#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1we7 s SER 2 N 0.00 -0.65 0.33 1.61 0.01 -1.26 -5.17 113.70 108.58 1we7 s SER 2 Ca 0.00 1.11 -0.02 0.00 1.31 0.00 0.00 55.95 58.36 1we7 s SER 2 Cb 0.00 1.03 -0.04 0.00 0.21 0.00 0.00 66.02 67.22 1we7 s SER 2 CO 0.00 -0.20 0.56 -0.55 0.41 0.00 0.00 173.24 173.45 1we7 s SER 3 N 1.14 6.35 -1.00 2.44 0.15 -1.26 -5.03 113.70 116.49 1we7 s SER 3 Ca -0.07 0.57 -0.16 0.00 0.70 0.00 0.00 55.95 56.99 1we7 s SER 3 Cb -0.06 -2.08 0.17 0.00 -1.71 0.00 0.00 66.02 62.33 1we7 s SER 3 CO -0.11 -0.26 1.15 -0.83 1.20 0.00 0.00 173.24 174.38 1we7 s GLY 4 N -3.68 2.27 -0.25 9.45 0.00 -1.26 -4.99 107.32 108.86 1we7 s GLY 4 Ca 0.42 -3.09 -0.06 0.00 0.00 0.00 0.00 44.72 41.99 1we7 s GLY 4 CO 0.34 1.85 0.03 -0.56 0.00 0.00 0.00 173.10 174.76 1we7 s SER 5 N 3.02 4.83 0.72 1.64 0.01 -1.26 -5.09 113.70 117.56 1we7 s SER 5 Ca 0.33 -0.40 -0.16 0.00 1.31 0.00 0.00 55.95 57.03 1we7 s SER 5 Cb -0.06 -1.85 0.02 0.00 0.21 0.00 0.00 66.02 64.35 1we7 s SER 5 CO -0.07 -0.07 1.17 -1.54 0.41 0.00 0.00 173.24 173.14 1we7 n SER 6 N 4.86 1.29 0.00 2.44 3.41 -1.26 -5.02 113.62 119.34 1we7 n SER 6 Ca -0.16 0.71 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 1we7 n SER 6 Cb 0.50 -1.50 0.00 0.00 -0.26 0.00 0.00 64.21 62.96 1we7 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1we7 n GLY 7 N 0.87 0.40 3.46 5.00 0.00 -1.26 -5.13 105.19 108.52 1we7 n GLY 7 Ca 0.14 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.02 1we7 n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1we7 s THR 8 N 0.73 0.00 0.29 2.61 2.01 -1.25 -4.99 115.64 115.04 1we7 s THR 8 Ca 0.00 -0.03 0.05 0.00 0.31 0.00 0.00 61.69 62.02 1we7 s THR 8 Cb 0.00 -1.00 0.29 0.00 0.01 0.00 0.00 72.50 71.80 1we7 s THR 8 CO 0.00 -0.01 1.75 -0.33 -0.69 0.00 0.00 174.62 175.34 1we7 h GLU 9 N 2.46 0.63 -0.24 4.92 3.07 -1.99 0.51 114.58 123.94 1we7 h GLU 9 Ca -0.31 -0.04 -0.19 0.00 -0.50 0.00 0.00 59.36 58.32 1we7 h GLU 9 Cb 1.24 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 29.01 1we7 h GLU 9 CO 0.39 0.41 -0.60 0.38 -1.40 0.00 0.00 179.01 178.19 1we7 h ASP 10 N 0.64 0.90 -1.93 1.42 2.03 -2.04 -3.24 116.42 114.21 1we7 h ASP 10 Ca 0.56 -0.51 -0.76 0.00 -0.73 0.00 0.00 57.03 55.60 1we7 h ASP 10 Cb 0.93 -0.26 -0.28 0.00 -0.83 0.00 0.00 39.33 38.89 1we7 h ASP 10 CO -0.42 1.29 0.96 -0.24 -1.03 0.00 0.00 179.24 179.81 1we7 n SER 11 N -3.98 7.39 -4.86 4.15 2.88 0.06 -5.00 113.62 114.26 1we7 n SER 11 Ca -0.05 -3.83 -0.32 0.00 -1.33 0.00 0.00 58.87 53.34 1we7 n SER 11 Cb 0.65 -1.03 -0.06 0.00 -0.75 0.00 0.00 64.21 63.03 1we7 n SER 11 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1we7 s LEU 12 N -4.04 4.05 0.88 2.46 1.43 -0.53 -3.96 118.68 118.98 1we7 s LEU 12 Ca 0.52 1.19 -0.10 0.00 -1.03 0.00 0.00 54.13 54.71 1we7 s LEU 12 Cb 0.44 -4.00 0.13 0.00 0.03 0.00 0.00 46.19 42.79 1we7 s LEU 12 CO -0.39 -0.21 1.13 -0.04 0.23 0.00 0.00 176.35 177.07 1we7 s MET 13 N -3.08 1.29 0.04 1.70 -1.94 -1.26 -5.03 119.30 111.01 1we7 s MET 13 Ca 0.53 1.42 -0.01 0.00 -1.71 0.00 0.00 55.69 55.92 1we7 s MET 13 Cb -0.10 -1.77 0.01 0.00 2.01 0.00 0.00 34.83 34.98 1we7 s MET 13 CO 0.20 -2.40 0.03 -0.35 -0.01 0.00 0.00 175.02 172.49 1we7 n PRO 14 N -4.06 -1.09 -0.06 2.03 -0.04 -1.26 -4.86 135.00 125.65 1we7 n PRO 14 Ca 0.11 -0.05 -0.22 0.00 -0.04 0.00 0.00 63.50 63.29 1we7 n PRO 14 Cb 0.52 -0.05 -0.12 0.00 -0.04 0.00 0.00 33.50 33.81 1we7 n PRO 14 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1we7 n GLU 15 N -1.61 0.65 0.33 0.54 2.13 -1.26 -3.74 120.64 117.67 1we7 n GLU 15 Ca 0.00 0.40 -0.18 0.00 0.66 0.00 0.00 57.16 58.05 1we7 n GLU 15 Cb 0.02 -1.70 -0.09 0.00 0.27 0.00 0.00 31.44 29.94 1we7 n GLU 15 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1we7 h GLU 16 N -0.52 -0.98 -0.38 5.31 4.39 -1.96 -2.93 114.58 117.52 1we7 h GLU 16 Ca -0.42 0.07 0.08 0.00 0.34 0.00 0.00 59.36 59.43 1we7 h GLU 16 Cb 1.66 0.22 -0.09 0.00 -0.10 0.00 0.00 28.75 30.44 1we7 h GLU 16 CO -0.10 -0.65 -0.23 1.49 -1.16 0.00 0.00 179.01 178.35 1we7 h GLU 17 N -1.02 -0.16 -0.76 2.33 4.81 -1.98 -2.46 114.58 115.34 1we7 h GLU 17 Ca -0.07 0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.24 1we7 h GLU 17 Cb 0.86 0.04 -0.09 0.00 0.63 0.00 0.00 28.75 30.18 1we7 h GLU 17 CO -0.00 -0.11 -0.45 0.34 -0.73 0.00 0.00 179.01 178.06 1we7 n PHE 18 N -5.39 -0.34 -0.34 0.92 -0.00 -1.12 0.18 117.46 111.39 1we7 n PHE 18 Ca 0.02 0.95 0.26 0.00 -0.00 0.00 0.00 57.45 58.68 1we7 n PHE 18 Cb 0.30 -0.55 0.55 0.00 -0.00 0.00 0.00 39.48 39.78 1we7 n PHE 18 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 1we7 h LEU 19 N 0.00 0.38 -1.40 -2.13 3.38 -1.31 1.06 115.31 115.28 1we7 h LEU 19 Ca 0.12 0.08 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 1we7 h LEU 19 Cb 0.31 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1we7 h LEU 19 CO -0.72 0.04 -0.30 0.03 0.09 0.00 0.00 178.44 177.59 1we7 h ARG 20 N 0.32 0.00 0.00 1.13 2.47 0.21 -3.37 114.38 115.13 1we7 h ARG 20 Ca 0.62 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.34 1we7 h ARG 20 Cb 1.70 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 30.02 1we7 h ARG 20 CO -0.28 0.30 -0.10 0.54 0.56 0.00 0.00 179.97 180.99 1we7 n ARG 21 N -4.15 0.05 -3.15 0.04 5.12 0.31 -4.97 116.66 109.91 1we7 n ARG 21 Ca -0.02 0.07 -0.39 0.00 -1.93 0.00 0.00 57.85 55.58 1we7 n ARG 21 Cb 0.35 -0.64 -0.05 0.00 -1.16 0.00 0.00 32.46 30.95 1we7 n ARG 21 CO 0.00 0.00 0.00 -0.80 -1.93 0.00 0.00 177.63 174.90 1we7 s ASN 22 N -4.12 7.02 0.00 0.55 0.01 0.19 -4.92 114.94 113.66 1we7 s ASN 22 Ca -0.03 1.21 0.00 0.00 -0.71 0.00 0.00 52.86 53.33 1we7 s ASN 22 Cb 0.00 -2.39 0.00 0.00 0.41 0.00 0.00 41.25 39.28 1we7 s ASN 22 CO 0.04 0.06 0.00 1.17 -1.51 0.00 0.00 177.10 176.87 1we7 n LYS 23 N 2.85 0.57 0.00 -0.60 3.00 -1.26 -3.86 118.16 118.86 1we7 n LYS 23 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.26 1we7 n LYS 23 Cb 0.51 -0.77 0.00 0.00 0.00 0.00 0.00 35.03 34.77 1we7 n LYS 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1we7 n GLY 24 N 2.38 -1.75 3.77 3.14 0.00 -1.26 -4.05 105.19 107.42 1we7 n GLY 24 Ca 0.00 -1.68 -0.34 0.00 0.00 0.00 0.00 46.02 43.99 1we7 n GLY 24 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1we7 s PRO 25 N 0.00 3.17 -0.16 1.61 0.04 -1.26 -5.01 135.00 133.39 1we7 s PRO 25 Ca 0.00 1.53 -0.07 0.00 0.04 0.00 0.00 61.00 62.50 1we7 s PRO 25 Cb 0.00 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.51 1we7 s PRO 25 CO 0.00 -0.98 0.08 0.14 0.04 0.00 0.00 177.00 176.28 1we7 s VAL 26 N -1.97 5.00 -0.52 -0.36 -7.23 -1.11 -4.86 120.40 109.35 1we7 s VAL 26 Ca 0.71 0.03 -0.23 0.00 -1.81 0.00 0.00 61.98 60.68 1we7 s VAL 26 Cb -0.23 -3.22 0.04 0.00 0.56 0.00 0.00 36.38 33.53 1we7 s VAL 26 CO 0.32 0.51 0.85 -0.44 -0.31 0.00 0.00 175.10 176.03 1we7 s SER 27 N -0.11 6.33 -0.04 4.85 0.01 -1.26 -3.43 113.70 120.06 1we7 s SER 27 Ca 0.08 -0.40 0.01 0.00 1.31 0.00 0.00 55.95 56.94 1we7 s SER 27 Cb -0.12 -2.40 -0.03 0.00 0.21 0.00 0.00 66.02 63.68 1we7 s SER 27 CO 0.01 -1.09 -0.02 0.27 0.41 0.00 0.00 173.24 172.81 1we7 s ILE 28 N 3.55 4.06 -0.16 1.44 -5.25 -1.23 -1.45 121.20 122.17 1we7 s ILE 28 Ca 0.27 -0.49 -0.04 0.00 -0.99 0.00 0.00 60.65 59.40 1we7 s ILE 28 Cb -0.14 -2.75 -0.03 0.00 2.95 0.00 0.00 42.46 42.50 1we7 s ILE 28 CO 0.19 0.49 -0.04 -0.75 -1.79 0.00 0.00 174.94 173.04 1we7 s LYS 29 N -1.20 3.67 -0.43 0.37 2.20 -0.73 -2.67 119.74 120.94 1we7 s LYS 29 Ca 0.16 -0.52 -0.14 0.00 -0.36 0.00 0.00 55.97 55.11 1we7 s LYS 29 Cb -0.11 -2.92 0.05 0.00 -1.51 0.00 0.00 37.83 33.34 1we7 s LYS 29 CO 0.06 0.23 0.31 0.08 -0.36 0.00 0.00 175.35 175.67 1we7 s VAL 30 N 0.38 5.02 -0.69 4.02 1.01 0.14 0.65 120.40 130.94 1we7 s VAL 30 Ca -0.04 -0.91 -0.26 0.00 0.00 0.00 0.00 61.98 60.77 1we7 s VAL 30 Cb -0.14 -3.89 -0.01 0.00 0.00 0.00 0.00 36.38 32.34 1we7 s VAL 30 CO 0.03 -0.41 1.68 -1.58 0.00 0.00 0.00 175.10 174.82 1we7 s GLN 31 N 1.62 2.82 -0.38 2.72 -0.44 -0.80 -1.40 119.66 123.81 1we7 s GLN 31 Ca 0.04 0.22 -0.24 0.00 -2.50 0.00 0.00 55.36 52.88 1we7 s GLN 31 Cb -0.21 -4.42 0.01 0.00 -1.64 0.00 0.00 33.01 26.75 1we7 s GLN 31 CO 0.07 -2.59 0.83 0.08 0.50 0.00 0.00 175.29 174.18 1we7 s VAL 32 N 8.01 4.67 0.92 1.34 1.01 0.36 -3.00 120.40 133.71 1we7 s VAL 32 Ca 0.57 0.92 -0.15 0.00 0.00 0.00 0.00 61.98 63.32 1we7 s VAL 32 Cb -0.10 -4.26 0.23 0.00 0.00 0.00 0.00 36.38 32.24 1we7 s VAL 32 CO 0.16 -0.50 0.81 -0.81 0.00 0.00 0.00 175.10 174.76 1we7 n PRO 33 N 6.57 -2.61 -3.97 2.72 -0.04 -1.26 -1.38 135.00 135.03 1we7 n PRO 33 Ca 0.04 -1.30 -0.34 0.00 -0.04 0.00 0.00 63.50 61.86 1we7 n PRO 33 Cb 0.48 -1.22 -0.14 0.00 -0.04 0.00 0.00 33.50 32.58 1we7 n PRO 33 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1we7 s ASN 34 N -3.70 4.73 -0.48 3.54 2.47 -1.26 -2.71 114.94 117.53 1we7 s ASN 34 Ca 0.53 -1.38 -0.16 0.00 0.42 0.00 0.00 52.86 52.27 1we7 s ASN 34 Cb -0.05 -1.65 0.08 0.00 -1.45 0.00 0.00 41.25 38.17 1we7 s ASN 34 CO 0.41 -0.25 0.42 -0.04 -3.72 0.00 0.00 177.10 173.92 1we7 s MET 35 N 1.18 2.99 0.00 0.43 -1.94 -0.84 -4.89 119.30 116.23 1we7 s MET 35 Ca -0.06 -1.34 0.25 0.00 -1.71 0.00 0.00 55.69 52.84 1we7 s MET 35 Cb -0.20 -4.14 0.74 0.00 2.01 0.00 0.00 34.83 33.24 1we7 s MET 35 CO -0.03 -1.06 1.57 0.94 -0.01 0.00 0.00 175.02 176.42 1we7 n GLN 36 N 5.28 1.91 -0.60 2.03 7.27 -1.26 -4.47 117.38 127.54 1we7 n GLN 36 Ca -0.12 -1.33 -0.05 0.00 0.07 0.00 0.00 57.00 55.57 1we7 n GLN 36 Cb 0.44 -1.46 -0.08 0.00 2.41 0.00 0.00 30.24 31.55 1we7 n GLN 36 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1we7 n ASP 37 N 0.59 3.94 -3.80 1.69 9.92 -1.26 -4.72 116.55 122.91 1we7 n ASP 37 Ca 0.17 -2.16 -0.25 0.00 -0.53 0.00 0.00 54.79 52.03 1we7 n ASP 37 Cb 0.43 -0.97 -0.03 0.00 -0.64 0.00 0.00 41.12 39.91 1we7 n ASP 37 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1we7 n LYS 38 N 2.23 -0.74 -3.75 -1.24 3.00 -1.26 -4.88 118.16 111.51 1we7 n LYS 38 Ca 0.19 -0.05 -0.27 0.00 -0.00 0.00 0.00 58.31 58.18 1we7 n LYS 38 Cb 0.56 -1.71 -0.03 0.00 0.00 0.00 0.00 35.03 33.85 1we7 n LYS 38 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.40 177.32 1we7 s THR 39 N -3.97 5.23 -0.13 3.15 -1.32 -1.26 -4.98 115.64 112.35 1we7 s THR 39 Ca 0.16 -0.47 -0.00 0.00 -1.21 0.00 0.00 61.69 60.17 1we7 s THR 39 Cb -0.09 -3.74 0.11 0.00 -1.51 0.00 0.00 72.50 67.26 1we7 s THR 39 CO 0.62 -0.17 1.79 -1.84 -2.21 0.00 0.00 174.62 172.81 1we7 n GLU 40 N -0.70 1.33 -4.98 7.08 0.00 -1.26 -4.81 120.64 117.30 1we7 n GLU 40 Ca -0.05 -0.67 -0.29 0.00 0.00 0.00 0.00 57.16 56.14 1we7 n GLU 40 Cb 0.54 -1.26 -0.17 0.00 0.00 0.00 0.00 31.44 30.55 1we7 n GLU 40 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.13 175.55 1we7 s TRP 41 N -0.77 2.18 -0.82 -1.84 0.51 -1.26 -4.52 118.94 112.42 1we7 s TRP 41 Ca 0.13 -0.88 -0.21 0.00 -2.12 0.00 0.00 56.10 53.03 1we7 s TRP 41 Cb 0.10 -1.49 -0.14 0.00 -0.81 0.00 0.00 33.47 31.14 1we7 s TRP 41 CO 0.00 -0.38 1.96 1.63 -0.51 0.00 0.00 176.95 179.65 1we7 n LYS 42 N 3.64 1.62 -3.86 4.98 5.02 -1.26 -4.82 118.16 123.48 1we7 n LYS 42 Ca -0.20 -1.87 -0.34 0.00 -2.02 0.00 0.00 58.31 53.87 1we7 n LYS 42 Cb 0.52 -2.92 -0.13 0.00 -0.02 0.00 0.00 35.03 32.49 1we7 n LYS 42 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1we7 s LEU 43 N 1.18 5.09 -0.45 -0.35 1.43 -1.26 -4.80 118.68 119.51 1we7 s LEU 43 Ca 0.56 -2.08 0.08 0.00 -1.03 0.00 0.00 54.13 51.66 1we7 s LEU 43 Cb 0.14 -1.76 0.26 0.00 0.03 0.00 0.00 46.19 44.86 1we7 s LEU 43 CO 0.10 -0.49 0.59 0.59 0.23 0.00 0.00 176.35 177.37 1we7 n ASN 44 N 4.47 1.11 -2.64 2.29 4.13 -1.17 -1.98 115.26 121.46 1we7 n ASN 44 Ca -0.00 -2.90 -0.12 0.00 1.68 0.00 0.00 54.58 53.25 1we7 n ASN 44 Cb 0.42 -0.65 0.01 0.00 -1.54 0.00 0.00 39.78 38.02 1we7 n ASN 44 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1we7 n GLY 45 N 1.21 0.06 3.68 7.41 0.00 -1.10 -4.92 105.19 111.53 1we7 n GLY 45 Ca 0.23 0.34 -0.11 0.00 0.00 0.00 0.00 46.02 46.49 1we7 n GLY 45 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1we7 s GLN 46 N -1.17 2.02 -0.05 1.61 -2.07 -0.48 -5.02 119.66 114.51 1we7 s GLN 46 Ca 0.11 -1.49 0.01 0.00 -1.82 0.00 0.00 55.36 52.17 1we7 s GLN 46 Cb -0.01 0.55 0.02 0.00 -1.09 0.00 0.00 33.01 32.47 1we7 s GLN 46 CO 0.26 -0.90 -0.07 0.20 -1.32 0.00 0.00 175.29 173.46 1we7 s GLY 47 N -3.11 0.55 -0.21 2.60 0.00 -1.26 -0.49 107.32 105.40 1we7 s GLY 47 Ca 0.21 -0.16 -0.03 0.00 0.00 0.00 0.00 44.72 44.74 1we7 s GLY 47 CO 0.14 0.33 -0.06 1.08 0.00 0.00 0.00 173.10 174.59 1we7 s LEU 48 N 0.82 2.84 0.03 0.66 1.43 -0.49 -4.91 118.68 119.06 1we7 s LEU 48 Ca -0.13 -0.40 0.03 0.00 -1.03 0.00 0.00 54.13 52.60 1we7 s LEU 48 Cb -0.15 -1.72 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 1we7 s LEU 48 CO 0.01 -0.01 -0.03 -0.69 0.23 0.00 0.00 176.35 175.87 1we7 s VAL 49 N 1.40 3.93 -0.12 -1.59 1.01 -1.26 0.27 120.40 124.03 1we7 s VAL 49 Ca 0.05 -0.77 -0.06 0.00 0.00 0.00 0.00 61.98 61.20 1we7 s VAL 49 Cb -0.14 -2.77 0.05 0.00 0.00 0.00 0.00 36.38 33.52 1we7 s VAL 49 CO -0.04 0.31 0.27 -0.36 0.00 0.00 0.00 175.10 175.29 1we7 s PHE 50 N -1.11 -0.40 -0.53 5.22 0.08 -1.09 -5.02 117.98 115.13 1we7 s PHE 50 Ca 0.20 0.92 -0.19 0.00 0.12 0.00 0.00 56.93 57.98 1we7 s PHE 50 Cb -0.11 0.05 0.07 0.00 -0.57 0.00 0.00 43.02 42.46 1we7 s PHE 50 CO 0.11 -0.29 0.64 0.99 -0.10 0.00 0.00 175.22 176.57 1we7 s THR 51 N 1.66 4.87 -0.04 0.64 2.01 -1.26 -3.48 115.64 120.04 1we7 s THR 51 Ca -0.06 -0.64 -0.05 0.00 0.31 0.00 0.00 61.69 61.25 1we7 s THR 51 Cb -0.11 -4.34 0.01 0.00 0.01 0.00 0.00 72.50 68.07 1we7 s THR 51 CO -0.09 -0.88 0.12 -0.76 -0.69 0.00 0.00 174.62 172.32 1we7 s LEU 52 N 2.61 1.55 1.08 4.42 1.43 -1.22 -4.92 118.68 123.62 1we7 s LEU 52 Ca 0.14 0.16 -0.15 0.00 -1.03 0.00 0.00 54.13 53.25 1we7 s LEU 52 Cb -0.21 0.46 0.23 0.00 0.03 0.00 0.00 46.19 46.70 1we7 s LEU 52 CO 0.10 -0.11 1.10 -2.16 0.23 0.00 0.00 176.35 175.52 1we7 s PRO 53 N -0.22 -0.20 -0.84 1.29 0.04 -1.26 -2.75 135.00 131.05 1we7 s PRO 53 Ca -0.03 0.30 -0.07 0.00 0.04 0.00 0.00 61.00 61.23 1we7 s PRO 53 Cb -0.02 -1.68 0.22 0.00 0.04 0.00 0.00 34.50 33.05 1we7 s PRO 53 CO 0.00 -3.11 0.75 -0.51 0.04 0.00 0.00 177.00 174.17 1we7 s LEU 54 N -6.64 6.00 0.00 -3.56 1.02 -1.26 -4.69 118.68 109.54 1we7 s LEU 54 Ca 0.67 -3.15 0.00 0.00 0.02 0.00 0.00 54.13 51.67 1we7 s LEU 54 Cb -0.16 -2.04 0.00 0.00 0.02 0.00 0.00 46.19 44.01 1we7 s LEU 54 CO 0.57 -0.37 0.00 0.35 0.02 0.00 0.00 176.35 176.92 1we7 n THR 55 N 3.21 0.00 -3.40 5.49 -2.24 -1.26 -4.69 114.28 111.39 1we7 n THR 55 Ca 0.16 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.82 1we7 n THR 55 Cb 0.41 -0.57 0.02 0.00 -2.10 0.00 0.00 70.33 68.08 1we7 n THR 55 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1we7 n ASP 56 N -1.62 1.52 -3.28 3.42 9.92 -1.26 -5.02 116.55 120.24 1we7 n ASP 56 Ca 0.00 -1.87 -0.20 0.00 -0.53 0.00 0.00 54.79 52.18 1we7 n ASP 56 Cb 0.32 -0.10 0.15 0.00 -0.64 0.00 0.00 41.12 40.85 1we7 n ASP 56 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1we7 n GLN 57 N -1.36 -1.40 0.09 -1.24 6.02 -1.26 -3.90 117.38 114.34 1we7 n GLN 57 Ca 0.03 -1.34 0.11 0.00 -0.01 0.00 0.00 57.00 55.80 1we7 n GLN 57 Cb 0.31 -1.00 0.45 0.00 1.02 0.00 0.00 30.24 31.03 1we7 n GLN 57 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1we7 n VAL 58 N -3.54 0.75 -0.01 5.09 0.31 -1.16 -3.34 118.33 116.43 1we7 n VAL 58 Ca 0.11 0.11 -0.10 0.00 -0.01 0.00 0.00 64.34 64.45 1we7 n VAL 58 Cb 0.40 -0.97 -0.05 0.00 -0.91 0.00 0.00 33.84 32.31 1we7 n VAL 58 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 1we7 h SER 59 N 0.00 0.01 -1.00 4.52 4.64 -1.84 -1.58 113.55 118.29 1we7 h SER 59 Ca 0.00 0.02 0.29 0.00 -0.47 0.00 0.00 61.79 61.63 1we7 h SER 59 Cb 0.43 0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 62.51 1we7 h SER 59 CO 0.00 0.02 0.85 -0.37 -0.87 0.00 0.00 176.83 176.47 1we7 h VAL 60 N 0.07 0.29 0.03 0.95 -1.51 -1.93 0.21 116.25 114.35 1we7 h VAL 60 Ca 0.05 0.00 -0.08 0.00 -1.23 0.00 0.00 66.70 65.44 1we7 h VAL 60 Cb 0.04 0.37 0.01 0.00 -2.13 0.00 0.00 31.29 29.58 1we7 h VAL 60 CO -0.07 0.00 -0.34 0.40 -1.23 0.00 0.00 177.57 176.33 1we7 h ILE 61 N 0.00 1.58 -0.89 7.19 2.04 -1.50 -3.31 117.51 122.61 1we7 h ILE 61 Ca 0.47 -2.16 0.08 0.00 1.00 0.00 0.00 64.86 64.26 1we7 h ILE 61 Cb 2.18 2.97 -0.07 0.00 -0.74 0.00 0.00 36.82 41.16 1we7 h ILE 61 CO -0.00 0.59 0.55 0.11 0.00 0.00 0.00 178.15 179.39 1we7 h LYS 62 N -0.54 0.93 -0.97 2.37 1.57 -0.41 -0.81 116.57 118.71 1we7 h LYS 62 Ca -0.05 -0.06 0.27 0.00 -1.87 0.00 0.00 60.65 58.94 1we7 h LYS 62 Cb 1.16 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 33.21 1we7 h LYS 62 CO 0.07 0.62 0.68 -0.24 -0.57 0.00 0.00 179.45 180.00 1we7 h VAL 63 N 0.96 0.54 0.35 0.50 3.04 -1.41 -1.05 116.25 119.17 1we7 h VAL 63 Ca 0.41 -0.04 -0.02 0.00 -1.01 0.00 0.00 66.70 66.04 1we7 h VAL 63 Cb 0.26 0.41 0.00 0.00 -2.01 0.00 0.00 31.29 29.96 1we7 h VAL 63 CO -0.21 0.02 -0.17 0.11 -1.01 0.00 0.00 177.57 176.32 1we7 h LYS 64 N 0.12 -0.45 -0.75 4.17 1.79 -1.26 -1.29 116.57 118.90 1we7 h LYS 64 Ca 0.48 0.03 0.16 0.00 -2.18 0.00 0.00 60.65 59.14 1we7 h LYS 64 Cb 1.69 0.10 -0.11 0.00 -1.58 0.00 0.00 32.23 32.34 1we7 h LYS 64 CO -0.07 -0.15 0.22 0.82 -1.08 0.00 0.00 179.45 179.18 1we7 h ILE 65 N -0.73 0.54 -0.29 1.86 2.04 -1.24 0.23 117.51 119.92 1we7 h ILE 65 Ca -0.05 -0.11 -0.09 0.00 1.00 0.00 0.00 64.86 65.61 1we7 h ILE 65 Cb 0.50 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 1we7 h ILE 65 CO 0.08 0.06 -0.21 -0.74 0.00 0.00 0.00 178.15 177.34 1we7 h HIS 66 N 0.31 0.59 -0.37 1.37 2.76 -1.43 0.62 115.15 119.00 1we7 h HIS 66 Ca 0.43 -0.11 -0.08 0.00 -2.20 0.00 0.00 60.37 58.40 1we7 h HIS 66 Cb 0.72 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.52 1we7 h HIS 66 CO -0.23 0.70 -0.09 0.93 -1.30 0.00 0.00 177.93 177.94 1we7 h GLU 67 N 0.47 0.72 0.00 5.26 5.08 0.54 -3.36 114.58 123.29 1we7 h GLU 67 Ca 0.08 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 1we7 h GLU 67 Cb 0.62 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1we7 h GLU 67 CO 0.04 0.87 -0.10 0.00 -1.00 0.00 0.00 179.01 178.83 1we7 h ALA 68 N 0.83 0.00 -2.30 3.43 0.00 -0.71 -3.47 119.26 117.03 1we7 h ALA 68 Ca 0.09 -0.10 -0.49 0.00 0.00 0.00 0.00 54.91 54.42 1we7 h ALA 68 Cb 0.60 0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.50 1we7 h ALA 68 CO 0.04 0.10 -0.14 0.95 0.00 0.00 0.00 179.25 180.19 1we7 s THR 69 N -1.64 5.06 -0.05 0.00 -4.23 0.22 -4.97 115.64 110.02 1we7 s THR 69 Ca -0.03 -0.23 0.00 0.00 -1.18 0.00 0.00 61.69 60.25 1we7 s THR 69 Cb 0.00 -3.83 0.06 0.00 1.34 0.00 0.00 72.50 70.08 1we7 s THR 69 CO 0.04 -0.53 1.40 0.61 -0.54 0.00 0.00 174.62 175.60 1we7 n GLY 70 N -1.61 2.46 3.82 3.99 0.00 -1.26 -4.02 105.19 108.57 1we7 n GLY 70 Ca -0.03 -0.16 -0.36 0.00 0.00 0.00 0.00 46.02 45.47 1we7 n GLY 70 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1we7 s MET 71 N -0.36 3.55 0.56 1.61 -2.45 -1.26 -4.38 119.30 116.57 1we7 s MET 71 Ca 0.06 -0.19 -0.19 0.00 -1.25 0.00 0.00 55.69 54.12 1we7 s MET 71 Cb 0.05 -3.19 -0.05 0.00 1.25 0.00 0.00 34.83 32.89 1we7 s MET 71 CO 0.01 0.66 1.13 -1.25 1.05 0.00 0.00 175.02 176.61 1we7 s PRO 72 N -0.68 3.27 0.00 4.11 0.04 -1.26 -3.68 135.00 136.80 1we7 s PRO 72 Ca 0.13 1.58 -0.03 0.00 0.04 0.00 0.00 61.00 62.72 1we7 s PRO 72 Cb -0.12 -2.00 -0.14 0.00 0.04 0.00 0.00 34.50 32.28 1we7 s PRO 72 CO 0.03 -0.91 2.78 0.00 0.04 0.00 0.00 177.00 178.93 1we7 n ALA 73 N -1.47 5.12 0.12 8.56 0.00 -1.26 -3.79 120.51 127.79 1we7 n ALA 73 Ca 0.11 -0.96 0.00 0.00 0.00 0.00 0.00 53.44 52.60 1we7 n ALA 73 Cb 0.51 -1.74 0.00 0.00 0.00 0.00 0.00 19.45 18.22 1we7 n ALA 73 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1we7 n GLY 74 N 2.07 -0.45 0.32 0.00 0.00 -1.26 -4.91 105.19 100.96 1we7 n GLY 74 Ca 0.22 0.05 -0.04 0.00 0.00 0.00 0.00 46.02 46.25 1we7 n GLY 74 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1we7 h LYS 75 N 0.00 0.97 -6.24 1.61 1.79 -1.92 -3.41 116.57 109.37 1we7 h LYS 75 Ca 0.00 -0.18 -0.58 0.00 -2.18 0.00 0.00 60.65 57.71 1we7 h LYS 75 Cb 0.00 -0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 30.47 1we7 h LYS 75 CO 0.00 0.82 1.30 1.14 -1.08 0.00 0.00 179.45 181.63 1we7 s GLN 76 N -5.36 3.32 -0.22 3.15 -2.07 -1.25 -0.74 119.66 116.48 1we7 s GLN 76 Ca -0.11 1.51 -0.14 0.00 -1.82 0.00 0.00 55.36 54.81 1we7 s GLN 76 Cb 0.16 -4.22 -0.04 0.00 -1.09 0.00 0.00 33.01 27.82 1we7 s GLN 76 CO 0.81 -1.88 0.29 0.21 -1.32 0.00 0.00 175.29 173.41 1we7 s LYS 77 N 5.73 4.12 -0.29 9.60 2.20 -0.06 -4.94 119.74 136.12 1we7 s LYS 77 Ca 0.82 -0.01 -0.17 0.00 -0.36 0.00 0.00 55.97 56.25 1we7 s LYS 77 Cb -0.24 -3.54 -0.02 0.00 -1.51 0.00 0.00 37.83 32.52 1we7 s LYS 77 CO 0.34 -0.00 0.49 -0.51 -0.36 0.00 0.00 175.35 175.30 1we7 s LEU 78 N 1.22 4.12 -0.09 5.43 1.43 -1.26 -0.83 118.68 128.70 1we7 s LEU 78 Ca 0.14 0.33 -0.02 0.00 -1.03 0.00 0.00 54.13 53.55 1we7 s LEU 78 Cb -0.14 -2.60 -0.03 0.00 0.03 0.00 0.00 46.19 43.45 1we7 s LEU 78 CO 0.06 -0.32 -0.01 -1.58 0.23 0.00 0.00 176.35 174.73 1we7 s GLN 79 N 2.29 3.06 -0.15 1.70 0.74 0.74 -2.92 119.66 125.13 1we7 s GLN 79 Ca 0.19 -0.44 -0.04 0.00 0.05 0.00 0.00 55.36 55.12 1we7 s GLN 79 Cb -0.16 -2.79 0.07 0.00 1.10 0.00 0.00 33.01 31.24 1we7 s GLN 79 CO 0.10 0.62 0.22 -0.47 -0.55 0.00 0.00 175.29 175.22 1we7 s TYR 80 N -0.67 -0.32 -1.21 1.67 5.04 -0.07 -0.86 117.35 120.94 1we7 s TYR 80 Ca 0.11 0.59 -0.00 0.00 -2.44 0.00 0.00 57.07 55.32 1we7 s TYR 80 Cb -0.12 -0.22 -0.00 0.00 0.35 0.00 0.00 41.96 41.97 1we7 s TYR 80 CO 0.02 -0.44 0.95 0.39 -1.34 0.00 0.00 175.55 175.13 1we7 n GLU 81 N 5.33 -6.18 -2.30 4.97 -0.58 -1.26 -1.95 120.64 118.68 1we7 n GLU 81 Ca -0.05 0.81 -0.21 0.00 -0.42 0.00 0.00 57.16 57.29 1we7 n GLU 81 Cb 0.50 -5.76 -0.02 0.00 -0.57 0.00 0.00 31.44 25.59 1we7 n GLU 81 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1we7 n GLY 82 N -1.20 -0.20 3.21 0.62 0.00 -1.26 -4.98 105.19 101.37 1we7 n GLY 82 Ca -0.28 -0.02 -0.25 0.00 0.00 0.00 0.00 46.02 45.47 1we7 n GLY 82 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1we7 s ILE 83 N -3.00 1.50 -1.13 -0.61 1.01 -0.82 -5.06 121.20 113.10 1we7 s ILE 83 Ca 0.00 -1.01 -0.03 0.00 0.00 0.00 0.00 60.65 59.62 1we7 s ILE 83 Cb 0.00 -1.29 0.25 0.00 0.01 0.00 0.00 42.46 41.43 1we7 s ILE 83 CO 0.00 0.26 2.01 0.49 0.00 0.00 0.00 174.94 177.70 1we7 n PHE 84 N 2.16 2.70 -1.53 3.97 3.72 -1.26 -0.89 117.46 126.33 1we7 n PHE 84 Ca -0.16 -2.65 -0.46 0.00 -0.05 0.00 0.00 57.45 54.13 1we7 n PHE 84 Cb 0.54 -1.42 -0.02 0.00 -0.94 0.00 0.00 39.48 37.64 1we7 n PHE 84 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 1we7 n ILE 85 N 0.59 1.99 -4.57 4.37 -5.35 -1.15 -4.96 119.36 110.28 1we7 n ILE 85 Ca 0.52 -0.50 -0.26 0.00 -0.27 0.00 0.00 62.75 62.24 1we7 n ILE 85 Cb 0.26 -0.70 -0.11 0.00 -1.74 0.00 0.00 39.64 37.35 1we7 n ILE 85 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1we7 s LYS 86 N -1.38 1.86 0.36 6.28 1.02 -1.26 -4.40 119.74 122.22 1we7 s LYS 86 Ca 0.60 -2.04 0.13 0.00 0.02 0.00 0.00 55.97 54.68 1we7 s LYS 86 Cb -0.77 -1.42 0.68 0.00 -0.52 0.00 0.00 37.83 35.80 1we7 s LYS 86 CO 0.59 -0.07 1.80 0.38 -0.92 0.00 0.00 175.35 177.13 1we7 h ASP 87 N 1.89 0.00 0.34 2.83 3.04 -1.94 -2.58 116.42 120.00 1we7 h ASP 87 Ca -0.43 0.00 -0.05 0.00 -3.24 0.00 0.00 57.03 53.32 1we7 h ASP 87 Cb 1.24 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.52 1we7 h ASP 87 CO 0.77 0.40 -0.21 0.28 -2.04 0.00 0.00 179.24 178.43 1we7 h SER 88 N 0.00 0.00 -3.36 4.15 0.02 -1.98 -3.34 113.55 109.04 1we7 h SER 88 Ca -0.00 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.40 1we7 h SER 88 Cb 0.71 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.21 1we7 h SER 88 CO 0.05 0.21 -0.06 0.20 -1.14 0.00 0.00 176.83 176.10 1we7 s ASN 89 N -6.62 6.84 0.31 3.07 0.01 -0.97 -5.00 114.94 112.59 1we7 s ASN 89 Ca -0.03 1.11 -0.12 0.00 -0.71 0.00 0.00 52.86 53.12 1we7 s ASN 89 Cb 0.14 -2.30 -0.08 0.00 0.41 0.00 0.00 41.25 39.42 1we7 s ASN 89 CO 0.66 0.08 0.68 -0.44 -1.51 0.00 0.00 177.10 176.57 1we7 s SER 90 N -1.75 6.64 -0.01 -1.22 0.01 -1.26 -3.01 113.70 113.09 1we7 s SER 90 Ca 0.39 1.10 -0.21 0.00 1.31 0.00 0.00 55.95 58.54 1we7 s SER 90 Cb -0.15 -2.30 -0.12 0.00 0.21 0.00 0.00 66.02 63.66 1we7 s SER 90 CO 0.19 -0.22 0.88 -0.07 0.41 0.00 0.00 173.24 174.44 1we7 h LEU 91 N 2.04 -0.59 -0.98 2.44 3.38 -1.86 -3.22 115.31 116.53 1we7 h LEU 91 Ca -0.47 -0.01 0.33 0.00 0.09 0.00 0.00 57.88 57.81 1we7 h LEU 91 Cb 1.18 0.15 -0.16 0.00 0.09 0.00 0.00 40.66 41.92 1we7 h LEU 91 CO 0.66 -0.18 0.42 0.00 0.09 0.00 0.00 178.44 179.44 1we7 h ALA 92 N -1.08 1.78 -0.59 1.53 0.00 -1.84 0.43 119.26 119.48 1we7 h ALA 92 Ca -0.07 0.24 0.11 0.00 0.00 0.00 0.00 54.91 55.19 1we7 h ALA 92 Cb 0.56 0.30 -0.08 0.00 0.00 0.00 0.00 17.79 18.57 1we7 h ALA 92 CO 0.12 -0.67 0.14 -0.92 0.00 0.00 0.00 179.25 177.91 1we7 h TYR 93 N 0.16 0.22 0.00 0.00 5.03 -1.84 0.24 116.97 120.78 1we7 h TYR 93 Ca 0.72 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 62.04 1we7 h TYR 93 Cb 1.68 -0.01 -0.00 0.00 1.55 0.00 0.00 36.73 39.95 1we7 h TYR 93 CO -0.13 -0.02 -0.10 1.88 -1.32 0.00 0.00 178.16 178.48 1we7 h TYR 94 N 0.27 0.00 -5.32 -3.82 0.05 -0.20 -3.44 116.97 104.51 1we7 h TYR 94 Ca 0.31 0.00 -0.27 0.00 0.05 0.00 0.00 58.73 58.82 1we7 h TYR 94 Cb 0.45 0.00 0.17 0.00 1.01 0.00 0.00 36.73 38.36 1we7 h TYR 94 CO -0.24 0.10 -0.75 0.09 -1.05 0.00 0.00 178.16 176.32 1we7 n ASN 95 N -3.39 -3.97 -3.58 3.88 3.02 0.83 -4.94 115.26 107.11 1we7 n ASN 95 Ca -0.01 -0.61 -0.29 0.00 -0.03 0.00 0.00 54.58 53.64 1we7 n ASN 95 Cb 0.28 -4.82 0.24 0.00 -0.61 0.00 0.00 39.78 34.87 1we7 n ASN 95 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1we7 n MET 96 N -3.53 -2.84 -4.05 3.52 2.81 -1.26 -5.07 117.12 106.69 1we7 n MET 96 Ca -0.18 -1.76 -0.09 0.00 -1.81 0.00 0.00 57.70 53.87 1we7 n MET 96 Cb 0.64 -1.57 -0.11 0.00 -0.71 0.00 0.00 33.22 31.48 1we7 n MET 96 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1we7 s ALA 97 N -3.16 0.39 1.04 3.04 0.00 -1.26 -4.99 121.76 116.83 1we7 s ALA 97 Ca 0.70 -0.94 -0.17 0.00 0.00 0.00 0.00 51.96 51.55 1we7 s ALA 97 Cb -0.06 0.20 0.04 0.00 0.00 0.00 0.00 23.12 23.30 1we7 s ALA 97 CO 0.53 -0.25 0.01 0.43 0.00 0.00 0.00 175.76 176.48 1we7 n SER 98 N 0.79 -2.53 -3.48 0.00 7.64 -1.26 -3.19 113.62 111.60 1we7 n SER 98 Ca -0.19 0.07 -0.25 0.00 1.01 0.00 0.00 58.87 59.52 1we7 n SER 98 Cb 0.58 -1.01 0.04 0.00 -1.01 0.00 0.00 64.21 62.81 1we7 n SER 98 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1we7 n GLY 99 N 2.01 -0.52 3.91 0.23 0.00 -1.00 -4.87 105.19 104.95 1we7 n GLY 99 Ca 0.03 0.18 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 1we7 n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1we7 s ALA 100 N -3.21 2.67 -0.18 4.61 0.00 -0.53 -4.95 121.76 120.17 1we7 s ALA 100 Ca 0.50 -0.74 -0.05 0.00 0.00 0.00 0.00 51.96 51.66 1we7 s ALA 100 Cb -0.24 -2.89 0.07 0.00 0.00 0.00 0.00 23.12 20.05 1we7 s ALA 100 CO 0.61 -1.71 0.10 0.54 0.00 0.00 0.00 175.76 175.29 1we7 s VAL 101 N -3.57 -0.09 -0.42 0.00 0.11 -1.26 -1.78 120.40 113.38 1we7 s VAL 101 Ca 0.63 -0.23 -0.20 0.00 -2.93 0.00 0.00 61.98 59.26 1we7 s VAL 101 Cb -0.10 -0.62 0.02 0.00 -1.53 0.00 0.00 36.38 34.15 1we7 s VAL 101 CO 0.49 -0.33 0.57 -0.63 -3.33 0.00 0.00 175.10 171.87 1we7 s ILE 102 N 2.14 4.92 -0.10 7.04 -1.09 0.21 -4.73 121.20 129.59 1we7 s ILE 102 Ca 0.03 0.01 -0.26 0.00 -2.23 0.00 0.00 60.65 58.20 1we7 s ILE 102 Cb -0.16 -4.14 -0.02 0.00 -1.58 0.00 0.00 42.46 36.56 1we7 s ILE 102 CO -0.12 -0.51 0.85 -1.00 -1.23 0.00 0.00 174.94 172.93 1we7 s HIS 103 N 2.59 3.53 0.11 3.97 3.76 -0.04 -1.91 115.29 127.29 1we7 s HIS 103 Ca 0.19 1.40 -0.23 0.00 -0.15 0.00 0.00 55.06 56.27 1we7 s HIS 103 Cb -0.15 -3.00 -0.07 0.00 1.11 0.00 0.00 32.58 30.46 1we7 s HIS 103 CO 0.17 -0.10 0.68 -1.17 -0.85 0.00 0.00 174.74 173.47 1we7 s LEU 104 N 1.52 4.54 0.03 0.89 2.96 -1.16 -0.18 118.68 127.28 1we7 s LEU 104 Ca 0.42 1.44 -0.02 0.00 -0.22 0.00 0.00 54.13 55.76 1we7 s LEU 104 Cb -0.18 -3.10 -0.02 0.00 0.50 0.00 0.00 46.19 43.38 1we7 s LEU 104 CO 0.18 0.21 0.01 0.00 -1.32 0.00 0.00 176.35 175.43 1we7 s ALA 105 N -0.97 0.12 -0.27 5.97 0.00 -0.01 -4.80 121.76 121.80 1we7 s ALA 105 Ca 0.33 -0.67 -0.29 0.00 0.00 0.00 0.00 51.96 51.33 1we7 s ALA 105 Cb -0.21 0.19 -0.00 0.00 0.00 0.00 0.00 23.12 23.10 1we7 s ALA 105 CO 0.22 -0.24 1.28 -0.51 0.00 0.00 0.00 175.76 176.51 1we7 s LEU 106 N -1.90 3.95 -0.10 0.00 1.43 -1.26 -0.88 118.68 119.91 1we7 s LEU 106 Ca -0.09 1.30 -0.30 0.00 -1.03 0.00 0.00 54.13 54.01 1we7 s LEU 106 Cb -0.04 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.61 1we7 s LEU 106 CO -0.03 -1.00 1.41 -0.75 0.23 0.00 0.00 176.35 176.21 1we7 s LYS 107 N 3.99 4.23 -0.56 1.70 2.20 0.08 -4.91 119.74 126.46 1we7 s LYS 107 Ca 0.55 1.88 0.04 0.00 -0.36 0.00 0.00 55.97 58.08 1we7 s LYS 107 Cb -0.17 -3.81 0.14 0.00 -1.51 0.00 0.00 37.83 32.48 1we7 s LYS 107 CO 0.21 -0.73 0.32 -1.21 -0.36 0.00 0.00 175.35 173.58 1we7 s GLU 108 N 3.48 2.05 0.33 4.03 2.02 -1.26 -4.93 118.70 124.42 1we7 s GLU 108 Ca 0.62 -2.77 -0.07 0.00 0.02 0.00 0.00 54.97 52.77 1we7 s GLU 108 Cb -0.27 -3.26 0.01 0.00 0.10 0.00 0.00 34.13 30.72 1we7 s GLU 108 CO 0.21 -1.16 0.54 1.03 0.02 0.00 0.00 175.26 175.91 1we7 s ARG 109 N -0.55 1.92 -0.60 1.61 0.52 -1.26 -5.11 118.95 115.47 1we7 s ARG 109 Ca 0.19 -1.60 -0.28 0.00 -0.52 0.00 0.00 55.73 53.53 1we7 s ARG 109 Cb -0.20 0.49 0.03 0.00 0.52 0.00 0.00 34.95 35.78 1we7 s ARG 109 CO -0.05 -0.82 1.27 0.45 0.02 0.00 0.00 175.30 176.17 1we7 s SER 110 N -3.16 6.32 -0.42 0.23 0.15 -1.26 -4.92 113.70 110.63 1we7 s SER 110 Ca 0.26 0.06 0.05 0.00 0.70 0.00 0.00 55.95 57.01 1we7 s SER 110 Cb -0.01 -2.55 0.18 0.00 -1.71 0.00 0.00 66.02 61.93 1we7 s SER 110 CO 0.16 -1.60 0.38 0.61 1.20 0.00 0.00 173.24 173.99 1we7 n GLY 111 N 5.17 2.35 3.77 9.45 0.00 -1.26 -5.13 105.19 119.54 1we7 n GLY 111 Ca 0.09 -1.42 -0.37 0.00 0.00 0.00 0.00 46.02 44.32 1we7 n GLY 111 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1we7 s PRO 112 N -0.23 3.68 -0.16 1.61 0.04 -1.26 -5.05 135.00 133.63 1we7 s PRO 112 Ca 0.33 1.74 -0.28 0.00 0.04 0.00 0.00 61.00 62.82 1we7 s PRO 112 Cb 0.06 -2.32 0.08 0.00 0.04 0.00 0.00 34.50 32.35 1we7 s PRO 112 CO -0.18 -0.61 0.75 0.45 0.04 0.00 0.00 177.00 177.44 1we7 s SER 113 N -1.45 -0.65 -0.04 6.66 0.15 -1.26 -5.18 113.70 111.93 1we7 s SER 113 Ca 0.65 0.97 -0.29 0.00 0.70 0.00 0.00 55.95 57.98 1we7 s SER 113 Cb -0.27 0.89 0.11 0.00 -1.71 0.00 0.00 66.02 65.03 1we7 s SER 113 CO 0.33 -0.42 0.90 -0.44 1.20 0.00 0.00 173.24 174.81 1we7 s SER 114 N -0.50 -0.38 0.00 5.45 0.01 -1.26 -5.36 113.70 111.66 1we7 s SER 114 Ca -0.05 0.11 0.00 0.00 1.31 0.00 0.00 55.95 57.32 1we7 s SER 114 Cb -0.02 0.37 0.00 0.00 0.21 0.00 0.00 66.02 66.58 1we7 s SER 114 CO 0.05 -0.57 0.00 0.61 0.41 0.00 0.00 173.24 173.74