#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s7n s ILE 4 N 0.00 0.79 -0.22 6.31 1.01 -1.26 -1.29 121.20 126.54 1s7n s ILE 4 Ca 0.00 -0.42 -0.02 0.00 0.00 0.00 0.00 60.65 60.20 1s7n s ILE 4 Cb 0.00 -0.66 0.01 0.00 0.01 0.00 0.00 42.46 41.81 1s7n s ILE 4 CO 0.00 0.23 -0.08 -0.63 0.00 0.00 0.00 174.94 174.45 1s7n s ILE 5 N -0.21 2.93 0.55 2.92 1.01 0.47 -4.95 121.20 123.91 1s7n s ILE 5 Ca 0.03 -0.75 -0.19 0.00 0.00 0.00 0.00 60.65 59.75 1s7n s ILE 5 Cb -0.04 -2.36 -0.06 0.00 0.01 0.00 0.00 42.46 40.01 1s7n s ILE 5 CO -0.00 0.39 1.13 -2.16 0.00 0.00 0.00 174.94 174.29 1s7n s PRO 6 N 1.39 3.35 0.11 2.79 0.04 -1.26 -0.78 135.00 140.64 1s7n s PRO 6 Ca 0.04 1.60 0.00 0.00 0.04 0.00 0.00 61.00 62.68 1s7n s PRO 6 Cb -0.15 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.39 1s7n s PRO 6 CO -0.06 -0.85 0.00 0.28 0.04 0.00 0.00 177.00 176.41 1s7n n VAL 7 N -1.32 0.56 -4.05 -0.36 0.31 -0.88 -4.85 118.33 107.74 1s7n n VAL 7 Ca 0.12 0.19 -0.13 0.00 -0.01 0.00 0.00 64.34 64.50 1s7n n VAL 7 Cb 0.51 -1.22 -0.04 0.00 -0.91 0.00 0.00 33.84 32.18 1s7n n VAL 7 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1s7n s SER 8 N -5.45 0.60 0.52 4.52 1.04 -0.03 -4.92 113.70 109.97 1s7n s SER 8 Ca 0.00 -1.34 0.18 0.00 0.48 0.00 0.00 55.95 55.27 1s7n s SER 8 Cb 0.00 0.66 1.29 0.00 0.10 0.00 0.00 66.02 68.07 1s7n s SER 8 CO 0.00 -1.29 2.12 0.71 0.98 0.00 0.00 173.24 175.76 1s7n h THR 9 N 2.14 0.95 -0.00 2.02 1.35 -2.02 -2.75 112.91 114.60 1s7n h THR 9 Ca -0.28 -0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 1s7n h THR 9 Cb 1.24 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 68.61 1s7n h THR 9 CO 0.39 0.00 -0.52 0.35 -0.25 0.00 0.00 175.52 175.49 1s7n n THR 10 N -4.51 0.00 -5.17 6.82 -2.24 -1.26 -4.94 114.28 102.98 1s7n n THR 10 Ca -0.01 -0.24 -0.32 0.00 -2.27 0.00 0.00 64.05 61.22 1s7n n THR 10 Cb 0.18 1.06 -0.16 0.00 -2.10 0.00 0.00 70.33 69.31 1s7n n THR 10 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1s7n s LEU 11 N -2.39 2.24 0.10 3.22 1.43 -1.04 -0.51 118.68 121.74 1s7n s LEU 11 Ca 0.07 -0.43 -0.10 0.00 -1.03 0.00 0.00 54.13 52.65 1s7n s LEU 11 Cb 0.11 -1.42 0.00 0.00 0.03 0.00 0.00 46.19 44.91 1s7n s LEU 11 CO 0.49 0.27 0.22 -1.83 0.23 0.00 0.00 176.35 175.73 1s7n s GLU 12 N -0.32 0.91 -0.16 1.70 -1.05 -0.75 -0.85 118.70 118.17 1s7n s GLU 12 Ca 0.02 -0.96 -0.04 0.00 -0.15 0.00 0.00 54.97 53.84 1s7n s GLU 12 Cb -0.13 0.36 -0.03 0.00 -0.44 0.00 0.00 34.13 33.90 1s7n s GLU 12 CO 0.02 -0.30 -0.02 -0.51 0.95 0.00 0.00 175.26 175.40 1s7n s LEU 13 N -2.87 3.34 -0.10 1.83 1.43 0.04 -1.49 118.68 120.88 1s7n s LEU 13 Ca 0.06 -0.10 0.03 0.00 -1.03 0.00 0.00 54.13 53.10 1s7n s LEU 13 Cb 0.04 -1.81 -0.01 0.00 0.03 0.00 0.00 46.19 44.44 1s7n s LEU 13 CO -0.10 0.17 -0.20 -0.13 0.23 0.00 0.00 176.35 176.32 1s7n s ARG 14 N 0.38 3.02 0.34 1.70 0.52 -0.56 -0.39 118.95 123.96 1s7n s ARG 14 Ca -0.03 -0.81 -0.29 0.00 -0.52 0.00 0.00 55.73 54.08 1s7n s ARG 14 Cb -0.14 -2.38 -0.11 0.00 0.52 0.00 0.00 34.95 32.84 1s7n s ARG 14 CO 0.02 0.26 1.50 0.00 0.02 0.00 0.00 175.30 177.11 1s7n s ALA 15 N 0.17 3.63 0.18 2.13 0.00 -0.41 -1.58 121.76 125.88 1s7n s ALA 15 Ca -0.11 1.52 -0.33 0.00 0.00 0.00 0.00 51.96 53.04 1s7n s ALA 15 Cb -0.16 -3.61 -0.14 0.00 0.00 0.00 0.00 23.12 19.21 1s7n s ALA 15 CO 0.06 -0.97 1.43 0.00 0.00 0.00 0.00 175.76 176.28 1s7n n ALA 16 N 1.18 0.69 -2.22 0.00 0.00 -0.15 -4.83 120.51 115.18 1s7n n ALA 16 Ca 0.04 0.44 -0.10 0.00 0.00 0.00 0.00 53.44 53.82 1s7n n ALA 16 Cb 0.39 -2.24 -0.10 0.00 0.00 0.00 0.00 19.45 17.49 1s7n n ALA 16 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1s7n s ASP 17 N 0.49 0.88 0.58 0.00 -1.08 -1.26 -4.87 116.67 111.41 1s7n s ASP 17 Ca 0.75 -0.95 0.28 0.00 -0.52 0.00 0.00 52.55 52.10 1s7n s ASP 17 Cb -0.73 0.13 1.63 0.00 -1.46 0.00 0.00 42.92 42.49 1s7n s ASP 17 CO 0.45 -0.49 2.11 -0.33 0.52 0.00 0.00 175.17 177.44 1s7n h GLU 18 N 3.19 0.00 0.00 4.34 5.08 -1.94 0.42 114.58 125.67 1s7n h GLU 18 Ca -0.35 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 1s7n h GLU 18 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1s7n h GLU 18 CO 0.63 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 177.51 1s7n n SER 19 N -3.90 0.00 0.04 1.42 3.41 -1.26 -1.55 113.62 111.78 1s7n n SER 19 Ca 0.01 0.25 0.12 0.00 -0.26 0.00 0.00 58.87 59.00 1s7n n SER 19 Cb 0.30 -0.38 0.19 0.00 -0.26 0.00 0.00 64.21 64.07 1s7n n SER 19 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1s7n n HIS 20 N -1.38 0.34 -0.14 7.33 8.25 0.15 -4.42 115.22 125.35 1s7n n HIS 20 Ca 0.06 0.10 -0.04 0.00 -0.26 0.00 0.00 57.72 57.58 1s7n n HIS 20 Cb 0.15 -0.50 0.05 0.00 1.12 0.00 0.00 29.99 30.80 1s7n n HIS 20 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1s7n h VAL 21 N 0.00 0.76 -0.39 1.59 2.07 -1.38 -0.84 116.25 118.06 1s7n h VAL 21 Ca 0.00 -0.08 0.05 0.00 0.82 0.00 0.00 66.70 67.49 1s7n h VAL 21 Cb 0.66 0.51 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 1s7n h VAL 21 CO 0.00 0.04 0.12 -0.65 0.02 0.00 0.00 177.57 177.11 1s7n h PRO 22 N 0.23 0.27 -0.20 1.57 0.11 -1.80 0.14 132.00 132.32 1s7n h PRO 22 Ca 0.22 -0.02 -0.16 0.00 0.11 0.00 0.00 66.00 66.16 1s7n h PRO 22 Cb 0.28 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.32 1s7n h PRO 22 CO -0.29 0.18 -0.53 0.00 -0.21 0.00 0.00 178.00 177.15 1s7n h ALA 23 N 1.26 0.70 -0.36 -0.75 0.00 -1.80 -2.52 119.26 115.80 1s7n h ALA 23 Ca 0.18 -0.51 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 1s7n h ALA 23 Cb 0.18 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1s7n h ALA 23 CO -0.20 0.68 0.05 1.25 0.00 0.00 0.00 179.25 181.04 1s7n h LEU 24 N 0.44 0.57 -0.46 0.00 5.85 -0.75 0.63 115.31 121.59 1s7n h LEU 24 Ca 0.01 -0.26 0.02 0.00 0.84 0.00 0.00 57.88 58.49 1s7n h LEU 24 Cb 1.08 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.92 1s7n h LEU 24 CO 0.10 0.69 0.26 -0.74 -0.34 0.00 0.00 178.44 178.41 1s7n h HIS 25 N 0.43 0.49 -0.61 1.25 2.76 -0.70 0.61 115.15 119.39 1s7n h HIS 25 Ca 0.11 0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.22 1s7n h HIS 25 Cb 0.36 -0.16 -0.03 0.00 1.55 0.00 0.00 27.41 29.14 1s7n h HIS 25 CO 0.02 0.28 0.09 1.96 -1.30 0.00 0.00 177.93 178.98 1s7n h GLN 26 N 0.53 0.99 -0.81 5.26 1.08 -1.12 -2.40 115.11 118.65 1s7n h GLN 26 Ca 0.19 -0.26 -0.01 0.00 -1.45 0.00 0.00 58.65 57.12 1s7n h GLN 26 Cb 0.03 -0.12 -0.04 0.00 -0.05 0.00 0.00 27.48 27.30 1s7n h GLN 26 CO -0.10 0.92 0.47 1.25 -0.95 0.00 0.00 178.83 180.42 1s7n h LEU 27 N 0.93 1.00 -0.27 1.46 5.85 0.11 -1.39 115.31 123.00 1s7n h LEU 27 Ca 0.19 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1s7n h LEU 27 Cb 0.42 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 1s7n h LEU 27 CO 0.01 0.79 0.11 0.58 -0.34 0.00 0.00 178.44 179.60 1s7n h VAL 28 N 1.12 1.17 -0.66 1.05 2.07 -0.73 -2.43 116.25 117.84 1s7n h VAL 28 Ca 0.29 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 67.31 1s7n h VAL 28 Cb -0.00 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 1s7n h VAL 28 CO -0.05 0.17 0.42 -0.07 0.02 0.00 0.00 177.57 178.06 1s7n h LEU 29 N 0.29 0.77 -1.24 2.57 3.38 -1.00 0.30 115.31 120.38 1s7n h LEU 29 Ca 0.09 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 1s7n h LEU 29 Cb 0.16 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 1s7n h LEU 29 CO -0.01 0.57 0.44 0.50 0.09 0.00 0.00 178.44 180.03 1s7n h LYS 30 N 0.89 0.96 -0.45 1.13 3.64 -1.20 -2.72 116.57 118.81 1s7n h LYS 30 Ca 0.24 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1s7n h LYS 30 Cb -0.08 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.54 1s7n h LYS 30 CO -0.05 0.66 0.00 0.09 -2.27 0.00 0.00 179.45 177.88 1s7n n ASN 31 N -4.40 3.44 -0.11 4.20 3.02 -0.71 -4.65 115.26 116.04 1s7n n ASN 31 Ca 0.07 -1.96 -0.05 0.00 -0.03 0.00 0.00 54.58 52.61 1s7n n ASN 31 Cb 0.06 -0.30 0.02 0.00 -0.61 0.00 0.00 39.78 38.96 1s7n n ASN 31 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1s7n h LYS 32 N 3.96 0.13 -0.09 3.52 3.64 -0.10 0.35 116.57 127.98 1s7n h LYS 32 Ca 0.00 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1s7n h LYS 32 Cb 0.92 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.71 1s7n h LYS 32 CO 0.00 0.08 0.05 0.00 -2.27 0.00 0.00 179.45 177.31 1s7n h ALA 33 N 1.31 0.11 -0.36 5.00 0.00 -1.82 -1.13 119.26 122.37 1s7n h ALA 33 Ca 0.18 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1s7n h ALA 33 Cb 0.24 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1s7n h ALA 33 CO -0.29 -0.35 0.05 2.35 0.00 0.00 0.00 179.25 181.01 1s7n h TRP 34 N 0.04 0.65 -0.74 0.00 7.01 -1.80 -2.98 115.95 118.12 1s7n h TRP 34 Ca 0.03 -0.09 0.04 0.00 2.11 0.00 0.00 58.89 60.98 1s7n h TRP 34 Cb 0.09 -0.18 -0.04 0.00 -2.10 0.00 0.00 29.16 26.93 1s7n h TRP 34 CO -0.04 0.67 0.49 -0.07 -2.79 0.00 0.00 178.44 176.69 1s7n h LEU 35 N 0.44 0.74 -2.66 0.65 3.38 -0.14 -2.36 115.31 115.37 1s7n h LEU 35 Ca 0.11 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1s7n h LEU 35 Cb 0.38 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 1s7n h LEU 35 CO 0.01 0.50 0.02 1.56 0.09 0.00 0.00 178.44 180.62 1s7n h GLN 36 N 0.86 0.00 0.00 1.13 4.20 -1.04 0.71 115.11 120.96 1s7n h GLN 36 Ca 0.30 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.01 1s7n h GLN 36 Cb 0.12 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.90 1s7n h GLN 36 CO -0.09 0.00 0.00 1.96 -0.67 0.00 0.00 178.83 180.03 1s7n h GLN 37 N 0.00 0.00 0.00 1.46 4.20 -1.49 -3.30 115.11 115.98 1s7n h GLN 37 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1s7n h GLN 37 Cb 0.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.83 1s7n h GLN 37 CO -0.00 0.00 -0.81 0.43 -0.67 0.00 0.00 178.83 177.78 1s7n n SER 38 N -3.01 4.06 -4.26 1.46 7.64 -0.36 -5.07 113.62 114.09 1s7n n SER 38 Ca -0.01 0.00 -0.21 0.00 1.01 0.00 0.00 58.87 59.66 1s7n n SER 38 Cb 0.20 0.63 -0.12 0.00 -1.01 0.00 0.00 64.21 63.91 1s7n n SER 38 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1s7n s LEU 39 N -2.89 2.35 -0.03 -3.43 1.43 0.10 -5.03 118.68 111.18 1s7n s LEU 39 Ca 0.00 -0.74 0.17 0.00 -1.03 0.00 0.00 54.13 52.53 1s7n s LEU 39 Cb 0.00 -0.71 -0.20 0.00 0.03 0.00 0.00 46.19 45.31 1s7n s LEU 39 CO 0.00 -0.04 0.58 -0.67 0.23 0.00 0.00 176.35 176.45 1s7n n ASP 40 N 0.83 0.56 0.12 2.29 2.03 -1.26 -4.06 116.55 117.06 1s7n n ASP 40 Ca -0.18 0.25 0.02 0.00 0.52 0.00 0.00 54.79 55.40 1s7n n ASP 40 Cb 0.55 0.53 0.37 0.00 -0.72 0.00 0.00 41.12 41.85 1s7n n ASP 40 CO 0.00 0.00 0.00 4.11 -1.92 0.00 0.00 177.20 179.39 1s7n h TRP 41 N 0.00 0.24 -0.98 -0.67 5.08 -1.96 -3.32 115.95 114.34 1s7n h TRP 41 Ca -0.26 -0.03 0.32 0.00 1.08 0.00 0.00 58.89 60.00 1s7n h TRP 41 Cb 1.75 -0.06 -0.16 0.00 -3.00 0.00 0.00 29.16 27.69 1s7n h TRP 41 CO 0.00 0.40 0.47 -1.35 -1.28 0.00 0.00 178.44 176.68 1s7n h PRO 42 N 0.21 0.22 0.00 0.12 0.11 -1.91 0.33 132.00 131.08 1s7n h PRO 42 Ca 0.04 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 1s7n h PRO 42 Cb 0.45 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.51 1s7n h PRO 42 CO 0.03 0.15 -0.07 -0.56 -0.21 0.00 0.00 178.00 177.34 1s7n h GLN 43 N 0.23 0.00 -0.13 1.05 3.07 -1.89 -2.35 115.11 115.09 1s7n h GLN 43 Ca 0.71 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.45 1s7n h GLN 43 Cb 1.64 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.20 1s7n h GLN 43 CO -0.66 0.07 0.00 0.66 0.09 0.00 0.00 178.83 178.99 1s7n n TYR 44 N -3.75 0.16 -2.74 0.06 4.01 0.11 -4.76 117.16 110.25 1s7n n TYR 44 Ca -0.02 -0.08 -0.42 0.00 -0.16 0.00 0.00 57.90 57.21 1s7n n TYR 44 Cb 0.17 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.16 1s7n n TYR 44 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1s7n s VAL 45 N -1.84 4.17 -0.00 -0.72 1.01 -0.89 -4.80 120.40 117.34 1s7n s VAL 45 Ca 0.31 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.51 1s7n s VAL 45 Cb 0.16 -4.69 -0.00 0.00 0.00 0.00 0.00 36.38 31.85 1s7n s VAL 45 CO 0.25 -1.40 0.00 0.35 0.00 0.00 0.00 175.10 174.29 1s7n n THR 46 N 6.23 0.01 -4.11 3.92 -2.24 -1.26 -4.99 114.28 111.84 1s7n n THR 46 Ca 0.01 -0.01 -0.14 0.00 -2.27 0.00 0.00 64.05 61.64 1s7n n THR 46 Cb 0.47 -0.93 -0.12 0.00 -2.10 0.00 0.00 70.33 67.66 1s7n n THR 46 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1s7n s SER 47 N -3.16 0.91 0.30 3.42 1.04 -1.26 -5.03 113.70 109.92 1s7n s SER 47 Ca -0.00 -0.44 -0.01 0.00 0.48 0.00 0.00 55.95 55.98 1s7n s SER 47 Cb 0.00 -0.00 0.45 0.00 0.10 0.00 0.00 66.02 66.57 1s7n s SER 47 CO 0.01 -0.12 1.89 -0.61 0.98 0.00 0.00 173.24 175.38 1s7n h GLN 48 N 4.86 0.87 -0.72 4.02 4.15 -1.98 -1.85 115.11 124.47 1s7n h GLN 48 Ca -0.34 -0.13 0.00 0.00 0.77 0.00 0.00 58.65 58.95 1s7n h GLN 48 Cb 1.20 -0.16 -0.04 0.00 0.21 0.00 0.00 27.48 28.69 1s7n h GLN 48 CO 0.43 0.70 0.46 1.49 -1.93 0.00 0.00 178.83 179.98 1s7n h GLU 49 N 0.87 0.96 -0.26 1.69 4.57 -1.99 0.28 114.58 120.69 1s7n h GLU 49 Ca 0.21 -0.07 -0.14 0.00 -1.18 0.00 0.00 59.36 58.19 1s7n h GLU 49 Cb 0.14 -0.21 -0.00 0.00 -0.16 0.00 0.00 28.75 28.52 1s7n h GLU 49 CO -0.02 0.65 -0.37 0.93 -1.18 0.00 0.00 179.01 179.02 1s7n h GLU 50 N 0.98 0.71 -0.87 1.92 4.39 -1.78 -0.91 114.58 119.02 1s7n h GLU 50 Ca 0.26 -0.41 0.04 0.00 0.34 0.00 0.00 59.36 59.59 1s7n h GLU 50 Cb -0.08 0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 28.55 1s7n h GLU 50 CO -0.05 1.03 0.55 1.15 -1.16 0.00 0.00 179.01 180.53 1s7n h THR 51 N 0.44 1.12 -0.78 1.13 2.02 -0.77 -0.72 112.91 115.34 1s7n h THR 51 Ca 0.03 -0.36 -0.02 0.00 0.77 0.00 0.00 66.41 66.82 1s7n h THR 51 Cb 0.95 -0.04 -0.04 0.00 -1.74 0.00 0.00 68.15 67.29 1s7n h THR 51 CO 0.09 0.19 0.40 -0.09 0.37 0.00 0.00 175.52 176.47 1s7n h ARG 52 N 1.06 1.11 -0.13 6.66 2.43 0.07 -1.01 114.38 124.57 1s7n h ARG 52 Ca 0.35 -0.14 0.05 0.00 -0.81 0.00 0.00 59.98 59.43 1s7n h ARG 52 Cb 0.04 -0.21 -0.06 0.00 -0.42 0.00 0.00 29.97 29.32 1s7n h ARG 52 CO -0.13 0.84 -0.28 0.87 -1.51 0.00 0.00 179.97 179.76 1s7n h LYS 53 N 1.11 -0.33 -0.44 0.20 6.56 0.08 0.86 116.57 124.60 1s7n h LYS 53 Ca 0.27 0.02 0.02 0.00 -1.06 0.00 0.00 60.65 59.90 1s7n h LYS 53 Cb 0.08 0.08 -0.03 0.00 -0.57 0.00 0.00 32.23 31.79 1s7n h LYS 53 CO -0.04 -0.22 0.27 0.45 -2.06 0.00 0.00 179.45 177.84 1s7n h HIS 54 N -0.35 0.50 -0.51 -1.35 3.86 -0.79 -2.07 115.15 114.44 1s7n h HIS 54 Ca 0.10 0.01 -0.09 0.00 -1.16 0.00 0.00 60.37 59.23 1s7n h HIS 54 Cb 0.50 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 28.79 1s7n h HIS 54 CO -0.37 0.29 -0.05 0.28 0.86 0.00 0.00 177.93 178.95 1s7n h VAL 55 N 0.54 1.26 -0.66 2.45 2.07 -0.57 -1.31 116.25 120.03 1s7n h VAL 55 Ca 0.17 -1.14 -0.01 0.00 0.82 0.00 0.00 66.70 66.55 1s7n h VAL 55 Cb -0.00 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 1s7n h VAL 55 CO -0.07 0.40 0.37 1.56 0.02 0.00 0.00 177.57 179.85 1s7n h GLN 56 N 0.82 0.91 -0.55 1.57 4.20 -0.57 0.37 115.11 121.86 1s7n h GLN 56 Ca 0.15 -0.10 -0.10 0.00 0.06 0.00 0.00 58.65 58.66 1s7n h GLN 56 Cb 0.55 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.13 1s7n h GLN 56 CO 0.03 0.67 -0.05 0.78 -0.67 0.00 0.00 178.83 179.60 1s7n h GLY 57 N 0.90 1.06 1.43 3.46 0.00 -1.07 -2.50 103.07 106.35 1s7n h GLY 57 Ca 0.23 -0.80 -0.03 0.00 0.00 0.00 0.00 47.33 46.73 1s7n h GLY 57 CO -0.04 0.73 0.17 3.43 0.00 0.00 0.00 176.54 180.83 1s7n h ASN 58 N 0.89 0.67 -0.47 0.19 -0.26 -0.78 -2.18 115.58 113.64 1s7n h ASN 58 Ca 0.15 -0.09 -0.07 0.00 -0.56 0.00 0.00 56.30 55.73 1s7n h ASN 58 Cb 0.59 -0.17 -0.02 0.00 -1.06 0.00 0.00 38.32 37.65 1s7n h ASN 58 CO 0.04 0.63 0.06 0.40 -1.06 0.00 0.00 177.43 177.50 1s7n h ILE 59 N 0.72 1.24 -0.33 2.81 2.04 -0.50 -0.91 117.51 122.58 1s7n h ILE 59 Ca 0.17 -0.95 -0.03 0.00 1.00 0.00 0.00 64.86 65.05 1s7n h ILE 59 Cb 0.20 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 1s7n h ILE 59 CO -0.01 0.35 0.09 -0.07 0.00 0.00 0.00 178.15 178.50 1s7n h LEU 60 N 0.81 0.49 -0.72 1.44 3.38 -1.12 -1.58 115.31 118.01 1s7n h LEU 60 Ca 0.16 -0.22 0.11 0.00 0.09 0.00 0.00 57.88 58.02 1s7n h LEU 60 Cb 0.40 -0.13 -0.08 0.00 0.09 0.00 0.00 40.66 40.94 1s7n h LEU 60 CO 0.01 0.59 0.33 -0.07 0.09 0.00 0.00 178.44 179.39 1s7n h LEU 61 N 0.37 0.40 -0.47 1.67 3.38 -0.98 -0.72 115.31 118.97 1s7n h LEU 61 Ca 0.10 0.08 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 1s7n h LEU 61 Cb 0.28 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1s7n h LEU 61 CO -0.00 0.21 0.10 -0.74 0.09 0.00 0.00 178.44 178.11 1s7n h HIS 62 N 0.55 0.80 -0.35 1.13 2.76 -0.89 -0.65 115.15 118.50 1s7n h HIS 62 Ca 0.37 -0.10 -0.11 0.00 -2.20 0.00 0.00 60.37 58.33 1s7n h HIS 62 Cb 0.45 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 29.17 1s7n h HIS 62 CO -0.13 0.73 -0.22 1.96 -1.30 0.00 0.00 177.93 178.98 1s7n h GLN 63 N 0.63 0.68 -0.00 5.26 1.08 -0.67 -2.73 115.11 119.36 1s7n h GLN 63 Ca 0.15 -0.26 0.00 0.00 -1.45 0.00 0.00 58.65 57.09 1s7n h GLN 63 Cb 0.34 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.73 1s7n h GLN 63 CO 0.00 0.84 -0.06 0.54 -0.95 0.00 0.00 178.83 179.21 1s7n n ARG 64 N -4.12 0.22 -1.02 1.46 1.74 -0.33 -4.92 116.66 109.68 1s7n n ARG 64 Ca 0.00 -0.03 -0.01 0.00 -0.77 0.00 0.00 57.85 57.05 1s7n n ARG 64 Cb 0.41 -1.50 -0.00 0.00 -1.02 0.00 0.00 32.46 30.35 1s7n n ARG 64 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1s7n n GLY 65 N 1.41 0.44 0.30 -0.13 0.00 -0.49 -4.93 105.19 101.78 1s7n n GLY 65 Ca 0.10 -1.00 0.11 0.00 0.00 0.00 0.00 46.02 45.23 1s7n n GLY 65 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1s7n n TYR 66 N -2.98 0.00 -3.81 1.61 4.01 -0.37 -4.78 117.16 110.84 1s7n n TYR 66 Ca -0.01 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.69 1s7n n TYR 66 Cb 0.02 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 1s7n n TYR 66 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1s7n s ALA 67 N -2.66 -1.44 -0.05 -0.72 0.00 -1.17 -1.59 121.76 114.13 1s7n s ALA 67 Ca 0.15 -0.20 -0.10 0.00 0.00 0.00 0.00 51.96 51.82 1s7n s ALA 67 Cb 0.18 0.70 0.02 0.00 0.00 0.00 0.00 23.12 24.02 1s7n s ALA 67 CO 0.66 -1.04 0.23 0.15 0.00 0.00 0.00 175.76 175.77 1s7n s LYS 68 N -2.88 0.44 -0.19 0.00 -0.14 -0.30 -3.49 119.74 113.17 1s7n s LYS 68 Ca 0.15 0.01 -0.03 0.00 -1.36 0.00 0.00 55.97 54.75 1s7n s LYS 68 Cb -0.03 0.20 0.06 0.00 -1.68 0.00 0.00 37.83 36.38 1s7n s LYS 68 CO 0.05 -0.09 0.04 1.41 -0.76 0.00 0.00 175.35 176.00 1s7n s MET 69 N -0.63 0.62 0.16 1.68 -2.45 -1.26 -0.96 119.30 116.45 1s7n s MET 69 Ca -0.07 -0.40 0.09 0.00 -1.25 0.00 0.00 55.69 54.06 1s7n s MET 69 Cb -0.04 -2.09 -0.04 0.00 1.25 0.00 0.00 34.83 33.91 1s7n s MET 69 CO 0.02 -0.64 -0.14 0.71 1.05 0.00 0.00 175.02 176.02 1s7n s TYR 70 N 1.87 2.57 -0.15 4.11 2.02 -0.18 -0.97 117.35 126.63 1s7n s TYR 70 Ca -0.01 -0.25 -0.03 0.00 -0.37 0.00 0.00 57.07 56.42 1s7n s TYR 70 Cb -0.17 -1.30 -0.03 0.00 -0.40 0.00 0.00 41.96 40.07 1s7n s TYR 70 CO -0.08 0.47 -0.05 -0.51 -1.57 0.00 0.00 175.55 173.81 1s7n s LEU 71 N -2.55 3.19 -0.15 -1.29 1.43 -0.61 -1.19 118.68 117.51 1s7n s LEU 71 Ca 0.22 -0.14 -0.22 0.00 -1.03 0.00 0.00 54.13 52.96 1s7n s LEU 71 Cb -0.09 -1.76 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 1s7n s LEU 71 CO 0.13 0.18 0.65 -0.63 0.23 0.00 0.00 176.35 176.92 1s7n s ILE 72 N 0.27 5.03 -0.11 -0.59 1.01 0.44 -1.49 121.20 125.76 1s7n s ILE 72 Ca -0.04 1.28 0.01 0.00 0.00 0.00 0.00 60.65 61.90 1s7n s ILE 72 Cb -0.14 -3.98 -0.02 0.00 0.01 0.00 0.00 42.46 38.33 1s7n s ILE 72 CO 0.03 0.17 -0.14 -0.36 0.00 0.00 0.00 174.94 174.64 1s7n s PHE 73 N 1.45 2.76 -0.22 3.97 0.40 -0.55 0.19 117.98 125.99 1s7n s PHE 73 Ca 0.32 -0.58 -0.01 0.00 -0.60 0.00 0.00 56.93 56.06 1s7n s PHE 73 Cb -0.16 -1.79 0.01 0.00 0.51 0.00 0.00 43.02 41.60 1s7n s PHE 73 CO 0.13 -0.15 -0.10 0.00 0.70 0.00 0.00 175.22 175.80 1s7n n GLN 75 N 4.69 -2.44 -0.98 0.00 6.02 0.34 0.11 117.38 125.11 1s7n n GLN 75 Ca -0.18 0.30 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 1s7n n GLN 75 Cb 0.49 -4.70 0.00 0.00 1.02 0.00 0.00 30.24 27.05 1s7n n GLN 75 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1s7n n ASN 76 N -2.72 -3.47 -4.53 1.08 4.05 -1.26 -4.99 115.26 103.42 1s7n n ASN 76 Ca -0.05 0.00 -0.36 0.00 0.45 0.00 0.00 54.58 54.62 1s7n n ASN 76 Cb 0.55 -1.43 -0.11 0.00 1.23 0.00 0.00 39.78 40.02 1s7n n ASN 76 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 177.26 173.51 1s7n s GLU 77 N -0.63 3.79 0.05 1.20 2.12 0.30 -5.07 118.70 120.46 1s7n s GLU 77 Ca 0.00 -0.42 -0.30 0.00 0.36 0.00 0.00 54.97 54.60 1s7n s GLU 77 Cb 0.00 -3.27 -0.08 0.00 0.26 0.00 0.00 34.13 31.04 1s7n s GLU 77 CO 0.00 0.02 1.80 1.41 -0.54 0.00 0.00 175.26 177.94 1s7n s MET 78 N 1.06 4.16 -0.00 4.30 -2.45 -1.26 0.34 119.30 125.44 1s7n s MET 78 Ca 0.04 2.46 0.04 0.00 -1.25 0.00 0.00 55.69 56.98 1s7n s MET 78 Cb -0.14 -3.85 -0.05 0.00 1.25 0.00 0.00 34.83 32.03 1s7n s MET 78 CO 0.03 -0.85 0.11 0.00 1.05 0.00 0.00 175.02 175.36 1s7n n ALA 79 N 6.53 2.28 0.00 4.11 0.00 0.13 -4.90 120.51 128.66 1s7n n ALA 79 Ca 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1s7n n ALA 79 Cb 0.41 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.72 1s7n n ALA 79 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s7n n GLY 80 N 1.80 -1.32 3.03 0.00 0.00 -1.20 -0.62 105.19 106.88 1s7n n GLY 80 Ca -0.00 -0.94 -0.20 0.00 0.00 0.00 0.00 46.02 44.89 1s7n n GLY 80 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s7n s VAL 81 N -2.85 0.78 -0.08 1.61 1.01 0.38 -0.42 120.40 120.83 1s7n s VAL 81 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 61.58 1s7n s VAL 81 Cb 0.00 -0.67 0.02 0.00 0.00 0.00 0.00 36.38 35.73 1s7n s VAL 81 CO 0.00 0.23 -0.06 -0.22 0.00 0.00 0.00 175.10 175.04 1s7n s LEU 82 N -0.10 1.21 0.12 3.92 2.96 -0.33 -1.90 118.68 124.55 1s7n s LEU 82 Ca 0.02 -0.22 0.01 0.00 -0.22 0.00 0.00 54.13 53.71 1s7n s LEU 82 Cb -0.05 -0.67 -0.04 0.00 0.50 0.00 0.00 46.19 45.92 1s7n s LEU 82 CO -0.00 -0.08 -0.01 -0.44 -1.32 0.00 0.00 176.35 174.49 1s7n s SER 83 N 1.34 0.84 -0.51 3.68 0.01 0.81 -1.01 113.70 118.86 1s7n s SER 83 Ca -0.03 -1.09 -0.14 0.00 1.31 0.00 0.00 55.95 56.00 1s7n s SER 83 Cb -0.14 0.17 0.12 0.00 0.21 0.00 0.00 66.02 66.38 1s7n s SER 83 CO -0.03 -0.58 0.44 -0.36 0.41 0.00 0.00 173.24 173.12 1s7n s PHE 84 N -3.79 3.30 0.53 2.43 0.08 -0.13 -0.28 117.98 120.12 1s7n s PHE 84 Ca 0.17 -1.44 0.24 0.00 0.12 0.00 0.00 56.93 56.02 1s7n s PHE 84 Cb 0.07 -3.62 1.37 0.00 -0.57 0.00 0.00 43.02 40.26 1s7n s PHE 84 CO -0.02 -0.99 2.02 -0.91 -0.10 0.00 0.00 175.22 175.22 1s7n h ASN 85 N 8.73 0.01 -4.46 1.36 -0.26 -0.68 -0.79 115.58 119.48 1s7n h ASN 85 Ca -0.27 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 55.44 1s7n h ASN 85 Cb 1.09 -0.00 -0.21 0.00 -1.06 0.00 0.00 38.32 38.14 1s7n h ASN 85 CO 0.96 0.01 0.22 0.00 -1.06 0.00 0.00 177.43 177.56 1s7n s ALA 86 N -5.04 -1.80 -0.08 -0.83 0.00 -1.22 -4.84 121.76 107.95 1s7n s ALA 86 Ca -0.05 1.62 0.03 0.00 0.00 0.00 0.00 51.96 53.55 1s7n s ALA 86 Cb 0.19 -0.55 0.01 0.00 0.00 0.00 0.00 23.12 22.77 1s7n s ALA 86 CO 0.72 -0.35 -0.15 0.42 0.00 0.00 0.00 175.76 176.41 1s7n s ILE 87 N -0.57 1.38 -0.64 0.00 1.01 -0.62 -0.46 121.20 121.30 1s7n s ILE 87 Ca -0.06 -0.61 -0.12 0.00 0.00 0.00 0.00 60.65 59.86 1s7n s ILE 87 Cb -0.02 -1.24 0.17 0.00 0.01 0.00 0.00 42.46 41.37 1s7n s ILE 87 CO 0.05 0.41 0.56 -1.61 0.00 0.00 0.00 174.94 174.35 1s7n s GLU 88 N 0.65 3.06 0.21 2.79 2.02 0.82 -4.78 118.70 123.48 1s7n s GLU 88 Ca -0.14 -2.10 -0.15 0.00 0.02 0.00 0.00 54.97 52.60 1s7n s GLU 88 Cb -0.16 -4.20 0.24 0.00 0.10 0.00 0.00 34.13 30.10 1s7n s GLU 88 CO 0.04 -1.27 1.61 -1.35 0.02 0.00 0.00 175.26 174.31 1s7n h PRO 89 N 8.16 -0.04 -0.57 0.39 0.11 -1.87 0.27 132.00 138.44 1s7n h PRO 89 Ca -0.09 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.91 1s7n h PRO 89 Cb 1.05 0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 1s7n h PRO 89 CO 0.86 -0.03 -0.06 0.82 -0.21 0.00 0.00 178.00 179.38 1s7n h ILE 90 N -0.05 1.27 0.00 4.15 2.04 -1.94 -2.53 117.51 120.45 1s7n h ILE 90 Ca 0.31 -1.21 0.00 0.00 1.00 0.00 0.00 64.86 64.95 1s7n h ILE 90 Cb 0.53 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 1s7n h ILE 90 CO -0.71 0.44 0.00 0.59 0.00 0.00 0.00 178.15 178.46 1s7n n ASN 91 N -4.17 0.34 -3.70 1.72 3.02 -0.98 -4.92 115.26 106.57 1s7n n ASN 91 Ca 0.02 0.54 -0.23 0.00 -0.03 0.00 0.00 54.58 54.88 1s7n n ASN 91 Cb 0.38 -0.63 0.04 0.00 -0.61 0.00 0.00 39.78 38.96 1s7n n ASN 91 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1s7n n LYS 92 N -1.83 -5.42 -4.90 3.52 5.02 0.05 -4.78 118.16 109.83 1s7n n LYS 92 Ca 0.06 0.66 -0.27 0.00 -2.02 0.00 0.00 58.31 56.74 1s7n n LYS 92 Cb 0.36 -5.36 -0.15 0.00 -0.02 0.00 0.00 35.03 29.86 1s7n n LYS 92 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1s7n s ALA 93 N -3.54 1.74 0.01 7.82 0.00 -1.12 -0.83 121.76 125.84 1s7n s ALA 93 Ca 0.16 -0.95 0.02 0.00 0.00 0.00 0.00 51.96 51.19 1s7n s ALA 93 Cb -0.08 -0.41 -0.01 0.00 0.00 0.00 0.00 23.12 22.62 1s7n s ALA 93 CO 0.80 0.42 -0.05 0.00 0.00 0.00 0.00 175.76 176.92 1s7n s ALA 94 N -0.59 0.41 -0.21 0.00 0.00 -0.21 -0.13 121.76 121.04 1s7n s ALA 94 Ca 0.08 -0.40 -0.10 0.00 0.00 0.00 0.00 51.96 51.54 1s7n s ALA 94 Cb -0.08 -0.03 -0.05 0.00 0.00 0.00 0.00 23.12 22.95 1s7n s ALA 94 CO 0.00 0.04 0.15 0.71 0.00 0.00 0.00 175.76 176.65 1s7n s TYR 95 N -0.60 3.38 -0.10 0.00 2.02 0.39 -0.59 117.35 121.85 1s7n s TYR 95 Ca -0.03 0.30 -0.10 0.00 -0.37 0.00 0.00 57.07 56.87 1s7n s TYR 95 Cb -0.05 -2.20 -0.05 0.00 -0.40 0.00 0.00 41.96 39.26 1s7n s TYR 95 CO -0.00 0.21 0.22 0.42 -1.57 0.00 0.00 175.55 174.83 1s7n s ILE 96 N 0.60 5.37 0.04 2.71 1.01 0.45 -0.05 121.20 131.34 1s7n s ILE 96 Ca 0.08 0.39 0.06 0.00 0.00 0.00 0.00 60.65 61.18 1s7n s ILE 96 Cb -0.12 -3.50 -0.02 0.00 0.01 0.00 0.00 42.46 38.83 1s7n s ILE 96 CO 0.00 0.58 -0.17 -0.83 0.00 0.00 0.00 174.94 174.53 1s7n s GLY 97 N -0.84 0.94 0.15 6.18 0.00 0.62 -4.53 107.32 109.83 1s7n s GLY 97 Ca 0.17 -0.94 -0.24 0.00 0.00 0.00 0.00 44.72 43.71 1s7n s GLY 97 CO 0.06 -0.90 0.67 -2.52 0.00 0.00 0.00 173.10 170.41 1s7n s TYR 98 N -0.85 -0.46 -0.18 1.90 -0.85 -1.26 -0.14 117.35 115.52 1s7n s TYR 98 Ca 0.04 0.23 -0.29 0.00 -0.52 0.00 0.00 57.07 56.53 1s7n s TYR 98 Cb -0.08 0.58 0.12 0.00 0.38 0.00 0.00 41.96 42.95 1s7n s TYR 98 CO 0.02 -0.85 0.95 1.67 -1.52 0.00 0.00 175.55 175.81 1s7n s TRP 99 N -3.67 -0.45 0.02 -3.49 1.48 -0.80 -5.01 118.94 107.03 1s7n s TRP 99 Ca 0.03 0.88 0.08 0.00 -1.06 0.00 0.00 56.10 56.03 1s7n s TRP 99 Cb -0.02 0.42 -0.03 0.00 -1.16 0.00 0.00 33.47 32.68 1s7n s TRP 99 CO -0.10 -0.36 -0.22 -0.51 -4.06 0.00 0.00 176.95 171.70 1s7n s LEU 100 N -0.75 2.34 0.24 -4.66 1.43 -1.26 -0.47 118.68 115.55 1s7n s LEU 100 Ca -0.02 -0.48 -0.31 0.00 -1.03 0.00 0.00 54.13 52.30 1s7n s LEU 100 Cb -0.02 -1.40 -0.14 0.00 0.03 0.00 0.00 46.19 44.66 1s7n s LEU 100 CO 0.01 0.28 1.19 -0.67 0.23 0.00 0.00 176.35 177.39 1s7n n ASP 101 N 1.88 1.80 0.03 2.29 -0.08 0.21 -4.82 116.55 117.86 1s7n n ASP 101 Ca -0.17 1.16 0.22 0.00 -1.51 0.00 0.00 54.79 54.49 1s7n n ASP 101 Cb 0.52 -1.31 0.73 0.00 2.34 0.00 0.00 41.12 43.39 1s7n n ASP 101 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 1s7n h GLU 102 N 3.11 0.00 -0.01 -0.67 4.81 -1.95 0.24 114.58 120.11 1s7n h GLU 102 Ca -0.43 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 1s7n h GLU 102 Cb 1.32 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.70 1s7n h GLU 102 CO 0.68 0.00 -0.27 -1.13 -0.73 0.00 0.00 179.01 177.56 1s7n n SER 103 N -3.83 0.87 -0.71 1.04 3.41 -1.26 -3.47 113.62 109.67 1s7n n SER 103 Ca 0.10 -0.75 0.11 0.00 -0.26 0.00 0.00 58.87 58.07 1s7n n SER 103 Cb 0.71 0.12 0.32 0.00 -0.26 0.00 0.00 64.21 65.09 1s7n n SER 103 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1s7n n PHE 104 N -0.81 0.29 -1.46 7.33 3.01 0.07 -4.95 117.46 120.95 1s7n n PHE 104 Ca 0.12 -0.15 -0.31 0.00 1.01 0.00 0.00 57.45 58.12 1s7n n PHE 104 Cb 0.34 0.00 0.07 0.00 -0.01 0.00 0.00 39.48 39.87 1s7n n PHE 104 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 1s7n s GLN 105 N -1.71 2.69 -0.13 -1.08 -0.21 -1.23 -4.08 119.66 113.92 1s7n s GLN 105 Ca 0.33 1.03 0.00 0.00 0.02 0.00 0.00 55.36 56.75 1s7n s GLN 105 Cb 0.18 -1.96 0.00 0.00 1.00 0.00 0.00 33.01 32.24 1s7n s GLN 105 CO 0.27 -1.30 0.00 0.41 -2.12 0.00 0.00 175.29 172.55 1s7n n GLY 106 N -1.71 0.49 0.50 3.09 0.00 -1.26 -4.90 105.19 101.41 1s7n n GLY 106 Ca 0.08 -0.30 0.05 0.00 0.00 0.00 0.00 46.02 45.85 1s7n n GLY 106 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1s7n n GLN 107 N -2.50 2.22 -1.68 1.61 6.02 -1.26 -4.95 117.38 116.84 1s7n n GLN 107 Ca -0.01 -1.74 -0.15 0.00 -0.01 0.00 0.00 57.00 55.09 1s7n n GLN 107 Cb 0.10 -1.22 -0.05 0.00 1.02 0.00 0.00 30.24 30.09 1s7n n GLN 107 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1s7n n GLY 108 N 0.41 1.06 0.24 1.08 0.00 -1.26 -4.91 105.19 101.81 1s7n n GLY 108 Ca 0.09 -0.27 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 1s7n n GLY 108 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1s7n h ILE 109 N 0.00 1.26 -0.13 -0.61 2.04 -1.92 -1.36 117.51 116.79 1s7n h ILE 109 Ca -0.33 -1.05 -0.06 0.00 1.00 0.00 0.00 64.86 64.42 1s7n h ILE 109 Cb 1.08 1.06 -0.00 0.00 -0.74 0.00 0.00 36.82 38.22 1s7n h ILE 109 CO 0.46 0.36 -0.14 -0.03 0.00 0.00 0.00 178.15 178.80 1s7n h MET 110 N 0.63 0.32 -0.41 2.37 4.05 -1.92 -0.84 114.93 119.14 1s7n h MET 110 Ca 0.13 -0.17 0.03 0.00 -0.28 0.00 0.00 59.70 59.40 1s7n h MET 110 Cb 0.50 0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 31.27 1s7n h MET 110 CO 0.02 0.73 0.20 0.77 0.23 0.00 0.00 176.91 178.86 1s7n h SER 111 N -0.06 0.28 -0.49 1.39 0.02 -1.96 0.29 113.55 113.03 1s7n h SER 111 Ca 0.02 0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 60.95 1s7n h SER 111 Cb 0.67 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 1s7n h SER 111 CO 0.03 0.20 0.12 1.56 -1.14 0.00 0.00 176.83 177.61 1s7n h GLN 112 N 0.40 0.78 -0.83 3.45 4.20 -1.22 -0.59 115.11 121.30 1s7n h GLN 112 Ca 0.18 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 1s7n h GLN 112 Cb 0.09 -0.10 -0.04 0.00 0.30 0.00 0.00 27.48 27.73 1s7n h GLN 112 CO -0.13 0.75 0.49 0.77 -0.67 0.00 0.00 178.83 180.05 1s7n h SER 113 N 0.66 1.00 -0.62 1.46 0.02 -0.55 -1.55 113.55 113.98 1s7n h SER 113 Ca 0.15 -0.07 -0.07 0.00 -0.84 0.00 0.00 61.79 60.96 1s7n h SER 113 Cb 0.32 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.58 1s7n h SER 113 CO 0.00 0.78 0.12 0.25 -1.14 0.00 0.00 176.83 176.84 1s7n h LEU 114 N 1.14 0.98 -0.25 5.07 5.85 -0.16 0.14 115.31 128.07 1s7n h LEU 114 Ca 0.30 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 1s7n h LEU 114 Cb -0.03 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.73 1s7n h LEU 114 CO -0.05 0.97 0.09 -0.61 -0.34 0.00 0.00 178.44 178.50 1s7n h GLN 115 N 0.97 0.39 -0.43 1.25 5.75 -0.70 0.56 115.11 122.90 1s7n h GLN 115 Ca 0.20 -0.07 -0.04 0.00 -0.15 0.00 0.00 58.65 58.59 1s7n h GLN 115 Cb 0.40 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.87 1s7n h GLN 115 CO 0.01 0.43 0.13 0.00 -2.65 0.00 0.00 178.83 176.75 1s7n h ALA 116 N 0.93 0.57 -0.47 3.38 0.00 -0.99 -2.19 119.26 120.48 1s7n h ALA 116 Ca 0.08 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 1s7n h ALA 116 Cb 0.20 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1s7n h ALA 116 CO -0.01 0.23 -0.02 1.25 0.00 0.00 0.00 179.25 180.70 1s7n h LEU 117 N 0.56 0.77 -0.28 0.00 5.85 -0.39 -2.29 115.31 119.53 1s7n h LEU 117 Ca 0.14 -0.20 -0.14 0.00 0.84 0.00 0.00 57.88 58.52 1s7n h LEU 117 Cb 0.28 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 1s7n h LEU 117 CO -0.00 0.86 -0.36 0.24 -0.34 0.00 0.00 178.44 178.83 1s7n h MET 118 N 0.74 0.74 -0.85 1.25 2.86 -0.73 -2.59 114.93 116.35 1s7n h MET 118 Ca 0.14 -0.42 -0.01 0.00 -2.06 0.00 0.00 59.70 57.34 1s7n h MET 118 Cb 0.49 0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.14 1s7n h MET 118 CO 0.02 1.05 0.47 1.15 1.06 0.00 0.00 176.91 180.66 1s7n h THR 119 N 0.49 1.25 -0.27 2.22 2.02 -1.34 0.17 112.91 117.45 1s7n h THR 119 Ca 0.03 -0.60 -0.02 0.00 0.77 0.00 0.00 66.41 66.59 1s7n h THR 119 Cb 0.95 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 1s7n h THR 119 CO 0.09 0.27 0.07 -0.74 0.37 0.00 0.00 175.52 175.58 1s7n h HIS 120 N 1.18 0.44 -0.01 3.16 6.17 -1.35 0.20 115.15 124.94 1s7n h HIS 120 Ca 0.30 -0.05 -0.13 0.00 0.71 0.00 0.00 60.37 61.20 1s7n h HIS 120 Cb 0.02 -0.13 -0.02 0.00 2.52 0.00 0.00 27.41 29.80 1s7n h HIS 120 CO 0.00 0.50 -0.59 1.88 0.71 0.00 0.00 177.93 180.43 1s7n h TYR 121 N 0.26 0.06 -0.17 5.26 0.05 -1.08 -0.55 116.97 120.80 1s7n h TYR 121 Ca 0.08 -0.02 -0.15 0.00 0.05 0.00 0.00 58.73 58.70 1s7n h TYR 121 Cb 0.27 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 37.99 1s7n h TYR 121 CO 0.01 0.62 -0.51 0.00 -1.05 0.00 0.00 178.16 177.23 1s7n h ALA 122 N 1.38 0.80 -0.02 3.88 0.00 -0.32 -1.68 119.26 123.30 1s7n h ALA 122 Ca -0.01 -0.49 -0.15 0.00 0.00 0.00 0.00 54.91 54.27 1s7n h ALA 122 Cb 1.05 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1s7n h ALA 122 CO 0.08 0.68 -0.66 0.00 0.00 0.00 0.00 179.25 179.34 1s7n h ARG 123 N 0.36 0.10 -0.02 0.00 3.08 -0.21 -1.98 114.38 115.71 1s7n h ARG 123 Ca 0.01 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 59.92 1s7n h ARG 123 Cb 1.03 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.08 1s7n h ARG 123 CO 0.09 0.72 -0.32 0.00 -1.07 0.00 0.00 179.97 179.40 1s7n h ARG 124 N 0.07 0.03 0.00 0.04 3.08 -0.88 -3.47 114.38 113.24 1s7n h ARG 124 Ca -0.01 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1s7n h ARG 124 Cb 1.18 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.23 1s7n h ARG 124 CO 0.09 0.35 0.00 0.41 -1.07 0.00 0.00 179.97 179.75 1s7n n GLY 125 N -0.59 0.81 0.00 0.04 0.00 -0.65 -4.93 105.19 99.86 1s7n n GLY 125 Ca -0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.12 1s7n n GLY 125 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1s7n n ASP 126 N 0.00 0.56 -3.78 1.61 5.68 -1.22 -4.82 116.55 114.58 1s7n n ASP 126 Ca 0.00 -0.33 -0.18 0.00 -0.50 0.00 0.00 54.79 53.77 1s7n n ASP 126 Cb 0.00 0.33 -0.17 0.00 -1.14 0.00 0.00 41.12 40.15 1s7n n ASP 126 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 1s7n s ILE 127 N -3.00 0.13 0.00 2.12 1.01 -1.23 -4.52 121.20 115.71 1s7n s ILE 127 Ca 0.11 0.17 0.00 0.00 0.00 0.00 0.00 60.65 60.92 1s7n s ILE 127 Cb 0.17 -0.27 0.00 0.00 0.01 0.00 0.00 42.46 42.37 1s7n s ILE 127 CO 0.72 0.16 0.00 -2.11 0.00 0.00 0.00 174.94 173.71 1s7n n ARG 128 N 4.52 0.92 -3.92 2.79 1.85 -0.08 -3.50 116.66 119.23 1s7n n ARG 128 Ca -0.19 0.00 -0.35 0.00 -1.00 0.00 0.00 57.85 56.31 1s7n n ARG 128 Cb 0.50 -0.99 -0.14 0.00 -1.05 0.00 0.00 32.46 30.79 1s7n n ARG 128 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 1s7n s ARG 129 N -1.95 2.77 -0.15 2.89 3.52 -0.01 -0.26 118.95 125.76 1s7n s ARG 129 Ca 0.00 -1.04 -0.03 0.00 -0.13 0.00 0.00 55.73 54.53 1s7n s ARG 129 Cb 0.00 -3.09 -0.03 0.00 -1.56 0.00 0.00 34.95 30.27 1s7n s ARG 129 CO 0.00 -0.46 -0.04 -0.06 -0.81 0.00 0.00 175.30 173.92 1s7n s PHE 130 N 1.33 3.01 0.01 5.12 0.08 -0.25 -1.04 117.98 126.23 1s7n s PHE 130 Ca -0.01 -0.28 0.07 0.00 0.12 0.00 0.00 56.93 56.83 1s7n s PHE 130 Cb -0.17 -1.93 -0.02 0.00 -0.57 0.00 0.00 43.02 40.33 1s7n s PHE 130 CO -0.03 -0.01 -0.21 0.08 -0.10 0.00 0.00 175.22 174.96 1s7n s VAL 131 N 0.24 1.64 -0.13 -0.44 1.01 0.24 -1.81 120.40 121.16 1s7n s VAL 131 Ca -0.03 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 60.95 1s7n s VAL 131 Cb -0.14 -1.39 0.02 0.00 0.00 0.00 0.00 36.38 34.87 1s7n s VAL 131 CO 0.03 0.36 -0.12 -0.63 0.00 0.00 0.00 175.10 174.74 1s7n s ILE 132 N -0.61 1.35 -0.16 2.22 1.01 -0.08 -0.41 121.20 124.52 1s7n s ILE 132 Ca 0.08 -0.50 -0.04 0.00 0.00 0.00 0.00 60.65 60.18 1s7n s ILE 132 Cb -0.08 -1.29 -0.03 0.00 0.01 0.00 0.00 42.46 41.07 1s7n s ILE 132 CO 0.00 0.42 -0.03 -0.54 0.00 0.00 0.00 174.94 174.79 1s7n s LYS 133 N 1.47 3.69 -0.14 2.79 1.02 -1.26 -0.34 119.74 126.97 1s7n s LYS 133 Ca 0.03 -0.51 -0.14 0.00 0.02 0.00 0.00 55.97 55.37 1s7n s LYS 133 Cb -0.13 -2.95 0.04 0.00 -0.52 0.00 0.00 37.83 34.27 1s7n s LYS 133 CO -0.08 0.23 0.40 0.00 -0.92 0.00 0.00 175.35 174.98 1s7n n ARG 135 N 2.78 0.83 -0.29 0.00 1.74 -1.26 -0.61 116.66 119.84 1s7n n ARG 135 Ca -0.14 0.29 0.10 0.00 -0.77 0.00 0.00 57.85 57.34 1s7n n ARG 135 Cb 0.57 -1.57 0.34 0.00 -1.02 0.00 0.00 32.46 30.78 1s7n n ARG 135 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1s7n h VAL 136 N 1.84 0.86 -0.85 1.55 2.07 -1.54 -1.64 116.25 118.55 1s7n h VAL 136 Ca -0.37 -0.27 -0.35 0.00 0.82 0.00 0.00 66.70 66.53 1s7n h VAL 136 Cb 1.38 0.02 -0.21 0.00 -1.52 0.00 0.00 31.29 30.95 1s7n h VAL 136 CO 0.61 0.14 0.44 -0.90 0.02 0.00 0.00 177.57 177.88 1s7n n ASP 137 N -4.58 4.29 -4.36 0.57 5.68 -1.26 -4.66 116.55 112.23 1s7n n ASP 137 Ca 0.18 -3.42 -0.46 0.00 -0.50 0.00 0.00 54.79 50.59 1s7n n ASP 137 Cb 0.43 -0.79 -0.03 0.00 -1.14 0.00 0.00 41.12 39.59 1s7n n ASP 137 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 1s7n s ASN 138 N -1.20 6.58 0.13 -1.12 3.84 -0.62 -4.90 114.94 117.65 1s7n s ASN 138 Ca 0.56 -2.24 -0.19 0.00 0.21 0.00 0.00 52.86 51.20 1s7n s ASN 138 Cb 0.46 -2.27 -0.04 0.00 -0.55 0.00 0.00 41.25 38.85 1s7n s ASN 138 CO 0.12 -0.81 1.78 1.56 -2.79 0.00 0.00 177.10 176.96 1s7n h GLN 139 N 8.37 0.29 -0.21 0.43 4.20 -1.86 -2.26 115.11 124.08 1s7n h GLN 139 Ca 0.01 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 1s7n h GLN 139 Cb 1.05 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.75 1s7n h GLN 139 CO 0.92 0.19 0.02 0.00 -0.67 0.00 0.00 178.83 179.30 1s7n h ALA 140 N 1.11 1.65 -0.06 3.87 0.00 -1.98 -1.79 119.26 122.06 1s7n h ALA 140 Ca 0.10 -0.11 -0.21 0.00 0.00 0.00 0.00 54.91 54.68 1s7n h ALA 140 Cb -0.00 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.70 1s7n h ALA 140 CO -0.05 0.27 -0.79 1.03 0.00 0.00 0.00 179.25 179.71 1s7n h SER 141 N 0.30 0.79 -0.88 0.00 0.87 -1.91 -2.21 113.55 110.51 1s7n h SER 141 Ca 0.07 -0.70 0.04 0.00 -1.23 0.00 0.00 61.79 59.97 1s7n h SER 141 Cb 0.17 -0.24 -0.05 0.00 -0.44 0.00 0.00 62.40 61.84 1s7n h SER 141 CO 0.00 1.38 0.57 0.78 -0.53 0.00 0.00 176.83 179.03 1s7n h ASN 142 N 0.28 0.94 -0.90 6.23 2.35 -1.19 -1.11 115.58 122.18 1s7n h ASN 142 Ca -0.08 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.65 1s7n h ASN 142 Cb 1.45 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 39.57 1s7n h ASN 142 CO 0.16 0.64 0.53 0.00 -1.65 0.00 0.00 177.43 177.11 1s7n h ALA 143 N 1.37 1.15 -0.19 -0.83 0.00 -1.26 -1.40 119.26 118.09 1s7n h ALA 143 Ca 0.35 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.17 1s7n h ALA 143 Cb 0.01 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 1s7n h ALA 143 CO -0.12 0.62 0.07 0.28 0.00 0.00 0.00 179.25 180.10 1s7n h VAL 144 N 1.24 0.96 -0.23 0.00 2.07 -0.60 -0.06 116.25 119.65 1s7n h VAL 144 Ca 0.32 -0.06 0.03 0.00 0.82 0.00 0.00 66.70 67.81 1s7n h VAL 144 Cb -0.02 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 1s7n h VAL 144 CO -0.06 0.03 0.06 0.00 0.02 0.00 0.00 177.57 177.62 1s7n h ALA 145 N 1.11 0.24 -0.14 1.67 0.00 -0.77 -2.26 119.26 119.12 1s7n h ALA 145 Ca 0.08 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1s7n h ALA 145 Cb 0.04 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1s7n h ALA 145 CO -0.08 -0.36 0.03 0.00 0.00 0.00 0.00 179.25 178.84 1s7n h ARG 146 N 0.16 0.23 -0.50 0.00 3.08 -1.10 -1.80 114.38 114.45 1s7n h ARG 146 Ca 0.10 -0.06 0.14 0.00 0.07 0.00 0.00 59.98 60.24 1s7n h ARG 146 Cb 0.08 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 1s7n h ARG 146 CO -0.12 0.39 0.36 -0.09 -1.07 0.00 0.00 179.97 179.44 1s7n h ARG 147 N 0.02 0.00 -0.61 0.04 2.43 -0.95 -0.93 114.38 114.38 1s7n h ARG 147 Ca 0.04 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1s7n h ARG 147 Cb 0.27 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 1s7n h ARG 147 CO 0.00 0.00 0.00 0.09 -1.51 0.00 0.00 179.97 178.55 1s7n n ASN 148 N -4.38 5.48 -2.12 -3.80 3.02 -0.85 -4.93 115.26 107.69 1s7n n ASN 148 Ca 0.09 -2.87 -0.18 0.00 -0.03 0.00 0.00 54.58 51.58 1s7n n ASN 148 Cb 0.58 -0.68 -0.00 0.00 -0.61 0.00 0.00 39.78 39.07 1s7n n ASN 148 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1s7n n HIS 149 N 0.60 -0.96 -2.88 3.10 8.25 -0.35 -5.00 115.22 117.99 1s7n n HIS 149 Ca 0.26 0.05 -0.36 0.00 -0.26 0.00 0.00 57.72 57.42 1s7n n HIS 149 Cb 1.15 -3.62 -0.06 0.00 1.12 0.00 0.00 29.99 28.57 1s7n n HIS 149 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1s7n s PHE 150 N -2.92 3.58 -0.16 4.41 0.40 -0.73 -4.79 117.98 117.77 1s7n s PHE 150 Ca 0.03 1.63 -0.08 0.00 -0.60 0.00 0.00 56.93 57.91 1s7n s PHE 150 Cb -0.01 -2.82 -0.04 0.00 0.51 0.00 0.00 43.02 40.65 1s7n s PHE 150 CO 0.04 0.16 0.12 0.99 0.70 0.00 0.00 175.22 177.23 1s7n s THR 151 N -1.74 5.34 -0.11 0.64 2.01 0.26 -4.62 115.64 117.43 1s7n s THR 151 Ca 0.51 0.16 -0.30 0.00 0.31 0.00 0.00 61.69 62.37 1s7n s THR 151 Cb -0.16 -3.38 -0.03 0.00 0.01 0.00 0.00 72.50 68.95 1s7n s THR 151 CO 0.21 0.53 1.37 -0.22 -0.69 0.00 0.00 174.62 175.82 1s7n s LEU 152 N -0.32 4.24 -0.08 4.42 2.96 -1.26 -0.94 118.68 127.70 1s7n s LEU 152 Ca 0.11 1.90 0.20 0.00 -0.22 0.00 0.00 54.13 56.11 1s7n s LEU 152 Cb -0.12 -3.54 -0.30 0.00 0.50 0.00 0.00 46.19 42.74 1s7n s LEU 152 CO 0.01 -0.78 0.33 -0.62 -1.32 0.00 0.00 176.35 173.97 1s7n n GLU 153 N 6.46 0.70 0.00 1.98 1.02 0.16 -4.98 120.64 125.98 1s7n n GLU 153 Ca 0.14 -0.13 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 1s7n n GLU 153 Cb 0.44 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.37 1s7n n GLU 153 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1s7n n GLY 154 N 1.48 -0.03 3.04 0.62 0.00 -1.19 -5.00 105.19 104.11 1s7n n GLY 154 Ca -0.13 -1.03 -0.29 0.00 0.00 0.00 0.00 46.02 44.58 1s7n n GLY 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s7n s MET 156 N 1.15 3.21 0.14 0.00 -1.94 0.27 -4.89 119.30 117.24 1s7n s MET 156 Ca -0.03 -0.53 -0.32 0.00 -1.71 0.00 0.00 55.69 53.11 1s7n s MET 156 Cb -0.14 -3.96 -0.11 0.00 2.01 0.00 0.00 34.83 32.63 1s7n s MET 156 CO -0.04 -0.94 1.81 1.17 -0.01 0.00 0.00 175.02 177.00 1s7n n LYS 157 N 5.99 2.77 -4.27 2.03 4.81 -1.26 -1.20 118.16 127.02 1s7n n LYS 157 Ca -0.04 1.01 -0.35 0.00 -0.87 0.00 0.00 58.31 58.06 1s7n n LYS 157 Cb 0.48 -2.89 -0.05 0.00 0.02 0.00 0.00 35.03 32.59 1s7n n LYS 157 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1s7n n GLN 158 N 5.24 -2.23 0.17 1.64 6.02 -1.23 -4.82 117.38 122.17 1s7n n GLN 158 Ca 0.18 0.28 0.08 0.00 -0.01 0.00 0.00 57.00 57.53 1s7n n GLN 158 Cb 0.36 -4.64 0.09 0.00 1.02 0.00 0.00 30.24 27.07 1s7n n GLN 158 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1s7n h ALA 159 N 0.87 0.81 -3.33 -1.58 0.00 -0.97 -3.41 119.26 111.64 1s7n h ALA 159 Ca -0.61 -0.18 -0.56 0.00 0.00 0.00 0.00 54.91 53.55 1s7n h ALA 159 Cb 1.39 -0.00 -0.34 0.00 0.00 0.00 0.00 17.79 18.83 1s7n h ALA 159 CO 0.77 0.23 -0.83 -2.00 0.00 0.00 0.00 179.25 177.42 1s7n s GLU 160 N -3.15 2.07 -0.15 0.00 2.12 -0.78 -4.94 118.70 113.87 1s7n s GLU 160 Ca 0.04 -0.52 -0.29 0.00 0.36 0.00 0.00 54.97 54.56 1s7n s GLU 160 Cb 0.07 -1.72 -0.01 0.00 0.26 0.00 0.00 34.13 32.73 1s7n s GLU 160 CO 0.72 -0.01 1.09 -0.47 -0.54 0.00 0.00 175.26 176.05 1s7n s TYR 161 N 0.82 3.29 -0.15 5.30 5.04 -1.26 -0.23 117.35 130.15 1s7n s TYR 161 Ca -0.11 1.39 -0.06 0.00 -2.44 0.00 0.00 57.07 55.85 1s7n s TYR 161 Cb -0.16 -3.31 0.07 0.00 0.35 0.00 0.00 41.96 38.92 1s7n s TYR 161 CO 0.01 -0.74 0.33 -1.17 -1.34 0.00 0.00 175.55 172.64 1s7n s LEU 162 N 2.73 -0.33 -1.01 6.97 0.20 -0.21 -4.79 118.68 122.24 1s7n s LEU 162 Ca 0.49 0.75 -0.15 0.00 0.69 0.00 0.00 54.13 55.91 1s7n s LEU 162 Cb -0.19 0.98 0.00 0.00 -0.43 0.00 0.00 46.19 46.56 1s7n s LEU 162 CO 0.14 -0.23 0.72 0.59 -0.29 0.00 0.00 176.35 177.28 1s7n n ASN 163 N 5.16 -5.44 0.00 3.68 3.02 -1.26 -2.39 115.26 118.03 1s7n n ASN 163 Ca -0.10 -0.90 0.00 0.00 -0.03 0.00 0.00 54.58 53.54 1s7n n ASN 163 Cb 0.50 -3.02 0.00 0.00 -0.61 0.00 0.00 39.78 36.66 1s7n n ASN 163 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1s7n n GLY 164 N -1.74 0.19 3.30 7.41 0.00 -1.26 -4.97 105.19 108.12 1s7n n GLY 164 Ca -0.14 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.72 1s7n n GLY 164 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1s7n s ASP 165 N -2.11 1.16 -0.14 1.61 -1.08 -1.01 -5.15 116.67 109.96 1s7n s ASP 165 Ca 0.00 -1.47 -0.02 0.00 -0.52 0.00 0.00 52.55 50.54 1s7n s ASP 165 Cb 0.00 0.31 -0.02 0.00 -1.46 0.00 0.00 42.92 41.75 1s7n s ASP 165 CO 0.00 -0.83 -0.08 -0.31 0.52 0.00 0.00 175.17 174.47 1s7n s TYR 166 N -3.76 2.93 0.11 -5.34 2.02 -1.26 -1.04 117.35 111.00 1s7n s TYR 166 Ca 0.37 -0.42 0.10 0.00 -0.37 0.00 0.00 57.07 56.75 1s7n s TYR 166 Cb 0.06 -1.89 -0.04 0.00 -0.40 0.00 0.00 41.96 39.70 1s7n s TYR 166 CO 0.15 -0.08 -0.23 -1.01 -1.57 0.00 0.00 175.55 172.81 1s7n s HIS 167 N 0.26 2.40 0.38 2.71 3.76 0.68 -4.79 115.29 120.69 1s7n s HIS 167 Ca -0.06 -0.34 -0.25 0.00 -0.15 0.00 0.00 55.06 54.26 1s7n s HIS 167 Cb -0.15 -1.31 -0.09 0.00 1.11 0.00 0.00 32.58 32.14 1s7n s HIS 167 CO 0.04 0.33 1.11 -0.51 -0.85 0.00 0.00 174.74 174.85 1s7n s ASP 168 N -1.95 6.73 -0.10 1.40 1.01 -1.26 -0.92 116.67 121.58 1s7n s ASP 168 Ca 0.15 2.20 0.02 0.00 0.71 0.00 0.00 52.55 55.62 1s7n s ASP 168 Cb -0.10 -2.60 0.02 0.00 1.01 0.00 0.00 42.92 41.24 1s7n s ASP 168 CO 0.07 -0.52 -0.14 -0.69 0.21 0.00 0.00 175.17 174.10 1s7n s VAL 169 N -1.48 1.41 0.25 -1.27 1.01 -0.34 -1.32 120.40 118.65 1s7n s VAL 169 Ca 0.56 -0.59 -0.26 0.00 0.00 0.00 0.00 61.98 61.69 1s7n s VAL 169 Cb -0.27 -1.30 -0.09 0.00 0.00 0.00 0.00 36.38 34.72 1s7n s VAL 169 CO 0.34 0.42 0.87 0.20 0.00 0.00 0.00 175.10 176.94 1s7n s ASN 170 N 1.02 7.39 -0.23 3.32 0.01 0.22 0.95 114.94 127.62 1s7n s ASN 170 Ca -0.06 1.76 -0.03 0.00 -0.71 0.00 0.00 52.86 53.82 1s7n s ASN 170 Cb -0.15 -2.55 0.01 0.00 0.41 0.00 0.00 41.25 38.97 1s7n s ASN 170 CO -0.02 0.07 -0.06 -0.32 -1.51 0.00 0.00 177.10 175.26 1s7n s MET 171 N -1.61 3.17 0.19 -0.60 -2.45 -0.08 -1.44 119.30 116.48 1s7n s MET 171 Ca 0.43 -0.76 0.09 0.00 -1.25 0.00 0.00 55.69 54.21 1s7n s MET 171 Cb -0.21 -2.98 -0.04 0.00 1.25 0.00 0.00 34.83 32.85 1s7n s MET 171 CO 0.26 -0.27 -0.07 0.71 1.05 0.00 0.00 175.02 176.70 1s7n s TYR 172 N 1.42 2.66 0.10 4.11 1.51 0.54 0.39 117.35 128.09 1s7n s TYR 172 Ca 0.04 -0.21 -0.17 0.00 -1.01 0.00 0.00 57.07 55.72 1s7n s TYR 172 Cb -0.15 -1.29 0.04 0.00 -0.11 0.00 0.00 41.96 40.45 1s7n s TYR 172 CO -0.04 0.53 0.41 0.00 -1.11 0.00 0.00 175.55 175.33 1s7n s ALA 173 N -1.78 -0.97 -0.11 3.71 0.00 -0.12 -0.90 121.76 121.59 1s7n s ALA 173 Ca 0.26 0.07 -0.07 0.00 0.00 0.00 0.00 51.96 52.22 1s7n s ALA 173 Cb -0.09 0.59 0.04 0.00 0.00 0.00 0.00 23.12 23.66 1s7n s ALA 173 CO 0.16 -0.59 0.27 0.50 0.00 0.00 0.00 175.76 176.11 1s7n s ARG 174 N -3.39 0.27 -0.16 0.00 3.52 -0.75 0.88 118.95 119.32 1s7n s ARG 174 Ca 0.00 0.49 -0.03 0.00 -0.13 0.00 0.00 55.73 56.06 1s7n s ARG 174 Cb 0.01 0.01 -0.02 0.00 -1.56 0.00 0.00 34.95 33.39 1s7n s ARG 174 CO -0.09 -0.11 -0.07 0.42 -0.81 0.00 0.00 175.30 174.65 1s7n s ILE 175 N 0.77 3.55 -0.13 4.11 1.01 -1.26 -1.09 121.20 128.16 1s7n s ILE 175 Ca -0.05 -0.47 -0.01 0.00 0.00 0.00 0.00 60.65 60.12 1s7n s ILE 175 Cb -0.06 -2.55 0.03 0.00 0.01 0.00 0.00 42.46 39.89 1s7n s ILE 175 CO -0.05 0.49 -0.05 -0.63 0.00 0.00 0.00 174.94 174.70 1s7n s ILE 176 N 0.55 0.96 -0.14 2.92 1.01 0.64 -5.02 121.20 122.12 1s7n s ILE 176 Ca -0.05 -0.37 0.00 0.00 0.00 0.00 0.00 60.65 60.24 1s7n s ILE 176 Cb -0.15 -1.07 -0.01 0.00 0.01 0.00 0.00 42.46 41.25 1s7n s ILE 176 CO 0.03 0.25 -0.15 -1.81 0.00 0.00 0.00 174.94 173.26 1s7n s ASP 177 N 1.72 3.76 0.00 3.58 1.01 -1.26 -4.49 116.67 120.99 1s7n s ASP 177 Ca 0.03 -0.41 0.28 0.00 0.71 0.00 0.00 52.55 53.16 1s7n s ASP 177 Cb -0.14 -1.57 1.10 0.00 1.01 0.00 0.00 42.92 43.33 1s7n s ASP 177 CO -0.08 0.13 1.77 0.00 0.21 0.00 0.00 175.17 177.21