#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1blr n ASN 2 N 0.00 0.00 0.00 3.54 4.13 -1.26 -4.49 115.26 117.18 1blr n ASN 2 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 1blr n ASN 2 Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 1blr n ASN 2 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1blr n PHE 3 N 10.24 0.00 -1.65 3.10 3.01 -1.26 -4.96 117.46 125.94 1blr n PHE 3 Ca 0.00 0.00 -0.55 0.00 1.01 0.00 0.00 57.45 57.91 1blr n PHE 3 Cb 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.40 1blr n PHE 3 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1blr n SER 4 N 2.65 2.49 0.00 4.37 3.41 -1.26 -4.73 113.62 120.55 1blr n SER 4 Ca 0.00 0.93 0.00 0.00 -0.26 0.00 0.00 58.87 59.54 1blr n SER 4 Cb 0.00 -1.19 0.00 0.00 -0.26 0.00 0.00 64.21 62.76 1blr n SER 4 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1blr n GLY 5 N 4.77 4.32 3.81 5.00 0.00 -0.99 -4.98 105.19 117.12 1blr n GLY 5 Ca 0.29 -1.17 -0.33 0.00 0.00 0.00 0.00 46.02 44.81 1blr n GLY 5 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1blr s ASN 6 N 0.00 6.32 -0.04 1.61 3.84 -1.26 -1.89 114.94 123.52 1blr s ASN 6 Ca 0.00 1.81 0.03 0.00 0.21 0.00 0.00 52.86 54.91 1blr s ASN 6 Cb 0.00 -2.54 -0.00 0.00 -0.55 0.00 0.00 41.25 38.16 1blr s ASN 6 CO 0.00 -0.80 -0.13 0.26 -2.79 0.00 0.00 177.10 173.64 1blr s TRP 7 N -2.24 1.37 -0.06 0.43 0.52 -1.05 -2.30 118.94 115.62 1blr s TRP 7 Ca 0.64 -0.38 -0.07 0.00 0.02 0.00 0.00 56.10 56.31 1blr s TRP 7 Cb -0.14 -0.94 -0.04 0.00 -1.15 0.00 0.00 33.47 31.19 1blr s TRP 7 CO 0.25 -0.14 0.22 0.15 0.02 0.00 0.00 176.95 177.45 1blr s LYS 8 N 0.12 3.54 0.59 4.98 -0.14 -0.72 -3.01 119.74 125.10 1blr s LYS 8 Ca -0.04 -0.06 -0.19 0.00 -1.36 0.00 0.00 55.97 54.32 1blr s LYS 8 Cb -0.10 -3.15 -0.04 0.00 -1.68 0.00 0.00 37.83 32.86 1blr s LYS 8 CO 0.01 0.72 1.25 -1.50 -0.76 0.00 0.00 175.35 175.08 1blr s ILE 9 N -1.14 2.43 -0.30 2.17 -1.16 -1.26 -2.55 121.20 119.38 1blr s ILE 9 Ca 0.21 0.28 -0.06 0.00 -0.51 0.00 0.00 60.65 60.56 1blr s ILE 9 Cb -0.13 -3.12 0.16 0.00 0.61 0.00 0.00 42.46 39.97 1blr s ILE 9 CO 0.10 -0.04 0.63 -0.63 -2.81 0.00 0.00 174.94 172.19 1blr s ILE 10 N -1.49 -1.00 -0.38 2.00 1.09 0.54 -4.85 121.20 117.12 1blr s ILE 10 Ca 0.77 0.00 -0.10 0.00 -1.10 0.00 0.00 60.65 60.22 1blr s ILE 10 Cb -0.34 -1.00 0.01 0.00 -1.06 0.00 0.00 42.46 40.07 1blr s ILE 10 CO 0.37 0.00 0.47 0.54 -0.10 0.00 0.00 174.94 176.22 1blr n ARG 11 N 5.44 -1.64 -5.25 2.79 3.00 -1.26 -0.86 116.66 118.88 1blr n ARG 11 Ca -0.07 1.63 -0.31 0.00 -0.01 0.00 0.00 57.85 59.09 1blr n ARG 11 Cb 0.50 -4.70 -0.16 0.00 0.00 0.00 0.00 32.46 28.11 1blr n ARG 11 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1blr s SER 12 N -2.34 3.19 -0.30 0.55 0.15 -1.26 -2.41 113.70 111.28 1blr s SER 12 Ca 0.15 -0.43 -0.17 0.00 0.70 0.00 0.00 55.95 56.20 1blr s SER 12 Cb -0.04 -0.41 0.17 0.00 -1.71 0.00 0.00 66.02 64.03 1blr s SER 12 CO 0.58 0.32 1.20 -0.70 1.20 0.00 0.00 173.24 175.85 1blr s GLU 13 N -0.63 0.05 0.00 5.44 2.12 -1.24 -5.04 118.70 119.40 1blr s GLU 13 Ca 0.10 0.09 0.00 0.00 0.36 0.00 0.00 54.97 55.52 1blr s GLU 13 Cb -0.10 0.05 0.00 0.00 0.26 0.00 0.00 34.13 34.34 1blr s GLU 13 CO -0.01 -0.06 0.00 0.09 -0.54 0.00 0.00 175.26 174.74 1blr n ASN 14 N 5.45 0.00 -0.32 -1.70 3.02 -1.26 -4.66 115.26 115.80 1blr n ASN 14 Ca -0.07 0.00 0.04 0.00 -0.03 0.00 0.00 54.58 54.52 1blr n ASN 14 Cb 0.55 0.00 0.12 0.00 -0.61 0.00 0.00 39.78 39.84 1blr n ASN 14 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1blr h PHE 15 N 0.00 -0.45 -0.43 3.10 3.57 -1.95 0.42 116.94 121.19 1blr h PHE 15 Ca 0.00 0.08 -0.13 0.00 3.53 0.00 0.00 57.97 61.45 1blr h PHE 15 Cb 0.00 0.34 -0.01 0.00 2.79 0.00 0.00 35.95 39.07 1blr h PHE 15 CO 0.00 -0.38 -0.23 0.93 -2.23 0.00 0.00 178.31 176.40 1blr h GLU 16 N 0.00 0.88 -0.03 1.11 5.08 -1.90 -1.57 114.58 118.15 1blr h GLU 16 Ca 0.43 -0.37 0.01 0.00 -1.00 0.00 0.00 59.36 58.43 1blr h GLU 16 Cb 0.67 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.89 1blr h GLU 16 CO -0.91 1.02 0.07 1.49 -1.00 0.00 0.00 179.01 179.68 1blr h GLU 17 N 0.76 0.00 0.09 2.33 4.81 -0.63 0.13 114.58 122.07 1blr h GLU 17 Ca 0.10 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.13 1blr h GLU 17 Cb 0.78 0.00 0.02 0.00 0.63 0.00 0.00 28.75 30.18 1blr h GLU 17 CO 0.06 0.00 -0.82 -0.07 -0.73 0.00 0.00 179.01 177.45 1blr h LEU 18 N 0.00 0.57 -0.71 1.64 3.38 -0.10 -1.99 115.31 118.10 1blr h LEU 18 Ca 0.01 -0.86 0.00 0.00 0.09 0.00 0.00 57.88 57.13 1blr h LEU 18 Cb 0.16 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1blr h LEU 18 CO -0.00 1.37 0.00 0.18 0.09 0.00 0.00 178.44 180.08 1blr n LEU 19 N -4.09 1.05 -0.04 1.67 7.99 -0.56 -1.90 117.00 121.11 1blr n LEU 19 Ca -0.13 -0.46 -0.01 0.00 -0.01 0.00 0.00 56.01 55.40 1blr n LEU 19 Cb 0.80 -0.08 -0.11 0.00 -0.11 0.00 0.00 43.42 43.92 1blr n LEU 19 CO 0.50 0.23 -0.84 0.29 -1.51 0.00 0.00 177.39 176.06 1blr n LYS 20 N -0.05 1.30 -0.09 3.23 5.02 -0.07 -3.58 118.16 123.92 1blr n LYS 20 Ca 0.13 -0.05 -0.10 0.00 -2.02 0.00 0.00 58.31 56.27 1blr n LYS 20 Cb 0.21 -1.34 -0.15 0.00 -0.02 0.00 0.00 35.03 33.73 1blr n LYS 20 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1blr n VAL 21 N -2.31 1.44 0.27 -0.18 0.24 -0.75 -3.83 118.33 113.20 1blr n VAL 21 Ca -0.15 -0.84 0.17 0.00 -2.04 0.00 0.00 64.34 61.49 1blr n VAL 21 Cb 0.72 -0.62 0.89 0.00 -1.47 0.00 0.00 33.84 33.36 1blr n VAL 21 CO 0.00 0.00 0.00 0.17 -2.14 0.00 0.00 176.83 174.86 1blr h LEU 22 N 0.00 0.00 0.00 1.34 -0.00 -1.58 -3.45 115.31 111.62 1blr h LEU 22 Ca -0.50 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.38 1blr h LEU 22 Cb 2.19 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.85 1blr h LEU 22 CO 0.04 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.09 1blr n GLY 23 N -1.02 0.72 3.46 0.17 0.00 -1.26 -5.09 105.19 102.17 1blr n GLY 23 Ca -0.02 -0.64 -0.41 0.00 0.00 0.00 0.00 46.02 44.96 1blr n GLY 23 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1blr n VAL 24 N 0.00 1.84 0.00 1.61 3.14 -1.24 -4.93 118.33 118.76 1blr n VAL 24 Ca 0.00 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.88 1blr n VAL 24 Cb 0.00 -0.59 0.00 0.00 -1.06 0.00 0.00 33.84 32.19 1blr n VAL 24 CO 0.00 0.00 0.00 -0.46 -6.46 0.00 0.00 176.83 169.91 1blr n ASN 25 N 1.12 0.00 0.00 6.55 6.94 -1.26 -4.89 115.26 123.72 1blr n ASN 25 Ca 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.67 1blr n ASN 25 Cb 0.42 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.84 1blr n ASN 25 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 1blr n VAL 26 N 0.00 0.00 0.34 3.53 0.31 -1.26 -4.87 118.33 116.38 1blr n VAL 26 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.17 1blr n VAL 26 Cb 0.00 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 32.85 1blr n VAL 26 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 1blr h MET 27 N 2.38 -0.84 -5.83 5.55 2.86 -1.90 -3.46 114.93 113.70 1blr h MET 27 Ca 0.00 0.06 -0.34 0.00 -2.06 0.00 0.00 59.70 57.36 1blr h MET 27 Cb 0.00 0.19 0.14 0.00 0.06 0.00 0.00 31.60 31.99 1blr h MET 27 CO 0.00 -0.52 -0.89 1.28 1.06 0.00 0.00 176.91 177.84 1blr n LEU 28 N -5.41 -4.24 -1.79 1.22 7.99 -1.26 -0.21 117.00 113.30 1blr n LEU 28 Ca -0.13 -0.84 -0.19 0.00 -0.01 0.00 0.00 56.01 54.84 1blr n LEU 28 Cb 0.37 -2.83 -0.06 0.00 -0.11 0.00 0.00 43.42 40.79 1blr n LEU 28 CO 0.34 0.29 -0.20 0.54 -1.51 0.00 0.00 177.39 176.85 1blr n ARG 29 N -3.74 -1.52 -3.51 3.23 1.74 -1.26 -3.37 116.66 108.22 1blr n ARG 29 Ca -0.11 1.08 -0.36 0.00 -0.77 0.00 0.00 57.85 57.69 1blr n ARG 29 Cb 0.61 -5.52 0.03 0.00 -1.02 0.00 0.00 32.46 26.57 1blr n ARG 29 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1blr n LYS 30 N -2.46 -1.81 0.22 5.56 5.02 0.71 -4.58 118.16 120.81 1blr n LYS 30 Ca -0.20 1.26 0.09 0.00 -2.02 0.00 0.00 58.31 57.44 1blr n LYS 30 Cb 0.64 -1.98 0.28 0.00 -0.02 0.00 0.00 35.03 33.96 1blr n LYS 30 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1blr h ILE 31 N 1.60 0.02 -0.11 -0.18 5.03 -1.60 0.10 117.51 122.37 1blr h ILE 31 Ca -0.58 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.16 1blr h ILE 31 Cb 1.38 0.17 0.00 0.00 -3.03 0.00 0.00 36.82 35.34 1blr h ILE 31 CO 0.25 0.00 0.00 0.00 -0.68 0.00 0.00 178.15 177.72 1blr n ALA 32 N -1.76 2.69 -2.10 1.87 0.00 -1.26 -3.70 120.51 116.24 1blr n ALA 32 Ca 0.04 -0.32 -0.02 0.00 0.00 0.00 0.00 53.44 53.14 1blr n ALA 32 Cb 0.96 -1.02 -0.03 0.00 0.00 0.00 0.00 19.45 19.36 1blr n ALA 32 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1blr n VAL 33 N 0.06 0.00 -3.75 0.00 0.31 0.02 -5.04 118.33 109.93 1blr n VAL 33 Ca 0.05 -0.20 -0.35 0.00 -0.01 0.00 0.00 64.34 63.82 1blr n VAL 33 Cb 0.35 0.48 -0.10 0.00 -0.91 0.00 0.00 33.84 33.65 1blr n VAL 33 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1blr s ALA 34 N 0.00 3.55 0.08 3.52 0.00 -1.24 -4.88 121.76 122.78 1blr s ALA 34 Ca 0.07 -3.27 -0.13 0.00 0.00 0.00 0.00 51.96 48.63 1blr s ALA 34 Cb 0.08 -2.59 0.04 0.00 0.00 0.00 0.00 23.12 20.65 1blr s ALA 34 CO -0.03 -2.09 0.60 0.00 0.00 0.00 0.00 175.76 174.24 1blr n ALA 35 N 3.42 -1.60 -2.24 0.00 0.00 -1.26 -5.06 120.51 113.76 1blr n ALA 35 Ca 0.08 -0.55 -0.32 0.00 0.00 0.00 0.00 53.44 52.64 1blr n ALA 35 Cb 0.37 0.28 -0.04 0.00 0.00 0.00 0.00 19.45 20.05 1blr n ALA 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1blr s ALA 36 N -1.58 2.12 0.49 0.00 0.00 -1.26 -4.95 121.76 116.58 1blr s ALA 36 Ca 0.14 -1.93 0.06 0.00 0.00 0.00 0.00 51.96 50.23 1blr s ALA 36 Cb -0.01 -4.57 0.03 0.00 0.00 0.00 0.00 23.12 18.57 1blr s ALA 36 CO 0.02 -4.40 0.68 -1.12 0.00 0.00 0.00 175.76 170.94 1blr s SER 37 N 6.63 5.42 -0.43 0.00 0.01 -1.26 -5.10 113.70 118.97 1blr s SER 37 Ca 0.61 -0.36 0.05 0.00 1.31 0.00 0.00 55.95 57.57 1blr s SER 37 Cb -0.03 -0.57 0.17 0.00 0.21 0.00 0.00 66.02 65.80 1blr s SER 37 CO -0.01 -0.99 0.53 -0.54 0.41 0.00 0.00 173.24 172.63 1blr s LYS 38 N -4.54 0.84 0.35 12.44 1.02 -1.26 -5.13 119.74 123.47 1blr s LYS 38 Ca 0.57 -0.98 -0.06 0.00 0.02 0.00 0.00 55.97 55.52 1blr s LYS 38 Cb -0.09 -0.46 0.08 0.00 -0.52 0.00 0.00 37.83 36.84 1blr s LYS 38 CO 0.36 -1.26 0.44 -0.35 -0.92 0.00 0.00 175.35 173.61 1blr n PRO 39 N 3.70 -0.71 -3.82 -1.68 -0.04 -1.26 -4.93 135.00 126.26 1blr n PRO 39 Ca 0.16 -0.68 -0.05 0.00 -0.04 0.00 0.00 63.50 62.90 1blr n PRO 39 Cb 0.51 -0.48 0.00 0.00 -0.04 0.00 0.00 33.50 33.49 1blr n PRO 39 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1blr s ALA 40 N -3.78 -1.41 0.36 0.55 0.00 -1.02 -4.23 121.76 112.21 1blr s ALA 40 Ca 0.25 -0.24 -0.14 0.00 0.00 0.00 0.00 51.96 51.83 1blr s ALA 40 Cb -0.01 0.71 0.04 0.00 0.00 0.00 0.00 23.12 23.86 1blr s ALA 40 CO 0.18 -1.04 0.70 0.54 0.00 0.00 0.00 175.76 176.14 1blr s VAL 41 N -2.80 0.00 -0.21 0.00 0.11 -1.16 -2.20 120.40 114.13 1blr s VAL 41 Ca 0.16 -1.14 -0.09 0.00 -2.93 0.00 0.00 61.98 57.97 1blr s VAL 41 Cb -0.03 -2.68 0.08 0.00 -1.53 0.00 0.00 36.38 32.22 1blr s VAL 41 CO 0.06 0.00 0.48 -0.70 -3.33 0.00 0.00 175.10 171.61 1blr s GLU 42 N -2.76 0.43 0.08 1.54 2.56 -0.87 -2.52 118.70 117.15 1blr s GLU 42 Ca 0.18 1.02 0.05 0.00 0.00 0.00 0.00 54.97 56.22 1blr s GLU 42 Cb -0.04 0.23 -0.04 0.00 2.00 0.00 0.00 34.13 36.28 1blr s GLU 42 CO 0.12 -0.20 -0.06 0.42 -0.56 0.00 0.00 175.26 174.99 1blr s ILE 43 N 2.03 3.66 -0.19 -3.70 -1.09 -0.79 -0.58 121.20 120.55 1blr s ILE 43 Ca -0.06 -1.06 -0.04 0.00 -2.23 0.00 0.00 60.65 57.26 1blr s ILE 43 Cb -0.10 -2.70 0.09 0.00 -1.58 0.00 0.00 42.46 38.18 1blr s ILE 43 CO -0.15 0.18 0.31 -0.54 -1.23 0.00 0.00 174.94 173.51 1blr s LYS 44 N -2.06 0.24 0.03 2.79 1.02 -0.91 -2.35 119.74 118.50 1blr s LYS 44 Ca 0.22 0.61 -0.09 0.00 0.02 0.00 0.00 55.97 56.73 1blr s LYS 44 Cb -0.11 -0.37 0.00 0.00 -0.52 0.00 0.00 37.83 36.83 1blr s LYS 44 CO 0.14 -0.46 0.18 1.14 -0.92 0.00 0.00 175.35 175.42 1blr s GLN 45 N 2.46 0.62 -0.44 1.68 1.03 -1.26 0.15 119.66 123.90 1blr s GLN 45 Ca 0.05 -0.55 0.02 0.00 0.04 0.00 0.00 55.36 54.92 1blr s GLN 45 Cb -0.14 0.26 0.14 0.00 0.03 0.00 0.00 33.01 33.30 1blr s GLN 45 CO -0.12 -0.17 0.27 -2.00 -2.54 0.00 0.00 175.29 170.73 1blr s GLU 46 N -2.15 1.18 5.68 9.60 2.12 -0.57 -4.88 118.70 129.68 1blr s GLU 46 Ca -0.08 -1.99 0.00 0.00 0.36 0.00 0.00 54.97 53.25 1blr s GLU 46 Cb -0.03 -2.09 0.00 0.00 0.26 0.00 0.00 34.13 32.27 1blr s GLU 46 CO -0.02 -1.21 0.00 0.41 -0.54 0.00 0.00 175.26 173.90 1blr n GLY 47 N 3.42 0.31 0.00 -1.50 0.00 -1.26 -3.11 105.19 103.05 1blr n GLY 47 Ca 0.13 -0.74 0.14 0.00 0.00 0.00 0.00 46.02 45.55 1blr n GLY 47 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1blr n ASP 48 N 6.48 0.00 -4.80 1.61 5.68 -1.26 -4.74 116.55 119.53 1blr n ASP 48 Ca 0.00 -0.63 -0.38 0.00 -0.50 0.00 0.00 54.79 53.28 1blr n ASP 48 Cb 0.00 -0.09 -0.06 0.00 -1.14 0.00 0.00 41.12 39.83 1blr n ASP 48 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1blr s THR 49 N -2.19 5.02 0.08 2.12 2.01 -1.18 -1.64 115.64 119.87 1blr s THR 49 Ca 0.37 0.93 -0.01 0.00 0.31 0.00 0.00 61.69 63.29 1blr s THR 49 Cb 0.19 -3.77 -0.04 0.00 0.01 0.00 0.00 72.50 68.89 1blr s THR 49 CO 0.35 0.50 -0.02 -0.36 -0.69 0.00 0.00 174.62 174.41 1blr s PHE 50 N -0.60 0.66 0.02 4.92 0.40 -0.77 -1.51 117.98 121.10 1blr s PHE 50 Ca 0.25 -1.08 0.01 0.00 -0.60 0.00 0.00 56.93 55.51 1blr s PHE 50 Cb -0.17 -0.43 -0.01 0.00 0.51 0.00 0.00 43.02 42.92 1blr s PHE 50 CO 0.13 -0.38 -0.04 -0.47 0.70 0.00 0.00 175.22 175.16 1blr s TYR 51 N -3.90 0.38 0.01 0.36 6.14 0.12 -2.08 117.35 118.37 1blr s TYR 51 Ca 0.12 -0.29 0.01 0.00 0.64 0.00 0.00 57.07 57.55 1blr s TYR 51 Cb 0.08 -0.24 -0.01 0.00 0.42 0.00 0.00 41.96 42.21 1blr s TYR 51 CO -0.06 -0.07 -0.05 0.42 0.64 0.00 0.00 175.55 176.43 1blr s ILE 52 N -0.77 0.34 -0.44 3.14 1.01 -1.00 -2.13 121.20 121.35 1blr s ILE 52 Ca -0.06 -0.46 0.05 0.00 0.00 0.00 0.00 60.65 60.17 1blr s ILE 52 Cb -0.06 -0.35 0.19 0.00 0.01 0.00 0.00 42.46 42.25 1blr s ILE 52 CO -0.00 -0.09 0.39 1.17 0.00 0.00 0.00 174.94 176.41 1blr n LYS 53 N 2.47 0.45 -2.80 2.79 4.81 0.26 -2.14 118.16 124.00 1blr n LYS 53 Ca -0.16 -3.31 -0.39 0.00 -0.87 0.00 0.00 58.31 53.58 1blr n LYS 53 Cb 0.57 -1.65 -0.06 0.00 0.02 0.00 0.00 35.03 33.91 1blr n LYS 53 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1blr s THR 54 N -0.33 4.17 0.00 3.15 2.01 -1.15 -2.06 115.64 121.43 1blr s THR 54 Ca 0.33 1.93 0.00 0.00 0.31 0.00 0.00 61.69 64.25 1blr s THR 54 Cb 0.06 -4.18 0.00 0.00 0.01 0.00 0.00 72.50 68.39 1blr s THR 54 CO -0.18 0.36 0.00 -1.54 -0.69 0.00 0.00 174.62 172.57 1blr n SER 55 N 1.14 0.00 0.00 3.53 3.41 -0.94 -3.43 113.62 117.33 1blr n SER 55 Ca -0.01 -0.78 0.00 0.00 -0.26 0.00 0.00 58.87 57.82 1blr n SER 55 Cb 0.48 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 1blr n SER 55 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1blr n THR 56 N 0.00 0.00 0.00 6.66 -1.04 -1.26 -2.45 114.28 116.19 1blr n THR 56 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1blr n THR 56 Cb 0.00 -0.62 0.00 0.00 -1.82 0.00 0.00 70.33 67.89 1blr n THR 56 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1blr n THR 57 N -2.37 0.00 -3.07 12.58 -1.04 -1.26 -4.54 114.28 114.57 1blr n THR 57 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1blr n THR 57 Cb 0.27 -0.03 0.00 0.00 -1.82 0.00 0.00 70.33 68.75 1blr n THR 57 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1blr n VAL 58 N -1.99 0.00 -0.75 12.58 0.24 -1.26 -5.08 118.33 122.07 1blr n VAL 58 Ca 0.00 0.00 -0.32 0.00 -2.04 0.00 0.00 64.34 61.98 1blr n VAL 58 Cb 0.00 -0.78 0.14 0.00 -1.47 0.00 0.00 33.84 31.73 1blr n VAL 58 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1blr n ARG 59 N -0.67 -0.35 0.00 7.34 1.74 -1.26 -4.90 116.66 118.55 1blr n ARG 59 Ca 0.00 -0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.03 1blr n ARG 59 Cb 0.00 -2.11 0.00 0.00 -1.02 0.00 0.00 32.46 29.33 1blr n ARG 59 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1blr n THR 60 N -3.87 0.00 -3.57 0.55 -1.04 -1.26 -4.85 114.28 100.24 1blr n THR 60 Ca 0.09 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.97 1blr n THR 60 Cb 0.53 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.98 1blr n THR 60 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1blr s THR 61 N 0.04 0.00 -0.03 12.58 2.01 -1.22 -5.09 115.64 123.93 1blr s THR 61 Ca 0.00 0.00 -0.01 0.00 0.31 0.00 0.00 61.69 61.99 1blr s THR 61 Cb 0.00 -1.00 0.02 0.00 0.01 0.00 0.00 72.50 71.53 1blr s THR 61 CO 0.00 0.00 0.07 -1.61 -0.69 0.00 0.00 174.62 172.39 1blr s GLU 62 N -0.83 0.02 -0.50 4.92 8.01 -1.26 -2.94 118.70 126.13 1blr s GLU 62 Ca -0.05 0.20 -0.16 0.00 0.01 0.00 0.00 54.97 54.98 1blr s GLU 62 Cb -0.01 -0.15 0.09 0.00 -4.31 0.00 0.00 34.13 29.74 1blr s GLU 62 CO 0.04 -0.12 0.45 0.96 0.01 0.00 0.00 175.26 176.60 1blr s ILE 63 N 0.79 5.18 -1.06 -1.63 -4.36 -0.91 -4.88 121.20 114.33 1blr s ILE 63 Ca -0.06 -1.11 -0.13 0.00 -0.26 0.00 0.00 60.65 59.08 1blr s ILE 63 Cb -0.09 -4.20 0.21 0.00 1.25 0.00 0.00 42.46 39.63 1blr s ILE 63 CO -0.03 -0.69 1.16 0.20 0.24 0.00 0.00 174.94 175.82 1blr s ASN 64 N 2.88 7.03 0.00 4.36 0.02 -1.26 -2.38 114.94 125.59 1blr s ASN 64 Ca 0.05 -2.99 0.00 0.00 -1.02 0.00 0.00 52.86 48.90 1blr s ASN 64 Cb -0.25 -2.30 0.00 0.00 0.02 0.00 0.00 41.25 38.72 1blr s ASN 64 CO 0.06 -0.61 0.00 2.22 0.02 0.00 0.00 177.10 178.79 1blr n PHE 65 N 4.49 0.00 -3.82 2.20 -1.74 -0.88 -5.01 117.46 112.70 1blr n PHE 65 Ca 0.26 0.00 -0.19 0.00 -0.56 0.00 0.00 57.45 56.96 1blr n PHE 65 Cb 0.43 0.00 -0.17 0.00 1.52 0.00 0.00 39.48 41.26 1blr n PHE 65 CO 0.00 0.00 0.00 0.15 -0.56 0.00 0.00 176.76 176.35 1blr s LYS 66 N -0.46 0.26 0.61 3.97 1.02 -1.26 -1.84 119.74 122.03 1blr s LYS 66 Ca 0.00 0.17 0.26 0.00 0.02 0.00 0.00 55.97 56.41 1blr s LYS 66 Cb 0.00 -0.59 0.97 0.00 -0.52 0.00 0.00 37.83 37.68 1blr s LYS 66 CO 0.00 -0.23 1.38 0.28 -0.92 0.00 0.00 175.35 175.87 1blr h VAL 67 N 6.31 0.05 -0.37 3.17 2.07 -1.60 0.12 116.25 126.00 1blr h VAL 67 Ca -0.29 0.00 -0.25 0.00 0.82 0.00 0.00 66.70 66.98 1blr h VAL 67 Cb 1.13 0.10 -0.11 0.00 -1.52 0.00 0.00 31.29 30.89 1blr h VAL 67 CO 0.34 0.00 0.32 0.61 0.02 0.00 0.00 177.57 178.86 1blr n GLY 68 N -1.67 3.74 3.68 2.17 0.00 -1.26 -4.28 105.19 107.56 1blr n GLY 68 Ca 0.20 -0.86 -0.09 0.00 0.00 0.00 0.00 46.02 45.26 1blr n GLY 68 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1blr s GLU 69 N -1.39 1.58 0.41 1.61 2.02 0.43 -5.11 118.70 118.25 1blr s GLU 69 Ca 0.25 -0.80 0.07 0.00 0.02 0.00 0.00 54.97 54.51 1blr s GLU 69 Cb 0.19 0.59 -0.04 0.00 0.10 0.00 0.00 34.13 34.97 1blr s GLU 69 CO -0.01 -0.71 0.24 -1.83 0.02 0.00 0.00 175.26 172.98 1blr s GLU 70 N -3.86 2.33 0.33 1.61 1.03 -1.26 -3.26 118.70 115.63 1blr s GLU 70 Ca 0.08 -1.73 0.01 0.00 0.03 0.00 0.00 54.97 53.36 1blr s GLU 70 Cb -0.04 -2.12 -0.00 0.00 -0.80 0.00 0.00 34.13 31.17 1blr s GLU 70 CO -0.01 -0.13 0.02 1.19 -1.33 0.00 0.00 175.26 175.01 1blr n PHE 71 N -1.33 0.66 -4.05 4.83 3.72 -0.82 -4.94 117.46 115.52 1blr n PHE 71 Ca 0.00 -1.72 -0.10 0.00 -0.05 0.00 0.00 57.45 55.58 1blr n PHE 71 Cb 0.63 -0.18 -0.11 0.00 -0.94 0.00 0.00 39.48 38.88 1blr n PHE 71 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1blr s GLU 72 N -3.21 0.51 0.06 -1.08 2.02 -1.26 -2.25 118.70 113.48 1blr s GLU 72 Ca 0.03 -0.87 -0.21 0.00 0.02 0.00 0.00 54.97 53.93 1blr s GLU 72 Cb 0.00 -0.04 0.07 0.00 0.10 0.00 0.00 34.13 34.27 1blr s GLU 72 CO 0.02 -0.03 0.99 0.39 0.02 0.00 0.00 175.26 176.65 1blr n GLU 73 N 1.05 0.32 -4.39 1.61 1.02 -0.42 -4.92 120.64 114.90 1blr n GLU 73 Ca -0.20 -0.91 -0.30 0.00 -0.02 0.00 0.00 57.16 55.72 1blr n GLU 73 Cb 0.57 1.35 -0.11 0.00 -0.02 0.00 0.00 31.44 33.23 1blr n GLU 73 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1blr s GLN 74 N -2.03 2.10 0.00 3.49 -0.21 -1.25 -1.81 119.66 119.94 1blr s GLN 74 Ca 0.23 -1.00 0.00 0.00 0.02 0.00 0.00 55.36 54.60 1blr s GLN 74 Cb -0.01 -2.26 0.00 0.00 1.00 0.00 0.00 33.01 31.74 1blr s GLN 74 CO 0.02 0.52 0.02 2.41 -2.12 0.00 0.00 175.29 176.14 1blr n THR 75 N 1.07 0.00 0.06 -0.19 -1.04 -1.18 -4.76 114.28 108.24 1blr n THR 75 Ca -0.15 0.25 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 1blr n THR 75 Cb 0.52 -0.71 0.00 0.00 -1.82 0.00 0.00 70.33 68.32 1blr n THR 75 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1blr n VAL 76 N -0.05 0.00 -2.17 12.58 0.31 -1.26 -5.01 118.33 122.74 1blr n VAL 76 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.31 1blr n VAL 76 Cb 0.00 -0.08 -0.03 0.00 -0.91 0.00 0.00 33.84 32.81 1blr n VAL 76 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1blr n ASP 77 N -2.81 -0.20 0.00 4.52 5.75 -1.26 -5.03 116.55 117.52 1blr n ASP 77 Ca 0.00 -1.92 0.00 0.00 -0.01 0.00 0.00 54.79 52.86 1blr n ASP 77 Cb 0.00 0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.14 1blr n ASP 77 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1blr n GLY 78 N 0.17 0.43 3.59 6.12 0.00 -1.26 -5.14 105.19 109.11 1blr n GLY 78 Ca -0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.62 1blr n GLY 78 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1blr s ARG 79 N 0.00 1.92 0.28 1.61 3.00 -1.26 -5.06 118.95 119.44 1blr s ARG 79 Ca 0.00 -2.00 -0.05 0.00 0.00 0.00 0.00 55.73 53.68 1blr s ARG 79 Cb 0.00 -1.70 0.07 0.00 0.00 0.00 0.00 34.95 33.31 1blr s ARG 79 CO 0.00 0.04 0.32 -0.35 0.00 0.00 0.00 175.30 175.31 1blr n PRO 80 N -0.91 -0.85 -3.65 3.54 -0.04 -1.26 -3.09 135.00 128.74 1blr n PRO 80 Ca -0.05 -0.50 -0.03 0.00 -0.04 0.00 0.00 63.50 62.89 1blr n PRO 80 Cb 0.65 -0.38 -0.07 0.00 -0.04 0.00 0.00 33.50 33.66 1blr n PRO 80 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1blr n LYS 82 N 2.17 1.42 -4.19 0.00 2.85 -0.22 -1.31 118.16 118.88 1blr n LYS 82 Ca -0.13 -1.02 -0.17 0.00 -1.05 0.00 0.00 58.31 55.94 1blr n LYS 82 Cb 0.57 0.18 -0.06 0.00 -0.65 0.00 0.00 35.03 35.06 1blr n LYS 82 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 1blr s SER 83 N -1.88 1.31 -0.30 -5.58 1.04 -0.95 -1.51 113.70 105.83 1blr s SER 83 Ca 0.05 -1.63 -0.15 0.00 0.48 0.00 0.00 55.95 54.71 1blr s SER 83 Cb -0.00 0.61 0.16 0.00 0.10 0.00 0.00 66.02 66.88 1blr s SER 83 CO 0.03 -1.17 0.96 -0.22 0.98 0.00 0.00 173.24 173.82 1blr s LEU 84 N -3.31 -0.63 0.11 2.42 0.20 -1.12 -1.95 118.68 114.40 1blr s LEU 84 Ca 0.36 0.87 -0.12 0.00 0.69 0.00 0.00 54.13 55.92 1blr s LEU 84 Cb 0.01 1.72 -0.06 0.00 -0.43 0.00 0.00 46.19 47.43 1blr s LEU 84 CO 0.24 -0.12 0.48 -0.69 -0.29 0.00 0.00 176.35 175.97 1blr s VAL 85 N 2.44 4.97 0.00 1.68 1.01 -1.20 -1.82 120.40 127.48 1blr s VAL 85 Ca -0.03 0.67 0.00 0.00 0.00 0.00 0.00 61.98 62.61 1blr s VAL 85 Cb -0.06 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.62 1blr s VAL 85 CO -0.18 0.28 0.00 1.17 0.00 0.00 0.00 175.10 176.38 1blr n LYS 86 N 0.91 0.00 -4.53 2.72 3.00 -0.84 -4.47 118.16 114.94 1blr n LYS 86 Ca -0.07 0.00 -0.26 0.00 -0.00 0.00 0.00 58.31 57.98 1blr n LYS 86 Cb 0.52 0.00 -0.08 0.00 0.00 0.00 0.00 35.03 35.47 1blr n LYS 86 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.40 175.82 1blr s TRP 87 N -1.99 1.82 0.17 5.64 0.52 -1.26 -1.89 118.94 121.95 1blr s TRP 87 Ca 0.00 -1.21 0.00 0.00 0.02 0.00 0.00 56.10 54.91 1blr s TRP 87 Cb 0.00 -1.23 0.00 0.00 -1.15 0.00 0.00 33.47 31.09 1blr s TRP 87 CO 0.00 -0.20 0.00 -1.91 0.02 0.00 0.00 176.95 174.86 1blr n GLU 88 N -0.92 0.00 -0.03 4.98 2.13 0.85 -4.69 120.64 122.96 1blr n GLU 88 Ca -0.07 0.00 -0.08 0.00 0.66 0.00 0.00 57.16 57.67 1blr n GLU 88 Cb 0.65 -0.19 -0.03 0.00 0.27 0.00 0.00 31.44 32.15 1blr n GLU 88 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1blr n SER 89 N -3.32 0.86 0.00 4.31 3.41 -1.24 -5.01 113.62 112.63 1blr n SER 89 Ca 0.00 0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 1blr n SER 89 Cb 0.04 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 63.67 1blr n SER 89 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1blr n GLU 90 N -3.53 0.00 -0.07 4.33 0.28 -1.26 -4.91 120.64 115.48 1blr n GLU 90 Ca -0.14 0.00 0.05 0.00 -0.16 0.00 0.00 57.16 56.91 1blr n GLU 90 Cb 0.49 0.00 0.09 0.00 1.43 0.00 0.00 31.44 33.44 1blr n GLU 90 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1blr n ASN 91 N 0.00 2.29 -3.98 -1.84 4.13 -1.26 -4.06 115.26 110.55 1blr n ASN 91 Ca 0.00 -1.68 -0.31 0.00 1.68 0.00 0.00 54.58 54.27 1blr n ASN 91 Cb 0.00 -0.09 -0.15 0.00 -1.54 0.00 0.00 39.78 38.00 1blr n ASN 91 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1blr s LYS 92 N -0.92 1.57 0.29 3.52 2.36 -1.26 -1.69 119.74 123.61 1blr s LYS 92 Ca 0.16 -1.47 0.07 0.00 -2.55 0.00 0.00 55.97 52.18 1blr s LYS 92 Cb 0.10 -2.85 -0.03 0.00 -1.05 0.00 0.00 37.83 34.00 1blr s LYS 92 CO 0.14 -0.80 0.22 0.00 1.55 0.00 0.00 175.35 176.46 1blr s MET 93 N 1.14 2.78 0.29 4.03 0.23 -0.25 -0.10 119.30 127.41 1blr s MET 93 Ca 0.03 -1.20 0.01 0.00 -1.03 0.00 0.00 55.69 53.50 1blr s MET 93 Cb -0.19 -2.48 -0.00 0.00 -1.53 0.00 0.00 34.83 30.63 1blr s MET 93 CO -0.09 0.26 0.02 1.33 -2.03 0.00 0.00 175.02 174.51 1blr n VAL 94 N -1.24 0.00 -2.74 5.16 0.24 -0.79 -1.35 118.33 117.61 1blr n VAL 94 Ca -0.05 -1.45 -0.05 0.00 -2.04 0.00 0.00 64.34 60.75 1blr n VAL 94 Cb 0.59 0.35 0.03 0.00 -1.47 0.00 0.00 33.84 33.34 1blr n VAL 94 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1blr s GLU 96 N 0.77 3.39 -0.24 0.00 2.12 -0.75 -1.54 118.70 122.45 1blr s GLU 96 Ca 0.29 1.34 -0.12 0.00 0.36 0.00 0.00 54.97 56.84 1blr s GLU 96 Cb 0.10 -4.16 -0.05 0.00 0.26 0.00 0.00 34.13 30.29 1blr s GLU 96 CO -0.12 -1.79 0.22 -0.65 -0.54 0.00 0.00 175.26 172.38 1blr s GLN 97 N 5.50 4.07 0.26 4.30 -0.21 -0.39 -2.80 119.66 130.39 1blr s GLN 97 Ca 0.76 -0.17 0.06 0.00 0.02 0.00 0.00 55.36 56.03 1blr s GLN 97 Cb -0.21 -3.56 -0.06 0.00 1.00 0.00 0.00 33.01 30.19 1blr s GLN 97 CO 0.34 -0.00 -0.06 -1.59 -2.12 0.00 0.00 175.29 171.85 1blr s LYS 98 N 1.24 1.49 -0.50 2.91 0.00 -0.57 -2.65 119.74 121.67 1blr s LYS 98 Ca 0.10 -1.75 0.02 0.00 0.00 0.00 0.00 55.97 54.35 1blr s LYS 98 Cb -0.14 -1.07 0.58 0.00 0.00 0.00 0.00 37.83 37.21 1blr s LYS 98 CO 0.06 0.03 1.93 1.47 0.00 0.00 0.00 175.35 178.84 1blr n LEU 99 N -0.54 6.91 0.00 2.77 -0.00 -1.26 -1.05 117.00 123.83 1blr n LEU 99 Ca -0.06 -3.73 0.00 0.00 -0.00 0.00 0.00 56.01 52.22 1blr n LEU 99 Cb 0.63 -0.87 0.00 0.00 -0.00 0.00 0.00 43.42 43.18 1blr n LEU 99 CO 0.39 1.15 0.00 0.18 -0.00 0.00 0.00 177.39 179.11 1blr n LEU 100 N -1.01 0.71 0.00 1.47 4.77 -1.26 -4.18 117.00 117.50 1blr n LEU 100 Ca 0.59 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.57 1blr n LEU 100 Cb 1.35 -1.84 0.00 0.00 -2.33 0.00 0.00 43.42 40.60 1blr n LEU 100 CO 0.64 -0.68 0.00 2.29 -1.33 0.00 0.00 177.39 178.31 1blr n LYS 101 N -0.33 0.00 -0.29 3.23 2.85 -1.26 -5.16 118.16 117.20 1blr n LYS 101 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1blr n LYS 101 Cb 0.32 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.70 1blr n LYS 101 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1blr n GLY 102 N -1.01 -3.21 0.45 2.58 0.00 -1.26 -5.01 105.19 97.73 1blr n GLY 102 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.90 1blr n GLY 102 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1blr n GLU 103 N -1.19 0.00 0.00 1.61 0.28 -1.26 -5.06 120.64 115.02 1blr n GLU 103 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1blr n GLU 103 Cb 0.02 -0.72 0.00 0.00 1.43 0.00 0.00 31.44 32.18 1blr n GLU 103 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1blr n GLY 104 N 2.97 0.59 0.00 -1.84 0.00 -1.26 -5.14 105.19 100.51 1blr n GLY 104 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1blr n GLY 104 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1blr n PRO 105 N 0.00 1.23 -3.72 1.61 -0.04 -1.26 -5.05 135.00 127.77 1blr n PRO 105 Ca 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.43 1blr n PRO 105 Cb 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.45 1blr n PRO 105 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1blr s LYS 106 N 0.25 1.09 0.29 0.54 2.20 -1.26 -4.84 119.74 118.01 1blr s LYS 106 Ca 0.00 -0.59 0.07 0.00 -0.36 0.00 0.00 55.97 55.10 1blr s LYS 106 Cb 0.00 0.38 -0.03 0.00 -1.51 0.00 0.00 37.83 36.66 1blr s LYS 106 CO 0.00 -0.50 0.21 0.95 -0.36 0.00 0.00 175.35 175.66 1blr s THR 107 N -3.18 3.94 0.00 3.43 -4.23 -1.08 -1.53 115.64 112.98 1blr s THR 107 Ca 0.12 -1.45 0.00 0.00 -1.18 0.00 0.00 61.69 59.18 1blr s THR 107 Cb -0.01 -3.25 0.00 0.00 1.34 0.00 0.00 72.50 70.58 1blr s THR 107 CO 0.01 -0.28 0.00 -1.54 -0.54 0.00 0.00 174.62 172.27 1blr n SER 108 N -1.22 0.00 -3.62 3.99 3.41 -1.03 -1.27 113.62 113.88 1blr n SER 108 Ca -0.05 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.43 1blr n SER 108 Cb 0.59 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.47 1blr n SER 108 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 1blr s TRP 109 N -2.00 -0.70 -0.21 7.33 1.48 -0.59 0.22 118.94 124.48 1blr s TRP 109 Ca 0.00 1.65 -0.01 0.00 -1.06 0.00 0.00 56.10 56.68 1blr s TRP 109 Cb 0.00 0.31 0.06 0.00 -1.16 0.00 0.00 33.47 32.68 1blr s TRP 109 CO 0.00 -0.37 -0.01 0.95 -4.06 0.00 0.00 176.95 173.46 1blr s THR 110 N 0.16 0.99 -0.01 0.66 -4.23 -0.47 0.11 115.64 112.86 1blr s THR 110 Ca -0.00 -0.82 -0.24 0.00 -1.18 0.00 0.00 61.69 59.44 1blr s THR 110 Cb -0.04 -1.36 -0.05 0.00 1.34 0.00 0.00 72.50 72.39 1blr s THR 110 CO 0.00 -0.12 0.73 -0.13 -0.54 0.00 0.00 174.62 174.56 1blr s ARG 111 N 1.65 4.46 0.05 3.99 0.52 -0.46 -2.14 118.95 127.02 1blr s ARG 111 Ca -0.03 0.98 0.03 0.00 -0.52 0.00 0.00 55.73 56.19 1blr s ARG 111 Cb -0.18 -3.40 -0.03 0.00 0.52 0.00 0.00 34.95 31.87 1blr s ARG 111 CO -0.07 0.19 -0.10 -2.00 0.02 0.00 0.00 175.30 173.34 1blr s GLU 112 N 0.31 0.62 0.38 3.54 2.12 -0.43 -1.09 118.70 124.15 1blr s GLU 112 Ca 0.38 -0.83 0.08 0.00 0.36 0.00 0.00 54.97 54.96 1blr s GLU 112 Cb -0.19 -0.46 -0.03 0.00 0.26 0.00 0.00 34.13 33.71 1blr s GLU 112 CO 0.21 0.09 0.27 -0.51 -0.54 0.00 0.00 175.26 174.78 1blr s LEU 113 N -1.65 3.36 0.00 2.70 2.01 -0.68 -0.68 118.68 123.75 1blr s LEU 113 Ca -0.07 -0.75 0.00 0.00 0.01 0.00 0.00 54.13 53.32 1blr s LEU 113 Cb -0.10 -1.92 0.00 0.00 0.01 0.00 0.00 46.19 44.18 1blr s LEU 113 CO 0.01 -0.49 0.00 0.41 1.01 0.00 0.00 176.35 177.29 1blr n THR 114 N -1.37 0.00 0.04 5.49 -1.04 -1.00 -4.86 114.28 111.54 1blr n THR 114 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1blr n THR 114 Cb 0.62 -0.91 0.00 0.00 -1.82 0.00 0.00 70.33 68.22 1blr n THR 114 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1blr n ASN 115 N -2.44 0.36 -1.01 8.00 3.02 -1.26 -5.01 115.26 116.92 1blr n ASN 115 Ca 0.00 0.11 -0.05 0.00 -0.03 0.00 0.00 54.58 54.62 1blr n ASN 115 Cb 0.00 -0.06 -0.04 0.00 -0.61 0.00 0.00 39.78 39.07 1blr n ASN 115 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1blr n ASP 116 N -2.97 -0.75 0.00 6.41 2.03 -1.26 -4.98 116.55 115.03 1blr n ASP 116 Ca 0.00 -1.48 0.00 0.00 0.52 0.00 0.00 54.79 53.83 1blr n ASP 116 Cb 0.00 0.24 0.00 0.00 -0.72 0.00 0.00 41.12 40.64 1blr n ASP 116 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1blr n GLY 117 N -0.11 0.00 2.49 0.27 0.00 -1.26 -4.85 105.19 101.73 1blr n GLY 117 Ca -0.19 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.66 1blr n GLY 117 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1blr n GLU 118 N 0.00 0.58 -2.97 1.61 1.02 -1.25 -3.97 120.64 115.66 1blr n GLU 118 Ca 0.00 -2.60 -0.43 0.00 -0.02 0.00 0.00 57.16 54.10 1blr n GLU 118 Cb 0.00 -1.43 -0.05 0.00 -0.02 0.00 0.00 31.44 29.94 1blr n GLU 118 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1blr s LEU 119 N -0.40 4.45 -0.43 -4.62 0.20 -0.78 -2.37 118.68 114.73 1blr s LEU 119 Ca 0.33 -0.58 -0.21 0.00 0.69 0.00 0.00 54.13 54.36 1blr s LEU 119 Cb 0.13 -2.67 0.02 0.00 -0.43 0.00 0.00 46.19 43.24 1blr s LEU 119 CO -0.16 -1.09 0.67 0.27 -0.29 0.00 0.00 176.35 175.75 1blr s ILE 120 N 3.41 4.80 -0.18 6.68 -5.25 0.14 -0.43 121.20 130.37 1blr s ILE 120 Ca 0.24 0.22 -0.03 0.00 -0.99 0.00 0.00 60.65 60.09 1blr s ILE 120 Cb -0.15 -4.22 -0.02 0.00 2.95 0.00 0.00 42.46 41.02 1blr s ILE 120 CO 0.16 -0.60 -0.05 -0.22 -1.79 0.00 0.00 174.94 172.45 1blr s LEU 121 N 2.91 3.03 0.22 0.37 1.98 -1.07 -1.32 118.68 124.81 1blr s LEU 121 Ca 0.24 -0.27 0.08 0.00 -2.89 0.00 0.00 54.13 51.30 1blr s LEU 121 Cb -0.14 -1.74 -0.04 0.00 0.66 0.00 0.00 46.19 44.93 1blr s LEU 121 CO 0.19 0.09 0.04 -0.89 -1.89 0.00 0.00 176.35 173.89 1blr s THR 122 N 0.84 3.79 -0.36 3.68 2.01 -0.91 -2.97 115.64 121.73 1blr s THR 122 Ca -0.01 -1.59 0.06 0.00 0.31 0.00 0.00 61.69 60.45 1blr s THR 122 Cb -0.15 -2.98 0.18 0.00 0.01 0.00 0.00 72.50 69.56 1blr s THR 122 CO 0.01 -0.26 0.55 -0.32 -0.69 0.00 0.00 174.62 173.91 1blr s MET 123 N -3.41 0.67 0.93 4.92 0.00 -0.85 -1.36 119.30 120.19 1blr s MET 123 Ca 0.30 -0.08 -0.12 0.00 0.00 0.00 0.00 55.69 55.79 1blr s MET 123 Cb -0.08 -0.04 0.15 0.00 0.00 0.00 0.00 34.83 34.86 1blr s MET 123 CO 0.21 -1.13 1.12 0.95 0.00 0.00 0.00 175.02 176.16 1blr s THR 124 N 2.15 2.10 -0.30 10.11 -4.23 0.13 -2.06 115.64 123.55 1blr s THR 124 Ca 0.14 0.03 -0.14 0.00 -1.18 0.00 0.00 61.69 60.54 1blr s THR 124 Cb -0.08 -2.71 0.18 0.00 1.34 0.00 0.00 72.50 71.23 1blr s THR 124 CO -0.15 -0.04 1.10 0.00 -0.54 0.00 0.00 174.62 174.99 1blr s ALA 125 N -3.18 -3.97 -1.18 3.99 0.00 -0.73 -2.45 121.76 114.24 1blr s ALA 125 Ca 0.64 1.37 -0.02 0.00 0.00 0.00 0.00 51.96 53.95 1blr s ALA 125 Cb -0.16 -2.74 0.00 0.00 0.00 0.00 0.00 23.12 20.22 1blr s ALA 125 CO 0.55 -1.86 0.21 -3.47 0.00 0.00 0.00 175.76 171.19 1blr n ASP 126 N 5.25 -4.62 0.00 0.00 2.03 -0.58 -2.04 116.55 116.59 1blr n ASP 126 Ca 0.02 -0.11 0.00 0.00 0.52 0.00 0.00 54.79 55.23 1blr n ASP 126 Cb 0.56 -3.62 0.00 0.00 -0.72 0.00 0.00 41.12 37.34 1blr n ASP 126 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1blr n ASP 127 N -1.02 0.00 -4.52 1.67 2.03 -1.25 -4.39 116.55 109.07 1blr n ASP 127 Ca -0.13 0.00 -0.27 0.00 0.52 0.00 0.00 54.79 54.91 1blr n ASP 127 Cb 0.61 0.00 0.13 0.00 -0.72 0.00 0.00 41.12 41.14 1blr n ASP 127 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1blr s VAL 128 N -2.69 2.10 -0.26 5.18 -7.23 -0.87 -4.83 120.40 111.80 1blr s VAL 128 Ca 0.00 -0.21 -0.08 0.00 -1.81 0.00 0.00 61.98 59.87 1blr s VAL 128 Cb 0.00 -2.88 0.12 0.00 0.56 0.00 0.00 36.38 34.18 1blr s VAL 128 CO 0.00 0.00 0.56 -0.69 -0.31 0.00 0.00 175.10 174.66 1blr s VAL 129 N -3.53 -0.87 -0.72 1.32 1.01 -1.26 -1.78 120.40 114.57 1blr s VAL 129 Ca 0.68 0.06 -0.15 0.00 0.00 0.00 0.00 61.98 62.57 1blr s VAL 129 Cb -0.06 -0.88 0.19 0.00 0.00 0.00 0.00 36.38 35.62 1blr s VAL 129 CO 0.49 0.02 0.67 0.00 0.00 0.00 0.00 175.10 176.28 1blr s THR 131 N 0.69 4.07 -0.26 0.00 2.01 -1.26 -2.01 115.64 118.88 1blr s THR 131 Ca 0.12 -0.30 -0.19 0.00 0.31 0.00 0.00 61.69 61.64 1blr s THR 131 Cb -0.17 -2.78 0.07 0.00 0.01 0.00 0.00 72.50 69.62 1blr s THR 131 CO -0.05 0.50 0.66 0.00 -0.69 0.00 0.00 174.62 175.04 1blr s ARG 132 N 0.25 0.71 0.57 4.92 1.70 -1.16 -3.71 118.95 122.24 1blr s ARG 132 Ca -0.02 1.06 -0.15 0.00 -0.47 0.00 0.00 55.73 56.15 1blr s ARG 132 Cb -0.14 0.23 -0.05 0.00 -0.57 0.00 0.00 34.95 34.42 1blr s ARG 132 CO 0.02 -0.13 1.03 0.08 -1.08 0.00 0.00 175.30 175.22 1blr s VAL 133 N 1.06 4.19 0.35 4.99 1.01 -0.04 -2.60 120.40 129.36 1blr s VAL 133 Ca -0.06 0.99 0.04 0.00 0.00 0.00 0.00 61.98 62.95 1blr s VAL 133 Cb -0.05 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 1blr s VAL 133 CO -0.10 -0.66 0.14 -0.31 0.00 0.00 0.00 175.10 174.17 1blr s TYR 134 N -2.62 1.72 0.10 5.22 1.51 0.42 -0.34 117.35 123.37 1blr s TYR 134 Ca 0.61 -1.29 -0.08 0.00 -1.01 0.00 0.00 57.07 55.29 1blr s TYR 134 Cb -0.13 -1.02 -0.01 0.00 -0.11 0.00 0.00 41.96 40.69 1blr s TYR 134 CO 0.37 -0.38 0.18 0.08 -1.11 0.00 0.00 175.55 174.69 1blr s VAL 135 N -3.41 0.13 -0.32 0.71 1.01 -1.06 -1.87 120.40 115.60 1blr s VAL 135 Ca 0.31 -1.29 -0.25 0.00 0.00 0.00 0.00 61.98 60.76 1blr s VAL 135 Cb 0.04 -1.46 0.01 0.00 0.00 0.00 0.00 36.38 34.97 1blr s VAL 135 CO 0.16 -0.61 0.85 -0.13 0.00 0.00 0.00 175.10 175.37 1blr s ARG 136 N -3.89 3.95 0.00 2.72 0.52 -1.25 -1.75 118.95 119.25 1blr s ARG 136 Ca 0.08 0.65 0.00 0.00 -0.52 0.00 0.00 55.73 55.94 1blr s ARG 136 Cb 0.05 -3.74 0.00 0.00 0.52 0.00 0.00 34.95 31.78 1blr s ARG 136 CO -0.09 -0.75 0.14 -1.91 0.02 0.00 0.00 175.30 172.71