#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c34 s SER -1 N 0.00 6.56 -0.24 1.61 0.01 -1.26 -4.99 113.70 115.40 2c34 s SER -1 Ca 0.00 0.68 0.12 0.00 1.31 0.00 0.00 55.95 58.06 2c34 s SER -1 Cb 0.00 -2.13 0.75 0.00 0.21 0.00 0.00 66.02 64.85 2c34 s SER -1 CO 0.00 0.16 1.68 1.41 0.41 0.00 0.00 173.24 176.90 2c34 n HIS 0 N 0.73 2.03 -1.41 2.43 -0.00 -1.26 -5.06 115.22 112.69 2c34 n HIS 0 Ca -0.07 -0.78 0.18 0.00 -0.00 0.00 0.00 57.72 57.05 2c34 n HIS 0 Cb 0.52 -0.53 -0.05 0.00 -0.00 0.00 0.00 29.99 29.94 2c34 n HIS 0 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.34 175.01 2c34 n MET 1 N 0.42 -2.72 -1.09 -0.41 2.00 -1.26 -4.76 117.12 109.30 2c34 n MET 1 Ca 0.29 1.79 0.03 0.00 0.00 0.00 0.00 57.70 59.81 2c34 n MET 1 Cb 1.18 -3.32 0.03 0.00 0.00 0.00 0.00 33.22 31.11 2c34 n MET 1 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 175.97 176.41 2c34 n ILE 2 N -4.04 0.20 -0.11 2.02 -5.35 -1.26 -4.91 119.36 105.90 2c34 n ILE 2 Ca 0.01 -0.87 -0.05 0.00 -0.27 0.00 0.00 62.75 61.57 2c34 n ILE 2 Cb 0.62 0.73 0.02 0.00 -1.74 0.00 0.00 39.64 39.26 2c34 n ILE 2 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2c34 h ALA 3 N 0.66 0.32 -2.72 -1.28 0.00 -2.02 -3.42 119.26 110.79 2c34 h ALA 3 Ca -0.14 0.13 -0.56 0.00 0.00 0.00 0.00 54.91 54.34 2c34 h ALA 3 Cb 1.66 0.23 0.18 0.00 0.00 0.00 0.00 17.79 19.86 2c34 h ALA 3 CO 0.06 -0.42 0.09 -2.30 0.00 0.00 0.00 179.25 176.68 2c34 n PRO 4 N -5.23 0.58 0.04 0.00 -0.02 -1.26 -4.94 135.00 124.16 2c34 n PRO 4 Ca 0.02 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 2c34 n PRO 4 Cb 0.21 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 2c34 n PRO 4 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2c34 n LEU 5 N -1.46 -0.40 0.00 2.45 7.94 -1.26 -4.98 117.00 119.29 2c34 n LEU 5 Ca 0.13 0.13 0.00 0.00 -1.11 0.00 0.00 56.01 55.16 2c34 n LEU 5 Cb 0.49 0.58 0.00 0.00 0.53 0.00 0.00 43.42 45.02 2c34 n LEU 5 CO 0.49 -0.46 0.29 -0.24 -1.11 0.00 0.00 177.39 176.36 2c34 n SER 6 N -2.69 0.97 -3.79 1.96 2.88 -1.26 -4.92 113.62 106.78 2c34 n SER 6 Ca 0.00 -1.33 -0.12 0.00 -1.33 0.00 0.00 58.87 56.09 2c34 n SER 6 Cb 0.00 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.38 2c34 n SER 6 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2c34 s VAL 7 N -0.33 0.08 -0.24 2.46 0.11 -1.26 -4.62 120.40 116.60 2c34 s VAL 7 Ca 0.00 -0.66 -0.01 0.00 -2.93 0.00 0.00 61.98 58.38 2c34 s VAL 7 Cb 0.00 -0.78 0.07 0.00 -1.53 0.00 0.00 36.38 34.13 2c34 s VAL 7 CO 0.00 -0.36 0.01 -0.54 -3.33 0.00 0.00 175.10 170.88 2c34 s LYS 8 N -2.05 1.10 0.13 1.54 -0.14 -1.26 -4.77 119.74 114.29 2c34 s LYS 8 Ca -0.09 -0.83 -0.31 0.00 -1.36 0.00 0.00 55.97 53.38 2c34 s LYS 8 Cb -0.03 -2.33 -0.09 0.00 -1.68 0.00 0.00 37.83 33.70 2c34 s LYS 8 CO -0.00 -0.70 1.43 -0.51 -0.76 0.00 0.00 175.35 174.81 2c34 s ASP 9 N 1.58 6.76 -0.04 2.83 1.01 -1.26 -4.18 116.67 123.37 2c34 s ASP 9 Ca -0.01 2.41 0.16 0.00 0.71 0.00 0.00 52.55 55.82 2c34 s ASP 9 Cb -0.18 -2.59 -0.25 0.00 1.01 0.00 0.00 42.92 40.91 2c34 s ASP 9 CO -0.10 -0.70 0.32 -3.20 0.21 0.00 0.00 175.17 171.70 2c34 n ASN 10 N 3.91 1.17 0.00 0.27 4.05 -1.26 -5.03 115.26 118.38 2c34 n ASN 10 Ca 0.12 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.15 2c34 n ASN 10 Cb 0.41 1.63 0.00 0.00 1.23 0.00 0.00 39.78 43.05 2c34 n ASN 10 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 2c34 n ASP 11 N -2.16 0.97 -1.36 1.20 9.92 -1.26 -4.87 116.55 118.98 2c34 n ASP 11 Ca -0.07 0.00 -0.01 0.00 -0.53 0.00 0.00 54.79 54.19 2c34 n ASP 11 Cb 0.53 0.00 -0.00 0.00 -0.64 0.00 0.00 41.12 41.00 2c34 n ASP 11 CO 0.00 0.00 0.00 2.29 0.13 0.00 0.00 177.20 179.62 2c34 n LYS 12 N 0.00 0.61 -4.10 -1.24 0.00 -1.26 -4.95 118.16 107.22 2c34 n LYS 12 Ca 0.00 -0.08 -0.25 0.00 -0.00 0.00 0.00 58.31 57.98 2c34 n LYS 12 Cb 0.00 0.05 -0.17 0.00 -0.00 0.00 0.00 35.03 34.91 2c34 n LYS 12 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.40 175.82 2c34 s TRP 13 N -1.73 1.26 0.04 5.58 0.51 -1.26 -2.19 118.94 121.14 2c34 s TRP 13 Ca 0.01 -0.53 -0.11 0.00 -2.12 0.00 0.00 56.10 53.34 2c34 s TRP 13 Cb 0.00 -1.05 0.01 0.00 -0.81 0.00 0.00 33.47 31.62 2c34 s TRP 13 CO 0.00 -0.38 0.24 0.14 -0.51 0.00 0.00 176.95 176.44 2c34 s VAL 14 N 1.36 0.10 1.10 4.03 -7.23 -1.16 -4.91 120.40 113.69 2c34 s VAL 14 Ca -0.02 -0.80 -0.19 0.00 -1.81 0.00 0.00 61.98 59.16 2c34 s VAL 14 Cb -0.14 -0.90 0.07 0.00 0.56 0.00 0.00 36.38 35.98 2c34 s VAL 14 CO -0.04 -0.44 -0.10 -0.90 -0.31 0.00 0.00 175.10 173.31 2c34 n ASP 15 N 0.69 -2.44 -0.90 4.85 5.75 -1.26 0.38 116.55 123.64 2c34 n ASP 15 Ca -0.19 -0.08 0.00 0.00 -0.01 0.00 0.00 54.79 54.52 2c34 n ASP 15 Cb 0.59 -0.94 0.00 0.00 -1.03 0.00 0.00 41.12 39.74 2c34 n ASP 15 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 2c34 n THR 16 N -4.27 0.00 -3.32 2.12 5.66 -1.23 -4.44 114.28 108.80 2c34 n THR 16 Ca 0.01 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.87 2c34 n THR 16 Cb 0.63 0.00 0.02 0.00 -1.55 0.00 0.00 70.33 69.43 2c34 n THR 16 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 2c34 n HIS 17 N 0.00 -1.90 -3.71 1.09 8.25 -1.26 -1.68 115.22 116.02 2c34 n HIS 17 Ca 0.00 -1.36 -0.37 0.00 -0.26 0.00 0.00 57.72 55.73 2c34 n HIS 17 Cb 0.00 -0.31 -0.06 0.00 1.12 0.00 0.00 29.99 30.74 2c34 n HIS 17 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2c34 s VAL 18 N -1.41 5.28 -0.87 1.59 0.11 -1.26 -4.26 120.40 119.58 2c34 s VAL 18 Ca 0.30 0.47 0.00 0.00 -2.93 0.00 0.00 61.98 59.82 2c34 s VAL 18 Cb -0.02 -3.55 0.00 0.00 -1.53 0.00 0.00 36.38 31.28 2c34 s VAL 18 CO 0.19 0.57 0.00 0.61 -3.33 0.00 0.00 175.10 173.14 2c34 n GLY 19 N 1.81 0.78 3.55 6.54 0.00 -0.22 -4.81 105.19 112.84 2c34 n GLY 19 Ca -0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.61 2c34 n GLY 19 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2c34 n LYS 20 N -0.77 1.07 -1.48 1.61 3.00 -1.26 -4.66 118.16 115.66 2c34 n LYS 20 Ca -0.08 -2.16 -0.42 0.00 -0.00 0.00 0.00 58.31 55.65 2c34 n LYS 20 Cb 0.43 -3.73 -0.12 0.00 0.00 0.00 0.00 35.03 31.61 2c34 n LYS 20 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 2c34 n THR 21 N 8.11 -0.01 -3.19 3.15 -1.04 -1.26 -4.64 114.28 115.41 2c34 n THR 21 Ca 0.44 -0.15 -0.45 0.00 -2.04 0.00 0.00 64.05 61.85 2c34 n THR 21 Cb 0.46 -0.96 -0.05 0.00 -1.82 0.00 0.00 70.33 67.95 2c34 n THR 21 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2c34 s THR 22 N 9.23 4.95 -0.01 12.58 2.01 -0.96 -4.86 115.64 138.58 2c34 s THR 22 Ca 1.27 -0.99 -0.29 0.00 0.31 0.00 0.00 61.69 61.98 2c34 s THR 22 Cb -1.07 -4.38 -0.03 0.00 0.01 0.00 0.00 72.50 67.03 2c34 s THR 22 CO 0.46 -0.94 0.95 -0.70 -0.69 0.00 0.00 174.62 173.70 2c34 s GLU 23 N 2.34 4.55 -0.25 4.92 2.12 -1.25 -2.42 118.70 128.71 2c34 s GLU 23 Ca 0.10 1.36 -0.02 0.00 0.36 0.00 0.00 54.97 56.77 2c34 s GLU 23 Cb -0.24 -3.46 0.08 0.00 0.26 0.00 0.00 34.13 30.77 2c34 s GLU 23 CO 0.07 -0.03 0.05 0.42 -0.54 0.00 0.00 175.26 175.23 2c34 s ILE 24 N 0.97 0.74 -0.76 -3.70 1.01 -0.44 -4.95 121.20 114.07 2c34 s ILE 24 Ca 0.50 -0.97 -0.21 0.00 0.00 0.00 0.00 60.65 59.98 2c34 s ILE 24 Cb -0.21 -1.36 0.10 0.00 0.01 0.00 0.00 42.46 41.00 2c34 s ILE 24 CO 0.27 -0.41 1.01 -1.00 0.00 0.00 0.00 174.94 174.81 2c34 s HIS 25 N 1.73 2.88 0.17 3.97 3.76 -1.26 -2.30 115.29 124.23 2c34 s HIS 25 Ca 0.03 -0.92 -0.13 0.00 -0.15 0.00 0.00 55.06 53.89 2c34 s HIS 25 Cb -0.17 -4.27 -0.07 0.00 1.11 0.00 0.00 32.58 29.18 2c34 s HIS 25 CO -0.16 -1.56 0.55 -0.51 -0.85 0.00 0.00 174.74 172.22 2c34 s LEU 26 N 3.40 4.30 0.26 0.89 1.43 -0.97 -4.88 118.68 123.12 2c34 s LEU 26 Ca 0.25 1.05 0.06 0.00 -1.03 0.00 0.00 54.13 54.46 2c34 s LEU 26 Cb -0.13 -3.36 -0.03 0.00 0.03 0.00 0.00 46.19 42.70 2c34 s LEU 26 CO 0.02 0.06 0.37 -0.54 0.23 0.00 0.00 176.35 176.49 2c34 s LYS 27 N -2.14 3.31 0.00 1.70 1.02 -1.26 -1.62 119.74 120.75 2c34 s LYS 27 Ca 0.40 -0.85 0.00 0.00 0.02 0.00 0.00 55.97 55.54 2c34 s LYS 27 Cb -0.14 -2.84 0.00 0.00 -0.52 0.00 0.00 37.83 34.33 2c34 s LYS 27 CO 0.19 0.34 0.00 0.41 -0.92 0.00 0.00 175.35 175.37 2c34 n GLY 28 N -1.44 -0.81 3.04 -3.33 0.00 -1.26 -4.94 105.19 96.45 2c34 n GLY 28 Ca -0.07 -0.25 0.04 0.00 0.00 0.00 0.00 46.02 45.75 2c34 n GLY 28 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2c34 s ASN 29 N -4.00 -0.40 0.50 1.61 2.47 -1.26 -4.88 114.94 108.98 2c34 s ASN 29 Ca 0.00 -0.03 0.22 0.00 0.42 0.00 0.00 52.86 53.47 2c34 s ASN 29 Cb 0.00 1.02 1.29 0.00 -1.45 0.00 0.00 41.25 42.12 2c34 s ASN 29 CO 0.00 -0.06 1.99 1.55 -3.72 0.00 0.00 177.10 176.85 2c34 h PRO 30 N 6.71 0.11 -0.07 0.43 0.13 -1.82 -0.91 132.00 136.59 2c34 h PRO 30 Ca -0.07 -0.01 0.02 0.00 -0.87 0.00 0.00 66.00 65.07 2c34 h PRO 30 Cb 1.19 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 2c34 h PRO 30 CO -0.09 0.08 0.23 1.15 -0.23 0.00 0.00 178.00 179.13 2c34 h THR 31 N 0.12 0.14 0.70 1.56 2.02 -1.79 -2.52 112.91 113.14 2c34 h THR 31 Ca 0.26 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.41 2c34 h THR 31 Cb 0.89 0.79 0.01 0.00 -1.74 0.00 0.00 68.15 68.10 2c34 h THR 31 CO -0.03 0.00 -0.34 0.71 0.37 0.00 0.00 175.52 176.23 2c34 h THR 32 N 0.00 0.02 0.00 3.16 1.35 -1.55 -3.48 112.91 112.40 2c34 h THR 32 Ca 0.03 -0.31 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 2c34 h THR 32 Cb 0.49 0.02 0.00 0.00 -1.73 0.00 0.00 68.15 66.93 2c34 h THR 32 CO -0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2c34 n GLY 33 N -0.64 1.20 3.65 5.82 0.00 -0.95 -5.15 105.19 109.12 2c34 n GLY 33 Ca -0.12 -0.08 -0.22 0.00 0.00 0.00 0.00 46.02 45.60 2c34 n GLY 33 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2c34 n TYR 34 N 0.00 -3.08 -3.81 1.61 4.02 -1.26 -4.26 117.16 110.38 2c34 n TYR 34 Ca 0.00 -1.59 -0.11 0.00 -0.01 0.00 0.00 57.90 56.19 2c34 n TYR 34 Cb 0.00 -0.72 -0.08 0.00 -0.02 0.00 0.00 39.34 38.52 2c34 n TYR 34 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 176.86 177.26 2c34 s MET 35 N -5.04 0.71 -0.60 -0.72 -2.45 0.58 -4.56 119.30 107.23 2c34 s MET 35 Ca 0.63 -0.53 -0.05 0.00 -1.25 0.00 0.00 55.69 54.49 2c34 s MET 35 Cb -0.03 0.30 0.15 0.00 1.25 0.00 0.00 34.83 36.50 2c34 s MET 35 CO 0.42 -0.21 0.43 -1.58 1.05 0.00 0.00 175.02 175.13 2c34 s TRP 36 N -2.36 3.48 0.00 4.11 0.23 -1.26 -1.47 118.94 121.68 2c34 s TRP 36 Ca -0.07 -2.46 0.00 0.00 -2.03 0.00 0.00 56.10 51.55 2c34 s TRP 36 Cb -0.02 -3.33 0.00 0.00 0.03 0.00 0.00 33.47 30.16 2c34 s TRP 36 CO -0.03 -0.90 0.00 -2.37 0.96 0.00 0.00 176.95 174.61 2c34 n THR 37 N 3.92 0.00 -3.18 2.01 5.66 -1.04 -4.90 114.28 116.75 2c34 n THR 37 Ca 0.05 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.66 2c34 n THR 37 Cb 0.40 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.12 2c34 n THR 37 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 2c34 s ARG 38 N -1.54 4.31 0.21 1.09 0.52 -1.26 -0.29 118.95 121.99 2c34 s ARG 38 Ca 0.00 0.86 -0.32 0.00 -0.52 0.00 0.00 55.73 55.76 2c34 s ARG 38 Cb 0.00 -3.22 -0.12 0.00 0.52 0.00 0.00 34.95 32.13 2c34 s ARG 38 CO 0.00 0.61 1.68 0.08 0.02 0.00 0.00 175.30 177.68 2c34 s VAL 39 N -1.15 2.14 0.00 3.52 1.01 0.65 -2.04 120.40 124.52 2c34 s VAL 39 Ca 0.32 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.40 2c34 s VAL 39 Cb -0.20 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.11 2c34 s VAL 39 CO 0.21 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.93 2c34 n GLY 40 N 3.67 0.58 0.00 4.51 0.00 -1.26 -4.84 105.19 107.85 2c34 n GLY 40 Ca 0.14 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2c34 n GLY 40 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2c34 n PHE 41 N -2.79 0.00 -1.52 1.61 3.72 -0.87 -5.01 117.46 112.60 2c34 n PHE 41 Ca 0.00 -0.00 -0.48 0.00 -0.05 0.00 0.00 57.45 56.92 2c34 n PHE 41 Cb 0.00 -0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.48 2c34 n PHE 41 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2c34 n VAL 42 N -0.00 0.28 0.00 -4.37 0.31 -1.20 -0.47 118.33 112.88 2c34 n VAL 42 Ca 0.00 -0.31 0.00 0.00 -0.01 0.00 0.00 64.34 64.02 2c34 n VAL 42 Cb 0.24 -1.98 0.00 0.00 -0.91 0.00 0.00 33.84 31.19 2c34 n VAL 42 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2c34 n GLY 43 N 6.06 2.13 3.61 2.92 0.00 -1.26 -4.93 105.19 113.71 2c34 n GLY 43 Ca 0.35 -0.18 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 2c34 n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c34 s LYS 44 N 0.00 -0.63 -0.07 1.61 1.02 0.38 -5.02 119.74 117.03 2c34 s LYS 44 Ca 0.00 0.23 -0.00 0.00 0.02 0.00 0.00 55.97 56.22 2c34 s LYS 44 Cb 0.00 -1.64 -0.00 0.00 -0.52 0.00 0.00 37.83 35.67 2c34 s LYS 44 CO 0.00 -3.38 -0.00 -0.44 -0.92 0.00 0.00 175.35 170.60 2c34 h ASP 45 N -2.35 0.00 -2.70 2.83 5.19 -1.98 -3.46 116.42 113.94 2c34 h ASP 45 Ca -0.50 0.00 -0.66 0.00 -0.62 0.00 0.00 57.03 55.25 2c34 h ASP 45 Cb 1.32 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 40.76 2c34 h ASP 45 CO 0.45 0.33 -0.48 0.54 -3.12 0.00 0.00 179.24 176.96 2c34 s VAL 46 N -1.38 5.48 -0.24 -1.35 0.11 -1.26 -5.02 120.40 116.74 2c34 s VAL 46 Ca -0.00 0.07 -0.17 0.00 -2.93 0.00 0.00 61.98 58.95 2c34 s VAL 46 Cb 0.00 -3.45 -0.14 0.00 -1.53 0.00 0.00 36.38 31.26 2c34 s VAL 46 CO 0.01 0.51 -0.15 0.18 -3.33 0.00 0.00 175.10 172.31 2c34 n LEU 47 N 1.58 1.92 -4.17 2.54 4.77 -1.26 -4.96 117.00 117.42 2c34 n LEU 47 Ca -0.16 0.38 -0.26 0.00 -0.03 0.00 0.00 56.01 55.94 2c34 n LEU 47 Cb 0.54 -0.87 0.19 0.00 -2.33 0.00 0.00 43.42 40.95 2c34 n LEU 47 CO 0.36 0.38 -0.13 -1.54 -1.33 0.00 0.00 177.39 175.13 2c34 n SER 48 N -4.34 -2.88 0.00 -1.43 3.41 -1.24 -4.94 113.62 102.20 2c34 n SER 48 Ca -0.42 -0.35 0.00 0.00 -0.26 0.00 0.00 58.87 57.83 2c34 n SER 48 Cb 0.77 -0.90 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 2c34 n SER 48 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2c34 n ASP 49 N -2.29 0.00 0.00 4.04 9.92 -1.25 -4.95 116.55 122.03 2c34 n ASP 49 Ca 0.05 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.31 2c34 n ASP 49 Cb 0.50 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.98 2c34 n ASP 49 CO 0.00 0.00 0.00 -1.84 0.13 0.00 0.00 177.20 175.49 2c34 n GLU 50 N -0.46 1.18 0.00 -1.24 0.28 -1.26 -4.94 120.64 114.21 2c34 n GLU 50 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2c34 n GLU 50 Cb 0.00 -0.68 0.00 0.00 1.43 0.00 0.00 31.44 32.19 2c34 n GLU 50 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 2c34 n ILE 51 N -1.19 0.00 -4.00 3.84 2.08 -1.26 -4.34 119.36 114.49 2c34 n ILE 51 Ca 0.00 0.89 -0.35 0.00 0.56 0.00 0.00 62.75 63.85 2c34 n ILE 51 Cb 0.18 -1.78 -0.14 0.00 -0.75 0.00 0.00 39.64 37.16 2c34 n ILE 51 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 2c34 s LEU 52 N -3.37 2.94 -0.79 1.39 1.43 -1.26 -1.13 118.68 117.89 2c34 s LEU 52 Ca 0.00 -0.36 -0.19 0.00 -1.03 0.00 0.00 54.13 52.56 2c34 s LEU 52 Cb 0.00 -1.74 -0.14 0.00 0.03 0.00 0.00 46.19 44.34 2c34 s LEU 52 CO 0.00 0.01 1.95 -0.62 0.23 0.00 0.00 176.35 177.92 2c34 n GLU 53 N 4.62 1.60 -2.35 1.70 -0.58 0.93 -3.83 120.64 122.72 2c34 n GLU 53 Ca -0.18 -1.76 -0.36 0.00 -0.42 0.00 0.00 57.16 54.45 2c34 n GLU 53 Cb 0.51 -2.82 -0.03 0.00 -0.57 0.00 0.00 31.44 28.53 2c34 n GLU 53 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2c34 s VAL 54 N 4.69 3.78 -1.04 2.62 1.01 -1.24 -2.02 120.40 128.20 2c34 s VAL 54 Ca 0.53 -0.94 -0.20 0.00 0.00 0.00 0.00 61.98 61.37 2c34 s VAL 54 Cb 0.13 -4.74 0.09 0.00 0.00 0.00 0.00 36.38 31.87 2c34 s VAL 54 CO 0.09 -1.54 1.38 -0.69 0.00 0.00 0.00 175.10 174.33 2c34 s VAL 55 N 7.16 4.31 -0.07 2.92 1.01 0.21 -3.59 120.40 132.35 2c34 s VAL 55 Ca 0.58 -1.34 -0.02 0.00 0.00 0.00 0.00 61.98 61.20 2c34 s VAL 55 Cb -0.01 -4.97 -0.04 0.00 0.00 0.00 0.00 36.38 31.36 2c34 s VAL 55 CO 0.00 -1.78 0.04 0.00 0.00 0.00 0.00 175.10 173.36 2c34 s LYS 57 N -1.10 1.21 -0.38 0.00 1.02 0.91 -4.94 119.74 116.47 2c34 s LYS 57 Ca 0.16 -0.38 -0.26 0.00 0.02 0.00 0.00 55.97 55.51 2c34 s LYS 57 Cb -0.12 -1.81 0.02 0.00 -0.52 0.00 0.00 37.83 35.40 2c34 s LYS 57 CO 0.05 -0.42 0.95 -0.47 -0.92 0.00 0.00 175.35 174.54 2c34 s TYR 58 N 1.72 3.06 -0.30 3.18 6.14 -1.26 -2.33 117.35 127.56 2c34 s TYR 58 Ca 0.02 0.78 -0.04 0.00 0.64 0.00 0.00 57.07 58.47 2c34 s TYR 58 Cb -0.15 -3.72 0.04 0.00 0.42 0.00 0.00 41.96 38.55 2c34 s TYR 58 CO -0.07 -0.87 0.02 0.99 0.64 0.00 0.00 175.55 176.26 2c34 s THR 59 N 3.57 3.29 -0.67 4.34 2.01 -1.08 -4.99 115.64 122.11 2c34 s THR 59 Ca 0.39 -1.17 -0.02 0.00 0.31 0.00 0.00 61.69 61.21 2c34 s THR 59 Cb -0.12 -2.82 0.43 0.00 0.01 0.00 0.00 72.50 70.01 2c34 s THR 59 CO 0.20 -0.04 2.04 -0.81 -0.69 0.00 0.00 174.62 175.32 2c34 n PRO 60 N 4.71 2.66 -1.43 4.92 -0.04 -1.26 -0.27 135.00 144.28 2c34 n PRO 60 Ca -0.14 -3.23 -0.47 0.00 -0.04 0.00 0.00 63.50 59.62 2c34 n PRO 60 Cb 0.45 -2.26 -0.03 0.00 -0.04 0.00 0.00 33.50 31.62 2c34 n PRO 60 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2c34 n THR 61 N -0.83 1.94 -0.33 0.52 -1.04 -1.26 -1.87 114.28 111.41 2c34 n THR 61 Ca 0.61 -0.50 -0.23 0.00 -2.04 0.00 0.00 64.05 61.89 2c34 n THR 61 Cb 0.62 -0.20 0.21 0.00 -1.82 0.00 0.00 70.33 69.15 2c34 n THR 61 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2c34 n PRO 62 N 0.95 -3.83 -0.02 -2.82 -0.02 -1.26 -1.52 135.00 126.49 2c34 n PRO 62 Ca 0.16 -1.14 -0.00 0.00 -2.02 0.00 0.00 63.50 60.50 2c34 n PRO 62 Cb 0.27 -1.38 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 2c34 n PRO 62 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2c34 n SER 63 N -4.97 -0.95 0.03 2.55 7.64 -1.26 -4.67 113.62 112.00 2c34 n SER 63 Ca 0.11 -0.54 -0.01 0.00 1.01 0.00 0.00 58.87 59.43 2c34 n SER 63 Cb 0.45 -0.01 -0.01 0.00 -1.01 0.00 0.00 64.21 63.63 2c34 n SER 63 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2c34 h SER 64 N -0.96 -0.08 0.01 6.43 0.87 -1.96 -3.43 113.55 114.44 2c34 h SER 64 Ca -0.01 0.00 -0.31 0.00 -1.23 0.00 0.00 61.79 60.24 2c34 h SER 64 Cb 0.02 0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 61.95 2c34 h SER 64 CO 0.00 0.02 -1.72 0.41 -0.53 0.00 0.00 176.83 175.01 2c34 n THR 65 N -2.65 1.56 -0.81 2.23 -1.04 -1.26 -4.99 114.28 107.31 2c34 n THR 65 Ca -0.01 -0.21 -0.12 0.00 -2.04 0.00 0.00 64.05 61.67 2c34 n THR 65 Cb 0.04 -1.94 0.10 0.00 -1.82 0.00 0.00 70.33 66.70 2c34 n THR 65 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2c34 n PRO 66 N -4.23 -1.68 -0.24 -2.82 -0.02 -1.26 -5.02 135.00 119.73 2c34 n PRO 66 Ca -0.38 -0.73 0.00 0.00 -2.02 0.00 0.00 63.50 60.37 2c34 n PRO 66 Cb 0.79 -0.65 0.01 0.00 -0.02 0.00 0.00 33.50 33.63 2c34 n PRO 66 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 2c34 n MET 67 N -2.75 0.20 -3.93 -0.52 2.81 -1.26 -4.01 117.12 107.65 2c34 n MET 67 Ca 0.06 -0.88 -0.31 0.00 -1.81 0.00 0.00 57.70 54.76 2c34 n MET 67 Cb 0.24 -0.57 -0.04 0.00 -0.71 0.00 0.00 33.22 32.13 2c34 n MET 67 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2c34 s VAL 68 N -0.19 5.30 0.00 2.03 0.11 -1.26 -4.54 120.40 121.86 2c34 s VAL 68 Ca 0.02 -0.44 0.00 0.00 -2.93 0.00 0.00 61.98 58.62 2c34 s VAL 68 Cb 0.01 -3.59 0.00 0.00 -1.53 0.00 0.00 36.38 31.27 2c34 s VAL 68 CO 0.00 0.13 0.00 0.61 -3.33 0.00 0.00 175.10 172.51 2c34 n GLY 69 N 0.26 2.80 2.99 6.54 0.00 -1.26 -4.43 105.19 112.08 2c34 n GLY 69 Ca -0.05 -0.69 -0.08 0.00 0.00 0.00 0.00 46.02 45.19 2c34 n GLY 69 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2c34 n VAL 70 N 0.00 -8.15 -3.68 1.61 0.31 -1.26 -4.43 118.33 102.73 2c34 n VAL 70 Ca 0.00 1.03 -0.10 0.00 -0.01 0.00 0.00 64.34 65.26 2c34 n VAL 70 Cb 0.00 -5.55 -0.11 0.00 -0.91 0.00 0.00 33.84 27.28 2c34 n VAL 70 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2c34 s GLY 71 N -1.69 -0.31 0.00 2.92 0.00 -0.57 -4.49 107.32 103.18 2c34 s GLY 71 Ca 0.12 1.43 0.00 0.00 0.00 0.00 0.00 44.72 46.27 2c34 s GLY 71 CO 0.61 2.00 0.00 0.61 0.00 0.00 0.00 173.10 176.32 2c34 n GLY 72 N 4.85 1.79 0.00 0.20 0.00 -1.09 -4.26 105.19 106.67 2c34 n GLY 72 Ca -0.15 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2c34 n GLY 72 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2c34 n ILE 73 N 0.00 0.00 -3.76 -0.61 -5.35 0.63 -4.28 119.36 105.99 2c34 n ILE 73 Ca 0.00 0.00 -0.30 0.00 -0.27 0.00 0.00 62.75 62.18 2c34 n ILE 73 Cb 0.00 0.00 -0.15 0.00 -1.74 0.00 0.00 39.64 37.75 2c34 n ILE 73 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 2c34 s TYR 74 N -1.57 1.87 -0.36 4.28 1.51 -0.64 -2.62 117.35 119.81 2c34 s TYR 74 Ca 0.00 -1.81 -0.24 0.00 -1.01 0.00 0.00 57.07 54.01 2c34 s TYR 74 Cb 0.00 -1.79 0.01 0.00 -0.11 0.00 0.00 41.96 40.07 2c34 s TYR 74 CO 0.00 -0.87 0.83 0.08 -1.11 0.00 0.00 175.55 174.47 2c34 s VAL 75 N 1.56 4.69 -0.18 0.71 1.01 -0.99 -2.28 120.40 124.92 2c34 s VAL 75 Ca 0.09 0.99 0.01 0.00 0.00 0.00 0.00 61.98 63.07 2c34 s VAL 75 Cb -0.17 -4.25 0.02 0.00 0.00 0.00 0.00 36.38 31.98 2c34 s VAL 75 CO -0.23 -0.46 -0.19 -0.69 0.00 0.00 0.00 175.10 173.53 2c34 s VAL 76 N 3.21 2.16 -0.50 2.92 1.01 -0.97 -0.06 120.40 128.16 2c34 s VAL 76 Ca 0.33 -0.91 -0.06 0.00 0.00 0.00 0.00 61.98 61.34 2c34 s VAL 76 Cb -0.13 -1.91 0.13 0.00 0.00 0.00 0.00 36.38 34.47 2c34 s VAL 76 CO 0.17 0.53 0.34 -0.76 0.00 0.00 0.00 175.10 175.39 2c34 s LEU 77 N 1.27 5.53 -0.50 3.92 1.43 -0.65 -1.33 118.68 128.34 2c34 s LEU 77 Ca 0.04 -2.18 -0.19 0.00 -1.03 0.00 0.00 54.13 50.77 2c34 s LEU 77 Cb -0.13 -1.93 0.06 0.00 0.03 0.00 0.00 46.19 44.21 2c34 s LEU 77 CO -0.11 -0.58 0.63 -0.69 0.23 0.00 0.00 176.35 175.83 2c34 s VAL 78 N 0.95 4.86 -0.44 -1.59 1.01 -1.02 0.67 120.40 124.84 2c34 s VAL 78 Ca 0.09 -0.45 -0.10 0.00 0.00 0.00 0.00 61.98 61.52 2c34 s VAL 78 Cb -0.23 -4.30 0.09 0.00 0.00 0.00 0.00 36.38 31.94 2c34 s VAL 78 CO -0.03 -0.80 0.31 -0.54 0.00 0.00 0.00 175.10 174.04 2c34 s LYS 79 N 2.66 2.62 -0.79 2.72 1.02 -0.86 -2.28 119.74 124.84 2c34 s LYS 79 Ca 0.16 -1.55 -0.29 0.00 0.02 0.00 0.00 55.97 54.31 2c34 s LYS 79 Cb -0.19 -3.88 -0.16 0.00 -0.52 0.00 0.00 37.83 33.08 2c34 s LYS 79 CO 0.12 -1.05 2.58 -2.30 -0.92 0.00 0.00 175.35 173.79 2c34 n PRO 80 N 4.96 0.44 0.08 -1.68 -0.02 -1.26 -0.05 135.00 137.46 2c34 n PRO 80 Ca -0.10 -0.01 -0.11 0.00 -2.02 0.00 0.00 63.50 61.27 2c34 n PRO 80 Cb 0.42 -2.32 -0.04 0.00 -0.02 0.00 0.00 33.50 31.53 2c34 n PRO 80 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2c34 h ARG 81 N 15.21 0.25 -6.15 -0.52 3.08 -1.38 -0.57 114.38 124.31 2c34 h ARG 81 Ca -0.13 -0.30 -0.61 0.00 0.07 0.00 0.00 59.98 59.01 2c34 h ARG 81 Cb 1.29 0.09 -0.14 0.00 0.08 0.00 0.00 29.97 31.30 2c34 h ARG 81 CO 1.29 1.04 -0.74 0.15 -1.07 0.00 0.00 179.97 180.64 2c34 s LYS 82 N -3.11 1.73 -0.23 0.04 1.02 -0.89 -4.97 119.74 113.34 2c34 s LYS 82 Ca -0.04 -1.80 -0.08 0.00 0.02 0.00 0.00 55.97 54.08 2c34 s LYS 82 Cb 0.09 -1.77 -0.04 0.00 -0.52 0.00 0.00 37.83 35.59 2c34 s LYS 82 CO 0.85 0.29 0.09 1.03 -0.92 0.00 0.00 175.35 176.69 2c34 s ARG 83 N -3.54 3.87 0.00 1.68 0.52 -1.26 -4.80 118.95 115.42 2c34 s ARG 83 Ca 0.31 -0.38 0.00 0.00 -0.52 0.00 0.00 55.73 55.14 2c34 s ARG 83 Cb -0.03 -3.35 0.00 0.00 0.52 0.00 0.00 34.95 32.09 2c34 s ARG 83 CO 0.16 0.02 0.00 0.41 0.02 0.00 0.00 175.30 175.91 2c34 n GLY 84 N 4.32 0.25 3.55 -3.53 0.00 0.11 -4.93 105.19 104.96 2c34 n GLY 84 Ca -0.16 -1.67 -0.37 0.00 0.00 0.00 0.00 46.02 43.82 2c34 n GLY 84 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2c34 s HIS 85 N -2.47 1.29 0.11 1.61 3.76 -1.26 -1.37 115.29 116.95 2c34 s HIS 85 Ca 0.00 1.24 0.02 0.00 -0.15 0.00 0.00 55.06 56.17 2c34 s HIS 85 Cb 0.00 -3.78 -0.04 0.00 1.11 0.00 0.00 32.58 29.87 2c34 s HIS 85 CO 0.00 -2.55 -0.05 -1.01 -0.85 0.00 0.00 174.74 170.28 2c34 s HIS 86 N 10.85 0.94 -0.18 1.40 4.02 -0.78 -4.96 115.29 126.58 2c34 s HIS 86 Ca 0.87 -0.95 -0.28 0.00 1.02 0.00 0.00 55.06 55.72 2c34 s HIS 86 Cb -0.17 -0.54 0.10 0.00 -1.02 0.00 0.00 32.58 30.96 2c34 s HIS 86 CO 0.25 -0.18 0.89 0.99 1.02 0.00 0.00 174.74 177.71 2c34 s THR 87 N -3.66 0.00 -0.59 1.30 2.01 -1.25 -1.82 115.64 111.64 2c34 s THR 87 Ca 0.14 0.00 -0.28 0.00 0.31 0.00 0.00 61.69 61.86 2c34 s THR 87 Cb 0.06 -1.00 0.02 0.00 0.01 0.00 0.00 72.50 71.59 2c34 s THR 87 CO -0.03 0.00 1.28 -0.22 -0.69 0.00 0.00 174.62 174.96 2c34 s LEU 88 N -0.61 3.41 -0.78 4.42 2.96 -1.04 -4.78 118.68 122.26 2c34 s LEU 88 Ca -0.03 0.13 -0.24 0.00 -0.22 0.00 0.00 54.13 53.77 2c34 s LEU 88 Cb -0.02 -3.08 0.06 0.00 0.50 0.00 0.00 46.19 43.65 2c34 s LEU 88 CO 0.02 -1.59 1.17 -1.61 -1.32 0.00 0.00 176.35 173.02 2c34 s GLU 89 N 5.22 3.27 0.42 1.98 2.02 -1.26 -2.19 118.70 128.15 2c34 s GLU 89 Ca 0.46 -0.76 0.08 0.00 0.02 0.00 0.00 54.97 54.76 2c34 s GLU 89 Cb -0.09 -4.46 -0.01 0.00 0.10 0.00 0.00 34.13 29.67 2c34 s GLU 89 CO 0.24 -2.00 0.45 -0.51 0.02 0.00 0.00 175.26 173.47 2c34 s LEU 90 N 4.67 3.50 -0.11 1.80 1.43 -0.07 -0.26 118.68 129.64 2c34 s LEU 90 Ca 0.32 -0.62 -0.30 0.00 -1.03 0.00 0.00 54.13 52.50 2c34 s LEU 90 Cb -0.10 -2.29 0.11 0.00 0.03 0.00 0.00 46.19 43.94 2c34 s LEU 90 CO 0.07 -0.69 0.89 0.54 0.23 0.00 0.00 176.35 177.38 2c34 s VAL 91 N -2.42 0.00 -0.76 -1.59 0.11 0.60 -2.20 120.40 114.13 2c34 s VAL 91 Ca 0.51 0.00 -0.13 0.00 -2.93 0.00 0.00 61.98 59.42 2c34 s VAL 91 Cb -0.06 -1.00 0.20 0.00 -1.53 0.00 0.00 36.38 33.99 2c34 s VAL 91 CO 0.30 0.00 0.69 -0.47 -3.33 0.00 0.00 175.10 172.29 2c34 s TYR 92 N -1.32 3.66 0.27 1.54 5.04 -0.98 -2.48 117.35 123.08 2c34 s TYR 92 Ca -0.04 -1.96 0.06 0.00 -2.44 0.00 0.00 57.07 52.69 2c34 s TYR 92 Cb -0.00 -3.75 -0.06 0.00 0.35 0.00 0.00 41.96 38.50 2c34 s TYR 92 CO 0.03 -0.98 -0.05 -0.08 -1.34 0.00 0.00 175.55 173.13 2c34 s THR 93 N 0.36 1.55 -0.76 4.34 -1.32 -0.54 -3.98 115.64 115.29 2c34 s THR 93 Ca 0.15 -2.11 -0.13 0.00 -1.21 0.00 0.00 61.69 58.40 2c34 s THR 93 Cb -0.14 -2.44 0.20 0.00 -1.51 0.00 0.00 72.50 68.61 2c34 s THR 93 CO -0.07 -0.30 0.69 -0.13 -2.21 0.00 0.00 174.62 172.60 2c34 s ARG 94 N -3.75 3.38 0.45 7.08 0.52 -1.09 0.22 118.95 125.76 2c34 s ARG 94 Ca 0.29 -2.34 0.34 0.00 -0.52 0.00 0.00 55.73 53.50 2c34 s ARG 94 Cb 0.04 -4.33 1.51 0.00 0.52 0.00 0.00 34.95 32.69 2c34 s ARG 94 CO 0.11 -1.28 1.55 -2.30 0.02 0.00 0.00 175.30 173.40 2c34 n PRO 95 N 4.14 -0.03 -0.10 3.54 -0.02 -1.26 0.50 135.00 141.76 2c34 n PRO 95 Ca 0.09 1.23 -0.10 0.00 -2.02 0.00 0.00 63.50 62.69 2c34 n PRO 95 Cb 0.45 -2.46 -0.03 0.00 -0.02 0.00 0.00 33.50 31.44 2c34 n PRO 95 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 2c34 h PHE 96 N 0.00 0.51 0.00 6.00 0.04 -1.91 -3.42 116.94 118.16 2c34 h PHE 96 Ca 0.88 -0.06 0.00 0.00 2.80 0.00 0.00 57.97 61.59 2c34 h PHE 96 Cb 2.92 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 40.93 2c34 h PHE 96 CO -0.01 0.55 0.00 0.39 -0.60 0.00 0.00 178.31 178.64 2c34 n GLU 97 N -4.66 0.00 -3.66 1.51 1.02 0.18 -5.14 120.64 109.89 2c34 n GLU 97 Ca -0.02 0.00 -0.06 0.00 -0.02 0.00 0.00 57.16 57.06 2c34 n GLU 97 Cb 0.19 -0.01 0.02 0.00 -0.02 0.00 0.00 31.44 31.62 2c34 n GLU 97 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2c34 n GLY 98 N 2.94 0.86 0.07 0.62 0.00 -0.75 -5.01 105.19 103.92 2c34 n GLY 98 Ca 0.00 -1.19 -0.05 0.00 0.00 0.00 0.00 46.02 44.77 2c34 n GLY 98 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2c34 n ILE 99 N -0.59 1.33 -0.81 -0.61 5.41 -1.26 -2.66 119.36 120.17 2c34 n ILE 99 Ca -0.05 0.22 0.09 0.00 1.00 0.00 0.00 62.75 64.01 2c34 n ILE 99 Cb 0.55 -2.31 -0.05 0.00 -0.71 0.00 0.00 39.64 37.12 2c34 n ILE 99 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2c34 n LYS 100 N -4.39 -1.89 0.08 0.38 5.02 -1.26 -4.14 118.16 111.96 2c34 n LYS 100 Ca -0.09 1.55 -0.12 0.00 -2.02 0.00 0.00 58.31 57.63 2c34 n LYS 100 Cb 0.32 -2.19 -0.05 0.00 -0.02 0.00 0.00 35.03 33.08 2c34 n LYS 100 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2c34 h PRO 101 N -0.76 0.32 -0.72 1.97 0.13 -1.99 -3.27 132.00 127.68 2c34 h PRO 101 Ca -0.11 -0.38 0.09 0.00 -0.87 0.00 0.00 66.00 64.73 2c34 h PRO 101 Cb 0.77 0.12 -0.05 0.00 0.13 0.00 0.00 31.00 31.97 2c34 h PRO 101 CO 0.04 1.08 0.48 1.05 -0.23 0.00 0.00 178.00 180.42 2c34 h GLU 102 N 0.17 0.64 -6.85 0.86 4.11 -1.84 -3.40 114.58 108.27 2c34 h GLU 102 Ca -0.08 -0.04 -0.56 0.00 0.07 0.00 0.00 59.36 58.75 2c34 h GLU 102 Cb 1.63 -0.14 0.17 0.00 0.50 0.00 0.00 28.75 30.91 2c34 h GLU 102 CO 0.16 0.42 0.03 0.09 0.07 0.00 0.00 179.01 179.78 2c34 n ASN 103 N -4.49 0.31 -3.62 3.06 5.03 -1.23 -4.97 115.26 109.35 2c34 n ASN 103 Ca 0.12 0.71 -0.30 0.00 0.87 0.00 0.00 54.58 55.98 2c34 n ASN 103 Cb 0.31 -1.37 0.27 0.00 -1.02 0.00 0.00 39.78 37.97 2c34 n ASN 103 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 2c34 s GLU 104 N -2.98 -2.14 0.21 3.52 2.12 -1.26 -4.74 118.70 113.44 2c34 s GLU 104 Ca 0.74 0.04 -0.21 0.00 0.36 0.00 0.00 54.97 55.90 2c34 s GLU 104 Cb -0.38 -1.48 0.04 0.00 0.26 0.00 0.00 34.13 32.58 2c34 s GLU 104 CO 0.50 -4.34 0.63 0.50 -0.54 0.00 0.00 175.26 172.01 2c34 s ARG 105 N -5.23 1.48 -0.18 4.30 6.06 -1.26 -2.31 118.95 121.81 2c34 s ARG 105 Ca 0.70 -0.72 -0.04 0.00 -2.50 0.00 0.00 55.73 53.16 2c34 s ARG 105 Cb -0.12 0.59 0.09 0.00 0.06 0.00 0.00 34.95 35.57 2c34 s ARG 105 CO 0.57 -0.66 0.27 -0.47 -2.50 0.00 0.00 175.30 172.51 2c34 s TYR 106 N -3.83 -0.44 -0.19 5.12 6.14 -0.94 -4.21 117.35 119.01 2c34 s TYR 106 Ca 0.06 0.63 -0.08 0.00 0.64 0.00 0.00 57.07 58.33 2c34 s TYR 106 Cb -0.03 -0.16 -0.04 0.00 0.42 0.00 0.00 41.96 42.15 2c34 s TYR 106 CO -0.04 -0.53 0.07 0.95 0.64 0.00 0.00 175.55 176.64 2c34 s THR 107 N 2.41 4.78 -0.44 4.34 -4.23 -1.25 -0.89 115.64 120.35 2c34 s THR 107 Ca 0.06 -0.04 -0.16 0.00 -1.18 0.00 0.00 61.69 60.37 2c34 s THR 107 Cb -0.14 -3.16 0.04 0.00 1.34 0.00 0.00 72.50 70.57 2c34 s THR 107 CO -0.11 0.44 0.38 -0.22 -0.54 0.00 0.00 174.62 174.57 2c34 s LEU 108 N 0.53 5.20 -0.13 4.79 2.96 -0.93 -4.32 118.68 126.78 2c34 s LEU 108 Ca 0.03 -0.98 -0.16 0.00 -0.22 0.00 0.00 54.13 52.81 2c34 s LEU 108 Cb -0.13 -2.24 -0.18 0.00 0.50 0.00 0.00 46.19 44.15 2c34 s LEU 108 CO 0.01 -0.57 1.19 0.00 -1.32 0.00 0.00 176.35 175.66 2c34 n HIS 109 N 5.34 0.11 -2.98 5.38 1.44 -0.93 -2.50 115.22 121.09 2c34 n HIS 109 Ca -0.10 -0.22 -0.34 0.00 -2.01 0.00 0.00 57.72 55.05 2c34 n HIS 109 Cb 0.46 -0.82 -0.02 0.00 0.12 0.00 0.00 29.99 29.73 2c34 n HIS 109 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2c34 n LEU 110 N 7.84 5.55 -2.26 2.39 4.77 -0.75 -3.01 117.00 131.52 2c34 n LEU 110 Ca 0.24 -5.45 -0.17 0.00 -0.03 0.00 0.00 56.01 50.59 2c34 n LEU 110 Cb 0.37 -0.90 -0.14 0.00 -2.33 0.00 0.00 43.42 40.42 2c34 n LEU 110 CO 0.70 2.07 1.94 -3.20 -1.33 0.00 0.00 177.39 177.57 2c34 n ASN 111 N 0.38 5.81 -1.86 -1.43 5.15 0.16 -1.86 115.26 121.60 2c34 n ASN 111 Ca 0.34 -2.48 -0.22 0.00 -0.60 0.00 0.00 54.58 51.62 2c34 n ASN 111 Cb 0.35 -1.42 -0.02 0.00 -0.53 0.00 0.00 39.78 38.16 2c34 n ASN 111 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 2c34 n VAL 112 N 2.72 0.52 0.92 3.44 0.31 -0.47 -3.55 118.33 122.22 2c34 n VAL 112 Ca 0.49 -0.13 0.07 0.00 -0.01 0.00 0.00 64.34 64.76 2c34 n VAL 112 Cb 0.77 0.00 0.44 0.00 -0.91 0.00 0.00 33.84 34.14 2c34 n VAL 112 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80