#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1blr n ASN 2 N 0.00 0.00 0.00 3.54 4.13 -1.26 -4.52 115.26 117.15 1blr n ASN 2 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 1blr n ASN 2 Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 1blr n ASN 2 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1blr n PHE 3 N 11.40 0.00 -1.68 3.10 3.01 -1.26 -4.96 117.46 127.07 1blr n PHE 3 Ca 0.00 0.00 -0.55 0.00 1.01 0.00 0.00 57.45 57.91 1blr n PHE 3 Cb 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.40 1blr n PHE 3 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1blr n SER 4 N 2.65 2.62 0.00 4.37 3.41 -1.26 -4.71 113.62 120.70 1blr n SER 4 Ca 0.00 0.98 0.00 0.00 -0.26 0.00 0.00 58.87 59.59 1blr n SER 4 Cb 0.00 -1.21 0.00 0.00 -0.26 0.00 0.00 64.21 62.74 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 4.53 4.31 3.82 5.00 0.00 -0.92 -5.00 105.19 116.93 1blr n GLY 5 Ca 0.27 -1.23 -0.32 0.00 0.00 0.00 0.00 46.02 44.75 1blr n GLY 5 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1blr s ASN 6 N 0.00 5.69 -0.05 1.61 3.84 -1.26 -2.11 114.94 122.67 1blr s ASN 6 Ca 0.00 1.66 0.01 0.00 0.21 0.00 0.00 52.86 54.74 1blr s ASN 6 Cb 0.00 -2.51 0.02 0.00 -0.55 0.00 0.00 41.25 38.21 1blr s ASN 6 CO 0.00 -1.23 -0.05 0.26 -2.79 0.00 0.00 177.10 173.29 1blr s TRP 7 N -2.83 0.81 0.31 0.43 0.52 -1.01 -2.13 118.94 115.04 1blr s TRP 7 Ca 0.60 -0.24 -0.05 0.00 0.02 0.00 0.00 56.10 56.43 1blr s TRP 7 Cb -0.14 -0.70 -0.05 0.00 -1.15 0.00 0.00 33.47 31.42 1blr s TRP 7 CO 0.47 -0.20 0.59 0.15 0.02 0.00 0.00 176.95 177.97 1blr s LYS 8 N 0.93 3.64 0.42 4.98 3.01 -0.69 -3.22 119.74 128.81 1blr s LYS 8 Ca -0.11 0.05 -0.24 0.00 -1.01 0.00 0.00 55.97 54.67 1blr s LYS 8 Cb -0.14 -2.61 -0.09 0.00 -1.01 0.00 0.00 37.83 33.98 1blr s LYS 8 CO 0.00 0.17 1.08 0.96 0.51 0.00 0.00 175.35 178.07 1blr s ILE 9 N -2.15 3.55 -0.25 2.17 -5.25 -1.26 -2.85 121.20 115.16 1blr s ILE 9 Ca 0.45 1.18 -0.03 0.00 -0.99 0.00 0.00 60.65 61.25 1blr s ILE 9 Cb -0.11 -3.60 0.14 0.00 2.95 0.00 0.00 42.46 41.84 1blr s ILE 9 CO 0.31 -0.00 0.42 -0.63 -1.79 0.00 0.00 174.94 173.24 1blr s ILE 10 N -1.63 -0.67 -0.32 8.37 1.09 0.54 -4.85 121.20 123.74 1blr s ILE 10 Ca 0.59 -0.03 -0.05 0.00 -1.10 0.00 0.00 60.65 60.06 1blr s ILE 10 Cb -0.24 -0.82 0.01 0.00 -1.06 0.00 0.00 42.46 40.35 1blr s ILE 10 CO 0.30 -0.08 0.20 0.54 -0.10 0.00 0.00 174.94 175.79 1blr n ARG 11 N 5.38 -2.84 -3.80 2.79 3.00 -1.26 -0.32 116.66 119.60 1blr n ARG 11 Ca -0.04 2.38 -0.23 0.00 -0.01 0.00 0.00 57.85 59.95 1blr n ARG 11 Cb 0.50 -5.12 -0.17 0.00 0.00 0.00 0.00 32.46 27.67 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 -1.84 1.63 -0.47 0.55 0.15 -1.26 -2.70 113.70 109.76 1blr s SER 12 Ca 0.08 -0.11 0.06 0.00 0.70 0.00 0.00 55.95 56.68 1blr s SER 12 Cb -0.02 -0.49 0.29 0.00 -1.71 0.00 0.00 66.02 64.08 1blr s SER 12 CO 0.71 -0.18 1.02 1.21 1.20 0.00 0.00 173.24 177.20 1blr n GLU 13 N 5.08 0.92 0.00 5.44 2.13 -1.26 -4.97 120.64 127.98 1blr n GLU 13 Ca -0.08 -1.87 0.00 0.00 0.66 0.00 0.00 57.16 55.87 1blr n GLU 13 Cb 0.50 -1.21 0.00 0.00 0.27 0.00 0.00 31.44 31.00 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 0.89 2.16 -0.20 4.31 4.13 -1.26 -4.76 115.26 120.53 1blr n ASN 14 Ca 0.07 -0.11 -0.03 0.00 1.68 0.00 0.00 54.58 56.19 1blr n ASN 14 Cb 0.67 0.65 0.03 0.00 -1.54 0.00 0.00 39.78 39.59 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 -0.20 3.10 3.57 -1.93 0.79 116.94 121.56 1blr h PHE 15 Ca 0.00 0.07 -0.13 0.00 3.53 0.00 0.00 57.97 61.44 1blr h PHE 15 Cb 0.00 0.40 -0.01 0.00 2.79 0.00 0.00 35.95 39.13 1blr h PHE 15 CO 0.00 -0.35 -0.41 1.49 -2.23 0.00 0.00 178.31 176.81 1blr h GLU 16 N -0.11 0.47 0.00 1.11 4.81 -1.93 -1.62 114.58 117.30 1blr h GLU 16 Ca 0.26 -0.24 -0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1blr h GLU 16 Cb 0.53 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.91 1blr h GLU 16 CO -0.67 0.80 -0.00 1.49 -0.73 0.00 0.00 179.01 179.90 1blr h GLU 17 N 0.39 0.00 -0.03 1.92 4.81 -1.22 0.45 114.58 120.90 1blr h GLU 17 Ca 0.03 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.21 1blr h GLU 17 Cb 0.89 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.27 1blr h GLU 17 CO 0.08 0.00 -0.18 -0.07 -0.73 0.00 0.00 179.01 178.11 1blr h LEU 18 N 0.00 0.20 -0.01 1.64 3.38 -0.09 -1.91 115.31 118.52 1blr h LEU 18 Ca -0.00 -0.68 0.00 0.00 0.09 0.00 0.00 57.88 57.29 1blr h LEU 18 Cb 0.02 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1blr h LEU 18 CO 0.00 0.85 -0.01 0.18 0.09 0.00 0.00 178.44 179.55 1blr n LEU 19 N -4.58 0.03 0.02 1.67 7.99 -0.71 -1.89 117.00 119.53 1blr n LEU 19 Ca -0.09 0.34 0.04 0.00 -0.01 0.00 0.00 56.01 56.28 1blr n LEU 19 Cb 0.43 -0.35 -0.10 0.00 -0.11 0.00 0.00 43.42 43.30 1blr n LEU 19 CO 0.38 0.01 -0.46 0.29 -1.51 0.00 0.00 177.39 176.10 1blr n LYS 20 N -1.34 0.64 -0.10 3.23 5.02 0.07 -2.27 118.16 123.40 1blr n LYS 20 Ca 0.12 0.07 -0.13 0.00 -2.02 0.00 0.00 58.31 56.34 1blr n LYS 20 Cb 0.28 -1.70 -0.14 0.00 -0.02 0.00 0.00 35.03 33.44 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 1.46 0.32 -0.18 0.24 -0.73 -3.95 118.33 112.82 1blr n VAL 21 Ca -0.10 -0.74 0.20 0.00 -2.04 0.00 0.00 64.34 61.67 1blr n VAL 21 Cb 0.76 -0.93 1.04 0.00 -1.47 0.00 0.00 33.84 33.24 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 -1.58 -3.45 115.31 119.73 1blr h LEU 22 Ca -0.54 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.45 1blr h LEU 22 Cb 2.09 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 42.31 1blr h LEU 22 CO -0.01 0.01 0.00 0.61 -4.11 0.00 0.00 178.44 174.95 1blr n GLY 23 N -0.85 0.66 3.51 0.17 0.00 -1.26 -5.09 105.19 102.33 1blr n GLY 23 Ca -0.02 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 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 2.10 0.00 1.61 3.14 -0.96 -4.93 118.33 119.29 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 -0.75 0.00 0.00 -1.06 0.00 0.00 33.84 32.03 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 0.90 0.00 0.00 6.55 5.15 -1.26 -4.89 115.26 121.70 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 0.40 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.65 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 0.05 3.44 0.31 -1.26 -4.90 118.33 115.97 1blr n VAL 26 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.31 1blr n VAL 26 Cb 0.00 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 32.92 1blr n VAL 26 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 1blr h MET 27 N 2.48 -0.13 -6.36 5.55 2.86 -1.91 -3.44 114.93 113.98 1blr h MET 27 Ca 0.00 0.01 -0.36 0.00 -2.06 0.00 0.00 59.70 57.28 1blr h MET 27 Cb 0.00 0.03 0.01 0.00 0.06 0.00 0.00 31.60 31.70 1blr h MET 27 CO 0.00 -0.09 -0.80 1.28 1.06 0.00 0.00 176.91 178.37 1blr n LEU 28 N -2.44 -3.15 -1.75 1.22 7.99 -1.26 0.39 117.00 118.01 1blr n LEU 28 Ca -0.02 -0.76 -0.21 0.00 -0.01 0.00 0.00 56.01 55.01 1blr n LEU 28 Cb 0.05 -2.13 -0.07 0.00 -0.11 0.00 0.00 43.42 41.16 1blr n LEU 28 CO 0.04 0.03 -0.21 0.54 -1.51 0.00 0.00 177.39 176.28 1blr n ARG 29 N -2.69 -1.48 -1.98 3.23 1.74 -1.26 -2.24 116.66 111.98 1blr n ARG 29 Ca -0.21 1.18 -0.05 0.00 -0.77 0.00 0.00 57.85 58.01 1blr n ARG 29 Cb 0.63 -5.62 -0.01 0.00 -1.02 0.00 0.00 32.46 26.44 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 -2.52 -2.10 -3.95 5.56 5.02 0.16 -2.49 118.16 117.84 1blr n LYS 30 Ca -0.22 0.26 -0.28 0.00 -2.02 0.00 0.00 58.31 56.06 1blr n LYS 30 Cb 0.68 -4.63 -0.06 0.00 -0.02 0.00 0.00 35.03 31.00 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 -2.28 -1.10 0.00 -0.18 -0.00 -0.95 -4.27 119.36 110.58 1blr n ILE 31 Ca -0.06 -0.41 0.00 0.00 -0.00 0.00 0.00 62.75 62.28 1blr n ILE 31 Cb 0.40 -1.02 0.00 0.00 -0.00 0.00 0.00 39.64 39.02 1blr n ILE 31 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1blr n ALA 32 N -3.92 0.00 -2.86 -1.39 0.00 -1.08 -5.13 120.51 106.13 1blr n ALA 32 Ca -0.22 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 52.87 1blr n ALA 32 Cb 0.52 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.92 1blr n ALA 32 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1blr s VAL 33 N -0.93 5.44 0.00 0.00 -7.23 -1.04 -4.83 120.40 111.82 1blr s VAL 33 Ca 0.00 0.12 0.00 0.00 -1.81 0.00 0.00 61.98 60.29 1blr s VAL 33 Cb 0.00 -3.47 0.00 0.00 0.56 0.00 0.00 36.38 33.47 1blr s VAL 33 CO 0.00 0.50 0.00 0.00 -0.31 0.00 0.00 175.10 175.29 1blr n ALA 34 N 1.56 0.00 -3.56 1.32 0.00 -1.26 -4.58 120.51 113.99 1blr n ALA 34 Ca -0.16 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.28 1blr n ALA 34 Cb 0.54 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.95 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 -2.14 0.11 0.00 0.00 -1.26 -5.00 121.76 113.46 1blr s ALA 35 Ca 0.00 2.25 0.00 0.00 0.00 0.00 0.00 51.96 54.21 1blr s ALA 35 Cb 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 23.12 21.26 1blr s ALA 35 CO 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 175.76 174.77 1blr n ALA 36 N 5.41 0.00 -2.83 0.00 0.00 -1.26 -5.14 120.51 116.69 1blr n ALA 36 Ca -0.10 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.12 1blr n ALA 36 Cb 0.50 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.91 1blr n ALA 36 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1blr s SER 37 N -1.48 5.80 -0.13 0.00 0.01 -1.26 -5.11 113.70 111.53 1blr s SER 37 Ca 0.00 -0.16 -0.04 0.00 1.31 0.00 0.00 55.95 57.07 1blr s SER 37 Cb 0.00 -1.52 -0.03 0.00 0.21 0.00 0.00 66.02 64.68 1blr s SER 37 CO 0.00 -0.10 0.00 -0.54 0.41 0.00 0.00 173.24 173.02 1blr s LYS 38 N -3.92 3.40 0.04 12.44 3.01 -1.26 -5.11 119.74 128.33 1blr s LYS 38 Ca 0.35 -0.43 -0.01 0.00 -1.01 0.00 0.00 55.97 54.87 1blr s LYS 38 Cb -0.08 -2.91 0.01 0.00 -1.01 0.00 0.00 37.83 33.83 1blr s LYS 38 CO 0.27 0.47 0.05 -0.35 0.51 0.00 0.00 175.35 176.30 1blr n PRO 39 N 2.85 -0.22 -3.13 -1.68 -0.04 -1.26 -4.87 135.00 126.66 1blr n PRO 39 Ca -0.18 -0.07 0.01 0.00 -0.04 0.00 0.00 63.50 63.22 1blr n PRO 39 Cb 0.53 -0.05 0.01 0.00 -0.04 0.00 0.00 33.50 33.95 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 -3.04 -2.13 -3.81 0.55 0.00 -0.73 -4.47 120.51 106.88 1blr n ALA 40 Ca -0.01 -0.50 -0.02 0.00 0.00 0.00 0.00 53.44 52.91 1blr n ALA 40 Cb 0.02 0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.60 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 -2.09 0.00 -0.25 0.00 0.11 -1.20 -2.63 120.40 114.34 1blr s VAL 41 Ca 0.18 -0.50 -0.04 0.00 -2.93 0.00 0.00 61.98 58.69 1blr s VAL 41 Cb -0.01 -2.46 0.14 0.00 -1.53 0.00 0.00 36.38 32.53 1blr s VAL 41 CO 0.00 0.00 0.47 -1.83 -3.33 0.00 0.00 175.10 170.41 1blr s GLU 42 N -2.55 0.42 0.02 1.54 -1.05 -0.97 -2.40 118.70 113.71 1blr s GLU 42 Ca 0.18 0.85 -0.06 0.00 -0.15 0.00 0.00 54.97 55.79 1blr s GLU 42 Cb -0.01 0.09 -0.05 0.00 -0.44 0.00 0.00 34.13 33.73 1blr s GLU 42 CO 0.02 -0.51 0.27 0.42 0.95 0.00 0.00 175.26 176.40 1blr s ILE 43 N 2.68 5.30 -0.15 1.83 1.01 -0.89 -2.10 121.20 128.87 1blr s ILE 43 Ca 0.10 0.12 -0.05 0.00 0.00 0.00 0.00 60.65 60.83 1blr s ILE 43 Cb -0.14 -3.57 0.06 0.00 0.01 0.00 0.00 42.46 38.81 1blr s ILE 43 CO -0.17 0.34 0.08 -0.54 0.00 0.00 0.00 174.94 174.65 1blr s LYS 44 N -1.84 0.06 0.02 2.79 1.02 -0.94 -2.17 119.74 118.68 1blr s LYS 44 Ca 0.28 -0.02 0.01 0.00 0.02 0.00 0.00 55.97 56.26 1blr s LYS 44 Cb -0.13 -1.65 -0.01 0.00 -0.52 0.00 0.00 37.83 35.51 1blr s LYS 44 CO 0.17 -0.62 -0.04 1.14 -0.92 0.00 0.00 175.35 175.08 1blr s GLN 45 N 2.14 0.32 -0.56 1.68 1.03 -1.26 0.02 119.66 123.02 1blr s GLN 45 Ca 0.02 -0.47 0.04 0.00 0.04 0.00 0.00 55.36 55.00 1blr s GLN 45 Cb -0.15 -0.09 0.16 0.00 0.03 0.00 0.00 33.01 32.96 1blr s GLN 45 CO -0.08 0.01 0.39 -2.00 -2.54 0.00 0.00 175.29 171.07 1blr s GLU 46 N -1.02 1.79 6.26 9.60 2.56 -0.47 -4.86 118.70 132.57 1blr s GLU 46 Ca -0.09 -2.71 0.00 0.00 0.00 0.00 0.00 54.97 52.17 1blr s GLU 46 Cb -0.07 -2.68 0.00 0.00 2.00 0.00 0.00 34.13 33.39 1blr s GLU 46 CO -0.00 -1.28 0.00 0.41 -0.56 0.00 0.00 175.26 173.83 1blr n GLY 47 N 2.58 0.88 0.00 -1.50 0.00 -1.26 -3.06 105.19 102.83 1blr n GLY 47 Ca 0.19 -0.67 0.15 0.00 0.00 0.00 0.00 46.02 45.69 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 7.20 0.00 -4.82 1.61 5.68 -1.26 -4.75 116.55 120.21 1blr n ASP 48 Ca 0.00 -0.74 -0.38 0.00 -0.50 0.00 0.00 54.79 53.16 1blr n ASP 48 Cb 0.00 -0.07 -0.06 0.00 -1.14 0.00 0.00 41.12 39.85 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 -2.14 4.87 0.05 2.12 2.01 -1.17 -1.30 115.64 120.08 1blr s THR 49 Ca 0.41 1.03 -0.05 0.00 0.31 0.00 0.00 61.69 63.40 1blr s THR 49 Cb 0.20 -3.81 -0.02 0.00 0.01 0.00 0.00 72.50 68.89 1blr s THR 49 CO 0.37 0.56 0.08 -0.36 -0.69 0.00 0.00 174.62 174.57 1blr s PHE 50 N -1.10 0.27 0.02 4.92 0.40 -0.80 -1.37 117.98 120.31 1blr s PHE 50 Ca 0.27 -0.65 0.01 0.00 -0.60 0.00 0.00 56.93 55.96 1blr s PHE 50 Cb -0.18 -0.19 -0.02 0.00 0.51 0.00 0.00 43.02 43.14 1blr s PHE 50 CO 0.16 -0.39 -0.04 -0.47 0.70 0.00 0.00 175.22 175.18 1blr s TYR 51 N -3.06 0.38 -0.21 0.36 6.14 0.10 -1.87 117.35 119.19 1blr s TYR 51 Ca -0.01 -0.36 -0.04 0.00 0.64 0.00 0.00 57.07 57.30 1blr s TYR 51 Cb 0.02 -0.25 0.09 0.00 0.42 0.00 0.00 41.96 42.24 1blr s TYR 51 CO -0.07 -0.09 0.18 0.42 0.64 0.00 0.00 175.55 176.63 1blr s ILE 52 N -0.98 -0.23 -0.76 3.14 -1.09 -0.98 -2.21 121.20 118.10 1blr s ILE 52 Ca -0.08 -0.25 -0.07 0.00 -2.23 0.00 0.00 60.65 58.01 1blr s ILE 52 Cb -0.07 -0.72 0.20 0.00 -1.58 0.00 0.00 42.46 40.29 1blr s ILE 52 CO -0.00 -0.32 0.64 -0.75 -1.23 0.00 0.00 174.94 173.27 1blr s LYS 53 N 2.25 3.13 0.21 2.79 2.20 -0.89 -2.24 119.74 127.18 1blr s LYS 53 Ca 0.06 -2.63 -0.10 0.00 -0.36 0.00 0.00 55.97 52.94 1blr s LYS 53 Cb -0.16 -4.06 -0.07 0.00 -1.51 0.00 0.00 37.83 32.03 1blr s LYS 53 CO -0.16 -1.23 0.54 0.99 -0.36 0.00 0.00 175.35 175.12 1blr s THR 54 N -0.19 4.93 -0.01 3.43 2.01 -1.25 -2.29 115.64 122.27 1blr s THR 54 Ca 0.19 0.52 -0.28 0.00 0.31 0.00 0.00 61.69 62.43 1blr s THR 54 Cb -0.14 -3.64 0.09 0.00 0.01 0.00 0.00 72.50 68.82 1blr s THR 54 CO -0.07 -0.00 1.27 -1.54 -0.69 0.00 0.00 174.62 173.60 1blr n SER 55 N 0.07 -1.22 0.07 3.53 3.41 -1.08 -4.36 113.62 114.03 1blr n SER 55 Ca -0.01 -1.28 0.00 0.00 -0.26 0.00 0.00 58.87 57.32 1blr n SER 55 Cb 0.52 1.90 0.00 0.00 -0.26 0.00 0.00 64.21 66.38 1blr n SER 55 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1blr n THR 56 N -0.92 0.18 -2.07 6.66 -1.04 -1.26 -1.77 114.28 114.06 1blr n THR 56 Ca 0.04 0.06 -0.03 0.00 -2.04 0.00 0.00 64.05 62.08 1blr n THR 56 Cb 0.58 -0.55 -0.03 0.00 -1.82 0.00 0.00 70.33 68.51 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 -3.04 0.00 -3.48 12.58 -1.04 -1.26 -4.80 114.28 113.24 1blr n THR 57 Ca 0.00 -0.14 -0.05 0.00 -2.04 0.00 0.00 64.05 61.83 1blr n THR 57 Cb 0.00 0.43 0.00 0.00 -1.82 0.00 0.00 70.33 68.95 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 0.07 0.00 -1.78 12.58 0.24 -1.26 -5.14 118.33 123.04 1blr n VAL 58 Ca -0.14 -0.53 -0.37 0.00 -2.04 0.00 0.00 64.34 61.26 1blr n VAL 58 Cb 0.71 0.43 0.06 0.00 -1.47 0.00 0.00 33.84 33.57 1blr n VAL 58 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 1blr s ARG 59 N -2.14 2.76 0.31 7.34 3.52 -1.26 -4.97 118.95 124.51 1blr s ARG 59 Ca 0.09 2.10 -0.12 0.00 -0.13 0.00 0.00 55.73 57.66 1blr s ARG 59 Cb -0.02 -1.97 0.02 0.00 -1.56 0.00 0.00 34.95 31.42 1blr s ARG 59 CO 0.06 -1.45 0.59 0.99 -0.81 0.00 0.00 175.30 174.69 1blr s THR 60 N -1.38 0.00 0.28 4.11 2.01 -1.26 -4.94 115.64 114.45 1blr s THR 60 Ca 0.79 -1.29 0.08 0.00 0.31 0.00 0.00 61.69 61.58 1blr s THR 60 Cb -0.38 -2.45 -0.04 0.00 0.01 0.00 0.00 72.50 69.65 1blr s THR 60 CO 0.41 0.00 0.13 0.28 -0.69 0.00 0.00 174.62 174.75 1blr s THR 61 N -3.34 3.80 -0.05 -0.82 -1.32 -1.26 -5.03 115.64 107.62 1blr s THR 61 Ca 0.21 -1.62 -0.03 0.00 -1.21 0.00 0.00 61.69 59.03 1blr s THR 61 Cb -0.03 -3.12 0.02 0.00 -1.51 0.00 0.00 72.50 67.86 1blr s THR 61 CO 0.12 -0.32 0.12 -1.83 -2.21 0.00 0.00 174.62 170.50 1blr s GLU 62 N -3.80 0.11 -0.49 7.08 1.03 -1.26 -3.86 118.70 117.52 1blr s GLU 62 Ca 0.34 0.22 -0.20 0.00 0.03 0.00 0.00 54.97 55.36 1blr s GLU 62 Cb -0.06 -0.02 0.05 0.00 -0.80 0.00 0.00 34.13 33.29 1blr s GLU 62 CO 0.23 -0.07 0.65 0.96 -1.33 0.00 0.00 175.26 175.71 1blr s ILE 63 N 0.44 4.82 -1.16 1.83 -4.36 -0.95 -4.85 121.20 116.98 1blr s ILE 63 Ca -0.03 -0.25 -0.10 0.00 -0.26 0.00 0.00 60.65 60.02 1blr s ILE 63 Cb -0.05 -4.29 0.24 0.00 1.25 0.00 0.00 42.46 39.62 1blr s ILE 63 CO -0.02 -0.77 1.33 -0.46 0.24 0.00 0.00 174.94 175.27 1blr n ASN 64 N 6.31 5.53 -0.53 4.36 2.04 -1.26 -2.32 115.26 129.38 1blr n ASN 64 Ca -0.04 -3.08 0.00 0.00 -0.44 0.00 0.00 54.58 51.01 1blr n ASN 64 Cb 0.46 -1.43 0.00 0.00 -2.53 0.00 0.00 39.78 36.28 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 3.45 -0.13 -3.67 -2.53 -1.74 -0.78 -4.99 117.46 107.07 1blr n PHE 65 Ca 0.29 0.00 -0.16 0.00 -0.56 0.00 0.00 57.45 57.02 1blr n PHE 65 Cb 0.39 0.00 -0.15 0.00 1.52 0.00 0.00 39.48 41.24 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 0.44 0.06 0.49 3.97 1.02 -1.26 -1.91 119.74 122.54 1blr s LYS 66 Ca 0.00 0.60 -0.20 0.00 0.02 0.00 0.00 55.97 56.38 1blr s LYS 66 Cb 0.00 -0.22 -0.11 0.00 -0.52 0.00 0.00 37.83 36.98 1blr s LYS 66 CO 0.00 -0.30 0.48 0.28 -0.92 0.00 0.00 175.35 174.89 1blr n VAL 67 N 5.29 1.80 -0.44 3.17 0.31 -0.42 -3.04 118.33 125.00 1blr n VAL 67 Ca -0.06 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.77 1blr n VAL 67 Cb 0.50 -0.56 0.00 0.00 -0.91 0.00 0.00 33.84 32.87 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 1.84 0.82 3.51 2.92 0.00 -1.06 -4.95 105.19 108.27 1blr n GLY 68 Ca 0.11 -0.43 -0.10 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.95 1.47 0.38 1.61 2.02 -1.17 -5.06 118.70 117.00 1blr s GLU 69 Ca 0.00 -1.30 0.08 0.00 0.02 0.00 0.00 54.97 53.77 1blr s GLU 69 Cb 0.00 0.43 -0.06 0.00 0.10 0.00 0.00 34.13 34.60 1blr s GLU 69 CO 0.00 -0.59 0.04 -1.83 0.02 0.00 0.00 175.26 172.90 1blr s GLU 70 N -4.04 2.05 0.29 1.61 1.03 -1.26 -2.86 118.70 115.53 1blr s GLU 70 Ca 0.25 -1.89 0.00 0.00 0.03 0.00 0.00 54.97 53.36 1blr s GLU 70 Cb 0.01 -1.84 -0.00 0.00 -0.80 0.00 0.00 34.13 31.50 1blr s GLU 70 CO 0.09 0.03 0.01 1.19 -1.33 0.00 0.00 175.26 175.25 1blr n PHE 71 N -1.00 0.61 -4.31 4.83 3.72 -0.81 -4.94 117.46 115.56 1blr n PHE 71 Ca -0.04 -1.48 -0.19 0.00 -0.05 0.00 0.00 57.45 55.69 1blr n PHE 71 Cb 0.64 -0.17 -0.11 0.00 -0.94 0.00 0.00 39.48 38.91 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 -3.05 1.23 0.08 -1.08 2.02 -1.26 -2.32 118.70 114.31 1blr s GLU 72 Ca 0.02 -1.45 -0.06 0.00 0.02 0.00 0.00 54.97 53.50 1blr s GLU 72 Cb 0.00 -1.11 0.02 0.00 0.10 0.00 0.00 34.13 33.14 1blr s GLU 72 CO 0.01 0.20 0.29 -1.91 0.02 0.00 0.00 175.26 173.87 1blr n GLU 73 N 0.05 0.27 -3.78 1.61 2.13 0.21 -4.84 120.64 116.28 1blr n GLU 73 Ca -0.11 -0.56 -0.13 0.00 0.66 0.00 0.00 57.16 57.02 1blr n GLU 73 Cb 0.59 0.73 -0.13 0.00 0.27 0.00 0.00 31.44 32.89 1blr n GLU 73 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 1blr s GLN 74 N -2.02 0.16 0.00 5.31 -0.21 -1.21 -2.09 119.66 119.60 1blr s GLN 74 Ca 0.06 0.32 0.00 0.00 0.02 0.00 0.00 55.36 55.77 1blr s GLN 74 Cb -0.01 -0.04 0.00 0.00 1.00 0.00 0.00 33.01 33.96 1blr s GLN 74 CO 0.03 -0.09 0.00 2.41 -2.12 0.00 0.00 175.29 175.51 1blr n THR 75 N 3.61 0.00 -0.03 -0.19 -1.04 -1.23 -4.75 114.28 110.65 1blr n THR 75 Ca -0.19 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.80 1blr n THR 75 Cb 0.55 -1.86 -0.01 0.00 -1.82 0.00 0.00 70.33 67.20 1blr n THR 75 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1blr n VAL 76 N -0.05 0.56 -3.83 12.58 0.31 -1.26 -4.98 118.33 121.66 1blr n VAL 76 Ca 0.00 0.39 -0.17 0.00 -0.01 0.00 0.00 64.34 64.54 1blr n VAL 76 Cb 0.00 -1.85 -0.17 0.00 -0.91 0.00 0.00 33.84 30.92 1blr n VAL 76 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1blr s ASP 77 N -4.41 0.53 0.00 4.52 1.11 -1.26 -4.96 116.67 112.20 1blr s ASP 77 Ca -0.06 0.00 0.00 0.00 0.18 0.00 0.00 52.55 52.67 1blr s ASP 77 Cb 0.01 -0.18 0.00 0.00 1.07 0.00 0.00 42.92 43.82 1blr s ASP 77 CO 0.09 -0.14 0.00 0.61 1.18 0.00 0.00 175.17 176.91 1blr n GLY 78 N 4.42 1.52 3.41 0.21 0.00 -1.26 -5.08 105.19 108.40 1blr n GLY 78 Ca -0.22 -0.40 -0.11 0.00 0.00 0.00 0.00 46.02 45.30 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 1.40 0.67 1.61 0.52 -1.26 -5.13 118.95 116.76 1blr s ARG 79 Ca 0.00 -1.44 -0.11 0.00 -0.52 0.00 0.00 55.73 53.66 1blr s ARG 79 Cb 0.00 0.38 0.16 0.00 0.52 0.00 0.00 34.95 36.01 1blr s ARG 79 CO 0.00 -0.53 0.79 -0.35 0.02 0.00 0.00 175.30 175.22 1blr n PRO 80 N -0.34 -1.37 -3.65 3.54 -0.04 -1.26 -3.52 135.00 128.37 1blr n PRO 80 Ca 0.00 -1.23 -0.14 0.00 -0.04 0.00 0.00 63.50 62.09 1blr n PRO 80 Cb 0.64 -0.93 -0.07 0.00 -0.04 0.00 0.00 33.50 33.10 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 2.78 1.55 -4.16 0.00 2.85 -0.35 0.64 118.16 121.47 1blr n LYS 82 Ca -0.14 -0.90 -0.16 0.00 -1.05 0.00 0.00 58.31 56.06 1blr n LYS 82 Cb 0.55 0.19 -0.06 0.00 -0.65 0.00 0.00 35.03 35.07 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 -1.74 1.03 -0.30 -5.58 1.04 -0.98 -1.86 113.70 105.31 1blr s SER 83 Ca 0.03 -1.53 -0.13 0.00 0.48 0.00 0.00 55.95 54.79 1blr s SER 83 Cb -0.00 0.60 0.16 0.00 0.10 0.00 0.00 66.02 66.88 1blr s SER 83 CO 0.02 -1.17 0.92 -0.22 0.98 0.00 0.00 173.24 173.76 1blr s LEU 84 N -3.26 -0.71 0.16 2.42 0.20 -1.10 -1.93 118.68 114.46 1blr s LEU 84 Ca 0.34 0.84 -0.13 0.00 0.69 0.00 0.00 54.13 55.88 1blr s LEU 84 Cb 0.01 1.76 -0.07 0.00 -0.43 0.00 0.00 46.19 47.46 1blr s LEU 84 CO 0.21 -0.14 0.53 -0.69 -0.29 0.00 0.00 176.35 175.97 1blr s VAL 85 N 2.62 4.91 0.00 1.68 1.01 -1.13 -1.88 120.40 127.60 1blr s VAL 85 Ca -0.01 0.69 0.00 0.00 0.00 0.00 0.00 61.98 62.66 1blr s VAL 85 Cb -0.08 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.60 1blr s VAL 85 CO -0.17 0.18 0.00 1.17 0.00 0.00 0.00 175.10 176.28 1blr n LYS 86 N 0.60 0.00 -3.91 2.72 3.00 -0.83 -2.57 118.16 117.18 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 0.44 0.12 5.64 7.02 -1.26 -1.90 117.44 127.51 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 -0.11 0.00 0.00 -2.42 0.00 0.00 31.31 28.78 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 -0.81 0.00 -0.02 -0.99 4.07 0.18 -4.61 120.64 118.47 1blr n GLU 88 Ca -0.09 0.00 -0.04 0.00 -0.06 0.00 0.00 57.16 56.96 1blr n GLU 88 Cb 0.47 -0.09 -0.01 0.00 -0.06 0.00 0.00 31.44 31.75 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 -3.43 0.49 0.00 4.31 3.41 -1.24 -5.00 113.62 112.16 1blr n SER 89 Ca 0.00 0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 1blr n SER 89 Cb 0.01 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 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 -3.29 0.00 -0.02 4.33 0.28 -1.26 -4.91 120.64 115.77 1blr n GLU 90 Ca -0.08 0.00 0.06 0.00 -0.16 0.00 0.00 57.16 56.98 1blr n GLU 90 Cb 0.49 0.00 0.06 0.00 1.43 0.00 0.00 31.44 33.42 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 2.15 -4.13 -1.84 4.13 -1.26 -4.12 115.26 110.19 1blr n ASN 91 Ca 0.00 -1.57 -0.33 0.00 1.68 0.00 0.00 54.58 54.35 1blr n ASN 91 Cb 0.00 -0.03 -0.15 0.00 -1.54 0.00 0.00 39.78 38.06 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 -1.05 2.68 0.26 3.52 2.36 -1.26 -1.79 119.74 124.45 1blr s LYS 92 Ca 0.16 -1.06 0.12 0.00 -2.55 0.00 0.00 55.97 52.64 1blr s LYS 92 Cb 0.11 -2.82 -0.05 0.00 -1.05 0.00 0.00 37.83 34.02 1blr s LYS 92 CO 0.16 -0.40 -0.19 0.00 1.55 0.00 0.00 175.35 176.47 1blr s MET 93 N 1.24 1.70 0.28 4.03 0.23 -0.34 0.47 119.30 126.90 1blr s MET 93 Ca -0.01 -1.68 0.00 0.00 -1.03 0.00 0.00 55.69 52.97 1blr s MET 93 Cb -0.17 -1.83 -0.00 0.00 -1.53 0.00 0.00 34.83 31.31 1blr s MET 93 CO -0.07 0.35 0.01 1.33 -2.03 0.00 0.00 175.02 174.60 1blr n VAL 94 N -0.43 0.00 -2.73 5.16 0.24 -0.80 -1.26 118.33 118.52 1blr n VAL 94 Ca -0.07 -1.33 -0.05 0.00 -2.04 0.00 0.00 64.34 60.85 1blr n VAL 94 Cb 0.59 0.28 0.03 0.00 -1.47 0.00 0.00 33.84 33.27 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 0.79 3.52 -0.23 0.00 2.12 -0.79 -1.53 118.70 122.58 1blr s GLU 96 Ca 0.29 1.51 -0.10 0.00 0.36 0.00 0.00 54.97 57.04 1blr s GLU 96 Cb 0.09 -4.13 -0.05 0.00 0.26 0.00 0.00 34.13 30.31 1blr s GLU 96 CO -0.11 -1.63 0.13 -0.65 -0.54 0.00 0.00 175.26 172.47 1blr s GLN 97 N 5.26 3.99 0.26 4.30 -0.21 -0.52 -2.70 119.66 130.05 1blr s GLN 97 Ca 0.76 -0.31 0.05 0.00 0.02 0.00 0.00 55.36 55.88 1blr s GLN 97 Cb -0.23 -3.46 -0.06 0.00 1.00 0.00 0.00 33.01 30.26 1blr s GLN 97 CO 0.32 0.05 -0.03 -1.59 -2.12 0.00 0.00 175.29 171.92 1blr s LYS 98 N 1.06 1.45 -0.61 2.91 -2.85 -0.78 -2.57 119.74 118.36 1blr s LYS 98 Ca 0.06 -1.74 -0.00 0.00 -1.00 0.00 0.00 55.97 53.30 1blr s LYS 98 Cb -0.14 -0.91 0.51 0.00 -2.06 0.00 0.00 37.83 35.23 1blr s LYS 98 CO 0.04 -0.02 1.99 1.47 0.10 0.00 0.00 175.35 178.93 1blr n LEU 99 N -0.51 7.41 -1.53 2.77 -0.00 -1.26 -1.21 117.00 122.67 1blr n LEU 99 Ca -0.05 -4.12 -0.19 0.00 -0.00 0.00 0.00 56.01 51.65 1blr n LEU 99 Cb 0.64 -0.93 -0.08 0.00 -0.00 0.00 0.00 43.42 43.04 1blr n LEU 99 CO 0.38 1.37 -0.18 0.18 -0.00 0.00 0.00 177.39 179.15 1blr n LEU 100 N -0.98 -1.35 0.01 1.47 4.77 -1.25 -4.11 117.00 115.57 1blr n LEU 100 Ca 0.62 0.46 0.00 0.00 -0.03 0.00 0.00 56.01 57.06 1blr n LEU 100 Cb 0.93 -2.61 0.00 0.00 -2.33 0.00 0.00 43.42 39.41 1blr n LEU 100 CO 0.74 -0.98 0.00 1.17 -1.33 0.00 0.00 177.39 177.00 1blr n LYS 101 N -2.22 0.00 0.00 3.23 0.00 -1.26 -5.10 118.16 112.81 1blr n LYS 101 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.12 1blr n LYS 101 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.64 1blr n LYS 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1blr n GLY 102 N -1.15 -0.57 0.07 3.14 0.00 -1.26 -5.01 105.19 100.40 1blr n GLY 102 Ca 0.00 -1.34 -0.05 0.00 0.00 0.00 0.00 46.02 44.63 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 0.54 0.17 0.00 1.61 0.28 -1.26 -5.05 120.64 116.94 1blr n GLU 103 Ca 0.00 0.04 0.00 0.00 -0.16 0.00 0.00 57.16 57.04 1blr n GLU 103 Cb 0.00 -1.12 0.00 0.00 1.43 0.00 0.00 31.44 31.75 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 3.14 0.07 0.00 -1.84 0.00 -1.26 -5.14 105.19 100.16 1blr n GLY 104 Ca -0.12 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1blr n GLY 104 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1blr n PRO 105 N -0.05 1.24 -3.76 1.61 -0.04 -1.26 -5.05 135.00 127.69 1blr n PRO 105 Ca 0.00 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.44 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 0.24 1.07 0.34 0.54 2.47 -1.26 -4.83 119.74 118.32 1blr s LYS 106 Ca 0.00 -0.62 0.07 0.00 -1.56 0.00 0.00 55.97 53.87 1blr s LYS 106 Cb 0.00 0.35 -0.02 0.00 -1.46 0.00 0.00 37.83 36.69 1blr s LYS 106 CO 0.00 -0.49 0.33 0.95 0.16 0.00 0.00 175.35 176.30 1blr s THR 107 N -2.87 3.53 0.00 3.43 -4.23 -1.06 -1.49 115.64 112.94 1blr s THR 107 Ca 0.15 -1.30 0.00 0.00 -1.18 0.00 0.00 61.69 59.36 1blr s THR 107 Cb -0.00 -3.20 0.00 0.00 1.34 0.00 0.00 72.50 70.63 1blr s THR 107 CO 0.02 -0.15 0.00 -1.54 -0.54 0.00 0.00 174.62 172.41 1blr n SER 108 N -1.44 0.00 -3.61 3.99 3.41 -1.07 -1.43 113.62 113.46 1blr n SER 108 Ca -0.01 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.47 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 -0.65 -0.20 7.33 1.48 -0.58 0.24 118.94 124.56 1blr s TRP 109 Ca 0.00 1.48 -0.01 0.00 -1.06 0.00 0.00 56.10 56.51 1blr s TRP 109 Cb 0.00 0.33 0.06 0.00 -1.16 0.00 0.00 33.47 32.70 1blr s TRP 109 CO 0.00 -0.37 -0.01 0.95 -4.06 0.00 0.00 176.95 173.46 1blr s THR 110 N -0.05 0.96 -0.13 0.66 -4.23 -0.51 0.96 115.64 113.30 1blr s THR 110 Ca -0.01 -0.80 -0.23 0.00 -1.18 0.00 0.00 61.69 59.48 1blr s THR 110 Cb -0.04 -1.33 -0.03 0.00 1.34 0.00 0.00 72.50 72.44 1blr s THR 110 CO 0.01 -0.12 0.68 -0.13 -0.54 0.00 0.00 174.62 174.52 1blr s ARG 111 N 1.66 4.34 0.08 3.99 0.52 -0.39 -2.15 118.95 127.01 1blr s ARG 111 Ca -0.02 0.79 0.05 0.00 -0.52 0.00 0.00 55.73 56.02 1blr s ARG 111 Cb -0.17 -3.51 -0.03 0.00 0.52 0.00 0.00 34.95 31.76 1blr s ARG 111 CO -0.07 -0.08 -0.12 -2.00 0.02 0.00 0.00 175.30 173.04 1blr s GLU 112 N 1.34 0.83 0.39 3.54 2.12 -0.54 -1.20 118.70 125.19 1blr s GLU 112 Ca 0.34 -1.04 0.08 0.00 0.36 0.00 0.00 54.97 54.70 1blr s GLU 112 Cb -0.17 -0.70 -0.04 0.00 0.26 0.00 0.00 34.13 33.49 1blr s GLU 112 CO 0.14 0.14 0.26 -0.51 -0.54 0.00 0.00 175.26 174.75 1blr s LEU 113 N -2.05 3.30 0.02 2.70 2.01 -0.74 -0.71 118.68 123.20 1blr s LEU 113 Ca 0.01 -0.84 0.00 0.00 0.01 0.00 0.00 54.13 53.32 1blr s LEU 113 Cb -0.07 -1.81 0.00 0.00 0.01 0.00 0.00 46.19 44.32 1blr s LEU 113 CO 0.02 -0.52 0.00 0.41 1.01 0.00 0.00 176.35 177.26 1blr n THR 114 N -1.36 0.16 0.03 5.49 -1.04 -1.14 -4.85 114.28 111.56 1blr n THR 114 Ca 0.00 0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 1blr n THR 114 Cb 0.62 -0.92 0.00 0.00 -1.82 0.00 0.00 70.33 68.21 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 -2.65 0.26 -0.95 8.00 4.13 -1.26 -5.01 115.26 117.78 1blr n ASN 115 Ca 0.00 0.09 -0.05 0.00 1.68 0.00 0.00 54.58 56.29 1blr n ASN 115 Cb 0.00 -0.04 -0.04 0.00 -1.54 0.00 0.00 39.78 38.15 1blr n ASN 115 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1blr n ASP 116 N -2.85 -0.77 0.00 6.41 2.03 -1.26 -4.98 116.55 115.14 1blr n ASP 116 Ca 0.00 -1.52 0.00 0.00 0.52 0.00 0.00 54.79 53.79 1blr n ASP 116 Cb 0.00 0.24 0.00 0.00 -0.72 0.00 0.00 41.12 40.64 1blr n ASP 116 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1blr n GLY 117 N -0.06 0.00 2.40 0.27 0.00 -1.26 -4.86 105.19 101.69 1blr n GLY 117 Ca -0.21 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.64 1blr n GLY 117 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1blr n GLU 118 N 0.00 0.79 -2.70 1.61 2.13 -1.24 -3.97 120.64 117.25 1blr n GLU 118 Ca 0.00 -2.68 -0.43 0.00 0.66 0.00 0.00 57.16 54.71 1blr n GLU 118 Cb 0.00 -1.34 -0.03 0.00 0.27 0.00 0.00 31.44 30.34 1blr n GLU 118 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 1blr s LEU 119 N -1.26 3.76 -0.45 4.31 0.20 0.27 -2.88 118.68 122.63 1blr s LEU 119 Ca 0.34 -0.06 -0.21 0.00 0.69 0.00 0.00 54.13 54.88 1blr s LEU 119 Cb 0.22 -3.05 0.03 0.00 -0.43 0.00 0.00 46.19 42.96 1blr s LEU 119 CO -0.15 -1.34 0.67 0.27 -0.29 0.00 0.00 176.35 175.52 1blr s ILE 120 N 4.44 4.79 -0.19 6.68 -5.25 0.11 -0.22 121.20 131.55 1blr s ILE 120 Ca 0.38 0.12 -0.04 0.00 -0.99 0.00 0.00 60.65 60.12 1blr s ILE 120 Cb -0.10 -4.24 -0.02 0.00 2.95 0.00 0.00 42.46 41.05 1blr s ILE 120 CO 0.23 -0.65 -0.04 -0.22 -1.79 0.00 0.00 174.94 172.47 1blr s LEU 121 N 2.92 3.02 0.24 0.37 1.98 -1.05 -1.47 118.68 124.69 1blr s LEU 121 Ca 0.23 -0.29 0.08 0.00 -2.89 0.00 0.00 54.13 51.27 1blr s LEU 121 Cb -0.14 -1.75 -0.04 0.00 0.66 0.00 0.00 46.19 44.92 1blr s LEU 121 CO 0.19 0.06 0.06 -0.89 -1.89 0.00 0.00 176.35 173.88 1blr s THR 122 N 1.02 3.86 -0.37 3.68 2.01 -0.91 -2.95 115.64 121.97 1blr s THR 122 Ca 0.01 -1.62 0.07 0.00 0.31 0.00 0.00 61.69 60.45 1blr s THR 122 Cb -0.15 -3.04 0.18 0.00 0.01 0.00 0.00 72.50 69.50 1blr s THR 122 CO 0.01 -0.30 0.58 -0.32 -0.69 0.00 0.00 174.62 173.89 1blr s MET 123 N -3.55 0.71 0.99 4.92 0.00 -0.84 -1.42 119.30 120.12 1blr s MET 123 Ca 0.31 -0.10 -0.12 0.00 0.00 0.00 0.00 55.69 55.77 1blr s MET 123 Cb -0.08 0.02 0.19 0.00 0.00 0.00 0.00 34.83 34.96 1blr s MET 123 CO 0.21 -1.15 1.10 0.95 0.00 0.00 0.00 175.02 176.14 1blr s THR 124 N 2.09 2.00 -0.30 10.11 -4.23 0.14 -2.13 115.64 123.32 1blr s THR 124 Ca 0.14 0.00 -0.13 0.00 -1.18 0.00 0.00 61.69 60.52 1blr s THR 124 Cb -0.07 -2.54 0.18 0.00 1.34 0.00 0.00 72.50 71.41 1blr s THR 124 CO -0.13 -0.00 1.09 0.00 -0.54 0.00 0.00 174.62 175.04 1blr s ALA 125 N -3.03 -3.97 -1.27 3.99 0.00 -0.71 -2.61 121.76 114.16 1blr s ALA 125 Ca 0.65 1.37 -0.02 0.00 0.00 0.00 0.00 51.96 53.96 1blr s ALA 125 Cb -0.18 -2.75 0.00 0.00 0.00 0.00 0.00 23.12 20.19 1blr s ALA 125 CO 0.57 -1.90 0.30 -0.25 0.00 0.00 0.00 175.76 174.48 1blr n ASP 126 N 5.22 -5.00 0.00 0.00 8.00 -0.56 -2.04 116.55 122.17 1blr n ASP 126 Ca 0.04 -0.15 0.00 0.00 0.71 0.00 0.00 54.79 55.39 1blr n ASP 126 Cb 0.57 -3.95 0.00 0.00 -0.02 0.00 0.00 41.12 37.72 1blr n ASP 126 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1blr n ASP 127 N -1.38 0.00 -4.50 -2.24 -0.08 -1.25 -4.45 116.55 102.64 1blr n ASP 127 Ca -0.13 0.00 -0.28 0.00 -1.51 0.00 0.00 54.79 52.88 1blr n ASP 127 Cb 0.61 0.00 0.13 0.00 2.34 0.00 0.00 41.12 44.21 1blr n ASP 127 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 1blr s VAL 128 N -2.45 2.09 -0.27 5.18 -7.23 -0.87 -4.77 120.40 112.07 1blr s VAL 128 Ca 0.00 -0.19 -0.05 0.00 -1.81 0.00 0.00 61.98 59.94 1blr s VAL 128 Cb 0.00 -2.90 0.15 0.00 0.56 0.00 0.00 36.38 34.19 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 -3.56 -0.86 -0.86 1.32 1.01 -1.26 -1.73 120.40 114.46 1blr s VAL 129 Ca 0.68 0.02 -0.17 0.00 0.00 0.00 0.00 61.98 62.51 1blr s VAL 129 Cb -0.06 -0.91 0.17 0.00 0.00 0.00 0.00 36.38 35.58 1blr s VAL 129 CO 0.49 -0.01 0.93 0.00 0.00 0.00 0.00 175.10 176.50 1blr s THR 131 N 1.49 4.08 -0.27 0.00 2.01 -1.26 -1.98 115.64 119.70 1blr s THR 131 Ca 0.24 -0.30 -0.23 0.00 0.31 0.00 0.00 61.69 61.71 1blr s THR 131 Cb -0.09 -2.78 0.08 0.00 0.01 0.00 0.00 72.50 69.72 1blr s THR 131 CO -0.08 0.51 0.73 0.00 -0.69 0.00 0.00 174.62 175.09 1blr s ARG 132 N 0.16 0.79 0.62 4.92 1.70 -1.15 -4.24 118.95 121.74 1blr s ARG 132 Ca -0.00 1.02 -0.14 0.00 -0.47 0.00 0.00 55.73 56.14 1blr s ARG 132 Cb -0.13 0.34 -0.03 0.00 -0.57 0.00 0.00 34.95 34.56 1blr s ARG 132 CO 0.02 -0.11 1.05 0.08 -1.08 0.00 0.00 175.30 175.26 1blr s VAL 133 N 0.65 4.05 0.12 4.99 1.01 0.56 -2.53 120.40 129.25 1blr s VAL 133 Ca -0.02 0.84 0.01 0.00 0.00 0.00 0.00 61.98 62.81 1blr s VAL 133 Cb -0.05 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 1blr s VAL 133 CO -0.04 -0.70 -0.03 -0.31 0.00 0.00 0.00 175.10 174.02 1blr s TYR 134 N -2.74 0.95 0.17 5.22 1.51 0.69 -0.34 117.35 122.82 1blr s TYR 134 Ca 0.60 -0.99 0.03 0.00 -1.01 0.00 0.00 57.07 55.70 1blr s TYR 134 Cb -0.14 -0.55 -0.05 0.00 -0.11 0.00 0.00 41.96 41.11 1blr s TYR 134 CO 0.44 -0.23 -0.02 0.08 -1.11 0.00 0.00 175.55 174.71 1blr s VAL 135 N -3.70 0.82 -0.27 0.71 1.01 -1.13 -0.56 120.40 117.27 1blr s VAL 135 Ca 0.16 -2.00 -0.28 0.00 0.00 0.00 0.00 61.98 59.86 1blr s VAL 135 Cb 0.06 -2.09 0.01 0.00 0.00 0.00 0.00 36.38 34.36 1blr s VAL 135 CO -0.02 -0.52 1.01 -0.13 0.00 0.00 0.00 175.10 175.44 1blr s ARG 136 N -3.87 4.16 0.00 2.72 0.52 -1.25 -1.70 118.95 119.52 1blr s ARG 136 Ca 0.23 1.14 0.00 0.00 -0.52 0.00 0.00 55.73 56.58 1blr s ARG 136 Cb 0.05 -3.68 0.00 0.00 0.52 0.00 0.00 34.95 31.84 1blr s ARG 136 CO 0.04 -0.72 0.39 -1.91 0.02 0.00 0.00 175.30 173.12