#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t60 n ILE 3 N 0.00 0.00 0.00 2.46 -5.35 -1.26 -4.93 119.36 110.27 1t60 n ILE 3 Ca 0.00 -0.01 0.00 0.00 -0.27 0.00 0.00 62.75 62.47 1t60 n ILE 3 Cb 0.00 -0.29 0.00 0.00 -1.74 0.00 0.00 39.64 37.61 1t60 n ILE 3 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1t60 n GLY 4 N 1.46 1.17 3.76 3.28 0.00 -1.26 -5.09 105.19 108.52 1t60 n GLY 4 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1t60 n GLY 4 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1t60 s TYR 5 N -2.00 3.35 -0.14 1.61 6.14 -1.26 -4.91 117.35 120.14 1t60 s TYR 5 Ca 0.00 1.57 -0.00 0.00 0.64 0.00 0.00 57.07 59.28 1t60 s TYR 5 Cb 0.00 -3.46 -0.01 0.00 0.42 0.00 0.00 41.96 38.91 1t60 s TYR 5 CO 0.00 -1.13 -0.13 -0.51 0.64 0.00 0.00 175.55 174.41 1t60 s LEU 6 N -1.54 2.67 -0.20 6.97 1.43 -1.26 -1.30 118.68 125.45 1t60 s LEU 6 Ca 0.47 -0.36 -0.18 0.00 -1.03 0.00 0.00 54.13 53.03 1t60 s LEU 6 Cb -0.35 -1.60 -0.03 0.00 0.03 0.00 0.00 46.19 44.23 1t60 s LEU 6 CO 0.46 0.15 0.50 -0.22 0.23 0.00 0.00 176.35 177.47 1t60 s LEU 7 N 0.45 4.15 -0.16 1.79 2.96 0.85 -4.84 118.68 123.89 1t60 s LEU 7 Ca -0.10 0.66 -0.04 0.00 -0.22 0.00 0.00 54.13 54.42 1t60 s LEU 7 Cb -0.16 -2.68 -0.03 0.00 0.50 0.00 0.00 46.19 43.82 1t60 s LEU 7 CO 0.05 -0.17 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.21 1t60 s VAL 8 N 1.58 4.10 -0.10 1.68 1.01 -1.26 -0.30 120.40 127.11 1t60 s VAL 8 Ca 0.23 -0.28 0.02 0.00 0.00 0.00 0.00 61.98 61.95 1t60 s VAL 8 Cb -0.15 -2.81 0.01 0.00 0.00 0.00 0.00 36.38 33.43 1t60 s VAL 8 CO 0.09 0.49 -0.16 -0.54 0.00 0.00 0.00 175.10 174.99 1t60 s LYS 9 N 0.31 2.25 -0.25 2.72 1.02 -0.61 -4.93 119.74 120.25 1t60 s LYS 9 Ca -0.02 -0.58 -0.07 0.00 0.02 0.00 0.00 55.97 55.32 1t60 s LYS 9 Cb -0.14 -1.87 -0.02 0.00 -0.52 0.00 0.00 37.83 35.28 1t60 s LYS 9 CO 0.02 -0.01 0.05 -1.01 -0.92 0.00 0.00 175.35 173.48 1t60 s HIS 10 N 0.83 3.06 0.18 3.18 3.76 -1.26 -1.66 115.29 123.38 1t60 s HIS 10 Ca -0.10 -0.53 -0.02 0.00 -0.15 0.00 0.00 55.06 54.27 1t60 s HIS 10 Cb -0.15 -2.22 0.06 0.00 1.11 0.00 0.00 32.58 31.38 1t60 s HIS 10 CO 0.01 -0.40 1.43 0.66 -0.85 0.00 0.00 174.74 175.59 1t60 h SER 11 N 8.22 0.49 -1.95 1.40 4.64 -1.37 -3.48 113.55 121.50 1t60 h SER 11 Ca -0.39 -0.32 -0.23 0.00 -0.47 0.00 0.00 61.79 60.39 1t60 h SER 11 Cb 1.17 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1t60 h SER 11 CO 0.58 1.06 -0.30 0.00 -0.87 0.00 0.00 176.83 177.30 1t60 n GLN 12 N -3.84 -1.46 -4.09 4.77 6.02 -1.26 -4.95 117.38 112.56 1t60 n GLN 12 Ca -0.04 0.54 -0.11 0.00 -0.01 0.00 0.00 57.00 57.37 1t60 n GLN 12 Cb 0.70 -4.63 -0.07 0.00 1.02 0.00 0.00 30.24 27.27 1t60 n GLN 12 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1t60 s THR 13 N -2.67 0.00 -0.28 5.09 -4.23 -1.26 -3.29 115.64 109.00 1t60 s THR 13 Ca 0.05 -1.67 0.02 0.00 -1.18 0.00 0.00 61.69 58.92 1t60 s THR 13 Cb -0.02 -2.39 0.28 0.00 1.34 0.00 0.00 72.50 71.71 1t60 s THR 13 CO 0.06 0.00 1.30 -0.90 -0.54 0.00 0.00 174.62 174.55 1t60 n ASP 14 N -0.56 3.23 -3.98 3.99 3.85 -1.26 -1.94 116.55 119.88 1t60 n ASP 14 Ca 0.00 -2.60 -0.18 0.00 -0.71 0.00 0.00 54.79 51.31 1t60 n ASP 14 Cb 0.63 -0.63 -0.15 0.00 -1.35 0.00 0.00 41.12 39.63 1t60 n ASP 14 CO 0.00 0.00 0.00 -1.10 -1.01 0.00 0.00 177.20 175.09 1t60 s GLN 15 N -1.41 0.64 0.20 0.11 -1.52 -1.26 -4.93 119.66 111.49 1t60 s GLN 15 Ca 0.23 -0.25 -0.32 0.00 -1.95 0.00 0.00 55.36 53.07 1t60 s GLN 15 Cb 0.19 -0.62 -0.12 0.00 -0.22 0.00 0.00 33.01 32.24 1t60 s GLN 15 CO 0.05 0.13 1.69 -1.21 -0.25 0.00 0.00 175.29 175.69 1t60 s GLU 16 N -0.03 4.14 0.43 2.91 2.02 -1.26 -4.56 118.70 122.35 1t60 s GLU 16 Ca 0.01 2.55 -0.22 0.00 0.02 0.00 0.00 54.97 57.33 1t60 s GLU 16 Cb -0.04 -3.09 -0.09 0.00 0.10 0.00 0.00 34.13 31.01 1t60 s GLU 16 CO -0.00 -0.72 1.03 -1.25 0.02 0.00 0.00 175.26 174.34 1t60 s PRO 17 N 1.11 4.04 0.17 0.39 0.04 -1.26 -5.02 135.00 134.47 1t60 s PRO 17 Ca 0.73 1.42 -0.08 0.00 0.04 0.00 0.00 61.00 63.11 1t60 s PRO 17 Cb -0.48 -2.34 -0.06 0.00 0.04 0.00 0.00 34.50 31.65 1t60 s PRO 17 CO 0.32 -0.24 0.46 0.00 0.04 0.00 0.00 177.00 177.59 1t60 s MET 18 N -2.83 3.74 0.35 4.56 0.23 -1.26 -4.59 119.30 119.49 1t60 s MET 18 Ca 0.62 0.14 -0.27 0.00 -1.03 0.00 0.00 55.69 55.14 1t60 s MET 18 Cb -0.19 -2.78 -0.09 0.00 -1.53 0.00 0.00 34.83 30.24 1t60 s MET 18 CO 0.23 0.41 1.16 0.00 -2.03 0.00 0.00 175.02 174.80 1t60 n PRO 20 N 0.57 0.55 -1.69 0.00 -0.02 -1.26 -4.82 135.00 128.34 1t60 n PRO 20 Ca 0.02 0.23 -0.44 0.00 -2.02 0.00 0.00 63.50 61.29 1t60 n PRO 20 Cb 0.45 -1.99 -0.02 0.00 -0.02 0.00 0.00 33.50 31.92 1t60 n PRO 20 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1t60 n VAL 21 N -2.11 1.34 0.00 -1.45 0.31 -1.26 -1.52 118.33 113.64 1t60 n VAL 21 Ca 0.12 -0.33 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 1t60 n VAL 21 Cb 0.49 -1.54 0.00 0.00 -0.91 0.00 0.00 33.84 31.88 1t60 n VAL 21 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1t60 n GLY 22 N 1.66 2.29 3.42 2.92 0.00 -1.26 -5.00 105.19 109.22 1t60 n GLY 22 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 1t60 n GLY 22 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1t60 s MET 23 N -0.40 2.92 0.34 1.61 1.00 -0.57 -4.99 119.30 119.21 1t60 s MET 23 Ca 0.00 -1.10 -0.29 0.00 0.00 0.00 0.00 55.69 54.30 1t60 s MET 23 Cb 0.00 -3.94 -0.11 0.00 0.00 0.00 0.00 34.83 30.78 1t60 s MET 23 CO 0.00 -0.79 1.50 1.21 0.00 0.00 0.00 175.02 176.94 1t60 s ASN 24 N 1.80 6.40 -0.33 3.03 2.47 -1.25 -4.61 114.94 122.46 1t60 s ASN 24 Ca 0.04 2.97 -0.20 0.00 0.42 0.00 0.00 52.86 56.09 1t60 s ASN 24 Cb -0.20 -2.65 -0.00 0.00 -1.45 0.00 0.00 41.25 36.94 1t60 s ASN 24 CO 0.08 -0.85 0.63 -0.75 -3.72 0.00 0.00 177.10 172.50 1t60 s LYS 25 N -1.51 3.81 0.08 0.43 2.20 -1.26 -0.51 119.74 122.97 1t60 s LYS 25 Ca 0.56 0.20 -0.14 0.00 -0.36 0.00 0.00 55.97 56.23 1t60 s LYS 25 Cb -0.46 -3.76 -0.18 0.00 -1.51 0.00 0.00 37.83 31.91 1t60 s LYS 25 CO 0.57 -0.64 1.25 -0.07 -0.36 0.00 0.00 175.35 176.10 1t60 h LEU 26 N 9.25 0.87 -7.23 5.43 4.07 -1.43 -3.49 115.31 122.78 1t60 h LEU 26 Ca -0.27 -0.67 0.27 0.00 0.08 0.00 0.00 57.88 57.30 1t60 h LEU 26 Cb 1.11 -0.26 -0.13 0.00 1.08 0.00 0.00 40.66 42.46 1t60 h LEU 26 CO 0.82 1.40 0.75 -1.66 -1.08 0.00 0.00 178.44 178.67 1t60 s TRP 27 N -3.60 -0.10 0.30 1.13 -2.14 -1.23 -5.02 118.94 108.28 1t60 s TRP 27 Ca -0.11 -0.03 0.11 0.00 2.66 0.00 0.00 56.10 58.73 1t60 s TRP 27 Cb 0.07 0.55 -0.05 0.00 -3.10 0.00 0.00 33.47 30.94 1t60 s TRP 27 CO 0.89 -0.37 -0.14 -1.12 -2.66 0.00 0.00 176.95 173.55 1t60 s SER 28 N -2.75 3.76 0.00 -2.66 0.01 -1.26 -0.92 113.70 109.88 1t60 s SER 28 Ca 0.12 -1.02 0.00 0.00 1.31 0.00 0.00 55.95 56.36 1t60 s SER 28 Cb 0.02 -0.38 0.00 0.00 0.21 0.00 0.00 66.02 65.87 1t60 s SER 28 CO -0.03 -0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.19 1t60 n GLY 29 N -0.71 1.54 3.42 3.44 0.00 0.12 -4.18 105.19 108.83 1t60 n GLY 29 Ca -0.05 -0.47 -0.32 0.00 0.00 0.00 0.00 46.02 45.18 1t60 n GLY 29 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1t60 s TYR 30 N -1.62 2.55 -0.56 1.61 1.51 0.17 -1.14 117.35 119.88 1t60 s TYR 30 Ca 0.00 -0.27 -0.27 0.00 -1.01 0.00 0.00 57.07 55.52 1t60 s TYR 30 Cb 0.00 -1.54 -0.02 0.00 -0.11 0.00 0.00 41.96 40.29 1t60 s TYR 30 CO 0.00 0.14 1.78 -1.12 -1.11 0.00 0.00 175.55 175.24 1t60 s SER 31 N -0.91 5.51 -0.20 2.29 0.01 -0.51 -1.82 113.70 118.07 1t60 s SER 31 Ca 0.12 0.49 -0.17 0.00 1.31 0.00 0.00 55.95 57.70 1t60 s SER 31 Cb -0.10 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.56 1t60 s SER 31 CO 0.01 -2.16 0.46 -0.22 0.41 0.00 0.00 173.24 171.75 1t60 s LEU 32 N 8.23 4.15 -0.19 2.44 2.96 0.37 -1.03 118.68 135.61 1t60 s LEU 32 Ca 0.67 0.61 -0.15 0.00 -0.22 0.00 0.00 54.13 55.03 1t60 s LEU 32 Cb -0.14 -2.62 -0.09 0.00 0.50 0.00 0.00 46.19 43.84 1t60 s LEU 32 CO 0.23 -0.13 -0.19 -0.11 -1.32 0.00 0.00 176.35 174.84 1t60 n LEU 33 N 4.62 1.89 -3.49 -0.68 7.94 -0.56 -4.62 117.00 122.09 1t60 n LEU 33 Ca -0.06 0.44 -0.09 0.00 -1.11 0.00 0.00 56.01 55.19 1t60 n LEU 33 Cb 0.51 -0.84 -0.02 0.00 0.53 0.00 0.00 43.42 43.60 1t60 n LEU 33 CO 0.41 -0.05 0.62 -0.72 -1.11 0.00 0.00 177.39 176.54 1t60 s TYR 34 N -2.52 -0.38 0.14 1.96 1.13 -1.05 -1.63 117.35 115.01 1t60 s TYR 34 Ca -0.27 0.22 0.06 0.00 -1.41 0.00 0.00 57.07 55.67 1t60 s TYR 34 Cb 0.06 0.55 -0.04 0.00 -1.10 0.00 0.00 41.96 41.43 1t60 s TYR 34 CO 0.41 -0.63 0.06 -0.06 -2.51 0.00 0.00 175.55 172.82 1t60 s PHE 35 N -3.28 3.02 -0.22 -3.49 0.08 -0.38 -0.52 117.98 113.19 1t60 s PHE 35 Ca 0.04 -0.05 -0.00 0.00 0.12 0.00 0.00 56.93 57.04 1t60 s PHE 35 Cb -0.01 -1.48 0.06 0.00 -0.57 0.00 0.00 43.02 41.02 1t60 s PHE 35 CO -0.09 0.51 -0.03 -1.21 -0.10 0.00 0.00 175.22 174.29 1t60 s GLU 36 N -2.82 1.40 -0.13 0.44 2.02 -0.39 -0.52 118.70 118.69 1t60 s GLU 36 Ca 0.29 -0.85 0.02 0.00 0.02 0.00 0.00 54.97 54.45 1t60 s GLU 36 Cb -0.10 -2.46 0.01 0.00 0.10 0.00 0.00 34.13 31.67 1t60 s GLU 36 CO 0.21 -0.60 -0.20 0.20 0.02 0.00 0.00 175.26 174.88 1t60 s GLY 37 N 1.51 1.28 -1.43 -1.39 0.00 -0.92 -1.94 107.32 104.43 1t60 s GLY 37 Ca -0.05 -1.00 -0.08 0.00 0.00 0.00 0.00 44.72 43.59 1t60 s GLY 37 CO -0.07 0.03 1.00 -1.06 0.00 0.00 0.00 173.10 173.01 1t60 n GLN 38 N 4.09 -6.90 -3.41 2.90 1.13 -1.26 -1.94 117.38 111.98 1t60 n GLN 38 Ca -0.20 0.83 -0.25 0.00 -1.94 0.00 0.00 57.00 55.45 1t60 n GLN 38 Cb 0.51 -5.82 0.02 0.00 0.11 0.00 0.00 30.24 25.07 1t60 n GLN 38 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 1t60 n GLU 39 N -4.70 -4.77 -3.81 -1.09 1.02 -1.26 -4.96 120.64 101.06 1t60 n GLU 39 Ca -0.02 0.67 -0.26 0.00 -0.02 0.00 0.00 57.16 57.53 1t60 n GLU 39 Cb 0.57 -5.50 -0.17 0.00 -0.02 0.00 0.00 31.44 26.32 1t60 n GLU 39 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1t60 s LYS 40 N -6.10 0.98 0.34 3.49 2.47 -0.82 -4.93 119.74 115.17 1t60 s LYS 40 Ca 0.45 -0.27 -0.27 0.00 -1.56 0.00 0.00 55.97 54.33 1t60 s LYS 40 Cb -0.22 -1.67 -0.09 0.00 -1.46 0.00 0.00 37.83 34.39 1t60 s LYS 40 CO 0.56 -0.43 1.08 0.00 0.16 0.00 0.00 175.35 176.72 1t60 s ALA 41 N 1.81 3.25 -0.16 3.13 0.00 -1.26 -2.17 121.76 126.34 1t60 s ALA 41 Ca 0.02 0.82 -0.03 0.00 0.00 0.00 0.00 51.96 52.77 1t60 s ALA 41 Cb -0.14 -3.31 0.05 0.00 0.00 0.00 0.00 23.12 19.72 1t60 s ALA 41 CO -0.07 -0.22 0.03 -1.58 0.00 0.00 0.00 175.76 173.92 1t60 s HIS 42 N -1.39 0.88 0.46 0.00 2.46 0.32 -4.96 115.29 113.06 1t60 s HIS 42 Ca 0.51 -0.66 -0.02 0.00 0.47 0.00 0.00 55.06 55.37 1t60 s HIS 42 Cb -0.28 -0.95 -0.02 0.00 -0.13 0.00 0.00 32.58 31.21 1t60 s HIS 42 CO 0.35 -0.54 0.71 -0.80 -2.47 0.00 0.00 174.74 171.99 1t60 s ASN 43 N 1.91 6.00 -0.01 9.88 0.01 -1.26 -1.25 114.94 130.22 1t60 s ASN 43 Ca 0.01 0.54 0.08 0.00 -0.71 0.00 0.00 52.86 52.78 1t60 s ASN 43 Cb -0.16 -1.84 -0.02 0.00 0.41 0.00 0.00 41.25 39.64 1t60 s ASN 43 CO -0.07 -0.64 -0.24 -1.10 -1.51 0.00 0.00 177.10 173.53 1t60 s GLN 44 N -4.62 1.90 -0.13 -0.60 -1.52 -0.65 -4.97 119.66 109.07 1t60 s GLN 44 Ca 0.47 -0.89 -0.29 0.00 -1.95 0.00 0.00 55.36 52.70 1t60 s GLN 44 Cb -0.10 -1.88 -0.02 0.00 -0.22 0.00 0.00 33.01 30.79 1t60 s GLN 44 CO 0.40 0.51 1.30 0.34 -0.25 0.00 0.00 175.29 177.60 1t60 s ASP 45 N -0.67 6.92 0.19 5.90 3.68 -1.26 -4.80 116.67 126.62 1t60 s ASP 45 Ca 0.09 1.78 0.12 0.00 2.13 0.00 0.00 52.55 56.67 1t60 s ASP 45 Cb -0.09 -2.54 0.64 0.00 -1.45 0.00 0.00 42.92 39.48 1t60 s ASP 45 CO -0.00 -0.76 1.34 0.18 0.13 0.00 0.00 175.17 176.06 1t60 n LEU 46 N 6.46 0.31 -0.89 -1.34 4.77 -1.26 -0.59 117.00 124.45 1t60 n LEU 46 Ca 0.14 0.62 0.12 0.00 -0.03 0.00 0.00 56.01 56.86 1t60 n LEU 46 Cb 0.45 -0.65 0.09 0.00 -2.33 0.00 0.00 43.42 40.97 1t60 n LEU 46 CO 0.57 -0.73 0.59 0.61 -1.33 0.00 0.00 177.39 177.10 1t60 n GLY 47 N -1.37 0.84 3.66 -0.72 0.00 -1.26 -4.45 105.19 101.88 1t60 n GLY 47 Ca -0.01 -0.67 -0.28 0.00 0.00 0.00 0.00 46.02 45.07 1t60 n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1t60 s LEU 48 N -1.99 3.31 0.63 0.99 1.43 0.24 -4.47 118.68 118.82 1t60 s LEU 48 Ca 0.26 -0.34 0.37 0.00 -1.03 0.00 0.00 54.13 53.38 1t60 s LEU 48 Cb 0.19 -2.00 2.08 0.00 0.03 0.00 0.00 46.19 46.50 1t60 s LEU 48 CO 0.32 0.12 2.27 0.00 0.23 0.00 0.00 176.35 179.29 1t60 h ALA 49 N 3.00 1.30 0.00 4.21 0.00 -1.88 -1.51 119.26 124.38 1t60 h ALA 49 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1t60 h ALA 49 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1t60 h ALA 49 CO 0.57 -0.06 0.00 0.78 0.00 0.00 0.00 179.25 180.55 1t60 h GLY 50 N 0.00 0.00 -0.11 0.00 0.00 -1.95 -1.36 103.07 99.64 1t60 h GLY 50 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1t60 h GLY 50 CO -0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.40 1t60 n SER 51 N -2.87 0.99 -4.02 0.19 3.41 -0.57 -4.55 113.62 106.20 1t60 n SER 51 Ca -0.01 -1.47 -0.31 0.00 -0.26 0.00 0.00 58.87 56.82 1t60 n SER 51 Cb 0.16 -0.04 -0.15 0.00 -0.26 0.00 0.00 64.21 63.92 1t60 n SER 51 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1t60 s LEU 53 N 0.82 4.10 0.21 0.00 2.96 -0.75 -4.81 118.68 121.20 1t60 s LEU 53 Ca 0.11 0.30 -0.09 0.00 -0.22 0.00 0.00 54.13 54.23 1t60 s LEU 53 Cb -0.20 -2.36 0.23 0.00 0.50 0.00 0.00 46.19 44.36 1t60 s LEU 53 CO -0.07 -0.08 1.83 0.00 -1.32 0.00 0.00 176.35 176.71 1t60 h ALA 54 N 7.75 0.94 -3.25 5.97 0.00 -1.87 0.50 119.26 129.30 1t60 h ALA 54 Ca -0.35 -0.01 -0.65 0.00 0.00 0.00 0.00 54.91 53.90 1t60 h ALA 54 Cb 1.17 -0.18 -0.26 0.00 0.00 0.00 0.00 17.79 18.51 1t60 h ALA 54 CO 0.66 0.15 -0.73 1.03 0.00 0.00 0.00 179.25 180.36 1t60 s ARG 55 N -6.10 3.45 0.42 0.00 0.52 -1.26 -4.53 118.95 111.44 1t60 s ARG 55 Ca -0.13 -0.63 -0.05 0.00 -0.52 0.00 0.00 55.73 54.39 1t60 s ARG 55 Cb 0.16 -2.77 -0.04 0.00 0.52 0.00 0.00 34.95 32.81 1t60 s ARG 55 CO 0.77 0.14 0.71 0.12 0.02 0.00 0.00 175.30 177.06 1t60 s PHE 56 N 0.57 3.52 -0.28 -0.53 2.19 -1.26 -4.95 117.98 117.24 1t60 s PHE 56 Ca -0.06 0.77 -0.27 0.00 0.33 0.00 0.00 56.93 57.71 1t60 s PHE 56 Cb -0.15 -2.24 0.18 0.00 -1.31 0.00 0.00 43.02 39.49 1t60 s PHE 56 CO 0.03 -0.12 1.32 0.45 1.83 0.00 0.00 175.22 178.73 1t60 s SER 57 N -3.75 -0.14 0.60 6.13 0.15 -1.26 -4.99 113.70 110.44 1t60 s SER 57 Ca 0.47 0.22 0.38 0.00 0.70 0.00 0.00 55.95 57.72 1t60 s SER 57 Cb -0.10 0.21 1.86 0.00 -1.71 0.00 0.00 66.02 66.28 1t60 s SER 57 CO 0.38 -0.07 2.17 0.71 1.20 0.00 0.00 173.24 177.63 1t60 h THR 58 N 2.81 0.05 -2.57 6.45 1.35 -1.91 -3.30 112.91 115.79 1t60 h THR 58 Ca -0.21 -0.29 -0.59 0.00 -0.55 0.00 0.00 66.41 64.77 1t60 h THR 58 Cb 1.19 1.27 -0.39 0.00 -1.73 0.00 0.00 68.15 68.49 1t60 h THR 58 CO 0.19 0.01 -0.87 -0.32 -0.25 0.00 0.00 175.52 174.28 1t60 s MET 59 N -3.93 0.96 0.00 4.72 -2.45 -1.26 -3.75 119.30 113.59 1t60 s MET 59 Ca -0.02 -1.94 0.31 0.00 -1.25 0.00 0.00 55.69 52.79 1t60 s MET 59 Cb 0.11 -1.65 1.72 0.00 1.25 0.00 0.00 34.83 36.26 1t60 s MET 59 CO 0.49 -1.29 2.13 -0.35 1.05 0.00 0.00 175.02 177.04 1t60 n PRO 60 N 3.25 1.07 -4.41 4.11 -0.04 -1.25 -4.90 135.00 132.83 1t60 n PRO 60 Ca 0.21 -0.17 -0.21 0.00 -0.04 0.00 0.00 63.50 63.30 1t60 n PRO 60 Cb 0.42 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.28 1t60 n PRO 60 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1t60 s PHE 61 N -2.05 1.76 0.17 0.54 -0.71 -1.26 -5.09 117.98 111.34 1t60 s PHE 61 Ca 0.45 -1.15 -0.01 0.00 -1.04 0.00 0.00 56.93 55.18 1t60 s PHE 61 Cb 0.22 -1.09 -0.04 0.00 -1.21 0.00 0.00 43.02 40.90 1t60 s PHE 61 CO 0.37 -0.23 0.09 -0.48 -1.34 0.00 0.00 175.22 173.64 1t60 s LEU 62 N -3.45 1.45 0.06 -1.99 0.05 -1.26 -4.49 118.68 109.05 1t60 s LEU 62 Ca 0.34 -1.31 0.00 0.00 0.05 0.00 0.00 54.13 53.21 1t60 s LEU 62 Cb 0.07 0.32 -0.04 0.00 -2.05 0.00 0.00 46.19 44.49 1t60 s LEU 62 CO 0.15 -0.78 -0.05 -0.72 -0.55 0.00 0.00 176.35 174.40 1t60 s TYR 63 N -4.08 0.64 0.14 3.48 -0.85 -0.75 -4.97 117.35 110.95 1t60 s TYR 63 Ca 0.32 -0.90 0.04 0.00 -0.52 0.00 0.00 57.07 56.02 1t60 s TYR 63 Cb 0.07 -0.42 -0.04 0.00 0.38 0.00 0.00 41.96 41.95 1t60 s TYR 63 CO 0.08 -0.25 -0.10 0.00 -1.52 0.00 0.00 175.55 173.76 1t60 s ASN 65 N -3.07 2.92 0.66 0.00 2.20 -0.77 -5.00 114.94 111.87 1t60 s ASN 65 Ca 0.15 -1.16 0.26 0.00 -0.94 0.00 0.00 52.86 51.16 1t60 s ASN 65 Cb 0.02 -0.20 1.38 0.00 -2.00 0.00 0.00 41.25 40.45 1t60 s ASN 65 CO 0.00 -0.28 1.78 -0.65 -2.94 0.00 0.00 177.10 175.01 1t60 h PRO 66 N 2.28 0.00 -0.06 3.55 0.11 -2.02 -2.00 132.00 133.85 1t60 h PRO 66 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1t60 h PRO 66 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1t60 h PRO 66 CO 0.67 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.87 1t60 n GLY 67 N -1.28 -0.32 3.65 -0.55 0.00 -1.26 -4.78 105.19 100.65 1t60 n GLY 67 Ca -0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 1t60 n GLY 67 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1t60 n ASP 68 N -0.41 -5.08 -3.97 1.61 10.43 -0.75 -4.99 116.55 113.39 1t60 n ASP 68 Ca 0.00 -0.62 -0.21 0.00 2.57 0.00 0.00 54.79 56.53 1t60 n ASP 68 Cb 0.01 -4.73 -0.16 0.00 1.84 0.00 0.00 41.12 38.08 1t60 n ASP 68 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1t60 s VAL 69 N -3.34 0.77 0.14 2.53 1.01 -1.24 -5.03 120.40 115.23 1t60 s VAL 69 Ca 0.48 -0.30 0.10 0.00 0.00 0.00 0.00 61.98 62.26 1t60 s VAL 69 Cb -0.22 -0.72 -0.04 0.00 0.00 0.00 0.00 36.38 35.40 1t60 s VAL 69 CO 0.76 0.26 -0.22 0.00 0.00 0.00 0.00 175.10 175.89 1t60 s TYR 71 N -1.46 1.07 -0.14 0.00 2.02 0.84 -4.98 117.35 114.70 1t60 s TYR 71 Ca 0.13 -0.31 0.02 0.00 -0.37 0.00 0.00 57.07 56.54 1t60 s TYR 71 Cb -0.09 -0.79 0.01 0.00 -0.40 0.00 0.00 41.96 40.69 1t60 s TYR 71 CO 0.06 -0.16 -0.20 -0.47 -1.57 0.00 0.00 175.55 173.21 1t60 s TYR 72 N 0.42 2.69 -1.66 2.71 6.14 -1.26 -1.82 117.35 124.57 1t60 s TYR 72 Ca -0.07 -1.25 -0.14 0.00 0.64 0.00 0.00 57.07 56.25 1t60 s TYR 72 Cb -0.12 -1.82 0.13 0.00 0.42 0.00 0.00 41.96 40.57 1t60 s TYR 72 CO 0.01 -0.56 0.62 0.00 0.64 0.00 0.00 175.55 176.26 1t60 n ALA 73 N 4.02 -1.46 -1.08 3.97 0.00 -1.26 -4.84 120.51 119.85 1t60 n ALA 73 Ca -0.20 -0.12 0.09 0.00 0.00 0.00 0.00 53.44 53.21 1t60 n ALA 73 Cb 0.52 -2.73 0.17 0.00 0.00 0.00 0.00 19.45 17.41 1t60 n ALA 73 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1t60 n SER 74 N -2.71 2.71 0.00 0.00 7.64 -1.26 -4.76 113.62 115.24 1t60 n SER 74 Ca -0.03 -3.12 0.00 0.00 1.01 0.00 0.00 58.87 56.73 1t60 n SER 74 Cb 0.54 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 63.27 1t60 n SER 74 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1t60 n ARG 75 N -1.19 0.00 -1.51 1.43 0.63 -1.26 -5.08 116.66 109.68 1t60 n ARG 75 Ca 0.18 0.00 0.03 0.00 -0.92 0.00 0.00 57.85 57.14 1t60 n ARG 75 Cb 0.71 0.00 0.05 0.00 0.45 0.00 0.00 32.46 33.67 1t60 n ARG 75 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1t60 n ASN 76 N 0.00 1.24 -4.90 6.15 4.05 -1.26 -4.83 115.26 115.71 1t60 n ASN 76 Ca 0.00 -2.32 -0.29 0.00 0.45 0.00 0.00 54.58 52.42 1t60 n ASN 76 Cb 0.00 -0.35 0.08 0.00 1.23 0.00 0.00 39.78 40.74 1t60 n ASN 76 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 177.26 172.40 1t60 s ASP 77 N -2.39 4.66 0.21 1.20 -0.00 -1.26 -4.93 116.67 114.15 1t60 s ASP 77 Ca 0.34 0.78 -0.01 0.00 -0.00 0.00 0.00 52.55 53.66 1t60 s ASP 77 Cb 0.38 -1.33 -0.04 0.00 -0.00 0.00 0.00 42.92 41.93 1t60 s ASP 77 CO -0.14 -1.80 0.12 -0.54 -0.00 0.00 0.00 175.17 172.81 1t60 s LYS 78 N -5.51 1.22 0.01 8.23 1.02 -0.82 -2.03 119.74 121.86 1t60 s LYS 78 Ca 0.61 -1.64 -0.00 0.00 0.02 0.00 0.00 55.97 54.96 1t60 s LYS 78 Cb -0.11 0.17 -0.01 0.00 -0.52 0.00 0.00 37.83 37.36 1t60 s LYS 78 CO 0.49 -0.36 -0.01 -1.54 -0.92 0.00 0.00 175.35 173.00 1t60 s SER 79 N -3.18 0.11 -0.04 2.83 1.04 -0.90 -1.27 113.70 112.29 1t60 s SER 79 Ca 0.38 -0.23 0.05 0.00 0.48 0.00 0.00 55.95 56.63 1t60 s SER 79 Cb 0.07 0.05 -0.01 0.00 0.10 0.00 0.00 66.02 66.24 1t60 s SER 79 CO 0.12 -0.14 -0.19 -0.31 0.98 0.00 0.00 173.24 173.69 1t60 s TYR 80 N -0.69 1.84 0.07 5.02 2.02 0.32 -0.48 117.35 125.46 1t60 s TYR 80 Ca -0.08 -0.49 0.05 0.00 -0.37 0.00 0.00 57.07 56.18 1t60 s TYR 80 Cb -0.05 -1.22 -0.03 0.00 -0.40 0.00 0.00 41.96 40.26 1t60 s TYR 80 CO -0.00 -0.14 -0.13 -1.58 -1.57 0.00 0.00 175.55 172.12 1t60 s TRP 81 N -0.11 1.15 0.31 2.71 0.52 -0.76 -1.50 118.94 121.26 1t60 s TRP 81 Ca -0.01 -0.49 -0.29 0.00 0.02 0.00 0.00 56.10 55.33 1t60 s TRP 81 Cb -0.11 -0.64 -0.10 0.00 -1.15 0.00 0.00 33.47 31.46 1t60 s TRP 81 CO 0.02 0.04 1.39 -1.17 0.02 0.00 0.00 176.95 177.25 1t60 s LEU 82 N -1.84 4.39 0.39 2.99 2.96 -0.20 -0.78 118.68 126.59 1t60 s LEU 82 Ca -0.01 2.75 0.08 0.00 -0.22 0.00 0.00 54.13 56.72 1t60 s LEU 82 Cb -0.09 -3.64 -0.02 0.00 0.50 0.00 0.00 46.19 42.93 1t60 s LEU 82 CO 0.02 -0.66 0.33 -0.94 -1.32 0.00 0.00 176.35 173.78 1t60 s SER 83 N -0.12 5.09 0.79 3.68 1.04 -0.24 -1.20 113.70 122.73 1t60 s SER 83 Ca 0.53 -0.68 -0.05 0.00 0.48 0.00 0.00 55.95 56.24 1t60 s SER 83 Cb -0.42 -0.70 0.13 0.00 0.10 0.00 0.00 66.02 65.13 1t60 s SER 83 CO 0.51 -0.54 0.84 0.35 0.98 0.00 0.00 173.24 175.39 1t60 n THR 84 N -1.46 0.00 -0.41 2.02 -2.24 -0.40 -4.49 114.28 107.30 1t60 n THR 84 Ca 0.01 -1.00 0.05 0.00 -2.27 0.00 0.00 64.05 60.85 1t60 n THR 84 Cb 0.61 -1.26 0.30 0.00 -2.10 0.00 0.00 70.33 67.88 1t60 n THR 84 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1t60 n THR 85 N -2.84 2.04 -1.91 4.28 -2.24 -1.21 -4.95 114.28 107.46 1t60 n THR 85 Ca 0.12 -1.04 -0.38 0.00 -2.27 0.00 0.00 64.05 60.48 1t60 n THR 85 Cb 0.44 -0.31 0.02 0.00 -2.10 0.00 0.00 70.33 68.38 1t60 n THR 85 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1t60 s ALA 86 N -2.29 2.96 0.60 6.98 0.00 -1.26 -4.92 121.76 123.82 1t60 s ALA 86 Ca 0.41 1.26 -0.19 0.00 0.00 0.00 0.00 51.96 53.44 1t60 s ALA 86 Cb 0.31 -3.53 -0.04 0.00 0.00 0.00 0.00 23.12 19.86 1t60 s ALA 86 CO 0.12 -1.15 1.10 -0.35 0.00 0.00 0.00 175.76 175.49 1t60 n PRO 87 N -0.67 1.08 -1.91 0.00 -0.04 -1.26 -4.88 135.00 127.32 1t60 n PRO 87 Ca 0.08 0.41 -0.42 0.00 -0.04 0.00 0.00 63.50 63.54 1t60 n PRO 87 Cb 0.45 -2.30 -0.03 0.00 -0.04 0.00 0.00 33.50 31.58 1t60 n PRO 87 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1t60 s LEU 88 N -2.68 4.37 0.44 1.53 1.43 -1.26 -4.96 118.68 117.55 1t60 s LEU 88 Ca 0.76 2.55 -0.23 0.00 -1.03 0.00 0.00 54.13 56.18 1t60 s LEU 88 Cb -0.42 -3.57 -0.08 0.00 0.03 0.00 0.00 46.19 42.15 1t60 s LEU 88 CO 0.46 -0.88 1.08 -2.16 0.23 0.00 0.00 176.35 175.08 1t60 s PRO 89 N 2.21 3.94 0.00 1.29 0.04 -1.26 -4.93 135.00 136.30 1t60 s PRO 89 Ca 0.73 1.54 0.12 0.00 0.04 0.00 0.00 61.00 63.43 1t60 s PRO 89 Cb -0.41 -2.37 0.46 0.00 0.04 0.00 0.00 34.50 32.21 1t60 s PRO 89 CO 0.32 -0.34 1.33 0.00 0.04 0.00 0.00 177.00 178.35 1t60 n MET 90 N -0.45 1.49 -3.52 4.56 0.00 -1.26 -4.82 117.12 113.12 1t60 n MET 90 Ca 0.07 -0.75 -0.16 0.00 0.00 0.00 0.00 57.70 56.87 1t60 n MET 90 Cb 0.50 -1.24 -0.05 0.00 0.00 0.00 0.00 33.22 32.43 1t60 n MET 90 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 175.97 177.38 1t60 s MET 91 N -1.77 0.99 0.49 3.17 -2.45 -1.26 -5.15 119.30 113.31 1t60 s MET 91 Ca 0.21 0.14 -0.22 0.00 -1.25 0.00 0.00 55.69 54.57 1t60 s MET 91 Cb 0.11 0.46 -0.09 0.00 1.25 0.00 0.00 34.83 36.56 1t60 s MET 91 CO 0.16 -0.33 0.90 -2.30 1.05 0.00 0.00 175.02 174.49 1t60 n PRO 92 N 0.69 1.06 -4.23 4.11 -0.02 -1.26 -4.97 135.00 130.38 1t60 n PRO 92 Ca -0.17 0.39 -0.35 0.00 -2.02 0.00 0.00 63.50 61.35 1t60 n PRO 92 Cb 0.58 -1.99 -0.08 0.00 -0.02 0.00 0.00 33.50 31.99 1t60 n PRO 92 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1t60 s VAL 93 N -1.41 4.64 0.15 -1.45 -7.23 -0.12 -4.92 120.40 110.06 1t60 s VAL 93 Ca 0.67 -0.14 0.09 0.00 -1.81 0.00 0.00 61.98 60.79 1t60 s VAL 93 Cb -0.51 -2.98 -0.04 0.00 0.56 0.00 0.00 36.38 33.41 1t60 s VAL 93 CO 0.54 0.59 -0.21 0.00 -0.31 0.00 0.00 175.10 175.71 1t60 s ALA 94 N -0.94 2.10 0.00 1.32 0.00 -1.26 -1.13 121.76 121.85 1t60 s ALA 94 Ca 0.14 -1.45 0.00 0.00 0.00 0.00 0.00 51.96 50.65 1t60 s ALA 94 Cb -0.12 -0.25 0.00 0.00 0.00 0.00 0.00 23.12 22.75 1t60 s ALA 94 CO 0.03 0.34 0.00 -1.91 0.00 0.00 0.00 175.76 174.22 1t60 n GLU 95 N 0.56 0.00 0.32 0.00 0.00 -1.12 -1.59 120.64 118.81 1t60 n GLU 95 Ca -0.15 0.00 0.20 0.00 0.00 0.00 0.00 57.16 57.20 1t60 n GLU 95 Cb 0.55 0.00 1.07 0.00 0.00 0.00 0.00 31.44 33.07 1t60 n GLU 95 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.13 178.62 1t60 h GLU 96 N 0.00 0.00 0.00 5.31 4.57 -1.97 -1.55 114.58 120.94 1t60 h GLU 96 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1t60 h GLU 96 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 1t60 h GLU 96 CO 0.00 0.01 0.00 -0.25 -1.18 0.00 0.00 179.01 177.59 1t60 n ASP 97 N -3.35 0.00 0.08 1.04 10.43 -0.62 -2.64 116.55 121.49 1t60 n ASP 97 Ca -0.03 0.17 -0.16 0.00 2.57 0.00 0.00 54.79 57.34 1t60 n ASP 97 Cb 0.10 -0.34 -0.14 0.00 1.84 0.00 0.00 41.12 42.58 1t60 n ASP 97 CO 0.00 0.00 0.00 0.40 -1.07 0.00 0.00 177.20 176.53 1t60 h ILE 98 N 0.00 1.28 -0.94 0.53 2.04 -1.41 -3.39 117.51 115.61 1t60 h ILE 98 Ca 0.00 -2.90 0.24 0.00 1.00 0.00 0.00 64.86 63.20 1t60 h ILE 98 Cb 0.19 2.82 -0.18 0.00 -0.74 0.00 0.00 36.82 38.91 1t60 h ILE 98 CO 0.00 0.84 -0.07 -1.14 0.00 0.00 0.00 178.15 177.78 1t60 n ARG 99 N -3.47 -0.08 0.18 2.37 0.63 -1.08 -0.66 116.66 114.55 1t60 n ARG 99 Ca -0.13 1.44 0.13 0.00 -0.92 0.00 0.00 57.85 58.36 1t60 n ARG 99 Cb 1.04 -2.23 0.63 0.00 0.45 0.00 0.00 32.46 32.34 1t60 n ARG 99 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 1t60 h PRO 100 N 0.00 0.00 0.00 -0.14 0.11 -1.80 -2.99 132.00 127.17 1t60 h PRO 100 Ca 0.53 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.64 1t60 h PRO 100 Cb 1.01 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1t60 h PRO 100 CO -0.92 0.00 -1.22 0.66 -0.21 0.00 0.00 178.00 176.31 1t60 n TYR 101 N -2.39 0.05 -3.28 0.65 4.01 0.16 -4.59 117.16 111.77 1t60 n TYR 101 Ca -0.00 0.02 -0.40 0.00 -0.16 0.00 0.00 57.90 57.35 1t60 n TYR 101 Cb 0.12 -0.22 -0.08 0.00 -0.31 0.00 0.00 39.34 38.85 1t60 n TYR 101 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1t60 s ILE 102 N -3.16 5.09 0.54 -0.72 -1.09 -1.13 -1.28 121.20 119.44 1t60 s ILE 102 Ca 0.03 0.71 -0.22 0.00 -2.23 0.00 0.00 60.65 58.94 1t60 s ILE 102 Cb 0.15 -3.81 -0.05 0.00 -1.58 0.00 0.00 42.46 37.17 1t60 s ILE 102 CO 0.86 0.06 1.34 -0.55 -1.23 0.00 0.00 174.94 175.42 1t60 s SER 103 N 1.61 5.37 0.34 3.58 0.15 -0.34 -4.41 113.70 119.99 1t60 s SER 103 Ca 0.19 2.73 0.07 0.00 0.70 0.00 0.00 55.95 59.64 1t60 s SER 103 Cb -0.16 -2.63 -0.02 0.00 -1.71 0.00 0.00 66.02 61.50 1t60 s SER 103 CO 0.10 -1.50 0.40 -0.13 1.20 0.00 0.00 173.24 173.31 1t60 s ARG 104 N -2.87 2.94 0.18 5.44 1.81 -0.82 -1.42 118.95 124.20 1t60 s ARG 104 Ca 0.70 -1.15 -0.13 0.00 -1.72 0.00 0.00 55.73 53.44 1t60 s ARG 104 Cb -0.39 -2.67 0.01 0.00 -0.45 0.00 0.00 34.95 31.44 1t60 s ARG 104 CO 0.47 0.06 0.39 0.00 -0.68 0.00 0.00 175.30 175.54 1t60 s SER 106 N -2.92 -0.12 -0.19 0.00 0.01 -0.67 -0.70 113.70 109.10 1t60 s SER 106 Ca 0.13 0.21 -0.05 0.00 1.31 0.00 0.00 55.95 57.56 1t60 s SER 106 Cb 0.01 0.29 -0.02 0.00 0.21 0.00 0.00 66.02 66.51 1t60 s SER 106 CO -0.01 -0.11 -0.01 -0.69 0.41 0.00 0.00 173.24 172.83 1t60 s VAL 107 N -0.17 3.94 -0.04 3.43 1.01 -0.09 -1.57 120.40 126.90 1t60 s VAL 107 Ca -0.03 -0.32 0.06 0.00 0.00 0.00 0.00 61.98 61.69 1t60 s VAL 107 Cb -0.02 -2.77 -0.01 0.00 0.00 0.00 0.00 36.38 33.58 1t60 s VAL 107 CO 0.00 0.44 -0.22 0.00 0.00 0.00 0.00 175.10 175.32 1t60 s GLU 109 N -0.20 3.71 0.09 0.00 2.56 0.33 -0.10 118.70 125.08 1t60 s GLU 109 Ca -0.00 1.60 0.00 0.00 0.00 0.00 0.00 54.97 56.57 1t60 s GLU 109 Cb -0.12 -4.07 -0.04 0.00 2.00 0.00 0.00 34.13 31.91 1t60 s GLU 109 CO 0.02 -1.40 0.25 0.00 -0.56 0.00 0.00 175.26 173.57 1t60 s ALA 110 N 5.50 3.97 0.27 6.30 0.00 -0.42 -3.87 121.76 133.52 1t60 s ALA 110 Ca 0.73 -0.85 -0.04 0.00 0.00 0.00 0.00 51.96 51.80 1t60 s ALA 110 Cb -0.24 -1.85 0.35 0.00 0.00 0.00 0.00 23.12 21.37 1t60 s ALA 110 CO 0.30 0.74 1.90 -1.35 0.00 0.00 0.00 175.76 177.35 1t60 h PRO 111 N 2.81 1.11 -3.21 0.00 0.11 -1.94 -3.17 132.00 127.71 1t60 h PRO 111 Ca -0.46 -0.12 -0.06 0.00 0.11 0.00 0.00 66.00 65.47 1t60 h PRO 111 Cb 1.17 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 1t60 h PRO 111 CO 0.74 0.80 0.19 0.00 -0.21 0.00 0.00 178.00 179.52 1t60 s ALA 112 N -5.76 -0.47 0.58 -0.75 0.00 -1.26 -2.38 121.76 111.72 1t60 s ALA 112 Ca -0.12 -0.88 -0.17 0.00 0.00 0.00 0.00 51.96 50.79 1t60 s ALA 112 Cb 0.17 0.77 -0.04 0.00 0.00 0.00 0.00 23.12 24.02 1t60 s ALA 112 CO 0.81 -0.95 1.07 0.14 0.00 0.00 0.00 175.76 176.82 1t60 s VAL 113 N -2.48 3.70 0.06 0.00 -7.23 -1.26 -4.75 120.40 108.44 1t60 s VAL 113 Ca 0.18 0.86 0.09 0.00 -1.81 0.00 0.00 61.98 61.30 1t60 s VAL 113 Cb -0.04 -3.35 -0.03 0.00 0.56 0.00 0.00 36.38 33.51 1t60 s VAL 113 CO 0.13 -0.42 -0.25 0.00 -0.31 0.00 0.00 175.10 174.24 1t60 s ALA 114 N -2.32 2.16 0.29 1.32 0.00 -1.26 -1.95 121.76 120.00 1t60 s ALA 114 Ca 0.65 -1.27 0.03 0.00 0.00 0.00 0.00 51.96 51.37 1t60 s ALA 114 Cb -0.17 -0.42 -0.04 0.00 0.00 0.00 0.00 23.12 22.49 1t60 s ALA 114 CO 0.34 0.50 0.15 0.96 0.00 0.00 0.00 175.76 177.71 1t60 s ILE 115 N -0.87 0.30 0.04 0.00 -4.36 0.25 -4.73 121.20 111.83 1t60 s ILE 115 Ca 0.11 -2.00 0.09 0.00 -0.26 0.00 0.00 60.65 58.59 1t60 s ILE 115 Cb -0.10 -2.53 -0.03 0.00 1.25 0.00 0.00 42.46 41.06 1t60 s ILE 115 CO 0.03 0.00 -0.26 0.00 0.24 0.00 0.00 174.94 174.95 1t60 s ALA 116 N -3.69 2.24 0.03 2.27 0.00 -0.68 -0.63 121.76 121.30 1t60 s ALA 116 Ca 0.37 -1.25 0.06 0.00 0.00 0.00 0.00 51.96 51.13 1t60 s ALA 116 Cb 0.05 -0.48 -0.02 0.00 0.00 0.00 0.00 23.12 22.67 1t60 s ALA 116 CO 0.17 0.53 -0.18 0.14 0.00 0.00 0.00 175.76 176.42 1t60 s VAL 117 N -0.78 1.42 -0.04 0.00 -7.23 -0.65 -4.51 120.40 108.60 1t60 s VAL 117 Ca 0.11 -1.02 0.04 0.00 -1.81 0.00 0.00 61.98 59.31 1t60 s VAL 117 Cb -0.10 -1.23 -0.00 0.00 0.56 0.00 0.00 36.38 35.60 1t60 s VAL 117 CO 0.02 0.19 -0.17 -1.00 -0.31 0.00 0.00 175.10 173.83 1t60 s HIS 118 N -0.71 1.66 -0.12 2.82 3.76 -1.26 -1.80 115.29 119.64 1t60 s HIS 118 Ca 0.05 -0.46 0.17 0.00 -0.15 0.00 0.00 55.06 54.67 1t60 s HIS 118 Cb -0.08 -1.12 -0.19 0.00 1.11 0.00 0.00 32.58 32.30 1t60 s HIS 118 CO 0.01 -0.15 0.62 -1.13 -0.85 0.00 0.00 174.74 173.24 1t60 n SER 119 N 3.11 0.61 -3.17 1.40 3.41 -0.65 -4.96 113.62 113.38 1t60 n SER 119 Ca -0.18 0.27 -0.23 0.00 -0.26 0.00 0.00 58.87 58.47 1t60 n SER 119 Cb 0.53 0.47 0.04 0.00 -0.26 0.00 0.00 64.21 64.99 1t60 n SER 119 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1t60 n GLN 120 N -2.82 -5.30 -3.86 4.33 6.02 -1.26 -4.91 117.38 109.57 1t60 n GLN 120 Ca -0.15 0.85 -0.10 0.00 -0.01 0.00 0.00 57.00 57.60 1t60 n GLN 120 Cb 0.91 -5.74 -0.06 0.00 1.02 0.00 0.00 30.24 26.37 1t60 n GLN 120 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1t60 s ASP 121 N -2.82 -0.07 0.48 1.08 2.15 -1.26 0.03 116.67 116.26 1t60 s ASP 121 Ca 0.37 -0.69 0.27 0.00 0.43 0.00 0.00 52.55 52.93 1t60 s ASP 121 Cb -0.17 0.48 1.15 0.00 -0.30 0.00 0.00 42.92 44.09 1t60 s ASP 121 CO 0.46 -0.94 1.92 -0.37 -0.17 0.00 0.00 175.17 176.07 1t60 h VAL 122 N 2.42 0.43 -4.17 1.11 -1.51 -1.87 -3.02 116.25 109.64 1t60 h VAL 122 Ca -0.31 -0.86 -0.48 0.00 -1.23 0.00 0.00 66.70 63.82 1t60 h VAL 122 Cb 1.24 1.61 0.04 0.00 -2.13 0.00 0.00 31.29 32.05 1t60 h VAL 122 CO 0.45 0.15 0.38 -0.94 -1.23 0.00 0.00 177.57 176.37 1t60 s SER 123 N -6.06 6.22 -0.04 4.19 1.04 -1.26 -4.83 113.70 112.97 1t60 s SER 123 Ca -0.00 1.73 -0.25 0.00 0.48 0.00 0.00 55.95 57.90 1t60 s SER 123 Cb 0.11 -2.53 -0.04 0.00 0.10 0.00 0.00 66.02 63.66 1t60 s SER 123 CO 0.60 -0.86 0.79 -0.63 0.98 0.00 0.00 173.24 174.12 1t60 s ILE 124 N -2.45 4.98 0.25 -1.02 1.01 -1.26 -4.51 121.20 118.20 1t60 s ILE 124 Ca 0.62 1.64 -0.30 0.00 0.00 0.00 0.00 60.65 62.62 1t60 s ILE 124 Cb -0.13 -4.13 -0.09 0.00 0.01 0.00 0.00 42.46 38.11 1t60 s ILE 124 CO 0.32 0.23 1.27 -2.16 0.00 0.00 0.00 174.94 174.60 1t60 s PRO 125 N 0.82 4.42 0.48 2.79 0.04 -1.26 -5.00 135.00 137.29 1t60 s PRO 125 Ca 0.42 2.06 -0.21 0.00 0.04 0.00 0.00 61.00 63.31 1t60 s PRO 125 Cb -0.19 -3.15 -0.08 0.00 0.04 0.00 0.00 34.50 31.11 1t60 s PRO 125 CO 0.21 -0.15 1.05 -1.01 0.04 0.00 0.00 177.00 177.14 1t60 s HIS 126 N -0.51 3.00 0.43 0.56 3.76 -1.26 -4.62 115.29 116.64 1t60 s HIS 126 Ca 0.52 1.58 -0.23 0.00 -0.15 0.00 0.00 55.06 56.78 1t60 s HIS 126 Cb -0.37 -3.10 -0.09 0.00 1.11 0.00 0.00 32.58 30.14 1t60 s HIS 126 CO 0.43 -0.88 1.05 0.00 -0.85 0.00 0.00 174.74 174.49 1t60 n PRO 128 N -0.36 0.41 -1.75 0.00 -0.02 -1.26 -4.84 135.00 127.17 1t60 n PRO 128 Ca 0.06 0.20 -0.42 0.00 -2.02 0.00 0.00 63.50 61.32 1t60 n PRO 128 Cb 0.50 -2.24 -0.03 0.00 -0.02 0.00 0.00 33.50 31.71 1t60 n PRO 128 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1t60 s ALA 129 N -1.90 3.86 0.00 3.55 0.00 -1.26 -1.58 121.76 124.43 1t60 s ALA 129 Ca 0.72 1.51 0.00 0.00 0.00 0.00 0.00 51.96 54.19 1t60 s ALA 129 Cb -0.33 -3.71 0.00 0.00 0.00 0.00 0.00 23.12 19.08 1t60 s ALA 129 CO 0.51 -1.02 0.00 0.41 0.00 0.00 0.00 175.76 175.67 1t60 n GLY 130 N 4.04 0.63 3.39 0.00 0.00 -1.26 -5.02 105.19 106.97 1t60 n GLY 130 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 1t60 n GLY 130 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1t60 s TRP 131 N -2.20 2.30 0.10 1.61 0.52 -0.62 0.11 118.94 120.76 1t60 s TRP 131 Ca 0.00 -0.38 0.08 0.00 0.02 0.00 0.00 56.10 55.82 1t60 s TRP 131 Cb 0.00 -1.24 -0.04 0.00 -1.15 0.00 0.00 33.47 31.04 1t60 s TRP 131 CO 0.00 0.35 -0.17 -0.98 0.02 0.00 0.00 176.95 176.16 1t60 s ARG 132 N -2.09 1.88 0.30 4.98 1.70 0.54 -4.73 118.95 121.54 1t60 s ARG 132 Ca 0.14 -1.12 -0.28 0.00 -0.47 0.00 0.00 55.73 54.00 1t60 s ARG 132 Cb -0.10 -2.15 -0.09 0.00 -0.57 0.00 0.00 34.95 32.04 1t60 s ARG 132 CO 0.06 0.50 1.08 0.45 -1.08 0.00 0.00 175.30 176.31 1t60 s SER 133 N -1.98 7.18 -0.12 -2.89 0.15 -1.26 -0.15 113.70 114.62 1t60 s SER 133 Ca 0.17 2.21 0.01 0.00 0.70 0.00 0.00 55.95 59.04 1t60 s SER 133 Cb -0.11 -2.62 -0.08 0.00 -1.71 0.00 0.00 66.02 61.51 1t60 s SER 133 CO 0.09 -0.20 -0.11 0.18 1.20 0.00 0.00 173.24 174.41 1t60 n LEU 134 N 0.94 2.91 -3.56 3.45 4.77 -0.00 -4.89 117.00 120.61 1t60 n LEU 134 Ca 0.00 -0.05 -0.06 0.00 -0.03 0.00 0.00 56.01 55.87 1t60 n LEU 134 Cb 0.46 -0.41 -0.02 0.00 -2.33 0.00 0.00 43.42 41.12 1t60 n LEU 134 CO 0.52 0.68 0.82 -1.66 -1.33 0.00 0.00 177.39 176.42 1t60 s TRP 135 N -2.23 -0.23 0.32 -1.77 -2.14 -1.22 -5.02 118.94 106.64 1t60 s TRP 135 Ca -0.16 0.11 0.10 0.00 2.66 0.00 0.00 56.10 58.81 1t60 s TRP 135 Cb 0.04 0.54 -0.06 0.00 -3.10 0.00 0.00 33.47 30.90 1t60 s TRP 135 CO 0.27 -0.44 -0.08 0.96 -2.66 0.00 0.00 176.95 175.00 1t60 s ILE 136 N -2.86 2.50 0.00 0.66 -4.36 -1.26 -0.69 121.20 115.18 1t60 s ILE 136 Ca 0.08 -2.16 0.00 0.00 -0.26 0.00 0.00 60.65 58.31 1t60 s ILE 136 Cb -0.01 -2.63 0.00 0.00 1.25 0.00 0.00 42.46 41.07 1t60 s ILE 136 CO -0.06 -0.26 0.00 0.61 0.24 0.00 0.00 174.94 175.47 1t60 n GLY 137 N -0.81 1.62 3.34 6.27 0.00 -0.51 -4.37 105.19 110.72 1t60 n GLY 137 Ca -0.05 -0.28 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 1t60 n GLY 137 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1t60 s TYR 138 N -0.88 2.29 -0.74 1.61 1.51 0.62 -1.80 117.35 119.96 1t60 s TYR 138 Ca 0.00 -0.41 -0.26 0.00 -1.01 0.00 0.00 57.07 55.39 1t60 s TYR 138 Cb 0.00 -1.36 -0.03 0.00 -0.11 0.00 0.00 41.96 40.45 1t60 s TYR 138 CO 0.00 0.14 1.91 -1.12 -1.11 0.00 0.00 175.55 175.36 1t60 s SER 139 N -1.28 5.20 -0.44 2.29 0.01 -0.75 -2.18 113.70 116.55 1t60 s SER 139 Ca 0.12 -0.12 -0.21 0.00 1.31 0.00 0.00 55.95 57.04 1t60 s SER 139 Cb -0.10 -2.54 0.02 0.00 0.21 0.00 0.00 66.02 63.61 1t60 s SER 139 CO 0.02 -2.56 0.69 0.12 0.41 0.00 0.00 173.24 171.93 1t60 s PHE 140 N 9.59 3.04 -0.17 2.43 5.36 0.54 -2.07 117.98 136.70 1t60 s PHE 140 Ca 0.69 0.03 -0.14 0.00 -0.96 0.00 0.00 56.93 56.54 1t60 s PHE 140 Cb -0.10 -3.45 -0.07 0.00 -0.34 0.00 0.00 43.02 39.06 1t60 s PHE 140 CO 0.11 -0.90 -0.19 -0.11 -1.46 0.00 0.00 175.22 172.67 1t60 n LEU 141 N 6.41 1.87 -3.98 6.12 7.94 -0.39 -4.47 117.00 130.50 1t60 n LEU 141 Ca -0.00 0.49 -0.13 0.00 -1.11 0.00 0.00 56.01 55.26 1t60 n LEU 141 Cb 0.48 -0.84 -0.01 0.00 0.53 0.00 0.00 43.42 43.57 1t60 n LEU 141 CO 0.55 -0.21 0.30 0.00 -1.11 0.00 0.00 177.39 176.92 1t60 s MET 142 N -2.47 2.07 0.15 1.96 0.23 -1.10 -0.54 119.30 119.60 1t60 s MET 142 Ca -0.23 -1.66 -0.20 0.00 -1.03 0.00 0.00 55.69 52.57 1t60 s MET 142 Cb 0.04 0.52 0.05 0.00 -1.53 0.00 0.00 34.83 33.91 1t60 s MET 142 CO 0.36 -0.91 0.53 -3.38 -2.03 0.00 0.00 175.02 169.59 1t60 s HIS 143 N -2.69 -0.38 0.06 3.16 -3.43 0.82 -0.42 115.29 112.40 1t60 s HIS 143 Ca 0.25 0.12 -0.12 0.00 -0.80 0.00 0.00 55.06 54.50 1t60 s HIS 143 Cb -0.02 0.45 0.01 0.00 -1.43 0.00 0.00 32.58 31.59 1t60 s HIS 143 CO 0.17 -0.82 0.28 0.95 -2.00 0.00 0.00 174.74 173.32 1t60 s THR 144 N -3.78 0.10 0.00 -5.38 -4.23 -0.96 -1.42 115.64 99.97 1t60 s THR 144 Ca 0.03 -0.79 0.00 0.00 -1.18 0.00 0.00 61.69 59.74 1t60 s THR 144 Cb -0.00 -1.02 0.00 0.00 1.34 0.00 0.00 72.50 72.82 1t60 s THR 144 CO -0.11 -0.44 0.00 0.00 -0.54 0.00 0.00 174.62 173.53 1t60 n ALA 145 N 0.41 0.00 -1.69 3.99 0.00 -0.54 -1.00 120.51 121.69 1t60 n ALA 145 Ca -0.18 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 52.82 1t60 n ALA 145 Cb 0.60 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.03 1t60 n ALA 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1t60 n ALA 146 N -3.00 1.45 -0.82 0.00 0.00 -1.26 -4.56 120.51 112.33 1t60 n ALA 146 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1t60 n ALA 146 Cb 0.00 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.12 1t60 n ALA 146 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1t60 n GLY 147 N 2.36 3.19 0.45 0.00 0.00 -1.26 -1.77 105.19 108.15 1t60 n GLY 147 Ca 0.12 -0.16 0.09 0.00 0.00 0.00 0.00 46.02 46.07 1t60 n GLY 147 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1t60 n ASP 148 N 3.05 3.04 -4.83 1.61 3.85 -1.26 -5.02 116.55 116.99 1t60 n ASP 148 Ca 0.00 -3.03 -0.33 0.00 -0.71 0.00 0.00 54.79 50.72 1t60 n ASP 148 Cb 0.00 -0.47 -0.06 0.00 -1.35 0.00 0.00 41.12 39.23 1t60 n ASP 148 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 1t60 s GLU 149 N -2.80 4.17 0.00 0.11 0.41 -0.73 -4.89 118.70 114.97 1t60 s GLU 149 Ca 0.36 1.06 0.00 0.00 -0.41 0.00 0.00 54.97 55.98 1t60 s GLU 149 Cb 0.30 -2.20 0.00 0.00 -1.78 0.00 0.00 34.13 30.46 1t60 s GLU 149 CO 0.06 -0.05 0.00 0.41 -0.49 0.00 0.00 175.26 175.19 1t60 n GLY 150 N -0.75 -0.67 0.00 -1.39 0.00 -1.26 -1.47 105.19 99.65 1t60 n GLY 150 Ca 0.07 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1t60 n GLY 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t60 n GLY 151 N 0.00 -0.81 3.74 -0.02 0.00 -0.51 -4.75 105.19 102.85 1t60 n GLY 151 Ca 0.00 -0.73 -0.05 0.00 0.00 0.00 0.00 46.02 45.24 1t60 n GLY 151 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1t60 s GLY 152 N 0.00 -0.24 0.26 -0.02 0.00 -1.26 -0.13 107.32 105.93 1t60 s GLY 152 Ca 0.00 0.13 0.06 0.00 0.00 0.00 0.00 44.72 44.90 1t60 s GLY 152 CO 0.00 0.02 0.36 1.20 0.00 0.00 0.00 173.10 174.68 1t60 s GLN 153 N -3.40 3.32 -0.15 2.90 -1.52 0.30 -4.95 119.66 116.16 1t60 s GLN 153 Ca 0.11 -0.84 -0.22 0.00 -1.95 0.00 0.00 55.36 52.46 1t60 s GLN 153 Cb -0.02 -2.84 -0.03 0.00 -0.22 0.00 0.00 33.01 29.90 1t60 s GLN 153 CO 0.02 0.36 0.67 0.45 -0.25 0.00 0.00 175.29 176.53 1t60 s SER 154 N -4.00 6.81 0.41 5.90 0.15 -1.26 -4.91 113.70 116.81 1t60 s SER 154 Ca 0.36 0.98 0.28 0.00 0.70 0.00 0.00 55.95 58.28 1t60 s SER 154 Cb -0.09 -2.38 1.45 0.00 -1.71 0.00 0.00 66.02 63.30 1t60 s SER 154 CO 0.29 -0.22 1.87 -0.07 1.20 0.00 0.00 173.24 176.30 1t60 h LEU 155 N 7.67 0.00 -0.29 3.45 3.38 -1.95 -0.93 115.31 126.64 1t60 h LEU 155 Ca -0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1t60 h LEU 155 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1t60 h LEU 155 CO 0.78 0.00 -0.59 0.55 0.09 0.00 0.00 178.44 179.27 1t60 n VAL 156 N -2.52 0.00 -3.38 1.22 3.14 -1.26 -4.52 118.33 111.01 1t60 n VAL 156 Ca -0.01 -0.07 -0.37 0.00 -2.96 0.00 0.00 64.34 60.93 1t60 n VAL 156 Cb 0.10 0.68 -0.06 0.00 -1.06 0.00 0.00 33.84 33.51 1t60 n VAL 156 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 1t60 s SER 157 N -2.80 6.87 0.66 6.55 0.15 -0.35 -1.69 113.70 123.09 1t60 s SER 157 Ca 0.14 1.08 0.37 0.00 0.70 0.00 0.00 55.95 58.25 1t60 s SER 157 Cb 0.18 -2.29 2.04 0.00 -1.71 0.00 0.00 66.02 64.23 1t60 s SER 157 CO 0.69 0.19 2.16 -0.65 1.20 0.00 0.00 173.24 176.83 1t60 h PRO 158 N 4.01 0.00 0.00 5.44 0.11 -1.84 -1.02 132.00 138.70 1t60 h PRO 158 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1t60 h PRO 158 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1t60 h PRO 158 CO 0.64 0.00 0.00 0.78 -0.21 0.00 0.00 178.00 179.21 1t60 h GLY 159 N 0.00 0.00 -0.40 -0.55 0.00 -1.84 -0.82 103.07 99.46 1t60 h GLY 159 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1t60 h GLY 159 CO -0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.40 1t60 n SER 160 N -2.94 1.36 -3.85 0.19 3.41 -0.39 -4.59 113.62 106.81 1t60 n SER 160 Ca -0.02 -1.51 -0.30 0.00 -0.26 0.00 0.00 58.87 56.78 1t60 n SER 160 Cb 0.12 -0.03 -0.13 0.00 -0.26 0.00 0.00 64.21 63.91 1t60 n SER 160 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1t60 s LEU 162 N -0.15 4.53 0.49 0.00 1.43 -0.92 -4.77 118.68 119.29 1t60 s LEU 162 Ca 0.18 1.65 0.26 0.00 -1.03 0.00 0.00 54.13 55.19 1t60 s LEU 162 Cb -0.23 -3.37 1.34 0.00 0.03 0.00 0.00 46.19 43.95 1t60 s LEU 162 CO -0.02 0.08 1.88 -0.33 0.23 0.00 0.00 176.35 178.19 1t60 h GLU 163 N 5.03 0.14 -3.20 1.70 5.08 -1.88 0.18 114.58 121.62 1t60 h GLU 163 Ca -0.45 -0.01 -0.17 0.00 -1.00 0.00 0.00 59.36 57.73 1t60 h GLU 163 Cb 1.21 -0.03 -0.26 0.00 0.50 0.00 0.00 28.75 30.16 1t60 h GLU 163 CO 0.69 0.09 -0.46 0.34 -1.00 0.00 0.00 179.01 178.67 1t60 s ASP 164 N -5.66 -0.23 0.33 1.42 3.68 -1.26 -4.46 116.67 110.49 1t60 s ASP 164 Ca -0.06 0.44 -0.29 0.00 2.13 0.00 0.00 52.55 54.77 1t60 s ASP 164 Cb 0.22 0.44 -0.12 0.00 -1.45 0.00 0.00 42.92 42.01 1t60 s ASP 164 CO 0.77 -0.08 1.48 0.33 0.13 0.00 0.00 175.17 177.80 1t60 n PHE 165 N 3.02 2.73 -3.70 -5.34 -0.00 -1.26 -4.88 117.46 108.02 1t60 n PHE 165 Ca -0.13 0.40 -0.15 0.00 -0.00 0.00 0.00 57.45 57.57 1t60 n PHE 165 Cb 0.58 -2.52 -0.15 0.00 -0.00 0.00 0.00 39.48 37.39 1t60 n PHE 165 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 1t60 s ARG 166 N -1.36 0.05 0.16 -4.13 0.52 -1.26 -5.05 118.95 107.88 1t60 s ARG 166 Ca 0.59 0.46 -0.15 0.00 -0.52 0.00 0.00 55.73 56.11 1t60 s ARG 166 Cb -0.52 -0.24 0.07 0.00 0.52 0.00 0.00 34.95 34.79 1t60 s ARG 166 CO 0.57 -0.24 1.76 0.00 0.02 0.00 0.00 175.30 177.41 1t60 h ALA 167 N 7.85 0.48 -2.73 2.13 0.00 -1.98 -3.34 119.26 121.67 1t60 h ALA 167 Ca -0.27 0.03 -0.61 0.00 0.00 0.00 0.00 54.91 54.07 1t60 h ALA 167 Cb 1.13 -0.02 -0.40 0.00 0.00 0.00 0.00 17.79 18.50 1t60 h ALA 167 CO 0.27 -0.21 -0.77 0.99 0.00 0.00 0.00 179.25 179.54 1t60 s THR 168 N -6.15 1.64 -2.00 0.00 2.01 -1.26 -3.98 115.64 105.90 1t60 s THR 168 Ca -0.13 -3.47 0.01 0.00 0.31 0.00 0.00 61.69 58.40 1t60 s THR 168 Cb 0.12 -2.09 0.02 0.00 0.01 0.00 0.00 72.50 70.55 1t60 s THR 168 CO 0.72 -1.12 0.95 -0.81 -0.69 0.00 0.00 174.62 173.67 1t60 n PRO 169 N 2.41 0.93 -3.95 4.92 -0.04 -1.25 -4.87 135.00 133.15 1t60 n PRO 169 Ca 0.24 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.62 1t60 n PRO 169 Cb 0.41 -1.01 -0.09 0.00 -0.04 0.00 0.00 33.50 32.77 1t60 n PRO 169 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1t60 s PHE 170 N -2.00 0.26 0.15 0.54 -0.71 -1.26 -1.08 117.98 113.88 1t60 s PHE 170 Ca 0.01 -0.62 0.10 0.00 -1.04 0.00 0.00 56.93 55.38 1t60 s PHE 170 Cb 0.00 -0.18 -0.04 0.00 -1.21 0.00 0.00 43.02 41.59 1t60 s PHE 170 CO 0.01 -0.38 -0.23 -1.50 -1.34 0.00 0.00 175.22 171.77 1t60 s ILE 171 N -2.97 2.11 -0.19 -4.49 2.07 0.04 -4.81 121.20 112.97 1t60 s ILE 171 Ca -0.02 -1.83 -0.07 0.00 -1.41 0.00 0.00 60.65 57.32 1t60 s ILE 171 Cb 0.01 -1.93 -0.04 0.00 0.13 0.00 0.00 42.46 40.64 1t60 s ILE 171 CO -0.06 -0.07 0.04 -0.70 -1.91 0.00 0.00 174.94 172.24 1t60 s GLU 172 N -2.34 3.86 -0.16 3.50 2.12 -1.00 -1.83 118.70 122.86 1t60 s GLU 172 Ca 0.15 -0.40 -0.02 0.00 0.36 0.00 0.00 54.97 55.06 1t60 s GLU 172 Cb -0.09 -3.17 -0.02 0.00 0.26 0.00 0.00 34.13 31.11 1t60 s GLU 172 CO 0.07 0.19 -0.09 0.00 -0.54 0.00 0.00 175.26 174.89 1t60 s ASN 174 N 0.64 6.17 0.00 0.00 3.04 0.17 -2.12 114.94 122.83 1t60 s ASN 174 Ca -0.05 -0.13 0.00 0.00 0.04 0.00 0.00 52.86 52.72 1t60 s ASN 174 Cb -0.15 -2.55 0.00 0.00 -1.54 0.00 0.00 41.25 37.01 1t60 s ASN 174 CO 0.03 -1.76 0.58 0.61 -3.04 0.00 0.00 177.10 173.51 1t60 n GLY 175 N 5.30 -2.58 0.20 1.21 0.00 -0.86 -1.04 105.19 107.42 1t60 n GLY 175 Ca 0.07 0.52 -0.00 0.00 0.00 0.00 0.00 46.02 46.61 1t60 n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t60 h ALA 176 N -1.12 1.24 0.00 4.61 0.00 -1.86 -2.96 119.26 119.17 1t60 h ALA 176 Ca 0.00 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.47 1t60 h ALA 176 Cb 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1t60 h ALA 176 CO 0.00 0.52 -0.39 -0.09 0.00 0.00 0.00 179.25 179.29 1t60 h ARG 177 N 0.16 0.00 -0.29 0.00 9.65 -1.85 -3.47 114.38 118.58 1t60 h ARG 177 Ca 0.02 0.00 -0.07 0.00 -1.10 0.00 0.00 59.98 58.83 1t60 h ARG 177 Cb 0.70 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.26 1t60 h ARG 177 CO 0.05 0.39 -0.07 0.41 2.80 0.00 0.00 179.97 183.56 1t60 n GLY 178 N -0.34 0.45 3.28 2.80 0.00 -0.20 -4.97 105.19 106.21 1t60 n GLY 178 Ca -0.02 -0.85 -0.18 0.00 0.00 0.00 0.00 46.02 44.97 1t60 n GLY 178 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1t60 s THR 179 N -2.14 1.47 0.13 2.61 -4.23 -1.23 -2.78 115.64 109.48 1t60 s THR 179 Ca 0.00 -1.91 0.06 0.00 -1.18 0.00 0.00 61.69 58.66 1t60 s THR 179 Cb 0.00 -1.74 -0.04 0.00 1.34 0.00 0.00 72.50 72.06 1t60 s THR 179 CO 0.00 -0.49 -0.13 0.00 -0.54 0.00 0.00 174.62 173.46 1t60 s HIS 181 N -2.53 -0.22 -0.23 0.00 5.04 0.50 -0.94 115.29 116.92 1t60 s HIS 181 Ca 0.12 -0.05 -0.06 0.00 -1.54 0.00 0.00 55.06 53.52 1t60 s HIS 181 Cb -0.03 0.61 -0.03 0.00 0.04 0.00 0.00 32.58 33.18 1t60 s HIS 181 CO 0.03 -0.79 0.04 0.71 -2.34 0.00 0.00 174.74 172.39 1t60 s TYR 182 N -3.32 3.08 0.11 3.88 1.51 -1.26 -2.37 117.35 118.99 1t60 s TYR 182 Ca 0.10 -0.41 0.06 0.00 -1.01 0.00 0.00 57.07 55.81 1t60 s TYR 182 Cb -0.02 -2.17 -0.04 0.00 -0.11 0.00 0.00 41.96 39.63 1t60 s TYR 182 CO -0.01 -0.28 -0.04 0.71 -1.11 0.00 0.00 175.55 174.82 1t60 s TYR 183 N 1.29 2.86 0.24 2.71 1.51 -1.26 -5.02 117.35 119.66 1t60 s TYR 183 Ca 0.04 -0.10 0.27 0.00 -1.01 0.00 0.00 57.07 56.27 1t60 s TYR 183 Cb -0.15 -1.46 1.47 0.00 -0.11 0.00 0.00 41.96 41.72 1t60 s TYR 183 CO 0.02 0.47 1.81 0.00 -1.11 0.00 0.00 175.55 176.74 1t60 h ALA 184 N 3.36 1.11 -0.31 3.71 0.00 -2.02 -2.44 119.26 122.68 1t60 h ALA 184 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1t60 h ALA 184 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1t60 h ALA 184 CO 0.56 -0.11 0.00 0.27 0.00 0.00 0.00 179.25 179.97 1t60 n ASN 185 N -2.54 2.13 -4.71 0.00 6.94 -1.26 -4.90 115.26 110.92 1t60 n ASN 185 Ca -0.02 -1.87 -0.42 0.00 -0.02 0.00 0.00 54.58 52.25 1t60 n ASN 185 Cb 0.18 -0.20 -0.03 0.00 -2.36 0.00 0.00 39.78 37.37 1t60 n ASN 185 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1t60 s LYS 186 N -1.60 4.42 0.01 -3.83 1.02 -0.92 -4.22 119.74 114.62 1t60 s LYS 186 Ca 0.31 1.74 0.05 0.00 0.02 0.00 0.00 55.97 58.09 1t60 s LYS 186 Cb 0.17 -3.40 -0.02 0.00 -0.52 0.00 0.00 37.83 34.07 1t60 s LYS 186 CO 0.24 -0.29 -0.16 0.71 -0.92 0.00 0.00 175.35 174.93 1t60 s TYR 187 N 1.30 1.38 -0.02 3.18 4.12 -0.17 -4.99 117.35 122.15 1t60 s TYR 187 Ca 0.58 -0.29 0.07 0.00 0.02 0.00 0.00 57.07 57.45 1t60 s TYR 187 Cb -0.28 -0.87 -0.02 0.00 -1.52 0.00 0.00 41.96 39.27 1t60 s TYR 187 CO 0.28 0.00 -0.24 -1.54 0.02 0.00 0.00 175.55 174.07 1t60 s SER 188 N -0.61 3.22 -0.04 2.29 1.04 -1.26 -2.26 113.70 116.08 1t60 s SER 188 Ca 0.05 -0.43 0.07 0.00 0.48 0.00 0.00 55.95 56.12 1t60 s SER 188 Cb -0.07 -0.42 -0.02 0.00 0.10 0.00 0.00 66.02 65.61 1t60 s SER 188 CO 0.00 0.32 -0.24 -0.36 0.98 0.00 0.00 173.24 173.95 1t60 s PHE 189 N -0.64 2.42 0.05 5.02 0.40 0.44 -4.98 117.98 120.69 1t60 s PHE 189 Ca 0.10 -0.50 0.04 0.00 -0.60 0.00 0.00 56.93 55.97 1t60 s PHE 189 Cb -0.10 -1.56 -0.02 0.00 0.51 0.00 0.00 43.02 41.85 1t60 s PHE 189 CO -0.01 -0.07 -0.11 -1.58 0.70 0.00 0.00 175.22 174.15 1t60 s TRP 190 N -0.46 0.93 0.43 0.36 0.52 -1.26 -1.26 118.94 118.20 1t60 s TRP 190 Ca 0.05 -0.43 -0.25 0.00 0.02 0.00 0.00 56.10 55.49 1t60 s TRP 190 Cb -0.11 -0.54 -0.08 0.00 -1.15 0.00 0.00 33.47 31.59 1t60 s TRP 190 CO 0.01 -0.01 1.26 -0.51 0.02 0.00 0.00 176.95 177.71 1t60 s LEU 191 N -1.46 4.12 0.46 2.99 1.43 -0.88 -4.90 118.68 120.43 1t60 s LEU 191 Ca -0.05 2.54 0.02 0.00 -1.03 0.00 0.00 54.13 55.61 1t60 s LEU 191 Cb -0.09 -4.04 0.00 0.00 0.03 0.00 0.00 46.19 42.09 1t60 s LEU 191 CO 0.01 -0.93 0.66 0.42 0.23 0.00 0.00 176.35 176.75 1t60 s THR 192 N -1.35 3.66 0.05 5.49 -4.23 -1.26 -0.58 115.64 117.42 1t60 s THR 192 Ca 0.60 -0.62 -0.19 0.00 -1.18 0.00 0.00 61.69 60.30 1t60 s THR 192 Cb -0.35 -3.34 -0.06 0.00 1.34 0.00 0.00 72.50 70.09 1t60 s THR 192 CO 0.44 -0.22 0.56 0.42 -0.54 0.00 0.00 174.62 175.28 1t60 s THR 193 N -2.54 4.81 -0.15 3.99 -4.23 -0.61 -4.01 115.64 112.89 1t60 s THR 193 Ca 0.50 1.19 0.01 0.00 -1.18 0.00 0.00 61.69 62.21 1t60 s THR 193 Cb -0.10 -3.89 0.02 0.00 1.34 0.00 0.00 72.50 69.87 1t60 s THR 193 CO 0.37 0.52 -0.18 -0.63 -0.54 0.00 0.00 174.62 174.16 1t60 s ILE 194 N -0.86 1.82 0.31 2.99 1.01 0.11 -4.89 121.20 121.69 1t60 s ILE 194 Ca 0.29 -0.80 0.04 0.00 0.00 0.00 0.00 60.65 60.17 1t60 s ILE 194 Cb -0.19 -1.65 0.12 0.00 0.01 0.00 0.00 42.46 40.74 1t60 s ILE 194 CO 0.18 0.50 1.81 1.55 0.00 0.00 0.00 174.94 178.98 1t60 h PRO 195 N 7.77 0.49 -7.14 2.79 0.13 -1.97 -3.44 132.00 130.63 1t60 h PRO 195 Ca -0.38 -0.14 -0.55 0.00 -0.87 0.00 0.00 66.00 64.06 1t60 h PRO 195 Cb 1.15 -0.05 0.16 0.00 0.13 0.00 0.00 31.00 32.39 1t60 h PRO 195 CO 0.56 0.61 0.46 -1.21 -0.23 0.00 0.00 178.00 178.19 1t60 s GLU 196 N -4.75 2.29 0.30 0.86 8.01 -1.26 -4.90 118.70 119.25 1t60 s GLU 196 Ca -0.07 1.94 -0.01 0.00 0.01 0.00 0.00 54.97 56.84 1t60 s GLU 196 Cb 0.15 -1.83 0.47 0.00 -4.31 0.00 0.00 34.13 28.61 1t60 s GLU 196 CO 0.78 -1.77 1.95 0.37 0.01 0.00 0.00 175.26 176.60 1t60 h GLN 197 N 0.09 1.06 0.00 1.61 5.75 -2.02 -3.42 115.11 118.19 1t60 h GLN 197 Ca -0.49 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 57.94 1t60 h GLN 197 Cb 1.32 -0.24 0.00 0.00 1.07 0.00 0.00 27.48 29.63 1t60 h GLN 197 CO 0.51 0.70 0.00 -1.13 -2.65 0.00 0.00 178.83 176.26 1t60 n SER 198 N -4.43 0.00 -3.81 -0.69 3.41 -1.26 -5.11 113.62 101.73 1t60 n SER 198 Ca 0.11 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.46 1t60 n SER 198 Cb 0.08 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 63.86 1t60 n SER 198 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1t60 s PHE 199 N 0.00 1.15 -0.11 7.33 5.36 -1.26 -5.12 117.98 125.32 1t60 s PHE 199 Ca 0.00 -0.68 -0.12 0.00 -0.96 0.00 0.00 56.93 55.17 1t60 s PHE 199 Cb 0.00 -1.05 -0.05 0.00 -0.34 0.00 0.00 43.02 41.58 1t60 s PHE 199 CO 0.00 -0.51 0.28 -1.14 -1.46 0.00 0.00 175.22 172.39 1t60 s GLN 200 N 1.82 3.96 0.00 10.12 0.74 -1.26 -4.83 119.66 130.21 1t60 s GLN 200 Ca 0.02 0.12 0.00 0.00 0.05 0.00 0.00 55.36 55.55 1t60 s GLN 200 Cb -0.14 -3.31 0.00 0.00 1.10 0.00 0.00 33.01 30.66 1t60 s GLN 200 CO -0.07 0.50 0.00 0.41 -0.55 0.00 0.00 175.29 175.58 1t60 n GLY 201 N 2.61 -0.17 3.69 2.59 0.00 -1.26 -4.88 105.19 107.77 1t60 n GLY 201 Ca -0.15 -1.73 -0.65 0.00 0.00 0.00 0.00 46.02 43.50 1t60 n GLY 201 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1t60 n THR 202 N -0.23 0.04 -2.04 2.61 -1.04 -1.26 -4.84 114.28 107.52 1t60 n THR 202 Ca 0.00 -0.01 -0.37 0.00 -2.04 0.00 0.00 64.05 61.64 1t60 n THR 202 Cb 0.00 -0.50 0.02 0.00 -1.82 0.00 0.00 70.33 68.03 1t60 n THR 202 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1t60 s PRO 203 N 2.41 3.25 -0.62 -2.82 0.02 -1.26 -4.96 135.00 131.02 1t60 s PRO 203 Ca 1.01 1.90 -0.16 0.00 0.02 0.00 0.00 61.00 63.77 1t60 s PRO 203 Cb -1.39 -2.15 0.14 0.00 0.02 0.00 0.00 34.50 31.13 1t60 s PRO 203 CO 0.74 -1.00 0.62 0.45 -0.33 0.00 0.00 177.00 177.48 1t60 s SER 204 N -1.38 6.30 0.53 2.53 0.15 -1.26 -5.04 113.70 115.54 1t60 s SER 204 Ca 0.72 -1.86 -0.20 0.00 0.70 0.00 0.00 55.95 55.31 1t60 s SER 204 Cb -0.32 -2.24 -0.08 0.00 -1.71 0.00 0.00 66.02 61.67 1t60 s SER 204 CO 0.37 -0.88 0.72 0.00 1.20 0.00 0.00 173.24 174.65 1t60 n ALA 205 N 5.35 -0.62 -3.54 5.45 0.00 -1.26 -5.00 120.51 120.89 1t60 n ALA 205 Ca -0.07 0.05 -0.09 0.00 0.00 0.00 0.00 53.44 53.33 1t60 n ALA 205 Cb 0.42 -1.94 -0.03 0.00 0.00 0.00 0.00 19.45 17.90 1t60 n ALA 205 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1t60 s ASP 206 N -1.09 -0.36 -0.22 0.00 3.68 -1.26 -5.14 116.67 112.29 1t60 s ASP 206 Ca 0.69 0.18 0.00 0.00 2.13 0.00 0.00 52.55 55.55 1t60 s ASP 206 Cb -0.48 0.34 0.03 0.00 -1.45 0.00 0.00 42.92 41.36 1t60 s ASP 206 CO 0.53 -0.48 -0.13 -0.89 0.13 0.00 0.00 175.17 174.33 1t60 s THR 207 N -2.23 2.44 -0.27 1.71 2.01 -1.26 -5.10 115.64 112.94 1t60 s THR 207 Ca 0.02 -1.04 -0.12 0.00 0.31 0.00 0.00 61.69 60.86 1t60 s THR 207 Cb -0.01 -2.17 -0.05 0.00 0.01 0.00 0.00 72.50 70.28 1t60 s THR 207 CO -0.04 0.33 0.23 -0.76 -0.69 0.00 0.00 174.62 173.69 1t60 s LEU 208 N 1.29 4.03 -0.04 4.42 1.43 -1.26 -5.01 118.68 123.54 1t60 s LEU 208 Ca 0.01 0.07 -0.00 0.00 -1.03 0.00 0.00 54.13 53.18 1t60 s LEU 208 Cb -0.15 -2.19 -0.00 0.00 0.03 0.00 0.00 46.19 43.87 1t60 s LEU 208 CO -0.08 -0.07 -0.01 0.11 0.23 0.00 0.00 176.35 176.53 1t60 h LYS 209 N 8.26 0.00 -1.75 1.70 1.79 -1.99 -3.47 116.57 121.11 1t60 h LYS 209 Ca -0.34 0.00 0.26 0.00 -2.18 0.00 0.00 60.65 58.38 1t60 h LYS 209 Cb 1.18 0.00 -0.13 0.00 -1.58 0.00 0.00 32.23 31.71 1t60 h LYS 209 CO 0.58 0.00 0.71 0.00 -1.08 0.00 0.00 179.45 179.66 1t60 s ALA 210 N -2.81 -2.02 0.00 3.86 0.00 -1.26 -4.86 121.76 114.66 1t60 s ALA 210 Ca -0.00 0.75 0.00 0.00 0.00 0.00 0.00 51.96 52.71 1t60 s ALA 210 Cb 0.00 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.47 1t60 s ALA 210 CO 0.01 -0.93 0.00 0.41 0.00 0.00 0.00 175.76 175.24 1t60 n GLY 211 N -0.39 0.58 1.47 0.00 0.00 -1.26 -4.18 105.19 101.42 1t60 n GLY 211 Ca -0.06 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.06 1t60 n GLY 211 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1t60 n LEU 212 N 0.00 4.31 -0.00 0.99 7.99 -1.26 -4.54 117.00 124.49 1t60 n LEU 212 Ca 0.00 -2.17 -0.00 0.00 -0.01 0.00 0.00 56.01 53.83 1t60 n LEU 212 Cb 0.00 -0.53 -0.00 0.00 -0.11 0.00 0.00 43.42 42.78 1t60 n LEU 212 CO 0.00 0.89 0.02 0.40 -1.51 0.00 0.00 177.39 177.19 1t60 h ILE 213 N 4.17 0.00 -0.98 -0.08 2.04 -1.90 -3.38 117.51 117.39 1t60 h ILE 213 Ca 0.00 -0.07 0.26 0.00 1.00 0.00 0.00 64.86 66.05 1t60 h ILE 213 Cb 1.21 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.23 1t60 h ILE 213 CO 0.12 0.00 0.67 0.03 0.00 0.00 0.00 178.15 178.96 1t60 h ARG 214 N -0.07 0.22 0.00 2.37 3.08 -1.95 0.23 114.38 118.26 1t60 h ARG 214 Ca -0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1t60 h ARG 214 Cb 0.00 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.00 1t60 h ARG 214 CO 0.00 0.14 0.00 0.25 -1.07 0.00 0.00 179.97 179.30 1t60 n THR 215 N -4.42 0.72 0.61 2.04 -2.24 -1.26 -1.51 114.28 108.22 1t60 n THR 215 Ca 0.21 0.18 0.07 0.00 -2.27 0.00 0.00 64.05 62.25 1t60 n THR 215 Cb 0.90 -0.94 0.03 0.00 -2.10 0.00 0.00 70.33 68.22 1t60 n THR 215 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1t60 n HIS 216 N -1.34 0.00 -3.82 4.78 -0.00 0.82 -4.77 115.22 110.87 1t60 n HIS 216 Ca 0.06 0.00 -0.35 0.00 -0.00 0.00 0.00 57.72 57.43 1t60 n HIS 216 Cb 0.13 0.00 -0.09 0.00 -0.00 0.00 0.00 29.99 30.02 1t60 n HIS 216 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 1t60 s ILE 217 N -1.43 5.07 0.44 3.57 -1.09 -0.57 -1.58 121.20 125.61 1t60 s ILE 217 Ca 0.14 0.07 -0.25 0.00 -2.23 0.00 0.00 60.65 58.39 1t60 s ILE 217 Cb 0.12 -3.32 -0.09 0.00 -1.58 0.00 0.00 42.46 37.58 1t60 s ILE 217 CO 0.26 0.42 1.24 -0.24 -1.23 0.00 0.00 174.94 175.38 1t60 n SER 218 N 3.83 2.34 -4.95 3.58 2.88 0.25 -4.60 113.62 116.96 1t60 n SER 218 Ca -0.16 1.08 -0.24 0.00 -1.33 0.00 0.00 58.87 58.21 1t60 n SER 218 Cb 0.52 -1.49 -0.02 0.00 -0.75 0.00 0.00 64.21 62.47 1t60 n SER 218 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1t60 s ARG 219 N -2.26 3.47 0.23 -1.46 1.81 -1.14 -1.81 118.95 117.78 1t60 s ARG 219 Ca 0.63 -0.55 -0.05 0.00 -1.72 0.00 0.00 55.73 54.04 1t60 s ARG 219 Cb -0.50 -2.87 -0.02 0.00 -0.45 0.00 0.00 34.95 31.11 1t60 s ARG 219 CO 0.57 0.41 0.28 0.00 -0.68 0.00 0.00 175.30 175.87 1t60 s GLN 221 N -4.00 0.36 -0.21 0.00 0.74 -0.74 -1.42 119.66 114.38 1t60 s GLN 221 Ca 0.33 0.54 -0.13 0.00 0.05 0.00 0.00 55.36 56.15 1t60 s GLN 221 Cb 0.04 0.09 -0.05 0.00 1.10 0.00 0.00 33.01 34.19 1t60 s GLN 221 CO 0.12 -0.09 0.26 0.08 -0.55 0.00 0.00 175.29 175.12 1t60 s VAL 222 N 0.62 5.30 0.09 1.34 1.01 0.13 -1.64 120.40 127.26 1t60 s VAL 222 Ca -0.04 0.43 0.08 0.00 0.00 0.00 0.00 61.98 62.45 1t60 s VAL 222 Cb -0.05 -3.60 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 1t60 s VAL 222 CO -0.04 0.33 -0.22 0.00 0.00 0.00 0.00 175.10 175.18 1t60 s MET 224 N -1.74 2.25 0.18 0.00 1.75 0.78 -0.58 119.30 121.95 1t60 s MET 224 Ca 0.08 -0.90 -0.33 0.00 -1.25 0.00 0.00 55.69 53.28 1t60 s MET 224 Cb -0.10 -2.05 -0.14 0.00 2.84 0.00 0.00 34.83 35.38 1t60 s MET 224 CO 0.04 0.47 1.51 1.17 -0.65 0.00 0.00 175.02 177.56 1t60 n LYS 225 N 2.67 2.07 -0.33 4.11 3.00 -0.82 -0.34 118.16 128.52 1t60 n LYS 225 Ca -0.17 0.74 0.00 0.00 -0.00 0.00 0.00 58.31 58.89 1t60 n LYS 225 Cb 0.52 -2.47 0.00 0.00 0.00 0.00 0.00 35.03 33.08 1t60 n LYS 225 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49