#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c34 n SER -1 N 0.00 0.00 -3.68 1.61 3.41 -1.26 -5.08 113.62 108.63 2c34 n SER -1 Ca 0.00 -0.07 -0.13 0.00 -0.26 0.00 0.00 58.87 58.42 2c34 n SER -1 Cb 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 63.82 2c34 n SER -1 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 2c34 s HIS 0 N 0.00 -0.44 0.25 7.33 5.65 -1.26 -5.14 115.29 121.68 2c34 s HIS 0 Ca 0.00 0.99 -0.30 0.00 0.25 0.00 0.00 55.06 56.00 2c34 s HIS 0 Cb 0.00 0.02 -0.09 0.00 -1.18 0.00 0.00 32.58 31.32 2c34 s HIS 0 CO 0.00 -0.34 1.30 -1.64 -0.65 0.00 0.00 174.74 173.41 2c34 s MET 1 N 2.15 4.40 0.30 2.88 1.00 -1.26 -4.92 119.30 123.85 2c34 s MET 1 Ca -0.02 2.09 0.24 0.00 0.00 0.00 0.00 55.69 58.01 2c34 s MET 1 Cb -0.12 -3.15 0.50 0.00 0.00 0.00 0.00 34.83 32.06 2c34 s MET 1 CO -0.09 -0.20 1.61 0.97 0.00 0.00 0.00 175.02 177.31 2c34 h ILE 2 N 3.47 0.00 0.00 2.53 2.10 -2.03 -3.45 117.51 120.13 2c34 h ILE 2 Ca -0.46 -0.75 0.00 0.00 1.08 0.00 0.00 64.86 64.73 2c34 h ILE 2 Cb 1.22 1.67 0.00 0.00 -1.09 0.00 0.00 36.82 38.62 2c34 h ILE 2 CO 0.73 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 177.80 2c34 n ALA 3 N -1.96 0.00 -1.70 0.18 0.00 -1.26 -5.12 120.51 110.65 2c34 n ALA 3 Ca 0.04 0.00 -0.55 0.00 0.00 0.00 0.00 53.44 52.93 2c34 n ALA 3 Cb 0.48 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.87 2c34 n ALA 3 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2c34 n PRO 4 N -2.33 1.38 -0.02 0.00 -0.02 -1.26 -4.91 135.00 127.84 2c34 n PRO 4 Ca 0.00 0.50 -0.01 0.00 -2.02 0.00 0.00 63.50 61.98 2c34 n PRO 4 Cb 0.00 -2.22 -0.00 0.00 -0.02 0.00 0.00 33.50 31.26 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 7.46 0.00-10.65 2.45 5.85 -1.99 -3.45 115.31 114.97 2c34 h LEU 5 Ca -0.47 0.00 -0.46 0.00 0.84 0.00 0.00 57.88 57.80 2c34 h LEU 5 Cb 1.31 0.00 0.09 0.00 0.37 0.00 0.00 40.66 42.43 2c34 h LEU 5 CO 0.95 0.19 0.19 -0.55 -0.34 0.00 0.00 178.44 178.88 2c34 s SER 6 N -4.00 4.40 0.15 1.25 0.15 -1.26 -5.06 113.70 109.33 2c34 s SER 6 Ca -0.03 0.09 -0.26 0.00 0.70 0.00 0.00 55.95 56.46 2c34 s SER 6 Cb 0.00 -0.57 -0.08 0.00 -1.71 0.00 0.00 66.02 63.67 2c34 s SER 6 CO 0.04 -1.84 0.80 0.54 1.20 0.00 0.00 173.24 173.98 2c34 s VAL 7 N -3.27 4.39 -0.35 4.45 0.11 -1.26 -4.96 120.40 119.51 2c34 s VAL 7 Ca 0.64 1.75 0.08 0.00 -2.93 0.00 0.00 61.98 61.52 2c34 s VAL 7 Cb -0.08 -4.16 0.60 0.00 -1.53 0.00 0.00 36.38 31.21 2c34 s VAL 7 CO 0.45 0.49 1.68 0.29 -3.33 0.00 0.00 175.10 174.68 2c34 n LYS 8 N 1.81 2.33 -1.32 1.54 4.01 -1.26 -5.03 118.16 120.25 2c34 n LYS 8 Ca -0.04 -3.09 -0.51 0.00 -0.51 0.00 0.00 58.31 54.16 2c34 n LYS 8 Cb 0.49 -2.01 -0.07 0.00 -0.51 0.00 0.00 35.03 32.92 2c34 n LYS 8 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 2c34 n ASP 9 N -0.96 0.77 0.00 4.39 -0.08 -1.26 -4.84 116.55 114.57 2c34 n ASP 9 Ca 0.43 0.92 0.00 0.00 -1.51 0.00 0.00 54.79 54.63 2c34 n ASP 9 Cb 1.32 -0.69 0.00 0.00 2.34 0.00 0.00 41.12 44.09 2c34 n ASP 9 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 2c34 n ASN 10 N 2.76 0.00 -2.78 1.67 6.94 -1.26 -4.99 115.26 117.59 2c34 n ASN 10 Ca 0.23 0.00 -0.24 0.00 -0.02 0.00 0.00 54.58 54.54 2c34 n ASN 10 Cb -0.03 0.00 -0.10 0.00 -2.36 0.00 0.00 39.78 37.30 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 -0.09 0.09 -4.09 0.53 5.68 -1.26 -4.68 116.55 112.72 2c34 n ASP 11 Ca 0.00 0.07 -0.43 0.00 -0.50 0.00 0.00 54.79 53.93 2c34 n ASP 11 Cb 0.00 -0.55 0.00 0.00 -1.14 0.00 0.00 41.12 39.44 2c34 n ASP 11 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 2c34 n LYS 12 N 5.10 3.80 -1.48 0.11 2.85 -1.17 -4.93 118.16 122.44 2c34 n LYS 12 Ca 0.41 -4.01 -0.44 0.00 -1.05 0.00 0.00 58.31 53.22 2c34 n LYS 12 Cb 0.02 -2.78 -0.09 0.00 -0.65 0.00 0.00 35.03 31.54 2c34 n LYS 12 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 177.40 178.26 2c34 n TRP 13 N 3.36 1.21 -3.91 5.58 7.02 -1.26 -3.85 117.44 125.59 2c34 n TRP 13 Ca 0.33 0.29 -0.09 0.00 -1.02 0.00 0.00 57.50 57.01 2c34 n TRP 13 Cb 0.37 -2.50 -0.02 0.00 -2.42 0.00 0.00 31.31 26.73 2c34 n TRP 13 CO 0.00 0.00 0.00 1.33 -2.02 0.00 0.00 177.69 177.00 2c34 n VAL 14 N 7.49 0.00 -3.98 -0.99 0.24 -0.92 -5.00 118.33 115.17 2c34 n VAL 14 Ca 0.48 -1.06 -0.27 0.00 -2.04 0.00 0.00 64.34 61.45 2c34 n VAL 14 Cb 0.25 0.62 -0.01 0.00 -1.47 0.00 0.00 33.84 33.23 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 -2.22 4.56 -0.01 -1.34 1.11 -1.26 -0.17 116.67 117.35 2c34 s ASP 15 Ca 0.17 -1.33 -0.09 0.00 0.18 0.00 0.00 52.55 51.48 2c34 s ASP 15 Cb -0.00 0.55 0.03 0.00 1.07 0.00 0.00 42.92 44.57 2c34 s ASP 15 CO 0.12 -1.15 0.40 1.07 1.18 0.00 0.00 175.17 176.80 2c34 n THR 16 N -1.76 0.00 -3.70 -1.27 5.66 -1.25 -4.60 114.28 107.35 2c34 n THR 16 Ca -0.04 -0.05 0.00 0.00 -3.05 0.00 0.00 64.05 60.91 2c34 n THR 16 Cb 0.65 0.18 0.00 0.00 -1.55 0.00 0.00 70.33 69.61 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 -0.29 -0.09 -3.00 1.09 8.25 -1.26 -0.98 115.22 118.94 2c34 n HIS 17 Ca 0.01 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.08 2c34 n HIS 17 Cb 0.18 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.23 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 -0.42 4.40 -0.61 1.59 1.01 -1.26 -3.82 120.40 121.29 2c34 s VAL 18 Ca 0.00 1.67 0.00 0.00 0.00 0.00 0.00 61.98 63.65 2c34 s VAL 18 Cb 0.00 -4.12 0.00 0.00 0.00 0.00 0.00 36.38 32.26 2c34 s VAL 18 CO 0.00 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.23 2c34 n GLY 19 N 1.61 0.55 3.57 4.51 0.00 -0.27 -4.82 105.19 110.34 2c34 n GLY 19 Ca -0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.10 0.23 -1.54 1.61 3.00 -1.25 -4.61 118.16 115.50 2c34 n LYS 20 Ca -0.06 -1.45 -0.35 0.00 -0.00 0.00 0.00 58.31 56.45 2c34 n LYS 20 Cb 0.49 -3.87 -0.07 0.00 0.00 0.00 0.00 35.03 31.57 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 9.03 -0.06 -3.13 3.15 -1.04 -1.25 -4.47 114.28 116.51 2c34 n THR 21 Ca 0.43 -0.57 -0.45 0.00 -2.04 0.00 0.00 64.05 61.42 2c34 n THR 21 Cb 0.46 -2.09 -0.05 0.00 -1.82 0.00 0.00 70.33 66.82 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 11.31 4.85 -0.04 12.58 2.01 -0.96 -4.84 115.64 140.55 2c34 s THR 22 Ca 1.08 -0.92 -0.26 0.00 0.31 0.00 0.00 61.69 61.91 2c34 s THR 22 Cb -0.46 -4.44 -0.03 0.00 0.01 0.00 0.00 72.50 67.58 2c34 s THR 22 CO 0.31 -1.04 0.80 -0.70 -0.69 0.00 0.00 174.62 173.30 2c34 s GLU 23 N 2.61 4.48 -0.29 4.92 2.12 -1.23 -2.42 118.70 128.89 2c34 s GLU 23 Ca 0.12 1.08 -0.03 0.00 0.36 0.00 0.00 54.97 56.50 2c34 s GLU 23 Cb -0.23 -3.45 0.10 0.00 0.26 0.00 0.00 34.13 30.80 2c34 s GLU 23 CO 0.07 0.03 0.11 0.42 -0.54 0.00 0.00 175.26 175.35 2c34 s ILE 24 N 0.84 0.34 -0.48 -3.70 1.01 -0.52 -4.92 121.20 113.77 2c34 s ILE 24 Ca 0.43 -0.97 -0.28 0.00 0.00 0.00 0.00 60.65 59.82 2c34 s ILE 24 Cb -0.19 -1.24 0.03 0.00 0.01 0.00 0.00 42.46 41.07 2c34 s ILE 24 CO 0.22 -0.66 1.07 -1.00 0.00 0.00 0.00 174.94 174.57 2c34 s HIS 25 N 1.90 2.84 0.12 3.97 3.76 -1.26 -2.31 115.29 124.31 2c34 s HIS 25 Ca 0.08 0.59 0.04 0.00 -0.15 0.00 0.00 55.06 55.62 2c34 s HIS 25 Cb -0.17 -4.30 -0.04 0.00 1.11 0.00 0.00 32.58 29.19 2c34 s HIS 25 CO -0.29 -1.24 0.13 -0.51 -0.85 0.00 0.00 174.74 171.98 2c34 s LEU 26 N 4.26 3.90 0.25 0.89 1.43 -0.71 -4.89 118.68 123.81 2c34 s LEU 26 Ca 0.44 -0.02 0.08 0.00 -1.03 0.00 0.00 54.13 53.60 2c34 s LEU 26 Cb -0.08 -2.53 -0.04 0.00 0.03 0.00 0.00 46.19 43.57 2c34 s LEU 26 CO 0.30 0.12 0.12 -0.54 0.23 0.00 0.00 176.35 176.58 2c34 s LYS 27 N -2.75 2.69 0.00 1.70 1.02 -1.26 -1.47 119.74 119.67 2c34 s LYS 27 Ca 0.31 -1.17 0.00 0.00 0.02 0.00 0.00 55.97 55.13 2c34 s LYS 27 Cb -0.11 -2.42 0.00 0.00 -0.52 0.00 0.00 37.83 34.78 2c34 s LYS 27 CO 0.24 0.39 0.00 0.41 -0.92 0.00 0.00 175.35 175.47 2c34 n GLY 28 N -1.00 0.12 2.02 -3.33 0.00 -1.26 -4.96 105.19 96.77 2c34 n GLY 28 Ca -0.07 -0.01 -0.00 0.00 0.00 0.00 0.00 46.02 45.93 2c34 n GLY 28 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2c34 n ASN 29 N 0.00 -7.25 -3.51 1.61 5.15 -1.04 -4.74 115.26 105.47 2c34 n ASN 29 Ca 0.00 1.37 -0.25 0.00 -0.60 0.00 0.00 54.58 55.10 2c34 n ASN 29 Cb 0.00 -4.14 0.23 0.00 -0.53 0.00 0.00 39.78 35.34 2c34 n ASN 29 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 2c34 n PRO 30 N 1.35 -3.56 -1.86 1.20 -0.02 -1.26 -3.34 135.00 127.52 2c34 n PRO 30 Ca -0.02 -1.05 -0.08 0.00 -2.02 0.00 0.00 63.50 60.33 2c34 n PRO 30 Cb 0.03 -1.75 -0.02 0.00 -0.02 0.00 0.00 33.50 31.74 2c34 n PRO 30 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2c34 n THR 31 N -5.15 -0.19 0.04 3.45 -2.24 -1.26 -4.70 114.28 104.22 2c34 n THR 31 Ca 0.09 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.86 2c34 n THR 31 Cb 0.49 -0.93 -0.00 0.00 -2.10 0.00 0.00 70.33 67.78 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 -2.31 1.25 0.00 4.28 -1.04 -1.21 -5.12 114.28 110.13 2c34 n THR 32 Ca -0.09 0.38 0.00 0.00 -2.04 0.00 0.00 64.05 62.30 2c34 n THR 32 Cb 0.42 -1.66 0.00 0.00 -1.82 0.00 0.00 70.33 67.27 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 3.29 2.45 0.00 3.41 0.00 -1.26 -5.17 105.19 107.90 2c34 n GLY 33 Ca -0.01 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.37 -4.37 1.61 4.02 -1.26 -4.84 117.16 110.94 2c34 n TYR 34 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.61 2c34 n TYR 34 Cb 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 39.34 39.20 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 -0.43 1.55 -0.70 -0.72 -2.45 0.25 -4.87 119.30 111.92 2c34 s MET 35 Ca 0.00 -1.35 -0.06 0.00 -1.25 0.00 0.00 55.69 53.03 2c34 s MET 35 Cb 0.00 -1.95 0.18 0.00 1.25 0.00 0.00 34.83 34.31 2c34 s MET 35 CO 0.00 0.44 0.56 -1.58 1.05 0.00 0.00 175.02 175.49 2c34 s TRP 36 N -1.25 3.53 0.00 4.11 0.52 -1.26 -0.97 118.94 123.61 2c34 s TRP 36 Ca 0.17 -2.50 0.00 0.00 0.02 0.00 0.00 56.10 53.79 2c34 s TRP 36 Cb -0.10 -3.40 0.00 0.00 -1.15 0.00 0.00 33.47 28.82 2c34 s TRP 36 CO 0.08 -0.88 0.00 -2.37 0.02 0.00 0.00 176.95 173.80 2c34 n THR 37 N 3.58 0.00 -3.35 2.01 5.66 -1.04 -4.88 114.28 116.25 2c34 n THR 37 Ca 0.10 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.77 2c34 n THR 37 Cb 0.41 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.13 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 -1.12 3.92 0.21 1.09 0.52 -1.26 -0.72 118.95 121.61 2c34 s ARG 38 Ca 0.00 0.44 -0.31 0.00 -0.52 0.00 0.00 55.73 55.34 2c34 s ARG 38 Cb 0.00 -2.78 -0.10 0.00 0.52 0.00 0.00 34.95 32.58 2c34 s ARG 38 CO 0.00 0.39 1.54 0.08 0.02 0.00 0.00 175.30 177.33 2c34 s VAL 39 N -1.64 2.53 0.00 3.52 1.01 0.74 -2.27 120.40 124.29 2c34 s VAL 39 Ca 0.43 0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.81 2c34 s VAL 39 Cb -0.13 -3.26 0.00 0.00 0.00 0.00 0.00 36.38 32.99 2c34 s VAL 39 CO 0.20 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.96 2c34 n GLY 40 N 3.03 0.49 0.00 4.51 0.00 -1.26 -4.84 105.19 107.12 2c34 n GLY 40 Ca 0.11 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.93 0.00 -1.67 1.61 3.72 -0.96 -5.03 117.46 112.19 2c34 n PHE 41 Ca 0.00 -0.00 -0.59 0.00 -0.05 0.00 0.00 57.45 56.81 2c34 n PHE 41 Cb 0.00 -0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.46 2c34 n PHE 41 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 176.76 178.26 2c34 n VAL 42 N -0.00 0.14 0.00 -4.37 3.14 -1.21 -0.26 118.33 115.77 2c34 n VAL 42 Ca 0.00 -0.03 0.00 0.00 -2.96 0.00 0.00 64.34 61.35 2c34 n VAL 42 Cb 0.21 -0.84 0.00 0.00 -1.06 0.00 0.00 33.84 32.15 2c34 n VAL 42 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2c34 n GLY 43 N 3.51 2.53 3.54 7.55 0.00 -1.26 -4.97 105.19 116.10 2c34 n GLY 43 Ca 0.25 -0.58 -0.29 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.33 -0.12 1.61 1.02 0.65 -4.98 119.74 117.59 2c34 s LYS 44 Ca 0.00 1.12 -0.19 0.00 0.02 0.00 0.00 55.97 56.92 2c34 s LYS 44 Cb 0.00 -1.60 -0.26 0.00 -0.52 0.00 0.00 37.83 35.44 2c34 s LYS 44 CO 0.00 -3.41 0.58 -0.44 -0.92 0.00 0.00 175.35 171.16 2c34 h ASP 45 N -2.41 0.29 -3.39 2.83 3.32 -1.96 -3.46 116.42 111.64 2c34 h ASP 45 Ca -0.55 -0.83 -0.66 0.00 0.02 0.00 0.00 57.03 55.00 2c34 h ASP 45 Cb 1.31 -0.09 -0.18 0.00 0.22 0.00 0.00 39.33 40.58 2c34 h ASP 45 CO 0.47 1.49 -0.65 -0.69 -1.72 0.00 0.00 179.24 178.14 2c34 s VAL 46 N -2.42 4.04 -0.27 -1.35 1.01 -1.26 -4.99 120.40 115.16 2c34 s VAL 46 Ca -0.20 -0.33 -0.14 0.00 0.00 0.00 0.00 61.98 61.31 2c34 s VAL 46 Cb 0.03 -2.72 -0.12 0.00 0.00 0.00 0.00 36.38 33.57 2c34 s VAL 46 CO 0.74 0.55 -0.35 0.18 0.00 0.00 0.00 175.10 176.22 2c34 n LEU 47 N 2.78 1.93 -4.18 3.92 4.77 -1.26 -4.95 117.00 120.00 2c34 n LEU 47 Ca -0.18 0.33 -0.27 0.00 -0.03 0.00 0.00 56.01 55.87 2c34 n LEU 47 Cb 0.53 -0.81 0.19 0.00 -2.33 0.00 0.00 43.42 41.00 2c34 n LEU 47 CO 0.30 0.55 -0.18 -1.54 -1.33 0.00 0.00 177.39 175.19 2c34 n SER 48 N -4.23 -2.80 0.00 -1.43 3.41 -1.25 -4.97 113.62 102.34 2c34 n SER 48 Ca -0.53 -0.32 0.00 0.00 -0.26 0.00 0.00 58.87 57.75 2c34 n SER 48 Cb 0.88 -0.91 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 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 -2.23 0.00 0.00 4.04 8.00 -1.25 -4.96 116.55 120.15 2c34 n ASP 49 Ca 0.04 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.54 2c34 n ASP 49 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.62 2c34 n ASP 49 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 2c34 n GLU 50 N -0.38 0.93 0.38 -1.24 0.28 -1.26 -4.90 120.64 114.45 2c34 n GLU 50 Ca 0.00 0.00 -0.15 0.00 -0.16 0.00 0.00 57.16 56.85 2c34 n GLU 50 Cb 0.00 -0.70 -0.07 0.00 1.43 0.00 0.00 31.44 32.10 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 -3.81 3.84 1.08 -1.96 -3.41 117.51 113.24 2c34 h ILE 51 Ca 0.00 -0.06 -0.55 0.00 -0.39 0.00 0.00 64.86 63.87 2c34 h ILE 51 Cb 0.40 0.00 -0.32 0.00 -3.07 0.00 0.00 36.82 33.84 2c34 h ILE 51 CO 0.00 0.00 -0.83 -0.76 -0.69 0.00 0.00 178.15 175.87 2c34 s LEU 52 N -8.47 1.87 -1.06 1.44 1.43 -1.26 -1.92 118.68 110.71 2c34 s LEU 52 Ca -0.14 -0.34 -0.15 0.00 -1.03 0.00 0.00 54.13 52.47 2c34 s LEU 52 Cb 0.01 -0.92 -0.08 0.00 0.03 0.00 0.00 46.19 45.23 2c34 s LEU 52 CO 0.42 0.13 2.14 -0.62 0.23 0.00 0.00 176.35 178.65 2c34 n GLU 53 N 3.26 2.18 -2.27 1.70 -0.58 0.57 -3.79 120.64 121.72 2c34 n GLU 53 Ca -0.19 -2.00 -0.34 0.00 -0.42 0.00 0.00 57.16 54.22 2c34 n GLU 53 Cb 0.53 -2.91 -0.04 0.00 -0.57 0.00 0.00 31.44 28.45 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 3.94 3.74 -1.25 2.62 1.01 -1.25 -2.20 120.40 127.01 2c34 s VAL 54 Ca 0.52 -1.13 -0.19 0.00 0.00 0.00 0.00 61.98 61.19 2c34 s VAL 54 Cb 0.14 -4.73 0.07 0.00 0.00 0.00 0.00 36.38 31.86 2c34 s VAL 54 CO 0.02 -1.39 1.68 -0.69 0.00 0.00 0.00 175.10 174.71 2c34 s VAL 55 N 8.28 4.15 -0.04 2.92 1.01 0.25 -3.77 120.40 133.20 2c34 s VAL 55 Ca 0.62 -1.79 -0.17 0.00 0.00 0.00 0.00 61.98 60.64 2c34 s VAL 55 Cb -0.00 -5.16 -0.05 0.00 0.00 0.00 0.00 36.38 31.17 2c34 s VAL 55 CO 0.07 -1.99 0.47 0.00 0.00 0.00 0.00 175.10 173.66 2c34 s LYS 57 N -0.29 1.21 -0.43 0.00 1.02 0.06 -4.95 119.74 116.37 2c34 s LYS 57 Ca 0.26 -1.12 -0.28 0.00 0.02 0.00 0.00 55.97 54.85 2c34 s LYS 57 Cb -0.17 -2.47 0.02 0.00 -0.52 0.00 0.00 37.83 34.70 2c34 s LYS 57 CO 0.13 -0.78 1.05 -0.47 -0.92 0.00 0.00 175.35 174.36 2c34 s TYR 58 N 1.42 2.94 -0.50 3.18 6.14 -1.26 -2.29 117.35 126.98 2c34 s TYR 58 Ca 0.02 0.75 -0.13 0.00 0.64 0.00 0.00 57.07 58.36 2c34 s TYR 58 Cb -0.18 -4.09 0.12 0.00 0.42 0.00 0.00 41.96 38.23 2c34 s TYR 58 CO -0.13 -1.08 0.42 0.99 0.64 0.00 0.00 175.55 176.40 2c34 s THR 59 N 4.02 4.73 -1.80 4.34 2.01 -0.96 -4.90 115.64 123.09 2c34 s THR 59 Ca 0.44 -1.61 0.21 0.00 0.31 0.00 0.00 61.69 61.03 2c34 s THR 59 Cb -0.09 -4.06 0.58 0.00 0.01 0.00 0.00 72.50 68.94 2c34 s THR 59 CO 0.26 -0.81 1.49 -0.81 -0.69 0.00 0.00 174.62 174.06 2c34 n PRO 60 N 5.08 2.75 -3.03 4.92 -0.04 -1.26 -0.19 135.00 143.23 2c34 n PRO 60 Ca -0.11 -2.55 -0.39 0.00 -0.04 0.00 0.00 63.50 60.40 2c34 n PRO 60 Cb 0.41 -1.52 -0.06 0.00 -0.04 0.00 0.00 33.50 32.29 2c34 n PRO 60 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2c34 s THR 61 N -1.01 4.60 0.78 0.52 2.01 -1.26 -4.55 115.64 116.73 2c34 s THR 61 Ca 0.44 1.59 -0.08 0.00 0.31 0.00 0.00 61.69 63.96 2c34 s THR 61 Cb 0.23 -4.09 0.17 0.00 0.01 0.00 0.00 72.50 68.82 2c34 s THR 61 CO 0.30 0.45 1.06 -0.81 -0.69 0.00 0.00 174.62 174.94 2c34 n PRO 62 N 2.21 -0.61 -1.81 4.92 -0.04 -1.26 -2.62 135.00 135.78 2c34 n PRO 62 Ca -0.05 -2.18 -0.02 0.00 -0.04 0.00 0.00 63.50 61.21 2c34 n PRO 62 Cb 0.50 -0.92 0.01 0.00 -0.04 0.00 0.00 33.50 33.04 2c34 n PRO 62 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2c34 n SER 63 N -3.35 -0.51 -0.07 3.54 2.88 -1.26 -4.89 113.62 109.97 2c34 n SER 63 Ca 0.15 -1.32 -0.10 0.00 -1.33 0.00 0.00 58.87 56.27 2c34 n SER 63 Cb 0.53 0.84 -0.03 0.00 -0.75 0.00 0.00 64.21 64.80 2c34 n SER 63 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2c34 n SER 64 N -0.98 1.74 -0.10 -3.46 2.88 -1.26 -4.92 113.62 107.53 2c34 n SER 64 Ca -0.02 0.29 -0.20 0.00 -1.33 0.00 0.00 58.87 57.61 2c34 n SER 64 Cb 0.14 -0.66 -0.07 0.00 -0.75 0.00 0.00 64.21 62.88 2c34 n SER 64 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2c34 n THR 65 N -4.23 1.06 -2.13 2.46 -1.04 -1.26 -4.97 114.28 104.17 2c34 n THR 65 Ca -0.16 -0.27 -0.42 0.00 -2.04 0.00 0.00 64.05 61.15 2c34 n THR 65 Cb 0.47 -1.74 -0.03 0.00 -1.82 0.00 0.00 70.33 67.21 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 -2.35 4.22 0.00 -2.82 0.02 -1.26 -4.83 135.00 127.97 2c34 s PRO 66 Ca -0.27 2.06 0.00 0.00 0.02 0.00 0.00 61.00 62.81 2c34 s PRO 66 Cb 0.10 -3.78 0.00 0.00 0.02 0.00 0.00 34.50 30.84 2c34 s PRO 66 CO 0.34 -0.73 0.84 -1.33 -0.33 0.00 0.00 177.00 175.80 2c34 n MET 67 N 6.34 0.00 -0.91 5.54 2.81 -1.26 -4.55 117.12 125.08 2c34 n MET 67 Ca 0.15 -0.73 -0.09 0.00 -1.81 0.00 0.00 57.70 55.23 2c34 n MET 67 Cb 0.43 -0.37 0.21 0.00 -0.71 0.00 0.00 33.22 32.78 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 2.75 0.00 2.03 3.14 -1.26 -4.61 118.33 120.38 2c34 n VAL 68 Ca 0.00 -2.30 0.00 0.00 -2.96 0.00 0.00 64.34 59.08 2c34 n VAL 68 Cb 0.64 -0.36 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 0.61 -6.46 0.00 0.00 176.83 170.98 2c34 n GLY 69 N -0.96 0.00 2.47 7.55 0.00 -1.26 -5.06 105.19 107.93 2c34 n GLY 69 Ca 0.40 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.15 2c34 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c34 s VAL 70 N -0.21 0.57 0.00 1.61 0.11 -1.26 -4.83 120.40 116.39 2c34 s VAL 70 Ca 0.00 -2.57 0.00 0.00 -2.93 0.00 0.00 61.98 56.48 2c34 s VAL 70 Cb 0.00 -1.40 0.00 0.00 -1.53 0.00 0.00 36.38 33.45 2c34 s VAL 70 CO 0.00 -1.14 0.51 0.61 -3.33 0.00 0.00 175.10 171.74 2c34 n GLY 71 N 3.08 0.38 0.00 6.54 0.00 -1.08 -4.33 105.19 109.78 2c34 n GLY 71 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2c34 n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c34 n GLY 72 N 0.00 1.97 0.00 -0.02 0.00 0.74 -4.79 105.19 103.09 2c34 n GLY 72 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.82 0.00 -3.47 -0.61 -5.35 -0.37 -2.51 119.36 106.22 2c34 n ILE 73 Ca 0.00 0.00 -0.25 0.00 -0.27 0.00 0.00 62.75 62.23 2c34 n ILE 73 Cb 0.00 -0.94 -0.12 0.00 -1.74 0.00 0.00 39.64 36.84 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 0.99 0.10 -0.53 4.28 1.51 -0.54 -2.26 117.35 120.91 2c34 s TYR 74 Ca 0.00 -0.78 -0.20 0.00 -1.01 0.00 0.00 57.07 55.08 2c34 s TYR 74 Cb 0.00 -0.73 0.06 0.00 -0.11 0.00 0.00 41.96 41.18 2c34 s TYR 74 CO 0.00 -0.87 0.70 0.54 -1.11 0.00 0.00 175.55 174.81 2c34 s VAL 75 N 1.97 4.76 -0.22 0.71 0.11 -0.97 -1.73 120.40 125.03 2c34 s VAL 75 Ca 0.11 -0.41 -0.11 0.00 -2.93 0.00 0.00 61.98 58.64 2c34 s VAL 75 Cb -0.16 -4.38 -0.05 0.00 -1.53 0.00 0.00 36.38 30.26 2c34 s VAL 75 CO -0.27 -0.92 0.16 -0.69 -3.33 0.00 0.00 175.10 170.04 2c34 s VAL 76 N 2.92 5.37 -0.45 2.04 1.01 -0.98 -0.76 120.40 129.56 2c34 s VAL 76 Ca 0.18 0.21 -0.04 0.00 0.00 0.00 0.00 61.98 62.33 2c34 s VAL 76 Cb -0.19 -3.50 0.12 0.00 0.00 0.00 0.00 36.38 32.81 2c34 s VAL 76 CO 0.12 0.38 0.27 -0.76 0.00 0.00 0.00 175.10 175.11 2c34 s LEU 77 N 0.77 5.35 -0.51 3.92 1.43 -0.71 -1.44 118.68 127.50 2c34 s LEU 77 Ca 0.08 -2.12 -0.19 0.00 -1.03 0.00 0.00 54.13 50.88 2c34 s LEU 77 Cb -0.13 -1.87 0.06 0.00 0.03 0.00 0.00 46.19 44.29 2c34 s LEU 77 CO 0.02 -0.55 0.60 -0.69 0.23 0.00 0.00 176.35 175.96 2c34 s VAL 78 N 1.02 4.91 -0.53 -1.59 1.01 -1.02 0.87 120.40 125.08 2c34 s VAL 78 Ca 0.09 -0.59 -0.11 0.00 0.00 0.00 0.00 61.98 61.36 2c34 s VAL 78 Cb -0.23 -4.29 0.13 0.00 0.00 0.00 0.00 36.38 31.99 2c34 s VAL 78 CO -0.03 -0.80 0.43 -0.54 0.00 0.00 0.00 175.10 174.16 2c34 s LYS 79 N 2.51 2.72 -0.88 2.72 1.02 -0.94 -2.27 119.74 124.63 2c34 s LYS 79 Ca 0.14 -1.84 -0.31 0.00 0.02 0.00 0.00 55.97 53.97 2c34 s LYS 79 Cb -0.20 -4.07 -0.19 0.00 -0.52 0.00 0.00 37.83 32.84 2c34 s LYS 79 CO 0.11 -1.24 2.61 -2.30 -0.92 0.00 0.00 175.35 173.60 2c34 n PRO 80 N 4.88 0.17 0.10 -1.68 -0.02 -1.26 -0.32 135.00 136.87 2c34 n PRO 80 Ca -0.07 0.01 -0.04 0.00 -2.02 0.00 0.00 63.50 61.37 2c34 n PRO 80 Cb 0.41 -1.80 0.02 0.00 -0.02 0.00 0.00 33.50 32.11 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 12.86 0.00 -6.27 -0.52 3.08 -1.65 -0.70 114.38 121.17 2c34 h ARG 81 Ca -0.09 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.37 2c34 h ARG 81 Cb 1.31 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 31.18 2c34 h ARG 81 CO 1.33 0.81 -0.80 0.15 -1.07 0.00 0.00 179.97 180.38 2c34 s LYS 82 N -3.12 1.41 -0.22 0.04 1.02 -0.90 -4.97 119.74 112.99 2c34 s LYS 82 Ca 0.00 -1.48 -0.14 0.00 0.02 0.00 0.00 55.97 54.38 2c34 s LYS 82 Cb 0.11 -1.60 -0.04 0.00 -0.52 0.00 0.00 37.83 35.78 2c34 s LYS 82 CO 0.79 0.33 0.30 1.03 -0.92 0.00 0.00 175.35 176.89 2c34 s ARG 83 N -2.76 4.12 0.00 1.68 0.52 -1.26 -4.88 118.95 116.37 2c34 s ARG 83 Ca 0.19 0.00 0.00 0.00 -0.52 0.00 0.00 55.73 55.40 2c34 s ARG 83 Cb -0.07 -3.55 0.00 0.00 0.52 0.00 0.00 34.95 31.85 2c34 s ARG 83 CO 0.09 -0.03 0.00 0.41 0.02 0.00 0.00 175.30 175.79 2c34 n GLY 84 N 4.14 0.91 3.65 -3.53 0.00 -0.23 -4.95 105.19 105.19 2c34 n GLY 84 Ca -0.11 -1.92 -0.42 0.00 0.00 0.00 0.00 46.02 43.56 2c34 n GLY 84 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2c34 s HIS 85 N -2.64 1.94 0.22 1.61 5.65 -1.26 -0.78 115.29 120.03 2c34 s HIS 85 Ca 0.00 0.30 -0.06 0.00 0.25 0.00 0.00 55.06 55.54 2c34 s HIS 85 Cb 0.00 -3.95 -0.02 0.00 -1.18 0.00 0.00 32.58 27.42 2c34 s HIS 85 CO 0.00 -3.65 0.29 -1.01 -0.65 0.00 0.00 174.74 169.72 2c34 s HIS 86 N 4.69 0.80 0.12 3.88 4.02 -0.36 -4.94 115.29 123.49 2c34 s HIS 86 Ca 0.75 -1.08 -0.24 0.00 1.02 0.00 0.00 55.06 55.51 2c34 s HIS 86 Cb -0.31 -0.22 0.08 0.00 -1.02 0.00 0.00 32.58 31.11 2c34 s HIS 86 CO 0.30 -0.80 0.65 0.99 1.02 0.00 0.00 174.74 176.90 2c34 s THR 87 N -4.09 0.00 -0.47 1.30 2.01 -1.26 -0.81 115.64 112.32 2c34 s THR 87 Ca 0.31 0.00 0.03 0.00 0.31 0.00 0.00 61.69 62.35 2c34 s THR 87 Cb 0.03 -1.00 0.12 0.00 0.01 0.00 0.00 72.50 71.67 2c34 s THR 87 CO 0.11 0.00 0.21 -0.22 -0.69 0.00 0.00 174.62 174.03 2c34 s LEU 88 N -2.65 4.55 -0.76 4.42 2.96 0.84 -4.95 118.68 123.09 2c34 s LEU 88 Ca 0.01 -2.72 -0.26 0.00 -0.22 0.00 0.00 54.13 50.94 2c34 s LEU 88 Cb -0.01 -1.66 -0.01 0.00 0.50 0.00 0.00 46.19 45.01 2c34 s LEU 88 CO -0.12 -0.30 1.74 -1.61 -1.32 0.00 0.00 176.35 174.75 2c34 s GLU 89 N 0.12 2.81 -0.29 1.98 2.02 -1.26 -0.65 118.70 123.43 2c34 s GLU 89 Ca 0.15 0.01 -0.07 0.00 0.02 0.00 0.00 54.97 55.08 2c34 s GLU 89 Cb -0.23 -4.66 0.00 0.00 0.10 0.00 0.00 34.13 29.34 2c34 s GLU 89 CO -0.03 -2.76 0.08 -0.51 0.02 0.00 0.00 175.26 172.06 2c34 s LEU 90 N 8.34 3.75 0.24 1.80 1.43 -0.72 -0.19 118.68 133.33 2c34 s LEU 90 Ca 0.60 -0.61 0.12 0.00 -1.03 0.00 0.00 54.13 53.21 2c34 s LEU 90 Cb -0.09 -1.89 -0.05 0.00 0.03 0.00 0.00 46.19 44.20 2c34 s LEU 90 CO 0.10 -0.16 -0.22 0.54 0.23 0.00 0.00 176.35 176.84 2c34 s VAL 91 N 1.52 2.40 -1.16 -1.59 0.11 0.10 0.41 120.40 122.20 2c34 s VAL 91 Ca 0.03 -2.22 -0.11 0.00 -2.93 0.00 0.00 61.98 56.76 2c34 s VAL 91 Cb -0.17 -2.21 0.24 0.00 -1.53 0.00 0.00 36.38 32.71 2c34 s VAL 91 CO 0.02 -0.27 1.25 0.00 -3.33 0.00 0.00 175.10 172.78 2c34 n TYR 92 N -0.18 5.12 -4.12 1.54 9.36 -0.98 -2.51 117.16 125.39 2c34 n TYR 92 Ca -0.09 -3.68 -0.30 0.00 3.32 0.00 0.00 57.90 57.15 2c34 n TYR 92 Cb 0.58 -1.89 -0.08 0.00 -0.63 0.00 0.00 39.34 37.32 2c34 n TYR 92 CO 0.00 0.00 0.00 -0.08 0.22 0.00 0.00 176.86 177.00 2c34 s THR 93 N -0.22 4.07 -0.57 2.97 -1.32 -0.14 -4.11 115.64 116.32 2c34 s THR 93 Ca 0.36 -1.01 -0.20 0.00 -1.21 0.00 0.00 61.69 59.63 2c34 s THR 93 Cb -0.07 -2.96 0.07 0.00 -1.51 0.00 0.00 72.50 68.04 2c34 s THR 93 CO -0.05 0.09 0.76 -0.13 -2.21 0.00 0.00 174.62 173.09 2c34 s ARG 94 N -2.41 3.12 0.51 7.08 0.52 -1.13 0.86 118.95 127.50 2c34 s ARG 94 Ca 0.27 -0.93 0.22 0.00 -0.52 0.00 0.00 55.73 54.77 2c34 s ARG 94 Cb -0.11 -4.17 1.31 0.00 0.52 0.00 0.00 34.95 32.49 2c34 s ARG 94 CO 0.19 -1.48 2.00 -1.35 0.02 0.00 0.00 175.30 174.67 2c34 h PRO 95 N 9.22 0.09 0.00 3.54 0.11 -1.93 0.35 132.00 143.37 2c34 h PRO 95 Ca -0.28 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.80 2c34 h PRO 95 Cb 1.08 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 2c34 h PRO 95 CO 1.07 0.06 -0.13 0.74 -0.21 0.00 0.00 178.00 179.53 2c34 h PHE 96 N 0.09 0.00 0.00 0.65 -1.00 -1.97 -3.40 116.94 111.31 2c34 h PHE 96 Ca 0.25 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.03 2c34 h PHE 96 Cb 0.86 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.42 2c34 h PHE 96 CO -0.00 0.13 0.00 0.39 -1.61 0.00 0.00 178.31 177.22 2c34 n GLU 97 N -3.68 0.00 -3.27 1.51 -0.58 0.04 -5.18 120.64 109.49 2c34 n GLU 97 Ca -0.02 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.72 2c34 n GLU 97 Cb 0.25 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.12 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 3.44 -1.39 3.86 0.62 0.00 0.10 -5.03 105.19 106.78 2c34 n GLY 98 Ca 0.00 -0.98 -0.37 0.00 0.00 0.00 0.00 46.02 44.66 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 5.31 0.23 -0.61 1.01 -1.26 -2.83 121.20 120.42 2c34 s ILE 99 Ca 0.00 0.47 0.03 0.00 0.00 0.00 0.00 60.65 61.14 2c34 s ILE 99 Cb 0.00 -3.53 -0.05 0.00 0.01 0.00 0.00 42.46 38.89 2c34 s ILE 99 CO 0.00 0.59 0.03 -0.54 0.00 0.00 0.00 174.94 175.02 2c34 s LYS 100 N -0.97 1.33 0.08 2.79 1.02 -1.26 -5.06 119.74 117.67 2c34 s LYS 100 Ca 0.18 -1.68 -0.14 0.00 0.02 0.00 0.00 55.97 54.34 2c34 s LYS 100 Cb -0.14 -0.46 -0.16 0.00 -0.52 0.00 0.00 37.83 36.55 2c34 s LYS 100 CO 0.08 -0.16 1.29 -1.35 -0.92 0.00 0.00 175.35 174.28 2c34 h PRO 101 N 2.47 0.72 0.00 -1.68 0.11 -1.99 -3.08 132.00 128.55 2c34 h PRO 101 Ca -0.38 -0.57 0.00 0.00 0.11 0.00 0.00 66.00 65.16 2c34 h PRO 101 Cb 1.23 0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.45 2c34 h PRO 101 CO 0.63 1.18 0.00 1.05 -0.21 0.00 0.00 178.00 180.66 2c34 h GLU 102 N 0.42 0.00 -7.08 1.05 4.11 -1.99 -3.43 114.58 107.66 2c34 h GLU 102 Ca -0.04 0.00 -0.55 0.00 0.07 0.00 0.00 59.36 58.84 2c34 h GLU 102 Cb 1.30 0.00 0.14 0.00 0.50 0.00 0.00 28.75 30.69 2c34 h GLU 102 CO 0.14 0.00 0.56 -0.80 0.07 0.00 0.00 179.01 178.98 2c34 s ASN 103 N -4.71 4.98 1.14 3.06 0.02 -1.17 -4.98 114.94 113.28 2c34 s ASN 103 Ca -0.04 2.68 -0.12 0.00 -1.02 0.00 0.00 52.86 54.35 2c34 s ASN 103 Cb 0.10 -2.63 0.27 0.00 0.02 0.00 0.00 41.25 39.02 2c34 s ASN 103 CO 0.33 -1.76 1.04 -1.61 0.02 0.00 0.00 177.10 175.12 2c34 s GLU 104 N -3.14 -0.73 0.20 -0.60 8.01 -1.26 -4.81 118.70 116.38 2c34 s GLU 104 Ca 0.77 0.92 0.03 0.00 0.01 0.00 0.00 54.97 56.70 2c34 s GLU 104 Cb -0.38 -1.57 -0.05 0.00 -4.31 0.00 0.00 34.13 27.82 2c34 s GLU 104 CO 0.43 -3.62 -0.02 0.50 0.01 0.00 0.00 175.26 172.56 2c34 s ARG 105 N -4.48 1.24 -0.37 1.61 6.06 -1.26 -2.31 118.95 119.44 2c34 s ARG 105 Ca 0.68 -1.61 0.02 0.00 -2.50 0.00 0.00 55.73 52.33 2c34 s ARG 105 Cb -0.25 -0.57 0.29 0.00 0.06 0.00 0.00 34.95 34.48 2c34 s ARG 105 CO 0.64 -0.06 1.20 0.98 -2.50 0.00 0.00 175.30 175.56 2c34 n TYR 106 N -0.34 -1.30 -2.82 5.12 9.36 0.17 -4.60 117.16 122.74 2c34 n TYR 106 Ca -0.06 -1.07 -0.43 0.00 3.32 0.00 0.00 57.90 59.66 2c34 n TYR 106 Cb 0.63 1.27 -0.03 0.00 -0.63 0.00 0.00 39.34 40.58 2c34 n TYR 106 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 2c34 s THR 107 N 0.22 4.44 -0.88 2.97 2.01 -1.26 -1.76 115.64 121.38 2c34 s THR 107 Ca 0.25 -1.12 -0.25 0.00 0.31 0.00 0.00 61.69 60.89 2c34 s THR 107 Cb 0.24 -4.84 -0.04 0.00 0.01 0.00 0.00 72.50 67.88 2c34 s THR 107 CO -0.14 -1.61 1.89 -0.22 -0.69 0.00 0.00 174.62 173.85 2c34 s LEU 108 N 3.56 3.21 0.26 4.42 2.96 0.18 -3.03 118.68 130.23 2c34 s LEU 108 Ca 0.34 -0.65 -0.30 0.00 -0.22 0.00 0.00 54.13 53.31 2c34 s LEU 108 Cb -0.06 -2.56 -0.09 0.00 0.50 0.00 0.00 46.19 43.98 2c34 s LEU 108 CO -0.06 -2.60 1.01 -1.00 -1.32 0.00 0.00 176.35 172.39 2c34 s HIS 109 N 9.53 3.80 -0.21 5.38 3.76 -1.25 -0.11 115.29 136.19 2c34 s HIS 109 Ca 0.68 1.82 -0.04 0.00 -0.15 0.00 0.00 55.06 57.36 2c34 s HIS 109 Cb -0.07 -3.12 0.09 0.00 1.11 0.00 0.00 32.58 30.59 2c34 s HIS 109 CO 0.01 -0.01 0.20 -0.51 -0.85 0.00 0.00 174.74 173.58 2c34 s LEU 110 N -1.29 0.00 -1.49 0.89 1.43 0.01 -2.16 118.68 116.08 2c34 s LEU 110 Ca 0.43 -0.39 -0.09 0.00 -1.03 0.00 0.00 54.13 53.05 2c34 s LEU 110 Cb -0.29 0.24 0.01 0.00 0.03 0.00 0.00 46.19 46.18 2c34 s LEU 110 CO 0.36 -0.34 2.65 -3.20 0.23 0.00 0.00 176.35 176.05 2c34 n ASN 111 N 5.31 7.97 -4.40 2.29 5.15 0.76 -1.22 115.26 131.12 2c34 n ASN 111 Ca -0.06 -2.82 -0.47 0.00 -0.60 0.00 0.00 54.58 50.63 2c34 n ASN 111 Cb 0.49 -1.49 -0.03 0.00 -0.53 0.00 0.00 39.78 38.22 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 3.03 1.88 1.75 3.44 0.31 0.04 -3.94 118.33 124.84 2c34 n VAL 112 Ca 0.69 -0.50 0.14 0.00 -0.01 0.00 0.00 64.34 64.66 2c34 n VAL 112 Cb 0.25 -0.05 0.83 0.00 -0.91 0.00 0.00 33.84 33.96 2c34 n VAL 112 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80