#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a9n s VAL 3 N 0.00 0.02 0.01 -3.33 1.01 -1.26 -4.70 120.40 112.15 2a9n s VAL 3 Ca 0.00 -0.18 -0.19 0.00 0.00 0.00 0.00 61.98 61.60 2a9n s VAL 3 Cb 0.00 -0.84 -0.06 0.00 0.00 0.00 0.00 36.38 35.48 2a9n s VAL 3 CO 0.00 -0.10 0.56 -0.76 0.00 0.00 0.00 175.10 174.80 2a9n s LEU 4 N -1.17 4.44 -0.17 3.92 1.43 -1.20 -4.94 118.68 121.00 2a9n s LEU 4 Ca -0.11 1.14 -0.14 0.00 -1.03 0.00 0.00 54.13 53.99 2a9n s LEU 4 Cb -0.02 -2.87 -0.05 0.00 0.03 0.00 0.00 46.19 43.29 2a9n s LEU 4 CO 0.07 0.16 0.31 0.42 0.23 0.00 0.00 176.35 177.54 2a9n s THR 5 N -0.46 5.29 0.18 5.49 -4.23 -0.60 -1.93 115.64 119.38 2a9n s THR 5 Ca 0.29 0.57 0.09 0.00 -1.18 0.00 0.00 61.69 61.47 2a9n s THR 5 Cb -0.18 -3.65 -0.04 0.00 1.34 0.00 0.00 72.50 69.97 2a9n s THR 5 CO 0.17 0.37 -0.19 -1.10 -0.54 0.00 0.00 174.62 173.32 2a9n s GLN 6 N 0.62 1.34 0.15 3.99 -0.21 -1.26 -1.97 119.66 122.32 2a9n s GLN 6 Ca 0.17 -1.46 -0.31 0.00 0.02 0.00 0.00 55.36 53.77 2a9n s GLN 6 Cb -0.13 -1.42 -0.10 0.00 1.00 0.00 0.00 33.01 32.35 2a9n s GLN 6 CO 0.05 0.29 1.67 -1.25 -2.12 0.00 0.00 175.29 173.92 2a9n s PRO 7 N -2.89 4.17 0.33 2.91 0.04 -1.26 -4.77 135.00 133.52 2a9n s PRO 7 Ca 0.18 2.47 0.11 0.00 0.04 0.00 0.00 61.00 63.80 2a9n s PRO 7 Cb -0.06 -3.28 0.99 0.00 0.04 0.00 0.00 34.50 32.19 2a9n s PRO 7 CO 0.08 -0.71 1.64 0.66 0.04 0.00 0.00 177.00 178.71 2a9n h SER 9 N 7.37 0.29 -4.53 6.66 4.64 -1.98 -3.37 113.55 122.64 2a9n h SER 9 Ca -0.43 0.21 -0.08 0.00 -0.47 0.00 0.00 61.79 61.01 2a9n h SER 9 Cb 1.20 0.21 -0.21 0.00 -0.31 0.00 0.00 62.40 63.30 2a9n h SER 9 CO 0.94 -0.19 -0.00 -0.55 -0.87 0.00 0.00 176.83 176.16 2a9n s SER 10 N -4.92 -0.54 0.03 4.97 0.15 -1.26 -2.54 113.70 109.59 2a9n s SER 10 Ca -0.11 0.80 -0.01 0.00 0.70 0.00 0.00 55.95 57.33 2a9n s SER 10 Cb 0.29 0.79 -0.03 0.00 -1.71 0.00 0.00 66.02 65.36 2a9n s SER 10 CO 0.78 -0.40 -0.02 0.68 1.20 0.00 0.00 173.24 175.48 2a9n s VAL 11 N -0.55 0.16 -0.00 4.45 -7.23 -1.07 -4.96 120.40 111.20 2a9n s VAL 11 Ca -0.07 -1.31 -0.10 0.00 -1.81 0.00 0.00 61.98 58.69 2a9n s VAL 11 Cb -0.03 -0.84 0.01 0.00 0.56 0.00 0.00 36.38 36.08 2a9n s VAL 11 CO 0.05 -0.72 0.20 -0.44 -0.31 0.00 0.00 175.10 173.87 2a9n s SER 12 N -2.13 -0.05 0.30 4.85 0.01 -1.26 -2.09 113.70 113.33 2a9n s SER 12 Ca -0.05 -0.10 -0.14 0.00 1.31 0.00 0.00 55.95 56.96 2a9n s SER 12 Cb -0.02 0.24 0.01 0.00 0.21 0.00 0.00 66.02 66.47 2a9n s SER 12 CO -0.05 -0.40 0.60 0.00 0.41 0.00 0.00 173.24 173.80 2a9n s ALA 13 N -1.36 -0.44 -0.03 1.44 0.00 -1.19 -5.00 121.76 115.18 2a9n s ALA 13 Ca -0.14 -0.80 -0.03 0.00 0.00 0.00 0.00 51.96 50.99 2a9n s ALA 13 Cb -0.07 0.95 -0.04 0.00 0.00 0.00 0.00 23.12 23.96 2a9n s ALA 13 CO 0.02 -0.92 0.14 0.00 0.00 0.00 0.00 175.76 175.01 2a9n s ALA 14 N -3.52 3.82 0.89 0.00 0.00 -1.26 -1.28 121.76 120.40 2a9n s ALA 14 Ca 0.19 -0.77 -0.16 0.00 0.00 0.00 0.00 51.96 51.22 2a9n s ALA 14 Cb -0.03 -1.81 -0.09 0.00 0.00 0.00 0.00 23.12 21.20 2a9n s ALA 14 CO 0.11 0.70 -0.24 -0.35 0.00 0.00 0.00 175.76 175.98 2a9n n PRO 15 N 1.25 -0.03 -0.57 0.00 -0.04 -1.26 -2.58 135.00 131.77 2a9n n PRO 15 Ca -0.13 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 2a9n n PRO 15 Cb 0.53 -1.33 0.00 0.00 -0.04 0.00 0.00 33.50 32.66 2a9n n PRO 15 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2a9n n GLY 16 N 2.62 0.82 0.00 0.55 0.00 0.29 -4.84 105.19 104.63 2a9n n GLY 16 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2a9n n GLY 16 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2a9n n GLN 17 N -2.00 1.18 -4.75 1.61 6.02 -1.07 -4.21 117.38 114.16 2a9n n GLN 17 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.71 2a9n n GLN 17 Cb 0.00 0.00 -0.17 0.00 1.02 0.00 0.00 30.24 31.09 2a9n n GLN 17 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 2a9n s LYS 18 N -1.47 2.30 0.23 -1.09 2.47 -1.26 -1.88 119.74 119.04 2a9n s LYS 18 Ca 0.00 -0.61 0.10 0.00 -1.56 0.00 0.00 55.97 53.90 2a9n s LYS 18 Cb 0.00 -1.84 -0.04 0.00 -1.46 0.00 0.00 37.83 34.48 2a9n s LYS 18 CO 0.00 0.05 -0.09 0.14 0.16 0.00 0.00 175.35 175.61 2a9n s VAL 19 N 0.65 3.09 -0.11 4.02 -7.23 -0.43 -5.01 120.40 115.37 2a9n s VAL 19 Ca -0.14 -1.93 -0.02 0.00 -1.81 0.00 0.00 61.98 58.09 2a9n s VAL 19 Cb -0.16 -2.59 0.04 0.00 0.56 0.00 0.00 36.38 34.23 2a9n s VAL 19 CO 0.04 -0.26 0.02 -0.89 -0.31 0.00 0.00 175.10 173.69 2a9n s THR 20 N -2.09 0.38 -0.27 5.32 2.01 -1.26 -2.43 115.64 117.30 2a9n s THR 20 Ca 0.28 -0.07 -0.12 0.00 0.31 0.00 0.00 61.69 62.09 2a9n s THR 20 Cb -0.07 -0.66 -0.05 0.00 0.01 0.00 0.00 72.50 71.73 2a9n s THR 20 CO 0.16 0.10 0.23 -0.63 -0.69 0.00 0.00 174.62 173.80 2a9n s ILE 21 N 1.96 5.29 -0.00 1.82 1.01 -0.24 -4.97 121.20 126.06 2a9n s ILE 21 Ca 0.03 0.28 -0.00 0.00 0.00 0.00 0.00 60.65 60.96 2a9n s ILE 21 Cb -0.14 -3.57 -0.04 0.00 0.01 0.00 0.00 42.46 38.73 2a9n s ILE 21 CO -0.06 0.25 0.07 -0.94 0.00 0.00 0.00 174.94 174.26 2a9n s SER 22 N 1.57 5.61 -0.29 3.58 1.04 -1.26 -0.63 113.70 123.32 2a9n s SER 22 Ca 0.09 0.12 -0.01 0.00 0.48 0.00 0.00 55.95 56.64 2a9n s SER 22 Cb -0.15 -1.59 0.09 0.00 0.10 0.00 0.00 66.02 64.46 2a9n s SER 22 CO 0.09 0.27 0.07 0.00 0.98 0.00 0.00 173.24 174.65 2a9n s SER 24 N 1.58 4.60 0.00 0.00 1.04 -0.83 -1.29 113.70 118.79 2a9n s SER 24 Ca 0.07 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.28 2a9n s SER 24 Cb -0.17 -1.76 0.00 0.00 0.10 0.00 0.00 66.02 64.19 2a9n s SER 24 CO -0.20 0.11 0.00 0.61 0.98 0.00 0.00 173.24 174.75 2a9n n GLY 25 N 3.89 3.42 3.30 7.32 0.00 -0.73 -1.55 105.19 120.83 2a9n n GLY 25 Ca -0.18 -0.34 -0.18 0.00 0.00 0.00 0.00 46.02 45.33 2a9n n GLY 25 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2a9n s SER 26 N 1.00 1.35 0.17 1.61 0.15 -1.25 -4.85 113.70 111.88 2a9n s SER 26 Ca 0.00 -1.60 -0.14 0.00 0.70 0.00 0.00 55.95 54.91 2a9n s SER 26 Cb 0.00 0.45 0.08 0.00 -1.71 0.00 0.00 66.02 64.84 2a9n s SER 26 CO 0.00 -0.94 1.82 0.74 1.20 0.00 0.00 173.24 176.06 2a9n h THR 27 N 2.25 1.08 -1.00 6.45 2.02 -1.95 -1.46 112.91 120.30 2a9n h THR 27 Ca -0.31 -0.21 0.10 0.00 0.77 0.00 0.00 66.41 66.75 2a9n h THR 27 Cb 1.24 0.40 -0.08 0.00 -1.74 0.00 0.00 68.15 67.97 2a9n h THR 27 CO 0.47 0.11 0.63 0.77 0.37 0.00 0.00 175.52 177.88 2a9n h SER 29 N 0.62 0.97 0.00 4.18 4.64 -1.97 -2.95 113.55 119.04 2a9n h SER 29 Ca 0.20 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2a9n h SER 29 Cb -0.01 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 61.91 2a9n h SER 29 CO -0.08 0.56 -0.33 -0.46 -0.87 0.00 0.00 176.83 175.65 2a9n n ASN 30 N -4.58 0.65 -0.03 4.97 0.23 -1.10 -2.63 115.26 112.77 2a9n n ASN 30 Ca 0.17 0.12 -0.14 0.00 -0.53 0.00 0.00 54.58 54.21 2a9n n ASN 30 Cb 0.28 -0.58 -0.11 0.00 -2.08 0.00 0.00 39.78 37.29 2a9n n ASN 30 CO 0.00 0.00 0.00 0.40 -0.93 0.00 0.00 177.26 176.73 2a9n h ILE 31 N -0.34 1.52 -0.96 1.53 1.08 -1.46 -3.05 117.51 115.83 2a9n h ILE 31 Ca 0.00 -1.60 0.13 0.00 -0.39 0.00 0.00 64.86 63.00 2a9n h ILE 31 Cb 0.33 2.57 -0.14 0.00 -3.07 0.00 0.00 36.82 36.51 2a9n h ILE 31 CO 0.00 0.42 -0.45 1.23 -0.69 0.00 0.00 178.15 178.66 2a9n h GLY 32 N -0.60 -0.24 -0.27 5.37 0.00 -1.39 -3.04 103.07 102.91 2a9n h GLY 32 Ca -0.00 0.61 0.00 0.00 0.00 0.00 0.00 47.33 47.94 2a9n h GLY 32 CO 0.01 -0.12 -0.75 0.70 0.00 0.00 0.00 176.54 176.38 2a9n n ASN 33 N -5.40 1.18 -4.62 0.19 3.02 -1.13 -4.98 115.26 103.52 2a9n n ASN 33 Ca 0.07 -1.09 -0.24 0.00 -0.03 0.00 0.00 54.58 53.29 2a9n n ASN 33 Cb 0.35 0.84 -0.08 0.00 -0.61 0.00 0.00 39.78 40.28 2a9n n ASN 33 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2a9n s ASN 39 N -2.61 4.20 0.49 6.41 0.01 -1.15 -5.11 114.94 117.18 2a9n s ASN 39 Ca 0.10 -0.93 -0.22 0.00 -0.71 0.00 0.00 52.86 51.10 2a9n s ASN 39 Cb 0.15 -0.57 -0.07 0.00 0.41 0.00 0.00 41.25 41.17 2a9n s ASN 39 CO 0.69 -0.17 1.19 -0.31 -1.51 0.00 0.00 177.10 176.99 2a9n s TYR 40 N -2.48 2.75 -0.10 2.20 2.02 -1.26 -4.78 117.35 115.69 2a9n s TYR 40 Ca 0.34 1.51 0.03 0.00 -0.37 0.00 0.00 57.07 58.58 2a9n s TYR 40 Cb -0.02 -3.43 -0.01 0.00 -0.40 0.00 0.00 41.96 38.10 2a9n s TYR 40 CO 0.19 -1.74 -0.20 0.54 -1.57 0.00 0.00 175.55 172.78 2a9n s VAL 41 N -1.54 2.49 0.10 0.71 0.11 -1.26 -4.25 120.40 116.75 2a9n s VAL 41 Ca 0.66 -0.88 0.09 0.00 -2.93 0.00 0.00 61.98 58.93 2a9n s VAL 41 Cb -0.30 -1.98 -0.03 0.00 -1.53 0.00 0.00 36.38 32.53 2a9n s VAL 41 CO 0.35 0.55 -0.24 -0.94 -3.33 0.00 0.00 175.10 171.49 2a9n s SER 42 N 0.20 2.94 0.01 3.54 1.04 -0.41 -1.42 113.70 119.59 2a9n s SER 42 Ca -0.12 -0.68 0.07 0.00 0.48 0.00 0.00 55.95 55.71 2a9n s SER 42 Cb -0.16 -0.20 -0.03 0.00 0.10 0.00 0.00 66.02 65.73 2a9n s SER 42 CO 0.06 0.15 -0.22 0.26 0.98 0.00 0.00 173.24 174.47 2a9n s TRP 43 N -1.02 2.45 0.02 5.02 0.52 0.25 -0.69 118.94 125.48 2a9n s TRP 43 Ca 0.10 -0.34 0.04 0.00 0.02 0.00 0.00 56.10 55.92 2a9n s TRP 43 Cb -0.10 -1.48 -0.01 0.00 -1.15 0.00 0.00 33.47 30.72 2a9n s TRP 43 CO 0.04 0.12 -0.11 0.71 0.02 0.00 0.00 176.95 177.73 2a9n s TYR 44 N -0.76 1.00 -0.05 -1.98 1.51 0.11 -1.17 117.35 116.00 2a9n s TYR 44 Ca 0.12 -0.28 0.01 0.00 -1.01 0.00 0.00 57.07 55.92 2a9n s TYR 44 Cb -0.10 -0.62 -0.03 0.00 -0.11 0.00 0.00 41.96 41.10 2a9n s TYR 44 CO 0.02 -0.00 -0.07 -1.14 -1.11 0.00 0.00 175.55 173.25 2a9n s GLN 45 N -0.73 2.71 -0.22 -0.62 0.74 -0.08 -0.61 119.66 120.85 2a9n s GLN 45 Ca 0.02 -0.58 -0.04 0.00 0.05 0.00 0.00 55.36 54.81 2a9n s GLN 45 Cb -0.06 -2.58 0.10 0.00 1.10 0.00 0.00 33.01 31.57 2a9n s GLN 45 CO 0.00 0.65 0.21 -1.14 -0.55 0.00 0.00 175.29 174.46 2a9n s GLN 46 N -0.95 0.19 0.07 1.67 0.74 -0.37 -0.59 119.66 120.41 2a9n s GLN 46 Ca 0.13 0.05 -0.30 0.00 0.05 0.00 0.00 55.36 55.29 2a9n s GLN 46 Cb -0.11 -1.21 -0.05 0.00 1.10 0.00 0.00 33.01 32.73 2a9n s GLN 46 CO 0.03 -0.75 1.14 -1.01 -0.55 0.00 0.00 175.29 174.15 2a9n s HIS 47 N 2.28 3.51 0.24 1.67 3.76 -1.26 -2.49 115.29 122.99 2a9n s HIS 47 Ca 0.07 1.43 -0.28 0.00 -0.15 0.00 0.00 55.06 56.12 2a9n s HIS 47 Cb -0.16 -3.34 -0.16 0.00 1.11 0.00 0.00 32.58 30.04 2a9n s HIS 47 CO -0.17 -0.92 0.74 -2.30 -0.85 0.00 0.00 174.74 171.25 2a9n n PRO 48 N 3.69 0.60 0.00 8.40 -0.02 -1.26 -2.53 135.00 143.87 2a9n n PRO 48 Ca 0.07 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 2a9n n PRO 48 Cb 0.47 -1.38 0.00 0.00 -0.02 0.00 0.00 33.50 32.57 2a9n n PRO 48 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2a9n n GLY 49 N 1.66 2.65 3.84 -1.23 0.00 -1.26 -5.02 105.19 105.83 2a9n n GLY 49 Ca 0.14 -0.67 -0.21 0.00 0.00 0.00 0.00 46.02 45.29 2a9n n GLY 49 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2a9n n LYS 50 N 0.00 0.63 -2.27 1.61 2.85 -1.05 -5.11 118.16 114.83 2a9n n LYS 50 Ca 0.00 -3.19 -0.32 0.00 -1.05 0.00 0.00 58.31 53.75 2a9n n LYS 50 Cb 0.00 -0.05 -0.02 0.00 -0.65 0.00 0.00 35.03 34.31 2a9n n LYS 50 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2a9n s ALA 51 N -2.72 2.96 0.88 0.58 0.00 -1.26 -4.74 121.76 117.46 2a9n s ALA 51 Ca 0.51 0.25 -0.11 0.00 0.00 0.00 0.00 51.96 52.60 2a9n s ALA 51 Cb -0.04 -3.16 0.12 0.00 0.00 0.00 0.00 23.12 20.05 2a9n s ALA 51 CO 0.33 -0.44 1.09 -2.14 0.00 0.00 0.00 175.76 174.60 2a9n s PRO 52 N -4.10 1.35 -0.01 0.00 0.02 -1.26 -4.72 135.00 126.28 2a9n s PRO 52 Ca 0.60 0.88 0.02 0.00 0.02 0.00 0.00 61.00 62.53 2a9n s PRO 52 Cb -0.12 -1.82 -0.00 0.00 0.02 0.00 0.00 34.50 32.58 2a9n s PRO 52 CO 0.34 -2.19 -0.08 0.21 -0.33 0.00 0.00 177.00 174.95 2a9n s LYS 53 N -4.92 0.73 -0.46 5.54 2.20 0.24 -4.94 119.74 118.13 2a9n s LYS 53 Ca 0.63 -0.27 -0.28 0.00 -0.36 0.00 0.00 55.97 55.69 2a9n s LYS 53 Cb -0.18 -0.71 0.03 0.00 -1.51 0.00 0.00 37.83 35.46 2a9n s LYS 53 CO 0.57 0.13 1.10 -1.17 -0.36 0.00 0.00 175.35 175.62 2a9n s LEU 54 N 0.02 3.71 -0.21 5.43 1.98 -1.26 -0.90 118.68 127.45 2a9n s LEU 54 Ca 0.00 0.46 -0.21 0.00 -2.89 0.00 0.00 54.13 51.49 2a9n s LEU 54 Cb -0.06 -3.50 -0.18 0.00 0.66 0.00 0.00 46.19 43.12 2a9n s LEU 54 CO -0.00 -1.20 0.18 0.23 -1.89 0.00 0.00 176.35 173.67 2a9n n MET 55 N 7.67 0.56 -3.86 1.98 2.81 -0.32 -4.74 117.12 121.22 2a9n n MET 55 Ca 0.11 0.57 -0.12 0.00 -1.81 0.00 0.00 57.70 56.45 2a9n n MET 55 Cb 0.49 -1.74 -0.14 0.00 -0.71 0.00 0.00 33.22 31.12 2a9n n MET 55 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 2a9n s ILE 56 N -2.36 -0.00 0.15 2.02 1.01 -1.11 -4.25 121.20 116.66 2a9n s ILE 56 Ca -0.29 0.01 0.02 0.00 0.00 0.00 0.00 60.65 60.39 2a9n s ILE 56 Cb 0.06 -0.02 -0.04 0.00 0.01 0.00 0.00 42.46 42.46 2a9n s ILE 56 CO 0.57 0.00 -0.01 -0.72 0.00 0.00 0.00 174.94 174.78 2a9n s TYR 57 N 0.04 1.12 -1.51 3.97 -0.85 -0.22 -0.59 117.35 119.31 2a9n s TYR 57 Ca -0.00 -1.00 -0.13 0.00 -0.52 0.00 0.00 57.07 55.42 2a9n s TYR 57 Cb -0.00 -0.64 0.09 0.00 0.38 0.00 0.00 41.96 41.79 2a9n s TYR 57 CO -0.00 -0.21 0.85 -0.25 -1.52 0.00 0.00 175.55 174.43 2a9n n ASP 58 N -0.18 -4.61 0.00 -0.18 10.43 -1.24 -1.49 116.55 119.27 2a9n n ASP 58 Ca -0.08 -0.69 0.00 0.00 2.57 0.00 0.00 54.79 56.59 2a9n n ASP 58 Cb 0.63 -3.71 0.00 0.00 1.84 0.00 0.00 41.12 39.88 2a9n n ASP 58 CO 0.00 0.00 0.00 0.52 -1.07 0.00 0.00 177.20 176.65 2a9n n VAL 67 N -4.51 0.00 -1.35 2.53 0.31 -0.51 -4.27 118.33 110.53 2a9n n VAL 67 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 2a9n n VAL 67 Cb 0.53 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.46 2a9n n VAL 67 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2a9n n SER 68 N 2.30 0.10 -4.76 4.52 3.41 -1.18 -3.49 113.62 114.53 2a9n n SER 68 Ca 0.00 -1.44 -0.26 0.00 -0.26 0.00 0.00 58.87 56.90 2a9n n SER 68 Cb 0.00 -0.08 -0.06 0.00 -0.26 0.00 0.00 64.21 63.81 2a9n n SER 68 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2a9n s LYS 69 N -0.08 2.74 -0.02 4.33 1.02 -0.56 -4.63 119.74 122.54 2a9n s LYS 69 Ca 0.01 -0.95 0.00 0.00 0.02 0.00 0.00 55.97 55.05 2a9n s LYS 69 Cb 0.01 -2.55 0.02 0.00 -0.52 0.00 0.00 37.83 34.78 2a9n s LYS 69 CO 0.00 0.47 -0.00 -0.98 -0.92 0.00 0.00 175.35 173.92 2a9n s ARG 70 N -3.08 0.20 0.61 1.68 1.70 -1.26 -1.06 118.95 117.74 2a9n s ARG 70 Ca 0.30 0.05 -0.18 0.00 -0.47 0.00 0.00 55.73 55.43 2a9n s ARG 70 Cb -0.10 -0.35 -0.02 0.00 -0.57 0.00 0.00 34.95 33.91 2a9n s ARG 70 CO 0.22 -0.09 1.16 -1.25 -1.08 0.00 0.00 175.30 174.27 2a9n s PRO 71 N 0.71 2.92 -0.04 3.89 0.04 -1.26 -4.87 135.00 136.39 2a9n s PRO 71 Ca -0.07 1.66 -0.36 0.00 0.04 0.00 0.00 61.00 62.27 2a9n s PRO 71 Cb -0.10 -1.94 -0.15 0.00 0.04 0.00 0.00 34.50 32.35 2a9n s PRO 71 CO -0.01 -1.21 1.62 0.43 0.04 0.00 0.00 177.00 177.87 2a9n n SER 72 N -1.86 2.57 0.00 6.66 7.64 -1.26 -2.50 113.62 124.88 2a9n n SER 72 Ca 0.12 1.07 0.00 0.00 1.01 0.00 0.00 58.87 61.07 2a9n n SER 72 Cb 0.51 -1.27 0.00 0.00 -1.01 0.00 0.00 64.21 62.44 2a9n n SER 72 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2a9n n GLY 73 N 3.60 1.28 3.11 0.23 0.00 -1.26 -5.10 105.19 107.05 2a9n n GLY 73 Ca 0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.94 2a9n n GLY 73 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a9n s VAL 74 N -2.00 1.64 0.47 1.61 1.01 -1.04 -5.12 120.40 116.97 2a9n s VAL 74 Ca 0.00 -0.75 -0.24 0.00 0.00 0.00 0.00 61.98 60.99 2a9n s VAL 74 Cb 0.00 -1.46 -0.07 0.00 0.00 0.00 0.00 36.38 34.85 2a9n s VAL 74 CO 0.00 0.47 1.36 -2.16 0.00 0.00 0.00 175.10 174.76 2a9n s PRO 75 N 0.70 3.61 0.00 2.72 0.04 -1.26 -4.88 135.00 135.92 2a9n s PRO 75 Ca -0.12 2.25 0.10 0.00 0.04 0.00 0.00 61.00 63.26 2a9n s PRO 75 Cb -0.16 -2.55 0.58 0.00 0.04 0.00 0.00 34.50 32.41 2a9n s PRO 75 CO 0.03 -0.82 1.00 -0.40 0.04 0.00 0.00 177.00 176.85 2a9n n ASP 76 N -0.37 0.00 -0.00 6.66 3.85 -1.26 -2.22 116.55 123.20 2a9n n ASP 76 Ca 0.06 -0.48 0.15 0.00 -0.71 0.00 0.00 54.79 53.82 2a9n n ASP 76 Cb 0.44 0.00 0.78 0.00 -1.35 0.00 0.00 41.12 40.99 2a9n n ASP 76 CO 0.00 0.00 0.00 -2.11 -1.01 0.00 0.00 177.20 174.08 2a9n n ARG 77 N -0.89 0.50 -3.51 0.11 1.85 -1.26 -4.69 116.66 108.77 2a9n n ARG 77 Ca 0.07 -0.01 -0.38 0.00 -1.00 0.00 0.00 57.85 56.54 2a9n n ARG 77 Cb 0.03 -1.50 -0.09 0.00 -1.05 0.00 0.00 32.46 29.85 2a9n n ARG 77 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2a9n s PHE 78 N -2.50 3.30 0.18 2.89 0.08 -0.94 -1.74 117.98 119.25 2a9n s PHE 78 Ca 0.31 0.35 0.09 0.00 0.12 0.00 0.00 56.93 57.80 2a9n s PHE 78 Cb 0.20 -2.43 -0.04 0.00 -0.57 0.00 0.00 43.02 40.18 2a9n s PHE 78 CO 0.45 -0.07 -0.19 -1.12 -0.10 0.00 0.00 175.22 174.20 2a9n s SER 79 N 1.32 2.86 -0.06 1.36 0.01 0.83 -4.99 113.70 115.03 2a9n s SER 79 Ca 0.12 -0.88 -0.04 0.00 1.31 0.00 0.00 55.95 56.46 2a9n s SER 79 Cb -0.15 -0.18 0.02 0.00 0.21 0.00 0.00 66.02 65.92 2a9n s SER 79 CO 0.08 -0.01 0.14 -0.83 0.41 0.00 0.00 173.24 173.02 2a9n s GLY 80 N -2.77 -0.07 0.11 3.44 0.00 -1.26 -1.06 107.32 105.70 2a9n s GLY 80 Ca 0.18 0.49 -0.01 0.00 0.00 0.00 0.00 44.72 45.37 2a9n s GLY 80 CO 0.08 0.57 0.04 -1.35 0.00 0.00 0.00 173.10 172.44 2a9n s SER 81 N 0.47 0.34 -0.04 1.64 1.04 -0.65 -4.02 113.70 112.49 2a9n s SER 81 Ca -0.03 -1.15 -0.01 0.00 0.48 0.00 0.00 55.95 55.24 2a9n s SER 81 Cb -0.05 0.28 0.03 0.00 0.10 0.00 0.00 66.02 66.38 2a9n s SER 81 CO -0.02 -0.70 0.03 -0.75 0.98 0.00 0.00 173.24 172.77 2a9n s LYS 82 N -4.01 0.18 -0.35 4.02 2.20 -1.26 -1.72 119.74 118.79 2a9n s LYS 82 Ca 0.20 0.20 0.00 0.00 -0.36 0.00 0.00 55.97 56.01 2a9n s LYS 82 Cb 0.07 -0.55 0.11 0.00 -1.51 0.00 0.00 37.83 35.96 2a9n s LYS 82 CO -0.01 -0.24 0.15 0.45 -0.36 0.00 0.00 175.35 175.34 2a9n s SER 83 N 1.59 3.80 0.95 1.43 0.15 -0.70 -5.02 113.70 115.91 2a9n s SER 83 Ca -0.02 -1.96 0.00 0.00 0.70 0.00 0.00 55.95 54.67 2a9n s SER 83 Cb -0.13 -0.85 0.00 0.00 -1.71 0.00 0.00 66.02 63.33 2a9n s SER 83 CO -0.03 -0.36 0.00 0.61 1.20 0.00 0.00 173.24 174.66 2a9n n GLY 84 N 4.41 1.16 1.75 9.45 0.00 -1.26 -3.43 105.19 117.26 2a9n n GLY 84 Ca 0.02 -0.63 0.02 0.00 0.00 0.00 0.00 46.02 45.43 2a9n n GLY 84 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2a9n n ASN 87 N 7.54 4.83 -3.70 1.61 5.03 -1.26 -3.99 115.26 125.33 2a9n n ASN 87 Ca 0.00 -2.89 -0.14 0.00 0.87 0.00 0.00 54.58 52.42 2a9n n ASN 87 Cb 0.00 -0.68 -0.09 0.00 -1.02 0.00 0.00 39.78 37.99 2a9n n ASN 87 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2a9n s SER 88 N -0.71 -0.41 0.34 6.41 1.04 -1.22 -1.77 113.70 117.37 2a9n s SER 88 Ca 0.47 0.60 0.08 0.00 0.48 0.00 0.00 55.95 57.58 2a9n s SER 88 Cb 0.36 0.66 -0.07 0.00 0.10 0.00 0.00 66.02 67.08 2a9n s SER 88 CO 0.13 -0.34 -0.06 0.00 0.98 0.00 0.00 173.24 173.94 2a9n s ALA 89 N -0.56 2.82 -0.09 5.32 0.00 -0.41 -1.72 121.76 127.12 2a9n s ALA 89 Ca -0.07 -2.08 -0.04 0.00 0.00 0.00 0.00 51.96 49.77 2a9n s ALA 89 Cb -0.03 0.08 0.04 0.00 0.00 0.00 0.00 23.12 23.21 2a9n s ALA 89 CO 0.04 -0.00 0.20 0.45 0.00 0.00 0.00 175.76 176.45 2a9n s SER 90 N -3.58 -0.09 -0.17 0.00 0.15 -0.70 -0.40 113.70 108.90 2a9n s SER 90 Ca 0.32 0.43 -0.11 0.00 0.70 0.00 0.00 55.95 57.30 2a9n s SER 90 Cb 0.04 0.34 -0.05 0.00 -1.71 0.00 0.00 66.02 64.64 2a9n s SER 90 CO 0.16 -0.17 0.18 -0.22 1.20 0.00 0.00 173.24 174.38 2a9n s LEU 91 N 1.39 4.25 -0.16 3.45 2.96 0.20 -1.64 118.68 129.13 2a9n s LEU 91 Ca -0.08 0.35 0.01 0.00 -0.22 0.00 0.00 54.13 54.19 2a9n s LEU 91 Cb -0.11 -2.17 0.02 0.00 0.50 0.00 0.00 46.19 44.43 2a9n s LEU 91 CO -0.07 0.20 -0.16 -1.81 -1.32 0.00 0.00 176.35 173.18 2a9n s ASP 92 N 0.15 2.85 -0.23 3.68 1.11 -0.23 -1.08 116.67 122.92 2a9n s ASP 92 Ca 0.12 -0.55 -0.03 0.00 0.18 0.00 0.00 52.55 52.27 2a9n s ASP 92 Cb -0.12 -1.29 0.01 0.00 1.07 0.00 0.00 42.92 42.59 2a9n s ASP 92 CO 0.01 -0.04 -0.06 -0.63 1.18 0.00 0.00 175.17 175.63 2a9n s ILE 93 N 1.41 3.05 0.35 0.77 1.01 -1.02 -0.12 121.20 126.65 2a9n s ILE 93 Ca 0.05 -0.79 0.08 0.00 0.00 0.00 0.00 60.65 59.99 2a9n s ILE 93 Cb -0.13 -2.46 -0.03 0.00 0.01 0.00 0.00 42.46 39.85 2a9n s ILE 93 CO -0.12 0.32 0.27 -0.94 0.00 0.00 0.00 174.94 174.47 2a9n s SER 94 N 1.39 5.07 -1.32 3.58 1.04 -0.71 -1.32 113.70 121.44 2a9n s SER 94 Ca 0.03 -0.63 -0.00 0.00 0.48 0.00 0.00 55.95 55.83 2a9n s SER 94 Cb -0.15 -0.82 0.00 0.00 0.10 0.00 0.00 66.02 65.14 2a9n s SER 94 CO -0.05 -0.40 0.68 0.61 0.98 0.00 0.00 173.24 175.06 2a9n n GLY 95 N -1.35 -0.28 3.72 7.32 0.00 -0.79 -4.81 105.19 109.00 2a9n n GLY 95 Ca -0.01 0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2a9n n GLY 95 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2a9n s LEU 96 N -6.71 4.37 0.42 0.99 2.96 -0.87 -4.55 118.68 115.29 2a9n s LEU 96 Ca 0.01 2.69 0.07 0.00 -0.22 0.00 0.00 54.13 56.68 2a9n s LEU 96 Cb -0.01 -3.60 -0.05 0.00 0.50 0.00 0.00 46.19 43.03 2a9n s LEU 96 CO 0.82 -0.85 0.17 -1.10 -1.32 0.00 0.00 176.35 174.06 2a9n s GLN 97 N 0.97 2.20 0.23 1.98 -0.21 -1.26 -0.55 119.66 123.02 2a9n s GLN 97 Ca 0.70 -1.88 0.26 0.00 0.02 0.00 0.00 55.36 54.46 2a9n s GLN 97 Cb -0.45 -1.95 0.70 0.00 1.00 0.00 0.00 33.01 32.31 2a9n s GLN 97 CO 0.33 -0.12 1.71 0.66 -2.12 0.00 0.00 175.29 175.74 2a9n h SER 98 N 1.44 0.00 1.64 5.90 4.64 -1.94 -3.00 113.55 122.22 2a9n h SER 98 Ca -0.43 -0.02 -0.05 0.00 -0.47 0.00 0.00 61.79 60.82 2a9n h SER 98 Cb 1.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.34 2a9n h SER 98 CO 0.71 0.01 -0.25 1.05 -0.87 0.00 0.00 176.83 177.48 2a9n h GLU 99 N 0.00 0.00 0.00 4.77 4.11 -2.00 -3.27 114.58 118.19 2a9n h GLU 99 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2a9n h GLU 99 Cb 0.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.02 2a9n h GLU 99 CO 0.00 0.25 0.00 -0.44 0.07 0.00 0.00 179.01 178.89 2a9n h ASP 100 N 0.00 0.00 -1.78 3.06 3.32 -1.94 -3.43 116.42 115.64 2a9n h ASP 100 Ca -0.00 0.00 -0.67 0.00 0.02 0.00 0.00 57.03 56.38 2a9n h ASP 100 Cb 1.14 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.70 2a9n h ASP 100 CO 0.03 0.00 1.05 1.21 -1.72 0.00 0.00 179.24 179.82 2a9n n GLU 101 N -2.91 1.72 0.00 3.56 2.13 -1.24 -4.86 120.64 119.04 2a9n n GLU 101 Ca 0.01 0.62 0.00 0.00 0.66 0.00 0.00 57.16 58.45 2a9n n GLU 101 Cb 0.27 -2.43 0.00 0.00 0.27 0.00 0.00 31.44 29.54 2a9n n GLU 101 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2a9n n ALA 102 N 6.45 0.00 -2.14 4.31 0.00 -0.96 -4.93 120.51 123.25 2a9n n ALA 102 Ca 0.25 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.32 2a9n n ALA 102 Cb 0.23 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.62 2a9n n ALA 102 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2a9n s ASP 103 N 0.00 7.11 -0.05 0.00 1.01 -1.04 -1.32 116.67 122.38 2a9n s ASP 103 Ca 0.00 1.40 0.04 0.00 0.71 0.00 0.00 52.55 54.70 2a9n s ASP 103 Cb 0.00 -2.41 -0.00 0.00 1.01 0.00 0.00 42.92 41.52 2a9n s ASP 103 CO 0.00 0.14 -0.18 -0.31 0.21 0.00 0.00 175.17 175.03 2a9n s TYR 104 N -1.34 1.81 -0.03 4.23 2.02 -0.63 -1.24 117.35 122.17 2a9n s TYR 104 Ca 0.38 -0.56 0.05 0.00 -0.37 0.00 0.00 57.07 56.57 2a9n s TYR 104 Cb -0.19 -1.23 -0.01 0.00 -0.40 0.00 0.00 41.96 40.14 2a9n s TYR 104 CO 0.22 -0.20 -0.19 0.71 -1.57 0.00 0.00 175.55 174.51 2a9n s TYR 105 N 0.11 1.84 0.33 2.71 2.02 0.22 -2.35 117.35 122.22 2a9n s TYR 105 Ca -0.06 -0.46 0.08 0.00 -0.37 0.00 0.00 57.07 56.26 2a9n s TYR 105 Cb -0.13 -1.21 -0.03 0.00 -0.40 0.00 0.00 41.96 40.19 2a9n s TYR 105 CO 0.03 -0.12 0.24 0.00 -1.57 0.00 0.00 175.55 174.14 2a9n s ALA 107 N -2.32 -1.82 -0.26 0.00 0.00 0.13 0.04 121.76 117.54 2a9n s ALA 107 Ca 0.39 1.02 -0.30 0.00 0.00 0.00 0.00 51.96 53.07 2a9n s ALA 107 Cb -0.05 0.39 0.18 0.00 0.00 0.00 0.00 23.12 23.63 2a9n s ALA 107 CO 0.25 -0.67 1.29 0.00 0.00 0.00 0.00 175.76 176.63 2a9n s ALA 108 N -3.05 -2.09 0.57 0.00 0.00 -0.95 -1.29 121.76 114.94 2a9n s ALA 108 Ca 0.04 1.82 -0.18 0.00 0.00 0.00 0.00 51.96 53.65 2a9n s ALA 108 Cb -0.01 -1.23 -0.05 0.00 0.00 0.00 0.00 23.12 21.83 2a9n s ALA 108 CO -0.09 -0.29 1.09 -0.46 0.00 0.00 0.00 175.76 176.02 2a9n s TRP 109 N -1.17 2.79 -0.15 0.00 -0.11 -1.26 -1.80 118.94 117.23 2a9n s TRP 109 Ca 0.07 1.55 0.02 0.00 1.22 0.00 0.00 56.10 58.96 2a9n s TRP 109 Cb -0.01 -3.16 0.01 0.00 -1.50 0.00 0.00 33.47 28.81 2a9n s TRP 109 CO -0.06 -1.35 -0.21 0.34 -4.62 0.00 0.00 176.95 171.05 2a9n s ASP 110 N -2.18 3.18 0.45 5.86 -1.08 -0.77 -4.29 116.67 117.84 2a9n s ASP 110 Ca 0.69 -0.60 0.25 0.00 -0.52 0.00 0.00 52.55 52.37 2a9n s ASP 110 Cb -0.20 -1.47 0.82 0.00 -1.46 0.00 0.00 42.92 40.61 2a9n s ASP 110 CO 0.30 0.06 1.78 0.44 0.52 0.00 0.00 175.17 178.27 2a9n h ASP 111 N 7.49 0.00 0.00 -0.34 3.32 -1.83 -2.37 116.42 122.68 2a9n h ASP 111 Ca -0.36 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.46 2a9n h ASP 111 Cb 1.18 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.69 2a9n h ASP 111 CO 0.58 0.15 -1.31 -1.20 -1.72 0.00 0.00 179.24 175.74 2a9n n SER 112 N -3.23 1.87 0.22 6.45 7.64 -1.26 -4.26 113.62 121.05 2a9n n SER 112 Ca 0.01 0.44 0.13 0.00 1.01 0.00 0.00 58.87 60.46 2a9n n SER 112 Cb 0.45 -0.93 0.25 0.00 -1.01 0.00 0.00 64.21 62.97 2a9n n SER 112 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2a9n h LEU 134 N -1.00 0.00 -2.01 -3.43 4.07 -1.98 -3.48 115.31 107.48 2a9n h LEU 134 Ca -0.34 0.00 -0.37 0.00 0.08 0.00 0.00 57.88 57.25 2a9n h LEU 134 Cb 1.23 0.00 0.11 0.00 1.08 0.00 0.00 40.66 43.09 2a9n h LEU 134 CO -0.21 0.00 -0.83 -1.20 -1.08 0.00 0.00 178.44 175.12 2a9n n SER 135 N -3.05 -2.77 -3.96 -0.43 7.64 -0.90 -5.03 113.62 105.12 2a9n n SER 135 Ca 0.04 -0.77 -0.09 0.00 1.01 0.00 0.00 58.87 59.06 2a9n n SER 135 Cb 0.50 -4.48 -0.10 0.00 -1.01 0.00 0.00 64.21 59.12 2a9n n SER 135 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2a9n s GLU 136 N -5.54 0.47 -0.14 1.43 2.02 -1.21 -5.00 118.70 110.73 2a9n s GLU 136 Ca 0.13 -0.72 -0.20 0.00 0.02 0.00 0.00 54.97 54.19 2a9n s GLU 136 Cb -0.03 0.18 -0.03 0.00 0.10 0.00 0.00 34.13 34.35 2a9n s GLU 136 CO 0.78 -0.10 0.59 0.12 0.02 0.00 0.00 175.26 176.67 2a9n s PHE 137 N -2.21 3.46 -0.12 1.61 5.36 -1.26 -1.84 117.98 122.98 2a9n s PHE 137 Ca -0.09 0.97 -0.01 0.00 -0.96 0.00 0.00 56.93 56.85 2a9n s PHE 137 Cb -0.04 -2.71 -0.03 0.00 -0.34 0.00 0.00 43.02 39.90 2a9n s PHE 137 CO -0.03 -0.00 -0.07 -0.51 -1.46 0.00 0.00 175.22 173.14 2a9n s LEU 138 N 1.23 3.08 0.15 6.12 1.43 -0.75 -4.98 118.68 124.97 2a9n s LEU 138 Ca 0.29 -0.14 0.04 0.00 -1.03 0.00 0.00 54.13 53.30 2a9n s LEU 138 Cb -0.16 -1.70 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 2a9n s LEU 138 CO 0.12 0.24 0.17 -0.36 0.23 0.00 0.00 176.35 176.76 2a9n s PHE 139 N -0.09 3.26 1.08 0.29 0.40 -1.26 -2.24 117.98 119.42 2a9n s PHE 139 Ca 0.01 0.04 -0.16 0.00 -0.60 0.00 0.00 56.93 56.21 2a9n s PHE 139 Cb -0.13 -1.57 0.23 0.00 0.51 0.00 0.00 43.02 42.06 2a9n s PHE 139 CO 0.03 0.52 1.14 0.20 0.70 0.00 0.00 175.22 177.81 2a9n s GLY 140 N -3.04 1.60 0.31 4.36 0.00 0.11 -3.22 107.32 107.44 2a9n s GLY 140 Ca 0.32 -0.80 0.17 0.00 0.00 0.00 0.00 44.72 44.41 2a9n s GLY 140 CO 0.25 -0.03 1.48 -0.91 0.00 0.00 0.00 173.10 173.88 2a9n h THR 141 N -2.15 0.66 0.00 0.90 1.35 -1.72 -3.46 112.91 108.49 2a9n h THR 141 Ca -0.48 -1.93 0.00 0.00 -0.55 0.00 0.00 66.41 63.45 2a9n h THR 141 Cb 1.30 2.32 0.00 0.00 -1.73 0.00 0.00 68.15 70.04 2a9n h THR 141 CO 0.44 0.38 0.00 0.61 -0.25 0.00 0.00 175.52 176.70 2a9n n GLY 142 N 1.20 2.53 2.92 5.82 0.00 -1.26 -5.00 105.19 111.39 2a9n n GLY 142 Ca 0.02 -1.61 -0.28 0.00 0.00 0.00 0.00 46.02 44.15 2a9n n GLY 142 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2a9n s THR 143 N -1.27 1.22 -0.37 2.61 2.01 -0.99 -4.39 115.64 114.46 2a9n s THR 143 Ca 0.00 -0.63 -0.29 0.00 0.31 0.00 0.00 61.69 61.09 2a9n s THR 143 Cb 0.00 -1.32 0.02 0.00 0.01 0.00 0.00 72.50 71.20 2a9n s THR 143 CO 0.00 0.21 1.17 -0.75 -0.69 0.00 0.00 174.62 174.56 2a9n s LYS 144 N 1.60 3.90 -0.20 4.92 2.20 -1.05 -1.61 119.74 129.49 2a9n s LYS 144 Ca 0.02 0.96 -0.17 0.00 -0.36 0.00 0.00 55.97 56.41 2a9n s LYS 144 Cb -0.15 -3.84 -0.03 0.00 -1.51 0.00 0.00 37.83 32.30 2a9n s LYS 144 CO -0.08 -1.14 0.47 -1.17 -0.36 0.00 0.00 175.35 173.07 2a9n s LEU 145 N 4.19 4.15 -0.11 5.43 2.96 -0.44 -2.59 118.68 132.27 2a9n s LEU 145 Ca 0.50 0.61 0.02 0.00 -0.22 0.00 0.00 54.13 55.04 2a9n s LEU 145 Cb -0.12 -2.63 0.01 0.00 0.50 0.00 0.00 46.19 43.95 2a9n s LEU 145 CO 0.23 -0.14 -0.16 0.42 -1.32 0.00 0.00 176.35 175.38 2a9n s THR 146 N 1.51 1.58 -0.41 3.68 -4.23 -0.89 -2.25 115.64 114.63 2a9n s THR 146 Ca 0.22 -0.69 -0.15 0.00 -1.18 0.00 0.00 61.69 59.89 2a9n s THR 146 Cb -0.15 -1.44 0.02 0.00 1.34 0.00 0.00 72.50 72.27 2a9n s THR 146 CO 0.09 0.46 0.31 -0.69 -0.54 0.00 0.00 174.62 174.25 2a9n s VAL 147 N 0.98 5.25 -2.00 2.29 1.01 -1.26 -3.18 120.40 123.49 2a9n s VAL 147 Ca -0.06 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.26 2a9n s VAL 147 Cb -0.15 -3.94 0.10 0.00 0.00 0.00 0.00 36.38 32.38 2a9n s VAL 147 CO -0.02 -0.33 0.68 0.18 0.00 0.00 0.00 175.10 175.61