#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o39 s VAL 17 N 0.00 4.19 -1.17 1.39 1.01 -0.12 -3.89 120.40 121.80 1o39 s VAL 17 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.69 1o39 s VAL 17 Cb 0.00 -2.77 0.00 0.00 0.00 0.00 0.00 36.38 33.61 1o39 s VAL 17 CO 0.00 0.58 0.00 0.61 0.00 0.00 0.00 175.10 176.29 1o39 n GLY 18 N 2.44 1.22 0.00 4.51 0.00 -1.22 -1.70 105.19 110.44 1o39 n GLY 18 Ca -0.18 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.41 1o39 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o39 n GLY 19 N -1.44 1.56 3.20 -0.02 0.00 -1.26 -4.85 105.19 102.38 1o39 n GLY 19 Ca -0.11 -2.03 -0.12 0.00 0.00 0.00 0.00 46.02 43.76 1o39 n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1o39 s TYR 20 N 1.24 1.10 -0.06 1.61 1.13 0.34 -4.91 117.35 117.80 1o39 s TYR 20 Ca 0.00 -1.24 -0.30 0.00 -1.41 0.00 0.00 57.07 54.12 1o39 s TYR 20 Cb 0.00 -0.60 -0.04 0.00 -1.10 0.00 0.00 41.96 40.22 1o39 s TYR 20 CO 0.00 -0.48 1.34 0.99 -2.51 0.00 0.00 175.55 174.89 1o39 s THR 21 N -3.98 3.98 0.21 -3.49 2.01 -1.26 -0.46 115.64 112.64 1o39 s THR 21 Ca 0.30 1.29 -0.08 0.00 0.31 0.00 0.00 61.69 63.52 1o39 s THR 21 Cb 0.07 -3.83 0.12 0.00 0.01 0.00 0.00 72.50 68.87 1o39 s THR 21 CO 0.07 -0.04 1.72 0.00 -0.69 0.00 0.00 174.62 175.68 1o39 n GLY 23 N -0.67 2.73 3.65 0.00 0.00 -1.26 -4.76 105.19 104.88 1o39 n GLY 23 Ca 0.05 -1.50 -0.48 0.00 0.00 0.00 0.00 46.02 44.09 1o39 n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o39 n ALA 24 N 1.26 0.76 -2.70 4.61 0.00 -1.26 -2.43 120.51 120.76 1o39 n ALA 24 Ca 0.00 0.46 -0.17 0.00 0.00 0.00 0.00 53.44 53.73 1o39 n ALA 24 Cb 0.00 -2.29 -0.00 0.00 0.00 0.00 0.00 19.45 17.16 1o39 n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1o39 n ASN 25 N 3.34 -4.43 0.07 0.00 4.13 -1.26 -4.86 115.26 112.25 1o39 n ASN 25 Ca 0.18 -0.01 0.12 0.00 1.68 0.00 0.00 54.58 56.54 1o39 n ASN 25 Cb 0.26 -3.70 0.24 0.00 -1.54 0.00 0.00 39.78 35.04 1o39 n ASN 25 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1o39 n THR 26 N -3.73 0.41 -3.65 3.41 -2.24 -1.02 -4.17 114.28 103.29 1o39 n THR 26 Ca -0.13 -0.27 -0.27 0.00 -2.27 0.00 0.00 64.05 61.11 1o39 n THR 26 Cb 0.61 -0.25 -0.10 0.00 -2.10 0.00 0.00 70.33 68.49 1o39 n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1o39 n VAL 27 N -2.14 1.98 0.28 2.28 0.31 -1.26 -4.97 118.33 114.81 1o39 n VAL 27 Ca 0.04 -5.04 0.07 0.00 -0.01 0.00 0.00 64.34 59.40 1o39 n VAL 27 Cb 0.43 -2.14 0.34 0.00 -0.91 0.00 0.00 33.84 31.56 1o39 n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1o39 n PRO 28 N 1.40 0.08 0.00 5.55 -0.04 -1.26 -2.17 135.00 138.55 1o39 n PRO 28 Ca 0.25 0.44 0.12 0.00 -0.04 0.00 0.00 63.50 64.26 1o39 n PRO 28 Cb 0.38 -1.69 0.08 0.00 -0.04 0.00 0.00 33.50 32.23 1o39 n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1o39 n TYR 29 N -1.84 0.00 -2.52 0.54 4.11 -1.20 -1.71 117.16 114.54 1o39 n TYR 29 Ca 0.01 0.00 -0.41 0.00 -0.00 0.00 0.00 57.90 57.50 1o39 n TYR 29 Cb 0.11 -0.00 -0.04 0.00 -0.00 0.00 0.00 39.34 39.41 1o39 n TYR 29 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.86 175.72 1o39 s GLN 30 N -2.22 4.57 0.19 -3.48 2.00 -0.92 -0.57 119.66 119.24 1o39 s GLN 30 Ca 0.24 1.71 0.06 0.00 -2.00 0.00 0.00 55.36 55.37 1o39 s GLN 30 Cb 0.19 -3.30 -0.05 0.00 0.80 0.00 0.00 33.01 30.66 1o39 s GLN 30 CO 0.42 0.03 -0.12 0.14 -0.50 0.00 0.00 175.29 175.27 1o39 s VAL 31 N -0.02 1.50 -0.08 1.34 -7.23 -0.59 -4.50 120.40 110.81 1o39 s VAL 31 Ca 0.51 -2.15 0.03 0.00 -1.81 0.00 0.00 61.98 58.56 1o39 s VAL 31 Cb -0.29 -2.03 -0.02 0.00 0.56 0.00 0.00 36.38 34.61 1o39 s VAL 31 CO 0.34 -0.61 -0.16 -0.55 -0.31 0.00 0.00 175.10 173.81 1o39 s SER 32 N -3.28 3.86 -0.24 4.85 0.15 -0.47 -2.40 113.70 116.16 1o39 s SER 32 Ca 0.21 -0.30 -0.10 0.00 0.70 0.00 0.00 55.95 56.47 1o39 s SER 32 Cb 0.01 -1.16 -0.04 0.00 -1.71 0.00 0.00 66.02 63.12 1o39 s SER 32 CO 0.05 0.26 0.14 -0.76 1.20 0.00 0.00 173.24 174.12 1o39 s LEU 33 N -0.20 3.92 -0.06 3.45 1.43 -0.03 -1.08 118.68 126.11 1o39 s LEU 33 Ca -0.00 0.02 0.05 0.00 -1.03 0.00 0.00 54.13 53.17 1o39 s LEU 33 Cb -0.13 -2.05 -0.01 0.00 0.03 0.00 0.00 46.19 44.03 1o39 s LEU 33 CO 0.03 0.04 -0.23 0.21 0.23 0.00 0.00 176.35 176.63 1o39 s ASN 34 N 1.22 2.83 -0.31 2.29 3.84 -0.13 -2.05 114.94 122.64 1o39 s ASN 34 Ca 0.06 -0.48 0.16 0.00 0.21 0.00 0.00 52.86 52.82 1o39 s ASN 34 Cb -0.14 -0.86 0.47 0.00 -0.55 0.00 0.00 41.25 40.17 1o39 s ASN 34 CO 0.05 0.21 1.08 -1.54 -2.79 0.00 0.00 177.10 174.11 1o39 n SER 37 N 3.09 2.61 0.00 -4.21 3.41 -1.26 -1.33 113.62 115.93 1o39 n SER 37 Ca -0.18 -2.77 0.00 0.00 -0.26 0.00 0.00 58.87 55.66 1o39 n SER 37 Cb 0.52 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 1o39 n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1o39 n GLY 38 N -0.46 0.35 3.58 5.00 0.00 -1.26 -5.00 105.19 107.40 1o39 n GLY 38 Ca 0.19 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.14 1o39 n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1o39 s TYR 39 N -2.00 -0.30 -0.04 1.61 1.13 -1.26 -5.13 117.35 111.36 1o39 s TYR 39 Ca 0.00 0.10 -0.28 0.00 -1.41 0.00 0.00 57.07 55.48 1o39 s TYR 39 Cb 0.00 0.58 -0.03 0.00 -1.10 0.00 0.00 41.96 41.41 1o39 s TYR 39 CO 0.00 -0.68 0.89 -1.58 -2.51 0.00 0.00 175.55 171.66 1o39 s HIS 40 N -3.26 3.61 0.00 -3.49 5.65 -1.26 -4.28 115.29 112.26 1o39 s HIS 40 Ca 0.07 1.53 0.00 0.00 0.25 0.00 0.00 55.06 56.91 1o39 s HIS 40 Cb -0.01 -3.02 0.00 0.00 -1.18 0.00 0.00 32.58 28.37 1o39 s HIS 40 CO -0.06 -0.00 0.00 1.97 -0.65 0.00 0.00 174.74 176.00 1o39 n PHE 41 N 4.00 0.00 -3.89 3.88 -1.74 -0.87 -4.99 117.46 113.85 1o39 n PHE 41 Ca 0.04 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.84 1o39 n PHE 41 Cb 0.51 0.00 -0.04 0.00 1.52 0.00 0.00 39.48 41.47 1o39 n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1o39 n GLY 43 N -0.39 2.62 3.76 0.00 0.00 -0.04 -0.85 105.19 110.28 1o39 n GLY 43 Ca -0.05 -2.26 0.00 0.00 0.00 0.00 0.00 46.02 43.72 1o39 n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1o39 s GLY 44 N -3.74 -0.24 -0.04 -0.02 0.00 -1.01 -3.71 107.32 98.56 1o39 s GLY 44 Ca 0.30 0.30 0.04 0.00 0.00 0.00 0.00 44.72 45.35 1o39 s GLY 44 CO 0.19 1.48 -0.15 -0.56 0.00 0.00 0.00 173.10 174.05 1o39 s SER 45 N -3.19 1.96 -0.18 1.64 0.01 -0.03 -1.54 113.70 112.35 1o39 s SER 45 Ca 0.18 -0.32 -0.27 0.00 1.31 0.00 0.00 55.95 56.85 1o39 s SER 45 Cb 0.01 -0.51 -0.01 0.00 0.21 0.00 0.00 66.02 65.73 1o39 s SER 45 CO -0.01 0.14 0.91 -0.22 0.41 0.00 0.00 173.24 174.48 1o39 s LEU 46 N 0.03 4.15 -0.01 2.44 2.96 0.26 -0.93 118.68 127.59 1o39 s LEU 46 Ca -0.03 1.27 0.11 0.00 -0.22 0.00 0.00 54.13 55.26 1o39 s LEU 46 Cb -0.10 -3.36 -0.15 0.00 0.50 0.00 0.00 46.19 43.08 1o39 s LEU 46 CO 0.02 -0.49 0.38 2.30 -1.32 0.00 0.00 176.35 177.23 1o39 n ILE 47 N 4.93 0.00 -3.83 6.68 -5.35 -0.57 -1.53 119.36 119.70 1o39 n ILE 47 Ca 0.07 -0.25 -0.06 0.00 -0.27 0.00 0.00 62.75 62.24 1o39 n ILE 47 Cb 0.48 0.67 0.00 0.00 -1.74 0.00 0.00 39.64 39.05 1o39 n ILE 47 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1o39 s ASN 48 N -2.60 -0.10 0.12 7.28 2.20 -1.18 -4.57 114.94 116.08 1o39 s ASN 48 Ca 0.01 -0.79 0.15 0.00 -0.94 0.00 0.00 52.86 51.29 1o39 s ASN 48 Cb 0.08 0.70 0.67 0.00 -2.00 0.00 0.00 41.25 40.70 1o39 s ASN 48 CO 0.46 -1.34 1.47 -1.54 -2.94 0.00 0.00 177.10 173.21 1o39 n SER 49 N -0.95 0.27 0.00 3.54 3.41 -1.26 -3.06 113.62 115.57 1o39 n SER 49 Ca -0.06 0.58 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 1o39 n SER 49 Cb 0.60 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 1o39 n SER 49 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 1o39 n GLN 50 N -1.81 1.01 -4.17 4.33 7.27 -1.26 -0.69 117.38 122.06 1o39 n GLN 50 Ca 0.02 -0.88 -0.16 0.00 0.07 0.00 0.00 57.00 56.05 1o39 n GLN 50 Cb 0.13 -0.86 -0.14 0.00 2.41 0.00 0.00 30.24 31.78 1o39 n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1o39 s TRP 51 N -0.43 0.56 0.10 3.69 0.52 -1.17 -0.64 118.94 121.57 1o39 s TRP 51 Ca 0.00 -0.18 0.08 0.00 0.02 0.00 0.00 56.10 56.02 1o39 s TRP 51 Cb 0.00 -0.36 -0.03 0.00 -1.15 0.00 0.00 33.47 31.93 1o39 s TRP 51 CO 0.00 -0.02 -0.20 0.08 0.02 0.00 0.00 176.95 176.83 1o39 s VAL 52 N -0.40 1.63 -0.03 4.03 1.01 -0.38 -1.51 120.40 124.75 1o39 s VAL 52 Ca -0.00 -1.53 0.07 0.00 0.00 0.00 0.00 61.98 60.52 1o39 s VAL 52 Cb -0.04 -1.51 -0.02 0.00 0.00 0.00 0.00 36.38 34.82 1o39 s VAL 52 CO -0.00 -0.10 -0.24 -0.69 0.00 0.00 0.00 175.10 174.06 1o39 s VAL 53 N -1.24 2.20 0.00 2.92 1.01 -0.11 -1.00 120.40 124.17 1o39 s VAL 53 Ca 0.06 -1.05 0.00 0.00 0.00 0.00 0.00 61.98 60.99 1o39 s VAL 53 Cb -0.10 -1.77 0.00 0.00 0.00 0.00 0.00 36.38 34.51 1o39 s VAL 53 CO 0.04 0.58 0.00 -0.24 0.00 0.00 0.00 175.10 175.48 1o39 n SER 54 N 2.46 0.00 -4.90 3.32 2.88 -0.20 -0.85 113.62 116.33 1o39 n SER 54 Ca -0.16 -0.46 -0.33 0.00 -1.33 0.00 0.00 58.87 56.58 1o39 n SER 54 Cb 0.51 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.92 1o39 n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1o39 s ALA 55 N -1.58 3.91 0.40 -1.46 0.00 -1.26 -0.75 121.76 121.02 1o39 s ALA 55 Ca 0.00 -0.69 0.11 0.00 0.00 0.00 0.00 51.96 51.37 1o39 s ALA 55 Cb 0.00 -1.96 0.82 0.00 0.00 0.00 0.00 23.12 21.98 1o39 s ALA 55 CO 0.00 0.72 1.92 0.00 0.00 0.00 0.00 175.76 178.40 1o39 h ALA 56 N 3.65 1.53 0.00 0.00 0.00 -1.69 -1.71 119.26 121.04 1o39 h ALA 56 Ca -0.48 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1o39 h ALA 56 Cb 1.18 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1o39 h ALA 56 CO 0.70 0.34 0.00 -2.39 0.00 0.00 0.00 179.25 177.90 1o39 n HIS 57 N -4.26 0.00 1.02 0.00 1.44 -1.26 -1.73 115.22 110.42 1o39 n HIS 57 Ca -0.01 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.82 1o39 n HIS 57 Cb 0.28 -0.00 0.23 0.00 0.12 0.00 0.00 29.99 30.62 1o39 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1o39 s TYR 59 N -1.91 2.56 -0.08 0.00 6.14 -0.71 -5.00 117.35 118.35 1o39 s TYR 59 Ca 0.32 1.39 -0.32 0.00 0.64 0.00 0.00 57.07 59.10 1o39 s TYR 59 Cb 0.20 -3.71 0.13 0.00 0.42 0.00 0.00 41.96 39.00 1o39 s TYR 59 CO 0.31 -2.45 1.31 -1.59 0.64 0.00 0.00 175.55 173.77 1o39 s LYS 60 N -2.61 0.28 0.37 4.97 -2.85 -1.26 -5.15 119.74 113.49 1o39 s LYS 60 Ca 0.64 -0.14 0.03 0.00 -1.00 0.00 0.00 55.97 55.50 1o39 s LYS 60 Cb -0.38 0.10 -0.01 0.00 -2.06 0.00 0.00 37.83 35.48 1o39 s LYS 60 CO 0.47 -0.13 0.55 -1.54 0.10 0.00 0.00 175.35 174.80 1o39 s SER 61 N -2.78 5.98 -0.37 0.03 1.04 -1.26 -4.57 113.70 111.76 1o39 s SER 61 Ca 0.13 0.08 -0.01 0.00 0.48 0.00 0.00 55.95 56.63 1o39 s SER 61 Cb 0.04 -1.48 -0.01 0.00 0.10 0.00 0.00 66.02 64.67 1o39 s SER 61 CO -0.04 -0.49 0.32 0.61 0.98 0.00 0.00 173.24 174.61 1o39 n GLY 62 N -1.80 0.20 3.57 7.32 0.00 -1.26 -5.03 105.19 108.19 1o39 n GLY 62 Ca -0.01 -0.17 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 1o39 n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1o39 s ILE 63 N -3.12 4.09 -0.09 -0.61 1.01 -1.26 -4.44 121.20 116.77 1o39 s ILE 63 Ca 0.06 -0.31 0.03 0.00 0.00 0.00 0.00 60.65 60.44 1o39 s ILE 63 Cb -0.01 -2.76 -0.01 0.00 0.01 0.00 0.00 42.46 39.69 1o39 s ILE 63 CO 0.24 0.53 -0.19 -1.58 0.00 0.00 0.00 174.94 173.94 1o39 s GLN 64 N -0.11 2.96 -0.17 2.79 0.74 -0.44 -2.28 119.66 123.14 1o39 s GLN 64 Ca 0.03 -0.79 -0.12 0.00 0.05 0.00 0.00 55.36 54.53 1o39 s GLN 64 Cb -0.13 -2.39 -0.05 0.00 1.10 0.00 0.00 33.01 31.55 1o39 s GLN 64 CO 0.02 0.30 0.24 0.08 -0.55 0.00 0.00 175.29 175.38 1o39 s VAL 65 N 0.07 5.34 -0.23 1.34 1.01 0.85 -0.95 120.40 127.82 1o39 s VAL 65 Ca -0.08 0.42 0.00 0.00 0.00 0.00 0.00 61.98 62.32 1o39 s VAL 65 Cb -0.15 -3.57 0.03 0.00 0.00 0.00 0.00 36.38 32.69 1o39 s VAL 65 CO 0.05 0.42 -0.11 -0.13 0.00 0.00 0.00 175.10 175.34 1o39 s ARG 65 N 0.33 2.72 0.18 2.72 0.52 -0.24 -1.16 118.95 124.03 1o39 s ARG 65 Ca 0.14 -1.03 0.05 0.00 -0.52 0.00 0.00 55.73 54.37 1o39 s ARG 65 Cb -0.12 -2.86 -0.04 0.00 0.52 0.00 0.00 34.95 32.45 1o39 s ARG 65 CO 0.02 -0.40 0.15 -0.51 0.02 0.00 0.00 175.30 174.59 1o39 s LEU 66 N 1.26 3.81 -1.41 2.53 1.02 -0.12 -1.37 118.68 124.40 1o39 s LEU 66 Ca -0.01 -0.15 0.00 0.00 0.02 0.00 0.00 54.13 53.99 1o39 s LEU 66 Cb -0.17 -2.41 0.00 0.00 0.02 0.00 0.00 46.19 43.64 1o39 s LEU 66 CO -0.07 0.05 0.00 0.61 0.02 0.00 0.00 176.35 176.96 1o39 n GLY 69 N -0.52 0.75 3.87 -3.19 0.00 -1.26 -1.31 105.19 103.53 1o39 n GLY 69 Ca -0.08 -0.31 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 1o39 n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1o39 s GLU 70 N -3.88 3.84 0.00 1.61 0.41 -1.26 -4.00 118.70 115.41 1o39 s GLU 70 Ca 0.00 0.53 0.00 0.00 -0.41 0.00 0.00 54.97 55.09 1o39 s GLU 70 Cb 0.00 -2.40 0.00 0.00 -1.78 0.00 0.00 34.13 29.95 1o39 s GLU 70 CO 0.00 0.01 0.00 -3.47 -0.49 0.00 0.00 175.26 171.31 1o39 n ASP 71 N -1.05 -0.00 -4.53 -0.19 4.64 -1.26 -4.62 116.55 109.54 1o39 n ASP 71 Ca 0.03 0.00 -0.42 0.00 -1.38 0.00 0.00 54.79 53.01 1o39 n ASP 71 Cb 0.54 0.05 -0.07 0.00 -1.04 0.00 0.00 41.12 40.60 1o39 n ASP 71 CO 0.00 0.00 0.00 0.21 -0.82 0.00 0.00 177.20 176.59 1o39 s ASN 72 N -3.71 6.33 0.00 1.67 3.84 -1.26 -2.90 114.94 118.91 1o39 s ASN 72 Ca 0.00 -0.23 0.22 0.00 0.21 0.00 0.00 52.86 53.06 1o39 s ASN 72 Cb 0.00 -2.30 0.98 0.00 -0.55 0.00 0.00 41.25 39.38 1o39 s ASN 72 CO 0.00 -0.68 1.70 2.30 -2.79 0.00 0.00 177.10 177.63 1o39 n ILE 73 N 5.70 0.45 0.85 -5.21 -5.35 -0.22 -3.18 119.36 112.41 1o39 n ILE 73 Ca -0.03 0.11 0.10 0.00 -0.27 0.00 0.00 62.75 62.67 1o39 n ILE 73 Cb 0.48 -0.74 0.04 0.00 -1.74 0.00 0.00 39.64 37.68 1o39 n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1o39 n ASN 74 N -1.43 2.27 -4.04 7.28 3.02 -1.26 -4.96 115.26 116.13 1o39 n ASN 74 Ca 0.07 -1.63 -0.21 0.00 -0.03 0.00 0.00 54.58 52.78 1o39 n ASN 74 Cb 0.23 0.23 -0.15 0.00 -0.61 0.00 0.00 39.78 39.48 1o39 n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1o39 s VAL 75 N -1.92 0.88 -0.20 2.41 1.01 -1.19 -5.11 120.40 116.28 1o39 s VAL 75 Ca 0.20 -0.45 -0.21 0.00 0.00 0.00 0.00 61.98 61.52 1o39 s VAL 75 Cb 0.16 -0.76 -0.02 0.00 0.00 0.00 0.00 36.38 35.76 1o39 s VAL 75 CO 0.36 0.26 0.64 -0.69 0.00 0.00 0.00 175.10 175.68 1o39 s VAL 76 N -0.07 5.01 0.00 2.92 1.01 -1.26 -4.72 120.40 123.28 1o39 s VAL 76 Ca 0.01 1.21 0.00 0.00 0.00 0.00 0.00 61.98 63.20 1o39 s VAL 76 Cb -0.06 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.36 1o39 s VAL 76 CO 0.00 0.10 0.03 -0.62 0.00 0.00 0.00 175.10 174.61 1o39 n GLU 77 N 5.12 5.75 0.00 2.72 1.02 -1.26 -5.11 120.64 128.88 1o39 n GLU 77 Ca -0.01 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.10 1o39 n GLU 77 Cb 0.50 -0.48 0.00 0.00 -0.02 0.00 0.00 31.44 31.43 1o39 n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1o39 n GLY 78 N 0.83 3.00 2.31 0.62 0.00 -1.26 -5.01 105.19 105.68 1o39 n GLY 78 Ca 0.00 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.19 1o39 n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1o39 n ASN 79 N 0.00 0.00 -4.81 1.61 3.02 -1.26 -4.96 115.26 108.86 1o39 n ASN 79 Ca 0.00 0.00 -0.34 0.00 -0.03 0.00 0.00 54.58 54.21 1o39 n ASN 79 Cb 0.00 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 1o39 n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1o39 s GLU 80 N -0.23 4.14 -0.05 3.52 8.01 -1.26 -4.25 118.70 128.58 1o39 s GLU 80 Ca 0.00 1.22 -0.01 0.00 0.01 0.00 0.00 54.97 56.19 1o39 s GLU 80 Cb 0.00 -2.22 0.03 0.00 -4.31 0.00 0.00 34.13 27.62 1o39 s GLU 80 CO 0.00 -0.12 0.01 -0.65 0.01 0.00 0.00 175.26 174.52 1o39 s GLN 81 N -3.07 0.38 -0.27 1.61 -0.21 -0.43 -4.97 119.66 112.69 1o39 s GLN 81 Ca 0.62 0.16 -0.05 0.00 0.02 0.00 0.00 55.36 56.11 1o39 s GLN 81 Cb -0.12 -0.73 0.01 0.00 1.00 0.00 0.00 33.01 33.16 1o39 s GLN 81 CO 0.16 -0.26 0.02 -0.06 -2.12 0.00 0.00 175.29 173.03 1o39 s PHE 82 N 1.75 3.09 -0.02 0.91 0.08 -1.26 -0.94 117.98 121.59 1o39 s PHE 82 Ca 0.01 -1.12 0.04 0.00 0.12 0.00 0.00 56.93 55.98 1o39 s PHE 82 Cb -0.13 -2.17 -0.01 0.00 -0.57 0.00 0.00 43.02 40.15 1o39 s PHE 82 CO -0.04 -0.61 -0.12 0.42 -0.10 0.00 0.00 175.22 174.78 1o39 s ILE 83 N 1.45 0.99 0.51 0.64 1.01 -0.31 -4.97 121.20 120.52 1o39 s ILE 83 Ca 0.03 -0.51 -0.13 0.00 0.00 0.00 0.00 60.65 60.03 1o39 s ILE 83 Cb -0.16 -0.84 -0.06 0.00 0.01 0.00 0.00 42.46 41.41 1o39 s ILE 83 CO -0.00 0.29 0.92 -0.44 0.00 0.00 0.00 174.94 175.70 1o39 s SER 84 N -0.15 6.47 0.13 3.58 0.01 -1.26 -0.10 113.70 122.38 1o39 s SER 84 Ca 0.02 1.36 -0.25 0.00 1.31 0.00 0.00 55.95 58.39 1o39 s SER 84 Cb -0.06 -2.43 -0.07 0.00 0.21 0.00 0.00 66.02 63.67 1o39 s SER 84 CO -0.00 -0.60 0.78 0.00 0.41 0.00 0.00 173.24 173.83 1o39 s ALA 85 N -2.69 3.42 -0.14 1.44 0.00 -0.97 -0.48 121.76 122.35 1o39 s ALA 85 Ca 0.55 0.34 -0.20 0.00 0.00 0.00 0.00 51.96 52.66 1o39 s ALA 85 Cb -0.10 -2.98 -0.25 0.00 0.00 0.00 0.00 23.12 19.79 1o39 s ALA 85 CO 0.38 0.22 0.50 0.66 0.00 0.00 0.00 175.76 177.52 1o39 h SER 86 N 4.74 0.21 -5.07 0.00 4.64 -0.81 -3.43 113.55 113.82 1o39 h SER 86 Ca -0.46 -0.78 -0.07 0.00 -0.47 0.00 0.00 61.79 60.00 1o39 h SER 86 Cb 1.21 -0.07 -0.15 0.00 -0.31 0.00 0.00 62.40 63.08 1o39 h SER 86 CO 0.67 1.47 -0.17 -1.59 -0.87 0.00 0.00 176.83 176.35 1o39 s LYS 87 N -2.40 0.94 -0.07 4.77 -2.85 -1.21 -5.00 119.74 113.92 1o39 s LYS 87 Ca -0.22 -0.62 0.03 0.00 -1.00 0.00 0.00 55.97 54.16 1o39 s LYS 87 Cb 0.03 0.41 0.00 0.00 -2.06 0.00 0.00 37.83 36.22 1o39 s LYS 87 CO 0.70 -0.33 -0.17 -1.12 0.10 0.00 0.00 175.35 174.53 1o39 s SER 88 N -2.45 2.31 -0.33 0.03 0.01 -1.26 -0.98 113.70 111.02 1o39 s SER 88 Ca -0.01 -0.40 0.00 0.00 1.31 0.00 0.00 55.95 56.86 1o39 s SER 88 Cb 0.01 -0.94 0.08 0.00 0.21 0.00 0.00 66.02 65.38 1o39 s SER 88 CO -0.08 0.11 0.05 -0.63 0.41 0.00 0.00 173.24 173.10 1o39 s ILE 89 N 0.38 2.77 0.23 1.44 1.01 0.67 -4.96 121.20 122.75 1o39 s ILE 89 Ca -0.13 -1.84 -0.24 0.00 0.00 0.00 0.00 60.65 58.44 1o39 s ILE 89 Cb -0.15 -2.79 -0.09 0.00 0.01 0.00 0.00 42.46 39.44 1o39 s ILE 89 CO 0.05 -0.37 0.81 -0.69 0.00 0.00 0.00 174.94 174.73 1o39 s VAL 90 N 1.11 4.38 0.22 2.92 1.01 -1.26 -1.35 120.40 127.44 1o39 s VAL 90 Ca 0.02 1.61 -0.32 0.00 0.00 0.00 0.00 61.98 63.29 1o39 s VAL 90 Cb -0.20 -4.02 -0.14 0.00 0.00 0.00 0.00 36.38 32.02 1o39 s VAL 90 CO -0.04 0.31 1.45 1.57 0.00 0.00 0.00 175.10 178.39 1o39 n HIS 91 N 1.01 2.19 0.08 5.22 -0.00 -0.90 -4.84 115.22 117.99 1o39 n HIS 91 Ca -0.02 0.39 0.17 0.00 0.46 0.00 0.00 57.72 58.72 1o39 n HIS 91 Cb 0.50 -2.48 0.70 0.00 -0.12 0.00 0.00 29.99 28.59 1o39 n HIS 91 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1o39 h PRO 92 N 4.64 0.00 -0.59 1.57 0.11 -1.93 -2.39 132.00 133.41 1o39 h PRO 92 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1o39 h PRO 92 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1o39 h PRO 92 CO 0.79 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 179.01 1o39 n SER 93 N -4.32 5.61 -4.74 -2.05 7.64 -1.26 -4.97 113.62 109.53 1o39 n SER 93 Ca 0.06 -2.86 -0.41 0.00 1.01 0.00 0.00 58.87 56.67 1o39 n SER 93 Cb 0.46 -0.67 -0.02 0.00 -1.01 0.00 0.00 64.21 62.97 1o39 n SER 93 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1o39 s TYR 94 N -2.62 3.04 -0.24 1.43 6.04 -0.90 -4.66 117.35 119.43 1o39 s TYR 94 Ca 0.54 1.01 0.02 0.00 0.04 0.00 0.00 57.07 58.68 1o39 s TYR 94 Cb 0.40 -3.81 0.04 0.00 -1.04 0.00 0.00 41.96 37.56 1o39 s TYR 94 CO 0.17 -2.66 -0.13 1.21 -1.54 0.00 0.00 175.55 172.61 1o39 s ASN 95 N 0.42 4.06 0.25 4.32 3.84 -0.95 -5.00 114.94 121.88 1o39 s ASN 95 Ca 0.60 -1.12 0.23 0.00 0.21 0.00 0.00 52.86 52.79 1o39 s ASN 95 Cb -0.42 -1.55 0.98 0.00 -0.55 0.00 0.00 41.25 39.71 1o39 s ASN 95 CO 0.42 -0.13 1.70 -1.54 -2.79 0.00 0.00 177.10 174.76 1o39 n SER 96 N 4.52 0.65 0.02 -4.21 3.41 -1.26 -0.89 113.62 115.86 1o39 n SER 96 Ca -0.16 0.66 -0.11 0.00 -0.26 0.00 0.00 58.87 59.00 1o39 n SER 96 Cb 0.45 -0.80 -0.14 0.00 -0.26 0.00 0.00 64.21 63.46 1o39 n SER 96 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1o39 h ASN 97 N 0.00 0.13 0.00 4.04 2.35 -1.97 -3.38 115.58 116.75 1o39 h ASN 97 Ca 0.00 -0.22 -0.04 0.00 -0.55 0.00 0.00 56.30 55.50 1o39 h ASN 97 Cb 0.35 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 1o39 h ASN 97 CO 0.00 1.18 -1.73 0.35 -1.65 0.00 0.00 177.43 175.59 1o39 n THR 98 N -3.25 0.14 -1.79 2.81 -2.24 -1.15 -4.97 114.28 103.83 1o39 n THR 98 Ca -0.14 -0.38 -0.07 0.00 -2.27 0.00 0.00 64.05 61.19 1o39 n THR 98 Cb 1.02 0.04 -0.01 0.00 -2.10 0.00 0.00 70.33 69.28 1o39 n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1o39 n LEU 99 N -2.10 -1.02 -4.76 3.22 4.77 -0.07 -5.00 117.00 112.04 1o39 n LEU 99 Ca -0.06 0.06 -0.40 0.00 -0.03 0.00 0.00 56.01 55.58 1o39 n LEU 99 Cb 0.48 -1.33 -0.05 0.00 -2.33 0.00 0.00 43.42 40.19 1o39 n LEU 99 CO 0.31 -0.19 0.74 0.21 -1.33 0.00 0.00 177.39 177.14 1o39 s ASN 100 N -2.77 7.40 -0.88 -1.43 2.47 -1.22 -3.07 114.94 115.44 1o39 s ASN 100 Ca 0.00 2.16 -0.03 0.00 0.42 0.00 0.00 52.86 55.40 1o39 s ASN 100 Cb 0.00 -2.62 0.00 0.00 -1.45 0.00 0.00 41.25 37.18 1o39 s ASN 100 CO 0.00 -0.04 0.75 0.59 -3.72 0.00 0.00 177.10 174.68 1o39 n ASN 101 N 1.32 -3.61 -4.03 -4.21 3.02 -1.26 -2.25 115.26 104.24 1o39 n ASN 101 Ca -0.01 -0.40 -0.43 0.00 -0.03 0.00 0.00 54.58 53.72 1o39 n ASN 101 Cb 0.46 -3.63 0.00 0.00 -0.61 0.00 0.00 39.78 35.99 1o39 n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1o39 n ASP 102 N -2.00 4.60 -3.90 6.41 2.03 -1.17 -4.39 116.55 118.13 1o39 n ASP 102 Ca -0.09 -2.95 -0.11 0.00 0.52 0.00 0.00 54.79 52.16 1o39 n ASP 102 Cb 0.58 -1.61 -0.11 0.00 -0.72 0.00 0.00 41.12 39.25 1o39 n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1o39 s ILE 103 N 2.39 0.07 -0.03 5.18 2.07 -1.26 -3.75 121.20 125.87 1o39 s ILE 103 Ca 0.46 -0.60 -0.08 0.00 -1.41 0.00 0.00 60.65 59.01 1o39 s ILE 103 Cb 0.09 -0.29 0.01 0.00 0.13 0.00 0.00 42.46 42.39 1o39 s ILE 103 CO -0.02 -0.33 0.19 -0.32 -1.91 0.00 0.00 174.94 172.55 1o39 s MET 104 N -1.06 0.41 -0.06 3.50 -2.45 0.07 -2.12 119.30 117.60 1o39 s MET 104 Ca -0.12 -0.10 0.02 0.00 -1.25 0.00 0.00 55.69 54.25 1o39 s MET 104 Cb -0.07 0.18 -0.03 0.00 1.25 0.00 0.00 34.83 36.17 1o39 s MET 104 CO 0.00 -0.09 -0.11 -0.51 1.05 0.00 0.00 175.02 175.36 1o39 s LEU 105 N -0.78 2.94 -0.06 4.11 1.43 -0.45 -1.03 118.68 124.83 1o39 s LEU 105 Ca -0.09 -0.12 0.04 0.00 -1.03 0.00 0.00 54.13 52.94 1o39 s LEU 105 Cb -0.05 -1.62 -0.00 0.00 0.03 0.00 0.00 46.19 44.55 1o39 s LEU 105 CO 0.01 0.35 -0.20 -0.63 0.23 0.00 0.00 176.35 176.12 1o39 s ILE 106 N -0.78 1.66 -0.12 -0.59 1.01 -0.17 -0.24 121.20 121.98 1o39 s ILE 106 Ca 0.12 -0.83 -0.06 0.00 0.00 0.00 0.00 60.65 59.88 1o39 s ILE 106 Cb -0.11 -1.43 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 1o39 s ILE 106 CO 0.01 0.47 0.09 -0.75 0.00 0.00 0.00 174.94 174.77 1o39 s LYS 107 N 0.12 3.44 0.26 2.79 2.20 -0.15 -1.25 119.74 127.14 1o39 s LYS 107 Ca -0.08 -0.24 -0.12 0.00 -0.36 0.00 0.00 55.97 55.18 1o39 s LYS 107 Cb -0.14 -3.10 -0.08 0.00 -1.51 0.00 0.00 37.83 33.00 1o39 s LYS 107 CO 0.04 0.66 0.62 -0.51 -0.36 0.00 0.00 175.35 175.80 1o39 s LEU 108 N -0.72 4.13 0.26 5.43 1.43 0.18 -0.20 118.68 129.20 1o39 s LEU 108 Ca 0.13 1.05 -0.05 0.00 -1.03 0.00 0.00 54.13 54.23 1o39 s LEU 108 Cb -0.12 -3.83 0.31 0.00 0.03 0.00 0.00 46.19 42.58 1o39 s LEU 108 CO 0.03 -0.12 1.94 0.50 0.23 0.00 0.00 176.35 178.92 1o39 h LYS 109 N 2.43 1.27 -4.40 1.70 3.64 -1.05 -3.41 116.57 116.75 1o39 h LYS 109 Ca -0.47 -0.08 -0.17 0.00 -1.27 0.00 0.00 60.65 58.67 1o39 h LYS 109 Cb 1.17 -0.29 -0.15 0.00 -0.41 0.00 0.00 32.23 32.56 1o39 h LYS 109 CO 0.68 0.84 -0.67 -1.54 -2.27 0.00 0.00 179.45 176.48 1o39 s SER 110 N -6.15 0.58 0.45 4.20 1.04 -1.26 -4.98 113.70 107.58 1o39 s SER 110 Ca -0.13 -1.08 -0.22 0.00 0.48 0.00 0.00 55.95 55.01 1o39 s SER 110 Cb 0.18 0.21 -0.09 0.00 0.10 0.00 0.00 66.02 66.42 1o39 s SER 110 CO 0.81 -0.62 1.05 0.00 0.98 0.00 0.00 173.24 175.46 1o39 s ALA 111 N -3.90 2.96 0.61 5.32 0.00 -1.26 -4.83 121.76 120.66 1o39 s ALA 111 Ca 0.14 0.66 -0.09 0.00 0.00 0.00 0.00 51.96 52.66 1o39 s ALA 111 Cb 0.07 -3.27 -0.02 0.00 0.00 0.00 0.00 23.12 19.90 1o39 s ALA 111 CO -0.05 -0.29 0.98 0.00 0.00 0.00 0.00 175.76 176.41 1o39 s ALA 112 N -1.84 3.14 -0.33 0.00 0.00 0.13 -5.00 121.76 117.86 1o39 s ALA 112 Ca 0.64 -0.29 -0.14 0.00 0.00 0.00 0.00 51.96 52.17 1o39 s ALA 112 Cb -0.19 -2.92 -0.02 0.00 0.00 0.00 0.00 23.12 19.99 1o39 s ALA 112 CO 0.23 -0.73 0.29 -1.54 0.00 0.00 0.00 175.76 174.02 1o39 s SER 113 N -4.22 6.12 0.18 0.00 1.04 -1.26 -4.89 113.70 110.67 1o39 s SER 113 Ca 0.54 -0.23 -0.15 0.00 0.48 0.00 0.00 55.95 56.59 1o39 s SER 113 Cb -0.11 -2.17 -0.07 0.00 0.10 0.00 0.00 66.02 63.77 1o39 s SER 113 CO 0.51 -0.25 0.59 -0.76 0.98 0.00 0.00 173.24 174.31 1o39 s LEU 114 N 1.88 4.30 0.00 2.42 1.43 -1.26 -4.79 118.68 122.66 1o39 s LEU 114 Ca 0.09 1.13 0.00 0.00 -1.03 0.00 0.00 54.13 54.32 1o39 s LEU 114 Cb -0.17 -3.43 0.00 0.00 0.03 0.00 0.00 46.19 42.62 1o39 s LEU 114 CO 0.11 0.05 0.00 -0.46 0.23 0.00 0.00 176.35 176.28 1o39 n ASN 115 N 0.59 0.02 0.11 2.29 0.23 0.39 -4.97 115.26 113.93 1o39 n ASN 115 Ca -0.03 0.00 0.12 0.00 -0.53 0.00 0.00 54.58 54.14 1o39 n ASN 115 Cb 0.52 0.00 0.18 0.00 -2.08 0.00 0.00 39.78 38.39 1o39 n ASN 115 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1o39 h SER 116 N 0.00 0.00 0.55 0.53 4.64 -2.00 -3.31 113.55 113.96 1o39 h SER 116 Ca 0.00 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1o39 h SER 116 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1o39 h SER 116 CO 0.00 0.04 -1.37 0.54 -0.87 0.00 0.00 176.83 175.17 1o39 n ARG 117 N -2.49 0.58 -3.77 4.77 3.00 -1.26 -4.75 116.66 112.73 1o39 n ARG 117 Ca 0.03 -0.01 -0.27 0.00 -0.01 0.00 0.00 57.85 57.59 1o39 n ARG 117 Cb 0.48 -1.68 -0.17 0.00 0.00 0.00 0.00 32.46 31.09 1o39 n ARG 117 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1o39 s VAL 118 N -3.40 0.61 0.07 1.55 1.01 -1.25 -4.44 120.40 114.55 1o39 s VAL 118 Ca -0.03 -0.42 -0.07 0.00 0.00 0.00 0.00 61.98 61.46 1o39 s VAL 118 Cb 0.12 -0.97 -0.01 0.00 0.00 0.00 0.00 36.38 35.52 1o39 s VAL 118 CO 0.84 -0.04 0.14 0.00 0.00 0.00 0.00 175.10 176.04 1o39 s ALA 119 N 1.84 -0.11 0.54 5.51 0.00 -0.69 -0.46 121.76 128.39 1o39 s ALA 119 Ca 0.01 -0.65 -0.03 0.00 0.00 0.00 0.00 51.96 51.29 1o39 s ALA 119 Cb -0.16 0.38 0.01 0.00 0.00 0.00 0.00 23.12 23.36 1o39 s ALA 119 CO -0.07 -0.44 0.80 -1.54 0.00 0.00 0.00 175.76 174.51 1o39 s SER 120 N -2.64 5.61 0.15 0.00 1.04 -1.26 -3.26 113.70 113.34 1o39 s SER 120 Ca 0.02 0.45 0.09 0.00 0.48 0.00 0.00 55.95 57.00 1o39 s SER 120 Cb 0.04 -1.52 -0.04 0.00 0.10 0.00 0.00 66.02 64.60 1o39 s SER 120 CO -0.09 -0.96 -0.15 -0.51 0.98 0.00 0.00 173.24 172.52 1o39 s ILE 121 N -2.81 2.98 0.34 -1.02 1.10 -0.58 -4.87 121.20 116.33 1o39 s ILE 121 Ca 0.52 -1.59 -0.13 0.00 -0.51 0.00 0.00 60.65 58.94 1o39 s ILE 121 Cb -0.10 -2.42 -0.08 0.00 0.15 0.00 0.00 42.46 40.01 1o39 s ILE 121 CO 0.42 -0.00 0.72 -0.44 -2.11 0.00 0.00 174.94 173.52 1o39 s SER 122 N -2.47 6.67 0.45 4.50 0.01 -1.26 -4.64 113.70 116.96 1o39 s SER 122 Ca 0.21 1.18 -0.11 0.00 1.31 0.00 0.00 55.95 58.54 1o39 s SER 122 Cb -0.10 -2.33 -0.06 0.00 0.21 0.00 0.00 66.02 63.74 1o39 s SER 122 CO 0.12 -0.25 0.83 -0.76 0.41 0.00 0.00 173.24 173.59 1o39 s LEU 123 N -3.24 3.73 0.61 2.44 1.43 -1.26 -0.60 118.68 121.80 1o39 s LEU 123 Ca 0.52 1.21 -0.09 0.00 -1.03 0.00 0.00 54.13 54.75 1o39 s LEU 123 Cb -0.10 -4.12 -0.01 0.00 0.03 0.00 0.00 46.19 41.98 1o39 s LEU 123 CO 0.22 -0.48 0.97 -2.16 0.23 0.00 0.00 176.35 175.13 1o39 s PRO 124 N -4.06 3.17 -0.01 1.29 0.04 -1.26 -4.74 135.00 129.43 1o39 s PRO 124 Ca 0.53 0.35 0.13 0.00 0.04 0.00 0.00 61.00 62.05 1o39 s PRO 124 Cb -0.10 -2.17 -0.18 0.00 0.04 0.00 0.00 34.50 32.09 1o39 s PRO 124 CO 0.34 -0.68 0.38 0.25 0.04 0.00 0.00 177.00 177.33 1o39 n THR 125 N -2.69 0.00 -3.78 1.26 -2.24 -1.26 -4.96 114.28 100.61 1o39 n THR 125 Ca 0.05 -0.27 -0.09 0.00 -2.27 0.00 0.00 64.05 61.47 1o39 n THR 125 Cb 0.56 0.48 -0.06 0.00 -2.10 0.00 0.00 70.33 69.21 1o39 n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1o39 s SER 127 N -3.06 -0.03 0.71 3.42 1.04 -1.26 -5.15 113.70 109.38 1o39 s SER 127 Ca -0.01 -0.55 -0.11 0.00 0.48 0.00 0.00 55.95 55.75 1o39 s SER 127 Cb 0.09 0.41 0.02 0.00 0.10 0.00 0.00 66.02 66.63 1o39 s SER 127 CO 0.54 -0.80 1.08 0.00 0.98 0.00 0.00 173.24 175.03 1o39 s ALA 129 N -3.23 3.91 0.26 0.00 0.00 -1.26 -5.10 121.76 116.34 1o39 s ALA 129 Ca 0.58 -1.20 0.08 0.00 0.00 0.00 0.00 51.96 51.43 1o39 s ALA 129 Cb -0.12 -1.99 -0.04 0.00 0.00 0.00 0.00 23.12 20.97 1o39 s ALA 129 CO 0.53 -0.28 0.11 -1.54 0.00 0.00 0.00 175.76 174.58 1o39 s SER 130 N -4.21 5.04 0.69 0.00 1.04 -1.26 -5.04 113.70 109.96 1o39 s SER 130 Ca 0.48 -0.46 -0.16 0.00 0.48 0.00 0.00 55.95 56.28 1o39 s SER 130 Cb -0.10 -1.11 -0.01 0.00 0.10 0.00 0.00 66.02 64.89 1o39 s SER 130 CO 0.36 -0.04 0.88 0.00 0.98 0.00 0.00 173.24 175.42 1o39 n ALA 132 N -1.06 -0.39 0.00 5.32 0.00 -1.26 -1.22 120.51 121.90 1o39 n ALA 132 Ca -0.07 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1o39 n ALA 132 Cb 0.59 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.97 1o39 n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o39 n GLY 133 N 1.25 2.94 3.75 0.00 0.00 0.38 -4.93 105.19 108.58 1o39 n GLY 133 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1o39 n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1o39 s THR 134 N -1.52 2.10 -0.09 2.61 2.01 -0.36 -4.67 115.64 115.73 1o39 s THR 134 Ca 0.00 0.09 -0.19 0.00 0.31 0.00 0.00 61.69 61.90 1o39 s THR 134 Cb 0.00 -3.06 -0.04 0.00 0.01 0.00 0.00 72.50 69.41 1o39 s THR 134 CO 0.00 0.01 0.51 -1.58 -0.69 0.00 0.00 174.62 172.87 1o39 s GLN 135 N -0.42 4.32 0.22 4.92 2.00 -1.26 -1.19 119.66 128.26 1o39 s GLN 135 Ca 0.63 0.52 0.04 0.00 -2.00 0.00 0.00 55.36 54.56 1o39 s GLN 135 Cb -0.47 -3.41 -0.05 0.00 0.80 0.00 0.00 33.01 29.87 1o39 s GLN 135 CO 0.47 0.20 -0.03 0.00 -0.50 0.00 0.00 175.29 175.43 1o39 s LEU 137 N -3.29 2.96 -0.05 0.00 2.96 0.65 -0.72 118.68 121.20 1o39 s LEU 137 Ca 0.26 -0.27 0.06 0.00 -0.22 0.00 0.00 54.13 53.95 1o39 s LEU 137 Cb 0.05 -1.71 -0.02 0.00 0.50 0.00 0.00 46.19 45.01 1o39 s LEU 137 CO 0.07 0.11 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.37 1o39 s ILE 138 N 0.68 2.40 0.06 6.68 1.01 0.27 -1.29 121.20 131.02 1o39 s ILE 138 Ca -0.04 -0.96 -0.02 0.00 0.00 0.00 0.00 60.65 59.64 1o39 s ILE 138 Cb -0.15 -1.89 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 1o39 s ILE 138 CO 0.02 0.58 -0.00 -0.94 0.00 0.00 0.00 174.94 174.59 1o39 s SER 139 N -0.43 0.44 0.00 3.58 1.04 -1.23 -0.66 113.70 116.44 1o39 s SER 139 Ca 0.04 -1.00 0.00 0.00 0.48 0.00 0.00 55.95 55.48 1o39 s SER 139 Cb -0.12 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.22 1o39 s SER 139 CO 0.01 -0.62 0.00 0.61 0.98 0.00 0.00 173.24 174.22 1o39 n GLY 140 N 0.07 0.90 1.30 7.32 0.00 -0.35 -4.51 105.19 109.92 1o39 n GLY 140 Ca -0.13 -1.08 -0.05 0.00 0.00 0.00 0.00 46.02 44.75 1o39 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1o39 n TRP 141 N -0.73 1.38 -2.06 1.61 8.01 -1.26 -1.85 117.44 122.55 1o39 n TRP 141 Ca 0.00 -1.51 -0.28 0.00 -1.31 0.00 0.00 57.50 54.39 1o39 n TRP 141 Cb 0.00 -0.53 0.15 0.00 -2.01 0.00 0.00 31.31 28.91 1o39 n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1o39 s GLY 142 N -2.23 1.74 0.34 6.99 0.00 -1.25 -4.40 107.32 108.51 1o39 s GLY 142 Ca 0.46 -1.17 -0.26 0.00 0.00 0.00 0.00 44.72 43.75 1o39 s GLY 142 CO 0.03 -0.51 0.83 -2.01 0.00 0.00 0.00 173.10 171.44 1o39 n ASN 143 N -3.47 0.44 -0.55 1.64 5.15 0.12 -2.50 115.26 116.09 1o39 n ASN 143 Ca 0.13 1.07 0.06 0.00 -0.60 0.00 0.00 54.58 55.24 1o39 n ASN 143 Cb 0.60 -1.22 0.09 0.00 -0.53 0.00 0.00 39.78 38.72 1o39 n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1o39 n THR 144 N -0.25 0.35 -4.44 -0.44 -2.24 -0.10 0.34 114.28 107.50 1o39 n THR 144 Ca 0.11 -0.68 -0.30 0.00 -2.27 0.00 0.00 64.05 60.91 1o39 n THR 144 Cb 0.35 0.98 -0.12 0.00 -2.10 0.00 0.00 70.33 69.44 1o39 n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1o39 s LYS 145 N -0.99 1.96 0.05 -0.78 1.02 -1.26 -4.46 119.74 115.28 1o39 s LYS 145 Ca 0.18 -1.07 0.20 0.00 0.02 0.00 0.00 55.97 55.30 1o39 s LYS 145 Cb 0.11 -2.17 -0.16 0.00 -0.52 0.00 0.00 37.83 35.08 1o39 s LYS 145 CO 0.15 0.51 0.71 -1.13 -0.92 0.00 0.00 175.35 174.67 1o39 n SER 146 N 1.11 0.53 -3.78 2.83 3.41 -1.26 -4.54 113.62 111.92 1o39 n SER 146 Ca -0.16 0.22 -0.29 0.00 -0.26 0.00 0.00 58.87 58.38 1o39 n SER 146 Cb 0.52 0.83 -0.13 0.00 -0.26 0.00 0.00 64.21 65.17 1o39 n SER 146 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1o39 s SER 147 N -5.29 3.84 0.00 4.04 0.01 -1.26 -4.59 113.70 110.44 1o39 s SER 147 Ca -0.04 -2.84 0.00 0.00 1.31 0.00 0.00 55.95 54.37 1o39 s SER 147 Cb 0.10 -1.22 0.00 0.00 0.21 0.00 0.00 66.02 65.11 1o39 s SER 147 CO 0.83 -0.24 0.00 0.61 0.41 0.00 0.00 173.24 174.85 1o39 n GLY 148 N 3.28 2.66 3.33 3.44 0.00 -1.26 -5.04 105.19 111.59 1o39 n GLY 148 Ca 0.09 -2.11 -0.35 0.00 0.00 0.00 0.00 46.02 43.65 1o39 n GLY 148 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1o39 s THR 149 N -2.07 3.54 -0.19 2.61 -4.23 -1.26 -4.42 115.64 109.62 1o39 s THR 149 Ca 0.00 -0.47 -0.04 0.00 -1.18 0.00 0.00 61.69 59.99 1o39 s THR 149 Cb 0.00 -2.64 0.08 0.00 1.34 0.00 0.00 72.50 71.28 1o39 s THR 149 CO 0.00 0.38 0.16 -0.55 -0.54 0.00 0.00 174.62 174.07 1o39 s SER 150 N 1.50 1.94 -0.10 3.99 0.15 -1.26 -5.00 113.70 114.92 1o39 s SER 150 Ca 0.05 -0.47 -0.04 0.00 0.70 0.00 0.00 55.95 56.20 1o39 s SER 150 Cb -0.15 0.05 -0.04 0.00 -1.71 0.00 0.00 66.02 64.18 1o39 s SER 150 CO -0.02 -0.34 0.06 -0.31 1.20 0.00 0.00 173.24 173.83 1o39 s TYR 151 N 2.23 3.35 0.65 3.44 1.51 -1.26 -0.92 117.35 126.35 1o39 s TYR 151 Ca 0.05 0.34 -0.04 0.00 -1.01 0.00 0.00 57.07 56.41 1o39 s TYR 151 Cb -0.16 -1.85 0.05 0.00 -0.11 0.00 0.00 41.96 39.89 1o39 s TYR 151 CO -0.12 0.59 0.93 -1.25 -1.11 0.00 0.00 175.55 174.59 1o39 s PRO 152 N -0.98 2.31 -0.19 -1.71 0.04 -1.26 -5.00 135.00 128.20 1o39 s PRO 152 Ca 0.14 -0.45 -0.01 0.00 0.04 0.00 0.00 61.00 60.72 1o39 s PRO 152 Cb -0.12 -2.28 -0.21 0.00 0.04 0.00 0.00 34.50 31.93 1o39 s PRO 152 CO 0.03 -1.06 0.06 -0.25 0.04 0.00 0.00 177.00 175.83 1o39 n ASP 153 N -2.72 1.96 -4.86 6.66 8.00 -1.26 -4.90 116.55 119.44 1o39 n ASP 153 Ca 0.08 0.03 -0.21 0.00 0.71 0.00 0.00 54.79 55.40 1o39 n ASP 153 Cb 0.60 -0.56 -0.04 0.00 -0.02 0.00 0.00 41.12 41.10 1o39 n ASP 153 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1o39 s VAL 154 N -2.54 4.33 0.15 2.53 -7.23 -1.26 -1.05 120.40 115.33 1o39 s VAL 154 Ca -0.28 -1.32 -0.31 0.00 -1.81 0.00 0.00 61.98 58.26 1o39 s VAL 154 Cb 0.08 -3.41 -0.10 0.00 0.56 0.00 0.00 36.38 33.51 1o39 s VAL 154 CO 0.69 -0.30 1.57 -0.22 -0.31 0.00 0.00 175.10 176.53 1o39 s LEU 155 N -3.91 4.37 0.09 1.32 2.96 -1.14 -4.83 118.68 117.54 1o39 s LEU 155 Ca 0.36 2.59 0.05 0.00 -0.22 0.00 0.00 54.13 56.91 1o39 s LEU 155 Cb -0.08 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 42.98 1o39 s LEU 155 CO 0.26 -0.83 0.00 -0.54 -1.32 0.00 0.00 176.35 173.93 1o39 s LYS 156 N 1.33 2.55 0.15 1.98 -0.14 -0.77 -1.76 119.74 123.08 1o39 s LYS 156 Ca 0.70 -0.84 0.07 0.00 -1.36 0.00 0.00 55.97 54.54 1o39 s LYS 156 Cb -0.43 -2.54 -0.04 0.00 -1.68 0.00 0.00 37.83 33.14 1o39 s LYS 156 CO 0.31 0.54 -0.16 0.00 -0.76 0.00 0.00 175.35 175.28 1o39 s LEU 158 N -2.58 -0.02 -0.21 0.00 2.96 0.16 -0.50 118.68 118.49 1o39 s LEU 158 Ca 0.13 1.00 -0.09 0.00 -0.22 0.00 0.00 54.13 54.95 1o39 s LEU 158 Cb -0.05 1.65 -0.05 0.00 0.50 0.00 0.00 46.19 48.24 1o39 s LEU 158 CO 0.05 -0.18 0.12 -0.54 -1.32 0.00 0.00 176.35 174.48 1o39 s LYS 159 N 0.69 4.07 -0.01 1.98 -0.14 -1.26 -0.56 119.74 124.50 1o39 s LYS 159 Ca -0.03 -0.28 -0.05 0.00 -1.36 0.00 0.00 55.97 54.24 1o39 s LYS 159 Cb -0.05 -3.42 0.00 0.00 -1.68 0.00 0.00 37.83 32.69 1o39 s LYS 159 CO -0.05 0.18 0.12 0.00 -0.76 0.00 0.00 175.35 174.83 1o39 s ALA 160 N 0.70 -0.27 0.29 5.17 0.00 0.10 -4.93 121.76 122.82 1o39 s ALA 160 Ca 0.07 -0.01 -0.08 0.00 0.00 0.00 0.00 51.96 51.93 1o39 s ALA 160 Cb -0.12 -0.00 -0.06 0.00 0.00 0.00 0.00 23.12 22.93 1o39 s ALA 160 CO 0.01 -0.15 0.60 -1.25 0.00 0.00 0.00 175.76 174.97 1o39 s PRO 161 N -0.88 3.74 0.15 0.00 0.04 -1.26 -0.39 135.00 136.39 1o39 s PRO 161 Ca -0.10 0.22 -0.30 0.00 0.04 0.00 0.00 61.00 60.86 1o39 s PRO 161 Cb -0.06 -2.59 -0.07 0.00 0.04 0.00 0.00 34.50 31.82 1o39 s PRO 161 CO 0.01 0.21 1.08 0.42 0.04 0.00 0.00 177.00 178.75 1o39 s ILE 162 N -2.03 4.04 0.54 0.56 1.01 -0.33 -1.26 121.20 123.73 1o39 s ILE 162 Ca 0.47 1.71 0.01 0.00 0.00 0.00 0.00 60.65 62.84 1o39 s ILE 162 Cb -0.11 -4.09 0.03 0.00 0.01 0.00 0.00 42.46 38.30 1o39 s ILE 162 CO 0.26 0.27 0.76 -0.76 0.00 0.00 0.00 174.94 175.47 1o39 s LEU 163 N -0.13 3.31 0.60 2.97 1.43 0.06 -0.47 118.68 126.45 1o39 s LEU 163 Ca 0.50 -0.01 -0.13 0.00 -1.03 0.00 0.00 54.13 53.46 1o39 s LEU 163 Cb -0.28 -2.88 -0.04 0.00 0.03 0.00 0.00 46.19 43.02 1o39 s LEU 163 CO 0.33 -1.11 1.03 -0.94 0.23 0.00 0.00 176.35 175.89 1o39 s SER 164 N -4.41 6.11 0.35 2.29 1.04 -1.26 -4.59 113.70 113.23 1o39 s SER 164 Ca 0.57 1.55 0.03 0.00 0.48 0.00 0.00 55.95 58.57 1o39 s SER 164 Cb -0.10 -2.49 0.63 0.00 0.10 0.00 0.00 66.02 64.15 1o39 s SER 164 CO 0.38 -0.95 1.97 -0.78 0.98 0.00 0.00 173.24 174.85 1o39 h ASP 165 N 0.04 0.67 -0.62 7.02 -0.00 -1.97 -1.84 116.42 119.72 1o39 h ASP 165 Ca -0.45 -0.05 -0.10 0.00 -0.00 0.00 0.00 57.03 56.44 1o39 h ASP 165 Cb 1.20 -0.17 -0.02 0.00 -0.00 0.00 0.00 39.33 40.33 1o39 h ASP 165 CO 0.60 0.54 0.02 0.28 -0.00 0.00 0.00 179.24 180.68 1o39 h SER 166 N 0.77 1.06 -0.15 2.28 0.02 -1.98 -0.22 113.55 115.33 1o39 h SER 166 Ca 0.20 -0.30 -0.12 0.00 -0.84 0.00 0.00 61.79 60.73 1o39 h SER 166 Cb 0.02 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.26 1o39 h SER 166 CO -0.03 1.10 -0.31 0.28 -1.14 0.00 0.00 176.83 176.72 1o39 h SER 167 N 0.99 0.66 0.08 3.07 0.02 -1.81 -0.25 113.55 116.31 1o39 h SER 167 Ca 0.18 -0.26 -0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1o39 h SER 167 Cb 0.55 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.91 1o39 h SER 167 CO 0.03 0.93 -0.04 0.00 -1.14 0.00 0.00 176.83 176.61 1o39 h LYS 169 N -0.35 0.00 0.00 0.00 1.57 -1.00 -1.51 116.57 115.28 1o39 h LYS 169 Ca -0.01 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.65 1o39 h LYS 169 Cb 0.30 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 1o39 h LYS 169 CO 0.02 0.18 -0.66 1.03 -0.57 0.00 0.00 179.45 179.44 1o39 h SER 170 N 0.00 0.00 0.53 0.86 0.87 -0.88 -2.78 113.55 112.15 1o39 h SER 170 Ca -0.00 0.00 -0.27 0.00 -1.23 0.00 0.00 61.79 60.28 1o39 h SER 170 Cb 0.53 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.50 1o39 h SER 170 CO 0.02 0.55 -1.22 0.00 -0.53 0.00 0.00 176.83 175.65 1o39 h ALA 171 N 1.45 0.10 -2.17 6.23 0.00 -0.38 -3.38 119.26 121.11 1o39 h ALA 171 Ca -0.03 -0.85 -0.56 0.00 0.00 0.00 0.00 54.91 53.47 1o39 h ALA 171 Cb 1.44 0.03 -0.41 0.00 0.00 0.00 0.00 17.79 18.84 1o39 h ALA 171 CO 0.07 0.91 -0.82 0.66 0.00 0.00 0.00 179.25 180.07 1o39 n TYR 172 N -3.59 2.59 -1.71 0.00 4.01 -0.65 -4.96 117.16 112.85 1o39 n TYR 172 Ca -0.09 -3.94 -0.43 0.00 -0.16 0.00 0.00 57.90 53.27 1o39 n TYR 172 Cb 1.00 -0.47 -0.03 0.00 -0.31 0.00 0.00 39.34 39.54 1o39 n TYR 172 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1o39 n PRO 173 N 0.23 2.42 -0.66 -0.72 -0.04 -1.05 -1.40 135.00 133.77 1o39 n PRO 173 Ca 0.28 0.86 0.00 0.00 -0.04 0.00 0.00 63.50 64.61 1o39 n PRO 173 Cb 0.48 -2.62 0.00 0.00 -0.04 0.00 0.00 33.50 31.32 1o39 n PRO 173 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1o39 n GLY 174 N 2.64 1.27 0.48 0.55 0.00 -1.26 -4.85 105.19 104.01 1o39 n GLY 174 Ca 0.12 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.20 1o39 n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1o39 n GLN 175 N -2.00 0.78 -3.87 1.61 6.02 -0.50 -4.96 117.38 114.47 1o39 n GLN 175 Ca 0.00 -1.19 -0.35 0.00 -0.01 0.00 0.00 57.00 55.45 1o39 n GLN 175 Cb 0.00 -1.23 -0.09 0.00 1.02 0.00 0.00 30.24 29.94 1o39 n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1o39 s ILE 176 N -1.05 5.08 0.56 5.09 -1.09 -1.25 -5.03 121.20 123.50 1o39 s ILE 176 Ca 0.14 0.07 0.06 0.00 -2.23 0.00 0.00 60.65 58.70 1o39 s ILE 176 Cb 0.10 -3.31 0.06 0.00 -1.58 0.00 0.00 42.46 37.73 1o39 s ILE 176 CO 0.16 0.44 0.51 0.42 -1.23 0.00 0.00 174.94 175.25 1o39 s THR 177 N 0.42 1.72 -2.00 2.92 -4.23 -1.26 -4.97 115.64 108.23 1o39 s THR 177 Ca 0.05 -1.37 0.18 0.00 -1.18 0.00 0.00 61.69 59.38 1o39 s THR 177 Cb -0.12 -2.09 0.52 0.00 1.34 0.00 0.00 72.50 72.15 1o39 s THR 177 CO -0.01 0.00 1.54 -1.54 -0.54 0.00 0.00 174.62 174.07 1o39 n SER 178 N -1.91 0.00 -1.18 3.99 3.41 -1.26 -2.51 113.62 114.17 1o39 n SER 178 Ca 0.03 -0.90 0.08 0.00 -0.26 0.00 0.00 58.87 57.81 1o39 n SER 178 Cb 0.64 0.00 0.30 0.00 -0.26 0.00 0.00 64.21 64.88 1o39 n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1o39 n ASN 179 N -0.89 4.33 -4.18 4.04 3.02 -1.26 -4.92 115.26 115.41 1o39 n ASN 179 Ca 0.14 -2.84 -0.12 0.00 -0.03 0.00 0.00 54.58 51.72 1o39 n ASN 179 Cb 0.06 -0.55 -0.10 0.00 -0.61 0.00 0.00 39.78 38.58 1o39 n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1o39 s MET 180 N -2.53 0.85 0.03 3.52 -1.94 -1.04 -0.94 119.30 117.25 1o39 s MET 180 Ca 0.44 -1.26 -0.16 0.00 -1.71 0.00 0.00 55.69 53.00 1o39 s MET 180 Cb 0.34 -0.36 0.03 0.00 2.01 0.00 0.00 34.83 36.84 1o39 s MET 180 CO 0.13 0.03 0.36 -0.59 -0.01 0.00 0.00 175.02 174.93 1o39 s PHE 181 N -3.10 -0.19 0.06 -0.03 -0.71 -0.68 -4.79 117.98 108.54 1o39 s PHE 181 Ca 0.09 0.14 0.02 0.00 -1.04 0.00 0.00 56.93 56.14 1o39 s PHE 181 Cb 0.02 0.15 -0.04 0.00 -1.21 0.00 0.00 43.02 41.94 1o39 s PHE 181 CO -0.02 -0.52 0.11 0.00 -1.34 0.00 0.00 175.22 173.45 1o39 s ALA 183 N -1.37 -0.61 0.00 0.00 0.00 -0.90 -0.76 121.76 118.12 1o39 s ALA 183 Ca 0.29 0.27 0.00 0.00 0.00 0.00 0.00 51.96 52.52 1o39 s ALA 183 Cb -0.12 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 22.97 1o39 s ALA 183 CO 0.22 -0.21 0.00 0.41 0.00 0.00 0.00 175.76 176.17 1o39 n GLY 184 N 1.69 0.84 2.97 0.00 0.00 -0.39 -2.65 105.19 107.65 1o39 n GLY 184 Ca -0.20 -1.88 -0.30 0.00 0.00 0.00 0.00 46.02 43.64 1o39 n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1o39 s TYR 184 N -2.67 2.22 0.26 1.61 2.02 -1.26 -4.41 117.35 115.12 1o39 s TYR 184 Ca 0.00 -1.43 0.36 0.00 -0.37 0.00 0.00 57.07 55.63 1o39 s TYR 184 Cb 0.00 -1.56 1.77 0.00 -0.40 0.00 0.00 41.96 41.77 1o39 s TYR 184 CO 0.00 -0.71 2.09 -0.07 -1.57 0.00 0.00 175.55 175.30 1o39 h LEU 185 N 8.02 0.00 -0.01 -1.29 3.38 -1.95 -0.86 115.31 122.60 1o39 h LEU 185 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1o39 h LEU 185 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1o39 h LEU 185 CO 0.46 0.00 0.00 -1.84 0.09 0.00 0.00 178.44 177.15 1o39 n GLU 186 N -2.91 0.11 0.00 1.13 0.00 -1.26 0.03 120.64 117.74 1o39 n GLU 186 Ca -0.01 0.10 0.00 0.00 0.00 0.00 0.00 57.16 57.25 1o39 n GLU 186 Cb 0.17 -1.63 0.00 0.00 0.00 0.00 0.00 31.44 29.98 1o39 n GLU 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1o39 n GLY 187 N 1.37 -2.62 1.55 -1.84 0.00 -0.33 -4.49 105.19 98.83 1o39 n GLY 187 Ca 0.06 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.37 1o39 n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o39 n GLY 188 N -0.38 2.64 2.94 -0.02 0.00 -0.26 -4.92 105.19 105.18 1o39 n GLY 188 Ca 0.00 -0.18 -0.21 0.00 0.00 0.00 0.00 46.02 45.63 1o39 n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o39 s LYS 188 N 0.00 1.12 0.00 1.61 1.02 -1.26 -3.39 119.74 118.84 1o39 s LYS 188 Ca 0.00 -0.21 -0.29 0.00 0.02 0.00 0.00 55.97 55.49 1o39 s LYS 188 Cb 0.00 -1.02 0.11 0.00 -0.52 0.00 0.00 37.83 36.40 1o39 s LYS 188 CO 0.00 -0.04 1.26 0.34 -0.92 0.00 0.00 175.35 175.99 1o39 s ASP 189 N 0.82 -0.03 0.56 2.83 3.68 -0.69 -4.34 116.67 119.49 1o39 s ASP 189 Ca -0.13 -0.21 0.01 0.00 2.13 0.00 0.00 52.55 54.36 1o39 s ASP 189 Cb -0.15 0.19 0.04 0.00 -1.45 0.00 0.00 42.92 41.55 1o39 s ASP 189 CO 0.01 -0.37 0.79 -0.94 0.13 0.00 0.00 175.17 174.79 1o39 s SER 190 N -3.29 5.22 0.29 -0.34 1.04 -1.26 -0.94 113.70 114.41 1o39 s SER 190 Ca 0.20 -0.05 -0.06 0.00 0.48 0.00 0.00 55.95 56.52 1o39 s SER 190 Cb 0.02 -0.80 0.02 0.00 0.10 0.00 0.00 66.02 65.36 1o39 s SER 190 CO -0.02 -1.19 0.49 0.00 0.98 0.00 0.00 173.24 173.50 1o39 n GLN 192 N -0.44 1.84 0.00 0.00 7.27 -1.26 -1.00 117.38 123.79 1o39 n GLN 192 Ca -0.03 0.66 0.00 0.00 0.07 0.00 0.00 57.00 57.70 1o39 n GLN 192 Cb 0.46 -2.32 0.00 0.00 2.41 0.00 0.00 30.24 30.79 1o39 n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1o39 n GLY 193 N 2.56 2.89 0.09 1.69 0.00 -1.26 -0.70 105.19 110.45 1o39 n GLY 193 Ca 0.14 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.28 1o39 n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1o39 n ASP 194 N 0.00 0.73 -4.51 1.61 8.00 -0.17 -3.87 116.55 118.34 1o39 n ASP 194 Ca 0.00 0.21 -0.56 0.00 0.71 0.00 0.00 54.79 55.15 1o39 n ASP 194 Cb 0.00 0.59 -0.07 0.00 -0.02 0.00 0.00 41.12 41.62 1o39 n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1o39 n SER 195 N -2.49 0.18 0.00 -2.24 7.64 -1.25 -1.13 113.62 114.34 1o39 n SER 195 Ca 0.00 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.03 1o39 n SER 195 Cb 0.52 -0.98 0.00 0.00 -1.01 0.00 0.00 64.21 62.74 1o39 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1o39 n GLY 196 N 1.73 3.28 3.85 0.23 0.00 0.12 -0.86 105.19 113.55 1o39 n GLY 196 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 1o39 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1o39 s GLY 197 N -2.25 1.72 0.33 -0.02 0.00 -0.28 -3.33 107.32 103.50 1o39 s GLY 197 Ca 0.00 -1.09 -0.15 0.00 0.00 0.00 0.00 44.72 43.48 1o39 s GLY 197 CO 0.00 -0.32 0.76 2.56 0.00 0.00 0.00 173.10 176.10 1o39 s PRO 198 N -5.75 4.02 -0.28 2.90 0.04 -1.26 -1.22 135.00 133.46 1o39 s PRO 198 Ca 0.72 0.71 -0.00 0.00 0.04 0.00 0.00 61.00 62.47 1o39 s PRO 198 Cb -0.06 -2.40 0.09 0.00 0.04 0.00 0.00 34.50 32.16 1o39 s PRO 198 CO 0.53 0.14 0.05 0.08 0.04 0.00 0.00 177.00 177.84 1o39 s VAL 199 N -2.01 1.11 -0.15 -0.36 1.01 -0.87 -3.53 120.40 115.61 1o39 s VAL 199 Ca 0.55 -1.35 -0.02 0.00 0.00 0.00 0.00 61.98 61.16 1o39 s VAL 199 Cb -0.10 -1.72 -0.02 0.00 0.00 0.00 0.00 36.38 34.55 1o39 s VAL 199 CO 0.17 -0.49 -0.09 -0.69 0.00 0.00 0.00 175.10 174.00 1o39 s VAL 200 N 1.53 3.31 -0.07 2.92 1.01 -0.41 -1.26 120.40 127.43 1o39 s VAL 200 Ca 0.05 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.49 1o39 s VAL 200 Cb -0.18 -2.43 0.02 0.00 0.00 0.00 0.00 36.38 33.79 1o39 s VAL 200 CO -0.17 0.50 -0.11 0.00 0.00 0.00 0.00 175.10 175.32 1o39 n SER 202 N 4.03 -4.38 -0.46 0.00 7.64 -1.26 -1.35 113.62 117.84 1o39 n SER 202 Ca -0.21 -0.64 -0.06 0.00 1.01 0.00 0.00 58.87 58.96 1o39 n SER 202 Cb 0.51 -3.55 -0.03 0.00 -1.01 0.00 0.00 64.21 60.14 1o39 n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1o39 n GLY 203 N -1.47 0.82 3.28 0.23 0.00 -1.26 -5.02 105.19 101.77 1o39 n GLY 203 Ca 0.02 -0.49 -0.24 0.00 0.00 0.00 0.00 46.02 45.31 1o39 n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o39 s LYS 204 N -2.17 1.11 -0.53 1.61 -0.14 -0.46 -4.20 119.74 114.96 1o39 s LYS 204 Ca 0.00 -1.15 -0.26 0.00 -1.36 0.00 0.00 55.97 53.20 1o39 s LYS 204 Cb 0.00 -1.36 0.03 0.00 -1.68 0.00 0.00 37.83 34.83 1o39 s LYS 204 CO 0.00 0.31 1.02 -1.17 -0.76 0.00 0.00 175.35 174.76 1o39 s LEU 209 N -1.89 3.86 -0.12 3.17 2.96 0.23 -1.56 118.68 125.33 1o39 s LEU 209 Ca 0.06 -0.03 0.19 0.00 -0.22 0.00 0.00 54.13 54.12 1o39 s LEU 209 Cb -0.10 -3.08 -0.28 0.00 0.50 0.00 0.00 46.19 43.24 1o39 s LEU 209 CO 0.04 -1.26 0.24 0.00 -1.32 0.00 0.00 176.35 174.06 1o39 n GLN 210 N 7.70 0.76 -4.14 1.98 1.13 -0.39 -4.09 117.38 120.33 1o39 n GLN 210 Ca 0.06 -0.09 -0.11 0.00 -1.94 0.00 0.00 57.00 54.91 1o39 n GLN 210 Cb 0.48 -1.49 -0.08 0.00 0.11 0.00 0.00 30.24 29.26 1o39 n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1o39 s GLY 211 N -4.92 1.18 -0.06 1.08 0.00 -0.86 -2.20 107.32 101.55 1o39 s GLY 211 Ca -0.09 -1.45 0.02 0.00 0.00 0.00 0.00 44.72 43.21 1o39 s GLY 211 CO 0.82 -1.15 -0.10 -0.42 0.00 0.00 0.00 173.10 172.25 1o39 s ILE 212 N -4.07 0.96 0.03 0.90 1.01 -1.07 -2.05 121.20 116.92 1o39 s ILE 212 Ca 0.34 -0.39 -0.30 0.00 0.00 0.00 0.00 60.65 60.30 1o39 s ILE 212 Cb 0.04 -0.89 -0.08 0.00 0.01 0.00 0.00 42.46 41.54 1o39 s ILE 212 CO 0.12 0.31 1.84 -0.69 0.00 0.00 0.00 174.94 176.52 1o39 s VAL 213 N 0.66 3.07 0.00 2.92 1.01 -0.35 -1.49 120.40 126.22 1o39 s VAL 213 Ca -0.13 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.08 1o39 s VAL 213 Cb -0.15 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.08 1o39 s VAL 213 CO 0.03 -0.02 0.00 -0.24 0.00 0.00 0.00 175.10 174.87 1o39 n SER 214 N 6.95 0.00 -0.96 3.32 2.88 -1.02 -0.70 113.62 124.09 1o39 n SER 214 Ca 0.19 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.73 1o39 n SER 214 Cb 0.41 -0.03 0.00 0.00 -0.75 0.00 0.00 64.21 63.84 1o39 n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1o39 n TRP 215 N -1.74 -0.27 0.00 0.66 4.27 -0.76 -4.88 117.44 114.72 1o39 n TRP 215 Ca 0.00 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.61 1o39 n TRP 215 Cb 0.00 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 29.95 1o39 n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1o39 n GLY 216 N 0.00 0.52 3.33 -1.67 0.00 -1.26 -0.40 105.19 105.70 1o39 n GLY 216 Ca 0.00 -1.01 -0.42 0.00 0.00 0.00 0.00 46.02 44.59 1o39 n GLY 216 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1o39 s SER 217 N 0.00 5.85 0.46 1.61 0.15 -1.26 -4.92 113.70 115.58 1o39 s SER 217 Ca 0.00 -1.35 0.00 0.00 0.70 0.00 0.00 55.95 55.30 1o39 s SER 217 Cb 0.00 -2.07 0.00 0.00 -1.71 0.00 0.00 66.02 62.24 1o39 s SER 217 CO 0.00 -0.55 0.00 0.61 1.20 0.00 0.00 173.24 174.50 1o39 n GLY 219 N 5.04 -0.38 2.93 9.45 0.00 -1.26 -4.64 105.19 116.32 1o39 n GLY 219 Ca -0.11 -1.09 -0.15 0.00 0.00 0.00 0.00 46.02 44.67 1o39 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o39 n ALA 221 N 3.00 -1.03 -2.26 0.00 0.00 -1.26 -4.63 120.51 114.33 1o39 n ALA 221 Ca -0.13 0.06 -0.31 0.00 0.00 0.00 0.00 53.44 53.06 1o39 n ALA 221 Cb 0.59 -2.38 -0.05 0.00 0.00 0.00 0.00 19.45 17.61 1o39 n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1o39 s GLN 221 N -5.88 3.84 0.33 0.00 -1.52 -1.26 -1.10 119.66 114.07 1o39 s GLN 221 Ca 0.34 0.43 -0.29 0.00 -1.95 0.00 0.00 55.36 53.90 1o39 s GLN 221 Cb -0.18 -2.49 -0.11 0.00 -0.22 0.00 0.00 33.01 30.01 1o39 s GLN 221 CO 0.42 0.13 1.40 0.21 -0.25 0.00 0.00 175.29 177.20 1o39 s LYS 222 N -3.31 4.25 -0.27 2.91 2.20 -1.26 -2.35 119.74 121.91 1o39 s LYS 222 Ca 0.50 2.37 0.00 0.00 -0.36 0.00 0.00 55.97 58.48 1o39 s LYS 222 Cb -0.10 -3.04 0.00 0.00 -1.51 0.00 0.00 37.83 33.18 1o39 s LYS 222 CO 0.24 -0.36 0.00 0.09 -0.36 0.00 0.00 175.35 174.96 1o39 n ASN 223 N 0.99 -5.93 -3.68 1.43 5.03 0.10 -4.89 115.26 108.32 1o39 n ASN 223 Ca 0.02 0.06 -0.27 0.00 0.87 0.00 0.00 54.58 55.26 1o39 n ASN 223 Cb 0.40 -3.65 -0.11 0.00 -1.02 0.00 0.00 39.78 35.41 1o39 n ASN 223 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1o39 n LYS 224 N 0.58 1.40 -0.90 3.52 4.76 -0.99 -4.80 118.16 121.73 1o39 n LYS 224 Ca -0.03 -4.09 -0.29 0.00 -2.87 0.00 0.00 58.31 51.04 1o39 n LYS 224 Cb 0.52 -2.06 0.22 0.00 -1.84 0.00 0.00 35.03 31.87 1o39 n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1o39 s PRO 225 N -1.14 -0.47 0.41 1.97 0.04 -1.26 -4.32 135.00 130.23 1o39 s PRO 225 Ca 0.29 0.52 -0.15 0.00 0.04 0.00 0.00 61.00 61.70 1o39 s PRO 225 Cb 0.01 -1.63 -0.08 0.00 0.04 0.00 0.00 34.50 32.83 1o39 s PRO 225 CO -0.16 -3.34 0.85 0.20 0.04 0.00 0.00 177.00 174.59 1o39 s GLY 226 N -3.15 2.18 -0.08 0.56 0.00 -1.09 -4.59 107.32 101.16 1o39 s GLY 226 Ca 0.67 0.09 0.03 0.00 0.00 0.00 0.00 44.72 45.51 1o39 s GLY 226 CO 0.60 0.32 -0.15 0.14 0.00 0.00 0.00 173.10 174.01 1o39 s VAL 227 N -2.28 2.92 0.11 1.40 1.01 0.46 -2.12 120.40 121.90 1o39 s VAL 227 Ca 0.56 -0.75 0.07 0.00 0.00 0.00 0.00 61.98 61.87 1o39 s VAL 227 Cb -0.10 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 1o39 s VAL 227 CO 0.23 0.57 -0.18 -0.31 0.00 0.00 0.00 175.10 175.41 1o39 s TYR 228 N -0.29 1.63 0.07 5.22 2.02 -0.13 -1.83 117.35 124.04 1o39 s TYR 228 Ca 0.02 -0.46 -0.30 0.00 -0.37 0.00 0.00 57.07 55.96 1o39 s TYR 228 Cb -0.13 -0.87 -0.05 0.00 -0.40 0.00 0.00 41.96 40.51 1o39 s TYR 228 CO 0.03 0.19 1.04 0.99 -1.57 0.00 0.00 175.55 176.23 1o39 s THR 229 N -1.52 4.43 -1.05 -0.71 2.01 -0.56 -1.68 115.64 116.56 1o39 s THR 229 Ca 0.07 1.86 -0.21 0.00 0.31 0.00 0.00 61.69 63.73 1o39 s THR 229 Cb -0.08 -4.19 0.08 0.00 0.01 0.00 0.00 72.50 68.31 1o39 s THR 229 CO 0.04 0.21 1.42 -0.75 -0.69 0.00 0.00 174.62 174.85 1o39 s LYS 230 N 0.54 3.68 0.40 4.92 2.20 -0.12 -2.59 119.74 128.76 1o39 s LYS 230 Ca 0.52 -1.47 0.13 0.00 -0.36 0.00 0.00 55.97 54.79 1o39 s LYS 230 Cb -0.25 -5.27 0.96 0.00 -1.51 0.00 0.00 37.83 31.76 1o39 s LYS 230 CO 0.30 -2.10 1.88 0.28 -0.36 0.00 0.00 175.35 175.35 1o39 h VAL 231 N 6.30 0.78 -0.33 4.02 2.07 -1.76 -2.16 116.25 125.18 1o39 h VAL 231 Ca 0.23 -0.18 0.09 0.00 0.82 0.00 0.00 66.70 67.67 1o39 h VAL 231 Cb 0.99 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1o39 h VAL 231 CO 1.35 0.10 0.29 0.00 0.02 0.00 0.00 177.57 179.33 1o39 n ASN 233 N -4.02 0.57 -0.44 0.00 3.02 -0.81 -3.54 115.26 110.04 1o39 n ASN 233 Ca 0.05 0.59 0.05 0.00 -0.03 0.00 0.00 54.58 55.23 1o39 n ASN 233 Cb 0.46 -0.73 0.08 0.00 -0.61 0.00 0.00 39.78 38.98 1o39 n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1o39 n TYR 234 N -2.07 0.20 -0.26 3.10 4.01 0.31 -4.75 117.16 117.69 1o39 n TYR 234 Ca 0.05 -0.26 -0.01 0.00 -0.16 0.00 0.00 57.90 57.51 1o39 n TYR 234 Cb 0.33 -0.02 0.11 0.00 -0.31 0.00 0.00 39.34 39.45 1o39 n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1o39 h VAL 235 N 1.71 1.02 -0.63 -0.72 2.07 -1.57 -0.52 116.25 117.62 1o39 h VAL 235 Ca 0.00 -0.28 -0.08 0.00 0.82 0.00 0.00 66.70 67.16 1o39 h VAL 235 Cb 0.54 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.41 1o39 h VAL 235 CO 0.00 0.15 0.09 0.77 0.02 0.00 0.00 177.57 178.60 1o39 h SER 236 N 0.83 0.98 0.08 0.57 4.64 -1.87 -1.53 113.55 117.25 1o39 h SER 236 Ca 0.32 -0.23 -0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1o39 h SER 236 Cb 0.14 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 61.97 1o39 h SER 236 CO -0.16 0.99 -0.04 -0.25 -0.87 0.00 0.00 176.83 176.50 1o39 h TRP 237 N 0.96 -0.10 0.13 4.77 7.01 -1.73 0.14 115.95 127.13 1o39 h TRP 237 Ca 0.19 -0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.20 1o39 h TRP 237 Cb 0.43 0.03 -0.02 0.00 -2.10 0.00 0.00 29.16 27.50 1o39 h TRP 237 CO 0.03 -0.03 -0.19 0.82 -2.79 0.00 0.00 178.44 176.28 1o39 h ILE 238 N -0.14 0.56 -0.52 2.65 2.04 -1.00 0.16 117.51 121.26 1o39 h ILE 238 Ca -0.01 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.89 1o39 h ILE 238 Cb 0.12 0.56 -0.04 0.00 -0.74 0.00 0.00 36.82 36.71 1o39 h ILE 238 CO 0.02 0.00 0.27 0.11 0.00 0.00 0.00 178.15 178.55 1o39 h LYS 239 N -0.38 0.51 -0.03 2.37 1.57 -1.09 0.27 116.57 119.79 1o39 h LYS 239 Ca 0.02 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1o39 h LYS 239 Cb 0.39 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 1o39 h LYS 239 CO -0.09 0.34 0.01 1.96 -0.57 0.00 0.00 179.45 181.09 1o39 h GLN 240 N 0.53 0.05 -0.45 3.15 4.20 -0.44 -0.83 115.11 121.33 1o39 h GLN 240 Ca 0.23 -0.01 0.05 0.00 0.06 0.00 0.00 58.65 58.97 1o39 h GLN 240 Cb 0.12 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.85 1o39 h GLN 240 CO -0.15 0.29 0.19 1.15 -0.67 0.00 0.00 178.83 179.64 1o39 h THR 241 N -0.20 0.91 -0.64 -0.54 2.02 -0.42 -0.76 112.91 113.29 1o39 h THR 241 Ca 0.01 -0.13 -0.08 0.00 0.77 0.00 0.00 66.41 66.98 1o39 h THR 241 Cb 0.26 0.49 -0.03 0.00 -1.74 0.00 0.00 68.15 67.14 1o39 h THR 241 CO 0.00 0.07 0.08 0.40 0.37 0.00 0.00 175.52 176.45 1o39 h ILE 242 N 0.39 1.26 -0.14 3.11 2.04 -0.89 -2.35 117.51 120.93 1o39 h ILE 242 Ca 0.20 -1.04 -0.03 0.00 1.00 0.00 0.00 64.86 64.99 1o39 h ILE 242 Cb 0.15 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1o39 h ILE 242 CO -0.17 0.39 -0.04 0.00 0.00 0.00 0.00 178.15 178.32 1o39 h ALA 243 N 1.10 1.67 -0.50 1.87 0.00 -0.37 -2.84 119.26 120.18 1o39 h ALA 243 Ca 0.19 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1o39 h ALA 243 Cb 0.45 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1o39 h ALA 243 CO 0.02 0.25 0.00 0.43 0.00 0.00 0.00 179.25 179.94 1o39 n SER 244 N -4.37 3.27 0.00 0.00 7.64 -0.36 -5.09 113.62 114.71 1o39 n SER 244 Ca -0.01 -1.97 0.00 0.00 1.01 0.00 0.00 58.87 57.90 1o39 n SER 244 Cb 0.19 -0.33 0.00 0.00 -1.01 0.00 0.00 64.21 63.06 1o39 n SER 244 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62