#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 -2.66 0.03 3.54 4.13 -1.26 -4.44 115.26 114.60 1blr n ASN 2 Ca 0.00 0.04 0.11 0.00 1.68 0.00 0.00 54.58 56.41 1blr n ASN 2 Cb 0.00 -1.12 -0.03 0.00 -1.54 0.00 0.00 39.78 37.09 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 -3.37 0.28 -1.64 3.10 3.01 -1.26 -4.88 117.46 112.71 1blr n PHE 3 Ca -0.03 0.08 -0.43 0.00 1.01 0.00 0.00 57.45 58.08 1blr n PHE 3 Cb 0.28 -0.49 -0.03 0.00 -0.01 0.00 0.00 39.48 39.23 1blr n PHE 3 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 1blr s SER 4 N -4.17 5.74 0.00 4.37 0.01 -1.26 -4.66 113.70 113.73 1blr s SER 4 Ca 0.01 2.09 0.00 0.00 1.31 0.00 0.00 55.95 59.36 1blr s SER 4 Cb 0.14 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.85 1blr s SER 4 CO 0.83 -1.71 0.00 0.61 0.41 0.00 0.00 173.24 173.38 1blr n GLY 5 N 5.41 3.70 3.84 3.44 0.00 -0.99 -4.98 105.19 115.61 1blr n GLY 5 Ca 0.27 -0.97 -0.32 0.00 0.00 0.00 0.00 46.02 45.00 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 6.34 -0.04 1.61 3.84 -1.26 -1.98 114.94 123.45 1blr s ASN 6 Ca 0.00 1.59 0.01 0.00 0.21 0.00 0.00 52.86 54.67 1blr s ASN 6 Cb 0.00 -2.50 0.02 0.00 -0.55 0.00 0.00 41.25 38.21 1blr s ASN 6 CO 0.00 -0.78 -0.06 0.26 -2.79 0.00 0.00 177.10 173.73 1blr s TRP 7 N -2.72 0.79 0.37 0.43 0.52 -0.99 -2.09 118.94 115.26 1blr s TRP 7 Ca 0.59 -0.22 0.00 0.00 0.02 0.00 0.00 56.10 56.49 1blr s TRP 7 Cb -0.11 -0.66 -0.03 0.00 -1.15 0.00 0.00 33.47 31.52 1blr s TRP 7 CO 0.38 -0.17 0.58 0.15 0.02 0.00 0.00 176.95 177.91 1blr s LYS 8 N 0.73 3.40 0.36 4.98 3.01 -0.67 -2.86 119.74 128.69 1blr s LYS 8 Ca -0.10 -0.35 -0.25 0.00 -1.01 0.00 0.00 55.97 54.26 1blr s LYS 8 Cb -0.13 -2.63 -0.10 0.00 -1.01 0.00 0.00 37.83 33.96 1blr s LYS 8 CO 0.01 0.04 0.98 0.96 0.51 0.00 0.00 175.35 177.85 1blr s ILE 9 N -2.38 4.07 -0.25 2.17 -5.25 -1.26 -2.98 121.20 115.31 1blr s ILE 9 Ca 0.42 1.61 -0.03 0.00 -0.99 0.00 0.00 60.65 61.67 1blr s ILE 9 Cb -0.10 -3.84 0.14 0.00 2.95 0.00 0.00 42.46 41.61 1blr s ILE 9 CO 0.37 0.03 0.42 -0.63 -1.79 0.00 0.00 174.94 173.34 1blr s ILE 10 N -1.71 -0.67 -0.31 8.37 1.09 0.63 -4.85 121.20 123.75 1blr s ILE 10 Ca 0.54 -0.05 -0.05 0.00 -1.10 0.00 0.00 60.65 59.99 1blr s ILE 10 Cb -0.18 -0.84 0.01 0.00 -1.06 0.00 0.00 42.46 40.39 1blr s ILE 10 CO 0.24 -0.09 0.20 0.54 -0.10 0.00 0.00 174.94 175.72 1blr n ARG 11 N 5.38 -2.70 -3.70 2.79 3.00 -1.26 -0.33 116.66 119.83 1blr n ARG 11 Ca -0.03 2.29 -0.29 0.00 -0.01 0.00 0.00 57.85 59.80 1blr n ARG 11 Cb 0.50 -4.97 -0.15 0.00 0.00 0.00 0.00 32.46 27.84 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 -1.80 3.76 -0.39 0.55 0.15 -1.26 -2.73 113.70 111.98 1blr s SER 12 Ca 0.08 -1.44 0.10 0.00 0.70 0.00 0.00 55.95 55.39 1blr s SER 12 Cb -0.02 -0.73 0.30 0.00 -1.71 0.00 0.00 66.02 63.86 1blr s SER 12 CO 0.68 -0.40 0.65 1.21 1.20 0.00 0.00 173.24 176.59 1blr n GLU 13 N 4.95 0.85 0.00 5.44 2.13 -1.26 -4.88 120.64 127.87 1blr n GLU 13 Ca -0.04 -3.21 0.00 0.00 0.66 0.00 0.00 57.16 54.57 1blr n GLU 13 Cb 0.43 -1.46 0.00 0.00 0.27 0.00 0.00 31.44 30.68 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 0.83 3.73 -0.24 4.31 4.13 -1.26 -4.75 115.26 122.00 1blr n ASN 14 Ca 0.22 0.00 -0.02 0.00 1.68 0.00 0.00 54.58 56.46 1blr n ASN 14 Cb 0.60 0.73 0.04 0.00 -1.54 0.00 0.00 39.78 39.62 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 -0.72 -0.31 3.10 3.04 -1.90 0.25 116.94 120.41 1blr h PHE 15 Ca 0.00 0.07 -0.09 0.00 3.98 0.00 0.00 57.97 61.93 1blr h PHE 15 Cb 0.02 0.42 -0.02 0.00 2.56 0.00 0.00 35.95 38.93 1blr h PHE 15 CO 0.00 -0.36 -0.19 0.93 -2.02 0.00 0.00 178.31 176.67 1blr h GLU 16 N -0.08 0.57 0.00 1.11 5.08 -1.91 -0.98 114.58 118.37 1blr h GLU 16 Ca 0.29 -0.20 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1blr h GLU 16 Cb 0.55 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 1blr h GLU 16 CO -0.74 0.73 -0.02 1.49 -1.00 0.00 0.00 179.01 179.48 1blr h GLU 17 N 0.51 0.00 -0.00 2.33 4.81 -0.88 -0.26 114.58 121.10 1blr h GLU 17 Ca 0.08 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.27 1blr h GLU 17 Cb 0.62 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.00 1blr h GLU 17 CO 0.04 0.02 -0.17 -0.07 -0.73 0.00 0.00 179.01 178.10 1blr h LEU 18 N 0.00 0.16 -0.29 1.64 3.38 0.29 -1.54 115.31 118.96 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 0.06 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1blr h LEU 18 CO 0.00 0.90 0.00 0.18 0.09 0.00 0.00 178.44 179.62 1blr n LEU 19 N -4.57 0.42 -0.03 1.67 7.99 -0.88 -1.78 117.00 119.82 1blr n LEU 19 Ca -0.10 -0.19 -0.00 0.00 -0.01 0.00 0.00 56.01 55.71 1blr n LEU 19 Cb 0.46 -0.04 -0.10 0.00 -0.11 0.00 0.00 43.42 43.64 1blr n LEU 19 CO 0.38 0.09 -0.77 0.29 -1.51 0.00 0.00 177.39 175.86 1blr n LYS 20 N -0.43 1.29 -0.08 3.23 5.02 -0.16 -4.03 118.16 123.00 1blr n LYS 20 Ca 0.11 -0.06 -0.10 0.00 -2.02 0.00 0.00 58.31 56.24 1blr n LYS 20 Cb 0.11 -1.30 -0.15 0.00 -0.02 0.00 0.00 35.03 33.67 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 -2.21 1.44 0.28 -0.18 0.24 -0.59 -3.47 118.33 113.84 1blr n VAL 21 Ca -0.11 -0.84 0.18 0.00 -2.04 0.00 0.00 64.34 61.54 1blr n VAL 21 Cb 0.63 -0.62 0.98 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 -1.57 -3.44 115.31 111.64 1blr h LEU 22 Ca -0.50 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.38 1blr h LEU 22 Cb 2.19 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.85 1blr h LEU 22 CO 0.04 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.09 1blr n GLY 23 N -1.09 0.37 3.60 0.17 0.00 -1.26 -5.07 105.19 101.91 1blr n GLY 23 Ca -0.02 -0.34 -0.43 0.00 0.00 0.00 0.00 46.02 45.23 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 2.20 -2.65 1.61 3.14 -1.23 -4.91 118.33 116.49 1blr n VAL 24 Ca 0.00 -0.50 -0.04 0.00 -2.96 0.00 0.00 64.34 60.84 1blr n VAL 24 Cb 0.00 -1.10 0.08 0.00 -1.06 0.00 0.00 33.84 31.76 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 0.83 -1.00 0.00 6.55 5.15 -1.26 -4.89 115.26 120.63 1blr n ASN 25 Ca 0.09 -1.50 0.00 0.00 -0.60 0.00 0.00 54.58 52.57 1blr n ASN 25 Cb 0.36 0.53 0.00 0.00 -0.53 0.00 0.00 39.78 40.14 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 1.44 0.00 0.20 3.44 0.31 -1.26 -4.89 118.33 117.58 1blr n VAL 26 Ca -0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.24 1blr n VAL 26 Cb 0.72 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 33.61 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 2.36 -0.51 -6.24 5.55 2.86 -1.90 -3.45 114.93 113.60 1blr h MET 27 Ca 0.00 0.03 -0.33 0.00 -2.06 0.00 0.00 59.70 57.34 1blr h MET 27 Cb 0.00 0.12 0.01 0.00 0.06 0.00 0.00 31.60 31.79 1blr h MET 27 CO 0.00 -0.34 -0.73 1.28 1.06 0.00 0.00 176.91 178.18 1blr n LEU 28 N -3.85 -3.51 -1.54 1.22 7.99 -1.26 0.38 117.00 116.43 1blr n LEU 28 Ca -0.07 -0.71 -0.19 0.00 -0.01 0.00 0.00 56.01 55.04 1blr n LEU 28 Cb 0.21 -2.28 -0.07 0.00 -0.11 0.00 0.00 43.42 41.17 1blr n LEU 28 CO 0.16 -0.06 -0.19 0.54 -1.51 0.00 0.00 177.39 176.34 1blr n ARG 29 N -2.71 -1.32 -2.00 3.23 3.00 -1.26 -2.17 116.66 113.43 1blr n ARG 29 Ca -0.18 1.11 -0.07 0.00 -0.01 0.00 0.00 57.85 58.71 1blr n ARG 29 Cb 0.61 -5.44 -0.01 0.00 0.00 0.00 0.00 32.46 27.62 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 -2.51 -2.06 -3.95 5.56 5.02 0.16 -2.23 118.16 118.15 1blr n LYS 30 Ca -0.19 0.34 -0.30 0.00 -2.02 0.00 0.00 58.31 56.14 1blr n LYS 30 Cb 0.62 -4.74 -0.02 0.00 -0.02 0.00 0.00 35.03 30.87 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 -2.41 -1.43 0.00 -0.18 2.08 -0.92 -4.17 119.36 112.33 1blr n ILE 31 Ca -0.07 -0.41 0.00 0.00 0.56 0.00 0.00 62.75 62.82 1blr n ILE 31 Cb 0.43 -1.26 0.00 0.00 -0.75 0.00 0.00 39.64 38.06 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 -3.91 0.00 -1.52 -1.39 0.00 -1.13 -5.09 120.51 107.47 1blr n ALA 32 Ca -0.15 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 52.90 1blr n ALA 32 Cb 0.47 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.82 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 -0.04 0.00 0.00 0.31 -0.95 -4.79 118.33 112.86 1blr n VAL 33 Ca 0.00 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 63.95 1blr n VAL 33 Cb 0.00 -1.59 0.00 0.00 -0.91 0.00 0.00 33.84 31.34 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 13.06 0.00 -3.87 3.52 0.00 -1.26 -4.92 120.51 127.04 1blr n ALA 34 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.97 1blr n ALA 34 Cb 0.27 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.73 1blr n ALA 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1blr s ALA 35 N 0.00 -2.10 0.25 0.00 0.00 -1.26 -5.19 121.76 113.46 1blr s ALA 35 Ca 0.00 0.06 -0.11 0.00 0.00 0.00 0.00 51.96 51.91 1blr s ALA 35 Cb 0.00 0.73 -0.01 0.00 0.00 0.00 0.00 23.12 23.84 1blr s ALA 35 CO 0.00 -1.10 0.43 0.00 0.00 0.00 0.00 175.76 175.09 1blr s ALA 36 N -2.23 0.02 0.09 0.00 0.00 -1.26 -5.18 121.76 113.20 1blr s ALA 36 Ca 0.23 -1.03 -0.24 0.00 0.00 0.00 0.00 51.96 50.92 1blr s ALA 36 Cb -0.00 1.12 0.06 0.00 0.00 0.00 0.00 23.12 24.30 1blr s ALA 36 CO 0.01 -0.81 0.59 -1.12 0.00 0.00 0.00 175.76 174.42 1blr s SER 37 N -3.05 -0.54 -0.08 0.00 0.01 -1.26 -4.97 113.70 103.80 1blr s SER 37 Ca 0.25 0.16 -0.20 0.00 1.31 0.00 0.00 55.95 57.47 1blr s SER 37 Cb 0.00 0.56 -0.16 0.00 0.21 0.00 0.00 66.02 66.64 1blr s SER 37 CO 0.10 -0.84 0.71 0.11 0.41 0.00 0.00 173.24 173.73 1blr h LYS 38 N 2.37 -0.12 0.00 12.44 1.79 -1.96 -3.46 116.57 127.63 1blr h LYS 38 Ca -0.32 0.01 -0.43 0.00 -2.18 0.00 0.00 60.65 57.73 1blr h LYS 38 Cb 1.25 0.03 0.18 0.00 -1.58 0.00 0.00 32.23 32.11 1blr h LYS 38 CO 0.39 0.38 0.35 -0.35 -1.08 0.00 0.00 179.45 179.15 1blr n PRO 39 N -4.82 -1.75 0.00 3.15 -0.04 -1.26 -4.69 135.00 125.59 1blr n PRO 39 Ca -0.07 -2.00 0.00 0.00 -0.04 0.00 0.00 63.50 61.39 1blr n PRO 39 Cb 0.27 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.29 1blr n PRO 39 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1blr n ALA 40 N -4.11 0.82 -3.84 0.55 0.00 -1.18 -4.72 120.51 108.03 1blr n ALA 40 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1blr n ALA 40 Cb 0.59 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.04 1blr n ALA 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1blr s VAL 41 N -1.65 0.00 -0.28 0.00 0.11 -1.14 -1.64 120.40 115.81 1blr s VAL 41 Ca 0.00 -0.33 -0.01 0.00 -2.93 0.00 0.00 61.98 58.71 1blr s VAL 41 Cb 0.00 -2.60 0.17 0.00 -1.53 0.00 0.00 36.38 32.42 1blr s VAL 41 CO 0.00 0.00 0.50 -1.83 -3.33 0.00 0.00 175.10 170.44 1blr s GLU 42 N -2.27 0.47 0.10 1.54 -1.05 -0.83 -2.33 118.70 114.32 1blr s GLU 42 Ca 0.22 0.76 -0.11 0.00 -0.15 0.00 0.00 54.97 55.69 1blr s GLU 42 Cb 0.00 0.08 -0.06 0.00 -0.44 0.00 0.00 34.13 33.72 1blr s GLU 42 CO 0.00 -0.66 0.44 0.42 0.95 0.00 0.00 175.26 176.42 1blr s ILE 43 N 2.72 5.03 -0.30 1.83 1.01 -0.84 -2.15 121.20 128.50 1blr s ILE 43 Ca 0.17 0.55 -0.03 0.00 0.00 0.00 0.00 60.65 61.34 1blr s ILE 43 Cb -0.15 -3.67 0.11 0.00 0.01 0.00 0.00 42.46 38.76 1blr s ILE 43 CO -0.19 0.27 0.17 -0.54 0.00 0.00 0.00 174.94 174.65 1blr s LYS 44 N -1.93 0.28 0.01 2.79 1.02 -0.92 -2.35 119.74 118.63 1blr s LYS 44 Ca 0.34 -0.65 0.08 0.00 0.02 0.00 0.00 55.97 55.76 1blr s LYS 44 Cb -0.14 -1.13 -0.02 0.00 -0.52 0.00 0.00 37.83 36.02 1blr s LYS 44 CO 0.18 -1.06 -0.24 1.14 -0.92 0.00 0.00 175.35 174.46 1blr s GLN 45 N 1.92 1.80 -0.56 1.68 -2.07 -1.26 -1.36 119.66 119.81 1blr s GLN 45 Ca 0.11 -0.92 0.04 0.00 -1.82 0.00 0.00 55.36 52.77 1blr s GLN 45 Cb -0.17 -1.82 0.15 0.00 -1.09 0.00 0.00 33.01 30.08 1blr s GLN 45 CO -0.29 0.49 0.35 -2.00 -1.32 0.00 0.00 175.29 172.52 1blr s GLU 46 N -0.80 1.88 5.55 9.60 2.56 -0.52 -4.82 118.70 132.14 1blr s GLU 46 Ca 0.09 -2.69 0.00 0.00 0.00 0.00 0.00 54.97 52.37 1blr s GLU 46 Cb -0.09 -2.92 0.00 0.00 2.00 0.00 0.00 34.13 33.12 1blr s GLU 46 CO 0.00 -1.22 0.00 0.41 -0.56 0.00 0.00 175.26 173.89 1blr n GLY 47 N 2.76 0.32 0.03 -1.50 0.00 -1.26 -3.09 105.19 102.45 1blr n GLY 47 Ca 0.14 -0.75 0.14 0.00 0.00 0.00 0.00 46.02 45.55 1blr n GLY 47 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1blr n ASP 48 N 6.44 0.10 -4.80 1.61 5.68 -1.26 -4.77 116.55 119.55 1blr n ASP 48 Ca 0.00 -1.15 -0.38 0.00 -0.50 0.00 0.00 54.79 52.76 1blr n ASP 48 Cb 0.00 -0.00 -0.06 0.00 -1.14 0.00 0.00 41.12 39.92 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 -2.00 5.06 0.03 2.12 2.01 -1.18 -1.52 115.64 120.16 1blr s THR 49 Ca 0.42 0.89 0.01 0.00 0.31 0.00 0.00 61.69 63.32 1blr s THR 49 Cb 0.19 -3.75 -0.02 0.00 0.01 0.00 0.00 72.50 68.93 1blr s THR 49 CO 0.32 0.50 -0.06 -0.36 -0.69 0.00 0.00 174.62 174.33 1blr s PHE 50 N -0.56 0.51 0.04 4.92 0.40 -0.71 -1.44 117.98 121.14 1blr s PHE 50 Ca 0.24 -0.46 0.06 0.00 -0.60 0.00 0.00 56.93 56.17 1blr s PHE 50 Cb -0.16 -0.32 -0.02 0.00 0.51 0.00 0.00 43.02 43.03 1blr s PHE 50 CO 0.13 -0.11 -0.17 -0.47 0.70 0.00 0.00 175.22 175.30 1blr s TYR 51 N -1.26 1.50 -0.26 0.36 6.14 -0.46 -2.03 117.35 121.33 1blr s TYR 51 Ca -0.10 -0.35 -0.03 0.00 0.64 0.00 0.00 57.07 57.22 1blr s TYR 51 Cb -0.09 -0.90 0.10 0.00 0.42 0.00 0.00 41.96 41.49 1blr s TYR 51 CO -0.00 0.05 0.17 0.42 0.64 0.00 0.00 175.55 176.84 1blr s ILE 52 N -0.78 -0.18 -0.76 3.14 -1.09 -1.03 -2.16 121.20 118.34 1blr s ILE 52 Ca 0.05 -0.52 -0.15 0.00 -2.23 0.00 0.00 60.65 57.80 1blr s ILE 52 Cb -0.08 -0.88 0.20 0.00 -1.58 0.00 0.00 42.46 40.12 1blr s ILE 52 CO 0.01 -0.53 0.72 -0.75 -1.23 0.00 0.00 174.94 173.16 1blr s LYS 53 N 2.19 3.46 -0.32 2.79 2.20 -0.91 -2.50 119.74 126.66 1blr s LYS 53 Ca 0.08 -2.26 -0.29 0.00 -0.36 0.00 0.00 55.97 53.13 1blr s LYS 53 Cb -0.15 -4.41 0.01 0.00 -1.51 0.00 0.00 37.83 31.76 1blr s LYS 53 CO -0.28 -1.32 1.24 0.99 -0.36 0.00 0.00 175.35 175.62 1blr s THR 54 N 0.58 4.22 -0.22 3.43 2.01 -1.07 -1.97 115.64 122.62 1blr s THR 54 Ca 0.15 1.38 -0.01 0.00 0.31 0.00 0.00 61.69 63.52 1blr s THR 54 Cb -0.15 -4.24 0.02 0.00 0.01 0.00 0.00 72.50 68.14 1blr s THR 54 CO -0.06 -0.51 -0.10 -0.94 -0.69 0.00 0.00 174.62 172.32 1blr s SER 55 N 2.53 3.96 -0.06 3.53 1.04 -0.65 -3.85 113.70 120.21 1blr s SER 55 Ca 0.53 -0.72 -0.08 0.00 0.48 0.00 0.00 55.95 56.17 1blr s SER 55 Cb -0.15 -1.62 -0.03 0.00 0.10 0.00 0.00 66.02 64.32 1blr s SER 55 CO 0.22 -0.07 -0.15 0.41 0.98 0.00 0.00 173.24 174.63 1blr n THR 56 N 4.67 0.88 0.13 2.02 -1.04 -1.24 -3.12 114.28 116.58 1blr n THR 56 Ca -0.18 0.27 0.00 0.00 -2.04 0.00 0.00 64.05 62.10 1blr n THR 56 Cb 0.49 -1.83 0.00 0.00 -1.82 0.00 0.00 70.33 67.17 1blr n THR 56 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1blr n THR 57 N -3.54 0.00 0.00 12.58 -1.04 -1.26 -4.65 114.28 116.37 1blr n THR 57 Ca -0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.95 1blr n THR 57 Cb 0.23 -0.31 0.00 0.00 -1.82 0.00 0.00 70.33 68.42 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 -3.18 0.00 -3.06 12.58 0.24 -1.26 -5.03 118.33 118.62 1blr n VAL 58 Ca 0.00 0.00 -0.39 0.00 -2.04 0.00 0.00 64.34 61.91 1blr n VAL 58 Cb 0.00 -0.61 -0.05 0.00 -1.47 0.00 0.00 33.84 31.70 1blr n VAL 58 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1blr s ARG 59 N -1.82 4.43 -0.46 7.34 1.81 -1.26 -5.01 118.95 123.98 1blr s ARG 59 Ca 0.00 0.96 0.06 0.00 -1.72 0.00 0.00 55.73 55.02 1blr s ARG 59 Cb 0.00 -3.35 0.19 0.00 -0.45 0.00 0.00 34.95 31.34 1blr s ARG 59 CO 0.00 0.34 0.55 2.41 -0.68 0.00 0.00 175.30 177.92 1blr n THR 60 N 2.67 -0.59 -2.00 0.02 -1.04 -1.26 -3.71 114.28 108.37 1blr n THR 60 Ca -0.04 -2.32 -0.29 0.00 -2.04 0.00 0.00 64.05 59.36 1blr n THR 60 Cb 0.50 -0.35 0.04 0.00 -1.82 0.00 0.00 70.33 68.70 1blr n THR 60 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1blr s THR 61 N 0.36 3.67 -0.15 12.58 2.01 -1.25 -4.76 115.64 128.09 1blr s THR 61 Ca 0.32 0.43 -0.11 0.00 0.31 0.00 0.00 61.69 62.64 1blr s THR 61 Cb 0.04 -3.52 0.05 0.00 0.01 0.00 0.00 72.50 69.08 1blr s THR 61 CO -0.13 -0.66 0.38 -1.83 -0.69 0.00 0.00 174.62 171.69 1blr s GLU 62 N -5.26 0.40 -0.41 4.92 1.03 -1.26 -2.60 118.70 115.52 1blr s GLU 62 Ca 0.57 0.63 -0.21 0.00 0.03 0.00 0.00 54.97 55.99 1blr s GLU 62 Cb -0.11 0.08 0.02 0.00 -0.80 0.00 0.00 34.13 33.32 1blr s GLU 62 CO 0.51 -0.11 0.65 0.96 -1.33 0.00 0.00 175.26 175.94 1blr s ILE 63 N 0.80 4.84 -0.97 1.83 -4.36 -1.04 -4.86 121.20 117.44 1blr s ILE 63 Ca -0.05 0.27 -0.13 0.00 -0.26 0.00 0.00 60.65 60.49 1blr s ILE 63 Cb -0.06 -4.17 0.23 0.00 1.25 0.00 0.00 42.46 39.71 1blr s ILE 63 CO -0.06 -0.52 0.97 0.20 0.24 0.00 0.00 174.94 175.78 1blr s ASN 64 N 1.95 6.98 0.00 4.36 0.02 -1.26 -2.46 114.94 124.53 1blr s ASN 64 Ca 0.23 -2.99 0.00 0.00 -1.02 0.00 0.00 52.86 49.09 1blr s ASN 64 Cb -0.14 -2.24 0.00 0.00 0.02 0.00 0.00 41.25 38.89 1blr s ASN 64 CO 0.18 -0.52 0.00 2.22 0.02 0.00 0.00 177.10 179.00 1blr n PHE 65 N 3.86 0.00 -3.78 2.20 -1.74 -0.86 -5.02 117.46 112.11 1blr n PHE 65 Ca 0.20 0.00 -0.19 0.00 -0.56 0.00 0.00 57.45 56.90 1blr n PHE 65 Cb 0.44 0.00 -0.17 0.00 1.52 0.00 0.00 39.48 41.27 1blr n PHE 65 CO 0.00 0.00 0.00 0.15 -0.56 0.00 0.00 176.76 176.35 1blr s LYS 66 N -0.46 0.16 0.60 3.97 1.02 -1.26 -1.74 119.74 122.03 1blr s LYS 66 Ca 0.00 0.21 0.28 0.00 0.02 0.00 0.00 55.97 56.48 1blr s LYS 66 Cb 0.00 -0.54 1.03 0.00 -0.52 0.00 0.00 37.83 37.80 1blr s LYS 66 CO 0.00 -0.24 1.40 0.28 -0.92 0.00 0.00 175.35 175.87 1blr h VAL 67 N 6.34 0.05 -0.36 3.17 2.07 -1.56 0.12 116.25 126.08 1blr h VAL 67 Ca -0.28 0.00 -0.24 0.00 0.82 0.00 0.00 66.70 67.00 1blr h VAL 67 Cb 1.12 0.10 -0.10 0.00 -1.52 0.00 0.00 31.29 30.89 1blr h VAL 67 CO 0.32 0.00 0.31 0.61 0.02 0.00 0.00 177.57 178.83 1blr n GLY 68 N -1.69 3.69 3.65 2.17 0.00 -1.26 -4.27 105.19 107.49 1blr n GLY 68 Ca 0.22 -0.82 -0.09 0.00 0.00 0.00 0.00 46.02 45.32 1blr n GLY 68 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1blr s GLU 69 N -1.37 1.55 0.41 1.61 2.02 0.41 -5.11 118.70 118.23 1blr s GLU 69 Ca 0.23 -0.75 0.08 0.00 0.02 0.00 0.00 54.97 54.55 1blr s GLU 69 Cb 0.18 0.60 -0.03 0.00 0.10 0.00 0.00 34.13 34.98 1blr s GLU 69 CO -0.00 -0.70 0.30 -1.83 0.02 0.00 0.00 175.26 173.04 1blr s GLU 70 N -3.84 2.42 0.31 1.61 1.03 -1.26 -3.26 118.70 115.71 1blr s GLU 70 Ca 0.06 -1.65 0.01 0.00 0.03 0.00 0.00 54.97 53.42 1blr s GLU 70 Cb -0.04 -2.22 -0.00 0.00 -0.80 0.00 0.00 34.13 31.07 1blr s GLU 70 CO -0.02 -0.15 0.02 1.19 -1.33 0.00 0.00 175.26 174.97 1blr n PHE 71 N -1.42 0.60 -4.17 4.83 3.72 -0.82 -4.94 117.46 115.27 1blr n PHE 71 Ca 0.02 -1.65 -0.14 0.00 -0.05 0.00 0.00 57.45 55.63 1blr n PHE 71 Cb 0.63 -0.17 -0.11 0.00 -0.94 0.00 0.00 39.48 38.90 1blr n PHE 71 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1blr s GLU 72 N -3.15 0.82 0.08 -1.08 2.02 -1.26 -2.25 118.70 113.88 1blr s GLU 72 Ca 0.03 -1.16 -0.16 0.00 0.02 0.00 0.00 54.97 53.70 1blr s GLU 72 Cb 0.00 -0.46 0.05 0.00 0.10 0.00 0.00 34.13 33.83 1blr s GLU 72 CO 0.02 0.06 0.75 -1.91 0.02 0.00 0.00 175.26 174.20 1blr n GLU 73 N 0.52 0.33 -4.17 1.61 2.13 0.93 -4.89 120.64 117.11 1blr n GLU 73 Ca -0.16 -0.84 -0.16 0.00 0.66 0.00 0.00 57.16 56.67 1blr n GLU 73 Cb 0.58 1.18 -0.13 0.00 0.27 0.00 0.00 31.44 33.34 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 0.58 0.00 5.31 -0.21 -1.24 -1.66 119.66 120.41 1blr s GLN 74 Ca 0.17 -0.53 0.00 0.00 0.02 0.00 0.00 55.36 55.02 1blr s GLN 74 Cb -0.01 -0.48 0.00 0.00 1.00 0.00 0.00 33.01 33.52 1blr s GLN 74 CO 0.02 0.11 0.00 0.25 -2.12 0.00 0.00 175.29 173.56 1blr n THR 75 N 2.15 0.00 -0.03 -0.19 -2.24 -1.02 -4.83 114.28 108.12 1blr n THR 75 Ca -0.18 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.46 1blr n THR 75 Cb 0.56 -0.43 -0.11 0.00 -2.10 0.00 0.00 70.33 68.25 1blr n THR 75 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1blr h VAL 76 N -1.44 1.55 0.00 2.28 2.07 -1.99 -3.44 116.25 115.28 1blr h VAL 76 Ca 0.00 -1.77 -0.16 0.00 0.82 0.00 0.00 66.70 65.59 1blr h VAL 76 Cb 0.00 2.69 -0.13 0.00 -1.52 0.00 0.00 31.29 32.33 1blr h VAL 76 CO 0.00 0.47 -0.13 -0.90 0.02 0.00 0.00 177.57 177.03 1blr n ASP 77 N -4.64 -1.62 0.00 0.57 5.75 -1.26 -5.09 116.55 110.26 1blr n ASP 77 Ca -0.09 -2.26 0.00 0.00 -0.01 0.00 0.00 54.79 52.43 1blr n ASP 77 Cb 0.41 1.13 0.00 0.00 -1.03 0.00 0.00 41.12 41.64 1blr n ASP 77 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1blr n GLY 78 N -0.36 1.69 3.88 6.12 0.00 -1.26 -5.16 105.19 110.10 1blr n GLY 78 Ca -0.11 -0.23 -0.25 0.00 0.00 0.00 0.00 46.02 45.43 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 0.89 2.31 0.67 1.61 3.00 -1.26 -4.98 118.95 121.19 1blr s ARG 79 Ca 0.00 -1.90 -0.11 0.00 0.00 0.00 0.00 55.73 53.72 1blr s ARG 79 Cb 0.00 -2.15 0.16 0.00 0.00 0.00 0.00 34.95 32.96 1blr s ARG 79 CO 0.00 -0.47 0.79 -0.35 0.00 0.00 0.00 175.30 175.27 1blr n PRO 80 N -1.66 -1.36 -3.65 3.54 -0.04 -1.26 -2.43 135.00 128.15 1blr n PRO 80 Ca -0.00 -1.23 -0.02 0.00 -0.04 0.00 0.00 63.50 62.20 1blr n PRO 80 Cb 0.64 -0.93 -0.07 0.00 -0.04 0.00 0.00 33.50 33.11 1blr n PRO 80 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1blr n LYS 82 N 2.41 1.68 -4.15 0.00 2.85 -0.25 -0.05 118.16 120.65 1blr n LYS 82 Ca -0.14 -0.86 -0.17 0.00 -1.05 0.00 0.00 58.31 56.10 1blr n LYS 82 Cb 0.57 0.22 -0.05 0.00 -0.65 0.00 0.00 35.03 35.11 1blr n LYS 82 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 1blr s SER 83 N -1.66 1.25 -0.30 -5.58 1.04 -0.95 -1.52 113.70 105.98 1blr s SER 83 Ca 0.01 -1.61 -0.15 0.00 0.48 0.00 0.00 55.95 54.68 1blr s SER 83 Cb -0.00 0.65 0.16 0.00 0.10 0.00 0.00 66.02 66.93 1blr s SER 83 CO 0.00 -1.26 0.96 -0.22 0.98 0.00 0.00 173.24 173.71 1blr s LEU 84 N -3.30 -0.63 0.11 2.42 0.20 -1.09 -1.94 118.68 114.45 1blr s LEU 84 Ca 0.34 0.86 -0.12 0.00 0.69 0.00 0.00 54.13 55.90 1blr s LEU 84 Cb 0.00 1.71 -0.06 0.00 -0.43 0.00 0.00 46.19 47.41 1blr s LEU 84 CO 0.24 -0.12 0.47 -0.69 -0.29 0.00 0.00 176.35 175.95 1blr s VAL 85 N 2.49 4.99 0.00 1.68 1.01 -1.20 -1.85 120.40 127.52 1blr s VAL 85 Ca -0.03 0.63 0.00 0.00 0.00 0.00 0.00 61.98 62.58 1blr s VAL 85 Cb -0.07 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.63 1blr s VAL 85 CO -0.18 0.28 0.00 1.17 0.00 0.00 0.00 175.10 176.37 1blr n LYS 86 N 0.89 0.00 -4.62 2.72 3.00 -0.82 -4.47 118.16 114.86 1blr n LYS 86 Ca -0.07 0.00 -0.30 0.00 -0.00 0.00 0.00 58.31 57.94 1blr n LYS 86 Cb 0.52 0.00 -0.07 0.00 0.00 0.00 0.00 35.03 35.48 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 0.71 0.07 5.64 7.02 -1.26 -1.96 117.44 127.67 1blr n TRP 87 Ca 0.00 -2.63 0.00 0.00 -1.02 0.00 0.00 57.50 53.85 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 -1.14 0.00 0.01 -0.99 4.07 -0.32 -4.60 120.64 117.67 1blr n GLU 88 Ca -0.14 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.96 1blr n GLU 88 Cb 0.65 -0.20 0.00 0.00 -0.06 0.00 0.00 31.44 31.83 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 -3.24 0.28 0.00 4.31 3.41 -1.25 -5.01 113.62 112.12 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 0.06 -0.08 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 -3.12 0.00 -0.03 4.33 0.28 -1.26 -4.90 120.64 115.93 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 0.36 0.00 0.07 0.00 1.43 0.00 0.00 31.44 33.30 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 -4.37 -1.84 4.13 -1.26 -3.85 115.26 110.28 1blr n ASN 91 Ca 0.00 -1.61 -0.31 0.00 1.68 0.00 0.00 54.58 54.35 1blr n ASN 91 Cb 0.00 -0.05 -0.15 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 -1.03 2.00 0.14 3.52 2.36 -1.26 -1.69 119.74 123.78 1blr s LYS 92 Ca 0.17 -1.00 -0.09 0.00 -2.55 0.00 0.00 55.97 52.50 1blr s LYS 92 Cb 0.11 -2.07 -0.01 0.00 -1.05 0.00 0.00 37.83 34.81 1blr s LYS 92 CO 0.16 0.54 0.27 0.00 1.55 0.00 0.00 175.35 177.87 1blr s MET 93 N -1.06 1.08 0.29 4.03 0.23 -0.11 -1.17 119.30 122.58 1blr s MET 93 Ca 0.12 -1.11 0.01 0.00 -1.03 0.00 0.00 55.69 53.68 1blr s MET 93 Cb -0.10 0.37 -0.00 0.00 -1.53 0.00 0.00 34.83 33.57 1blr s MET 93 CO 0.02 -0.39 0.04 1.33 -2.03 0.00 0.00 175.02 173.99 1blr n VAL 94 N -0.18 0.00 -2.73 5.16 0.24 -0.83 -1.51 118.33 118.48 1blr n VAL 94 Ca -0.10 -1.50 -0.05 0.00 -2.04 0.00 0.00 64.34 60.65 1blr n VAL 94 Cb 0.63 0.41 0.03 0.00 -1.47 0.00 0.00 33.84 33.44 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 0.74 3.49 -0.24 0.00 2.12 -0.77 -1.58 118.70 122.46 1blr s GLU 96 Ca 0.29 1.48 -0.10 0.00 0.36 0.00 0.00 54.97 57.00 1blr s GLU 96 Cb 0.12 -4.14 -0.05 0.00 0.26 0.00 0.00 34.13 30.32 1blr s GLU 96 CO -0.13 -1.67 0.15 -0.65 -0.54 0.00 0.00 175.26 172.42 1blr s GLN 97 N 5.32 4.01 0.31 4.30 -0.21 -0.45 -2.67 119.66 130.26 1blr s GLN 97 Ca 0.77 -0.30 0.07 0.00 0.02 0.00 0.00 55.36 55.91 1blr s GLN 97 Cb -0.23 -3.51 -0.06 0.00 1.00 0.00 0.00 33.01 30.21 1blr s GLN 97 CO 0.33 0.02 -0.04 -1.59 -2.12 0.00 0.00 175.29 171.88 1blr s LYS 98 N 1.16 1.65 -0.33 2.91 -2.85 -0.57 -2.64 119.74 119.07 1blr s LYS 98 Ca 0.07 -1.86 0.10 0.00 -1.00 0.00 0.00 55.97 53.28 1blr s LYS 98 Cb -0.14 -1.25 0.72 0.00 -2.06 0.00 0.00 37.83 35.10 1blr s LYS 98 CO 0.05 0.02 1.79 1.47 0.10 0.00 0.00 175.35 178.78 1blr n LEU 99 N -0.67 5.97 0.00 2.77 -0.00 -1.26 -1.09 117.00 122.73 1blr n LEU 99 Ca -0.05 -3.29 0.00 0.00 -0.00 0.00 0.00 56.01 52.67 1blr n LEU 99 Cb 0.64 -0.74 0.00 0.00 -0.00 0.00 0.00 43.42 43.32 1blr n LEU 99 CO 0.42 0.85 0.00 0.18 -0.00 0.00 0.00 177.39 178.84 1blr n LEU 100 N -0.33 0.72 0.00 1.47 4.77 -1.26 -4.30 117.00 118.06 1blr n LEU 100 Ca 0.42 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 1blr n LEU 100 Cb 1.38 -1.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1blr n LEU 100 CO 0.43 -0.48 0.00 0.29 -1.33 0.00 0.00 177.39 176.30 1blr n LYS 101 N -1.35 0.00 -0.99 3.23 5.02 -1.26 -5.13 118.16 117.69 1blr n LYS 101 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1blr n LYS 101 Cb 0.13 -0.03 0.00 0.00 -0.02 0.00 0.00 35.03 35.11 1blr n LYS 101 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1blr n GLY 102 N -0.81 -4.07 0.21 0.72 0.00 -1.26 -5.00 105.19 94.97 1blr n GLY 102 Ca 0.00 -0.82 -0.01 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 -0.66 0.03 0.00 1.61 0.28 -1.26 -5.06 120.64 115.58 1blr n GLU 103 Ca 0.00 0.01 0.00 0.00 -0.16 0.00 0.00 57.16 57.01 1blr n GLU 103 Cb 0.00 -0.93 0.00 0.00 1.43 0.00 0.00 31.44 31.94 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 3.33 0.30 0.00 -1.84 0.00 -1.26 -5.14 105.19 100.58 1blr n GLY 104 Ca -0.02 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1blr n GLY 104 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1blr n PRO 105 N 0.00 1.20 -3.78 1.61 -0.04 -1.26 -5.05 135.00 127.68 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 -0.00 0.00 -0.04 0.00 0.00 33.50 33.46 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 0.18 1.18 0.31 0.54 2.20 -1.26 -4.82 119.74 118.06 1blr s LYS 106 Ca 0.00 -0.69 0.07 0.00 -0.36 0.00 0.00 55.97 54.99 1blr s LYS 106 Cb 0.00 0.38 -0.03 0.00 -1.51 0.00 0.00 37.83 36.67 1blr s LYS 106 CO 0.00 -0.55 0.27 0.95 -0.36 0.00 0.00 175.35 175.66 1blr s THR 107 N -2.85 3.82 0.00 3.43 -4.23 -1.08 -1.52 115.64 113.22 1blr s THR 107 Ca 0.15 -1.37 0.00 0.00 -1.18 0.00 0.00 61.69 59.29 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 0.03 -0.23 0.00 -1.54 -0.54 0.00 0.00 174.62 172.34 1blr n SER 108 N -1.32 0.00 -3.60 3.99 3.41 -1.04 -1.34 113.62 113.71 1blr n SER 108 Ca -0.04 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.44 1blr n SER 108 Cb 0.59 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.47 1blr n SER 108 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 1blr s TRP 109 N -2.00 -0.67 -0.17 7.33 1.48 -0.62 0.19 118.94 124.48 1blr s TRP 109 Ca 0.00 1.53 -0.01 0.00 -1.06 0.00 0.00 56.10 56.55 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 -0.40 -0.02 0.95 -4.06 0.00 0.00 176.95 173.42 1blr s THR 110 N -0.08 0.92 -0.13 0.66 -4.23 -0.56 0.10 115.64 112.33 1blr s THR 110 Ca -0.02 -0.60 -0.20 0.00 -1.18 0.00 0.00 61.69 59.69 1blr s THR 110 Cb -0.04 -1.20 -0.04 0.00 1.34 0.00 0.00 72.50 72.57 1blr s THR 110 CO 0.02 0.02 0.57 -0.13 -0.54 0.00 0.00 174.62 174.55 1blr s ARG 111 N 1.70 4.33 0.07 3.99 0.52 -0.57 -2.05 118.95 126.94 1blr s ARG 111 Ca -0.00 0.59 0.04 0.00 -0.52 0.00 0.00 55.73 55.84 1blr s ARG 111 Cb -0.16 -3.48 -0.03 0.00 0.52 0.00 0.00 34.95 31.80 1blr s ARG 111 CO -0.07 0.03 -0.13 -2.00 0.02 0.00 0.00 175.30 173.15 1blr s GLU 112 N 1.02 0.77 0.37 3.54 2.12 -0.52 -0.93 118.70 125.05 1blr s GLU 112 Ca 0.29 -0.94 0.08 0.00 0.36 0.00 0.00 54.97 54.76 1blr s GLU 112 Cb -0.16 -0.70 -0.03 0.00 0.26 0.00 0.00 34.13 33.51 1blr s GLU 112 CO 0.12 0.15 0.30 -0.51 -0.54 0.00 0.00 175.26 174.78 1blr s LEU 113 N -1.78 3.45 0.00 2.70 2.01 -0.68 -0.73 118.68 123.66 1blr s LEU 113 Ca -0.03 -0.66 0.00 0.00 0.01 0.00 0.00 54.13 53.45 1blr s LEU 113 Cb -0.09 -2.05 0.00 0.00 0.01 0.00 0.00 46.19 44.05 1blr s LEU 113 CO 0.02 -0.47 0.00 0.41 1.01 0.00 0.00 176.35 177.31 1blr n THR 114 N -1.41 0.02 0.03 5.49 -1.04 -1.02 -4.86 114.28 111.50 1blr n THR 114 Ca 0.00 0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 1blr n THR 114 Cb 0.61 -0.95 0.00 0.00 -1.82 0.00 0.00 70.33 68.17 1blr n THR 114 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1blr n ASN 115 N -2.52 0.29 -1.00 8.00 3.02 -1.26 -5.01 115.26 116.79 1blr n ASN 115 Ca 0.00 0.10 -0.05 0.00 -0.03 0.00 0.00 54.58 54.60 1blr n ASN 115 Cb 0.00 -0.05 -0.04 0.00 -0.61 0.00 0.00 39.78 39.08 1blr n ASN 115 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1blr n ASP 116 N -2.89 -0.77 0.00 6.41 -0.08 -1.26 -4.98 116.55 112.98 1blr n ASP 116 Ca 0.00 -1.51 0.00 0.00 -1.51 0.00 0.00 54.79 51.77 1blr n ASP 116 Cb 0.00 0.25 0.00 0.00 2.34 0.00 0.00 41.12 43.71 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 -0.10 0.00 2.48 0.27 0.00 -1.26 -4.85 105.19 101.74 1blr n GLY 117 Ca -0.20 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.66 1blr n GLY 117 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1blr n GLU 118 N 0.00 0.63 -2.94 1.61 1.02 -1.25 -3.96 120.64 115.76 1blr n GLU 118 Ca 0.00 -2.56 -0.43 0.00 -0.02 0.00 0.00 57.16 54.15 1blr n GLU 118 Cb 0.00 -1.40 -0.05 0.00 -0.02 0.00 0.00 31.44 29.97 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 -0.56 4.34 -0.42 -4.62 0.20 0.02 -2.44 118.68 115.21 1blr s LEU 119 Ca 0.33 -0.46 -0.21 0.00 0.69 0.00 0.00 54.13 54.48 1blr s LEU 119 Cb 0.15 -2.75 0.02 0.00 -0.43 0.00 0.00 46.19 43.18 1blr s LEU 119 CO -0.16 -1.10 0.68 0.27 -0.29 0.00 0.00 176.35 175.75 1blr s ILE 120 N 3.52 4.80 -0.20 6.68 -5.25 0.09 -0.22 121.20 130.62 1blr s ILE 120 Ca 0.26 0.30 -0.03 0.00 -0.99 0.00 0.00 60.65 60.19 1blr s ILE 120 Cb -0.14 -4.21 -0.01 0.00 2.95 0.00 0.00 42.46 41.05 1blr s ILE 120 CO 0.18 -0.57 -0.07 -0.22 -1.79 0.00 0.00 174.94 172.47 1blr s LEU 121 N 2.92 2.80 0.25 0.37 1.98 -1.03 -1.45 118.68 124.52 1blr s LEU 121 Ca 0.25 -0.40 0.07 0.00 -2.89 0.00 0.00 54.13 51.16 1blr s LEU 121 Cb -0.14 -1.69 -0.04 0.00 0.66 0.00 0.00 46.19 44.99 1blr s LEU 121 CO 0.19 0.02 0.19 -0.89 -1.89 0.00 0.00 176.35 173.98 1blr s THR 122 N 1.22 4.44 -0.37 3.68 2.01 -0.87 -2.99 115.64 122.76 1blr s THR 122 Ca 0.02 -1.40 0.07 0.00 0.31 0.00 0.00 61.69 60.69 1blr s THR 122 Cb -0.14 -3.40 0.18 0.00 0.01 0.00 0.00 72.50 69.15 1blr s THR 122 CO -0.03 -0.34 0.58 -0.32 -0.69 0.00 0.00 174.62 173.82 1blr s MET 123 N -3.82 0.72 0.97 4.92 0.00 -0.84 -1.50 119.30 119.75 1blr s MET 123 Ca 0.33 -0.13 -0.12 0.00 0.00 0.00 0.00 55.69 55.77 1blr s MET 123 Cb -0.08 0.01 0.17 0.00 0.00 0.00 0.00 34.83 34.94 1blr s MET 123 CO 0.25 -1.15 1.10 0.95 0.00 0.00 0.00 175.02 176.17 1blr s THR 124 N 2.06 2.11 -0.30 10.11 -4.23 0.13 -2.12 115.64 123.40 1blr s THR 124 Ca 0.14 0.03 -0.13 0.00 -1.18 0.00 0.00 61.69 60.56 1blr s THR 124 Cb -0.07 -2.58 0.18 0.00 1.34 0.00 0.00 72.50 71.37 1blr s THR 124 CO -0.12 -0.04 1.07 0.00 -0.54 0.00 0.00 174.62 174.99 1blr s ALA 125 N -3.03 -3.94 -1.23 3.99 0.00 -0.71 -2.50 121.76 114.34 1blr s ALA 125 Ca 0.65 1.37 -0.01 0.00 0.00 0.00 0.00 51.96 53.96 1blr s ALA 125 Cb -0.18 -2.75 0.00 0.00 0.00 0.00 0.00 23.12 20.19 1blr s ALA 125 CO 0.57 -1.91 0.19 -3.47 0.00 0.00 0.00 175.76 171.14 1blr n ASP 126 N 5.22 -4.71 0.00 0.00 -0.08 -0.57 -2.09 116.55 114.32 1blr n ASP 126 Ca 0.04 -0.10 0.00 0.00 -1.51 0.00 0.00 54.79 53.23 1blr n ASP 126 Cb 0.57 -3.73 0.00 0.00 2.34 0.00 0.00 41.12 40.30 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 -1.09 0.00 -4.52 1.67 2.03 -1.25 -4.50 116.55 108.90 1blr n ASP 127 Ca -0.14 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 54.89 1blr n ASP 127 Cb 0.62 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 -0.27 5.18 -7.23 -0.89 -4.79 120.40 112.09 1blr s VAL 128 Ca 0.00 -0.16 -0.04 0.00 -1.81 0.00 0.00 61.98 59.97 1blr s VAL 128 Cb 0.00 -2.92 0.15 0.00 0.56 0.00 0.00 36.38 34.17 1blr s VAL 128 CO 0.00 0.00 0.52 -0.69 -0.31 0.00 0.00 175.10 174.62 1blr s VAL 129 N -3.58 -0.83 -0.90 1.32 1.01 -1.26 -1.73 120.40 114.42 1blr s VAL 129 Ca 0.68 0.01 -0.17 0.00 0.00 0.00 0.00 61.98 62.49 1blr s VAL 129 Cb -0.07 -0.90 0.16 0.00 0.00 0.00 0.00 36.38 35.58 1blr s VAL 129 CO 0.49 -0.02 1.01 0.00 0.00 0.00 0.00 175.10 176.58 1blr s THR 131 N 1.82 4.50 -0.19 0.00 2.01 -1.26 -1.98 115.64 120.53 1blr s THR 131 Ca 0.28 -0.13 -0.15 0.00 0.31 0.00 0.00 61.69 62.00 1blr s THR 131 Cb -0.06 -3.05 0.05 0.00 0.01 0.00 0.00 72.50 69.45 1blr s THR 131 CO -0.09 0.42 0.50 0.00 -0.69 0.00 0.00 174.62 174.75 1blr s ARG 132 N 0.85 0.55 0.61 4.92 1.70 -1.16 -4.30 118.95 122.13 1blr s ARG 132 Ca 0.03 0.77 -0.14 0.00 -0.47 0.00 0.00 55.73 55.92 1blr s ARG 132 Cb -0.14 0.20 -0.03 0.00 -0.57 0.00 0.00 34.95 34.41 1blr s ARG 132 CO 0.02 -0.10 1.04 0.08 -1.08 0.00 0.00 175.30 175.27 1blr s VAL 133 N 0.66 4.07 0.18 4.99 1.01 0.55 -2.46 120.40 129.39 1blr s VAL 133 Ca -0.03 0.87 0.02 0.00 0.00 0.00 0.00 61.98 62.84 1blr s VAL 133 Cb -0.05 -3.49 -0.05 0.00 0.00 0.00 0.00 36.38 32.80 1blr s VAL 133 CO -0.04 -0.69 0.01 -0.31 0.00 0.00 0.00 175.10 174.06 1blr s TYR 134 N -2.71 1.23 0.14 5.22 1.51 0.70 -0.27 117.35 123.17 1blr s TYR 134 Ca 0.60 -1.02 0.01 0.00 -1.01 0.00 0.00 57.07 55.65 1blr s TYR 134 Cb -0.14 -0.70 -0.04 0.00 -0.11 0.00 0.00 41.96 40.97 1blr s TYR 134 CO 0.42 -0.21 -0.01 0.08 -1.11 0.00 0.00 175.55 174.72 1blr s VAL 135 N -3.66 0.55 -0.30 0.71 1.01 -1.16 -0.80 120.40 116.76 1blr s VAL 135 Ca 0.25 -1.94 -0.27 0.00 0.00 0.00 0.00 61.98 60.01 1blr s VAL 135 Cb 0.06 -1.95 0.01 0.00 0.00 0.00 0.00 36.38 34.50 1blr s VAL 135 CO 0.04 -0.62 0.98 -0.13 0.00 0.00 0.00 175.10 175.38 1blr s ARG 136 N -3.92 4.07 0.00 2.72 0.52 -1.25 -1.66 118.95 119.42 1blr s ARG 136 Ca 0.20 0.97 0.00 0.00 -0.52 0.00 0.00 55.73 56.38 1blr s ARG 136 Cb 0.06 -3.72 0.00 0.00 0.52 0.00 0.00 34.95 31.81 1blr s ARG 136 CO 0.00 -0.79 0.41 -1.91 0.02 0.00 0.00 175.30 173.03