#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 -4.44 115.26 117.23 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 10.15 0.00 -1.68 3.10 3.01 -1.26 -4.97 117.46 125.81 1blr n PHE 3 Ca 0.00 0.00 -0.54 0.00 1.01 0.00 0.00 57.45 57.92 1blr n PHE 3 Cb 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.41 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 2.63 2.52 0.00 4.37 3.41 -1.26 -4.70 113.62 120.59 1blr n SER 4 Ca 0.00 1.06 0.00 0.00 -0.26 0.00 0.00 58.87 59.67 1blr n SER 4 Cb 0.00 -1.22 0.00 0.00 -0.26 0.00 0.00 64.21 62.73 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 3.85 4.52 3.81 5.00 0.00 -0.95 -5.00 105.19 116.41 1blr n GLY 5 Ca 0.23 -1.30 -0.32 0.00 0.00 0.00 0.00 46.02 44.63 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 5.94 -0.06 1.61 3.84 -1.26 -2.11 114.94 122.90 1blr s ASN 6 Ca 0.00 1.74 0.02 0.00 0.21 0.00 0.00 52.86 54.83 1blr s ASN 6 Cb 0.00 -2.52 0.02 0.00 -0.55 0.00 0.00 41.25 38.19 1blr s ASN 6 CO 0.00 -1.06 -0.10 0.26 -2.79 0.00 0.00 177.10 173.41 1blr s TRP 7 N -2.55 1.22 0.27 0.43 0.52 -1.19 -2.18 118.94 115.47 1blr s TRP 7 Ca 0.62 -0.43 -0.07 0.00 0.02 0.00 0.00 56.10 56.24 1blr s TRP 7 Cb -0.14 -0.94 -0.06 0.00 -1.15 0.00 0.00 33.47 31.18 1blr s TRP 7 CO 0.38 -0.25 0.56 0.15 0.02 0.00 0.00 176.95 177.81 1blr s LYS 8 N 0.74 3.70 0.33 4.98 3.01 -0.63 -3.97 119.74 127.90 1blr s LYS 8 Ca -0.14 0.12 -0.27 0.00 -1.01 0.00 0.00 55.97 54.67 1blr s LYS 8 Cb -0.15 -2.64 -0.09 0.00 -1.01 0.00 0.00 37.83 33.94 1blr s LYS 8 CO 0.03 0.24 1.12 -1.50 0.51 0.00 0.00 175.35 175.74 1blr s ILE 9 N -2.00 3.42 -0.22 2.17 -1.16 -1.26 -2.80 121.20 119.35 1blr s ILE 9 Ca 0.45 1.31 -0.05 0.00 -0.51 0.00 0.00 60.65 61.86 1blr s ILE 9 Cb -0.11 -3.79 0.12 0.00 0.61 0.00 0.00 42.46 39.29 1blr s ILE 9 CO 0.27 0.22 0.41 -0.63 -2.81 0.00 0.00 174.94 172.40 1blr s ILE 10 N -1.31 -0.64 0.26 2.00 1.09 0.44 -4.88 121.20 118.16 1blr s ILE 10 Ca 0.50 0.05 0.00 0.00 -1.10 0.00 0.00 60.65 60.09 1blr s ILE 10 Cb -0.30 -0.75 0.00 0.00 -1.06 0.00 0.00 42.46 40.35 1blr s ILE 10 CO 0.39 -0.03 0.00 0.54 -0.10 0.00 0.00 174.94 175.74 1blr n ARG 11 N 5.38 -4.39 -3.04 2.79 3.00 -1.26 -0.29 116.66 118.85 1blr n ARG 11 Ca -0.06 3.18 0.02 0.00 -0.01 0.00 0.00 57.85 60.98 1blr n ARG 11 Cb 0.50 -3.43 -0.00 0.00 0.00 0.00 0.00 32.46 29.53 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 -1.32 -1.04 -0.46 0.55 0.15 -1.26 -2.48 113.70 107.84 1blr s SER 12 Ca 0.00 -0.42 0.09 0.00 0.70 0.00 0.00 55.95 56.32 1blr s SER 12 Cb 0.00 1.37 0.32 0.00 -1.71 0.00 0.00 66.02 66.01 1blr s SER 12 CO 0.00 -0.13 0.77 1.21 1.20 0.00 0.00 173.24 176.29 1blr n GLU 13 N 4.29 1.75 0.00 5.44 2.13 -1.26 -4.82 120.64 128.18 1blr n GLU 13 Ca 0.08 -3.92 0.00 0.00 0.66 0.00 0.00 57.16 53.99 1blr n GLU 13 Cb 0.59 -1.85 0.00 0.00 0.27 0.00 0.00 31.44 30.45 1blr n GLU 13 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1blr n ASN 14 N 0.33 2.54 -0.23 4.31 3.02 -1.26 -4.76 115.26 119.21 1blr n ASN 14 Ca 0.27 -0.03 0.01 0.00 -0.03 0.00 0.00 54.58 54.80 1blr n ASN 14 Cb 0.54 0.56 0.09 0.00 -0.61 0.00 0.00 39.78 40.36 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 -0.25 -0.13 3.10 3.04 -1.87 0.19 116.94 121.02 1blr h PHE 15 Ca 0.00 0.06 -0.13 0.00 3.98 0.00 0.00 57.97 61.87 1blr h PHE 15 Cb 0.00 0.22 -0.01 0.00 2.56 0.00 0.00 35.95 38.71 1blr h PHE 15 CO 0.00 -0.26 -0.51 1.05 -2.02 0.00 0.00 178.31 176.57 1blr h GLU 16 N 0.04 0.35 0.00 1.11 -0.00 -1.93 -1.74 114.58 112.41 1blr h GLU 16 Ca 0.34 -0.20 -0.00 0.00 -0.00 0.00 0.00 59.36 59.50 1blr h GLU 16 Cb 0.55 0.02 -0.00 0.00 -0.00 0.00 0.00 28.75 29.31 1blr h GLU 16 CO -0.66 0.77 -0.01 1.49 -0.00 0.00 0.00 179.01 180.60 1blr h GLU 17 N 0.27 0.00 -0.00 1.06 4.81 -1.00 0.81 114.58 120.53 1blr h GLU 17 Ca 0.01 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1blr h GLU 17 Cb 0.99 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.37 1blr h GLU 17 CO 0.08 0.01 -0.03 -0.07 -0.73 0.00 0.00 179.01 178.27 1blr h LEU 18 N 0.00 0.03 0.00 1.64 3.38 -0.18 -1.90 115.31 118.28 1blr h LEU 18 Ca -0.00 -0.77 0.00 0.00 0.09 0.00 0.00 57.88 57.20 1blr h LEU 18 Cb 0.10 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1blr h LEU 18 CO 0.00 0.79 0.00 0.18 0.09 0.00 0.00 178.44 179.50 1blr n LEU 19 N -4.69 0.00 -0.02 1.67 7.99 -0.88 -1.96 117.00 119.11 1blr n LEU 19 Ca -0.09 0.18 0.03 0.00 -0.01 0.00 0.00 56.01 56.12 1blr n LEU 19 Cb 0.39 -0.18 -0.14 0.00 -0.11 0.00 0.00 43.42 43.38 1blr n LEU 19 CO 0.34 -0.00 -0.73 0.29 -1.51 0.00 0.00 177.39 175.78 1blr n LYS 20 N -1.18 0.66 -0.09 3.23 5.02 0.22 -3.32 118.16 122.70 1blr n LYS 20 Ca 0.18 -0.05 -0.12 0.00 -2.02 0.00 0.00 58.31 56.29 1blr n LYS 20 Cb 0.19 -1.59 -0.15 0.00 -0.02 0.00 0.00 35.03 33.46 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 -2.54 1.48 0.32 -0.18 0.24 -0.72 -3.58 118.33 113.35 1blr n VAL 21 Ca -0.13 -0.77 0.20 0.00 -2.04 0.00 0.00 64.34 61.60 1blr n VAL 21 Cb 0.78 -0.87 1.09 0.00 -1.47 0.00 0.00 33.84 33.37 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 0.01 0.00 0.00 1.34 8.10 -1.60 -3.44 115.31 119.71 1blr h LEU 22 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.49 1blr h LEU 22 Cb 2.12 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 42.34 1blr h LEU 22 CO 0.01 0.00 0.00 0.61 -4.11 0.00 0.00 178.44 174.96 1blr n GLY 23 N -1.16 0.47 3.55 0.17 0.00 -1.26 -5.09 105.19 101.87 1blr n GLY 23 Ca -0.03 -0.24 -0.43 0.00 0.00 0.00 0.00 46.02 45.32 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 2.05 0.00 1.61 3.14 -1.21 -4.91 118.33 119.01 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 -0.84 0.00 0.00 -1.06 0.00 0.00 33.84 31.94 1blr n VAL 24 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 1blr n ASN 25 N 1.12 0.00 0.00 6.55 2.85 -1.26 -4.90 115.26 119.63 1blr n ASN 25 Ca 0.11 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.58 1blr n ASN 25 Cb 0.35 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.37 1blr n ASN 25 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 1blr n VAL 26 N 0.00 0.00 0.15 3.44 0.31 -1.26 -4.90 118.33 116.07 1blr n VAL 26 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.27 1blr n VAL 26 Cb 0.00 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 32.90 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 2.48 -0.39 -6.46 5.55 2.86 -1.90 -3.44 114.93 113.62 1blr h MET 27 Ca 0.00 0.03 -0.41 0.00 -2.06 0.00 0.00 59.70 57.25 1blr h MET 27 Cb 0.00 0.09 0.01 0.00 0.06 0.00 0.00 31.60 31.76 1blr h MET 27 CO 0.00 -0.26 -0.87 1.28 1.06 0.00 0.00 176.91 178.12 1blr n LEU 28 N -3.35 -2.63 -2.02 1.22 7.99 -1.26 0.77 117.00 117.72 1blr n LEU 28 Ca -0.05 -0.87 -0.20 0.00 -0.01 0.00 0.00 56.01 54.88 1blr n LEU 28 Cb 0.16 -2.03 -0.04 0.00 -0.11 0.00 0.00 43.42 41.40 1blr n LEU 28 CO 0.12 0.20 -0.23 -1.14 -1.51 0.00 0.00 177.39 174.83 1blr n ARG 29 N -3.07 -1.52 -1.83 3.23 0.00 -1.26 -2.24 116.66 109.97 1blr n ARG 29 Ca -0.20 1.05 -0.02 0.00 -0.00 0.00 0.00 57.85 58.68 1blr n ARG 29 Cb 0.63 -5.57 -0.00 0.00 0.00 0.00 0.00 32.46 27.51 1blr n ARG 29 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1blr n LYS 30 N -2.74 -2.02 -2.86 -0.14 5.02 0.23 -2.57 118.16 113.08 1blr n LYS 30 Ca -0.22 0.12 -0.16 0.00 -2.02 0.00 0.00 58.31 56.03 1blr n LYS 30 Cb 0.67 -4.41 -0.03 0.00 -0.02 0.00 0.00 35.03 31.24 1blr n LYS 30 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1blr n ILE 31 N -1.96 0.00 0.00 -0.18 2.08 -0.95 -3.87 119.36 114.48 1blr n ILE 31 Ca -0.02 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.29 1blr n ILE 31 Cb 0.31 -0.18 0.00 0.00 -0.75 0.00 0.00 39.64 39.02 1blr n ILE 31 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1blr n ALA 32 N -2.49 0.00 -2.85 -1.39 0.00 -1.06 -5.12 120.51 107.60 1blr n ALA 32 Ca 0.04 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.47 1blr n ALA 32 Cb 0.35 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.79 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 -1.59 -8.30 -2.45 0.00 0.31 -1.25 -4.98 118.33 100.06 1blr n VAL 33 Ca 0.00 1.51 -0.02 0.00 -0.01 0.00 0.00 64.34 65.82 1blr n VAL 33 Cb 0.00 -5.26 0.03 0.00 -0.91 0.00 0.00 33.84 27.71 1blr n VAL 33 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1blr n ALA 34 N 1.41 3.04 -0.05 3.52 0.00 -1.26 -4.94 120.51 122.24 1blr n ALA 34 Ca -0.12 -1.42 -0.16 0.00 0.00 0.00 0.00 53.44 51.75 1blr n ALA 34 Cb 0.29 -0.66 -0.05 0.00 0.00 0.00 0.00 19.45 19.03 1blr n ALA 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1blr h ALA 35 N 0.95 0.40 -3.24 0.00 0.00 -2.05 -3.42 119.26 111.90 1blr h ALA 35 Ca -0.40 -0.56 -0.64 0.00 0.00 0.00 0.00 54.91 53.31 1blr h ALA 35 Cb 1.43 -0.05 -0.22 0.00 0.00 0.00 0.00 17.79 18.95 1blr h ALA 35 CO -0.11 0.68 -0.66 0.00 0.00 0.00 0.00 179.25 179.16 1blr s ALA 36 N -3.94 3.02 -0.99 0.00 0.00 -1.26 -5.05 121.76 113.54 1blr s ALA 36 Ca -0.10 -0.88 -0.07 0.00 0.00 0.00 0.00 51.96 50.91 1blr s ALA 36 Cb 0.09 -1.64 0.25 0.00 0.00 0.00 0.00 23.12 21.83 1blr s ALA 36 CO 0.90 0.09 0.94 -1.12 0.00 0.00 0.00 175.76 176.56 1blr s SER 37 N 0.58 6.72 -0.41 0.00 0.01 -1.26 -4.79 113.70 114.54 1blr s SER 37 Ca -0.02 -3.54 -0.14 0.00 1.31 0.00 0.00 55.95 53.56 1blr s SER 37 Cb -0.14 -2.09 0.02 0.00 0.21 0.00 0.00 66.02 64.02 1blr s SER 37 CO 0.02 -0.27 0.52 0.29 0.41 0.00 0.00 173.24 174.21 1blr n LYS 38 N 2.70 -2.54 -1.77 12.44 5.02 -1.26 -4.82 118.16 127.92 1blr n LYS 38 Ca 0.22 2.22 -0.29 0.00 -2.02 0.00 0.00 58.31 58.43 1blr n LYS 38 Cb 0.39 -5.63 0.13 0.00 -0.02 0.00 0.00 35.03 29.91 1blr n LYS 38 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1blr s PRO 39 N -2.48 1.27 0.24 1.97 0.04 -1.26 -4.73 135.00 130.05 1blr s PRO 39 Ca 0.22 0.02 0.00 0.00 0.04 0.00 0.00 61.00 61.28 1blr s PRO 39 Cb -0.06 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.60 1blr s PRO 39 CO 0.77 -2.06 0.00 0.00 0.04 0.00 0.00 177.00 175.76 1blr n ALA 40 N -3.62 2.29 0.00 8.56 0.00 -1.12 -4.13 120.51 122.49 1blr n ALA 40 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1blr n ALA 40 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 1blr n ALA 40 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1blr n VAL 41 N -3.18 0.00 -3.44 0.00 3.14 -1.25 -4.26 118.33 109.33 1blr n VAL 41 Ca 0.00 0.00 0.01 0.00 -2.96 0.00 0.00 64.34 61.39 1blr n VAL 41 Cb 0.00 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 32.75 1blr n VAL 41 CO 0.00 0.00 0.00 -1.83 -6.46 0.00 0.00 176.83 168.54 1blr s GLU 42 N -1.81 0.50 -0.01 1.45 -1.05 -0.79 -3.15 118.70 113.84 1blr s GLU 42 Ca 0.00 1.14 -0.04 0.00 -0.15 0.00 0.00 54.97 55.92 1blr s GLU 42 Cb 0.00 0.67 -0.04 0.00 -0.44 0.00 0.00 34.13 34.32 1blr s GLU 42 CO 0.00 -0.29 0.20 0.42 0.95 0.00 0.00 175.26 176.54 1blr s ILE 43 N 2.81 5.41 -0.25 1.83 1.01 -0.90 -2.25 121.20 128.86 1blr s ILE 43 Ca 0.02 -0.06 -0.04 0.00 0.00 0.00 0.00 60.65 60.57 1blr s ILE 43 Cb -0.12 -3.54 0.09 0.00 0.01 0.00 0.00 42.46 38.91 1blr s ILE 43 CO -0.19 0.35 0.13 -0.54 0.00 0.00 0.00 174.94 174.69 1blr s LYS 44 N -1.85 0.16 0.03 2.79 1.02 -0.94 -2.25 119.74 118.71 1blr s LYS 44 Ca 0.27 -0.33 0.05 0.00 0.02 0.00 0.00 55.97 55.98 1blr s LYS 44 Cb -0.13 -1.34 -0.02 0.00 -0.52 0.00 0.00 37.83 35.82 1blr s LYS 44 CO 0.17 -0.89 -0.16 1.14 -0.92 0.00 0.00 175.35 174.69 1blr s GLN 45 N 2.14 1.07 -0.51 1.68 1.03 -1.26 -0.71 119.66 123.11 1blr s GLN 45 Ca 0.07 -0.77 0.03 0.00 0.04 0.00 0.00 55.36 54.73 1blr s GLN 45 Cb -0.16 -1.10 0.15 0.00 0.03 0.00 0.00 33.01 31.93 1blr s GLN 45 CO -0.27 0.28 0.33 -2.00 -2.54 0.00 0.00 175.29 171.09 1blr s GLU 46 N -1.05 1.54 5.76 9.60 2.12 -0.54 -4.85 118.70 131.27 1blr s GLU 46 Ca 0.03 -2.40 0.00 0.00 0.36 0.00 0.00 54.97 52.97 1blr s GLU 46 Cb -0.08 -2.47 0.00 0.00 0.26 0.00 0.00 34.13 31.84 1blr s GLU 46 CO 0.01 -1.24 0.00 0.41 -0.54 0.00 0.00 175.26 173.90 1blr n GLY 47 N 2.98 0.30 0.00 -1.50 0.00 -1.26 -3.09 105.19 102.61 1blr n GLY 47 Ca 0.16 -0.73 0.15 0.00 0.00 0.00 0.00 46.02 45.60 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 6.68 0.00 -4.79 1.61 5.68 -1.26 -4.75 116.55 119.72 1blr n ASP 48 Ca 0.00 -0.81 -0.38 0.00 -0.50 0.00 0.00 54.79 53.10 1blr n ASP 48 Cb 0.00 -0.05 -0.06 0.00 -1.14 0.00 0.00 41.12 39.87 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 -2.09 5.03 0.02 2.12 2.01 -1.18 -1.21 115.64 120.34 1blr s THR 49 Ca 0.42 0.96 0.01 0.00 0.31 0.00 0.00 61.69 63.39 1blr s THR 49 Cb 0.21 -3.79 -0.02 0.00 0.01 0.00 0.00 72.50 68.91 1blr s THR 49 CO 0.36 0.48 -0.05 -0.36 -0.69 0.00 0.00 174.62 174.37 1blr s PHE 50 N -0.43 0.39 0.05 4.92 0.40 -0.50 -1.47 117.98 121.35 1blr s PHE 50 Ca 0.26 -0.36 0.07 0.00 -0.60 0.00 0.00 56.93 56.29 1blr s PHE 50 Cb -0.17 -0.25 -0.03 0.00 0.51 0.00 0.00 43.02 43.09 1blr s PHE 50 CO 0.13 -0.09 -0.20 -0.47 0.70 0.00 0.00 175.22 175.29 1blr s TYR 51 N -0.98 1.74 -0.21 0.36 6.14 0.11 -1.56 117.35 122.95 1blr s TYR 51 Ca -0.08 -0.38 -0.04 0.00 0.64 0.00 0.00 57.07 57.21 1blr s TYR 51 Cb -0.07 -1.03 0.10 0.00 0.42 0.00 0.00 41.96 41.38 1blr s TYR 51 CO -0.00 0.10 0.24 0.42 0.64 0.00 0.00 175.55 176.94 1blr s ILE 52 N -0.84 -0.35 -0.38 3.14 1.01 -0.95 -2.22 121.20 120.61 1blr s ILE 52 Ca 0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 60.65 60.57 1blr s ILE 52 Cb -0.09 -0.71 0.10 0.00 0.01 0.00 0.00 42.46 41.77 1blr s ILE 52 CO 0.02 -0.22 0.14 -0.75 0.00 0.00 0.00 174.94 174.14 1blr s LYS 53 N 2.34 1.91 0.20 2.79 2.20 -0.95 -1.42 119.74 126.81 1blr s LYS 53 Ca 0.08 -1.78 -0.08 0.00 -0.36 0.00 0.00 55.97 53.82 1blr s LYS 53 Cb -0.16 -3.45 -0.07 0.00 -1.51 0.00 0.00 37.83 32.65 1blr s LYS 53 CO -0.14 -0.99 0.50 0.99 -0.36 0.00 0.00 175.35 175.35 1blr s THR 54 N 1.09 5.00 0.03 3.43 2.01 -1.23 -1.88 115.64 124.10 1blr s THR 54 Ca 0.08 0.34 -0.12 0.00 0.31 0.00 0.00 61.69 62.30 1blr s THR 54 Cb -0.22 -3.62 0.04 0.00 0.01 0.00 0.00 72.50 68.71 1blr s THR 54 CO -0.05 -0.03 0.54 -1.54 -0.69 0.00 0.00 174.62 172.84 1blr n SER 55 N -0.06 -0.67 0.00 3.53 3.41 -1.26 -4.25 113.62 114.32 1blr n SER 55 Ca -0.00 -1.26 0.00 0.00 -0.26 0.00 0.00 58.87 57.35 1blr n SER 55 Cb 0.52 1.07 0.00 0.00 -0.26 0.00 0.00 64.21 65.54 1blr n SER 55 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 1blr n THR 56 N -0.38 0.00 0.04 6.66 5.66 -1.26 -2.78 114.28 122.21 1blr n THR 56 Ca 0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 1blr n THR 56 Cb 0.27 -0.15 0.00 0.00 -1.55 0.00 0.00 70.33 68.90 1blr n THR 56 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1blr n THR 57 N -1.93 0.00 -0.62 1.09 -1.04 -1.26 -4.90 114.28 105.62 1blr n THR 57 Ca 0.00 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.91 1blr n THR 57 Cb 0.00 -0.01 0.09 0.00 -1.82 0.00 0.00 70.33 68.59 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 -2.67 0.00 -0.34 12.58 0.24 -1.26 -4.99 118.33 121.89 1blr n VAL 58 Ca 0.00 -0.15 -0.30 0.00 -2.04 0.00 0.00 64.34 61.85 1blr n VAL 58 Cb 0.00 -0.99 0.29 0.00 -1.47 0.00 0.00 33.84 31.67 1blr n VAL 58 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1blr s ARG 59 N -3.85 -2.67 0.00 7.34 1.70 -1.26 -5.01 118.95 115.20 1blr s ARG 59 Ca 0.25 0.33 0.00 0.00 -0.47 0.00 0.00 55.73 55.83 1blr s ARG 59 Cb -0.03 -1.39 0.00 0.00 -0.57 0.00 0.00 34.95 32.96 1blr s ARG 59 CO 0.19 -4.75 0.00 2.41 -1.08 0.00 0.00 175.30 172.07 1blr n THR 60 N -5.57 0.00 -4.36 4.99 -1.04 -1.26 -4.86 114.28 102.17 1blr n THR 60 Ca 0.10 0.00 -0.20 0.00 -2.04 0.00 0.00 64.05 61.91 1blr n THR 60 Cb 0.59 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.99 1blr n THR 60 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1blr s THR 61 N -2.83 1.89 -0.07 12.58 -1.32 -1.26 -5.07 115.64 119.56 1blr s THR 61 Ca 0.00 -2.18 -0.11 0.00 -1.21 0.00 0.00 61.69 58.19 1blr s THR 61 Cb 0.00 -2.04 0.02 0.00 -1.51 0.00 0.00 72.50 68.97 1blr s THR 61 CO 0.00 -0.50 0.28 -1.83 -2.21 0.00 0.00 174.62 170.37 1blr s GLU 62 N -3.43 0.45 -0.52 7.08 1.03 -1.26 -3.54 118.70 118.51 1blr s GLU 62 Ca 0.22 0.16 -0.18 0.00 0.03 0.00 0.00 54.97 55.21 1blr s GLU 62 Cb -0.03 0.21 0.09 0.00 -0.80 0.00 0.00 34.13 33.60 1blr s GLU 62 CO 0.08 -0.09 0.56 0.96 -1.33 0.00 0.00 175.26 175.45 1blr s ILE 63 N -0.41 5.02 -1.18 1.83 -4.36 -0.51 -4.87 121.20 116.72 1blr s ILE 63 Ca -0.05 -0.95 -0.10 0.00 -0.26 0.00 0.00 60.65 59.29 1blr s ILE 63 Cb -0.04 -4.31 0.22 0.00 1.25 0.00 0.00 42.46 39.58 1blr s ILE 63 CO 0.02 -0.84 1.46 -0.46 0.24 0.00 0.00 174.94 175.36 1blr n ASN 64 N 5.79 5.44 -0.08 4.36 2.04 -1.26 -2.24 115.26 129.31 1blr n ASN 64 Ca -0.10 -3.08 0.00 0.00 -0.44 0.00 0.00 54.58 50.96 1blr n ASN 64 Cb 0.43 -1.46 0.00 0.00 -2.53 0.00 0.00 39.78 36.22 1blr n ASN 64 CO 0.00 0.00 0.00 2.22 -0.44 0.00 0.00 177.26 179.04 1blr n PHE 65 N 3.92 -0.02 -3.70 -2.53 -1.74 -0.60 -4.98 117.46 107.81 1blr n PHE 65 Ca 0.33 0.00 -0.13 0.00 -0.56 0.00 0.00 57.45 57.09 1blr n PHE 65 Cb 0.39 0.00 -0.13 0.00 1.52 0.00 0.00 39.48 41.26 1blr n PHE 65 CO 0.00 0.00 0.00 -1.59 -0.56 0.00 0.00 176.76 174.61 1blr s LYS 66 N 1.14 0.18 0.65 3.97 -2.85 -1.26 -1.40 119.74 120.17 1blr s LYS 66 Ca 0.00 0.61 0.07 0.00 -1.00 0.00 0.00 55.97 55.66 1blr s LYS 66 Cb 0.00 -0.09 0.35 0.00 -2.06 0.00 0.00 37.83 36.03 1blr s LYS 66 CO 0.00 -0.21 1.18 0.28 0.10 0.00 0.00 175.35 176.69 1blr h VAL 67 N 6.04 0.01 -0.23 1.79 2.07 -1.47 -2.16 116.25 122.31 1blr h VAL 67 Ca -0.30 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.07 1blr h VAL 67 Cb 1.14 0.11 -0.07 0.00 -1.52 0.00 0.00 31.29 30.95 1blr h VAL 67 CO 0.28 0.00 0.19 0.61 0.02 0.00 0.00 177.57 178.66 1blr n GLY 68 N -1.48 3.25 3.90 2.17 0.00 -1.26 -4.39 105.19 107.38 1blr n GLY 68 Ca 0.02 -0.54 0.01 0.00 0.00 0.00 0.00 46.02 45.51 1blr n GLY 68 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1blr s GLU 69 N -0.82 0.68 0.47 1.61 -1.05 -0.81 -5.12 118.70 113.66 1blr s GLU 69 Ca 0.16 -0.43 0.06 0.00 -0.15 0.00 0.00 54.97 54.60 1blr s GLU 69 Cb 0.12 0.19 -0.01 0.00 -0.44 0.00 0.00 34.13 33.99 1blr s GLU 69 CO -0.00 -0.32 0.24 -1.83 0.95 0.00 0.00 175.26 174.29 1blr s GLU 70 N -2.15 2.25 0.24 -4.83 1.03 -1.26 -3.20 118.70 110.78 1blr s GLU 70 Ca 0.25 -1.98 0.01 0.00 0.03 0.00 0.00 54.97 53.28 1blr s GLU 70 Cb -0.00 -1.97 -0.00 0.00 -0.80 0.00 0.00 34.13 31.36 1blr s GLU 70 CO 0.01 -0.33 0.02 1.19 -1.33 0.00 0.00 175.26 174.82 1blr n PHE 71 N -1.44 0.43 -4.16 4.83 3.72 -0.89 -4.94 117.46 115.02 1blr n PHE 71 Ca -0.04 -1.29 -0.12 0.00 -0.05 0.00 0.00 57.45 55.94 1blr n PHE 71 Cb 0.65 -0.12 -0.10 0.00 -0.94 0.00 0.00 39.48 38.96 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 -2.89 0.80 0.06 -1.08 2.02 -1.26 -2.54 118.70 113.81 1blr s GLU 72 Ca 0.03 -1.19 -0.11 0.00 0.02 0.00 0.00 54.97 53.72 1blr s GLU 72 Cb 0.00 -0.34 0.04 0.00 0.10 0.00 0.00 34.13 33.93 1blr s GLU 72 CO 0.02 0.03 0.52 -1.91 0.02 0.00 0.00 175.26 173.94 1blr n GLU 73 N 0.39 0.26 -4.33 1.61 2.13 0.97 -4.87 120.64 116.79 1blr n GLU 73 Ca -0.15 -0.62 -0.20 0.00 0.66 0.00 0.00 57.16 56.85 1blr n GLU 73 Cb 0.59 0.87 -0.15 0.00 0.27 0.00 0.00 31.44 33.02 1blr n GLU 73 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 1blr s GLN 74 N -2.02 0.88 0.00 5.31 -0.21 -1.23 -1.84 119.66 120.55 1blr s GLN 74 Ca 0.12 -0.26 0.00 0.00 0.02 0.00 0.00 55.36 55.24 1blr s GLN 74 Cb -0.01 -0.83 0.00 0.00 1.00 0.00 0.00 33.01 33.17 1blr s GLN 74 CO 0.02 0.08 0.00 2.41 -2.12 0.00 0.00 175.29 175.68 1blr n THR 75 N 3.39 0.00 -0.02 -0.19 -1.04 -1.22 -4.77 114.28 110.42 1blr n THR 75 Ca -0.19 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 61.81 1blr n THR 75 Cb 0.54 -1.40 -0.00 0.00 -1.82 0.00 0.00 70.33 67.65 1blr n THR 75 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1blr h VAL 76 N -0.51 0.00 -3.38 12.58 2.07 -1.96 -3.49 116.25 121.57 1blr h VAL 76 Ca 0.00 -0.39 -0.25 0.00 0.82 0.00 0.00 66.70 66.88 1blr h VAL 76 Cb 0.00 0.00 -0.31 0.00 -1.52 0.00 0.00 31.29 29.46 1blr h VAL 76 CO 0.00 0.00 -0.64 -0.62 0.02 0.00 0.00 177.57 176.33 1blr s ASP 77 N -4.23 -0.06 0.00 0.57 -1.08 -1.26 -4.96 116.67 105.64 1blr s ASP 77 Ca -0.04 0.21 0.00 0.00 -0.52 0.00 0.00 52.55 52.20 1blr s ASP 77 Cb 0.00 0.12 0.00 0.00 -1.46 0.00 0.00 42.92 41.59 1blr s ASP 77 CO 0.05 -0.12 0.00 0.61 0.52 0.00 0.00 175.17 176.23 1blr n GLY 78 N 3.96 1.94 3.40 2.66 0.00 -1.26 -5.07 105.19 110.82 1blr n GLY 78 Ca -0.24 -0.52 -0.12 0.00 0.00 0.00 0.00 46.02 45.14 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 1.55 0.00 1.61 0.52 -1.26 -5.13 118.95 116.23 1blr s ARG 79 Ca 0.00 -1.58 0.00 0.00 -0.52 0.00 0.00 55.73 53.63 1blr s ARG 79 Cb 0.00 0.38 0.00 0.00 0.52 0.00 0.00 34.95 35.85 1blr s ARG 79 CO 0.00 -0.60 0.00 -0.35 0.02 0.00 0.00 175.30 174.37 1blr n PRO 80 N -0.41 0.51 -3.64 3.54 -0.04 -1.26 -3.38 135.00 130.31 1blr n PRO 80 Ca 0.01 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.42 1blr n PRO 80 Cb 0.63 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 34.03 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 1.57 1.64 -4.18 0.00 2.85 -0.40 -0.02 118.16 119.62 1blr n LYS 82 Ca -0.10 -0.98 -0.18 0.00 -1.05 0.00 0.00 58.31 56.01 1blr n LYS 82 Cb 0.57 0.27 -0.06 0.00 -0.65 0.00 0.00 35.03 35.16 1blr n LYS 82 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 1blr n SER 83 N -1.11 -1.07 -3.39 -5.58 3.41 -1.05 -1.80 113.62 103.02 1blr n SER 83 Ca -0.05 -3.11 0.02 0.00 -0.26 0.00 0.00 58.87 55.46 1blr n SER 83 Cb 0.17 2.18 -0.04 0.00 -0.26 0.00 0.00 64.21 66.27 1blr n SER 83 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1blr s LEU 84 N 0.00 -0.64 0.23 1.04 0.20 -1.08 -2.09 118.68 116.34 1blr s LEU 84 Ca 0.36 0.82 -0.10 0.00 0.69 0.00 0.00 54.13 55.90 1blr s LEU 84 Cb 0.00 1.71 -0.07 0.00 -0.43 0.00 0.00 46.19 47.40 1blr s LEU 84 CO 0.25 -0.12 0.56 -0.69 -0.29 0.00 0.00 176.35 176.06 1blr s VAL 85 N 2.54 4.92 0.00 1.68 1.01 -1.20 -1.85 120.40 127.50 1blr s VAL 85 Ca -0.02 0.51 0.00 0.00 0.00 0.00 0.00 61.98 62.47 1blr s VAL 85 Cb -0.07 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.69 1blr s VAL 85 CO -0.17 -0.07 0.00 0.29 0.00 0.00 0.00 175.10 175.15 1blr n LYS 86 N -0.12 0.00 -3.95 2.72 4.76 -0.81 -4.53 118.16 116.24 1blr n LYS 86 Ca 0.00 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.21 1blr n LYS 86 Cb 0.52 0.00 -0.05 0.00 -1.84 0.00 0.00 35.03 33.66 1blr n LYS 86 CO 0.00 0.00 0.00 0.91 -1.37 0.00 0.00 177.40 176.94 1blr n TRP 87 N 0.00 0.70 0.11 2.13 7.02 -1.26 -1.83 117.44 124.30 1blr n TRP 87 Ca 0.00 -1.89 0.00 0.00 -1.02 0.00 0.00 57.50 54.59 1blr n TRP 87 Cb 0.00 -0.19 0.00 0.00 -2.42 0.00 0.00 31.31 28.70 1blr n TRP 87 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 1blr n GLU 88 N -0.88 0.00 0.01 -0.99 4.07 0.13 -4.55 120.64 118.43 1blr n GLU 88 Ca -0.13 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.97 1blr n GLU 88 Cb 0.47 -0.04 0.00 0.00 -0.06 0.00 0.00 31.44 31.81 1blr n GLU 88 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 1blr n SER 89 N -3.26 0.20 0.00 4.31 3.41 -1.22 -5.00 113.62 112.05 1blr n SER 89 Ca 0.00 0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 1blr n SER 89 Cb 0.01 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 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 -3.08 0.00 -0.02 4.33 0.28 -1.26 -4.90 120.64 115.98 1blr n GLU 90 Ca 0.00 0.00 0.05 0.00 -0.16 0.00 0.00 57.16 57.05 1blr n GLU 90 Cb 0.39 0.00 0.06 0.00 1.43 0.00 0.00 31.44 33.32 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 2.06 -4.20 -1.84 4.13 -1.26 -4.02 115.26 110.12 1blr n ASN 91 Ca 0.00 -1.53 -0.33 0.00 1.68 0.00 0.00 54.58 54.40 1blr n ASN 91 Cb 0.00 -0.03 -0.16 0.00 -1.54 0.00 0.00 39.78 38.05 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 -0.93 3.09 0.19 3.52 2.36 -1.26 -1.93 119.74 124.78 1blr s LYS 92 Ca 0.14 -0.81 0.05 0.00 -2.55 0.00 0.00 55.97 52.80 1blr s LYS 92 Cb 0.10 -2.52 -0.05 0.00 -1.05 0.00 0.00 37.83 34.31 1blr s LYS 92 CO 0.14 -0.03 -0.09 0.00 1.55 0.00 0.00 175.35 176.93 1blr s MET 93 N 0.87 1.21 0.27 4.03 0.23 -0.39 0.18 119.30 125.70 1blr s MET 93 Ca -0.05 -1.55 0.00 0.00 -1.03 0.00 0.00 55.69 53.06 1blr s MET 93 Cb -0.15 -0.77 -0.00 0.00 -1.53 0.00 0.00 34.83 32.38 1blr s MET 93 CO -0.02 0.06 0.01 1.33 -2.03 0.00 0.00 175.02 174.37 1blr n VAL 94 N -0.31 0.00 -2.73 5.16 0.24 -0.76 -1.40 118.33 118.53 1blr n VAL 94 Ca -0.08 -1.29 -0.06 0.00 -2.04 0.00 0.00 64.34 60.87 1blr n VAL 94 Cb 0.61 0.29 0.04 0.00 -1.47 0.00 0.00 33.84 33.31 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 0.69 3.47 -0.27 0.00 2.12 -0.77 -1.63 118.70 122.31 1blr s GLU 96 Ca 0.29 1.64 -0.10 0.00 0.36 0.00 0.00 54.97 57.16 1blr s GLU 96 Cb 0.14 -4.18 -0.05 0.00 0.26 0.00 0.00 34.13 30.31 1blr s GLU 96 CO -0.14 -1.70 0.17 -0.65 -0.54 0.00 0.00 175.26 172.40 1blr s GLN 97 N 5.43 3.95 0.30 4.30 -0.21 -0.47 -2.63 119.66 130.32 1blr s GLN 97 Ca 0.81 -0.33 0.06 0.00 0.02 0.00 0.00 55.36 55.92 1blr s GLN 97 Cb -0.26 -3.59 -0.06 0.00 1.00 0.00 0.00 33.01 30.11 1blr s GLN 97 CO 0.33 -0.12 -0.02 -1.59 -2.12 0.00 0.00 175.29 171.78 1blr s LYS 98 N 1.55 1.59 -0.62 2.91 -2.85 -0.74 -2.44 119.74 119.15 1blr s LYS 98 Ca 0.07 -1.83 -0.01 0.00 -1.00 0.00 0.00 55.97 53.20 1blr s LYS 98 Cb -0.15 -1.08 0.48 0.00 -2.06 0.00 0.00 37.83 35.01 1blr s LYS 98 CO 0.08 -0.03 1.97 1.47 0.10 0.00 0.00 175.35 178.94 1blr n LEU 99 N -0.62 7.40 -1.47 2.77 -0.00 -1.26 -1.27 117.00 122.54 1blr n LEU 99 Ca -0.05 -4.22 -0.18 0.00 -0.00 0.00 0.00 56.01 51.56 1blr n LEU 99 Cb 0.64 -0.92 -0.08 0.00 -0.00 0.00 0.00 43.42 43.06 1blr n LEU 99 CO 0.41 1.45 -0.17 0.18 -0.00 0.00 0.00 177.39 179.26 1blr n LEU 100 N -0.94 -1.26 0.01 1.47 4.77 -1.26 -4.10 117.00 115.69 1blr n LEU 100 Ca 0.61 0.44 0.00 0.00 -0.03 0.00 0.00 56.01 57.03 1blr n LEU 100 Cb 0.81 -2.60 0.00 0.00 -2.33 0.00 0.00 43.42 39.30 1blr n LEU 100 CO 0.75 -0.97 0.00 1.17 -1.33 0.00 0.00 177.39 177.00 1blr n LYS 101 N -2.10 0.00 0.00 3.23 3.00 -1.26 -5.13 118.16 115.90 1blr n LYS 101 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.13 1blr n LYS 101 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.64 1blr n LYS 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1blr n GLY 102 N -1.23 -0.08 0.08 3.14 0.00 -1.26 -4.99 105.19 100.85 1blr n GLY 102 Ca 0.00 -1.34 -0.10 0.00 0.00 0.00 0.00 46.02 44.58 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 1.08 0.86 0.00 1.61 0.28 -1.26 -5.03 120.64 118.18 1blr n GLU 103 Ca 0.00 0.06 0.00 0.00 -0.16 0.00 0.00 57.16 57.06 1blr n GLU 103 Cb 0.00 -1.33 0.00 0.00 1.43 0.00 0.00 31.44 31.54 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 2.57 -0.26 0.00 -1.84 0.00 -1.26 -5.15 105.19 99.26 1blr n GLY 104 Ca -0.26 0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.05 1.29 -3.75 1.61 -0.04 -1.26 -5.06 135.00 127.74 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 0.32 1.09 0.39 0.54 2.47 -1.26 -4.83 119.74 118.45 1blr s LYS 106 Ca 0.00 -0.62 0.08 0.00 -1.56 0.00 0.00 55.97 53.87 1blr s LYS 106 Cb 0.00 0.36 -0.01 0.00 -1.46 0.00 0.00 37.83 36.72 1blr s LYS 106 CO 0.00 -0.50 0.41 0.95 0.16 0.00 0.00 175.35 176.37 1blr s THR 107 N -2.99 3.11 0.00 3.43 -4.23 -1.02 -1.49 115.64 112.45 1blr s THR 107 Ca 0.14 -1.24 0.00 0.00 -1.18 0.00 0.00 61.69 59.41 1blr s THR 107 Cb -0.01 -3.09 0.00 0.00 1.34 0.00 0.00 72.50 70.74 1blr s THR 107 CO 0.02 -0.06 0.00 -1.54 -0.54 0.00 0.00 174.62 172.50 1blr n SER 108 N -1.58 0.00 -3.60 3.99 3.41 -1.06 -1.37 113.62 113.41 1blr n SER 108 Ca 0.03 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.50 1blr n SER 108 Cb 0.60 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.49 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 -0.63 -0.20 7.33 1.48 -0.64 0.21 118.94 124.49 1blr s TRP 109 Ca 0.00 1.40 -0.01 0.00 -1.06 0.00 0.00 56.10 56.43 1blr s TRP 109 Cb 0.00 0.35 0.05 0.00 -1.16 0.00 0.00 33.47 32.71 1blr s TRP 109 CO 0.00 -0.39 -0.02 0.95 -4.06 0.00 0.00 176.95 173.43 1blr s THR 110 N -0.20 0.98 -0.17 0.66 -4.23 -0.60 0.11 115.64 112.19 1blr s THR 110 Ca -0.02 -0.76 -0.23 0.00 -1.18 0.00 0.00 61.69 59.50 1blr s THR 110 Cb -0.03 -1.31 -0.02 0.00 1.34 0.00 0.00 72.50 72.47 1blr s THR 110 CO 0.01 -0.08 0.74 -0.13 -0.54 0.00 0.00 174.62 174.63 1blr s ARG 111 N 1.66 4.28 0.10 3.99 0.52 -0.50 -2.07 118.95 126.94 1blr s ARG 111 Ca -0.02 0.85 0.07 0.00 -0.52 0.00 0.00 55.73 56.11 1blr s ARG 111 Cb -0.17 -3.56 -0.03 0.00 0.52 0.00 0.00 34.95 31.70 1blr s ARG 111 CO -0.07 -0.26 -0.17 -2.00 0.02 0.00 0.00 175.30 172.82 1blr s GLU 112 N 1.93 1.01 0.38 3.54 2.12 -0.58 -1.26 118.70 125.84 1blr s GLU 112 Ca 0.35 -1.14 0.08 0.00 0.36 0.00 0.00 54.97 54.61 1blr s GLU 112 Cb -0.16 -1.08 -0.03 0.00 0.26 0.00 0.00 34.13 33.12 1blr s GLU 112 CO 0.12 0.24 0.30 -0.51 -0.54 0.00 0.00 175.26 174.87 1blr s LEU 113 N -2.06 3.41 -0.25 2.70 2.01 -0.81 -0.70 118.68 122.98 1blr s LEU 113 Ca 0.05 -0.71 -0.13 0.00 0.01 0.00 0.00 54.13 53.35 1blr s LEU 113 Cb -0.08 -2.00 0.08 0.00 0.01 0.00 0.00 46.19 44.20 1blr s LEU 113 CO 0.04 -0.51 0.60 -0.89 1.01 0.00 0.00 176.35 176.60 1blr s THR 114 N -2.43 -0.14 0.00 5.49 2.01 -1.07 -4.83 115.64 114.66 1blr s THR 114 Ca 0.44 0.03 0.00 0.00 0.31 0.00 0.00 61.69 62.47 1blr s THR 114 Cb -0.03 -0.88 0.00 0.00 0.01 0.00 0.00 72.50 71.60 1blr s THR 114 CO 0.26 0.01 0.00 0.59 -0.69 0.00 0.00 174.62 174.80 1blr n ASN 115 N 4.48 0.00 -1.23 3.53 4.13 -1.26 -2.69 115.26 122.21 1blr n ASN 115 Ca -0.19 0.00 -0.03 0.00 1.68 0.00 0.00 54.58 56.04 1blr n ASN 115 Cb 0.56 0.00 -0.00 0.00 -1.54 0.00 0.00 39.78 38.80 1blr n ASN 115 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1blr n ASP 116 N 2.95 -0.63 0.00 6.41 2.03 -1.26 -4.99 116.55 121.07 1blr n ASP 116 Ca 0.00 -1.28 0.00 0.00 0.52 0.00 0.00 54.79 54.03 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 -0.29 0.00 2.28 0.27 0.00 -1.10 -4.88 105.19 101.47 1blr n GLY 117 Ca -0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.68 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 0.75 -2.59 1.61 1.02 -1.15 -3.90 120.64 116.39 1blr n GLU 118 Ca 0.00 -3.00 -0.42 0.00 -0.02 0.00 0.00 57.16 53.72 1blr n GLU 118 Cb 0.00 -1.29 -0.03 0.00 -0.02 0.00 0.00 31.44 30.10 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 -1.25 3.39 -0.45 -4.62 0.20 -0.60 -2.61 118.68 112.75 1blr s LEU 119 Ca 0.35 -0.12 -0.20 0.00 0.69 0.00 0.00 54.13 54.85 1blr s LEU 119 Cb 0.20 -2.93 0.03 0.00 -0.43 0.00 0.00 46.19 43.05 1blr s LEU 119 CO -0.13 -1.60 0.62 0.27 -0.29 0.00 0.00 176.35 175.23 1blr s ILE 120 N 5.17 4.85 -0.27 6.68 -5.25 0.13 -0.42 121.20 132.09 1blr s ILE 120 Ca 0.39 -0.01 -0.06 0.00 -0.99 0.00 0.00 60.65 59.98 1blr s ILE 120 Cb -0.08 -4.21 0.00 0.00 2.95 0.00 0.00 42.46 41.13 1blr s ILE 120 CO 0.21 -0.61 0.05 -0.22 -1.79 0.00 0.00 174.94 172.58 1blr s LEU 121 N 2.74 3.57 0.29 0.37 1.98 -1.03 -1.52 118.68 125.07 1blr s LEU 121 Ca 0.21 -0.58 0.04 0.00 -2.89 0.00 0.00 54.13 50.90 1blr s LEU 121 Cb -0.15 -1.85 -0.03 0.00 0.66 0.00 0.00 46.19 44.83 1blr s LEU 121 CO 0.17 -0.13 0.44 -0.89 -1.89 0.00 0.00 176.35 174.05 1blr s THR 122 N 1.50 4.99 -0.36 3.68 2.01 -0.88 -3.15 115.64 123.43 1blr s THR 122 Ca 0.04 -0.84 0.07 0.00 0.31 0.00 0.00 61.69 61.27 1blr s THR 122 Cb -0.16 -3.78 0.18 0.00 0.01 0.00 0.00 72.50 68.75 1blr s THR 122 CO 0.01 -0.36 0.59 -0.32 -0.69 0.00 0.00 174.62 173.85 1blr s MET 123 N -4.12 0.71 1.00 4.92 0.00 -0.80 -1.56 119.30 119.45 1blr s MET 123 Ca 0.38 -0.03 -0.12 0.00 0.00 0.00 0.00 55.69 55.91 1blr s MET 123 Cb -0.09 0.08 0.19 0.00 0.00 0.00 0.00 34.83 35.00 1blr s MET 123 CO 0.31 -1.14 1.10 0.95 0.00 0.00 0.00 175.02 176.24 1blr s THR 124 N 2.16 2.02 -0.30 10.11 -4.23 0.13 -2.15 115.64 123.39 1blr s THR 124 Ca 0.14 0.01 -0.12 0.00 -1.18 0.00 0.00 61.69 60.53 1blr s THR 124 Cb -0.07 -2.52 0.18 0.00 1.34 0.00 0.00 72.50 71.43 1blr s THR 124 CO -0.14 -0.01 1.07 0.00 -0.54 0.00 0.00 174.62 175.00 1blr s ALA 125 N -2.99 -3.91 -1.25 3.99 0.00 -0.67 -2.57 121.76 114.36 1blr s ALA 125 Ca 0.65 1.37 -0.02 0.00 0.00 0.00 0.00 51.96 53.96 1blr s ALA 125 Cb -0.18 -2.74 0.00 0.00 0.00 0.00 0.00 23.12 20.20 1blr s ALA 125 CO 0.57 -1.89 0.27 -3.47 0.00 0.00 0.00 175.76 171.24 1blr n ASP 126 N 5.23 -4.89 0.00 0.00 -0.08 -0.56 -2.05 116.55 114.20 1blr n ASP 126 Ca 0.04 -0.13 0.00 0.00 -1.51 0.00 0.00 54.79 53.19 1blr n ASP 126 Cb 0.57 -3.86 0.00 0.00 2.34 0.00 0.00 41.12 40.16 1blr n ASP 126 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1blr n ASP 127 N -1.27 0.00 -4.51 1.67 2.03 -1.25 -4.47 116.55 108.75 1blr n ASP 127 Ca -0.13 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 54.90 1blr n ASP 127 Cb 0.61 0.00 0.13 0.00 -0.72 0.00 0.00 41.12 41.15 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 -2.40 2.08 -0.26 5.18 -7.23 -0.87 -4.78 120.40 112.12 1blr s VAL 128 Ca 0.00 -0.17 -0.04 0.00 -1.81 0.00 0.00 61.98 59.96 1blr s VAL 128 Cb 0.00 -2.91 0.15 0.00 0.56 0.00 0.00 36.38 34.18 1blr s VAL 128 CO 0.00 0.00 0.51 -0.69 -0.31 0.00 0.00 175.10 174.61 1blr s VAL 129 N -3.57 -0.81 -0.84 1.32 1.01 -1.26 -1.67 120.40 114.58 1blr s VAL 129 Ca 0.68 0.01 -0.17 0.00 0.00 0.00 0.00 61.98 62.50 1blr s VAL 129 Cb -0.06 -0.88 0.17 0.00 0.00 0.00 0.00 36.38 35.60 1blr s VAL 129 CO 0.49 -0.03 0.91 0.00 0.00 0.00 0.00 175.10 176.48 1blr s THR 131 N 1.59 4.52 -0.01 0.00 2.01 -1.26 -1.91 115.64 120.57 1blr s THR 131 Ca 0.23 -0.50 0.01 0.00 0.31 0.00 0.00 61.69 61.74 1blr s THR 131 Cb -0.10 -3.33 0.01 0.00 0.01 0.00 0.00 72.50 69.10 1blr s THR 131 CO -0.07 0.04 -0.01 0.00 -0.69 0.00 0.00 174.62 173.89 1blr s ARG 132 N 1.59 0.25 0.55 4.92 1.70 -1.19 -4.40 118.95 122.38 1blr s ARG 132 Ca 0.04 -0.02 -0.16 0.00 -0.47 0.00 0.00 55.73 55.12 1blr s ARG 132 Cb -0.17 -0.33 -0.06 0.00 -0.57 0.00 0.00 34.95 33.82 1blr s ARG 132 CO 0.06 -0.03 1.01 0.08 -1.08 0.00 0.00 175.30 175.34 1blr s VAL 133 N 0.41 4.32 0.28 4.99 1.01 0.61 -2.47 120.40 129.54 1blr s VAL 133 Ca -0.04 1.07 0.02 0.00 0.00 0.00 0.00 61.98 63.03 1blr s VAL 133 Cb -0.07 -3.62 -0.05 0.00 0.00 0.00 0.00 36.38 32.64 1blr s VAL 133 CO -0.01 -0.68 0.10 -0.31 0.00 0.00 0.00 175.10 174.20 1blr s TYR 134 N -2.63 1.62 0.09 5.22 1.51 0.44 -0.42 117.35 123.18 1blr s TYR 134 Ca 0.60 -1.18 -0.03 0.00 -1.01 0.00 0.00 57.07 55.45 1blr s TYR 134 Cb -0.12 -0.96 -0.03 0.00 -0.11 0.00 0.00 41.96 40.74 1blr s TYR 134 CO 0.35 -0.31 0.06 0.08 -1.11 0.00 0.00 175.55 174.63 1blr s VAL 135 N -3.65 0.16 -0.29 0.71 1.01 -1.12 -1.55 120.40 115.66 1blr s VAL 135 Ca 0.37 -1.68 -0.27 0.00 0.00 0.00 0.00 61.98 60.40 1blr s VAL 135 Cb 0.07 -1.66 0.01 0.00 0.00 0.00 0.00 36.38 34.80 1blr s VAL 135 CO 0.14 -0.72 0.94 -0.13 0.00 0.00 0.00 175.10 175.33 1blr s ARG 136 N -3.95 4.07 0.00 2.72 0.52 -1.25 -1.61 118.95 119.45 1blr s ARG 136 Ca 0.12 0.92 0.00 0.00 -0.52 0.00 0.00 55.73 56.26 1blr s ARG 136 Cb 0.07 -3.71 0.00 0.00 0.52 0.00 0.00 34.95 31.83 1blr s ARG 136 CO -0.06 -0.74 0.35 -1.91 0.02 0.00 0.00 175.30 172.95