#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 0.81 -0.31 6.31 1.01 -1.26 -0.74 121.20 127.02 1s7n s ILE 4 Ca 0.00 -0.28 -0.08 0.00 0.00 0.00 0.00 60.65 60.29 1s7n s ILE 4 Cb 0.00 -0.78 0.01 0.00 0.01 0.00 0.00 42.46 41.69 1s7n s ILE 4 CO 0.00 0.29 0.12 -0.63 0.00 0.00 0.00 174.94 174.72 1s7n s ILE 5 N 0.87 4.26 0.56 2.92 1.01 0.08 -4.97 121.20 125.93 1s7n s ILE 5 Ca -0.12 -0.65 -0.21 0.00 0.00 0.00 0.00 60.65 59.68 1s7n s ILE 5 Cb -0.15 -3.23 -0.04 0.00 0.01 0.00 0.00 42.46 39.05 1s7n s ILE 5 CO 0.01 0.01 1.27 -2.84 0.00 0.00 0.00 174.94 173.39 1s7n s PRO 6 N 1.54 3.14 0.11 2.79 0.02 -1.26 -0.82 135.00 140.51 1s7n s PRO 6 Ca 0.03 2.00 0.00 0.00 0.02 0.00 0.00 61.00 63.05 1s7n s PRO 6 Cb -0.18 -2.13 0.00 0.00 0.02 0.00 0.00 34.50 32.21 1s7n s PRO 6 CO 0.04 -1.12 0.00 0.28 -0.33 0.00 0.00 177.00 175.88 1s7n n VAL 7 N -1.20 0.64 -3.83 3.83 0.31 -0.92 -4.83 118.33 112.33 1s7n n VAL 7 Ca 0.11 0.21 -0.10 0.00 -0.01 0.00 0.00 64.34 64.56 1s7n n VAL 7 Cb 0.47 -1.28 -0.01 0.00 -0.91 0.00 0.00 33.84 32.12 1s7n n VAL 7 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1s7n n SER 8 N -3.31 -1.26 0.29 4.52 3.41 -0.54 -4.93 113.62 111.80 1s7n n SER 8 Ca 0.00 -2.37 0.18 0.00 -0.26 0.00 0.00 58.87 56.42 1s7n n SER 8 Cb 0.11 2.24 0.85 0.00 -0.26 0.00 0.00 64.21 67.14 1s7n n SER 8 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1s7n h THR 9 N 1.77 0.11 0.00 6.66 1.35 -2.02 -2.86 112.91 117.91 1s7n h THR 9 Ca -0.22 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 65.25 1s7n h THR 9 Cb 0.92 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 1s7n h THR 9 CO 0.29 0.03 -0.62 0.35 -0.25 0.00 0.00 175.52 175.32 1s7n n THR 10 N -3.18 0.00 -4.39 6.82 -2.24 -1.26 -4.91 114.28 105.12 1s7n n THR 10 Ca -0.01 -0.28 -0.28 0.00 -2.27 0.00 0.00 64.05 61.22 1s7n n THR 10 Cb 0.23 0.85 -0.13 0.00 -2.10 0.00 0.00 70.33 69.18 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 -2.66 2.31 -0.02 3.22 1.43 -1.08 -0.12 118.68 121.75 1s7n s LEU 11 Ca 0.02 -0.72 -0.25 0.00 -1.03 0.00 0.00 54.13 52.14 1s7n s LEU 11 Cb 0.06 -1.12 0.06 0.00 0.03 0.00 0.00 46.19 45.22 1s7n s LEU 11 CO 0.36 0.15 0.56 -1.83 0.23 0.00 0.00 176.35 175.82 1s7n s GLU 12 N -1.97 0.98 -0.13 1.70 -1.05 -0.62 -1.46 118.70 116.15 1s7n s GLU 12 Ca 0.12 0.04 -0.11 0.00 -0.15 0.00 0.00 54.97 54.87 1s7n s GLU 12 Cb -0.10 0.45 -0.05 0.00 -0.44 0.00 0.00 34.13 34.00 1s7n s GLU 12 CO 0.05 -0.31 0.22 -0.51 0.95 0.00 0.00 175.26 175.66 1s7n s LEU 13 N -1.43 4.32 -0.08 1.83 1.43 -0.01 -1.14 118.68 123.60 1s7n s LEU 13 Ca -0.10 0.51 0.02 0.00 -1.03 0.00 0.00 54.13 53.53 1s7n s LEU 13 Cb -0.01 -2.24 0.01 0.00 0.03 0.00 0.00 46.19 43.98 1s7n s LEU 13 CO 0.06 0.26 -0.14 -0.13 0.23 0.00 0.00 176.35 176.62 1s7n s ARG 14 N -0.30 1.96 0.29 1.70 0.52 -0.35 -0.74 118.95 122.03 1s7n s ARG 14 Ca 0.15 -0.49 -0.29 0.00 -0.52 0.00 0.00 55.73 54.58 1s7n s ARG 14 Cb -0.13 -1.63 -0.13 0.00 0.52 0.00 0.00 34.95 33.58 1s7n s ARG 14 CO 0.04 0.00 1.20 0.00 0.02 0.00 0.00 175.30 176.56 1s7n n ALA 15 N 3.95 0.52 -1.76 2.13 0.00 0.08 -0.82 120.51 124.61 1s7n n ALA 15 Ca -0.21 0.39 -0.39 0.00 0.00 0.00 0.00 53.44 53.24 1s7n n ALA 15 Cb 0.52 -2.15 0.01 0.00 0.00 0.00 0.00 19.45 17.82 1s7n n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1s7n s ALA 16 N -0.81 3.09 0.17 0.00 0.00 -0.09 -4.75 121.76 119.37 1s7n s ALA 16 Ca 0.61 1.19 -0.13 0.00 0.00 0.00 0.00 51.96 53.63 1s7n s ALA 16 Cb -0.66 -3.48 0.01 0.00 0.00 0.00 0.00 23.12 18.99 1s7n s ALA 16 CO 0.58 -0.93 0.38 0.16 0.00 0.00 0.00 175.76 175.96 1s7n s ASP 17 N -0.93 -0.09 0.41 0.00 1.47 -1.26 -4.87 116.67 111.40 1s7n s ASP 17 Ca 0.62 -0.69 0.15 0.00 1.18 0.00 0.00 52.55 53.81 1s7n s ASP 17 Cb -0.36 0.49 1.02 0.00 -0.34 0.00 0.00 42.92 43.72 1s7n s ASP 17 CO 0.45 -0.95 1.89 -0.33 0.68 0.00 0.00 175.17 176.91 1s7n h GLU 18 N 2.40 0.45 0.00 2.11 5.08 -1.95 -0.15 114.58 122.53 1s7n h GLU 18 Ca -0.31 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 1s7n h GLU 18 Cb 1.24 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1s7n h GLU 18 CO 0.44 0.30 0.00 0.66 -1.00 0.00 0.00 179.01 179.41 1s7n h SER 19 N 0.47 0.00 1.71 1.42 4.64 -2.00 -2.29 113.55 117.49 1s7n h SER 19 Ca 0.42 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.69 1s7n h SER 19 Cb 0.93 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.02 1s7n h SER 19 CO -0.16 0.00 -0.29 0.45 -0.87 0.00 0.00 176.83 175.96 1s7n h HIS 20 N 0.00 0.00 -0.93 4.77 3.86 -1.43 -3.40 115.15 118.02 1s7n h HIS 20 Ca 0.00 0.00 0.13 0.00 -1.16 0.00 0.00 60.37 59.34 1s7n h HIS 20 Cb 0.16 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 28.49 1s7n h HIS 20 CO 0.00 0.25 -0.43 0.28 0.86 0.00 0.00 177.93 178.89 1s7n h VAL 21 N 0.00 0.02 -0.11 2.45 2.07 -1.51 -1.16 116.25 118.00 1s7n h VAL 21 Ca -0.01 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.54 1s7n h VAL 21 Cb 1.19 0.02 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 1s7n h VAL 21 CO 0.03 0.00 -0.07 -0.65 0.02 0.00 0.00 177.57 176.91 1s7n h PRO 22 N -0.03 -0.06 -0.48 1.57 0.11 -1.82 0.25 132.00 131.53 1s7n h PRO 22 Ca 0.29 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.33 1s7n h PRO 22 Cb 0.55 0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.66 1s7n h PRO 22 CO -0.93 -0.04 0.02 0.00 -0.21 0.00 0.00 178.00 176.84 1s7n h ALA 23 N 1.04 0.64 -0.32 -0.75 0.00 -1.70 -1.19 119.26 116.98 1s7n h ALA 23 Ca 0.07 -0.27 0.05 0.00 0.00 0.00 0.00 54.91 54.76 1s7n h ALA 23 Cb 0.16 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1s7n h ALA 23 CO -0.15 0.42 0.02 1.25 0.00 0.00 0.00 179.25 180.79 1s7n h LEU 24 N 0.69 -0.08 -0.06 0.00 5.85 -0.98 0.48 115.31 121.21 1s7n h LEU 24 Ca 0.14 0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.94 1s7n h LEU 24 Cb 0.48 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 1s7n h LEU 24 CO 0.02 -0.00 -0.06 -0.74 -0.34 0.00 0.00 178.44 177.32 1s7n h HIS 25 N 0.12 -0.13 -0.75 1.25 2.76 -0.28 0.24 115.15 118.36 1s7n h HIS 25 Ca 0.15 0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.34 1s7n h HIS 25 Cb 0.19 0.07 -0.04 0.00 1.55 0.00 0.00 27.41 29.18 1s7n h HIS 25 CO -0.21 -0.09 0.49 1.96 -1.30 0.00 0.00 177.93 178.78 1s7n h GLN 26 N -0.07 0.99 -0.68 5.26 1.08 -0.59 -0.80 115.11 120.31 1s7n h GLN 26 Ca 0.05 -0.06 -0.00 0.00 -1.45 0.00 0.00 58.65 57.18 1s7n h GLN 26 Cb 0.13 -0.22 -0.03 0.00 -0.05 0.00 0.00 27.48 27.31 1s7n h GLN 26 CO -0.11 0.66 0.42 1.25 -0.95 0.00 0.00 178.83 180.10 1s7n h LEU 27 N 1.02 0.81 -0.37 1.46 5.85 0.15 0.10 115.31 124.34 1s7n h LEU 27 Ca 0.27 -0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.86 1s7n h LEU 27 Cb -0.11 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.71 1s7n h LEU 27 CO -0.06 0.63 -0.08 0.58 -0.34 0.00 0.00 178.44 179.17 1s7n h VAL 28 N 0.93 1.28 -0.62 1.05 2.07 -0.06 -2.40 116.25 118.50 1s7n h VAL 28 Ca 0.25 -1.14 -0.06 0.00 0.82 0.00 0.00 66.70 66.56 1s7n h VAL 28 Cb -0.04 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 1s7n h VAL 28 CO -0.05 0.38 0.16 -0.07 0.02 0.00 0.00 177.57 178.01 1s7n h LEU 29 N 0.50 0.90 -1.24 2.57 3.38 -0.73 0.30 115.31 121.00 1s7n h LEU 29 Ca 0.09 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 1s7n h LEU 29 Cb 0.59 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1s7n h LEU 29 CO 0.03 0.87 0.15 0.50 0.09 0.00 0.00 178.44 180.08 1s7n h LYS 30 N 0.93 0.67 -0.02 1.13 3.64 -0.70 -3.15 116.57 119.08 1s7n h LYS 30 Ca 0.20 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1s7n h LYS 30 Cb 0.32 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1s7n h LYS 30 CO -0.00 0.59 -0.42 0.09 -2.27 0.00 0.00 179.45 177.44 1s7n n ASN 31 N -4.33 2.00 -0.19 4.20 3.02 -0.76 -4.67 115.26 114.53 1s7n n ASN 31 Ca 0.03 -1.50 -0.01 0.00 -0.03 0.00 0.00 54.58 53.08 1s7n n ASN 31 Cb 0.18 0.45 0.07 0.00 -0.61 0.00 0.00 39.78 39.87 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 2.42 0.05 -0.71 3.52 3.64 -0.39 0.21 116.57 125.32 1s7n h LYS 32 Ca 0.00 -0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.31 1s7n h LYS 32 Cb 0.72 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.50 1s7n h LYS 32 CO 0.00 0.03 0.19 0.00 -2.27 0.00 0.00 179.45 177.40 1s7n h ALA 33 N 1.56 0.99 -0.10 5.00 0.00 -1.83 -0.20 119.26 124.69 1s7n h ALA 33 Ca 0.29 -0.24 -0.17 0.00 0.00 0.00 0.00 54.91 54.79 1s7n h ALA 33 Cb 0.46 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 17.98 1s7n h ALA 33 CO -0.55 0.66 -0.59 2.35 0.00 0.00 0.00 179.25 181.12 1s7n h TRP 34 N 1.06 0.79 -0.58 0.00 7.01 -1.76 -3.13 115.95 119.34 1s7n h TRP 34 Ca 0.23 -0.36 0.06 0.00 2.11 0.00 0.00 58.89 60.93 1s7n h TRP 34 Cb 0.34 -0.12 -0.03 0.00 -2.10 0.00 0.00 29.16 27.25 1s7n h TRP 34 CO 0.03 1.15 0.39 -0.07 -2.79 0.00 0.00 178.44 177.15 1s7n h LEU 35 N 0.19 0.49 -0.79 0.65 3.38 -0.24 -1.28 115.31 117.72 1s7n h LEU 35 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1s7n h LEU 35 Cb 1.24 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1s7n h LEU 35 CO 0.12 0.32 0.00 0.00 0.09 0.00 0.00 178.44 178.98 1s7n n GLN 36 N -4.47 0.15 0.12 1.13 6.02 -0.12 -0.34 117.38 119.87 1s7n n GLN 36 Ca 0.08 0.47 0.13 0.00 -0.01 0.00 0.00 57.00 57.66 1s7n n GLN 36 Cb 0.23 -1.84 0.39 0.00 1.02 0.00 0.00 30.24 30.04 1s7n n GLN 36 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 1s7n h GLN 37 N 0.00 0.00 0.00 -1.09 1.08 -1.31 -3.35 115.11 110.44 1s7n h GLN 37 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1s7n h GLN 37 Cb 0.24 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.67 1s7n h GLN 37 CO 0.00 0.00 -0.69 0.43 -0.95 0.00 0.00 178.83 177.62 1s7n n SER 38 N -2.36 3.43 -4.00 1.46 7.64 0.31 -5.06 113.62 115.05 1s7n n SER 38 Ca 0.05 -0.09 -0.15 0.00 1.01 0.00 0.00 58.87 59.69 1s7n n SER 38 Cb 0.42 0.86 -0.13 0.00 -1.01 0.00 0.00 64.21 64.35 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 -2.41 2.10 0.02 -3.43 1.43 0.54 -5.02 118.68 111.91 1s7n s LEU 39 Ca 0.00 -0.27 0.01 0.00 -1.03 0.00 0.00 54.13 52.84 1s7n s LEU 39 Cb 0.00 -0.23 -0.26 0.00 0.03 0.00 0.00 46.19 45.74 1s7n s LEU 39 CO 0.00 -0.04 0.92 -0.78 0.23 0.00 0.00 176.35 176.68 1s7n h ASP 40 N 5.43 0.26 -0.67 2.29 3.58 -1.86 -3.38 116.42 122.07 1s7n h ASP 40 Ca -0.31 -0.36 0.15 0.00 0.42 0.00 0.00 57.03 56.94 1s7n h ASP 40 Cb 1.20 -0.08 -0.04 0.00 1.72 0.00 0.00 39.33 42.12 1s7n h ASP 40 CO 0.47 1.30 0.46 4.11 -2.88 0.00 0.00 179.24 182.69 1s7n h TRP 41 N 0.05 0.30 0.00 0.28 5.08 -1.96 -1.75 115.95 117.95 1s7n h TRP 41 Ca -0.20 0.01 -0.01 0.00 1.08 0.00 0.00 58.89 59.77 1s7n h TRP 41 Cb 1.97 -0.10 -0.00 0.00 -3.00 0.00 0.00 29.16 28.03 1s7n h TRP 41 CO 0.04 0.12 -0.06 -1.35 -1.28 0.00 0.00 178.44 175.91 1s7n h PRO 42 N 0.26 0.00 -0.22 0.12 0.11 -1.94 -1.94 132.00 128.39 1s7n h PRO 42 Ca 0.32 0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.50 1s7n h PRO 42 Cb 0.91 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 1s7n h PRO 42 CO -0.07 0.06 0.19 1.96 -0.21 0.00 0.00 178.00 179.93 1s7n h GLN 43 N 0.00 0.00 -0.45 1.05 1.08 -1.59 1.00 115.11 116.20 1s7n h GLN 43 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1s7n h GLN 43 Cb 0.23 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.66 1s7n h GLN 43 CO 0.01 0.00 0.00 0.66 -0.95 0.00 0.00 178.83 178.55 1s7n n TYR 44 N -4.07 0.61 -2.86 2.96 4.01 -0.73 -4.88 117.16 112.19 1s7n n TYR 44 Ca 0.02 -0.29 -0.35 0.00 -0.16 0.00 0.00 57.90 57.12 1s7n n TYR 44 Cb 0.33 -0.02 -0.07 0.00 -0.31 0.00 0.00 39.34 39.28 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 -1.46 4.35 0.00 -0.72 1.01 0.34 -4.94 120.40 118.98 1s7n s VAL 45 Ca 0.29 1.59 0.00 0.00 0.00 0.00 0.00 61.98 63.86 1s7n s VAL 45 Cb 0.15 -3.83 0.00 0.00 0.00 0.00 0.00 36.38 32.70 1s7n s VAL 45 CO 0.19 -0.02 0.00 0.35 0.00 0.00 0.00 175.10 175.62 1s7n n THR 46 N 0.13 0.00 -3.61 3.92 -2.24 -1.26 -5.12 114.28 106.11 1s7n n THR 46 Ca 0.03 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.54 1s7n n THR 46 Cb 0.52 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.72 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 1.28 6.38 0.34 3.42 1.04 -1.26 -4.98 113.70 119.92 1s7n s SER 47 Ca 0.00 0.45 0.07 0.00 0.48 0.00 0.00 55.95 56.96 1s7n s SER 47 Cb 0.00 -2.03 0.77 0.00 0.10 0.00 0.00 66.02 64.86 1s7n s SER 47 CO 0.00 -0.10 1.86 -0.61 0.98 0.00 0.00 173.24 175.37 1s7n h GLN 48 N 1.77 0.73 -0.76 4.02 4.15 -1.98 0.67 115.11 123.71 1s7n h GLN 48 Ca -0.48 -0.04 0.08 0.00 0.77 0.00 0.00 58.65 58.97 1s7n h GLN 48 Cb 1.20 -0.16 -0.07 0.00 0.21 0.00 0.00 27.48 28.66 1s7n h GLN 48 CO 0.67 0.48 0.43 0.93 -1.93 0.00 0.00 178.83 179.41 1s7n h GLU 49 N 0.75 0.73 -0.36 1.69 5.08 -2.00 0.47 114.58 120.95 1s7n h GLU 49 Ca 0.46 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.73 1s7n h GLU 49 Cb 0.68 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1s7n h GLU 49 CO -0.22 0.49 0.06 0.93 -1.00 0.00 0.00 179.01 179.26 1s7n h GLU 50 N 0.76 0.60 -0.94 2.33 4.39 -0.10 -2.24 114.58 119.36 1s7n h GLU 50 Ca 0.35 -0.16 -0.00 0.00 0.34 0.00 0.00 59.36 59.89 1s7n h GLU 50 Cb 0.28 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 28.81 1s7n h GLU 50 CO -0.22 0.67 0.58 1.15 -1.16 0.00 0.00 179.01 180.03 1s7n h THR 51 N 0.44 1.26 -0.92 1.13 2.02 -0.03 -1.42 112.91 115.37 1s7n h THR 51 Ca 0.11 -0.54 0.02 0.00 0.77 0.00 0.00 66.41 66.77 1s7n h THR 51 Cb 0.36 -0.09 -0.05 0.00 -1.74 0.00 0.00 68.15 66.63 1s7n h THR 51 CO 0.01 0.26 0.61 -0.09 0.37 0.00 0.00 175.52 176.68 1s7n h ARG 52 N 1.30 1.16 -0.12 6.66 2.43 -0.71 -1.76 114.38 123.33 1s7n h ARG 52 Ca 0.34 -0.07 0.02 0.00 -0.81 0.00 0.00 59.98 59.46 1s7n h ARG 52 Cb -0.07 -0.26 -0.05 0.00 -0.42 0.00 0.00 29.97 29.17 1s7n h ARG 52 CO -0.07 0.77 -0.41 -0.22 -1.51 0.00 0.00 179.97 178.54 1s7n h LYS 53 N 1.20 -0.41 -0.37 0.20 1.63 -0.66 0.41 116.57 118.57 1s7n h LYS 53 Ca 0.35 0.03 0.03 0.00 -0.85 0.00 0.00 60.65 60.22 1s7n h LYS 53 Cb -0.05 0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 31.63 1s7n h LYS 53 CO -0.09 -0.27 0.16 0.45 -3.45 0.00 0.00 179.45 176.24 1s7n h HIS 54 N -0.42 0.29 -0.23 1.91 3.86 -1.21 -0.83 115.15 118.51 1s7n h HIS 54 Ca 0.03 0.02 0.05 0.00 -1.16 0.00 0.00 60.37 59.30 1s7n h HIS 54 Cb 0.50 -0.08 -0.05 0.00 1.06 0.00 0.00 27.41 28.84 1s7n h HIS 54 CO -0.56 0.14 -0.10 0.28 0.86 0.00 0.00 177.93 178.55 1s7n h VAL 55 N 0.33 0.67 -0.45 2.45 2.07 -0.88 0.65 116.25 121.08 1s7n h VAL 55 Ca 0.16 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.75 1s7n h VAL 55 Cb 0.10 0.67 -0.06 0.00 -1.52 0.00 0.00 31.29 30.48 1s7n h VAL 55 CO -0.14 0.00 0.11 1.56 0.02 0.00 0.00 177.57 179.13 1s7n h GLN 56 N -0.07 0.25 -0.86 1.57 4.20 0.28 0.71 115.11 121.19 1s7n h GLN 56 Ca 0.12 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.79 1s7n h GLN 56 Cb 0.25 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.94 1s7n h GLN 56 CO -0.28 0.16 0.45 0.78 -0.67 0.00 0.00 178.83 179.27 1s7n h GLY 57 N 0.26 1.31 1.22 3.46 0.00 0.41 -2.37 103.07 107.37 1s7n h GLY 57 Ca 0.22 -0.62 -0.09 0.00 0.00 0.00 0.00 47.33 46.84 1s7n h GLY 57 CO -0.27 0.59 -0.04 3.43 0.00 0.00 0.00 176.54 180.25 1s7n h ASN 58 N 1.22 0.91 -0.78 0.19 -0.26 0.19 -2.51 115.58 114.54 1s7n h ASN 58 Ca 0.30 -0.26 0.10 0.00 -0.56 0.00 0.00 56.30 55.88 1s7n h ASN 58 Cb 0.07 -0.24 -0.07 0.00 -1.06 0.00 0.00 38.32 37.01 1s7n h ASN 58 CO -0.04 0.99 0.42 0.40 -1.06 0.00 0.00 177.43 178.14 1s7n h ILE 59 N 0.85 0.88 -0.09 2.81 2.04 0.88 0.11 117.51 124.98 1s7n h ILE 59 Ca 0.15 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.77 1s7n h ILE 59 Cb 0.56 0.11 -0.00 0.00 -0.74 0.00 0.00 36.82 36.75 1s7n h ILE 59 CO 0.03 0.13 0.06 -0.07 0.00 0.00 0.00 178.15 178.30 1s7n h LEU 60 N 0.71 0.10 -1.21 1.44 3.38 -1.14 0.46 115.31 119.05 1s7n h LEU 60 Ca 0.38 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.34 1s7n h LEU 60 Cb 0.37 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 1s7n h LEU 60 CO -0.26 0.09 0.53 -0.07 0.09 0.00 0.00 178.44 178.83 1s7n h LEU 61 N 0.11 0.91 -0.26 1.67 3.38 -1.03 0.21 115.31 120.30 1s7n h LEU 61 Ca 0.03 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 1s7n h LEU 61 Cb 0.00 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1s7n h LEU 61 CO -0.01 0.66 -0.04 -0.74 0.09 0.00 0.00 178.44 178.40 1s7n h HIS 62 N 1.08 0.55 -0.41 1.13 2.76 0.14 0.31 115.15 120.70 1s7n h HIS 62 Ca 0.30 -0.11 -0.05 0.00 -2.20 0.00 0.00 60.37 58.31 1s7n h HIS 62 Cb -0.10 -0.14 -0.02 0.00 1.55 0.00 0.00 27.41 28.70 1s7n h HIS 62 CO -0.00 0.69 0.08 1.96 -1.30 0.00 0.00 177.93 179.36 1s7n h GLN 63 N 0.25 0.67 0.00 5.26 4.20 0.41 -2.84 115.11 123.07 1s7n h GLN 63 Ca 0.07 -0.17 0.00 0.00 0.06 0.00 0.00 58.65 58.61 1s7n h GLN 63 Cb 0.50 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.20 1s7n h GLN 63 CO 0.02 0.71 0.00 0.54 -0.67 0.00 0.00 178.83 179.43 1s7n n ARG 64 N -4.52 0.16 -1.00 1.46 1.74 0.69 -4.90 116.66 110.29 1s7n n ARG 64 Ca -0.00 0.13 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 1s7n n ARG 64 Cb 0.22 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.16 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 0.48 0.41 0.15 -0.13 0.00 0.86 -4.93 105.19 102.03 1s7n n GLY 65 Ca 0.07 -0.80 0.11 0.00 0.00 0.00 0.00 46.02 45.40 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 -3.00 0.00 -3.83 1.61 4.01 0.05 -4.74 117.16 111.26 1s7n n TYR 66 Ca 0.00 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.70 1s7n n TYR 66 Cb 0.00 -0.03 0.01 0.00 -0.31 0.00 0.00 39.34 39.00 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 -2.84 -1.49 -0.05 -0.72 0.00 -1.19 -0.64 121.76 114.83 1s7n s ALA 67 Ca 0.12 -0.25 -0.10 0.00 0.00 0.00 0.00 51.96 51.73 1s7n s ALA 67 Cb 0.17 0.71 0.02 0.00 0.00 0.00 0.00 23.12 24.02 1s7n s ALA 67 CO 0.75 -1.05 0.25 0.15 0.00 0.00 0.00 175.76 175.87 1s7n s LYS 68 N -2.58 0.45 -0.18 0.00 -0.14 -0.54 -3.44 119.74 113.30 1s7n s LYS 68 Ca 0.18 0.04 -0.03 0.00 -1.36 0.00 0.00 55.97 54.79 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 0.05 1.41 -0.76 0.00 0.00 175.35 176.01 1s7n s MET 69 N -0.61 0.44 -0.02 1.68 -2.45 -1.26 -1.11 119.30 115.97 1s7n s MET 69 Ca -0.07 -0.27 0.06 0.00 -1.25 0.00 0.00 55.69 54.16 1s7n s MET 69 Cb -0.04 -1.95 -0.03 0.00 1.25 0.00 0.00 34.83 34.07 1s7n s MET 69 CO 0.02 -0.63 -0.20 0.71 1.05 0.00 0.00 175.02 175.97 1s7n s TYR 70 N 1.96 2.53 -0.14 4.11 2.02 -0.23 -0.91 117.35 126.69 1s7n s TYR 70 Ca 0.00 -0.28 -0.09 0.00 -0.37 0.00 0.00 57.07 56.33 1s7n s TYR 70 Cb -0.16 -1.54 -0.04 0.00 -0.40 0.00 0.00 41.96 39.81 1s7n s TYR 70 CO -0.08 0.12 0.15 -0.51 -1.57 0.00 0.00 175.55 173.66 1s7n s LEU 71 N -0.85 4.33 -0.18 -1.29 1.43 0.00 -0.54 118.68 121.58 1s7n s LEU 71 Ca 0.12 0.42 -0.18 0.00 -1.03 0.00 0.00 54.13 53.45 1s7n s LEU 71 Cb -0.10 -2.11 -0.03 0.00 0.03 0.00 0.00 46.19 43.97 1s7n s LEU 71 CO 0.01 0.32 0.51 -0.63 0.23 0.00 0.00 176.35 176.79 1s7n s ILE 72 N -0.53 5.12 -0.18 -0.59 1.01 1.00 -1.21 121.20 125.82 1s7n s ILE 72 Ca 0.13 0.96 -0.02 0.00 0.00 0.00 0.00 60.65 61.72 1s7n s ILE 72 Cb -0.12 -3.84 -0.01 0.00 0.01 0.00 0.00 42.46 38.50 1s7n s ILE 72 CO 0.03 0.21 -0.09 -0.36 0.00 0.00 0.00 174.94 174.72 1s7n s PHE 73 N 1.43 2.88 -0.26 3.97 0.40 -0.29 0.72 117.98 126.83 1s7n s PHE 73 Ca 0.25 -0.87 -0.03 0.00 -0.60 0.00 0.00 56.93 55.67 1s7n s PHE 73 Cb -0.15 -1.98 0.02 0.00 0.51 0.00 0.00 43.02 41.42 1s7n s PHE 73 CO 0.10 -0.42 -0.02 0.00 0.70 0.00 0.00 175.22 175.58 1s7n n GLN 75 N 4.74 -3.00 -0.97 0.00 6.02 0.83 0.01 117.38 125.00 1s7n n GLN 75 Ca -0.16 0.36 0.00 0.00 -0.01 0.00 0.00 57.00 57.19 1s7n n GLN 75 Cb 0.48 -4.91 0.00 0.00 1.02 0.00 0.00 30.24 26.83 1s7n n GLN 75 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1s7n n ASN 76 N -2.72 -2.78 -4.54 1.08 4.13 -1.26 -5.02 115.26 104.15 1s7n n ASN 76 Ca -0.01 0.00 -0.34 0.00 1.68 0.00 0.00 54.58 55.91 1s7n n ASN 76 Cb 0.54 -1.07 -0.12 0.00 -1.54 0.00 0.00 39.78 37.59 1s7n n ASN 76 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 1s7n s GLU 77 N -0.42 3.56 0.04 3.52 2.12 0.10 -5.05 118.70 122.56 1s7n s GLU 77 Ca 0.00 -0.49 -0.30 0.00 0.36 0.00 0.00 54.97 54.53 1s7n s GLU 77 Cb 0.00 -2.90 -0.08 0.00 0.26 0.00 0.00 34.13 31.41 1s7n s GLU 77 CO 0.00 0.33 1.80 1.41 -0.54 0.00 0.00 175.26 178.26 1s7n s MET 78 N 0.13 4.16 -0.01 4.30 -2.45 -1.26 -1.51 119.30 122.67 1s7n s MET 78 Ca -0.00 2.45 0.06 0.00 -1.25 0.00 0.00 55.69 56.94 1s7n s MET 78 Cb -0.13 -3.91 -0.08 0.00 1.25 0.00 0.00 34.83 31.95 1s7n s MET 78 CO 0.03 -0.86 0.17 0.00 1.05 0.00 0.00 175.02 175.40 1s7n n ALA 79 N 6.74 2.40 0.00 4.11 0.00 0.22 -4.93 120.51 129.06 1s7n n ALA 79 Ca 0.18 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1s7n n ALA 79 Cb 0.41 -0.20 0.00 0.00 0.00 0.00 0.00 19.45 19.65 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 1.81 -1.43 2.91 0.00 0.00 -1.16 -1.07 105.19 106.26 1s7n n GLY 80 Ca -0.00 -1.00 -0.19 0.00 0.00 0.00 0.00 46.02 44.82 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 -2.68 0.54 -0.11 1.61 1.01 -0.10 -0.00 120.40 120.66 1s7n s VAL 81 Ca 0.00 -0.16 0.02 0.00 0.00 0.00 0.00 61.98 61.84 1s7n s VAL 81 Cb 0.00 -0.54 0.01 0.00 0.00 0.00 0.00 36.38 35.85 1s7n s VAL 81 CO 0.00 0.21 -0.16 -0.22 0.00 0.00 0.00 175.10 174.93 1s7n s LEU 82 N 0.68 1.76 0.12 3.92 2.96 0.30 -2.16 118.68 126.26 1s7n s LEU 82 Ca -0.09 -0.44 0.03 0.00 -0.22 0.00 0.00 54.13 53.40 1s7n s LEU 82 Cb -0.12 -1.12 -0.04 0.00 0.50 0.00 0.00 46.19 45.40 1s7n s LEU 82 CO 0.00 0.02 -0.07 -0.44 -1.32 0.00 0.00 176.35 174.54 1s7n s SER 83 N 0.96 1.35 -0.48 3.68 0.01 0.03 -1.07 113.70 118.18 1s7n s SER 83 Ca -0.07 -1.01 -0.10 0.00 1.31 0.00 0.00 55.95 56.08 1s7n s SER 83 Cb -0.15 0.06 0.12 0.00 0.21 0.00 0.00 66.02 66.26 1s7n s SER 83 CO -0.01 -0.43 0.37 -0.36 0.41 0.00 0.00 173.24 173.21 1s7n s PHE 84 N -3.53 3.40 0.55 2.43 0.08 -0.27 -0.45 117.98 120.20 1s7n s PHE 84 Ca 0.14 -1.79 0.26 0.00 0.12 0.00 0.00 56.93 55.66 1s7n s PHE 84 Cb 0.04 -3.54 1.47 0.00 -0.57 0.00 0.00 43.02 40.43 1s7n s PHE 84 CO -0.03 -1.00 2.02 -0.91 -0.10 0.00 0.00 175.22 175.20 1s7n h ASN 85 N 8.51 0.00 -4.48 1.36 -0.26 -0.58 -1.44 115.58 118.69 1s7n h ASN 85 Ca -0.22 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 55.49 1s7n h ASN 85 Cb 1.08 0.00 -0.21 0.00 -1.06 0.00 0.00 38.32 38.13 1s7n h ASN 85 CO 0.89 0.00 0.24 0.00 -1.06 0.00 0.00 177.43 177.49 1s7n s ALA 86 N -4.86 -1.81 -0.03 -0.83 0.00 -1.24 -4.76 121.76 108.24 1s7n s ALA 86 Ca -0.05 1.59 0.05 0.00 0.00 0.00 0.00 51.96 53.55 1s7n s ALA 86 Cb 0.18 -0.52 -0.01 0.00 0.00 0.00 0.00 23.12 22.77 1s7n s ALA 86 CO 0.65 -0.34 -0.19 0.42 0.00 0.00 0.00 175.76 176.30 1s7n s ILE 87 N -0.64 1.52 -0.65 0.00 1.01 0.19 -0.51 121.20 122.12 1s7n s ILE 87 Ca -0.06 -0.79 -0.05 0.00 0.00 0.00 0.00 60.65 59.75 1s7n s ILE 87 Cb -0.02 -1.29 0.17 0.00 0.01 0.00 0.00 42.46 41.33 1s7n s ILE 87 CO 0.05 0.43 0.49 -1.61 0.00 0.00 0.00 174.94 174.30 1s7n s GLU 88 N -0.18 2.73 0.17 2.79 2.02 0.71 -4.75 118.70 122.19 1s7n s GLU 88 Ca 0.01 -2.45 -0.20 0.00 0.02 0.00 0.00 54.97 52.34 1s7n s GLU 88 Cb -0.10 -3.87 0.09 0.00 0.10 0.00 0.00 34.13 30.36 1s7n s GLU 88 CO 0.01 -1.19 1.62 -1.35 0.02 0.00 0.00 175.26 174.37 1s7n h PRO 89 N 7.28 -0.16 -0.53 0.39 0.11 -1.86 0.34 132.00 137.57 1s7n h PRO 89 Ca -0.01 0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.13 1s7n h PRO 89 Cb 0.98 0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.10 1s7n h PRO 89 CO 0.73 -0.11 0.35 0.82 -0.21 0.00 0.00 178.00 179.58 1s7n h ILE 90 N -0.17 1.10 -0.01 4.15 2.04 -1.95 -1.14 117.51 121.53 1s7n h ILE 90 Ca 0.19 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1s7n h ILE 90 Cb 0.47 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.93 1s7n h ILE 90 CO -0.50 0.12 -0.28 0.59 0.00 0.00 0.00 178.15 178.08 1s7n n ASN 91 N -4.46 1.09 -3.76 1.72 3.02 -0.39 -4.94 115.26 107.53 1s7n n ASN 91 Ca 0.05 -0.93 -0.23 0.00 -0.03 0.00 0.00 54.58 53.45 1s7n n ASN 91 Cb 0.09 0.16 0.02 0.00 -0.61 0.00 0.00 39.78 39.45 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 -0.62 -4.72 -4.31 3.52 5.02 0.11 -4.80 118.16 112.36 1s7n n LYS 92 Ca 0.12 0.59 -0.19 0.00 -2.02 0.00 0.00 58.31 56.80 1s7n n LYS 92 Cb 0.36 -5.11 -0.13 0.00 -0.02 0.00 0.00 35.03 30.12 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 -3.68 1.06 0.02 7.82 0.00 -1.09 -0.55 121.76 125.34 1s7n s ALA 93 Ca 0.06 -0.78 0.00 0.00 0.00 0.00 0.00 51.96 51.24 1s7n s ALA 93 Cb -0.03 -0.15 -0.02 0.00 0.00 0.00 0.00 23.12 22.92 1s7n s ALA 93 CO 0.83 0.19 -0.02 0.00 0.00 0.00 0.00 175.76 176.75 1s7n s ALA 94 N -0.87 0.10 -0.19 0.00 0.00 -0.57 -0.21 121.76 120.03 1s7n s ALA 94 Ca 0.00 -0.48 -0.05 0.00 0.00 0.00 0.00 51.96 51.43 1s7n s ALA 94 Cb -0.08 0.12 -0.03 0.00 0.00 0.00 0.00 23.12 23.13 1s7n s ALA 94 CO 0.01 -0.13 0.00 0.71 0.00 0.00 0.00 175.76 176.36 1s7n s TYR 95 N -1.17 3.06 0.11 0.00 1.51 0.34 -1.16 117.35 120.04 1s7n s TYR 95 Ca -0.13 -0.37 -0.16 0.00 -1.01 0.00 0.00 57.07 55.40 1s7n s TYR 95 Cb -0.08 -2.07 -0.07 0.00 -0.11 0.00 0.00 41.96 39.64 1s7n s TYR 95 CO -0.01 -0.17 0.54 0.42 -1.11 0.00 0.00 175.55 175.23 1s7n s ILE 96 N 0.84 4.83 0.03 2.71 1.01 -0.08 0.10 121.20 130.64 1s7n s ILE 96 Ca 0.01 0.95 0.02 0.00 0.00 0.00 0.00 60.65 61.64 1s7n s ILE 96 Cb -0.14 -3.78 -0.02 0.00 0.01 0.00 0.00 42.46 38.53 1s7n s ILE 96 CO 0.02 0.37 -0.08 -0.83 0.00 0.00 0.00 174.94 174.42 1s7n s GLY 97 N -1.47 0.46 0.11 6.18 0.00 0.40 -4.62 107.32 108.39 1s7n s GLY 97 Ca 0.34 -0.58 -0.25 0.00 0.00 0.00 0.00 44.72 44.22 1s7n s GLY 97 CO 0.19 -0.59 0.80 -2.52 0.00 0.00 0.00 173.10 170.98 1s7n s TYR 98 N -0.85 -0.33 -0.16 1.90 -0.85 -1.26 -0.79 117.35 115.00 1s7n s TYR 98 Ca -0.04 0.10 -0.30 0.00 -0.52 0.00 0.00 57.07 56.31 1s7n s TYR 98 Cb -0.07 0.59 0.12 0.00 0.38 0.00 0.00 41.96 42.98 1s7n s TYR 98 CO 0.00 -0.78 0.95 1.67 -1.52 0.00 0.00 175.55 175.87 1s7n s TRP 99 N -3.44 -0.43 0.18 -3.49 1.48 -0.92 -5.02 118.94 107.31 1s7n s TRP 99 Ca 0.06 0.77 0.11 0.00 -1.06 0.00 0.00 56.10 55.98 1s7n s TRP 99 Cb -0.02 0.43 -0.04 0.00 -1.16 0.00 0.00 33.47 32.68 1s7n s TRP 99 CO -0.06 -0.37 -0.22 -0.51 -4.06 0.00 0.00 176.95 171.74 1s7n s LEU 100 N -0.97 2.52 0.34 -4.66 1.43 -1.26 -0.93 118.68 115.15 1s7n s LEU 100 Ca -0.03 -0.79 -0.29 0.00 -1.03 0.00 0.00 54.13 52.00 1s7n s LEU 100 Cb -0.01 -1.27 -0.11 0.00 0.03 0.00 0.00 46.19 44.83 1s7n s LEU 100 CO 0.02 0.13 1.42 -0.62 0.23 0.00 0.00 176.35 177.53 1s7n s ASP 101 N -2.59 6.54 0.41 2.29 -1.08 -0.23 -4.87 116.67 117.14 1s7n s ASP 101 Ca 0.20 2.86 0.18 0.00 -0.52 0.00 0.00 52.55 55.28 1s7n s ASP 101 Cb -0.08 -2.65 1.09 0.00 -1.46 0.00 0.00 42.92 39.82 1s7n s ASP 101 CO 0.10 -0.73 1.83 -0.08 0.52 0.00 0.00 175.17 176.81 1s7n h GLU 102 N 3.57 0.39 0.00 4.34 4.81 -1.95 0.29 114.58 126.03 1s7n h GLU 102 Ca -0.49 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 1s7n h GLU 102 Cb 1.23 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.52 1s7n h GLU 102 CO 0.68 0.26 0.00 -1.13 -0.73 0.00 0.00 179.01 178.08 1s7n n SER 103 N -4.53 0.00 -1.09 1.04 3.41 -1.26 -3.20 113.62 107.99 1s7n n SER 103 Ca 0.21 -0.42 0.12 0.00 -0.26 0.00 0.00 58.87 58.51 1s7n n SER 103 Cb 0.75 -0.19 0.22 0.00 -0.26 0.00 0.00 64.21 64.73 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 -1.19 0.41 -1.63 7.33 3.72 0.09 -4.99 117.46 121.20 1s7n n PHE 104 Ca 0.17 -0.21 -0.29 0.00 -0.05 0.00 0.00 57.45 57.08 1s7n n PHE 104 Cb 0.20 0.00 0.12 0.00 -0.94 0.00 0.00 39.48 38.86 1s7n n PHE 104 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1s7n s GLN 105 N -1.59 1.40 -0.02 -1.08 -0.21 -1.19 -4.09 119.66 112.88 1s7n s GLN 105 Ca 0.37 0.27 0.00 0.00 0.02 0.00 0.00 55.36 56.02 1s7n s GLN 105 Cb 0.22 -1.87 0.00 0.00 1.00 0.00 0.00 33.01 32.36 1s7n s GLN 105 CO 0.31 -2.01 0.00 0.41 -2.12 0.00 0.00 175.29 171.88 1s7n n GLY 106 N -2.48 0.41 0.00 3.09 0.00 -1.26 -4.87 105.19 100.08 1s7n n GLY 106 Ca 0.07 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.23 1.59 -0.99 1.61 6.02 -1.26 -4.99 117.38 117.13 1s7n n GLN 107 Ca -0.00 -1.09 0.00 0.00 -0.01 0.00 0.00 57.00 55.90 1s7n n GLN 107 Cb 0.10 -0.93 0.00 0.00 1.02 0.00 0.00 30.24 30.43 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 -0.31 0.36 0.24 1.08 0.00 -1.26 -4.92 105.19 100.38 1s7n n GLY 108 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 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 1.18 -0.13 -0.61 2.04 -1.94 -0.00 117.51 118.04 1s7n h ILE 109 Ca 0.00 -0.42 -0.05 0.00 1.00 0.00 0.00 64.86 65.40 1s7n h ILE 109 Cb 0.30 0.41 -0.00 0.00 -0.74 0.00 0.00 36.82 36.79 1s7n h ILE 109 CO 0.00 0.19 -0.10 -0.03 0.00 0.00 0.00 178.15 178.20 1s7n h MET 110 N 0.77 0.31 -0.20 2.37 4.05 -1.91 -1.48 114.93 118.84 1s7n h MET 110 Ca 0.20 -0.15 0.04 0.00 -0.28 0.00 0.00 59.70 59.52 1s7n h MET 110 Cb 0.00 0.00 -0.05 0.00 -0.80 0.00 0.00 31.60 30.76 1s7n h MET 110 CO -0.04 0.68 -0.09 0.77 0.23 0.00 0.00 176.91 178.46 1s7n h SER 111 N -0.06 -0.30 -0.86 1.39 0.02 -1.94 0.37 113.55 112.17 1s7n h SER 111 Ca 0.02 0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 61.03 1s7n h SER 111 Cb 0.61 0.17 -0.04 0.00 0.14 0.00 0.00 62.40 63.28 1s7n h SER 111 CO 0.03 -0.12 0.45 1.56 -1.14 0.00 0.00 176.83 177.61 1s7n h GLN 112 N -0.07 1.21 -0.20 3.45 4.20 -0.99 -0.39 115.11 122.33 1s7n h GLN 112 Ca 0.11 -0.15 -0.02 0.00 0.06 0.00 0.00 58.65 58.64 1s7n h GLN 112 Cb 0.23 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 1s7n h GLN 112 CO -0.24 0.90 0.03 0.77 -0.67 0.00 0.00 178.83 179.62 1s7n h SER 113 N 1.21 0.31 -0.40 1.46 0.02 -0.83 -2.26 113.55 113.07 1s7n h SER 113 Ca 0.30 -0.26 -0.01 0.00 -0.84 0.00 0.00 61.79 60.98 1s7n h SER 113 Cb 0.05 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.49 1s7n h SER 113 CO -0.05 0.49 0.20 0.25 -1.14 0.00 0.00 176.83 176.59 1s7n h LEU 114 N 0.12 0.52 -0.33 5.07 5.85 0.08 0.26 115.31 126.89 1s7n h LEU 114 Ca 0.06 -0.12 0.07 0.00 0.84 0.00 0.00 57.88 58.73 1s7n h LEU 114 Cb 0.31 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 41.15 1s7n h LEU 114 CO 0.00 0.49 -0.09 -0.61 -0.34 0.00 0.00 178.44 177.89 1s7n h GLN 115 N 0.51 -0.01 -0.36 1.25 5.75 -1.05 0.54 115.11 121.74 1s7n h GLN 115 Ca 0.14 0.00 -0.06 0.00 -0.15 0.00 0.00 58.65 58.58 1s7n h GLN 115 Cb 0.10 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.64 1s7n h GLN 115 CO -0.02 -0.01 -0.04 0.00 -2.65 0.00 0.00 178.83 176.12 1s7n h ALA 116 N 1.31 1.27 -0.15 3.38 0.00 -0.81 -0.45 119.26 123.81 1s7n h ALA 116 Ca 0.16 -0.24 -0.21 0.00 0.00 0.00 0.00 54.91 54.62 1s7n h ALA 116 Cb 0.25 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.89 1s7n h ALA 116 CO -0.34 0.49 -0.72 1.25 0.00 0.00 0.00 179.25 179.92 1s7n h LEU 117 N 0.55 0.90 -0.59 0.00 5.85 -0.11 -1.47 115.31 120.44 1s7n h LEU 117 Ca 0.11 -0.63 -0.09 0.00 0.84 0.00 0.00 57.88 58.11 1s7n h LEU 117 Cb 0.41 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 1s7n h LEU 117 CO 0.02 1.38 0.02 0.24 -0.34 0.00 0.00 178.44 179.75 1s7n h MET 118 N 0.48 1.03 -0.45 1.25 2.86 -0.76 -2.22 114.93 117.12 1s7n h MET 118 Ca -0.05 -0.32 -0.03 0.00 -2.06 0.00 0.00 59.70 57.25 1s7n h MET 118 Cb 1.35 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.90 1s7n h MET 118 CO 0.15 1.00 0.18 1.15 1.06 0.00 0.00 176.91 180.45 1s7n h THR 119 N 0.92 1.21 -0.38 2.22 2.02 -0.98 -1.47 112.91 116.45 1s7n h THR 119 Ca 0.17 -0.64 0.05 0.00 0.77 0.00 0.00 66.41 66.76 1s7n h THR 119 Cb 0.53 0.78 -0.05 0.00 -1.74 0.00 0.00 68.15 67.67 1s7n h THR 119 CO 0.03 0.24 0.10 -0.74 0.37 0.00 0.00 175.52 175.51 1s7n h HIS 120 N 0.59 0.17 -0.02 3.16 6.17 -1.04 0.08 115.15 124.25 1s7n h HIS 120 Ca 0.15 0.02 -0.16 0.00 0.71 0.00 0.00 60.37 61.09 1s7n h HIS 120 Cb 0.20 -0.02 -0.02 0.00 2.52 0.00 0.00 27.41 30.09 1s7n h HIS 120 CO 0.00 0.05 -0.73 1.88 0.71 0.00 0.00 177.93 179.84 1s7n h TYR 121 N 0.24 0.19 -0.27 5.26 -1.99 -1.28 -2.10 116.97 117.01 1s7n h TYR 121 Ca 0.18 -0.09 -0.13 0.00 2.00 0.00 0.00 58.73 60.69 1s7n h TYR 121 Cb 0.19 -0.03 -0.01 0.00 2.00 0.00 0.00 36.73 38.88 1s7n h TYR 121 CO -0.17 0.82 -0.37 0.00 -0.00 0.00 0.00 178.16 178.44 1s7n h ALA 122 N 1.15 0.85 -0.35 3.88 0.00 -0.96 -0.54 119.26 123.30 1s7n h ALA 122 Ca -0.02 -0.43 -0.15 0.00 0.00 0.00 0.00 54.91 54.31 1s7n h ALA 122 Cb 1.29 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1s7n h ALA 122 CO 0.11 0.64 -0.39 0.00 0.00 0.00 0.00 179.25 179.60 1s7n h ARG 123 N 0.52 0.84 -0.38 0.00 3.08 -0.93 -2.31 114.38 115.20 1s7n h ARG 123 Ca 0.05 -0.44 0.03 0.00 0.07 0.00 0.00 59.98 59.69 1s7n h ARG 123 Cb 0.87 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.92 1s7n h ARG 123 CO 0.08 1.08 0.25 0.00 -1.07 0.00 0.00 179.97 180.31 1s7n h ARG 124 N 0.69 0.37 0.00 0.04 3.08 -1.12 -3.47 114.38 113.97 1s7n h ARG 124 Ca 0.06 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1s7n h ARG 124 Cb 0.96 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.93 1s7n h ARG 124 CO 0.09 0.24 0.00 0.41 -1.07 0.00 0.00 179.97 179.64 1s7n n GLY 125 N -1.51 0.78 0.12 0.04 0.00 -0.23 -4.94 105.19 99.45 1s7n n GLY 125 Ca 0.04 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.17 1s7n n GLY 125 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1s7n h ASP 126 N 0.00 0.00 -3.42 1.61 3.04 -1.82 -3.44 116.42 112.39 1s7n h ASP 126 Ca 0.00 -0.04 -0.48 0.00 -3.24 0.00 0.00 57.03 53.27 1s7n h ASP 126 Cb 0.00 0.00 -0.34 0.00 -1.04 0.00 0.00 39.33 37.95 1s7n h ASP 126 CO 0.00 0.02 -0.80 -0.63 -2.04 0.00 0.00 179.24 175.79 1s7n s ILE 127 N -3.29 0.90 0.00 4.15 1.01 -1.23 -4.47 121.20 118.28 1s7n s ILE 127 Ca 0.02 -0.33 0.00 0.00 0.00 0.00 0.00 60.65 60.34 1s7n s ILE 127 Cb 0.10 -0.86 0.00 0.00 0.01 0.00 0.00 42.46 41.70 1s7n s ILE 127 CO 0.75 0.31 0.00 -2.11 0.00 0.00 0.00 174.94 173.89 1s7n n ARG 128 N 3.99 1.46 -3.99 2.79 1.85 0.29 -3.56 116.66 119.48 1s7n n ARG 128 Ca -0.23 0.00 -0.34 0.00 -1.00 0.00 0.00 57.85 56.28 1s7n n ARG 128 Cb 0.51 -0.87 -0.15 0.00 -1.05 0.00 0.00 32.46 30.91 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 -1.58 2.73 -0.18 2.89 3.52 -0.70 0.37 118.95 126.01 1s7n s ARG 129 Ca 0.00 -1.04 -0.07 0.00 -0.13 0.00 0.00 55.73 54.50 1s7n s ARG 129 Cb 0.00 -2.94 -0.04 0.00 -1.56 0.00 0.00 34.95 30.41 1s7n s ARG 129 CO 0.00 -0.42 0.04 -0.06 -0.81 0.00 0.00 175.30 174.05 1s7n s PHE 130 N 1.28 3.21 -0.05 5.12 0.40 0.19 -1.51 117.98 126.61 1s7n s PHE 130 Ca -0.01 -0.01 0.06 0.00 -0.60 0.00 0.00 56.93 56.37 1s7n s PHE 130 Cb -0.17 -2.06 -0.01 0.00 0.51 0.00 0.00 43.02 41.29 1s7n s PHE 130 CO -0.05 0.11 -0.24 0.08 0.70 0.00 0.00 175.22 175.82 1s7n s VAL 131 N 0.38 1.93 -0.12 -0.44 1.01 -0.31 0.10 120.40 122.95 1s7n s VAL 131 Ca 0.02 -1.00 0.02 0.00 0.00 0.00 0.00 61.98 61.01 1s7n s VAL 131 Cb -0.13 -1.64 0.01 0.00 0.00 0.00 0.00 36.38 34.63 1s7n s VAL 131 CO 0.01 0.54 -0.17 -0.63 0.00 0.00 0.00 175.10 174.84 1s7n s ILE 132 N -0.17 1.69 -0.21 2.22 1.01 0.38 -0.90 121.20 125.22 1s7n s ILE 132 Ca -0.02 -0.75 -0.02 0.00 0.00 0.00 0.00 60.65 59.85 1s7n s ILE 132 Cb -0.13 -1.52 0.00 0.00 0.01 0.00 0.00 42.46 40.82 1s7n s ILE 132 CO 0.03 0.48 -0.10 -0.54 0.00 0.00 0.00 174.94 174.81 1s7n s LYS 133 N 0.96 3.24 -0.02 2.79 1.02 -1.26 -0.07 119.74 126.41 1s7n s LYS 133 Ca -0.06 -0.70 -0.06 0.00 0.02 0.00 0.00 55.97 55.17 1s7n s LYS 133 Cb -0.15 -2.86 0.00 0.00 -0.52 0.00 0.00 37.83 34.30 1s7n s LYS 133 CO -0.02 -0.20 0.14 0.00 -0.92 0.00 0.00 175.35 174.34 1s7n n ARG 135 N 1.95 1.49 -0.27 0.00 1.74 -1.26 -0.15 116.66 120.17 1s7n n ARG 135 Ca -0.19 0.53 0.07 0.00 -0.77 0.00 0.00 57.85 57.49 1s7n n ARG 135 Cb 0.57 -2.03 0.22 0.00 -1.02 0.00 0.00 32.46 30.19 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 2.54 0.58 0.00 1.55 2.07 -1.33 -0.35 116.25 121.32 1s7n h VAL 136 Ca -0.43 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 66.96 1s7n h VAL 136 Cb 1.32 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1s7n h VAL 136 CO 0.68 0.07 0.00 0.47 0.02 0.00 0.00 177.57 178.81 1s7n n ASP 137 N -5.04 0.00 -4.45 0.57 8.00 -1.26 -4.61 116.55 109.75 1s7n n ASP 137 Ca 0.16 -1.07 -0.43 0.00 0.71 0.00 0.00 54.79 54.16 1s7n n ASP 137 Cb 0.48 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.55 1s7n n ASP 137 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 1s7n s ASN 138 N -1.87 6.26 0.04 -2.24 3.84 -0.14 -4.91 114.94 115.92 1s7n s ASN 138 Ca 0.40 -1.22 -0.27 0.00 0.21 0.00 0.00 52.86 51.97 1s7n s ASN 138 Cb 0.18 -2.41 -0.17 0.00 -0.55 0.00 0.00 41.25 38.30 1s7n s ASN 138 CO 0.30 -1.35 1.46 -0.61 -2.79 0.00 0.00 177.10 174.12 1s7n h GLN 139 N 9.41 -0.45 -0.77 0.43 5.75 -1.85 -2.15 115.11 125.48 1s7n h GLN 139 Ca -0.20 0.03 0.05 0.00 -0.15 0.00 0.00 58.65 58.38 1s7n h GLN 139 Cb 1.06 0.10 -0.05 0.00 1.07 0.00 0.00 27.48 29.67 1s7n h GLN 139 CO 1.17 -0.20 0.51 0.00 -2.65 0.00 0.00 178.83 177.65 1s7n h ALA 140 N -0.05 1.61 -0.12 3.38 0.00 -1.98 -0.92 119.26 121.18 1s7n h ALA 140 Ca -0.05 -0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.61 1s7n h ALA 140 Cb 0.46 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.02 1s7n h ALA 140 CO 0.08 0.29 -0.81 1.03 0.00 0.00 0.00 179.25 179.84 1s7n h SER 141 N 0.88 0.87 -0.19 0.00 0.87 -1.92 -2.31 113.55 111.74 1s7n h SER 141 Ca 0.32 -0.59 -0.07 0.00 -1.23 0.00 0.00 61.79 60.22 1s7n h SER 141 Cb 0.16 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 1s7n h SER 141 CO -0.11 1.38 -0.10 0.78 -0.53 0.00 0.00 176.83 178.26 1s7n h ASN 142 N 0.48 0.53 -0.71 6.23 2.35 -0.84 -1.87 115.58 121.75 1s7n h ASN 142 Ca -0.06 -0.14 0.03 0.00 -0.55 0.00 0.00 56.30 55.58 1s7n h ASN 142 Cb 1.44 -0.14 -0.04 0.00 0.05 0.00 0.00 38.32 39.62 1s7n h ASN 142 CO 0.16 0.67 0.45 0.00 -1.65 0.00 0.00 177.43 177.06 1s7n h ALA 143 N 1.39 0.92 -0.17 -0.83 0.00 -1.06 0.27 119.26 119.79 1s7n h ALA 143 Ca 0.10 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1s7n h ALA 143 Cb 0.48 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1s7n h ALA 143 CO 0.03 0.24 0.06 0.28 0.00 0.00 0.00 179.25 179.86 1s7n h VAL 144 N 0.88 0.97 -0.67 0.00 2.07 -0.78 0.34 116.25 119.07 1s7n h VAL 144 Ca 0.28 -0.05 0.02 0.00 0.82 0.00 0.00 66.70 67.77 1s7n h VAL 144 Cb 0.00 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 30.54 1s7n h VAL 144 CO -0.10 0.03 0.43 0.00 0.02 0.00 0.00 177.57 177.95 1s7n h ALA 145 N 1.10 0.85 -0.56 1.67 0.00 -0.96 -1.70 119.26 119.66 1s7n h ALA 145 Ca 0.07 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1s7n h ALA 145 Cb 0.03 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1s7n h ALA 145 CO -0.07 0.24 0.04 0.00 0.00 0.00 0.00 179.25 179.46 1s7n h ARG 146 N 0.87 0.96 0.00 0.00 3.08 -0.10 -2.12 114.38 117.06 1s7n h ARG 146 Ca 0.25 -0.29 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 1s7n h ARG 146 Cb -0.06 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 1s7n h ARG 146 CO -0.07 0.95 -0.19 -0.09 -1.07 0.00 0.00 179.97 179.49 1s7n h ARG 147 N 0.84 0.00 -0.52 0.04 2.43 -0.08 -2.59 114.38 114.50 1s7n h ARG 147 Ca 0.16 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1s7n h ARG 147 Cb 0.49 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 1s7n h ARG 147 CO 0.02 0.19 0.00 0.09 -1.51 0.00 0.00 179.97 178.77 1s7n n ASN 148 N -3.70 5.38 -2.03 -3.80 3.02 -0.67 -4.95 115.26 108.52 1s7n n ASN 148 Ca -0.01 -2.93 -0.14 0.00 -0.03 0.00 0.00 54.58 51.46 1s7n n ASN 148 Cb 0.31 -0.66 0.03 0.00 -0.61 0.00 0.00 39.78 38.85 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 0.44 -1.29 -3.28 3.10 8.25 -0.97 -5.00 115.22 116.47 1s7n n HIS 149 Ca 0.27 0.36 -0.36 0.00 -0.26 0.00 0.00 57.72 57.72 1s7n n HIS 149 Cb 1.13 -3.25 -0.06 0.00 1.12 0.00 0.00 29.99 28.93 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 -2.96 3.67 -0.01 4.41 0.40 -0.83 -4.82 117.98 117.84 1s7n s PHE 150 Ca 0.21 1.19 -0.18 0.00 -0.60 0.00 0.00 56.93 57.55 1s7n s PHE 150 Cb -0.09 -2.46 -0.06 0.00 0.51 0.00 0.00 43.02 40.93 1s7n s PHE 150 CO 0.25 0.45 0.50 0.99 0.70 0.00 0.00 175.22 178.12 1s7n s THR 151 N -1.39 4.97 -0.14 0.64 2.01 0.63 -4.71 115.64 117.65 1s7n s THR 151 Ca 0.37 1.05 -0.28 0.00 0.31 0.00 0.00 61.69 63.13 1s7n s THR 151 Cb -0.16 -3.83 -0.01 0.00 0.01 0.00 0.00 72.50 68.51 1s7n s THR 151 CO 0.20 0.48 0.97 -0.22 -0.69 0.00 0.00 174.62 175.36 1s7n s LEU 152 N -0.51 4.21 -0.02 4.42 2.96 -1.26 -0.80 118.68 127.68 1s7n s LEU 152 Ca 0.27 1.43 0.18 0.00 -0.22 0.00 0.00 54.13 55.79 1s7n s LEU 152 Cb -0.17 -3.48 -0.26 0.00 0.50 0.00 0.00 46.19 42.78 1s7n s LEU 152 CO 0.15 -0.47 0.47 -0.62 -1.32 0.00 0.00 176.35 174.56 1s7n n GLU 153 N 5.23 0.71 -3.70 1.98 1.02 0.76 -4.97 120.64 121.67 1s7n n GLU 153 Ca 0.08 -0.13 0.00 0.00 -0.02 0.00 0.00 57.16 57.10 1s7n n GLU 153 Cb 0.48 -1.40 0.00 0.00 -0.02 0.00 0.00 31.44 30.50 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 1.47 -2.12 2.87 0.62 0.00 -1.13 -4.99 105.19 101.90 1s7n n GLY 154 Ca -0.02 -1.20 -0.23 0.00 0.00 0.00 0.00 46.02 44.57 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 1.46 3.33 0.09 0.00 -1.94 0.69 -4.91 119.30 118.02 1s7n s MET 156 Ca -0.02 -0.45 -0.31 0.00 -1.71 0.00 0.00 55.69 53.20 1s7n s MET 156 Cb -0.13 -3.91 -0.09 0.00 2.01 0.00 0.00 34.83 32.71 1s7n s MET 156 CO -0.04 -0.82 1.73 0.21 -0.01 0.00 0.00 175.02 176.10 1s7n s LYS 157 N 2.40 4.17 -1.61 2.03 2.20 -1.26 -1.31 119.74 126.36 1s7n s LYS 157 Ca 0.17 2.44 -0.15 0.00 -0.36 0.00 0.00 55.97 58.07 1s7n s LYS 157 Cb -0.16 -3.62 0.11 0.00 -1.51 0.00 0.00 37.83 32.66 1s7n s LYS 157 CO 0.15 -0.78 0.81 1.04 -0.36 0.00 0.00 175.35 176.21 1s7n n GLN 158 N 5.71 -3.99 0.14 4.03 6.02 -1.22 -4.86 117.38 123.20 1s7n n GLN 158 Ca 0.17 0.45 0.08 0.00 -0.01 0.00 0.00 57.00 57.69 1s7n n GLN 158 Cb 0.40 -5.17 0.05 0.00 1.02 0.00 0.00 30.24 26.54 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 0.92 0.74 -3.19 -1.58 0.00 -1.14 -3.41 119.26 111.61 1s7n h ALA 159 Ca -0.59 -0.23 -0.67 0.00 0.00 0.00 0.00 54.91 53.42 1s7n h ALA 159 Cb 1.38 0.02 -0.34 0.00 0.00 0.00 0.00 17.79 18.85 1s7n h ALA 159 CO 0.72 0.28 -0.87 -2.00 0.00 0.00 0.00 179.25 177.38 1s7n s GLU 160 N -3.15 3.02 0.17 0.00 2.12 -0.77 -4.92 118.70 115.17 1s7n s GLU 160 Ca 0.03 -0.85 -0.30 0.00 0.36 0.00 0.00 54.97 54.21 1s7n s GLU 160 Cb 0.07 -2.44 -0.07 0.00 0.26 0.00 0.00 34.13 31.95 1s7n s GLU 160 CO 0.74 -0.02 1.08 -0.47 -0.54 0.00 0.00 175.26 176.05 1s7n s TYR 161 N 0.83 3.63 -0.29 5.30 5.04 -1.26 -0.01 117.35 130.59 1s7n s TYR 161 Ca -0.07 1.63 -0.13 0.00 -2.44 0.00 0.00 57.07 56.06 1s7n s TYR 161 Cb -0.15 -3.24 0.11 0.00 0.35 0.00 0.00 41.96 39.02 1s7n s TYR 161 CO -0.02 -0.49 0.70 -1.17 -1.34 0.00 0.00 175.55 173.23 1s7n s LEU 162 N -0.33 -0.99 -1.19 6.97 0.20 0.13 -4.64 118.68 118.83 1s7n s LEU 162 Ca 0.49 1.47 -0.32 0.00 0.69 0.00 0.00 54.13 56.46 1s7n s LEU 162 Cb -0.29 2.28 0.04 0.00 -0.43 0.00 0.00 46.19 47.79 1s7n s LEU 162 CO 0.34 -0.22 0.70 0.59 -0.29 0.00 0.00 176.35 177.47 1s7n n ASN 163 N 4.81 -4.34 0.00 3.68 3.02 -1.26 -1.82 115.26 119.35 1s7n n ASN 163 Ca -0.16 -1.26 0.00 0.00 -0.03 0.00 0.00 54.58 53.14 1s7n n ASN 163 Cb 0.54 -1.90 0.00 0.00 -0.61 0.00 0.00 39.78 37.81 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 -2.03 0.73 3.30 7.41 0.00 -1.26 -5.01 105.19 108.33 1s7n n GLY 164 Ca -0.11 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.81 1s7n n GLY 164 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1s7n s ASP 165 N -2.45 0.08 -0.25 1.61 1.01 -0.75 -5.15 116.67 110.77 1s7n s ASP 165 Ca 0.00 -0.86 -0.03 0.00 0.71 0.00 0.00 52.55 52.37 1s7n s ASP 165 Cb 0.00 0.41 0.01 0.00 1.01 0.00 0.00 42.92 44.35 1s7n s ASP 165 CO 0.00 -0.85 -0.04 -0.31 0.21 0.00 0.00 175.17 174.19 1s7n s TYR 166 N -3.95 3.04 0.16 4.23 2.02 -1.26 0.23 117.35 121.82 1s7n s TYR 166 Ca 0.15 -1.31 0.07 0.00 -0.37 0.00 0.00 57.07 55.61 1s7n s TYR 166 Cb 0.04 -2.10 -0.04 0.00 -0.40 0.00 0.00 41.96 39.46 1s7n s TYR 166 CO -0.02 -0.66 0.03 -1.01 -1.57 0.00 0.00 175.55 172.32 1s7n s HIS 167 N 1.39 2.93 0.24 2.71 3.76 0.99 -4.51 115.29 122.80 1s7n s HIS 167 Ca 0.02 -0.10 -0.30 0.00 -0.15 0.00 0.00 55.06 54.54 1s7n s HIS 167 Cb -0.16 -1.42 -0.09 0.00 1.11 0.00 0.00 32.58 32.01 1s7n s HIS 167 CO -0.03 0.52 1.28 -0.51 -0.85 0.00 0.00 174.74 175.14 1s7n s ASP 168 N -2.93 6.92 -0.14 1.40 1.01 -1.26 -1.26 116.67 120.42 1s7n s ASP 168 Ca 0.28 2.45 0.02 0.00 0.71 0.00 0.00 52.55 56.00 1s7n s ASP 168 Cb -0.10 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.21 1s7n s ASP 168 CO 0.20 -0.47 -0.19 -0.69 0.21 0.00 0.00 175.17 174.22 1s7n s VAL 169 N -0.35 2.37 0.08 -1.27 1.01 -0.43 -0.87 120.40 120.94 1s7n s VAL 169 Ca 0.53 -0.88 -0.30 0.00 0.00 0.00 0.00 61.98 61.33 1s7n s VAL 169 Cb -0.37 -1.97 -0.05 0.00 0.00 0.00 0.00 36.38 34.00 1s7n s VAL 169 CO 0.42 0.53 1.03 0.20 0.00 0.00 0.00 175.10 177.28 1s7n s ASN 170 N 0.74 7.36 -0.36 3.32 0.01 0.79 -0.22 114.94 126.58 1s7n s ASN 170 Ca -0.08 1.83 -0.11 0.00 -0.71 0.00 0.00 52.86 53.80 1s7n s ASN 170 Cb -0.16 -2.58 0.02 0.00 0.41 0.00 0.00 41.25 38.94 1s7n s ASN 170 CO 0.00 -0.21 0.19 -0.32 -1.51 0.00 0.00 177.10 175.25 1s7n s MET 171 N 0.42 2.99 0.14 -0.60 -2.45 0.02 -1.75 119.30 118.05 1s7n s MET 171 Ca 0.51 -0.97 0.05 0.00 -1.25 0.00 0.00 55.69 54.03 1s7n s MET 171 Cb -0.25 -3.69 -0.04 0.00 1.25 0.00 0.00 34.83 32.11 1s7n s MET 171 CO 0.30 -0.62 0.08 0.71 1.05 0.00 0.00 175.02 176.54 1s7n s TYR 172 N 1.58 3.08 -0.02 4.11 1.51 0.90 -0.17 117.35 128.35 1s7n s TYR 172 Ca 0.03 -0.02 -0.16 0.00 -1.01 0.00 0.00 57.07 55.92 1s7n s TYR 172 Cb -0.19 -1.52 0.03 0.00 -0.11 0.00 0.00 41.96 40.17 1s7n s TYR 172 CO 0.07 0.51 0.33 0.00 -1.11 0.00 0.00 175.55 175.35 1s7n s ALA 173 N -1.60 -0.83 -0.05 3.71 0.00 0.02 -0.47 121.76 122.55 1s7n s ALA 173 Ca 0.29 0.38 0.01 0.00 0.00 0.00 0.00 51.96 52.63 1s7n s ALA 173 Cb -0.11 0.07 0.02 0.00 0.00 0.00 0.00 23.12 23.10 1s7n s ALA 173 CO 0.22 -0.26 -0.03 0.50 0.00 0.00 0.00 175.76 176.18 1s7n s ARG 174 N -1.31 0.69 -0.17 0.00 3.52 0.11 -0.27 118.95 121.53 1s7n s ARG 174 Ca -0.13 -0.04 -0.07 0.00 -0.13 0.00 0.00 55.73 55.36 1s7n s ARG 174 Cb -0.05 -0.79 -0.04 0.00 -1.56 0.00 0.00 34.95 32.52 1s7n s ARG 174 CO 0.04 -0.12 0.06 0.42 -0.81 0.00 0.00 175.30 174.89 1s7n s ILE 175 N 1.09 4.80 -0.14 4.11 1.01 -1.26 -0.64 121.20 130.17 1s7n s ILE 175 Ca -0.09 -0.04 -0.04 0.00 0.00 0.00 0.00 60.65 60.49 1s7n s ILE 175 Cb -0.14 -3.14 0.05 0.00 0.01 0.00 0.00 42.46 39.24 1s7n s ILE 175 CO -0.01 0.49 0.08 -0.63 0.00 0.00 0.00 174.94 174.87 1s7n s ILE 176 N 0.11 -0.09 -0.32 2.92 1.01 0.16 -5.01 121.20 119.99 1s7n s ILE 176 Ca 0.05 -0.00 -0.10 0.00 0.00 0.00 0.00 60.65 60.60 1s7n s ILE 176 Cb -0.12 -0.46 -0.00 0.00 0.01 0.00 0.00 42.46 41.88 1s7n s ILE 176 CO 0.01 -0.15 0.16 -1.81 0.00 0.00 0.00 174.94 173.14 1s7n s ASP 177 N 2.15 5.58 -0.72 3.58 1.01 -1.26 -4.60 116.67 122.41 1s7n s ASP 177 Ca 0.03 -0.56 -0.25 0.00 0.71 0.00 0.00 52.55 52.47 1s7n s ASP 177 Cb -0.15 -2.01 0.05 0.00 1.01 0.00 0.00 42.92 41.82 1s7n s ASP 177 CO -0.07 -0.21 1.15 0.00 0.21 0.00 0.00 175.17 176.25 1s7n s ALA 178 N 1.61 2.90 -1.16 5.23 0.00 -1.26 -5.09 121.76 124.00 1s7n s ALA 178 Ca 0.04 -1.60 0.09 0.00 0.00 0.00 0.00 51.96 50.50 1s7n s ALA 178 Cb -0.17 -4.10 0.07 0.00 0.00 0.00 0.00 23.12 18.92 1s7n s ALA 178 CO 0.06 -3.09 0.79 -0.25 0.00 0.00 0.00 175.76 173.28