#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yem s GLU 2 N 0.00 2.92 -0.08 4.33 2.12 0.32 0.06 118.70 128.37 1yem s GLU 2 Ca 0.00 -0.84 0.01 0.00 0.36 0.00 0.00 54.97 54.50 1yem s GLU 2 Cb 0.00 -2.22 -0.02 0.00 0.26 0.00 0.00 34.13 32.14 1yem s GLU 2 CO 0.00 0.18 -0.10 0.08 -0.54 0.00 0.00 175.26 174.87 1yem s VAL 3 N 0.35 3.36 -0.18 3.70 1.01 0.25 -1.01 120.40 127.88 1yem s VAL 3 Ca -0.18 -0.59 -0.09 0.00 0.00 0.00 0.00 61.98 61.12 1yem s VAL 3 Cb -0.18 -2.38 0.06 0.00 0.00 0.00 0.00 36.38 33.89 1yem s VAL 3 CO 0.08 0.57 0.42 -0.70 0.00 0.00 0.00 175.10 175.47 1yem s GLU 4 N -0.40 0.39 -0.05 2.72 2.12 0.93 -0.87 118.70 123.54 1yem s GLU 4 Ca 0.05 0.84 0.06 0.00 0.36 0.00 0.00 54.97 56.28 1yem s GLU 4 Cb -0.12 0.03 -0.01 0.00 0.26 0.00 0.00 34.13 34.28 1yem s GLU 4 CO 0.02 -0.17 -0.24 0.42 -0.54 0.00 0.00 175.26 174.76 1yem s ILE 5 N 1.57 1.93 -0.08 -3.70 1.01 -0.23 -4.31 121.20 117.39 1yem s ILE 5 Ca -0.09 -1.00 -0.01 0.00 0.00 0.00 0.00 60.65 59.55 1yem s ILE 5 Cb -0.09 -1.64 -0.03 0.00 0.01 0.00 0.00 42.46 40.72 1yem s ILE 5 CO -0.13 0.54 -0.03 -0.75 0.00 0.00 0.00 174.94 174.57 1yem s LYS 6 N -0.16 2.94 0.00 2.79 2.20 -1.26 -1.21 119.74 125.05 1yem s LYS 6 Ca -0.03 -0.48 0.04 0.00 -0.36 0.00 0.00 55.97 55.14 1yem s LYS 6 Cb -0.13 -2.71 -0.01 0.00 -1.51 0.00 0.00 37.83 33.47 1yem s LYS 6 CO 0.03 0.64 -0.11 -0.06 -0.36 0.00 0.00 175.35 175.49 1yem s PHE 7 N -0.73 1.02 0.32 4.03 0.40 0.03 -0.32 117.98 122.74 1yem s PHE 7 Ca 0.11 -0.24 -0.28 0.00 -0.60 0.00 0.00 56.93 55.92 1yem s PHE 7 Cb -0.11 -0.64 -0.09 0.00 0.51 0.00 0.00 43.02 42.68 1yem s PHE 7 CO 0.02 -0.01 1.13 0.15 0.70 0.00 0.00 175.22 177.21 1yem s LYS 8 N -0.52 4.44 0.24 0.44 1.02 0.77 -0.98 119.74 125.15 1yem s LYS 8 Ca 0.03 1.83 -0.06 0.00 0.02 0.00 0.00 55.97 57.79 1yem s LYS 8 Cb -0.05 -3.00 -0.02 0.00 -0.52 0.00 0.00 37.83 34.23 1yem s LYS 8 CO 0.00 0.02 0.31 0.96 -0.92 0.00 0.00 175.35 175.72 1yem s ILE 9 N -1.27 0.00 -0.18 2.17 -4.36 -0.97 -4.86 121.20 111.73 1yem s ILE 9 Ca 0.49 -1.72 -0.06 0.00 -0.26 0.00 0.00 60.65 59.10 1yem s ILE 9 Cb -0.31 -2.39 -0.03 0.00 1.25 0.00 0.00 42.46 40.97 1yem s ILE 9 CO 0.40 0.00 0.03 -1.59 0.24 0.00 0.00 174.94 174.02 1yem s LYS 10 N -3.98 3.82 0.10 0.37 0.00 -1.26 -4.37 119.74 114.41 1yem s LYS 10 Ca 0.31 -0.43 -0.32 0.00 0.00 0.00 0.00 55.97 55.54 1yem s LYS 10 Cb 0.03 -3.12 -0.13 0.00 0.00 0.00 0.00 37.83 34.61 1yem s LYS 10 CO 0.12 0.20 1.60 1.25 0.00 0.00 0.00 175.35 178.51 1yem h LEU 11 N 6.91 -1.12 -0.24 2.77 5.85 -1.95 -1.26 115.31 126.27 1yem h LEU 11 Ca -0.35 0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.42 1yem h LEU 11 Cb 1.18 0.39 -0.01 0.00 0.37 0.00 0.00 40.66 42.59 1yem h LEU 11 CO 0.66 -0.53 -0.04 -0.33 -0.34 0.00 0.00 178.44 177.86 1yem h GLU 12 N -0.77 0.46 -0.35 1.25 4.39 -1.99 -1.06 114.58 116.51 1yem h GLU 12 Ca -0.02 -0.17 0.07 0.00 0.34 0.00 0.00 59.36 59.59 1yem h GLU 12 Cb 0.71 -0.03 -0.09 0.00 -0.10 0.00 0.00 28.75 29.25 1yem h GLU 12 CO -0.11 0.67 -0.29 -0.44 -1.16 0.00 0.00 179.01 177.68 1yem h ASP 13 N 0.20 -0.97 -0.65 1.42 3.45 -1.98 0.33 116.42 118.23 1yem h ASP 13 Ca 0.06 0.17 -0.06 0.00 0.43 0.00 0.00 57.03 57.64 1yem h ASP 13 Cb 0.49 0.46 -0.03 0.00 -0.56 0.00 0.00 39.33 39.69 1yem h ASP 13 CO 0.02 -0.31 0.18 0.15 -1.57 0.00 0.00 179.24 177.71 1yem h PHE 14 N -0.25 1.06 -0.81 4.55 3.04 -1.00 0.18 116.94 123.71 1yem h PHE 14 Ca 0.16 -0.12 -0.02 0.00 3.98 0.00 0.00 57.97 61.98 1yem h PHE 14 Cb 0.51 -0.30 -0.04 0.00 2.56 0.00 0.00 35.95 38.68 1yem h PHE 14 CO -0.49 0.87 0.44 -0.07 -2.02 0.00 0.00 178.31 177.05 1yem h LEU 15 N 0.94 1.01 -0.01 0.59 3.38 -0.75 1.21 115.31 121.68 1yem h LEU 15 Ca 0.21 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1yem h LEU 15 Cb 0.33 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1yem h LEU 15 CO -0.00 0.81 0.00 0.45 0.09 0.00 0.00 178.44 179.79 1yem h HIS 16 N 1.14 0.02 -0.06 1.13 3.86 -0.38 -0.09 115.15 120.78 1yem h HIS 16 Ca 0.29 -0.00 0.02 0.00 -1.16 0.00 0.00 60.37 59.52 1yem h HIS 16 Cb 0.03 -0.01 -0.02 0.00 1.06 0.00 0.00 27.41 28.47 1yem h HIS 16 CO 0.01 0.27 -0.07 1.15 0.86 0.00 0.00 177.93 180.15 1yem h THR 17 N -0.23 0.80 -0.65 2.45 2.02 -0.63 -2.57 112.91 114.10 1yem h THR 17 Ca 0.00 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.27 1yem h THR 17 Cb 0.26 0.80 -0.07 0.00 -1.74 0.00 0.00 68.15 67.40 1yem h THR 17 CO 0.00 0.00 0.30 0.25 0.37 0.00 0.00 175.52 176.44 1yem h LEU 18 N -0.10 0.36 -1.63 2.58 5.85 0.16 -2.82 115.31 119.71 1yem h LEU 18 Ca 0.05 0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 1yem h LEU 18 Cb 0.16 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1yem h LEU 18 CO -0.11 0.21 -0.18 0.78 -0.34 0.00 0.00 178.44 178.80 1yem h ASN 19 N 0.52 0.00 0.00 1.25 4.21 -0.60 -2.25 115.58 118.70 1yem h ASN 19 Ca 0.32 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.83 1yem h ASN 19 Cb 0.35 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.55 1yem h ASN 19 CO -0.27 0.18 0.00 0.35 -1.29 0.00 0.00 177.43 176.40 1yem n THR 20 N -3.62 1.31 0.18 2.81 -2.24 -1.06 -1.83 114.28 109.83 1yem n THR 20 Ca -0.01 0.67 0.09 0.00 -2.27 0.00 0.00 64.05 62.53 1yem n THR 20 Cb 0.31 -1.67 0.17 0.00 -2.10 0.00 0.00 70.33 67.04 1yem n THR 20 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1yem n PHE 21 N -2.03 0.41 -3.41 4.78 3.72 -0.85 -5.02 117.46 115.07 1yem n PHE 21 Ca -0.01 -0.27 -0.21 0.00 -0.05 0.00 0.00 57.45 56.91 1yem n PHE 21 Cb 0.03 -0.01 0.06 0.00 -0.94 0.00 0.00 39.48 38.62 1yem n PHE 21 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1yem n ASN 22 N 1.08 -6.09 -4.78 4.37 3.02 -0.76 -4.97 115.26 107.13 1yem n ASN 22 Ca 0.15 -0.82 -0.35 0.00 -0.03 0.00 0.00 54.58 53.53 1yem n ASN 22 Cb 0.50 -4.56 -0.02 0.00 -0.61 0.00 0.00 39.78 35.09 1yem n ASN 22 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1yem s PRO 23 N -4.98 3.67 0.20 3.52 0.04 -1.26 -5.02 135.00 131.18 1yem s PRO 23 Ca 0.46 1.57 -0.30 0.00 0.04 0.00 0.00 61.00 62.77 1yem s PRO 23 Cb -0.10 -2.19 -0.08 0.00 0.04 0.00 0.00 34.50 32.17 1yem s PRO 23 CO 0.78 -0.58 1.14 -2.00 0.04 0.00 0.00 177.00 176.39 1yem s GLU 24 N -3.03 4.56 0.30 4.56 2.12 -0.02 -4.93 118.70 122.26 1yem s GLU 24 Ca 0.67 1.80 -0.17 0.00 0.36 0.00 0.00 54.97 57.63 1yem s GLU 24 Cb -0.23 -3.24 -0.09 0.00 0.26 0.00 0.00 34.13 30.83 1yem s GLU 24 CO 0.27 0.03 0.75 -0.06 -0.54 0.00 0.00 175.26 175.71 1yem s PHE 25 N -0.34 3.47 0.02 5.30 0.08 -1.26 -1.66 117.98 123.59 1yem s PHE 25 Ca 0.50 1.31 0.00 0.00 0.12 0.00 0.00 56.93 58.86 1yem s PHE 25 Cb -0.31 -2.59 0.00 0.00 -0.57 0.00 0.00 43.02 39.55 1yem s PHE 25 CO 0.37 0.16 0.00 0.28 -0.10 0.00 0.00 175.22 175.93 1yem n VAL 26 N -0.00 0.19 -3.73 -0.44 0.31 -0.92 -4.83 118.33 108.90 1yem n VAL 26 Ca 0.02 0.06 -0.02 0.00 -0.01 0.00 0.00 64.34 64.39 1yem n VAL 26 Cb 0.52 -0.95 -0.01 0.00 -0.91 0.00 0.00 33.84 32.49 1yem n VAL 26 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1yem s ARG 27 N -1.18 1.04 -0.02 5.55 1.70 -1.23 -5.04 118.95 119.76 1yem s ARG 27 Ca 0.00 -0.58 0.08 0.00 -0.47 0.00 0.00 55.73 54.76 1yem s ARG 27 Cb 0.00 0.35 -0.02 0.00 -0.57 0.00 0.00 34.95 34.71 1yem s ARG 27 CO 0.00 -0.48 -0.25 -0.47 -1.08 0.00 0.00 175.30 173.02 1yem s TYR 28 N -3.07 2.28 -0.02 5.89 5.04 -1.26 -1.04 117.35 125.17 1yem s TYR 28 Ca 0.13 -0.45 0.00 0.00 -2.44 0.00 0.00 57.07 54.31 1yem s TYR 28 Cb -0.00 -1.47 0.02 0.00 0.35 0.00 0.00 41.96 40.86 1yem s TYR 28 CO 0.01 -0.05 0.01 -1.21 -1.34 0.00 0.00 175.55 172.97 1yem s GLU 29 N -0.56 0.19 -0.41 4.97 2.02 0.15 -4.91 118.70 120.15 1yem s GLU 29 Ca 0.09 0.08 -0.16 0.00 0.02 0.00 0.00 54.97 55.00 1yem s GLU 29 Cb -0.10 -0.37 0.02 0.00 0.10 0.00 0.00 34.13 33.78 1yem s GLU 29 CO -0.01 -0.12 0.36 -1.21 0.02 0.00 0.00 175.26 174.30 1yem s GLU 30 N 0.87 3.09 0.02 1.61 2.02 -1.26 -0.40 118.70 124.64 1yem s GLU 30 Ca -0.08 -0.86 0.05 0.00 0.02 0.00 0.00 54.97 54.10 1yem s GLU 30 Cb -0.11 -3.95 -0.03 0.00 0.10 0.00 0.00 34.13 30.13 1yem s GLU 30 CO -0.02 -0.76 -0.13 -0.65 0.02 0.00 0.00 175.26 173.72 1yem s GLN 31 N 1.89 2.31 -0.12 1.61 -0.21 -0.04 -1.84 119.66 123.26 1yem s GLN 31 Ca 0.08 -0.85 -0.00 0.00 0.02 0.00 0.00 55.36 54.62 1yem s GLN 31 Cb -0.18 -2.33 0.02 0.00 1.00 0.00 0.00 33.01 31.52 1yem s GLN 31 CO 0.12 0.57 -0.09 -2.00 -2.12 0.00 0.00 175.29 171.77 1yem s GLU 32 N -1.35 1.67 -0.20 2.91 2.12 0.18 -1.54 118.70 122.50 1yem s GLU 32 Ca 0.15 -0.32 -0.02 0.00 0.36 0.00 0.00 54.97 55.14 1yem s GLU 32 Cb -0.11 -1.67 -0.00 0.00 0.26 0.00 0.00 34.13 32.61 1yem s GLU 32 CO 0.06 -0.24 -0.09 -0.51 -0.54 0.00 0.00 175.26 173.93 1yem s ASP 33 N 1.60 3.97 -0.30 -1.70 -0.00 0.32 -0.16 116.67 120.40 1yem s ASP 33 Ca 0.04 -0.45 -0.11 0.00 -0.00 0.00 0.00 52.55 52.04 1yem s ASP 33 Cb -0.13 -1.66 -0.02 0.00 -0.00 0.00 0.00 42.92 41.11 1yem s ASP 33 CO -0.08 0.01 0.18 -0.69 -0.00 0.00 0.00 175.17 174.59 1yem s VAL 34 N 1.26 4.95 -0.09 -1.27 1.01 0.12 -0.53 120.40 125.86 1yem s VAL 34 Ca 0.03 -0.18 -0.14 0.00 0.00 0.00 0.00 61.98 61.70 1yem s VAL 34 Cb -0.14 -3.46 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 1yem s VAL 34 CO -0.04 0.12 0.33 -0.31 0.00 0.00 0.00 175.10 175.21 1yem s TYR 35 N 1.68 3.59 -0.01 5.22 2.02 0.11 -1.37 117.35 128.60 1yem s TYR 35 Ca 0.06 0.77 0.00 0.00 -0.37 0.00 0.00 57.07 57.53 1yem s TYR 35 Cb -0.17 -2.28 -0.04 0.00 -0.40 0.00 0.00 41.96 39.08 1yem s TYR 35 CO 0.08 0.47 0.04 -0.06 -1.57 0.00 0.00 175.55 174.52 1yem s PHE 36 N -0.36 3.19 -0.12 2.71 0.08 -0.31 0.35 117.98 123.52 1yem s PHE 36 Ca 0.20 0.16 -0.29 0.00 0.12 0.00 0.00 56.93 57.11 1yem s PHE 36 Cb -0.14 -1.71 -0.05 0.00 -0.57 0.00 0.00 43.02 40.54 1yem s PHE 36 CO 0.08 0.51 1.76 -1.21 -0.10 0.00 0.00 175.22 176.26 1yem s GLU 37 N -1.61 3.91 0.14 0.44 2.02 0.15 -4.39 118.70 119.36 1yem s GLU 37 Ca 0.21 2.05 0.02 0.00 0.02 0.00 0.00 54.97 57.27 1yem s GLU 37 Cb -0.12 -4.08 -0.04 0.00 0.10 0.00 0.00 34.13 29.99 1yem s GLU 37 CO 0.12 -1.17 -0.04 0.14 0.02 0.00 0.00 175.26 174.32 1yem s VAL 38 N 5.02 0.78 0.69 2.63 -7.23 -1.26 -4.63 120.40 116.41 1yem s VAL 38 Ca 0.78 -1.98 -0.11 0.00 -1.81 0.00 0.00 61.98 58.86 1yem s VAL 38 Cb -0.32 -1.93 0.01 0.00 0.56 0.00 0.00 36.38 34.70 1yem s VAL 38 CO 0.32 -0.66 1.08 -2.16 -0.31 0.00 0.00 175.10 173.37 1yem s PRO 39 N -3.86 2.97 0.55 4.82 0.05 -1.26 -4.80 135.00 133.46 1yem s PRO 39 Ca 0.19 0.60 -0.20 0.00 0.05 0.00 0.00 61.00 61.63 1yem s PRO 39 Cb 0.05 -2.02 -0.05 0.00 0.05 0.00 0.00 34.50 32.53 1yem s PRO 39 CO 0.00 -0.99 1.21 1.03 0.05 0.00 0.00 177.00 178.30 1yem s ARG 40 N -5.26 3.23 -0.77 4.56 0.52 -1.26 -1.44 118.95 118.54 1yem s ARG 40 Ca 0.58 1.83 -0.02 0.00 -0.52 0.00 0.00 55.73 57.60 1yem s ARG 40 Cb -0.12 -2.09 0.39 0.00 0.52 0.00 0.00 34.95 33.66 1yem s ARG 40 CO 0.53 -1.00 2.03 -0.35 0.02 0.00 0.00 175.30 176.53 1yem n PRO 41 N -1.22 2.73 -4.02 3.54 -0.04 -1.26 -5.11 135.00 129.62 1yem n PRO 41 Ca 0.11 -3.43 -0.27 0.00 -0.04 0.00 0.00 63.50 59.88 1yem n PRO 41 Cb 0.49 -2.28 -0.05 0.00 -0.04 0.00 0.00 33.50 31.62 1yem n PRO 41 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1yem s LYS 42 N -3.97 3.13 -0.01 0.54 1.02 -0.52 0.15 119.74 120.09 1yem s LYS 42 Ca 0.58 -0.72 0.02 0.00 0.02 0.00 0.00 55.97 55.87 1yem s LYS 42 Cb 0.47 -2.80 -0.00 0.00 -0.52 0.00 0.00 37.83 34.98 1yem s LYS 42 CO -0.24 0.52 -0.08 -0.51 -0.92 0.00 0.00 175.35 174.12 1yem s LEU 43 N -3.01 1.89 -0.08 3.17 1.43 0.18 -4.73 118.68 117.54 1yem s LEU 43 Ca 0.32 -0.15 -0.02 0.00 -1.03 0.00 0.00 54.13 53.26 1yem s LEU 43 Cb -0.11 -0.43 0.03 0.00 0.03 0.00 0.00 46.19 45.71 1yem s LEU 43 CO 0.25 0.07 0.03 -0.22 0.23 0.00 0.00 176.35 176.72 1yem s LEU 44 N 0.02 0.46 0.05 1.79 2.96 -1.26 -0.84 118.68 121.85 1yem s LEU 44 Ca 0.00 -0.12 -0.02 0.00 -0.22 0.00 0.00 54.13 53.77 1yem s LEU 44 Cb -0.05 -0.33 -0.03 0.00 0.50 0.00 0.00 46.19 46.27 1yem s LEU 44 CO -0.00 -0.23 0.00 0.00 -1.32 0.00 0.00 176.35 174.80 1yem s ARG 45 N 2.04 0.61 -0.17 1.98 1.70 -0.46 -1.17 118.95 123.48 1yem s ARG 45 Ca 0.04 -1.12 -0.03 0.00 -0.47 0.00 0.00 55.73 54.16 1yem s ARG 45 Cb -0.13 0.22 -0.02 0.00 -0.57 0.00 0.00 34.95 34.45 1yem s ARG 45 CO -0.05 -0.12 -0.07 0.42 -1.08 0.00 0.00 175.30 174.40 1yem s ILE 46 N -3.65 3.40 -0.14 4.99 1.01 -0.47 -0.54 121.20 125.80 1yem s ILE 46 Ca 0.04 -0.51 -0.02 0.00 0.00 0.00 0.00 60.65 60.16 1yem s ILE 46 Cb 0.06 -2.49 -0.02 0.00 0.01 0.00 0.00 42.46 40.01 1yem s ILE 46 CO -0.09 0.47 -0.06 -0.60 0.00 0.00 0.00 174.94 174.66 1yem s ARG 47 N 0.81 3.49 -0.20 2.79 3.52 0.09 -0.70 118.95 128.76 1yem s ARG 47 Ca -0.02 -0.56 -0.04 0.00 -0.13 0.00 0.00 55.73 54.97 1yem s ARG 47 Cb -0.15 -2.80 -0.02 0.00 -1.56 0.00 0.00 34.95 30.42 1yem s ARG 47 CO 0.01 0.29 -0.02 0.20 -0.81 0.00 0.00 175.30 174.97 1yem s GLY 48 N 0.20 1.68 -0.74 8.12 0.00 0.78 -0.98 107.32 116.39 1yem s GLY 48 Ca -0.04 -1.00 -0.08 0.00 0.00 0.00 0.00 44.72 43.60 1yem s GLY 48 CO 0.03 0.22 0.61 0.14 0.00 0.00 0.00 173.10 174.10 1yem s VAL 49 N 0.99 4.67 0.24 1.40 1.01 0.48 -0.65 120.40 128.55 1yem s VAL 49 Ca 0.01 -2.76 -0.06 0.00 0.00 0.00 0.00 61.98 59.17 1yem s VAL 49 Cb -0.14 -3.95 0.22 0.00 0.00 0.00 0.00 36.38 32.51 1yem s VAL 49 CO 0.01 -0.96 1.87 -0.74 0.00 0.00 0.00 175.10 175.28 1yem h HIS 50 N 7.35 1.03 0.00 5.22 2.76 -1.63 -0.94 115.15 128.94 1yem h HIS 50 Ca 0.05 0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 58.20 1yem h HIS 50 Cb 0.99 -0.34 -0.01 0.00 1.55 0.00 0.00 27.41 29.61 1yem h HIS 50 CO 0.87 0.55 -0.22 -2.95 -1.30 0.00 0.00 177.93 174.89 1yem h ASN 51 N 1.04 0.00 -0.01 3.26 -1.07 -1.94 -3.07 115.58 113.79 1yem h ASN 51 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.74 1yem h ASN 51 Cb 0.11 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.36 1yem h ASN 51 CO -0.15 0.22 -0.43 0.18 0.07 0.00 0.00 177.43 177.31 1yem n LEU 52 N -3.29 1.74 -3.97 6.14 4.77 -0.88 -4.99 117.00 116.52 1yem n LEU 52 Ca 0.01 -0.74 -0.26 0.00 -0.03 0.00 0.00 56.01 54.99 1yem n LEU 52 Cb 0.48 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.54 1yem n LEU 52 CO 0.34 0.33 -0.23 0.29 -1.33 0.00 0.00 177.39 176.79 1yem n LYS 53 N -0.17 -3.26 -4.78 3.23 4.01 -0.41 -5.00 118.16 111.77 1yem n LYS 53 Ca 0.07 0.40 -0.25 0.00 -0.51 0.00 0.00 58.31 58.02 1yem n LYS 53 Cb 0.39 -4.53 -0.15 0.00 -0.51 0.00 0.00 35.03 30.23 1yem n LYS 53 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1yem s LYS 54 N -6.58 1.41 0.01 1.97 -0.14 -1.14 -5.02 119.74 110.25 1yem s LYS 54 Ca 0.03 -0.73 0.03 0.00 -1.36 0.00 0.00 55.97 53.93 1yem s LYS 54 Cb -0.01 -1.41 -0.01 0.00 -1.68 0.00 0.00 37.83 34.71 1yem s LYS 54 CO 0.89 0.38 -0.09 0.71 -0.76 0.00 0.00 175.35 176.48 1yem s TYR 55 N -0.56 0.81 0.06 3.18 2.02 -1.26 -0.39 117.35 121.22 1yem s TYR 55 Ca 0.07 -0.22 0.02 0.00 -0.37 0.00 0.00 57.07 56.56 1yem s TYR 55 Cb -0.08 -0.51 -0.03 0.00 -0.40 0.00 0.00 41.96 40.95 1yem s TYR 55 CO 0.00 -0.01 -0.07 0.71 -1.57 0.00 0.00 175.55 174.61 1yem s TYR 56 N -0.47 0.72 -0.14 2.71 1.51 -0.15 -1.21 117.35 120.33 1yem s TYR 56 Ca 0.01 -0.64 -0.01 0.00 -1.01 0.00 0.00 57.07 55.42 1yem s TYR 56 Cb -0.05 -0.43 -0.02 0.00 -0.11 0.00 0.00 41.96 41.35 1yem s TYR 56 CO 0.00 -0.11 -0.10 -1.17 -1.11 0.00 0.00 175.55 173.05 1yem s LEU 57 N -2.04 2.87 -0.10 -1.29 0.20 -0.42 -0.73 118.68 117.17 1yem s LEU 57 Ca -0.03 -0.27 0.00 0.00 0.69 0.00 0.00 54.13 54.52 1yem s LEU 57 Cb -0.05 -1.66 0.02 0.00 -0.43 0.00 0.00 46.19 44.07 1yem s LEU 57 CO -0.01 0.17 -0.08 -0.89 -0.29 0.00 0.00 176.35 175.25 1yem s THR 58 N 0.33 1.00 -0.10 3.68 2.01 0.30 -2.29 115.64 120.58 1yem s THR 58 Ca -0.09 -0.30 0.00 0.00 0.31 0.00 0.00 61.69 61.62 1yem s THR 58 Cb -0.15 -1.00 -0.02 0.00 0.01 0.00 0.00 72.50 71.33 1yem s THR 58 CO 0.05 0.36 -0.09 0.12 -0.69 0.00 0.00 174.62 174.36 1yem s PHE 59 N 1.51 2.88 0.02 4.92 5.36 0.37 -1.36 117.98 131.68 1yem s PHE 59 Ca 0.01 -0.23 0.02 0.00 -0.96 0.00 0.00 56.93 55.77 1yem s PHE 59 Cb -0.13 -1.77 -0.02 0.00 -0.34 0.00 0.00 43.02 40.76 1yem s PHE 59 CO -0.06 0.10 -0.06 0.15 -1.46 0.00 0.00 175.22 173.90 1yem s LYS 60 N -0.29 0.45 -0.14 10.12 1.02 -0.02 -0.33 119.74 130.54 1yem s LYS 60 Ca 0.03 -0.53 0.00 0.00 0.02 0.00 0.00 55.97 55.50 1yem s LYS 60 Cb -0.13 -0.27 0.02 0.00 -0.52 0.00 0.00 37.83 36.93 1yem s LYS 60 CO 0.03 0.06 -0.13 -2.00 -0.92 0.00 0.00 175.35 172.39 1yem s GLU 61 N -1.03 2.12 0.00 1.68 2.56 0.20 0.49 118.70 124.72 1yem s GLU 61 Ca -0.06 -0.50 -0.30 0.00 0.00 0.00 0.00 54.97 54.10 1yem s GLU 61 Cb -0.07 -2.01 -0.04 0.00 2.00 0.00 0.00 34.13 34.01 1yem s GLU 61 CO 0.00 -0.25 1.20 0.42 -0.56 0.00 0.00 175.26 176.07 1yem s ILE 62 N 1.53 4.15 -0.95 -3.70 1.01 0.12 -0.94 121.20 122.43 1yem s ILE 62 Ca 0.05 1.52 0.15 0.00 0.00 0.00 0.00 60.65 62.37 1yem s ILE 62 Cb -0.13 -3.98 -0.12 0.00 0.01 0.00 0.00 42.46 38.25 1yem s ILE 62 CO -0.10 0.06 0.71 0.18 0.00 0.00 0.00 174.94 175.79 1yem n LEU 63 N 4.58 1.00 0.00 2.97 4.77 -0.13 -4.77 117.00 125.41 1yem n LEU 63 Ca 0.10 -0.58 -0.14 0.00 -0.03 0.00 0.00 56.01 55.35 1yem n LEU 63 Cb 0.46 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.51 1yem n LEU 63 CO 0.55 0.22 -0.09 -0.90 -1.33 0.00 0.00 177.39 175.84 1yem n ASP 64 N -0.98 1.06 0.03 -1.43 5.75 -1.25 -5.00 116.55 114.73 1yem n ASP 64 Ca 0.04 -2.25 -0.04 0.00 -0.01 0.00 0.00 54.79 52.54 1yem n ASP 64 Cb 0.27 0.60 -0.09 0.00 -1.03 0.00 0.00 41.12 40.87 1yem n ASP 64 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1yem h GLU 65 N 0.00 0.00 -0.52 0.11 5.08 -1.96 -3.38 114.58 113.92 1yem h GLU 65 Ca -0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 1yem h GLU 65 Cb 0.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1yem h GLU 65 CO 0.29 0.49 0.00 0.09 -1.00 0.00 0.00 179.01 178.88 1yem n ASN 66 N -3.05 5.20 -3.60 1.42 3.02 -1.26 -4.94 115.26 112.05 1yem n ASN 66 Ca -0.09 -2.88 -0.27 0.00 -0.03 0.00 0.00 54.58 51.32 1yem n ASN 66 Cb 0.91 -0.64 0.03 0.00 -0.61 0.00 0.00 39.78 39.48 1yem n ASN 66 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1yem n ASN 67 N 0.45 -5.09 -0.00 6.41 3.02 -1.26 -4.85 115.26 113.94 1yem n ASN 67 Ca 0.26 -0.58 0.01 0.00 -0.03 0.00 0.00 54.58 54.25 1yem n ASN 67 Cb 1.09 -4.08 -0.02 0.00 -0.61 0.00 0.00 39.78 36.16 1yem n ASN 67 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1yem n GLU 68 N -4.43 5.81 -4.75 3.52 1.02 -1.26 -4.91 120.64 115.64 1yem n GLU 68 Ca -0.00 -0.02 -0.26 0.00 -0.02 0.00 0.00 57.16 56.86 1yem n GLU 68 Cb 0.55 -0.65 -0.16 0.00 -0.02 0.00 0.00 31.44 31.16 1yem n GLU 68 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1yem s GLU 69 N -1.24 1.77 -0.03 3.49 2.12 -1.26 -0.05 118.70 123.50 1yem s GLU 69 Ca 0.01 -0.54 -0.04 0.00 0.36 0.00 0.00 54.97 54.76 1yem s GLU 69 Cb 0.02 -1.50 0.01 0.00 0.26 0.00 0.00 34.13 32.92 1yem s GLU 69 CO 0.12 0.17 0.10 -0.06 -0.54 0.00 0.00 175.26 175.04 1yem s PHE 70 N 0.25 -0.06 -0.21 5.30 0.08 -0.18 -0.96 117.98 122.20 1yem s PHE 70 Ca -0.08 0.16 -0.08 0.00 0.12 0.00 0.00 56.93 57.04 1yem s PHE 70 Cb -0.13 0.01 -0.04 0.00 -0.57 0.00 0.00 43.02 42.29 1yem s PHE 70 CO 0.03 -0.10 0.09 -0.47 -0.10 0.00 0.00 175.22 174.67 1yem s TYR 71 N -0.28 3.24 -0.04 0.36 5.04 -0.12 -0.52 117.35 125.04 1yem s TYR 71 Ca -0.03 0.03 0.06 0.00 -2.44 0.00 0.00 57.07 54.68 1yem s TYR 71 Cb -0.02 -2.16 -0.01 0.00 0.35 0.00 0.00 41.96 40.11 1yem s TYR 71 CO 0.00 0.03 -0.22 -2.00 -1.34 0.00 0.00 175.55 172.03 1yem s GLU 72 N 0.80 2.03 -0.14 4.97 2.12 -1.26 -0.63 118.70 126.59 1yem s GLU 72 Ca 0.05 -0.78 -0.00 0.00 0.36 0.00 0.00 54.97 54.59 1yem s GLU 72 Cb -0.13 -1.82 0.03 0.00 0.26 0.00 0.00 34.13 32.46 1yem s GLU 72 CO 0.02 0.39 -0.10 0.08 -0.54 0.00 0.00 175.26 175.12 1yem s VAL 73 N -0.27 1.29 0.05 3.70 1.01 0.55 -4.79 120.40 121.93 1yem s VAL 73 Ca 0.02 -0.52 -0.04 0.00 0.00 0.00 0.00 61.98 61.43 1yem s VAL 73 Cb -0.11 -1.29 -0.02 0.00 0.00 0.00 0.00 36.38 34.96 1yem s VAL 73 CO 0.01 0.35 0.07 -1.83 0.00 0.00 0.00 175.10 173.70 1yem s GLU 74 N 1.59 0.62 0.13 2.72 -1.05 -1.26 -0.48 118.70 120.98 1yem s GLU 74 Ca 0.04 -0.90 -0.18 0.00 -0.15 0.00 0.00 54.97 53.78 1yem s GLU 74 Cb -0.13 0.24 0.04 0.00 -0.44 0.00 0.00 34.13 33.84 1yem s GLU 74 CO -0.09 -0.15 0.45 -0.59 0.95 0.00 0.00 175.26 175.82 1yem s PHE 75 N -3.09 -0.28 0.49 4.83 -0.12 -0.97 -5.01 117.98 113.83 1yem s PHE 75 Ca -0.01 -0.01 -0.21 0.00 -0.05 0.00 0.00 56.93 56.65 1yem s PHE 75 Cb 0.02 0.33 -0.07 0.00 -0.63 0.00 0.00 43.02 42.66 1yem s PHE 75 CO -0.07 -0.73 1.09 -1.21 -0.05 0.00 0.00 175.22 174.25 1yem s GLU 76 N -3.79 3.69 0.16 1.99 2.02 -1.26 -1.30 118.70 120.22 1yem s GLU 76 Ca 0.02 1.54 0.07 0.00 0.02 0.00 0.00 54.97 56.62 1yem s GLU 76 Cb 0.01 -2.18 -0.04 0.00 0.10 0.00 0.00 34.13 32.02 1yem s GLU 76 CO -0.12 -0.55 -0.14 0.96 0.02 0.00 0.00 175.26 175.42 1yem s ILE 77 N -1.78 1.54 -0.95 -1.63 -4.36 -0.35 -4.82 121.20 108.84 1yem s ILE 77 Ca 0.67 -1.98 0.24 0.00 -0.26 0.00 0.00 60.65 59.32 1yem s ILE 77 Cb -0.22 -1.81 -0.08 0.00 1.25 0.00 0.00 42.46 41.60 1yem s ILE 77 CO 0.26 -0.51 1.21 0.61 0.24 0.00 0.00 174.94 176.75 1yem n GLY 78 N 0.06 -1.17 2.99 6.27 0.00 -1.26 -4.15 105.19 107.92 1yem n GLY 78 Ca -0.12 -0.43 -0.09 0.00 0.00 0.00 0.00 46.02 45.39 1yem n GLY 78 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1yem s ASP 79 N -3.12 0.09 0.06 1.61 3.68 -1.26 -5.02 116.67 112.72 1yem s ASP 79 Ca 0.09 0.39 -0.30 0.00 2.13 0.00 0.00 52.55 54.86 1yem s ASP 79 Cb 0.17 1.19 -0.18 0.00 -1.45 0.00 0.00 42.92 42.65 1yem s ASP 79 CO 0.76 -0.29 1.58 0.15 0.13 0.00 0.00 175.17 177.51 1yem h PHE 80 N 8.18 -0.67 -0.73 -5.34 3.57 -1.95 -2.40 116.94 117.60 1yem h PHE 80 Ca -0.19 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.24 1yem h PHE 80 Cb 1.15 0.22 -0.03 0.00 2.79 0.00 0.00 35.95 40.08 1yem h PHE 80 CO 0.15 -0.39 0.23 0.93 -2.23 0.00 0.00 178.31 177.00 1yem h GLU 81 N -0.77 1.14 -0.71 1.11 4.39 -1.99 -2.12 114.58 115.63 1yem h GLU 81 Ca -0.07 -0.25 -0.03 0.00 0.34 0.00 0.00 59.36 59.34 1yem h GLU 81 Cb 0.57 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 29.03 1yem h GLU 81 CO 0.12 0.97 0.31 0.87 -1.16 0.00 0.00 179.01 180.12 1yem h LYS 82 N 1.09 1.04 -0.71 2.33 1.57 -1.98 0.91 116.57 120.82 1yem h LYS 82 Ca 0.24 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1yem h LYS 82 Cb 0.31 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.41 1yem h LYS 82 CO -0.01 0.84 0.41 0.00 -0.57 0.00 0.00 179.45 180.12 1yem h ALA 83 N 1.14 0.90 -0.71 3.86 0.00 -1.17 0.11 119.26 123.39 1yem h ALA 83 Ca 0.24 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1yem h ALA 83 Cb 0.17 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1yem h ALA 83 CO -0.02 0.40 0.42 0.28 0.00 0.00 0.00 179.25 180.32 1yem h VAL 84 N 0.97 1.21 -0.39 0.00 2.07 -1.03 -2.40 116.25 116.67 1yem h VAL 84 Ca 0.25 -0.48 -0.02 0.00 0.82 0.00 0.00 66.70 67.27 1yem h VAL 84 Cb 0.00 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 29.99 1yem h VAL 84 CO -0.04 0.22 0.17 -0.08 0.02 0.00 0.00 177.57 177.86 1yem h GLU 85 N 0.98 0.57 -0.04 1.57 4.81 0.03 -1.96 114.58 120.55 1yem h GLU 85 Ca 0.25 -0.09 0.02 0.00 -0.13 0.00 0.00 59.36 59.41 1yem h GLU 85 Cb -0.01 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 1yem h GLU 85 CO -0.05 0.53 -0.07 0.28 -0.73 0.00 0.00 179.01 178.97 1yem h VAL 86 N 0.49 0.80 -0.37 0.32 2.07 -0.64 -0.63 116.25 118.29 1yem h VAL 86 Ca 0.13 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.61 1yem h VAL 86 Cb 0.16 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 1yem h VAL 86 CO -0.01 0.00 0.04 -0.26 0.02 0.00 0.00 177.57 177.35 1yem h PHE 87 N -0.11 0.59 -0.09 1.57 -1.00 -1.34 -0.98 116.94 115.57 1yem h PHE 87 Ca 0.04 -0.05 -0.00 0.00 2.81 0.00 0.00 57.97 60.77 1yem h PHE 87 Cb 0.17 -0.17 -0.00 0.00 3.61 0.00 0.00 35.95 39.55 1yem h PHE 87 CO -0.16 0.55 0.05 0.87 -1.61 0.00 0.00 178.31 178.00 1yem h LYS 88 N 0.55 0.12 0.00 1.51 1.57 -1.03 -1.49 116.57 117.81 1yem h LYS 88 Ca 0.12 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1yem h LYS 88 Cb 0.30 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1yem h LYS 88 CO 0.01 0.18 0.00 0.00 -0.57 0.00 0.00 179.45 179.07 1yem h ARG 89 N 0.03 0.00 -0.00 3.15 3.08 -0.42 0.18 114.38 120.39 1yem h ARG 89 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1yem h ARG 89 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1yem h ARG 89 CO -0.00 0.00 -0.04 1.28 -1.07 0.00 0.00 179.97 180.14 1yem n LEU 90 N -3.04 0.41 0.00 3.04 4.77 -0.44 -4.92 117.00 116.82 1yem n LEU 90 Ca -0.01 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 1yem n LEU 90 Cb 0.21 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1yem n LEU 90 CO 0.24 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 1yem n GLY 91 N 1.16 0.75 3.77 -0.72 0.00 0.61 -5.08 105.19 105.69 1yem n GLY 91 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 1yem n GLY 91 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1yem s PHE 92 N -2.06 3.49 -0.12 1.61 0.08 -0.58 -5.01 117.98 115.39 1yem s PHE 92 Ca 0.00 1.71 -0.04 0.00 0.12 0.00 0.00 56.93 58.72 1yem s PHE 92 Cb 0.00 -3.10 -0.04 0.00 -0.57 0.00 0.00 43.02 39.32 1yem s PHE 92 CO 0.00 -0.32 0.04 0.15 -0.10 0.00 0.00 175.22 175.00 1yem s LYS 93 N -2.08 3.35 -0.04 0.44 -0.14 -1.26 -4.25 119.74 115.75 1yem s LYS 93 Ca 0.52 -0.34 -0.30 0.00 -1.36 0.00 0.00 55.97 54.49 1yem s LYS 93 Cb -0.23 -2.98 -0.05 0.00 -1.68 0.00 0.00 37.83 32.88 1yem s LYS 93 CO 0.30 0.60 1.48 0.42 -0.76 0.00 0.00 175.35 177.39 1yem s ILE 94 N -0.57 3.71 -0.04 2.17 1.01 -1.26 0.29 121.20 126.50 1yem s ILE 94 Ca 0.10 0.99 0.08 0.00 0.00 0.00 0.00 60.65 61.82 1yem s ILE 94 Cb -0.12 -3.64 -0.24 0.00 0.01 0.00 0.00 42.46 38.48 1yem s ILE 94 CO 0.02 -0.05 0.66 -0.61 0.00 0.00 0.00 174.94 174.96 1yem h GLN 95 N 8.51 0.07 -1.48 2.79 4.15 -0.40 -3.45 115.11 125.30 1yem h GLN 95 Ca -0.37 -0.12 0.12 0.00 0.77 0.00 0.00 58.65 59.06 1yem h GLN 95 Cb 1.17 0.04 -0.23 0.00 0.21 0.00 0.00 27.48 28.67 1yem h GLN 95 CO 0.93 0.70 0.64 0.00 -1.93 0.00 0.00 178.83 179.18 1yem s ALA 96 N -2.60 -1.97 -0.14 3.38 0.00 -1.20 -5.00 121.76 114.22 1yem s ALA 96 Ca -0.08 1.63 0.01 0.00 0.00 0.00 0.00 51.96 53.52 1yem s ALA 96 Cb 0.08 -0.81 -0.00 0.00 0.00 0.00 0.00 23.12 22.38 1yem s ALA 96 CO 0.82 -0.32 -0.16 0.99 0.00 0.00 0.00 175.76 177.09 1yem s THR 97 N -1.23 2.69 -0.15 0.00 2.01 -1.26 -0.71 115.64 116.99 1yem s THR 97 Ca 0.01 -0.77 0.00 0.00 0.31 0.00 0.00 61.69 61.24 1yem s THR 97 Cb -0.01 -2.12 0.02 0.00 0.01 0.00 0.00 72.50 70.40 1yem s THR 97 CO -0.01 0.52 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.66 1yem s ILE 98 N 0.67 1.60 -0.15 1.82 1.01 0.31 -4.96 121.20 121.50 1yem s ILE 98 Ca -0.08 -0.65 -0.05 0.00 0.00 0.00 0.00 60.65 59.87 1yem s ILE 98 Cb -0.16 -1.50 -0.03 0.00 0.01 0.00 0.00 42.46 40.78 1yem s ILE 98 CO 0.02 0.46 0.01 -0.54 0.00 0.00 0.00 174.94 174.89 1yem s LYS 99 N 1.47 3.66 0.07 2.79 1.02 -1.26 -0.52 119.74 126.98 1yem s LYS 99 Ca 0.05 -0.43 -0.08 0.00 0.02 0.00 0.00 55.97 55.53 1yem s LYS 99 Cb -0.13 -3.01 -0.00 0.00 -0.52 0.00 0.00 37.83 34.17 1yem s LYS 99 CO -0.11 0.35 0.17 -1.59 -0.92 0.00 0.00 175.35 173.24 1yem s LYS 100 N 0.11 0.77 -0.12 1.68 -2.85 -0.59 -1.04 119.74 117.70 1yem s LYS 100 Ca 0.02 -0.88 -0.02 0.00 -1.00 0.00 0.00 55.97 54.09 1yem s LYS 100 Cb -0.13 0.31 -0.03 0.00 -2.06 0.00 0.00 37.83 35.92 1yem s LYS 100 CO 0.02 -0.23 -0.05 0.15 0.10 0.00 0.00 175.35 175.34 1yem s LYS 101 N -3.43 3.34 -0.03 1.78 1.02 -0.09 -0.86 119.74 121.47 1yem s LYS 101 Ca 0.02 -0.54 0.02 0.00 0.02 0.00 0.00 55.97 55.49 1yem s LYS 101 Cb 0.03 -2.79 0.01 0.00 -0.52 0.00 0.00 37.83 34.57 1yem s LYS 101 CO -0.09 0.39 -0.06 0.50 -0.92 0.00 0.00 175.35 175.17 1yem s ARG 102 N -0.04 0.84 -0.22 1.68 3.52 0.47 -0.59 118.95 124.59 1yem s ARG 102 Ca 0.01 -0.19 -0.02 0.00 -0.13 0.00 0.00 55.73 55.39 1yem s ARG 102 Cb -0.13 -0.80 0.01 0.00 -1.56 0.00 0.00 34.95 32.46 1yem s ARG 102 CO 0.03 0.02 -0.07 -1.58 -0.81 0.00 0.00 175.30 172.89 1yem s TRP 103 N 0.50 2.97 -0.14 5.12 0.51 0.52 -0.68 118.94 127.73 1yem s TRP 103 Ca -0.07 -1.25 -0.07 0.00 -2.12 0.00 0.00 56.10 52.59 1yem s TRP 103 Cb -0.11 -2.06 -0.04 0.00 -0.81 0.00 0.00 33.47 30.45 1yem s TRP 103 CO 0.00 -0.65 0.11 0.08 -0.51 0.00 0.00 176.95 175.98 1yem s VAL 104 N 1.40 5.22 0.05 4.03 1.01 -0.21 -1.24 120.40 130.66 1yem s VAL 104 Ca 0.04 0.11 -0.01 0.00 0.00 0.00 0.00 61.98 62.12 1yem s VAL 104 Cb -0.15 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 1yem s VAL 104 CO -0.05 0.55 -0.03 -0.31 0.00 0.00 0.00 175.10 175.26 1yem s TYR 105 N -0.47 0.51 -0.08 5.22 2.02 -0.50 -2.16 117.35 121.90 1yem s TYR 105 Ca 0.11 -1.01 0.02 0.00 -0.37 0.00 0.00 57.07 55.83 1yem s TYR 105 Cb -0.12 -0.38 -0.02 0.00 -0.40 0.00 0.00 41.96 41.05 1yem s TYR 105 CO 0.02 -0.35 -0.15 0.15 -1.57 0.00 0.00 175.55 173.65 1yem s LYS 106 N -3.66 2.87 -0.14 -0.62 1.02 -0.67 -0.84 119.74 117.70 1yem s LYS 106 Ca 0.05 -0.71 -0.05 0.00 0.02 0.00 0.00 55.97 55.27 1yem s LYS 106 Cb 0.06 -2.46 0.06 0.00 -0.52 0.00 0.00 37.83 34.98 1yem s LYS 106 CO -0.09 0.43 0.30 -1.17 -0.92 0.00 0.00 175.35 173.90 1yem s LEU 107 N -0.24 -0.22 -1.49 3.17 2.96 -0.70 -0.84 118.68 121.33 1yem s LEU 107 Ca 0.01 0.67 -0.10 0.00 -0.22 0.00 0.00 54.13 54.49 1yem s LEU 107 Cb -0.13 0.86 0.07 0.00 0.50 0.00 0.00 46.19 47.48 1yem s LEU 107 CO 0.03 -0.22 0.83 0.59 -1.32 0.00 0.00 176.35 176.26 1yem n ASN 108 N 5.08 -3.25 -0.83 3.68 3.02 -1.26 -1.73 115.26 119.97 1yem n ASN 108 Ca -0.11 -0.84 -0.11 0.00 -0.03 0.00 0.00 54.58 53.49 1yem n ASN 108 Cb 0.51 -3.69 -0.05 0.00 -0.61 0.00 0.00 39.78 35.94 1yem n ASN 108 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1yem n GLY 109 N -1.66 1.21 3.59 7.41 0.00 -1.26 -5.02 105.19 109.45 1yem n GLY 109 Ca -0.07 -0.51 -0.27 0.00 0.00 0.00 0.00 46.02 45.16 1yem n GLY 109 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1yem s VAL 110 N -2.39 1.99 -0.08 1.61 -7.23 -0.70 -4.91 120.40 108.69 1yem s VAL 110 Ca 0.00 -2.04 0.01 0.00 -1.81 0.00 0.00 61.98 58.14 1yem s VAL 110 Cb 0.00 -2.90 -0.03 0.00 0.56 0.00 0.00 36.38 34.01 1yem s VAL 110 CO 0.00 -0.05 -0.10 -0.89 -0.31 0.00 0.00 175.10 173.76 1yem s THR 111 N -2.73 3.45 -0.05 5.32 2.01 -0.74 -1.72 115.64 121.17 1yem s THR 111 Ca 0.34 -0.56 0.05 0.00 0.31 0.00 0.00 61.69 61.83 1yem s THR 111 Cb 0.08 -2.41 -0.02 0.00 0.01 0.00 0.00 72.50 70.16 1yem s THR 111 CO 0.17 0.58 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.71 1yem s LEU 112 N -0.50 2.34 -0.30 4.42 1.02 -0.02 -1.73 118.68 123.91 1yem s LEU 112 Ca 0.07 -0.38 0.01 0.00 0.02 0.00 0.00 54.13 53.85 1yem s LEU 112 Cb -0.12 -1.45 0.09 0.00 0.02 0.00 0.00 46.19 44.73 1yem s LEU 112 CO 0.02 0.29 0.04 -1.61 0.02 0.00 0.00 176.35 175.11 1yem s GLU 113 N -0.40 1.23 -0.26 1.70 2.02 -0.06 -1.40 118.70 121.53 1yem s GLU 113 Ca 0.04 -1.35 -0.22 0.00 0.02 0.00 0.00 54.97 53.47 1yem s GLU 113 Cb -0.12 -2.60 -0.01 0.00 0.10 0.00 0.00 34.13 31.50 1yem s GLU 113 CO 0.02 -0.87 0.69 0.08 0.02 0.00 0.00 175.26 175.20 1yem s VAL 114 N 1.30 4.93 -0.08 2.63 1.01 -0.37 -1.16 120.40 128.65 1yem s VAL 114 Ca 0.06 1.24 0.04 0.00 0.00 0.00 0.00 61.98 63.32 1yem s VAL 114 Cb -0.18 -3.99 -0.01 0.00 0.00 0.00 0.00 36.38 32.19 1yem s VAL 114 CO -0.14 -0.02 -0.22 0.20 0.00 0.00 0.00 175.10 174.92 1yem s ASN 115 N 1.45 3.29 -0.36 3.32 0.01 0.91 -0.35 114.94 123.21 1yem s ASN 115 Ca 0.29 -0.48 -0.12 0.00 -0.71 0.00 0.00 52.86 51.84 1yem s ASN 115 Cb -0.15 -1.17 0.01 0.00 0.41 0.00 0.00 41.25 40.34 1yem s ASN 115 CO 0.08 0.21 0.21 -0.60 -1.51 0.00 0.00 177.10 175.49 1yem s ARG 116 N 0.06 3.09 -0.25 -0.60 3.52 0.24 -0.98 118.95 124.04 1yem s ARG 116 Ca -0.09 -0.90 -0.09 0.00 -0.13 0.00 0.00 55.73 54.51 1yem s ARG 116 Cb -0.15 -3.74 -0.04 0.00 -1.56 0.00 0.00 34.95 29.46 1yem s ARG 116 CO 0.06 -0.59 0.13 0.08 -0.81 0.00 0.00 175.30 174.16 1yem s VAL 117 N 1.62 4.92 0.15 7.11 1.01 0.68 -0.91 120.40 134.98 1yem s VAL 117 Ca 0.04 0.03 -0.31 0.00 0.00 0.00 0.00 61.98 61.74 1yem s VAL 117 Cb -0.18 -3.31 -0.10 0.00 0.00 0.00 0.00 36.38 32.79 1yem s VAL 117 CO 0.08 0.33 1.63 -0.70 0.00 0.00 0.00 175.10 176.43 1yem s GLU 118 N 1.39 4.19 0.00 2.72 2.12 -0.20 -1.40 118.70 127.52 1yem s GLU 118 Ca 0.06 2.41 0.00 0.00 0.36 0.00 0.00 54.97 57.80 1yem s GLU 118 Cb -0.15 -3.26 0.00 0.00 0.26 0.00 0.00 34.13 30.98 1yem s GLU 118 CO 0.06 -0.67 0.00 0.41 -0.54 0.00 0.00 175.26 174.52 1yem n GLY 119 N 3.87 0.35 0.98 -1.50 0.00 -1.26 -4.75 105.19 102.87 1yem n GLY 119 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1yem n GLY 119 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1yem n ILE 120 N -2.53 0.00 0.00 -0.61 5.41 -0.74 -5.06 119.36 115.82 1yem n ILE 120 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1yem n ILE 120 Cb 0.17 -0.52 0.00 0.00 -0.71 0.00 0.00 39.64 38.58 1yem n ILE 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1yem n GLY 121 N 2.00 0.89 3.65 7.39 0.00 -0.50 -5.01 105.19 113.61 1yem n GLY 121 Ca 0.00 -1.98 -0.34 0.00 0.00 0.00 0.00 46.02 43.70 1yem n GLY 121 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1yem s ASP 122 N -3.48 4.98 0.05 1.61 -0.00 -1.26 -0.23 116.67 118.34 1yem s ASP 122 Ca 0.00 0.02 -0.09 0.00 -0.00 0.00 0.00 52.55 52.48 1yem s ASP 122 Cb 0.00 -1.31 0.00 0.00 -0.00 0.00 0.00 42.92 41.62 1yem s ASP 122 CO 0.00 0.33 0.19 -0.36 -0.00 0.00 0.00 175.17 175.33 1yem s PHE 123 N -0.95 0.09 -0.07 4.23 0.40 -0.15 -2.29 117.98 119.24 1yem s PHE 123 Ca 0.16 -0.37 0.05 0.00 -0.60 0.00 0.00 56.93 56.16 1yem s PHE 123 Cb -0.11 -0.05 -0.01 0.00 0.51 0.00 0.00 43.02 43.36 1yem s PHE 123 CO 0.05 -0.46 -0.23 0.54 0.70 0.00 0.00 175.22 175.83 1yem s VAL 124 N -2.92 2.24 -0.23 -0.44 0.11 -0.15 -0.06 120.40 118.95 1yem s VAL 124 Ca -0.02 -0.99 -0.10 0.00 -2.93 0.00 0.00 61.98 57.94 1yem s VAL 124 Cb 0.01 -1.84 -0.05 0.00 -1.53 0.00 0.00 36.38 32.97 1yem s VAL 124 CO -0.06 0.57 0.13 -1.81 -3.33 0.00 0.00 175.10 170.60 1yem s ASP 125 N -0.06 5.94 -0.15 3.54 1.01 -0.31 -0.79 116.67 125.85 1yem s ASP 125 Ca -0.06 0.09 -0.01 0.00 0.71 0.00 0.00 52.55 53.27 1yem s ASP 125 Cb -0.15 -2.06 -0.01 0.00 1.01 0.00 0.00 42.92 41.71 1yem s ASP 125 CO 0.05 0.09 -0.12 -0.63 0.21 0.00 0.00 175.17 174.77 1yem s ILE 126 N 0.92 3.05 -0.03 0.77 1.01 -0.35 -0.88 121.20 125.69 1yem s ILE 126 Ca 0.07 -0.65 -0.12 0.00 0.00 0.00 0.00 60.65 59.95 1yem s ILE 126 Cb -0.13 -2.30 0.02 0.00 0.01 0.00 0.00 42.46 40.05 1yem s ILE 126 CO 0.03 0.50 0.26 -1.83 0.00 0.00 0.00 174.94 173.90 1yem s GLU 127 N 0.65 0.54 -0.02 2.79 1.03 -0.70 -1.06 118.70 121.92 1yem s GLU 127 Ca -0.06 -0.12 0.03 0.00 0.03 0.00 0.00 54.97 54.85 1yem s GLU 127 Cb -0.15 0.24 -0.00 0.00 -0.80 0.00 0.00 34.13 33.42 1yem s GLU 127 CO 0.03 -0.13 -0.11 0.08 -1.33 0.00 0.00 175.26 173.79 1yem s VAL 128 N -1.02 0.92 -0.54 1.83 1.01 -0.05 -1.80 120.40 120.76 1yem s VAL 128 Ca -0.11 -0.46 -0.24 0.00 0.00 0.00 0.00 61.98 61.17 1yem s VAL 128 Cb -0.05 -0.79 0.04 0.00 0.00 0.00 0.00 36.38 35.57 1yem s VAL 128 CO 0.03 0.27 0.93 -0.63 0.00 0.00 0.00 175.10 175.70 1yem s ILE 129 N 0.00 4.42 0.16 2.22 1.01 -1.26 -0.58 121.20 127.17 1yem s ILE 129 Ca -0.00 0.32 -0.22 0.00 0.00 0.00 0.00 60.65 60.74 1yem s ILE 129 Cb -0.07 -4.51 0.06 0.00 0.01 0.00 0.00 42.46 37.95 1yem s ILE 129 CO 0.00 -1.06 0.59 -0.94 0.00 0.00 0.00 174.94 173.53 1yem s SER 130 N 2.74 -0.52 -0.91 3.58 1.04 0.11 -4.98 113.70 114.76 1yem s SER 130 Ca 0.31 -0.07 -0.01 0.00 0.48 0.00 0.00 55.95 56.66 1yem s SER 130 Cb -0.12 0.60 0.34 0.00 0.10 0.00 0.00 66.02 66.93 1yem s SER 130 CO 0.20 -0.98 1.81 0.47 0.98 0.00 0.00 173.24 175.72 1yem n ASP 131 N -0.37 7.13 -2.72 7.02 9.92 -1.26 -4.34 116.55 131.93 1yem n ASP 131 Ca -0.16 -3.75 -0.05 0.00 -0.53 0.00 0.00 54.79 50.31 1yem n ASP 131 Cb 0.65 -1.06 0.03 0.00 -0.64 0.00 0.00 41.12 40.09 1yem n ASP 131 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 1yem n SER 132 N -0.26 -2.50 -0.26 -2.24 2.88 -1.26 -5.07 113.62 104.91 1yem n SER 132 Ca 0.48 -2.26 0.06 0.00 -1.33 0.00 0.00 58.87 55.81 1yem n SER 132 Cb 0.28 1.34 0.16 0.00 -0.75 0.00 0.00 64.21 65.24 1yem n SER 132 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1yem h PRO 133 N 4.34 0.10 -0.75 -1.46 0.13 -1.99 -1.82 132.00 130.56 1yem h PRO 133 Ca -0.04 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 65.03 1yem h PRO 133 Cb 1.12 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 32.20 1yem h PRO 133 CO 0.01 0.07 0.24 0.93 -0.23 0.00 0.00 178.00 179.01 1yem h GLU 134 N 0.10 1.15 -0.02 0.86 3.07 -1.99 0.11 114.58 117.87 1yem h GLU 134 Ca 0.42 -0.25 -0.02 0.00 -0.50 0.00 0.00 59.36 59.02 1yem h GLU 134 Cb 0.75 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.49 1yem h GLU 134 CO -0.68 0.98 -0.06 1.05 -1.40 0.00 0.00 179.01 178.90 1yem h GLU 135 N 1.10 0.08 -0.59 2.33 4.11 -1.93 -3.03 114.58 116.66 1yem h GLU 135 Ca 0.24 -0.06 0.01 0.00 0.07 0.00 0.00 59.36 59.63 1yem h GLU 135 Cb 0.30 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.53 1yem h GLU 135 CO -0.01 0.68 0.39 0.00 0.07 0.00 0.00 179.01 180.14 1yem h ALA 136 N 0.40 1.62 -0.08 1.06 0.00 -1.27 -1.30 119.26 119.69 1yem h ALA 136 Ca -0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1yem h ALA 136 Cb 0.68 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1yem h ALA 136 CO 0.01 0.34 -0.25 -0.22 0.00 0.00 0.00 179.25 179.13 1yem h LYS 137 N 0.76 0.15 0.15 0.00 3.64 -0.81 -2.37 116.57 118.09 1yem h LYS 137 Ca 0.22 -0.04 -0.30 0.00 -1.27 0.00 0.00 60.65 59.25 1yem h LYS 137 Cb -0.03 -0.01 0.03 0.00 -0.41 0.00 0.00 32.23 31.80 1yem h LYS 137 CO -0.05 0.40 -1.29 0.93 -2.27 0.00 0.00 179.45 177.16 1yem h GLU 138 N 0.14 0.56 -0.31 1.90 5.08 -1.16 -2.45 114.58 118.34 1yem h GLU 138 Ca 0.02 -0.81 -0.02 0.00 -1.00 0.00 0.00 59.36 57.55 1yem h GLU 138 Cb 0.52 0.28 -0.02 0.00 0.50 0.00 0.00 28.75 30.03 1yem h GLU 138 CO 0.04 1.37 0.10 -0.22 -1.00 0.00 0.00 179.01 179.29 1yem h LYS 139 N 0.23 0.44 -0.22 2.33 3.64 -1.20 -0.10 116.57 121.68 1yem h LYS 139 Ca -0.19 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 59.00 1yem h LYS 139 Cb 1.97 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 33.70 1yem h LYS 139 CO 0.24 0.39 -0.35 0.82 -2.27 0.00 0.00 179.45 178.29 1yem h ILE 140 N 0.44 1.32 -0.05 2.00 2.04 -1.43 -2.97 117.51 118.85 1yem h ILE 140 Ca 0.11 -1.55 -0.13 0.00 1.00 0.00 0.00 64.86 64.29 1yem h ILE 140 Cb 0.14 1.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.99 1yem h ILE 140 CO -0.01 0.48 -0.55 -0.50 0.00 0.00 0.00 178.15 177.58 1yem h TRP 141 N 0.32 0.19 0.28 1.37 4.06 -1.14 1.00 115.95 122.03 1yem h TRP 141 Ca 0.02 -0.07 0.00 0.00 2.06 0.00 0.00 58.89 60.91 1yem h TRP 141 Cb 0.93 -0.04 -0.03 0.00 -1.00 0.00 0.00 29.16 29.03 1yem h TRP 141 CO 0.08 0.67 -0.36 1.49 -3.56 0.00 0.00 178.44 176.76 1yem h GLU 142 N 0.12 -0.67 -0.69 0.49 4.81 -1.05 0.28 114.58 117.88 1yem h GLU 142 Ca -0.00 0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.24 1yem h GLU 142 Cb 1.01 0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.51 1yem h GLU 142 CO 0.08 -0.44 0.30 0.28 -0.73 0.00 0.00 179.01 178.50 1yem h VAL 143 N -0.69 1.24 -0.56 0.32 2.07 -1.35 -2.44 116.25 114.83 1yem h VAL 143 Ca -0.01 -0.71 -0.06 0.00 0.82 0.00 0.00 66.70 66.75 1yem h VAL 143 Cb 0.65 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 1yem h VAL 143 CO -0.11 0.29 0.13 0.00 0.02 0.00 0.00 177.57 177.90 1yem h ALA 144 N 1.14 0.74 0.10 1.67 0.00 -0.65 -1.25 119.26 121.02 1yem h ALA 144 Ca 0.23 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1yem h ALA 144 Cb 0.17 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1yem h ALA 144 CO -0.02 0.45 -0.05 1.57 0.00 0.00 0.00 179.25 181.20 1yem h LYS 145 N 0.81 -0.13 -1.00 0.00 2.10 -0.89 0.34 116.57 117.80 1yem h LYS 145 Ca 0.18 0.01 0.21 0.00 -2.00 0.00 0.00 60.65 59.05 1yem h LYS 145 Cb 0.35 0.03 -0.10 0.00 -0.90 0.00 0.00 32.23 31.61 1yem h LYS 145 CO 0.00 -0.03 0.62 1.98 -2.00 0.00 0.00 179.45 180.02 1yem h MET 146 N -0.21 0.61 -0.03 0.07 -1.53 -1.21 0.46 114.93 113.10 1yem h MET 146 Ca -0.01 -0.04 0.00 0.00 -3.44 0.00 0.00 59.70 56.21 1yem h MET 146 Cb 0.17 -0.14 0.00 0.00 -0.55 0.00 0.00 31.60 31.08 1yem h MET 146 CO 0.02 0.41 0.00 1.28 0.14 0.00 0.00 176.91 178.76 1yem n LEU 147 N -4.74 0.38 0.00 3.39 4.77 -0.49 -4.89 117.00 115.42 1yem n LEU 147 Ca 0.24 -0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 1yem n LEU 147 Cb 0.67 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 1yem n LEU 147 CO 0.22 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 1yem n GLY 148 N 0.92 0.48 3.77 -0.72 0.00 0.16 -4.95 105.19 104.85 1yem n GLY 148 Ca 0.17 -0.70 -0.39 0.00 0.00 0.00 0.00 46.02 45.10 1yem n GLY 148 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yem s LEU 149 N 0.00 4.46 0.44 0.99 1.43 0.11 -4.99 118.68 121.12 1yem s LEU 149 Ca 0.00 1.27 0.06 0.00 -1.03 0.00 0.00 54.13 54.43 1yem s LEU 149 Cb 0.00 -3.01 -0.06 0.00 0.03 0.00 0.00 46.19 43.16 1yem s LEU 149 CO 0.00 0.12 0.05 -0.54 0.23 0.00 0.00 176.35 176.21 1yem s LYS 150 N -0.40 2.07 0.30 1.70 1.02 -1.26 -3.92 119.74 119.25 1yem s LYS 150 Ca 0.32 -2.13 0.05 0.00 0.02 0.00 0.00 55.97 54.23 1yem s LYS 150 Cb -0.19 -1.68 0.74 0.00 -0.52 0.00 0.00 37.83 36.17 1yem s LYS 150 CO 0.19 -0.15 1.73 0.93 -0.92 0.00 0.00 175.35 177.13 1yem h GLU 151 N 1.58 0.54 0.00 1.68 4.39 -1.98 -0.22 114.58 120.58 1yem h GLU 151 Ca -0.44 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.23 1yem h GLU 151 Cb 1.26 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.79 1yem h GLU 151 CO 0.77 0.36 0.00 1.05 -1.16 0.00 0.00 179.01 180.03 1yem h GLU 152 N 0.56 0.00 0.00 2.33 4.11 -2.02 -2.39 114.58 117.16 1yem h GLU 152 Ca 0.57 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.92 1yem h GLU 152 Cb 1.01 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.25 1yem h GLU 152 CO -0.46 0.00 -0.47 -0.44 0.07 0.00 0.00 179.01 177.71 1yem h ASP 153 N 0.00 0.00 -2.61 3.06 3.45 -1.37 -3.47 116.42 115.47 1yem h ASP 153 Ca 0.00 0.00 -0.53 0.00 0.43 0.00 0.00 57.03 56.93 1yem h ASP 153 Cb 0.42 0.00 0.06 0.00 -0.56 0.00 0.00 39.33 39.25 1yem h ASP 153 CO 0.00 0.38 1.01 0.52 -1.57 0.00 0.00 179.24 179.58 1yem n VAL 154 N -3.15 0.03 -3.79 -1.35 0.31 -0.90 -0.16 118.33 109.31 1yem n VAL 154 Ca 0.02 -0.01 -0.37 0.00 -0.01 0.00 0.00 64.34 63.97 1yem n VAL 154 Cb 0.69 -1.97 -0.12 0.00 -0.91 0.00 0.00 33.84 31.53 1yem n VAL 154 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1yem s GLU 155 N 1.28 2.29 0.15 5.55 2.56 0.57 -4.83 118.70 126.27 1yem s GLU 155 Ca 0.76 -1.52 0.24 0.00 0.00 0.00 0.00 54.97 54.45 1yem s GLU 155 Cb -0.51 -3.47 0.28 0.00 2.00 0.00 0.00 34.13 32.42 1yem s GLU 155 CO 0.33 -0.86 1.28 -1.00 -0.56 0.00 0.00 175.26 174.44 1yem h PRO 156 N 8.10 0.00 -6.85 4.30 0.13 -1.89 -3.38 132.00 132.42 1yem h PRO 156 Ca -0.18 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.47 1yem h PRO 156 Cb 1.06 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.18 1yem h PRO 156 CO 0.64 0.00 0.38 1.03 -0.23 0.00 0.00 178.00 179.82 1yem s ARG 157 N -3.21 4.61 0.52 0.86 0.52 -1.26 -4.62 118.95 116.36 1yem s ARG 157 Ca 0.05 1.48 -0.18 0.00 -0.52 0.00 0.00 55.73 56.56 1yem s ARG 157 Cb 0.12 -2.96 -0.07 0.00 0.52 0.00 0.00 34.95 32.56 1yem s ARG 157 CO 0.73 0.27 1.03 -0.51 0.02 0.00 0.00 175.30 176.84 1yem s LEU 158 N -1.80 3.72 0.34 2.53 1.43 -1.26 -4.87 118.68 118.77 1yem s LEU 158 Ca 0.48 1.82 0.09 0.00 -1.03 0.00 0.00 54.13 55.49 1yem s LEU 158 Cb -0.23 -4.54 0.82 0.00 0.03 0.00 0.00 46.19 42.26 1yem s LEU 158 CO 0.30 -0.82 1.81 1.88 0.23 0.00 0.00 176.35 179.74 1yem h TYR 159 N 1.18 0.92 -0.53 0.29 0.99 -1.98 0.53 116.97 118.36 1yem h TYR 159 Ca -0.48 0.03 0.06 0.00 2.00 0.00 0.00 58.73 60.33 1yem h TYR 159 Cb 1.21 -0.28 -0.05 0.00 1.00 0.00 0.00 36.73 38.61 1yem h TYR 159 CO 0.59 0.24 0.25 1.25 -0.00 0.00 0.00 178.16 180.48 1yem h LEU 160 N 0.69 0.34 -0.53 3.88 5.85 -2.00 -2.64 115.31 120.89 1yem h LEU 160 Ca 0.54 0.04 -0.12 0.00 0.84 0.00 0.00 57.88 59.18 1yem h LEU 160 Cb 0.93 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.93 1yem h LEU 160 CO -0.30 0.23 -0.13 -0.33 -0.34 0.00 0.00 178.44 177.56 1yem h GLU 161 N 0.48 1.03 0.00 1.25 5.08 -1.34 -3.29 114.58 117.80 1yem h GLU 161 Ca 0.24 -0.40 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1yem h GLU 161 Cb 0.19 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1yem h GLU 161 CO -0.19 1.09 0.00 1.28 -1.00 0.00 0.00 179.01 180.18 1yem n LEU 162 N -4.14 0.00 0.00 1.33 4.77 -0.21 -5.00 117.00 113.75 1yem n LEU 162 Ca 0.01 0.39 0.10 0.00 -0.03 0.00 0.00 56.01 56.48 1yem n LEU 162 Cb 0.42 -0.39 0.60 0.00 -2.33 0.00 0.00 43.42 41.72 1yem n LEU 162 CO 0.46 -0.31 0.80 -0.38 -1.33 0.00 0.00 177.39 176.62