#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o3m s VAL 17 N 0.00 3.68 -0.62 1.39 1.01 0.09 -3.98 120.40 121.97 1o3m s VAL 17 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 61.53 1o3m s VAL 17 Cb 0.00 -2.56 0.00 0.00 0.00 0.00 0.00 36.38 33.82 1o3m s VAL 17 CO 0.00 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.25 1o3m n GLY 18 N 3.06 0.82 0.00 4.51 0.00 -1.23 -1.19 105.19 111.16 1o3m n GLY 18 Ca -0.18 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.24 1o3m n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o3m n GLY 19 N -2.04 1.87 3.31 -0.02 0.00 -1.26 -4.86 105.19 102.19 1o3m n GLY 19 Ca -0.06 -2.07 -0.16 0.00 0.00 0.00 0.00 46.02 43.72 1o3m n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1o3m s TYR 20 N 1.53 1.53 -0.16 1.61 1.13 0.23 -4.90 117.35 118.31 1o3m s TYR 20 Ca 0.00 -1.21 -0.29 0.00 -1.41 0.00 0.00 57.07 54.16 1o3m s TYR 20 Cb 0.00 -0.88 -0.02 0.00 -1.10 0.00 0.00 41.96 39.96 1o3m s TYR 20 CO 0.00 -0.37 1.27 0.99 -2.51 0.00 0.00 175.55 174.93 1o3m s THR 21 N -3.76 4.26 0.20 -3.49 2.01 -1.26 -0.39 115.64 113.21 1o3m s THR 21 Ca 0.38 1.53 -0.11 0.00 0.31 0.00 0.00 61.69 63.80 1o3m s THR 21 Cb 0.07 -3.99 0.12 0.00 0.01 0.00 0.00 72.50 68.72 1o3m s THR 21 CO 0.14 -0.13 1.84 0.00 -0.69 0.00 0.00 174.62 175.78 1o3m n GLY 23 N -1.28 3.06 3.65 0.00 0.00 -1.26 -4.82 105.19 104.53 1o3m n GLY 23 Ca 0.06 -1.53 -0.49 0.00 0.00 0.00 0.00 46.02 44.06 1o3m n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o3m n ALA 24 N 0.70 0.38 -2.26 4.61 0.00 -1.26 -2.76 120.51 119.93 1o3m n ALA 24 Ca 0.00 0.45 -0.16 0.00 0.00 0.00 0.00 53.44 53.74 1o3m n ALA 24 Cb 0.00 -2.26 -0.02 0.00 0.00 0.00 0.00 19.45 17.17 1o3m n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1o3m n ASN 25 N 3.55 -4.57 -0.07 0.00 4.13 -1.26 -4.85 115.26 112.19 1o3m n ASN 25 Ca 0.19 0.16 0.13 0.00 1.68 0.00 0.00 54.58 56.74 1o3m n ASN 25 Cb 0.24 -3.89 0.44 0.00 -1.54 0.00 0.00 39.78 35.03 1o3m n ASN 25 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1o3m n THR 26 N -3.35 0.00 -3.51 3.41 -2.24 -1.11 -4.12 114.28 103.36 1o3m n THR 26 Ca -0.18 -0.04 -0.27 0.00 -2.27 0.00 0.00 64.05 61.29 1o3m n THR 26 Cb 0.62 0.04 -0.09 0.00 -2.10 0.00 0.00 70.33 68.80 1o3m n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1o3m n VAL 27 N -1.20 0.82 0.31 2.28 0.31 -1.26 -4.97 118.33 114.61 1o3m n VAL 27 Ca 0.09 -4.52 0.15 0.00 -0.01 0.00 0.00 64.34 60.06 1o3m n VAL 27 Cb 0.32 -2.01 0.68 0.00 -0.91 0.00 0.00 33.84 31.93 1o3m n VAL 27 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1o3m h PRO 28 N 4.78 0.00 -0.01 5.55 0.13 -1.78 -2.39 132.00 138.27 1o3m h PRO 28 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1o3m h PRO 28 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 1o3m h PRO 28 CO 0.63 0.00 -0.10 2.48 -0.23 0.00 0.00 178.00 180.79 1o3m n TYR 29 N -2.67 0.00 -2.48 1.56 4.11 -1.20 -2.41 117.16 114.08 1o3m n TYR 29 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 57.90 57.48 1o3m n TYR 29 Cb 0.21 -0.04 -0.03 0.00 -0.00 0.00 0.00 39.34 39.48 1o3m n TYR 29 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.86 175.72 1o3m s GLN 30 N -2.17 4.47 0.27 -3.48 2.00 -0.90 -1.05 119.66 118.80 1o3m s GLN 30 Ca 0.32 1.71 0.09 0.00 -2.00 0.00 0.00 55.36 55.48 1o3m s GLN 30 Cb 0.20 -3.36 -0.05 0.00 0.80 0.00 0.00 33.01 30.60 1o3m s GLN 30 CO 0.40 -0.19 -0.13 0.14 -0.50 0.00 0.00 175.29 175.00 1o3m s VAL 31 N 0.92 2.04 -0.11 1.34 -7.23 -0.62 -4.50 120.40 112.23 1o3m s VAL 31 Ca 0.57 -2.25 0.02 0.00 -1.81 0.00 0.00 61.98 58.51 1o3m s VAL 31 Cb -0.28 -2.33 -0.01 0.00 0.56 0.00 0.00 36.38 34.32 1o3m s VAL 31 CO 0.30 -0.39 -0.19 -0.55 -0.31 0.00 0.00 175.10 173.95 1o3m s SER 32 N -3.46 3.54 -0.20 4.85 0.15 -0.70 -2.41 113.70 115.47 1o3m s SER 32 Ca 0.28 -0.43 -0.13 0.00 0.70 0.00 0.00 55.95 56.37 1o3m s SER 32 Cb -0.00 -1.42 -0.05 0.00 -1.71 0.00 0.00 66.02 62.85 1o3m s SER 32 CO 0.12 0.18 0.27 -0.76 1.20 0.00 0.00 173.24 174.26 1o3m s LEU 33 N 0.24 4.17 -0.05 3.45 1.43 0.06 -1.04 118.68 126.94 1o3m s LEU 33 Ca -0.12 0.37 0.05 0.00 -1.03 0.00 0.00 54.13 53.39 1o3m s LEU 33 Cb -0.16 -2.32 -0.01 0.00 0.03 0.00 0.00 46.19 43.73 1o3m s LEU 33 CO 0.07 0.04 -0.20 0.21 0.23 0.00 0.00 176.35 176.69 1o3m s ASN 34 N 0.83 2.52 -0.32 2.29 3.84 -0.11 -2.08 114.94 121.90 1o3m s ASN 34 Ca 0.14 -0.42 0.16 0.00 0.21 0.00 0.00 52.86 52.95 1o3m s ASN 34 Cb -0.14 -0.68 0.47 0.00 -0.55 0.00 0.00 41.25 40.35 1o3m s ASN 34 CO 0.05 0.19 1.04 -1.54 -2.79 0.00 0.00 177.10 174.05 1o3m n SER 37 N 3.05 2.36 0.00 -4.21 3.41 -1.26 -1.28 113.62 115.69 1o3m n SER 37 Ca -0.18 -2.81 0.00 0.00 -0.26 0.00 0.00 58.87 55.63 1o3m n SER 37 Cb 0.53 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 1o3m n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1o3m n GLY 38 N -0.33 0.33 3.58 5.00 0.00 -1.26 -4.99 105.19 107.52 1o3m n GLY 38 Ca 0.17 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.14 1o3m n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1o3m s TYR 39 N -2.00 -0.19 -0.05 1.61 1.13 -1.26 -5.14 117.35 111.45 1o3m s TYR 39 Ca 0.00 0.09 -0.30 0.00 -1.41 0.00 0.00 57.07 55.45 1o3m s TYR 39 Cb 0.00 0.54 -0.02 0.00 -1.10 0.00 0.00 41.96 41.37 1o3m s TYR 39 CO 0.00 -0.37 0.98 -1.58 -2.51 0.00 0.00 175.55 172.07 1o3m s HIS 40 N -2.72 3.59 0.00 -3.49 5.65 -1.26 -4.31 115.29 112.76 1o3m s HIS 40 Ca 0.09 1.64 0.00 0.00 0.25 0.00 0.00 55.06 57.04 1o3m s HIS 40 Cb -0.00 -3.14 0.00 0.00 -1.18 0.00 0.00 32.58 28.26 1o3m s HIS 40 CO -0.05 -0.10 0.00 1.97 -0.65 0.00 0.00 174.74 175.91 1o3m n PHE 41 N 4.37 0.00 -3.82 3.88 -1.74 -0.88 -4.99 117.46 114.28 1o3m n PHE 41 Ca 0.07 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.87 1o3m n PHE 41 Cb 0.50 0.00 -0.04 0.00 1.52 0.00 0.00 39.48 41.46 1o3m n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1o3m n GLY 43 N -0.38 2.63 3.79 0.00 0.00 -0.04 -0.76 105.19 110.44 1o3m n GLY 43 Ca -0.07 -2.28 -0.02 0.00 0.00 0.00 0.00 46.02 43.65 1o3m n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1o3m s GLY 44 N -4.13 -0.14 -0.03 -0.02 0.00 -1.01 -3.67 107.32 98.31 1o3m s GLY 44 Ca 0.34 0.07 0.05 0.00 0.00 0.00 0.00 44.72 45.18 1o3m s GLY 44 CO 0.21 1.40 -0.17 -0.56 0.00 0.00 0.00 173.10 173.98 1o3m s SER 45 N -3.20 2.15 -0.25 1.64 0.01 -0.23 -1.59 113.70 112.23 1o3m s SER 45 Ca 0.18 -0.34 -0.26 0.00 1.31 0.00 0.00 55.95 56.83 1o3m s SER 45 Cb -0.00 -0.49 0.00 0.00 0.21 0.00 0.00 66.02 65.74 1o3m s SER 45 CO 0.02 0.17 0.89 -0.22 0.41 0.00 0.00 173.24 174.51 1o3m s LEU 46 N -0.10 4.08 -0.01 2.44 2.96 -0.21 -0.89 118.68 126.95 1o3m s LEU 46 Ca -0.01 1.08 0.15 0.00 -0.22 0.00 0.00 54.13 55.14 1o3m s LEU 46 Cb -0.10 -3.28 -0.19 0.00 0.50 0.00 0.00 46.19 43.12 1o3m s LEU 46 CO 0.01 -0.58 0.52 2.30 -1.32 0.00 0.00 176.35 177.29 1o3m n ILE 47 N 5.32 0.00 -3.82 6.68 -5.35 -0.81 -1.10 119.36 120.29 1o3m n ILE 47 Ca 0.07 -0.23 -0.08 0.00 -0.27 0.00 0.00 62.75 62.25 1o3m n ILE 47 Cb 0.47 0.68 0.02 0.00 -1.74 0.00 0.00 39.64 39.07 1o3m n ILE 47 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1o3m s ASN 48 N -2.91 -0.00 0.07 7.28 2.20 -1.21 -4.55 114.94 115.82 1o3m s ASN 48 Ca 0.01 -1.04 0.17 0.00 -0.94 0.00 0.00 52.86 51.06 1o3m s ASN 48 Cb 0.11 0.78 0.71 0.00 -2.00 0.00 0.00 41.25 40.85 1o3m s ASN 48 CO 0.62 -1.55 1.52 -1.54 -2.94 0.00 0.00 177.10 173.22 1o3m n SER 49 N -1.35 0.19 0.00 3.54 3.41 -1.26 -3.47 113.62 114.68 1o3m n SER 49 Ca -0.07 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 59.09 1o3m n SER 49 Cb 0.60 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 1o3m n SER 49 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 1o3m n GLN 50 N -1.71 0.85 -4.43 4.33 7.27 -1.26 -0.40 117.38 122.02 1o3m n GLN 50 Ca 0.03 -0.82 -0.20 0.00 0.07 0.00 0.00 57.00 56.09 1o3m n GLN 50 Cb 0.18 -0.84 -0.14 0.00 2.41 0.00 0.00 30.24 31.84 1o3m n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1o3m s TRP 51 N -0.38 1.00 0.09 3.69 0.52 -1.23 -0.45 118.94 122.17 1o3m s TRP 51 Ca 0.00 -0.22 0.08 0.00 0.02 0.00 0.00 56.10 55.98 1o3m s TRP 51 Cb 0.00 -0.63 -0.03 0.00 -1.15 0.00 0.00 33.47 31.66 1o3m s TRP 51 CO 0.00 -0.01 -0.22 0.08 0.02 0.00 0.00 176.95 176.82 1o3m s VAL 52 N -0.40 1.79 -0.07 4.03 1.01 -0.44 -1.92 120.40 124.41 1o3m s VAL 52 Ca 0.03 -1.50 0.04 0.00 0.00 0.00 0.00 61.98 60.55 1o3m s VAL 52 Cb -0.05 -1.61 -0.02 0.00 0.00 0.00 0.00 36.38 34.71 1o3m s VAL 52 CO -0.00 0.03 -0.19 -0.69 0.00 0.00 0.00 175.10 174.25 1o3m s VAL 53 N -1.06 2.59 0.00 2.92 1.01 -0.06 -1.23 120.40 124.56 1o3m s VAL 53 Ca 0.08 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.19 1o3m s VAL 53 Cb -0.10 -2.00 0.00 0.00 0.00 0.00 0.00 36.38 34.28 1o3m s VAL 53 CO 0.04 0.57 0.00 -0.24 0.00 0.00 0.00 175.10 175.47 1o3m n SER 54 N 2.85 0.00 -4.88 3.32 2.88 -0.04 -1.07 113.62 116.68 1o3m n SER 54 Ca -0.17 -0.41 -0.34 0.00 -1.33 0.00 0.00 58.87 56.62 1o3m n SER 54 Cb 0.52 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.93 1o3m n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1o3m s ALA 55 N -1.75 3.90 0.41 -1.46 0.00 -1.26 -0.90 121.76 120.70 1o3m s ALA 55 Ca 0.00 -0.76 0.08 0.00 0.00 0.00 0.00 51.96 51.28 1o3m s ALA 55 Cb 0.00 -1.85 0.86 0.00 0.00 0.00 0.00 23.12 22.13 1o3m s ALA 55 CO 0.00 0.73 2.02 0.00 0.00 0.00 0.00 175.76 178.51 1o3m h ALA 56 N 4.00 1.66 0.00 0.00 0.00 -1.69 -1.13 119.26 122.10 1o3m h ALA 56 Ca -0.50 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1o3m h ALA 56 Cb 1.19 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1o3m h ALA 56 CO 0.67 0.27 0.00 -2.39 0.00 0.00 0.00 179.25 177.80 1o3m n HIS 57 N -4.42 0.00 1.25 0.00 1.44 -1.26 -1.86 115.22 110.37 1o3m n HIS 57 Ca 0.01 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.85 1o3m n HIS 57 Cb 0.12 -0.29 0.33 0.00 0.12 0.00 0.00 29.99 30.28 1o3m n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1o3m n TYR 59 N -0.11 2.38 -3.77 0.00 4.19 -0.78 -4.98 117.16 114.09 1o3m n TYR 59 Ca 0.14 0.33 -0.04 0.00 3.31 0.00 0.00 57.90 61.64 1o3m n TYR 59 Cb 0.39 -2.52 -0.01 0.00 0.49 0.00 0.00 39.34 37.69 1o3m n TYR 59 CO 0.00 0.00 0.00 -1.59 0.91 0.00 0.00 176.86 176.18 1o3m s LYS 60 N 0.01 1.25 0.36 2.98 -2.85 -1.26 -5.15 119.74 115.07 1o3m s LYS 60 Ca 0.70 -0.70 0.07 0.00 -1.00 0.00 0.00 55.97 55.05 1o3m s LYS 60 Cb -0.61 0.42 -0.01 0.00 -2.06 0.00 0.00 37.83 35.57 1o3m s LYS 60 CO 0.45 -0.57 0.46 -1.54 0.10 0.00 0.00 175.35 174.25 1o3m s SER 61 N -2.97 5.77 -0.04 0.03 1.04 -1.26 -4.57 113.70 111.71 1o3m s SER 61 Ca 0.13 -0.31 -0.00 0.00 0.48 0.00 0.00 55.95 56.25 1o3m s SER 61 Cb -0.02 -1.04 0.00 0.00 0.10 0.00 0.00 66.02 65.06 1o3m s SER 61 CO 0.03 -0.51 0.03 0.61 0.98 0.00 0.00 173.24 174.38 1o3m n GLY 62 N -1.65 0.82 3.75 7.32 0.00 -1.26 -5.02 105.19 109.15 1o3m n GLY 62 Ca 0.02 -0.69 -0.36 0.00 0.00 0.00 0.00 46.02 44.98 1o3m n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1o3m s ILE 63 N -2.84 5.32 -0.10 -0.61 1.01 -1.26 -4.42 121.20 118.30 1o3m s ILE 63 Ca 0.01 0.47 0.02 0.00 0.00 0.00 0.00 60.65 61.15 1o3m s ILE 63 Cb -0.01 -3.58 -0.02 0.00 0.01 0.00 0.00 42.46 38.86 1o3m s ILE 63 CO 0.02 0.44 -0.15 -1.58 0.00 0.00 0.00 174.94 173.66 1o3m s GLN 64 N 0.16 3.05 -0.18 2.79 0.74 -0.40 -2.07 119.66 123.75 1o3m s GLN 64 Ca 0.15 -0.72 -0.13 0.00 0.05 0.00 0.00 55.36 54.71 1o3m s GLN 64 Cb -0.13 -2.50 -0.05 0.00 1.10 0.00 0.00 33.01 31.43 1o3m s GLN 64 CO 0.04 0.34 0.27 0.08 -0.55 0.00 0.00 175.29 175.46 1o3m s VAL 65 N 0.00 5.31 -0.26 1.34 1.01 0.45 -0.94 120.40 127.32 1o3m s VAL 65 Ca -0.05 0.48 -0.02 0.00 0.00 0.00 0.00 61.98 62.40 1o3m s VAL 65 Cb -0.14 -3.61 0.03 0.00 0.00 0.00 0.00 36.38 32.66 1o3m s VAL 65 CO 0.04 0.37 -0.05 -0.13 0.00 0.00 0.00 175.10 175.34 1o3m s ARG 65 N 0.63 2.76 0.26 2.72 0.52 -0.21 -1.06 118.95 124.57 1o3m s ARG 65 Ca 0.15 -1.03 0.07 0.00 -0.52 0.00 0.00 55.73 54.39 1o3m s ARG 65 Cb -0.13 -3.02 -0.03 0.00 0.52 0.00 0.00 34.95 32.29 1o3m s ARG 65 CO 0.03 -0.44 0.27 -0.51 0.02 0.00 0.00 175.30 174.67 1o3m s LEU 66 N 1.31 3.93 -1.56 2.53 1.02 0.00 -1.72 118.68 124.20 1o3m s LEU 66 Ca -0.01 -0.19 0.00 0.00 0.02 0.00 0.00 54.13 53.95 1o3m s LEU 66 Cb -0.17 -2.49 0.00 0.00 0.02 0.00 0.00 46.19 43.55 1o3m s LEU 66 CO -0.04 -0.11 0.00 0.61 0.02 0.00 0.00 176.35 176.84 1o3m n GLY 69 N -1.29 1.14 3.88 -3.19 0.00 -1.26 -1.69 105.19 102.78 1o3m n GLY 69 Ca -0.07 -0.28 -0.30 0.00 0.00 0.00 0.00 46.02 45.37 1o3m n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1o3m s GLU 70 N -3.65 3.75 0.00 1.61 0.41 -1.26 -3.98 118.70 115.57 1o3m s GLU 70 Ca 0.00 0.38 0.00 0.00 -0.41 0.00 0.00 54.97 54.94 1o3m s GLU 70 Cb 0.00 -2.43 0.00 0.00 -1.78 0.00 0.00 34.13 29.92 1o3m s GLU 70 CO 0.00 -0.00 0.00 -3.47 -0.49 0.00 0.00 175.26 171.30 1o3m n ASP 71 N -1.27 0.00 -4.62 -0.19 4.64 -1.26 -4.61 116.55 109.24 1o3m n ASP 71 Ca 0.02 0.00 -0.43 0.00 -1.38 0.00 0.00 54.79 53.00 1o3m n ASP 71 Cb 0.54 0.00 -0.02 0.00 -1.04 0.00 0.00 41.12 40.60 1o3m n ASP 71 CO 0.00 0.00 0.00 0.21 -0.82 0.00 0.00 177.20 176.59 1o3m s ASN 72 N 1.00 6.76 0.00 1.67 3.84 -1.26 -3.17 114.94 123.78 1o3m s ASN 72 Ca 0.00 0.71 0.25 0.00 0.21 0.00 0.00 52.86 54.03 1o3m s ASN 72 Cb 0.00 -2.55 1.37 0.00 -0.55 0.00 0.00 41.25 39.52 1o3m s ASN 72 CO 0.00 -1.10 1.85 2.30 -2.79 0.00 0.00 177.10 177.36 1o3m n ILE 73 N 6.45 0.13 0.69 -5.21 -5.35 -0.30 -3.20 119.36 112.57 1o3m n ILE 73 Ca 0.12 0.03 0.07 0.00 -0.27 0.00 0.00 62.75 62.70 1o3m n ILE 73 Cb 0.48 -0.63 -0.05 0.00 -1.74 0.00 0.00 39.64 37.71 1o3m n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1o3m n ASN 74 N -1.17 1.10 -4.17 7.28 3.02 -1.26 -4.96 115.26 115.10 1o3m n ASN 74 Ca 0.15 -1.05 -0.27 0.00 -0.03 0.00 0.00 54.58 53.38 1o3m n ASN 74 Cb 0.15 0.76 -0.16 0.00 -0.61 0.00 0.00 39.78 39.92 1o3m n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1o3m s VAL 75 N -2.15 1.58 -0.38 2.41 1.01 -1.19 -5.09 120.40 116.59 1o3m s VAL 75 Ca 0.09 -0.80 -0.24 0.00 0.00 0.00 0.00 61.98 61.02 1o3m s VAL 75 Cb 0.12 -1.35 0.01 0.00 0.00 0.00 0.00 36.38 35.16 1o3m s VAL 75 CO 0.51 0.45 0.85 -0.69 0.00 0.00 0.00 175.10 176.22 1o3m s VAL 76 N -0.01 4.64 -0.71 2.92 1.01 -1.26 -4.75 120.40 122.24 1o3m s VAL 76 Ca -0.04 0.94 0.13 0.00 0.00 0.00 0.00 61.98 63.01 1o3m s VAL 76 Cb -0.12 -4.29 -0.11 0.00 0.00 0.00 0.00 36.38 31.86 1o3m s VAL 76 CO 0.03 -0.54 0.58 -0.62 0.00 0.00 0.00 175.10 174.54 1o3m n GLU 77 N 6.66 2.64 0.00 2.72 1.02 -1.26 -5.09 120.64 127.34 1o3m n GLU 77 Ca 0.05 -0.13 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 1o3m n GLU 77 Cb 0.48 -1.11 0.00 0.00 -0.02 0.00 0.00 31.44 30.79 1o3m n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1o3m n GLY 78 N 1.25 2.78 1.81 0.62 0.00 -1.26 -4.99 105.19 105.40 1o3m n GLY 78 Ca 0.03 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.29 1o3m n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1o3m n ASN 79 N 0.00 0.00 -4.78 1.61 3.02 -1.26 -4.96 115.26 108.89 1o3m n ASN 79 Ca 0.00 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.18 1o3m n ASN 79 Cb 0.00 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.14 1o3m n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1o3m s GLU 80 N -0.40 4.12 -0.06 3.52 8.01 -1.26 -4.21 118.70 128.43 1o3m s GLU 80 Ca 0.00 1.62 -0.01 0.00 0.01 0.00 0.00 54.97 56.60 1o3m s GLU 80 Cb 0.00 -2.59 0.03 0.00 -4.31 0.00 0.00 34.13 27.26 1o3m s GLU 80 CO 0.00 -0.21 -0.01 -0.65 0.01 0.00 0.00 175.26 174.40 1o3m s GLN 81 N -2.42 0.63 -0.27 1.61 -0.21 -0.68 -4.97 119.66 113.34 1o3m s GLN 81 Ca 0.58 0.05 -0.05 0.00 0.02 0.00 0.00 55.36 55.96 1o3m s GLN 81 Cb -0.25 -0.88 0.01 0.00 1.00 0.00 0.00 33.01 32.89 1o3m s GLN 81 CO 0.31 -0.23 0.02 -0.06 -2.12 0.00 0.00 175.29 173.21 1o3m s PHE 82 N 1.60 3.10 -0.04 0.91 0.08 -1.26 -0.82 117.98 121.55 1o3m s PHE 82 Ca -0.01 -1.14 0.04 0.00 0.12 0.00 0.00 56.93 55.94 1o3m s PHE 82 Cb -0.13 -2.17 -0.00 0.00 -0.57 0.00 0.00 43.02 40.15 1o3m s PHE 82 CO -0.04 -0.61 -0.15 0.42 -0.10 0.00 0.00 175.22 174.74 1o3m s ILE 83 N 1.44 1.25 0.58 0.64 1.01 -0.22 -4.96 121.20 120.93 1o3m s ILE 83 Ca 0.02 -0.62 -0.15 0.00 0.00 0.00 0.00 60.65 59.90 1o3m s ILE 83 Cb -0.17 -1.08 -0.05 0.00 0.01 0.00 0.00 42.46 41.18 1o3m s ILE 83 CO -0.00 0.37 1.03 -0.44 0.00 0.00 0.00 174.94 175.89 1o3m s SER 84 N 0.06 6.06 0.12 3.58 0.01 -1.26 -0.41 113.70 121.85 1o3m s SER 84 Ca -0.03 1.70 -0.28 0.00 1.31 0.00 0.00 55.95 58.65 1o3m s SER 84 Cb -0.10 -2.52 -0.07 0.00 0.21 0.00 0.00 66.02 63.54 1o3m s SER 84 CO 0.02 -0.98 0.89 0.00 0.41 0.00 0.00 173.24 173.57 1o3m s ALA 85 N -2.58 3.32 -0.06 1.44 0.00 -0.88 -1.14 121.76 121.85 1o3m s ALA 85 Ca 0.61 0.49 0.05 0.00 0.00 0.00 0.00 51.96 53.11 1o3m s ALA 85 Cb -0.14 -3.16 -0.24 0.00 0.00 0.00 0.00 23.12 19.58 1o3m s ALA 85 CO 0.37 0.07 0.61 0.66 0.00 0.00 0.00 175.76 177.47 1o3m h SER 86 N 5.20 0.17 -4.54 0.00 4.64 -1.01 -3.43 113.55 114.58 1o3m h SER 86 Ca -0.44 -0.35 0.04 0.00 -0.47 0.00 0.00 61.79 60.56 1o3m h SER 86 Cb 1.21 -0.05 -0.20 0.00 -0.31 0.00 0.00 62.40 63.05 1o3m h SER 86 CO 0.70 1.31 0.40 -1.59 -0.87 0.00 0.00 176.83 176.79 1o3m s LYS 87 N -2.59 0.82 -0.03 4.77 -2.85 -1.21 -5.00 119.74 113.65 1o3m s LYS 87 Ca -0.10 0.07 0.07 0.00 -1.00 0.00 0.00 55.97 55.00 1o3m s LYS 87 Cb 0.07 0.39 -0.02 0.00 -2.06 0.00 0.00 37.83 36.21 1o3m s LYS 87 CO 0.81 -0.28 -0.25 -1.12 0.10 0.00 0.00 175.35 174.61 1o3m s SER 88 N -1.47 3.11 -0.31 0.03 0.01 -1.26 -1.19 113.70 112.61 1o3m s SER 88 Ca -0.03 -0.46 0.04 0.00 1.31 0.00 0.00 55.95 56.80 1o3m s SER 88 Cb -0.00 -0.49 0.09 0.00 0.21 0.00 0.00 66.02 65.82 1o3m s SER 88 CO 0.01 0.30 0.00 -0.63 0.41 0.00 0.00 173.24 173.34 1o3m s ILE 89 N -0.51 2.20 0.27 1.44 1.01 0.88 -4.96 121.20 121.52 1o3m s ILE 89 Ca 0.07 -2.09 -0.28 0.00 0.00 0.00 0.00 60.65 58.35 1o3m s ILE 89 Cb -0.11 -2.52 -0.09 0.00 0.01 0.00 0.00 42.46 39.75 1o3m s ILE 89 CO 0.00 -0.42 0.93 -0.69 0.00 0.00 0.00 174.94 174.76 1o3m s VAL 90 N 0.99 4.14 0.16 2.92 1.01 -1.26 -1.57 120.40 126.80 1o3m s VAL 90 Ca 0.05 1.96 -0.34 0.00 0.00 0.00 0.00 61.98 63.65 1o3m s VAL 90 Cb -0.19 -4.19 -0.15 0.00 0.00 0.00 0.00 36.38 31.85 1o3m s VAL 90 CO -0.07 0.36 1.42 1.57 0.00 0.00 0.00 175.10 178.37 1o3m n HIS 91 N 1.12 1.91 0.21 5.22 -0.00 -0.83 -4.84 115.22 118.01 1o3m n HIS 91 Ca -0.01 0.46 0.13 0.00 0.46 0.00 0.00 57.72 58.77 1o3m n HIS 91 Cb 0.48 -2.43 0.72 0.00 -0.12 0.00 0.00 29.99 28.65 1o3m n HIS 91 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1o3m h PRO 92 N 4.80 0.00 -0.64 1.57 0.11 -1.93 -1.99 132.00 133.92 1o3m h PRO 92 Ca -0.45 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.61 1o3m h PRO 92 Cb 1.29 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.37 1o3m h PRO 92 CO 0.80 0.00 0.06 0.43 -0.21 0.00 0.00 178.00 179.08 1o3m n SER 93 N -4.28 5.33 -4.75 -2.05 7.64 -1.26 -4.96 113.62 109.29 1o3m n SER 93 Ca 0.00 -2.95 -0.41 0.00 1.01 0.00 0.00 58.87 56.52 1o3m n SER 93 Cb 0.22 -0.69 -0.02 0.00 -1.01 0.00 0.00 64.21 62.71 1o3m n SER 93 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1o3m s TYR 94 N -2.72 2.98 -0.28 1.43 6.04 -0.75 -4.66 117.35 119.39 1o3m s TYR 94 Ca 0.52 1.13 0.01 0.00 0.04 0.00 0.00 57.07 58.77 1o3m s TYR 94 Cb 0.40 -3.81 0.06 0.00 -1.04 0.00 0.00 41.96 37.57 1o3m s TYR 94 CO 0.15 -2.53 -0.06 1.21 -1.54 0.00 0.00 175.55 172.78 1o3m s ASN 95 N 0.12 4.62 0.03 4.32 3.84 -0.92 -5.00 114.94 121.95 1o3m s ASN 95 Ca 0.56 -1.39 0.16 0.00 0.21 0.00 0.00 52.86 52.41 1o3m s ASN 95 Cb -0.42 -1.61 0.70 0.00 -0.55 0.00 0.00 41.25 39.37 1o3m s ASN 95 CO 0.48 -0.22 1.52 -1.54 -2.79 0.00 0.00 177.10 174.54 1o3m n SER 96 N 4.49 0.08 -0.01 -4.21 3.41 -1.26 -0.26 113.62 115.87 1o3m n SER 96 Ca -0.13 0.52 -0.17 0.00 -0.26 0.00 0.00 58.87 58.83 1o3m n SER 96 Cb 0.42 -0.54 -0.14 0.00 -0.26 0.00 0.00 64.21 63.70 1o3m n SER 96 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1o3m n ASN 97 N -1.59 1.71 -0.01 4.04 3.02 -1.26 -4.33 115.26 116.84 1o3m n ASN 97 Ca 0.04 0.26 0.10 0.00 -0.03 0.00 0.00 54.58 54.95 1o3m n ASN 97 Cb 0.19 -0.59 -0.14 0.00 -0.61 0.00 0.00 39.78 38.63 1o3m n ASN 97 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1o3m n THR 98 N -3.33 0.00 -1.95 3.41 -2.24 -1.15 -4.96 114.28 104.05 1o3m n THR 98 Ca -0.28 -0.29 -0.14 0.00 -2.27 0.00 0.00 64.05 61.08 1o3m n THR 98 Cb 1.05 0.44 -0.03 0.00 -2.10 0.00 0.00 70.33 69.69 1o3m n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1o3m n LEU 99 N -1.89 -1.40 -4.76 3.22 4.77 0.65 -4.99 117.00 112.59 1o3m n LEU 99 Ca -0.01 0.11 -0.39 0.00 -0.03 0.00 0.00 56.01 55.70 1o3m n LEU 99 Cb 0.43 -2.10 -0.05 0.00 -2.33 0.00 0.00 43.42 39.37 1o3m n LEU 99 CO 0.41 -0.35 0.73 0.21 -1.33 0.00 0.00 177.39 177.05 1o3m s ASN 100 N -2.55 7.26 -0.93 -1.43 2.47 -1.21 -3.17 114.94 115.38 1o3m s ASN 100 Ca 0.00 2.09 -0.04 0.00 0.42 0.00 0.00 52.86 55.34 1o3m s ASN 100 Cb 0.00 -2.61 0.00 0.00 -1.45 0.00 0.00 41.25 37.20 1o3m s ASN 100 CO 0.00 -0.14 0.80 0.59 -3.72 0.00 0.00 177.10 174.64 1o3m n ASN 101 N 0.92 -3.81 -4.42 -4.21 3.02 -1.26 -2.17 115.26 103.32 1o3m n ASN 101 Ca 0.00 -0.42 -0.43 0.00 -0.03 0.00 0.00 54.58 53.71 1o3m n ASN 101 Cb 0.47 -3.82 0.00 0.00 -0.61 0.00 0.00 39.78 35.82 1o3m n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1o3m n ASP 102 N -2.11 4.92 -3.75 6.41 2.03 -1.19 -4.39 116.55 118.47 1o3m n ASP 102 Ca -0.09 -2.94 -0.13 0.00 0.52 0.00 0.00 54.79 52.15 1o3m n ASP 102 Cb 0.58 -1.68 -0.09 0.00 -0.72 0.00 0.00 41.12 39.21 1o3m n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1o3m s ILE 103 N 3.18 0.03 -0.02 5.18 2.07 -1.26 -3.96 121.20 126.42 1o3m s ILE 103 Ca 0.49 -0.25 -0.06 0.00 -1.41 0.00 0.00 60.65 59.42 1o3m s ILE 103 Cb 0.03 -0.57 0.01 0.00 0.13 0.00 0.00 42.46 42.06 1o3m s ILE 103 CO 0.04 -0.14 0.14 -0.32 -1.91 0.00 0.00 174.94 172.75 1o3m s MET 104 N -0.63 0.37 -0.04 3.50 -2.45 -0.08 -1.97 119.30 118.00 1o3m s MET 104 Ca -0.07 -0.20 0.03 0.00 -1.25 0.00 0.00 55.69 54.20 1o3m s MET 104 Cb -0.04 0.16 -0.03 0.00 1.25 0.00 0.00 34.83 36.17 1o3m s MET 104 CO 0.03 -0.08 -0.11 -0.51 1.05 0.00 0.00 175.02 175.40 1o3m s LEU 105 N -0.88 2.94 -0.10 4.11 1.43 -0.61 -0.86 118.68 124.71 1o3m s LEU 105 Ca -0.10 -0.14 0.02 0.00 -1.03 0.00 0.00 54.13 52.88 1o3m s LEU 105 Cb -0.05 -1.64 0.01 0.00 0.03 0.00 0.00 46.19 44.54 1o3m s LEU 105 CO 0.01 0.34 -0.17 -0.63 0.23 0.00 0.00 176.35 176.13 1o3m s ILE 106 N -0.82 1.59 -0.12 -0.59 1.01 -0.37 -0.08 121.20 121.82 1o3m s ILE 106 Ca 0.13 -0.71 -0.09 0.00 0.00 0.00 0.00 60.65 59.98 1o3m s ILE 106 Cb -0.11 -1.43 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 1o3m s ILE 106 CO 0.02 0.46 0.18 -0.75 0.00 0.00 0.00 174.94 174.85 1o3m s LYS 107 N 0.79 3.68 0.29 2.79 2.20 -0.33 -1.33 119.74 127.82 1o3m s LYS 107 Ca -0.10 -0.06 -0.16 0.00 -0.36 0.00 0.00 55.97 55.29 1o3m s LYS 107 Cb -0.16 -3.25 -0.09 0.00 -1.51 0.00 0.00 37.83 32.83 1o3m s LYS 107 CO 0.01 0.65 0.72 -0.51 -0.36 0.00 0.00 175.35 175.87 1o3m s LEU 108 N -0.71 4.15 0.15 5.43 1.43 0.40 -0.48 118.68 129.05 1o3m s LEU 108 Ca 0.15 1.30 -0.15 0.00 -1.03 0.00 0.00 54.13 54.40 1o3m s LEU 108 Cb -0.13 -3.91 0.01 0.00 0.03 0.00 0.00 46.19 42.20 1o3m s LEU 108 CO 0.04 -0.13 1.74 0.50 0.23 0.00 0.00 176.35 178.73 1o3m h LYS 109 N 2.63 0.61 -5.71 1.70 3.64 -1.41 -3.41 116.57 114.62 1o3m h LYS 109 Ca -0.48 -0.08 -0.48 0.00 -1.27 0.00 0.00 60.65 58.34 1o3m h LYS 109 Cb 1.18 -0.11 -0.15 0.00 -0.41 0.00 0.00 32.23 32.74 1o3m h LYS 109 CO 0.65 0.51 -0.75 -1.54 -2.27 0.00 0.00 179.45 176.06 1o3m s SER 110 N -5.78 2.71 0.48 4.20 1.04 -1.26 -4.99 113.70 110.11 1o3m s SER 110 Ca -0.13 -0.99 -0.19 0.00 0.48 0.00 0.00 55.95 55.12 1o3m s SER 110 Cb 0.11 -0.16 -0.09 0.00 0.10 0.00 0.00 66.02 65.98 1o3m s SER 110 CO 0.75 -0.12 1.00 0.00 0.98 0.00 0.00 173.24 175.84 1o3m s ALA 111 N -2.73 2.96 0.46 5.32 0.00 -1.26 -4.84 121.76 121.67 1o3m s ALA 111 Ca 0.22 0.42 -0.13 0.00 0.00 0.00 0.00 51.96 52.46 1o3m s ALA 111 Cb -0.02 -3.18 -0.07 0.00 0.00 0.00 0.00 23.12 19.84 1o3m s ALA 111 CO 0.08 -0.18 0.87 0.00 0.00 0.00 0.00 175.76 176.53 1o3m s ALA 112 N -2.24 3.22 -0.31 0.00 0.00 0.46 -5.00 121.76 117.90 1o3m s ALA 112 Ca 0.63 -0.03 -0.22 0.00 0.00 0.00 0.00 51.96 52.34 1o3m s ALA 112 Cb -0.12 -2.89 -0.00 0.00 0.00 0.00 0.00 23.12 20.10 1o3m s ALA 112 CO 0.21 -0.12 0.69 -1.54 0.00 0.00 0.00 175.76 175.00 1o3m s SER 113 N -3.14 6.56 0.07 0.00 1.04 -1.26 -4.87 113.70 112.09 1o3m s SER 113 Ca 0.55 0.51 -0.10 0.00 0.48 0.00 0.00 55.95 57.38 1o3m s SER 113 Cb -0.10 -2.36 -0.06 0.00 0.10 0.00 0.00 66.02 63.60 1o3m s SER 113 CO 0.32 -0.54 0.39 -0.76 0.98 0.00 0.00 173.24 173.63 1o3m s LEU 114 N 2.75 4.36 0.00 2.42 1.43 -1.26 -4.81 118.68 123.57 1o3m s LEU 114 Ca 0.28 0.79 0.00 0.00 -1.03 0.00 0.00 54.13 54.17 1o3m s LEU 114 Cb -0.15 -2.94 0.00 0.00 0.03 0.00 0.00 46.19 43.13 1o3m s LEU 114 CO 0.12 0.18 0.00 -0.46 0.23 0.00 0.00 176.35 176.43 1o3m n ASN 115 N 0.97 1.22 0.02 2.29 0.23 0.22 -4.97 115.26 115.23 1o3m n ASN 115 Ca -0.08 0.00 -0.03 0.00 -0.53 0.00 0.00 54.58 53.94 1o3m n ASN 115 Cb 0.52 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.12 1o3m n ASN 115 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1o3m n SER 116 N 0.00 0.88 0.14 0.53 3.41 -1.26 -3.92 113.62 113.40 1o3m n SER 116 Ca 0.00 0.40 0.09 0.00 -0.26 0.00 0.00 58.87 59.09 1o3m n SER 116 Cb 0.00 0.07 0.05 0.00 -0.26 0.00 0.00 64.21 64.08 1o3m n SER 116 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1o3m h ARG 117 N 0.00 0.00 -4.27 4.33 -0.00 -1.94 -3.43 114.38 109.07 1o3m h ARG 117 Ca -0.20 0.00 -0.54 0.00 -0.50 0.00 0.00 59.98 58.74 1o3m h ARG 117 Cb 1.71 0.00 -0.37 0.00 0.00 0.00 0.00 29.97 31.31 1o3m h ARG 117 CO 0.06 0.12 -0.80 0.08 0.00 0.00 0.00 179.97 179.42 1o3m s VAL 118 N -3.19 1.11 0.08 2.04 1.01 -1.25 -4.47 120.40 115.73 1o3m s VAL 118 Ca 0.03 -0.40 -0.09 0.00 0.00 0.00 0.00 61.98 61.52 1o3m s VAL 118 Cb 0.07 -1.15 -0.00 0.00 0.00 0.00 0.00 36.38 35.31 1o3m s VAL 118 CO 0.74 0.33 0.19 0.00 0.00 0.00 0.00 175.10 176.37 1o3m s ALA 119 N 1.67 -0.25 0.49 5.51 0.00 -1.01 -0.61 121.76 127.55 1o3m s ALA 119 Ca 0.04 -0.57 0.03 0.00 0.00 0.00 0.00 51.96 51.46 1o3m s ALA 119 Cb -0.13 0.46 0.02 0.00 0.00 0.00 0.00 23.12 23.47 1o3m s ALA 119 CO -0.08 -0.49 0.69 -1.54 0.00 0.00 0.00 175.76 174.34 1o3m s SER 120 N -2.77 5.50 0.13 0.00 1.04 -1.26 -3.21 113.70 113.14 1o3m s SER 120 Ca 0.04 -0.05 0.09 0.00 0.48 0.00 0.00 55.95 56.50 1o3m s SER 120 Cb 0.04 -0.98 -0.04 0.00 0.10 0.00 0.00 66.02 65.14 1o3m s SER 120 CO -0.10 -0.94 -0.14 -0.51 0.98 0.00 0.00 173.24 172.53 1o3m s ILE 121 N -2.60 3.03 0.39 -1.02 1.10 -0.25 -4.86 121.20 116.98 1o3m s ILE 121 Ca 0.54 -1.51 -0.19 0.00 -0.51 0.00 0.00 60.65 58.98 1o3m s ILE 121 Cb -0.10 -2.43 -0.10 0.00 0.15 0.00 0.00 42.46 39.97 1o3m s ILE 121 CO 0.37 0.04 0.87 -0.44 -2.11 0.00 0.00 174.94 173.66 1o3m s SER 122 N -2.36 6.88 0.45 4.50 0.01 -1.26 -4.58 113.70 117.33 1o3m s SER 122 Ca 0.21 1.53 -0.12 0.00 1.31 0.00 0.00 55.95 58.88 1o3m s SER 122 Cb -0.10 -2.48 -0.07 0.00 0.21 0.00 0.00 66.02 63.59 1o3m s SER 122 CO 0.12 -0.30 0.84 -0.76 0.41 0.00 0.00 173.24 173.55 1o3m s LEU 123 N -3.11 3.74 0.62 2.44 1.43 -1.26 -1.01 118.68 121.54 1o3m s LEU 123 Ca 0.59 1.27 -0.10 0.00 -1.03 0.00 0.00 54.13 54.85 1o3m s LEU 123 Cb -0.09 -4.17 -0.03 0.00 0.03 0.00 0.00 46.19 41.92 1o3m s LEU 123 CO 0.15 -0.48 1.02 -2.16 0.23 0.00 0.00 176.35 175.11 1o3m s PRO 124 N -3.98 3.45 -0.01 1.29 0.04 -1.26 -4.76 135.00 129.76 1o3m s PRO 124 Ca 0.54 0.63 0.13 0.00 0.04 0.00 0.00 61.00 62.34 1o3m s PRO 124 Cb -0.10 -2.10 -0.19 0.00 0.04 0.00 0.00 34.50 32.15 1o3m s PRO 124 CO 0.32 -0.62 0.36 0.25 0.04 0.00 0.00 177.00 177.35 1o3m n THR 125 N -2.75 0.00 -3.89 1.26 -2.24 -1.26 -4.96 114.28 100.44 1o3m n THR 125 Ca 0.06 -0.28 -0.09 0.00 -2.27 0.00 0.00 64.05 61.47 1o3m n THR 125 Cb 0.55 0.41 -0.08 0.00 -2.10 0.00 0.00 70.33 69.10 1o3m n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1o3m s SER 127 N -3.18 0.16 0.66 3.42 1.04 -1.26 -5.14 113.70 109.39 1o3m s SER 127 Ca -0.02 -0.64 -0.12 0.00 0.48 0.00 0.00 55.95 55.65 1o3m s SER 127 Cb 0.09 0.30 -0.01 0.00 0.10 0.00 0.00 66.02 66.50 1o3m s SER 127 CO 0.54 -0.66 1.05 0.00 0.98 0.00 0.00 173.24 175.16 1o3m s ALA 129 N -2.97 3.51 0.35 0.00 0.00 -1.26 -5.09 121.76 116.29 1o3m s ALA 129 Ca 0.58 -0.41 0.07 0.00 0.00 0.00 0.00 51.96 52.20 1o3m s ALA 129 Cb -0.13 -2.47 -0.02 0.00 0.00 0.00 0.00 23.12 20.50 1o3m s ALA 129 CO 0.51 0.13 0.37 -1.54 0.00 0.00 0.00 175.76 175.23 1o3m s SER 130 N -3.17 5.50 0.54 0.00 1.04 -1.26 -5.03 113.70 111.32 1o3m s SER 130 Ca 0.47 -0.42 -0.21 0.00 0.48 0.00 0.00 55.95 56.28 1o3m s SER 130 Cb -0.11 -1.00 -0.07 0.00 0.10 0.00 0.00 66.02 64.94 1o3m s SER 130 CO 0.31 -0.43 0.98 0.00 0.98 0.00 0.00 173.24 175.08 1o3m n ALA 132 N -1.50 0.20 0.00 5.32 0.00 -1.26 -1.88 120.51 121.40 1o3m n ALA 132 Ca -0.00 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1o3m n ALA 132 Cb 0.59 -2.10 0.00 0.00 0.00 0.00 0.00 19.45 17.94 1o3m n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o3m n GLY 133 N 1.25 3.06 3.74 0.00 0.00 0.38 -4.94 105.19 108.68 1o3m n GLY 133 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1o3m n GLY 133 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1o3m n THR 134 N -1.37 1.24 -3.25 2.61 -1.04 -0.79 -4.61 114.28 107.08 1o3m n THR 134 Ca 0.00 -0.31 -0.38 0.00 -2.04 0.00 0.00 64.05 61.32 1o3m n THR 134 Cb 0.00 -1.87 -0.06 0.00 -1.82 0.00 0.00 70.33 66.58 1o3m n THR 134 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 1o3m s GLN 135 N -0.85 4.33 0.27 -2.82 2.00 -1.26 -1.35 119.66 119.98 1o3m s GLN 135 Ca 0.62 0.59 0.03 0.00 -2.00 0.00 0.00 55.36 54.60 1o3m s GLN 135 Cb -0.52 -3.41 -0.06 0.00 0.80 0.00 0.00 33.01 29.83 1o3m s GLN 135 CO 0.52 0.21 0.03 0.00 -0.50 0.00 0.00 175.29 175.54 1o3m s LEU 137 N -3.37 2.59 -0.04 0.00 2.96 0.72 -0.97 118.68 120.57 1o3m s LEU 137 Ca 0.32 -0.41 0.05 0.00 -0.22 0.00 0.00 54.13 53.87 1o3m s LEU 137 Cb 0.07 -1.59 -0.02 0.00 0.50 0.00 0.00 46.19 45.14 1o3m s LEU 137 CO 0.12 0.10 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.42 1o3m s ILE 138 N 0.71 2.51 0.06 6.68 1.01 -0.28 -1.69 121.20 130.21 1o3m s ILE 138 Ca -0.06 -0.92 -0.03 0.00 0.00 0.00 0.00 60.65 59.63 1o3m s ILE 138 Cb -0.15 -1.94 -0.03 0.00 0.01 0.00 0.00 42.46 40.35 1o3m s ILE 138 CO 0.02 0.58 0.03 -0.94 0.00 0.00 0.00 174.94 174.63 1o3m s SER 139 N -0.52 0.38 0.00 3.58 1.04 -1.25 -0.83 113.70 116.11 1o3m s SER 139 Ca 0.07 -0.89 0.00 0.00 0.48 0.00 0.00 55.95 55.61 1o3m s SER 139 Cb -0.11 0.24 0.00 0.00 0.10 0.00 0.00 66.02 66.24 1o3m s SER 139 CO 0.01 -0.63 0.00 0.61 0.98 0.00 0.00 173.24 174.21 1o3m n GLY 140 N 0.10 1.46 1.52 7.32 0.00 -0.64 -4.55 105.19 110.40 1o3m n GLY 140 Ca -0.14 -1.09 -0.02 0.00 0.00 0.00 0.00 46.02 44.77 1o3m n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1o3m n TRP 141 N -0.85 1.77 -1.59 1.61 8.01 -1.26 -2.25 117.44 122.88 1o3m n TRP 141 Ca 0.00 -1.21 -0.30 0.00 -1.31 0.00 0.00 57.50 54.68 1o3m n TRP 141 Cb 0.00 -0.55 0.22 0.00 -2.01 0.00 0.00 31.31 28.97 1o3m n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1o3m s GLY 142 N -1.61 1.73 0.46 6.99 0.00 -1.25 -4.35 107.32 109.28 1o3m s GLY 142 Ca 0.49 -1.21 -0.23 0.00 0.00 0.00 0.00 44.72 43.78 1o3m s GLY 142 CO 0.09 -0.34 0.99 -2.01 0.00 0.00 0.00 173.10 171.83 1o3m n ASN 143 N -4.25 1.11 -0.50 1.64 5.15 0.05 -2.98 115.26 115.48 1o3m n ASN 143 Ca 0.16 0.98 0.05 0.00 -0.60 0.00 0.00 54.58 55.17 1o3m n ASN 143 Cb 0.59 -1.36 0.09 0.00 -0.53 0.00 0.00 39.78 38.58 1o3m n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1o3m n THR 144 N -0.76 0.44 -5.03 -0.44 -2.24 -0.16 0.12 114.28 106.20 1o3m n THR 144 Ca 0.10 -0.72 -0.32 0.00 -2.27 0.00 0.00 64.05 60.84 1o3m n THR 144 Cb 0.41 0.90 -0.14 0.00 -2.10 0.00 0.00 70.33 69.40 1o3m n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1o3m s LYS 145 N -0.93 2.50 0.22 -0.78 1.02 -1.26 -4.50 119.74 116.01 1o3m s LYS 145 Ca 0.17 -0.78 0.15 0.00 0.02 0.00 0.00 55.97 55.53 1o3m s LYS 145 Cb 0.10 -2.29 0.01 0.00 -0.52 0.00 0.00 37.83 35.13 1o3m s LYS 145 CO 0.14 0.53 1.29 0.66 -0.92 0.00 0.00 175.35 177.05 1o3m h SER 146 N 5.62 0.00 -3.21 2.83 4.64 -1.94 -3.38 113.55 118.11 1o3m h SER 146 Ca -0.41 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.29 1o3m h SER 146 Cb 1.15 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.83 1o3m h SER 146 CO 0.50 0.51 -0.62 -0.44 -0.87 0.00 0.00 176.83 175.91 1o3m s SER 147 N -6.27 4.46 0.00 4.97 0.01 -1.26 -4.44 113.70 111.16 1o3m s SER 147 Ca 0.02 -3.66 0.00 0.00 1.31 0.00 0.00 55.95 53.62 1o3m s SER 147 Cb 0.08 -1.52 0.00 0.00 0.21 0.00 0.00 66.02 64.79 1o3m s SER 147 CO 0.76 -0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.91 1o3m n GLY 148 N 2.22 0.81 3.02 3.44 0.00 -1.26 -5.07 105.19 108.35 1o3m n GLY 148 Ca 0.18 -2.23 -0.29 0.00 0.00 0.00 0.00 46.02 43.68 1o3m n GLY 148 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1o3m s THR 149 N -0.90 1.52 -0.13 2.61 -4.23 -1.26 -4.39 115.64 108.86 1o3m s THR 149 Ca 0.00 -0.61 -0.01 0.00 -1.18 0.00 0.00 61.69 59.88 1o3m s THR 149 Cb 0.00 -1.42 0.04 0.00 1.34 0.00 0.00 72.50 72.46 1o3m s THR 149 CO 0.00 0.45 -0.02 -0.55 -0.54 0.00 0.00 174.62 173.96 1o3m s SER 150 N 1.37 2.24 -0.20 3.99 0.15 -1.26 -4.97 113.70 115.03 1o3m s SER 150 Ca 0.02 -0.40 -0.07 0.00 0.70 0.00 0.00 55.95 56.19 1o3m s SER 150 Cb -0.13 -0.65 -0.04 0.00 -1.71 0.00 0.00 66.02 63.49 1o3m s SER 150 CO -0.08 -0.20 0.06 -0.31 1.20 0.00 0.00 173.24 173.91 1o3m s TYR 151 N 1.83 3.18 0.71 3.44 1.51 -1.26 -0.99 117.35 125.76 1o3m s TYR 151 Ca 0.03 -0.08 -0.11 0.00 -1.01 0.00 0.00 57.07 55.89 1o3m s TYR 151 Cb -0.14 -2.12 0.02 0.00 -0.11 0.00 0.00 41.96 39.60 1o3m s TYR 151 CO -0.07 -0.01 1.10 -1.25 -1.11 0.00 0.00 175.55 174.21 1o3m s PRO 152 N 0.76 2.82 -0.13 -1.71 0.04 -1.26 -5.00 135.00 130.52 1o3m s PRO 152 Ca 0.03 0.44 -0.05 0.00 0.04 0.00 0.00 61.00 61.47 1o3m s PRO 152 Cb -0.13 -2.02 -0.25 0.00 0.04 0.00 0.00 34.50 32.13 1o3m s PRO 152 CO 0.02 -1.06 0.32 -0.25 0.04 0.00 0.00 177.00 176.07 1o3m n ASP 153 N -3.02 2.04 -4.89 6.66 8.00 -1.26 -4.90 116.55 119.19 1o3m n ASP 153 Ca 0.07 0.18 -0.21 0.00 0.71 0.00 0.00 54.79 55.55 1o3m n ASP 153 Cb 0.57 -0.77 -0.03 0.00 -0.02 0.00 0.00 41.12 40.87 1o3m n ASP 153 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1o3m s VAL 154 N -2.56 3.76 0.18 2.53 -7.23 -1.26 -1.15 120.40 114.68 1o3m s VAL 154 Ca -0.23 -1.26 -0.31 0.00 -1.81 0.00 0.00 61.98 58.37 1o3m s VAL 154 Cb 0.07 -3.27 -0.10 0.00 0.56 0.00 0.00 36.38 33.64 1o3m s VAL 154 CO 0.76 -0.18 1.49 -0.22 -0.31 0.00 0.00 175.10 176.63 1o3m s LEU 155 N -4.04 4.38 0.09 1.32 2.96 -1.19 -4.82 118.68 117.38 1o3m s LEU 155 Ca 0.41 2.58 0.05 0.00 -0.22 0.00 0.00 54.13 56.95 1o3m s LEU 155 Cb -0.07 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.98 1o3m s LEU 155 CO 0.28 -0.75 -0.01 -0.54 -1.32 0.00 0.00 176.35 174.01 1o3m s LYS 156 N 0.60 2.49 0.16 1.98 -0.14 -0.95 -1.96 119.74 121.92 1o3m s LYS 156 Ca 0.65 -0.86 0.08 0.00 -1.36 0.00 0.00 55.97 54.48 1o3m s LYS 156 Cb -0.42 -2.51 -0.04 0.00 -1.68 0.00 0.00 37.83 33.18 1o3m s LYS 156 CO 0.35 0.54 -0.16 0.00 -0.76 0.00 0.00 175.35 175.31 1o3m s LEU 158 N -2.77 0.11 -0.16 0.00 2.96 -0.01 -0.60 118.68 118.21 1o3m s LEU 158 Ca 0.16 0.78 -0.11 0.00 -0.22 0.00 0.00 54.13 54.75 1o3m s LEU 158 Cb -0.04 1.19 -0.05 0.00 0.50 0.00 0.00 46.19 47.78 1o3m s LEU 158 CO 0.06 -0.18 0.19 -0.54 -1.32 0.00 0.00 176.35 174.56 1o3m s LYS 159 N 1.24 4.00 -0.01 1.98 -0.14 -1.26 -1.12 119.74 124.43 1o3m s LYS 159 Ca -0.08 -0.07 -0.09 0.00 -1.36 0.00 0.00 55.97 54.36 1o3m s LYS 159 Cb -0.08 -3.35 0.01 0.00 -1.68 0.00 0.00 37.83 32.72 1o3m s LYS 159 CO -0.10 0.43 0.18 0.00 -0.76 0.00 0.00 175.35 175.10 1o3m s ALA 160 N -0.06 -0.45 0.30 5.17 0.00 -0.14 -4.93 121.76 121.66 1o3m s ALA 160 Ca 0.13 0.04 -0.05 0.00 0.00 0.00 0.00 51.96 52.08 1o3m s ALA 160 Cb -0.12 0.06 -0.05 0.00 0.00 0.00 0.00 23.12 23.00 1o3m s ALA 160 CO 0.02 -0.21 0.58 -1.25 0.00 0.00 0.00 175.76 174.90 1o3m s PRO 161 N -1.22 3.64 0.14 0.00 0.04 -1.26 -0.46 135.00 135.89 1o3m s PRO 161 Ca -0.13 0.05 -0.30 0.00 0.04 0.00 0.00 61.00 60.66 1o3m s PRO 161 Cb -0.06 -2.62 -0.07 0.00 0.04 0.00 0.00 34.50 31.79 1o3m s PRO 161 CO 0.02 0.18 0.99 0.42 0.04 0.00 0.00 177.00 178.65 1o3m s ILE 162 N -2.13 4.32 0.52 0.56 1.01 -0.46 -1.56 121.20 123.46 1o3m s ILE 162 Ca 0.45 1.98 0.01 0.00 0.00 0.00 0.00 60.65 63.08 1o3m s ILE 162 Cb -0.11 -4.27 0.02 0.00 0.01 0.00 0.00 42.46 38.12 1o3m s ILE 162 CO 0.30 0.33 0.75 -0.76 0.00 0.00 0.00 174.94 175.56 1o3m s LEU 163 N -0.23 3.40 0.67 2.97 1.43 -0.28 -0.47 118.68 126.17 1o3m s LEU 163 Ca 0.47 0.13 -0.11 0.00 -1.03 0.00 0.00 54.13 53.58 1o3m s LEU 163 Cb -0.25 -3.00 -0.00 0.00 0.03 0.00 0.00 46.19 42.97 1o3m s LEU 163 CO 0.31 -0.99 1.05 -0.94 0.23 0.00 0.00 176.35 176.01 1o3m s SER 164 N -4.35 5.56 0.26 2.29 1.04 -1.26 -4.65 113.70 112.59 1o3m s SER 164 Ca 0.54 1.59 -0.03 0.00 0.48 0.00 0.00 55.95 58.54 1o3m s SER 164 Cb -0.10 -2.49 0.33 0.00 0.10 0.00 0.00 66.02 63.85 1o3m s SER 164 CO 0.39 -1.32 1.79 -0.78 0.98 0.00 0.00 173.24 174.30 1o3m h ASP 165 N -0.56 0.84 -0.21 7.02 -0.00 -1.97 -2.22 116.42 119.31 1o3m h ASP 165 Ca -0.44 -0.16 0.00 0.00 -0.00 0.00 0.00 57.03 56.43 1o3m h ASP 165 Cb 1.21 -0.22 -0.01 0.00 -0.00 0.00 0.00 39.33 40.30 1o3m h ASP 165 CO 0.58 0.83 0.13 0.28 -0.00 0.00 0.00 179.24 181.06 1o3m h SER 166 N 0.86 0.23 -0.32 2.28 0.02 -1.99 -0.74 113.55 113.89 1o3m h SER 166 Ca 0.18 -0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.04 1o3m h SER 166 Cb 0.33 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.80 1o3m h SER 166 CO 0.00 0.17 -0.10 0.28 -1.14 0.00 0.00 176.83 176.04 1o3m h SER 167 N 0.28 0.73 0.09 3.07 0.02 -1.89 -0.04 113.55 115.81 1o3m h SER 167 Ca 0.08 -0.21 -0.00 0.00 -0.84 0.00 0.00 61.79 60.82 1o3m h SER 167 Cb -0.02 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.32 1o3m h SER 167 CO -0.03 0.86 -0.04 0.00 -1.14 0.00 0.00 176.83 176.48 1o3m h LYS 169 N -0.35 0.23 -0.10 0.00 1.57 -1.06 -1.01 116.57 115.86 1o3m h LYS 169 Ca -0.01 -0.07 -0.12 0.00 -1.87 0.00 0.00 60.65 58.57 1o3m h LYS 169 Cb 0.29 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 1o3m h LYS 169 CO 0.02 0.45 -0.49 1.03 -0.57 0.00 0.00 179.45 179.89 1o3m h SER 170 N 0.21 0.27 0.60 0.86 0.87 -0.81 -2.11 113.55 113.45 1o3m h SER 170 Ca 0.04 -0.13 -0.23 0.00 -1.23 0.00 0.00 61.79 60.24 1o3m h SER 170 Cb 0.52 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.40 1o3m h SER 170 CO 0.04 0.72 -1.03 0.00 -0.53 0.00 0.00 176.83 176.03 1o3m h ALA 171 N 1.29 0.33 -2.17 6.23 0.00 -0.02 -3.38 119.26 121.54 1o3m h ALA 171 Ca 0.01 -0.80 -0.56 0.00 0.00 0.00 0.00 54.91 53.56 1o3m h ALA 171 Cb 0.95 -0.05 -0.41 0.00 0.00 0.00 0.00 17.79 18.28 1o3m h ALA 171 CO 0.08 0.95 -0.81 0.66 0.00 0.00 0.00 179.25 180.13 1o3m n TYR 172 N -3.60 2.56 -1.65 0.00 4.01 -0.49 -4.97 117.16 113.02 1o3m n TYR 172 Ca -0.05 -3.94 -0.45 0.00 -0.16 0.00 0.00 57.90 53.30 1o3m n TYR 172 Cb 0.90 -0.47 -0.02 0.00 -0.31 0.00 0.00 39.34 39.44 1o3m n TYR 172 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1o3m n PRO 173 N 0.30 1.83 -0.92 -0.72 -0.04 -0.80 -1.57 135.00 133.07 1o3m n PRO 173 Ca 0.28 0.65 0.00 0.00 -0.04 0.00 0.00 63.50 64.39 1o3m n PRO 173 Cb 0.47 -2.22 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 1o3m n PRO 173 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1o3m n GLY 174 N 1.67 0.23 0.05 0.55 0.00 -1.26 -4.82 105.19 101.60 1o3m n GLY 174 Ca 0.10 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.13 1o3m n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1o3m n GLN 175 N -0.84 3.62 -3.49 1.61 6.02 -0.61 -5.00 117.38 118.69 1o3m n GLN 175 Ca 0.00 -0.25 -0.38 0.00 -0.01 0.00 0.00 57.00 56.36 1o3m n GLN 175 Cb 0.24 -0.79 -0.08 0.00 1.02 0.00 0.00 30.24 30.63 1o3m n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1o3m s ILE 176 N -0.88 5.26 0.57 5.09 -1.09 -1.25 -5.05 121.20 123.85 1o3m s ILE 176 Ca 0.02 0.49 0.09 0.00 -2.23 0.00 0.00 60.65 59.02 1o3m s ILE 176 Cb 0.02 -3.64 0.08 0.00 -1.58 0.00 0.00 42.46 37.34 1o3m s ILE 176 CO 0.08 0.28 0.70 0.42 -1.23 0.00 0.00 174.94 175.19 1o3m s THR 177 N 1.28 2.01 -1.42 2.92 -4.23 -1.26 -4.97 115.64 109.97 1o3m s THR 177 Ca 0.14 -1.12 0.18 0.00 -1.18 0.00 0.00 61.69 59.71 1o3m s THR 177 Cb -0.14 -2.14 0.30 0.00 1.34 0.00 0.00 72.50 71.87 1o3m s THR 177 CO 0.07 0.00 1.53 -1.54 -0.54 0.00 0.00 174.62 174.13 1o3m n SER 178 N -2.13 0.00 -1.68 3.99 3.41 -1.26 -2.60 113.62 113.35 1o3m n SER 178 Ca 0.11 0.04 0.06 0.00 -0.26 0.00 0.00 58.87 58.83 1o3m n SER 178 Cb 0.62 -0.29 0.37 0.00 -0.26 0.00 0.00 64.21 64.65 1o3m n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1o3m n ASN 179 N -1.29 5.27 -4.15 4.04 3.02 -1.26 -4.93 115.26 115.97 1o3m n ASN 179 Ca 0.08 -2.99 -0.14 0.00 -0.03 0.00 0.00 54.58 51.51 1o3m n ASN 179 Cb 0.14 -0.66 -0.11 0.00 -0.61 0.00 0.00 39.78 38.54 1o3m n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1o3m s MET 180 N -2.81 0.77 0.09 3.52 -1.94 -1.07 -1.14 119.30 116.71 1o3m s MET 180 Ca 0.52 -1.06 -0.10 0.00 -1.71 0.00 0.00 55.69 53.34 1o3m s MET 180 Cb 0.40 -0.47 0.01 0.00 2.01 0.00 0.00 34.83 36.78 1o3m s MET 180 CO 0.14 0.07 0.23 -0.59 -0.01 0.00 0.00 175.02 174.86 1o3m s PHE 181 N -2.19 0.08 0.05 -0.03 -0.71 -0.62 -4.79 117.98 109.77 1o3m s PHE 181 Ca 0.02 -0.48 0.03 0.00 -1.04 0.00 0.00 56.93 55.46 1o3m s PHE 181 Cb -0.04 -0.00 -0.04 0.00 -1.21 0.00 0.00 43.02 41.73 1o3m s PHE 181 CO -0.00 -0.56 0.03 0.00 -1.34 0.00 0.00 175.22 173.35 1o3m s ALA 183 N -1.25 -0.62 0.00 0.00 0.00 -0.87 -1.13 121.76 117.89 1o3m s ALA 183 Ca 0.24 0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.72 1o3m s ALA 183 Cb -0.12 -0.24 0.00 0.00 0.00 0.00 0.00 23.12 22.76 1o3m s ALA 183 CO 0.16 -0.16 0.00 0.41 0.00 0.00 0.00 175.76 176.17 1o3m n GLY 184 N 2.37 0.80 2.85 0.00 0.00 -0.60 -2.90 105.19 107.72 1o3m n GLY 184 Ca -0.16 -1.72 -0.25 0.00 0.00 0.00 0.00 46.02 43.89 1o3m n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1o3m s TYR 184 N -3.40 1.15 0.39 1.61 2.02 -1.26 -4.42 117.35 113.44 1o3m s TYR 184 Ca 0.00 -0.51 0.27 0.00 -0.37 0.00 0.00 57.07 56.46 1o3m s TYR 184 Cb 0.00 -1.05 1.40 0.00 -0.40 0.00 0.00 41.96 41.91 1o3m s TYR 184 CO 0.00 -0.43 2.05 -0.07 -1.57 0.00 0.00 175.55 175.53 1o3m h LEU 185 N 8.21 0.00 0.00 -1.29 3.38 -1.95 -2.20 115.31 121.45 1o3m h LEU 185 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1o3m h LEU 185 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1o3m h LEU 185 CO 0.35 0.13 0.00 -1.84 0.09 0.00 0.00 178.44 177.17 1o3m n GLU 186 N -3.62 0.18 0.00 1.13 0.00 -1.26 -0.01 120.64 117.07 1o3m n GLU 186 Ca -0.02 0.15 0.00 0.00 0.00 0.00 0.00 57.16 57.29 1o3m n GLU 186 Cb 0.25 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.19 1o3m n GLU 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1o3m n GLY 187 N 0.15 -1.14 2.01 -1.84 0.00 -0.83 -4.59 105.19 98.95 1o3m n GLY 187 Ca 0.07 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.50 1o3m n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o3m n GLY 188 N -0.98 2.83 2.96 -0.02 0.00 0.06 -4.94 105.19 105.11 1o3m n GLY 188 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1o3m n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o3m s LYS 188 N -0.08 1.35 -0.02 1.61 1.02 -1.26 -3.53 119.74 118.83 1o3m s LYS 188 Ca 0.00 -0.28 -0.30 0.00 0.02 0.00 0.00 55.97 55.40 1o3m s LYS 188 Cb 0.00 -1.20 0.12 0.00 -0.52 0.00 0.00 37.83 36.23 1o3m s LYS 188 CO 0.00 -0.04 1.31 0.34 -0.92 0.00 0.00 175.35 176.04 1o3m s ASP 189 N 0.85 -0.05 0.66 2.83 3.68 -0.33 -4.40 116.67 119.90 1o3m s ASP 189 Ca -0.12 -0.13 -0.01 0.00 2.13 0.00 0.00 52.55 54.43 1o3m s ASP 189 Cb -0.15 0.14 0.08 0.00 -1.45 0.00 0.00 42.92 41.55 1o3m s ASP 189 CO 0.01 -0.27 0.92 -0.94 0.13 0.00 0.00 175.17 175.02 1o3m s SER 190 N -3.05 4.75 0.33 -0.34 1.04 -1.26 -0.73 113.70 114.43 1o3m s SER 190 Ca 0.15 -0.10 -0.10 0.00 0.48 0.00 0.00 55.95 56.38 1o3m s SER 190 Cb 0.05 -0.50 0.04 0.00 0.10 0.00 0.00 66.02 65.71 1o3m s SER 190 CO -0.04 -1.56 0.62 0.00 0.98 0.00 0.00 173.24 173.23 1o3m n GLN 192 N -0.46 1.27 0.00 0.00 7.27 -1.26 -1.42 117.38 122.78 1o3m n GLN 192 Ca -0.06 0.45 0.00 0.00 0.07 0.00 0.00 57.00 57.46 1o3m n GLN 192 Cb 0.50 -1.87 0.00 0.00 2.41 0.00 0.00 30.24 31.29 1o3m n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1o3m n GLY 193 N 1.59 3.16 0.12 1.69 0.00 -1.26 -0.77 105.19 109.72 1o3m n GLY 193 Ca 0.12 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.26 1o3m n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1o3m h ASP 194 N 0.00 0.00 -0.90 1.61 3.32 -1.55 -3.34 116.42 115.57 1o3m h ASP 194 Ca 0.00 -0.05 -0.63 0.00 0.02 0.00 0.00 57.03 56.37 1o3m h ASP 194 Cb 0.00 0.00 0.09 0.00 0.22 0.00 0.00 39.33 39.64 1o3m h ASP 194 CO 0.00 0.03 -0.36 -1.20 -1.72 0.00 0.00 179.24 175.99 1o3m n SER 195 N -2.61 -0.87 0.00 6.45 7.64 -1.26 -1.49 113.62 121.49 1o3m n SER 195 Ca 0.02 1.02 0.00 0.00 1.01 0.00 0.00 58.87 60.92 1o3m n SER 195 Cb 0.52 -0.85 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 1o3m n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1o3m n GLY 196 N 1.69 2.91 3.92 0.23 0.00 -0.15 -0.86 105.19 112.93 1o3m n GLY 196 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 1o3m n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1o3m s GLY 197 N -1.51 1.73 0.40 -0.02 0.00 -0.55 -3.39 107.32 103.98 1o3m s GLY 197 Ca 0.00 -1.07 -0.22 0.00 0.00 0.00 0.00 44.72 43.43 1o3m s GLY 197 CO 0.00 -0.36 0.95 2.56 0.00 0.00 0.00 173.10 176.25 1o3m s PRO 198 N -5.81 4.32 -0.25 2.90 0.04 -1.26 -1.44 135.00 133.50 1o3m s PRO 198 Ca 0.71 1.18 -0.01 0.00 0.04 0.00 0.00 61.00 62.92 1o3m s PRO 198 Cb -0.06 -2.35 0.08 0.00 0.04 0.00 0.00 34.50 32.21 1o3m s PRO 198 CO 0.52 0.05 0.03 0.08 0.04 0.00 0.00 177.00 177.73 1o3m s VAL 199 N -2.03 1.00 -0.13 -0.36 1.01 -0.73 -3.79 120.40 115.38 1o3m s VAL 199 Ca 0.59 -1.12 -0.01 0.00 0.00 0.00 0.00 61.98 61.44 1o3m s VAL 199 Cb -0.12 -1.54 -0.02 0.00 0.00 0.00 0.00 36.38 34.70 1o3m s VAL 199 CO 0.16 -0.37 -0.09 -0.69 0.00 0.00 0.00 175.10 174.11 1o3m s VAL 200 N 1.60 3.39 -0.08 2.92 1.01 -0.68 -1.31 120.40 127.26 1o3m s VAL 200 Ca 0.02 -0.54 0.01 0.00 0.00 0.00 0.00 61.98 61.47 1o3m s VAL 200 Cb -0.18 -2.44 0.02 0.00 0.00 0.00 0.00 36.38 33.78 1o3m s VAL 200 CO -0.14 0.52 -0.10 0.00 0.00 0.00 0.00 175.10 175.39 1o3m n SER 202 N 4.22 -1.42 -0.06 0.00 7.64 -1.26 -1.44 113.62 121.30 1o3m n SER 202 Ca -0.20 -0.99 -0.01 0.00 1.01 0.00 0.00 58.87 58.68 1o3m n SER 202 Cb 0.51 -3.02 -0.00 0.00 -1.01 0.00 0.00 64.21 60.69 1o3m n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1o3m n GLY 203 N -1.81 0.29 3.31 0.23 0.00 -1.26 -5.00 105.19 100.96 1o3m n GLY 203 Ca -0.18 -0.03 -0.28 0.00 0.00 0.00 0.00 46.02 45.53 1o3m n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o3m s LYS 204 N -1.22 1.55 -0.54 1.61 -0.14 -0.52 -4.06 119.74 116.43 1o3m s LYS 204 Ca 0.00 -1.08 -0.28 0.00 -1.36 0.00 0.00 55.97 53.25 1o3m s LYS 204 Cb 0.00 -1.76 0.02 0.00 -1.68 0.00 0.00 37.83 34.42 1o3m s LYS 204 CO 0.00 0.44 1.31 -1.17 -0.76 0.00 0.00 175.35 175.17 1o3m s LEU 209 N -1.36 3.46 -0.09 3.17 2.96 -0.18 -1.59 118.68 125.05 1o3m s LEU 209 Ca 0.10 0.31 0.17 0.00 -0.22 0.00 0.00 54.13 54.49 1o3m s LEU 209 Cb -0.10 -3.21 -0.25 0.00 0.50 0.00 0.00 46.19 43.14 1o3m s LEU 209 CO 0.03 -1.55 0.25 0.00 -1.32 0.00 0.00 176.35 173.75 1o3m n GLN 210 N 8.43 0.86 -4.11 1.98 1.13 -0.42 -4.13 117.38 121.12 1o3m n GLN 210 Ca 0.11 -0.10 -0.10 0.00 -1.94 0.00 0.00 57.00 54.98 1o3m n GLN 210 Cb 0.49 -1.44 -0.09 0.00 0.11 0.00 0.00 30.24 29.31 1o3m n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1o3m s GLY 211 N -4.56 0.94 -0.05 1.08 0.00 -0.92 -1.86 107.32 101.95 1o3m s GLY 211 Ca -0.07 -1.35 0.03 0.00 0.00 0.00 0.00 44.72 43.33 1o3m s GLY 211 CO 0.73 -1.21 -0.14 -0.42 0.00 0.00 0.00 173.10 172.07 1o3m s ILE 212 N -4.05 1.22 0.01 0.90 1.01 -1.04 -1.77 121.20 117.49 1o3m s ILE 212 Ca 0.26 -0.57 -0.30 0.00 0.00 0.00 0.00 60.65 60.03 1o3m s ILE 212 Cb 0.06 -1.08 -0.08 0.00 0.01 0.00 0.00 42.46 41.37 1o3m s ILE 212 CO 0.04 0.37 1.82 -0.69 0.00 0.00 0.00 174.94 176.47 1o3m s VAL 213 N 0.32 3.19 0.01 2.92 1.01 -0.52 -1.43 120.40 125.90 1o3m s VAL 213 Ca -0.08 0.31 -0.00 0.00 0.00 0.00 0.00 61.98 62.21 1o3m s VAL 213 Cb -0.13 -3.20 -0.00 0.00 0.00 0.00 0.00 36.38 33.05 1o3m s VAL 213 CO 0.03 -0.02 -0.00 -0.24 0.00 0.00 0.00 175.10 174.86 1o3m n SER 214 N 7.09 0.17 -2.45 3.32 2.88 -1.09 -0.98 113.62 122.56 1o3m n SER 214 Ca 0.18 0.02 -0.09 0.00 -1.33 0.00 0.00 58.87 57.65 1o3m n SER 214 Cb 0.41 -0.09 -0.00 0.00 -0.75 0.00 0.00 64.21 63.79 1o3m n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1o3m n TRP 215 N -2.65 -1.57 0.00 0.66 4.27 -0.98 -4.93 117.44 112.24 1o3m n TRP 215 Ca -0.00 -1.63 0.00 0.00 -3.89 0.00 0.00 57.50 51.98 1o3m n TRP 215 Cb 0.01 0.54 0.00 0.00 -1.36 0.00 0.00 31.31 30.50 1o3m n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1o3m n GLY 216 N -0.43 0.68 3.43 -1.67 0.00 -1.26 -1.05 105.19 104.90 1o3m n GLY 216 Ca -0.03 -0.86 -0.44 0.00 0.00 0.00 0.00 46.02 44.70 1o3m n GLY 216 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1o3m s SER 217 N 0.00 6.19 0.62 1.61 0.15 -1.26 -4.91 113.70 116.09 1o3m s SER 217 Ca 0.00 -1.01 0.00 0.00 0.70 0.00 0.00 55.95 55.64 1o3m s SER 217 Cb 0.00 -2.24 0.00 0.00 -1.71 0.00 0.00 66.02 62.07 1o3m s SER 217 CO 0.00 -0.74 0.00 0.61 1.20 0.00 0.00 173.24 174.31 1o3m n GLY 219 N 5.17 0.04 2.90 9.45 0.00 -1.26 -4.62 105.19 116.87 1o3m n GLY 219 Ca -0.09 -1.00 -0.17 0.00 0.00 0.00 0.00 46.02 44.77 1o3m n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o3m n ALA 221 N 3.49 -1.23 -2.34 0.00 0.00 -1.26 -4.50 120.51 114.66 1o3m n ALA 221 Ca -0.19 0.13 -0.31 0.00 0.00 0.00 0.00 53.44 53.07 1o3m n ALA 221 Cb 0.55 -3.99 -0.04 0.00 0.00 0.00 0.00 19.45 15.96 1o3m n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1o3m s GLN 221 N -6.60 3.78 0.38 0.00 -1.52 -1.26 -0.76 119.66 113.69 1o3m s GLN 221 Ca 0.65 0.31 -0.27 0.00 -1.95 0.00 0.00 55.36 54.10 1o3m s GLN 221 Cb -0.33 -2.55 -0.10 0.00 -0.22 0.00 0.00 33.01 29.81 1o3m s GLN 221 CO 0.80 0.18 1.36 0.21 -0.25 0.00 0.00 175.29 177.59 1o3m s LYS 222 N -3.27 4.08 -1.80 2.91 2.20 -1.26 -2.50 119.74 120.10 1o3m s LYS 222 Ca 0.48 2.29 0.00 0.00 -0.36 0.00 0.00 55.97 58.39 1o3m s LYS 222 Cb -0.11 -2.88 0.00 0.00 -1.51 0.00 0.00 37.83 33.33 1o3m s LYS 222 CO 0.25 -0.45 0.00 0.09 -0.36 0.00 0.00 175.35 174.88 1o3m n ASN 223 N 0.36 -4.57 -3.51 1.43 5.03 0.99 -4.90 115.26 110.09 1o3m n ASN 223 Ca 0.02 0.42 -0.27 0.00 0.87 0.00 0.00 54.58 55.62 1o3m n ASN 223 Cb 0.42 -4.09 -0.10 0.00 -1.02 0.00 0.00 39.78 35.00 1o3m n ASN 223 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1o3m n LYS 224 N -2.08 1.25 -1.02 3.52 4.76 -1.04 -4.82 118.16 118.73 1o3m n LYS 224 Ca -0.17 -3.87 -0.29 0.00 -2.87 0.00 0.00 58.31 51.11 1o3m n LYS 224 Cb 0.57 -1.88 0.21 0.00 -1.84 0.00 0.00 35.03 32.08 1o3m n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1o3m s PRO 225 N -1.15 -0.24 0.45 1.97 0.04 -1.26 -4.42 135.00 130.39 1o3m s PRO 225 Ca 0.32 0.45 -0.13 0.00 0.04 0.00 0.00 61.00 61.68 1o3m s PRO 225 Cb 0.06 -1.67 -0.07 0.00 0.04 0.00 0.00 34.50 32.87 1o3m s PRO 225 CO -0.14 -3.17 0.86 0.20 0.04 0.00 0.00 177.00 174.80 1o3m s GLY 226 N -3.34 1.99 -0.07 0.56 0.00 -1.14 -4.54 107.32 100.77 1o3m s GLY 226 Ca 0.67 -0.05 0.04 0.00 0.00 0.00 0.00 44.72 45.38 1o3m s GLY 226 CO 0.59 0.18 -0.18 0.14 0.00 0.00 0.00 173.10 173.82 1o3m s VAL 227 N -2.49 2.67 0.07 1.40 1.01 -0.21 -2.05 120.40 120.81 1o3m s VAL 227 Ca 0.54 -0.84 0.07 0.00 0.00 0.00 0.00 61.98 61.75 1o3m s VAL 227 Cb -0.10 -2.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 1o3m s VAL 227 CO 0.32 0.57 -0.19 -0.31 0.00 0.00 0.00 175.10 175.48 1o3m s TYR 228 N -0.26 1.64 0.09 5.22 2.02 0.23 -2.33 117.35 123.96 1o3m s TYR 228 Ca 0.00 -0.40 -0.30 0.00 -0.37 0.00 0.00 57.07 56.00 1o3m s TYR 228 Cb -0.13 -0.93 -0.06 0.00 -0.40 0.00 0.00 41.96 40.44 1o3m s TYR 228 CO 0.03 0.13 1.17 0.99 -1.57 0.00 0.00 175.55 176.30 1o3m s THR 229 N -1.03 4.01 -0.94 -0.71 2.01 -0.51 -1.59 115.64 116.88 1o3m s THR 229 Ca 0.05 1.51 -0.22 0.00 0.31 0.00 0.00 61.69 63.33 1o3m s THR 229 Cb -0.09 -3.97 0.07 0.00 0.01 0.00 0.00 72.50 68.52 1o3m s THR 229 CO 0.03 0.15 1.31 -0.75 -0.69 0.00 0.00 174.62 174.67 1o3m s LYS 230 N 0.67 3.51 0.40 4.92 2.20 -0.29 -2.49 119.74 128.66 1o3m s LYS 230 Ca 0.56 -1.16 0.09 0.00 -0.36 0.00 0.00 55.97 55.10 1o3m s LYS 230 Cb -0.29 -5.02 0.87 0.00 -1.51 0.00 0.00 37.83 31.88 1o3m s LYS 230 CO 0.31 -2.06 2.01 0.28 -0.36 0.00 0.00 175.35 175.53 1o3m h VAL 231 N 6.39 1.02 -0.10 4.02 2.07 -1.68 -2.52 116.25 125.45 1o3m h VAL 231 Ca 0.09 -0.20 0.03 0.00 0.82 0.00 0.00 66.70 67.45 1o3m h VAL 231 Cb 1.02 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1o3m h VAL 231 CO 1.31 0.10 0.19 0.00 0.02 0.00 0.00 177.57 179.19 1o3m n ASN 233 N -3.40 0.68 -0.41 0.00 3.02 -0.95 -3.88 115.26 110.31 1o3m n ASN 233 Ca -0.00 0.57 0.04 0.00 -0.03 0.00 0.00 54.58 55.16 1o3m n ASN 233 Cb 0.28 -0.75 0.07 0.00 -0.61 0.00 0.00 39.78 38.77 1o3m n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1o3m n TYR 234 N -2.14 0.16 -0.21 3.10 4.01 0.09 -4.78 117.16 117.38 1o3m n TYR 234 Ca 0.05 -0.22 -0.02 0.00 -0.16 0.00 0.00 57.90 57.56 1o3m n TYR 234 Cb 0.40 -0.01 0.09 0.00 -0.31 0.00 0.00 39.34 39.50 1o3m n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1o3m h VAL 235 N 1.63 0.93 -0.36 -0.72 2.07 -1.65 0.29 116.25 118.44 1o3m h VAL 235 Ca 0.00 -0.20 -0.10 0.00 0.82 0.00 0.00 66.70 67.22 1o3m h VAL 235 Cb 0.50 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 1o3m h VAL 235 CO 0.00 0.11 -0.19 0.77 0.02 0.00 0.00 177.57 178.28 1o3m h SER 236 N 0.59 0.69 -0.16 0.57 4.64 -1.89 -1.09 113.55 116.90 1o3m h SER 236 Ca 0.28 -0.23 -0.02 0.00 -0.47 0.00 0.00 61.79 61.36 1o3m h SER 236 Cb 0.21 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 1o3m h SER 236 CO -0.20 0.88 0.03 -0.25 -0.87 0.00 0.00 176.83 176.42 1o3m h TRP 237 N 0.61 0.28 0.00 4.77 7.01 -1.74 0.28 115.95 127.15 1o3m h TRP 237 Ca 0.09 -0.04 0.01 0.00 2.11 0.00 0.00 58.89 61.06 1o3m h TRP 237 Cb 0.66 -0.08 -0.01 0.00 -2.10 0.00 0.00 29.16 27.64 1o3m h TRP 237 CO 0.03 0.42 -0.04 0.82 -2.79 0.00 0.00 178.44 176.88 1o3m h ILE 238 N 0.06 0.91 -0.26 2.65 2.04 -0.69 -0.73 117.51 121.48 1o3m h ILE 238 Ca 0.05 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.93 1o3m h ILE 238 Cb 0.28 0.91 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 1o3m h ILE 238 CO 0.00 0.00 0.11 0.11 0.00 0.00 0.00 178.15 178.37 1o3m h LYS 239 N -0.06 0.23 -0.44 2.37 1.57 -1.08 -0.86 116.57 118.30 1o3m h LYS 239 Ca 0.02 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.73 1o3m h LYS 239 Cb 0.08 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 1o3m h LYS 239 CO -0.04 0.15 0.05 1.96 -0.57 0.00 0.00 179.45 181.01 1o3m h GLN 240 N 0.24 0.74 -0.42 3.15 4.20 -0.82 -0.25 115.11 121.95 1o3m h GLN 240 Ca 0.11 -0.21 -0.03 0.00 0.06 0.00 0.00 58.65 58.58 1o3m h GLN 240 Cb 0.06 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 1o3m h GLN 240 CO -0.10 0.78 0.14 1.15 -0.67 0.00 0.00 178.83 180.13 1o3m h THR 241 N 0.59 1.21 -0.56 -0.54 2.02 -0.92 -2.46 112.91 112.25 1o3m h THR 241 Ca 0.13 -0.69 -0.09 0.00 0.77 0.00 0.00 66.41 66.53 1o3m h THR 241 Cb 0.41 0.87 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 1o3m h THR 241 CO 0.01 0.25 0.02 0.40 0.37 0.00 0.00 175.52 176.57 1o3m h ILE 242 N 0.54 1.26 0.00 3.11 2.04 -1.07 -2.08 117.51 121.31 1o3m h ILE 242 Ca 0.14 -1.10 -0.00 0.00 1.00 0.00 0.00 64.86 64.90 1o3m h ILE 242 Cb 0.24 0.86 -0.00 0.00 -0.74 0.00 0.00 36.82 37.19 1o3m h ILE 242 CO -0.01 0.39 -0.02 0.00 0.00 0.00 0.00 178.15 178.52 1o3m h ALA 243 N 0.97 1.07 -0.39 1.87 0.00 -0.81 -2.67 119.26 119.30 1o3m h ALA 243 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1o3m h ALA 243 Cb 0.52 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1o3m h ALA 243 CO 0.03 0.02 0.00 0.43 0.00 0.00 0.00 179.25 179.73 1o3m n SER 244 N -3.21 3.11 0.00 0.00 7.64 -0.81 -5.08 113.62 115.26 1o3m n SER 244 Ca -0.02 -1.92 0.00 0.00 1.01 0.00 0.00 58.87 57.94 1o3m n SER 244 Cb 0.16 -0.26 0.00 0.00 -1.01 0.00 0.00 64.21 63.11 1o3m n SER 244 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62