#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b6f s VAL 2 N 0.00 3.96 0.45 1.61 1.01 -1.26 -4.02 120.40 122.15 1b6f s VAL 2 Ca 0.00 -1.32 0.08 0.00 0.00 0.00 0.00 61.98 60.73 1b6f s VAL 2 Cb 0.00 -3.01 0.02 0.00 0.00 0.00 0.00 36.38 33.40 1b6f s VAL 2 CO 0.00 -0.12 0.62 -0.36 0.00 0.00 0.00 175.10 175.24 1b6f s PHE 3 N -1.75 2.63 -0.21 5.22 0.40 0.16 -4.91 117.98 119.51 1b6f s PHE 3 Ca 0.29 -0.41 -0.22 0.00 -0.60 0.00 0.00 56.93 55.99 1b6f s PHE 3 Cb -0.09 -2.40 0.06 0.00 0.51 0.00 0.00 43.02 41.10 1b6f s PHE 3 CO 0.20 -0.56 0.61 1.21 0.70 0.00 0.00 175.22 177.38 1b6f s ASN 4 N -4.40 -0.62 -0.45 1.36 3.04 -1.26 -2.29 114.94 110.31 1b6f s ASN 4 Ca 0.56 1.15 0.06 0.00 0.04 0.00 0.00 52.86 54.67 1b6f s ASN 4 Cb -0.09 1.15 0.33 0.00 -1.54 0.00 0.00 41.25 41.10 1b6f s ASN 4 CO 0.34 -0.26 1.13 -1.22 -3.04 0.00 0.00 177.10 174.05 1b6f n TYR 5 N 2.52 -2.75 -2.69 0.43 4.01 -0.34 -4.99 117.16 113.36 1b6f n TYR 5 Ca -0.14 -2.16 -0.32 0.00 -0.16 0.00 0.00 57.90 55.11 1b6f n TYR 5 Cb 0.56 1.57 -0.05 0.00 -0.31 0.00 0.00 39.34 41.12 1b6f n TYR 5 CO 0.00 0.00 0.00 -1.83 -0.46 0.00 0.00 176.86 174.57 1b6f s GLU 6 N 0.18 4.00 0.22 -0.72 -1.05 -1.26 -3.85 118.70 116.23 1b6f s GLU 6 Ca 0.23 0.88 -0.02 0.00 -0.15 0.00 0.00 54.97 55.90 1b6f s GLU 6 Cb 0.30 -2.23 0.01 0.00 -0.44 0.00 0.00 34.13 31.77 1b6f s GLU 6 CO -0.05 -0.11 0.32 0.25 0.95 0.00 0.00 175.26 176.62 1b6f n THR 7 N -1.11 0.00 -3.45 1.83 -2.24 0.24 -4.91 114.28 104.65 1b6f n THR 7 Ca 0.06 -1.05 -0.13 0.00 -2.27 0.00 0.00 64.05 60.65 1b6f n THR 7 Cb 0.54 0.67 -0.03 0.00 -2.10 0.00 0.00 70.33 69.41 1b6f n THR 7 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1b6f s GLU 8 N -2.45 1.22 0.33 -0.78 -1.05 -1.26 0.51 118.70 115.22 1b6f s GLU 8 Ca 0.17 -0.32 0.00 0.00 -0.15 0.00 0.00 54.97 54.68 1b6f s GLU 8 Cb -0.01 0.56 -0.00 0.00 -0.44 0.00 0.00 34.13 34.24 1b6f s GLU 8 CO 0.12 -0.50 0.42 -2.37 0.95 0.00 0.00 175.26 173.88 1b6f n THR 9 N -0.08 0.00 -4.39 1.83 5.66 0.15 -4.97 114.28 112.49 1b6f n THR 9 Ca -0.17 -1.83 -0.24 0.00 -3.05 0.00 0.00 64.05 58.76 1b6f n THR 9 Cb 0.63 1.06 -0.09 0.00 -1.55 0.00 0.00 70.33 70.39 1b6f n THR 9 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1b6f s THR 10 N -2.91 2.86 -0.25 1.09 -4.23 -1.26 -0.56 115.64 110.38 1b6f s THR 10 Ca 0.30 -2.16 -0.20 0.00 -1.18 0.00 0.00 61.69 58.45 1b6f s THR 10 Cb -0.00 -2.59 0.07 0.00 1.34 0.00 0.00 72.50 71.32 1b6f s THR 10 CO 0.21 -0.36 0.64 -0.55 -0.54 0.00 0.00 174.62 174.03 1b6f s SER 11 N -3.60 -0.73 0.13 3.99 0.15 -0.08 -4.86 113.70 108.70 1b6f s SER 11 Ca 0.31 1.33 0.27 0.00 0.70 0.00 0.00 55.95 58.56 1b6f s SER 11 Cb -0.05 1.30 0.97 0.00 -1.71 0.00 0.00 66.02 66.54 1b6f s SER 11 CO 0.17 -0.23 1.83 0.52 1.20 0.00 0.00 173.24 176.74 1b6f n VAL 12 N 3.20 0.38 -2.20 4.45 0.31 -1.26 0.72 118.33 123.93 1b6f n VAL 12 Ca -0.16 -0.17 -0.36 0.00 -0.01 0.00 0.00 64.34 63.64 1b6f n VAL 12 Cb 0.56 -0.56 0.00 0.00 -0.91 0.00 0.00 33.84 32.94 1b6f n VAL 12 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1b6f s ILE 13 N -3.06 3.01 0.59 2.52 -1.09 -1.26 -3.99 121.20 117.91 1b6f s ILE 13 Ca 0.12 0.68 -0.19 0.00 -2.23 0.00 0.00 60.65 59.03 1b6f s ILE 13 Cb 0.15 -3.31 -0.04 0.00 -1.58 0.00 0.00 42.46 37.69 1b6f s ILE 13 CO 0.57 -0.08 1.18 -2.16 -1.23 0.00 0.00 174.94 173.22 1b6f s PRO 14 N -3.06 3.03 0.34 2.79 0.04 -1.26 -3.07 135.00 133.82 1b6f s PRO 14 Ca 0.70 1.75 0.18 0.00 0.04 0.00 0.00 61.00 63.66 1b6f s PRO 14 Cb -0.27 -1.95 0.47 0.00 0.04 0.00 0.00 34.50 32.79 1b6f s PRO 14 CO 0.32 -1.14 1.63 0.00 0.04 0.00 0.00 177.00 177.85 1b6f h ALA 15 N 0.88 0.87 0.01 8.56 0.00 -1.85 -2.40 119.26 125.33 1b6f h ALA 15 Ca -0.50 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.03 1b6f h ALA 15 Cb 1.29 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1b6f h ALA 15 CO 0.55 0.53 -0.00 0.00 0.00 0.00 0.00 179.25 180.32 1b6f h ALA 16 N 1.58 -0.01 -0.66 0.00 0.00 -1.92 -2.14 119.26 116.11 1b6f h ALA 16 Ca -0.00 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.48 1b6f h ALA 16 Cb 1.07 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 1b6f h ALA 16 CO 0.05 -0.02 0.22 -0.09 0.00 0.00 0.00 179.25 179.42 1b6f h ARG 17 N -0.98 1.00 -0.19 0.00 2.43 -1.97 -2.32 114.38 112.35 1b6f h ARG 17 Ca -0.00 -0.19 -0.12 0.00 -0.81 0.00 0.00 59.98 58.86 1b6f h ARG 17 Cb 0.75 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 1b6f h ARG 17 CO 0.00 0.85 -0.38 1.25 -1.51 0.00 0.00 179.97 180.18 1b6f h LEU 18 N 0.97 0.45 0.12 3.80 7.12 -1.54 -2.62 115.31 123.61 1b6f h LEU 18 Ca 0.22 -0.19 -0.01 0.00 0.13 0.00 0.00 57.88 58.04 1b6f h LEU 18 Cb 0.25 -0.12 0.00 0.00 -0.53 0.00 0.00 40.66 40.26 1b6f h LEU 18 CO -0.01 0.79 -0.06 0.15 -0.13 0.00 0.00 178.44 179.18 1b6f h PHE 19 N 0.36 -0.16 -0.67 1.25 3.04 -0.85 0.19 116.94 120.11 1b6f h PHE 19 Ca 0.04 -0.00 0.13 0.00 3.98 0.00 0.00 57.97 62.11 1b6f h PHE 19 Cb 0.83 0.05 -0.13 0.00 2.56 0.00 0.00 35.95 39.26 1b6f h PHE 19 CO 0.03 -0.10 -0.23 -0.22 -2.02 0.00 0.00 178.31 175.77 1b6f h LYS 20 N -0.20 -0.05 -0.90 1.11 3.64 -1.56 2.20 116.57 120.81 1b6f h LYS 20 Ca -0.02 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.40 1b6f h LYS 20 Cb 0.13 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.91 1b6f h LYS 20 CO 0.03 -0.03 0.59 0.00 -2.27 0.00 0.00 179.45 177.77 1b6f h ALA 21 N 1.49 1.42 0.00 5.00 0.00 -1.49 1.17 119.26 126.85 1b6f h ALA 21 Ca 0.31 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1b6f h ALA 21 Cb 0.53 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1b6f h ALA 21 CO -0.71 0.50 -0.31 0.34 0.00 0.00 0.00 179.25 179.07 1b6f n PHE 22 N -4.43 0.46 0.00 0.00 -0.00 0.13 -1.19 117.46 112.42 1b6f n PHE 22 Ca 0.12 0.13 0.00 0.00 -0.00 0.00 0.00 57.45 57.70 1b6f n PHE 22 Cb 0.09 -0.64 0.00 0.00 -0.00 0.00 0.00 39.48 38.93 1b6f n PHE 22 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.76 175.87 1b6f n ILE 23 N -1.93 0.00 -0.15 -2.13 2.08 0.70 -3.95 119.36 113.97 1b6f n ILE 23 Ca 0.05 0.01 -0.09 0.00 0.56 0.00 0.00 62.75 63.28 1b6f n ILE 23 Cb 0.40 -0.70 -0.04 0.00 -0.75 0.00 0.00 39.64 38.55 1b6f n ILE 23 CO 0.00 0.00 0.00 0.25 0.56 0.00 0.00 176.55 177.36 1b6f h LEU 24 N 0.00 -1.39 -1.40 1.39 7.12 0.11 0.18 115.31 121.31 1b6f h LEU 24 Ca 0.00 0.22 0.00 0.00 0.13 0.00 0.00 57.88 58.23 1b6f h LEU 24 Cb 0.00 0.63 0.00 0.00 -0.53 0.00 0.00 40.66 40.76 1b6f h LEU 24 CO 0.00 -0.35 0.00 0.47 -0.13 0.00 0.00 178.44 178.43 1b6f n ASP 25 N -5.41 2.16 -0.18 1.25 9.92 0.86 -4.40 116.55 120.75 1b6f n ASP 25 Ca 0.01 -1.73 -0.05 0.00 -0.53 0.00 0.00 54.79 52.49 1b6f n ASP 25 Cb 0.35 -0.04 0.01 0.00 -0.64 0.00 0.00 41.12 40.81 1b6f n ASP 25 CO 0.00 0.00 0.00 1.23 0.13 0.00 0.00 177.20 178.56 1b6f h GLY 26 N 4.81 -0.02 -1.41 0.44 0.00 0.54 2.25 103.07 109.68 1b6f h GLY 26 Ca 0.00 0.37 0.49 0.00 0.00 0.00 0.00 47.33 48.20 1b6f h GLY 26 CO 0.00 -0.22 1.23 1.29 0.00 0.00 0.00 176.54 178.84 1b6f h ASP 27 N -0.15 0.00 0.00 0.19 2.03 -1.77 0.65 116.42 117.37 1b6f h ASP 27 Ca 0.23 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.53 1b6f h ASP 27 Cb 0.53 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.03 1b6f h ASP 27 CO -0.63 0.00 -0.46 -3.20 -1.03 0.00 0.00 179.24 173.92 1b6f n ASN 28 N -4.01 0.74 0.15 4.15 5.15 0.23 -4.50 115.26 117.17 1b6f n ASN 28 Ca 0.38 -0.57 0.12 0.00 -0.60 0.00 0.00 54.58 53.91 1b6f n ASN 28 Cb 1.75 1.04 0.17 0.00 -0.53 0.00 0.00 39.78 42.21 1b6f n ASN 28 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 1b6f h LEU 29 N 0.00 0.00 0.22 1.20 7.12 0.91 -3.05 115.31 121.72 1b6f h LEU 29 Ca 0.00 -0.03 -0.01 0.00 0.13 0.00 0.00 57.88 57.97 1b6f h LEU 29 Cb 0.18 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.32 1b6f h LEU 29 CO 0.00 0.01 -0.11 -0.26 -0.13 0.00 0.00 178.44 177.96 1b6f h PHE 30 N 0.00 -0.28 0.00 1.25 -1.00 -1.27 -2.86 116.94 112.79 1b6f h PHE 30 Ca 0.00 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.77 1b6f h PHE 30 Cb 0.92 0.09 0.00 0.00 3.61 0.00 0.00 35.95 40.58 1b6f h PHE 30 CO 0.00 -0.13 0.00 -0.35 -1.61 0.00 0.00 178.31 176.22 1b6f n PRO 31 N -4.97 0.36 -0.03 1.51 -0.04 -1.26 -0.26 135.00 130.31 1b6f n PRO 31 Ca -0.04 0.08 -0.02 0.00 -0.04 0.00 0.00 63.50 63.48 1b6f n PRO 31 Cb 0.14 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.09 1b6f n PRO 31 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1b6f n LYS 32 N -1.18 0.17 0.02 0.54 3.00 -1.15 -3.73 118.16 115.83 1b6f n LYS 32 Ca 0.10 0.30 0.13 0.00 -0.00 0.00 0.00 58.31 58.84 1b6f n LYS 32 Cb 0.11 -1.06 0.36 0.00 0.00 0.00 0.00 35.03 34.45 1b6f n LYS 32 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 1b6f n VAL 33 N -3.16 0.10 -3.12 3.15 0.24 -1.08 -4.28 118.33 110.18 1b6f n VAL 33 Ca -0.03 -0.06 -0.17 0.00 -2.04 0.00 0.00 64.34 62.03 1b6f n VAL 33 Cb 0.12 -0.10 -0.02 0.00 -1.47 0.00 0.00 33.84 32.37 1b6f n VAL 33 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1b6f n ALA 34 N -1.57 1.61 0.93 2.33 0.00 0.64 -4.77 120.51 119.68 1b6f n ALA 34 Ca 0.06 -3.10 0.10 0.00 0.00 0.00 0.00 53.44 50.49 1b6f n ALA 34 Cb 0.36 -0.95 0.50 0.00 0.00 0.00 0.00 19.45 19.35 1b6f n ALA 34 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1b6f n PRO 35 N 0.45 0.27 0.12 0.00 -0.04 -1.14 -2.86 135.00 131.81 1b6f n PRO 35 Ca 0.22 0.10 0.01 0.00 -0.04 0.00 0.00 63.50 63.79 1b6f n PRO 35 Cb 0.65 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.61 1b6f n PRO 35 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1b6f h GLN 36 N 0.00 0.00 0.00 0.54 4.20 -1.90 -3.39 115.11 114.56 1b6f h GLN 36 Ca 0.00 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.56 1b6f h GLN 36 Cb 0.20 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.95 1b6f h GLN 36 CO 0.00 0.54 -1.33 0.00 -0.67 0.00 0.00 178.83 177.36 1b6f n ALA 37 N -2.25 0.86 -2.84 3.87 0.00 -1.13 -4.73 120.51 114.28 1b6f n ALA 37 Ca 0.01 -0.76 -0.36 0.00 0.00 0.00 0.00 53.44 52.33 1b6f n ALA 37 Cb 0.76 -0.03 -0.07 0.00 0.00 0.00 0.00 19.45 20.12 1b6f n ALA 37 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1b6f s ILE 38 N -2.58 5.39 -0.18 0.00 1.09 -1.20 -4.23 121.20 119.49 1b6f s ILE 38 Ca -0.28 0.17 0.11 0.00 -1.10 0.00 0.00 60.65 59.54 1b6f s ILE 38 Cb 0.07 -3.37 -0.19 0.00 -1.06 0.00 0.00 42.46 37.91 1b6f s ILE 38 CO 0.42 0.58 -0.02 -0.24 -0.10 0.00 0.00 174.94 175.58 1b6f n SER 39 N 2.30 1.31 -3.53 3.58 2.88 0.40 -4.37 113.62 116.19 1b6f n SER 39 Ca -0.19 -0.04 -0.18 0.00 -1.33 0.00 0.00 58.87 57.13 1b6f n SER 39 Cb 0.54 0.50 -0.06 0.00 -0.75 0.00 0.00 64.21 64.44 1b6f n SER 39 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1b6f s SER 40 N -5.43 -0.66 -0.03 -3.46 1.04 -1.14 -4.91 113.70 99.11 1b6f s SER 40 Ca -0.15 0.77 0.04 0.00 0.48 0.00 0.00 55.95 57.09 1b6f s SER 40 Cb 0.06 0.61 -0.00 0.00 0.10 0.00 0.00 66.02 66.78 1b6f s SER 40 CO 0.63 -0.58 -0.15 -0.69 0.98 0.00 0.00 173.24 173.44 1b6f s VAL 41 N -1.07 1.21 0.03 5.02 1.01 -1.26 0.67 120.40 126.01 1b6f s VAL 41 Ca -0.10 -0.61 -0.00 0.00 0.00 0.00 0.00 61.98 61.27 1b6f s VAL 41 Cb -0.00 -1.05 -0.03 0.00 0.00 0.00 0.00 36.38 35.30 1b6f s VAL 41 CO 0.09 0.35 -0.03 -1.61 0.00 0.00 0.00 175.10 173.91 1b6f s GLU 42 N 0.02 0.41 -0.33 2.72 2.02 0.15 -4.93 118.70 118.75 1b6f s GLU 42 Ca -0.02 -0.80 -0.09 0.00 0.02 0.00 0.00 54.97 54.07 1b6f s GLU 42 Cb -0.10 0.13 0.01 0.00 0.10 0.00 0.00 34.13 34.27 1b6f s GLU 42 CO 0.01 -0.07 0.15 1.21 0.02 0.00 0.00 175.26 176.59 1b6f s ASN 43 N -1.92 5.52 -0.01 -0.19 2.47 -1.26 0.14 114.94 119.70 1b6f s ASN 43 Ca -0.09 -0.77 -0.12 0.00 0.42 0.00 0.00 52.86 52.30 1b6f s ASN 43 Cb -0.04 -1.98 -0.32 0.00 -1.45 0.00 0.00 41.25 37.46 1b6f s ASN 43 CO -0.04 -0.27 0.84 0.40 -3.72 0.00 0.00 177.10 174.31 1b6f h ILE 44 N 5.81 1.12 -3.54 -5.21 1.08 0.35 -3.47 117.51 113.65 1b6f h ILE 44 Ca -0.29 -2.64 -0.07 0.00 -0.39 0.00 0.00 64.86 61.46 1b6f h ILE 44 Cb 1.12 2.88 -0.07 0.00 -3.07 0.00 0.00 36.82 37.69 1b6f h ILE 44 CO 0.63 0.84 -0.02 -0.70 -0.69 0.00 0.00 178.15 178.21 1b6f s GLU 45 N -2.59 1.76 0.20 2.37 2.56 0.42 -4.92 118.70 118.50 1b6f s GLU 45 Ca -0.12 -1.34 0.00 0.00 0.00 0.00 0.00 54.97 53.51 1b6f s GLU 45 Cb 0.05 0.51 0.00 0.00 2.00 0.00 0.00 34.13 36.69 1b6f s GLU 45 CO 0.89 -0.76 0.00 0.41 -0.56 0.00 0.00 175.26 175.24 1b6f n GLY 46 N -0.45 -2.17 1.86 -1.50 0.00 -1.26 -0.51 105.19 101.16 1b6f n GLY 46 Ca -0.03 -1.34 -0.21 0.00 0.00 0.00 0.00 46.02 44.45 1b6f n GLY 46 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1b6f n ASN 47 N -3.17 4.82 0.00 1.61 5.15 -1.26 -4.79 115.26 117.61 1b6f n ASN 47 Ca -0.01 -3.76 0.00 0.00 -0.60 0.00 0.00 54.58 50.20 1b6f n ASN 47 Cb 0.28 -0.68 0.00 0.00 -0.53 0.00 0.00 39.78 38.85 1b6f n ASN 47 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1b6f n GLY 48 N -0.95 0.70 0.00 8.20 0.00 -1.26 -5.02 105.19 106.85 1b6f n GLY 48 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.50 1b6f n GLY 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b6f n GLY 49 N -2.55 0.99 3.72 -0.02 0.00 -1.26 -4.93 105.19 101.14 1b6f n GLY 49 Ca 0.00 -1.89 -0.42 0.00 0.00 0.00 0.00 46.02 43.72 1b6f n GLY 49 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1b6f s PRO 50 N 1.96 4.42 0.00 1.61 0.04 -1.26 -2.59 135.00 139.17 1b6f s PRO 50 Ca 0.00 1.87 0.00 0.00 0.04 0.00 0.00 61.00 62.91 1b6f s PRO 50 Cb 0.00 -3.30 0.00 0.00 0.04 0.00 0.00 34.50 31.24 1b6f s PRO 50 CO 0.00 -0.27 0.00 0.41 0.04 0.00 0.00 177.00 177.18 1b6f n GLY 51 N 3.07 1.53 3.71 0.56 0.00 0.56 -4.94 105.19 109.69 1b6f n GLY 51 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 1b6f n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1b6f s THR 52 N -2.55 2.11 -0.15 2.61 2.01 -1.07 -4.43 115.64 114.16 1b6f s THR 52 Ca 0.00 0.05 0.00 0.00 0.31 0.00 0.00 61.69 62.06 1b6f s THR 52 Cb 0.00 -2.68 -0.00 0.00 0.01 0.00 0.00 72.50 69.82 1b6f s THR 52 CO 0.00 -0.03 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.12 1b6f s ILE 53 N -1.87 2.68 0.03 1.82 1.01 0.34 0.08 121.20 125.29 1b6f s ILE 53 Ca 0.76 -0.77 0.02 0.00 0.00 0.00 0.00 60.65 60.67 1b6f s ILE 53 Cb -0.32 -2.13 -0.02 0.00 0.01 0.00 0.00 42.46 40.01 1b6f s ILE 53 CO 0.46 0.51 -0.08 -0.75 0.00 0.00 0.00 174.94 175.09 1b6f s LYS 54 N 0.80 0.53 -0.15 2.79 2.20 -1.03 0.27 119.74 125.16 1b6f s LYS 54 Ca -0.05 -0.59 -0.12 0.00 -0.36 0.00 0.00 55.97 54.85 1b6f s LYS 54 Cb -0.15 -0.38 -0.05 0.00 -1.51 0.00 0.00 37.83 35.74 1b6f s LYS 54 CO 0.00 0.08 0.23 0.21 -0.36 0.00 0.00 175.35 175.52 1b6f s LYS 55 N -1.11 4.05 0.01 4.03 2.20 0.38 -1.66 119.74 127.63 1b6f s LYS 55 Ca -0.05 0.00 0.04 0.00 -0.36 0.00 0.00 55.97 55.59 1b6f s LYS 55 Cb -0.07 -3.36 -0.03 0.00 -1.51 0.00 0.00 37.83 32.85 1b6f s LYS 55 CO 0.00 0.40 -0.08 0.42 -0.36 0.00 0.00 175.35 175.74 1b6f s ILE 56 N -0.01 3.55 -0.03 5.43 -1.09 0.16 0.33 121.20 129.55 1b6f s ILE 56 Ca 0.15 -0.81 0.04 0.00 -2.23 0.00 0.00 60.65 57.80 1b6f s ILE 56 Cb -0.13 -2.54 -0.03 0.00 -1.58 0.00 0.00 42.46 38.19 1b6f s ILE 56 CO 0.03 0.39 -0.15 -0.44 -1.23 0.00 0.00 174.94 173.55 1b6f s SER 57 N -1.40 3.98 -0.07 3.58 0.01 0.21 -0.63 113.70 119.38 1b6f s SER 57 Ca 0.17 -0.25 0.05 0.00 1.31 0.00 0.00 55.95 57.23 1b6f s SER 57 Cb -0.11 -0.80 -0.01 0.00 0.21 0.00 0.00 66.02 65.32 1b6f s SER 57 CO 0.07 0.32 -0.23 -0.36 0.41 0.00 0.00 173.24 173.45 1b6f s PHE 58 N -0.78 2.34 0.36 2.43 0.40 -1.26 0.15 117.98 121.62 1b6f s PHE 58 Ca 0.12 -0.79 -0.26 0.00 -0.60 0.00 0.00 56.93 55.41 1b6f s PHE 58 Cb -0.11 -1.55 -0.09 0.00 0.51 0.00 0.00 43.02 41.78 1b6f s PHE 58 CO 0.02 -0.28 1.06 -1.25 0.70 0.00 0.00 175.22 175.47 1b6f s PRO 59 N 0.06 4.33 1.18 0.24 0.04 -1.26 -4.44 135.00 135.15 1b6f s PRO 59 Ca -0.09 1.58 0.00 0.00 0.04 0.00 0.00 61.00 62.54 1b6f s PRO 59 Cb -0.15 -2.75 0.00 0.00 0.04 0.00 0.00 34.50 31.64 1b6f s PRO 59 CO 0.05 -0.01 0.00 -1.91 0.04 0.00 0.00 177.00 175.17 1b6f n GLU 60 N 0.35 0.00 -0.84 4.56 4.07 -1.26 -4.99 120.64 122.53 1b6f n GLU 60 Ca 0.03 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.13 1b6f n GLU 60 Cb 0.48 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.86 1b6f n GLU 60 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1b6f n GLY 61 N 0.00 -0.05 7.00 8.31 0.00 -1.26 -4.78 105.19 114.41 1b6f n GLY 61 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1b6f n GLY 61 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1b6f n PHE 62 N -0.31 -0.95 0.02 1.61 7.35 -1.26 -3.97 117.46 119.95 1b6f n PHE 62 Ca 0.00 0.00 -0.19 0.00 -0.76 0.00 0.00 57.45 56.50 1b6f n PHE 62 Cb 0.03 0.04 -0.10 0.00 0.35 0.00 0.00 39.48 39.80 1b6f n PHE 62 CO 0.00 0.00 0.00 -1.00 -0.76 0.00 0.00 176.76 175.00 1b6f h PRO 63 N 0.00 0.64 -5.84 -7.13 0.13 -2.03 -3.43 132.00 114.35 1b6f h PRO 63 Ca 0.00 -0.67 -0.57 0.00 -0.87 0.00 0.00 66.00 63.89 1b6f h PRO 63 Cb 0.00 0.18 -0.07 0.00 0.13 0.00 0.00 31.00 31.24 1b6f h PRO 63 CO 0.00 1.26 -0.02 -0.06 -0.23 0.00 0.00 178.00 178.95 1b6f s PHE 64 N -3.34 3.52 0.00 1.56 0.08 -1.25 -4.83 117.98 113.71 1b6f s PHE 64 Ca -0.11 1.03 0.00 0.00 0.12 0.00 0.00 56.93 57.97 1b6f s PHE 64 Cb 0.06 -2.68 0.00 0.00 -0.57 0.00 0.00 43.02 39.83 1b6f s PHE 64 CO 0.89 0.09 0.00 0.36 -0.10 0.00 0.00 175.22 176.47 1b6f n LYS 65 N 3.89 0.00 -2.04 0.44 2.85 -1.26 -4.89 118.16 117.14 1b6f n LYS 65 Ca -0.04 0.00 -0.40 0.00 -1.05 0.00 0.00 58.31 56.81 1b6f n LYS 65 Cb 0.51 -0.07 -0.01 0.00 -0.65 0.00 0.00 35.03 34.81 1b6f n LYS 65 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 177.40 178.87 1b6f s TYR 66 N -1.63 2.90 0.25 5.58 1.13 -1.26 -4.22 117.35 120.10 1b6f s TYR 66 Ca 0.00 1.37 -0.03 0.00 -1.41 0.00 0.00 57.07 57.00 1b6f s TYR 66 Cb 0.00 -3.74 -0.02 0.00 -1.10 0.00 0.00 41.96 37.09 1b6f s TYR 66 CO 0.00 -2.13 0.29 0.14 -2.51 0.00 0.00 175.55 171.33 1b6f s VAL 67 N -1.17 0.00 -0.04 -3.49 -7.23 0.20 -3.98 120.40 104.68 1b6f s VAL 67 Ca 0.52 -1.79 0.05 0.00 -1.81 0.00 0.00 61.98 58.94 1b6f s VAL 67 Cb -0.41 -2.45 -0.02 0.00 0.56 0.00 0.00 36.38 34.07 1b6f s VAL 67 CO 0.54 0.00 -0.19 -0.75 -0.31 0.00 0.00 175.10 174.39 1b6f s LYS 68 N -3.88 2.43 -0.03 4.82 2.20 0.54 0.41 119.74 126.23 1b6f s LYS 68 Ca 0.34 -0.78 0.02 0.00 -0.36 0.00 0.00 55.97 55.19 1b6f s LYS 68 Cb 0.03 -2.27 0.01 0.00 -1.51 0.00 0.00 37.83 34.09 1b6f s LYS 68 CO 0.14 0.57 -0.07 0.16 -0.36 0.00 0.00 175.35 175.79 1b6f s ASP 69 N -0.61 1.08 0.06 1.43 -4.77 -0.67 -0.67 116.67 112.53 1b6f s ASP 69 Ca 0.09 -0.16 -0.07 0.00 -3.30 0.00 0.00 52.55 49.11 1b6f s ASP 69 Cb -0.11 -0.38 -0.05 0.00 -1.09 0.00 0.00 42.92 41.29 1b6f s ASP 69 CO 0.00 0.02 0.33 -0.60 0.70 0.00 0.00 175.17 175.62 1b6f s ARG 70 N 0.47 3.63 0.39 2.11 3.52 0.11 -2.45 118.95 126.73 1b6f s ARG 70 Ca -0.07 -0.03 -0.25 0.00 -0.13 0.00 0.00 55.73 55.25 1b6f s ARG 70 Cb -0.11 -3.00 -0.09 0.00 -1.56 0.00 0.00 34.95 30.20 1b6f s ARG 70 CO 0.01 0.58 1.08 0.08 -0.81 0.00 0.00 175.30 176.23 1b6f s VAL 71 N -1.43 3.56 0.00 7.11 1.01 0.11 0.27 120.40 131.03 1b6f s VAL 71 Ca 0.33 1.24 0.00 0.00 0.00 0.00 0.00 61.98 63.55 1b6f s VAL 71 Cb -0.13 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.58 1b6f s VAL 71 CO 0.19 0.06 0.00 -0.67 0.00 0.00 0.00 175.10 174.68 1b6f n ASP 72 N 0.04 0.00 -3.68 3.32 -0.08 0.57 -0.32 116.55 116.40 1b6f n ASP 72 Ca 0.04 0.14 -0.11 0.00 -1.51 0.00 0.00 54.79 53.35 1b6f n ASP 72 Cb 0.48 -0.47 -0.12 0.00 2.34 0.00 0.00 41.12 43.36 1b6f n ASP 72 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1b6f s GLU 73 N -0.94 0.25 0.09 -0.67 2.02 -1.08 -3.99 118.70 114.38 1b6f s GLU 73 Ca 0.00 0.77 0.07 0.00 0.02 0.00 0.00 54.97 55.83 1b6f s GLU 73 Cb 0.00 0.03 -0.04 0.00 0.10 0.00 0.00 34.13 34.22 1b6f s GLU 73 CO 0.00 -0.22 -0.10 0.08 0.02 0.00 0.00 175.26 175.04 1b6f s VAL 74 N 1.99 3.37 -0.31 2.63 1.01 -1.25 -1.48 120.40 126.37 1b6f s VAL 74 Ca -0.04 -1.22 0.01 0.00 0.00 0.00 0.00 61.98 60.73 1b6f s VAL 74 Cb -0.11 -2.56 0.15 0.00 0.00 0.00 0.00 36.38 33.86 1b6f s VAL 74 CO -0.10 0.14 0.35 -0.62 0.00 0.00 0.00 175.10 174.87 1b6f s ASP 75 N -2.12 1.13 0.00 3.32 -1.08 0.34 -4.87 116.67 113.39 1b6f s ASP 75 Ca 0.21 -0.83 0.07 0.00 -0.52 0.00 0.00 52.55 51.48 1b6f s ASP 75 Cb -0.11 0.72 0.30 0.00 -1.46 0.00 0.00 42.92 42.38 1b6f s ASP 75 CO 0.13 -0.35 1.14 1.57 0.52 0.00 0.00 175.17 178.18 1b6f n HIS 76 N 5.08 0.00 -0.08 -5.34 -0.00 -1.26 -1.55 115.22 112.06 1b6f n HIS 76 Ca 0.02 0.00 -0.15 0.00 -0.00 0.00 0.00 57.72 57.59 1b6f n HIS 76 Cb 0.47 -0.40 -0.06 0.00 -0.00 0.00 0.00 29.99 30.00 1b6f n HIS 76 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.34 178.75 1b6f n THR 77 N -1.40 0.89 1.27 3.57 -1.04 -1.26 -4.49 114.28 111.82 1b6f n THR 77 Ca 0.02 -0.27 0.02 0.00 -2.04 0.00 0.00 64.05 61.78 1b6f n THR 77 Cb 0.06 -1.46 0.06 0.00 -1.82 0.00 0.00 70.33 67.17 1b6f n THR 77 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1b6f n ASN 78 N -3.44 1.07 -3.97 8.00 4.05 -1.16 -4.88 115.26 114.93 1b6f n ASN 78 Ca -0.30 -2.06 -0.27 0.00 0.45 0.00 0.00 54.58 52.41 1b6f n ASN 78 Cb 0.75 -0.24 -0.02 0.00 1.23 0.00 0.00 39.78 41.49 1b6f n ASN 78 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 1b6f n PHE 79 N -0.05 -1.62 -4.02 1.20 3.72 -0.60 -4.74 117.46 111.35 1b6f n PHE 79 Ca 0.04 0.70 -0.31 0.00 -0.05 0.00 0.00 57.45 57.84 1b6f n PHE 79 Cb 0.21 -3.62 -0.16 0.00 -0.94 0.00 0.00 39.48 34.98 1b6f n PHE 79 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1b6f s LYS 80 N -6.61 2.25 -0.26 -1.08 2.20 -0.99 -1.88 119.74 113.37 1b6f s LYS 80 Ca 0.04 -0.74 -0.02 0.00 -0.36 0.00 0.00 55.97 54.89 1b6f s LYS 80 Cb -0.02 -2.32 0.09 0.00 -1.51 0.00 0.00 37.83 34.07 1b6f s LYS 80 CO 0.90 -0.33 0.08 -0.47 -0.36 0.00 0.00 175.35 175.17 1b6f s TYR 81 N 1.41 1.19 0.04 4.03 6.14 -0.59 0.13 117.35 129.70 1b6f s TYR 81 Ca 0.02 -1.25 0.08 0.00 0.64 0.00 0.00 57.07 56.56 1b6f s TYR 81 Cb -0.15 -1.30 -0.03 0.00 0.42 0.00 0.00 41.96 40.90 1b6f s TYR 81 CO -0.10 -0.77 -0.22 -0.80 0.64 0.00 0.00 175.55 174.30 1b6f s ASN 82 N 1.80 3.47 -0.07 4.32 0.01 -0.55 -1.57 114.94 122.35 1b6f s ASN 82 Ca 0.06 -0.50 -0.05 0.00 -0.71 0.00 0.00 52.86 51.65 1b6f s ASN 82 Cb -0.17 -0.45 0.03 0.00 0.41 0.00 0.00 41.25 41.07 1b6f s ASN 82 CO -0.21 0.26 0.17 -0.72 -1.51 0.00 0.00 177.10 175.09 1b6f s TYR 83 N -0.85 -0.20 0.50 2.20 -0.85 -0.37 0.21 117.35 117.99 1b6f s TYR 83 Ca 0.13 0.50 0.05 0.00 -0.52 0.00 0.00 57.07 57.23 1b6f s TYR 83 Cb -0.10 0.03 0.03 0.00 0.38 0.00 0.00 41.96 42.30 1b6f s TYR 83 CO 0.03 -0.13 0.70 -1.12 -1.52 0.00 0.00 175.55 173.51 1b6f s SER 84 N 0.51 5.38 -0.19 -0.18 0.01 0.77 -1.34 113.70 118.66 1b6f s SER 84 Ca -0.03 -0.28 -0.05 0.00 1.31 0.00 0.00 55.95 56.90 1b6f s SER 84 Cb -0.05 -0.64 -0.02 0.00 0.21 0.00 0.00 66.02 65.52 1b6f s SER 84 CO -0.02 -1.03 -0.01 -0.69 0.41 0.00 0.00 173.24 171.90 1b6f s VAL 85 N -2.59 3.88 0.00 3.43 1.01 0.22 0.09 120.40 126.44 1b6f s VAL 85 Ca 0.57 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 62.21 1b6f s VAL 85 Cb -0.10 -2.75 0.00 0.00 0.00 0.00 0.00 36.38 33.54 1b6f s VAL 85 CO 0.36 0.44 0.00 2.30 0.00 0.00 0.00 175.10 178.20 1b6f n ILE 86 N 4.18 0.00 -2.90 2.22 -5.35 0.15 -3.91 119.36 113.74 1b6f n ILE 86 Ca -0.17 0.08 -0.43 0.00 -0.27 0.00 0.00 62.75 61.95 1b6f n ILE 86 Cb 0.52 -1.07 -0.04 0.00 -1.74 0.00 0.00 39.64 37.31 1b6f n ILE 86 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1b6f s GLU 87 N -0.98 3.16 0.14 6.28 2.12 -1.11 -4.73 118.70 123.58 1b6f s GLU 87 Ca 0.00 -1.01 0.09 0.00 0.36 0.00 0.00 54.97 54.41 1b6f s GLU 87 Cb 0.00 -4.32 -0.04 0.00 0.26 0.00 0.00 34.13 30.03 1b6f s GLU 87 CO 0.00 -1.78 -0.17 0.20 -0.54 0.00 0.00 175.26 172.97 1b6f s GLY 88 N 3.68 1.70 0.16 -1.50 0.00 -1.26 0.20 107.32 110.30 1b6f s GLY 88 Ca 0.22 -1.43 -0.27 0.00 0.00 0.00 0.00 44.72 43.23 1b6f s GLY 88 CO 0.07 -1.43 1.56 -1.33 0.00 0.00 0.00 173.10 171.97 1b6f h GLY 89 N 3.46 -0.60 0.51 0.20 0.00 -1.90 -2.41 103.07 102.32 1b6f h GLY 89 Ca -0.49 0.63 -0.05 0.00 0.00 0.00 0.00 47.33 47.42 1b6f h GLY 89 CO 0.48 -0.12 -0.20 -0.56 0.00 0.00 0.00 176.54 176.14 1b6f h PRO 90 N -0.21 0.18 -6.94 4.80 0.13 -1.95 -3.45 132.00 124.56 1b6f h PRO 90 Ca 0.17 -0.16 -0.54 0.00 -0.87 0.00 0.00 66.00 64.60 1b6f h PRO 90 Cb 0.55 0.04 0.20 0.00 0.13 0.00 0.00 31.00 31.91 1b6f h PRO 90 CO -0.73 0.83 -0.18 -0.89 -0.23 0.00 0.00 178.00 176.80 1b6f n ILE 91 N -4.56 0.86 0.00 -3.56 5.41 -0.91 -4.98 119.36 111.62 1b6f n ILE 91 Ca -0.09 -0.20 0.00 0.00 1.00 0.00 0.00 62.75 63.46 1b6f n ILE 91 Cb 0.45 -0.85 0.00 0.00 -0.71 0.00 0.00 39.64 38.53 1b6f n ILE 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1b6f n GLY 92 N 1.09 0.04 0.64 7.39 0.00 -1.26 -4.31 105.19 108.77 1b6f n GLY 92 Ca 0.10 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.07 1b6f n GLY 92 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1b6f n ASP 93 N -2.27 1.37 -0.28 1.61 2.03 -1.26 -4.89 116.55 112.85 1b6f n ASP 93 Ca 0.00 0.21 0.00 0.00 0.52 0.00 0.00 54.79 55.52 1b6f n ASP 93 Cb 0.00 -0.49 0.00 0.00 -0.72 0.00 0.00 41.12 39.91 1b6f n ASP 93 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 1b6f n THR 94 N -3.85 0.00 -3.43 5.18 5.66 -1.26 -4.96 114.28 111.62 1b6f n THR 94 Ca -0.09 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.58 1b6f n THR 94 Cb 0.30 0.28 -0.05 0.00 -1.55 0.00 0.00 70.33 69.30 1b6f n THR 94 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1b6f s LEU 95 N 0.00 4.25 -1.68 1.09 1.43 -1.26 -4.04 118.68 118.46 1b6f s LEU 95 Ca 0.00 0.94 -0.01 0.00 -1.03 0.00 0.00 54.13 54.02 1b6f s LEU 95 Cb 0.00 -3.45 0.00 0.00 0.03 0.00 0.00 46.19 42.77 1b6f s LEU 95 CO 0.00 0.02 0.18 -0.62 0.23 0.00 0.00 176.35 176.15 1b6f n GLU 96 N 0.29 -2.63 -2.17 1.70 1.02 0.42 -4.47 120.64 114.80 1b6f n GLU 96 Ca -0.02 0.96 -0.34 0.00 -0.02 0.00 0.00 57.16 57.73 1b6f n GLU 96 Cb 0.52 -5.68 0.01 0.00 -0.02 0.00 0.00 31.44 26.27 1b6f n GLU 96 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1b6f s LYS 97 N -5.24 3.28 -0.04 3.49 1.02 0.19 -4.59 119.74 117.85 1b6f s LYS 97 Ca 0.09 1.51 0.04 0.00 0.02 0.00 0.00 55.97 57.63 1b6f s LYS 97 Cb -0.04 -2.00 0.00 0.00 -0.52 0.00 0.00 37.83 35.27 1b6f s LYS 97 CO 0.11 -0.89 -0.15 0.42 -0.92 0.00 0.00 175.35 173.92 1b6f s ILE 98 N -1.95 1.27 -0.32 2.17 1.09 -1.25 0.22 121.20 122.42 1b6f s ILE 98 Ca 0.70 -0.61 -0.00 0.00 -1.10 0.00 0.00 60.65 59.64 1b6f s ILE 98 Cb -0.22 -1.11 0.07 0.00 -1.06 0.00 0.00 42.46 40.15 1b6f s ILE 98 CO 0.30 0.37 0.03 -0.55 -0.10 0.00 0.00 174.94 174.99 1b6f s SER 99 N 0.18 4.86 0.15 3.58 0.15 0.85 0.69 113.70 124.16 1b6f s SER 99 Ca -0.06 -1.60 -0.05 0.00 0.70 0.00 0.00 55.95 54.94 1b6f s SER 99 Cb -0.12 -1.69 -0.06 0.00 -1.71 0.00 0.00 66.02 62.44 1b6f s SER 99 CO 0.02 -0.33 0.39 0.20 1.20 0.00 0.00 173.24 174.73 1b6f s ASN 100 N 1.28 6.50 -0.03 5.45 -0.87 -0.45 -1.08 114.94 125.74 1b6f s ASN 100 Ca -0.00 0.61 -0.04 0.00 -1.57 0.00 0.00 52.86 51.86 1b6f s ASN 100 Cb -0.20 -2.10 0.01 0.00 -0.02 0.00 0.00 41.25 38.93 1b6f s ASN 100 CO -0.04 0.04 0.11 -1.61 -2.57 0.00 0.00 177.10 173.03 1b6f s GLU 101 N -2.70 0.19 -0.06 -0.60 8.01 0.12 -1.24 118.70 122.43 1b6f s GLU 101 Ca 0.42 0.03 -0.02 0.00 0.01 0.00 0.00 54.97 55.40 1b6f s GLU 101 Cb -0.12 0.09 0.03 0.00 -4.31 0.00 0.00 34.13 29.82 1b6f s GLU 101 CO 0.24 -0.03 0.05 0.42 0.01 0.00 0.00 175.26 175.95 1b6f s ILE 102 N -0.24 0.04 -0.17 -1.63 1.01 -0.61 0.30 121.20 119.90 1b6f s ILE 102 Ca -0.03 0.28 0.00 0.00 0.00 0.00 0.00 60.65 60.90 1b6f s ILE 102 Cb -0.02 -0.31 0.01 0.00 0.01 0.00 0.00 42.46 42.15 1b6f s ILE 102 CO 0.00 0.16 -0.17 -0.75 0.00 0.00 0.00 174.94 174.18 1b6f s LYS 103 N 2.10 3.09 -0.25 2.79 2.20 -0.14 -1.54 119.74 128.00 1b6f s LYS 103 Ca 0.05 -0.79 -0.06 0.00 -0.36 0.00 0.00 55.97 54.81 1b6f s LYS 103 Cb -0.12 -2.62 -0.01 0.00 -1.51 0.00 0.00 37.83 33.56 1b6f s LYS 103 CO -0.04 -0.13 0.03 0.42 -0.36 0.00 0.00 175.35 175.26 1b6f s ILE 104 N 1.15 3.88 0.15 5.43 1.01 -0.79 -1.35 121.20 130.67 1b6f s ILE 104 Ca 0.01 -0.40 0.10 0.00 0.00 0.00 0.00 60.65 60.35 1b6f s ILE 104 Cb -0.14 -2.84 -0.04 0.00 0.01 0.00 0.00 42.46 39.45 1b6f s ILE 104 CO -0.07 0.32 -0.22 -0.69 0.00 0.00 0.00 174.94 174.27 1b6f s VAL 105 N 1.54 2.00 0.59 2.92 1.01 -0.94 -4.62 120.40 122.90 1b6f s VAL 105 Ca 0.05 -1.82 -0.04 0.00 0.00 0.00 0.00 61.98 60.18 1b6f s VAL 105 Cb -0.15 -1.86 0.02 0.00 0.00 0.00 0.00 36.38 34.39 1b6f s VAL 105 CO 0.01 -0.12 0.87 0.00 0.00 0.00 0.00 175.10 175.86 1b6f s ALA 106 N -1.53 3.41 0.37 5.51 0.00 -1.26 0.15 121.76 128.41 1b6f s ALA 106 Ca 0.14 -0.87 0.08 0.00 0.00 0.00 0.00 51.96 51.31 1b6f s ALA 106 Cb -0.08 -2.47 -0.06 0.00 0.00 0.00 0.00 23.12 20.51 1b6f s ALA 106 CO 0.07 -0.83 0.05 0.95 0.00 0.00 0.00 175.76 176.00 1b6f s THR 107 N -2.95 2.40 -1.79 0.00 -4.23 0.55 -4.58 115.64 105.03 1b6f s THR 107 Ca 0.55 -1.92 0.18 0.00 -1.18 0.00 0.00 61.69 59.32 1b6f s THR 107 Cb -0.10 -2.88 0.45 0.00 1.34 0.00 0.00 72.50 71.30 1b6f s THR 107 CO 0.43 -0.11 1.51 -0.81 -0.54 0.00 0.00 174.62 175.10 1b6f n PRO 108 N -1.02 0.46 -0.00 3.99 -0.04 -1.26 -2.26 135.00 134.87 1b6f n PRO 108 Ca -0.04 0.04 0.09 0.00 -0.04 0.00 0.00 63.50 63.56 1b6f n PRO 108 Cb 0.64 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.49 1b6f n PRO 108 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1b6f n ASP 109 N -1.10 0.87 0.00 3.54 8.00 -1.26 -4.98 116.55 121.62 1b6f n ASP 109 Ca 0.12 -0.92 0.00 0.00 0.71 0.00 0.00 54.79 54.70 1b6f n ASP 109 Cb 0.09 1.02 0.00 0.00 -0.02 0.00 0.00 41.12 42.22 1b6f n ASP 109 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1b6f n GLY 110 N 1.44 1.96 0.00 0.44 0.00 -0.96 -5.08 105.19 102.99 1b6f n GLY 110 Ca 0.03 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.41 1b6f n GLY 110 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b6f n GLY 111 N 0.00 -1.38 3.16 -0.02 0.00 -1.26 -4.49 105.19 101.20 1b6f n GLY 111 Ca 0.00 -1.60 -0.09 0.00 0.00 0.00 0.00 46.02 44.33 1b6f n GLY 111 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b6f s SER 112 N -1.14 0.32 -0.18 1.61 1.04 0.22 0.20 113.70 115.77 1b6f s SER 112 Ca 0.00 -1.09 -0.03 0.00 0.48 0.00 0.00 55.95 55.32 1b6f s SER 112 Cb 0.00 0.29 -0.01 0.00 0.10 0.00 0.00 66.02 66.40 1b6f s SER 112 CO 0.00 -0.71 -0.07 -0.63 0.98 0.00 0.00 173.24 172.81 1b6f s ILE 113 N -4.00 3.33 -0.15 -1.02 1.01 0.41 -0.90 121.20 119.89 1b6f s ILE 113 Ca 0.18 -0.53 -0.14 0.00 0.00 0.00 0.00 60.65 60.15 1b6f s ILE 113 Cb 0.07 -2.47 -0.05 0.00 0.01 0.00 0.00 42.46 40.02 1b6f s ILE 113 CO -0.02 0.47 0.33 -0.22 0.00 0.00 0.00 174.94 175.49 1b6f s LEU 114 N 0.98 4.26 -0.21 2.97 2.96 0.27 -2.22 118.68 127.69 1b6f s LEU 114 Ca -0.01 0.58 0.02 0.00 -0.22 0.00 0.00 54.13 54.50 1b6f s LEU 114 Cb -0.15 -2.43 0.04 0.00 0.50 0.00 0.00 46.19 44.15 1b6f s LEU 114 CO -0.00 0.10 -0.14 -0.54 -1.32 0.00 0.00 176.35 174.45 1b6f s LYS 115 N 0.41 2.44 -0.19 1.98 1.02 -0.46 0.32 119.74 125.27 1b6f s LYS 115 Ca 0.18 -1.02 -0.06 0.00 0.02 0.00 0.00 55.97 55.09 1b6f s LYS 115 Cb -0.13 -2.64 -0.04 0.00 -0.52 0.00 0.00 37.83 34.50 1b6f s LYS 115 CO 0.05 -0.40 0.04 0.42 -0.92 0.00 0.00 175.35 174.54 1b6f s ILE 116 N 1.25 4.46 -0.32 2.17 1.01 0.18 -0.96 121.20 128.99 1b6f s ILE 116 Ca -0.02 -0.15 -0.05 0.00 0.00 0.00 0.00 60.65 60.44 1b6f s ILE 116 Cb -0.16 -3.01 0.04 0.00 0.01 0.00 0.00 42.46 39.34 1b6f s ILE 116 CO -0.09 0.45 0.06 -0.44 0.00 0.00 0.00 174.94 174.92 1b6f s SER 117 N 0.57 5.12 -0.13 3.58 0.01 0.15 0.82 113.70 123.82 1b6f s SER 117 Ca 0.01 -1.16 -0.05 0.00 1.31 0.00 0.00 55.95 56.07 1b6f s SER 117 Cb -0.13 -1.81 -0.04 0.00 0.21 0.00 0.00 66.02 64.25 1b6f s SER 117 CO 0.02 -0.29 0.04 0.21 0.41 0.00 0.00 173.24 173.63 1b6f s ASN 118 N 1.35 5.55 -0.02 2.44 2.47 -1.25 0.13 114.94 125.60 1b6f s ASN 118 Ca -0.03 0.16 0.02 0.00 0.42 0.00 0.00 52.86 53.44 1b6f s ASN 118 Cb -0.19 -1.77 0.00 0.00 -1.45 0.00 0.00 41.25 37.84 1b6f s ASN 118 CO 0.01 0.30 -0.08 -0.54 -3.72 0.00 0.00 177.10 173.07 1b6f s LYS 119 N -0.40 0.78 0.02 0.43 1.02 -0.24 -1.20 119.74 120.14 1b6f s LYS 119 Ca 0.09 -0.27 0.04 0.00 0.02 0.00 0.00 55.97 55.85 1b6f s LYS 119 Cb -0.12 -0.74 -0.03 0.00 -0.52 0.00 0.00 37.83 36.41 1b6f s LYS 119 CO 0.02 0.12 -0.10 0.71 -0.92 0.00 0.00 175.35 175.18 1b6f s TYR 120 N 0.07 2.80 -0.26 3.18 2.02 -0.97 -0.11 117.35 124.08 1b6f s TYR 120 Ca -0.01 -0.10 0.01 0.00 -0.37 0.00 0.00 57.07 56.60 1b6f s TYR 120 Cb -0.06 -1.56 0.07 0.00 -0.40 0.00 0.00 41.96 40.01 1b6f s TYR 120 CO 0.00 0.34 0.00 -1.01 -1.57 0.00 0.00 175.55 173.32 1b6f s HIS 121 N -0.99 2.30 0.35 2.71 3.76 0.60 0.36 115.29 124.38 1b6f s HIS 121 Ca 0.17 -1.84 0.08 0.00 -0.15 0.00 0.00 55.06 53.32 1b6f s HIS 121 Cb -0.11 -1.75 -0.07 0.00 1.11 0.00 0.00 32.58 31.77 1b6f s HIS 121 CO 0.07 -0.81 -0.05 0.95 -0.85 0.00 0.00 174.74 174.06 1b6f s THR 122 N 1.42 1.99 0.36 1.30 -4.23 -1.26 0.16 115.64 115.39 1b6f s THR 122 Ca 0.01 -2.12 -0.11 0.00 -1.18 0.00 0.00 61.69 58.28 1b6f s THR 122 Cb -0.18 -2.71 -0.07 0.00 1.34 0.00 0.00 72.50 70.87 1b6f s THR 122 CO -0.11 -0.15 0.73 -0.75 -0.54 0.00 0.00 174.62 173.80 1b6f s LYS 123 N -3.68 3.83 0.60 3.99 2.47 -1.26 -4.32 119.74 121.37 1b6f s LYS 123 Ca 0.33 0.47 0.28 0.00 -1.56 0.00 0.00 55.97 55.49 1b6f s LYS 123 Cb 0.05 -2.44 1.28 0.00 -1.46 0.00 0.00 37.83 35.26 1b6f s LYS 123 CO 0.16 0.06 1.67 0.78 0.16 0.00 0.00 175.35 178.19 1b6f h GLY 124 N 1.65 0.00 0.00 5.54 0.00 -2.01 -0.68 103.07 107.58 1b6f h GLY 124 Ca -0.47 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 46.70 1b6f h GLY 124 CO 0.65 0.00 -0.87 -1.80 0.00 0.00 0.00 176.54 174.52 1b6f h ASP 125 N 0.00 0.00 -4.05 0.19 3.58 -2.02 -3.47 116.42 110.64 1b6f h ASP 125 Ca 0.31 -0.59 -0.45 0.00 0.42 0.00 0.00 57.03 56.73 1b6f h ASP 125 Cb 1.82 0.00 0.16 0.00 1.72 0.00 0.00 39.33 43.03 1b6f h ASP 125 CO -0.00 1.30 0.39 -1.00 -2.88 0.00 0.00 179.24 177.05 1b6f s HIS 126 N -2.30 1.68 0.16 0.28 3.76 -0.26 -5.09 115.29 113.52 1b6f s HIS 126 Ca -0.25 0.41 -0.23 0.00 -0.15 0.00 0.00 55.06 54.84 1b6f s HIS 126 Cb 0.03 -3.94 0.07 0.00 1.11 0.00 0.00 32.58 29.85 1b6f s HIS 126 CO 0.58 -2.67 0.61 -1.83 -0.85 0.00 0.00 174.74 170.58 1b6f s GLU 127 N -5.78 1.29 -0.54 1.40 -1.05 -1.26 -4.19 118.70 108.58 1b6f s GLU 127 Ca 0.72 -0.49 -0.02 0.00 -0.15 0.00 0.00 54.97 55.03 1b6f s GLU 127 Cb -0.06 0.59 0.14 0.00 -0.44 0.00 0.00 34.13 34.36 1b6f s GLU 127 CO 0.53 -0.57 0.34 0.54 0.95 0.00 0.00 175.26 177.05 1b6f s VAL 128 N -3.75 3.39 0.49 1.83 0.11 -1.26 -5.04 120.40 116.17 1b6f s VAL 128 Ca 0.01 -2.73 -0.21 0.00 -2.93 0.00 0.00 61.98 56.12 1b6f s VAL 128 Cb -0.01 -3.27 -0.09 0.00 -1.53 0.00 0.00 36.38 31.48 1b6f s VAL 128 CO -0.12 -0.80 0.79 0.29 -3.33 0.00 0.00 175.10 171.93 1b6f n LYS 129 N 3.78 0.91 0.09 1.54 4.01 -1.26 -4.78 118.16 122.44 1b6f n LYS 129 Ca 0.05 0.33 0.07 0.00 -0.51 0.00 0.00 58.31 58.25 1b6f n LYS 129 Cb 0.38 -1.87 0.35 0.00 -0.51 0.00 0.00 35.03 33.38 1b6f n LYS 129 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1b6f n ALA 130 N -1.07 1.18 -0.00 7.82 0.00 -1.26 -3.48 120.51 123.70 1b6f n ALA 130 Ca 0.11 0.09 -0.00 0.00 0.00 0.00 0.00 53.44 53.64 1b6f n ALA 130 Cb 0.43 -1.21 -0.00 0.00 0.00 0.00 0.00 19.45 18.66 1b6f n ALA 130 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1b6f h GLU 131 N 0.00 -0.00 -0.39 0.00 5.08 -1.99 1.51 114.58 118.79 1b6f h GLU 131 Ca 0.00 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.47 1b6f h GLU 131 Cb 0.08 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1b6f h GLU 131 CO 0.00 -0.00 0.35 0.37 -1.00 0.00 0.00 179.01 178.72 1b6f h GLN 132 N -0.00 0.00 -0.08 2.33 4.15 -1.93 0.10 115.11 119.67 1b6f h GLN 132 Ca 0.00 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.37 1b6f h GLN 132 Cb 0.00 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.69 1b6f h GLN 132 CO -0.00 0.00 -0.14 0.28 -1.93 0.00 0.00 178.83 177.03 1b6f h VAL 133 N 0.00 1.40 -0.09 2.39 2.07 -0.78 -0.89 116.25 120.35 1b6f h VAL 133 Ca 0.19 -1.41 -0.09 0.00 0.82 0.00 0.00 66.70 66.21 1b6f h VAL 133 Cb 0.88 2.13 -0.01 0.00 -1.52 0.00 0.00 31.29 32.76 1b6f h VAL 133 CO -0.00 0.40 -0.35 0.50 0.02 0.00 0.00 177.57 178.14 1b6f h LYS 134 N -0.21 0.19 -0.13 1.57 3.64 0.35 -2.33 116.57 119.64 1b6f h LYS 134 Ca 0.01 -0.07 -0.22 0.00 -1.27 0.00 0.00 60.65 59.09 1b6f h LYS 134 Cb 0.71 -0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.53 1b6f h LYS 134 CO 0.03 0.52 -0.80 0.00 -2.27 0.00 0.00 179.45 176.93 1b6f h ALA 135 N 1.48 0.34 0.00 5.00 0.00 -1.01 -2.85 119.26 122.23 1b6f h ALA 135 Ca 0.02 -0.61 -0.06 0.00 0.00 0.00 0.00 54.91 54.26 1b6f h ALA 135 Cb 0.70 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1b6f h ALA 135 CO 0.05 0.70 -0.27 1.03 0.00 0.00 0.00 179.25 180.77 1b6f h SER 136 N 0.48 0.00 -0.14 0.00 0.87 -0.96 -2.50 113.55 111.30 1b6f h SER 136 Ca -0.06 0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 60.33 1b6f h SER 136 Cb 1.42 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 63.39 1b6f h SER 136 CO 0.16 0.27 -0.58 0.50 -0.53 0.00 0.00 176.83 176.64 1b6f h LYS 137 N 0.00 0.64 -0.43 2.24 3.64 -1.32 -0.22 116.57 121.13 1b6f h LYS 137 Ca -0.00 -0.50 -0.03 0.00 -1.27 0.00 0.00 60.65 58.84 1b6f h LYS 137 Cb 0.57 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.47 1b6f h LYS 137 CO 0.03 1.12 0.15 1.49 -2.27 0.00 0.00 179.45 179.97 1b6f h GLU 138 N 0.31 0.67 -0.09 1.90 4.81 -1.28 -2.70 114.58 118.20 1b6f h GLU 138 Ca -0.03 -0.14 -0.14 0.00 -0.13 0.00 0.00 59.36 58.92 1b6f h GLU 138 Cb 1.22 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.48 1b6f h GLU 138 CO 0.12 0.64 -0.56 -0.07 -0.73 0.00 0.00 179.01 178.41 1b6f h LEU 139 N 0.56 0.31 0.20 1.64 3.38 -1.48 -3.07 115.31 116.85 1b6f h LEU 139 Ca 0.14 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 57.95 1b6f h LEU 139 Cb 0.24 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1b6f h LEU 139 CO -0.01 0.81 -0.31 1.23 0.09 0.00 0.00 178.44 180.25 1b6f h GLY 140 N 1.37 -0.64 0.49 0.83 0.00 -0.72 -0.73 103.07 103.68 1b6f h GLY 140 Ca 0.00 0.36 0.08 0.00 0.00 0.00 0.00 47.33 47.77 1b6f h GLY 140 CO 0.09 -0.25 0.29 -2.09 0.00 0.00 0.00 176.54 174.58 1b6f h GLU 141 N -0.58 0.50 -0.47 4.80 4.22 -1.50 0.71 114.58 122.26 1b6f h GLU 141 Ca 0.01 -0.03 0.07 0.00 0.08 0.00 0.00 59.36 59.49 1b6f h GLU 141 Cb 0.57 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 1b6f h GLU 141 CO -0.13 0.33 0.32 1.15 -2.18 0.00 0.00 179.01 178.50 1b6f h THR 142 N 0.51 0.93 0.17 0.32 2.02 -1.29 0.93 112.91 116.51 1b6f h THR 142 Ca 0.31 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.37 1b6f h THR 142 Cb 0.32 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 67.31 1b6f h THR 142 CO -0.26 0.06 -0.08 -0.07 0.37 0.00 0.00 175.52 175.54 1b6f h LEU 143 N 0.33 -0.20 -1.10 2.58 3.38 0.60 0.40 115.31 121.30 1b6f h LEU 143 Ca 0.21 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 1b6f h LEU 143 Cb 0.40 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1b6f h LEU 143 CO -0.05 0.27 -0.14 0.17 0.09 0.00 0.00 178.44 178.78 1b6f h LEU 144 N -0.73 0.00 0.03 1.67 8.10 -0.97 -2.55 115.31 120.86 1b6f h LEU 144 Ca -0.02 0.00 -0.25 0.00 0.11 0.00 0.00 57.88 57.71 1b6f h LEU 144 Cb 0.51 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 40.70 1b6f h LEU 144 CO 0.04 0.14 -1.28 -0.09 -4.11 0.00 0.00 178.44 173.14 1b6f h ARG 145 N 0.00 0.07 -0.25 0.17 2.43 0.95 -2.69 114.38 115.06 1b6f h ARG 145 Ca -0.00 -0.11 -0.19 0.00 -0.81 0.00 0.00 59.98 58.87 1b6f h ARG 145 Cb 0.71 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 1b6f h ARG 145 CO 0.02 0.92 -0.58 0.00 -1.51 0.00 0.00 179.97 178.81 1b6f h ALA 146 N 0.88 0.50 -0.22 2.80 0.00 0.02 -1.40 119.26 121.82 1b6f h ALA 146 Ca -0.13 -0.53 -0.09 0.00 0.00 0.00 0.00 54.91 54.16 1b6f h ALA 146 Cb 1.89 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.60 1b6f h ALA 146 CO 0.13 0.69 -0.22 0.28 0.00 0.00 0.00 179.25 180.12 1b6f h VAL 147 N 0.60 1.32 -0.17 0.00 2.07 -1.55 -0.52 116.25 118.00 1b6f h VAL 147 Ca 0.00 -1.39 -0.01 0.00 0.82 0.00 0.00 66.70 66.13 1b6f h VAL 147 Cb 1.18 1.72 -0.01 0.00 -1.52 0.00 0.00 31.29 32.67 1b6f h VAL 147 CO 0.12 0.43 0.08 -0.08 0.02 0.00 0.00 177.57 178.14 1b6f h GLU 148 N 0.23 0.25 0.00 1.57 4.22 -1.48 -1.27 114.58 118.10 1b6f h GLU 148 Ca 0.03 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1b6f h GLU 148 Cb 0.77 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.98 1b6f h GLU 148 CO 0.06 0.29 0.00 1.03 -2.18 0.00 0.00 179.01 178.21 1b6f h SER 149 N 0.15 0.00 0.58 1.04 0.87 -1.25 -2.65 113.55 112.29 1b6f h SER 149 Ca 0.06 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 60.34 1b6f h SER 149 Cb 0.13 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.08 1b6f h SER 149 CO -0.01 0.00 -1.39 0.22 -0.53 0.00 0.00 176.83 175.12 1b6f h TYR 150 N 0.00 0.35 0.19 2.24 3.20 -0.17 -3.22 116.97 119.57 1b6f h TYR 150 Ca 0.00 -0.26 -0.01 0.00 3.14 0.00 0.00 58.73 61.60 1b6f h TYR 150 Cb 0.37 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.63 1b6f h TYR 150 CO 0.00 1.27 -0.09 -0.07 -1.64 0.00 0.00 178.16 177.62 1b6f h LEU 151 N 0.05 -0.22 -1.96 2.82 3.38 -0.93 -3.21 115.31 115.24 1b6f h LEU 151 Ca -0.18 -0.26 0.27 0.00 0.09 0.00 0.00 57.88 57.80 1b6f h LEU 151 Cb 1.97 0.06 -0.04 0.00 0.09 0.00 0.00 40.66 42.73 1b6f h LEU 151 CO 0.16 0.32 0.68 0.25 0.09 0.00 0.00 178.44 179.95 1b6f h LEU 152 N -0.95 0.03 0.00 1.67 6.46 -1.66 0.87 115.31 121.73 1b6f h LEU 152 Ca -0.03 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.74 1b6f h LEU 152 Cb 0.46 -0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.39 1b6f h LEU 152 CO 0.04 0.01 0.00 0.00 -0.62 0.00 0.00 178.44 177.87 1b6f n ALA 153 N -2.71 1.81 -3.49 1.25 0.00 -1.21 -4.29 120.51 111.86 1b6f n ALA 153 Ca 0.20 -0.06 -0.42 0.00 0.00 0.00 0.00 53.44 53.15 1b6f n ALA 153 Cb 1.00 -1.27 -0.06 0.00 0.00 0.00 0.00 19.45 19.13 1b6f n ALA 153 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1b6f s HIS 154 N -2.87 3.57 -0.02 0.00 2.46 0.30 -4.81 115.29 113.93 1b6f s HIS 154 Ca 0.10 -2.19 0.24 0.00 0.47 0.00 0.00 55.06 53.68 1b6f s HIS 154 Cb 0.11 -3.56 0.42 0.00 -0.13 0.00 0.00 32.58 29.41 1b6f s HIS 154 CO 0.29 -0.94 1.17 -1.13 -2.47 0.00 0.00 174.74 171.66 1b6f n SER 155 N 4.00 1.03 -0.06 9.88 3.41 -1.26 -4.82 113.62 125.80 1b6f n SER 155 Ca 0.07 -2.17 -0.06 0.00 -0.26 0.00 0.00 58.87 56.46 1b6f n SER 155 Cb 0.43 -0.32 -0.08 0.00 -0.26 0.00 0.00 64.21 63.98 1b6f n SER 155 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1b6f n ASP 156 N 0.34 2.41 -0.15 4.04 -0.08 -1.26 -5.09 116.55 116.77 1b6f n ASP 156 Ca 0.07 -0.01 0.00 0.00 -1.51 0.00 0.00 54.79 53.34 1b6f n ASP 156 Cb 1.10 0.64 0.00 0.00 2.34 0.00 0.00 41.12 45.19 1b6f n ASP 156 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1b6f n ALA 157 N -2.47 0.00 0.40 -1.67 0.00 -1.26 -3.25 120.51 112.26 1b6f n ALA 157 Ca -0.19 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.38 1b6f n ALA 157 Cb 0.84 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.62 1b6f n ALA 157 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1b6f h TYR 158 N 0.00 0.00 0.00 0.00 3.20 -2.04 -3.55 116.97 114.58 1b6f h TYR 158 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1b6f h TYR 158 Cb 0.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.27 1b6f h TYR 158 CO 0.00 0.00 0.00 -1.71 -1.64 0.00 0.00 178.16 174.81