#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 0.87 0.03 3.54 3.02 -1.26 -4.80 115.26 116.66 1blr n ASN 2 Ca 0.00 -2.28 0.11 0.00 -0.03 0.00 0.00 54.58 52.39 1blr n ASN 2 Cb 0.00 -0.30 0.01 0.00 -0.61 0.00 0.00 39.78 38.87 1blr n ASN 2 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1blr n PHE 3 N 0.07 0.31 -1.75 3.10 3.01 -1.26 -4.88 117.46 116.06 1blr n PHE 3 Ca 0.06 0.09 -0.43 0.00 1.01 0.00 0.00 57.45 58.19 1blr n PHE 3 Cb 0.94 -0.48 -0.03 0.00 -0.01 0.00 0.00 39.48 39.90 1blr n PHE 3 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1blr s SER 4 N -4.09 5.91 0.00 4.37 1.04 -1.26 -4.62 113.70 115.05 1blr s SER 4 Ca 0.02 1.99 0.00 0.00 0.48 0.00 0.00 55.95 58.44 1blr s SER 4 Cb 0.14 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.74 1blr s SER 4 CO 0.81 -1.58 0.00 0.61 0.98 0.00 0.00 173.24 174.06 1blr n GLY 5 N 5.22 3.95 3.81 7.32 0.00 -0.88 -5.00 105.19 119.62 1blr n GLY 5 Ca 0.25 -1.03 -0.33 0.00 0.00 0.00 0.00 46.02 44.90 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 6.63 -0.06 1.61 3.84 -1.26 -2.11 114.94 123.59 1blr s ASN 6 Ca 0.00 1.78 0.03 0.00 0.21 0.00 0.00 52.86 54.88 1blr s ASN 6 Cb 0.00 -2.55 0.00 0.00 -0.55 0.00 0.00 41.25 38.16 1blr s ASN 6 CO 0.00 -0.58 -0.15 0.26 -2.79 0.00 0.00 177.10 173.83 1blr s TRP 7 N -2.15 1.65 0.03 0.43 0.52 -0.98 -2.18 118.94 116.25 1blr s TRP 7 Ca 0.64 -0.54 -0.10 0.00 0.02 0.00 0.00 56.10 56.11 1blr s TRP 7 Cb -0.12 -1.14 -0.05 0.00 -1.15 0.00 0.00 33.47 31.00 1blr s TRP 7 CO 0.18 -0.23 0.36 0.15 0.02 0.00 0.00 176.95 177.43 1blr s LYS 8 N 0.30 3.75 0.45 4.98 -0.14 -0.71 -3.14 119.74 125.23 1blr s LYS 8 Ca -0.09 0.18 -0.24 0.00 -1.36 0.00 0.00 55.97 54.45 1blr s LYS 8 Cb -0.13 -3.10 -0.08 0.00 -1.68 0.00 0.00 37.83 32.84 1blr s LYS 8 CO 0.03 0.63 1.31 -1.50 -0.76 0.00 0.00 175.35 175.07 1blr s ILE 9 N -1.25 2.51 -0.21 2.17 -1.16 -1.26 -2.73 121.20 119.26 1blr s ILE 9 Ca 0.28 0.43 -0.04 0.00 -0.51 0.00 0.00 60.65 60.81 1blr s ILE 9 Cb -0.14 -3.24 0.11 0.00 0.61 0.00 0.00 42.46 39.80 1blr s ILE 9 CO 0.15 0.04 0.33 -0.63 -2.81 0.00 0.00 174.94 172.01 1blr s ILE 10 N -1.31 -0.51 0.40 2.00 1.09 0.11 -4.87 121.20 118.10 1blr s ILE 10 Ca 0.62 -0.02 0.00 0.00 -1.10 0.00 0.00 60.65 60.15 1blr s ILE 10 Cb -0.38 -0.72 0.00 0.00 -1.06 0.00 0.00 42.46 40.30 1blr s ILE 10 CO 0.47 -0.10 0.00 -1.14 -0.10 0.00 0.00 174.94 174.08 1blr n ARG 11 N 5.35 -3.82 -3.63 2.79 0.00 -1.26 -1.42 116.66 114.67 1blr n ARG 11 Ca -0.05 2.82 -0.12 0.00 -0.00 0.00 0.00 57.85 60.51 1blr n ARG 11 Cb 0.50 -3.16 -0.07 0.00 0.00 0.00 0.00 32.46 29.73 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 -2.82 -0.74 -0.30 6.15 0.15 -1.26 -3.29 113.70 111.59 1blr s SER 12 Ca 0.00 1.38 -0.18 0.00 0.70 0.00 0.00 55.95 57.85 1blr s SER 12 Cb 0.00 1.38 0.18 0.00 -1.71 0.00 0.00 66.02 65.86 1blr s SER 12 CO 0.00 -0.23 1.23 -0.70 1.20 0.00 0.00 173.24 174.73 1blr s GLU 13 N 0.61 0.01 0.00 5.44 2.12 -1.26 -5.04 118.70 120.58 1blr s GLU 13 Ca -0.02 0.01 0.00 0.00 0.36 0.00 0.00 54.97 55.33 1blr s GLU 13 Cb -0.05 0.01 0.00 0.00 0.26 0.00 0.00 34.13 34.35 1blr s GLU 13 CO -0.04 -0.01 0.00 0.09 -0.54 0.00 0.00 175.26 174.75 1blr n ASN 14 N 5.27 0.00 -0.29 -1.70 4.13 -1.26 -4.69 115.26 116.72 1blr n ASN 14 Ca -0.00 0.00 0.03 0.00 1.68 0.00 0.00 54.58 56.29 1blr n ASN 14 Cb 0.57 0.00 0.11 0.00 -1.54 0.00 0.00 39.78 38.92 1blr n ASN 14 CO 0.00 0.00 0.00 0.15 0.28 0.00 0.00 177.26 177.69 1blr h PHE 15 N 0.00 -0.41 -0.23 3.10 3.04 -1.96 0.48 116.94 120.96 1blr h PHE 15 Ca 0.00 0.07 -0.14 0.00 3.98 0.00 0.00 57.97 61.88 1blr h PHE 15 Cb 0.00 0.31 -0.01 0.00 2.56 0.00 0.00 35.95 38.81 1blr h PHE 15 CO 0.00 -0.35 -0.44 0.93 -2.02 0.00 0.00 178.31 176.42 1blr h GLU 16 N 0.00 0.57 -0.00 1.11 3.07 -1.95 -1.71 114.58 115.67 1blr h GLU 16 Ca 0.40 -0.31 0.00 0.00 -0.50 0.00 0.00 59.36 58.95 1blr h GLU 16 Cb 0.63 0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.55 1blr h GLU 16 CO -0.84 0.90 0.00 0.93 -1.40 0.00 0.00 179.01 178.60 1blr h GLU 17 N 0.46 0.00 0.05 2.33 4.39 -0.53 -0.06 114.58 121.21 1blr h GLU 17 Ca 0.03 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.63 1blr h GLU 17 Cb 0.96 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.62 1blr h GLU 17 CO 0.09 0.00 -0.44 -0.07 -1.16 0.00 0.00 179.01 177.43 1blr h LEU 18 N 0.00 0.31 -0.27 1.33 3.38 -0.01 -2.11 115.31 117.94 1blr h LEU 18 Ca 0.00 -0.87 0.00 0.00 0.09 0.00 0.00 57.88 57.10 1blr h LEU 18 Cb 0.00 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1blr h LEU 18 CO -0.00 1.15 0.00 0.18 0.09 0.00 0.00 178.44 179.86 1blr n LEU 19 N -4.36 0.41 -0.05 1.67 7.99 -0.72 -1.73 117.00 120.22 1blr n LEU 19 Ca -0.11 -0.17 -0.01 0.00 -0.01 0.00 0.00 56.01 55.71 1blr n LEU 19 Cb 0.63 -0.02 -0.12 0.00 -0.11 0.00 0.00 43.42 43.80 1blr n LEU 19 CO 0.42 0.08 -0.87 0.29 -1.51 0.00 0.00 177.39 175.80 1blr n LYS 20 N -0.55 1.09 -0.08 3.23 5.02 -0.12 -3.48 118.16 123.27 1blr n LYS 20 Ca 0.16 -0.07 -0.10 0.00 -2.02 0.00 0.00 58.31 56.29 1blr n LYS 20 Cb 0.14 -1.39 -0.16 0.00 -0.02 0.00 0.00 35.03 33.60 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 -2.36 1.43 0.26 -0.18 0.24 -0.80 -3.87 118.33 113.06 1blr n VAL 21 Ca -0.16 -0.85 0.16 0.00 -2.04 0.00 0.00 64.34 61.46 1blr n VAL 21 Cb 0.76 -0.58 0.81 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 -1.54 -3.45 115.31 111.66 1blr h LEU 22 Ca -0.49 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.39 1blr h LEU 22 Cb 2.20 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.86 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 -0.93 0.72 3.51 0.17 0.00 -1.26 -5.07 105.19 102.34 1blr n GLY 23 Ca -0.01 -0.65 -0.44 0.00 0.00 0.00 0.00 46.02 44.92 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 1.96 0.00 1.61 3.14 -1.23 -4.91 118.33 118.90 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 -0.68 0.00 0.00 -1.06 0.00 0.00 33.84 32.10 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 1.31 0.00 0.00 6.55 2.85 -1.26 -4.89 115.26 119.82 1blr n ASN 25 Ca 0.12 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.59 1blr n ASN 25 Cb 0.34 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.36 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 0.24 3.44 0.31 -1.26 -4.87 118.33 116.19 1blr n VAL 26 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.18 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 -0.58 -6.01 5.55 2.86 -1.90 -3.46 114.93 113.77 1blr h MET 27 Ca 0.00 0.04 -0.30 0.00 -2.06 0.00 0.00 59.70 57.38 1blr h MET 27 Cb 0.00 0.13 0.06 0.00 0.06 0.00 0.00 31.60 31.85 1blr h MET 27 CO 0.00 -0.30 -0.69 1.28 1.06 0.00 0.00 176.91 178.26 1blr n LEU 28 N -5.27 -4.05 -1.83 1.22 7.99 -1.26 0.16 117.00 113.95 1blr n LEU 28 Ca -0.11 -0.71 -0.19 0.00 -0.01 0.00 0.00 56.01 55.00 1blr n LEU 28 Cb 0.29 -2.58 -0.06 0.00 -0.11 0.00 0.00 43.42 40.96 1blr n LEU 28 CO 0.33 -0.04 -0.20 0.54 -1.51 0.00 0.00 177.39 176.51 1blr n ARG 29 N -3.07 -1.54 -3.46 3.23 1.74 -1.26 -3.38 116.66 108.91 1blr n ARG 29 Ca -0.11 1.05 -0.33 0.00 -0.77 0.00 0.00 57.85 57.69 1blr n ARG 29 Cb 0.59 -5.50 0.03 0.00 -1.02 0.00 0.00 32.46 26.56 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 -2.48 -1.68 -0.26 5.56 5.02 0.12 -4.70 118.16 119.75 1blr n LYS 30 Ca -0.20 1.33 0.32 0.00 -2.02 0.00 0.00 58.31 57.74 1blr n LYS 30 Cb 0.64 -1.89 0.62 0.00 -0.02 0.00 0.00 35.03 34.37 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 2.33 0.13 0.00 -0.18 2.04 -1.54 -2.78 117.51 117.51 1blr h ILE 31 Ca -0.48 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.38 1blr h ILE 31 Cb 1.35 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.62 1blr h ILE 31 CO 0.19 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.34 1blr n ALA 32 N -2.46 -0.03 -1.46 1.87 0.00 -1.26 -5.05 120.51 112.12 1blr n ALA 32 Ca 0.24 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.82 1blr n ALA 32 Cb 1.40 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.78 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 -0.91 -1.38 -2.69 0.00 0.31 -1.05 -4.92 118.33 107.67 1blr n VAL 33 Ca 0.00 1.07 -0.06 0.00 -0.01 0.00 0.00 64.34 65.33 1blr n VAL 33 Cb 0.00 -1.65 0.09 0.00 -0.91 0.00 0.00 33.84 31.36 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 -3.94 2.27 0.86 3.52 0.00 -1.26 -4.93 120.51 117.03 1blr n ALA 34 Ca -0.07 -1.99 0.10 0.00 0.00 0.00 0.00 53.44 51.47 1blr n ALA 34 Cb 0.64 -0.95 0.48 0.00 0.00 0.00 0.00 19.45 19.62 1blr n ALA 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1blr n ALA 35 N -0.53 2.01 -1.31 0.00 0.00 -1.26 -4.94 120.51 114.47 1blr n ALA 35 Ca 0.00 -0.09 0.16 0.00 0.00 0.00 0.00 53.44 53.51 1blr n ALA 35 Cb 0.84 -1.32 -0.09 0.00 0.00 0.00 0.00 19.45 18.88 1blr n ALA 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1blr n ALA 36 N -1.35 -3.42 -1.42 0.00 0.00 -1.26 -4.54 120.51 108.51 1blr n ALA 36 Ca 0.08 0.86 -0.29 0.00 0.00 0.00 0.00 53.44 54.09 1blr n ALA 36 Cb 0.18 -1.44 0.10 0.00 0.00 0.00 0.00 19.45 18.29 1blr n ALA 36 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1blr n SER 37 N -4.11 6.06 -2.67 0.00 7.64 -1.26 -4.58 113.62 114.70 1blr n SER 37 Ca -0.09 -3.75 -0.04 0.00 1.01 0.00 0.00 58.87 56.00 1blr n SER 37 Cb 0.62 -0.83 0.10 0.00 -1.01 0.00 0.00 64.21 63.09 1blr n SER 37 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1blr n LYS 38 N -0.96 0.24 -1.99 1.43 4.81 -1.26 -5.16 118.16 115.28 1blr n LYS 38 Ca 0.57 -0.85 -0.32 0.00 -0.87 0.00 0.00 58.31 56.84 1blr n LYS 38 Cb 0.94 -0.31 0.01 0.00 0.02 0.00 0.00 35.03 35.69 1blr n LYS 38 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1blr s PRO 39 N 0.11 3.53 0.02 1.64 0.04 -1.26 -4.78 135.00 134.30 1blr s PRO 39 Ca 0.23 0.92 -0.27 0.00 0.04 0.00 0.00 61.00 61.91 1blr s PRO 39 Cb 0.26 -2.07 0.09 0.00 0.04 0.00 0.00 34.50 32.83 1blr s PRO 39 CO -0.15 -0.62 1.24 0.00 0.04 0.00 0.00 177.00 177.50 1blr s ALA 40 N -2.89 -2.28 0.30 8.56 0.00 -1.22 -4.40 121.76 119.83 1blr s ALA 40 Ca 0.58 -0.02 -0.19 0.00 0.00 0.00 0.00 51.96 52.32 1blr s ALA 40 Cb -0.12 0.85 0.04 0.00 0.00 0.00 0.00 23.12 23.89 1blr s ALA 40 CO 0.45 -1.13 0.80 0.54 0.00 0.00 0.00 175.76 176.42 1blr s VAL 41 N -2.06 0.00 -0.24 0.00 0.11 -1.19 -2.06 120.40 114.96 1blr s VAL 41 Ca 0.27 -0.93 -0.04 0.00 -2.93 0.00 0.00 61.98 58.35 1blr s VAL 41 Cb -0.01 -2.41 0.13 0.00 -1.53 0.00 0.00 36.38 32.56 1blr s VAL 41 CO 0.00 0.00 0.44 -1.83 -3.33 0.00 0.00 175.10 170.39 1blr s GLU 42 N -3.09 0.39 -0.06 1.54 -1.05 -1.00 -2.32 118.70 113.11 1blr s GLU 42 Ca 0.14 0.84 -0.06 0.00 -0.15 0.00 0.00 54.97 55.74 1blr s GLU 42 Cb -0.05 0.05 -0.04 0.00 -0.44 0.00 0.00 34.13 33.65 1blr s GLU 42 CO 0.08 -0.47 0.19 0.42 0.95 0.00 0.00 175.26 176.43 1blr s ILE 43 N 2.64 5.42 -0.11 1.83 1.01 -0.90 -2.36 121.20 128.74 1blr s ILE 43 Ca 0.08 0.14 -0.03 0.00 0.00 0.00 0.00 60.65 60.84 1blr s ILE 43 Cb -0.14 -3.49 0.04 0.00 0.01 0.00 0.00 42.46 38.89 1blr s ILE 43 CO -0.16 0.49 0.05 -0.54 0.00 0.00 0.00 174.94 174.78 1blr s LYS 44 N -1.42 0.23 0.02 2.79 1.02 -0.94 -2.08 119.74 119.37 1blr s LYS 44 Ca 0.21 0.07 -0.05 0.00 0.02 0.00 0.00 55.97 56.22 1blr s LYS 44 Cb -0.13 -1.23 -0.01 0.00 -0.52 0.00 0.00 37.83 35.94 1blr s LYS 44 CO 0.11 -0.47 0.07 1.14 -0.92 0.00 0.00 175.35 175.29 1blr s GLN 45 N 2.07 0.47 -0.51 1.68 1.03 -1.26 -0.05 119.66 123.09 1blr s GLN 45 Ca 0.03 -0.58 0.03 0.00 0.04 0.00 0.00 55.36 54.89 1blr s GLN 45 Cb -0.14 0.18 0.16 0.00 0.03 0.00 0.00 33.01 33.24 1blr s GLN 45 CO -0.06 -0.10 0.34 -2.00 -2.54 0.00 0.00 175.29 170.93 1blr s GLU 46 N -1.80 1.51 6.03 9.60 2.12 -0.56 -4.89 118.70 130.72 1blr s GLU 46 Ca -0.12 -2.43 0.00 0.00 0.36 0.00 0.00 54.97 52.78 1blr s GLU 46 Cb -0.06 -2.37 0.00 0.00 0.26 0.00 0.00 34.13 31.96 1blr s GLU 46 CO -0.01 -1.27 0.00 0.41 -0.54 0.00 0.00 175.26 173.85 1blr n GLY 47 N 2.87 0.42 0.00 -1.50 0.00 -1.26 -3.11 105.19 102.61 1blr n GLY 47 Ca 0.18 -0.70 0.14 0.00 0.00 0.00 0.00 46.02 45.64 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 7.02 0.00 -4.79 1.61 5.68 -1.26 -4.74 116.55 120.07 1blr n ASP 48 Ca 0.00 -0.40 -0.39 0.00 -0.50 0.00 0.00 54.79 53.50 1blr n ASP 48 Cb 0.00 -0.17 -0.06 0.00 -1.14 0.00 0.00 41.12 39.75 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 -2.35 4.87 0.05 2.12 2.01 -1.18 -0.85 115.64 120.30 1blr s THR 49 Ca 0.32 1.15 -0.01 0.00 0.31 0.00 0.00 61.69 63.46 1blr s THR 49 Cb 0.19 -3.87 -0.04 0.00 0.01 0.00 0.00 72.50 68.78 1blr s THR 49 CO 0.38 0.50 -0.03 -0.36 -0.69 0.00 0.00 174.62 174.41 1blr s PHE 50 N -0.69 0.50 0.02 4.92 0.40 -0.63 -1.49 117.98 121.01 1blr s PHE 50 Ca 0.29 -0.97 0.02 0.00 -0.60 0.00 0.00 56.93 55.66 1blr s PHE 50 Cb -0.18 -0.37 -0.01 0.00 0.51 0.00 0.00 43.02 42.97 1blr s PHE 50 CO 0.17 -0.34 -0.06 -0.47 0.70 0.00 0.00 175.22 175.23 1blr s TYR 51 N -3.51 0.49 -0.18 0.36 6.14 0.93 -1.89 117.35 119.69 1blr s TYR 51 Ca 0.04 -0.28 -0.04 0.00 0.64 0.00 0.00 57.07 57.43 1blr s TYR 51 Cb 0.05 -0.31 0.08 0.00 0.42 0.00 0.00 41.96 42.21 1blr s TYR 51 CO -0.08 -0.05 0.21 0.42 0.64 0.00 0.00 175.55 176.68 1blr s ILE 52 N -0.72 -0.30 -0.48 3.14 1.01 -1.04 -2.20 121.20 120.61 1blr s ILE 52 Ca -0.04 -0.05 -0.00 0.00 0.00 0.00 0.00 60.65 60.56 1blr s ILE 52 Cb -0.06 -0.62 0.13 0.00 0.01 0.00 0.00 42.46 41.93 1blr s ILE 52 CO -0.00 -0.16 0.26 -0.75 0.00 0.00 0.00 174.94 174.29 1blr s LYS 53 N 2.31 2.07 -0.41 2.79 2.36 -0.99 -1.89 119.74 125.98 1blr s LYS 53 Ca 0.06 -2.20 -0.25 0.00 -2.55 0.00 0.00 55.97 51.02 1blr s LYS 53 Cb -0.15 -3.51 0.02 0.00 -1.05 0.00 0.00 37.83 33.14 1blr s LYS 53 CO -0.11 -1.09 0.91 0.99 1.55 0.00 0.00 175.35 177.60 1blr s THR 54 N 0.46 4.56 -0.83 3.43 2.01 -1.24 -2.37 115.64 121.65 1blr s THR 54 Ca 0.13 0.96 -0.04 0.00 0.31 0.00 0.00 61.69 63.04 1blr s THR 54 Cb -0.22 -4.36 0.21 0.00 0.01 0.00 0.00 72.50 68.14 1blr s THR 54 CO -0.04 -0.65 0.72 -0.94 -0.69 0.00 0.00 174.62 173.01 1blr s SER 55 N 2.04 6.00 -0.12 3.53 1.04 -0.87 -4.26 113.70 121.07 1blr s SER 55 Ca 0.37 -3.34 0.19 0.00 0.48 0.00 0.00 55.95 53.65 1blr s SER 55 Cb -0.11 -1.96 -0.27 0.00 0.10 0.00 0.00 66.02 63.78 1blr s SER 55 CO 0.22 -0.29 0.28 1.07 0.98 0.00 0.00 173.24 175.49 1blr n THR 56 N 2.89 0.96 -1.81 2.02 5.66 -1.26 -3.41 114.28 119.33 1blr n THR 56 Ca 0.17 -0.73 0.00 0.00 -3.05 0.00 0.00 64.05 60.43 1blr n THR 56 Cb 0.39 -0.36 0.00 0.00 -1.55 0.00 0.00 70.33 68.80 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 -2.62 0.00 0.28 1.09 -1.04 -1.26 -4.61 114.28 106.11 1blr n THR 57 Ca -0.22 0.00 0.15 0.00 -2.04 0.00 0.00 64.05 61.95 1blr n THR 57 Cb 0.95 0.00 0.90 0.00 -1.82 0.00 0.00 70.33 70.36 1blr n THR 57 CO 0.00 0.00 0.00 -0.37 -0.64 0.00 0.00 175.07 174.06 1blr h VAL 58 N 0.00 0.51 -3.27 12.58 -1.51 -1.98 -3.32 116.25 119.26 1blr h VAL 58 Ca 0.00 0.00 -0.75 0.00 -1.23 0.00 0.00 66.70 64.72 1blr h VAL 58 Cb 0.00 0.97 -0.23 0.00 -2.13 0.00 0.00 31.29 29.90 1blr h VAL 58 CO 0.00 0.00 0.32 -0.13 -1.23 0.00 0.00 177.57 176.53 1blr s ARG 59 N -4.63 3.54 -0.01 5.19 1.81 -1.26 -4.85 118.95 118.73 1blr s ARG 59 Ca -0.05 -2.12 -0.01 0.00 -1.72 0.00 0.00 55.73 51.83 1blr s ARG 59 Cb 0.15 -4.57 -0.00 0.00 -0.45 0.00 0.00 34.95 30.08 1blr s ARG 59 CO 0.55 -1.47 -0.02 2.41 -0.68 0.00 0.00 175.30 176.09 1blr n THR 60 N 4.63 0.11 -1.33 0.02 -1.04 -1.25 -4.55 114.28 110.88 1blr n THR 60 Ca 0.14 0.47 0.08 0.00 -2.04 0.00 0.00 64.05 62.70 1blr n THR 60 Cb 0.47 -1.57 -0.04 0.00 -1.82 0.00 0.00 70.33 67.37 1blr n THR 60 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1blr n THR 61 N -2.61 -1.72 -3.75 12.58 -1.04 -1.26 -4.37 114.28 112.11 1blr n THR 61 Ca -0.01 1.07 -0.13 0.00 -2.04 0.00 0.00 64.05 62.94 1blr n THR 61 Cb 0.04 -1.71 -0.13 0.00 -1.82 0.00 0.00 70.33 66.70 1blr n THR 61 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1blr s GLU 62 N -4.72 0.20 -0.60 -2.82 8.01 -1.26 -3.62 118.70 113.89 1blr s GLU 62 Ca 0.00 0.44 -0.20 0.00 0.01 0.00 0.00 54.97 55.22 1blr s GLU 62 Cb 0.00 -0.05 0.09 0.00 -4.31 0.00 0.00 34.13 29.86 1blr s GLU 62 CO 0.00 -0.12 0.76 0.96 0.01 0.00 0.00 175.26 176.87 1blr s ILE 63 N 0.89 4.71 -1.15 -1.63 -4.36 -0.79 -4.88 121.20 113.99 1blr s ILE 63 Ca -0.06 -0.77 -0.12 0.00 -0.26 0.00 0.00 60.65 59.43 1blr s ILE 63 Cb -0.08 -4.51 0.22 0.00 1.25 0.00 0.00 42.46 39.33 1blr s ILE 63 CO -0.05 -1.17 1.27 0.20 0.24 0.00 0.00 174.94 175.43 1blr s ASN 64 N 3.52 7.16 0.00 4.36 0.02 -1.26 -2.49 114.94 126.24 1blr s ASN 64 Ca 0.15 -3.21 0.00 0.00 -1.02 0.00 0.00 52.86 48.78 1blr s ASN 64 Cb -0.22 -2.31 0.00 0.00 0.02 0.00 0.00 41.25 38.74 1blr s ASN 64 CO 0.08 -0.56 0.00 2.22 0.02 0.00 0.00 177.10 178.86 1blr n PHE 65 N 4.38 -0.00 -3.64 2.20 -1.74 -0.79 -4.99 117.46 112.87 1blr n PHE 65 Ca 0.30 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 57.09 1blr n PHE 65 Cb 0.42 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 41.31 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 0.64 0.28 0.29 3.97 0.00 -1.26 -1.60 119.74 122.06 1blr s LYS 66 Ca 0.00 0.94 -0.26 0.00 0.00 0.00 0.00 55.97 56.65 1blr s LYS 66 Cb 0.00 0.20 -0.16 0.00 0.00 0.00 0.00 37.83 37.88 1blr s LYS 66 CO 0.00 -0.28 0.53 0.28 0.00 0.00 0.00 175.35 175.88 1blr n VAL 67 N 5.38 1.72 0.00 1.79 0.31 -0.03 -3.20 118.33 124.30 1blr n VAL 67 Ca -0.08 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.75 1blr n VAL 67 Cb 0.49 -0.26 0.00 0.00 -0.91 0.00 0.00 33.84 33.16 1blr n VAL 67 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1blr n GLY 68 N 1.89 1.08 3.40 2.92 0.00 -1.06 -4.92 105.19 108.50 1blr n GLY 68 Ca 0.14 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.71 1.88 0.37 1.61 4.04 -1.19 -5.04 118.70 119.65 1blr s GLU 69 Ca 0.00 -1.91 0.07 0.00 0.04 0.00 0.00 54.97 53.17 1blr s GLU 69 Cb 0.00 0.39 -0.07 0.00 0.02 0.00 0.00 34.13 34.47 1blr s GLU 69 CO 0.00 -0.75 -0.01 -1.83 -1.84 0.00 0.00 175.26 170.84 1blr s GLU 70 N -3.16 1.84 0.14 -4.83 1.03 -1.26 -2.77 118.70 109.70 1blr s GLU 70 Ca 0.35 -2.02 0.00 0.00 0.03 0.00 0.00 54.97 53.34 1blr s GLU 70 Cb 0.01 -1.48 -0.00 0.00 -0.80 0.00 0.00 34.13 31.86 1blr s GLU 70 CO 0.25 -0.03 0.01 1.19 -1.33 0.00 0.00 175.26 175.35 1blr n PHE 71 N -0.85 0.27 -4.24 4.83 3.72 -0.84 -4.94 117.46 115.41 1blr n PHE 71 Ca -0.05 -0.74 -0.16 0.00 -0.05 0.00 0.00 57.45 56.45 1blr n PHE 71 Cb 0.66 -0.07 -0.11 0.00 -0.94 0.00 0.00 39.48 39.02 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 -2.52 1.02 0.10 -1.08 2.02 -1.26 -2.51 118.70 114.46 1blr s GLU 72 Ca 0.02 -1.30 -0.14 0.00 0.02 0.00 0.00 54.97 53.57 1blr s GLU 72 Cb 0.00 -0.76 0.05 0.00 0.10 0.00 0.00 34.13 33.52 1blr s GLU 72 CO 0.01 0.13 0.66 -1.91 0.02 0.00 0.00 175.26 174.17 1blr n GLU 73 N 0.28 0.36 -4.27 1.61 2.13 0.93 -4.86 120.64 116.83 1blr n GLU 73 Ca -0.14 -0.86 -0.18 0.00 0.66 0.00 0.00 57.16 56.64 1blr n GLU 73 Cb 0.58 1.18 -0.15 0.00 0.27 0.00 0.00 31.44 33.33 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 -2.03 0.69 0.00 5.31 -0.21 -1.24 -1.76 119.66 120.43 1blr s GLN 74 Ca 0.15 -0.23 0.00 0.00 0.02 0.00 0.00 55.36 55.29 1blr s GLN 74 Cb -0.02 -0.67 0.00 0.00 1.00 0.00 0.00 33.01 33.32 1blr s GLN 74 CO 0.03 0.10 0.00 2.41 -2.12 0.00 0.00 175.29 175.71 1blr n THR 75 N 3.20 0.00 -0.02 -0.19 -1.04 -1.21 -4.83 114.28 110.19 1blr n THR 75 Ca -0.17 0.00 -0.00 0.00 -2.04 0.00 0.00 64.05 61.84 1blr n THR 75 Cb 0.56 -1.02 -0.00 0.00 -1.82 0.00 0.00 70.33 68.04 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 -0.71 0.00 -2.22 12.58 2.07 -1.98 -3.47 116.25 122.52 1blr h VAL 76 Ca 0.00 -0.42 -0.25 0.00 0.82 0.00 0.00 66.70 66.85 1blr h VAL 76 Cb 0.00 0.00 -0.33 0.00 -1.52 0.00 0.00 31.29 29.44 1blr h VAL 76 CO 0.00 0.00 -0.57 -0.62 0.02 0.00 0.00 177.57 176.40 1blr s ASP 77 N -4.09 0.98 0.00 0.57 2.15 -1.26 -5.02 116.67 109.99 1blr s ASP 77 Ca -0.00 -0.13 0.00 0.00 0.43 0.00 0.00 52.55 52.84 1blr s ASP 77 Cb 0.00 0.68 0.00 0.00 -0.30 0.00 0.00 42.92 43.31 1blr s ASP 77 CO 0.01 -0.33 0.00 0.61 -0.17 0.00 0.00 175.17 175.29 1blr n GLY 78 N 5.34 -0.92 3.54 2.66 0.00 -1.26 -5.13 105.19 109.42 1blr n GLY 78 Ca -0.04 0.34 -0.25 0.00 0.00 0.00 0.00 46.02 46.06 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 1.84 0.00 1.61 3.00 -1.26 -5.09 118.95 119.05 1blr s ARG 79 Ca 0.00 -2.06 0.00 0.00 0.00 0.00 0.00 55.73 53.67 1blr s ARG 79 Cb 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 34.95 33.85 1blr s ARG 79 CO 0.00 -0.22 0.00 -0.35 0.00 0.00 0.00 175.30 174.73 1blr n PRO 80 N -0.86 -0.23 -3.65 3.54 -0.04 -1.26 -3.28 135.00 129.22 1blr n PRO 80 Ca -0.05 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.37 1blr n PRO 80 Cb 0.66 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 34.06 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 1.58 1.45 -4.19 0.00 2.85 -0.35 -0.05 118.16 119.46 1blr n LYS 82 Ca -0.10 -1.34 -0.17 0.00 -1.05 0.00 0.00 58.31 55.65 1blr n LYS 82 Cb 0.57 0.30 -0.06 0.00 -0.65 0.00 0.00 35.03 35.19 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 -2.08 1.22 -0.30 -5.58 1.04 -1.05 -1.78 113.70 105.18 1blr s SER 83 Ca 0.03 -1.61 -0.12 0.00 0.48 0.00 0.00 55.95 54.73 1blr s SER 83 Cb -0.00 0.60 0.16 0.00 0.10 0.00 0.00 66.02 66.87 1blr s SER 83 CO 0.02 -1.16 0.88 -0.22 0.98 0.00 0.00 173.24 173.74 1blr s LEU 84 N -3.30 -0.78 0.17 2.42 0.20 -1.05 -1.98 118.68 114.37 1blr s LEU 84 Ca 0.36 0.93 -0.14 0.00 0.69 0.00 0.00 54.13 55.97 1blr s LEU 84 Cb 0.01 1.83 -0.07 0.00 -0.43 0.00 0.00 46.19 47.53 1blr s LEU 84 CO 0.23 -0.15 0.56 -0.69 -0.29 0.00 0.00 176.35 176.02 1blr s VAL 85 N 2.65 4.84 0.00 1.68 1.01 -1.11 -1.73 120.40 127.74 1blr s VAL 85 Ca -0.01 0.81 0.00 0.00 0.00 0.00 0.00 61.98 62.78 1blr s VAL 85 Cb -0.09 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.57 1blr s VAL 85 CO -0.17 0.19 0.00 1.17 0.00 0.00 0.00 175.10 176.28 1blr n LYS 86 N 0.64 0.00 -3.90 2.72 3.00 -0.84 -2.57 118.16 117.21 1blr n LYS 86 Ca -0.04 0.00 -0.22 0.00 -0.00 0.00 0.00 58.31 58.05 1blr n LYS 86 Cb 0.52 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.50 1blr n LYS 86 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.40 178.31 1blr n TRP 87 N 0.00 0.54 0.08 5.64 7.02 -1.26 -1.93 117.44 127.52 1blr n TRP 87 Ca 0.00 -1.90 0.00 0.00 -1.02 0.00 0.00 57.50 54.58 1blr n TRP 87 Cb 0.00 -0.14 0.00 0.00 -2.42 0.00 0.00 31.31 28.75 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 -0.83 0.00 0.01 -0.99 4.07 0.14 -4.58 120.64 118.47 1blr n GLU 88 Ca -0.11 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.99 1blr n GLU 88 Cb 0.47 -0.07 0.00 0.00 -0.06 0.00 0.00 31.44 31.78 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 -3.09 0.20 0.00 4.31 3.41 -1.23 -5.01 113.62 112.22 1blr n SER 89 Ca 0.00 0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 1blr n SER 89 Cb 0.03 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 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 -3.05 0.00 -0.05 4.33 0.28 -1.26 -4.90 120.64 115.99 1blr n GLU 90 Ca 0.00 0.00 0.06 0.00 -0.16 0.00 0.00 57.16 57.06 1blr n GLU 90 Cb 0.34 0.00 0.08 0.00 1.43 0.00 0.00 31.44 33.29 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 2.22 -4.09 -1.84 4.13 -1.26 -4.69 115.26 109.73 1blr n ASN 91 Ca 0.00 -1.61 -0.32 0.00 1.68 0.00 0.00 54.58 54.33 1blr n ASN 91 Cb 0.00 -0.06 -0.16 0.00 -1.54 0.00 0.00 39.78 38.02 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 -0.97 2.72 0.26 3.52 2.36 -1.26 -1.61 119.74 124.75 1blr s LYS 92 Ca 0.16 -0.81 0.09 0.00 -2.55 0.00 0.00 55.97 52.86 1blr s LYS 92 Cb 0.10 -2.48 -0.05 0.00 -1.05 0.00 0.00 37.83 34.35 1blr s LYS 92 CO 0.15 -0.26 -0.13 0.00 1.55 0.00 0.00 175.35 176.66 1blr s MET 93 N 1.33 1.52 0.28 4.03 0.23 -0.32 0.28 119.30 126.64 1blr s MET 93 Ca 0.04 -1.72 0.00 0.00 -1.03 0.00 0.00 55.69 52.98 1blr s MET 93 Cb -0.14 -1.34 -0.00 0.00 -1.53 0.00 0.00 34.83 31.82 1blr s MET 93 CO -0.12 0.18 0.01 1.33 -2.03 0.00 0.00 175.02 174.40 1blr n VAL 94 N -0.53 0.00 -2.74 5.16 0.24 -0.81 -1.41 118.33 118.24 1blr n VAL 94 Ca -0.06 -1.35 -0.05 0.00 -2.04 0.00 0.00 64.34 60.83 1blr n VAL 94 Cb 0.61 0.31 0.03 0.00 -1.47 0.00 0.00 33.84 33.32 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 0.75 3.51 -0.22 0.00 2.12 -0.70 -1.54 118.70 122.62 1blr s GLU 96 Ca 0.29 1.67 -0.09 0.00 0.36 0.00 0.00 54.97 57.20 1blr s GLU 96 Cb 0.12 -4.17 -0.04 0.00 0.26 0.00 0.00 34.13 30.29 1blr s GLU 96 CO -0.13 -1.65 0.12 -0.65 -0.54 0.00 0.00 175.26 172.41 1blr s GLN 97 N 5.35 4.00 0.27 4.30 -0.21 -0.43 -2.52 119.66 130.43 1blr s GLN 97 Ca 0.81 -0.31 0.07 0.00 0.02 0.00 0.00 55.36 55.94 1blr s GLN 97 Cb -0.26 -3.41 -0.06 0.00 1.00 0.00 0.00 33.01 30.28 1blr s GLN 97 CO 0.33 0.11 -0.07 -1.59 -2.12 0.00 0.00 175.29 171.95 1blr s LYS 98 N 0.87 1.54 -0.57 2.91 -2.85 -0.73 -2.56 119.74 118.34 1blr s LYS 98 Ca 0.06 -1.77 0.01 0.00 -1.00 0.00 0.00 55.97 53.27 1blr s LYS 98 Cb -0.13 -1.18 0.51 0.00 -2.06 0.00 0.00 37.83 34.97 1blr s LYS 98 CO 0.03 0.06 1.93 1.47 0.10 0.00 0.00 175.35 178.94 1blr n LEU 99 N -0.57 7.15 -0.78 2.77 -0.00 -1.26 -1.21 117.00 123.11 1blr n LEU 99 Ca -0.06 -4.12 -0.10 0.00 -0.00 0.00 0.00 56.01 51.73 1blr n LEU 99 Cb 0.63 -0.89 -0.04 0.00 -0.00 0.00 0.00 43.42 43.11 1blr n LEU 99 CO 0.39 1.39 -0.10 0.18 -0.00 0.00 0.00 177.39 179.25 1blr n LEU 100 N -0.98 -0.26 0.00 1.47 4.77 -1.26 -4.04 117.00 116.70 1blr n LEU 100 Ca 0.60 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.83 1blr n LEU 100 Cb 0.96 -2.61 0.00 0.00 -2.33 0.00 0.00 43.42 39.44 1blr n LEU 100 CO 0.70 -1.01 0.00 2.29 -1.33 0.00 0.00 177.39 178.04 1blr n LYS 101 N -0.79 0.00 -1.30 3.23 -0.00 -1.26 -5.15 118.16 112.89 1blr n LYS 101 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.21 1blr n LYS 101 Cb 0.57 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.60 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 -0.47 -4.27 0.06 2.58 0.00 -1.26 -4.98 105.19 96.85 1blr n GLY 102 Ca 0.00 -0.81 -0.03 0.00 0.00 0.00 0.00 46.02 45.19 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 -1.14 0.09 0.00 1.61 0.28 -1.26 -5.05 120.64 115.18 1blr n GLU 103 Ca 0.00 0.02 0.00 0.00 -0.16 0.00 0.00 57.16 57.02 1blr n GLU 103 Cb 0.06 -1.05 0.00 0.00 1.43 0.00 0.00 31.44 31.87 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 3.30 -0.02 0.00 -1.84 0.00 -1.26 -5.14 105.19 100.23 1blr n GLY 104 Ca -0.07 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.26 1.08 -3.73 1.61 -0.04 -1.26 -5.06 135.00 127.35 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 -0.01 1.06 0.34 0.54 2.20 -1.26 -4.83 119.74 117.79 1blr s LYS 106 Ca 0.00 -0.58 0.07 0.00 -0.36 0.00 0.00 55.97 55.10 1blr s LYS 106 Cb 0.00 0.37 -0.02 0.00 -1.51 0.00 0.00 37.83 36.66 1blr s LYS 106 CO 0.00 -0.49 0.33 0.95 -0.36 0.00 0.00 175.35 175.78 1blr s THR 107 N -3.15 3.52 0.00 3.43 -4.23 -1.06 -1.56 115.64 112.59 1blr s THR 107 Ca 0.12 -1.31 0.00 0.00 -1.18 0.00 0.00 61.69 59.32 1blr s THR 107 Cb -0.00 -3.20 0.00 0.00 1.34 0.00 0.00 72.50 70.64 1blr s THR 107 CO 0.01 -0.15 0.00 -1.54 -0.54 0.00 0.00 174.62 172.40 1blr n SER 108 N -1.43 0.00 -3.61 3.99 3.41 -1.07 -1.31 113.62 113.60 1blr n SER 108 Ca -0.01 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.46 1blr n SER 108 Cb 0.60 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.48 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 -0.72 -0.20 7.33 1.48 -0.59 0.15 118.94 124.40 1blr s TRP 109 Ca 0.00 1.64 -0.01 0.00 -1.06 0.00 0.00 56.10 56.66 1blr s TRP 109 Cb 0.00 0.32 0.06 0.00 -1.16 0.00 0.00 33.47 32.68 1blr s TRP 109 CO 0.00 -0.41 -0.01 0.95 -4.06 0.00 0.00 176.95 173.42 1blr s THR 110 N -0.02 0.91 -0.04 0.66 -4.23 -0.59 0.11 115.64 112.45 1blr s THR 110 Ca -0.02 -0.75 -0.25 0.00 -1.18 0.00 0.00 61.69 59.49 1blr s THR 110 Cb -0.04 -1.29 -0.04 0.00 1.34 0.00 0.00 72.50 72.48 1blr s THR 110 CO 0.02 -0.11 0.76 -0.13 -0.54 0.00 0.00 174.62 174.61 1blr s ARG 111 N 1.69 4.46 0.05 3.99 0.52 -0.50 -2.17 118.95 126.99 1blr s ARG 111 Ca -0.02 1.00 0.04 0.00 -0.52 0.00 0.00 55.73 56.23 1blr s ARG 111 Cb -0.17 -3.43 -0.02 0.00 0.52 0.00 0.00 34.95 31.84 1blr s ARG 111 CO -0.07 0.09 -0.12 -2.00 0.02 0.00 0.00 175.30 173.21 1blr s GLU 112 N 0.68 0.78 0.29 3.54 2.12 -0.41 -1.18 118.70 124.52 1blr s GLU 112 Ca 0.40 -0.80 0.09 0.00 0.36 0.00 0.00 54.97 55.02 1blr s GLU 112 Cb -0.19 -0.74 -0.04 0.00 0.26 0.00 0.00 34.13 33.42 1blr s GLU 112 CO 0.20 0.17 0.03 -0.51 -0.54 0.00 0.00 175.26 174.61 1blr s LEU 113 N -1.40 3.20 -0.01 2.70 2.01 -0.63 -0.85 118.68 123.69 1blr s LEU 113 Ca -0.02 -0.69 -0.02 0.00 0.01 0.00 0.00 54.13 53.41 1blr s LEU 113 Cb -0.09 -1.70 -0.01 0.00 0.01 0.00 0.00 46.19 44.40 1blr s LEU 113 CO 0.01 -0.07 -0.04 0.35 1.01 0.00 0.00 176.35 177.61 1blr n THR 114 N -0.95 0.33 0.08 5.49 -2.24 -1.13 -4.85 114.28 111.01 1blr n THR 114 Ca -0.06 0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1blr n THR 114 Cb 0.60 -1.56 0.00 0.00 -2.10 0.00 0.00 70.33 67.27 1blr n THR 114 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1blr n ASN 115 N -3.21 -0.35 -1.21 3.42 4.13 -1.26 -5.03 115.26 111.75 1blr n ASN 115 Ca -0.05 0.29 -0.02 0.00 1.68 0.00 0.00 54.58 56.48 1blr n ASN 115 Cb 0.47 0.46 0.01 0.00 -1.54 0.00 0.00 39.78 39.18 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 -3.02 -0.40 0.00 6.41 -0.08 -1.26 -4.99 116.55 113.21 1blr n ASP 116 Ca 0.00 -0.99 0.00 0.00 -1.51 0.00 0.00 54.79 52.29 1blr n ASP 116 Cb 0.00 0.16 0.00 0.00 2.34 0.00 0.00 41.12 43.62 1blr n ASP 116 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1blr n GLY 117 N -0.23 0.00 2.67 0.27 0.00 -1.26 -4.73 105.19 101.91 1blr n GLY 117 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.85 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 0.65 -3.03 1.61 1.02 -1.24 -4.13 120.64 115.52 1blr n GLU 118 Ca 0.00 -2.08 -0.44 0.00 -0.02 0.00 0.00 57.16 54.62 1blr n GLU 118 Cb 0.00 -1.46 -0.05 0.00 -0.02 0.00 0.00 31.44 29.92 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 -0.19 4.90 -0.42 -4.62 0.20 -0.43 -2.85 118.68 115.27 1blr s LEU 119 Ca 0.32 -1.08 -0.22 0.00 0.69 0.00 0.00 54.13 53.83 1blr s LEU 119 Cb 0.14 -2.42 0.02 0.00 -0.43 0.00 0.00 46.19 43.50 1blr s LEU 119 CO -0.17 -1.15 0.74 0.27 -0.29 0.00 0.00 176.35 175.75 1blr s ILE 120 N 3.15 4.72 -0.21 6.68 -5.25 -0.03 -0.74 121.20 129.52 1blr s ILE 120 Ca 0.17 0.49 -0.04 0.00 -0.99 0.00 0.00 60.65 60.28 1blr s ILE 120 Cb -0.20 -4.25 -0.01 0.00 2.95 0.00 0.00 42.46 40.95 1blr s ILE 120 CO 0.10 -0.59 -0.03 -0.22 -1.79 0.00 0.00 174.94 172.41 1blr s LEU 121 N 3.10 2.98 0.24 0.37 1.98 -0.47 -1.29 118.68 125.60 1blr s LEU 121 Ca 0.28 -0.34 0.06 0.00 -2.89 0.00 0.00 54.13 51.24 1blr s LEU 121 Cb -0.13 -1.76 -0.03 0.00 0.66 0.00 0.00 46.19 44.93 1blr s LEU 121 CO 0.20 0.00 0.23 -0.89 -1.89 0.00 0.00 176.35 174.00 1blr s THR 122 N 1.35 4.65 -0.36 3.68 2.01 -0.92 -2.59 115.64 123.46 1blr s THR 122 Ca 0.04 -1.29 0.07 0.00 0.31 0.00 0.00 61.69 60.82 1blr s THR 122 Cb -0.14 -3.51 0.18 0.00 0.01 0.00 0.00 72.50 69.04 1blr s THR 122 CO -0.01 -0.33 0.59 -0.32 -0.69 0.00 0.00 174.62 173.85 1blr s MET 123 N -3.84 0.69 0.98 4.92 0.00 -0.82 -1.53 119.30 119.70 1blr s MET 123 Ca 0.33 0.00 -0.13 0.00 0.00 0.00 0.00 55.69 55.90 1blr s MET 123 Cb -0.08 0.07 0.18 0.00 0.00 0.00 0.00 34.83 35.00 1blr s MET 123 CO 0.26 -1.13 1.12 0.95 0.00 0.00 0.00 175.02 176.21 1blr s THR 124 N 2.20 1.98 -0.30 10.11 -4.23 0.12 -2.10 115.64 123.43 1blr s THR 124 Ca 0.14 0.00 -0.13 0.00 -1.18 0.00 0.00 61.69 60.51 1blr s THR 124 Cb -0.07 -2.60 0.18 0.00 1.34 0.00 0.00 72.50 71.34 1blr s THR 124 CO -0.15 0.00 1.09 0.00 -0.54 0.00 0.00 174.62 175.02 1blr s ALA 125 N -3.11 -3.98 -1.22 3.99 0.00 -0.70 -2.60 121.76 114.14 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 -0.16 -2.76 0.00 0.00 0.00 0.00 0.00 23.12 20.20 1blr s ALA 125 CO 0.56 -1.91 0.25 -3.47 0.00 0.00 0.00 175.76 171.19 1blr n ASP 126 N 5.22 -4.77 0.00 0.00 2.03 -0.60 -2.07 116.55 116.36 1blr n ASP 126 Ca 0.04 -0.12 0.00 0.00 0.52 0.00 0.00 54.79 55.23 1blr n ASP 126 Cb 0.57 -3.75 0.00 0.00 -0.72 0.00 0.00 41.12 37.21 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 -1.16 0.00 -4.49 1.67 2.03 -1.25 -4.41 116.55 108.94 1blr n ASP 127 Ca -0.13 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 54.91 1blr n ASP 127 Cb 0.61 0.00 0.14 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 -2.45 2.08 -0.26 5.18 -7.23 -0.88 -4.79 120.40 112.05 1blr s VAL 128 Ca 0.00 -0.17 -0.08 0.00 -1.81 0.00 0.00 61.98 59.92 1blr s VAL 128 Cb 0.00 -2.91 0.12 0.00 0.56 0.00 0.00 36.38 34.15 1blr s VAL 128 CO 0.00 0.00 0.54 -0.69 -0.31 0.00 0.00 175.10 174.64 1blr s VAL 129 N -3.58 -0.84 -0.67 1.32 1.01 -1.26 -1.73 120.40 114.65 1blr s VAL 129 Ca 0.68 0.06 -0.15 0.00 0.00 0.00 0.00 61.98 62.58 1blr s VAL 129 Cb -0.06 -0.86 0.17 0.00 0.00 0.00 0.00 36.38 35.63 1blr s VAL 129 CO 0.49 0.02 0.61 0.00 0.00 0.00 0.00 175.10 176.23 1blr s THR 131 N 0.96 5.47 -0.01 0.00 2.01 -1.26 -1.94 115.64 120.87 1blr s THR 131 Ca 0.10 0.24 -0.16 0.00 0.31 0.00 0.00 61.69 62.18 1blr s THR 131 Cb -0.21 -3.43 0.03 0.00 0.01 0.00 0.00 72.50 68.89 1blr s THR 131 CO -0.02 0.58 0.33 -0.13 -0.69 0.00 0.00 174.62 174.68 1blr s ARG 132 N -0.72 0.71 -0.03 4.92 0.52 -1.07 -4.12 118.95 119.17 1blr s ARG 132 Ca 0.14 -0.21 -0.01 0.00 -0.52 0.00 0.00 55.73 55.13 1blr s ARG 132 Cb -0.12 0.32 -0.04 0.00 0.52 0.00 0.00 34.95 35.63 1blr s ARG 132 CO 0.03 -0.20 0.05 0.08 0.02 0.00 0.00 175.30 175.28 1blr s VAL 133 N -1.48 4.57 0.36 3.52 1.01 -0.51 -1.36 120.40 126.51 1blr s VAL 133 Ca -0.12 -0.37 0.03 0.00 0.00 0.00 0.00 61.98 61.52 1blr s VAL 133 Cb -0.04 -3.03 -0.05 0.00 0.00 0.00 0.00 36.38 33.26 1blr s VAL 133 CO 0.04 0.43 0.09 -0.31 0.00 0.00 0.00 175.10 175.35 1blr s TYR 134 N -1.09 1.85 0.09 5.22 1.51 0.08 0.06 117.35 125.08 1blr s TYR 134 Ca 0.19 -1.11 -0.06 0.00 -1.01 0.00 0.00 57.07 55.09 1blr s TYR 134 Cb -0.12 -1.21 -0.02 0.00 -0.11 0.00 0.00 41.96 40.51 1blr s TYR 134 CO 0.10 -0.14 0.12 0.08 -1.11 0.00 0.00 175.55 174.60 1blr s VAL 135 N -3.30 0.16 -0.31 0.71 1.01 -1.10 -1.31 120.40 116.25 1blr s VAL 135 Ca 0.31 -1.44 -0.24 0.00 0.00 0.00 0.00 61.98 60.61 1blr s VAL 135 Cb 0.06 -1.49 0.00 0.00 0.00 0.00 0.00 36.38 34.96 1blr s VAL 135 CO 0.15 -0.71 0.83 -0.13 0.00 0.00 0.00 175.10 175.23 1blr s ARG 136 N -3.90 3.97 0.00 2.72 0.52 -1.26 -1.73 118.95 119.27 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 0.06 -3.73 0.00 0.00 0.52 0.00 0.00 34.95 31.80 1blr s ARG 136 CO -0.09 -0.71 0.14 -1.91 0.02 0.00 0.00 175.30 172.75