#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 0.03 -0.18 1.61 1.04 -1.26 -5.15 113.70 109.80 2c34 s SER -1 Ca 0.00 -0.85 -0.14 0.00 0.48 0.00 0.00 55.95 55.44 2c34 s SER -1 Cb 0.00 0.44 -0.05 0.00 0.10 0.00 0.00 66.02 66.51 2c34 s SER -1 CO 0.00 -0.90 0.30 -1.00 0.98 0.00 0.00 173.24 172.63 2c34 s HIS 0 N -3.96 3.43 -0.17 5.02 0.09 -1.26 -5.06 115.29 113.37 2c34 s HIS 0 Ca 0.17 0.57 -0.23 0.00 -0.00 0.00 0.00 55.06 55.56 2c34 s HIS 0 Cb 0.03 -2.37 -0.02 0.00 -0.00 0.00 0.00 32.58 30.22 2c34 s HIS 0 CO -0.00 0.17 0.74 -1.64 -0.00 0.00 0.00 174.74 174.01 2c34 s MET 1 N 0.70 4.27 0.00 1.40 1.00 -1.26 -4.93 119.30 120.48 2c34 s MET 1 Ca 0.16 0.85 0.17 0.00 0.00 0.00 0.00 55.69 56.88 2c34 s MET 1 Cb -0.13 -3.57 0.58 0.00 0.00 0.00 0.00 34.83 31.71 2c34 s MET 1 CO 0.05 -0.27 1.44 0.44 0.00 0.00 0.00 175.02 176.68 2c34 n ILE 2 N 4.65 0.33 -3.91 2.53 -5.35 -1.26 -4.56 119.36 111.79 2c34 n ILE 2 Ca 0.02 -0.42 -0.29 0.00 -0.27 0.00 0.00 62.75 61.79 2c34 n ILE 2 Cb 0.49 0.35 -0.13 0.00 -1.74 0.00 0.00 39.64 38.61 2c34 n ILE 2 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2c34 s ALA 3 N -1.67 3.62 -0.97 -1.28 0.00 -1.26 -4.93 121.76 115.27 2c34 s ALA 3 Ca 0.30 -3.63 0.00 0.00 0.00 0.00 0.00 51.96 48.63 2c34 s ALA 3 Cb 0.16 -2.16 0.00 0.00 0.00 0.00 0.00 23.12 21.12 2c34 s ALA 3 CO 0.23 -2.07 0.40 -2.30 0.00 0.00 0.00 175.76 172.02 2c34 n PRO 4 N 2.38 0.77 0.23 0.00 -0.02 -1.26 -4.19 135.00 132.91 2c34 n PRO 4 Ca 0.15 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.51 2c34 n PRO 4 Cb 0.34 -1.38 -0.06 0.00 -0.02 0.00 0.00 33.50 32.38 2c34 n PRO 4 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2c34 h LEU 5 N 0.26 -0.83 0.00 2.45 5.85 -1.98 -3.44 115.31 117.62 2c34 h LEU 5 Ca 0.00 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2c34 h LEU 5 Cb 0.40 0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.69 2c34 h LEU 5 CO 0.00 -0.45 0.00 -1.20 -0.34 0.00 0.00 178.44 176.45 2c34 n SER 6 N -4.30 0.00 -4.56 1.25 7.64 -1.26 -4.57 113.62 107.83 2c34 n SER 6 Ca -0.08 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.39 2c34 n SER 6 Cb 0.30 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.47 2c34 n SER 6 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2c34 s VAL 7 N -0.78 3.70 -0.30 0.44 1.01 -1.26 -4.90 120.40 118.31 2c34 s VAL 7 Ca 0.00 0.46 -0.20 0.00 0.00 0.00 0.00 61.98 62.23 2c34 s VAL 7 Cb 0.00 -4.67 0.19 0.00 0.00 0.00 0.00 36.38 31.89 2c34 s VAL 7 CO 0.00 -1.56 1.28 -0.75 0.00 0.00 0.00 175.10 174.07 2c34 s LYS 8 N 5.85 0.13 0.06 2.72 2.47 -1.26 -4.65 119.74 125.06 2c34 s LYS 8 Ca 0.43 0.18 -0.30 0.00 -1.56 0.00 0.00 55.97 54.72 2c34 s LYS 8 Cb -0.09 0.04 -0.08 0.00 -1.46 0.00 0.00 37.83 36.24 2c34 s LYS 8 CO 0.18 -0.02 1.74 0.34 0.16 0.00 0.00 175.35 177.75 2c34 s ASP 9 N 0.61 6.55 0.14 1.43 2.15 -1.26 -4.84 116.67 121.45 2c34 s ASP 9 Ca -0.01 2.54 0.00 0.00 0.43 0.00 0.00 52.55 55.50 2c34 s ASP 9 Cb -0.04 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.03 2c34 s ASP 9 CO -0.12 -0.94 0.00 -0.46 -0.17 0.00 0.00 175.17 173.47 2c34 n ASN 10 N 6.14 0.67 -4.54 -0.34 6.94 -1.26 -4.93 115.26 117.94 2c34 n ASN 10 Ca 0.17 0.22 -0.37 0.00 -0.02 0.00 0.00 54.58 54.58 2c34 n ASN 10 Cb 0.40 -0.11 -0.06 0.00 -2.36 0.00 0.00 39.78 37.65 2c34 n ASN 10 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 2c34 n ASP 11 N -3.44 1.78 -3.12 0.53 5.75 -1.26 -2.63 116.55 114.17 2c34 n ASP 11 Ca 0.00 -0.33 -0.30 0.00 -0.01 0.00 0.00 54.79 54.14 2c34 n ASP 11 Cb 0.04 -1.41 -0.03 0.00 -1.03 0.00 0.00 41.12 38.69 2c34 n ASP 11 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 2c34 n LYS 12 N 8.87 3.77 -2.57 0.11 3.00 0.04 -4.95 118.16 126.44 2c34 n LYS 12 Ca 0.45 -4.82 -0.43 0.00 -0.00 0.00 0.00 58.31 53.51 2c34 n LYS 12 Cb 0.41 -2.30 -0.02 0.00 0.00 0.00 0.00 35.03 33.12 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 -3.67 3.12 0.16 5.64 0.52 -1.26 -2.76 118.94 120.69 2c34 s TRP 13 Ca 0.46 1.25 -0.03 0.00 0.02 0.00 0.00 56.10 57.80 2c34 s TRP 13 Cb 0.25 -3.44 0.01 0.00 -1.15 0.00 0.00 33.47 29.15 2c34 s TRP 13 CO -0.13 -0.98 0.28 1.33 0.02 0.00 0.00 176.95 177.46 2c34 n VAL 14 N 5.46 0.00 -2.70 4.03 0.24 -0.90 -4.85 118.33 119.61 2c34 n VAL 14 Ca 0.13 -0.62 -0.22 0.00 -2.04 0.00 0.00 64.34 61.58 2c34 n VAL 14 Cb 0.46 0.46 0.09 0.00 -1.47 0.00 0.00 33.84 33.38 2c34 n VAL 14 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2c34 s ASP 15 N -1.93 4.62 -0.02 -1.34 1.11 -1.26 -1.25 116.67 116.60 2c34 s ASP 15 Ca 0.10 -0.45 -0.29 0.00 0.18 0.00 0.00 52.55 52.09 2c34 s ASP 15 Cb -0.01 -0.02 0.10 0.00 1.07 0.00 0.00 42.92 44.06 2c34 s ASP 15 CO 0.07 -1.66 1.29 0.28 1.18 0.00 0.00 175.17 176.33 2c34 s THR 16 N -2.98 0.00 0.00 -1.27 -1.32 -1.22 -4.44 115.64 104.40 2c34 s THR 16 Ca 0.64 -0.18 0.00 0.00 -1.21 0.00 0.00 61.69 60.94 2c34 s THR 16 Cb -0.06 -2.64 0.00 0.00 -1.51 0.00 0.00 72.50 68.30 2c34 s THR 16 CO 0.42 0.00 0.00 1.41 -2.21 0.00 0.00 174.62 174.24 2c34 n HIS 17 N -0.76 0.00 -3.38 9.09 8.25 -1.26 -1.15 115.22 126.02 2c34 n HIS 17 Ca -0.01 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.08 2c34 n HIS 17 Cb 0.60 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.65 2c34 n HIS 17 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2c34 s VAL 18 N 1.88 5.21 -0.59 1.59 1.01 -1.26 -4.09 120.40 124.16 2c34 s VAL 18 Ca 0.00 0.81 0.00 0.00 0.00 0.00 0.00 61.98 62.79 2c34 s VAL 18 Cb 0.00 -3.76 0.00 0.00 0.00 0.00 0.00 36.38 32.62 2c34 s VAL 18 CO 0.00 0.32 0.00 0.61 0.00 0.00 0.00 175.10 176.03 2c34 n GLY 19 N 3.45 0.63 3.53 4.51 0.00 0.27 -4.85 105.19 112.74 2c34 n GLY 19 Ca -0.08 -0.08 -0.14 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.76 0.35 -1.54 1.61 3.00 -1.26 -4.59 118.16 114.96 2c34 n LYS 20 Ca -0.06 -0.99 -0.31 0.00 -0.00 0.00 0.00 58.31 56.95 2c34 n LYS 20 Cb 0.44 -3.41 -0.06 0.00 0.00 0.00 0.00 35.03 32.00 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 8.41 -0.06 -2.89 3.15 -1.04 -1.26 -4.41 114.28 116.19 2c34 n THR 21 Ca 0.45 -0.64 -0.43 0.00 -2.04 0.00 0.00 64.05 61.39 2c34 n THR 21 Cb 0.42 -2.27 -0.04 0.00 -1.82 0.00 0.00 70.33 66.62 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 11.98 4.46 -0.10 12.58 2.01 -0.97 -4.84 115.64 140.75 2c34 s THR 22 Ca 1.03 0.05 -0.21 0.00 0.31 0.00 0.00 61.69 62.88 2c34 s THR 22 Cb -0.32 -4.52 -0.04 0.00 0.01 0.00 0.00 72.50 67.64 2c34 s THR 22 CO 0.26 -1.11 0.59 -0.70 -0.69 0.00 0.00 174.62 172.97 2c34 s GLU 23 N 3.74 4.37 -0.18 4.92 2.12 -1.23 -2.43 118.70 130.01 2c34 s GLU 23 Ca 0.27 0.65 -0.05 0.00 0.36 0.00 0.00 54.97 56.20 2c34 s GLU 23 Cb -0.14 -3.46 0.07 0.00 0.26 0.00 0.00 34.13 30.86 2c34 s GLU 23 CO 0.17 0.07 0.13 0.42 -0.54 0.00 0.00 175.26 175.50 2c34 s ILE 24 N 0.85 -0.15 -0.39 -3.70 1.01 -0.70 -4.96 121.20 113.16 2c34 s ILE 24 Ca 0.31 -0.16 -0.25 0.00 0.00 0.00 0.00 60.65 60.56 2c34 s ILE 24 Cb -0.16 -0.61 0.02 0.00 0.01 0.00 0.00 42.46 41.72 2c34 s ILE 24 CO 0.14 -0.27 0.88 -1.00 0.00 0.00 0.00 174.94 174.69 2c34 s HIS 25 N 2.19 3.05 0.29 3.97 3.76 -1.26 -2.32 115.29 124.98 2c34 s HIS 25 Ca 0.03 0.60 0.07 0.00 -0.15 0.00 0.00 55.06 55.61 2c34 s HIS 25 Cb -0.16 -3.65 -0.03 0.00 1.11 0.00 0.00 32.58 29.85 2c34 s HIS 25 CO -0.10 -0.87 0.27 -0.51 -0.85 0.00 0.00 174.74 172.68 2c34 s LEU 26 N 3.43 3.79 0.26 0.89 1.02 -0.89 -4.87 118.68 122.31 2c34 s LEU 26 Ca 0.36 -0.31 0.12 0.00 0.02 0.00 0.00 54.13 54.32 2c34 s LEU 26 Cb -0.12 -2.38 -0.05 0.00 0.02 0.00 0.00 46.19 43.67 2c34 s LEU 26 CO 0.20 -0.19 -0.19 -0.54 0.02 0.00 0.00 176.35 175.65 2c34 s LYS 27 N -3.94 1.69 0.00 1.70 3.01 -1.26 -1.63 119.74 119.32 2c34 s LYS 27 Ca 0.37 -1.68 0.00 0.00 -1.01 0.00 0.00 55.97 53.65 2c34 s LYS 27 Cb -0.07 -1.82 0.00 0.00 -1.01 0.00 0.00 37.83 34.93 2c34 s LYS 27 CO 0.26 0.35 0.00 0.41 0.51 0.00 0.00 175.35 176.88 2c34 n GLY 28 N -0.43 1.61 3.15 -3.33 0.00 -1.26 -4.98 105.19 99.95 2c34 n GLY 28 Ca -0.07 -0.01 0.05 0.00 0.00 0.00 0.00 46.02 45.99 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 2.00 -0.61 0.41 1.61 2.47 -1.26 -4.79 114.94 114.76 2c34 s ASN 29 Ca 0.00 0.20 0.08 0.00 0.42 0.00 0.00 52.86 53.57 2c34 s ASN 29 Cb 0.00 1.44 0.88 0.00 -1.45 0.00 0.00 41.25 42.12 2c34 s ASN 29 CO 0.00 -0.11 2.02 -0.65 -3.72 0.00 0.00 177.10 174.64 2c34 h PRO 30 N 7.67 0.54 -0.26 0.43 0.11 -1.82 -1.25 132.00 137.42 2c34 h PRO 30 Ca -0.11 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.97 2c34 h PRO 30 Cb 1.18 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2c34 h PRO 30 CO -0.05 0.36 0.00 0.25 -0.21 0.00 0.00 178.00 178.34 2c34 n THR 31 N -4.47 0.00 -0.06 -1.15 -2.24 -1.26 -3.03 114.28 102.06 2c34 n THR 31 Ca 0.06 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.71 2c34 n THR 31 Cb 0.16 -0.19 -0.14 0.00 -2.10 0.00 0.00 70.33 68.06 2c34 n THR 31 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2c34 n THR 32 N -0.31 1.55 0.00 4.28 -1.04 -0.47 -5.02 114.28 113.26 2c34 n THR 32 Ca 0.00 -0.76 0.00 0.00 -2.04 0.00 0.00 64.05 61.25 2c34 n THR 32 Cb 0.06 -1.03 0.00 0.00 -1.82 0.00 0.00 70.33 67.55 2c34 n THR 32 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2c34 n GLY 33 N 1.81 1.69 2.43 3.41 0.00 -1.17 -5.11 105.19 108.25 2c34 n GLY 33 Ca -0.30 -0.29 -0.12 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.53 -3.82 1.61 4.02 -1.26 -4.50 117.16 110.68 2c34 n TYR 34 Ca 0.00 -1.32 -0.12 0.00 -0.01 0.00 0.00 57.90 56.45 2c34 n TYR 34 Cb 0.00 -0.34 -0.10 0.00 -0.02 0.00 0.00 39.34 38.88 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 -3.63 0.45 -1.13 -0.72 -2.45 0.44 -4.63 119.30 107.63 2c34 s MET 35 Ca 0.38 -0.09 -0.11 0.00 -1.25 0.00 0.00 55.69 54.62 2c34 s MET 35 Cb -0.03 0.20 0.25 0.00 1.25 0.00 0.00 34.83 36.50 2c34 s MET 35 CO 0.24 -0.10 1.18 -1.58 1.05 0.00 0.00 175.02 175.81 2c34 s TRP 36 N -0.83 4.06 0.03 4.11 0.23 -1.26 -1.46 118.94 123.82 2c34 s TRP 36 Ca -0.09 -2.52 0.00 0.00 -2.03 0.00 0.00 56.10 51.46 2c34 s TRP 36 Cb -0.05 -3.96 -0.00 0.00 0.03 0.00 0.00 33.47 29.49 2c34 s TRP 36 CO 0.02 -1.07 0.00 -2.37 0.96 0.00 0.00 176.95 174.49 2c34 n THR 37 N 3.24 0.00 -2.84 2.01 5.66 -1.01 -4.92 114.28 116.42 2c34 n THR 37 Ca 0.27 -0.13 -0.40 0.00 -3.05 0.00 0.00 64.05 60.74 2c34 n THR 37 Cb 0.40 0.03 -0.05 0.00 -1.55 0.00 0.00 70.33 69.16 2c34 n THR 37 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 2c34 s ARG 38 N -2.09 4.68 0.33 1.09 3.52 -1.26 -1.05 118.95 124.17 2c34 s ARG 38 Ca 0.00 1.32 -0.28 0.00 -0.13 0.00 0.00 55.73 56.65 2c34 s ARG 38 Cb 0.00 -3.32 -0.13 0.00 -1.56 0.00 0.00 34.95 29.95 2c34 s ARG 38 CO 0.00 0.41 1.22 0.28 -0.81 0.00 0.00 175.30 176.40 2c34 n VAL 39 N 2.10 2.03 -0.74 7.11 0.31 -0.61 -0.99 118.33 127.53 2c34 n VAL 39 Ca -0.02 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.81 2c34 n VAL 39 Cb 0.49 -1.43 0.00 0.00 -0.91 0.00 0.00 33.84 31.98 2c34 n VAL 39 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2c34 n GLY 40 N 0.88 0.04 0.49 2.92 0.00 -1.26 -4.70 105.19 103.56 2c34 n GLY 40 Ca 0.06 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.15 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 -2.02 0.00 -2.11 1.61 3.72 -0.16 -5.05 117.46 113.44 2c34 n PHE 41 Ca 0.00 -1.11 -0.42 0.00 -0.05 0.00 0.00 57.45 55.87 2c34 n PHE 41 Cb 0.21 -0.19 -0.03 0.00 -0.94 0.00 0.00 39.48 38.53 2c34 n PHE 41 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2c34 s VAL 42 N -2.56 3.10 0.00 -4.37 0.11 -1.19 -2.61 120.40 112.88 2c34 s VAL 42 Ca 0.33 0.81 0.00 0.00 -2.93 0.00 0.00 61.98 60.18 2c34 s VAL 42 Cb 0.31 -3.52 0.00 0.00 -1.53 0.00 0.00 36.38 31.65 2c34 s VAL 42 CO -0.04 0.07 0.00 0.61 -3.33 0.00 0.00 175.10 172.41 2c34 n GLY 43 N 3.38 2.94 3.49 6.54 0.00 -1.26 -5.02 105.19 115.26 2c34 n GLY 43 Ca 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.97 -0.15 1.61 1.02 -1.07 -5.01 119.74 115.15 2c34 s LYS 44 Ca 0.00 0.75 -0.12 0.00 0.02 0.00 0.00 55.97 56.63 2c34 s LYS 44 Cb 0.00 -1.55 -0.04 0.00 -0.52 0.00 0.00 37.83 35.71 2c34 s LYS 44 CO 0.00 -3.74 -0.20 -3.47 -0.92 0.00 0.00 175.35 167.02 2c34 n ASP 45 N -4.92 1.84 0.02 2.83 2.03 -1.26 -4.58 116.55 112.51 2c34 n ASP 45 Ca 0.03 0.56 -0.08 0.00 0.52 0.00 0.00 54.79 55.82 2c34 n ASP 45 Cb 0.55 -0.85 -0.13 0.00 -0.72 0.00 0.00 41.12 39.97 2c34 n ASP 45 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 2c34 h VAL 46 N -1.00 1.31 0.00 5.18 2.07 -1.92 -3.46 116.25 118.43 2c34 h VAL 46 Ca -0.02 -3.09 0.00 0.00 0.82 0.00 0.00 66.70 64.41 2c34 h VAL 46 Cb 0.66 2.65 0.00 0.00 -1.52 0.00 0.00 31.29 33.07 2c34 h VAL 46 CO -0.01 0.74 0.00 0.18 0.02 0.00 0.00 177.57 178.50 2c34 n LEU 47 N -3.21 0.00 0.00 2.57 4.77 -1.26 -4.33 117.00 115.54 2c34 n LEU 47 Ca -0.08 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.85 2c34 n LEU 47 Cb 0.99 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 42.13 2c34 n LEU 47 CO 0.46 0.00 0.05 -1.54 -1.33 0.00 0.00 177.39 175.03 2c34 n SER 48 N 2.27 -2.25 0.00 -1.43 3.41 -1.25 -4.85 113.62 109.53 2c34 n SER 48 Ca 0.00 -0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.47 2c34 n SER 48 Cb 0.00 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 63.79 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 -3.24 0.00 0.00 4.04 9.92 -1.25 -4.98 116.55 121.04 2c34 n ASP 49 Ca 0.02 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.28 2c34 n ASP 49 Cb 0.09 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.57 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 0.00 1.35 0.24 -1.24 0.28 -1.26 -4.90 120.64 115.12 2c34 n GLU 50 Ca 0.00 0.00 -0.10 0.00 -0.16 0.00 0.00 57.16 56.90 2c34 n GLU 50 Cb 0.00 -0.75 -0.05 0.00 1.43 0.00 0.00 31.44 32.07 2c34 n GLU 50 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 2c34 h ILE 51 N 0.00 0.00 -3.20 3.84 1.08 -1.97 -3.39 117.51 113.87 2c34 h ILE 51 Ca 0.00 -0.11 -0.63 0.00 -0.39 0.00 0.00 64.86 63.72 2c34 h ILE 51 Cb 0.51 0.00 -0.34 0.00 -3.07 0.00 0.00 36.82 33.91 2c34 h ILE 51 CO 0.00 0.00 -0.85 -0.76 -0.69 0.00 0.00 178.15 175.85 2c34 s LEU 52 N -7.25 1.92 -0.87 1.44 1.43 -1.26 -1.70 118.68 112.39 2c34 s LEU 52 Ca -0.09 -0.53 -0.19 0.00 -1.03 0.00 0.00 54.13 52.28 2c34 s LEU 52 Cb 0.01 -1.29 -0.12 0.00 0.03 0.00 0.00 46.19 44.81 2c34 s LEU 52 CO 0.27 0.04 1.99 -0.62 0.23 0.00 0.00 176.35 178.26 2c34 n GLU 53 N 4.24 1.73 -2.66 1.70 -0.58 0.98 -3.92 120.64 122.13 2c34 n GLU 53 Ca -0.19 -1.89 -0.42 0.00 -0.42 0.00 0.00 57.16 54.24 2c34 n GLU 53 Cb 0.51 -2.91 -0.04 0.00 -0.57 0.00 0.00 31.44 28.44 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 4.61 4.52 -0.47 2.62 1.01 -1.24 -1.28 120.40 130.18 2c34 s VAL 54 Ca 0.54 1.95 0.03 0.00 0.00 0.00 0.00 61.98 64.50 2c34 s VAL 54 Cb 0.14 -4.25 0.15 0.00 0.00 0.00 0.00 36.38 32.42 2c34 s VAL 54 CO 0.08 0.23 0.31 -0.69 0.00 0.00 0.00 175.10 175.03 2c34 s VAL 55 N 0.48 1.26 -0.39 2.92 1.01 0.18 -3.74 120.40 122.12 2c34 s VAL 55 Ca 0.50 -2.83 -0.15 0.00 0.00 0.00 0.00 61.98 59.51 2c34 s VAL 55 Cb -0.24 -1.86 0.01 0.00 0.00 0.00 0.00 36.38 34.29 2c34 s VAL 55 CO 0.30 -1.02 0.31 0.00 0.00 0.00 0.00 175.10 174.69 2c34 s LYS 57 N 1.80 3.36 -0.52 0.00 1.02 -0.49 -4.88 119.74 120.02 2c34 s LYS 57 Ca 0.07 -0.51 -0.28 0.00 0.02 0.00 0.00 55.97 55.27 2c34 s LYS 57 Cb -0.18 -3.88 0.03 0.00 -0.52 0.00 0.00 37.83 33.28 2c34 s LYS 57 CO 0.11 -0.72 1.11 -0.47 -0.92 0.00 0.00 175.35 174.46 2c34 s TYR 58 N 2.19 2.76 -0.11 3.18 6.14 -1.26 -2.31 117.35 127.93 2c34 s TYR 58 Ca 0.14 0.49 0.03 0.00 0.64 0.00 0.00 57.07 58.38 2c34 s TYR 58 Cb -0.16 -4.37 0.00 0.00 0.42 0.00 0.00 41.96 37.85 2c34 s TYR 58 CO 0.13 -1.36 -0.22 0.99 0.64 0.00 0.00 175.55 175.72 2c34 s THR 59 N 4.48 1.99 0.00 4.34 2.01 -0.81 -5.02 115.64 122.62 2c34 s THR 59 Ca 0.43 -0.96 0.00 0.00 0.31 0.00 0.00 61.69 61.47 2c34 s THR 59 Cb -0.08 -1.73 0.00 0.00 0.01 0.00 0.00 72.50 70.70 2c34 s THR 59 CO 0.28 0.54 0.00 -0.81 -0.69 0.00 0.00 174.62 173.94 2c34 n PRO 60 N 3.72 3.40 -5.17 4.92 -0.05 -1.26 0.41 135.00 140.97 2c34 n PRO 60 Ca -0.19 0.00 -0.32 0.00 -0.05 0.00 0.00 63.50 62.94 2c34 n PRO 60 Cb 0.52 0.00 -0.16 0.00 -0.05 0.00 0.00 33.50 33.81 2c34 n PRO 60 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 175.50 176.44 2c34 s THR 61 N 1.21 2.23 0.98 0.52 2.01 -1.26 -3.35 115.64 117.98 2c34 s THR 61 Ca 0.00 -0.98 -0.12 0.00 0.31 0.00 0.00 61.69 60.90 2c34 s THR 61 Cb 0.00 -1.84 0.12 0.00 0.01 0.00 0.00 72.50 70.79 2c34 s THR 61 CO 0.00 0.56 0.77 -0.81 -0.69 0.00 0.00 174.62 174.45 2c34 n PRO 62 N 3.16 -0.71 -3.46 4.92 -0.04 -1.26 -4.75 135.00 132.86 2c34 n PRO 62 Ca -0.18 -0.16 -0.10 0.00 -0.04 0.00 0.00 63.50 63.02 2c34 n PRO 62 Cb 0.52 -2.11 -0.02 0.00 -0.04 0.00 0.00 33.50 31.85 2c34 n PRO 62 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2c34 s SER 63 N -2.32 -0.47 0.00 3.54 0.15 -1.26 -5.00 113.70 108.34 2c34 s SER 63 Ca 0.63 0.00 0.00 0.00 0.70 0.00 0.00 55.95 57.28 2c34 s SER 63 Cb -0.22 0.49 0.00 0.00 -1.71 0.00 0.00 66.02 64.59 2c34 s SER 63 CO 0.63 -0.80 0.02 -1.54 1.20 0.00 0.00 173.24 172.75 2c34 n SER 64 N -0.31 0.05 0.02 5.45 3.41 -1.26 -4.98 113.62 115.99 2c34 n SER 64 Ca -0.13 -0.86 0.00 0.00 -0.26 0.00 0.00 58.87 57.62 2c34 n SER 64 Cb 0.63 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.59 2c34 n SER 64 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2c34 n THR 65 N -0.01 0.00 -1.52 6.66 -1.04 -1.26 -5.15 114.28 111.96 2c34 n THR 65 Ca 0.00 0.00 -0.32 0.00 -2.04 0.00 0.00 64.05 61.69 2c34 n THR 65 Cb 0.20 0.00 0.07 0.00 -1.82 0.00 0.00 70.33 68.78 2c34 n THR 65 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2c34 s PRO 66 N -2.00 2.60 0.00 -2.82 0.02 -1.26 -4.98 135.00 126.56 2c34 s PRO 66 Ca 0.00 1.21 0.00 0.00 0.02 0.00 0.00 61.00 62.23 2c34 s PRO 66 Cb 0.00 -1.94 0.00 0.00 0.02 0.00 0.00 34.50 32.58 2c34 s PRO 66 CO 0.00 -1.38 0.61 -1.33 -0.33 0.00 0.00 177.00 174.57 2c34 n MET 67 N -3.00 0.00 -0.67 5.54 2.81 -1.26 -4.86 117.12 115.69 2c34 n MET 67 Ca 0.09 -0.51 0.01 0.00 -1.81 0.00 0.00 57.70 55.48 2c34 n MET 67 Cb 0.53 -0.32 0.23 0.00 -0.71 0.00 0.00 33.22 32.95 2c34 n MET 67 CO 0.00 0.00 0.00 1.55 1.51 0.00 0.00 175.97 179.03 2c34 n VAL 68 N 0.00 2.48 -2.88 2.03 3.14 -1.26 -4.83 118.33 117.01 2c34 n VAL 68 Ca 0.00 -2.21 0.03 0.00 -2.96 0.00 0.00 64.34 59.19 2c34 n VAL 68 Cb 0.57 -0.30 0.00 0.00 -1.06 0.00 0.00 33.84 33.06 2c34 n VAL 68 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 2c34 s GLY 69 N -2.09 -1.39 -0.41 7.55 0.00 -1.26 -5.10 107.32 104.62 2c34 s GLY 69 Ca 0.45 1.38 0.04 0.00 0.00 0.00 0.00 44.72 46.59 2c34 s GLY 69 CO 0.06 4.22 0.33 0.54 0.00 0.00 0.00 173.10 178.24 2c34 s VAL 70 N 2.18 0.32 -0.23 1.40 0.11 -1.26 -4.90 120.40 118.02 2c34 s VAL 70 Ca 0.17 -2.58 -0.00 0.00 -2.93 0.00 0.00 61.98 56.64 2c34 s VAL 70 Cb 0.01 -1.25 0.06 0.00 -1.53 0.00 0.00 36.38 33.68 2c34 s VAL 70 CO -0.16 -1.22 -0.01 -0.83 -3.33 0.00 0.00 175.10 169.55 2c34 s GLY 71 N 0.14 1.12 0.00 6.54 0.00 -1.26 -4.16 107.32 109.70 2c34 s GLY 71 Ca 0.32 -1.23 0.00 0.00 0.00 0.00 0.00 44.72 43.81 2c34 s GLY 71 CO -0.18 1.14 0.00 0.61 0.00 0.00 0.00 173.10 174.66 2c34 n GLY 72 N 4.78 0.57 0.00 0.20 0.00 -1.16 -4.44 105.19 105.15 2c34 n GLY 72 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.53 -0.61 -5.35 0.17 -4.26 119.36 105.77 2c34 n ILE 73 Ca 0.00 0.00 -0.26 0.00 -0.27 0.00 0.00 62.75 62.22 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 -3.27 0.14 -0.86 4.28 1.51 -0.64 -1.93 117.35 116.57 2c34 s TYR 74 Ca 0.00 -0.57 -0.21 0.00 -1.01 0.00 0.00 57.07 55.28 2c34 s TYR 74 Cb 0.00 -0.75 0.09 0.00 -0.11 0.00 0.00 41.96 41.19 2c34 s TYR 74 CO 0.00 -0.75 1.17 0.08 -1.11 0.00 0.00 175.55 174.94 2c34 s VAL 75 N 2.16 4.36 -0.18 0.71 1.01 -0.98 -2.09 120.40 125.40 2c34 s VAL 75 Ca 0.07 -0.91 -0.21 0.00 0.00 0.00 0.00 61.98 60.93 2c34 s VAL 75 Cb -0.16 -4.83 -0.03 0.00 0.00 0.00 0.00 36.38 31.37 2c34 s VAL 75 CO -0.28 -1.62 0.65 -0.69 0.00 0.00 0.00 175.10 173.16 2c34 s VAL 76 N 3.81 5.02 -0.46 2.92 1.01 -0.98 -1.40 120.40 130.32 2c34 s VAL 76 Ca 0.33 1.24 0.04 0.00 0.00 0.00 0.00 61.98 63.59 2c34 s VAL 76 Cb -0.07 -3.97 0.12 0.00 0.00 0.00 0.00 36.38 32.46 2c34 s VAL 76 CO -0.02 0.13 0.19 -0.76 0.00 0.00 0.00 175.10 174.64 2c34 s LEU 77 N 1.73 4.44 -0.55 3.92 1.43 -0.28 -1.71 118.68 127.66 2c34 s LEU 77 Ca 0.30 -2.73 -0.21 0.00 -1.03 0.00 0.00 54.13 50.47 2c34 s LEU 77 Cb -0.16 -1.63 0.06 0.00 0.03 0.00 0.00 46.19 44.49 2c34 s LEU 77 CO 0.11 -0.28 0.78 -0.69 0.23 0.00 0.00 176.35 176.50 2c34 s VAL 78 N 0.11 4.65 -0.57 -1.59 1.01 -1.02 0.50 120.40 123.49 2c34 s VAL 78 Ca 0.15 -0.33 -0.14 0.00 0.00 0.00 0.00 61.98 61.66 2c34 s VAL 78 Cb -0.24 -4.45 0.14 0.00 0.00 0.00 0.00 36.38 31.83 2c34 s VAL 78 CO -0.03 -1.04 0.50 -0.54 0.00 0.00 0.00 175.10 174.00 2c34 s LYS 79 N 3.22 2.95 -0.55 2.72 1.02 -0.40 -2.30 119.74 126.40 2c34 s LYS 79 Ca 0.20 -1.86 -0.36 0.00 0.02 0.00 0.00 55.97 53.97 2c34 s LYS 79 Cb -0.18 -4.22 -0.15 0.00 -0.52 0.00 0.00 37.83 32.76 2c34 s LYS 79 CO 0.13 -1.29 2.31 -0.35 -0.92 0.00 0.00 175.35 175.23 2c34 n PRO 80 N 4.93 0.53 -0.04 -1.68 -0.04 -1.26 -0.01 135.00 137.43 2c34 n PRO 80 Ca -0.08 0.11 -0.15 0.00 -0.04 0.00 0.00 63.50 63.34 2c34 n PRO 80 Cb 0.41 -2.08 -0.13 0.00 -0.04 0.00 0.00 33.50 31.66 2c34 n PRO 80 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2c34 h ARG 81 N 12.13 0.08 -6.15 0.54 3.08 -1.58 0.80 114.38 123.29 2c34 h ARG 81 Ca -0.17 -0.13 -0.53 0.00 0.07 0.00 0.00 59.98 59.22 2c34 h ARG 81 Cb 1.34 0.05 -0.04 0.00 0.08 0.00 0.00 29.97 31.39 2c34 h ARG 81 CO 1.14 1.04 -0.50 0.15 -1.07 0.00 0.00 179.97 180.72 2c34 s LYS 82 N -2.38 3.17 -0.23 0.04 1.02 -0.96 -4.90 119.74 115.51 2c34 s LYS 82 Ca -0.17 -0.79 -0.15 0.00 0.02 0.00 0.00 55.97 54.87 2c34 s LYS 82 Cb -0.02 -2.78 -0.04 0.00 -0.52 0.00 0.00 37.83 34.47 2c34 s LYS 82 CO 0.72 0.48 0.37 1.03 -0.92 0.00 0.00 175.35 177.03 2c34 s ARG 83 N -3.40 4.11 0.00 1.68 0.52 -1.26 -4.86 118.95 115.74 2c34 s ARG 83 Ca 0.33 0.10 0.00 0.00 -0.52 0.00 0.00 55.73 55.64 2c34 s ARG 83 Cb -0.10 -3.58 0.00 0.00 0.52 0.00 0.00 34.95 31.80 2c34 s ARG 83 CO 0.26 -0.11 0.00 0.41 0.02 0.00 0.00 175.30 175.88 2c34 n GLY 84 N 4.21 0.09 3.47 -3.53 0.00 -0.57 -5.01 105.19 103.84 2c34 n GLY 84 Ca -0.09 -1.25 -0.43 0.00 0.00 0.00 0.00 46.02 44.24 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 -3.63 2.88 0.50 1.61 3.76 -1.26 -1.42 115.29 117.73 2c34 s HIS 85 Ca 0.00 -0.39 0.01 0.00 -0.15 0.00 0.00 55.06 54.53 2c34 s HIS 85 Cb 0.00 -3.91 -0.01 0.00 1.11 0.00 0.00 32.58 29.77 2c34 s HIS 85 CO 0.00 -1.28 0.03 -1.01 -0.85 0.00 0.00 174.74 171.63 2c34 s HIS 86 N 3.37 1.80 0.06 1.40 3.76 -0.95 -5.03 115.29 119.70 2c34 s HIS 86 Ca 0.21 -1.06 -0.27 0.00 -0.15 0.00 0.00 55.06 53.80 2c34 s HIS 86 Cb -0.17 -1.50 0.07 0.00 1.11 0.00 0.00 32.58 32.10 2c34 s HIS 86 CO 0.14 0.09 0.64 0.99 -0.85 0.00 0.00 174.74 175.75 2c34 s THR 87 N -2.96 0.00 -0.38 1.30 2.01 -1.26 -1.63 115.64 112.72 2c34 s THR 87 Ca 0.07 0.00 0.01 0.00 0.31 0.00 0.00 61.69 62.08 2c34 s THR 87 Cb 0.01 -1.00 0.12 0.00 0.01 0.00 0.00 72.50 71.64 2c34 s THR 87 CO 0.04 0.00 0.19 -0.22 -0.69 0.00 0.00 174.62 173.94 2c34 s LEU 88 N -2.01 2.38 -0.25 4.42 1.98 0.78 -4.93 118.68 121.06 2c34 s LEU 88 Ca -0.05 -2.24 -0.08 0.00 -2.89 0.00 0.00 54.13 48.87 2c34 s LEU 88 Cb -0.01 -0.91 -0.03 0.00 0.66 0.00 0.00 46.19 45.90 2c34 s LEU 88 CO -0.02 -0.32 0.09 -1.83 -1.89 0.00 0.00 176.35 172.38 2c34 s GLU 89 N 0.86 3.76 0.47 1.98 -1.05 -1.26 0.87 118.70 124.33 2c34 s GLU 89 Ca 0.15 -0.43 0.07 0.00 -0.15 0.00 0.00 54.97 54.61 2c34 s GLU 89 Cb -0.22 -3.37 0.03 0.00 -0.44 0.00 0.00 34.13 30.13 2c34 s GLU 89 CO -0.08 -0.12 0.65 -0.51 0.95 0.00 0.00 175.26 176.14 2c34 s LEU 90 N 1.47 3.49 -0.03 1.83 1.43 0.01 -1.58 118.68 125.30 2c34 s LEU 90 Ca 0.06 -0.45 -0.30 0.00 -1.03 0.00 0.00 54.13 52.40 2c34 s LEU 90 Cb -0.15 -2.47 0.07 0.00 0.03 0.00 0.00 46.19 43.67 2c34 s LEU 90 CO 0.05 -0.95 0.68 0.54 0.23 0.00 0.00 176.35 176.91 2c34 s VAL 91 N -2.48 0.00 -1.02 -1.59 0.11 -0.22 -1.98 120.40 113.22 2c34 s VAL 91 Ca 0.57 0.00 -0.14 0.00 -2.93 0.00 0.00 61.98 59.48 2c34 s VAL 91 Cb -0.09 -1.00 0.20 0.00 -1.53 0.00 0.00 36.38 33.95 2c34 s VAL 91 CO 0.35 0.00 1.12 -0.47 -3.33 0.00 0.00 175.10 172.77 2c34 s TYR 92 N -1.45 3.64 0.45 1.54 5.04 -0.96 -2.40 117.35 123.20 2c34 s TYR 92 Ca -0.09 -2.03 0.07 0.00 -2.44 0.00 0.00 57.07 52.58 2c34 s TYR 92 Cb -0.00 -4.08 -0.01 0.00 0.35 0.00 0.00 41.96 38.22 2c34 s TYR 92 CO 0.07 -1.22 0.39 -0.08 -1.34 0.00 0.00 175.55 173.37 2c34 s THR 93 N 0.90 2.41 -0.65 4.34 -1.32 -0.53 -4.10 115.64 116.68 2c34 s THR 93 Ca 0.31 -1.39 -0.11 0.00 -1.21 0.00 0.00 61.69 59.30 2c34 s THR 93 Cb -0.07 -2.79 0.17 0.00 -1.51 0.00 0.00 72.50 68.30 2c34 s THR 93 CO -0.07 0.00 0.55 -0.13 -2.21 0.00 0.00 174.62 172.76 2c34 s ARG 94 N -4.17 3.00 0.52 7.08 0.52 -0.67 0.17 118.95 125.39 2c34 s ARG 94 Ca 0.46 -2.20 0.32 0.00 -0.52 0.00 0.00 55.73 53.78 2c34 s ARG 94 Cb -0.02 -4.13 1.46 0.00 0.52 0.00 0.00 34.95 32.78 2c34 s ARG 94 CO 0.27 -1.25 1.84 -1.35 0.02 0.00 0.00 175.30 174.83 2c34 h PRO 95 N 7.93 0.06 -0.04 3.54 0.11 -1.83 0.49 132.00 142.26 2c34 h PRO 95 Ca -0.06 -0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.85 2c34 h PRO 95 Cb 1.04 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 2c34 h PRO 95 CO 0.81 0.04 -0.82 0.74 -0.21 0.00 0.00 178.00 178.55 2c34 h PHE 96 N 0.06 0.57 0.00 0.65 -1.00 -1.92 -3.43 116.94 111.88 2c34 h PHE 96 Ca 0.51 -0.28 0.00 0.00 2.81 0.00 0.00 57.97 61.00 2c34 h PHE 96 Cb 1.91 -0.08 0.00 0.00 3.61 0.00 0.00 35.95 41.39 2c34 h PHE 96 CO -0.00 1.07 0.00 0.39 -1.61 0.00 0.00 178.31 178.16 2c34 n GLU 97 N -3.79 0.00 -3.15 1.51 -0.58 0.77 -5.16 120.64 110.23 2c34 n GLU 97 Ca -0.05 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.69 2c34 n GLU 97 Cb 0.77 -0.06 0.00 0.00 -0.57 0.00 0.00 31.44 31.57 2c34 n GLU 97 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2c34 n GLY 98 N 2.93 -1.30 3.90 0.62 0.00 0.14 -4.99 105.19 106.48 2c34 n GLY 98 Ca 0.00 -0.94 -0.32 0.00 0.00 0.00 0.00 46.02 44.76 2c34 n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2c34 s ILE 99 N -2.63 5.23 0.32 -0.61 1.01 -1.26 -1.67 121.20 121.59 2c34 s ILE 99 Ca 0.00 -0.00 0.03 0.00 0.00 0.00 0.00 60.65 60.68 2c34 s ILE 99 Cb 0.00 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 38.81 2c34 s ILE 99 CO 0.00 0.13 0.14 -0.54 0.00 0.00 0.00 174.94 174.67 2c34 s LYS 100 N -2.42 1.64 -0.02 2.79 1.02 -1.26 -5.01 119.74 116.48 2c34 s LYS 100 Ca 0.37 -1.94 -0.08 0.00 0.02 0.00 0.00 55.97 54.34 2c34 s LYS 100 Cb -0.13 -0.29 -0.30 0.00 -0.52 0.00 0.00 37.83 36.59 2c34 s LYS 100 CO 0.23 -0.41 0.78 -1.00 -0.92 0.00 0.00 175.35 174.04 2c34 h PRO 101 N 2.15 0.35 0.00 -1.68 0.13 -1.99 -3.28 132.00 127.68 2c34 h PRO 101 Ca -0.35 -0.60 0.00 0.00 -0.87 0.00 0.00 66.00 64.18 2c34 h PRO 101 Cb 1.25 0.22 0.00 0.00 0.13 0.00 0.00 31.00 32.61 2c34 h PRO 101 CO 0.56 1.25 0.00 -0.85 -0.23 0.00 0.00 178.00 178.72 2c34 n GLU 102 N -3.55 0.00 -0.91 0.86 0.28 -1.26 -4.76 120.64 111.31 2c34 n GLU 102 Ca -0.20 0.36 -0.30 0.00 -0.16 0.00 0.00 57.16 56.85 2c34 n GLU 102 Cb 1.07 -1.50 0.15 0.00 1.43 0.00 0.00 31.44 32.58 2c34 n GLU 102 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 2c34 s ASN 103 N -3.01 3.20 0.88 -1.84 0.02 -1.24 -4.91 114.94 108.04 2c34 s ASN 103 Ca 0.04 1.91 -0.12 0.00 -1.02 0.00 0.00 52.86 53.67 2c34 s ASN 103 Cb 0.05 -2.47 0.12 0.00 0.02 0.00 0.00 41.25 38.98 2c34 s ASN 103 CO 0.15 -2.88 1.12 -0.70 0.02 0.00 0.00 177.10 174.80 2c34 s GLU 104 N -4.74 1.39 0.06 -0.60 2.56 -1.26 -4.84 118.70 111.27 2c34 s GLU 104 Ca 0.65 0.47 -0.04 0.00 0.00 0.00 0.00 54.97 56.05 2c34 s GLU 104 Cb -0.21 -1.85 -0.02 0.00 2.00 0.00 0.00 34.13 34.05 2c34 s GLU 104 CO 0.58 -2.06 0.06 0.50 -0.56 0.00 0.00 175.26 173.77 2c34 s ARG 105 N -5.18 0.67 -0.50 4.30 6.06 -1.26 -2.27 118.95 120.78 2c34 s ARG 105 Ca 0.63 -1.04 0.07 0.00 -2.50 0.00 0.00 55.73 52.88 2c34 s ARG 105 Cb -0.15 0.25 0.19 0.00 0.06 0.00 0.00 34.95 35.30 2c34 s ARG 105 CO 0.54 -0.16 0.69 -0.47 -2.50 0.00 0.00 175.30 173.40 2c34 s TYR 106 N -3.61 -1.47 0.63 5.12 5.04 -0.84 -4.53 117.35 117.69 2c34 s TYR 106 Ca 0.04 -0.55 -0.13 0.00 -2.44 0.00 0.00 57.07 53.99 2c34 s TYR 106 Cb 0.05 0.24 -0.03 0.00 0.35 0.00 0.00 41.96 42.57 2c34 s TYR 106 CO -0.09 -1.24 1.04 0.99 -1.34 0.00 0.00 175.55 174.91 2c34 s THR 107 N 0.97 4.19 -0.47 4.34 2.01 -1.08 -0.81 115.64 124.79 2c34 s THR 107 Ca 0.28 0.84 0.07 0.00 0.31 0.00 0.00 61.69 63.19 2c34 s THR 107 Cb -0.01 -3.54 0.18 0.00 0.01 0.00 0.00 72.50 69.15 2c34 s THR 107 CO -0.06 -0.80 0.63 -0.22 -0.69 0.00 0.00 174.62 173.48 2c34 s LEU 108 N -4.97 -0.99 0.71 4.42 2.96 0.25 -0.78 118.68 120.29 2c34 s LEU 108 Ca 0.59 -1.72 -0.14 0.00 -0.22 0.00 0.00 54.13 52.65 2c34 s LEU 108 Cb -0.13 1.51 0.03 0.00 0.50 0.00 0.00 46.19 48.10 2c34 s LEU 108 CO 0.46 -0.10 1.13 -1.00 -1.32 0.00 0.00 176.35 175.51 2c34 s HIS 109 N 0.99 2.44 -0.25 5.38 3.76 -1.11 -0.15 115.29 126.35 2c34 s HIS 109 Ca 0.27 1.58 -0.02 0.00 -0.15 0.00 0.00 55.06 56.73 2c34 s HIS 109 Cb -0.01 -3.21 0.12 0.00 1.11 0.00 0.00 32.58 30.59 2c34 s HIS 109 CO -0.07 -1.95 0.30 -0.51 -0.85 0.00 0.00 174.74 171.66 2c34 s LEU 110 N -5.27 -0.34 -1.57 0.89 1.43 -0.64 -2.13 118.68 111.05 2c34 s LEU 110 Ca 0.67 -0.27 -0.11 0.00 -1.03 0.00 0.00 54.13 53.40 2c34 s LEU 110 Cb -0.21 0.67 -0.07 0.00 0.03 0.00 0.00 46.19 46.61 2c34 s LEU 110 CO 0.46 -0.34 2.80 -3.20 0.23 0.00 0.00 176.35 176.30 2c34 n ASN 111 N 5.33 7.72 -4.71 2.29 5.15 -0.38 -2.23 115.26 128.43 2c34 n ASN 111 Ca -0.04 -2.61 -0.61 0.00 -0.60 0.00 0.00 54.58 50.73 2c34 n ASN 111 Cb 0.49 -1.56 -0.08 0.00 -0.53 0.00 0.00 39.78 38.10 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 3.89 0.18 0.95 3.44 0.31 -0.51 -3.45 118.33 123.15 2c34 n VAL 112 Ca 0.73 -0.03 0.08 0.00 -0.01 0.00 0.00 64.34 65.10 2c34 n VAL 112 Cb 0.26 -0.92 0.45 0.00 -0.91 0.00 0.00 33.84 32.72 2c34 n VAL 112 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80