#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 5.03 -1.26 -4.43 115.26 118.14 1blr n ASN 2 Ca 0.00 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.45 1blr n ASN 2 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 1blr n ASN 2 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1blr n PHE 3 N 9.25 0.00 -1.63 3.10 3.01 -1.26 -4.96 117.46 124.98 1blr n PHE 3 Ca 0.00 0.00 -0.53 0.00 1.01 0.00 0.00 57.45 57.93 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 2.76 2.61 0.00 4.37 3.41 -1.26 -4.71 113.62 120.79 1blr n SER 4 Ca 0.00 0.87 0.00 0.00 -0.26 0.00 0.00 58.87 59.48 1blr n SER 4 Cb 0.00 -1.23 0.00 0.00 -0.26 0.00 0.00 64.21 62.72 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 4.92 4.18 3.81 5.00 0.00 -1.10 -4.99 105.19 117.01 1blr n GLY 5 Ca 0.30 -1.13 -0.33 0.00 0.00 0.00 0.00 46.02 44.86 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 6.10 -0.06 1.61 3.84 -1.26 -1.98 114.94 123.20 1blr s ASN 6 Ca 0.00 1.76 0.02 0.00 0.21 0.00 0.00 52.86 54.85 1blr s ASN 6 Cb 0.00 -2.53 0.02 0.00 -0.55 0.00 0.00 41.25 38.19 1blr s ASN 6 CO 0.00 -0.95 -0.09 0.26 -2.79 0.00 0.00 177.10 173.53 1blr s TRP 7 N -2.44 1.18 0.39 0.43 0.52 -1.04 -2.14 118.94 115.84 1blr s TRP 7 Ca 0.63 -0.40 -0.03 0.00 0.02 0.00 0.00 56.10 56.31 1blr s TRP 7 Cb -0.14 -0.90 -0.04 0.00 -1.15 0.00 0.00 33.47 31.24 1blr s TRP 7 CO 0.33 -0.23 0.65 0.15 0.02 0.00 0.00 176.95 177.87 1blr s LYS 8 N 0.72 3.55 0.29 4.98 3.01 -0.65 -3.33 119.74 128.30 1blr s LYS 8 Ca -0.13 -0.02 -0.28 0.00 -1.01 0.00 0.00 55.97 54.53 1blr s LYS 8 Cb -0.15 -2.53 -0.09 0.00 -1.01 0.00 0.00 37.83 34.04 1blr s LYS 8 CO 0.02 0.01 0.98 -1.50 0.51 0.00 0.00 175.35 175.38 1blr s ILE 9 N -2.44 3.97 -0.21 2.17 -1.16 -1.26 -2.89 121.20 119.38 1blr s ILE 9 Ca 0.44 1.82 -0.07 0.00 -0.51 0.00 0.00 60.65 62.34 1blr s ILE 9 Cb -0.10 -4.10 0.10 0.00 0.61 0.00 0.00 42.46 38.97 1blr s ILE 9 CO 0.38 0.32 0.43 -0.63 -2.81 0.00 0.00 174.94 172.63 1blr s ILE 10 N -1.36 -0.67 0.20 2.00 1.09 0.35 -4.87 121.20 117.93 1blr s ILE 10 Ca 0.46 0.14 0.00 0.00 -1.10 0.00 0.00 60.65 60.15 1blr s ILE 10 Cb -0.24 -0.70 0.00 0.00 -1.06 0.00 0.00 42.46 40.46 1blr s ILE 10 CO 0.31 0.05 0.00 0.54 -0.10 0.00 0.00 174.94 175.74 1blr n ARG 11 N 5.39 -4.50 -3.64 2.79 3.00 -1.26 -0.27 116.66 118.18 1blr n ARG 11 Ca -0.08 3.27 -0.08 0.00 -0.01 0.00 0.00 57.85 60.95 1blr n ARG 11 Cb 0.49 -3.45 -0.07 0.00 0.00 0.00 0.00 32.46 29.44 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 -0.67 -0.77 -0.32 0.55 0.15 -1.26 -2.48 113.70 108.90 1blr s SER 12 Ca 0.00 1.32 0.04 0.00 0.70 0.00 0.00 55.95 58.01 1blr s SER 12 Cb 0.00 1.33 0.31 0.00 -1.71 0.00 0.00 66.02 65.95 1blr s SER 12 CO 0.00 -0.21 1.39 1.21 1.20 0.00 0.00 173.24 176.83 1blr n GLU 13 N 3.55 0.15 0.00 5.44 2.13 -1.26 -5.01 120.64 125.64 1blr n GLU 13 Ca -0.17 -0.71 0.00 0.00 0.66 0.00 0.00 57.16 56.94 1blr n GLU 13 Cb 0.57 -0.14 0.00 0.00 0.27 0.00 0.00 31.44 32.14 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 0.42 1.82 -0.19 4.31 3.02 -1.26 -4.77 115.26 118.61 1blr n ASN 14 Ca -0.07 -0.07 -0.04 0.00 -0.03 0.00 0.00 54.58 54.37 1blr n ASN 14 Cb 0.75 0.50 0.02 0.00 -0.61 0.00 0.00 39.78 40.45 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 -0.73 -0.27 3.10 3.57 -1.94 0.69 116.94 121.35 1blr h PHE 15 Ca 0.00 0.06 -0.12 0.00 3.53 0.00 0.00 57.97 61.44 1blr h PHE 15 Cb 0.00 0.41 -0.01 0.00 2.79 0.00 0.00 35.95 39.13 1blr h PHE 15 CO 0.00 -0.35 -0.34 1.49 -2.23 0.00 0.00 178.31 176.88 1blr h GLU 16 N -0.13 0.60 -0.01 1.11 4.81 -1.90 -1.59 114.58 117.47 1blr h GLU 16 Ca 0.24 -0.28 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1blr h GLU 16 Cb 0.52 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.89 1blr h GLU 16 CO -0.64 0.86 0.03 1.49 -0.73 0.00 0.00 179.01 180.02 1blr h GLU 17 N 0.50 0.00 -0.05 1.92 4.81 -1.25 0.30 114.58 120.82 1blr h GLU 17 Ca 0.06 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.22 1blr h GLU 17 Cb 0.83 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.21 1blr h GLU 17 CO 0.07 0.00 -0.24 -0.07 -0.73 0.00 0.00 179.01 178.04 1blr h LEU 18 N 0.00 0.29 -0.01 1.64 3.38 -0.04 -1.93 115.31 118.65 1blr h LEU 18 Ca 0.00 -0.66 0.00 0.00 0.09 0.00 0.00 57.88 57.32 1blr h LEU 18 Cb 0.07 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1blr h LEU 18 CO -0.00 0.91 -0.02 0.18 0.09 0.00 0.00 178.44 179.60 1blr n LEU 19 N -4.51 0.03 0.03 1.67 7.99 -0.58 -1.88 117.00 119.75 1blr n LEU 19 Ca -0.09 0.36 0.04 0.00 -0.01 0.00 0.00 56.01 56.32 1blr n LEU 19 Cb 0.46 -0.38 -0.09 0.00 -0.11 0.00 0.00 43.42 43.31 1blr n LEU 19 CO 0.40 0.01 -0.40 0.29 -1.51 0.00 0.00 177.39 176.18 1blr n LYS 20 N -1.37 0.63 -0.11 3.23 5.02 -0.01 -2.36 118.16 123.19 1blr n LYS 20 Ca 0.11 0.08 -0.13 0.00 -2.02 0.00 0.00 58.31 56.35 1blr n LYS 20 Cb 0.29 -1.72 -0.14 0.00 -0.02 0.00 0.00 35.03 33.43 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 -2.68 1.44 0.32 -0.18 0.24 -0.73 -3.92 118.33 112.80 1blr n VAL 21 Ca -0.08 -0.74 0.20 0.00 -2.04 0.00 0.00 64.34 61.67 1blr n VAL 21 Cb 0.74 -0.86 1.04 0.00 -1.47 0.00 0.00 33.84 33.28 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 8.10 -1.57 -3.45 115.31 119.73 1blr h LEU 22 Ca -0.56 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.43 1blr h LEU 22 Cb 2.11 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 42.33 1blr h LEU 22 CO -0.01 0.01 0.00 0.61 -4.11 0.00 0.00 178.44 174.94 1blr n GLY 23 N -0.82 0.62 3.51 0.17 0.00 -1.26 -5.08 105.19 102.34 1blr n GLY 23 Ca -0.02 -0.38 -0.43 0.00 0.00 0.00 0.00 46.02 45.19 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 2.00 0.00 1.61 3.14 -0.99 -4.92 118.33 119.17 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 -0.73 0.00 0.00 -1.06 0.00 0.00 33.84 32.05 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 1.15 0.00 0.00 6.55 5.15 -1.26 -4.89 115.26 121.95 1blr n ASN 25 Ca 0.11 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.09 1blr n ASN 25 Cb 0.36 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.61 1blr n ASN 25 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 1blr n VAL 26 N 0.00 0.00 0.16 3.44 0.31 -1.26 -4.89 118.33 116.08 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 2.49 -0.40 -6.41 5.55 2.86 -1.90 -3.45 114.93 113.68 1blr h MET 27 Ca 0.00 0.03 -0.39 0.00 -2.06 0.00 0.00 59.70 57.28 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 -0.83 1.28 1.06 0.00 0.00 176.91 178.15 1blr n LEU 28 N -3.46 -2.92 -1.98 1.22 7.99 -1.26 0.20 117.00 116.79 1blr n LEU 28 Ca -0.05 -0.81 -0.20 0.00 -0.01 0.00 0.00 56.01 54.94 1blr n LEU 28 Cb 0.16 -2.08 -0.05 0.00 -0.11 0.00 0.00 43.42 41.34 1blr n LEU 28 CO 0.12 0.10 -0.22 -1.14 -1.51 0.00 0.00 177.39 174.74 1blr n ARG 29 N -2.83 -1.59 -2.20 3.23 0.63 -1.26 -2.71 116.66 109.93 1blr n ARG 29 Ca -0.21 1.08 0.00 0.00 -0.92 0.00 0.00 57.85 57.80 1blr n ARG 29 Cb 0.63 -5.59 0.00 0.00 0.45 0.00 0.00 32.46 27.95 1blr n ARG 29 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1blr n LYS 30 N -2.65 -2.67 -2.66 -0.14 5.02 0.13 -3.51 118.16 111.67 1blr n LYS 30 Ca -0.22 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.07 1blr n LYS 30 Cb 0.67 -3.93 0.00 0.00 -0.02 0.00 0.00 35.03 31.75 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 -2.14 0.00 0.00 -0.18 2.08 -1.10 -3.75 119.36 114.27 1blr n ILE 31 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 1blr n ILE 31 Cb 0.42 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.31 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 -0.81 0.00 -0.68 -1.39 0.00 -1.23 -4.96 120.51 111.44 1blr n ALA 32 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 1blr n ALA 32 Cb 0.00 0.00 0.14 0.00 0.00 0.00 0.00 19.45 19.59 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 0.00 2.66 -2.22 0.00 0.31 -1.25 -4.08 118.33 113.75 1blr n VAL 33 Ca 0.00 -1.44 0.04 0.00 -0.01 0.00 0.00 64.34 62.93 1blr n VAL 33 Cb 0.00 -0.60 0.08 0.00 -0.91 0.00 0.00 33.84 32.41 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 -0.74 2.79 -0.04 3.52 0.00 -1.26 -4.88 120.51 119.90 1blr n ALA 34 Ca 0.45 -2.66 -0.05 0.00 0.00 0.00 0.00 53.44 51.18 1blr n ALA 34 Cb 1.39 -0.62 -0.02 0.00 0.00 0.00 0.00 19.45 20.20 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 -0.02 1.30 -3.38 0.00 0.00 -1.26 -5.07 120.51 112.08 1blr n ALA 35 Ca 0.10 -0.52 -0.14 0.00 0.00 0.00 0.00 53.44 52.89 1blr n ALA 35 Cb 1.00 0.07 -0.09 0.00 0.00 0.00 0.00 19.45 20.43 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 -2.69 -1.19 0.02 0.00 0.00 -1.26 -5.17 121.76 111.47 1blr s ALA 36 Ca -0.17 1.29 -0.21 0.00 0.00 0.00 0.00 51.96 52.87 1blr s ALA 36 Cb 0.02 -0.69 0.04 0.00 0.00 0.00 0.00 23.12 22.50 1blr s ALA 36 CO 0.25 -0.24 0.47 -1.12 0.00 0.00 0.00 175.76 175.13 1blr s SER 37 N 0.07 -0.38 -0.45 0.00 0.01 -1.26 -5.07 113.70 106.62 1blr s SER 37 Ca -0.02 0.18 0.07 0.00 1.31 0.00 0.00 55.95 57.50 1blr s SER 37 Cb -0.03 0.45 0.25 0.00 0.21 0.00 0.00 66.02 66.90 1blr s SER 37 CO 0.01 -0.64 0.76 1.17 0.41 0.00 0.00 173.24 174.96 1blr n LYS 38 N 0.66 0.78 -2.64 12.44 4.81 -1.26 -5.12 118.16 127.82 1blr n LYS 38 Ca -0.19 -2.35 -0.42 0.00 -0.87 0.00 0.00 58.31 54.49 1blr n LYS 38 Cb 0.59 -1.36 -0.04 0.00 0.02 0.00 0.00 35.03 34.24 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 -0.14 4.59 0.50 1.64 0.04 -1.26 -4.88 135.00 135.48 1blr s PRO 39 Ca 0.33 1.53 0.01 0.00 0.04 0.00 0.00 61.00 62.91 1blr s PRO 39 Cb 0.22 -3.39 -0.01 0.00 0.04 0.00 0.00 34.50 31.36 1blr s PRO 39 CO -0.18 0.02 0.03 0.00 0.04 0.00 0.00 177.00 176.91 1blr s ALA 40 N 0.53 3.92 0.32 8.56 0.00 -0.90 -4.39 121.76 129.79 1blr s ALA 40 Ca 0.51 -0.45 -0.18 0.00 0.00 0.00 0.00 51.96 51.84 1blr s ALA 40 Cb -0.24 0.18 0.03 0.00 0.00 0.00 0.00 23.12 23.09 1blr s ALA 40 CO 0.30 -0.08 0.71 0.54 0.00 0.00 0.00 175.76 177.23 1blr s VAL 41 N -2.95 0.00 -0.25 0.00 0.11 -1.21 -2.67 120.40 113.42 1blr s VAL 41 Ca 0.08 -1.06 -0.03 0.00 -2.93 0.00 0.00 61.98 58.03 1blr s VAL 41 Cb 0.01 -2.36 0.14 0.00 -1.53 0.00 0.00 36.38 32.64 1blr s VAL 41 CO 0.05 0.00 0.46 -1.83 -3.33 0.00 0.00 175.10 170.45 1blr s GLU 42 N -3.31 0.41 0.19 1.54 -1.05 -0.98 -2.50 118.70 113.01 1blr s GLU 42 Ca 0.14 0.80 -0.07 0.00 -0.15 0.00 0.00 54.97 55.70 1blr s GLU 42 Cb -0.05 0.01 -0.06 0.00 -0.44 0.00 0.00 34.13 33.59 1blr s GLU 42 CO 0.09 -0.54 0.46 0.42 0.95 0.00 0.00 175.26 176.64 1blr s ILE 43 N 2.66 5.06 -0.21 1.83 -1.09 -0.84 -2.23 121.20 126.39 1blr s ILE 43 Ca 0.11 0.19 -0.04 0.00 -2.23 0.00 0.00 60.65 58.69 1blr s ILE 43 Cb -0.15 -3.63 0.11 0.00 -1.58 0.00 0.00 42.46 37.21 1blr s ILE 43 CO -0.17 -0.04 0.29 -0.54 -1.23 0.00 0.00 174.94 173.25 1blr s LYS 44 N -2.81 0.25 0.02 2.79 1.02 -1.02 -2.71 119.74 117.29 1blr s LYS 44 Ca 0.44 0.39 -0.02 0.00 0.02 0.00 0.00 55.97 56.80 1blr s LYS 44 Cb -0.12 -0.80 -0.02 0.00 -0.52 0.00 0.00 37.83 36.38 1blr s LYS 44 CO 0.24 -0.61 0.02 1.14 -0.92 0.00 0.00 175.35 175.21 1blr s GLN 45 N 2.43 0.39 -0.43 1.68 1.03 -1.26 -0.21 119.66 123.29 1blr s GLN 45 Ca 0.09 -0.61 0.02 0.00 0.04 0.00 0.00 55.36 54.90 1blr s GLN 45 Cb -0.15 0.15 0.14 0.00 0.03 0.00 0.00 33.01 33.18 1blr s GLN 45 CO -0.13 -0.08 0.26 -2.00 -2.54 0.00 0.00 175.29 170.80 1blr s GLU 46 N -1.69 1.17 5.54 9.60 2.12 -0.45 -4.88 118.70 130.11 1blr s GLU 46 Ca -0.13 -1.96 0.00 0.00 0.36 0.00 0.00 54.97 53.24 1blr s GLU 46 Cb -0.08 -2.10 0.00 0.00 0.26 0.00 0.00 34.13 32.22 1blr s GLU 46 CO -0.01 -1.20 0.00 0.41 -0.54 0.00 0.00 175.26 173.92 1blr n GLY 47 N 3.48 0.30 0.00 -1.50 0.00 -1.26 -3.10 105.19 103.11 1blr n GLY 47 Ca 0.12 -0.76 0.14 0.00 0.00 0.00 0.00 46.02 45.52 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 6.34 0.00 -4.77 1.61 5.68 -1.26 -4.73 116.55 119.42 1blr n ASP 48 Ca 0.00 -0.62 -0.38 0.00 -0.50 0.00 0.00 54.79 53.29 1blr n ASP 48 Cb 0.00 -0.10 -0.06 0.00 -1.14 0.00 0.00 41.12 39.82 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 5.08 0.07 2.12 2.01 -1.18 -1.08 115.64 120.46 1blr s THR 49 Ca 0.36 0.96 0.01 0.00 0.31 0.00 0.00 61.69 63.34 1blr s THR 49 Cb 0.19 -3.80 -0.03 0.00 0.01 0.00 0.00 72.50 68.86 1blr s THR 49 CO 0.35 0.43 -0.06 -0.36 -0.69 0.00 0.00 174.62 174.29 1blr s PHE 50 N -0.08 0.69 0.04 4.92 0.40 -0.38 -1.34 117.98 122.23 1blr s PHE 50 Ca 0.26 -0.78 0.04 0.00 -0.60 0.00 0.00 56.93 55.84 1blr s PHE 50 Cb -0.16 -0.43 -0.02 0.00 0.51 0.00 0.00 43.02 42.92 1blr s PHE 50 CO 0.12 -0.18 -0.11 -0.47 0.70 0.00 0.00 175.22 175.29 1blr s TYR 51 N -2.80 0.94 -0.23 0.36 6.14 0.71 -1.56 117.35 120.90 1blr s TYR 51 Ca 0.02 -0.40 -0.03 0.00 0.64 0.00 0.00 57.07 57.30 1blr s TYR 51 Cb -0.00 -0.55 0.11 0.00 0.42 0.00 0.00 41.96 41.93 1blr s TYR 51 CO -0.04 -0.01 0.25 0.42 0.64 0.00 0.00 175.55 176.82 1blr s ILE 52 N -1.04 -0.36 -0.81 3.14 1.01 -0.90 -2.43 121.20 119.81 1blr s ILE 52 Ca -0.03 -0.23 -0.10 0.00 0.00 0.00 0.00 60.65 60.29 1blr s ILE 52 Cb -0.08 -0.78 0.21 0.00 0.01 0.00 0.00 42.46 41.82 1blr s ILE 52 CO 0.01 -0.28 0.72 -0.75 0.00 0.00 0.00 174.94 174.64 1blr s LYS 53 N 2.35 3.40 -1.13 2.79 2.20 -0.95 -1.91 119.74 126.49 1blr s LYS 53 Ca 0.08 -2.60 -0.19 0.00 -0.36 0.00 0.00 55.97 52.91 1blr s LYS 53 Cb -0.15 -4.25 0.10 0.00 -1.51 0.00 0.00 37.83 32.01 1blr s LYS 53 CO -0.19 -1.26 1.48 0.99 -0.36 0.00 0.00 175.35 176.01 1blr s THR 54 N -0.11 4.36 0.09 3.43 2.01 -1.25 -2.32 115.64 121.84 1blr s THR 54 Ca 0.19 -1.65 0.00 0.00 0.31 0.00 0.00 61.69 60.54 1blr s THR 54 Cb -0.12 -5.02 -0.00 0.00 0.01 0.00 0.00 72.50 67.36 1blr s THR 54 CO -0.08 -1.82 0.01 -1.54 -0.69 0.00 0.00 174.62 170.50 1blr n SER 55 N 7.65 1.80 0.00 3.53 3.41 -1.09 -4.73 113.62 124.18 1blr n SER 55 Ca 0.37 -1.41 0.00 0.00 -0.26 0.00 0.00 58.87 57.57 1blr n SER 55 Cb 0.47 0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.54 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 -0.21 0.00 0.04 6.66 5.66 -1.26 -2.11 114.28 123.05 1blr n THR 56 Ca -0.03 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.97 1blr n THR 56 Cb 0.12 -0.17 0.00 0.00 -1.55 0.00 0.00 70.33 68.72 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 -1.96 0.00 -0.34 1.09 -1.04 -1.26 -4.89 114.28 105.89 1blr n THR 57 Ca 0.00 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.88 1blr n THR 57 Cb 0.00 -0.01 0.12 0.00 -1.82 0.00 0.00 70.33 68.62 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 -2.66 0.00 -1.04 12.58 0.24 -1.26 -4.95 118.33 121.24 1blr n VAL 58 Ca 0.00 -0.08 -0.32 0.00 -2.04 0.00 0.00 64.34 61.91 1blr n VAL 58 Cb 0.00 -0.68 0.12 0.00 -1.47 0.00 0.00 33.84 31.82 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 -3.93 1.69 0.20 7.34 1.70 -1.26 -5.02 118.95 119.66 1blr s ARG 59 Ca 0.28 1.44 -0.22 0.00 -0.47 0.00 0.00 55.73 56.77 1blr s ARG 59 Cb -0.04 -1.81 0.05 0.00 -0.57 0.00 0.00 34.95 32.58 1blr s ARG 59 CO 0.23 -2.11 0.62 0.99 -1.08 0.00 0.00 175.30 173.94 1blr s THR 60 N -2.64 0.01 0.59 4.99 2.01 -1.26 -4.93 115.64 114.40 1blr s THR 60 Ca 0.66 -0.38 -0.01 0.00 0.31 0.00 0.00 61.69 62.27 1blr s THR 60 Cb -0.21 -1.34 0.04 0.00 0.01 0.00 0.00 72.50 70.99 1blr s THR 60 CO 0.55 -0.02 0.84 0.28 -0.69 0.00 0.00 174.62 175.57 1blr s THR 61 N -3.81 2.56 -0.06 -0.82 -1.32 -1.26 -5.02 115.64 105.90 1blr s THR 61 Ca 0.05 -0.56 -0.29 0.00 -1.21 0.00 0.00 61.69 59.67 1blr s THR 61 Cb -0.02 -3.00 0.07 0.00 -1.51 0.00 0.00 72.50 68.04 1blr s THR 61 CO -0.06 0.00 0.66 -1.83 -2.21 0.00 0.00 174.62 171.18 1blr s GLU 62 N -4.89 1.02 -0.50 7.08 1.03 -1.26 -3.94 118.70 117.24 1blr s GLU 62 Ca 0.58 0.29 -0.16 0.00 0.03 0.00 0.00 54.97 55.71 1blr s GLU 62 Cb -0.10 0.48 0.09 0.00 -0.80 0.00 0.00 34.13 33.80 1blr s GLU 62 CO 0.40 -0.30 0.44 0.96 -1.33 0.00 0.00 175.26 175.43 1blr s ILE 63 N -1.08 5.22 -1.18 1.83 -4.36 -0.80 -4.89 121.20 115.95 1blr s ILE 63 Ca -0.10 -1.22 -0.10 0.00 -0.26 0.00 0.00 60.65 58.97 1blr s ILE 63 Cb -0.01 -4.21 0.22 0.00 1.25 0.00 0.00 42.46 39.72 1blr s ILE 63 CO 0.09 -0.69 1.41 -0.46 0.24 0.00 0.00 174.94 175.53 1blr n ASN 64 N 5.24 5.47 -0.26 4.36 2.04 -1.26 -2.11 115.26 128.74 1blr n ASN 64 Ca -0.13 -3.08 0.00 0.00 -0.44 0.00 0.00 54.58 50.93 1blr n ASN 64 Cb 0.42 -1.45 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 3.80 -0.04 -3.71 -2.53 -1.74 -0.60 -4.97 117.46 107.67 1blr n PHE 65 Ca 0.32 0.00 -0.13 0.00 -0.56 0.00 0.00 57.45 57.07 1blr n PHE 65 Cb 0.39 0.00 -0.14 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 0.77 0.16 0.64 3.97 -2.85 -1.26 -1.25 119.74 119.92 1blr s LYS 66 Ca 0.00 0.56 0.12 0.00 -1.00 0.00 0.00 55.97 55.66 1blr s LYS 66 Cb 0.00 -0.13 0.44 0.00 -2.06 0.00 0.00 37.83 36.09 1blr s LYS 66 CO 0.00 -0.21 1.16 0.28 0.10 0.00 0.00 175.35 176.68 1blr h VAL 67 N 6.06 0.01 -0.26 1.79 2.07 -1.40 -1.74 116.25 122.77 1blr h VAL 67 Ca -0.32 0.00 -0.18 0.00 0.82 0.00 0.00 66.70 67.03 1blr h VAL 67 Cb 1.14 0.03 -0.07 0.00 -1.52 0.00 0.00 31.29 30.86 1blr h VAL 67 CO 0.30 0.00 0.19 0.61 0.02 0.00 0.00 177.57 178.69 1blr n GLY 68 N -1.58 3.34 3.79 2.17 0.00 -1.26 -4.35 105.19 107.29 1blr n GLY 68 Ca 0.10 -0.64 -0.02 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.86 1.04 0.45 1.61 -1.05 -0.66 -5.12 118.70 114.10 1blr s GLU 69 Ca 0.20 -0.62 0.07 0.00 -0.15 0.00 0.00 54.97 54.47 1blr s GLU 69 Cb 0.14 0.32 -0.03 0.00 -0.44 0.00 0.00 34.13 34.13 1blr s GLU 69 CO -0.01 -0.48 0.25 -1.83 0.95 0.00 0.00 175.26 174.14 1blr s GLU 70 N -2.66 2.29 0.19 -4.83 1.03 -1.26 -3.18 118.70 110.28 1blr s GLU 70 Ca 0.17 -1.86 0.00 0.00 0.03 0.00 0.00 54.97 53.32 1blr s GLU 70 Cb -0.01 -2.05 -0.00 0.00 -0.80 0.00 0.00 34.13 31.27 1blr s GLU 70 CO 0.02 -0.25 0.02 1.19 -1.33 0.00 0.00 175.26 174.91 1blr n PHE 71 N -1.41 0.35 -4.19 4.83 3.72 -0.86 -4.94 117.46 114.96 1blr n PHE 71 Ca -0.01 -1.02 -0.14 0.00 -0.05 0.00 0.00 57.45 56.23 1blr n PHE 71 Cb 0.64 -0.09 -0.10 0.00 -0.94 0.00 0.00 39.48 38.98 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 -2.70 0.90 0.12 -1.08 2.02 -1.26 -2.54 118.70 114.16 1blr s GLU 72 Ca 0.03 -1.26 -0.14 0.00 0.02 0.00 0.00 54.97 53.62 1blr s GLU 72 Cb 0.00 -0.51 0.05 0.00 0.10 0.00 0.00 34.13 33.77 1blr s GLU 72 CO 0.02 0.07 0.68 -1.91 0.02 0.00 0.00 175.26 174.13 1blr n GLU 73 N 0.29 0.43 -4.17 1.61 2.13 0.14 -4.86 120.64 116.21 1blr n GLU 73 Ca -0.14 -0.98 -0.19 0.00 0.66 0.00 0.00 57.16 56.51 1blr n GLU 73 Cb 0.59 1.33 -0.16 0.00 0.27 0.00 0.00 31.44 33.47 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 0.68 0.76 5.31 -0.21 -1.23 -1.93 119.66 121.00 1blr s GLN 74 Ca 0.15 -0.13 -0.12 0.00 0.02 0.00 0.00 55.36 55.27 1blr s GLN 74 Cb -0.02 -0.69 0.05 0.00 1.00 0.00 0.00 33.01 33.35 1blr s GLN 74 CO 0.04 -0.01 1.12 0.99 -2.12 0.00 0.00 175.29 175.31 1blr s THR 75 N 0.56 2.97 0.52 -0.19 2.01 -1.07 -4.78 115.64 115.65 1blr s THR 75 Ca -0.07 0.37 0.18 0.00 0.31 0.00 0.00 61.69 62.48 1blr s THR 75 Cb -0.11 -2.80 0.30 0.00 0.01 0.00 0.00 72.50 69.90 1blr s THR 75 CO -0.00 -0.35 2.11 -0.37 -0.69 0.00 0.00 174.62 175.32 1blr h VAL 76 N -0.80 0.94 -1.17 3.82 -1.51 -1.98 -3.44 116.25 112.11 1blr h VAL 76 Ca -0.45 -0.00 0.18 0.00 -1.23 0.00 0.00 66.70 65.20 1blr h VAL 76 Cb 1.25 0.92 -0.32 0.00 -2.13 0.00 0.00 31.29 31.02 1blr h VAL 76 CO 0.50 0.00 0.69 -0.62 -1.23 0.00 0.00 177.57 176.92 1blr s ASP 77 N -6.85 -0.15 0.00 4.19 -1.08 -1.26 -5.06 116.67 106.46 1blr s ASP 77 Ca -0.05 0.25 0.00 0.00 -0.52 0.00 0.00 52.55 52.23 1blr s ASP 77 Cb 0.18 0.93 0.00 0.00 -1.46 0.00 0.00 42.92 42.57 1blr s ASP 77 CO 0.69 -0.04 0.00 0.61 0.52 0.00 0.00 175.17 176.95 1blr n GLY 78 N 2.97 2.10 3.40 2.66 0.00 -1.26 -5.06 105.19 110.01 1blr n GLY 78 Ca -0.16 -0.59 -0.14 0.00 0.00 0.00 0.00 46.02 45.13 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 1.65 0.60 1.61 0.52 -1.26 -5.10 118.95 116.97 1blr s ARG 79 Ca 0.00 -1.69 -0.10 0.00 -0.52 0.00 0.00 55.73 53.42 1blr s ARG 79 Cb 0.00 0.38 0.14 0.00 0.52 0.00 0.00 34.95 36.00 1blr s ARG 79 CO 0.00 -0.64 0.70 -0.35 0.02 0.00 0.00 175.30 175.03 1blr n PRO 80 N -0.48 -1.24 -3.64 3.54 -0.04 -1.26 -2.60 135.00 129.28 1blr n PRO 80 Ca 0.02 -1.10 -0.08 0.00 -0.04 0.00 0.00 63.50 62.31 1blr n PRO 80 Cb 0.63 -0.82 -0.07 0.00 -0.04 0.00 0.00 33.50 33.20 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 1.99 1.69 -4.09 0.00 2.85 -0.35 0.28 118.16 120.53 1blr n LYS 82 Ca -0.12 -0.74 -0.16 0.00 -1.05 0.00 0.00 58.31 56.24 1blr n LYS 82 Cb 0.56 0.21 -0.05 0.00 -0.65 0.00 0.00 35.03 35.10 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 -1.12 -1.16 -3.41 -5.58 3.41 -1.05 -1.67 113.62 103.04 1blr n SER 83 Ca -0.04 -3.02 0.01 0.00 -0.26 0.00 0.00 58.87 55.57 1blr n SER 83 Cb 0.13 2.28 -0.04 0.00 -0.26 0.00 0.00 64.21 66.32 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 -0.66 0.09 1.04 0.20 -1.13 -2.02 118.68 116.20 1blr s LEU 84 Ca 0.33 0.86 -0.13 0.00 0.69 0.00 0.00 54.13 55.88 1blr s LEU 84 Cb -0.00 1.74 -0.06 0.00 -0.43 0.00 0.00 46.19 47.43 1blr s LEU 84 CO 0.24 -0.13 0.47 -0.69 -0.29 0.00 0.00 176.35 175.95 1blr s VAL 85 N 2.55 4.97 0.00 1.68 1.01 -1.19 -1.89 120.40 127.53 1blr s VAL 85 Ca -0.02 0.69 0.00 0.00 0.00 0.00 0.00 61.98 62.65 1blr s VAL 85 Cb -0.07 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.60 1blr s VAL 85 CO -0.17 0.33 0.00 1.17 0.00 0.00 0.00 175.10 176.42 1blr n LYS 86 N 1.04 0.00 -4.04 2.72 3.00 -0.82 -4.48 118.16 115.57 1blr n LYS 86 Ca -0.08 0.00 -0.24 0.00 -0.00 0.00 0.00 58.31 57.99 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 0.82 0.02 5.64 7.02 -1.26 -1.95 117.44 127.72 1blr n TRP 87 Ca 0.00 -1.94 0.00 0.00 -1.02 0.00 0.00 57.50 54.54 1blr n TRP 87 Cb 0.00 -0.23 0.00 0.00 -2.42 0.00 0.00 31.31 28.66 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 -0.94 0.00 0.02 -0.99 4.07 0.17 -4.49 120.64 118.47 1blr n GLU 88 Ca -0.15 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.95 1blr n GLU 88 Cb 0.49 -0.11 0.00 0.00 -0.06 0.00 0.00 31.44 31.76 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 -2.74 0.05 0.00 4.31 3.41 -1.24 -4.99 113.62 112.41 1blr n SER 89 Ca 0.00 0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 1blr n SER 89 Cb 0.10 0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 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 -2.81 0.00 -0.07 4.33 0.28 -1.26 -4.90 120.64 116.21 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 0.17 0.00 0.09 0.00 1.43 0.00 0.00 31.44 33.12 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 -4.37 -1.84 4.13 -1.26 -3.96 115.26 110.24 1blr n ASN 91 Ca 0.00 -1.67 -0.31 0.00 1.68 0.00 0.00 54.58 54.28 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 -0.54 0.28 0.00 0.00 177.26 177.00 1blr s LYS 92 N -0.92 2.10 0.11 3.52 3.01 -1.26 -1.87 119.74 124.43 1blr s LYS 92 Ca 0.16 -0.94 -0.08 0.00 -1.01 0.00 0.00 55.97 54.10 1blr s LYS 92 Cb 0.10 -2.11 -0.01 0.00 -1.01 0.00 0.00 37.83 34.80 1blr s LYS 92 CO 0.14 0.56 0.20 0.00 0.51 0.00 0.00 175.35 176.75 1blr s MET 93 N -0.92 0.93 0.31 1.68 0.23 -0.21 -0.65 119.30 120.67 1blr s MET 93 Ca 0.11 -1.07 0.01 0.00 -1.03 0.00 0.00 55.69 53.72 1blr s MET 93 Cb -0.10 0.34 -0.00 0.00 -1.53 0.00 0.00 34.83 33.53 1blr s MET 93 CO 0.01 -0.31 0.04 1.33 -2.03 0.00 0.00 175.02 174.06 1blr n VAL 94 N -0.10 0.00 -2.73 5.16 0.24 -0.82 -1.41 118.33 118.67 1blr n VAL 94 Ca -0.12 -1.58 -0.06 0.00 -2.04 0.00 0.00 64.34 60.54 1blr n VAL 94 Cb 0.63 0.42 0.04 0.00 -1.47 0.00 0.00 33.84 33.45 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 0.72 3.20 -0.24 0.00 2.12 -0.79 -1.71 118.70 122.00 1blr s GLU 96 Ca 0.30 1.37 -0.13 0.00 0.36 0.00 0.00 54.97 56.86 1blr s GLU 96 Cb 0.13 -4.24 -0.04 0.00 0.26 0.00 0.00 34.13 30.24 1blr s GLU 96 CO -0.14 -2.02 0.30 -0.65 -0.54 0.00 0.00 175.26 172.21 1blr s GLN 97 N 5.94 4.09 0.32 4.30 -0.21 -0.34 -2.86 119.66 130.90 1blr s GLN 97 Ca 0.80 -0.03 0.06 0.00 0.02 0.00 0.00 55.36 56.21 1blr s GLN 97 Cb -0.22 -3.57 -0.06 0.00 1.00 0.00 0.00 33.01 30.16 1blr s GLN 97 CO 0.32 -0.07 -0.02 -1.59 -2.12 0.00 0.00 175.29 171.80 1blr s LYS 98 N 1.44 1.67 -0.57 2.91 -2.85 -0.67 -2.51 119.74 119.16 1blr s LYS 98 Ca 0.13 -1.88 0.01 0.00 -1.00 0.00 0.00 55.97 53.23 1blr s LYS 98 Cb -0.15 -1.22 0.50 0.00 -2.06 0.00 0.00 37.83 34.91 1blr s LYS 98 CO 0.08 -0.02 1.91 1.47 0.10 0.00 0.00 175.35 178.88 1blr n LEU 99 N -0.69 7.06 -1.49 2.77 -0.00 -1.26 -1.21 117.00 122.18 1blr n LEU 99 Ca -0.05 -4.15 -0.18 0.00 -0.00 0.00 0.00 56.01 51.64 1blr n LEU 99 Cb 0.65 -0.87 -0.08 0.00 -0.00 0.00 0.00 43.42 43.12 1blr n LEU 99 CO 0.42 1.42 -0.17 0.18 -0.00 0.00 0.00 177.39 179.24 1blr n LEU 100 N -0.97 -1.28 0.02 1.47 4.77 -1.26 -4.09 117.00 115.66 1blr n LEU 100 Ca 0.59 0.44 0.00 0.00 -0.03 0.00 0.00 56.01 57.01 1blr n LEU 100 Cb 0.94 -2.58 0.00 0.00 -2.33 0.00 0.00 43.42 39.45 1blr n LEU 100 CO 0.69 -0.96 0.00 1.17 -1.33 0.00 0.00 177.39 176.95 1blr n LYS 101 N -2.13 0.00 0.00 3.23 3.00 -1.26 -5.11 118.16 115.89 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 0.60 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.63 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 -1.05 -1.95 0.05 3.14 0.00 -1.26 -4.99 105.19 99.13 1blr n GLY 102 Ca 0.00 -1.21 -0.07 0.00 0.00 0.00 0.00 46.02 44.75 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 -0.18 0.75 0.00 1.61 0.28 -1.26 -5.04 120.64 116.80 1blr n GLU 103 Ca 0.00 0.05 0.00 0.00 -0.16 0.00 0.00 57.16 57.05 1blr n GLU 103 Cb 0.00 -1.22 0.00 0.00 1.43 0.00 0.00 31.44 31.65 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 2.88 -0.34 0.00 -1.84 0.00 -1.26 -5.15 105.19 99.48 1blr n GLY 104 Ca -0.18 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.22 1.14 -3.72 1.61 -0.04 -1.26 -5.06 135.00 127.44 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 1.10 0.33 0.54 2.20 -1.26 -4.83 119.74 117.83 1blr s LYS 106 Ca 0.00 -0.60 0.07 0.00 -0.36 0.00 0.00 55.97 55.09 1blr s LYS 106 Cb 0.00 0.38 -0.02 0.00 -1.51 0.00 0.00 37.83 36.68 1blr s LYS 106 CO 0.00 -0.50 0.33 0.95 -0.36 0.00 0.00 175.35 175.77 1blr s THR 107 N -3.20 3.73 0.00 3.43 -4.23 -1.04 -1.56 115.64 112.76 1blr s THR 107 Ca 0.12 -1.28 0.00 0.00 -1.18 0.00 0.00 61.69 59.35 1blr s THR 107 Cb -0.01 -3.26 0.00 0.00 1.34 0.00 0.00 72.50 70.57 1blr s THR 107 CO 0.01 -0.18 0.00 -1.54 -0.54 0.00 0.00 174.62 172.37 1blr n SER 108 N -1.43 0.00 -3.60 3.99 3.41 -1.05 -1.19 113.62 113.75 1blr n SER 108 Ca -0.02 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.45 1blr n SER 108 Cb 0.59 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 -0.68 -0.17 7.33 1.48 -0.70 0.22 118.94 124.43 1blr s TRP 109 Ca 0.00 1.51 -0.01 0.00 -1.06 0.00 0.00 56.10 56.53 1blr s TRP 109 Cb 0.00 0.33 0.05 0.00 -1.16 0.00 0.00 33.47 32.69 1blr s TRP 109 CO 0.00 -0.41 -0.02 0.95 -4.06 0.00 0.00 176.95 173.41 1blr s THR 110 N -0.15 0.89 -0.12 0.66 -4.23 -0.60 0.11 115.64 112.19 1blr s THR 110 Ca -0.02 -0.59 -0.22 0.00 -1.18 0.00 0.00 61.69 59.67 1blr s THR 110 Cb -0.03 -1.18 -0.03 0.00 1.34 0.00 0.00 72.50 72.60 1blr s THR 110 CO 0.02 0.01 0.68 -0.13 -0.54 0.00 0.00 174.62 174.66 1blr s ARG 111 N 1.72 4.35 0.07 3.99 0.52 -0.50 -2.06 118.95 127.05 1blr s ARG 111 Ca -0.00 0.79 0.06 0.00 -0.52 0.00 0.00 55.73 56.06 1blr s ARG 111 Cb -0.16 -3.49 -0.03 0.00 0.52 0.00 0.00 34.95 31.79 1blr s ARG 111 CO -0.07 -0.05 -0.16 -2.00 0.02 0.00 0.00 175.30 173.03 1blr s GLU 112 N 1.23 0.96 0.36 3.54 2.12 -0.51 -1.05 118.70 125.35 1blr s GLU 112 Ca 0.34 -0.98 0.08 0.00 0.36 0.00 0.00 54.97 54.77 1blr s GLU 112 Cb -0.17 -1.04 -0.03 0.00 0.26 0.00 0.00 34.13 33.15 1blr s GLU 112 CO 0.15 0.24 0.28 -0.51 -0.54 0.00 0.00 175.26 174.88 1blr s LEU 113 N -1.64 3.46 -0.23 2.70 2.01 -0.78 -0.50 118.68 123.69 1blr s LEU 113 Ca 0.02 -0.64 -0.12 0.00 0.01 0.00 0.00 54.13 53.40 1blr s LEU 113 Cb -0.10 -2.05 0.08 0.00 0.01 0.00 0.00 46.19 44.13 1blr s LEU 113 CO 0.03 -0.43 0.55 -0.89 1.01 0.00 0.00 176.35 176.62 1blr s THR 114 N -2.38 -0.15 0.00 5.49 2.01 -0.89 -4.84 115.64 114.87 1blr s THR 114 Ca 0.42 0.05 0.00 0.00 0.31 0.00 0.00 61.69 62.47 1blr s THR 114 Cb -0.04 -0.82 0.00 0.00 0.01 0.00 0.00 72.50 71.65 1blr s THR 114 CO 0.26 0.02 0.00 0.59 -0.69 0.00 0.00 174.62 174.80 1blr n ASN 115 N 4.49 0.00 -1.22 3.53 4.13 -1.26 -2.71 115.26 122.21 1blr n ASN 115 Ca -0.20 0.00 -0.03 0.00 1.68 0.00 0.00 54.58 56.03 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 3.06 -0.63 0.00 6.41 2.03 -1.26 -4.99 116.55 121.17 1blr n ASP 116 Ca 0.00 -1.29 0.00 0.00 0.52 0.00 0.00 54.79 54.02 1blr n ASP 116 Cb 0.00 0.23 0.00 0.00 -0.72 0.00 0.00 41.12 40.63 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 -0.28 0.00 2.38 0.27 0.00 -1.10 -4.89 105.19 101.57 1blr n GLY 117 Ca -0.14 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.67 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 0.53 -2.80 1.61 1.02 -1.15 -3.95 120.64 115.90 1blr n GLU 118 Ca 0.00 -2.90 -0.43 0.00 -0.02 0.00 0.00 57.16 53.81 1blr n GLU 118 Cb 0.00 -1.42 -0.04 0.00 -0.02 0.00 0.00 31.44 29.96 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 -0.51 4.04 -0.46 -4.62 0.20 -0.52 -2.10 118.68 114.70 1blr s LEU 119 Ca 0.33 -0.52 -0.21 0.00 0.69 0.00 0.00 54.13 54.42 1blr s LEU 119 Cb 0.12 -2.70 0.03 0.00 -0.43 0.00 0.00 46.19 43.21 1blr s LEU 119 CO -0.15 -1.37 0.70 0.27 -0.29 0.00 0.00 176.35 175.50 1blr s ILE 120 N 4.25 4.76 -0.25 6.68 -5.25 0.34 -0.50 121.20 131.23 1blr s ILE 120 Ca 0.29 0.08 -0.05 0.00 -0.99 0.00 0.00 60.65 59.98 1blr s ILE 120 Cb -0.13 -4.28 -0.01 0.00 2.95 0.00 0.00 42.46 41.00 1blr s ILE 120 CO 0.17 -0.71 0.01 -0.22 -1.79 0.00 0.00 174.94 172.40 1blr s LEU 121 N 2.99 3.26 0.26 0.37 1.98 -1.08 -1.42 118.68 125.04 1blr s LEU 121 Ca 0.23 -0.43 0.06 0.00 -2.89 0.00 0.00 54.13 51.10 1blr s LEU 121 Cb -0.14 -1.82 -0.03 0.00 0.66 0.00 0.00 46.19 44.86 1blr s LEU 121 CO 0.18 -0.07 0.35 -0.89 -1.89 0.00 0.00 176.35 174.04 1blr s THR 122 N 1.51 4.87 -0.36 3.68 2.01 -0.87 -3.13 115.64 123.35 1blr s THR 122 Ca 0.05 -1.07 0.06 0.00 0.31 0.00 0.00 61.69 61.05 1blr s THR 122 Cb -0.15 -3.69 0.18 0.00 0.01 0.00 0.00 72.50 68.85 1blr s THR 122 CO -0.00 -0.30 0.57 -0.32 -0.69 0.00 0.00 174.62 173.88 1blr s MET 123 N -3.99 0.68 0.98 4.92 0.00 -0.82 -1.56 119.30 119.51 1blr s MET 123 Ca 0.36 -0.05 -0.12 0.00 0.00 0.00 0.00 55.69 55.88 1blr s MET 123 Cb -0.09 0.02 0.18 0.00 0.00 0.00 0.00 34.83 34.94 1blr s MET 123 CO 0.29 -1.13 1.11 0.95 0.00 0.00 0.00 175.02 176.23 1blr s THR 124 N 2.16 2.01 -0.30 10.11 -4.23 0.13 -2.14 115.64 123.39 1blr s THR 124 Ca 0.14 0.00 -0.12 0.00 -1.18 0.00 0.00 61.69 60.53 1blr s THR 124 Cb -0.08 -2.58 0.18 0.00 1.34 0.00 0.00 72.50 71.36 1blr s THR 124 CO -0.14 -0.00 1.06 0.00 -0.54 0.00 0.00 174.62 174.99 1blr s ALA 125 N -3.08 -3.90 -1.21 3.99 0.00 -0.72 -2.51 121.76 114.33 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 -0.17 -2.74 0.00 0.00 0.00 0.00 0.00 23.12 20.20 1blr s ALA 125 CO 0.56 -1.91 0.22 -3.47 0.00 0.00 0.00 175.76 171.16 1blr n ASP 126 N 5.22 -4.71 0.00 0.00 -0.08 -0.60 -2.06 116.55 114.32 1blr n ASP 126 Ca 0.04 -0.11 0.00 0.00 -1.51 0.00 0.00 54.79 53.21 1blr n ASP 126 Cb 0.57 -3.71 0.00 0.00 2.34 0.00 0.00 41.12 40.31 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 -1.10 0.00 -4.49 1.67 2.03 -1.25 -4.40 116.55 109.01 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 0.14 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 -2.51 2.09 -0.27 5.18 -7.23 -0.88 -4.75 120.40 112.03 1blr s VAL 128 Ca 0.00 -0.23 -0.06 0.00 -1.81 0.00 0.00 61.98 59.88 1blr s VAL 128 Cb 0.00 -2.87 0.14 0.00 0.56 0.00 0.00 36.38 34.21 1blr s VAL 128 CO 0.00 0.00 0.55 -0.69 -0.31 0.00 0.00 175.10 174.65 1blr s VAL 129 N -3.53 -0.86 -0.78 1.32 1.01 -1.26 -1.76 120.40 114.54 1blr s VAL 129 Ca 0.68 0.03 -0.15 0.00 0.00 0.00 0.00 61.98 62.54 1blr s VAL 129 Cb -0.06 -0.89 0.18 0.00 0.00 0.00 0.00 36.38 35.61 1blr s VAL 129 CO 0.49 0.00 0.77 0.00 0.00 0.00 0.00 175.10 176.36 1blr s THR 131 N 0.95 4.32 -0.05 0.00 2.01 -1.26 -1.95 115.64 119.66 1blr s THR 131 Ca 0.17 -0.19 -0.03 0.00 0.31 0.00 0.00 61.69 61.95 1blr s THR 131 Cb -0.14 -3.04 0.03 0.00 0.01 0.00 0.00 72.50 69.37 1blr s THR 131 CO -0.06 0.32 0.12 0.00 -0.69 0.00 0.00 174.62 174.32 1blr s ARG 132 N 1.61 0.09 0.62 4.92 1.70 -1.18 -4.39 118.95 122.32 1blr s ARG 132 Ca 0.06 0.29 -0.14 0.00 -0.47 0.00 0.00 55.73 55.47 1blr s ARG 132 Cb -0.15 -0.12 -0.03 0.00 -0.57 0.00 0.00 34.95 34.08 1blr s ARG 132 CO 0.04 -0.13 1.05 0.08 -1.08 0.00 0.00 175.30 175.26 1blr s VAL 133 N 0.86 3.94 0.28 4.99 1.01 0.63 -2.65 120.40 129.46 1blr s VAL 133 Ca -0.07 0.83 0.02 0.00 0.00 0.00 0.00 61.98 62.76 1blr s VAL 133 Cb -0.09 -3.42 -0.05 0.00 0.00 0.00 0.00 36.38 32.83 1blr s VAL 133 CO -0.04 -0.63 0.11 -0.31 0.00 0.00 0.00 175.10 174.23 1blr s TYR 134 N -2.65 1.58 0.10 5.22 1.51 0.34 -0.49 117.35 122.96 1blr s TYR 134 Ca 0.61 -1.22 -0.04 0.00 -1.01 0.00 0.00 57.07 55.42 1blr s TYR 134 Cb -0.15 -0.92 -0.03 0.00 -0.11 0.00 0.00 41.96 40.76 1blr s TYR 134 CO 0.42 -0.36 0.08 0.08 -1.11 0.00 0.00 175.55 174.66 1blr s VAL 135 N -3.68 0.15 -0.29 0.71 1.01 -1.14 -1.44 120.40 115.72 1blr s VAL 135 Ca 0.37 -1.65 -0.27 0.00 0.00 0.00 0.00 61.98 60.43 1blr s VAL 135 Cb 0.07 -1.67 0.01 0.00 0.00 0.00 0.00 36.38 34.79 1blr s VAL 135 CO 0.15 -0.68 0.95 -0.13 0.00 0.00 0.00 175.10 175.38 1blr s ARG 136 N -3.95 4.09 0.00 2.72 0.52 -1.25 -1.63 118.95 119.44 1blr s ARG 136 Ca 0.13 0.96 0.00 0.00 -0.52 0.00 0.00 55.73 56.29 1blr s ARG 136 Cb 0.07 -3.70 0.00 0.00 0.52 0.00 0.00 34.95 31.83 1blr s ARG 136 CO -0.06 -0.73 0.35 -1.91 0.02 0.00 0.00 175.30 172.98