#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 6.42 -0.21 1.61 1.04 -1.26 -5.11 113.70 116.19 1we7 s SER 2 Ca 0.00 0.43 -0.23 0.00 0.48 0.00 0.00 55.95 56.63 1we7 s SER 2 Cb 0.00 -2.02 0.06 0.00 0.10 0.00 0.00 66.02 64.16 1we7 s SER 2 CO 0.00 0.07 0.63 -0.55 0.98 0.00 0.00 173.24 174.37 1we7 s SER 3 N -2.67 -0.65 -0.00 7.02 0.15 -1.26 -5.18 113.70 111.12 1we7 s SER 3 Ca 0.38 1.18 -0.28 0.00 0.70 0.00 0.00 55.95 57.93 1we7 s SER 3 Cb -0.12 1.19 0.09 0.00 -1.71 0.00 0.00 66.02 65.46 1we7 s SER 3 CO 0.27 -0.27 0.76 -0.83 1.20 0.00 0.00 173.24 174.37 1we7 s GLY 4 N 0.12 -0.51 0.42 9.45 0.00 -1.26 -5.18 107.32 110.36 1we7 s GLY 4 Ca -0.02 1.16 0.07 0.00 0.00 0.00 0.00 44.72 45.94 1we7 s GLY 4 CO 0.02 0.63 0.58 -0.56 0.00 0.00 0.00 173.10 173.77 1we7 s SER 5 N -1.85 5.66 -0.53 1.64 0.01 -1.26 -5.08 113.70 112.30 1we7 s SER 5 Ca -0.03 -0.36 -0.11 0.00 1.31 0.00 0.00 55.95 56.77 1we7 s SER 5 Cb -0.01 -0.75 0.13 0.00 0.21 0.00 0.00 66.02 65.61 1we7 s SER 5 CO -0.02 -0.76 0.42 -0.55 0.41 0.00 0.00 173.24 172.75 1we7 s SER 6 N -4.34 5.87 0.00 2.44 0.15 -1.26 -4.86 113.70 111.70 1we7 s SER 6 Ca 0.54 -2.02 0.00 0.00 0.70 0.00 0.00 55.95 55.17 1we7 s SER 6 Cb -0.10 -2.06 0.00 0.00 -1.71 0.00 0.00 66.02 62.15 1we7 s SER 6 CO 0.33 -0.70 0.00 0.61 1.20 0.00 0.00 173.24 174.69 1we7 n GLY 7 N 4.80 -1.13 0.25 9.45 0.00 -1.26 -4.82 105.19 112.49 1we7 n GLY 7 Ca -0.06 -0.81 -0.14 0.00 0.00 0.00 0.00 46.02 45.01 1we7 n GLY 7 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1we7 h THR 8 N 0.00 0.54 0.00 2.61 1.35 -2.02 -3.07 112.91 112.31 1we7 h THR 8 Ca 0.00 -0.46 -0.01 0.00 -0.55 0.00 0.00 66.41 65.39 1we7 h THR 8 Cb 0.00 0.74 -0.00 0.00 -1.73 0.00 0.00 68.15 67.16 1we7 h THR 8 CO 0.00 0.08 -0.01 -0.62 -0.25 0.00 0.00 175.52 174.71 1we7 n GLU 9 N -5.21 1.01 -0.10 4.72 4.71 -1.26 -3.78 120.64 120.73 1we7 n GLU 9 Ca -0.10 -0.04 -0.20 0.00 -0.01 0.00 0.00 57.16 56.81 1we7 n GLU 9 Cb 0.29 -1.05 -0.07 0.00 -1.01 0.00 0.00 31.44 29.60 1we7 n GLU 9 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 1we7 n ASP 10 N 1.55 1.43 -2.35 1.62 2.03 -1.16 -4.69 116.55 114.98 1we7 n ASP 10 Ca 0.02 0.22 -0.30 0.00 0.52 0.00 0.00 54.79 55.24 1we7 n ASP 10 Cb 0.50 -0.55 0.03 0.00 -0.72 0.00 0.00 41.12 40.39 1we7 n ASP 10 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1we7 n SER 11 N -3.81 6.03 -4.71 1.67 2.88 -1.25 -5.05 113.62 109.38 1we7 n SER 11 Ca -0.38 -3.77 -0.40 0.00 -1.33 0.00 0.00 58.87 52.99 1we7 n SER 11 Cb 0.77 -0.65 0.02 0.00 -0.75 0.00 0.00 64.21 63.60 1we7 n SER 11 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1we7 n LEU 12 N -0.69 4.35 -4.70 2.46 4.77 -1.26 -4.96 117.00 116.97 1we7 n LEU 12 Ca 0.49 1.07 -0.30 0.00 -0.03 0.00 0.00 56.01 57.24 1we7 n LEU 12 Cb 0.70 -1.52 0.14 0.00 -2.33 0.00 0.00 43.42 40.42 1we7 n LEU 12 CO 0.51 -0.67 0.67 -0.04 -1.33 0.00 0.00 177.39 176.53 1we7 s MET 13 N -2.37 1.32 0.00 3.23 -1.94 -1.26 -5.04 119.30 113.24 1we7 s MET 13 Ca 0.64 1.19 0.00 0.00 -1.71 0.00 0.00 55.69 55.80 1we7 s MET 13 Cb -0.48 -1.79 0.00 0.00 2.01 0.00 0.00 34.83 34.57 1we7 s MET 13 CO 0.56 -2.30 0.00 -0.35 -0.01 0.00 0.00 175.02 172.92 1we7 n PRO 14 N -3.97 -1.00 -0.10 2.03 -0.04 -1.26 -4.83 135.00 125.83 1we7 n PRO 14 Ca 0.09 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.32 1we7 n PRO 14 Cb 0.53 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.88 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 -1.50 0.63 0.31 0.54 2.13 -1.26 -3.48 120.64 118.01 1we7 n GLU 15 Ca 0.00 0.30 -0.17 0.00 0.66 0.00 0.00 57.16 57.95 1we7 n GLU 15 Cb 0.00 -1.60 -0.09 0.00 0.27 0.00 0.00 31.44 30.03 1we7 n GLU 15 CO 0.00 0.00 0.00 1.05 -0.41 0.00 0.00 177.13 177.77 1we7 h GLU 16 N -0.52 -0.73 -0.13 5.31 4.11 -1.95 -3.09 114.58 117.57 1we7 h GLU 16 Ca -0.54 0.05 -0.00 0.00 0.07 0.00 0.00 59.36 58.94 1we7 h GLU 16 Cb 1.71 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 31.12 1we7 h GLU 16 CO -0.19 -0.46 0.08 1.49 0.07 0.00 0.00 179.01 180.00 1we7 h GLU 17 N -0.84 0.18 -0.71 1.06 4.22 -1.98 -3.14 114.58 113.37 1we7 h GLU 17 Ca -0.08 -0.02 0.06 0.00 0.08 0.00 0.00 59.36 59.41 1we7 h GLU 17 Cb 0.61 -0.04 -0.09 0.00 0.50 0.00 0.00 28.75 29.74 1we7 h GLU 17 CO 0.13 0.15 -0.42 0.34 -2.18 0.00 0.00 179.01 177.03 1we7 n PHE 18 N -4.98 -0.31 -0.36 0.92 7.35 -1.20 0.19 117.46 119.07 1we7 n PHE 18 Ca -0.05 0.89 0.26 0.00 -0.76 0.00 0.00 57.45 57.80 1we7 n PHE 18 Cb 0.05 -0.55 0.52 0.00 0.35 0.00 0.00 39.48 39.85 1we7 n PHE 18 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1we7 h LEU 19 N 0.00 0.44 -1.13 -2.13 3.38 -1.49 0.92 115.31 115.30 1we7 h LEU 19 Ca 0.11 0.14 -0.06 0.00 0.09 0.00 0.00 57.88 58.16 1we7 h LEU 19 Cb 0.29 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 1we7 h LEU 19 CO -0.67 -0.05 -0.04 0.03 0.09 0.00 0.00 178.44 177.80 1we7 h ARG 20 N 0.31 0.56 0.45 1.13 2.47 0.21 -3.24 114.38 116.27 1we7 h ARG 20 Ca 0.70 -0.14 -0.02 0.00 -1.26 0.00 0.00 59.98 59.26 1we7 h ARG 20 Cb 1.81 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 30.06 1we7 h ARG 20 CO -0.44 0.62 -0.21 0.00 0.56 0.00 0.00 179.97 180.49 1we7 h ARG 21 N 0.53 -0.58 -6.14 0.04 3.08 0.15 -3.43 114.38 108.04 1we7 h ARG 21 Ca 0.11 0.04 -0.56 0.00 0.07 0.00 0.00 59.98 59.63 1we7 h ARG 21 Cb 0.40 0.13 -0.05 0.00 0.08 0.00 0.00 29.97 30.53 1we7 h ARG 21 CO 0.02 -0.39 0.45 0.54 -1.07 0.00 0.00 179.97 179.52 1we7 s ASN 22 N -4.25 7.13 0.11 7.04 2.20 -0.85 -4.94 114.94 121.38 1we7 s ASN 22 Ca -0.09 1.38 -0.10 0.00 -0.94 0.00 0.00 52.86 53.12 1we7 s ASN 22 Cb 0.01 -2.51 -0.15 0.00 -2.00 0.00 0.00 41.25 36.61 1we7 s ASN 22 CO 0.26 -0.39 1.27 0.50 -2.94 0.00 0.00 177.10 175.81 1we7 h LYS 23 N 7.13 0.62 -2.25 3.55 1.63 -1.84 -3.43 116.57 121.98 1we7 h LYS 23 Ca -0.32 -0.60 0.24 0.00 -0.85 0.00 0.00 60.65 59.12 1we7 h LYS 23 Cb 1.15 0.16 -0.10 0.00 -0.60 0.00 0.00 32.23 32.83 1we7 h LYS 23 CO 0.83 1.21 -0.64 0.41 -3.45 0.00 0.00 179.45 177.82 1we7 n GLY 24 N 0.90 -2.54 3.63 5.01 0.00 -1.26 -4.98 105.19 105.95 1we7 n GLY 24 Ca -0.08 -1.23 -0.29 0.00 0.00 0.00 0.00 46.02 44.42 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 -3.01 -0.56 0.11 1.61 0.04 -1.26 -5.03 135.00 126.89 1we7 s PRO 25 Ca 0.00 0.16 0.07 0.00 0.04 0.00 0.00 61.00 61.28 1we7 s PRO 25 Cb 0.00 -1.65 -0.04 0.00 0.04 0.00 0.00 34.50 32.85 1we7 s PRO 25 CO 0.00 -3.32 -0.10 0.14 0.04 0.00 0.00 177.00 173.75 1we7 s VAL 26 N -2.99 3.34 -0.41 -0.36 -7.23 -0.88 -4.87 120.40 107.00 1we7 s VAL 26 Ca 0.69 -1.29 -0.08 0.00 -1.81 0.00 0.00 61.98 59.49 1we7 s VAL 26 Cb -0.13 -2.56 0.07 0.00 0.56 0.00 0.00 36.38 34.32 1we7 s VAL 26 CO 0.57 0.11 0.23 -0.55 -0.31 0.00 0.00 175.10 175.15 1we7 s SER 27 N -2.21 5.57 -0.13 4.85 0.15 -1.26 -2.10 113.70 118.57 1we7 s SER 27 Ca 0.21 -1.48 -0.05 0.00 0.70 0.00 0.00 55.95 55.34 1we7 s SER 27 Cb -0.11 -1.96 -0.04 0.00 -1.71 0.00 0.00 66.02 62.20 1we7 s SER 27 CO 0.14 -0.51 0.04 0.27 1.20 0.00 0.00 173.24 174.38 1we7 s ILE 28 N 1.41 4.64 -0.24 6.45 -5.25 -1.25 -0.82 121.20 126.12 1we7 s ILE 28 Ca 0.03 -0.11 -0.10 0.00 -0.99 0.00 0.00 60.65 59.48 1we7 s ILE 28 Cb -0.22 -3.02 -0.05 0.00 2.95 0.00 0.00 42.46 42.12 1we7 s ILE 28 CO 0.02 0.55 0.15 -0.75 -1.79 0.00 0.00 174.94 173.11 1we7 s LYS 29 N -0.35 4.01 -0.45 0.37 2.20 0.23 -3.08 119.74 122.67 1we7 s LYS 29 Ca 0.08 -0.30 -0.17 0.00 -0.36 0.00 0.00 55.97 55.22 1we7 s LYS 29 Cb -0.12 -3.51 0.04 0.00 -1.51 0.00 0.00 37.83 32.73 1we7 s LYS 29 CO 0.02 0.02 0.47 0.08 -0.36 0.00 0.00 175.35 175.58 1we7 s VAL 30 N 1.16 5.08 -0.51 4.02 1.01 0.67 0.19 120.40 132.02 1we7 s VAL 30 Ca 0.07 -0.56 -0.28 0.00 0.00 0.00 0.00 61.98 61.21 1we7 s VAL 30 Cb -0.14 -4.12 0.01 0.00 0.00 0.00 0.00 36.38 32.13 1we7 s VAL 30 CO 0.05 -0.55 1.50 -1.58 0.00 0.00 0.00 175.10 174.52 1we7 s GLN 31 N 2.12 3.29 -0.43 2.72 2.00 -0.19 -1.41 119.66 127.77 1we7 s GLN 31 Ca 0.11 0.68 -0.19 0.00 -2.00 0.00 0.00 55.36 53.96 1we7 s GLN 31 Cb -0.19 -4.14 0.02 0.00 0.80 0.00 0.00 33.01 29.50 1we7 s GLN 31 CO 0.11 -1.93 0.55 0.08 -0.50 0.00 0.00 175.29 173.60 1we7 s VAL 32 N 6.32 4.95 0.78 1.34 1.01 0.34 -2.34 120.40 132.80 1we7 s VAL 32 Ca 0.59 -0.08 -0.11 0.00 0.00 0.00 0.00 61.98 62.39 1we7 s VAL 32 Cb -0.13 -4.12 0.06 0.00 0.00 0.00 0.00 36.38 32.19 1we7 s VAL 32 CO 0.27 -0.50 1.09 -2.16 0.00 0.00 0.00 175.10 173.80 1we7 s PRO 33 N 2.50 2.17 -0.34 2.72 0.04 -1.26 -1.34 135.00 139.48 1we7 s PRO 33 Ca 0.18 1.14 -0.16 0.00 0.04 0.00 0.00 61.00 62.20 1we7 s PRO 33 Cb -0.15 -1.89 -0.01 0.00 0.04 0.00 0.00 34.50 32.49 1we7 s PRO 33 CO 0.16 -1.70 0.43 0.54 0.04 0.00 0.00 177.00 176.48 1we7 s ASN 34 N -3.39 6.25 -0.57 6.66 2.20 -1.26 -3.50 114.94 121.33 1we7 s ASN 34 Ca 0.61 -0.11 -0.06 0.00 -0.94 0.00 0.00 52.86 52.36 1we7 s ASN 34 Cb -0.17 -2.23 0.15 0.00 -2.00 0.00 0.00 41.25 36.99 1we7 s ASN 34 CO 0.56 -0.39 0.41 -0.04 -2.94 0.00 0.00 177.10 174.69 1we7 s MET 35 N 2.19 2.55 -0.20 3.55 -1.94 -0.65 -4.85 119.30 119.94 1we7 s MET 35 Ca 0.15 -2.18 -0.01 0.00 -1.71 0.00 0.00 55.69 51.95 1we7 s MET 35 Cb -0.16 -3.84 -0.21 0.00 2.01 0.00 0.00 34.83 32.63 1we7 s MET 35 CO 0.12 -1.17 0.02 0.94 -0.01 0.00 0.00 175.02 174.91 1we7 n GLN 36 N 4.15 0.69 0.00 2.03 -0.06 -1.26 -4.59 117.38 118.34 1we7 n GLN 36 Ca 0.02 0.19 0.00 0.00 -2.00 0.00 0.00 57.00 55.21 1we7 n GLN 36 Cb 0.40 -1.60 0.00 0.00 -4.06 0.00 0.00 30.24 24.99 1we7 n GLN 36 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 1we7 n ASP 37 N -3.34 0.00 -3.29 1.69 8.00 -1.26 -4.69 116.55 113.66 1we7 n ASP 37 Ca -0.40 0.68 0.03 0.00 0.71 0.00 0.00 54.79 55.81 1we7 n ASP 37 Cb 1.02 -0.33 -0.04 0.00 -0.02 0.00 0.00 41.12 41.74 1we7 n ASP 37 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1we7 s LYS 38 N -2.91 0.17 -0.20 -1.24 2.36 -1.26 -5.18 119.74 111.47 1we7 s LYS 38 Ca 0.00 0.42 -0.32 0.00 -2.55 0.00 0.00 55.97 53.52 1we7 s LYS 38 Cb 0.00 0.25 0.15 0.00 -1.05 0.00 0.00 37.83 37.18 1we7 s LYS 38 CO 0.00 -0.06 1.20 -0.08 1.55 0.00 0.00 175.35 177.96 1we7 s THR 39 N 2.27 0.00 -0.63 3.43 -1.32 -1.26 -5.05 115.64 113.07 1we7 s THR 39 Ca -0.01 0.00 0.01 0.00 -1.21 0.00 0.00 61.69 60.48 1we7 s THR 39 Cb -0.04 -1.00 0.40 0.00 -1.51 0.00 0.00 72.50 70.36 1we7 s THR 39 CO -0.17 0.00 1.66 -1.84 -2.21 0.00 0.00 174.62 172.06 1we7 n GLU 40 N 0.26 3.04 -4.16 7.08 0.28 -1.26 -4.98 120.64 120.90 1we7 n GLU 40 Ca -0.02 -3.85 -0.17 0.00 -0.16 0.00 0.00 57.16 52.96 1we7 n GLU 40 Cb 0.58 -2.27 -0.12 0.00 1.43 0.00 0.00 31.44 31.07 1we7 n GLU 40 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 1we7 s TRP 41 N -3.82 1.10 -0.27 -1.84 0.51 -1.26 -4.75 118.94 108.61 1we7 s TRP 41 Ca 0.53 -0.50 -0.05 0.00 -2.12 0.00 0.00 56.10 53.95 1we7 s TRP 41 Cb 0.44 -0.62 -0.18 0.00 -0.81 0.00 0.00 33.47 32.29 1we7 s TRP 41 CO -0.23 0.03 2.89 1.63 -0.51 0.00 0.00 176.95 180.76 1we7 n LYS 42 N 1.16 1.86 -3.27 4.98 4.76 -1.26 -4.79 118.16 121.59 1we7 n LYS 42 Ca -0.20 -1.01 -0.46 0.00 -2.87 0.00 0.00 58.31 53.77 1we7 n LYS 42 Cb 0.55 -2.05 -0.04 0.00 -1.84 0.00 0.00 35.03 31.65 1we7 n LYS 42 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1we7 s LEU 43 N 0.03 6.21 -0.46 -0.35 1.43 -1.26 -4.86 118.68 119.42 1we7 s LEU 43 Ca 0.53 -2.03 0.07 0.00 -1.03 0.00 0.00 54.13 51.67 1we7 s LEU 43 Cb 0.23 -2.23 0.23 0.00 0.03 0.00 0.00 46.19 44.45 1we7 s LEU 43 CO -0.01 -0.81 0.52 0.59 0.23 0.00 0.00 176.35 176.87 1we7 n ASN 44 N 5.05 0.87 -2.29 2.29 3.02 -1.24 -1.64 115.26 121.33 1we7 n ASN 44 Ca -0.03 -2.79 -0.09 0.00 -0.03 0.00 0.00 54.58 51.63 1we7 n ASN 44 Cb 0.43 -0.63 0.01 0.00 -0.61 0.00 0.00 39.78 38.97 1we7 n ASN 44 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1we7 n GLY 45 N 1.66 0.05 3.65 7.41 0.00 -1.23 -4.87 105.19 111.85 1we7 n GLY 45 Ca 0.24 0.26 -0.10 0.00 0.00 0.00 0.00 46.02 46.43 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 -0.94 1.88 -0.05 1.61 -2.07 -0.45 -4.97 119.66 114.66 1we7 s GLN 46 Ca 0.09 -1.42 0.02 0.00 -1.82 0.00 0.00 55.36 52.23 1we7 s GLN 46 Cb -0.01 0.52 0.01 0.00 -1.09 0.00 0.00 33.01 32.44 1we7 s GLN 46 CO 0.20 -0.82 -0.11 0.20 -1.32 0.00 0.00 175.29 173.44 1we7 s GLY 47 N -3.09 0.72 -0.25 2.60 0.00 -1.26 -0.50 107.32 105.54 1we7 s GLY 47 Ca 0.22 -0.38 -0.03 0.00 0.00 0.00 0.00 44.72 44.53 1we7 s GLY 47 CO 0.13 0.08 -0.04 1.08 0.00 0.00 0.00 173.10 174.34 1we7 s LEU 48 N 0.55 3.21 -0.07 0.66 1.43 -0.50 -4.93 118.68 119.03 1we7 s LEU 48 Ca -0.11 -0.78 0.00 0.00 -1.03 0.00 0.00 54.13 52.21 1we7 s LEU 48 Cb -0.14 -1.70 -0.03 0.00 0.03 0.00 0.00 46.19 44.35 1we7 s LEU 48 CO 0.03 -0.12 -0.05 -0.69 0.23 0.00 0.00 176.35 175.75 1we7 s VAL 49 N 1.37 3.90 -0.21 -1.59 1.01 -1.26 -0.24 120.40 123.38 1we7 s VAL 49 Ca 0.01 -0.43 -0.05 0.00 0.00 0.00 0.00 61.98 61.52 1we7 s VAL 49 Cb -0.16 -2.62 0.11 0.00 0.00 0.00 0.00 36.38 33.71 1we7 s VAL 49 CO -0.04 0.58 0.37 -0.36 0.00 0.00 0.00 175.10 175.65 1we7 s PHE 50 N -0.85 -0.72 -0.18 5.22 0.08 -1.18 -5.03 117.98 115.32 1we7 s PHE 50 Ca 0.13 1.07 -0.23 0.00 0.12 0.00 0.00 56.93 58.02 1we7 s PHE 50 Cb -0.11 0.09 -0.02 0.00 -0.57 0.00 0.00 43.02 42.41 1we7 s PHE 50 CO 0.02 -0.57 0.75 0.95 -0.10 0.00 0.00 175.22 176.27 1we7 s THR 51 N 2.54 4.94 -0.06 0.64 -4.23 -1.26 -3.89 115.64 114.32 1we7 s THR 51 Ca 0.05 1.45 -0.15 0.00 -1.18 0.00 0.00 61.69 61.86 1we7 s THR 51 Cb -0.14 -4.06 0.03 0.00 1.34 0.00 0.00 72.50 69.67 1we7 s THR 51 CO -0.13 0.06 0.35 -0.76 -0.54 0.00 0.00 174.62 173.60 1we7 s LEU 52 N 2.04 0.67 0.92 4.79 1.43 -0.89 -4.90 118.68 122.73 1we7 s LEU 52 Ca 0.34 0.33 -0.12 0.00 -1.03 0.00 0.00 54.13 53.66 1we7 s LEU 52 Cb -0.16 1.35 0.14 0.00 0.03 0.00 0.00 46.19 47.55 1we7 s LEU 52 CO 0.12 -0.36 1.09 -2.16 0.23 0.00 0.00 176.35 175.27 1we7 s PRO 53 N -0.84 1.10 -1.02 1.29 0.04 -1.26 -2.07 135.00 132.24 1we7 s PRO 53 Ca -0.09 0.76 -0.15 0.00 0.04 0.00 0.00 61.00 61.56 1we7 s PRO 53 Cb -0.04 -1.80 0.18 0.00 0.04 0.00 0.00 34.50 32.88 1we7 s PRO 53 CO 0.03 -2.33 1.15 -0.51 0.04 0.00 0.00 177.00 175.38 1we7 s LEU 54 N -6.27 5.56 0.14 -3.56 2.01 -1.26 -4.64 118.68 110.67 1we7 s LEU 54 Ca 0.64 -2.68 0.00 0.00 0.01 0.00 0.00 54.13 52.10 1we7 s LEU 54 Cb -0.18 -2.34 0.00 0.00 0.01 0.00 0.00 46.19 43.68 1we7 s LEU 54 CO 0.57 -0.76 0.00 0.35 1.01 0.00 0.00 176.35 177.52 1we7 n THR 55 N 4.54 0.64 -1.72 5.49 -2.24 -1.26 -4.90 114.28 114.83 1we7 n THR 55 Ca 0.26 0.21 -0.13 0.00 -2.27 0.00 0.00 64.05 62.12 1we7 n THR 55 Cb 0.45 -1.09 0.09 0.00 -2.10 0.00 0.00 70.33 67.68 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 -3.33 0.22 -3.09 3.42 9.92 -1.26 -4.96 116.55 117.47 1we7 n ASP 56 Ca 0.00 -1.33 -0.13 0.00 -0.53 0.00 0.00 54.79 52.80 1we7 n ASP 56 Cb 0.00 -0.44 0.08 0.00 -0.64 0.00 0.00 41.12 40.12 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 -2.24 -0.25 0.10 -1.24 6.02 -1.26 -4.11 117.38 114.40 1we7 n GLN 57 Ca 0.08 -1.17 0.11 0.00 -0.01 0.00 0.00 57.00 56.00 1we7 n GLN 57 Cb 0.28 -0.53 0.45 0.00 1.02 0.00 0.00 30.24 31.47 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 -2.56 0.88 0.32 5.09 0.31 -0.90 -2.64 118.33 118.82 1we7 n VAL 58 Ca 0.08 0.25 0.21 0.00 -0.01 0.00 0.00 64.34 64.88 1we7 n VAL 58 Cb 0.29 -1.15 1.13 0.00 -0.91 0.00 0.00 33.84 33.20 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 0.00 1.68 4.52 4.64 -1.79 0.16 113.55 122.76 1we7 h SER 59 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1we7 h SER 59 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1we7 h SER 59 CO 0.00 0.00 -0.29 -0.37 -0.87 0.00 0.00 176.83 175.30 1we7 h VAL 60 N 0.00 0.00 0.00 0.95 -1.51 -1.85 -3.06 116.25 110.78 1we7 h VAL 60 Ca 0.00 -0.97 -0.18 0.00 -1.23 0.00 0.00 66.70 64.32 1we7 h VAL 60 Cb 0.07 1.83 -0.03 0.00 -2.13 0.00 0.00 31.29 31.02 1we7 h VAL 60 CO 0.00 0.00 -1.02 0.40 -1.23 0.00 0.00 177.57 175.72 1we7 h ILE 61 N 0.00 1.05 0.00 7.19 2.04 -0.89 -3.34 117.51 123.57 1we7 h ILE 61 Ca 0.00 -2.62 -0.00 0.00 1.00 0.00 0.00 64.86 63.24 1we7 h ILE 61 Cb 0.99 2.47 0.00 0.00 -0.74 0.00 0.00 36.82 39.54 1we7 h ILE 61 CO 0.00 0.60 -0.00 0.11 0.00 0.00 0.00 178.15 178.86 1we7 h LYS 62 N 0.00 -0.01 -1.06 2.37 1.57 -1.57 -3.32 116.57 114.56 1we7 h LYS 62 Ca -0.08 0.00 0.37 0.00 -1.87 0.00 0.00 60.65 59.07 1we7 h LYS 62 Cb 1.63 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 33.79 1we7 h LYS 62 CO 0.08 0.87 0.62 -0.24 -0.57 0.00 0.00 179.45 180.21 1we7 h VAL 63 N -0.95 0.18 -0.16 0.50 3.04 -1.69 0.42 116.25 117.59 1we7 h VAL 63 Ca -0.00 -0.06 0.01 0.00 -1.01 0.00 0.00 66.70 65.64 1we7 h VAL 63 Cb 0.87 -0.02 -0.02 0.00 -2.01 0.00 0.00 31.29 30.12 1we7 h VAL 63 CO 0.00 0.03 0.06 0.11 -1.01 0.00 0.00 177.57 176.76 1we7 h LYS 64 N 0.18 0.13 -0.31 4.17 1.79 -1.68 -2.47 116.57 118.38 1we7 h LYS 64 Ca 0.78 -0.01 0.05 0.00 -2.18 0.00 0.00 60.65 59.30 1we7 h LYS 64 Cb 2.02 -0.03 -0.08 0.00 -1.58 0.00 0.00 32.23 32.56 1we7 h LYS 64 CO -0.61 0.09 -0.50 0.82 -1.08 0.00 0.00 179.45 178.17 1we7 h ILE 65 N 0.14 0.05 -0.85 1.86 2.04 -0.27 0.15 117.51 120.62 1we7 h ILE 65 Ca 0.07 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.10 1we7 h ILE 65 Cb 0.04 0.05 -0.06 0.00 -0.74 0.00 0.00 36.82 36.11 1we7 h ILE 65 CO -0.07 0.00 0.56 -0.74 0.00 0.00 0.00 178.15 177.90 1we7 h HIS 66 N -0.43 0.59 0.54 1.37 2.76 -1.43 0.59 115.15 119.14 1we7 h HIS 66 Ca 0.09 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.26 1we7 h HIS 66 Cb 0.62 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 29.38 1we7 h HIS 66 CO -0.63 0.20 -0.45 1.49 -1.30 0.00 0.00 177.93 177.24 1we7 h GLU 67 N 0.48 -0.94 0.13 5.26 4.22 -0.25 -3.33 114.58 120.17 1we7 h GLU 67 Ca 0.43 0.06 -0.01 0.00 0.08 0.00 0.00 59.36 59.93 1we7 h GLU 67 Cb 0.95 0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1we7 h GLU 67 CO -0.17 -0.62 -0.06 0.00 -2.18 0.00 0.00 179.01 175.98 1we7 h ALA 68 N -0.73 -0.18 -2.36 2.92 0.00 -0.85 -3.46 119.26 114.59 1we7 h ALA 68 Ca -0.06 -0.14 -0.50 0.00 0.00 0.00 0.00 54.91 54.21 1we7 h ALA 68 Cb 0.83 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1we7 h ALA 68 CO -0.01 -0.19 -0.10 0.95 0.00 0.00 0.00 179.25 179.90 1we7 s THR 69 N -2.45 5.01 -0.07 0.00 -4.23 0.20 -4.97 115.64 109.13 1we7 s THR 69 Ca -0.07 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.45 1we7 s THR 69 Cb -0.00 -3.78 0.10 0.00 1.34 0.00 0.00 72.50 70.16 1we7 s THR 69 CO 0.24 -0.45 1.30 0.61 -0.54 0.00 0.00 174.62 175.77 1we7 n GLY 70 N -1.31 2.50 3.79 3.99 0.00 -1.26 -3.73 105.19 109.16 1we7 n GLY 70 Ca -0.02 -0.20 -0.36 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.52 3.92 0.85 1.61 -2.45 -1.26 -4.60 119.30 116.85 1we7 s MET 71 Ca 0.09 -0.05 -0.11 0.00 -1.25 0.00 0.00 55.69 54.37 1we7 s MET 71 Cb 0.07 -3.32 0.10 0.00 1.25 0.00 0.00 34.83 32.93 1we7 s MET 71 CO 0.01 0.49 1.09 -1.25 1.05 0.00 0.00 175.02 176.41 1we7 s PRO 72 N -0.24 1.63 -0.52 4.11 0.04 -1.26 -3.09 135.00 135.67 1we7 s PRO 72 Ca 0.14 0.95 -0.03 0.00 0.04 0.00 0.00 61.00 62.10 1we7 s PRO 72 Cb -0.12 -1.84 0.16 0.00 0.04 0.00 0.00 34.50 32.73 1we7 s PRO 72 CO 0.03 -2.02 2.49 0.00 0.04 0.00 0.00 177.00 177.54 1we7 n ALA 73 N -3.75 6.28 -0.62 8.56 0.00 -1.26 -4.34 120.51 125.38 1we7 n ALA 73 Ca 0.08 -3.08 0.00 0.00 0.00 0.00 0.00 53.44 50.44 1we7 n ALA 73 Cb 0.54 -1.99 0.00 0.00 0.00 0.00 0.00 19.45 18.00 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 0.43 -0.69 0.32 0.00 0.00 -1.26 -4.93 105.19 99.06 1we7 n GLY 74 Ca 0.48 0.16 0.14 0.00 0.00 0.00 0.00 46.02 46.81 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 0.08 -6.60 1.61 1.57 -1.98 -3.40 116.57 107.85 1we7 h LYS 75 Ca 0.00 -0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.20 1we7 h LYS 75 Cb 0.00 -0.02 0.08 0.00 0.08 0.00 0.00 32.23 32.37 1we7 h LYS 75 CO 0.00 0.05 0.64 0.00 -0.57 0.00 0.00 179.45 179.58 1we7 n GLN 76 N -5.38 2.09 -4.00 3.15 10.64 -1.26 -3.29 117.38 119.33 1we7 n GLN 76 Ca 0.22 0.74 -0.34 0.00 -1.83 0.00 0.00 57.00 55.80 1we7 n GLN 76 Cb 0.74 -2.42 -0.15 0.00 -0.86 0.00 0.00 30.24 27.55 1we7 n GLN 76 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.06 175.44 1we7 s LYS 77 N -0.33 2.79 -0.03 2.61 2.20 -0.47 -4.92 119.74 121.60 1we7 s LYS 77 Ca 0.69 -1.00 -0.26 0.00 -0.36 0.00 0.00 55.97 55.04 1we7 s LYS 77 Cb -0.64 -2.90 -0.03 0.00 -1.51 0.00 0.00 37.83 32.74 1we7 s LYS 77 CO 0.49 -0.39 0.82 -0.51 -0.36 0.00 0.00 175.35 175.40 1we7 s LEU 78 N 1.29 4.34 -0.12 5.43 1.43 -1.26 -0.82 118.68 128.98 1we7 s LEU 78 Ca -0.00 1.39 0.03 0.00 -1.03 0.00 0.00 54.13 54.52 1we7 s LEU 78 Cb -0.16 -3.29 0.00 0.00 0.03 0.00 0.00 46.19 42.77 1we7 s LEU 78 CO -0.06 -0.17 -0.21 -1.58 0.23 0.00 0.00 176.35 174.56 1we7 s GLN 79 N 0.85 3.11 -0.08 1.70 0.74 0.11 -3.49 119.66 122.59 1we7 s GLN 79 Ca 0.43 -0.83 -0.03 0.00 0.05 0.00 0.00 55.36 54.98 1we7 s GLN 79 Cb -0.19 -2.41 0.04 0.00 1.10 0.00 0.00 33.01 31.54 1we7 s GLN 79 CO 0.22 0.12 0.07 -0.47 -0.55 0.00 0.00 175.29 174.69 1we7 s TYR 80 N 0.51 0.09 -1.52 1.67 5.04 0.46 -0.42 117.35 123.18 1we7 s TYR 80 Ca -0.13 0.09 -0.12 0.00 -2.44 0.00 0.00 57.07 54.47 1we7 s TYR 80 Cb -0.17 -0.54 0.08 0.00 0.35 0.00 0.00 41.96 41.68 1we7 s TYR 80 CO 0.05 -0.29 0.88 0.39 -1.34 0.00 0.00 175.55 175.23 1we7 n GLU 81 N 5.29 -4.93 -1.53 4.97 -0.58 -1.26 -0.25 120.64 122.36 1we7 n GLU 81 Ca -0.04 0.55 -0.08 0.00 -0.42 0.00 0.00 57.16 57.17 1we7 n GLU 81 Cb 0.50 -5.32 -0.02 0.00 -0.57 0.00 0.00 31.44 26.02 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 -1.65 0.70 3.33 0.62 0.00 -1.26 -5.02 105.19 101.90 1we7 n GLY 82 Ca -0.02 -0.63 -0.31 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.33 2.12 -0.77 -0.61 1.01 0.65 -5.04 121.20 116.23 1we7 s ILE 83 Ca 0.00 -1.24 -0.02 0.00 0.00 0.00 0.00 60.65 59.39 1we7 s ILE 83 Cb 0.00 -1.78 0.30 0.00 0.01 0.00 0.00 42.46 40.99 1we7 s ILE 83 CO 0.00 0.48 2.17 0.49 0.00 0.00 0.00 174.94 178.07 1we7 n PHE 84 N 2.11 2.73 -0.92 3.97 3.72 -1.26 -0.40 117.46 127.40 1we7 n PHE 84 Ca -0.16 -2.27 -0.34 0.00 -0.05 0.00 0.00 57.45 54.63 1we7 n PHE 84 Cb 0.51 -1.23 -0.04 0.00 -0.94 0.00 0.00 39.48 37.79 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 -0.29 0.58 -3.71 4.37 -5.35 -1.23 -4.88 119.36 108.86 1we7 n ILE 85 Ca 0.53 -0.15 -0.22 0.00 -0.27 0.00 0.00 62.75 62.65 1we7 n ILE 85 Cb 0.30 0.00 -0.04 0.00 -1.74 0.00 0.00 39.64 38.16 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 -0.29 2.50 0.14 6.28 3.01 -1.26 -4.54 119.74 125.57 1we7 s LYS 86 Ca 0.50 -1.55 -0.12 0.00 -1.01 0.00 0.00 55.97 53.78 1we7 s LYS 86 Cb -0.70 -2.32 -0.02 0.00 -1.01 0.00 0.00 37.83 33.78 1we7 s LYS 86 CO 0.36 -0.13 1.52 0.38 0.51 0.00 0.00 175.35 177.99 1we7 h ASP 87 N 1.15 0.89 0.29 2.83 3.04 -1.92 -2.89 116.42 119.80 1we7 h ASP 87 Ca -0.42 -0.39 -0.05 0.00 -3.24 0.00 0.00 57.03 52.93 1we7 h ASP 87 Cb 1.26 -0.24 -0.01 0.00 -1.04 0.00 0.00 39.33 39.30 1we7 h ASP 87 CO 0.60 1.08 -0.22 0.77 -2.04 0.00 0.00 179.24 179.43 1we7 h SER 88 N 0.68 0.00 -4.01 4.15 4.64 -1.96 -3.11 113.55 113.95 1we7 h SER 88 Ca 0.10 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.93 1we7 h SER 88 Cb 0.74 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.86 1we7 h SER 88 CO 0.06 0.22 0.43 0.20 -0.87 0.00 0.00 176.83 176.86 1we7 s ASN 89 N -6.77 6.42 0.10 4.97 0.01 -1.09 -4.90 114.94 113.68 1we7 s ASN 89 Ca -0.03 2.10 -0.05 0.00 -0.71 0.00 0.00 52.86 54.16 1we7 s ASN 89 Cb 0.15 -2.58 -0.05 0.00 0.41 0.00 0.00 41.25 39.17 1we7 s ASN 89 CO 0.68 -0.73 0.35 -0.44 -1.51 0.00 0.00 177.10 175.45 1we7 s SER 90 N -1.61 6.51 0.06 -1.22 0.01 -1.26 -2.12 113.70 114.06 1we7 s SER 90 Ca 0.63 0.59 -0.23 0.00 1.31 0.00 0.00 55.95 58.25 1we7 s SER 90 Cb -0.23 -2.09 -0.15 0.00 0.21 0.00 0.00 66.02 63.75 1we7 s SER 90 CO 0.28 0.11 1.57 -0.07 0.41 0.00 0.00 173.24 175.55 1we7 h LEU 91 N 3.17 0.06 -0.55 2.44 4.07 -1.87 -3.10 115.31 119.54 1we7 h LEU 91 Ca -0.47 -0.18 0.11 0.00 0.08 0.00 0.00 57.88 57.42 1we7 h LEU 91 Cb 1.17 -0.02 -0.11 0.00 1.08 0.00 0.00 40.66 42.79 1we7 h LEU 91 CO 0.71 0.22 -0.21 0.00 -1.08 0.00 0.00 178.44 178.08 1we7 h ALA 92 N 0.84 0.20 -0.65 1.53 0.00 -1.90 -0.42 119.26 118.86 1we7 h ALA 92 Ca 0.01 0.19 0.13 0.00 0.00 0.00 0.00 54.91 55.25 1we7 h ALA 92 Cb 0.19 0.55 -0.12 0.00 0.00 0.00 0.00 17.79 18.41 1we7 h ALA 92 CO -0.00 -0.53 -0.11 -0.92 0.00 0.00 0.00 179.25 177.69 1we7 h TYR 93 N -0.08 -0.25 0.00 0.00 5.03 -1.82 0.59 116.97 120.44 1we7 h TYR 93 Ca 0.25 0.06 -0.03 0.00 2.58 0.00 0.00 58.73 61.59 1we7 h TYR 93 Cb 0.48 0.21 -0.00 0.00 1.55 0.00 0.00 36.73 38.96 1we7 h TYR 93 CO -0.52 -0.25 -0.16 1.88 -1.32 0.00 0.00 178.16 177.79 1we7 h TYR 94 N 0.03 0.00 -5.08 -3.82 0.05 -1.09 -3.46 116.97 103.60 1we7 h TYR 94 Ca 0.33 0.00 -0.25 0.00 0.05 0.00 0.00 58.73 58.85 1we7 h TYR 94 Cb 0.52 0.00 0.15 0.00 1.01 0.00 0.00 36.73 38.41 1we7 h TYR 94 CO -0.48 0.16 -0.68 0.09 -1.05 0.00 0.00 178.16 176.19 1we7 n ASN 95 N -3.74 -3.61 -4.27 3.88 3.02 0.21 -4.94 115.26 105.80 1we7 n ASN 95 Ca -0.02 -0.56 -0.29 0.00 -0.03 0.00 0.00 54.58 53.69 1we7 n ASN 95 Cb 0.27 -4.45 0.22 0.00 -0.61 0.00 0.00 39.78 35.20 1we7 n ASN 95 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1we7 s MET 96 N -4.76 -0.56 0.01 3.52 -1.94 -1.25 -5.02 119.30 109.30 1we7 s MET 96 Ca 0.16 0.29 0.04 0.00 -1.71 0.00 0.00 55.69 54.47 1we7 s MET 96 Cb -0.02 -1.64 -0.02 0.00 2.01 0.00 0.00 34.83 35.16 1we7 s MET 96 CO 0.62 -3.35 -0.14 0.00 -0.01 0.00 0.00 175.02 172.15 1we7 s ALA 97 N -2.90 1.12 1.02 3.03 0.00 -1.26 -5.00 121.76 117.78 1we7 s ALA 97 Ca 0.68 -0.69 -0.22 0.00 0.00 0.00 0.00 51.96 51.73 1we7 s ALA 97 Cb -0.16 -0.23 -0.09 0.00 0.00 0.00 0.00 23.12 22.64 1we7 s ALA 97 CO 0.58 0.24 -0.85 -1.13 0.00 0.00 0.00 175.76 174.60 1we7 n SER 98 N 2.33 -3.40 -3.99 0.00 3.41 -1.26 -2.74 113.62 107.97 1we7 n SER 98 Ca -0.16 0.04 -0.33 0.00 -0.26 0.00 0.00 58.87 58.16 1we7 n SER 98 Cb 0.55 -0.73 -0.01 0.00 -0.26 0.00 0.00 64.21 63.76 1we7 n SER 98 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1we7 n GLY 99 N 2.96 -0.47 3.93 5.00 0.00 -0.83 -4.84 105.19 110.93 1we7 n GLY 99 Ca -0.01 0.14 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.20 2.43 -0.22 4.61 0.00 -0.00 -4.90 121.76 120.48 1we7 s ALA 100 Ca 0.67 -1.06 -0.04 0.00 0.00 0.00 0.00 51.96 51.53 1we7 s ALA 100 Cb -0.36 -2.80 0.09 0.00 0.00 0.00 0.00 23.12 20.05 1we7 s ALA 100 CO 0.82 -2.16 0.15 0.54 0.00 0.00 0.00 175.76 175.12 1we7 s VAL 101 N -3.76 -0.18 -0.44 0.00 0.11 -1.26 -0.60 120.40 114.27 1we7 s VAL 101 Ca 0.70 -0.33 -0.23 0.00 -2.93 0.00 0.00 61.98 59.19 1we7 s VAL 101 Cb -0.06 -0.74 0.02 0.00 -1.53 0.00 0.00 36.38 34.07 1we7 s VAL 101 CO 0.51 -0.39 0.78 -0.63 -3.33 0.00 0.00 175.10 172.05 1we7 s ILE 102 N 2.20 4.66 -0.19 7.04 -1.09 0.52 -4.77 121.20 129.56 1we7 s ILE 102 Ca 0.06 0.47 -0.28 0.00 -2.23 0.00 0.00 60.65 58.66 1we7 s ILE 102 Cb -0.16 -4.31 -0.00 0.00 -1.58 0.00 0.00 42.46 36.41 1we7 s ILE 102 CO -0.19 -0.69 0.96 -1.00 -1.23 0.00 0.00 174.94 172.79 1we7 s HIS 103 N 3.28 3.39 0.08 3.97 3.76 0.44 -1.02 115.29 129.19 1we7 s HIS 103 Ca 0.30 1.42 -0.23 0.00 -0.15 0.00 0.00 55.06 56.39 1we7 s HIS 103 Cb -0.12 -3.17 -0.06 0.00 1.11 0.00 0.00 32.58 30.33 1we7 s HIS 103 CO 0.22 -0.36 0.70 -1.17 -0.85 0.00 0.00 174.74 173.28 1we7 s LEU 104 N 2.67 4.51 -0.03 0.89 2.96 -0.99 0.05 118.68 128.73 1we7 s LEU 104 Ca 0.43 1.43 0.01 0.00 -0.22 0.00 0.00 54.13 55.77 1we7 s LEU 104 Cb -0.16 -3.14 0.02 0.00 0.50 0.00 0.00 46.19 43.42 1we7 s LEU 104 CO 0.10 0.14 -0.01 0.00 -1.32 0.00 0.00 176.35 175.26 1we7 s ALA 105 N -0.64 0.38 -0.35 5.97 0.00 0.00 -4.69 121.76 122.44 1we7 s ALA 105 Ca 0.35 0.11 -0.29 0.00 0.00 0.00 0.00 51.96 52.12 1we7 s ALA 105 Cb -0.21 -0.31 -0.01 0.00 0.00 0.00 0.00 23.12 22.59 1we7 s ALA 105 CO 0.22 -0.04 1.57 -1.17 0.00 0.00 0.00 175.76 176.34 1we7 s LEU 106 N 0.90 3.61 0.51 0.00 0.20 -1.26 -1.36 118.68 121.28 1we7 s LEU 106 Ca -0.10 1.13 -0.22 0.00 0.69 0.00 0.00 54.13 55.63 1we7 s LEU 106 Cb -0.13 -3.53 -0.06 0.00 -0.43 0.00 0.00 46.19 42.04 1we7 s LEU 106 CO -0.01 -1.49 1.22 -0.75 -0.29 0.00 0.00 176.35 175.04 1we7 s LYS 107 N 5.11 3.45 -0.40 1.98 2.20 -1.21 -4.97 119.74 125.89 1we7 s LYS 107 Ca 0.69 1.90 -0.13 0.00 -0.36 0.00 0.00 55.97 58.07 1we7 s LYS 107 Cb -0.18 -2.27 0.03 0.00 -1.51 0.00 0.00 37.83 33.90 1we7 s LYS 107 CO 0.32 -0.84 0.27 -1.21 -0.36 0.00 0.00 175.35 173.53 1we7 s GLU 108 N -2.88 2.89 0.24 4.03 0.41 -1.26 -5.00 118.70 117.13 1we7 s GLU 108 Ca 0.68 -1.11 0.07 0.00 -0.41 0.00 0.00 54.97 54.20 1we7 s GLU 108 Cb -0.32 -3.89 -0.04 0.00 -1.78 0.00 0.00 34.13 28.10 1we7 s GLU 108 CO 0.38 -0.78 0.19 0.50 -0.49 0.00 0.00 175.26 175.06 1we7 s ARG 109 N 1.61 2.94 -0.65 1.61 3.52 -1.26 -4.97 118.95 121.75 1we7 s ARG 109 Ca 0.04 -1.03 -0.25 0.00 -0.13 0.00 0.00 55.73 54.35 1we7 s ARG 109 Cb -0.20 -2.58 -0.16 0.00 -1.56 0.00 0.00 34.95 30.45 1we7 s ARG 109 CO 0.08 0.41 1.90 -1.13 -0.81 0.00 0.00 175.30 175.74 1we7 n SER 110 N -1.09 0.30 -3.96 -2.12 3.41 -1.26 -4.54 113.62 104.36 1we7 n SER 110 Ca -0.08 0.23 -0.48 0.00 -0.26 0.00 0.00 58.87 58.28 1we7 n SER 110 Cb 0.57 -0.68 -0.12 0.00 -0.26 0.00 0.00 64.21 63.73 1we7 n SER 110 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1we7 n GLY 111 N 5.01 -0.26 3.62 5.00 0.00 -1.26 -4.88 105.19 112.43 1we7 n GLY 111 Ca 0.47 1.04 -0.29 0.00 0.00 0.00 0.00 46.02 47.23 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 6.52 -0.60 -0.09 1.61 0.04 -1.26 -5.06 135.00 136.17 1we7 s PRO 112 Ca 1.15 0.16 0.00 0.00 0.04 0.00 0.00 61.00 62.35 1we7 s PRO 112 Cb -1.28 -1.65 -0.03 0.00 0.04 0.00 0.00 34.50 31.58 1we7 s PRO 112 CO 0.54 -3.35 -0.07 -1.54 0.04 0.00 0.00 177.00 172.62 1we7 s SER 113 N -3.70 4.61 -0.39 6.66 1.04 -1.26 -5.04 113.70 115.61 1we7 s SER 113 Ca 0.69 -0.06 -0.27 0.00 0.48 0.00 0.00 55.95 56.78 1we7 s SER 113 Cb -0.13 -1.28 -0.06 0.00 0.10 0.00 0.00 66.02 64.64 1we7 s SER 113 CO 0.57 0.32 2.35 -0.24 0.98 0.00 0.00 173.24 177.22 1we7 n SER 114 N 2.52 2.64 -0.02 7.02 2.88 -1.26 -5.33 113.62 122.06 1we7 n SER 114 Ca -0.18 -0.24 0.00 0.00 -1.33 0.00 0.00 58.87 57.13 1we7 n SER 114 Cb 0.53 -1.57 0.00 0.00 -0.75 0.00 0.00 64.21 62.42 1we7 n SER 114 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42