s SER 61 Cb -0.05 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.50 3d65 s SER 61 CO -0.02 -0.64 0.00 0.61 0.98 0.00 0.00 173.24 174.17 3d65 n GLY 62 N 0.01 0.44 3.77 7.32 0.00 -1.26 -5.00 105.19 110.46 3d65 n GLY 62 Ca 0.07 -0.74 -0.40 0.00 0.00 0.00 0.00 46.02 44.95 3d65 n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d65 s ILE 63 N -2.23 2.56 -0.18 -0.61 1.01 -1.26 -4.85 121.20 115.65 3d65 s ILE 63 Ca 0.00 0.54 -0.04 0.00 0.00 0.00 0.00 60.65 61.15 3d65 s ILE 63 Cb 0.00 -3.33 -0.02 0.00 0.01 0.00 0.00 42.46 39.12 3d65 s ILE 63 CO 0.00 0.11 -0.04 -1.58 0.00 0.00 0.00 174.94 173.43 3d65 s GLN 64 N -2.03 3.55 -0.08 2.79 0.74 -0.22 -1.64 119.66 122.77 3d65 s GLN 64 Ca 0.53 -0.57 -0.19 0.00 0.05 0.00 0.00 55.36 55.18 3d65 s GLN 64 Cb -0.40 -2.94 -0.04 0.00 1.10 0.00 0.00 33.01 30.73 3d65 s GLN 64 CO 0.53 0.09 0.53 0.08 -0.55 0.00 0.00 175.29 175.96 3d65 s VAL 65 N 0.76 5.10 -0.32 1.34 1.01 0.41 -0.79 120.40 127.91 3d65 s VAL 65 Ca -0.02 1.08 -0.01 0.00 0.00 0.00 0.00 61.98 63.03 3d65 s VAL 65 Cb -0.15 -3.87 0.07 0.00 0.00 0.00 0.00 36.38 32.43 3d65 s VAL 65 CO 0.02 0.35 0.04 -0.13 0.00 0.00 0.00 175.10 175.38 3d65 s ARG 66 N 0.39 2.26 0.29 2.72 0.52 0.17 -0.51 118.95 124.79 3d65 s ARG 66 Ca 0.29 -1.43 0.06 0.00 -0.52 0.00 0.00 55.73 54.13 3d65 s ARG 66 Cb -0.16 -3.25 -0.02 0.00 0.52 0.00 0.00 34.95 32.03 3d65 s ARG 66 CO 0.13 -0.73 0.37 -0.51 0.02 0.00 0.00 175.30 174.58 3d65 s LEU 67 N 1.20 4.04 -0.89 2.53 1.02 0.28 -1.41 118.68 125.44 3d65 s LEU 67 Ca -0.01 -0.13 0.00 0.00 0.02 0.00 0.00 54.13 54.00 3d65 s LEU 67 Cb -0.20 -2.68 0.00 0.00 0.02 0.00 0.00 46.19 43.33 3d65 s LEU 67 CO -0.02 -0.24 0.00 0.61 0.02 0.00 0.00 176.35 176.72 3d65 n GLY 69 N -1.46 0.88 3.77 -3.19 0.00 -1.26 -0.48 105.19 103.44 3d65 n GLY 69 Ca -0.05 -0.10 -0.39 0.00 0.00 0.00 0.00 46.02 45.49 3d65 n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d65 s GLU 70 N -2.53 4.38 0.00 1.61 0.41 -1.26 -3.99 118.70 117.32 3d65 s GLU 70 Ca 0.00 1.77 0.00 0.00 -0.41 0.00 0.00 54.97 56.33 3d65 s GLU 70 Cb 0.00 -2.92 0.00 0.00 -1.78 0.00 0.00 34.13 29.43 3d65 s GLU 70 CO 0.00 -0.01 0.00 -3.47 -0.49 0.00 0.00 175.26 171.29 3d65 n ASP 71 N 0.62 0.00 -4.50 -0.19 2.03 -1.26 -4.55 116.55 108.70 3d65 n ASP 71 Ca 0.02 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.90 3d65 n ASP 71 Cb 0.46 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.82 3d65 n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 3d65 s ASN 72 N -3.69 6.30 0.27 1.67 3.84 -1.26 -2.83 114.94 119.24 3d65 s ASN 72 Ca 0.00 -0.51 0.23 0.00 0.21 0.00 0.00 52.86 52.79 3d65 s ASN 72 Cb 0.00 -2.41 1.01 0.00 -0.55 0.00 0.00 41.25 39.30 3d65 s ASN 72 CO 0.00 -1.21 1.71 2.30 -2.79 0.00 0.00 177.10 177.11 3d65 n ILE 73 N 6.08 0.86 1.14 -5.21 -5.35 -0.83 -2.24 119.36 113.81 3d65 n ILE 73 Ca -0.00 0.30 0.12 0.00 -0.27 0.00 0.00 62.75 62.90 3d65 n ILE 73 Cb 0.47 -1.24 0.21 0.00 -1.74 0.00 0.00 39.64 37.33 3d65 n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 3d65 n ASN 74 N -2.25 1.51 -3.66 7.28 3.02 -1.26 -4.86 115.26 115.04 3d65 n ASN 74 Ca 0.02 -1.20 -0.19 0.00 -0.03 0.00 0.00 54.58 53.18 3d65 n ASN 74 Cb 0.20 0.29 -0.17 0.00 -0.61 0.00 0.00 39.78 39.49 3d65 n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3d65 s VAL 75 N -2.47 -0.18 0.04 2.41 1.01 -0.95 -5.11 120.40 115.15 3d65 s VAL 75 Ca 0.22 0.37 -0.30 0.00 0.00 0.00 0.00 61.98 62.26 3d65 s VAL 75 Cb 0.19 -0.24 -0.08 0.00 0.00 0.00 0.00 36.38 36.25 3d65 s VAL 75 CO 0.54 0.14 1.80 -0.69 0.00 0.00 0.00 175.10 176.89 3d65 s VAL 76 N 2.23 3.06 -0.08 2.92 1.01 -1.26 -4.64 120.40 123.63 3d65 s VAL 76 Ca 0.04 0.29 0.07 0.00 0.00 0.00 0.00 61.98 62.38 3d65 s VAL 76 Cb -0.12 -3.19 -0.09 0.00 0.00 0.00 0.00 36.38 32.98 3d65 s VAL 76 CO -0.05 -0.02 0.18 -0.62 0.00 0.00 0.00 175.10 174.60 3d65 n GLU 77 N 6.65 1.41 0.00 2.72 1.02 -1.26 -5.04 120.64 126.14 3d65 n GLU 77 Ca 0.18 -0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.27 3d65 n GLU 77 Cb 0.41 -1.06 0.00 0.00 -0.02 0.00 0.00 31.44 30.76 3d65 n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3d65 n GLY 78 N 1.88 1.64 0.98 0.62 0.00 -1.26 -4.97 105.19 104.06 3d65 n GLY 78 Ca -0.01 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 3d65 n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3d65 n ASN 79 N 0.00 3.24 -4.80 1.61 3.02 -1.26 -5.01 115.26 112.06 3d65 n ASN 79 Ca 0.00 -1.93 -0.33 0.00 -0.03 0.00 0.00 54.58 52.29 3d65 n ASN 79 Cb 0.00 -0.26 -0.02 0.00 -0.61 0.00 0.00 39.78 38.88 3d65 n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3d65 s GLU 80 N -1.19 3.68 -0.14 3.52 8.01 -1.26 -4.34 118.70 126.98 3d65 s GLU 80 Ca 0.34 1.27 -0.00 0.00 0.01 0.00 0.00 54.97 56.59 3d65 s GLU 80 Cb 0.19 -2.08 0.03 0.00 -4.31 0.00 0.00 34.13 27.96 3d65 s GLU 80 CO 0.26 -0.52 -0.09 -0.65 0.01 0.00 0.00 175.26 174.27 3d65 s GLN 81 N -3.55 1.73 -0.24 1.61 -0.21 0.36 -4.96 119.66 114.39 3d65 s GLN 81 Ca 0.65 -0.45 -0.10 0.00 0.02 0.00 0.00 55.36 55.48 3d65 s GLN 81 Cb -0.15 -1.90 -0.05 0.00 1.00 0.00 0.00 33.01 31.91 3d65 s GLN 81 CO 0.26 -0.32 0.14 -0.06 -2.12 0.00 0.00 175.29 173.19 3d65 s PHE 82 N 1.61 3.25 -0.05 0.91 2.99 -1.26 -0.56 117.98 124.86 3d65 s PHE 82 Ca 0.03 0.08 0.00 0.00 0.00 0.00 0.00 56.93 57.04 3d65 s PHE 82 Cb -0.14 -2.27 0.02 0.00 0.00 0.00 0.00 43.02 40.64 3d65 s PHE 82 CO -0.09 -0.05 -0.03 0.42 -0.00 0.00 0.00 175.22 175.48 3d65 s ILE 83 N 1.24 0.44 0.48 0.64 1.01 0.33 -4.99 121.20 120.36 3d65 s ILE 83 Ca 0.07 -0.03 -0.24 0.00 0.00 0.00 0.00 60.65 60.45 3d65 s ILE 83 Cb -0.14 -0.51 -0.07 0.00 0.01 0.00 0.00 42.46 41.75 3d65 s ILE 83 CO 0.06 0.22 1.38 -0.44 0.00 0.00 0.00 174.94 176.16 3d65 s SER 84 N 1.20 5.69 -0.02 3.58 0.01 -1.26 -0.45 113.70 122.45 3d65 s SER 84 Ca -0.07 2.82 -0.30 0.00 1.31 0.00 0.00 55.95 59.71 3d65 s SER 84 Cb -0.14 -2.64 -0.03 0.00 0.21 0.00 0.00 66.02 63.42 3d65 s SER 84 CO -0.02 -1.29 1.13 0.00 0.41 0.00 0.00 173.24 173.47 3d65 s ALA 85 N -1.26 3.39 -0.07 1.44 0.00 -0.65 -0.21 121.76 124.40 3d65 s ALA 85 Ca 0.65 0.62 -0.03 0.00 0.00 0.00 0.00 51.96 53.19 3d65 s ALA 85 Cb -0.41 -3.45 -0.27 0.00 0.00 0.00 0.00 23.12 18.99 3d65 s ALA 85 CO 0.52 -0.56 0.56 0.66 0.00 0.00 0.00 175.76 176.94 3d65 h SER 86 N 7.11 0.38 -4.27 0.00 4.64 -1.02 -3.44 113.55 116.94 3d65 h SER 86 Ca -0.37 -0.71 -0.31 0.00 -0.47 0.00 0.00 61.79 59.93 3d65 h SER 86 Cb 1.18 -0.12 -0.25 0.00 -0.31 0.00 0.00 62.40 62.90 3d65 h SER 86 CO 0.84 1.63 -0.75 -0.54 -0.87 0.00 0.00 176.83 177.13 3d65 s LYS 87 N -2.58 0.50 -0.21 4.77 1.02 -1.19 -5.01 119.74 117.05 3d65 s LYS 87 Ca -0.16 -0.45 -0.00 0.00 0.02 0.00 0.00 55.97 55.38 3d65 s LYS 87 Cb 0.07 -0.40 0.05 0.00 -0.52 0.00 0.00 37.83 37.03 3d65 s LYS 87 CO 0.81 0.10 -0.04 -1.12 -0.92 0.00 0.00 175.35 174.17 3d65 s SER 88 N -0.76 3.38 -0.38 2.83 0.01 -1.26 -0.97 113.70 116.55 3d65 s SER 88 Ca -0.03 -0.95 -0.06 0.00 1.31 0.00 0.00 55.95 56.22 3d65 s SER 88 Cb -0.06 -1.02 0.07 0.00 0.21 0.00 0.00 66.02 65.23 3d65 s SER 88 CO 0.00 -0.22 0.18 -0.63 0.41 0.00 0.00 173.24 172.97 3d65 s ILE 89 N 1.53 3.72 0.36 1.44 1.01 0.13 -4.96 121.20 124.45 3d65 s ILE 89 Ca -0.03 -1.50 -0.25 0.00 0.00 0.00 0.00 60.65 58.87 3d65 s ILE 89 Cb -0.17 -3.29 -0.09 0.00 0.01 0.00 0.00 42.46 38.92 3d65 s ILE 89 CO -0.07 -0.42 1.04 -0.69 0.00 0.00 0.00 174.94 174.79 3d65 s VAL 90 N 1.33 3.78 0.13 2.92 1.01 -1.26 -0.76 120.40 127.55 3d65 s VAL 90 Ca 0.02 1.45 -0.35 0.00 0.00 0.00 0.00 61.98 63.10 3d65 s VAL 90 Cb -0.22 -3.80 -0.15 0.00 0.00 0.00 0.00 36.38 32.21 3d65 s VAL 90 CO 0.00 0.10 1.43 1.57 0.00 0.00 0.00 175.10 178.19 3d65 n HIS 91 N 0.27 1.84 0.32 5.22 -0.00 -0.53 -4.85 115.22 117.48 3d65 n HIS 91 Ca 0.03 0.48 0.20 0.00 0.46 0.00 0.00 57.72 58.90 3d65 n HIS 91 Cb 0.49 -2.42 1.09 0.00 -0.12 0.00 0.00 29.99 29.03 3d65 n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 3d65 h PRO 92 N 4.99 0.00 -0.65 1.57 0.13 -1.93 -1.03 132.00 135.08 3d65 h PRO 92 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3d65 h PRO 92 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 3d65 h PRO 92 CO 0.81 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 179.01 3d65 n SER 93 N -3.29 3.83 -4.66 1.44 7.64 -1.26 -4.99 113.62 112.32 3d65 n SER 93 Ca -0.03 -2.04 -0.51 0.00 1.01 0.00 0.00 58.87 57.30 3d65 n SER 93 Cb 0.13 -0.45 -0.05 0.00 -1.01 0.00 0.00 64.21 62.82 3d65 n SER 93 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3d65 n TYR 94 N 1.37 2.04 -3.82 1.43 -0.00 -0.39 -4.72 117.16 113.07 3d65 n TYR 94 Ca 0.22 0.35 -0.36 0.00 -0.00 0.00 0.00 57.90 58.12 3d65 n TYR 94 Cb 0.61 -2.50 -0.13 0.00 -0.00 0.00 0.00 39.34 37.32 3d65 n TYR 94 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.86 178.07 3d65 s ASN 95 N 2.25 5.13 0.51 2.98 3.84 -0.63 -4.98 114.94 124.04 3d65 s ASN 95 Ca 0.89 -1.58 0.34 0.00 0.21 0.00 0.00 52.86 52.72 3d65 s ASN 95 Cb -0.85 -1.79 1.73 0.00 -0.55 0.00 0.00 41.25 39.79 3d65 s ASN 95 CO 0.50 -0.40 2.04 0.77 -2.79 0.00 0.00 177.10 177.23 3d65 h SER 96 N 8.06 0.00 0.66 -4.21 4.64 -1.93 0.25 113.55 121.02 3d65 h SER 96 Ca -0.18 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 60.87 3d65 h SER 96 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 3d65 h SER 96 CO 0.62 0.00 -1.21 0.78 -0.87 0.00 0.00 176.83 176.14 3d65 h ASN 97 N 0.00 0.39 -0.00 4.97 -0.26 -1.97 -3.37 115.58 115.34 3d65 h ASN 97 Ca 0.00 -0.41 0.00 0.00 -0.56 0.00 0.00 56.30 55.33 3d65 h ASN 97 Cb 0.16 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 37.29 3d65 h ASN 97 CO 0.00 1.32 -0.30 0.35 -1.06 0.00 0.00 177.43 177.74 3d65 n THR 98 N -3.52 0.00 -1.40 2.81 -2.24 -1.09 -4.97 114.28 103.86 3d65 n THR 98 Ca -0.08 -0.35 -0.14 0.00 -2.27 0.00 0.00 64.05 61.22 3d65 n THR 98 Cb 1.01 1.04 -0.06 0.00 -2.10 0.00 0.00 70.33 70.22 3d65 n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3d65 n LEU 99 N -0.86 -0.81 -4.77 3.22 4.77 0.85 -4.98 117.00 114.42 3d65 n LEU 99 Ca 0.02 0.34 -0.41 0.00 -0.03 0.00 0.00 56.01 55.93 3d65 n LEU 99 Cb 0.14 -2.43 -0.02 0.00 -2.33 0.00 0.00 43.42 38.78 3d65 n LEU 99 CO 0.14 -0.91 1.03 0.21 -1.33 0.00 0.00 177.39 176.53 3d65 s ASN 100 N -2.63 6.67 -1.25 -1.43 3.04 -1.21 -3.12 114.94 115.01 3d65 s ASN 100 Ca 0.00 2.74 -0.02 0.00 0.04 0.00 0.00 52.86 55.63 3d65 s ASN 100 Cb 0.00 -2.65 0.00 0.00 -1.54 0.00 0.00 41.25 37.07 3d65 s ASN 100 CO 0.00 -0.63 1.00 0.59 -3.04 0.00 0.00 177.10 175.02 3d65 n ASN 101 N 1.09 -2.74 -4.13 -4.21 3.02 -1.26 -1.60 115.26 105.42 3d65 n ASN 101 Ca 0.02 -0.63 -0.43 0.00 -0.03 0.00 0.00 54.58 53.50 3d65 n ASN 101 Cb 0.41 -4.97 0.00 0.00 -0.61 0.00 0.00 39.78 34.62 3d65 n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3d65 n ASP 102 N -3.10 4.89 -3.80 6.41 2.03 -1.18 -4.29 116.55 117.50 3d65 n ASP 102 Ca -0.23 -2.99 -0.12 0.00 0.52 0.00 0.00 54.79 51.96 3d65 n ASP 102 Cb 0.65 -1.58 -0.10 0.00 -0.72 0.00 0.00 41.12 39.37 3d65 n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 3d65 s ILE 103 N 1.85 0.04 -0.05 5.18 2.07 -1.26 -3.78 121.20 125.25 3d65 s ILE 103 Ca 0.44 -0.34 -0.09 0.00 -1.41 0.00 0.00 60.65 59.26 3d65 s ILE 103 Cb 0.06 -0.45 0.02 0.00 0.13 0.00 0.00 42.46 42.21 3d65 s ILE 103 CO -0.00 -0.18 0.21 -0.32 -1.91 0.00 0.00 174.94 172.74 3d65 s MET 104 N -0.72 0.40 -0.09 3.50 -2.45 -0.39 -1.45 119.30 118.09 3d65 s MET 104 Ca -0.08 0.01 0.02 0.00 -1.25 0.00 0.00 55.69 54.39 3d65 s MET 104 Cb -0.04 0.18 -0.02 0.00 1.25 0.00 0.00 34.83 36.20 3d65 s MET 104 CO 0.02 -0.08 -0.15 -0.51 1.05 0.00 0.00 175.02 175.35 3d65 s LEU 105 N -0.58 2.67 -0.19 4.11 1.43 0.06 -1.09 118.68 125.09 3d65 s LEU 105 Ca -0.07 -0.28 -0.01 0.00 -1.03 0.00 0.00 54.13 52.74 3d65 s LEU 105 Cb -0.04 -1.57 0.01 0.00 0.03 0.00 0.00 46.19 44.62 3d65 s LEU 105 CO 0.01 0.25 -0.14 -0.63 0.23 0.00 0.00 176.35 176.07 3d65 s ILE 106 N -0.17 2.58 0.00 -0.59 1.01 0.27 0.22 121.20 124.53 3d65 s ILE 106 Ca -0.01 -0.77 -0.19 0.00 0.00 0.00 0.00 60.65 59.68 3d65 s ILE 106 Cb -0.13 -2.12 -0.06 0.00 0.01 0.00 0.00 42.46 40.16 3d65 s ILE 106 CO 0.03 0.50 0.54 -0.75 0.00 0.00 0.00 174.94 175.27 3d65 s LYS 107 N 1.26 4.23 0.02 2.79 2.20 -0.14 -0.74 119.74 129.35 3d65 s LYS 107 Ca 0.03 0.65 -0.26 0.00 -0.36 0.00 0.00 55.97 56.03 3d65 s LYS 107 Cb -0.14 -3.31 -0.05 0.00 -1.51 0.00 0.00 37.83 32.83 3d65 s LYS 107 CO -0.07 0.47 0.82 -0.51 -0.36 0.00 0.00 175.35 175.69 3d65 s LEU 108 N -0.48 4.41 0.32 5.43 1.43 -0.05 -0.44 118.68 129.30 3d65 s LEU 108 Ca 0.29 1.47 0.11 0.00 -1.03 0.00 0.00 54.13 54.96 3d65 s LEU 108 Cb -0.18 -3.31 0.95 0.00 0.03 0.00 0.00 46.19 43.68 3d65 s LEU 108 CO 0.16 -0.08 1.69 0.50 0.23 0.00 0.00 176.35 178.85 3d65 h LYS 109 N 6.15 0.41 -5.05 1.70 3.64 -0.88 -3.41 116.57 119.13 3d65 h LYS 109 Ca -0.42 -0.02 -0.36 0.00 -1.27 0.00 0.00 60.65 58.57 3d65 h LYS 109 Cb 1.21 -0.09 -0.21 0.00 -0.41 0.00 0.00 32.23 32.73 3d65 h LYS 109 CO 0.73 0.27 -0.76 -1.54 -2.27 0.00 0.00 179.45 175.88 3d65 s SER 110 N -5.06 1.39 0.31 4.20 1.04 -1.26 -4.97 113.70 109.35 3d65 s SER 110 Ca -0.11 -0.62 -0.29 0.00 0.48 0.00 0.00 55.95 55.41 3d65 s SER 110 Cb 0.28 -0.02 -0.10 0.00 0.10 0.00 0.00 66.02 66.28 3d65 s SER 110 CO 0.79 -0.14 1.37 0.00 0.98 0.00 0.00 173.24 176.24 3d65 s ALA 111 N -1.47 3.55 0.76 5.32 0.00 -1.26 -4.88 121.76 123.79 3d65 s ALA 111 Ca -0.03 1.32 -0.12 0.00 0.00 0.00 0.00 51.96 53.13 3d65 s ALA 111 Cb -0.09 -3.52 0.06 0.00 0.00 0.00 0.00 23.12 19.57 3d65 s ALA 111 CO 0.01 -0.73 1.12 0.00 0.00 0.00 0.00 175.76 176.16 3d65 s ALA 112 N -0.76 2.16 -0.52 0.00 0.00 0.12 -4.99 121.76 117.78 3d65 s ALA 112 Ca 0.53 0.45 -0.20 0.00 0.00 0.00 0.00 51.96 52.74 3d65 s ALA 112 Cb -0.41 -3.33 0.06 0.00 0.00 0.00 0.00 23.12 19.43 3d65 s ALA 112 CO 0.51 -1.83 0.69 -1.12 0.00 0.00 0.00 175.76 174.02 3d65 s SER 113 N -2.94 6.24 0.18 0.00 0.01 -1.26 -4.86 113.70 111.07 3d65 s SER 113 Ca 0.65 -0.86 -0.30 0.00 1.31 0.00 0.00 55.95 56.75 3d65 s SER 113 Cb -0.20 -2.32 -0.08 0.00 0.21 0.00 0.00 66.02 63.64 3d65 s SER 113 CO 0.52 -0.98 1.06 -0.76 0.41 0.00 0.00 173.24 173.49 3d65 s LEU 114 N 2.89 4.51 0.00 2.44 1.43 -1.26 -4.79 118.68 123.90 3d65 s LEU 114 Ca 0.18 2.04 0.00 0.00 -1.03 0.00 0.00 54.13 55.31 3d65 s LEU 114 Cb -0.18 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.43 3d65 s LEU 114 CO 0.13 -0.15 0.00 -0.46 0.23 0.00 0.00 176.35 176.09 3d65 n ASN 115 N 2.29 0.00 0.25 2.29 6.94 0.34 -4.98 115.26 122.39 3d65 n ASN 115 Ca 0.02 -0.92 0.13 0.00 -0.02 0.00 0.00 54.58 53.79 3d65 n ASN 115 Cb 0.47 0.00 0.64 0.00 -2.36 0.00 0.00 39.78 38.53 3d65 n ASN 115 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 3d65 h SER 116 N 0.00 0.00 0.15 0.53 4.64 -2.00 -2.89 113.55 113.98 3d65 h SER 116 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3d65 h SER 116 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3d65 h SER 116 CO 0.00 0.14 -1.18 0.54 -0.87 0.00 0.00 176.83 175.46 3d65 n ARG 117 N -3.43 0.21 -3.64 4.77 5.12 -1.26 -4.77 116.66 113.66 3d65 n ARG 117 Ca -0.01 -0.04 -0.29 0.00 -1.93 0.00 0.00 57.85 55.58 3d65 n ARG 117 Cb 0.31 -1.53 -0.15 0.00 -1.16 0.00 0.00 32.46 29.94 3d65 n ARG 117 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3d65 s VAL 118 N -3.16 0.44 0.02 1.55 1.01 -1.09 -4.18 120.40 114.98 3d65 s VAL 118 Ca 0.04 -1.10 0.00 0.00 0.00 0.00 0.00 61.98 60.92 3d65 s VAL 118 Cb 0.15 -1.35 -0.02 0.00 0.00 0.00 0.00 36.38 35.17 3d65 s VAL 118 CO 0.85 -0.70 -0.03 0.00 0.00 0.00 0.00 175.10 175.22 3d65 s ALA 119 N 1.84 0.17 0.58 5.51 0.00 -0.87 -0.51 121.76 128.48 3d65 s ALA 119 Ca 0.09 -0.53 -0.12 0.00 0.00 0.00 0.00 51.96 51.41 3d65 s ALA 119 Cb -0.17 0.11 -0.05 0.00 0.00 0.00 0.00 23.12 23.01 3d65 s ALA 119 CO -0.31 -0.11 0.99 -1.54 0.00 0.00 0.00 175.76 174.79 3d65 s SER 120 N -1.25 6.33 -0.09 0.00 1.04 -1.26 -2.91 113.70 115.56 3d65 s SER 120 Ca -0.13 1.40 0.00 0.00 0.48 0.00 0.00 55.95 57.70 3d65 s SER 120 Cb -0.08 -2.45 -0.03 0.00 0.10 0.00 0.00 66.02 63.55 3d65 s SER 120 CO -0.01 -0.77 -0.08 -0.51 0.98 0.00 0.00 173.24 172.86 3d65 s ILE 121 N -2.99 3.61 0.54 -1.02 1.10 0.08 -4.87 121.20 117.64 3d65 s ILE 121 Ca 0.55 -0.50 -0.21 0.00 -0.51 0.00 0.00 60.65 59.98 3d65 s ILE 121 Cb -0.11 -2.50 -0.05 0.00 0.15 0.00 0.00 42.46 39.96 3d65 s ILE 121 CO 0.48 0.57 1.23 -0.44 -2.11 0.00 0.00 174.94 174.66 3d65 s SER 122 N -0.45 5.55 0.45 4.50 0.01 -1.26 -4.60 113.70 117.90 3d65 s SER 122 Ca 0.06 2.44 -0.13 0.00 1.31 0.00 0.00 55.95 59.64 3d65 s SER 122 Cb -0.12 -2.61 -0.07 0.00 0.21 0.00 0.00 66.02 63.43 3d65 s SER 122 CO 0.02 -1.35 0.86 -0.76 0.41 0.00 0.00 173.24 172.41 3d65 s LEU 123 N -3.60 3.75 0.69 2.44 1.43 -1.26 -0.66 118.68 121.47 3d65 s LEU 123 Ca 0.71 1.31 -0.15 0.00 -1.03 0.00 0.00 54.13 54.98 3d65 s LEU 123 Cb -0.32 -4.21 0.02 0.00 0.03 0.00 0.00 46.19 41.71 3d65 s LEU 123 CO 0.37 -0.48 1.14 -2.84 0.23 0.00 0.00 176.35 174.77 3d65 s PRO 124 N -3.94 2.53 0.00 1.29 0.02 -1.26 -4.78 135.00 128.86 3d65 s PRO 124 Ca 0.54 1.48 0.11 0.00 0.02 0.00 0.00 61.00 63.15 3d65 s PRO 124 Cb -0.10 -1.91 0.04 0.00 0.02 0.00 0.00 34.50 32.55 3d65 s PRO 124 CO 0.31 -1.48 0.75 0.25 -0.33 0.00 0.00 177.00 176.50 3d65 n THR 125 N -2.63 0.00 -3.66 0.99 -2.24 -1.26 -5.01 114.28 100.47 3d65 n THR 125 Ca 0.11 -0.43 -0.10 0.00 -2.27 0.00 0.00 64.05 61.36 3d65 n THR 125 Cb 0.52 1.17 -0.03 0.00 -2.10 0.00 0.00 70.33 69.89 3d65 n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3d65 s SER 127 N -1.24 -0.34 0.66 3.42 1.04 -1.26 -5.17 113.70 110.81 3d65 s SER 127 Ca 0.11 -0.35 -0.13 0.00 0.48 0.00 0.00 55.95 56.05 3d65 s SER 127 Cb 0.09 0.60 -0.00 0.00 0.10 0.00 0.00 66.02 66.80 3d65 s SER 127 CO 0.22 -1.06 1.07 0.00 0.98 0.00 0.00 173.24 174.46 3d65 s ALA 129 N -2.66 3.45 0.24 0.00 0.00 -1.26 -5.10 121.76 116.44 3d65 s ALA 129 Ca 0.62 -0.35 0.08 0.00 0.00 0.00 0.00 51.96 52.31 3d65 s ALA 129 Cb -0.16 -2.55 -0.04 0.00 0.00 0.00 0.00 23.12 20.37 3d65 s ALA 129 CO 0.45 0.08 0.11 -1.54 0.00 0.00 0.00 175.76 174.86 3d65 s SER 130 N -3.19 5.14 0.41 0.00 1.04 -1.26 -5.05 113.70 110.79 3d65 s SER 130 Ca 0.48 -0.38 -0.24 0.00 0.48 0.00 0.00 55.95 56.30 3d65 s SER 130 Cb -0.10 -1.19 -0.11 0.00 0.10 0.00 0.00 66.02 64.71 3d65 s SER 130 CO 0.31 -0.00 0.86 0.00 0.98 0.00 0.00 173.24 175.39 3d65 n ALA 132 N -0.91 -0.42 0.00 5.32 0.00 -1.26 -1.62 120.51 121.61 3d65 n ALA 132 Ca -0.08 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.59 3d65 n ALA 132 Cb 0.58 -1.98 0.00 0.00 0.00 0.00 0.00 19.45 18.05 3d65 n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d65 n GLY 133 N 1.39 2.97 3.76 0.00 0.00 0.19 -4.94 105.19 108.56 3d65 n GLY 133 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 3d65 n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d65 s THR 134 N -2.11 2.18 0.03 2.61 2.01 -0.64 -4.62 115.64 115.10 3d65 s THR 134 Ca 0.00 0.16 -0.22 0.00 0.31 0.00 0.00 61.69 61.94 3d65 s THR 134 Cb 0.00 -3.10 -0.06 0.00 0.01 0.00 0.00 72.50 69.35 3d65 s THR 134 CO 0.00 0.03 0.64 -1.58 -0.69 0.00 0.00 174.62 173.02 3d65 s GLN 135 N -0.90 4.36 0.18 4.92 2.00 -1.26 -1.43 119.66 127.54 3d65 s GLN 135 Ca 0.60 0.84 0.08 0.00 -2.00 0.00 0.00 55.36 54.88 3d65 s GLN 135 Cb -0.46 -3.33 -0.04 0.00 0.80 0.00 0.00 33.01 29.97 3d65 s GLN 135 CO 0.51 0.39 -0.16 0.00 -0.50 0.00 0.00 175.29 175.53 3d65 s LEU 137 N -3.01 3.71 -0.08 0.00 2.96 0.46 -0.54 118.68 122.18 3d65 s LEU 137 Ca 0.19 -0.41 0.01 0.00 -0.22 0.00 0.00 54.13 53.70 3d65 s LEU 137 Cb -0.03 -1.93 -0.02 0.00 0.50 0.00 0.00 46.19 44.70 3d65 s LEU 137 CO 0.07 -0.11 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.24 3d65 s ILE 138 N 1.59 3.28 0.05 6.68 1.01 0.00 -1.25 121.20 132.57 3d65 s ILE 138 Ca 0.05 -0.62 -0.07 0.00 0.00 0.00 0.00 60.65 60.01 3d65 s ILE 138 Cb -0.16 -2.33 -0.01 0.00 0.01 0.00 0.00 42.46 39.97 3d65 s ILE 138 CO 0.04 0.57 0.13 -0.94 0.00 0.00 0.00 174.94 174.74 3d65 s SER 139 N -0.40 0.17 0.00 3.58 1.04 -1.20 -0.44 113.70 116.44 3d65 s SER 139 Ca 0.05 -0.59 0.00 0.00 0.48 0.00 0.00 55.95 55.89 3d65 s SER 139 Cb -0.12 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.27 3d65 s SER 139 CO 0.02 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 174.26 3d65 n GLY 140 N 0.44 -0.51 1.32 7.32 0.00 -0.40 -4.40 105.19 108.96 3d65 n GLY 140 Ca -0.17 -1.21 0.06 0.00 0.00 0.00 0.00 46.02 44.70 3d65 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3d65 n TRP 141 N -0.76 1.44 -1.37 1.61 8.01 -1.26 -1.94 117.44 123.17 3d65 n TRP 141 Ca 0.00 -0.89 -0.30 0.00 -1.31 0.00 0.00 57.50 55.00 3d65 n TRP 141 Cb 0.00 -0.42 0.22 0.00 -2.01 0.00 0.00 31.31 29.10 3d65 n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 3d65 s GLY 142 N -1.53 1.66 0.37 6.99 0.00 -1.25 -4.29 107.32 109.27 3d65 s GLY 142 Ca 0.47 -1.06 -0.27 0.00 0.00 0.00 0.00 44.72 43.86 3d65 s GLY 142 CO 0.11 -0.21 1.24 -2.01 0.00 0.00 0.00 173.10 172.23 3d65 n ASN 143 N -4.44 2.45 -0.86 1.64 2.85 0.70 -3.04 115.26 114.55 3d65 n ASN 143 Ca 0.14 1.15 0.10 0.00 -0.11 0.00 0.00 54.58 55.86 3d65 n ASN 143 Cb 0.59 -1.46 0.13 0.00 1.24 0.00 0.00 39.78 40.28 3d65 n ASN 143 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 3d65 n THR 144 N 0.05 0.26 -5.23 -0.44 -2.24 -0.40 -0.52 114.28 105.77 3d65 n THR 144 Ca 0.06 -0.63 -0.32 0.00 -2.27 0.00 0.00 64.05 60.89 3d65 n THR 144 Cb 0.37 1.17 -0.17 0.00 -2.10 0.00 0.00 70.33 69.60 3d65 n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3d65 s LYS 145 N -1.45 2.87 0.41 -0.78 1.02 -1.26 -4.35 119.74 116.20 3d65 s LYS 145 Ca 0.27 -0.89 0.25 0.00 0.02 0.00 0.00 55.97 55.63 3d65 s LYS 145 Cb 0.17 -2.25 0.59 0.00 -0.52 0.00 0.00 37.83 35.82 3d65 s LYS 145 CO 0.25 0.26 1.69 0.66 -0.92 0.00 0.00 175.35 177.29 3d65 h SER 146 N 6.47 0.00 -2.27 2.83 4.64 -1.94 -3.40 113.55 119.89 3d65 h SER 146 Ca -0.24 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.59 3d65 h SER 146 Cb 1.22 0.00 -0.35 0.00 -0.31 0.00 0.00 62.40 62.95 3d65 h SER 146 CO 0.47 0.00 -0.80 -0.55 -0.87 0.00 0.00 176.83 175.08 3d65 s SER 147 N -5.79 1.93 0.00 4.97 0.15 -1.26 -4.71 113.70 108.99 3d65 s SER 147 Ca 0.07 -2.09 0.00 0.00 0.70 0.00 0.00 55.95 54.63 3d65 s SER 147 Cb 0.07 0.02 0.00 0.00 -1.71 0.00 0.00 66.02 64.40 3d65 s SER 147 CO 0.63 -0.26 0.00 0.61 1.20 0.00 0.00 173.24 175.42 3d65 n GLY 148 N 3.89 0.89 2.87 9.45 0.00 -1.26 -5.08 105.19 115.95 3d65 n GLY 148 Ca 0.15 -2.05 -0.27 0.00 0.00 0.00 0.00 46.02 43.85 3d65 n GLY 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d65 s THR 149 N -1.17 0.93 -0.22 2.61 2.01 -1.26 -4.58 115.64 113.95 3d65 s THR 149 Ca 0.00 -0.34 -0.03 0.00 0.31 0.00 0.00 61.69 61.62 3d65 s THR 149 Cb 0.00 -1.04 0.11 0.00 0.01 0.00 0.00 72.50 71.58 3d65 s THR 149 CO 0.00 0.25 0.31 -0.55 -0.69 0.00 0.00 174.62 173.94 3d65 s SER 150 N 1.73 0.69 -0.08 3.53 0.15 -1.26 -5.01 113.70 113.45 3d65 s SER 150 Ca 0.03 0.07 -0.14 0.00 0.70 0.00 0.00 55.95 56.61 3d65 s SER 150 Cb -0.14 0.81 -0.05 0.00 -1.71 0.00 0.00 66.02 64.94 3d65 s SER 150 CO -0.08 -0.31 0.35 -0.31 1.20 0.00 0.00 173.24 174.09 3d65 s TYR 151 N 2.45 3.59 0.44 3.44 2.02 -1.26 -1.27 117.35 126.76 3d65 s TYR 151 Ca 0.10 0.79 -0.12 0.00 -0.37 0.00 0.00 57.07 57.47 3d65 s TYR 151 Cb -0.15 -2.30 -0.07 0.00 -0.40 0.00 0.00 41.96 39.03 3d65 s TYR 151 CO -0.14 0.45 0.83 -1.25 -1.57 0.00 0.00 175.55 173.87 3d65 s PRO 152 N -0.31 3.82 0.00 -1.71 0.04 -1.26 -4.98 135.00 130.61 3d65 s PRO 152 Ca 0.21 0.61 -0.21 0.00 0.04 0.00 0.00 61.00 61.64 3d65 s PRO 152 Cb -0.15 -2.32 -0.20 0.00 0.04 0.00 0.00 34.50 31.88 3d65 s PRO 152 CO 0.09 -0.11 1.17 -0.44 0.04 0.00 0.00 177.00 177.74 3d65 h ASP 153 N 1.14 0.41 -2.30 6.66 3.45 -1.94 -3.47 116.42 120.38 3d65 h ASP 153 Ca -0.47 -0.67 -0.46 0.00 0.43 0.00 0.00 57.03 55.86 3d65 h ASP 153 Cb 1.19 -0.12 -0.00 0.00 -0.56 0.00 0.00 39.33 39.83 3d65 h ASP 153 CO 0.63 1.02 -0.34 0.68 -1.57 0.00 0.00 179.24 179.66 3d65 s VAL 154 N -3.56 4.96 0.14 -1.35 -7.23 -1.26 -1.97 120.40 110.14 3d65 s VAL 154 Ca -0.14 -0.84 -0.31 0.00 -1.81 0.00 0.00 61.98 58.87 3d65 s VAL 154 Cb 0.04 -3.77 -0.10 0.00 0.56 0.00 0.00 36.38 33.11 3d65 s VAL 154 CO 0.78 -0.35 1.56 -0.22 -0.31 0.00 0.00 175.10 176.55 3d65 s LEU 155 N -4.12 4.37 0.11 1.32 0.20 -1.13 -4.86 118.68 114.57 3d65 s LEU 155 Ca 0.38 2.56 0.03 0.00 0.69 0.00 0.00 54.13 57.79 3d65 s LEU 155 Cb -0.09 -3.59 -0.04 0.00 -0.43 0.00 0.00 46.19 42.04 3d65 s LEU 155 CO 0.31 -0.81 0.12 -0.54 -0.29 0.00 0.00 176.35 175.14 3d65 s LYS 156 N 1.35 2.96 0.08 1.98 -0.14 -0.82 -1.81 119.74 123.34 3d65 s LYS 156 Ca 0.70 -0.71 0.05 0.00 -1.36 0.00 0.00 55.97 54.65 3d65 s LYS 156 Cb -0.42 -2.74 -0.03 0.00 -1.68 0.00 0.00 37.83 32.95 3d65 s LYS 156 CO 0.31 0.54 -0.14 0.00 -0.76 0.00 0.00 175.35 175.31 3d65 s LEU 158 N -1.90 0.27 -0.20 0.00 2.96 0.41 -0.86 118.68 119.36 3d65 s LEU 158 Ca 0.00 0.57 -0.15 0.00 -0.22 0.00 0.00 54.13 54.34 3d65 s LEU 158 Cb -0.09 0.80 -0.04 0.00 0.50 0.00 0.00 46.19 47.36 3d65 s LEU 158 CO 0.02 -0.18 0.34 -0.54 -1.32 0.00 0.00 176.35 174.68 3d65 s LYS 159 N 1.41 4.16 -0.04 1.98 1.02 -1.26 -0.81 119.74 126.20 3d65 s LYS 159 Ca -0.08 0.11 -0.06 0.00 0.02 0.00 0.00 55.97 55.96 3d65 s LYS 159 Cb -0.10 -3.53 0.01 0.00 -0.52 0.00 0.00 37.83 33.69 3d65 s LYS 159 CO -0.09 0.01 0.14 0.00 -0.92 0.00 0.00 175.35 174.49 3d65 s ALA 160 N 1.18 -0.35 0.43 5.17 0.00 0.29 -4.95 121.76 123.54 3d65 s ALA 160 Ca 0.17 0.27 -0.09 0.00 0.00 0.00 0.00 51.96 52.30 3d65 s ALA 160 Cb -0.14 -0.15 -0.06 0.00 0.00 0.00 0.00 23.12 22.77 3d65 s ALA 160 CO 0.07 -0.11 0.78 -1.25 0.00 0.00 0.00 175.76 175.26 3d65 s PRO 161 N -0.30 3.72 0.21 0.00 0.04 -1.26 -0.15 135.00 137.26 3d65 s PRO 161 Ca -0.04 0.42 -0.30 0.00 0.04 0.00 0.00 61.00 61.12 3d65 s PRO 161 Cb -0.03 -2.38 -0.09 0.00 0.04 0.00 0.00 34.50 32.04 3d65 s PRO 161 CO 0.00 -0.09 1.35 0.42 0.04 0.00 0.00 177.00 178.72 3d65 s ILE 162 N -2.48 3.04 0.25 0.56 1.01 -0.51 -1.58 121.20 121.49 3d65 s ILE 162 Ca 0.51 0.86 -0.02 0.00 0.00 0.00 0.00 60.65 62.00 3d65 s ILE 162 Cb -0.10 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.77 3d65 s ILE 162 CO 0.35 0.13 0.46 -0.76 0.00 0.00 0.00 174.94 175.13 3d65 s LEU 163 N -0.17 4.15 0.47 2.97 1.43 0.08 0.57 118.68 128.18 3d65 s LEU 163 Ca 0.58 0.52 -0.25 0.00 -1.03 0.00 0.00 54.13 53.95 3d65 s LEU 163 Cb -0.38 -3.31 -0.08 0.00 0.03 0.00 0.00 46.19 42.45 3d65 s LEU 163 CO 0.39 -0.12 1.42 -0.94 0.23 0.00 0.00 176.35 177.33 3d65 s SER 164 N -3.25 5.75 0.39 2.29 1.04 -1.26 -4.56 113.70 114.10 3d65 s SER 164 Ca 0.41 2.90 0.14 0.00 0.48 0.00 0.00 55.95 59.88 3d65 s SER 164 Cb -0.11 -2.65 0.98 0.00 0.10 0.00 0.00 66.02 64.34 3d65 s SER 164 CO 0.30 -1.26 1.85 0.44 0.98 0.00 0.00 173.24 175.56 3d65 h ASP 165 N 2.16 0.51 -0.63 7.02 3.32 -1.97 -1.23 116.42 125.60 3d65 h ASP 165 Ca -0.51 0.05 -0.07 0.00 0.02 0.00 0.00 57.03 56.52 3d65 h ASP 165 Cb 1.27 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 40.75 3d65 h ASP 165 CO 0.60 0.22 0.13 0.77 -1.72 0.00 0.00 179.24 179.25 3d65 h SER 166 N 0.52 0.98 -0.69 6.45 4.64 -1.99 0.59 113.55 124.05 3d65 h SER 166 Ca 0.47 -0.24 -0.06 0.00 -0.47 0.00 0.00 61.79 61.49 3d65 h SER 166 Cb 1.01 -0.26 -0.03 0.00 -0.31 0.00 0.00 62.40 62.81 3d65 h SER 166 CO -0.20 0.97 0.21 0.28 -0.87 0.00 0.00 176.83 177.22 3d65 h SER 167 N 0.94 1.00 -0.07 4.97 0.02 -1.69 -0.50 113.55 118.22 3d65 h SER 167 Ca 0.20 -0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 3d65 h SER 167 Cb 0.39 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 62.66 3d65 h SER 167 CO 0.01 0.94 0.01 0.00 -1.14 0.00 0.00 176.83 176.65 3d65 h LYS 169 N -0.13 0.45 -0.59 0.00 1.57 -0.83 -1.69 116.57 115.36 3d65 h LYS 169 Ca 0.02 -0.12 -0.10 0.00 -1.87 0.00 0.00 60.65 58.58 3d65 h LYS 169 Cb 0.30 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 3d65 h LYS 169 CO 0.00 0.57 -0.02 1.03 -0.57 0.00 0.00 179.45 180.46 3d65 h SER 170 N 0.42 1.03 0.38 0.86 0.87 -0.90 -2.84 113.55 113.36 3d65 h SER 170 Ca 0.08 -0.30 -0.13 0.00 -1.23 0.00 0.00 61.79 60.21 3d65 h SER 170 Cb 0.47 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.14 3d65 h SER 170 CO 0.03 1.09 -0.54 0.00 -0.53 0.00 0.00 176.83 176.88 3d65 h ALA 171 N 1.01 0.99 -2.05 6.23 0.00 -0.78 -3.37 119.26 121.29 3d65 h ALA 171 Ca 0.16 -0.49 -0.56 0.00 0.00 0.00 0.00 54.91 54.02 3d65 h ALA 171 Cb 0.58 -0.09 -0.40 0.00 0.00 0.00 0.00 17.79 17.88 3d65 h ALA 171 CO 0.03 0.68 -1.00 0.66 0.00 0.00 0.00 179.25 179.63 3d65 n TYR 172 N -3.92 0.72 -1.68 0.00 4.02 -0.68 -4.96 117.16 110.66 3d65 n TYR 172 Ca -0.02 -3.74 -0.45 0.00 -0.01 0.00 0.00 57.90 53.68 3d65 n TYR 172 Cb 0.56 -0.41 -0.04 0.00 -0.02 0.00 0.00 39.34 39.43 3d65 n TYR 172 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 3d65 n PRO 173 N 1.05 2.35 -0.76 -0.72 -0.02 -1.08 -1.61 135.00 134.22 3d65 n PRO 173 Ca 0.24 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.57 3d65 n PRO 173 Cb 0.52 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 3d65 n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d65 n GLY 174 N 3.71 1.11 0.00 -1.23 0.00 -1.26 -4.85 105.19 102.67 3d65 n GLY 174 Ca 0.17 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.30 3d65 n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3d65 n GLN 175 N -2.00 0.10 -3.58 1.61 6.02 -0.63 -4.92 117.38 113.98 3d65 n GLN 175 Ca 0.00 -0.03 -0.41 0.00 -0.01 0.00 0.00 57.00 56.56 3d65 n GLN 175 Cb 0.00 -1.51 -0.11 0.00 1.02 0.00 0.00 30.24 29.65 3d65 n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3d65 s ILE 176 N -3.07 4.74 0.73 5.09 -1.09 -1.26 -5.02 121.20 121.32 3d65 s ILE 176 Ca 0.06 -0.70 -0.01 0.00 -2.23 0.00 0.00 60.65 57.77 3d65 s ILE 176 Cb 0.16 -3.59 0.13 0.00 -1.58 0.00 0.00 42.46 37.58 3d65 s ILE 176 CO 0.87 -0.18 1.00 0.42 -1.23 0.00 0.00 174.94 175.82 3d65 s THR 177 N 1.60 2.12 -1.07 2.92 -4.23 -1.26 -4.96 115.64 110.75 3d65 s THR 177 Ca 0.03 -0.59 0.14 0.00 -1.18 0.00 0.00 61.69 60.09 3d65 s THR 177 Cb -0.19 -2.53 0.14 0.00 1.34 0.00 0.00 72.50 71.26 3d65 s THR 177 CO 0.07 0.00 1.44 -1.54 -0.54 0.00 0.00 174.62 174.06 3d65 n SER 178 N -2.85 0.00 -1.46 3.99 3.41 -1.26 -2.13 113.62 113.32 3d65 n SER 178 Ca 0.15 0.43 0.07 0.00 -0.26 0.00 0.00 58.87 59.26 3d65 n SER 178 Cb 0.61 -0.46 0.31 0.00 -0.26 0.00 0.00 64.21 64.40 3d65 n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3d65 n ASN 179 N -1.46 4.30 -4.16 4.04 3.02 -1.26 -4.92 115.26 114.82 3d65 n ASN 179 Ca 0.04 -2.48 -0.18 0.00 -0.03 0.00 0.00 54.58 51.93 3d65 n ASN 179 Cb 0.16 -0.56 -0.12 0.00 -0.61 0.00 0.00 39.78 38.64 3d65 n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3d65 s MET 180 N -1.98 0.79 0.06 3.52 -1.94 -0.91 -0.56 119.30 118.28 3d65 s MET 180 Ca 0.43 -0.91 -0.03 0.00 -1.71 0.00 0.00 55.69 53.47 3d65 s MET 180 Cb 0.29 -0.77 -0.03 0.00 2.01 0.00 0.00 34.83 36.33 3d65 s MET 180 CO 0.19 0.17 0.03 -0.59 -0.01 0.00 0.00 175.02 174.81 3d65 s PHE 181 N -1.25 0.39 0.04 -0.03 -0.12 -0.29 -4.77 117.98 111.95 3d65 s PHE 181 Ca -0.03 -0.87 -0.00 0.00 -0.05 0.00 0.00 56.93 55.99 3d65 s PHE 181 Cb -0.10 -0.28 -0.04 0.00 -0.63 0.00 0.00 43.02 41.98 3d65 s PHE 181 CO 0.02 -0.41 0.16 0.00 -0.05 0.00 0.00 175.22 174.94 3d65 s ALA 183 N -1.40 -0.22 0.00 0.00 0.00 -0.74 -0.74 121.76 118.67 3d65 s ALA 183 Ca 0.30 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.16 3d65 s ALA 183 Cb -0.13 0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.03 3d65 s ALA 183 CO 0.23 -0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.24 3d65 n GLY 184 N 1.93 0.53 2.63 0.00 0.00 -0.62 -2.57 105.19 107.09 3d65 n GLY 184 Ca -0.20 -1.46 -0.24 0.00 0.00 0.00 0.00 46.02 44.12 3d65 n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d65 s TYR 184 N -3.61 0.15 0.51 1.61 1.51 -1.26 -4.29 117.35 111.97 3d65 s TYR 184 Ca 0.00 -0.16 0.27 0.00 -1.01 0.00 0.00 57.07 56.17 3d65 s TYR 184 Cb 0.00 -0.63 1.58 0.00 -0.11 0.00 0.00 41.96 42.80 3d65 s TYR 184 CO 0.00 -0.43 2.16 -0.07 -1.11 0.00 0.00 175.55 176.09 3d65 h LEU 185 N 8.42 0.00 0.00 -1.29 3.38 -1.95 -1.35 115.31 122.53 3d65 h LEU 185 Ca -0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.83 3d65 h LEU 185 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 3d65 h LEU 185 CO 0.26 0.06 0.00 -0.62 0.09 0.00 0.00 178.44 178.23 3d65 n GLU 186 N -3.85 0.08 0.00 1.13 4.71 -1.26 -0.38 120.64 121.07 3d65 n GLU 186 Ca -0.02 0.18 0.00 0.00 -0.01 0.00 0.00 57.16 57.30 3d65 n GLU 186 Cb 0.16 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.09 3d65 n GLU 186 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3d65 n GLY 187 N 0.26 -0.97 0.27 0.62 0.00 -0.51 -4.61 105.19 100.25 3d65 n GLY 187 Ca 0.06 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.42 3d65 n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d65 n GLY 188 N -0.96 3.34 2.67 -0.02 0.00 0.34 -4.93 105.19 105.62 3d65 n GLY 188 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 3d65 n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d65 s LYS 188 N -0.69 0.06 0.13 1.61 1.02 -1.26 -3.55 119.74 117.06 3d65 s LYS 188 Ca 0.00 0.11 -0.25 0.00 0.02 0.00 0.00 55.97 55.85 3d65 s LYS 188 Cb 0.00 -1.34 0.07 0.00 -0.52 0.00 0.00 37.83 36.04 3d65 s LYS 188 CO 0.00 -0.58 0.77 0.34 -0.92 0.00 0.00 175.35 174.97 3d65 s ASP 189 N 2.19 -0.38 0.91 2.83 3.68 -0.42 -4.26 116.67 121.22 3d65 s ASP 189 Ca 0.04 -0.18 -0.13 0.00 2.13 0.00 0.00 52.55 54.41 3d65 s ASP 189 Cb -0.15 0.53 0.14 0.00 -1.45 0.00 0.00 42.92 41.99 3d65 s ASP 189 CO -0.08 -0.91 1.17 -0.94 0.13 0.00 0.00 175.17 174.53 3d65 s SER 190 N -2.73 3.59 0.39 -0.34 1.04 -1.26 -0.27 113.70 114.11 3d65 s SER 190 Ca 0.06 0.81 -0.13 0.00 0.48 0.00 0.00 55.95 57.16 3d65 s SER 190 Cb -0.02 -1.27 0.05 0.00 0.10 0.00 0.00 66.02 64.88 3d65 s SER 190 CO -0.06 -2.49 0.75 0.00 0.98 0.00 0.00 173.24 172.42 3d65 n GLN 192 N -0.54 2.43 0.00 0.00 3.00 -1.26 -1.21 117.38 119.80 3d65 n GLN 192 Ca -0.08 0.86 0.00 0.00 -0.01 0.00 0.00 57.00 57.78 3d65 n GLN 192 Cb 0.59 -2.59 0.00 0.00 0.00 0.00 0.00 30.24 28.24 3d65 n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3d65 n GLY 193 N 2.12 2.26 0.07 1.08 0.00 -1.26 -0.21 105.19 109.25 3d65 n GLY 193 Ca 0.10 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.23 3d65 n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3d65 n ASP 194 N 0.00 0.62 -4.46 1.61 10.43 -0.35 -3.76 116.55 120.65 3d65 n ASP 194 Ca 0.00 0.13 -0.52 0.00 2.57 0.00 0.00 54.79 56.97 3d65 n ASP 194 Cb 0.00 0.80 -0.05 0.00 1.84 0.00 0.00 41.12 43.71 3d65 n ASP 194 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 3d65 n SER 195 N -2.39 -0.46 0.00 -2.24 7.64 -1.26 -1.54 113.62 113.37 3d65 n SER 195 Ca -0.00 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.02 3d65 n SER 195 Cb 0.52 -0.98 0.00 0.00 -1.01 0.00 0.00 64.21 62.74 3d65 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3d65 n GLY 196 N 1.80 1.82 3.92 0.23 0.00 0.43 -0.60 105.19 112.78 3d65 n GLY 196 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 3d65 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d65 s GLY 197 N -1.99 1.66 0.47 -0.02 0.00 -0.59 -3.30 107.32 103.55 3d65 s GLY 197 Ca 0.00 -0.86 -0.20 0.00 0.00 0.00 0.00 44.72 43.65 3d65 s GLY 197 CO 0.00 -0.34 1.00 2.56 0.00 0.00 0.00 173.10 176.33 3d65 s PRO 198 N -5.55 3.94 -0.26 2.90 0.04 -1.26 -1.24 135.00 133.58 3d65 s PRO 198 Ca 0.64 1.24 0.01 0.00 0.04 0.00 0.00 61.00 62.93 3d65 s PRO 198 Cb -0.09 -2.13 0.07 0.00 0.04 0.00 0.00 34.50 32.39 3d65 s PRO 198 CO 0.49 -0.29 -0.02 0.08 0.04 0.00 0.00 177.00 177.29 3d65 s VAL 199 N -2.12 1.51 -0.13 -0.36 1.01 -0.46 -3.23 120.40 116.62 3d65 s VAL 199 Ca 0.65 -1.36 -0.03 0.00 0.00 0.00 0.00 61.98 61.24 3d65 s VAL 199 Cb -0.13 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.36 3d65 s VAL 199 CO 0.19 -0.24 -0.04 -0.69 0.00 0.00 0.00 175.10 174.33 3d65 s VAL 200 N 1.38 3.93 -0.04 2.92 1.01 -0.38 -0.81 120.40 128.41 3d65 s VAL 200 Ca -0.02 -0.36 -0.01 0.00 0.00 0.00 0.00 61.98 61.60 3d65 s VAL 200 Cb -0.19 -2.69 0.03 0.00 0.00 0.00 0.00 36.38 33.53 3d65 s VAL 200 CO -0.09 0.53 0.01 0.00 0.00 0.00 0.00 175.10 175.55 3d65 n SER 202 N 4.66 -1.90 -0.31 0.00 7.64 -1.26 -1.40 113.62 121.06 3d65 n SER 202 Ca -0.16 -1.01 -0.04 0.00 1.01 0.00 0.00 58.87 58.67 3d65 n SER 202 Cb 0.50 -2.90 -0.02 0.00 -1.01 0.00 0.00 64.21 60.79 3d65 n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3d65 n GLY 203 N -1.72 0.64 3.24 0.23 0.00 -1.26 -5.01 105.19 101.30 3d65 n GLY 203 Ca -0.11 -0.30 -0.27 0.00 0.00 0.00 0.00 46.02 45.34 3d65 n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d65 s LYS 204 N -1.71 1.69 -0.67 1.61 -0.14 -0.49 -4.11 119.74 115.91 3d65 s LYS 204 Ca 0.00 -0.79 -0.26 0.00 -1.36 0.00 0.00 55.97 53.55 3d65 s LYS 204 Cb 0.00 -1.66 -0.01 0.00 -1.68 0.00 0.00 37.83 34.48 3d65 s LYS 204 CO 0.00 0.45 1.71 -1.17 -0.76 0.00 0.00 175.35 175.58 3d65 s LEU 209 N -0.60 3.25 -0.04 3.17 2.96 0.16 -0.44 118.68 127.15 3d65 s LEU 209 Ca 0.08 0.02 0.21 0.00 -0.22 0.00 0.00 54.13 54.23 3d65 s LEU 209 Cb -0.08 -2.54 -0.29 0.00 0.50 0.00 0.00 46.19 43.77 3d65 s LEU 209 CO -0.00 -2.25 0.46 0.00 -1.32 0.00 0.00 176.35 173.23 3d65 n GLN 210 N 9.21 0.66 -4.08 1.98 1.13 0.01 -4.18 117.38 122.11 3d65 n GLN 210 Ca 0.18 -0.13 -0.07 0.00 -1.94 0.00 0.00 57.00 55.03 3d65 n GLN 210 Cb 0.51 -1.55 -0.10 0.00 0.11 0.00 0.00 30.24 29.21 3d65 n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 3d65 s GLY 211 N -4.69 0.50 -0.05 1.08 0.00 -0.77 -1.63 107.32 101.75 3d65 s GLY 211 Ca -0.08 -1.19 0.04 0.00 0.00 0.00 0.00 44.72 43.49 3d65 s GLY 211 CO 0.88 -1.28 -0.18 -0.42 0.00 0.00 0.00 173.10 172.11 3d65 s ILE 212 N -3.93 1.49 0.08 0.90 1.01 -0.97 -1.35 121.20 118.43 3d65 s ILE 212 Ca 0.09 -0.73 -0.34 0.00 0.00 0.00 0.00 60.65 59.67 3d65 s ILE 212 Cb 0.08 -1.29 -0.13 0.00 0.01 0.00 0.00 42.46 41.13 3d65 s ILE 212 CO -0.09 0.43 1.72 0.52 0.00 0.00 0.00 174.94 177.52 3d65 n VAL 213 N 3.27 0.24 0.01 2.92 0.31 -0.37 -1.13 118.33 123.59 3d65 n VAL 213 Ca -0.19 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 3d65 n VAL 213 Cb 0.53 -1.74 0.00 0.00 -0.91 0.00 0.00 33.84 31.71 3d65 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 3d65 n SER 214 N 4.81 0.11 -3.59 4.52 2.88 -1.01 -0.42 113.62 120.92 3d65 n SER 214 Ca 0.19 0.05 -0.08 0.00 -1.33 0.00 0.00 58.87 57.70 3d65 n SER 214 Cb 0.30 -0.01 -0.01 0.00 -0.75 0.00 0.00 64.21 63.74 3d65 n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 3d65 s TRP 215 N -1.17 -0.02 -0.15 0.66 1.48 -0.79 -4.88 118.94 114.07 3d65 s TRP 215 Ca 0.00 -0.49 -0.34 0.00 -1.06 0.00 0.00 56.10 54.21 3d65 s TRP 215 Cb 0.00 0.68 0.14 0.00 -1.16 0.00 0.00 33.47 33.13 3d65 s TRP 215 CO 0.00 -1.31 1.30 0.20 -4.06 0.00 0.00 176.95 173.08 3d65 s GLY 216 N -2.98 -0.33 -0.42 3.67 0.00 -1.26 0.29 107.32 106.29 3d65 s GLY 216 Ca 0.14 1.35 -0.20 0.00 0.00 0.00 0.00 44.72 46.00 3d65 s GLY 216 CO 0.09 0.40 0.62 -0.45 0.00 0.00 0.00 173.10 173.76 3d65 s SER 217 N -2.47 6.33 0.91 1.64 0.15 -1.26 -4.91 113.70 114.09 3d65 s SER 217 Ca 0.12 -0.28 0.00 0.00 0.70 0.00 0.00 55.95 56.49 3d65 s SER 217 Cb 0.02 -2.31 0.00 0.00 -1.71 0.00 0.00 66.02 62.02 3d65 s SER 217 CO -0.04 -0.73 0.00 0.61 1.20 0.00 0.00 173.24 174.28 3d65 n GLY 219 N 4.98 0.93 2.94 9.45 0.00 -1.26 -4.67 105.19 117.57 3d65 n GLY 219 Ca -0.02 -0.78 -0.19 0.00 0.00 0.00 0.00 46.02 45.03 3d65 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d65 n ALA 221 N 3.49 -0.32 -1.81 0.00 0.00 -1.26 -4.62 120.51 116.00 3d65 n ALA 221 Ca -0.20 0.32 -0.33 0.00 0.00 0.00 0.00 53.44 53.24 3d65 n ALA 221 Cb 0.54 -2.02 -0.05 0.00 0.00 0.00 0.00 19.45 17.92 3d65 n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3d65 s GLN 221 N -3.76 3.99 0.27 0.00 -1.52 -1.26 -0.50 119.66 116.88 3d65 s GLN 221 Ca 0.00 1.14 -0.31 0.00 -1.95 0.00 0.00 55.36 54.24 3d65 s GLN 221 Cb 0.00 -2.14 -0.12 0.00 -0.22 0.00 0.00 33.01 30.53 3d65 s GLN 221 CO 0.00 -0.24 1.63 1.17 -0.25 0.00 0.00 175.29 177.59 3d65 n LYS 222 N -1.06 2.71 -1.79 2.91 4.81 -1.26 -2.43 118.16 122.05 3d65 n LYS 222 Ca 0.08 0.97 -0.21 0.00 -0.87 0.00 0.00 58.31 58.27 3d65 n LYS 222 Cb 0.54 -2.77 -0.07 0.00 0.02 0.00 0.00 35.03 32.75 3d65 n LYS 222 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 3d65 n ASN 223 N 2.59 -5.60 -3.24 3.14 5.15 0.49 -4.90 115.26 112.89 3d65 n ASN 223 Ca 0.10 0.40 -0.24 0.00 -0.60 0.00 0.00 54.58 54.24 3d65 n ASN 223 Cb 0.36 -4.88 -0.07 0.00 -0.53 0.00 0.00 39.78 34.67 3d65 n ASN 223 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 3d65 n LYS 224 N -2.53 1.32 -1.42 1.20 5.02 -1.02 -4.69 118.16 116.03 3d65 n LYS 224 Ca -0.22 -3.68 -0.29 0.00 -2.02 0.00 0.00 58.31 52.10 3d65 n LYS 224 Cb 0.69 -1.58 0.12 0.00 -0.02 0.00 0.00 35.03 34.25 3d65 n LYS 224 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3d65 s PRO 225 N -1.75 1.43 0.51 1.97 0.04 -1.26 -4.46 135.00 131.48 3d65 s PRO 225 Ca 0.37 0.57 -0.21 0.00 0.04 0.00 0.00 61.00 61.77 3d65 s PRO 225 Cb 0.19 -1.85 -0.06 0.00 0.04 0.00 0.00 34.50 32.82 3d65 s PRO 225 CO -0.08 -2.06 1.20 0.20 0.04 0.00 0.00 177.00 176.30 3d65 s GLY 226 N -3.77 2.76 -0.08 0.56 0.00 -1.06 -4.62 107.32 101.11 3d65 s GLY 226 Ca 0.63 0.99 0.02 0.00 0.00 0.00 0.00 44.72 46.36 3d65 s GLY 226 CO 0.55 1.42 -0.13 0.14 0.00 0.00 0.00 173.10 175.08 3d65 s VAL 227 N -1.56 3.11 -0.02 1.40 1.01 0.15 -1.79 120.40 122.69 3d65 s VAL 227 Ca 0.69 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 62.01 3d65 s VAL 227 Cb -0.30 -2.26 0.00 0.00 0.00 0.00 0.00 36.38 33.83 3d65 s VAL 227 CO 0.35 0.57 -0.07 -0.31 0.00 0.00 0.00 175.10 175.63 3d65 s TYR 228 N -0.32 0.79 0.23 5.22 2.02 0.12 -1.88 117.35 123.53 3d65 s TYR 228 Ca 0.03 -0.19 -0.31 0.00 -0.37 0.00 0.00 57.07 56.24 3d65 s TYR 228 Cb -0.13 -0.58 -0.11 0.00 -0.40 0.00 0.00 41.96 40.75 3d65 s TYR 228 CO 0.03 -0.09 1.55 0.99 -1.57 0.00 0.00 175.55 176.46 3d65 s THR 229 N 0.21 2.43 -0.98 -0.71 2.01 -0.28 -1.14 115.64 117.18 3d65 s THR 229 Ca -0.03 0.33 -0.21 0.00 0.31 0.00 0.00 61.69 62.09 3d65 s THR 229 Cb -0.08 -3.21 0.08 0.00 0.01 0.00 0.00 72.50 69.30 3d65 s THR 229 CO 0.00 0.04 1.32 -0.75 -0.69 0.00 0.00 174.62 174.54 3d65 s LYS 230 N 0.21 3.59 0.35 4.92 2.20 0.27 -2.29 119.74 129.00 3d65 s LYS 230 Ca 0.65 -1.37 0.06 0.00 -0.36 0.00 0.00 55.97 54.94 3d65 s LYS 230 Cb -0.45 -5.17 0.72 0.00 -1.51 0.00 0.00 37.83 31.42 3d65 s LYS 230 CO 0.40 -2.03 1.93 0.28 -0.36 0.00 0.00 175.35 175.57 3d65 h VAL 231 N 6.40 0.99 -0.00 4.02 2.07 -1.60 -1.92 116.25 126.21 3d65 h VAL 231 Ca 0.18 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.43 3d65 h VAL 231 Cb 1.02 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.91 3d65 h VAL 231 CO 1.30 0.14 0.03 0.00 0.02 0.00 0.00 177.57 179.06 3d65 n ASN 233 N -3.11 0.00 0.00 0.00 4.13 -0.72 -3.82 115.26 111.74 3d65 n ASN 233 Ca -0.03 -0.73 0.00 0.00 1.68 0.00 0.00 54.58 55.50 3d65 n ASN 233 Cb 0.10 -0.07 0.00 0.00 -1.54 0.00 0.00 39.78 38.27 3d65 n ASN 233 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 3d65 n TYR 234 N -1.07 0.00 -0.05 3.10 4.01 -0.14 -4.84 117.16 118.16 3d65 n TYR 234 Ca 0.20 -0.21 -0.04 0.00 -0.16 0.00 0.00 57.90 57.69 3d65 n TYR 234 Cb 0.13 -0.02 0.18 0.00 -0.31 0.00 0.00 39.34 39.32 3d65 n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 3d65 h VAL 235 N 1.19 1.25 -0.37 -0.72 2.07 -1.66 -0.92 116.25 117.09 3d65 h VAL 235 Ca 0.00 -1.11 -0.08 0.00 0.82 0.00 0.00 66.70 66.33 3d65 h VAL 235 Cb 0.62 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 3d65 h VAL 235 CO 0.00 0.37 -0.07 -1.28 0.02 0.00 0.00 177.57 176.62 3d65 h SER 236 N 0.60 0.71 -0.87 0.57 0.87 -1.89 -2.12 113.55 111.43 3d65 h SER 236 Ca 0.11 -0.35 0.07 0.00 -1.23 0.00 0.00 61.79 60.38 3d65 h SER 236 Cb 0.55 -0.19 -0.06 0.00 -0.44 0.00 0.00 62.40 62.26 3d65 h SER 236 CO 0.03 0.89 0.53 -0.25 -0.53 0.00 0.00 176.83 177.51 3d65 h TRP 237 N 0.51 0.99 0.36 2.24 7.01 -1.80 -0.13 115.95 125.12 3d65 h TRP 237 Ca 0.10 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.11 3d65 h TRP 237 Cb 0.57 -0.32 0.00 0.00 -2.10 0.00 0.00 29.16 27.31 3d65 h TRP 237 CO 0.05 0.49 -0.17 0.82 -2.79 0.00 0.00 178.44 176.83 3d65 h ILE 238 N 0.96 0.65 -0.68 2.65 2.04 -1.09 0.80 117.51 122.83 3d65 h ILE 238 Ca 0.38 -0.33 0.10 0.00 1.00 0.00 0.00 64.86 66.01 3d65 h ILE 238 Cb 0.20 0.82 -0.07 0.00 -0.74 0.00 0.00 36.82 37.03 3d65 h ILE 238 CO -0.18 0.06 0.31 0.11 0.00 0.00 0.00 178.15 178.45 3d65 h LYS 239 N -0.67 0.51 -0.16 2.37 1.57 -1.22 -0.48 116.57 118.50 3d65 h LYS 239 Ca -0.05 -0.03 -0.17 0.00 -1.87 0.00 0.00 60.65 58.53 3d65 h LYS 239 Cb 0.48 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 3d65 h LYS 239 CO 0.08 0.34 -0.60 1.96 -0.57 0.00 0.00 179.45 180.66 3d65 h GLN 240 N 0.53 0.52 -0.40 3.15 1.08 -0.90 -1.21 115.11 117.88 3d65 h GLN 240 Ca 0.34 -0.35 -0.09 0.00 -1.45 0.00 0.00 58.65 57.09 3d65 h GLN 240 Cb 0.39 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.86 3d65 h GLN 240 CO -0.29 0.97 -0.12 1.15 -0.95 0.00 0.00 178.83 179.59 3d65 h THR 241 N 0.39 1.28 -0.00 -0.54 2.02 -0.57 -1.72 112.91 113.76 3d65 h THR 241 Ca -0.00 -1.22 0.00 0.00 0.77 0.00 0.00 66.41 65.96 3d65 h THR 241 Cb 1.15 1.23 -0.00 0.00 -1.74 0.00 0.00 68.15 68.79 3d65 h THR 241 CO 0.11 0.41 0.00 0.40 0.37 0.00 0.00 175.52 176.81 3d65 h ILE 242 N 0.60 1.02 -0.05 3.11 2.04 -1.04 -2.74 117.51 120.46 3d65 h ILE 242 Ca 0.10 -0.07 0.01 0.00 1.00 0.00 0.00 64.86 65.91 3d65 h ILE 242 Cb 0.65 1.06 -0.00 0.00 -0.74 0.00 0.00 36.82 37.79 3d65 h ILE 242 CO 0.04 0.02 0.04 0.00 0.00 0.00 0.00 178.15 178.26 3d65 h ALA 243 N 0.97 1.82 -0.01 1.87 0.00 -1.15 -2.96 119.26 119.80 3d65 h ALA 243 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3d65 h ALA 243 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3d65 h ALA 243 CO -0.00 -0.07 -0.42 0.45 0.00 0.00 0.00 179.25 179.21 3d65 n SER 244 N -4.18 1.24 0.00 0.00 2.88 -0.65 -5.10 113.62 107.81 3d65 n SER 244 Ca -0.02 -0.99 0.00 0.00 -1.33 0.00 0.00 58.87 56.53 3d65 n SER 244 Cb 0.14 0.32 0.00 0.00 -0.75 0.00 0.00 64.21 63.92 3d65 n SER 244 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40