#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hol n GLU 25 N 0.00 2.72 -4.39 3.49 0.28 -1.26 -5.07 120.64 116.41 3hol n GLU 25 Ca 0.00 -1.98 -0.26 0.00 -0.16 0.00 0.00 57.16 54.76 3hol n GLU 25 Cb 0.00 -1.26 -0.12 0.00 1.43 0.00 0.00 31.44 31.49 3hol n GLU 25 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 3hol s TYR 26 N -0.99 2.16 0.01 -1.84 2.02 -1.26 -3.64 117.35 113.81 3hol s TYR 26 Ca 0.22 -0.39 -0.05 0.00 -0.37 0.00 0.00 57.07 56.48 3hol s TYR 26 Cb 0.12 -1.08 -0.01 0.00 -0.40 0.00 0.00 41.96 40.59 3hol s TYR 26 CO 0.15 0.44 0.09 -1.59 -1.57 0.00 0.00 175.55 173.08 3hol s LYS 27 N -2.64 0.47 0.13 -0.62 -2.85 -0.54 -4.98 119.74 108.70 3hol s LYS 27 Ca 0.19 -0.52 -0.35 0.00 -1.00 0.00 0.00 55.97 54.29 3hol s LYS 27 Cb -0.08 0.19 -0.16 0.00 -2.06 0.00 0.00 37.83 35.72 3hol s LYS 27 CO 0.09 -0.11 1.23 -0.25 0.10 0.00 0.00 175.35 176.41 3hol n ASP 28 N 1.35 1.39 -4.77 0.03 8.00 -1.26 0.15 116.55 121.43 3hol n ASP 28 Ca -0.22 1.13 -0.41 0.00 0.71 0.00 0.00 54.79 56.00 3hol n ASP 28 Cb 0.56 -1.19 -0.01 0.00 -0.02 0.00 0.00 41.12 40.46 3hol n ASP 28 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3hol s VAL 29 N 0.10 2.11 -0.06 2.53 1.01 -0.59 -4.58 120.40 120.93 3hol s VAL 29 Ca 0.79 0.11 -0.30 0.00 0.00 0.00 0.00 61.98 62.58 3hol s VAL 29 Cb -0.91 -3.07 -0.03 0.00 0.00 0.00 0.00 36.38 32.37 3hol s VAL 29 CO 0.50 0.02 1.15 -1.61 0.00 0.00 0.00 175.10 175.16 3hol s GLU 30 N -1.82 4.38 -0.01 2.72 0.41 -1.26 -5.00 118.70 118.13 3hol s GLU 30 Ca 0.54 1.61 0.01 0.00 -0.41 0.00 0.00 54.97 56.72 3hol s GLU 30 Cb -0.46 -3.53 -0.00 0.00 -1.78 0.00 0.00 34.13 28.35 3hol s GLU 30 CO 0.60 -0.39 -0.05 -0.08 -0.49 0.00 0.00 175.26 174.86 3hol s THR 31 N 2.03 0.38 0.25 3.63 -1.32 -1.26 -5.12 115.64 114.23 3hol s THR 31 Ca 0.54 -0.19 -0.28 0.00 -1.21 0.00 0.00 61.69 60.55 3hol s THR 31 Cb -0.23 -0.33 -0.15 0.00 -1.51 0.00 0.00 72.50 70.27 3hol s THR 31 CO 0.22 0.11 0.78 0.00 -2.21 0.00 0.00 174.62 173.52 3hol n ALA 32 N 3.07 -1.47 -1.80 11.08 0.00 -1.26 -4.95 120.51 125.17 3hol n ALA 32 Ca -0.14 0.41 -0.33 0.00 0.00 0.00 0.00 53.44 53.39 3hol n ALA 32 Cb 0.58 -1.83 -0.04 0.00 0.00 0.00 0.00 19.45 18.16 3hol n ALA 32 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 3hol s LYS 33 N -1.30 3.91 0.17 0.00 -2.85 -1.26 -4.96 119.74 113.45 3hol s LYS 33 Ca 0.61 1.11 -0.32 0.00 -1.00 0.00 0.00 55.97 56.38 3hol s LYS 33 Cb -0.81 -2.13 -0.11 0.00 -2.06 0.00 0.00 37.83 32.73 3hol s LYS 33 CO 0.58 -0.31 1.74 0.21 0.10 0.00 0.00 175.35 177.67 3hol s LYS 34 N -3.67 4.14 -0.15 1.78 2.20 -1.26 -4.87 119.74 117.91 3hol s LYS 34 Ca 0.62 2.57 -0.29 0.00 -0.36 0.00 0.00 55.97 58.51 3hol s LYS 34 Cb -0.12 -3.26 -0.05 0.00 -1.51 0.00 0.00 37.83 32.90 3hol s LYS 34 CO 0.25 -0.77 1.79 -1.83 -0.36 0.00 0.00 175.35 174.43 3hol s GLU 35 N 1.70 3.80 0.50 4.03 -1.05 -1.26 -4.92 118.70 121.49 3hol s GLU 35 Ca 0.76 1.97 -0.24 0.00 -0.15 0.00 0.00 54.97 57.32 3hol s GLU 35 Cb -0.48 -4.11 -0.07 0.00 -0.44 0.00 0.00 34.13 29.03 3hol s GLU 35 CO 0.33 -1.31 1.39 1.17 0.95 0.00 0.00 175.26 177.79 3hol n LYS 36 N 7.76 1.97 -4.29 -4.83 4.81 -1.26 -5.01 118.16 117.31 3hol n LYS 36 Ca 0.21 0.71 -0.20 0.00 -0.87 0.00 0.00 58.31 58.16 3hol n LYS 36 Cb 0.44 -2.60 -0.13 0.00 0.02 0.00 0.00 35.03 32.77 3hol n LYS 36 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 3hol s GLU 37 N -2.65 0.91 -0.19 1.64 2.12 -1.26 -5.12 118.70 114.16 3hol s GLU 37 Ca 0.66 -0.86 -0.00 0.00 0.36 0.00 0.00 54.97 55.13 3hol s GLU 37 Cb -0.44 -0.94 0.05 0.00 0.26 0.00 0.00 34.13 33.06 3hol s GLU 37 CO 0.53 0.22 -0.06 -1.14 -0.54 0.00 0.00 175.26 174.28 3hol s GLN 38 N -1.41 1.59 0.38 4.30 0.74 -1.26 -5.13 119.66 118.87 3hol s GLN 38 Ca 0.01 -0.67 -0.24 0.00 0.05 0.00 0.00 55.36 54.50 3hol s GLN 38 Cb -0.09 -2.21 -0.10 0.00 1.10 0.00 0.00 33.01 31.72 3hol s GLN 38 CO 0.02 -0.47 1.00 -0.51 -0.55 0.00 0.00 175.29 174.78 3hol s LEU 39 N 1.54 4.15 0.92 3.68 1.43 -1.26 -5.03 118.68 124.12 3hol s LEU 39 Ca -0.01 1.92 -0.12 0.00 -1.03 0.00 0.00 54.13 54.89 3hol s LEU 39 Cb -0.16 -4.21 0.09 0.00 0.03 0.00 0.00 46.19 41.94 3hol s LEU 39 CO -0.08 -0.36 0.78 0.61 0.23 0.00 0.00 176.35 177.54 3hol n GLY 40 N 0.22 -1.16 0.41 -3.19 0.00 -1.26 -4.83 105.19 95.37 3hol n GLY 40 Ca 0.05 -0.71 0.21 0.00 0.00 0.00 0.00 46.02 45.57 3hol n GLY 40 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3hol h GLU 41 N -1.63 0.14 -0.26 1.61 4.11 -2.02 0.09 114.58 116.62 3hol h GLU 41 Ca -0.43 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 58.99 3hol h GLU 41 Cb 1.28 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.50 3hol h GLU 41 CO 0.38 0.09 0.00 1.28 0.07 0.00 0.00 179.01 180.84 3hol n LEU 42 N -4.39 2.51 -0.42 3.06 4.77 -1.26 -4.37 117.00 116.89 3hol n LEU 42 Ca 0.14 -1.05 0.04 0.00 -0.03 0.00 0.00 56.01 55.11 3hol n LEU 42 Cb 0.69 -0.16 0.09 0.00 -2.33 0.00 0.00 43.42 41.71 3hol n LEU 42 CO 0.36 0.53 0.53 0.23 -1.33 0.00 0.00 177.39 177.70 3hol n MET 43 N 0.88 2.06 -2.45 3.23 2.81 0.02 -4.83 117.12 118.84 3hol n MET 43 Ca 0.17 -1.62 -0.41 0.00 -1.81 0.00 0.00 57.70 54.03 3hol n MET 43 Cb 0.46 -1.18 -0.04 0.00 -0.71 0.00 0.00 33.22 31.75 3hol n MET 43 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 3hol s GLU 44 N -0.90 4.57 0.47 0.03 0.41 -1.24 -4.82 118.70 117.22 3hol s GLU 44 Ca 0.15 1.81 -0.22 0.00 -0.41 0.00 0.00 54.97 56.30 3hol s GLU 44 Cb 0.08 -3.23 -0.08 0.00 -1.78 0.00 0.00 34.13 29.13 3hol s GLU 44 CO 0.11 0.07 1.10 -1.25 -0.49 0.00 0.00 175.26 174.80 3hol s PRO 45 N -0.77 3.78 0.22 0.39 0.04 -1.26 -5.06 135.00 132.34 3hol s PRO 45 Ca 0.48 1.58 -0.17 0.00 0.04 0.00 0.00 61.00 62.93 3hol s PRO 45 Cb -0.32 -2.28 0.02 0.00 0.04 0.00 0.00 34.50 31.97 3hol s PRO 45 CO 0.38 -0.49 0.55 0.00 0.04 0.00 0.00 177.00 177.49 3hol s ALA 46 N -1.73 -0.88 0.37 8.56 0.00 -1.26 -5.02 121.76 121.80 3hol s ALA 46 Ca 0.65 -0.34 0.05 0.00 0.00 0.00 0.00 51.96 52.32 3hol s ALA 46 Cb -0.23 0.89 0.73 0.00 0.00 0.00 0.00 23.12 24.51 3hol s ALA 46 CO 0.28 -0.86 1.99 -0.07 0.00 0.00 0.00 175.76 177.10 3hol h LEU 47 N 2.17 0.65 -7.70 0.00 3.38 -1.87 -3.47 115.31 108.47 3hol h LEU 47 Ca -0.27 -0.01 0.23 0.00 0.09 0.00 0.00 57.88 57.93 3hol h LEU 47 Cb 1.26 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 41.79 3hol h LEU 47 CO 0.34 0.45 0.67 -0.83 0.09 0.00 0.00 178.44 179.16 3hol s GLY 48 N -3.56 -0.14 0.04 0.83 0.00 -1.18 -1.52 107.32 101.80 3hol s GLY 48 Ca -0.10 0.09 -0.03 0.00 0.00 0.00 0.00 44.72 44.68 3hol s GLY 48 CO 0.76 1.76 0.03 -0.19 0.00 0.00 0.00 173.10 175.46 3hol s TYR 49 N -2.49 0.30 -0.05 1.90 2.02 -0.55 -0.47 117.35 118.02 3hol s TYR 49 Ca 0.19 -0.65 -0.05 0.00 -0.37 0.00 0.00 57.07 56.18 3hol s TYR 49 Cb -0.00 -0.22 0.01 0.00 -0.40 0.00 0.00 41.96 41.35 3hol s TYR 49 CO 0.01 -0.32 0.14 0.54 -1.57 0.00 0.00 175.55 174.36 3hol s VAL 50 N -2.59 0.01 0.05 0.71 0.11 0.06 -1.69 120.40 117.06 3hol s VAL 50 Ca -0.05 -0.11 0.04 0.00 -2.93 0.00 0.00 61.98 58.93 3hol s VAL 50 Cb -0.02 -0.24 -0.02 0.00 -1.53 0.00 0.00 36.38 34.57 3hol s VAL 50 CO -0.05 -0.06 -0.13 0.54 -3.33 0.00 0.00 175.10 172.07 3hol s VAL 51 N -0.15 1.00 0.24 2.04 0.11 -0.17 -0.84 120.40 122.63 3hol s VAL 51 Ca -0.02 -1.05 -0.30 0.00 -2.93 0.00 0.00 61.98 57.69 3hol s VAL 51 Cb -0.02 -0.93 -0.09 0.00 -1.53 0.00 0.00 36.38 33.81 3hol s VAL 51 CO 0.00 -0.10 1.10 -0.75 -3.33 0.00 0.00 175.10 172.02 3hol s LYS 52 N -1.29 4.63 0.03 1.54 2.20 -1.26 -1.33 119.74 124.25 3hol s LYS 52 Ca -0.01 1.77 -0.30 0.00 -0.36 0.00 0.00 55.97 57.06 3hol s LYS 52 Cb -0.08 -3.22 -0.07 0.00 -1.51 0.00 0.00 37.83 32.95 3hol s LYS 52 CO 0.01 0.17 1.50 0.08 -0.36 0.00 0.00 175.35 176.76 3hol s VAL 53 N -0.84 3.44 0.51 4.02 1.01 -0.16 -4.84 120.40 123.55 3hol s VAL 53 Ca 0.46 0.85 -0.22 0.00 0.00 0.00 0.00 61.98 63.08 3hol s VAL 53 Cb -0.31 -3.55 -0.06 0.00 0.00 0.00 0.00 36.38 32.46 3hol s VAL 53 CO 0.39 -0.00 1.24 -2.84 0.00 0.00 0.00 175.10 173.88 3hol s PRO 54 N 2.50 3.40 -0.06 2.72 0.02 -1.26 -4.75 135.00 137.56 3hol s PRO 54 Ca 0.68 1.94 0.01 0.00 0.02 0.00 0.00 61.00 63.64 3hol s PRO 54 Cb -0.35 -2.26 0.02 0.00 0.02 0.00 0.00 34.50 31.93 3hol s PRO 54 CO 0.29 -0.89 -0.06 0.08 -0.33 0.00 0.00 177.00 176.09 3hol s VAL 55 N -1.48 0.74 0.15 3.83 1.01 -1.26 -0.87 120.40 122.52 3hol s VAL 55 Ca 0.69 -0.20 0.02 0.00 0.00 0.00 0.00 61.98 62.49 3hol s VAL 55 Cb -0.33 -0.75 0.02 0.00 0.00 0.00 0.00 36.38 35.32 3hol s VAL 55 CO 0.39 0.28 0.16 -1.54 0.00 0.00 0.00 175.10 174.39 3hol n SER 56 N 4.30 0.98 -3.87 3.32 3.41 0.75 -4.85 113.62 117.67 3hol n SER 56 Ca -0.20 -1.44 -0.07 0.00 -0.26 0.00 0.00 58.87 56.90 3hol n SER 56 Cb 0.51 -0.06 -0.02 0.00 -0.26 0.00 0.00 64.21 64.37 3hol n SER 56 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3hol s SER 57 N -1.89 -0.23 0.34 4.04 1.04 -0.31 -4.86 113.70 111.82 3hol s SER 57 Ca 0.12 -0.66 0.07 0.00 0.48 0.00 0.00 55.95 55.96 3hol s SER 57 Cb -0.01 0.71 0.74 0.00 0.10 0.00 0.00 66.02 67.57 3hol s SER 57 CO 0.08 -1.33 1.87 0.15 0.98 0.00 0.00 173.24 175.00 3hol h PHE 58 N 2.04 0.89 -0.02 5.02 3.57 -2.00 -2.36 116.94 124.07 3hol h PHE 58 Ca -0.20 0.03 -0.23 0.00 3.53 0.00 0.00 57.97 61.09 3hol h PHE 58 Cb 1.25 -0.28 0.01 0.00 2.79 0.00 0.00 35.95 39.71 3hol h PHE 58 CO 0.44 0.36 -0.92 1.49 -2.23 0.00 0.00 178.31 177.44 3hol h GLU 59 N 0.78 0.50 -3.18 1.11 4.81 -2.04 -3.39 114.58 113.16 3hol h GLU 59 Ca 0.44 -0.51 -0.62 0.00 -0.13 0.00 0.00 59.36 58.54 3hol h GLU 59 Cb 0.60 0.14 -0.40 0.00 0.63 0.00 0.00 28.75 29.71 3hol h GLU 59 CO -0.20 1.15 -0.70 -0.80 -0.73 0.00 0.00 179.01 177.73 3hol s ASN 60 N -7.11 3.92 0.35 1.04 0.02 -0.98 -5.01 114.94 107.17 3hol s ASN 60 Ca -0.07 -2.72 0.19 0.00 -1.02 0.00 0.00 52.86 49.23 3hol s ASN 60 Cb 0.09 -1.26 0.19 0.00 0.02 0.00 0.00 41.25 40.29 3hol s ASN 60 CO 0.88 -0.26 1.52 0.11 0.02 0.00 0.00 177.10 179.37 3hol h LYS 61 N 6.71 0.00 -5.05 -0.60 1.57 -1.65 -0.82 116.57 116.73 3hol h LYS 61 Ca -0.04 0.00 -0.66 0.00 -1.87 0.00 0.00 60.65 58.08 3hol h LYS 61 Cb 0.92 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 32.93 3hol h LYS 61 CO 0.56 0.28 -0.76 0.21 -0.57 0.00 0.00 179.45 179.17 3hol s LYS 62 N -3.07 3.28 -0.10 3.15 2.20 -1.26 0.10 119.74 124.04 3hol s LYS 62 Ca 0.05 -0.68 -0.00 0.00 -0.36 0.00 0.00 55.97 54.98 3hol s LYS 62 Cb 0.06 -2.85 0.02 0.00 -1.51 0.00 0.00 37.83 33.56 3hol s LYS 62 CO 0.71 -0.15 -0.07 0.08 -0.36 0.00 0.00 175.35 175.57 3hol s VAL 63 N 1.29 0.90 0.52 4.02 1.01 0.19 -5.02 120.40 123.31 3hol s VAL 63 Ca 0.03 -0.23 0.03 0.00 0.00 0.00 0.00 61.98 61.81 3hol s VAL 63 Cb -0.14 -0.93 0.03 0.00 0.00 0.00 0.00 36.38 35.34 3hol s VAL 63 CO -0.05 0.34 0.73 -1.81 0.00 0.00 0.00 175.10 174.31 3hol s ASP 64 N 1.60 5.35 0.10 3.32 1.01 -1.26 -1.39 116.67 125.40 3hol s ASP 64 Ca 0.02 -0.12 -0.33 0.00 0.71 0.00 0.00 52.55 52.83 3hol s ASP 64 Cb -0.13 -0.80 -0.12 0.00 1.01 0.00 0.00 42.92 42.88 3hol s ASP 64 CO -0.06 -1.06 1.73 -0.38 0.21 0.00 0.00 175.17 175.61 3hol n ILE 65 N -2.23 0.23 -3.86 0.77 2.08 -0.70 -4.85 119.36 110.80 3hol n ILE 65 Ca 0.08 -0.04 -0.09 0.00 0.56 0.00 0.00 62.75 63.26 3hol n ILE 65 Cb 0.60 -1.82 -0.04 0.00 -0.75 0.00 0.00 39.64 37.63 3hol n ILE 65 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 3hol s SER 66 N 2.13 -0.20 -1.12 4.38 1.04 -1.26 -4.96 113.70 113.72 3hol s SER 66 Ca 0.82 -0.68 -0.05 0.00 0.48 0.00 0.00 55.95 56.53 3hol s SER 66 Cb -0.61 0.62 0.01 0.00 0.10 0.00 0.00 66.02 66.13 3hol s SER 66 CO 0.40 -1.16 0.96 0.47 0.98 0.00 0.00 173.24 174.89 3hol n ASP 67 N -0.38 -4.30 -4.74 7.02 8.00 -1.26 -4.68 116.55 116.21 3hol n ASP 67 Ca -0.05 -0.49 -0.41 0.00 0.71 0.00 0.00 54.79 54.54 3hol n ASP 67 Cb 0.61 -4.44 -0.02 0.00 -0.02 0.00 0.00 41.12 37.25 3hol n ASP 67 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3hol s ILE 68 N -3.29 2.72 -0.02 0.53 1.01 -1.26 -4.68 121.20 116.21 3hol s ILE 68 Ca 0.31 0.59 0.07 0.00 0.00 0.00 0.00 60.65 61.62 3hol s ILE 68 Cb -0.13 -3.38 -0.02 0.00 0.01 0.00 0.00 42.46 38.93 3hol s ILE 68 CO 0.63 0.09 -0.23 -1.61 0.00 0.00 0.00 174.94 173.82 3hol s GLU 69 N -0.19 2.19 0.35 2.79 2.02 -0.02 -4.95 118.70 120.89 3hol s GLU 69 Ca 0.60 -0.89 -0.27 0.00 0.02 0.00 0.00 54.97 54.44 3hol s GLU 69 Cb -0.41 -2.13 -0.09 0.00 0.10 0.00 0.00 34.13 31.60 3hol s GLU 69 CO 0.41 0.57 1.14 0.54 0.02 0.00 0.00 175.26 177.95 3hol s VAL 70 N -0.67 3.31 -0.17 2.63 0.11 -1.26 -0.76 120.40 123.59 3hol s VAL 70 Ca 0.11 1.18 -0.08 0.00 -2.93 0.00 0.00 61.98 60.26 3hol s VAL 70 Cb -0.10 -3.70 -0.04 0.00 -1.53 0.00 0.00 36.38 31.01 3hol s VAL 70 CO -0.00 0.18 0.09 -0.63 -3.33 0.00 0.00 175.10 171.40 3hol s ILE 71 N -1.34 5.02 -0.93 7.04 1.01 0.38 -4.84 121.20 127.55 3hol s ILE 71 Ca 0.52 0.05 0.11 0.00 0.00 0.00 0.00 60.65 61.33 3hol s ILE 71 Cb -0.31 -3.26 -0.02 0.00 0.01 0.00 0.00 42.46 38.89 3hol s ILE 71 CO 0.39 0.48 0.63 0.35 0.00 0.00 0.00 174.94 176.80 3hol n THR 72 N 3.27 0.00 -3.54 2.92 -2.24 -1.26 -3.09 114.28 110.34 3hol n THR 72 Ca -0.17 -0.36 -0.41 0.00 -2.27 0.00 0.00 64.05 60.84 3hol n THR 72 Cb 0.53 1.11 -0.11 0.00 -2.10 0.00 0.00 70.33 69.76 3hol n THR 72 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3hol s ASN 73 N -1.55 5.92 0.00 3.42 2.47 -1.26 -4.79 114.94 119.15 3hol s ASN 73 Ca 0.08 -0.69 0.15 0.00 0.42 0.00 0.00 52.86 52.82 3hol s ASN 73 Cb 0.09 -2.10 0.58 0.00 -1.45 0.00 0.00 41.25 38.37 3hol s ASN 73 CO 0.31 -0.32 1.42 0.61 -3.72 0.00 0.00 177.10 175.40 3hol n GLY 74 N 5.08 -0.01 3.66 1.21 0.00 -1.26 -4.86 105.19 109.00 3hol n GLY 74 Ca -0.12 -0.30 -0.43 0.00 0.00 0.00 0.00 46.02 45.17 3hol n GLY 74 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hol s ASN 75 N -1.33 6.96 0.45 1.61 3.84 -1.26 -4.07 114.94 121.14 3hol s ASN 75 Ca 0.25 1.53 0.30 0.00 0.21 0.00 0.00 52.86 55.15 3hol s ASN 75 Cb 0.13 -2.54 1.27 0.00 -0.55 0.00 0.00 41.25 39.56 3hol s ASN 75 CO 0.19 -0.77 1.90 -0.07 -2.79 0.00 0.00 177.10 175.56 3hol h LEU 76 N 9.77 0.00 0.00 3.21 3.38 -1.95 -2.62 115.31 127.10 3hol h LEU 76 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 3hol h LEU 76 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 3hol h LEU 76 CO 0.98 0.00 -0.26 0.44 0.09 0.00 0.00 178.44 179.69 3hol h ASP 77 N 0.00 0.00 -3.58 -0.43 3.32 -2.00 -3.42 116.42 110.30 3hol h ASP 77 Ca 0.00 -0.03 -0.66 0.00 0.02 0.00 0.00 57.03 56.35 3hol h ASP 77 Cb 0.43 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 39.82 3hol h ASP 77 CO 0.00 0.02 -0.05 -1.81 -1.72 0.00 0.00 179.24 175.67 3hol s ASP 78 N -5.27 6.28 0.08 6.45 1.01 -0.99 -5.07 116.67 119.16 3hol s ASP 78 Ca 0.07 -0.32 -0.22 0.00 0.71 0.00 0.00 52.55 52.79 3hol s ASP 78 Cb 0.09 -2.27 -0.07 0.00 1.01 0.00 0.00 42.92 41.69 3hol s ASP 78 CO 0.68 -0.59 0.64 -0.69 0.21 0.00 0.00 175.17 175.42 3hol s VAL 79 N 2.43 4.68 0.29 -1.27 1.01 -1.26 -4.88 120.40 121.40 3hol s VAL 79 Ca 0.18 1.38 -0.29 0.00 0.00 0.00 0.00 61.98 63.24 3hol s VAL 79 Cb -0.16 -3.98 -0.13 0.00 0.00 0.00 0.00 36.38 32.11 3hol s VAL 79 CO 0.15 0.50 1.25 -2.65 0.00 0.00 0.00 175.10 174.35 3hol n PRO 80 N 2.00 1.85 -1.53 2.72 -0.02 -1.26 -2.44 135.00 136.32 3hol n PRO 80 Ca -0.08 0.65 -0.18 0.00 -2.02 0.00 0.00 63.50 61.87 3hol n PRO 80 Cb 0.50 -2.20 -0.08 0.00 -0.02 0.00 0.00 33.50 31.71 3hol n PRO 80 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3hol n TYR 81 N 0.87 0.00 -0.27 6.00 4.01 -1.26 -4.89 117.16 121.62 3hol n TYR 81 Ca 0.09 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.92 3hol n TYR 81 Cb 0.33 -3.10 0.23 0.00 -0.31 0.00 0.00 39.34 36.49 3hol n TYR 81 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 3hol h LYS 82 N 0.00 0.23 -0.70 -0.72 1.63 -1.90 -1.74 116.57 113.37 3hol h LYS 82 Ca -0.37 -0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.41 3hol h LYS 82 Cb 1.19 -0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 32.73 3hol h LYS 82 CO 0.54 0.15 0.41 0.00 -3.45 0.00 0.00 179.45 177.11 3hol h ALA 83 N 1.70 0.90 -0.97 5.00 0.00 -1.90 -2.01 119.26 121.97 3hol h ALA 83 Ca 0.48 -0.09 0.13 0.00 0.00 0.00 0.00 54.91 55.43 3hol h ALA 83 Cb 0.90 -0.28 -0.08 0.00 0.00 0.00 0.00 17.79 18.32 3hol h ALA 83 CO -0.59 0.38 0.62 -0.91 0.00 0.00 0.00 179.25 178.75 3hol h ASN 84 N 0.96 0.85 0.78 0.00 4.21 -1.72 -2.70 115.58 117.96 3hol h ASN 84 Ca 0.25 0.05 0.00 0.00 1.21 0.00 0.00 56.30 57.81 3hol h ASN 84 Cb -0.01 -0.12 0.00 0.00 -1.12 0.00 0.00 38.32 37.07 3hol h ASN 84 CO -0.04 0.45 0.00 0.77 -1.29 0.00 0.00 177.43 177.31 3hol h SER 85 N 0.91 0.00 -0.03 5.81 4.64 -1.02 -2.53 113.55 121.33 3hol h SER 85 Ca 0.49 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.82 3hol h SER 85 Cb 0.55 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.64 3hol h SER 85 CO -0.25 0.00 0.07 0.77 -0.87 0.00 0.00 176.83 176.55 3hol h SER 86 N 0.00 0.00 0.08 4.97 4.64 -1.51 -1.82 113.55 119.91 3hol h SER 86 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hol h SER 86 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 3hol h SER 86 CO 0.00 0.00 -0.15 0.29 -0.87 0.00 0.00 176.83 176.10 3hol n LYS 87 N -3.43 1.39 -2.44 4.77 5.02 -0.95 -4.96 118.16 117.56 3hol n LYS 87 Ca -0.02 -0.92 -0.34 0.00 -2.02 0.00 0.00 58.31 55.01 3hol n LYS 87 Cb 0.15 -1.48 -0.02 0.00 -0.02 0.00 0.00 35.03 33.66 3hol n LYS 87 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3hol s TYR 88 N -2.24 2.89 0.20 2.13 1.51 -0.68 -4.96 117.35 116.19 3hol s TYR 88 Ca 0.29 1.57 -0.11 0.00 -1.01 0.00 0.00 57.07 57.81 3hol s TYR 88 Cb 0.20 -3.14 0.20 0.00 -0.11 0.00 0.00 41.96 39.11 3hol s TYR 88 CO 0.43 -1.08 1.79 -0.91 -1.11 0.00 0.00 175.55 174.67 3hol h ASN 89 N 1.42 0.45 -2.67 2.29 4.21 -1.89 -3.36 115.58 116.04 3hol h ASN 89 Ca -0.50 0.03 -0.57 0.00 1.21 0.00 0.00 56.30 56.48 3hol h ASN 89 Cb 1.23 -0.05 -0.39 0.00 -1.12 0.00 0.00 38.32 37.99 3hol h ASN 89 CO 0.58 0.29 -0.83 -0.47 -1.29 0.00 0.00 177.43 175.72 3hol s TYR 90 N -6.11 0.65 0.13 1.19 5.04 -1.26 -4.93 117.35 112.06 3hol s TYR 90 Ca -0.13 -1.44 -0.31 0.00 -2.44 0.00 0.00 57.07 52.75 3hol s TYR 90 Cb 0.15 -0.94 -0.09 0.00 0.35 0.00 0.00 41.96 41.43 3hol s TYR 90 CO 0.75 -0.83 1.61 -2.14 -1.34 0.00 0.00 175.55 173.60 3hol s PRO 91 N 1.34 4.20 -0.36 4.97 0.02 -1.26 -0.51 135.00 143.40 3hol s PRO 91 Ca 0.16 2.36 0.01 0.00 0.02 0.00 0.00 61.00 63.54 3hol s PRO 91 Cb -0.21 -3.32 0.12 0.00 0.02 0.00 0.00 34.50 31.10 3hol s PRO 91 CO -0.09 -0.66 0.15 0.34 -0.33 0.00 0.00 177.00 176.41 3hol s ASP 92 N 1.63 3.87 -0.25 2.53 -1.08 0.11 -4.86 116.67 118.63 3hol s ASP 92 Ca 0.72 -2.06 -0.10 0.00 -0.52 0.00 0.00 52.55 50.58 3hol s ASP 92 Cb -0.43 -0.94 -0.05 0.00 -1.46 0.00 0.00 42.92 40.04 3hol s ASP 92 CO 0.32 -0.35 0.16 -0.63 0.52 0.00 0.00 175.17 175.19 3hol s ILE 93 N 1.08 5.30 0.29 4.11 1.01 -1.26 -1.42 121.20 130.31 3hol s ILE 93 Ca 0.13 0.16 -0.30 0.00 0.00 0.00 0.00 60.65 60.64 3hol s ILE 93 Cb -0.20 -3.49 -0.11 0.00 0.01 0.00 0.00 42.46 38.67 3hol s ILE 93 CO -0.13 0.32 1.51 -0.75 0.00 0.00 0.00 174.94 175.89 3hol s LYS 94 N 1.27 4.19 0.74 2.79 2.20 -0.57 -4.90 119.74 125.46 3hol s LYS 94 Ca 0.07 2.46 -0.15 0.00 -0.36 0.00 0.00 55.97 57.98 3hol s LYS 94 Cb -0.14 -3.05 0.03 0.00 -1.51 0.00 0.00 37.83 33.15 3hol s LYS 94 CO 0.06 -0.52 1.12 -2.37 -0.36 0.00 0.00 175.35 173.28 3hol n THR 95 N 2.02 2.98 -2.98 3.43 5.66 -1.26 -4.83 114.28 119.29 3hol n THR 95 Ca 0.07 -0.34 -0.41 0.00 -3.05 0.00 0.00 64.05 60.32 3hol n THR 95 Cb 0.39 -1.22 -0.05 0.00 -1.55 0.00 0.00 70.33 67.90 3hol n THR 95 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 3hol s LYS 96 N -3.63 4.30 -0.33 1.09 2.20 -1.26 -5.03 119.74 117.08 3hol s LYS 96 Ca 0.75 0.88 -0.29 0.00 -0.36 0.00 0.00 55.97 56.95 3hol s LYS 96 Cb -0.33 -3.55 0.01 0.00 -1.51 0.00 0.00 37.83 32.44 3hol s LYS 96 CO 0.48 -0.23 1.26 0.34 -0.36 0.00 0.00 175.35 176.85 3hol s ASP 97 N 1.10 6.67 0.34 1.43 -1.08 -1.26 -4.91 116.67 118.97 3hol s ASP 97 Ca 0.35 1.07 0.26 0.00 -0.52 0.00 0.00 52.55 53.71 3hol s ASP 97 Cb -0.17 -2.54 1.18 0.00 -1.46 0.00 0.00 42.92 39.94 3hol s ASP 97 CO 0.13 -1.10 1.78 0.28 0.52 0.00 0.00 175.17 176.77 3hol h SER 98 N 9.24 0.00 1.08 -0.34 0.02 -2.01 -2.18 113.55 119.36 3hol h SER 98 Ca -0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 3hol h SER 98 Cb 1.09 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.63 3hol h SER 98 CO 1.05 0.00 -0.19 -1.54 -1.14 0.00 0.00 176.83 175.00 3hol n SER 99 N -2.41 0.51 -4.62 3.07 3.41 -1.26 -4.78 113.62 107.55 3hol n SER 99 Ca 0.01 0.35 -0.41 0.00 -0.26 0.00 0.00 58.87 58.56 3hol n SER 99 Cb 0.17 -0.38 -0.07 0.00 -0.26 0.00 0.00 64.21 63.68 3hol n SER 99 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3hol s LEU 100 N -3.82 4.09 -0.01 1.04 1.43 -0.82 -4.94 118.68 115.64 3hol s LEU 100 Ca 0.11 0.60 0.21 0.00 -1.03 0.00 0.00 54.13 54.01 3hol s LEU 100 Cb 0.15 -2.82 -0.24 0.00 0.03 0.00 0.00 46.19 43.31 3hol s LEU 100 CO 0.62 -0.40 0.54 0.00 0.23 0.00 0.00 176.35 177.34 3hol n GLN 101 N 5.75 0.65 0.00 1.70 6.02 -1.26 -4.69 117.38 125.55 3hol n GLN 101 Ca -0.01 -0.05 0.00 0.00 -0.01 0.00 0.00 57.00 56.93 3hol n GLN 101 Cb 0.49 -1.61 0.00 0.00 1.02 0.00 0.00 30.24 30.14 3hol n GLN 101 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3hol n TYR 102 N -2.51 0.00 -4.24 1.08 4.01 -1.26 -4.95 117.16 109.29 3hol n TYR 102 Ca -0.10 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.51 3hol n TYR 102 Cb 0.72 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.65 3hol n TYR 102 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 3hol s VAL 103 N -0.78 0.99 -0.23 -0.72 -7.23 -1.26 -0.93 120.40 110.24 3hol s VAL 103 Ca 0.00 -2.02 -0.16 0.00 -1.81 0.00 0.00 61.98 57.99 3hol s VAL 103 Cb 0.00 -1.88 0.07 0.00 0.56 0.00 0.00 36.38 35.13 3hol s VAL 103 CO 0.00 -0.72 0.57 -0.60 -0.31 0.00 0.00 175.10 174.05 3hol s ARG 104 N -3.80 0.61 0.17 4.82 3.52 0.47 -4.88 118.95 119.86 3hol s ARG 104 Ca 0.17 0.95 0.04 0.00 -0.13 0.00 0.00 55.73 56.76 3hol s ARG 104 Cb 0.04 0.17 -0.05 0.00 -1.56 0.00 0.00 34.95 33.55 3hol s ARG 104 CO 0.00 -0.13 -0.08 -1.54 -0.81 0.00 0.00 175.30 172.75 3hol s SER 105 N 1.06 1.80 0.00 -2.12 1.04 -1.26 -0.43 113.70 113.79 3hol s SER 105 Ca -0.06 -1.06 0.00 0.00 0.48 0.00 0.00 55.95 55.31 3hol s SER 105 Cb -0.06 -0.00 0.00 0.00 0.10 0.00 0.00 66.02 66.06 3hol s SER 105 CO -0.10 -0.37 0.00 0.61 0.98 0.00 0.00 173.24 174.36 3hol n GLY 106 N -0.25 -0.51 3.28 7.32 0.00 -0.72 -4.99 105.19 109.32 3hol n GLY 106 Ca -0.09 -0.67 -0.09 0.00 0.00 0.00 0.00 46.02 45.17 3hol n GLY 106 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hol s TYR 107 N -4.00 0.41 -0.28 1.61 -0.85 -1.26 -2.10 117.35 110.88 3hol s TYR 107 Ca 0.00 -0.80 -0.03 0.00 -0.52 0.00 0.00 57.07 55.72 3hol s TYR 107 Cb 0.00 -0.12 0.09 0.00 0.38 0.00 0.00 41.96 42.31 3hol s TYR 107 CO 0.00 -0.65 0.11 0.08 -1.52 0.00 0.00 175.55 173.57 3hol s VAL 108 N -3.96 0.27 0.16 -3.49 1.01 -0.17 -1.51 120.40 112.71 3hol s VAL 108 Ca 0.15 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.24 3hol s VAL 108 Cb 0.04 -1.18 -0.05 0.00 0.00 0.00 0.00 36.38 35.20 3hol s VAL 108 CO -0.02 -0.65 -0.01 0.27 0.00 0.00 0.00 175.10 174.69 3hol s ILE 109 N 1.93 0.67 -0.39 2.22 -4.36 -0.51 -0.56 121.20 120.21 3hol s ILE 109 Ca 0.08 -1.97 -0.24 0.00 -0.26 0.00 0.00 60.65 58.26 3hol s ILE 109 Cb -0.16 -2.05 0.01 0.00 1.25 0.00 0.00 42.46 41.51 3hol s ILE 109 CO -0.30 -0.54 0.82 -0.62 0.24 0.00 0.00 174.94 174.55 3hol s ASP 110 N -3.15 6.55 0.00 4.36 -1.08 0.24 0.05 116.67 123.63 3hol s ASP 110 Ca 0.22 0.30 0.30 0.00 -0.52 0.00 0.00 52.55 52.85 3hol s ASP 110 Cb 0.06 -2.41 1.75 0.00 -1.46 0.00 0.00 42.92 40.86 3hol s ASP 110 CO 0.03 -0.82 2.11 0.61 0.52 0.00 0.00 175.17 177.62 3hol n GLY 111 N 4.61 -0.98 2.44 2.66 0.00 0.33 -3.37 105.19 110.89 3hol n GLY 111 Ca 0.04 -0.18 -0.18 0.00 0.00 0.00 0.00 46.02 45.70 3hol n GLY 111 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hol n GLU 112 N -1.04 1.55 -2.24 1.61 1.02 -1.26 -4.94 120.64 115.34 3hol n GLU 112 Ca 0.21 -3.67 -0.41 0.00 -0.02 0.00 0.00 57.16 53.28 3hol n GLU 112 Cb 0.12 -1.72 -0.03 0.00 -0.02 0.00 0.00 31.44 29.79 3hol n GLU 112 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 3hol s HIS 113 N -2.84 3.24 -0.16 -0.32 2.46 -1.22 -4.67 115.29 111.79 3hol s HIS 113 Ca 0.39 1.48 -0.21 0.00 0.47 0.00 0.00 55.06 57.19 3hol s HIS 113 Cb 0.37 -3.55 0.05 0.00 -0.13 0.00 0.00 32.58 29.33 3hol s HIS 113 CO -0.07 -1.45 0.56 0.45 -2.47 0.00 0.00 174.74 171.75 3hol s SER 114 N -0.49 -0.55 0.29 9.88 0.15 -1.26 -5.14 113.70 116.58 3hol s SER 114 Ca 0.49 0.93 0.00 0.00 0.70 0.00 0.00 55.95 58.07 3hol s SER 114 Cb -0.37 0.94 0.00 0.00 -1.71 0.00 0.00 66.02 64.88 3hol s SER 114 CO 0.47 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 175.22 3hol n GLY 115 N 2.24 -0.82 0.35 9.45 0.00 -1.26 -4.01 105.19 111.13 3hol n GLY 115 Ca -0.16 -1.17 0.14 0.00 0.00 0.00 0.00 46.02 44.83 3hol n GLY 115 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3hol n SER 116 N -0.85 1.11 -4.65 1.61 3.41 -1.26 -4.88 113.62 108.10 3hol n SER 116 Ca 0.00 -1.32 -0.30 0.00 -0.26 0.00 0.00 58.87 56.99 3hol n SER 116 Cb 0.00 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.12 3hol n SER 116 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 3hol s ASN 117 N -2.05 2.79 0.52 4.04 0.01 -1.26 -4.95 114.94 114.04 3hol s ASN 117 Ca 0.39 1.80 -0.20 0.00 -0.71 0.00 0.00 52.86 54.14 3hol s ASN 117 Cb 0.21 -2.39 -0.07 0.00 0.41 0.00 0.00 41.25 39.41 3hol s ASN 117 CO 0.36 -3.12 1.10 -1.83 -1.51 0.00 0.00 177.10 172.10 3hol s GLU 118 N -4.71 3.54 0.04 -0.60 -1.05 -1.26 -4.90 118.70 109.76 3hol s GLU 118 Ca 0.66 1.52 -0.08 0.00 -0.15 0.00 0.00 54.97 56.91 3hol s GLU 118 Cb -0.21 -2.06 -0.31 0.00 -0.44 0.00 0.00 34.13 31.11 3hol s GLU 118 CO 0.59 -0.67 1.02 -0.22 0.95 0.00 0.00 175.26 176.93 3hol h LYS 119 N 1.38 0.37 0.00 -4.83 1.63 -1.92 -3.44 116.57 109.76 3hol h LYS 119 Ca -0.50 -0.63 0.00 0.00 -0.85 0.00 0.00 60.65 58.67 3hol h LYS 119 Cb 1.25 0.24 0.00 0.00 -0.60 0.00 0.00 32.23 33.11 3hol h LYS 119 CO 0.58 1.29 0.00 0.41 -3.45 0.00 0.00 179.45 178.28 3hol n GLY 120 N 1.64 0.74 3.16 5.01 0.00 -1.26 -0.59 105.19 113.88 3hol n GLY 120 Ca -0.13 -1.72 -0.10 0.00 0.00 0.00 0.00 46.02 44.06 3hol n GLY 120 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hol s TYR 121 N -3.28 0.08 -0.03 1.61 2.02 0.28 -0.99 117.35 117.04 3hol s TYR 121 Ca 0.00 -0.31 0.05 0.00 -0.37 0.00 0.00 57.07 56.44 3hol s TYR 121 Cb 0.00 -0.05 -0.01 0.00 -0.40 0.00 0.00 41.96 41.50 3hol s TYR 121 CO 0.00 -0.40 -0.18 0.08 -1.57 0.00 0.00 175.55 173.48 3hol s VAL 122 N -2.47 1.44 0.13 0.71 1.01 -0.44 -1.00 120.40 119.79 3hol s VAL 122 Ca -0.06 -0.75 -0.13 0.00 0.00 0.00 0.00 61.98 61.03 3hol s VAL 122 Cb -0.02 -1.22 0.02 0.00 0.00 0.00 0.00 36.38 35.16 3hol s VAL 122 CO -0.03 0.41 0.35 -0.72 0.00 0.00 0.00 175.10 175.11 3hol s TYR 123 N -0.20 -0.01 0.11 5.22 -0.85 -0.89 -1.00 117.35 119.72 3hol s TYR 123 Ca 0.02 -0.34 0.03 0.00 -0.52 0.00 0.00 57.07 56.25 3hol s TYR 123 Cb -0.09 0.16 -0.04 0.00 0.38 0.00 0.00 41.96 42.37 3hol s TYR 123 CO 0.01 -0.70 -0.09 1.52 -1.52 0.00 0.00 175.55 174.76 3hol s TYR 124 N -3.85 1.05 0.20 -3.49 -0.85 -0.68 -1.76 117.35 107.97 3hol s TYR 124 Ca 0.07 -0.73 -0.16 0.00 -0.52 0.00 0.00 57.07 55.73 3hol s TYR 124 Cb 0.02 -0.57 0.02 0.00 0.38 0.00 0.00 41.96 41.81 3hol s TYR 124 CO -0.08 -0.02 0.49 -1.59 -1.52 0.00 0.00 175.55 172.83 3hol s LYS 125 N -3.18 1.40 0.18 -3.49 -2.85 0.42 -1.48 119.74 110.73 3hol s LYS 125 Ca 0.09 -0.98 -0.15 0.00 -1.00 0.00 0.00 55.97 53.93 3hol s LYS 125 Cb -0.00 0.50 0.02 0.00 -2.06 0.00 0.00 37.83 36.28 3hol s LYS 125 CO -0.01 -0.58 0.44 0.20 0.10 0.00 0.00 175.35 175.49 3hol s GLY 126 N -2.91 0.04 0.29 0.59 0.00 -0.57 -0.40 107.32 104.36 3hol s GLY 126 Ca 0.12 -0.39 0.04 0.00 0.00 0.00 0.00 44.72 44.49 3hol s GLY 126 CO -0.00 -0.43 0.03 0.54 0.00 0.00 0.00 173.10 173.24 3hol s ASN 127 N -2.89 2.12 -1.11 1.64 2.20 -0.10 -4.51 114.94 112.29 3hol s ASN 127 Ca 0.10 -1.31 -0.05 0.00 -0.94 0.00 0.00 52.86 50.66 3hol s ASN 127 Cb 0.01 -0.04 -0.04 0.00 -2.00 0.00 0.00 41.25 39.18 3hol s ASN 127 CO -0.03 -0.57 0.92 -0.24 -2.94 0.00 0.00 177.10 174.24 3hol n SER 128 N -0.57 -5.01 -4.61 3.54 2.88 -1.26 -3.48 113.62 105.11 3hol n SER 128 Ca -0.03 -0.72 -0.50 0.00 -1.33 0.00 0.00 58.87 56.29 3hol n SER 128 Cb 0.65 -4.98 -0.05 0.00 -0.75 0.00 0.00 64.21 59.09 3hol n SER 128 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 3hol n PRO 129 N -3.61 1.37 -1.72 -1.46 -0.02 -1.26 -0.64 135.00 127.67 3hol n PRO 129 Ca -0.14 0.49 -0.43 0.00 -2.02 0.00 0.00 63.50 61.40 3hol n PRO 129 Cb 0.63 -2.12 -0.02 0.00 -0.02 0.00 0.00 33.50 31.97 3hol n PRO 129 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hol n ALA 130 N 2.39 2.12 0.61 3.55 0.00 -0.52 -4.81 120.51 123.85 3hol n ALA 130 Ca 0.17 0.39 0.06 0.00 0.00 0.00 0.00 53.44 54.06 3hol n ALA 130 Cb 0.23 -2.41 -0.08 0.00 0.00 0.00 0.00 19.45 17.19 3hol n ALA 130 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3hol n LYS 131 N 2.21 2.52 -4.39 0.00 5.02 -0.94 -4.66 118.16 117.92 3hol n LYS 131 Ca 0.10 -0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.18 3hol n LYS 131 Cb 0.35 -1.14 -0.13 0.00 -0.02 0.00 0.00 35.03 34.09 3hol n LYS 131 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3hol s GLU 132 N -2.28 1.00 0.17 1.97 2.02 -0.82 -0.46 118.70 120.30 3hol s GLU 132 Ca 0.05 -0.81 0.11 0.00 0.02 0.00 0.00 54.97 54.34 3hol s GLU 132 Cb 0.10 -1.04 -0.04 0.00 0.10 0.00 0.00 34.13 33.25 3hol s GLU 132 CO 0.55 0.26 -0.23 -0.51 0.02 0.00 0.00 175.26 175.34 3hol s LEU 133 N -1.19 2.47 0.39 1.80 1.43 -0.51 -3.42 118.68 119.65 3hol s LEU 133 Ca 0.02 -0.78 -0.26 0.00 -1.03 0.00 0.00 54.13 52.09 3hol s LEU 133 Cb -0.08 -1.26 -0.11 0.00 0.03 0.00 0.00 46.19 44.77 3hol s LEU 133 CO 0.01 0.14 1.12 -2.65 0.23 0.00 0.00 176.35 175.21 3hol n PRO 134 N 0.47 1.62 -0.04 1.29 -0.02 -1.26 -0.41 135.00 136.65 3hol n PRO 134 Ca -0.14 0.58 -0.13 0.00 -2.02 0.00 0.00 63.50 61.78 3hol n PRO 134 Cb 0.55 -2.15 -0.11 0.00 -0.02 0.00 0.00 33.50 31.76 3hol n PRO 134 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3hol h VAL 135 N 1.89 1.55 0.00 -1.45 2.07 -1.56 -3.44 116.25 115.31 3hol h VAL 135 Ca -0.45 -1.73 0.00 0.00 0.82 0.00 0.00 66.70 65.34 3hol h VAL 135 Cb 1.32 2.71 0.00 0.00 -1.52 0.00 0.00 31.29 33.80 3hol h VAL 135 CO 0.59 0.44 0.00 -0.46 0.02 0.00 0.00 177.57 178.16 3hol n ASN 136 N -4.74 0.00 -4.75 0.57 2.04 -1.26 -3.90 115.26 103.22 3hol n ASN 136 Ca -0.09 -0.81 -0.41 0.00 -0.44 0.00 0.00 54.58 52.83 3hol n ASN 136 Cb 0.36 0.00 -0.03 0.00 -2.53 0.00 0.00 39.78 37.58 3hol n ASN 136 CO 0.00 0.00 0.00 -1.58 -0.44 0.00 0.00 177.26 175.24 3hol s GLN 137 N 0.00 4.42 -0.40 -3.83 0.74 -1.26 -4.54 119.66 114.78 3hol s GLN 137 Ca 0.00 2.04 -0.26 0.00 0.05 0.00 0.00 55.36 57.18 3hol s GLN 137 Cb 0.00 -3.18 0.02 0.00 1.10 0.00 0.00 33.01 30.96 3hol s GLN 137 CO 0.00 -0.17 0.97 -1.17 -0.55 0.00 0.00 175.29 174.37 3hol s LEU 138 N -0.60 3.94 -0.08 3.68 2.96 -1.26 -4.21 118.68 123.11 3hol s LEU 138 Ca 0.53 0.48 0.03 0.00 -0.22 0.00 0.00 54.13 54.95 3hol s LEU 138 Cb -0.36 -3.30 -0.02 0.00 0.50 0.00 0.00 46.19 43.01 3hol s LEU 138 CO 0.41 -0.96 -0.18 -0.76 -1.32 0.00 0.00 176.35 173.54 3hol s LEU 139 N 3.70 2.48 -0.26 -0.68 1.43 -0.46 -4.94 118.68 119.95 3hol s LEU 139 Ca 0.40 -0.36 -0.10 0.00 -1.03 0.00 0.00 54.13 53.04 3hol s LEU 139 Cb -0.11 -1.51 -0.05 0.00 0.03 0.00 0.00 46.19 44.56 3hol s LEU 139 CO 0.22 0.25 0.16 -0.89 0.23 0.00 0.00 176.35 176.32 3hol s THR 140 N -0.16 5.21 -0.18 5.49 2.01 -1.26 -0.20 115.64 126.54 3hol s THR 140 Ca -0.02 0.13 -0.09 0.00 0.31 0.00 0.00 61.69 62.02 3hol s THR 140 Cb -0.14 -3.46 -0.05 0.00 0.01 0.00 0.00 72.50 68.87 3hol s THR 140 CO 0.04 0.30 0.13 -0.31 -0.69 0.00 0.00 174.62 174.08 3hol s TYR 141 N 1.47 3.44 -0.02 4.92 2.02 0.59 -3.42 117.35 126.35 3hol s TYR 141 Ca 0.07 0.35 0.07 0.00 -0.37 0.00 0.00 57.07 57.20 3hol s TYR 141 Cb -0.15 -2.11 -0.02 0.00 -0.40 0.00 0.00 41.96 39.28 3hol s TYR 141 CO 0.08 0.37 -0.24 0.99 -1.57 0.00 0.00 175.55 175.18 3hol s THR 142 N 0.07 1.88 0.00 -0.71 2.01 -0.62 -0.22 115.64 118.05 3hol s THR 142 Ca 0.09 -1.02 0.00 0.00 0.31 0.00 0.00 61.69 61.07 3hol s THR 142 Cb -0.11 -1.56 0.00 0.00 0.01 0.00 0.00 72.50 70.84 3hol s THR 142 CO -0.01 0.53 0.00 0.61 -0.69 0.00 0.00 174.62 175.06 3hol n GLY 143 N 2.48 1.45 3.51 4.40 0.00 -0.26 -1.81 105.19 114.97 3hol n GLY 143 Ca -0.16 -0.04 -0.25 0.00 0.00 0.00 0.00 46.02 45.58 3hol n GLY 143 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hol s SER 144 N 2.00 2.76 0.11 1.61 1.04 -0.75 -0.55 113.70 119.93 3hol s SER 144 Ca 0.00 -1.60 -0.04 0.00 0.48 0.00 0.00 55.95 54.79 3hol s SER 144 Cb 0.00 0.36 -0.03 0.00 0.10 0.00 0.00 66.02 66.46 3hol s SER 144 CO 0.00 -0.85 0.11 -1.66 0.98 0.00 0.00 173.24 171.82 3hol s TRP 145 N -3.22 0.56 0.20 5.02 1.48 -1.01 -2.68 118.94 119.30 3hol s TRP 145 Ca 0.26 -0.99 -0.08 0.00 -1.06 0.00 0.00 56.10 54.23 3hol s TRP 145 Cb 0.04 -0.30 -0.02 0.00 -1.16 0.00 0.00 33.47 32.04 3hol s TRP 145 CO 0.14 -0.54 0.30 -0.51 -4.06 0.00 0.00 176.95 172.28 3hol s ASP 146 N -2.97 0.04 0.14 -2.66 1.01 -0.50 -4.70 116.67 107.02 3hol s ASP 146 Ca 0.15 -1.04 -0.24 0.00 0.71 0.00 0.00 52.55 52.13 3hol s ASP 146 Cb 0.06 0.46 0.07 0.00 1.01 0.00 0.00 42.92 44.53 3hol s ASP 146 CO -0.03 -0.95 0.71 0.72 0.21 0.00 0.00 175.17 175.83 3hol s PHE 147 N -4.04 -0.42 -0.02 4.23 -0.12 -1.26 -0.61 117.98 115.74 3hol s PHE 147 Ca 0.25 0.18 0.03 0.00 -0.05 0.00 0.00 56.93 57.34 3hol s PHE 147 Cb 0.03 0.58 -0.00 0.00 -0.63 0.00 0.00 43.02 43.00 3hol s PHE 147 CO 0.06 -0.83 -0.11 -0.08 -0.05 0.00 0.00 175.22 174.21 3hol s THR 148 N -3.59 0.95 0.92 -4.49 -1.32 -0.38 -1.56 115.64 106.17 3hol s THR 148 Ca 0.04 -0.47 -0.15 0.00 -1.21 0.00 0.00 61.69 59.90 3hol s THR 148 Cb -0.02 -0.82 0.17 0.00 -1.51 0.00 0.00 72.50 70.32 3hol s THR 148 CO -0.08 0.28 1.28 -0.94 -2.21 0.00 0.00 174.62 172.95 3hol s SER 149 N 0.01 3.48 0.97 8.08 1.04 0.13 -1.53 113.70 125.87 3hol s SER 149 Ca -0.01 0.37 -0.11 0.00 0.48 0.00 0.00 55.95 56.69 3hol s SER 149 Cb -0.08 -0.53 0.15 0.00 0.10 0.00 0.00 66.02 65.67 3hol s SER 149 CO 0.00 -2.51 0.90 -0.46 0.98 0.00 0.00 173.24 172.15 3hol n ASN 150 N -3.63 0.14 -4.34 7.02 6.94 -0.58 -4.43 115.26 116.36 3hol n ASN 150 Ca 0.13 -1.37 -0.35 0.00 -0.02 0.00 0.00 54.58 52.98 3hol n ASN 150 Cb 0.60 -0.68 -0.14 0.00 -2.36 0.00 0.00 39.78 37.20 3hol n ASN 150 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3hol s ALA 151 N -3.91 2.80 -0.24 -2.53 0.00 -0.48 -4.22 121.76 113.18 3hol s ALA 151 Ca 0.52 -1.08 -0.04 0.00 0.00 0.00 0.00 51.96 51.35 3hol s ALA 151 Cb -0.01 -1.61 0.08 0.00 0.00 0.00 0.00 23.12 21.58 3hol s ALA 151 CO 0.36 -0.25 0.11 1.21 0.00 0.00 0.00 175.76 177.19 3hol s ASN 152 N 1.17 3.12 0.00 0.00 3.84 -0.26 -0.64 114.94 122.18 3hol s ASN 152 Ca 0.02 -1.05 0.27 0.00 0.21 0.00 0.00 52.86 52.31 3hol s ASN 152 Cb -0.14 -0.36 0.85 0.00 -0.55 0.00 0.00 41.25 41.04 3hol s ASN 152 CO -0.01 -0.40 1.63 0.18 -2.79 0.00 0.00 177.10 175.71 3hol n LEU 153 N 5.22 0.62 -4.67 3.21 4.77 0.12 -4.31 117.00 121.96 3hol n LEU 153 Ca -0.06 -0.04 -0.43 0.00 -0.03 0.00 0.00 56.01 55.45 3hol n LEU 153 Cb 0.45 -0.21 -0.03 0.00 -2.33 0.00 0.00 43.42 41.29 3hol n LEU 153 CO 0.07 0.13 1.54 0.59 -1.33 0.00 0.00 177.39 178.39 3hol n ASN 154 N -1.06 4.02 -0.26 -1.43 3.02 -1.26 -4.87 115.26 113.41 3hol n ASN 154 Ca 0.10 0.94 0.22 0.00 -0.03 0.00 0.00 54.58 55.82 3hol n ASN 154 Cb 0.32 -1.51 0.56 0.00 -0.61 0.00 0.00 39.78 38.54 3hol n ASN 154 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 3hol h ASN 155 N 9.65 0.34 -0.56 6.41 2.35 -1.99 -0.54 115.58 131.23 3hol h ASN 155 Ca -0.48 0.04 -0.04 0.00 -0.55 0.00 0.00 56.30 55.27 3hol h ASN 155 Cb 1.24 -0.01 -0.03 0.00 0.05 0.00 0.00 38.32 39.57 3hol h ASN 155 CO 0.94 0.11 0.21 -0.08 -1.65 0.00 0.00 177.43 176.96 3hol h GLU 156 N 0.32 0.89 -0.20 0.81 4.22 -1.99 -3.04 114.58 115.59 3hol h GLU 156 Ca 0.50 -0.16 -0.00 0.00 0.08 0.00 0.00 59.36 59.79 3hol h GLU 156 Cb 1.40 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 3hol h GLU 156 CO -0.17 0.75 0.12 1.49 -2.18 0.00 0.00 179.01 179.02 3hol h GLU 157 N 0.87 0.27 -2.24 1.92 4.57 -1.47 -3.47 114.58 115.04 3hol h GLU 157 Ca 0.20 -0.02 -0.19 0.00 -1.18 0.00 0.00 59.36 58.17 3hol h GLU 157 Cb 0.22 -0.06 0.02 0.00 -0.16 0.00 0.00 28.75 28.77 3hol h GLU 157 CO -0.01 0.19 -0.28 0.41 -1.18 0.00 0.00 179.01 178.13 3hol n GLY 158 N -1.48 0.10 3.77 1.92 0.00 -1.15 -4.85 105.19 103.50 3hol n GLY 158 Ca 0.00 -0.37 -0.34 0.00 0.00 0.00 0.00 46.02 45.31 3hol n GLY 158 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hol s ARG 159 N -5.00 3.20 0.31 1.61 0.52 -1.26 0.44 118.95 118.77 3hol s ARG 159 Ca 0.12 1.52 -0.28 0.00 -0.52 0.00 0.00 55.73 56.57 3hol s ARG 159 Cb -0.05 -1.99 -0.09 0.00 0.52 0.00 0.00 34.95 33.33 3hol s ARG 159 CO 0.15 -0.95 1.07 -2.14 0.02 0.00 0.00 175.30 173.45 3hol s PRO 160 N -3.56 4.52 -0.16 3.54 0.02 -1.24 -4.64 135.00 133.48 3hol s PRO 160 Ca 0.70 1.69 -0.21 0.00 0.02 0.00 0.00 61.00 63.21 3hol s PRO 160 Cb -0.22 -3.01 -0.23 0.00 0.02 0.00 0.00 34.50 31.06 3hol s PRO 160 CO 0.31 0.14 0.43 -0.91 -0.33 0.00 0.00 177.00 176.65 3hol h ASN 161 N 3.46 0.13 -3.40 2.53 2.35 -1.91 -0.76 115.58 117.99 3hol h ASN 161 Ca -0.47 -0.73 -0.56 0.00 -0.55 0.00 0.00 56.30 54.00 3hol h ASN 161 Cb 1.21 -0.04 -0.39 0.00 0.05 0.00 0.00 38.32 39.15 3hol h ASN 161 CO 0.66 1.45 -0.77 -0.31 -1.65 0.00 0.00 177.43 176.80 3hol s TYR 162 N -2.38 1.58 -0.39 1.19 2.02 -1.26 -0.38 117.35 117.73 3hol s TYR 162 Ca -0.24 -1.25 0.09 0.00 -0.37 0.00 0.00 57.07 55.30 3hol s TYR 162 Cb 0.04 -1.28 0.29 0.00 -0.40 0.00 0.00 41.96 40.60 3hol s TYR 162 CO 0.67 -0.69 0.61 1.28 -1.57 0.00 0.00 175.55 175.85 3hol n LEU 163 N 4.90 0.32 0.30 -1.29 4.77 -1.26 -4.99 117.00 119.75 3hol n LEU 163 Ca -0.09 -4.77 0.19 0.00 -0.03 0.00 0.00 56.01 51.31 3hol n LEU 163 Cb 0.46 0.68 0.86 0.00 -2.33 0.00 0.00 43.42 43.08 3hol n LEU 163 CO 0.15 2.15 1.06 0.78 -1.33 0.00 0.00 177.39 180.19 3hol h ASN 164 N 3.64 0.00 1.08 -1.43 2.35 -1.88 -0.68 115.58 118.65 3hol h ASN 164 Ca 0.07 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 3hol h ASN 164 Cb 0.92 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.29 3hol h ASN 164 CO 0.47 0.00 -0.37 0.47 -1.65 0.00 0.00 177.43 176.35 3hol n ASP 165 N -3.10 0.71 -0.12 5.81 8.00 -1.26 -4.30 116.55 122.29 3hol n ASP 165 Ca -0.01 0.28 -0.20 0.00 0.71 0.00 0.00 54.79 55.58 3hol n ASP 165 Cb 0.23 -0.21 -0.12 0.00 -0.02 0.00 0.00 41.12 41.00 3hol n ASP 165 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3hol n ASP 166 N -2.12 1.99 -4.14 -2.24 8.00 -0.36 -4.64 116.55 113.05 3hol n ASP 166 Ca 0.04 -0.05 -0.12 0.00 0.71 0.00 0.00 54.79 55.37 3hol n ASP 166 Cb 0.43 -0.50 -0.11 0.00 -0.02 0.00 0.00 41.12 40.93 3hol n ASP 166 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3hol s TYR 167 N -2.52 0.85 -0.71 1.24 2.02 -0.62 -0.39 117.35 117.21 3hol s TYR 167 Ca -0.34 -0.74 0.05 0.00 -0.37 0.00 0.00 57.07 55.66 3hol s TYR 167 Cb 0.09 -0.49 0.29 0.00 -0.40 0.00 0.00 41.96 41.45 3hol s TYR 167 CO 0.60 -0.10 0.95 0.66 -1.57 0.00 0.00 175.55 176.09 3hol n TYR 168 N 0.54 0.75 -4.05 2.71 4.01 -0.44 -4.54 117.16 116.14 3hol n TYR 168 Ca -0.16 -0.28 -0.10 0.00 -0.16 0.00 0.00 57.90 57.20 3hol n TYR 168 Cb 0.58 -0.26 -0.07 0.00 -0.31 0.00 0.00 39.34 39.29 3hol n TYR 168 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 3hol s THR 169 N -1.60 0.02 0.37 -0.72 -1.32 -1.26 -4.99 115.64 106.13 3hol s THR 169 Ca 0.19 -1.57 0.08 0.00 -1.21 0.00 0.00 61.69 59.18 3hol s THR 169 Cb 0.15 -2.20 -0.05 0.00 -1.51 0.00 0.00 72.50 68.89 3hol s THR 169 CO 0.06 -0.08 0.14 -0.54 -2.21 0.00 0.00 174.62 171.99 3hol s LYS 170 N -4.05 2.25 -1.04 7.08 1.02 -1.26 -4.70 119.74 119.05 3hol s LYS 170 Ca 0.26 -1.72 -0.06 0.00 0.02 0.00 0.00 55.97 54.47 3hol s LYS 170 Cb 0.03 -2.05 -0.07 0.00 -0.52 0.00 0.00 37.83 35.22 3hol s LYS 170 CO 0.08 0.01 0.91 1.19 -0.92 0.00 0.00 175.35 176.62 3hol n PHE 171 N -1.16 -2.43 -2.10 3.18 3.72 0.49 -4.82 117.46 114.34 3hol n PHE 171 Ca -0.02 0.85 -0.43 0.00 -0.05 0.00 0.00 57.45 57.80 3hol n PHE 171 Cb 0.63 -4.14 -0.03 0.00 -0.94 0.00 0.00 39.48 35.01 3hol n PHE 171 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3hol s ILE 172 N -3.38 3.73 -0.85 4.37 -1.09 -0.29 -1.80 121.20 121.89 3hol s ILE 172 Ca 0.44 0.87 0.00 0.00 -2.23 0.00 0.00 60.65 59.73 3hol s ILE 172 Cb -0.06 -3.60 0.00 0.00 -1.58 0.00 0.00 42.46 37.22 3hol s ILE 172 CO 0.73 -0.12 0.00 0.61 -1.23 0.00 0.00 174.94 174.93 3hol n GLY 173 N 4.15 0.89 0.00 6.18 0.00 -1.18 -4.23 105.19 111.00 3hol n GLY 173 Ca 0.17 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.01 3hol n GLY 173 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hol n LYS 174 N -1.48 0.00 0.18 1.61 5.02 -0.74 -1.10 118.16 121.64 3hol n LYS 174 Ca -0.08 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.24 3hol n LYS 174 Cb 0.42 -0.11 0.33 0.00 -0.02 0.00 0.00 35.03 35.65 3hol n LYS 174 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 3hol h ARG 175 N 0.00 0.00 -4.74 1.97 2.43 -1.85 -1.40 114.38 110.80 3hol h ARG 175 Ca 0.00 0.00 -0.48 0.00 -0.81 0.00 0.00 59.98 58.69 3hol h ARG 175 Cb 0.00 0.00 -0.32 0.00 -0.42 0.00 0.00 29.97 29.23 3hol h ARG 175 CO 0.00 0.42 -0.80 0.08 -1.51 0.00 0.00 179.97 178.15 3hol s VAL 176 N -3.85 1.00 0.38 0.20 1.01 -1.26 -0.18 120.40 117.69 3hol s VAL 176 Ca -0.01 -0.46 -0.27 0.00 0.00 0.00 0.00 61.98 61.24 3hol s VAL 176 Cb 0.13 -0.88 -0.11 0.00 0.00 0.00 0.00 36.38 35.51 3hol s VAL 176 CO 0.71 0.31 1.24 0.61 0.00 0.00 0.00 175.10 177.96 3hol n GLY 177 N 3.37 0.44 3.71 4.51 0.00 -0.05 -3.07 105.19 114.11 3hol n GLY 177 Ca -0.19 0.25 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 3hol n GLY 177 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3hol s LEU 178 N -1.15 4.37 0.03 0.99 2.96 -1.26 -4.73 118.68 119.89 3hol s LEU 178 Ca 0.58 2.03 0.04 0.00 -0.22 0.00 0.00 54.13 56.56 3hol s LEU 178 Cb -0.55 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.52 3hol s LEU 178 CO 0.60 -0.47 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.41 3hol s VAL 179 N 1.04 3.70 0.45 1.68 1.01 -1.26 0.21 120.40 127.23 3hol s VAL 179 Ca 0.59 -0.88 0.22 0.00 0.00 0.00 0.00 61.98 61.91 3hol s VAL 179 Cb -0.30 -2.66 0.41 0.00 0.00 0.00 0.00 36.38 33.83 3hol s VAL 179 CO 0.29 0.30 1.87 0.77 0.00 0.00 0.00 175.10 178.33 3hol h SER 180 N 4.18 0.29 0.52 3.32 4.64 -1.67 0.12 113.55 124.95 3hol h SER 180 Ca -0.48 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3hol h SER 180 Cb 1.17 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3hol h SER 180 CO 0.55 0.11 0.00 0.61 -0.87 0.00 0.00 176.83 177.23 3hol n GLY 181 N -1.57 -1.03 0.09 -0.77 0.00 -1.26 -1.49 105.19 99.16 3hol n GLY 181 Ca 0.19 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.28 3hol n GLY 181 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hol n ASP 182 N -1.46 0.66 -4.79 1.61 8.00 0.40 -4.92 116.55 116.04 3hol n ASP 182 Ca 0.05 0.58 -0.37 0.00 0.71 0.00 0.00 54.79 55.76 3hol n ASP 182 Cb 0.18 -0.75 -0.06 0.00 -0.02 0.00 0.00 41.12 40.47 3hol n ASP 182 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hol s ALA 183 N -3.12 3.31 -0.03 2.24 0.00 -0.55 -1.32 121.76 122.28 3hol s ALA 183 Ca 0.10 0.38 -0.30 0.00 0.00 0.00 0.00 51.96 52.14 3hol s ALA 183 Cb 0.13 -3.03 -0.03 0.00 0.00 0.00 0.00 23.12 20.18 3hol s ALA 183 CO 0.54 0.24 1.07 0.15 0.00 0.00 0.00 175.76 177.77 3hol s LYS 184 N -1.93 4.46 0.61 0.00 1.02 0.48 -4.88 119.74 119.49 3hol s LYS 184 Ca 0.46 1.52 0.32 0.00 0.02 0.00 0.00 55.97 58.30 3hol s LYS 184 Cb -0.18 -3.48 1.87 0.00 -0.52 0.00 0.00 37.83 35.51 3hol s LYS 184 CO 0.23 -0.24 2.21 -1.35 -0.92 0.00 0.00 175.35 175.28 3hol h PRO 185 N 7.01 0.00 -0.10 -1.68 0.11 -1.90 -0.58 132.00 134.87 3hol h PRO 185 Ca -0.37 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.73 3hol h PRO 185 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 3hol h PRO 185 CO 0.82 0.00 0.01 0.00 -0.21 0.00 0.00 178.00 178.62 3hol h ALA 186 N 1.89 1.85 0.00 -0.75 0.00 -1.92 -3.22 119.26 117.11 3hol h ALA 186 Ca 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3hol h ALA 186 Cb 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3hol h ALA 186 CO -0.00 0.12 -0.55 1.63 0.00 0.00 0.00 179.25 180.45 3hol n LYS 187 N -4.47 3.70 -3.77 0.00 5.02 -0.36 -5.02 118.16 113.27 3hol n LYS 187 Ca -0.01 -0.01 -0.15 0.00 -2.02 0.00 0.00 58.31 56.11 3hol n LYS 187 Cb 0.12 -0.85 -0.16 0.00 -0.02 0.00 0.00 35.03 34.13 3hol n LYS 187 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3hol s HIS 188 N -1.74 0.01 -0.15 2.13 3.76 -0.44 -4.89 115.29 113.98 3hol s HIS 188 Ca 0.01 0.16 -0.04 0.00 -0.15 0.00 0.00 55.06 55.03 3hol s HIS 188 Cb 0.03 -0.22 0.07 0.00 1.11 0.00 0.00 32.58 33.57 3hol s HIS 188 CO 0.20 -0.09 0.18 0.21 -0.85 0.00 0.00 174.74 174.38 3hol s LYS 189 N 1.05 0.11 -0.48 1.40 2.20 -1.26 -4.09 119.74 118.67 3hol s LYS 189 Ca -0.09 0.34 -0.18 0.00 -0.36 0.00 0.00 55.97 55.67 3hol s LYS 189 Cb -0.12 -0.86 0.05 0.00 -1.51 0.00 0.00 37.83 35.38 3hol s LYS 189 CO -0.03 -0.50 0.56 0.71 -0.36 0.00 0.00 175.35 175.73 3hol s TYR 190 N 2.29 3.10 0.15 4.03 2.02 -1.26 -1.11 117.35 126.57 3hol s TYR 190 Ca 0.04 -0.50 0.11 0.00 -0.37 0.00 0.00 57.07 56.36 3hol s TYR 190 Cb -0.14 -3.33 -0.04 0.00 -0.40 0.00 0.00 41.96 38.05 3hol s TYR 190 CO -0.09 -0.92 -0.25 0.95 -1.57 0.00 0.00 175.55 173.68 3hol s THR 191 N 2.43 2.21 0.10 -0.71 -4.23 -0.66 -2.41 115.64 112.36 3hol s THR 191 Ca 0.14 -1.83 0.07 0.00 -1.18 0.00 0.00 61.69 58.88 3hol s THR 191 Cb -0.19 -1.98 -0.03 0.00 1.34 0.00 0.00 72.50 71.63 3hol s THR 191 CO 0.12 -0.02 -0.18 -0.94 -0.54 0.00 0.00 174.62 173.07 3hol s SER 192 N -2.28 2.20 -0.11 3.99 1.04 0.29 -0.97 113.70 117.87 3hol s SER 192 Ca 0.15 -0.68 -0.07 0.00 0.48 0.00 0.00 55.95 55.83 3hol s SER 192 Cb -0.09 -0.10 0.04 0.00 0.10 0.00 0.00 66.02 65.97 3hol s SER 192 CO 0.07 -0.01 0.27 -1.58 0.98 0.00 0.00 173.24 172.97 3hol s GLN 193 N -1.96 0.26 -0.00 4.02 0.74 -0.76 -1.10 119.66 120.86 3hol s GLN 193 Ca 0.04 0.50 0.03 0.00 0.05 0.00 0.00 55.36 55.98 3hol s GLN 193 Cb -0.09 -0.02 -0.01 0.00 1.10 0.00 0.00 33.01 33.99 3hol s GLN 193 CO 0.04 -0.12 -0.11 -0.06 -0.55 0.00 0.00 175.29 174.49 3hol s PHE 194 N 0.89 0.97 -0.19 1.67 0.08 0.69 -1.09 117.98 121.01 3hol s PHE 194 Ca -0.06 -0.21 -0.01 0.00 0.12 0.00 0.00 56.93 56.77 3hol s PHE 194 Cb -0.07 -0.62 0.00 0.00 -0.57 0.00 0.00 43.02 41.76 3hol s PHE 194 CO -0.06 -0.01 -0.12 -2.00 -0.10 0.00 0.00 175.22 172.93 3hol s GLU 195 N -0.40 3.21 -0.20 0.44 2.12 0.61 -0.30 118.70 124.19 3hol s GLU 195 Ca 0.03 -0.72 -0.04 0.00 0.36 0.00 0.00 54.97 54.60 3hol s GLU 195 Cb -0.05 -2.76 -0.02 0.00 0.26 0.00 0.00 34.13 31.56 3hol s GLU 195 CO -0.00 -0.15 -0.04 0.08 -0.54 0.00 0.00 175.26 174.61 3hol s VAL 196 N 1.24 3.53 -0.58 3.70 1.01 0.72 -1.85 120.40 128.17 3hol s VAL 196 Ca 0.03 -0.46 -0.16 0.00 0.00 0.00 0.00 61.98 61.39 3hol s VAL 196 Cb -0.14 -2.58 0.14 0.00 0.00 0.00 0.00 36.38 33.79 3hol s VAL 196 CO -0.06 0.44 0.55 -0.62 0.00 0.00 0.00 175.10 175.42 3hol s ASP 197 N 1.09 6.25 0.50 3.32 -1.08 -0.31 -1.35 116.67 125.10 3hol s ASP 197 Ca 0.01 -1.85 0.28 0.00 -0.52 0.00 0.00 52.55 50.47 3hol s ASP 197 Cb -0.15 -2.22 1.25 0.00 -1.46 0.00 0.00 42.92 40.35 3hol s ASP 197 CO -0.00 -0.85 1.96 -0.26 0.52 0.00 0.00 175.17 176.54 3hol h PHE 198 N 8.80 0.00 -0.45 -5.34 -1.00 -1.83 -0.92 116.94 116.19 3hol h PHE 198 Ca -0.25 0.00 -0.09 0.00 2.81 0.00 0.00 57.97 60.44 3hol h PHE 198 Cb 1.09 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.63 3hol h PHE 198 CO 0.77 0.14 -0.07 0.00 -1.61 0.00 0.00 178.31 177.54 3hol h ALA 199 N 1.86 1.03 -0.02 2.45 0.00 -1.80 -3.10 119.26 119.69 3hol h ALA 199 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3hol h ALA 199 Cb 0.54 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3hol h ALA 199 CO 0.02 0.59 -0.40 0.25 0.00 0.00 0.00 179.25 179.71 3hol n THR 200 N -4.18 0.00 -3.73 0.00 -2.24 -1.05 -4.99 114.28 98.09 3hol n THR 200 Ca 0.02 -0.30 -0.26 0.00 -2.27 0.00 0.00 64.05 61.24 3hol n THR 200 Cb 0.34 1.28 0.05 0.00 -2.10 0.00 0.00 70.33 69.90 3hol n THR 200 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3hol n LYS 201 N 0.13 -6.37 -4.79 -0.78 5.02 -0.38 -4.95 118.16 106.04 3hol n LYS 201 Ca 0.09 0.70 -0.30 0.00 -2.02 0.00 0.00 58.31 56.78 3hol n LYS 201 Cb 0.47 -5.61 -0.14 0.00 -0.02 0.00 0.00 35.03 29.72 3hol n LYS 201 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3hol s LYS 202 N -6.31 1.81 -0.02 1.97 -0.14 -1.03 -1.81 119.74 114.21 3hol s LYS 202 Ca 0.48 -1.11 0.03 0.00 -1.36 0.00 0.00 55.97 54.00 3hol s LYS 202 Cb -0.23 -2.01 -0.00 0.00 -1.68 0.00 0.00 37.83 33.91 3hol s LYS 202 CO 0.78 0.51 -0.10 1.41 -0.76 0.00 0.00 175.35 177.20 3hol s MET 203 N -1.38 0.98 0.28 1.68 -2.45 -0.12 -1.16 119.30 117.14 3hol s MET 203 Ca 0.13 -0.34 0.06 0.00 -1.25 0.00 0.00 55.69 54.28 3hol s MET 203 Cb -0.10 -0.92 -0.06 0.00 1.25 0.00 0.00 34.83 35.00 3hol s MET 203 CO 0.03 0.15 -0.03 0.95 1.05 0.00 0.00 175.02 177.18 3hol s THR 204 N 0.05 1.51 0.00 10.11 -4.23 -0.77 -1.55 115.64 120.76 3hol s THR 204 Ca -0.01 -2.09 0.00 0.00 -1.18 0.00 0.00 61.69 58.41 3hol s THR 204 Cb -0.07 -2.51 0.00 0.00 1.34 0.00 0.00 72.50 71.26 3hol s THR 204 CO 0.00 -0.25 0.00 0.61 -0.54 0.00 0.00 174.62 174.45 3hol n GLY 205 N -0.59 -0.92 2.86 3.99 0.00 -0.99 -0.28 105.19 109.25 3hol n GLY 205 Ca -0.05 -1.08 -0.13 0.00 0.00 0.00 0.00 46.02 44.76 3hol n GLY 205 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hol s LYS 206 N -2.00 0.02 -0.21 1.61 1.02 -0.25 -0.94 119.74 118.99 3hol s LYS 206 Ca 0.00 0.02 -0.08 0.00 0.02 0.00 0.00 55.97 55.93 3hol s LYS 206 Cb 0.00 -0.06 -0.04 0.00 -0.52 0.00 0.00 37.83 37.22 3hol s LYS 206 CO 0.00 -0.02 0.07 -0.51 -0.92 0.00 0.00 175.35 173.97 3hol s LEU 207 N 0.15 3.68 0.24 3.17 1.43 -0.43 -1.82 118.68 125.10 3hol s LEU 207 Ca -0.01 -0.03 0.10 0.00 -1.03 0.00 0.00 54.13 53.16 3hol s LEU 207 Cb -0.02 -1.96 -0.05 0.00 0.03 0.00 0.00 46.19 44.20 3hol s LEU 207 CO -0.00 0.08 -0.18 -0.44 0.23 0.00 0.00 176.35 176.04 3hol s SER 208 N 0.91 3.14 -0.28 2.29 0.01 -0.14 -0.25 113.70 119.37 3hol s SER 208 Ca 0.04 -1.01 0.01 0.00 1.31 0.00 0.00 55.95 56.30 3hol s SER 208 Cb -0.14 -0.23 0.08 0.00 0.21 0.00 0.00 66.02 65.95 3hol s SER 208 CO 0.03 -0.04 0.02 -0.62 0.41 0.00 0.00 173.24 173.03 3hol s ASP 209 N -3.37 4.11 1.33 2.44 -1.08 0.55 -1.66 116.67 119.00 3hol s ASP 209 Ca 0.26 -1.56 0.00 0.00 -0.52 0.00 0.00 52.55 50.73 3hol s ASP 209 Cb -0.03 -1.18 0.00 0.00 -1.46 0.00 0.00 42.92 40.24 3hol s ASP 209 CO 0.11 -0.33 0.00 0.29 0.52 0.00 0.00 175.17 175.76 3hol n LYS 210 N 4.63 0.00 -1.30 4.34 5.02 -0.27 -1.70 118.16 128.88 3hol n LYS 210 Ca -0.05 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.95 3hol n LYS 210 Cb 0.43 0.00 0.12 0.00 -0.02 0.00 0.00 35.03 35.56 3hol n LYS 210 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3hol n GLU 211 N 14.00 2.54 -4.61 1.97 1.02 -1.26 -4.87 120.64 129.43 3hol n GLU 211 Ca 0.00 -3.23 -0.26 0.00 -0.02 0.00 0.00 57.16 53.66 3hol n GLU 211 Cb 0.00 -2.23 -0.17 0.00 -0.02 0.00 0.00 31.44 29.02 3hol n GLU 211 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 3hol s LYS 212 N -3.61 1.89 0.03 3.49 2.20 -0.69 -5.12 119.74 117.92 3hol s LYS 212 Ca 0.61 -0.47 -0.30 0.00 -0.36 0.00 0.00 55.97 55.45 3hol s LYS 212 Cb 0.49 -1.56 -0.04 0.00 -1.51 0.00 0.00 37.83 35.21 3hol s LYS 212 CO 0.03 0.02 1.06 0.99 -0.36 0.00 0.00 175.35 177.10 3hol s THR 213 N 0.71 4.54 -0.16 3.43 2.01 -1.26 -0.33 115.64 124.57 3hol s THR 213 Ca -0.13 1.83 -0.03 0.00 0.31 0.00 0.00 61.69 63.67 3hol s THR 213 Cb -0.16 -4.18 -0.09 0.00 0.01 0.00 0.00 72.50 68.09 3hol s THR 213 CO 0.03 0.15 -0.17 -0.38 -0.69 0.00 0.00 174.62 173.56 3hol n ILE 214 N 3.86 0.91 -4.11 1.82 2.08 0.65 -4.71 119.36 119.86 3hol n ILE 214 Ca 0.07 -0.30 -0.13 0.00 0.56 0.00 0.00 62.75 62.95 3hol n ILE 214 Cb 0.49 -1.33 -0.11 0.00 -0.75 0.00 0.00 39.64 37.94 3hol n ILE 214 CO 0.00 0.00 0.00 -0.31 0.56 0.00 0.00 176.55 176.80 3hol s TYR 215 N -2.31 0.80 0.19 1.39 2.02 -0.90 -0.69 117.35 117.86 3hol s TYR 215 Ca -0.22 -0.61 0.07 0.00 -0.37 0.00 0.00 57.07 55.94 3hol s TYR 215 Cb 0.07 -0.47 -0.04 0.00 -0.40 0.00 0.00 41.96 41.12 3hol s TYR 215 CO 0.33 -0.08 0.05 0.95 -1.57 0.00 0.00 175.55 175.24 3hol s THR 216 N -1.99 3.95 0.10 -0.71 -4.23 -0.44 -1.32 115.64 110.99 3hol s THR 216 Ca -0.03 -1.40 0.06 0.00 -1.18 0.00 0.00 61.69 59.13 3hol s THR 216 Cb -0.06 -3.03 -0.03 0.00 1.34 0.00 0.00 72.50 70.72 3hol s THR 216 CO -0.01 -0.17 -0.14 0.68 -0.54 0.00 0.00 174.62 174.44 3hol s VAL 217 N -1.86 1.24 -0.09 2.29 -7.23 -0.12 -0.02 120.40 114.61 3hol s VAL 217 Ca 0.29 -1.55 -0.05 0.00 -1.81 0.00 0.00 61.98 58.87 3hol s VAL 217 Cb -0.09 -1.34 0.04 0.00 0.56 0.00 0.00 36.38 35.55 3hol s VAL 217 CO 0.21 -0.34 0.21 0.20 -0.31 0.00 0.00 175.10 175.07 3hol s ASN 218 N -2.16 -0.21 0.11 4.85 0.01 -0.80 -2.35 114.94 114.39 3hol s ASN 218 Ca 0.04 0.44 -0.13 0.00 -0.71 0.00 0.00 52.86 52.50 3hol s ASN 218 Cb -0.07 0.35 0.02 0.00 0.41 0.00 0.00 41.25 41.96 3hol s ASN 218 CO 0.03 -0.14 0.32 0.00 -1.51 0.00 0.00 177.10 175.79 3hol s ALA 219 N 1.03 -0.65 0.03 0.60 0.00 -0.59 -0.88 121.76 121.29 3hol s ALA 219 Ca -0.08 -0.28 0.05 0.00 0.00 0.00 0.00 51.96 51.65 3hol s ALA 219 Cb -0.09 0.62 -0.03 0.00 0.00 0.00 0.00 23.12 23.62 3hol s ALA 219 CO -0.06 -0.60 -0.10 -0.51 0.00 0.00 0.00 175.76 174.49 3hol s ASP 220 N -2.83 4.38 -0.13 0.00 1.01 -0.19 -0.94 116.67 117.97 3hol s ASP 220 Ca 0.04 -0.25 -0.16 0.00 0.71 0.00 0.00 52.55 52.89 3hol s ASP 220 Cb 0.03 -0.92 -0.04 0.00 1.01 0.00 0.00 42.92 42.99 3hol s ASP 220 CO -0.11 0.26 0.39 -0.63 0.21 0.00 0.00 175.17 175.29 3hol s ILE 221 N -1.00 5.23 -0.04 0.77 1.01 -0.75 -1.38 121.20 125.04 3hol s ILE 221 Ca 0.17 0.77 0.01 0.00 0.00 0.00 0.00 60.65 61.60 3hol s ILE 221 Cb -0.11 -3.73 0.02 0.00 0.01 0.00 0.00 42.46 38.65 3hol s ILE 221 CO 0.08 0.37 -0.04 -0.13 0.00 0.00 0.00 174.94 175.22 3hol s ARG 222 N 0.45 0.67 6.01 2.79 1.81 0.04 -4.95 118.95 125.75 3hol s ARG 222 Ca 0.22 -0.08 0.00 0.00 -1.72 0.00 0.00 55.73 54.15 3hol s ARG 222 Cb -0.14 -0.71 0.00 0.00 -0.45 0.00 0.00 34.95 33.65 3hol s ARG 222 CO 0.08 -0.07 0.00 0.41 -0.68 0.00 0.00 175.30 175.04 3hol n GLY 223 N 3.92 3.26 1.65 -3.53 0.00 -1.26 -1.02 105.19 108.21 3hol n GLY 223 Ca -0.25 -0.12 0.04 0.00 0.00 0.00 0.00 46.02 45.70 3hol n GLY 223 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3hol n ASN 224 N 3.49 5.00 -4.59 1.61 0.23 -1.09 -4.98 115.26 114.93 3hol n ASN 224 Ca 0.00 -3.05 -0.24 0.00 -0.53 0.00 0.00 54.58 50.76 3hol n ASN 224 Cb 0.00 -0.66 -0.09 0.00 -2.08 0.00 0.00 39.78 36.95 3hol n ASN 224 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 3hol s ARG 225 N -2.86 2.02 0.04 -3.83 1.81 -0.19 -0.68 118.95 115.27 3hol s ARG 225 Ca 0.51 -1.66 0.06 0.00 -1.72 0.00 0.00 55.73 52.93 3hol s ARG 225 Cb 0.40 -1.95 -0.02 0.00 -0.45 0.00 0.00 34.95 32.93 3hol s ARG 225 CO 0.13 0.26 -0.16 -0.59 -0.68 0.00 0.00 175.30 174.27 3hol s PHE 226 N -2.46 1.40 0.01 -0.53 -0.12 -0.37 -0.78 117.98 115.13 3hol s PHE 226 Ca 0.32 -0.36 0.03 0.00 -0.05 0.00 0.00 56.93 56.87 3hol s PHE 226 Cb -0.03 -0.83 -0.01 0.00 -0.63 0.00 0.00 43.02 41.52 3hol s PHE 226 CO 0.18 0.06 -0.09 0.95 -0.05 0.00 0.00 175.22 176.27 3hol s THR 227 N -0.85 0.71 0.00 -4.49 -4.23 -0.48 -1.39 115.64 104.91 3hol s THR 227 Ca 0.03 -0.64 0.00 0.00 -1.18 0.00 0.00 61.69 59.91 3hol s THR 227 Cb -0.08 -0.64 0.00 0.00 1.34 0.00 0.00 72.50 73.12 3hol s THR 227 CO 0.01 0.02 0.00 0.61 -0.54 0.00 0.00 174.62 174.72 3hol n GLY 228 N 2.37 -1.03 3.00 3.99 0.00 -0.21 -1.02 105.19 112.29 3hol n GLY 228 Ca -0.16 0.05 -0.09 0.00 0.00 0.00 0.00 46.02 45.82 3hol n GLY 228 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hol s ALA 229 N -1.00 0.07 -0.13 4.61 0.00 -0.06 -2.28 121.76 122.98 3hol s ALA 229 Ca 0.00 -0.54 -0.01 0.00 0.00 0.00 0.00 51.96 51.41 3hol s ALA 229 Cb 0.00 0.15 -0.02 0.00 0.00 0.00 0.00 23.12 23.25 3hol s ALA 229 CO 0.00 -0.17 -0.10 0.00 0.00 0.00 0.00 175.76 175.49 3hol s ALA 230 N -1.50 2.78 -0.27 0.00 0.00 0.13 -1.90 121.76 121.00 3hol s ALA 230 Ca -0.15 -0.87 -0.08 0.00 0.00 0.00 0.00 51.96 50.85 3hol s ALA 230 Cb -0.09 -1.31 -0.02 0.00 0.00 0.00 0.00 23.12 21.70 3hol s ALA 230 CO -0.01 0.30 0.10 0.99 0.00 0.00 0.00 175.76 177.13 3hol s THR 231 N 0.15 4.42 0.18 0.00 2.01 0.97 -1.23 115.64 122.14 3hol s THR 231 Ca -0.05 -0.24 -0.32 0.00 0.31 0.00 0.00 61.69 61.40 3hol s THR 231 Cb -0.14 -3.13 -0.11 0.00 0.01 0.00 0.00 72.50 69.13 3hol s THR 231 CO 0.04 0.26 1.64 0.00 -0.69 0.00 0.00 174.62 175.86 3hol s ALA 232 N 1.62 3.84 -0.05 7.40 0.00 -1.26 -1.33 121.76 131.97 3hol s ALA 232 Ca 0.06 1.45 0.14 0.00 0.00 0.00 0.00 51.96 53.61 3hol s ALA 232 Cb -0.16 -3.66 0.12 0.00 0.00 0.00 0.00 23.12 19.43 3hol s ALA 232 CO 0.05 -0.86 1.47 0.77 0.00 0.00 0.00 175.76 177.18 3hol h SER 233 N 6.92 0.00 -3.71 0.00 0.02 -1.14 -3.40 113.55 112.23 3hol h SER 233 Ca -0.43 0.00 -0.65 0.00 -0.84 0.00 0.00 61.79 59.87 3hol h SER 233 Cb 1.20 0.00 -0.38 0.00 0.14 0.00 0.00 62.40 63.36 3hol h SER 233 CO 0.93 0.57 -0.77 -0.62 -1.14 0.00 0.00 176.83 175.80 3hol s ASP 234 N -6.50 4.37 0.00 3.07 -1.08 -1.26 -4.99 116.67 110.28 3hol s ASP 234 Ca 0.03 -1.58 0.29 0.00 -0.52 0.00 0.00 52.55 50.77 3hol s ASP 234 Cb 0.09 -1.44 1.34 0.00 -1.46 0.00 0.00 42.92 41.44 3hol s ASP 234 CO 0.75 -0.27 1.96 0.29 0.52 0.00 0.00 175.17 178.42 3hol n LYS 235 N 4.46 0.23 -3.12 4.34 4.76 -1.26 -4.25 118.16 123.32 3hol n LYS 235 Ca -0.07 -0.01 -0.41 0.00 -2.87 0.00 0.00 58.31 54.95 3hol n LYS 235 Cb 0.42 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 32.05 3hol n LYS 235 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 3hol s ASN 236 N -2.78 6.56 0.20 4.39 0.01 -1.26 -4.89 114.94 117.16 3hol s ASN 236 Ca 0.21 0.67 -0.08 0.00 -0.71 0.00 0.00 52.86 52.95 3hol s ASN 236 Cb 0.20 -2.33 0.12 0.00 0.41 0.00 0.00 41.25 39.64 3hol s ASN 236 CO 0.50 -0.37 1.71 0.50 -1.51 0.00 0.00 177.10 177.94 3hol h LYS 237 N 7.93 1.15 0.00 -0.60 3.64 -1.87 -3.41 116.57 123.41 3hol h LYS 237 Ca -0.27 -0.28 0.00 0.00 -1.27 0.00 0.00 60.65 58.83 3hol h LYS 237 Cb 1.12 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.80 3hol h LYS 237 CO 0.77 1.01 0.00 0.41 -2.27 0.00 0.00 179.45 179.37 3hol n GLY 238 N -0.66 0.09 3.46 5.01 0.00 -1.26 0.81 105.19 112.64 3hol n GLY 238 Ca 0.05 -1.00 -0.14 0.00 0.00 0.00 0.00 46.02 44.93 3hol n GLY 238 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hol s LYS 239 N 0.00 1.19 7.15 1.61 2.20 -1.26 -4.74 119.74 125.89 3hol s LYS 239 Ca 0.00 -0.19 0.00 0.00 -0.36 0.00 0.00 55.97 55.42 3hol s LYS 239 Cb 0.00 0.55 0.00 0.00 -1.51 0.00 0.00 37.83 36.87 3hol s LYS 239 CO 0.00 -0.47 0.00 0.41 -0.36 0.00 0.00 175.35 174.93 3hol n GLY 240 N 0.13 3.05 0.27 5.54 0.00 0.17 -2.75 105.19 111.61 3hol n GLY 240 Ca -0.18 -0.25 0.14 0.00 0.00 0.00 0.00 46.02 45.73 3hol n GLY 240 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3hol h GLU 241 N 0.00 0.00 -0.67 1.61 5.08 -1.91 -1.99 114.58 116.70 3hol h GLU 241 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3hol h GLU 241 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3hol h GLU 241 CO 0.00 0.09 0.00 -1.13 -1.00 0.00 0.00 179.01 176.97 3hol n SER 242 N -3.64 3.63 -4.67 1.42 3.41 -1.11 -4.99 113.62 107.68 3hol n SER 242 Ca -0.02 -2.02 -0.45 0.00 -0.26 0.00 0.00 58.87 56.13 3hol n SER 242 Cb 0.20 -0.45 -0.02 0.00 -0.26 0.00 0.00 64.21 63.68 3hol n SER 242 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hol n TYR 243 N 1.45 2.09 -3.78 7.33 9.36 -0.75 -4.34 117.16 128.52 3hol n TYR 243 Ca 0.23 0.48 -0.37 0.00 3.32 0.00 0.00 57.90 61.55 3hol n TYR 243 Cb 0.58 -2.43 -0.13 0.00 -0.63 0.00 0.00 39.34 36.73 3hol n TYR 243 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 3hol s ASN 244 N 0.12 5.23 0.00 2.98 2.47 0.24 -4.94 114.94 121.04 3hol s ASN 244 Ca 0.66 -1.14 0.16 0.00 0.42 0.00 0.00 52.86 52.96 3hol s ASN 244 Cb -0.65 -1.84 0.70 0.00 -1.45 0.00 0.00 41.25 38.01 3hol s ASN 244 CO 0.53 -0.31 1.52 0.49 -3.72 0.00 0.00 177.10 175.61 3hol n PHE 245 N 4.78 0.00 -2.36 0.43 3.72 -1.26 -4.11 117.46 118.66 3hol n PHE 245 Ca -0.13 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.02 3hol n PHE 245 Cb 0.45 -0.49 0.01 0.00 -0.94 0.00 0.00 39.48 38.50 3hol n PHE 245 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 3hol n PHE 246 N -1.49 3.13 0.29 1.38 3.72 -1.26 -4.77 117.46 118.46 3hol n PHE 246 Ca 0.04 -2.84 0.11 0.00 -0.05 0.00 0.00 57.45 54.71 3hol n PHE 246 Cb 0.19 -0.16 -0.07 0.00 -0.94 0.00 0.00 39.48 38.50 3hol n PHE 246 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3hol n SER 247 N -0.53 0.46 -4.82 4.37 3.41 -1.26 -4.55 113.62 110.69 3hol n SER 247 Ca 0.39 -0.09 -0.38 0.00 -0.26 0.00 0.00 58.87 58.53 3hol n SER 247 Cb 0.75 1.21 -0.06 0.00 -0.26 0.00 0.00 64.21 65.85 3hol n SER 247 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hol s ALA 248 N -3.34 3.69 0.82 7.33 0.00 -1.26 -4.58 121.76 124.42 3hol s ALA 248 Ca -0.01 -0.28 -0.12 0.00 0.00 0.00 0.00 51.96 51.55 3hol s ALA 248 Cb 0.13 -2.36 0.08 0.00 0.00 0.00 0.00 23.12 20.98 3hol s ALA 248 CO 0.85 0.43 1.12 -0.51 0.00 0.00 0.00 175.76 177.64 3hol s ASP 249 N -0.81 4.33 -0.04 0.00 1.01 -1.26 -4.39 116.67 115.51 3hol s ASP 249 Ca 0.22 1.12 0.02 0.00 0.71 0.00 0.00 52.55 54.63 3hol s ASP 249 Cb -0.16 -1.79 0.01 0.00 1.01 0.00 0.00 42.92 41.99 3hol s ASP 249 CO 0.11 -2.05 -0.09 -0.55 0.21 0.00 0.00 175.17 172.80 3hol s SER 250 N -4.08 1.32 -0.15 0.27 0.15 -0.37 -0.74 113.70 110.10 3hol s SER 250 Ca 0.61 -0.21 0.16 0.00 0.70 0.00 0.00 55.95 57.22 3hol s SER 250 Cb -0.14 -0.46 0.70 0.00 -1.71 0.00 0.00 66.02 64.42 3hol s SER 250 CO 0.53 0.04 1.62 0.00 1.20 0.00 0.00 173.24 176.63 3hol n GLN 251 N 3.51 3.91 -2.27 5.44 1.13 -1.26 -0.69 117.38 127.15 3hol n GLN 251 Ca -0.20 -2.92 -0.20 0.00 -1.94 0.00 0.00 57.00 51.74 3hol n GLN 251 Cb 0.53 -1.96 0.02 0.00 0.11 0.00 0.00 30.24 28.95 3hol n GLN 251 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 3hol n SER 252 N 0.73 4.22 -4.70 1.08 3.41 -1.24 -4.76 113.62 112.36 3hol n SER 252 Ca 0.25 -3.44 -0.42 0.00 -0.26 0.00 0.00 58.87 54.99 3hol n SER 252 Cb 0.95 -0.40 -0.03 0.00 -0.26 0.00 0.00 64.21 64.48 3hol n SER 252 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3hol s LEU 253 N -3.59 4.29 -0.15 1.04 0.20 -0.96 -3.78 118.68 115.72 3hol s LEU 253 Ca 0.46 1.55 -0.11 0.00 0.69 0.00 0.00 54.13 56.71 3hol s LEU 253 Cb 0.40 -3.53 0.05 0.00 -0.43 0.00 0.00 46.19 42.68 3hol s LEU 253 CO -0.02 -0.36 0.39 -0.70 -0.29 0.00 0.00 176.35 175.37 3hol s GLU 254 N 1.58 0.42 0.00 1.98 -6.30 -0.43 -1.05 118.70 114.90 3hol s GLU 254 Ca 0.49 0.64 0.00 0.00 -2.50 0.00 0.00 54.97 53.60 3hol s GLU 254 Cb -0.19 0.11 0.00 0.00 0.00 0.00 0.00 34.13 34.05 3hol s GLU 254 CO 0.22 -0.10 0.00 0.41 0.02 0.00 0.00 175.26 175.81 3hol n GLY 255 N 3.48 2.33 3.17 -1.50 0.00 -0.48 -1.39 105.19 110.79 3hol n GLY 255 Ca -0.18 -1.00 -0.08 0.00 0.00 0.00 0.00 46.02 44.76 3hol n GLY 255 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hol s GLY 256 N -0.79 0.33 -0.06 -0.02 0.00 -0.10 -1.24 107.32 105.43 3hol s GLY 256 Ca 0.00 -0.92 -0.16 0.00 0.00 0.00 0.00 44.72 43.64 3hol s GLY 256 CO 0.00 -1.04 0.42 -1.36 0.00 0.00 0.00 173.10 171.12 3hol s PHE 257 N -3.90 3.63 0.20 1.90 0.08 0.14 -1.75 117.98 118.28 3hol s PHE 257 Ca 0.08 0.92 0.05 0.00 0.12 0.00 0.00 56.93 58.09 3hol s PHE 257 Cb 0.06 -2.38 -0.05 0.00 -0.57 0.00 0.00 43.02 40.08 3hol s PHE 257 CO -0.09 0.44 -0.06 0.71 -0.10 0.00 0.00 175.22 176.12 3hol s TYR 258 N -0.35 1.50 0.00 0.36 2.02 -0.16 -1.43 117.35 119.29 3hol s TYR 258 Ca 0.24 -0.81 0.00 0.00 -0.37 0.00 0.00 57.07 56.13 3hol s TYR 258 Cb -0.16 -0.82 0.00 0.00 -0.40 0.00 0.00 41.96 40.58 3hol s TYR 258 CO 0.11 0.07 0.00 0.41 -1.57 0.00 0.00 175.55 174.58 3hol n GLY 259 N -0.35 -0.57 0.33 0.71 0.00 0.19 -2.05 105.19 103.46 3hol n GLY 259 Ca -0.07 -1.41 0.16 0.00 0.00 0.00 0.00 46.02 44.70 3hol n GLY 259 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hol h PRO 260 N 0.00 0.00 -0.14 1.61 0.11 -1.89 -1.65 132.00 130.04 3hol h PRO 260 Ca 0.00 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.03 3hol h PRO 260 Cb 0.00 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.06 3hol h PRO 260 CO 0.00 0.00 -0.35 1.63 -0.21 0.00 0.00 178.00 179.07 3hol n LYS 261 N -4.24 1.70 -3.19 1.05 5.02 -1.26 -1.94 118.16 115.30 3hol n LYS 261 Ca 0.03 -3.28 -0.23 0.00 -2.02 0.00 0.00 58.31 52.81 3hol n LYS 261 Cb 0.37 -1.70 0.05 0.00 -0.02 0.00 0.00 35.03 33.72 3hol n LYS 261 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hol n ALA 262 N -1.12 -1.07 -0.03 7.82 0.00 -0.62 -4.48 120.51 121.00 3hol n ALA 262 Ca 0.25 0.32 0.17 0.00 0.00 0.00 0.00 53.44 54.18 3hol n ALA 262 Cb 0.82 -4.34 0.62 0.00 0.00 0.00 0.00 19.45 16.55 3hol n ALA 262 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3hol h GLU 263 N -1.75 0.15 -4.44 0.00 3.07 -1.73 -3.45 114.58 106.42 3hol h GLU 263 Ca -0.54 -0.01 -0.20 0.00 -0.50 0.00 0.00 59.36 58.11 3hol h GLU 263 Cb 1.37 -0.03 -0.15 0.00 -0.84 0.00 0.00 28.75 29.10 3hol h GLU 263 CO 0.57 0.10 -0.62 -1.21 -1.40 0.00 0.00 179.01 176.45 3hol s GLU 264 N -5.16 1.03 0.03 2.33 2.02 -0.87 -2.47 118.70 115.61 3hol s GLU 264 Ca -0.06 -1.49 -0.10 0.00 0.02 0.00 0.00 54.97 53.35 3hol s GLU 264 Cb 0.20 0.26 0.01 0.00 0.10 0.00 0.00 34.13 34.69 3hol s GLU 264 CO 0.74 -0.31 0.20 0.00 0.02 0.00 0.00 175.26 175.90 3hol s MET 265 N -4.08 0.66 0.05 1.61 0.23 -0.42 -0.99 119.30 116.36 3hol s MET 265 Ca 0.29 -0.55 -0.19 0.00 -1.03 0.00 0.00 55.69 54.21 3hol s MET 265 Cb 0.07 0.28 0.04 0.00 -1.53 0.00 0.00 34.83 33.69 3hol s MET 265 CO 0.05 -0.19 0.45 0.00 -2.03 0.00 0.00 175.02 173.30 3hol s ALA 266 N -2.25 -1.10 0.00 3.16 0.00 -0.72 -1.53 121.76 119.32 3hol s ALA 266 Ca -0.07 0.36 0.00 0.00 0.00 0.00 0.00 51.96 52.25 3hol s ALA 266 Cb -0.03 0.39 0.00 0.00 0.00 0.00 0.00 23.12 23.49 3hol s ALA 266 CO -0.02 -0.49 0.00 0.41 0.00 0.00 0.00 175.76 175.66 3hol n GLY 267 N 0.40 0.49 3.44 0.00 0.00 -0.63 -0.93 105.19 107.96 3hol n GLY 267 Ca -0.18 -0.75 -0.10 0.00 0.00 0.00 0.00 46.02 44.99 3hol n GLY 267 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hol s LYS 268 N -1.25 1.27 0.12 1.61 -2.85 -0.49 -1.24 119.74 116.91 3hol s LYS 268 Ca 0.00 -0.88 -0.07 0.00 -1.00 0.00 0.00 55.97 54.01 3hol s LYS 268 Cb 0.00 0.48 -0.01 0.00 -2.06 0.00 0.00 37.83 36.24 3hol s LYS 268 CO 0.00 -0.52 0.19 -0.59 0.10 0.00 0.00 175.35 174.53 3hol s PHE 269 N -3.87 0.34 -0.08 1.78 -0.12 -0.45 -1.32 117.98 114.26 3hol s PHE 269 Ca 0.09 -0.76 0.04 0.00 -0.05 0.00 0.00 56.93 56.26 3hol s PHE 269 Cb 0.00 -0.13 0.00 0.00 -0.63 0.00 0.00 43.02 42.27 3hol s PHE 269 CO -0.04 -0.59 -0.21 0.08 -0.05 0.00 0.00 175.22 174.40 3hol s VAL 270 N -3.92 1.82 0.44 -2.49 1.01 -1.25 -1.18 120.40 114.82 3hol s VAL 270 Ca 0.11 -0.89 -0.24 0.00 0.00 0.00 0.00 61.98 60.96 3hol s VAL 270 Cb 0.05 -1.58 -0.10 0.00 0.00 0.00 0.00 36.38 34.76 3hol s VAL 270 CO -0.06 0.51 1.14 0.00 0.00 0.00 0.00 175.10 176.69 3hol n ALA 271 N 3.47 0.75 0.27 5.51 0.00 -0.06 -4.41 120.51 126.03 3hol n ALA 271 Ca -0.19 0.23 0.11 0.00 0.00 0.00 0.00 53.44 53.59 3hol n ALA 271 Cb 0.53 -2.18 0.76 0.00 0.00 0.00 0.00 19.45 18.55 3hol n ALA 271 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 3hol h ASN 272 N 1.73 0.00 -0.50 0.00 2.35 -1.25 0.86 115.58 118.77 3hol h ASN 272 Ca -0.46 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 3hol h ASN 272 Cb 1.32 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.69 3hol h ASN 272 CO 0.58 0.05 0.00 -0.90 -1.65 0.00 0.00 177.43 175.50 3hol n ASP 273 N -4.06 4.17 -2.01 5.81 5.75 -1.26 -4.94 116.55 120.01 3hol n ASP 273 Ca -0.03 -2.48 -0.20 0.00 -0.01 0.00 0.00 54.79 52.07 3hol n ASP 273 Cb 0.13 -0.56 -0.05 0.00 -1.03 0.00 0.00 41.12 39.62 3hol n ASP 273 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3hol n LYS 274 N 0.74 -1.59 0.00 0.11 5.02 0.29 -4.88 118.16 117.86 3hol n LYS 274 Ca 0.21 1.08 0.12 0.00 -2.02 0.00 0.00 58.31 57.71 3hol n LYS 274 Cb 0.82 -5.61 0.26 0.00 -0.02 0.00 0.00 35.03 30.49 3hol n LYS 274 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3hol n SER 275 N -1.66 1.48 -3.66 4.39 3.41 -1.26 -1.73 113.62 114.60 3hol n SER 275 Ca -0.22 -1.20 -0.14 0.00 -0.26 0.00 0.00 58.87 57.05 3hol n SER 275 Cb 0.67 0.22 -0.08 0.00 -0.26 0.00 0.00 64.21 64.76 3hol n SER 275 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3hol s LEU 276 N -2.42 -0.39 -0.15 1.04 2.96 -1.26 -1.53 118.68 116.93 3hol s LEU 276 Ca 0.24 1.25 0.00 0.00 -0.22 0.00 0.00 54.13 55.40 3hol s LEU 276 Cb 0.19 2.15 0.03 0.00 0.50 0.00 0.00 46.19 49.06 3hol s LEU 276 CO 0.51 -0.23 -0.11 0.12 -1.32 0.00 0.00 176.35 175.32 3hol s PHE 277 N 0.30 2.00 0.06 5.38 5.36 -0.58 -0.89 117.98 129.60 3hol s PHE 277 Ca -0.00 -1.14 0.07 0.00 -0.96 0.00 0.00 56.93 54.90 3hol s PHE 277 Cb -0.04 -1.49 -0.03 0.00 -0.34 0.00 0.00 43.02 41.11 3hol s PHE 277 CO 0.01 -0.64 -0.17 0.00 -1.46 0.00 0.00 175.22 172.96 3hol s ALA 278 N 1.54 2.63 0.15 11.12 0.00 -0.33 -1.25 121.76 135.63 3hol s ALA 278 Ca 0.04 -1.22 0.05 0.00 0.00 0.00 0.00 51.96 50.83 3hol s ALA 278 Cb -0.13 -0.74 -0.04 0.00 0.00 0.00 0.00 23.12 22.20 3hol s ALA 278 CO -0.10 0.58 -0.10 0.14 0.00 0.00 0.00 175.76 176.28 3hol s VAL 279 N -0.98 1.20 0.06 0.00 -7.23 0.22 -1.34 120.40 112.34 3hol s VAL 279 Ca 0.15 -2.07 -0.23 0.00 -1.81 0.00 0.00 61.98 58.03 3hol s VAL 279 Cb -0.11 -1.87 0.05 0.00 0.56 0.00 0.00 36.38 35.02 3hol s VAL 279 CO 0.06 -0.73 0.53 0.72 -0.31 0.00 0.00 175.10 175.38 3hol s PHE 280 N -3.31 -0.44 0.00 2.82 -0.12 -0.37 -1.41 117.98 115.15 3hol s PHE 280 Ca 0.17 0.46 -0.15 0.00 -0.05 0.00 0.00 56.93 57.37 3hol s PHE 280 Cb 0.02 0.37 0.02 0.00 -0.63 0.00 0.00 43.02 42.80 3hol s PHE 280 CO 0.01 -0.67 0.32 -1.54 -0.05 0.00 0.00 175.22 173.29 3hol s SER 281 N -2.06 -0.18 0.11 1.98 1.04 -1.09 -1.60 113.70 111.90 3hol s SER 281 Ca -0.04 0.01 -0.25 0.00 0.48 0.00 0.00 55.95 56.15 3hol s SER 281 Cb -0.01 0.33 0.07 0.00 0.10 0.00 0.00 66.02 66.52 3hol s SER 281 CO -0.03 -0.51 0.82 0.00 0.98 0.00 0.00 173.24 174.50 3hol s ALA 282 N -1.73 -1.64 0.00 5.32 0.00 -0.58 -1.81 121.76 121.31 3hol s ALA 282 Ca -0.11 0.47 0.00 0.00 0.00 0.00 0.00 51.96 52.33 3hol s ALA 282 Cb -0.04 0.64 -0.00 0.00 0.00 0.00 0.00 23.12 23.72 3hol s ALA 282 CO 0.02 -0.85 -0.02 0.21 0.00 0.00 0.00 175.76 175.12 3hol s LYS 283 N -3.42 0.15 0.50 0.00 2.20 -0.75 -1.30 119.74 117.12 3hol s LYS 283 Ca 0.07 -0.14 -0.06 0.00 -0.36 0.00 0.00 55.97 55.48 3hol s LYS 283 Cb -0.02 -0.08 -0.03 0.00 -1.51 0.00 0.00 37.83 36.18 3hol s LYS 283 CO -0.05 0.02 0.82 -3.38 -0.36 0.00 0.00 175.35 172.40 3hol s HIS 284 N -0.26 3.56 -0.30 4.03 -3.43 -1.03 -1.58 115.29 116.28 3hol s HIS 284 Ca -0.02 0.86 0.11 0.00 -0.80 0.00 0.00 55.06 55.21 3hol s HIS 284 Cb -0.02 -2.37 0.63 0.00 -1.43 0.00 0.00 32.58 29.39 3hol s HIS 284 CO -0.00 -0.35 1.64 0.27 -2.00 0.00 0.00 174.74 174.30 3hol n ASN 285 N -2.33 3.89 -4.83 7.38 6.94 -1.22 -4.98 115.26 120.10 3hol n ASN 285 Ca 0.01 -3.36 -0.32 0.00 -0.02 0.00 0.00 54.58 50.89 3hol n ASN 285 Cb 0.55 -0.68 -0.04 0.00 -2.36 0.00 0.00 39.78 37.25 3hol n ASN 285 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 3hol s GLY 286 N -1.67 2.13 -0.06 4.83 0.00 -1.26 -5.08 107.32 106.20 3hol s GLY 286 Ca 0.50 0.25 0.05 0.00 0.00 0.00 0.00 44.72 45.51 3hol s GLY 286 CO 0.09 0.53 -0.21 -0.56 0.00 0.00 0.00 173.10 172.95 3hol s SER 287 N -2.88 2.62 -1.26 1.64 0.01 -1.26 -4.82 113.70 107.74 3hol s SER 287 Ca 0.60 -0.45 -0.08 0.00 1.31 0.00 0.00 55.95 57.33 3hol s SER 287 Cb -0.11 -0.89 -0.01 0.00 0.21 0.00 0.00 66.02 65.23 3hol s SER 287 CO 0.29 0.17 0.66 0.59 0.41 0.00 0.00 173.24 175.36 3hol n ASN 288 N 3.25 -2.67 -4.71 2.44 4.13 -1.26 -4.90 115.26 111.54 3hol n ASN 288 Ca -0.19 -0.94 -0.42 0.00 1.68 0.00 0.00 54.58 54.71 3hol n ASN 288 Cb 0.52 -3.57 -0.03 0.00 -1.54 0.00 0.00 39.78 35.17 3hol n ASN 288 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3hol s VAL 289 N -3.67 4.81 0.17 2.41 1.01 -1.26 -5.02 120.40 118.85 3hol s VAL 289 Ca 0.20 2.02 -0.30 0.00 0.00 0.00 0.00 61.98 63.90 3hol s VAL 289 Cb -0.06 -4.30 -0.08 0.00 0.00 0.00 0.00 36.38 31.94 3hol s VAL 289 CO 0.85 0.14 1.20 -1.81 0.00 0.00 0.00 175.10 175.48 3hol s ASP 290 N 1.03 7.09 0.18 3.32 1.01 -1.26 -5.00 116.67 123.03 3hol s ASP 290 Ca 0.52 2.21 0.07 0.00 0.71 0.00 0.00 52.55 56.06 3hol s ASP 290 Cb -0.21 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.07 3hol s ASP 290 CO 0.27 -0.38 -0.13 0.42 0.21 0.00 0.00 175.17 175.56 3hol s THR 291 N 0.05 1.54 0.09 -1.27 -4.23 -1.26 -1.46 115.64 109.10 3hol s THR 291 Ca 0.53 -2.09 0.09 0.00 -1.18 0.00 0.00 61.69 59.04 3hol s THR 291 Cb -0.32 -1.91 -0.03 0.00 1.34 0.00 0.00 72.50 71.57 3hol s THR 291 CO 0.36 -0.60 -0.23 0.68 -0.54 0.00 0.00 174.62 174.29 3hol s VAL 292 N -2.91 1.85 0.30 2.29 -7.23 0.45 -4.79 120.40 110.37 3hol s VAL 292 Ca 0.19 -1.48 -0.29 0.00 -1.81 0.00 0.00 61.98 58.58 3hol s VAL 292 Cb -0.01 -1.65 -0.10 0.00 0.56 0.00 0.00 36.38 35.19 3hol s VAL 292 CO 0.05 0.08 1.14 -0.60 -0.31 0.00 0.00 175.10 175.46 3hol s ARG 293 N -1.69 4.53 -0.03 4.82 6.06 -1.26 -1.43 118.95 129.95 3hol s ARG 293 Ca 0.09 1.88 0.04 0.00 -2.50 0.00 0.00 55.73 55.24 3hol s ARG 293 Cb -0.10 -3.11 -0.06 0.00 0.06 0.00 0.00 34.95 31.74 3hol s ARG 293 CO 0.04 0.09 0.05 0.44 -2.50 0.00 0.00 175.30 173.41 3hol n ILE 294 N 1.00 0.21 -3.88 4.11 -5.35 0.39 -4.81 119.36 111.04 3hol n ILE 294 Ca -0.00 -0.17 -0.12 0.00 -0.27 0.00 0.00 62.75 62.19 3hol n ILE 294 Cb 0.44 -0.47 -0.13 0.00 -1.74 0.00 0.00 39.64 37.74 3hol n ILE 294 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 3hol s ILE 295 N -2.19 0.01 -0.06 7.28 1.01 -0.97 -1.23 121.20 125.06 3hol s ILE 295 Ca -0.02 -0.12 0.03 0.00 0.00 0.00 0.00 60.65 60.54 3hol s ILE 295 Cb 0.02 -0.07 -0.02 0.00 0.01 0.00 0.00 42.46 42.40 3hol s ILE 295 CO 0.19 -0.07 -0.16 -1.81 0.00 0.00 0.00 174.94 173.10 3hol s ASP 296 N -0.19 3.85 -0.29 3.58 1.01 -0.73 -4.82 116.67 119.09 3hol s ASP 296 Ca -0.02 -0.28 0.02 0.00 0.71 0.00 0.00 52.55 52.98 3hol s ASP 296 Cb -0.01 -0.97 0.20 0.00 1.01 0.00 0.00 42.92 43.14 3hol s ASP 296 CO -0.00 0.30 0.66 0.00 0.21 0.00 0.00 175.17 176.34 3hol s ALA 297 N -0.44 -2.60 0.17 5.23 0.00 -1.24 -0.90 121.76 121.99 3hol s ALA 297 Ca 0.05 1.27 -0.07 0.00 0.00 0.00 0.00 51.96 53.21 3hol s ALA 297 Cb -0.12 -2.50 -0.02 0.00 0.00 0.00 0.00 23.12 20.49 3hol s ALA 297 CO 0.02 -1.75 0.25 -1.54 0.00 0.00 0.00 175.76 172.74 3hol s SER 298 N 2.86 0.08 -0.04 0.00 1.04 -0.76 -0.95 113.70 115.93 3hol s SER 298 Ca 0.14 -0.99 0.01 0.00 0.48 0.00 0.00 55.95 55.59 3hol s SER 298 Cb -0.10 0.42 0.02 0.00 0.10 0.00 0.00 66.02 66.46 3hol s SER 298 CO -0.24 -0.89 -0.04 -0.75 0.98 0.00 0.00 173.24 172.30 3hol s LYS 299 N -4.01 0.72 -0.26 4.02 2.20 0.25 -1.81 119.74 120.85 3hol s LYS 299 Ca 0.21 -0.08 -0.09 0.00 -0.36 0.00 0.00 55.97 55.65 3hol s LYS 299 Cb 0.04 -0.75 -0.04 0.00 -1.51 0.00 0.00 37.83 35.57 3hol s LYS 299 CO 0.03 -0.07 0.13 0.42 -0.36 0.00 0.00 175.35 175.49 3hol s ILE 300 N 0.84 4.82 -0.22 5.43 1.01 0.10 -0.43 121.20 132.76 3hol s ILE 300 Ca -0.11 0.00 -0.29 0.00 0.00 0.00 0.00 60.65 60.26 3hol s ILE 300 Cb -0.14 -3.27 0.01 0.00 0.01 0.00 0.00 42.46 39.07 3hol s ILE 300 CO -0.00 0.30 1.01 -0.62 0.00 0.00 0.00 174.94 175.63 3hol s ASP 301 N 1.62 7.08 0.00 3.58 2.15 0.56 -0.54 116.67 131.12 3hol s ASP 301 Ca 0.07 1.36 0.30 0.00 0.43 0.00 0.00 52.55 54.70 3hol s ASP 301 Cb -0.15 -2.53 1.50 0.00 -0.30 0.00 0.00 42.92 41.43 3hol s ASP 301 CO 0.07 -0.62 2.01 0.18 -0.17 0.00 0.00 175.17 176.64 3hol n LEU 302 N 6.12 0.28 -0.00 -1.34 4.77 -0.55 0.58 117.00 126.85 3hol n LEU 302 Ca 0.11 0.05 -0.16 0.00 -0.03 0.00 0.00 56.01 55.97 3hol n LEU 302 Cb 0.47 -0.14 -0.14 0.00 -2.33 0.00 0.00 43.42 41.27 3hol n LEU 302 CO 0.51 0.05 -0.66 0.71 -1.33 0.00 0.00 177.39 176.67 3hol h THR 303 N 0.38 0.75 0.00 -5.08 1.35 -1.93 -3.39 112.91 104.98 3hol h THR 303 Ca 0.00 -2.52 0.00 0.00 -0.55 0.00 0.00 66.41 63.34 3hol h THR 303 Cb 0.24 2.49 0.00 0.00 -1.73 0.00 0.00 68.15 69.15 3hol h THR 303 CO 0.00 0.72 -1.32 0.59 -0.25 0.00 0.00 175.52 175.27 3hol n ASN 304 N -3.30 0.83 -3.87 5.36 3.02 -1.20 -5.00 115.26 111.10 3hol n ASN 304 Ca -0.25 -0.47 -0.27 0.00 -0.03 0.00 0.00 54.58 53.56 3hol n ASN 304 Cb 1.05 1.40 0.02 0.00 -0.61 0.00 0.00 39.78 41.64 3hol n ASN 304 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3hol n PHE 305 N -1.76 -2.01 -4.37 3.10 3.72 0.20 -4.99 117.46 111.33 3hol n PHE 305 Ca 0.00 0.85 -0.26 0.00 -0.05 0.00 0.00 57.45 57.99 3hol n PHE 305 Cb 0.37 -4.02 -0.10 0.00 -0.94 0.00 0.00 39.48 34.79 3hol n PHE 305 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 3hol s SER 306 N -3.87 3.82 -0.03 4.37 1.04 -1.18 -4.68 113.70 113.17 3hol s SER 306 Ca 0.32 -0.77 0.02 0.00 0.48 0.00 0.00 55.95 56.01 3hol s SER 306 Cb -0.16 -0.46 -0.03 0.00 0.10 0.00 0.00 66.02 65.46 3hol s SER 306 CO 0.84 0.10 -0.08 -0.51 0.98 0.00 0.00 173.24 174.57 3hol s ILE 307 N -1.82 3.59 0.04 -1.02 2.07 -1.26 -0.33 121.20 122.48 3hol s ILE 307 Ca 0.24 -0.67 0.00 0.00 -1.41 0.00 0.00 60.65 58.81 3hol s ILE 307 Cb -0.08 -2.51 -0.03 0.00 0.13 0.00 0.00 42.46 39.97 3hol s ILE 307 CO 0.13 0.49 -0.04 -0.94 -1.91 0.00 0.00 174.94 172.67 3hol s SER 308 N -1.12 0.51 0.30 4.50 1.04 0.43 -4.98 113.70 114.37 3hol s SER 308 Ca 0.15 -0.77 -0.28 0.00 0.48 0.00 0.00 55.95 55.53 3hol s SER 308 Cb -0.11 0.13 -0.09 0.00 0.10 0.00 0.00 66.02 66.05 3hol s SER 308 CO 0.04 -0.43 1.01 -1.61 0.98 0.00 0.00 173.24 173.23 3hol s GLU 309 N -2.75 4.60 -0.03 4.02 0.41 -1.26 -0.58 118.70 123.11 3hol s GLU 309 Ca -0.03 1.55 -0.03 0.00 -0.41 0.00 0.00 54.97 56.05 3hol s GLU 309 Cb -0.01 -3.00 -0.04 0.00 -1.78 0.00 0.00 34.13 29.30 3hol s GLU 309 CO -0.05 0.25 0.13 -0.51 -0.49 0.00 0.00 175.26 174.59 3hol s LEU 310 N -1.74 4.18 0.06 1.80 1.43 -0.12 -4.85 118.68 119.43 3hol s LEU 310 Ca 0.47 0.30 -0.31 0.00 -1.03 0.00 0.00 54.13 53.56 3hol s LEU 310 Cb -0.25 -2.36 -0.07 0.00 0.03 0.00 0.00 46.19 43.54 3hol s LEU 310 CO 0.32 0.30 1.46 0.20 0.23 0.00 0.00 176.35 178.86 3hol s ASN 311 N -1.64 6.78 -0.09 2.29 0.01 -1.26 -4.77 114.94 116.26 3hol s ASN 311 Ca 0.23 2.28 -0.11 0.00 -0.71 0.00 0.00 52.86 54.55 3hol s ASN 311 Cb -0.12 -2.57 0.03 0.00 0.41 0.00 0.00 41.25 38.99 3hol s ASN 311 CO 0.13 -0.74 0.30 0.21 -1.51 0.00 0.00 177.10 175.49 3hol s ASN 312 N 1.69 -0.28 0.00 -1.22 3.84 -1.26 -4.37 114.94 113.34 3hol s ASN 312 Ca 0.66 0.49 0.17 0.00 0.21 0.00 0.00 52.86 54.39 3hol s ASN 312 Cb -0.35 0.55 0.34 0.00 -0.55 0.00 0.00 41.25 41.23 3hol s ASN 312 CO 0.29 -0.17 1.25 0.49 -2.79 0.00 0.00 177.10 176.17 3hol n PHE 313 N 2.58 0.43 0.00 0.43 3.72 -1.26 -4.81 117.46 118.56 3hol n PHE 313 Ca -0.15 -0.30 0.00 0.00 -0.05 0.00 0.00 57.45 56.95 3hol n PHE 313 Cb 0.57 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 39.11 3hol n PHE 313 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hol n GLY 314 N 1.02 1.14 3.16 1.37 0.00 -1.26 -2.69 105.19 107.94 3hol n GLY 314 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 3hol n GLY 314 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hol s ASP 315 N -1.23 5.00 0.35 1.61 -1.08 -1.26 -4.87 116.67 115.18 3hol s ASP 315 Ca 0.00 -1.48 0.27 0.00 -0.52 0.00 0.00 52.55 50.82 3hol s ASP 315 Cb 0.00 -1.74 1.16 0.00 -1.46 0.00 0.00 42.92 40.87 3hol s ASP 315 CO 0.00 -0.34 1.80 0.00 0.52 0.00 0.00 175.17 177.15 3hol h ALA 316 N 8.01 1.00 -0.31 3.66 0.00 -1.88 -2.09 119.26 127.64 3hol h ALA 316 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3hol h ALA 316 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3hol h ALA 316 CO 0.57 0.00 0.00 0.43 0.00 0.00 0.00 179.25 180.25 3hol n SER 317 N -2.47 1.84 -4.18 0.00 7.64 -1.26 -4.42 113.62 110.76 3hol n SER 317 Ca 0.01 -1.93 -0.34 0.00 1.01 0.00 0.00 58.87 57.63 3hol n SER 317 Cb 0.22 -0.20 -0.15 0.00 -1.01 0.00 0.00 64.21 63.06 3hol n SER 317 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3hol s VAL 318 N -1.59 2.45 -0.21 0.44 1.01 -0.79 -0.09 120.40 121.62 3hol s VAL 318 Ca 0.26 -0.81 -0.03 0.00 0.00 0.00 0.00 61.98 61.40 3hol s VAL 318 Cb 0.14 -2.06 -0.00 0.00 0.00 0.00 0.00 36.38 34.45 3hol s VAL 318 CO 0.19 0.50 -0.07 -0.22 0.00 0.00 0.00 175.10 175.50 3hol s LEU 319 N 1.35 2.75 -0.35 3.92 2.96 0.31 -4.90 118.68 124.71 3hol s LEU 319 Ca 0.05 -0.44 -0.13 0.00 -0.22 0.00 0.00 54.13 53.39 3hol s LEU 319 Cb -0.13 -1.69 -0.01 0.00 0.50 0.00 0.00 46.19 44.85 3hol s LEU 319 CO -0.10 -0.02 0.27 -0.63 -1.32 0.00 0.00 176.35 174.55 3hol s ILE 320 N 1.44 5.26 -0.17 6.68 1.01 -1.26 0.19 121.20 134.35 3hol s ILE 320 Ca 0.06 -0.22 -0.00 0.00 0.00 0.00 0.00 60.65 60.49 3hol s ILE 320 Cb -0.14 -3.76 0.00 0.00 0.01 0.00 0.00 42.46 38.57 3hol s ILE 320 CO -0.05 -0.06 -0.14 -0.63 0.00 0.00 0.00 174.94 174.06 3hol s ILE 321 N 1.77 2.70 -1.58 2.92 -1.09 0.36 -4.66 121.20 121.62 3hol s ILE 321 Ca 0.07 -0.75 -0.04 0.00 -2.23 0.00 0.00 60.65 57.70 3hol s ILE 321 Cb -0.17 -2.16 0.04 0.00 -1.58 0.00 0.00 42.46 38.59 3hol s ILE 321 CO 0.11 0.50 0.21 -0.67 -1.23 0.00 0.00 174.94 173.86 3hol n ASP 322 N 4.28 0.09 0.00 3.58 2.03 -1.26 -0.69 116.55 124.58 3hol n ASP 322 Ca -0.19 -1.21 0.00 0.00 0.52 0.00 0.00 54.79 53.91 3hol n ASP 322 Cb 0.51 -1.94 0.00 0.00 -0.72 0.00 0.00 41.12 38.97 3hol n ASP 322 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3hol n GLY 323 N -2.19 3.26 3.78 0.27 0.00 -1.26 -4.94 105.19 104.11 3hol n GLY 323 Ca -0.24 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 3hol n GLY 323 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hol s LYS 324 N -0.53 3.95 -0.06 1.61 2.20 0.13 -4.95 119.74 122.10 3hol s LYS 324 Ca 0.00 -0.05 -0.30 0.00 -0.36 0.00 0.00 55.97 55.26 3hol s LYS 324 Cb 0.00 -3.33 -0.02 0.00 -1.51 0.00 0.00 37.83 32.96 3hol s LYS 324 CO 0.00 0.47 1.04 0.15 -0.36 0.00 0.00 175.35 176.65 3hol s LYS 325 N -0.17 4.44 -0.21 4.03 1.02 -1.26 -0.48 119.74 127.11 3hol s LYS 325 Ca 0.14 1.47 -0.04 0.00 0.02 0.00 0.00 55.97 57.55 3hol s LYS 325 Cb -0.12 -3.51 -0.01 0.00 -0.52 0.00 0.00 37.83 33.66 3hol s LYS 325 CO 0.03 -0.27 -0.03 0.42 -0.92 0.00 0.00 175.35 174.58 3hol s ILE 326 N 1.75 3.59 -0.30 2.17 1.01 0.13 -4.96 121.20 124.59 3hol s ILE 326 Ca 0.51 -0.42 -0.24 0.00 0.00 0.00 0.00 60.65 60.50 3hol s ILE 326 Cb -0.21 -2.63 0.00 0.00 0.01 0.00 0.00 42.46 39.63 3hol s ILE 326 CO 0.22 0.42 0.81 -0.54 0.00 0.00 0.00 174.94 175.85 3hol s LYS 327 N 1.29 3.98 -1.06 2.79 -0.14 -1.26 -0.53 119.74 124.80 3hol s LYS 327 Ca 0.04 0.63 -0.17 0.00 -1.36 0.00 0.00 55.97 55.10 3hol s LYS 327 Cb -0.14 -3.73 0.13 0.00 -1.68 0.00 0.00 37.83 32.41 3hol s LYS 327 CO -0.01 -0.69 1.32 -0.51 -0.76 0.00 0.00 175.35 174.70 3hol s LEU 328 N 3.00 4.78 0.05 3.17 1.43 0.86 -4.95 118.68 127.02 3hol s LEU 328 Ca 0.33 -2.33 0.02 0.00 -1.03 0.00 0.00 54.13 51.13 3hol s LEU 328 Cb -0.14 -2.43 -0.03 0.00 0.03 0.00 0.00 46.19 43.62 3hol s LEU 328 CO 0.12 -1.02 -0.08 0.00 0.23 0.00 0.00 176.35 175.61 3hol s ALA 329 N 2.70 0.65 0.00 4.21 0.00 -1.26 -4.88 121.76 123.18 3hol s ALA 329 Ca 0.39 -0.84 0.00 0.00 0.00 0.00 0.00 51.96 51.51 3hol s ALA 329 Cb -0.03 0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.14 3hol s ALA 329 CO -0.05 -0.03 0.00 0.41 0.00 0.00 0.00 175.76 176.09 3hol n GLY 330 N 1.30 0.73 0.08 0.00 0.00 -1.26 -5.01 105.19 101.03 3hol n GLY 330 Ca -0.22 -0.81 -0.10 0.00 0.00 0.00 0.00 46.02 44.89 3hol n GLY 330 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3hol h SER 331 N 0.00 0.08 -4.31 1.61 4.64 -2.01 -3.48 113.55 110.08 3hol h SER 331 Ca 0.00 -0.14 -0.51 0.00 -0.47 0.00 0.00 61.79 60.68 3hol h SER 331 Cb 0.00 -0.03 0.10 0.00 -0.31 0.00 0.00 62.40 62.17 3hol h SER 331 CO 0.00 1.12 0.35 -0.83 -0.87 0.00 0.00 176.83 176.60 3hol s GLY 332 N -5.00 1.65 0.21 -0.77 0.00 -1.26 -4.96 107.32 97.19 3hol s GLY 332 Ca -0.05 0.02 -0.10 0.00 0.00 0.00 0.00 44.72 44.59 3hol s GLY 332 CO 0.83 0.37 1.71 -2.75 0.00 0.00 0.00 173.10 173.25 3hol h PHE 333 N -0.88 0.21 -2.93 1.90 3.57 -1.95 -3.37 116.94 113.50 3hol h PHE 333 Ca -0.45 0.03 -0.54 0.00 3.53 0.00 0.00 57.97 60.55 3hol h PHE 333 Cb 1.23 -0.00 -0.16 0.00 2.79 0.00 0.00 35.95 39.81 3hol h PHE 333 CO 0.57 -0.02 -0.77 0.95 -2.23 0.00 0.00 178.31 176.81 3hol s THR 334 N -6.11 2.01 -0.02 4.41 -4.23 -1.26 -1.46 115.64 108.97 3hol s THR 334 Ca -0.13 -2.12 0.01 0.00 -1.18 0.00 0.00 61.69 58.26 3hol s THR 334 Cb 0.17 -2.03 0.02 0.00 1.34 0.00 0.00 72.50 72.00 3hol s THR 334 CO 0.74 -0.39 -0.02 0.20 -0.54 0.00 0.00 174.62 174.62 3hol s ASN 335 N -3.03 0.49 0.02 3.99 0.01 -0.73 -4.94 114.94 110.75 3hol s ASN 335 Ca 0.21 -0.05 -0.21 0.00 -0.71 0.00 0.00 52.86 52.10 3hol s ASN 335 Cb -0.04 -0.21 -0.06 0.00 0.41 0.00 0.00 41.25 41.35 3hol s ASN 335 CO 0.09 -0.06 0.62 -0.75 -1.51 0.00 0.00 177.10 175.49 3hol s LYS 336 N 0.72 4.33 -0.09 -0.60 2.20 -1.26 -1.18 119.74 123.86 3hol s LYS 336 Ca -0.08 0.78 0.02 0.00 -0.36 0.00 0.00 55.97 56.34 3hol s LYS 336 Cb -0.11 -3.33 0.01 0.00 -1.51 0.00 0.00 37.83 32.90 3hol s LYS 336 CO -0.01 0.41 -0.15 -1.01 -0.36 0.00 0.00 175.35 174.23 3hol s HIS 337 N -0.34 1.79 -0.23 4.03 3.76 0.16 -4.96 115.29 119.49 3hol s HIS 337 Ca 0.32 -0.74 0.02 0.00 -0.15 0.00 0.00 55.06 54.51 3hol s HIS 337 Cb -0.19 -1.28 0.05 0.00 1.11 0.00 0.00 32.58 32.27 3hol s HIS 337 CO 0.18 -0.37 -0.13 0.99 -0.85 0.00 0.00 174.74 174.57 3hol s THR 338 N 0.75 2.07 -0.01 1.30 2.01 -1.26 -0.50 115.64 120.00 3hol s THR 338 Ca -0.12 -1.39 0.02 0.00 0.31 0.00 0.00 61.69 60.50 3hol s THR 338 Cb -0.16 -2.11 0.00 0.00 0.01 0.00 0.00 72.50 70.25 3hol s THR 338 CO 0.03 0.12 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.39 3hol s ILE 339 N 1.19 0.52 -0.18 1.82 -1.09 0.51 -4.97 121.20 119.00 3hol s ILE 339 Ca -0.05 -0.25 -0.20 0.00 -2.23 0.00 0.00 60.65 57.93 3hol s ILE 339 Cb -0.18 -0.46 -0.03 0.00 -1.58 0.00 0.00 42.46 40.21 3hol s ILE 339 CO -0.07 0.16 0.58 -1.61 -1.23 0.00 0.00 174.94 172.77 3hol s GLU 340 N 0.06 4.24 -0.17 2.79 8.01 -1.26 -0.19 118.70 132.18 3hol s GLU 340 Ca -0.00 0.55 -0.03 0.00 0.01 0.00 0.00 54.97 55.49 3hol s GLU 340 Cb -0.05 -3.54 0.06 0.00 -4.31 0.00 0.00 34.13 26.28 3hol s GLU 340 CO -0.00 -0.13 0.05 0.42 0.01 0.00 0.00 175.26 175.61 3hol s ILE 341 N 1.56 0.27 -1.43 -1.63 1.01 -0.20 -4.86 121.20 115.92 3hol s ILE 341 Ca 0.28 -0.34 -0.08 0.00 0.00 0.00 0.00 60.65 60.51 3hol s ILE 341 Cb -0.16 -0.80 0.05 0.00 0.01 0.00 0.00 42.46 41.55 3hol s ILE 341 CO 0.11 -0.19 0.88 0.59 0.00 0.00 0.00 174.94 176.33 3hol n ASN 342 N 5.15 -3.40 -1.08 3.58 3.02 -1.26 -1.98 115.26 119.29 3hol n ASN 342 Ca -0.08 -0.78 -0.12 0.00 -0.03 0.00 0.00 54.58 53.57 3hol n ASN 342 Cb 0.48 -4.04 -0.03 0.00 -0.61 0.00 0.00 39.78 35.58 3hol n ASN 342 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hol n GLY 343 N -1.66 0.78 3.26 7.41 0.00 -1.26 -5.03 105.19 108.68 3hol n GLY 343 Ca -0.10 -0.44 -0.26 0.00 0.00 0.00 0.00 46.02 45.21 3hol n GLY 343 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hol s LYS 344 N -3.59 1.50 -0.43 1.61 1.02 -0.84 -5.11 119.74 113.90 3hol s LYS 344 Ca 0.00 -0.92 -0.12 0.00 0.02 0.00 0.00 55.97 54.94 3hol s LYS 344 Cb 0.00 -1.59 0.07 0.00 -0.52 0.00 0.00 37.83 35.79 3hol s LYS 344 CO 0.00 0.41 0.31 0.95 -0.92 0.00 0.00 175.35 176.10 3hol s THR 345 N -0.74 4.71 0.01 2.17 -4.23 -1.26 -1.03 115.64 115.27 3hol s THR 345 Ca 0.08 -1.16 -0.11 0.00 -1.18 0.00 0.00 61.69 59.33 3hol s THR 345 Cb -0.09 -3.81 -0.05 0.00 1.34 0.00 0.00 72.50 69.89 3hol s THR 345 CO 0.01 -0.48 0.35 -0.04 -0.54 0.00 0.00 174.62 173.92 3hol s MET 346 N 1.54 3.75 -0.10 3.99 -1.94 0.73 -1.14 119.30 126.12 3hol s MET 346 Ca 0.03 0.19 0.01 0.00 -1.71 0.00 0.00 55.69 54.21 3hol s MET 346 Cb -0.23 -3.12 0.02 0.00 2.01 0.00 0.00 34.83 33.51 3hol s MET 346 CO 0.05 0.65 -0.12 0.08 -0.01 0.00 0.00 175.02 175.67 3hol s VAL 347 N -1.22 1.25 -0.04 -6.03 1.01 -0.30 -0.36 120.40 114.71 3hol s VAL 347 Ca 0.26 -0.48 0.06 0.00 0.00 0.00 0.00 61.98 61.82 3hol s VAL 347 Cb -0.15 -1.18 -0.01 0.00 0.00 0.00 0.00 36.38 35.04 3hol s VAL 347 CO 0.14 0.40 -0.24 0.00 0.00 0.00 0.00 175.10 175.40 3hol s ALA 348 N 1.17 2.06 -0.25 5.51 0.00 0.35 -1.64 121.76 128.96 3hol s ALA 348 Ca -0.04 -1.01 0.02 0.00 0.00 0.00 0.00 51.96 50.92 3hol s ALA 348 Cb -0.14 -0.61 0.05 0.00 0.00 0.00 0.00 23.12 22.42 3hol s ALA 348 CO -0.03 0.43 -0.11 0.08 0.00 0.00 0.00 175.76 176.13 3hol s VAL 349 N -0.26 2.30 -0.03 0.00 1.01 -0.04 0.36 120.40 123.74 3hol s VAL 349 Ca 0.00 -1.43 0.03 0.00 0.00 0.00 0.00 61.98 60.59 3hol s VAL 349 Cb -0.12 -2.27 -0.03 0.00 0.00 0.00 0.00 36.38 33.96 3hol s VAL 349 CO 0.02 0.09 -0.12 0.00 0.00 0.00 0.00 175.10 175.09 3hol s ALA 350 N 1.17 2.77 0.11 5.51 0.00 -0.33 -1.74 121.76 129.25 3hol s ALA 350 Ca -0.05 -1.00 0.10 0.00 0.00 0.00 0.00 51.96 51.01 3hol s ALA 350 Cb -0.18 -1.01 -0.04 0.00 0.00 0.00 0.00 23.12 21.89 3hol s ALA 350 CO -0.06 0.57 -0.25 0.00 0.00 0.00 0.00 175.76 176.02 3hol h SER 353 N 3.50 0.00 -0.50 0.00 4.64 -1.41 -1.92 113.55 117.85 3hol h SER 353 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 3hol h SER 353 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3hol h SER 353 CO 0.59 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.09 3hol n ASN 354 N -3.30 3.61 -4.29 4.97 6.94 -1.26 -4.87 115.26 117.06 3hol n ASN 354 Ca -0.03 -1.99 -0.33 0.00 -0.02 0.00 0.00 54.58 52.21 3hol n ASN 354 Cb 0.09 -0.33 -0.16 0.00 -2.36 0.00 0.00 39.78 37.03 3hol n ASN 354 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3hol s LEU 355 N -1.33 2.40 -0.02 -4.53 1.43 -0.72 -4.98 118.68 110.93 3hol s LEU 355 Ca 0.42 -0.45 0.14 0.00 -1.03 0.00 0.00 54.13 53.21 3hol s LEU 355 Cb 0.24 -1.51 -0.21 0.00 0.03 0.00 0.00 46.19 44.73 3hol s LEU 355 CO 0.32 0.15 0.33 -0.62 0.23 0.00 0.00 176.35 176.77 3hol n GLU 356 N 3.58 0.61 -0.03 1.70 -0.58 -1.26 -4.64 120.64 120.02 3hol n GLU 356 Ca -0.19 -0.12 0.01 0.00 -0.42 0.00 0.00 57.16 56.45 3hol n GLU 356 Cb 0.53 -1.32 0.03 0.00 -0.57 0.00 0.00 31.44 30.11 3hol n GLU 356 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 3hol n TYR 357 N -1.93 0.08 -3.67 -0.32 4.01 -1.26 -4.91 117.16 109.16 3hol n TYR 357 Ca -0.02 -0.46 -0.10 0.00 -0.16 0.00 0.00 57.90 57.16 3hol n TYR 357 Cb 0.35 -0.04 -0.04 0.00 -0.31 0.00 0.00 39.34 39.29 3hol n TYR 357 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3hol s MET 358 N -0.93 1.15 -0.05 -0.72 0.23 -1.26 -0.88 119.30 116.83 3hol s MET 358 Ca 0.04 -0.76 -0.11 0.00 -1.03 0.00 0.00 55.69 53.83 3hol s MET 358 Cb 0.02 0.48 0.02 0.00 -1.53 0.00 0.00 34.83 33.82 3hol s MET 358 CO 0.03 -0.46 0.27 0.15 -2.03 0.00 0.00 175.02 172.98 3hol s LYS 359 N -3.83 0.48 0.08 3.16 -0.14 -0.44 -4.62 119.74 114.44 3hol s LYS 359 Ca 0.05 0.05 -0.10 0.00 -1.36 0.00 0.00 55.97 54.61 3hol s LYS 359 Cb 0.01 0.22 0.01 0.00 -1.68 0.00 0.00 37.83 36.38 3hol s LYS 359 CO -0.09 -0.10 0.23 -0.59 -0.76 0.00 0.00 175.35 174.03 3hol s PHE 360 N -0.64 0.08 -2.89 3.18 -0.12 -0.44 -0.77 117.98 116.37 3hol s PHE 360 Ca -0.07 -0.45 0.00 0.00 -0.05 0.00 0.00 56.93 56.36 3hol s PHE 360 Cb -0.04 -0.00 0.00 0.00 -0.63 0.00 0.00 43.02 42.34 3hol s PHE 360 CO 0.02 -0.55 0.00 0.41 -0.05 0.00 0.00 175.22 175.05 3hol n GLY 361 N 0.05 -0.61 3.54 1.99 0.00 -0.57 -0.23 105.19 109.35 3hol n GLY 361 Ca -0.16 -0.61 -0.30 0.00 0.00 0.00 0.00 46.02 44.95 3hol n GLY 361 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hol s GLN 362 N -1.16 2.17 -0.07 1.61 -0.21 -0.71 -1.20 119.66 120.10 3hol s GLN 362 Ca 0.00 -0.96 -0.03 0.00 0.02 0.00 0.00 55.36 54.39 3hol s GLN 362 Cb 0.00 -2.30 0.04 0.00 1.00 0.00 0.00 33.01 31.75 3hol s GLN 362 CO 0.00 0.53 0.14 -1.17 -2.12 0.00 0.00 175.29 172.67 3hol s LEU 363 N -1.82 0.47 0.24 2.90 2.96 0.17 -0.86 118.68 122.75 3hol s LEU 363 Ca 0.18 0.28 -0.03 0.00 -0.22 0.00 0.00 54.13 54.34 3hol s LEU 363 Cb -0.11 0.28 -0.02 0.00 0.50 0.00 0.00 46.19 46.84 3hol s LEU 363 CO 0.10 -0.18 0.28 -1.66 -1.32 0.00 0.00 176.35 173.56 3hol s TRP 364 N 1.56 1.00 -0.17 5.38 -2.14 -0.65 0.68 118.94 124.59 3hol s TRP 364 Ca -0.05 -1.22 -0.05 0.00 2.66 0.00 0.00 56.10 57.44 3hol s TRP 364 Cb -0.12 -0.32 -0.03 0.00 -3.10 0.00 0.00 33.47 29.90 3hol s TRP 364 CO -0.06 -0.81 -0.01 -1.14 -2.66 0.00 0.00 176.95 172.27 3hol s GLN 365 N -3.93 3.73 -0.32 3.25 0.74 0.11 -1.15 119.66 122.09 3hol s GLN 365 Ca 0.34 -0.48 0.02 0.00 0.05 0.00 0.00 55.36 55.29 3hol s GLN 365 Cb 0.04 -3.00 0.15 0.00 1.10 0.00 0.00 33.01 31.30 3hol s GLN 365 CO 0.14 0.22 0.38 -1.14 -0.55 0.00 0.00 175.29 174.34 3hol s GLN 366 N 0.45 0.47 1.09 1.67 0.74 -0.29 0.82 119.66 124.61 3hol s GLN 366 Ca -0.02 -0.23 -0.18 0.00 0.05 0.00 0.00 55.36 54.99 3hol s GLN 366 Cb -0.14 -0.48 0.09 0.00 1.10 0.00 0.00 33.01 33.58 3hol s GLN 366 CO 0.02 -1.09 0.05 0.00 -0.55 0.00 0.00 175.29 173.72 3hol n ALA 367 N 4.99 -3.93 -3.82 1.58 0.00 -1.26 -4.73 120.51 113.34 3hol n ALA 367 Ca 0.03 -1.18 -0.28 0.00 0.00 0.00 0.00 53.44 52.01 3hol n ALA 367 Cb 0.48 -1.55 -0.12 0.00 0.00 0.00 0.00 19.45 18.25 3hol n ALA 367 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3hol s GLU 368 N -3.45 2.12 3.70 0.00 2.12 -1.26 -0.63 118.70 121.30 3hol s GLU 368 Ca 0.56 -3.02 0.00 0.00 0.36 0.00 0.00 54.97 52.87 3hol s GLU 368 Cb -0.13 -3.06 0.00 0.00 0.26 0.00 0.00 34.13 31.20 3hol s GLU 368 CO 0.66 -1.28 0.00 0.41 -0.54 0.00 0.00 175.26 174.52 3hol n GLY 369 N 2.30 0.54 0.00 -1.50 0.00 -1.26 -5.15 105.19 100.12 3hol n GLY 369 Ca 0.19 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.23 3hol n GLY 369 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hol n GLY 370 N 0.00 0.21 3.39 -0.02 0.00 0.19 -5.13 105.19 103.83 3hol n GLY 370 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3hol n GLY 370 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hol s LYS 371 N 0.00 3.54 -0.04 1.61 1.02 -1.26 -5.05 119.74 119.56 3hol s LYS 371 Ca 0.00 -0.54 -0.30 0.00 0.02 0.00 0.00 55.97 55.15 3hol s LYS 371 Cb 0.00 -3.19 -0.04 0.00 -0.52 0.00 0.00 37.83 34.08 3hol s LYS 371 CO 0.00 -0.19 1.33 -2.14 -0.92 0.00 0.00 175.35 173.44 3hol s PRO 372 N 1.54 4.29 0.18 -1.68 0.02 -1.26 -4.50 135.00 133.60 3hol s PRO 372 Ca 0.06 1.85 0.06 0.00 0.02 0.00 0.00 61.00 62.99 3hol s PRO 372 Cb -0.15 -3.62 -0.05 0.00 0.02 0.00 0.00 34.50 30.71 3hol s PRO 372 CO 0.01 -0.57 -0.13 -1.83 -0.33 0.00 0.00 177.00 174.15 3hol s GLU 373 N 2.59 1.21 -1.23 5.54 -1.05 0.24 -4.87 118.70 121.14 3hol s GLU 373 Ca 0.61 -1.53 -0.09 0.00 -0.15 0.00 0.00 54.97 53.81 3hol s GLU 373 Cb -0.28 -0.90 -0.01 0.00 -0.44 0.00 0.00 34.13 32.50 3hol s GLU 373 CO 0.24 0.14 0.71 0.09 0.95 0.00 0.00 175.26 177.38 3hol n ASN 374 N -0.30 -3.20 -4.77 0.83 3.02 -1.26 0.08 115.26 109.66 3hol n ASN 374 Ca -0.09 -0.92 -0.38 0.00 -0.03 0.00 0.00 54.58 53.16 3hol n ASN 374 Cb 0.60 -3.73 -0.02 0.00 -0.61 0.00 0.00 39.78 36.03 3hol n ASN 374 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3hol s ASN 375 N -3.92 6.49 0.24 6.41 2.47 -1.26 -4.19 114.94 121.18 3hol s ASN 375 Ca 0.23 2.38 -0.11 0.00 0.42 0.00 0.00 52.86 55.78 3hol s ASN 375 Cb -0.07 -2.62 -0.01 0.00 -1.45 0.00 0.00 41.25 37.10 3hol s ASN 375 CO 0.84 -0.70 0.42 -0.94 -3.72 0.00 0.00 177.10 173.00 3hol s SER 376 N -1.10 -0.06 0.22 -4.21 1.04 0.21 -1.48 113.70 108.32 3hol s SER 376 Ca 0.57 -0.99 0.11 0.00 0.48 0.00 0.00 55.95 56.12 3hol s SER 376 Cb -0.31 0.55 -0.04 0.00 0.10 0.00 0.00 66.02 66.31 3hol s SER 376 CO 0.39 -1.09 -0.18 -0.76 0.98 0.00 0.00 173.24 172.58 3hol s LEU 377 N -3.04 2.65 0.04 2.42 1.43 0.29 -0.65 118.68 121.82 3hol s LEU 377 Ca 0.25 -0.82 0.01 0.00 -1.03 0.00 0.00 54.13 52.53 3hol s LEU 377 Cb 0.01 -1.30 -0.03 0.00 0.03 0.00 0.00 46.19 44.89 3hol s LEU 377 CO 0.09 0.09 -0.05 0.72 0.23 0.00 0.00 176.35 177.43 3hol s PHE 378 N -1.92 0.48 -0.02 0.29 -0.12 -0.34 -0.72 117.98 115.64 3hol s PHE 378 Ca 0.25 -0.63 0.00 0.00 -0.05 0.00 0.00 56.93 56.50 3hol s PHE 378 Cb -0.07 -0.31 0.02 0.00 -0.63 0.00 0.00 43.02 42.02 3hol s PHE 378 CO 0.13 -0.18 0.02 -1.17 -0.05 0.00 0.00 175.22 173.97 3hol s LEU 379 N -1.83 1.35 0.01 -1.99 0.20 -0.75 -1.51 118.68 114.16 3hol s LEU 379 Ca -0.09 0.02 0.04 0.00 0.69 0.00 0.00 54.13 54.79 3hol s LEU 379 Cb -0.06 -0.07 -0.01 0.00 -0.43 0.00 0.00 46.19 45.61 3hol s LEU 379 CO -0.02 -0.09 -0.12 -1.10 -0.29 0.00 0.00 176.35 174.73 3hol s GLN 380 N 0.76 0.93 0.00 1.98 -0.21 0.05 -1.84 119.66 121.33 3hol s GLN 380 Ca -0.06 -0.56 -0.19 0.00 0.02 0.00 0.00 55.36 54.57 3hol s GLN 380 Cb -0.09 -0.91 0.04 0.00 1.00 0.00 0.00 33.01 33.05 3hol s GLN 380 CO -0.02 0.24 0.41 0.20 -2.12 0.00 0.00 175.29 174.00 3hol s GLY 381 N -0.66 -0.27 -0.46 3.09 0.00 -0.07 -1.32 107.32 107.63 3hol s GLY 381 Ca 0.03 0.47 -0.10 0.00 0.00 0.00 0.00 44.72 45.12 3hol s GLY 381 CO 0.00 0.22 0.33 -0.54 0.00 0.00 0.00 173.10 173.11 3hol s GLU 382 N -1.78 2.56 0.49 2.90 2.02 -0.06 -1.77 118.70 123.06 3hol s GLU 382 Ca -0.10 -1.65 -0.24 0.00 0.02 0.00 0.00 54.97 53.00 3hol s GLU 382 Cb -0.03 -3.91 -0.07 0.00 0.10 0.00 0.00 34.13 30.23 3hol s GLU 382 CO 0.02 -1.12 1.38 0.54 0.02 0.00 0.00 175.26 176.10 3hol n ARG 383 N 4.94 1.97 -1.74 1.61 5.12 -0.36 -2.05 116.66 126.14 3hol n ARG 383 Ca -0.09 0.71 -0.42 0.00 -1.93 0.00 0.00 57.85 56.12 3hol n ARG 383 Cb 0.41 -2.57 -0.02 0.00 -1.16 0.00 0.00 32.46 29.12 3hol n ARG 383 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 3hol n THR 384 N -0.56 0.84 -1.71 0.55 -1.04 0.78 -4.53 114.28 108.60 3hol n THR 384 Ca 0.08 -0.21 -0.43 0.00 -2.04 0.00 0.00 64.05 61.45 3hol n THR 384 Cb 0.43 -1.96 -0.03 0.00 -1.82 0.00 0.00 70.33 66.95 3hol n THR 384 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3hol n ALA 385 N 2.47 2.22 0.24 2.41 0.00 -1.26 -4.73 120.51 121.85 3hol n ALA 385 Ca 0.10 0.40 0.07 0.00 0.00 0.00 0.00 53.44 54.01 3hol n ALA 385 Cb 0.36 -2.43 0.59 0.00 0.00 0.00 0.00 19.45 17.97 3hol n ALA 385 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3hol h THR 386 N 3.48 1.02 0.00 0.00 2.02 -1.94 0.12 112.91 117.62 3hol h THR 386 Ca -0.45 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 66.40 3hol h THR 386 Cb 1.23 1.18 0.00 0.00 -1.74 0.00 0.00 68.15 68.82 3hol h THR 386 CO 0.85 0.09 0.00 -2.24 0.37 0.00 0.00 175.52 174.59 3hol h ASP 387 N 0.00 0.00 0.02 4.18 2.03 -2.01 -2.56 116.42 118.08 3hol h ASP 387 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3hol h ASP 387 Cb 0.17 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.67 3hol h ASP 387 CO 0.01 0.00 -0.11 0.29 -1.03 0.00 0.00 179.24 178.40 3hol n LYS 388 N -2.77 1.71 -2.14 4.15 4.76 0.42 -4.96 118.16 119.33 3hol n LYS 388 Ca 0.01 -1.24 -0.41 0.00 -2.87 0.00 0.00 58.31 53.79 3hol n LYS 388 Cb 0.25 -1.47 -0.03 0.00 -1.84 0.00 0.00 35.03 31.94 3hol n LYS 388 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 3hol s MET 389 N -2.15 4.34 0.35 1.97 -1.94 -0.97 -4.70 119.30 116.21 3hol s MET 389 Ca 0.29 2.14 -0.27 0.00 -1.71 0.00 0.00 55.69 56.14 3hol s MET 389 Cb 0.20 -3.17 -0.12 0.00 2.01 0.00 0.00 34.83 33.75 3hol s MET 389 CO 0.39 -0.33 1.25 -2.30 -0.01 0.00 0.00 175.02 174.02 3hol n PRO 390 N 2.71 2.01 0.00 2.03 -0.02 -1.26 -4.89 135.00 135.58 3hol n PRO 390 Ca 0.07 0.71 0.13 0.00 -2.02 0.00 0.00 63.50 62.38 3hol n PRO 390 Cb 0.42 -2.29 0.40 0.00 -0.02 0.00 0.00 33.50 32.01 3hol n PRO 390 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3hol n LYS 391 N 0.46 0.34 -2.91 -0.52 5.02 -1.26 -4.89 118.16 114.40 3hol n LYS 391 Ca 0.06 -0.17 -0.02 0.00 -2.02 0.00 0.00 58.31 56.16 3hol n LYS 391 Cb 0.36 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.89 3hol n LYS 391 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hol n GLY 392 N 1.42 0.84 0.00 0.72 0.00 -1.26 -4.25 105.19 102.66 3hol n GLY 392 Ca 0.09 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 45.06 3hol n GLY 392 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hol n GLY 393 N -0.44 2.41 3.19 -0.02 0.00 -1.26 -4.62 105.19 104.45 3hol n GLY 393 Ca -0.01 -1.92 -0.31 0.00 0.00 0.00 0.00 46.02 43.78 3hol n GLY 393 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hol s ASN 394 N 0.00 2.84 0.05 1.61 3.84 -1.26 -1.73 114.94 120.29 3hol s ASN 394 Ca 0.00 -0.50 -0.00 0.00 0.21 0.00 0.00 52.86 52.57 3hol s ASN 394 Cb 0.00 -1.19 -0.04 0.00 -0.55 0.00 0.00 41.25 39.47 3hol s ASN 394 CO 0.00 0.15 -0.04 -0.31 -2.79 0.00 0.00 177.10 174.11 3hol s TYR 395 N 0.29 0.55 -0.15 0.43 2.02 0.55 -4.98 117.35 116.07 3hol s TYR 395 Ca -0.15 -0.91 -0.07 0.00 -0.37 0.00 0.00 57.07 55.57 3hol s TYR 395 Cb -0.17 -0.38 -0.04 0.00 -0.40 0.00 0.00 41.96 40.98 3hol s TYR 395 CO 0.07 -0.29 0.10 0.21 -1.57 0.00 0.00 175.55 174.08 3hol s LYS 396 N -3.31 3.65 0.02 -0.62 2.47 -1.26 -0.67 119.74 120.01 3hol s LYS 396 Ca 0.03 -0.23 0.08 0.00 -1.56 0.00 0.00 55.97 54.28 3hol s LYS 396 Cb 0.03 -3.19 -0.03 0.00 -1.46 0.00 0.00 37.83 33.19 3hol s LYS 396 CO -0.07 0.56 -0.25 0.71 0.16 0.00 0.00 175.35 176.46 3hol s TYR 397 N -0.41 2.38 -0.03 4.03 1.51 0.33 -0.76 117.35 124.39 3hol s TYR 397 Ca 0.11 -0.39 0.02 0.00 -1.01 0.00 0.00 57.07 55.80 3hol s TYR 397 Cb -0.12 -1.45 0.01 0.00 -0.11 0.00 0.00 41.96 40.29 3hol s TYR 397 CO 0.02 0.09 -0.09 0.42 -1.11 0.00 0.00 175.55 174.88 3hol s ILE 398 N -0.75 0.77 0.00 2.71 -1.09 -0.43 -0.70 121.20 121.71 3hol s ILE 398 Ca 0.11 -0.34 0.00 0.00 -2.23 0.00 0.00 60.65 58.20 3hol s ILE 398 Cb -0.10 -0.70 0.00 0.00 -1.58 0.00 0.00 42.46 40.08 3hol s ILE 398 CO 0.01 0.25 0.00 0.61 -1.23 0.00 0.00 174.94 174.58 3hol n GLY 399 N 3.41 3.08 0.76 6.18 0.00 -0.70 -1.14 105.19 116.79 3hol n GLY 399 Ca -0.19 -0.21 -0.04 0.00 0.00 0.00 0.00 46.02 45.58 3hol n GLY 399 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3hol n THR 400 N 0.00 0.00 -3.71 2.61 5.66 -0.91 -0.87 114.28 117.06 3hol n THR 400 Ca 0.00 -0.44 -0.10 0.00 -3.05 0.00 0.00 64.05 60.46 3hol n THR 400 Cb 0.00 0.26 -0.03 0.00 -1.55 0.00 0.00 70.33 69.01 3hol n THR 400 CO 0.00 0.00 0.00 -1.66 -3.05 0.00 0.00 175.07 170.36 3hol s TRP 401 N -3.98 -0.19 -0.02 1.09 1.48 -1.24 -2.55 118.94 113.54 3hol s TRP 401 Ca 0.07 -0.15 0.05 0.00 -1.06 0.00 0.00 56.10 55.01 3hol s TRP 401 Cb -0.00 0.46 -0.01 0.00 -1.16 0.00 0.00 33.47 32.76 3hol s TRP 401 CO 0.05 -0.95 -0.16 -0.51 -4.06 0.00 0.00 176.95 171.32 3hol s ASP 402 N -2.86 1.94 0.02 -2.66 1.01 -0.65 -2.04 116.67 111.43 3hol s ASP 402 Ca 0.08 -0.30 -0.28 0.00 0.71 0.00 0.00 52.55 52.76 3hol s ASP 402 Cb -0.02 -0.31 0.09 0.00 1.01 0.00 0.00 42.92 43.70 3hol s ASP 402 CO -0.03 0.18 0.79 0.00 0.21 0.00 0.00 175.17 176.32 3hol s ALA 403 N -0.26 -1.76 -0.03 5.23 0.00 -0.78 -0.60 121.76 123.56 3hol s ALA 403 Ca 0.04 0.98 0.01 0.00 0.00 0.00 0.00 51.96 52.99 3hol s ALA 403 Cb -0.08 0.34 0.01 0.00 0.00 0.00 0.00 23.12 23.40 3hol s ALA 403 CO 0.00 -0.61 -0.05 -1.14 0.00 0.00 0.00 175.76 173.96 3hol s GLN 404 N -2.75 0.63 -0.06 0.00 0.74 -0.36 -1.48 119.66 116.38 3hol s GLN 404 Ca 0.01 -0.13 0.05 0.00 0.05 0.00 0.00 55.36 55.33 3hol s GLN 404 Cb -0.01 -0.65 -0.00 0.00 1.10 0.00 0.00 33.01 33.45 3hol s GLN 404 CO -0.06 0.00 -0.21 0.08 -0.55 0.00 0.00 175.29 174.55 3hol s VAL 405 N 0.48 1.78 0.00 1.34 1.01 0.11 -1.51 120.40 123.61 3hol s VAL 405 Ca -0.06 -0.89 0.02 0.00 0.00 0.00 0.00 61.98 61.04 3hol s VAL 405 Cb -0.09 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.75 3hol s VAL 405 CO -0.00 0.50 -0.05 -0.44 0.00 0.00 0.00 175.10 175.11 3hol s SER 406 N 0.09 0.60 0.00 3.32 0.01 -0.19 -0.88 113.70 116.66 3hol s SER 406 Ca -0.08 -0.17 0.00 0.00 1.31 0.00 0.00 55.95 57.00 3hol s SER 406 Cb -0.14 -0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.05 3hol s SER 406 CO 0.04 0.01 0.00 0.29 0.41 0.00 0.00 173.24 173.99 3hol n LYS 407 N 2.68 0.00 0.10 12.44 4.76 -1.26 -0.51 118.16 136.36 3hol n LYS 407 Ca -0.15 0.00 -0.01 0.00 -2.87 0.00 0.00 58.31 55.28 3hol n LYS 407 Cb 0.58 0.00 0.25 0.00 -1.84 0.00 0.00 35.03 34.02 3hol n LYS 407 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 3hol h GLU 408 N 0.00 0.22 -5.77 1.97 3.07 -1.96 -3.46 114.58 108.65 3hol h GLU 408 Ca 0.00 -0.10 -0.59 0.00 -0.50 0.00 0.00 59.36 58.17 3hol h GLU 408 Cb 0.00 -0.01 -0.08 0.00 -0.84 0.00 0.00 28.75 27.82 3hol h GLU 408 CO 0.00 0.58 -0.45 -0.80 -1.40 0.00 0.00 179.01 176.93 3hol s ASN 409 N -6.88 4.41 0.14 1.42 0.01 -1.26 -5.16 114.94 107.62 3hol s ASN 409 Ca -0.04 -1.24 0.08 0.00 -0.71 0.00 0.00 52.86 50.95 3hol s ASN 409 Cb 0.14 -0.06 -0.04 0.00 0.41 0.00 0.00 41.25 41.69 3hol s ASN 409 CO 0.76 -0.74 -0.07 0.20 -1.51 0.00 0.00 177.10 175.74 3hol s ASN 410 N -3.99 4.48 -0.04 -1.22 0.01 -1.26 -4.39 114.94 108.52 3hol s ASN 410 Ca 0.33 -0.43 -0.07 0.00 -0.71 0.00 0.00 52.86 51.98 3hol s ASN 410 Cb 0.02 -0.86 0.01 0.00 0.41 0.00 0.00 41.25 40.83 3hol s ASN 410 CO 0.18 0.14 0.17 0.86 -1.51 0.00 0.00 177.10 176.94 3hol s TRP 411 N -1.48 -0.11 0.04 2.20 -0.00 -0.06 -4.77 118.94 114.77 3hol s TRP 411 Ca 0.24 0.26 0.02 0.00 -0.00 0.00 0.00 56.10 56.62 3hol s TRP 411 Cb -0.10 0.03 -0.02 0.00 -0.00 0.00 0.00 33.47 33.37 3hol s TRP 411 CO 0.15 -0.17 -0.08 0.14 -0.00 0.00 0.00 176.95 177.00 3hol s VAL 412 N -0.47 0.53 -0.15 5.86 -7.23 -1.26 -0.71 120.40 116.97 3hol s VAL 412 Ca -0.06 -0.99 -0.03 0.00 -1.81 0.00 0.00 61.98 59.09 3hol s VAL 412 Cb -0.04 -0.59 -0.02 0.00 0.56 0.00 0.00 36.38 36.29 3hol s VAL 412 CO 0.01 -0.33 -0.06 0.00 -0.31 0.00 0.00 175.10 174.40 3hol s ALA 413 N -1.25 2.88 -0.18 1.32 0.00 -0.55 -4.96 121.76 119.02 3hol s ALA 413 Ca -0.09 -0.85 0.01 0.00 0.00 0.00 0.00 51.96 51.03 3hol s ALA 413 Cb -0.09 -1.46 0.04 0.00 0.00 0.00 0.00 23.12 21.60 3hol s ALA 413 CO 0.00 0.20 -0.12 0.99 0.00 0.00 0.00 175.76 176.83 3hol s THR 414 N 0.40 1.69 0.02 0.00 2.01 -1.26 -1.87 115.64 116.63 3hol s THR 414 Ca -0.06 -0.92 -0.38 0.00 0.31 0.00 0.00 61.69 60.64 3hol s THR 414 Cb -0.15 -1.69 -0.18 0.00 0.01 0.00 0.00 72.50 70.50 3hol s THR 414 CO 0.04 0.28 1.29 0.00 -0.69 0.00 0.00 174.62 175.53 3hol n ALA 415 N 4.69 -1.79 -2.99 7.40 0.00 -0.86 -4.77 120.51 122.19 3hol n ALA 415 Ca -0.16 0.54 -0.10 0.00 0.00 0.00 0.00 53.44 53.71 3hol n ALA 415 Cb 0.48 -1.98 -0.06 0.00 0.00 0.00 0.00 19.45 17.89 3hol n ALA 415 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 3hol s ASP 416 N 0.59 0.13 -0.06 0.00 1.47 -1.26 -4.94 116.67 112.59 3hol s ASP 416 Ca 0.88 -1.10 0.11 0.00 1.18 0.00 0.00 52.55 53.61 3hol s ASP 416 Cb -1.08 0.57 0.27 0.00 -0.34 0.00 0.00 42.92 42.35 3hol s ASP 416 CO 0.52 -1.13 1.21 -0.90 0.68 0.00 0.00 175.17 175.55 3hol n ASP 417 N -0.57 2.81 -4.56 2.11 5.75 -1.26 -4.77 116.55 116.07 3hol n ASP 417 Ca -0.01 -2.42 -0.39 0.00 -0.01 0.00 0.00 54.79 51.96 3hol n ASP 417 Cb 0.62 -0.28 -0.03 0.00 -1.03 0.00 0.00 41.12 40.41 3hol n ASP 417 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3hol s ASP 418 N -1.53 6.20 0.00 -1.12 -1.08 -1.26 -4.85 116.67 113.03 3hol s ASP 418 Ca 0.23 -1.04 0.17 0.00 -0.52 0.00 0.00 52.55 51.39 3hol s ASP 418 Cb 0.17 -2.56 0.84 0.00 -1.46 0.00 0.00 42.92 39.90 3hol s ASP 418 CO 0.08 -1.77 1.52 0.54 0.52 0.00 0.00 175.17 176.06 3hol n ARG 419 N 9.01 0.18 -0.13 4.34 1.74 -1.26 -0.10 116.66 130.45 3hol n ARG 419 Ca 0.26 0.14 -0.22 0.00 -0.77 0.00 0.00 57.85 57.26 3hol n ARG 419 Cb 0.50 -1.50 -0.11 0.00 -1.02 0.00 0.00 32.46 30.33 3hol n ARG 419 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3hol n LYS 420 N -1.34 0.61 0.00 5.56 5.02 -1.26 -4.78 118.16 121.97 3hol n LYS 420 Ca 0.07 0.19 0.00 0.00 -2.02 0.00 0.00 58.31 56.55 3hol n LYS 420 Cb 0.15 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 3hol n LYS 420 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hol n ALA 421 N -3.64 1.87 -1.23 7.82 0.00 -1.20 -4.94 120.51 119.19 3hol n ALA 421 Ca -0.48 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 52.69 3hol n ALA 421 Cb 0.94 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.39 3hol n ALA 421 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hol n GLY 422 N 0.27 0.36 3.07 0.00 0.00 0.86 0.16 105.19 109.91 3hol n GLY 422 Ca 0.00 -1.67 -0.43 0.00 0.00 0.00 0.00 46.02 43.92 3hol n GLY 422 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3hol n TYR 423 N 0.00 3.91 -2.76 1.61 4.01 -1.26 -3.86 117.16 118.80 3hol n TYR 423 Ca 0.00 -2.95 -0.33 0.00 -0.16 0.00 0.00 57.90 54.46 3hol n TYR 423 Cb 0.00 -2.43 -0.06 0.00 -0.31 0.00 0.00 39.34 36.54 3hol n TYR 423 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 3hol s ARG 424 N 2.79 4.18 0.09 -0.72 0.52 -1.25 -3.60 118.95 120.95 3hol s ARG 424 Ca 0.47 1.18 0.06 0.00 -0.52 0.00 0.00 55.73 56.93 3hol s ARG 424 Cb 0.09 -2.21 -0.03 0.00 0.52 0.00 0.00 34.95 33.31 3hol s ARG 424 CO -0.01 -0.08 -0.17 0.95 0.02 0.00 0.00 175.30 176.00 3hol s THR 425 N -2.10 1.36 -0.02 0.02 -4.23 -0.05 -0.86 115.64 109.77 3hol s THR 425 Ca 0.62 -1.44 -0.05 0.00 -1.18 0.00 0.00 61.69 59.64 3hol s THR 425 Cb -0.11 -1.30 0.01 0.00 1.34 0.00 0.00 72.50 72.43 3hol s THR 425 CO 0.15 -0.18 0.12 -1.61 -0.54 0.00 0.00 174.62 172.56 3hol s GLU 426 N -1.91 0.29 -0.03 3.99 2.02 -0.57 -1.72 118.70 120.77 3hol s GLU 426 Ca 0.02 -0.10 -0.02 0.00 0.02 0.00 0.00 54.97 54.89 3hol s GLU 426 Cb -0.09 0.12 0.01 0.00 0.10 0.00 0.00 34.13 34.27 3hol s GLU 426 CO 0.03 -0.06 0.07 -0.06 0.02 0.00 0.00 175.26 175.26 3hol s PHE 427 N -0.60 -0.07 -0.21 1.61 0.08 0.12 -0.32 117.98 118.59 3hol s PHE 427 Ca -0.07 0.19 -0.08 0.00 0.12 0.00 0.00 56.93 57.09 3hol s PHE 427 Cb -0.04 0.01 -0.04 0.00 -0.57 0.00 0.00 43.02 42.38 3hol s PHE 427 CO 0.01 -0.04 0.08 -0.51 -0.10 0.00 0.00 175.22 174.65 3hol s ASP 428 N 0.12 5.62 -0.13 1.36 1.01 -0.35 -0.51 116.67 123.79 3hol s ASP 428 Ca -0.01 0.03 0.02 0.00 0.71 0.00 0.00 52.55 53.30 3hol s ASP 428 Cb -0.01 -1.98 0.02 0.00 1.01 0.00 0.00 42.92 41.95 3hol s ASP 428 CO -0.00 0.11 -0.17 -0.69 0.21 0.00 0.00 175.17 174.63 3hol s VAL 429 N 0.74 1.73 -0.47 -1.27 1.01 0.15 -1.50 120.40 120.78 3hol s VAL 429 Ca 0.04 -0.76 -0.00 0.00 0.00 0.00 0.00 61.98 61.26 3hol s VAL 429 Cb -0.13 -1.57 0.13 0.00 0.00 0.00 0.00 36.38 34.80 3hol s VAL 429 CO 0.02 0.49 0.25 -0.62 0.00 0.00 0.00 175.10 175.23 3hol s ASP 430 N 1.09 4.96 0.29 3.32 -1.08 0.11 -0.33 116.67 125.03 3hol s ASP 430 Ca -0.03 -2.48 0.00 0.00 -0.52 0.00 0.00 52.55 49.53 3hol s ASP 430 Cb -0.14 -1.76 0.45 0.00 -1.46 0.00 0.00 42.92 40.01 3hol s ASP 430 CO -0.05 -0.40 1.84 -0.26 0.52 0.00 0.00 175.17 176.82 3hol h PHE 431 N 7.37 0.77 -0.03 -5.34 0.04 -1.57 0.67 116.94 118.86 3hol h PHE 431 Ca -0.07 -0.07 0.03 0.00 2.80 0.00 0.00 57.97 60.66 3hol h PHE 431 Cb 0.98 -0.22 -0.04 0.00 2.20 0.00 0.00 35.95 38.87 3hol h PHE 431 CO 0.57 0.67 -0.22 0.78 -0.60 0.00 0.00 178.31 179.51 3hol h GLY 432 N 0.93 -0.29 -1.68 -1.45 0.00 -1.74 -2.84 103.07 96.00 3hol h GLY 432 Ca 0.16 0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.75 3hol h GLY 432 CO 0.00 -0.19 0.00 0.70 0.00 0.00 0.00 176.54 177.05 3hol n ASN 433 N -5.35 2.65 -2.96 0.19 4.13 -1.22 -4.96 115.26 107.75 3hol n ASN 433 Ca -0.04 -1.90 -0.18 0.00 1.68 0.00 0.00 54.58 54.14 3hol n ASN 433 Cb 0.26 -0.22 0.07 0.00 -1.54 0.00 0.00 39.78 38.34 3hol n ASN 433 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 3hol n LYS 434 N 0.96 -6.16 -4.71 3.52 4.01 -0.33 -4.95 118.16 110.49 3hol n LYS 434 Ca 0.18 0.66 -0.26 0.00 -0.51 0.00 0.00 58.31 58.38 3hol n LYS 434 Cb 0.47 -5.20 -0.14 0.00 -0.51 0.00 0.00 35.03 29.65 3hol n LYS 434 CO 0.00 0.00 0.00 -0.80 -1.11 0.00 0.00 177.40 175.49 3hol s ASN 435 N -3.42 2.59 -0.04 4.39 0.01 0.08 -1.49 114.94 117.06 3hol s ASN 435 Ca 0.37 -0.53 -0.03 0.00 -0.71 0.00 0.00 52.86 51.96 3hol s ASN 435 Cb -0.17 -0.22 0.02 0.00 0.41 0.00 0.00 41.25 41.29 3hol s ASN 435 CO 0.58 0.18 0.11 -0.22 -1.51 0.00 0.00 177.10 176.25 3hol s LEU 436 N -1.15 1.41 0.09 0.60 0.20 -1.13 0.05 118.68 118.75 3hol s LEU 436 Ca 0.08 0.22 0.01 0.00 0.69 0.00 0.00 54.13 55.14 3hol s LEU 436 Cb -0.09 0.35 -0.04 0.00 -0.43 0.00 0.00 46.19 45.98 3hol s LEU 436 CO 0.02 -0.06 -0.06 -0.94 -0.29 0.00 0.00 176.35 175.02 3hol s SER 437 N 0.30 1.04 0.22 3.68 1.04 -0.56 -1.91 113.70 117.51 3hol s SER 437 Ca -0.02 -1.00 -0.14 0.00 0.48 0.00 0.00 55.95 55.28 3hol s SER 437 Cb -0.03 0.11 0.00 0.00 0.10 0.00 0.00 66.02 66.20 3hol s SER 437 CO -0.01 -0.48 0.46 -0.83 0.98 0.00 0.00 173.24 173.36 3hol s GLY 438 N -3.00 0.34 -0.02 7.32 0.00 -0.27 -1.21 107.32 110.49 3hol s GLY 438 Ca 0.11 -0.69 0.01 0.00 0.00 0.00 0.00 44.72 44.14 3hol s GLY 438 CO -0.05 -0.56 -0.02 0.54 0.00 0.00 0.00 173.10 173.01 3hol s LYS 439 N -3.97 0.30 -0.07 2.90 1.02 0.56 -1.59 119.74 118.89 3hol s LYS 439 Ca 0.18 -0.03 0.03 0.00 0.02 0.00 0.00 55.97 56.17 3hol s LYS 439 Cb -0.00 -0.38 0.01 0.00 -0.52 0.00 0.00 37.83 36.94 3hol s LYS 439 CO 0.04 -0.03 -0.16 -0.51 -0.92 0.00 0.00 175.35 173.77 3hol s LEU 440 N 0.47 1.81 0.05 3.17 1.02 -0.13 -1.52 118.68 123.55 3hol s LEU 440 Ca -0.05 -0.39 0.06 0.00 0.02 0.00 0.00 54.13 53.77 3hol s LEU 440 Cb -0.08 -1.02 -0.04 0.00 0.02 0.00 0.00 46.19 45.07 3hol s LEU 440 CO -0.01 0.09 -0.11 -0.36 0.02 0.00 0.00 176.35 175.98 3hol s PHE 441 N 0.49 2.75 0.58 0.29 0.08 -0.04 -1.11 117.98 121.02 3hol s PHE 441 Ca -0.15 -0.14 -0.13 0.00 0.12 0.00 0.00 56.93 56.63 3hol s PHE 441 Cb -0.16 -1.51 -0.05 0.00 -0.57 0.00 0.00 43.02 40.73 3hol s PHE 441 CO 0.05 0.36 1.02 0.34 -0.10 0.00 0.00 175.22 176.89 3hol s ASP 442 N -1.68 6.28 0.31 1.36 2.15 -1.26 -3.81 116.67 120.01 3hol s ASP 442 Ca 0.18 1.52 -0.29 0.00 0.43 0.00 0.00 52.55 54.39 3hol s ASP 442 Cb -0.11 -2.49 -0.11 0.00 -0.30 0.00 0.00 42.92 39.91 3hol s ASP 442 CO 0.09 -0.83 1.44 -1.59 -0.17 0.00 0.00 175.17 174.10 3hol s LYS 443 N -4.67 4.23 -0.23 4.34 -2.85 -1.25 -1.74 119.74 117.57 3hol s LYS 443 Ca 0.57 2.38 0.00 0.00 -1.00 0.00 0.00 55.97 57.92 3hol s LYS 443 Cb -0.11 -3.05 0.00 0.00 -2.06 0.00 0.00 37.83 32.60 3hol s LYS 443 CO 0.44 -0.41 0.00 0.09 0.10 0.00 0.00 175.35 175.57 3hol n ASN 444 N 1.46 -5.42 -4.73 0.03 3.02 0.12 -4.96 115.26 104.78 3hol n ASN 444 Ca 0.04 0.05 -0.41 0.00 -0.03 0.00 0.00 54.58 54.23 3hol n ASN 444 Cb 0.40 -3.11 -0.04 0.00 -0.61 0.00 0.00 39.78 36.41 3hol n ASN 444 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3hol s GLY 445 N -2.10 2.96 -0.09 7.41 0.00 -0.71 -4.96 107.32 109.82 3hol s GLY 445 Ca 0.00 0.66 -0.20 0.00 0.00 0.00 0.00 44.72 45.17 3hol s GLY 445 CO 0.00 1.49 0.70 -2.08 0.00 0.00 0.00 173.10 173.21 3hol h VAL 446 N 3.84 1.08 -2.97 1.40 2.07 -1.93 -3.47 116.25 116.27 3hol h VAL 446 Ca -0.44 -1.56 -0.61 0.00 0.82 0.00 0.00 66.70 64.92 3hol h VAL 446 Cb 1.21 1.94 -0.10 0.00 -1.52 0.00 0.00 31.29 32.83 3hol h VAL 446 CO 0.72 0.33 -0.62 0.20 0.02 0.00 0.00 177.57 178.21 3hol s ASN 447 N -5.78 5.18 0.53 0.57 0.02 -1.26 -5.09 114.94 109.12 3hol s ASN 447 Ca -0.13 -0.20 -0.19 0.00 -1.02 0.00 0.00 52.86 51.32 3hol s ASN 447 Cb -0.01 -1.26 -0.06 0.00 0.02 0.00 0.00 41.25 39.93 3hol s ASN 447 CO 0.48 0.11 1.06 -2.16 0.02 0.00 0.00 177.10 176.62 3hol s PRO 448 N -2.77 3.55 0.17 -0.60 0.04 -1.26 -4.71 135.00 129.42 3hol s PRO 448 Ca 0.28 1.36 0.08 0.00 0.04 0.00 0.00 61.00 62.77 3hol s PRO 448 Cb -0.11 -2.06 -0.03 0.00 0.04 0.00 0.00 34.50 32.35 3hol s PRO 448 CO 0.21 -0.64 1.38 -0.39 0.04 0.00 0.00 177.00 177.60 3hol h VAL 449 N 1.11 1.62 -4.06 -0.36 -1.51 -1.47 -3.45 116.25 108.14 3hol h VAL 449 Ca -0.49 -3.01 -0.46 0.00 -1.23 0.00 0.00 66.70 61.51 3hol h VAL 449 Cb 1.23 2.63 -0.25 0.00 -2.13 0.00 0.00 31.29 32.77 3hol h VAL 449 CO 0.58 0.86 -0.80 -0.36 -1.23 0.00 0.00 177.57 176.62 3hol s PHE 450 N -2.99 1.27 0.24 5.19 0.08 -1.05 -4.36 117.98 116.36 3hol s PHE 450 Ca 0.00 -0.34 0.11 0.00 0.12 0.00 0.00 56.93 56.82 3hol s PHE 450 Cb 0.11 -0.76 -0.05 0.00 -0.57 0.00 0.00 43.02 41.75 3hol s PHE 450 CO 0.80 0.03 -0.15 0.95 -0.10 0.00 0.00 175.22 176.75 3hol s THR 451 N -0.80 2.78 -0.01 0.64 -4.23 -0.40 -0.96 115.64 112.67 3hol s THR 451 Ca 0.02 -2.09 0.05 0.00 -1.18 0.00 0.00 61.69 58.49 3hol s THR 451 Cb -0.08 -2.42 -0.01 0.00 1.34 0.00 0.00 72.50 71.33 3hol s THR 451 CO 0.01 -0.28 -0.15 -0.69 -0.54 0.00 0.00 174.62 172.97 3hol s VAL 452 N -2.14 1.20 -0.12 2.29 1.01 -0.62 -1.82 120.40 120.20 3hol s VAL 452 Ca 0.27 -0.66 -0.04 0.00 0.00 0.00 0.00 61.98 61.56 3hol s VAL 452 Cb -0.07 -1.00 0.05 0.00 0.00 0.00 0.00 36.38 35.37 3hol s VAL 452 CO 0.15 0.34 0.12 -0.62 0.00 0.00 0.00 175.10 175.08 3hol s ASP 453 N -0.37 1.54 0.19 3.32 2.15 -0.71 -1.11 116.67 121.69 3hol s ASP 453 Ca 0.06 -0.17 0.01 0.00 0.43 0.00 0.00 52.55 52.88 3hol s ASP 453 Cb -0.06 -0.01 -0.00 0.00 -0.30 0.00 0.00 42.92 42.55 3hol s ASP 453 CO -0.01 -0.30 0.23 -0.81 -0.17 0.00 0.00 175.17 174.11 3hol n PRO 454 N 5.30 0.33 -4.40 4.34 -0.04 -0.80 -2.33 135.00 137.40 3hol n PRO 454 Ca -0.05 -1.68 -0.30 0.00 -0.04 0.00 0.00 63.50 61.43 3hol n PRO 454 Cb 0.50 1.52 -0.12 0.00 -0.04 0.00 0.00 33.50 35.35 3hol n PRO 454 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3hol s LYS 455 N -2.57 1.89 -0.22 0.54 -0.14 -0.61 -2.82 119.74 115.81 3hol s LYS 455 Ca 0.19 -1.11 -0.13 0.00 -1.36 0.00 0.00 55.97 53.55 3hol s LYS 455 Cb 0.00 -2.15 -0.04 0.00 -1.68 0.00 0.00 37.83 33.96 3hol s LYS 455 CO 0.13 0.50 0.28 0.42 -0.76 0.00 0.00 175.35 175.92 3hol s ILE 456 N -1.08 5.28 -0.16 2.17 1.01 -0.55 -2.20 121.20 125.66 3hol s ILE 456 Ca 0.17 0.45 0.00 0.00 0.00 0.00 0.00 60.65 61.28 3hol s ILE 456 Cb -0.11 -3.62 0.03 0.00 0.01 0.00 0.00 42.46 38.78 3hol s ILE 456 CO 0.09 0.30 -0.11 -0.62 0.00 0.00 0.00 174.94 174.60 3hol s ASP 457 N 1.01 2.83 1.13 3.58 2.15 0.23 -4.85 116.67 122.75 3hol s ASP 457 Ca 0.14 -0.59 0.00 0.00 0.43 0.00 0.00 52.55 52.52 3hol s ASP 457 Cb -0.14 -1.12 0.00 0.00 -0.30 0.00 0.00 42.92 41.36 3hol s ASP 457 CO 0.06 -0.10 0.00 0.61 -0.17 0.00 0.00 175.17 175.57 3hol n GLY 458 N 4.78 3.33 1.65 2.66 0.00 -1.26 -1.98 105.19 114.38 3hol n GLY 458 Ca -0.15 0.15 0.06 0.00 0.00 0.00 0.00 46.02 46.07 3hol n GLY 458 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3hol n ASN 459 N 5.12 4.90 -3.63 1.61 0.23 -1.26 -4.95 115.26 117.29 3hol n ASN 459 Ca 0.00 -2.76 -0.16 0.00 -0.53 0.00 0.00 54.58 51.13 3hol n ASN 459 Cb 0.00 -0.65 -0.08 0.00 -2.08 0.00 0.00 39.78 36.97 3hol n ASN 459 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 3hol s GLY 460 N -0.64 1.83 0.05 4.83 0.00 -0.84 -1.13 107.32 111.42 3hol s GLY 460 Ca 0.45 -1.81 -0.08 0.00 0.00 0.00 0.00 44.72 43.28 3hol s GLY 460 CO 0.13 -1.33 0.16 -0.11 0.00 0.00 0.00 173.10 171.96 3hol s PHE 461 N -3.63 0.12 0.01 1.90 -0.12 -0.56 -0.60 117.98 115.10 3hol s PHE 461 Ca 0.38 -0.40 -0.16 0.00 -0.05 0.00 0.00 56.93 56.69 3hol s PHE 461 Cb 0.03 -0.07 0.03 0.00 -0.63 0.00 0.00 43.02 42.38 3hol s PHE 461 CO 0.21 -0.43 0.35 0.95 -0.05 0.00 0.00 175.22 176.25 3hol s THR 462 N -2.82 0.06 -0.21 -4.49 -4.23 -0.93 -1.38 115.64 101.62 3hol s THR 462 Ca -0.03 -0.49 0.00 0.00 -1.18 0.00 0.00 61.69 59.99 3hol s THR 462 Cb 0.00 -0.78 0.00 0.00 1.34 0.00 0.00 72.50 73.06 3hol s THR 462 CO -0.05 -0.27 0.00 0.61 -0.54 0.00 0.00 174.62 174.36 3hol n GLY 463 N 0.94 -0.94 2.96 3.99 0.00 -0.16 -1.58 105.19 110.41 3hol n GLY 463 Ca -0.20 -0.09 -0.14 0.00 0.00 0.00 0.00 46.02 45.60 3hol n GLY 463 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hol s LYS 464 N -0.29 0.34 0.06 1.61 -0.14 -0.98 -1.17 119.74 119.17 3hol s LYS 464 Ca 0.00 -0.32 0.05 0.00 -1.36 0.00 0.00 55.97 54.34 3hol s LYS 464 Cb 0.00 -0.24 -0.04 0.00 -1.68 0.00 0.00 37.83 35.87 3hol s LYS 464 CO 0.00 0.06 -0.05 0.00 -0.76 0.00 0.00 175.35 174.59 3hol s ALA 465 N -0.52 3.09 0.19 5.17 0.00 0.21 -1.73 121.76 128.16 3hol s ALA 465 Ca -0.03 -1.11 -0.14 0.00 0.00 0.00 0.00 51.96 50.68 3hol s ALA 465 Cb -0.04 -1.09 0.01 0.00 0.00 0.00 0.00 23.12 22.00 3hol s ALA 465 CO -0.00 0.65 0.44 -1.59 0.00 0.00 0.00 175.76 175.26 3hol s LYS 466 N -1.91 1.30 0.56 0.00 -2.85 -0.75 -2.00 119.74 114.09 3hol s LYS 466 Ca 0.21 -0.98 0.03 0.00 -1.00 0.00 0.00 55.97 54.22 3hol s LYS 466 Cb -0.11 0.47 0.05 0.00 -2.06 0.00 0.00 37.83 36.18 3hol s LYS 466 CO 0.13 -0.53 0.78 0.95 0.10 0.00 0.00 175.35 176.77 3hol s THR 467 N -3.91 2.59 1.20 3.79 -4.23 -0.18 -1.27 115.64 113.63 3hol s THR 467 Ca 0.12 -0.74 -0.17 0.00 -1.18 0.00 0.00 61.69 59.72 3hol s THR 467 Cb 0.01 -2.85 0.23 0.00 1.34 0.00 0.00 72.50 71.23 3hol s THR 467 CO -0.02 0.00 0.54 -1.54 -0.54 0.00 0.00 174.62 173.06 3hol n SER 468 N -2.33 -2.54 -0.18 3.99 3.41 -1.26 -4.82 113.62 109.88 3hol n SER 468 Ca 0.10 -0.30 -0.07 0.00 -0.26 0.00 0.00 58.87 58.33 3hol n SER 468 Cb 0.60 -1.05 0.02 0.00 -0.26 0.00 0.00 64.21 63.52 3hol n SER 468 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 3hol h ASP 469 N -2.65 0.64 1.11 4.04 3.58 -1.99 -2.71 116.42 118.45 3hol h ASP 469 Ca -0.53 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 56.86 3hol h ASP 469 Cb 1.29 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 42.18 3hol h ASP 469 CO 0.38 0.51 0.00 0.00 -2.88 0.00 0.00 179.24 177.26 3hol n ALA 470 N -2.27 2.09 -0.48 -0.78 0.00 -1.26 -5.02 120.51 112.80 3hol n ALA 470 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.45 3hol n ALA 470 Cb 0.05 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.08 3hol n ALA 470 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hol n GLY 471 N 0.93 -0.69 3.08 0.00 0.00 -1.03 -4.71 105.19 102.77 3hol n GLY 471 Ca 0.05 -1.12 -0.08 0.00 0.00 0.00 0.00 46.02 44.87 3hol n GLY 471 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3hol s PHE 472 N 0.00 0.41 -0.06 1.61 -0.12 -0.76 -4.80 117.98 114.26 3hol s PHE 472 Ca 0.00 -0.88 -0.23 0.00 -0.05 0.00 0.00 56.93 55.77 3hol s PHE 472 Cb 0.00 -0.30 -0.04 0.00 -0.63 0.00 0.00 43.02 42.05 3hol s PHE 472 CO 0.00 -0.35 0.69 0.00 -0.05 0.00 0.00 175.22 175.51 3hol s ALA 473 N -3.30 3.36 0.19 1.99 0.00 -1.26 -0.59 121.76 122.15 3hol s ALA 473 Ca 0.01 0.12 0.02 0.00 0.00 0.00 0.00 51.96 52.11 3hol s ALA 473 Cb 0.03 -2.93 0.09 0.00 0.00 0.00 0.00 23.12 20.31 3hol s ALA 473 CO -0.08 -0.06 1.45 -0.07 0.00 0.00 0.00 175.76 177.00 3hol h LEU 474 N 6.59 0.33 -8.33 0.00 3.38 -1.93 -3.39 115.31 111.95 3hol h LEU 474 Ca -0.42 -0.23 -0.69 0.00 0.09 0.00 0.00 57.88 56.64 3hol h LEU 474 Cb 1.20 -0.10 -0.26 0.00 0.09 0.00 0.00 40.66 41.59 3hol h LEU 474 CO 0.75 0.96 -0.57 -0.62 0.09 0.00 0.00 178.44 179.05 3hol s ASP 475 N -6.94 5.44 0.00 -0.43 2.15 -1.26 -4.58 116.67 111.06 3hol s ASP 475 Ca -0.04 -0.93 0.16 0.00 0.43 0.00 0.00 52.55 52.17 3hol s ASP 475 Cb 0.11 -1.94 0.78 0.00 -0.30 0.00 0.00 42.92 41.57 3hol s ASP 475 CO 0.82 -0.30 1.49 -1.20 -0.17 0.00 0.00 175.17 175.80 3hol n SER 476 N 4.90 0.00 -0.10 -0.34 7.64 -1.26 -2.95 113.62 121.51 3hol n SER 476 Ca -0.13 0.18 -0.14 0.00 1.01 0.00 0.00 58.87 59.79 3hol n SER 476 Cb 0.46 -0.35 -0.14 0.00 -1.01 0.00 0.00 64.21 63.18 3hol n SER 476 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3hol n GLY 477 N 0.12 -0.67 3.90 0.23 0.00 -1.26 -5.01 105.19 102.50 3hol n GLY 477 Ca 0.07 -0.24 -0.34 0.00 0.00 0.00 0.00 46.02 45.51 3hol n GLY 477 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hol s SER 478 N -6.12 6.38 -0.16 1.61 0.01 -1.15 -4.98 113.70 109.29 3hol s SER 478 Ca -0.22 0.38 0.12 0.00 1.31 0.00 0.00 55.95 57.53 3hol s SER 478 Cb 0.08 -2.02 0.63 0.00 0.21 0.00 0.00 66.02 64.92 3hol s SER 478 CO 0.72 0.28 1.47 -0.24 0.41 0.00 0.00 173.24 175.88 3hol n SER 479 N 1.10 4.50 -0.18 2.44 2.88 -1.26 -4.71 113.62 118.39 3hol n SER 479 Ca -0.12 -2.63 -0.03 0.00 -1.33 0.00 0.00 58.87 54.76 3hol n SER 479 Cb 0.53 -0.61 0.07 0.00 -0.75 0.00 0.00 64.21 63.45 3hol n SER 479 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 3hol h ARG 480 N 3.17 0.48 -5.99 -1.46 2.43 -1.93 -3.45 114.38 107.62 3hol h ARG 480 Ca 0.00 -0.03 -0.61 0.00 -0.81 0.00 0.00 59.98 58.53 3hol h ARG 480 Cb 1.54 -0.11 -0.13 0.00 -0.42 0.00 0.00 29.97 30.85 3hol h ARG 480 CO 0.33 0.32 -0.69 0.71 -1.51 0.00 0.00 179.97 179.13 3hol s TYR 481 N -6.11 2.40 0.65 2.20 2.02 -1.26 -5.12 117.35 112.13 3hol s TYR 481 Ca -0.13 -0.46 -0.18 0.00 -0.37 0.00 0.00 57.07 55.93 3hol s TYR 481 Cb 0.15 -1.32 -0.01 0.00 -0.40 0.00 0.00 41.96 40.38 3hol s TYR 481 CO 0.74 0.60 1.27 -1.21 -1.57 0.00 0.00 175.55 175.38 3hol s GLU 482 N -3.60 2.55 0.42 -0.62 2.02 -1.26 -4.96 118.70 113.25 3hol s GLU 482 Ca 0.32 1.98 -0.26 0.00 0.02 0.00 0.00 54.97 57.04 3hol s GLU 482 Cb 0.01 -1.86 -0.09 0.00 0.10 0.00 0.00 34.13 32.30 3hol s GLU 482 CO 0.17 -1.58 1.36 -0.80 0.02 0.00 0.00 175.26 174.43 3hol s ASN 483 N -1.52 6.12 0.37 -0.19 0.01 -1.26 -4.80 114.94 113.67 3hol s ASN 483 Ca 0.81 2.78 -0.27 0.00 -0.71 0.00 0.00 52.86 55.47 3hol s ASN 483 Cb -0.35 -2.65 -0.09 0.00 0.41 0.00 0.00 41.25 38.57 3hol s ASN 483 CO 0.39 -1.00 1.22 0.68 -1.51 0.00 0.00 177.10 176.89 3hol s VAL 484 N -1.23 2.97 0.01 1.60 -7.23 0.25 -4.72 120.40 112.05 3hol s VAL 484 Ca 0.59 0.88 0.04 0.00 -1.81 0.00 0.00 61.98 61.68 3hol s VAL 484 Cb -0.41 -3.52 -0.02 0.00 0.56 0.00 0.00 36.38 33.00 3hol s VAL 484 CO 0.53 0.14 -0.14 -0.54 -0.31 0.00 0.00 175.10 174.77 3hol s LYS 485 N -2.09 1.02 -0.02 4.82 1.02 -1.26 -1.83 119.74 121.40 3hol s LYS 485 Ca 0.54 -0.61 0.02 0.00 0.02 0.00 0.00 55.97 55.95 3hol s LYS 485 Cb -0.34 -1.00 -0.00 0.00 -0.52 0.00 0.00 37.83 35.96 3hol s LYS 485 CO 0.44 0.26 -0.08 -0.06 -0.92 0.00 0.00 175.35 175.00 3hol s PHE 486 N -0.56 0.76 0.06 3.18 0.08 -1.26 -4.87 117.98 115.37 3hol s PHE 486 Ca 0.04 -0.16 0.04 0.00 0.12 0.00 0.00 56.93 56.96 3hol s PHE 486 Cb -0.06 -0.53 -0.03 0.00 -0.57 0.00 0.00 43.02 41.83 3hol s PHE 486 CO 0.00 -0.05 -0.11 -0.80 -0.10 0.00 0.00 175.22 174.16 3hol s ASN 487 N 0.04 1.24 -1.48 1.36 0.01 -1.26 -1.01 114.94 113.85 3hol s ASN 487 Ca -0.00 -0.59 -0.02 0.00 -0.71 0.00 0.00 52.86 51.53 3hol s ASN 487 Cb -0.06 -0.00 0.01 0.00 0.41 0.00 0.00 41.25 41.61 3hol s ASN 487 CO -0.00 -0.15 0.22 0.47 -1.51 0.00 0.00 177.10 176.13 3hol n ASP 488 N 1.33 -5.20 -4.69 -1.22 8.00 -1.20 -4.95 116.55 108.63 3hol n ASP 488 Ca -0.22 -0.08 -0.42 0.00 0.71 0.00 0.00 54.79 54.78 3hol n ASP 488 Cb 0.55 -4.30 -0.03 0.00 -0.02 0.00 0.00 41.12 37.32 3hol n ASP 488 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3hol s VAL 489 N -2.96 4.54 0.22 2.53 1.01 -0.85 -4.86 120.40 120.04 3hol s VAL 489 Ca 0.13 1.83 -0.31 0.00 0.00 0.00 0.00 61.98 63.64 3hol s VAL 489 Cb -0.06 -4.18 -0.11 0.00 0.00 0.00 0.00 36.38 32.03 3hol s VAL 489 CO 0.16 -0.01 1.58 0.00 0.00 0.00 0.00 175.10 176.83 3hol s ALA 490 N 2.18 3.77 -0.02 5.51 0.00 -1.26 0.63 121.76 132.58 3hol s ALA 490 Ca 0.51 1.46 0.06 0.00 0.00 0.00 0.00 51.96 53.99 3hol s ALA 490 Cb -0.21 -3.63 -0.01 0.00 0.00 0.00 0.00 23.12 19.27 3hol s ALA 490 CO 0.19 -0.86 -0.19 0.08 0.00 0.00 0.00 175.76 174.98 3hol s VAL 491 N 0.62 1.51 0.05 0.00 1.01 -0.32 -4.20 120.40 119.07 3hol s VAL 491 Ca 0.67 -0.82 -0.09 0.00 0.00 0.00 0.00 61.98 61.74 3hol s VAL 491 Cb -0.46 -1.26 0.00 0.00 0.00 0.00 0.00 36.38 34.67 3hol s VAL 491 CO 0.38 0.43 0.19 -0.94 0.00 0.00 0.00 175.10 175.16 3hol s SER 492 N -0.42 0.05 0.00 3.32 1.04 -1.00 -0.99 113.70 115.70 3hol s SER 492 Ca 0.07 -0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.08 3hol s SER 492 Cb -0.08 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.34 3hol s SER 492 CO -0.01 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 174.24 3hol n GLY 493 N 0.55 0.84 3.55 7.32 0.00 -0.48 -1.35 105.19 115.63 3hol n GLY 493 Ca -0.18 -0.80 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 3hol n GLY 493 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hol s GLY 494 N -2.16 1.05 -0.15 -0.02 0.00 -0.26 -1.50 107.32 104.29 3hol s GLY 494 Ca 0.00 -1.23 -0.06 0.00 0.00 0.00 0.00 44.72 43.43 3hol s GLY 494 CO 0.00 -0.81 0.07 -1.36 0.00 0.00 0.00 173.10 171.00 3hol s PHE 495 N -3.30 3.32 0.05 1.90 0.08 -0.28 -1.84 117.98 117.90 3hol s PHE 495 Ca 0.26 0.22 0.07 0.00 0.12 0.00 0.00 56.93 57.61 3hol s PHE 495 Cb -0.01 -1.98 -0.03 0.00 -0.57 0.00 0.00 43.02 40.43 3hol s PHE 495 CO 0.15 0.38 -0.20 0.71 -0.10 0.00 0.00 175.22 176.16 3hol s TYR 496 N -0.26 1.74 0.00 0.36 2.02 0.11 -0.16 117.35 121.16 3hol s TYR 496 Ca 0.09 -0.38 0.00 0.00 -0.37 0.00 0.00 57.07 56.41 3hol s TYR 496 Cb -0.12 -1.03 0.00 0.00 -0.40 0.00 0.00 41.96 40.41 3hol s TYR 496 CO 0.01 0.10 0.00 0.41 -1.57 0.00 0.00 175.55 174.50 3hol n GLY 497 N 1.78 -0.75 0.28 0.71 0.00 -0.87 -3.21 105.19 103.13 3hol n GLY 497 Ca -0.17 -1.70 0.17 0.00 0.00 0.00 0.00 46.02 44.31 3hol n GLY 497 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hol h PRO 498 N 0.00 0.00 0.00 1.61 0.11 -1.93 -2.89 132.00 128.90 3hol h PRO 498 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3hol h PRO 498 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3hol h PRO 498 CO 0.00 0.05 -0.01 0.25 -0.21 0.00 0.00 178.00 178.09 3hol n THR 499 N -3.24 0.76 -2.54 -1.15 -2.24 -1.26 -4.84 114.28 99.78 3hol n THR 499 Ca -0.01 -0.78 -0.21 0.00 -2.27 0.00 0.00 64.05 60.79 3hol n THR 499 Cb 0.26 0.60 -0.00 0.00 -2.10 0.00 0.00 70.33 69.09 3hol n THR 499 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hol n ALA 500 N -0.40 -0.71 1.19 6.98 0.00 -1.09 -4.75 120.51 121.73 3hol n ALA 500 Ca 0.01 0.19 0.13 0.00 0.00 0.00 0.00 53.44 53.76 3hol n ALA 500 Cb 0.33 -2.49 0.65 0.00 0.00 0.00 0.00 19.45 17.94 3hol n ALA 500 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hol n ALA 501 N -2.37 2.32 -2.50 0.00 0.00 -1.25 -4.71 120.51 112.00 3hol n ALA 501 Ca -0.21 -0.12 -0.25 0.00 0.00 0.00 0.00 53.44 52.86 3hol n ALA 501 Cb 0.67 -1.44 -0.14 0.00 0.00 0.00 0.00 19.45 18.54 3hol n ALA 501 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3hol s GLU 502 N -2.67 1.35 0.07 0.00 2.02 -1.20 -0.32 118.70 117.95 3hol s GLU 502 Ca 0.23 -0.88 0.01 0.00 0.02 0.00 0.00 54.97 54.35 3hol s GLU 502 Cb 0.18 -1.43 -0.04 0.00 0.10 0.00 0.00 34.13 32.95 3hol s GLU 502 CO 0.43 0.37 -0.06 -0.48 0.02 0.00 0.00 175.26 175.54 3hol s LEU 503 N -1.06 2.42 0.22 1.80 0.05 -0.51 -0.71 118.68 120.89 3hol s LEU 503 Ca 0.07 -0.84 -0.22 0.00 0.05 0.00 0.00 54.13 53.18 3hol s LEU 503 Cb -0.08 -0.02 0.04 0.00 -2.05 0.00 0.00 46.19 44.08 3hol s LEU 503 CO 0.01 -0.41 0.73 -0.83 -0.55 0.00 0.00 176.35 175.30 3hol s GLY 504 N -2.50 -0.26 -0.00 -3.48 0.00 -0.77 -0.84 107.32 99.46 3hol s GLY 504 Ca 0.03 0.02 -0.02 0.00 0.00 0.00 0.00 44.72 44.75 3hol s GLY 504 CO -0.04 0.01 0.07 0.61 0.00 0.00 0.00 173.10 173.75 3hol n GLY 505 N -0.43 0.45 3.40 0.20 0.00 -0.83 -1.11 105.19 106.88 3hol n GLY 505 Ca -0.08 -0.82 -0.14 0.00 0.00 0.00 0.00 46.02 44.98 3hol n GLY 505 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3hol s GLN 506 N -2.00 1.05 0.01 1.61 -2.07 -0.46 -1.47 119.66 116.32 3hol s GLN 506 Ca 0.02 -0.22 -0.15 0.00 -1.82 0.00 0.00 55.36 53.18 3hol s GLN 506 Cb -0.00 0.48 0.02 0.00 -1.09 0.00 0.00 33.01 32.42 3hol s GLN 506 CO -0.00 -0.38 0.32 -0.59 -1.32 0.00 0.00 175.29 173.32 3hol s PHE 507 N -2.45 -0.17 0.07 9.60 -0.12 -0.97 -2.38 117.98 121.57 3hol s PHE 507 Ca -0.05 0.19 -0.16 0.00 -0.05 0.00 0.00 56.93 56.86 3hol s PHE 507 Cb -0.01 0.11 0.03 0.00 -0.63 0.00 0.00 43.02 42.52 3hol s PHE 507 CO -0.02 -0.44 0.37 -3.38 -0.05 0.00 0.00 175.22 171.70 3hol s HIS 508 N -1.78 -0.17 -0.08 3.49 -3.43 -1.26 -1.66 115.29 110.40 3hol s HIS 508 Ca -0.10 -0.01 -0.31 0.00 -0.80 0.00 0.00 55.06 53.84 3hol s HIS 508 Cb -0.03 0.18 0.09 0.00 -1.43 0.00 0.00 32.58 31.38 3hol s HIS 508 CO 0.02 -0.60 0.77 -1.58 -2.00 0.00 0.00 174.74 171.35 3hol s HIS 509 N -3.06 -0.57 -0.13 0.38 5.04 -0.23 -4.69 115.29 112.03 3hol s HIS 509 Ca -0.02 0.98 -0.06 0.00 -1.54 0.00 0.00 55.06 54.42 3hol s HIS 509 Cb 0.01 0.42 0.05 0.00 0.04 0.00 0.00 32.58 33.10 3hol s HIS 509 CO -0.07 -0.53 0.29 0.21 -2.34 0.00 0.00 174.74 172.30 3hol s LYS 510 N -1.19 0.24 0.23 2.88 2.20 -1.26 -0.88 119.74 121.96 3hol s LYS 510 Ca -0.08 0.63 -0.11 0.00 -0.36 0.00 0.00 55.97 56.05 3hol s LYS 510 Cb -0.00 -0.07 0.04 0.00 -1.51 0.00 0.00 37.83 36.29 3hol s LYS 510 CO 0.07 -0.18 0.59 -1.13 -0.36 0.00 0.00 175.35 174.34 3hol n SER 511 N 4.44 -1.48 0.14 1.43 3.41 -1.07 -5.01 113.62 115.49 3hol n SER 511 Ca -0.22 -1.97 0.03 0.00 -0.26 0.00 0.00 58.87 56.45 3hol n SER 511 Cb 0.53 2.46 0.41 0.00 -0.26 0.00 0.00 64.21 67.35 3hol n SER 511 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 3hol h GLU 512 N 0.00 0.18 -0.08 4.33 4.81 -2.01 -2.81 114.58 118.99 3hol h GLU 512 Ca -0.22 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.97 3hol h GLU 512 Cb 0.84 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.20 3hol h GLU 512 CO 0.28 0.34 0.00 0.09 -0.73 0.00 0.00 179.01 178.99 3hol n ASN 513 N -4.28 0.36 0.00 1.04 3.02 -1.26 -4.96 115.26 109.19 3hol n ASN 513 Ca -0.01 -2.00 0.00 0.00 -0.03 0.00 0.00 54.58 52.54 3hol n ASN 513 Cb 0.27 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.39 3hol n ASN 513 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hol n GLY 514 N 0.59 3.66 3.28 7.41 0.00 -1.06 -4.47 105.19 114.61 3hol n GLY 514 Ca 0.02 -1.77 -0.23 0.00 0.00 0.00 0.00 46.02 44.04 3hol n GLY 514 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hol s SER 515 N 0.00 2.48 -0.04 1.61 0.01 0.33 -2.61 113.70 115.49 3hol s SER 515 Ca 0.00 -0.70 -0.11 0.00 1.31 0.00 0.00 55.95 56.45 3hol s SER 515 Cb 0.00 -0.13 0.02 0.00 0.21 0.00 0.00 66.02 66.11 3hol s SER 515 CO 0.00 0.04 0.24 0.54 0.41 0.00 0.00 173.24 174.47 3hol s VAL 516 N -1.28 0.04 -0.03 3.43 0.11 -0.06 -1.02 120.40 121.60 3hol s VAL 516 Ca 0.07 -0.37 0.01 0.00 -2.93 0.00 0.00 61.98 58.76 3hol s VAL 516 Cb -0.09 -0.47 0.01 0.00 -1.53 0.00 0.00 36.38 34.29 3hol s VAL 516 CO 0.04 -0.20 -0.04 -0.83 -3.33 0.00 0.00 175.10 170.74 3hol s GLY 517 N -0.83 0.36 -0.13 6.54 0.00 -0.57 -1.07 107.32 111.63 3hol s GLY 517 Ca -0.09 -0.08 -0.10 0.00 0.00 0.00 0.00 44.72 44.45 3hol s GLY 517 CO 0.02 0.24 0.34 0.00 0.00 0.00 0.00 173.10 173.70 3hol s ALA 518 N 0.57 -0.84 0.01 3.20 0.00 -0.66 -1.22 121.76 122.82 3hol s ALA 518 Ca -0.07 1.11 0.06 0.00 0.00 0.00 0.00 51.96 53.06 3hol s ALA 518 Cb -0.10 -0.67 -0.02 0.00 0.00 0.00 0.00 23.12 22.33 3hol s ALA 518 CO -0.00 -0.20 -0.18 0.14 0.00 0.00 0.00 175.76 175.52 3hol s VAL 519 N 0.72 1.43 0.05 0.00 -7.23 0.23 -2.29 120.40 113.32 3hol s VAL 519 Ca -0.04 -0.89 -0.01 0.00 -1.81 0.00 0.00 61.98 59.23 3hol s VAL 519 Cb -0.06 -1.22 -0.04 0.00 0.56 0.00 0.00 36.38 35.63 3hol s VAL 519 CO -0.05 0.31 -0.03 0.72 -0.31 0.00 0.00 175.10 175.75 3hol s PHE 520 N -0.55 0.50 0.01 2.82 -0.12 -0.54 -1.64 117.98 118.46 3hol s PHE 520 Ca 0.06 -1.04 -0.16 0.00 -0.05 0.00 0.00 56.93 55.74 3hol s PHE 520 Cb -0.07 -0.38 0.03 0.00 -0.63 0.00 0.00 43.02 41.97 3hol s PHE 520 CO 0.00 -0.38 0.35 0.20 -0.05 0.00 0.00 175.22 175.34 3hol s GLY 521 N -2.87 -0.19 -0.09 1.99 0.00 -1.06 -1.96 107.32 103.15 3hol s GLY 521 Ca 0.06 0.28 -0.21 0.00 0.00 0.00 0.00 44.72 44.86 3hol s GLY 521 CO -0.10 0.05 0.49 0.00 0.00 0.00 0.00 173.10 173.55 3hol s ALA 522 N -1.92 -1.26 -0.10 3.20 0.00 -0.02 -2.14 121.76 119.52 3hol s ALA 522 Ca -0.09 1.02 -0.03 0.00 0.00 0.00 0.00 51.96 52.87 3hol s ALA 522 Cb -0.03 -0.27 -0.03 0.00 0.00 0.00 0.00 23.12 22.79 3hol s ALA 522 CO 0.01 -0.29 0.01 0.21 0.00 0.00 0.00 175.76 175.70 3hol s LYS 523 N -0.72 3.18 0.43 0.00 2.47 -0.29 -1.42 119.74 123.38 3hol s LYS 523 Ca -0.08 -0.41 -0.25 0.00 -1.56 0.00 0.00 55.97 53.68 3hol s LYS 523 Cb -0.03 -2.86 -0.10 0.00 -1.46 0.00 0.00 37.83 33.38 3hol s LYS 523 CO 0.05 0.61 1.14 0.94 0.16 0.00 0.00 175.35 178.25 3hol n GLN 524 N 2.44 1.62 -4.24 4.03 7.27 0.57 -1.31 117.38 127.76 3hol n GLN 524 Ca -0.18 0.58 -0.24 0.00 0.07 0.00 0.00 57.00 57.23 3hol n GLN 524 Cb 0.53 -2.22 -0.07 0.00 2.41 0.00 0.00 30.24 30.89 3hol n GLN 524 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 3hol s GLN 525 N -2.15 2.42 0.07 3.69 -1.52 0.06 -1.54 119.66 120.69 3hol s GLN 525 Ca 0.63 -1.27 0.07 0.00 -1.95 0.00 0.00 55.36 52.84 3hol s GLN 525 Cb -0.53 -2.28 -0.03 0.00 -0.22 0.00 0.00 33.01 29.95 3hol s GLN 525 CO 0.57 0.40 -0.19 0.54 -0.25 0.00 0.00 175.29 176.36 3hol s VAL 526 N -2.10 1.52 0.66 1.09 0.11 0.12 -4.62 120.40 117.19 3hol s VAL 526 Ca 0.30 -1.35 -0.11 0.00 -2.93 0.00 0.00 61.98 57.89 3hol s VAL 526 Cb -0.08 -1.37 0.16 0.00 -1.53 0.00 0.00 36.38 33.56 3hol s VAL 526 CO 0.20 -0.01 0.67 2.29 -3.33 0.00 0.00 175.10 174.91 3hol n LYS 527 N 1.41 -1.79 -0.60 1.54 2.85 -1.26 -1.47 118.16 118.84 3hol n LYS 527 Ca -0.19 -1.06 0.00 0.00 -1.05 0.00 0.00 58.31 56.01 3hol n LYS 527 Cb 0.54 -0.89 0.00 0.00 -0.65 0.00 0.00 35.03 34.02 3hol n LYS 527 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98