#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xct s ILE 2 N 0.00 2.29 -0.29 1.69 1.01 -1.26 -4.22 121.20 120.42 1xct s ILE 2 Ca 0.00 0.27 -0.17 0.00 0.00 0.00 0.00 60.65 60.75 1xct s ILE 2 Cb 0.00 -3.17 0.13 0.00 0.01 0.00 0.00 42.46 39.43 1xct s ILE 2 CO 0.00 0.06 0.92 -1.58 0.00 0.00 0.00 174.94 174.33 1xct s GLN 3 N -1.40 0.47 -0.13 2.79 0.74 -1.03 -4.97 119.66 116.13 1xct s GLN 3 Ca 0.55 0.78 -0.01 0.00 0.05 0.00 0.00 55.36 56.73 1xct s GLN 3 Cb -0.45 0.11 -0.02 0.00 1.10 0.00 0.00 33.01 33.75 1xct s GLN 3 CO 0.54 -0.09 -0.10 -0.51 -0.55 0.00 0.00 175.29 174.58 1xct s LEU 4 N 1.28 2.89 -0.23 3.68 1.43 -1.26 -3.11 118.68 123.37 1xct s LEU 4 Ca -0.08 -0.26 -0.02 0.00 -1.03 0.00 0.00 54.13 52.75 1xct s LEU 4 Cb -0.04 -1.66 0.07 0.00 0.03 0.00 0.00 46.19 44.58 1xct s LEU 4 CO -0.15 0.18 0.03 -0.69 0.23 0.00 0.00 176.35 175.95 1xct s VAL 5 N 0.30 0.78 0.13 -1.59 1.01 -0.95 -4.60 120.40 115.48 1xct s VAL 5 Ca -0.08 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.03 1xct s VAL 5 Cb -0.15 -1.30 0.03 0.00 0.00 0.00 0.00 36.38 34.96 1xct s VAL 5 CO 0.05 -0.29 0.17 0.00 0.00 0.00 0.00 175.10 175.03 1xct n GLN 6 N 4.94 -0.39 0.00 2.72 6.02 -1.26 -0.27 117.38 129.15 1xct n GLN 6 Ca -0.08 -0.26 0.00 0.00 -0.01 0.00 0.00 57.00 56.65 1xct n GLN 6 Cb 0.45 -0.19 0.00 0.00 1.02 0.00 0.00 30.24 31.53 1xct n GLN 6 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1xct n SER 7 N -3.14 -0.01 -3.80 1.08 7.64 -0.03 -4.78 113.62 110.58 1xct n SER 7 Ca 0.02 -0.01 -0.20 0.00 1.01 0.00 0.00 58.87 59.70 1xct n SER 7 Cb 0.08 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.25 1xct n SER 7 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xct n GLY 8 N 3.29 3.38 3.73 0.23 0.00 -1.26 -4.85 105.19 109.71 1xct n GLY 8 Ca 0.00 -2.29 -0.42 0.00 0.00 0.00 0.00 46.02 43.31 1xct n GLY 8 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xct s PRO 9 N -3.32 4.21 -0.03 1.61 0.04 -1.26 -4.74 135.00 131.50 1xct s PRO 9 Ca 0.09 2.39 0.06 0.00 0.04 0.00 0.00 61.00 63.58 1xct s PRO 9 Cb -0.01 -3.12 -0.02 0.00 0.04 0.00 0.00 34.50 31.39 1xct s PRO 9 CO 0.06 -0.57 -0.22 -1.21 0.04 0.00 0.00 177.00 175.10 1xct s GLU 10 N 0.47 2.26 -0.09 4.56 0.41 -1.21 -4.75 118.70 120.34 1xct s GLU 10 Ca 0.66 -0.84 0.04 0.00 -0.41 0.00 0.00 54.97 54.42 1xct s GLU 10 Cb -0.44 -2.17 0.00 0.00 -1.78 0.00 0.00 34.13 29.74 1xct s GLU 10 CO 0.37 0.58 -0.22 -1.17 -0.49 0.00 0.00 175.26 174.33 1xct s LEU 11 N -0.65 2.02 -0.05 1.80 0.20 -1.26 -1.95 118.68 118.79 1xct s LEU 11 Ca 0.11 -0.51 -0.02 0.00 0.69 0.00 0.00 54.13 54.39 1xct s LEU 11 Cb -0.10 -1.31 0.04 0.00 -0.43 0.00 0.00 46.19 44.38 1xct s LEU 11 CO -0.00 0.15 0.09 -0.54 -0.29 0.00 0.00 176.35 175.75 1xct s LYS 12 N 0.35 0.00 0.60 1.98 -0.14 -1.04 -5.00 119.74 116.49 1xct s LYS 12 Ca -0.17 0.35 -0.19 0.00 -1.36 0.00 0.00 55.97 54.59 1xct s LYS 12 Cb -0.17 -0.28 -0.03 0.00 -1.68 0.00 0.00 37.83 35.66 1xct s LYS 12 CO 0.08 -0.22 1.21 1.63 -0.76 0.00 0.00 175.35 177.28 1xct n LYS 13 N 4.61 1.22 -1.71 1.68 4.01 -1.03 -2.27 118.16 124.67 1xct n LYS 13 Ca -0.19 0.47 -0.43 0.00 -0.51 0.00 0.00 58.31 57.65 1xct n LYS 13 Cb 0.50 -2.43 -0.03 0.00 -0.51 0.00 0.00 35.03 32.57 1xct n LYS 13 CO 0.00 0.00 0.00 -0.35 -1.11 0.00 0.00 177.40 175.94 1xct n PRO 14 N -1.34 2.52 0.00 1.97 -0.04 -1.25 -1.75 135.00 135.10 1xct n PRO 14 Ca 0.14 0.90 0.00 0.00 -0.04 0.00 0.00 63.50 64.50 1xct n PRO 14 Cb 0.47 -2.67 0.00 0.00 -0.04 0.00 0.00 33.50 31.25 1xct n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1xct n GLY 15 N 2.81 2.48 0.00 0.55 0.00 -0.71 -4.93 105.19 105.40 1xct n GLY 15 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1xct n GLY 15 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xct n GLU 16 N -2.00 0.00 0.00 1.61 1.02 -0.72 -4.15 120.64 116.40 1xct n GLU 16 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1xct n GLU 16 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1xct n GLU 16 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 1xct n THR 17 N 0.00 0.00 -3.66 2.62 5.66 -1.26 -3.61 114.28 114.03 1xct n THR 17 Ca 0.00 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.88 1xct n THR 17 Cb 0.00 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 68.66 1xct n THR 17 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1xct s VAL 18 N -2.00 -0.50 -0.43 1.08 0.11 -1.22 -4.95 120.40 112.49 1xct s VAL 18 Ca 0.00 0.24 -0.14 0.00 -2.93 0.00 0.00 61.98 59.15 1xct s VAL 18 Cb 0.00 -0.52 0.05 0.00 -1.53 0.00 0.00 36.38 34.38 1xct s VAL 18 CO 0.00 0.10 0.32 -0.75 -3.33 0.00 0.00 175.10 171.45 1xct s LYS 19 N 2.49 2.91 0.29 1.54 2.20 -1.26 -3.07 119.74 124.84 1xct s LYS 19 Ca 0.00 -1.23 0.07 0.00 -0.36 0.00 0.00 55.97 54.46 1xct s LYS 19 Cb -0.12 -3.99 -0.03 0.00 -1.51 0.00 0.00 37.83 32.18 1xct s LYS 19 CO -0.10 -0.89 0.26 0.96 -0.36 0.00 0.00 175.35 175.22 1xct s ILE 20 N 1.61 4.06 0.41 5.43 -4.36 0.20 -4.90 121.20 123.65 1xct s ILE 20 Ca 0.04 -1.36 0.03 0.00 -0.26 0.00 0.00 60.65 59.11 1xct s ILE 20 Cb -0.22 -3.32 -0.03 0.00 1.25 0.00 0.00 42.46 40.14 1xct s ILE 20 CO 0.07 -0.26 0.11 -0.94 0.24 0.00 0.00 174.94 174.15 1xct s SER 21 N -3.93 2.91 -0.28 4.36 1.04 -1.26 0.55 113.70 117.09 1xct s SER 21 Ca 0.37 -1.64 -0.01 0.00 0.48 0.00 0.00 55.95 55.15 1xct s SER 21 Cb -0.07 0.44 0.17 0.00 0.10 0.00 0.00 66.02 66.66 1xct s SER 21 CO 0.26 -0.89 0.51 0.00 0.98 0.00 0.00 173.24 174.10 1xct s LYS 23 N 2.73 3.55 0.30 0.00 2.20 0.63 -1.45 119.74 127.69 1xct s LYS 23 Ca 0.17 -0.12 -0.05 0.00 -0.36 0.00 0.00 55.97 55.61 1xct s LYS 23 Cb -0.15 -3.85 0.08 0.00 -1.51 0.00 0.00 37.83 32.40 1xct s LYS 23 CO -0.19 -0.80 0.18 0.00 -0.36 0.00 0.00 175.35 174.18 1xct n ALA 24 N 6.06 -1.07 0.00 3.13 0.00 -1.20 -2.23 120.51 125.20 1xct n ALA 24 Ca -0.02 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1xct n ALA 24 Cb 0.48 -0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1xct n ALA 24 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1xct n SER 25 N -3.58 0.00 0.00 0.00 2.88 -1.18 -4.77 113.62 106.97 1xct n SER 25 Ca 0.03 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 1xct n SER 25 Cb 0.12 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.58 1xct n SER 25 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1xct n GLY 26 N -0.89 0.66 3.52 0.46 0.00 -1.26 -2.46 105.19 105.22 1xct n GLY 26 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1xct n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xct s TYR 27 N -2.61 -0.56 -0.88 1.61 1.13 -1.26 -4.42 117.35 110.36 1xct s TYR 27 Ca 0.00 0.86 -0.25 0.00 -1.41 0.00 0.00 57.07 56.26 1xct s TYR 27 Cb 0.00 0.45 -0.18 0.00 -1.10 0.00 0.00 41.96 41.13 1xct s TYR 27 CO 0.00 -0.59 2.29 -2.37 -2.51 0.00 0.00 175.55 172.38 1xct n THR 28 N 0.62 0.00 -0.36 -3.49 5.66 -1.26 -4.75 114.28 110.70 1xct n THR 28 Ca -0.16 -0.34 -0.08 0.00 -3.05 0.00 0.00 64.05 60.41 1xct n THR 28 Cb 0.59 -1.89 -0.03 0.00 -1.55 0.00 0.00 70.33 67.45 1xct n THR 28 CO 0.00 0.00 0.00 2.22 -3.05 0.00 0.00 175.07 174.24 1xct n PHE 29 N 18.48 0.38 0.00 1.09 -1.74 -1.26 -2.89 117.46 131.51 1xct n PHE 29 Ca 0.45 -0.89 0.00 0.00 -0.56 0.00 0.00 57.45 56.45 1xct n PHE 29 Cb 0.43 -0.98 0.00 0.00 1.52 0.00 0.00 39.48 40.45 1xct n PHE 29 CO 0.00 0.00 0.00 2.41 -0.56 0.00 0.00 176.76 178.61 1xct n THR 30 N 3.71 0.00 1.16 1.97 -1.04 -1.26 -4.71 114.28 114.10 1xct n THR 30 Ca 0.19 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.23 1xct n THR 30 Cb 0.18 0.00 0.10 0.00 -1.82 0.00 0.00 70.33 68.79 1xct n THR 30 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1xct n ASP 31 N -0.65 1.38 -3.84 8.00 9.92 -1.14 -4.52 116.55 125.69 1xct n ASP 31 Ca 0.00 -2.05 -0.12 0.00 -0.53 0.00 0.00 54.79 52.09 1xct n ASP 31 Cb 0.00 -0.21 -0.13 0.00 -0.64 0.00 0.00 41.12 40.14 1xct n ASP 31 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1xct s PHE 32 N -1.68 -0.11 0.32 1.24 0.40 -1.26 -4.94 117.98 111.96 1xct s PHE 32 Ca 0.15 0.26 -0.07 0.00 -0.60 0.00 0.00 56.93 56.67 1xct s PHE 32 Cb 0.08 0.03 -0.06 0.00 0.51 0.00 0.00 43.02 43.59 1xct s PHE 32 CO 0.09 -0.06 0.62 -1.54 0.70 0.00 0.00 175.22 175.03 1xct s SER 33 N 0.00 6.49 -0.15 1.36 1.04 -1.21 -4.46 113.70 116.78 1xct s SER 33 Ca -0.01 0.87 0.01 0.00 0.48 0.00 0.00 55.95 57.30 1xct s SER 33 Cb -0.01 -2.21 0.00 0.00 0.10 0.00 0.00 66.02 63.90 1xct s SER 33 CO 0.00 -0.24 -0.18 -0.32 0.98 0.00 0.00 173.24 173.48 1xct s MET 34 N -3.55 3.15 0.39 4.02 1.75 -1.06 -0.98 119.30 123.03 1xct s MET 34 Ca 0.47 -0.79 0.08 0.00 -1.25 0.00 0.00 55.69 54.20 1xct s MET 34 Cb -0.11 -2.56 -0.05 0.00 2.84 0.00 0.00 34.83 34.96 1xct s MET 34 CO 0.29 0.01 0.19 -1.01 -0.65 0.00 0.00 175.02 173.85 1xct s HIS 35 N 0.81 2.65 0.02 4.11 3.76 -0.99 -2.13 115.29 123.51 1xct s HIS 35 Ca -0.06 -0.51 0.07 0.00 -0.15 0.00 0.00 55.06 54.41 1xct s HIS 35 Cb -0.15 -1.87 -0.02 0.00 1.11 0.00 0.00 32.58 31.64 1xct s HIS 35 CO -0.01 0.20 -0.22 -1.58 -0.85 0.00 0.00 174.74 172.29 1xct s TRP 36 N -2.53 1.95 -0.19 1.40 0.52 -0.34 -2.39 118.94 117.36 1xct s TRP 36 Ca 0.41 -0.38 -0.06 0.00 0.02 0.00 0.00 56.10 56.09 1xct s TRP 36 Cb 0.01 -1.20 0.09 0.00 -1.15 0.00 0.00 33.47 31.22 1xct s TRP 36 CO 0.23 0.04 0.38 0.08 0.02 0.00 0.00 176.95 177.71 1xct s VAL 37 N -0.67 -0.60 0.12 4.03 1.01 -0.64 -0.51 120.40 123.15 1xct s VAL 37 Ca 0.09 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.24 1xct s VAL 37 Cb -0.09 -0.63 -0.04 0.00 0.00 0.00 0.00 36.38 35.62 1xct s VAL 37 CO 0.01 0.06 0.28 0.54 0.00 0.00 0.00 175.10 175.99 1xct s ASN 38 N 2.57 6.37 -0.36 3.32 4.22 -0.58 0.31 114.94 130.80 1xct s ASN 38 Ca 0.00 0.30 -0.00 0.00 -2.14 0.00 0.00 52.86 51.02 1xct s ASN 38 Cb -0.12 -1.97 0.13 0.00 1.28 0.00 0.00 41.25 40.57 1xct s ASN 38 CO -0.12 0.08 0.20 -1.58 -2.04 0.00 0.00 177.10 173.64 1xct s GLN 39 N -2.90 0.66 0.86 3.55 0.74 -1.26 -1.32 119.66 119.98 1xct s GLN 39 Ca 0.36 -1.34 -0.14 0.00 0.05 0.00 0.00 55.36 54.29 1xct s GLN 39 Cb -0.12 -1.54 0.01 0.00 1.10 0.00 0.00 33.01 32.46 1xct s GLN 39 CO 0.28 -1.16 0.50 0.00 -0.55 0.00 0.00 175.29 174.36 1xct n ALA 40 N 4.16 -2.04 -1.66 1.58 0.00 -1.26 -3.48 120.51 117.81 1xct n ALA 40 Ca 0.08 -0.45 -0.48 0.00 0.00 0.00 0.00 53.44 52.59 1xct n ALA 40 Cb 0.37 -1.84 -0.05 0.00 0.00 0.00 0.00 19.45 17.93 1xct n ALA 40 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1xct n PRO 41 N -1.40 2.11 -0.22 0.00 -0.02 -1.26 -1.39 135.00 132.82 1xct n PRO 41 Ca 0.08 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 1xct n PRO 41 Cb 0.52 -2.68 0.00 0.00 -0.02 0.00 0.00 33.50 31.32 1xct n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xct n GLY 42 N 4.66 2.27 2.81 -1.23 0.00 -1.26 -5.00 105.19 107.44 1xct n GLY 42 Ca 0.24 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.12 1xct n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xct n LYS 43 N -2.00 0.50 -1.06 1.61 4.76 -0.48 -5.13 118.16 116.36 1xct n LYS 43 Ca 0.00 -2.15 -0.11 0.00 -2.87 0.00 0.00 58.31 53.18 1xct n LYS 43 Cb 0.00 -0.28 0.07 0.00 -1.84 0.00 0.00 35.03 32.98 1xct n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xct n GLY 44 N -0.24 -0.43 3.55 0.72 0.00 -1.26 -4.65 105.19 102.88 1xct n GLY 44 Ca 0.12 -1.81 -0.43 0.00 0.00 0.00 0.00 46.02 43.90 1xct n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xct s LEU 45 N 0.00 4.22 -0.26 0.99 1.43 -1.26 -4.26 118.68 119.54 1xct s LEU 45 Ca 0.30 0.03 -0.09 0.00 -1.03 0.00 0.00 54.13 53.33 1xct s LEU 45 Cb -0.01 -2.97 -0.04 0.00 0.03 0.00 0.00 46.19 43.20 1xct s LEU 45 CO 0.20 -0.85 0.14 0.20 0.23 0.00 0.00 176.35 176.27 1xct s ASN 46 N 2.04 5.72 0.02 2.29 0.01 -0.43 -4.99 114.94 119.59 1xct s ASN 46 Ca 0.30 -0.05 -0.30 0.00 -0.71 0.00 0.00 52.86 52.10 1xct s ASN 46 Cb -0.12 -2.04 -0.04 0.00 0.41 0.00 0.00 41.25 39.45 1xct s ASN 46 CO 0.21 -0.01 1.12 0.86 -1.51 0.00 0.00 177.10 177.76 1xct s TRP 47 N 1.52 3.48 0.00 2.20 -0.00 -1.26 -1.52 118.94 123.36 1xct s TRP 47 Ca 0.07 1.44 0.00 0.00 -0.00 0.00 0.00 56.10 57.60 1xct s TRP 47 Cb -0.15 -3.31 0.00 0.00 -0.00 0.00 0.00 33.47 30.01 1xct s TRP 47 CO 0.07 -0.82 0.00 -1.33 -0.00 0.00 0.00 176.95 174.87 1xct n MET 48 N 4.12 0.00 0.00 5.86 2.81 0.34 -4.75 117.12 125.49 1xct n MET 48 Ca 0.08 0.11 0.00 0.00 -1.81 0.00 0.00 57.70 56.09 1xct n MET 48 Cb 0.48 -0.48 0.00 0.00 -0.71 0.00 0.00 33.22 32.51 1xct n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1xct n GLY 49 N 2.06 2.46 0.50 3.03 0.00 -1.19 0.81 105.19 112.87 1xct n GLY 49 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1xct n GLY 49 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1xct n TRP 50 N 0.00 -0.24 -3.59 1.61 4.27 -0.54 -1.20 117.44 117.75 1xct n TRP 50 Ca 0.00 -0.10 -0.05 0.00 -3.89 0.00 0.00 57.50 53.46 1xct n TRP 50 Cb 0.00 0.04 -0.02 0.00 -1.36 0.00 0.00 31.31 29.98 1xct n TRP 50 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 1xct s VAL 51 N -2.18 0.00 0.15 -1.67 0.11 -0.90 -2.22 120.40 113.68 1xct s VAL 51 Ca 0.04 -0.17 0.07 0.00 -2.93 0.00 0.00 61.98 58.98 1xct s VAL 51 Cb -0.00 -1.35 -0.04 0.00 -1.53 0.00 0.00 36.38 33.46 1xct s VAL 51 CO 0.00 0.00 -0.00 0.54 -3.33 0.00 0.00 175.10 172.31 1xct s ASN 52 N -2.58 4.83 0.17 3.54 4.22 -1.15 -2.56 114.94 121.42 1xct s ASN 52 Ca 0.09 -0.33 -0.12 0.00 -2.14 0.00 0.00 52.86 50.35 1xct s ASN 52 Cb -0.00 -1.06 0.07 0.00 1.28 0.00 0.00 41.25 41.54 1xct s ASN 52 CO -0.05 0.12 1.75 0.74 -2.04 0.00 0.00 177.10 177.62 1xct h THR 53 N 2.60 1.21 -3.10 0.54 2.02 -1.79 -2.54 112.91 111.85 1xct h THR 53 Ca -0.47 -0.61 -0.59 0.00 0.77 0.00 0.00 66.41 65.50 1xct h THR 53 Cb 1.19 0.54 -0.05 0.00 -1.74 0.00 0.00 68.15 68.10 1xct h THR 53 CO 0.58 0.24 -0.24 -1.61 0.37 0.00 0.00 175.52 174.86 1xct s GLU 54 N -5.67 3.77 0.00 6.66 2.02 -1.26 -3.95 118.70 120.27 1xct s GLU 54 Ca -0.13 0.20 0.00 0.00 0.02 0.00 0.00 54.97 55.06 1xct s GLU 54 Cb 0.13 -3.01 0.00 0.00 0.10 0.00 0.00 34.13 31.34 1xct s GLU 54 CO 0.78 0.57 0.00 2.41 0.02 0.00 0.00 175.26 179.04 1xct n THR 55 N 0.98 0.00 -0.83 3.63 -1.04 -1.26 -4.32 114.28 111.44 1xct n THR 55 Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 1xct n THR 55 Cb 0.52 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.03 1xct n THR 55 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xct n GLY 56 N 0.00 0.00 3.73 3.41 0.00 -0.96 -4.88 105.19 106.49 1xct n GLY 56 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1xct n GLY 56 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xct s GLU 57 N -1.66 4.15 0.68 1.61 2.12 -1.26 -4.64 118.70 119.70 1xct s GLU 57 Ca 0.00 2.53 0.04 0.00 0.36 0.00 0.00 54.97 57.90 1xct s GLU 57 Cb 0.00 -3.08 0.13 0.00 0.26 0.00 0.00 34.13 31.44 1xct s GLU 57 CO 0.00 -0.67 0.94 -1.25 -0.54 0.00 0.00 175.26 173.74 1xct s PRO 58 N 0.61 1.83 -0.30 4.30 0.04 -1.26 -2.95 135.00 137.26 1xct s PRO 58 Ca 0.70 -1.44 -0.15 0.00 0.04 0.00 0.00 61.00 60.15 1xct s PRO 58 Cb -0.48 -2.46 0.18 0.00 0.04 0.00 0.00 34.50 31.78 1xct s PRO 58 CO 0.37 -1.30 1.05 0.99 0.04 0.00 0.00 177.00 178.15 1xct s THR 59 N -2.98 -0.38 0.32 1.26 2.01 -0.94 -4.93 115.64 110.00 1xct s THR 59 Ca 0.66 0.00 0.08 0.00 0.31 0.00 0.00 61.69 62.73 1xct s THR 59 Cb -0.04 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 71.43 1xct s THR 59 CO 0.43 0.00 0.25 -0.31 -0.69 0.00 0.00 174.62 174.30 1xct s TYR 60 N 2.57 2.89 0.47 4.92 4.12 -1.26 -1.46 117.35 129.60 1xct s TYR 60 Ca -0.01 -0.29 -0.13 0.00 0.02 0.00 0.00 57.07 56.67 1xct s TYR 60 Cb -0.07 -1.71 -0.07 0.00 -1.52 0.00 0.00 41.96 38.60 1xct s TYR 60 CO -0.15 0.26 0.87 0.00 0.02 0.00 0.00 175.55 176.55 1xct s ALA 61 N -2.30 3.23 0.65 3.71 0.00 0.24 -4.91 121.76 122.38 1xct s ALA 61 Ca 0.39 -0.06 0.18 0.00 0.00 0.00 0.00 51.96 52.47 1xct s ALA 61 Cb -0.06 -2.88 0.93 0.00 0.00 0.00 0.00 23.12 21.11 1xct s ALA 61 CO 0.26 -0.16 1.52 -0.44 0.00 0.00 0.00 175.76 176.93 1xct h ASP 62 N 0.96 0.00 -0.55 0.00 5.19 -1.94 0.64 116.42 120.72 1xct h ASP 62 Ca -0.47 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 55.93 1xct h ASP 62 Cb 1.19 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.69 1xct h ASP 62 CO 0.63 0.00 0.01 0.47 -3.12 0.00 0.00 179.24 177.23 1xct n ASP 63 N -2.82 5.46 -0.27 6.45 10.43 -1.26 -4.97 116.55 129.58 1xct n ASP 63 Ca 0.01 -2.89 0.00 0.00 2.57 0.00 0.00 54.79 54.48 1xct n ASP 63 Cb 0.72 -0.68 0.00 0.00 1.84 0.00 0.00 41.12 43.00 1xct n ASP 63 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 1xct n PHE 64 N 0.56 0.00 -1.01 1.24 3.01 0.22 -5.12 117.46 116.36 1xct n PHE 64 Ca 0.27 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.86 1xct n PHE 64 Cb 1.16 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 40.59 1xct n PHE 64 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 1xct n LYS 65 N 0.00 -2.16 -1.17 -1.08 3.00 -1.26 -4.80 118.16 110.69 1xct n LYS 65 Ca 0.00 1.56 -0.06 0.00 -0.00 0.00 0.00 58.31 59.82 1xct n LYS 65 Cb 0.00 -2.59 -0.02 0.00 0.00 0.00 0.00 35.03 32.42 1xct n LYS 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1xct n GLY 66 N -3.64 0.64 0.00 3.14 0.00 -1.26 -4.15 105.19 99.92 1xct n GLY 66 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1xct n GLY 66 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1xct n ARG 67 N -0.73 0.00 -4.70 1.61 0.63 -1.26 -4.97 116.66 107.24 1xct n ARG 67 Ca -0.06 0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 56.59 1xct n ARG 67 Cb 0.45 0.00 -0.14 0.00 0.45 0.00 0.00 32.46 33.22 1xct n ARG 67 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 1xct s PHE 68 N 0.00 2.15 -0.11 -0.14 0.08 -1.26 0.41 117.98 119.12 1xct s PHE 68 Ca 0.00 -0.40 -0.00 0.00 0.12 0.00 0.00 56.93 56.65 1xct s PHE 68 Cb 0.00 -1.26 0.02 0.00 -0.57 0.00 0.00 43.02 41.22 1xct s PHE 68 CO 0.00 0.16 -0.07 0.00 -0.10 0.00 0.00 175.22 175.21 1xct s ALA 69 N -0.88 1.30 -1.05 5.36 0.00 -0.91 -4.56 121.76 121.02 1xct s ALA 69 Ca 0.11 -0.53 -0.06 0.00 0.00 0.00 0.00 51.96 51.48 1xct s ALA 69 Cb -0.10 -0.90 0.27 0.00 0.00 0.00 0.00 23.12 22.40 1xct s ALA 69 CO 0.03 -0.40 1.11 1.19 0.00 0.00 0.00 175.76 177.69 1xct n PHE 70 N 4.92 4.43 -3.23 0.00 0.99 -1.26 -2.02 117.46 121.29 1xct n PHE 70 Ca -0.13 -3.71 -0.19 0.00 -0.00 0.00 0.00 57.45 53.43 1xct n PHE 70 Cb 0.50 -1.47 0.00 0.00 -1.00 0.00 0.00 39.48 37.52 1xct n PHE 70 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 1xct s SER 71 N 0.27 5.82 -0.27 4.37 1.04 -0.80 -4.77 113.70 119.35 1xct s SER 71 Ca 0.31 -0.21 -0.24 0.00 0.48 0.00 0.00 55.95 56.29 1xct s SER 71 Cb -0.06 -1.06 0.07 0.00 0.10 0.00 0.00 66.02 65.08 1xct s SER 71 CO -0.05 -0.60 0.72 -1.48 0.98 0.00 0.00 173.24 172.81 1xct s LEU 72 N -4.30 -0.77 -0.29 2.42 2.34 -1.26 0.07 118.68 116.89 1xct s LEU 72 Ca 0.49 1.44 0.10 0.00 0.06 0.00 0.00 54.13 56.23 1xct s LEU 72 Cb -0.10 2.44 0.47 0.00 -0.56 0.00 0.00 46.19 48.44 1xct s LEU 72 CO 0.33 -0.25 1.17 1.21 -1.06 0.00 0.00 176.35 177.75 1xct n GLU 73 N 2.92 3.23 0.00 1.48 2.13 -1.26 -5.04 120.64 124.11 1xct n GLU 73 Ca -0.15 -4.04 0.00 0.00 0.66 0.00 0.00 57.16 53.63 1xct n GLU 73 Cb 0.56 -2.14 0.00 0.00 0.27 0.00 0.00 31.44 30.12 1xct n GLU 73 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 1xct n THR 74 N -0.68 0.00 -0.17 6.31 -1.04 -1.26 -4.60 114.28 112.83 1xct n THR 74 Ca 0.36 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.37 1xct n THR 74 Cb 0.93 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.44 1xct n THR 74 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1xct n SER 75 N 0.10 0.00 0.00 8.00 3.41 -1.26 -2.09 113.62 121.78 1xct n SER 75 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1xct n SER 75 Cb 0.00 -1.22 0.00 0.00 -0.26 0.00 0.00 64.21 62.73 1xct n SER 75 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xct n ALA 76 N 0.83 0.00 -2.03 7.33 0.00 -1.26 -4.94 120.51 120.43 1xct n ALA 76 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1xct n ALA 76 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1xct n ALA 76 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1xct n SER 77 N 0.00 -1.66 -4.56 0.00 7.64 -0.89 -3.25 113.62 110.90 1xct n SER 77 Ca 0.00 0.30 -0.15 0.00 1.01 0.00 0.00 58.87 60.03 1xct n SER 77 Cb 0.00 -1.62 -0.07 0.00 -1.01 0.00 0.00 64.21 61.51 1xct n SER 77 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1xct s THR 78 N -1.92 3.08 0.20 0.44 2.01 -1.25 -4.36 115.64 113.84 1xct s THR 78 Ca 0.00 -0.06 -0.32 0.00 0.31 0.00 0.00 61.69 61.61 1xct s THR 78 Cb 0.00 -3.19 -0.12 0.00 0.01 0.00 0.00 72.50 69.20 1xct s THR 78 CO 0.00 -0.16 1.69 0.00 -0.69 0.00 0.00 174.62 175.46 1xct n ALA 79 N 18.03 2.54 -2.41 7.40 0.00 -0.53 -4.28 120.51 141.25 1xct n ALA 79 Ca 0.46 0.41 -0.31 0.00 0.00 0.00 0.00 53.44 53.99 1xct n ALA 79 Cb 0.44 -2.49 -0.14 0.00 0.00 0.00 0.00 19.45 17.26 1xct n ALA 79 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1xct s TYR 80 N 1.07 2.52 -0.01 0.00 2.02 0.11 -0.91 117.35 122.16 1xct s TYR 80 Ca 0.75 -0.29 0.05 0.00 -0.37 0.00 0.00 57.07 57.21 1xct s TYR 80 Cb -0.54 -1.53 -0.01 0.00 -0.40 0.00 0.00 41.96 39.48 1xct s TYR 80 CO 0.34 0.13 -0.15 -1.17 -1.57 0.00 0.00 175.55 173.13 1xct s LEU 81 N -0.93 2.02 0.19 -1.29 2.96 0.19 -1.90 118.68 119.91 1xct s LEU 81 Ca 0.12 -0.28 0.02 0.00 -0.22 0.00 0.00 54.13 53.77 1xct s LEU 81 Cb -0.10 -0.79 -0.05 0.00 0.50 0.00 0.00 46.19 45.75 1xct s LEU 81 CO 0.01 0.18 0.01 -1.58 -1.32 0.00 0.00 176.35 173.65 1xct s GLN 82 N -0.33 1.16 -0.21 1.98 0.74 -0.85 0.62 119.66 122.77 1xct s GLN 82 Ca 0.05 -1.57 -0.04 0.00 0.05 0.00 0.00 55.36 53.86 1xct s GLN 82 Cb -0.06 -0.32 0.11 0.00 1.10 0.00 0.00 33.01 33.83 1xct s GLN 82 CO -0.00 -0.13 0.30 0.42 -0.55 0.00 0.00 175.29 175.32 1xct s ILE 83 N -3.62 -0.46 0.91 -2.34 1.01 -1.17 -2.14 121.20 113.38 1xct s ILE 83 Ca 0.25 -0.05 -0.11 0.00 0.00 0.00 0.00 60.65 60.74 1xct s ILE 83 Cb 0.06 -0.72 0.14 0.00 0.01 0.00 0.00 42.46 41.95 1xct s ILE 83 CO 0.05 -0.13 1.09 0.20 0.00 0.00 0.00 174.94 176.15 1xct s ASN 84 N 2.44 3.24 0.00 3.58 -0.87 0.17 -3.41 114.94 120.09 1xct s ASN 84 Ca 0.09 1.65 0.00 0.00 -1.57 0.00 0.00 52.86 53.03 1xct s ASN 84 Cb -0.15 -2.30 0.00 0.00 -0.02 0.00 0.00 41.25 38.78 1xct s ASN 84 CO -0.13 -2.81 0.00 -1.54 -2.57 0.00 0.00 177.10 170.05 1xct n SER 85 N -4.01 0.00 -4.29 -1.22 3.41 -1.24 -4.81 113.62 101.46 1xct n SER 85 Ca 0.08 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.39 1xct n SER 85 Cb 0.54 0.00 0.24 0.00 -0.26 0.00 0.00 64.21 64.74 1xct n SER 85 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1xct n LEU 86 N -0.18 -1.94 -3.97 1.04 4.77 -1.25 -4.67 117.00 110.81 1xct n LEU 86 Ca 0.00 -0.25 -0.11 0.00 -0.03 0.00 0.00 56.01 55.61 1xct n LEU 86 Cb 0.00 -1.13 -0.02 0.00 -2.33 0.00 0.00 43.42 39.94 1xct n LEU 86 CO 0.00 -3.40 0.29 -1.59 -1.33 0.00 0.00 177.39 171.36 1xct s LYS 87 N -4.15 1.93 0.33 3.23 -2.85 -1.26 -1.74 119.74 115.24 1xct s LYS 87 Ca 0.64 -1.50 0.05 0.00 -1.00 0.00 0.00 55.97 54.17 1xct s LYS 87 Cb -0.20 0.52 0.59 0.00 -2.06 0.00 0.00 37.83 36.67 1xct s LYS 87 CO 0.65 -0.84 1.83 -0.91 0.10 0.00 0.00 175.35 176.18 1xct h ASN 88 N 2.10 0.41 0.11 0.03 4.21 -1.98 -2.35 115.58 118.11 1xct h ASN 88 Ca -0.28 -0.10 0.00 0.00 1.21 0.00 0.00 56.30 57.13 1xct h ASN 88 Cb 1.25 -0.11 0.00 0.00 -1.12 0.00 0.00 38.32 38.34 1xct h ASN 88 CO 0.37 0.57 0.00 -0.62 -1.29 0.00 0.00 177.43 176.46 1xct n GLU 89 N -4.22 0.59 0.03 0.81 -0.58 -1.26 -2.21 120.64 113.80 1xct n GLU 89 Ca 0.00 0.02 0.12 0.00 -0.42 0.00 0.00 57.16 56.89 1xct n GLU 89 Cb 0.31 -1.50 0.23 0.00 -0.57 0.00 0.00 31.44 29.90 1xct n GLU 89 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1xct n ASP 90 N -1.08 0.58 -4.56 1.62 8.00 -0.88 -4.78 116.55 115.45 1xct n ASP 90 Ca 0.15 0.00 -0.20 0.00 0.71 0.00 0.00 54.79 55.45 1xct n ASP 90 Cb 0.10 0.16 -0.06 0.00 -0.02 0.00 0.00 41.12 41.30 1xct n ASP 90 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1xct n THR 91 N -1.85 -0.03 -4.06 -3.53 -1.04 -0.94 -4.83 114.28 98.01 1xct n THR 91 Ca 0.04 -0.59 -0.09 0.00 -2.04 0.00 0.00 64.05 61.37 1xct n THR 91 Cb 0.39 -2.21 -0.03 0.00 -1.82 0.00 0.00 70.33 66.67 1xct n THR 91 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xct n ALA 92 N 17.68 0.23 -0.11 2.41 0.00 -1.25 -4.25 120.51 135.21 1xct n ALA 92 Ca 0.44 -0.90 -0.14 0.00 0.00 0.00 0.00 53.44 52.84 1xct n ALA 92 Cb 0.46 0.73 -0.12 0.00 0.00 0.00 0.00 19.45 20.51 1xct n ALA 92 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1xct n THR 93 N -0.30 1.34 -1.95 0.00 -1.04 -1.23 -2.23 114.28 108.87 1xct n THR 93 Ca 0.03 -0.61 0.00 0.00 -2.04 0.00 0.00 64.05 61.43 1xct n THR 93 Cb 0.29 -1.08 0.00 0.00 -1.82 0.00 0.00 70.33 67.72 1xct n THR 93 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1xct n TYR 94 N -3.04 -4.71 -4.42 -1.42 4.01 -1.25 0.12 117.16 106.45 1xct n TYR 94 Ca -0.39 2.80 -0.21 0.00 -0.16 0.00 0.00 57.90 59.94 1xct n TYR 94 Cb 1.00 -3.61 -0.10 0.00 -0.31 0.00 0.00 39.34 36.32 1xct n TYR 94 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1xct s PHE 95 N -0.67 1.89 -0.03 -0.72 0.40 0.15 -1.77 117.98 117.23 1xct s PHE 95 Ca 0.00 -0.78 0.02 0.00 -0.60 0.00 0.00 56.93 55.57 1xct s PHE 95 Cb 0.00 -1.12 0.01 0.00 0.51 0.00 0.00 43.02 42.42 1xct s PHE 95 CO 0.00 0.18 -0.09 0.00 0.70 0.00 0.00 175.22 176.02 1xct s ALA 97 N 0.32 -0.27 -0.07 0.00 0.00 -1.00 -0.85 121.76 119.88 1xct s ALA 97 Ca -0.05 0.17 -0.30 0.00 0.00 0.00 0.00 51.96 51.78 1xct s ALA 97 Cb -0.10 -0.11 -0.04 0.00 0.00 0.00 0.00 23.12 22.88 1xct s ALA 97 CO 0.01 -0.10 1.30 0.50 0.00 0.00 0.00 175.76 177.47 1xct s ARG 98 N -0.35 4.29 -0.26 0.00 3.52 0.26 -2.35 118.95 124.06 1xct s ARG 98 Ca -0.04 1.78 -0.10 0.00 -0.13 0.00 0.00 55.73 57.24 1xct s ARG 98 Cb -0.03 -3.64 -0.05 0.00 -1.56 0.00 0.00 34.95 29.68 1xct s ARG 98 CO 0.00 -0.57 0.15 0.12 -0.81 0.00 0.00 175.30 174.20 1xct s PHE 99 N 2.69 3.22 0.33 5.12 2.19 -0.15 -2.05 117.98 129.34 1xct s PHE 99 Ca 0.59 0.05 -0.04 0.00 0.33 0.00 0.00 56.93 57.86 1xct s PHE 99 Cb -0.26 -2.31 -0.05 0.00 -1.31 0.00 0.00 43.02 39.09 1xct s PHE 99 CO 0.22 -0.13 0.58 -0.51 1.83 0.00 0.00 175.22 177.21 1xct s LEU 100 N 1.49 4.00 0.66 6.12 1.43 -1.02 -3.29 118.68 128.07 1xct s LEU 100 Ca 0.07 0.67 0.37 0.00 -1.03 0.00 0.00 54.13 54.21 1xct s LEU 100 Cb -0.15 -3.51 2.04 0.00 0.03 0.00 0.00 46.19 44.59 1xct s LEU 100 CO 0.08 -0.26 2.16 -0.07 0.23 0.00 0.00 176.35 178.48 1xct h LEU 101 N 1.27 0.00 -0.10 1.79 3.38 -1.92 0.13 115.31 119.88 1xct h LEU 101 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1xct h LEU 101 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1xct h LEU 101 CO 0.64 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.71 1xct n ARG 102 N -3.06 0.02 -1.48 1.13 1.74 -1.26 -4.87 116.66 108.87 1xct n ARG 102 Ca -0.02 0.35 0.00 0.00 -0.77 0.00 0.00 57.85 57.41 1xct n ARG 102 Cb 0.22 -1.54 0.00 0.00 -1.02 0.00 0.00 32.46 30.12 1xct n ARG 102 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1xct n GLN 103 N -1.58 0.00 -3.73 5.56 1.13 0.47 -5.08 117.38 114.15 1xct n GLN 103 Ca 0.02 0.04 -0.14 0.00 -1.94 0.00 0.00 57.00 54.98 1xct n GLN 103 Cb 0.12 -2.75 -0.09 0.00 0.11 0.00 0.00 30.24 27.64 1xct n GLN 103 CO 0.00 0.00 0.00 1.52 -1.44 0.00 0.00 177.06 177.14 1xct s TYR 104 N -2.00 -0.29 -0.51 1.08 -0.85 -1.25 -4.98 117.35 108.56 1xct s TYR 104 Ca 0.00 0.54 -0.28 0.00 -0.52 0.00 0.00 57.07 56.81 1xct s TYR 104 Cb 0.00 0.14 0.03 0.00 0.38 0.00 0.00 41.96 42.51 1xct s TYR 104 CO 0.00 -0.37 1.12 -0.06 -1.52 0.00 0.00 175.55 174.72 1xct s PHE 105 N -0.94 2.76 -1.94 -3.49 0.08 -1.26 -2.44 117.98 110.75 1xct s PHE 105 Ca -0.10 0.55 0.26 0.00 0.12 0.00 0.00 56.93 57.75 1xct s PHE 105 Cb -0.04 -4.40 0.61 0.00 -0.57 0.00 0.00 43.02 38.62 1xct s PHE 105 CO 0.04 -1.36 1.48 -0.40 -0.10 0.00 0.00 175.22 174.88 1xct n ASP 106 N 7.94 1.36 -3.61 1.36 5.75 -0.87 -4.81 116.55 123.67 1xct n ASP 106 Ca 0.10 -1.13 -0.17 0.00 -0.01 0.00 0.00 54.79 53.58 1xct n ASP 106 Cb 0.49 0.19 -0.14 0.00 -1.03 0.00 0.00 41.12 40.62 1xct n ASP 106 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1xct s VAL 107 N -2.42 -0.30 0.51 2.12 1.01 -1.25 -4.98 120.40 115.09 1xct s VAL 107 Ca 0.25 0.17 0.06 0.00 0.00 0.00 0.00 61.98 62.46 1xct s VAL 107 Cb 0.19 -0.45 0.03 0.00 0.00 0.00 0.00 36.38 36.14 1xct s VAL 107 CO 0.50 0.01 0.43 0.26 0.00 0.00 0.00 175.10 176.30 1xct s TRP 108 N 2.32 1.89 0.00 5.22 0.52 -1.26 0.89 118.94 128.51 1xct s TRP 108 Ca 0.04 -0.74 0.00 0.00 0.02 0.00 0.00 56.10 55.42 1xct s TRP 108 Cb -0.13 -2.00 0.00 0.00 -1.15 0.00 0.00 33.47 30.18 1xct s TRP 108 CO -0.08 -0.44 0.00 0.41 0.02 0.00 0.00 176.95 176.86 1xct n GLY 109 N -1.74 0.43 0.15 0.98 0.00 -0.03 -4.40 105.19 100.57 1xct n GLY 109 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1xct n GLY 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xct n ALA 110 N -3.00 1.24 -0.94 4.61 0.00 -1.26 -5.00 120.51 116.16 1xct n ALA 110 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.54 1xct n ALA 110 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1xct n ALA 110 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xct n GLY 111 N 0.00 -1.29 2.91 0.00 0.00 -1.25 -4.85 105.19 100.70 1xct n GLY 111 Ca 0.00 -0.60 -0.29 0.00 0.00 0.00 0.00 46.02 45.12 1xct n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xct s THR 112 N -2.61 1.31 -0.77 2.61 2.01 0.32 -4.89 115.64 113.62 1xct s THR 112 Ca 0.00 -0.95 -0.25 0.00 0.31 0.00 0.00 61.69 60.80 1xct s THR 112 Cb 0.00 -1.55 -0.06 0.00 0.01 0.00 0.00 72.50 70.90 1xct s THR 112 CO 0.00 -0.01 2.04 -0.89 -0.69 0.00 0.00 174.62 175.07 1xct s THR 113 N 1.52 3.31 -1.02 -0.82 2.01 -1.26 -4.12 115.64 115.27 1xct s THR 113 Ca -0.03 -0.13 -0.10 0.00 0.31 0.00 0.00 61.69 61.74 1xct s THR 113 Cb -0.17 -3.74 0.26 0.00 0.01 0.00 0.00 72.50 68.86 1xct s THR 113 CO -0.07 -0.70 1.00 0.54 -0.69 0.00 0.00 174.62 174.69 1xct s VAL 114 N 10.79 5.85 0.23 3.82 0.11 -0.95 -3.31 120.40 136.94 1xct s VAL 114 Ca 0.75 -3.15 -0.30 0.00 -2.93 0.00 0.00 61.98 56.35 1xct s VAL 114 Cb -0.10 -4.54 -0.10 0.00 -1.53 0.00 0.00 36.38 30.11 1xct s VAL 114 CO 0.09 -1.14 1.40 -0.89 -3.33 0.00 0.00 175.10 171.22 1xct s THR 115 N -0.84 2.86 -0.35 5.04 2.01 -0.82 -3.95 115.64 119.60 1xct s THR 115 Ca 0.27 0.72 -0.04 0.00 0.31 0.00 0.00 61.69 62.94 1xct s THR 115 Cb -0.10 -3.46 0.06 0.00 0.01 0.00 0.00 72.50 69.01 1xct s THR 115 CO -0.08 0.11 0.11 -0.69 -0.69 0.00 0.00 174.62 173.37 1xct s VAL 116 N 0.08 3.47 0.14 3.82 1.01 -1.26 -2.50 120.40 125.17 1xct s VAL 116 Ca 0.59 -1.42 -0.03 0.00 0.00 0.00 0.00 61.98 61.11 1xct s VAL 116 Cb -0.40 -3.07 0.01 0.00 0.00 0.00 0.00 36.38 32.92 1xct s VAL 116 CO 0.41 -0.29 0.25 -0.24 0.00 0.00 0.00 175.10 175.23 1xct n SER 117 N 4.72 -0.72 -0.01 3.32 2.88 -0.96 -4.66 113.62 118.19 1xct n SER 117 Ca -0.10 -1.66 0.03 0.00 -1.33 0.00 0.00 58.87 55.81 1xct n SER 117 Cb 0.43 1.24 -0.06 0.00 -0.75 0.00 0.00 64.21 65.07 1xct n SER 117 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1xct n SER 118 N -1.53 3.08 -4.65 -3.46 3.41 -1.26 -2.45 113.62 106.76 1xct n SER 118 Ca -0.02 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.21 1xct n SER 118 Cb 0.23 1.30 0.05 0.00 -0.26 0.00 0.00 64.21 65.53 1xct n SER 118 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xct n ALA 119 N -1.85 0.52 -1.85 7.33 0.00 -1.26 -4.95 120.51 118.45 1xct n ALA 119 Ca -0.03 0.06 -0.39 0.00 0.00 0.00 0.00 53.44 53.08 1xct n ALA 119 Cb 0.28 -2.17 -0.06 0.00 0.00 0.00 0.00 19.45 17.50 1xct n ALA 119 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1xct s LYS 120 N -2.72 4.69 0.31 0.00 -2.85 -1.26 -5.00 119.74 112.90 1xct s LYS 120 Ca 0.74 1.32 -0.29 0.00 -1.00 0.00 0.00 55.97 56.73 1xct s LYS 120 Cb -0.43 -3.18 -0.11 0.00 -2.06 0.00 0.00 37.83 32.05 1xct s LYS 120 CO 0.48 0.50 1.48 0.99 0.10 0.00 0.00 175.35 178.91 1xct s THR 121 N -1.25 2.30 -0.11 3.79 2.01 -1.26 -4.76 115.64 116.35 1xct s THR 121 Ca 0.41 0.27 -0.06 0.00 0.31 0.00 0.00 61.69 62.62 1xct s THR 121 Cb -0.23 -3.17 0.05 0.00 0.01 0.00 0.00 72.50 69.15 1xct s THR 121 CO 0.28 0.05 0.26 0.42 -0.69 0.00 0.00 174.62 174.95 1xct s THR 122 N -0.49 -0.07 0.76 -0.82 -4.23 -0.43 -4.96 115.64 105.40 1xct s THR 122 Ca 0.57 0.15 -0.11 0.00 -1.18 0.00 0.00 61.69 61.12 1xct s THR 122 Cb -0.45 -0.41 0.05 0.00 1.34 0.00 0.00 72.50 73.04 1xct s THR 122 CO 0.52 0.06 1.10 -2.16 -0.54 0.00 0.00 174.62 173.61 1xct s PRO 123 N 1.38 2.24 0.27 3.99 0.04 -1.26 -2.26 135.00 139.40 1xct s PRO 123 Ca -0.08 1.26 -0.06 0.00 0.04 0.00 0.00 61.00 62.15 1xct s PRO 123 Cb -0.10 -1.89 -0.06 0.00 0.04 0.00 0.00 34.50 32.49 1xct s PRO 123 CO -0.09 -1.67 0.55 -1.25 0.04 0.00 0.00 177.00 174.59 1xct s PRO 124 N -4.70 3.68 -0.15 0.56 0.04 -1.26 -4.60 135.00 128.57 1xct s PRO 124 Ca 0.63 0.09 -0.19 0.00 0.04 0.00 0.00 61.00 61.56 1xct s PRO 124 Cb -0.19 -2.64 -0.04 0.00 0.04 0.00 0.00 34.50 31.67 1xct s PRO 124 CO 0.53 0.24 0.55 -1.12 0.04 0.00 0.00 177.00 177.24 1xct s SER 125 N -2.93 6.69 -0.49 6.66 0.01 -0.91 -4.97 113.70 117.77 1xct s SER 125 Ca 0.45 0.83 -0.00 0.00 1.31 0.00 0.00 55.95 58.54 1xct s SER 125 Cb -0.11 -2.32 0.13 0.00 0.21 0.00 0.00 66.02 63.93 1xct s SER 125 CO 0.28 -0.12 0.26 -0.69 0.41 0.00 0.00 173.24 173.38 1xct s VAL 126 N 1.17 3.13 0.23 3.43 1.01 -1.26 -1.78 120.40 126.34 1xct s VAL 126 Ca 0.28 -2.62 -0.16 0.00 0.00 0.00 0.00 61.98 59.48 1xct s VAL 126 Cb -0.16 -3.14 -0.08 0.00 0.00 0.00 0.00 36.38 33.01 1xct s VAL 126 CO 0.11 -0.76 0.66 -0.31 0.00 0.00 0.00 175.10 174.81 1xct s TYR 127 N 0.46 3.53 0.00 5.22 2.02 -0.68 -4.84 117.35 123.05 1xct s TYR 127 Ca 0.13 1.19 -0.21 0.00 -0.37 0.00 0.00 57.07 57.80 1xct s TYR 127 Cb -0.22 -2.48 -0.05 0.00 -0.40 0.00 0.00 41.96 38.80 1xct s TYR 127 CO -0.04 0.28 0.62 -1.25 -1.57 0.00 0.00 175.55 173.59 1xct s PRO 128 N -2.39 4.35 -0.27 -1.71 0.04 -1.26 -1.63 135.00 132.13 1xct s PRO 128 Ca 0.46 0.79 -0.09 0.00 0.04 0.00 0.00 61.00 62.20 1xct s PRO 128 Cb -0.14 -3.35 -0.03 0.00 0.04 0.00 0.00 34.50 31.03 1xct s PRO 128 CO 0.19 0.35 0.12 -0.51 0.04 0.00 0.00 177.00 177.19 1xct s LEU 129 N -0.15 3.72 0.02 -3.56 1.43 -1.24 -4.88 118.68 114.02 1xct s LEU 129 Ca 0.32 -0.21 -0.01 0.00 -1.03 0.00 0.00 54.13 53.20 1xct s LEU 129 Cb -0.19 -1.99 -0.02 0.00 0.03 0.00 0.00 46.19 44.02 1xct s LEU 129 CO 0.18 -0.07 -0.01 0.00 0.23 0.00 0.00 176.35 176.69 1xct s ALA 130 N 1.65 0.09 1.21 4.21 0.00 -1.26 -1.92 121.76 125.73 1xct s ALA 130 Ca 0.06 -0.57 -0.14 0.00 0.00 0.00 0.00 51.96 51.31 1xct s ALA 130 Cb -0.16 0.16 0.29 0.00 0.00 0.00 0.00 23.12 23.41 1xct s ALA 130 CO 0.06 -0.18 0.93 -0.35 0.00 0.00 0.00 175.76 176.22 1xct n PRO 131 N 1.46 -2.67 -4.59 0.00 -0.04 -1.26 -5.01 135.00 122.89 1xct n PRO 131 Ca -0.23 -0.75 -0.28 0.00 -0.04 0.00 0.00 63.50 62.20 1xct n PRO 131 Cb 0.56 -2.11 -0.08 0.00 -0.04 0.00 0.00 33.50 31.82 1xct n PRO 131 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1xct s GLY 132 N -2.34 2.71 -0.60 0.55 0.00 -1.26 -4.55 107.32 101.82 1xct s GLY 132 Ca 0.68 -1.05 -0.19 0.00 0.00 0.00 0.00 44.72 44.16 1xct s GLY 132 CO 0.66 -1.96 1.83 1.44 0.00 0.00 0.00 173.10 175.07 1xct n SER 133 N -1.24 2.51 0.00 1.64 7.64 -1.26 -4.65 113.62 118.25 1xct n SER 133 Ca -0.10 -2.53 0.00 0.00 1.01 0.00 0.00 58.87 57.25 1xct n SER 133 Cb 0.66 -0.95 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 1xct n SER 133 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xct n ALA 134 N 6.95 0.00 0.00 -0.43 0.00 -1.26 -5.02 120.51 120.75 1xct n ALA 134 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1xct n ALA 134 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.78 1xct n ALA 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xct n ALA 135 N -0.38 0.00 -1.18 0.00 0.00 -1.26 -4.85 120.51 112.84 1xct n ALA 135 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1xct n ALA 135 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1xct n ALA 135 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1xct n GLN 136 N -2.00 -3.34 -2.28 0.00 1.13 -1.26 -4.65 117.38 104.98 1xct n GLN 136 Ca 0.00 2.45 -0.43 0.00 -1.94 0.00 0.00 57.00 57.08 1xct n GLN 136 Cb 0.00 -2.72 0.00 0.00 0.11 0.00 0.00 30.24 27.63 1xct n GLN 136 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1xct n THR 137 N -0.34 3.82 -2.23 5.09 -2.24 -1.26 -4.94 114.28 112.18 1xct n THR 137 Ca 0.00 -3.78 -0.41 0.00 -2.27 0.00 0.00 64.05 57.59 1xct n THR 137 Cb 0.00 -2.46 -0.03 0.00 -2.10 0.00 0.00 70.33 65.75 1xct n THR 137 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1xct s ASN 138 N 3.50 5.90 0.02 3.42 -0.87 -1.26 -4.80 114.94 120.84 1xct s ASN 138 Ca 0.49 0.52 0.00 0.00 -1.57 0.00 0.00 52.86 52.30 1xct s ASN 138 Cb 0.07 -2.54 0.00 0.00 -0.02 0.00 0.00 41.25 38.77 1xct s ASN 138 CO 0.01 -1.85 0.00 -0.24 -2.57 0.00 0.00 177.10 172.45 1xct n SER 139 N 10.40 0.00 -4.24 -1.22 2.88 -1.26 -4.48 113.62 115.70 1xct n SER 139 Ca 0.16 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.41 1xct n SER 139 Cb 0.49 0.00 0.21 0.00 -0.75 0.00 0.00 64.21 64.16 1xct n SER 139 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 1xct s MET 140 N 0.00 -0.35 -0.17 -1.46 -1.94 -1.26 -1.95 119.30 112.16 1xct s MET 140 Ca 0.00 0.15 -0.12 0.00 -1.71 0.00 0.00 55.69 54.02 1xct s MET 140 Cb 0.00 -1.68 0.05 0.00 2.01 0.00 0.00 34.83 35.22 1xct s MET 140 CO 0.00 -3.18 0.44 0.54 -0.01 0.00 0.00 175.02 172.81 1xct s VAL 141 N -3.06 -0.02 -0.08 -6.03 0.11 -1.05 -4.63 120.40 105.65 1xct s VAL 141 Ca 0.68 0.06 -0.05 0.00 -2.93 0.00 0.00 61.98 59.74 1xct s VAL 141 Cb -0.13 -0.63 -0.04 0.00 -1.53 0.00 0.00 36.38 34.04 1xct s VAL 141 CO 0.56 0.02 0.13 -0.89 -3.33 0.00 0.00 175.10 171.60 1xct s THR 142 N 1.01 5.28 0.10 5.04 2.01 -1.26 -2.30 115.64 125.52 1xct s THR 142 Ca -0.06 0.00 0.05 0.00 0.31 0.00 0.00 61.69 61.99 1xct s THR 142 Cb -0.06 -3.35 -0.03 0.00 0.01 0.00 0.00 72.50 69.06 1xct s THR 142 CO -0.09 0.52 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.47 1xct s LEU 143 N -1.32 2.37 0.00 4.42 1.43 0.20 -4.56 118.68 121.23 1xct s LEU 143 Ca 0.19 -0.76 0.00 0.00 -1.03 0.00 0.00 54.13 52.53 1xct s LEU 143 Cb -0.12 -0.45 0.00 0.00 0.03 0.00 0.00 46.19 45.65 1xct s LEU 143 CO 0.09 -0.17 0.00 0.61 0.23 0.00 0.00 176.35 177.11 1xct n GLY 144 N 0.75 6.05 0.00 -3.19 0.00 -0.81 0.12 105.19 108.11 1xct n GLY 144 Ca -0.17 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.22 1xct n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xct s LEU 146 N 0.00 4.13 -1.02 0.00 2.96 -0.65 -3.35 118.68 120.76 1xct s LEU 146 Ca 0.00 1.59 -0.05 0.00 -0.22 0.00 0.00 54.13 55.45 1xct s LEU 146 Cb 0.00 -3.54 0.27 0.00 0.50 0.00 0.00 46.19 43.42 1xct s LEU 146 CO 0.00 -0.79 1.06 0.52 -1.32 0.00 0.00 176.35 175.82 1xct n VAL 147 N 5.47 4.10 -3.07 1.68 0.31 -0.03 -1.69 118.33 125.09 1xct n VAL 147 Ca 0.14 -5.40 -0.40 0.00 -0.01 0.00 0.00 64.34 58.67 1xct n VAL 147 Cb 0.45 -2.40 -0.05 0.00 -0.91 0.00 0.00 33.84 30.94 1xct n VAL 147 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1xct s LYS 148 N -1.68 4.41 -0.10 5.55 2.20 -0.73 -2.12 119.74 127.26 1xct s LYS 148 Ca 0.30 0.83 -0.05 0.00 -0.36 0.00 0.00 55.97 56.69 1xct s LYS 148 Cb -0.05 -3.45 0.02 0.00 -1.51 0.00 0.00 37.83 32.84 1xct s LYS 148 CO -0.06 0.05 0.10 0.41 -0.36 0.00 0.00 175.35 175.49 1xct n GLY 149 N 3.16 -3.98 3.84 5.54 0.00 -0.88 -2.14 105.19 110.73 1xct n GLY 149 Ca -0.02 0.56 -0.05 0.00 0.00 0.00 0.00 46.02 46.52 1xct n GLY 149 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xct s TYR 150 N -0.43 0.04 -0.29 1.61 1.13 -0.88 -3.99 117.35 114.53 1xct s TYR 150 Ca -0.11 -0.50 -0.24 0.00 -1.41 0.00 0.00 57.07 54.81 1xct s TYR 150 Cb 0.01 0.73 0.15 0.00 -1.10 0.00 0.00 41.96 41.75 1xct s TYR 150 CO 0.39 -1.10 1.19 0.12 -2.51 0.00 0.00 175.55 173.63 1xct s PHE 151 N -2.49 -0.31 0.03 -3.49 5.36 -0.96 -0.16 117.98 115.95 1xct s PHE 151 Ca 0.18 0.74 -0.03 0.00 -0.96 0.00 0.00 56.93 56.86 1xct s PHE 151 Cb -0.03 0.39 -0.04 0.00 -0.34 0.00 0.00 43.02 43.00 1xct s PHE 151 CO 0.07 -0.15 0.23 -1.25 -1.46 0.00 0.00 175.22 172.65 1xct s PRO 152 N 0.28 3.49 0.00 10.12 0.04 -1.26 -1.31 135.00 146.36 1xct s PRO 152 Ca 0.03 -0.27 0.00 0.00 0.04 0.00 0.00 61.00 60.80 1xct s PRO 152 Cb -0.05 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.44 1xct s PRO 152 CO -0.11 0.63 0.00 -1.91 0.04 0.00 0.00 177.00 175.66 1xct n GLU 153 N 0.75 0.00 -1.51 4.56 4.07 -1.26 -4.64 120.64 122.61 1xct n GLU 153 Ca -0.09 0.00 -0.58 0.00 -0.06 0.00 0.00 57.16 56.43 1xct n GLU 153 Cb 0.52 0.00 -0.09 0.00 -0.06 0.00 0.00 31.44 31.81 1xct n GLU 153 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72 1xct n PRO 154 N -0.32 0.63 -3.77 5.31 -0.04 -1.26 -4.91 135.00 130.64 1xct n PRO 154 Ca 0.00 0.20 -0.10 0.00 -0.04 0.00 0.00 63.50 63.56 1xct n PRO 154 Cb 0.00 -1.94 -0.07 0.00 -0.04 0.00 0.00 33.50 31.45 1xct n PRO 154 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1xct s VAL 155 N 5.21 0.11 -0.18 0.52 1.01 -1.26 -4.18 120.40 121.63 1xct s VAL 155 Ca 1.09 -0.87 -0.04 0.00 0.00 0.00 0.00 61.98 62.16 1xct s VAL 155 Cb -1.20 -1.14 0.09 0.00 0.00 0.00 0.00 36.38 34.12 1xct s VAL 155 CO 0.64 -0.48 0.25 0.42 0.00 0.00 0.00 175.10 175.93 1xct s THR 156 N -3.35 -0.38 0.33 3.92 -4.23 -0.21 -4.96 115.64 106.75 1xct s THR 156 Ca 0.01 0.03 -0.05 0.00 -1.18 0.00 0.00 61.69 60.49 1xct s THR 156 Cb 0.02 -0.61 0.07 0.00 1.34 0.00 0.00 72.50 73.33 1xct s THR 156 CO -0.08 -0.08 0.44 0.52 -0.54 0.00 0.00 174.62 174.88 1xct n VAL 157 N 5.33 0.00 0.00 2.29 0.31 -1.26 -1.36 118.33 123.65 1xct n VAL 157 Ca -0.05 -0.34 0.00 0.00 -0.01 0.00 0.00 64.34 63.93 1xct n VAL 157 Cb 0.50 -1.80 0.00 0.00 -0.91 0.00 0.00 33.84 31.63 1xct n VAL 157 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1xct n THR 158 N -2.58 0.00 -5.10 2.52 5.66 -1.05 -4.86 114.28 108.87 1xct n THR 158 Ca 0.06 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.74 1xct n THR 158 Cb 0.20 0.00 -0.17 0.00 -1.55 0.00 0.00 70.33 68.81 1xct n THR 158 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 175.07 172.28 1xct s TRP 159 N -1.90 2.51 -1.75 1.09 0.52 -1.26 -1.26 118.94 116.89 1xct s TRP 159 Ca 0.00 -1.06 0.00 0.00 0.02 0.00 0.00 56.10 55.06 1xct s TRP 159 Cb 0.00 -1.69 0.00 0.00 -1.15 0.00 0.00 33.47 30.63 1xct s TRP 159 CO 0.00 -0.44 0.00 0.09 0.02 0.00 0.00 176.95 176.62 1xct n ASN 160 N 3.62 -5.53 -0.08 2.95 4.13 -0.61 -0.41 115.26 119.33 1xct n ASN 160 Ca -0.19 0.10 -0.01 0.00 1.68 0.00 0.00 54.58 56.16 1xct n ASN 160 Cb 0.53 -4.66 -0.00 0.00 -1.54 0.00 0.00 39.78 34.10 1xct n ASN 160 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1xct n SER 161 N -1.84 -5.43 0.00 6.41 7.64 -1.26 -1.82 113.62 117.32 1xct n SER 161 Ca -0.23 0.03 0.00 0.00 1.01 0.00 0.00 58.87 59.68 1xct n SER 161 Cb 0.67 -3.02 0.00 0.00 -1.01 0.00 0.00 64.21 60.85 1xct n SER 161 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xct n GLY 162 N 0.20 1.30 0.02 0.23 0.00 0.45 -4.95 105.19 102.44 1xct n GLY 162 Ca -0.01 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.02 1xct n GLY 162 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xct n SER 163 N 0.00 0.05 -3.43 1.61 7.64 -0.75 -3.69 113.62 115.04 1xct n SER 163 Ca 0.00 0.51 -0.26 0.00 1.01 0.00 0.00 58.87 60.13 1xct n SER 163 Cb 0.00 -0.52 -0.11 0.00 -1.01 0.00 0.00 64.21 62.57 1xct n SER 163 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1xct s LEU 164 N -3.12 0.72 -0.13 -3.43 1.43 -1.14 -4.99 118.68 108.02 1xct s LEU 164 Ca -0.00 -2.06 0.15 0.00 -1.03 0.00 0.00 54.13 51.19 1xct s LEU 164 Cb 0.01 -0.16 -0.21 0.00 0.03 0.00 0.00 46.19 45.86 1xct s LEU 164 CO 0.02 -0.29 0.12 -1.54 0.23 0.00 0.00 176.35 174.88 1xct n SER 165 N 4.06 1.09 -4.87 2.29 3.41 -1.24 -4.36 113.62 114.00 1xct n SER 165 Ca 0.12 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.43 1xct n SER 165 Cb 0.39 1.06 -0.03 0.00 -0.26 0.00 0.00 64.21 65.37 1xct n SER 165 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1xct s SER 166 N -4.76 6.54 -0.26 4.04 1.04 -1.26 -3.54 113.70 115.50 1xct s SER 166 Ca -0.08 1.23 0.00 0.00 0.48 0.00 0.00 55.95 57.58 1xct s SER 166 Cb 0.06 -2.36 0.00 0.00 0.10 0.00 0.00 66.02 63.82 1xct s SER 166 CO 0.66 -0.45 0.00 0.61 0.98 0.00 0.00 173.24 175.05 1xct n GLY 167 N -1.38 0.51 3.68 7.32 0.00 -1.26 -4.65 105.19 109.41 1xct n GLY 167 Ca 0.03 -0.19 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 1xct n GLY 167 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xct s VAL 168 N -1.80 5.07 -0.24 1.61 1.01 -1.23 -2.93 120.40 121.89 1xct s VAL 168 Ca 0.00 0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.04 1xct s VAL 168 Cb 0.00 -3.30 0.07 0.00 0.00 0.00 0.00 36.38 33.15 1xct s VAL 168 CO 0.00 0.46 0.03 -1.00 0.00 0.00 0.00 175.10 174.58 1xct s HIS 169 N 0.33 1.61 -0.37 5.22 3.76 -0.60 -5.00 115.29 120.24 1xct s HIS 169 Ca 0.05 -1.35 -0.07 0.00 -0.15 0.00 0.00 55.06 53.54 1xct s HIS 169 Cb -0.12 -1.37 0.05 0.00 1.11 0.00 0.00 32.58 32.25 1xct s HIS 169 CO -0.01 -0.73 0.16 0.99 -0.85 0.00 0.00 174.74 174.31 1xct s THR 170 N 1.66 3.95 0.53 1.30 2.01 -1.26 -0.50 115.64 123.32 1xct s THR 170 Ca 0.00 -1.24 -0.19 0.00 0.31 0.00 0.00 61.69 60.57 1xct s THR 170 Cb -0.18 -3.31 -0.06 0.00 0.01 0.00 0.00 72.50 68.96 1xct s THR 170 CO -0.12 -0.31 1.08 -0.36 -0.69 0.00 0.00 174.62 174.23 1xct s PHE 171 N 1.41 2.84 0.60 4.92 0.40 -0.78 -4.99 117.98 122.39 1xct s PHE 171 Ca 0.01 1.55 -0.18 0.00 -0.60 0.00 0.00 56.93 57.71 1xct s PHE 171 Cb -0.21 -3.15 -0.03 0.00 0.51 0.00 0.00 43.02 40.14 1xct s PHE 171 CO 0.02 -1.21 1.20 -2.14 0.70 0.00 0.00 175.22 173.79 1xct s PRO 172 N -3.40 2.92 0.68 0.24 0.02 -1.26 -4.39 135.00 129.81 1xct s PRO 172 Ca 0.69 1.78 -0.16 0.00 0.02 0.00 0.00 61.00 63.33 1xct s PRO 172 Cb -0.20 -1.93 0.01 0.00 0.02 0.00 0.00 34.50 32.41 1xct s PRO 172 CO 0.26 -1.23 1.21 0.00 -0.33 0.00 0.00 177.00 176.91 1xct s ALA 173 N -1.68 2.28 -0.02 -1.55 0.00 -1.26 -4.77 121.76 114.76 1xct s ALA 173 Ca 0.76 0.93 -0.03 0.00 0.00 0.00 0.00 51.96 53.62 1xct s ALA 173 Cb -0.29 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.36 1xct s ALA 173 CO 0.34 -1.63 0.07 0.08 0.00 0.00 0.00 175.76 174.62 1xct s VAL 174 N -1.84 0.03 0.16 0.00 1.01 -0.09 -4.91 120.40 114.76 1xct s VAL 174 Ca 0.76 -0.28 -0.30 0.00 0.00 0.00 0.00 61.98 62.15 1xct s VAL 174 Cb -0.30 -0.20 -0.08 0.00 0.00 0.00 0.00 36.38 35.80 1xct s VAL 174 CO 0.41 -0.15 1.32 -0.76 0.00 0.00 0.00 175.10 175.92 1xct s LEU 175 N -0.47 4.40 -0.42 3.92 2.01 -1.26 -2.09 118.68 124.78 1xct s LEU 175 Ca -0.05 2.34 0.09 0.00 0.01 0.00 0.00 54.13 56.51 1xct s LEU 175 Cb -0.03 -3.60 0.42 0.00 0.01 0.00 0.00 46.19 42.98 1xct s LEU 175 CO 0.00 -0.55 1.02 1.67 1.01 0.00 0.00 176.35 179.50 1xct n GLN 176 N 3.15 2.63 -0.96 1.70 7.27 -0.27 -4.93 117.38 125.97 1xct n GLN 176 Ca 0.08 -4.14 0.00 0.00 0.07 0.00 0.00 57.00 53.01 1xct n GLN 176 Cb 0.43 -1.94 0.00 0.00 2.41 0.00 0.00 30.24 31.14 1xct n GLN 176 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 1xct n SER 177 N -0.29 -1.28 0.00 1.69 7.64 -1.26 -4.45 113.62 115.67 1xct n SER 177 Ca 0.29 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.17 1xct n SER 177 Cb 0.67 -0.64 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 1xct n SER 177 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1xct n ASP 178 N -0.33 0.00 -3.76 6.43 10.43 -1.26 -4.90 116.55 123.15 1xct n ASP 178 Ca 0.00 0.00 -0.14 0.00 2.57 0.00 0.00 54.79 57.22 1xct n ASP 178 Cb 0.02 -2.07 -0.15 0.00 1.84 0.00 0.00 41.12 40.75 1xct n ASP 178 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 1xct s LEU 179 N 0.00 0.90 1.27 0.64 2.96 -1.26 -4.97 118.68 118.21 1xct s LEU 179 Ca 0.00 0.16 -0.18 0.00 -0.22 0.00 0.00 54.13 53.89 1xct s LEU 179 Cb 0.00 0.13 0.31 0.00 0.50 0.00 0.00 46.19 47.14 1xct s LEU 179 CO 0.00 -0.14 1.01 -0.31 -1.32 0.00 0.00 176.35 175.59 1xct s TYR 180 N 1.13 0.41 -0.27 5.38 1.51 0.78 -1.11 117.35 125.18 1xct s TYR 180 Ca -0.09 0.75 -0.27 0.00 -1.01 0.00 0.00 57.07 56.45 1xct s TYR 180 Cb -0.12 -3.11 0.17 0.00 -0.11 0.00 0.00 41.96 38.80 1xct s TYR 180 CO -0.04 -4.27 1.30 -0.08 -1.11 0.00 0.00 175.55 171.35 1xct s THR 181 N -2.55 0.00 -0.05 -0.71 -1.32 -0.89 -2.08 115.64 108.05 1xct s THR 181 Ca 0.69 0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.86 1xct s THR 181 Cb -0.16 -1.00 0.08 0.00 -1.51 0.00 0.00 72.50 69.91 1xct s THR 181 CO 0.59 0.00 0.73 -1.48 -2.21 0.00 0.00 174.62 172.25 1xct s LEU 182 N -0.46 -0.60 0.49 9.08 0.05 -0.90 -0.91 118.68 125.42 1xct s LEU 182 Ca 0.06 0.61 0.05 0.00 0.05 0.00 0.00 54.13 54.90 1xct s LEU 182 Cb -0.03 2.43 -0.01 0.00 -2.05 0.00 0.00 46.19 46.53 1xct s LEU 182 CO -0.10 -0.59 0.19 -0.94 -0.55 0.00 0.00 176.35 174.36 1xct s SER 183 N -1.30 4.37 -0.25 1.48 1.04 -1.26 -0.85 113.70 116.93 1xct s SER 183 Ca -0.09 -1.33 -0.17 0.00 0.48 0.00 0.00 55.95 54.84 1xct s SER 183 Cb -0.00 0.13 0.07 0.00 0.10 0.00 0.00 66.02 66.32 1xct s SER 183 CO 0.07 -0.82 0.63 -0.55 0.98 0.00 0.00 173.24 173.55 1xct s SER 184 N -4.01 -0.78 0.18 7.02 0.15 -1.21 -1.87 113.70 113.19 1xct s SER 184 Ca 0.27 1.34 0.11 0.00 0.70 0.00 0.00 55.95 58.37 1xct s SER 184 Cb 0.01 1.26 -0.04 0.00 -1.71 0.00 0.00 66.02 65.54 1xct s SER 184 CO 0.16 -0.23 -0.24 -0.94 1.20 0.00 0.00 173.24 173.19 1xct s SER 185 N 1.13 3.37 0.05 5.45 1.04 0.34 -2.12 113.70 122.96 1xct s SER 185 Ca -0.06 -0.85 -0.01 0.00 0.48 0.00 0.00 55.95 55.51 1xct s SER 185 Cb -0.05 -0.24 -0.04 0.00 0.10 0.00 0.00 66.02 65.79 1xct s SER 185 CO -0.11 0.12 -0.03 0.54 0.98 0.00 0.00 173.24 174.74 1xct s VAL 186 N -1.59 0.22 -0.04 5.02 0.11 0.33 -1.56 120.40 122.89 1xct s VAL 186 Ca 0.19 -1.64 -0.02 0.00 -2.93 0.00 0.00 61.98 57.59 1xct s VAL 186 Cb -0.08 -1.28 0.03 0.00 -1.53 0.00 0.00 36.38 33.52 1xct s VAL 186 CO 0.09 -0.89 0.08 -0.89 -3.33 0.00 0.00 175.10 170.16 1xct s THR 187 N -3.41 -0.04 0.00 5.04 2.01 -1.15 0.62 115.64 118.71 1xct s THR 187 Ca 0.03 0.16 -0.03 0.00 0.31 0.00 0.00 61.69 62.15 1xct s THR 187 Cb 0.04 -0.15 -0.01 0.00 0.01 0.00 0.00 72.50 72.40 1xct s THR 187 CO -0.08 0.06 0.05 0.68 -0.69 0.00 0.00 174.62 174.65 1xct s VAL 188 N 0.90 0.08 0.38 3.82 -7.23 -0.97 -4.77 120.40 112.61 1xct s VAL 188 Ca -0.07 -0.66 -0.25 0.00 -1.81 0.00 0.00 61.98 59.20 1xct s VAL 188 Cb -0.10 -0.30 -0.12 0.00 0.56 0.00 0.00 36.38 36.42 1xct s VAL 188 CO -0.04 -0.36 0.80 -2.65 -0.31 0.00 0.00 175.10 172.54 1xct n PRO 189 N 1.81 0.95 0.28 4.82 -0.02 -1.26 -2.53 135.00 139.07 1xct n PRO 189 Ca -0.21 0.34 0.17 0.00 -2.02 0.00 0.00 63.50 61.78 1xct n PRO 189 Cb 0.56 -1.72 0.77 0.00 -0.02 0.00 0.00 33.50 33.09 1xct n PRO 189 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1xct h SER 190 N 1.31 0.00 -0.01 2.55 0.87 -1.59 -2.76 113.55 113.92 1xct h SER 190 Ca -0.41 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.16 1xct h SER 190 Cb 1.37 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.33 1xct h SER 190 CO 0.56 0.03 0.20 0.77 -0.53 0.00 0.00 176.83 177.85 1xct h SER 191 N 0.00 0.00 0.00 6.23 4.64 -1.89 -3.32 113.55 119.21 1xct h SER 191 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xct h SER 191 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 1xct h SER 191 CO 0.00 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.31 1xct n THR 192 N -3.01 0.00 -1.99 2.95 -2.24 -1.04 -4.86 114.28 104.08 1xct n THR 192 Ca -0.02 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.36 1xct n THR 192 Cb 0.26 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.24 1xct n THR 192 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1xct s TRP 193 N 0.41 2.73 0.20 4.78 -0.00 -1.24 0.17 118.94 125.99 1xct s TRP 193 Ca 0.00 1.37 -0.12 0.00 -0.00 0.00 0.00 56.10 57.35 1xct s TRP 193 Cb 0.00 -3.74 0.24 0.00 -0.00 0.00 0.00 33.47 29.97 1xct s TRP 193 CO 0.00 -2.30 1.69 -1.35 -0.00 0.00 0.00 176.95 174.99 1xct h PRO 194 N 2.62 0.18 -1.71 5.86 0.11 -1.92 -3.39 132.00 133.75 1xct h PRO 194 Ca -0.50 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1xct h PRO 194 Cb 1.25 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1xct h PRO 194 CO 0.62 0.12 0.00 0.43 -0.21 0.00 0.00 178.00 178.96 1xct n SER 195 N -5.18 0.00 -3.66 -2.05 7.64 0.13 -4.65 113.62 105.84 1xct n SER 195 Ca 0.07 -0.18 -0.13 0.00 1.01 0.00 0.00 58.87 59.63 1xct n SER 195 Cb 0.29 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.43 1xct n SER 195 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1xct s GLU 196 N 0.76 0.90 -1.35 1.43 0.41 -1.21 -4.87 118.70 114.77 1xct s GLU 196 Ca 0.00 -0.27 -0.16 0.00 -0.41 0.00 0.00 54.97 54.13 1xct s GLU 196 Cb 0.00 0.41 0.07 0.00 -1.78 0.00 0.00 34.13 32.82 1xct s GLU 196 CO 0.00 -0.30 1.89 2.41 -0.49 0.00 0.00 175.26 178.77 1xct n THR 197 N 0.66 3.81 -3.14 3.63 -1.04 -1.26 -4.72 114.28 112.22 1xct n THR 197 Ca -0.19 -3.78 -0.41 0.00 -2.04 0.00 0.00 64.05 57.63 1xct n THR 197 Cb 0.59 -2.44 -0.07 0.00 -1.82 0.00 0.00 70.33 66.59 1xct n THR 197 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1xct s VAL 198 N 3.72 4.94 -0.03 12.58 1.01 -1.26 -4.86 120.40 136.51 1xct s VAL 198 Ca 0.51 0.75 0.05 0.00 0.00 0.00 0.00 61.98 63.29 1xct s VAL 198 Cb 0.07 -4.00 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 1xct s VAL 198 CO 0.02 -0.17 -0.18 -0.89 0.00 0.00 0.00 175.10 173.89 1xct s THR 199 N 2.59 1.43 -0.88 3.92 2.01 -1.26 -1.25 115.64 122.19 1xct s THR 199 Ca 0.24 -0.74 -0.04 0.00 0.31 0.00 0.00 61.69 61.46 1xct s THR 199 Cb -0.15 -1.21 0.22 0.00 0.01 0.00 0.00 72.50 71.37 1xct s THR 199 CO 0.12 0.41 0.78 0.00 -0.69 0.00 0.00 174.62 175.24 1xct s ASN 201 N 0.32 6.51 -0.12 0.00 4.22 -0.39 -4.03 114.94 121.46 1xct s ASN 201 Ca 0.26 1.87 0.02 0.00 -2.14 0.00 0.00 52.86 52.87 1xct s ASN 201 Cb -0.10 -2.53 0.02 0.00 1.28 0.00 0.00 41.25 39.92 1xct s ASN 201 CO -0.10 -1.11 -0.16 0.54 -2.04 0.00 0.00 177.10 174.23 1xct s VAL 202 N 4.70 1.56 0.20 3.54 0.11 0.13 -2.52 120.40 128.12 1xct s VAL 202 Ca 0.72 -0.67 0.04 0.00 -2.93 0.00 0.00 61.98 59.14 1xct s VAL 202 Cb -0.28 -1.42 -0.03 0.00 -1.53 0.00 0.00 36.38 33.11 1xct s VAL 202 CO 0.28 0.45 0.27 0.00 -3.33 0.00 0.00 175.10 172.78 1xct s ALA 203 N 1.05 3.84 -0.38 1.54 0.00 -0.46 -2.44 121.76 124.90 1xct s ALA 203 Ca -0.05 -1.19 0.02 0.00 0.00 0.00 0.00 51.96 50.75 1xct s ALA 203 Cb -0.15 -1.63 0.16 0.00 0.00 0.00 0.00 23.12 21.50 1xct s ALA 203 CO -0.03 0.39 0.28 -1.58 0.00 0.00 0.00 175.76 174.82 1xct s HIS 204 N -1.88 0.93 0.53 0.00 2.46 -0.23 -1.05 115.29 116.06 1xct s HIS 204 Ca 0.34 -2.00 0.39 0.00 0.47 0.00 0.00 55.06 54.25 1xct s HIS 204 Cb -0.10 -0.93 1.56 0.00 -0.13 0.00 0.00 32.58 32.98 1xct s HIS 204 CO 0.27 -0.83 1.73 -1.35 -2.47 0.00 0.00 174.74 172.10 1xct h PRO 205 N 6.29 0.03 0.00 2.88 0.11 -1.77 -2.57 132.00 136.97 1xct h PRO 205 Ca 0.17 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1xct h PRO 205 Cb 0.94 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.04 1xct h PRO 205 CO 0.32 0.02 0.00 0.00 -0.21 0.00 0.00 178.00 178.13 1xct n ALA 206 N -2.77 -0.25 0.58 -0.75 0.00 -1.26 -2.56 120.51 113.50 1xct n ALA 206 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.75 1xct n ALA 206 Cb 1.44 0.01 0.00 0.00 0.00 0.00 0.00 19.45 20.89 1xct n ALA 206 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1xct n SER 207 N -1.27 0.51 -1.67 0.00 3.41 -1.13 -4.78 113.62 108.69 1xct n SER 207 Ca 0.00 -1.09 -0.06 0.00 -0.26 0.00 0.00 58.87 57.46 1xct n SER 207 Cb 0.00 -0.25 -0.02 0.00 -0.26 0.00 0.00 64.21 63.68 1xct n SER 207 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1xct n SER 208 N 0.18 -1.92 -4.94 4.04 7.64 -1.00 -4.89 113.62 112.73 1xct n SER 208 Ca 0.00 0.23 -0.25 0.00 1.01 0.00 0.00 58.87 59.86 1xct n SER 208 Cb 0.13 -1.91 -0.02 0.00 -1.01 0.00 0.00 64.21 61.40 1xct n SER 208 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1xct s THR 209 N -1.82 5.16 -0.30 0.44 2.01 -1.03 -4.97 115.64 115.13 1xct s THR 209 Ca 0.00 -0.50 -0.02 0.00 0.31 0.00 0.00 61.69 61.48 1xct s THR 209 Cb 0.00 -3.82 0.19 0.00 0.01 0.00 0.00 72.50 68.88 1xct s THR 209 CO 0.00 -0.40 0.75 -1.59 -0.69 0.00 0.00 174.62 172.70 1xct s LYS 210 N -3.93 0.43 0.02 4.92 -2.85 -1.26 -1.06 119.74 116.00 1xct s LYS 210 Ca 0.39 0.56 -0.04 0.00 -1.00 0.00 0.00 55.97 55.87 1xct s LYS 210 Cb -0.10 0.29 -0.04 0.00 -2.06 0.00 0.00 37.83 35.91 1xct s LYS 210 CO 0.32 -0.65 0.24 0.54 0.10 0.00 0.00 175.35 175.90 1xct s VAL 211 N 2.88 5.34 -0.57 1.79 0.11 -1.02 -4.94 120.40 123.99 1xct s VAL 211 Ca 0.15 -0.01 0.05 0.00 -2.93 0.00 0.00 61.98 59.23 1xct s VAL 211 Cb -0.10 -3.57 0.18 0.00 -1.53 0.00 0.00 36.38 31.36 1xct s VAL 211 CO -0.22 0.29 0.46 0.47 -3.33 0.00 0.00 175.10 172.78 1xct n ASP 212 N 0.86 1.60 -4.69 3.54 9.92 -1.26 -0.69 116.55 125.83 1xct n ASP 212 Ca -0.10 -2.89 -0.42 0.00 -0.53 0.00 0.00 54.79 50.86 1xct n ASP 212 Cb 0.52 -0.67 -0.03 0.00 -0.64 0.00 0.00 41.12 40.30 1xct n ASP 212 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1xct s LYS 213 N -0.96 4.44 0.17 -1.24 -0.14 -1.26 -4.84 119.74 115.91 1xct s LYS 213 Ca 0.30 1.23 -0.18 0.00 -1.36 0.00 0.00 55.97 55.96 1xct s LYS 213 Cb 0.02 -3.51 -0.08 0.00 -1.68 0.00 0.00 37.83 32.58 1xct s LYS 213 CO -0.17 -0.18 0.64 0.15 -0.76 0.00 0.00 175.35 175.03 1xct s LYS 214 N 1.56 4.16 -0.58 1.68 1.02 -1.26 -1.51 119.74 124.81 1xct s LYS 214 Ca 0.45 0.73 -0.27 0.00 0.02 0.00 0.00 55.97 56.91 1xct s LYS 214 Cb -0.19 -2.97 0.03 0.00 -0.52 0.00 0.00 37.83 34.18 1xct s LYS 214 CO 0.19 0.47 1.11 0.42 -0.92 0.00 0.00 175.35 176.63 1xct s ILE 215 N -1.42 4.12 -0.11 2.17 1.09 -0.38 -4.94 121.20 121.73 1xct s ILE 215 Ca 0.39 0.65 -0.13 0.00 -1.10 0.00 0.00 60.65 60.46 1xct s ILE 215 Cb -0.17 -4.68 -0.05 0.00 -1.06 0.00 0.00 42.46 36.50 1xct s ILE 215 CO 0.20 -1.31 0.29 -0.69 -0.10 0.00 0.00 174.94 173.34 1xct s VAL 216 N 4.67 5.28 1.19 2.92 1.01 -1.26 -4.79 120.40 129.41 1xct s VAL 216 Ca 0.38 0.56 -0.15 0.00 0.00 0.00 0.00 61.98 62.77 1xct s VAL 216 Cb -0.09 -3.61 0.29 0.00 0.00 0.00 0.00 36.38 32.96 1xct s VAL 216 CO 0.22 0.47 1.03 -2.16 0.00 0.00 0.00 175.10 174.67 1xct s PRO 217 N -0.16 -1.09 0.00 2.72 0.04 -1.26 -4.89 135.00 130.35 1xct s PRO 217 Ca 0.18 0.58 0.00 0.00 0.04 0.00 0.00 61.00 61.80 1xct s PRO 217 Cb -0.14 -1.55 0.00 0.00 0.04 0.00 0.00 34.50 32.85 1xct s PRO 217 CO 0.06 -3.77 0.00 -2.13 0.04 0.00 0.00 177.00 171.20