#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 0.33 0.25 1.61 1.04 -1.26 -4.99 113.70 110.68 2c34 s SER -1 Ca 0.00 0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.75 2c34 s SER -1 Cb 0.00 0.24 0.00 0.00 0.10 0.00 0.00 66.02 66.36 2c34 s SER -1 CO 0.00 -0.20 0.00 1.57 0.98 0.00 0.00 173.24 175.59 2c34 n HIS 0 N 4.79 -3.03 -0.02 5.02 -0.00 -1.26 -4.94 115.22 115.77 2c34 n HIS 0 Ca -0.15 0.74 -0.08 0.00 -0.00 0.00 0.00 57.72 58.22 2c34 n HIS 0 Cb 0.51 1.91 -0.14 0.00 -0.00 0.00 0.00 29.99 32.27 2c34 n HIS 0 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.34 176.86 2c34 h MET 1 N 0.00 0.00 -4.21 1.57 2.07 -2.05 -3.47 114.93 108.84 2c34 h MET 1 Ca 0.00 0.00 -0.05 0.00 -2.07 0.00 0.00 59.70 57.58 2c34 h MET 1 Cb 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 29.72 2c34 h MET 1 CO 0.00 0.50 -0.06 1.51 1.07 0.00 0.00 176.91 179.93 2c34 n ILE 2 N -3.05 -0.09 -0.08 -1.22 3.06 -1.26 -4.79 119.36 111.93 2c34 n ILE 2 Ca -0.16 0.00 -0.15 0.00 -2.50 0.00 0.00 62.75 59.93 2c34 n ILE 2 Cb 1.05 -0.33 -0.12 0.00 0.54 0.00 0.00 39.64 40.78 2c34 n ILE 2 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2c34 h ALA 3 N 1.15 0.06 0.00 1.51 0.00 -1.90 -3.05 119.26 117.04 2c34 h ALA 3 Ca -0.06 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.19 2c34 h ALA 3 Cb 0.87 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2c34 h ALA 3 CO 0.07 0.17 0.00 -0.35 0.00 0.00 0.00 179.25 179.14 2c34 n PRO 4 N -4.57 0.02 -0.08 0.00 -0.04 -1.26 -3.23 135.00 125.84 2c34 n PRO 4 Ca -0.15 0.22 -0.21 0.00 -0.04 0.00 0.00 63.50 63.32 2c34 n PRO 4 Cb 0.52 -1.54 -0.12 0.00 -0.04 0.00 0.00 33.50 32.32 2c34 n PRO 4 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2c34 h LEU 5 N 0.00 0.08 -8.07 1.53 5.85 -1.95 -3.49 115.31 109.26 2c34 h LEU 5 Ca 0.00 -0.64 -0.13 0.00 0.84 0.00 0.00 57.88 57.94 2c34 h LEU 5 Cb 0.31 -0.03 -0.17 0.00 0.37 0.00 0.00 40.66 41.14 2c34 h LEU 5 CO 0.00 1.49 -0.63 -0.94 -0.34 0.00 0.00 178.44 178.01 2c34 s SER 6 N -6.82 0.34 0.39 1.25 1.04 -1.15 -5.10 113.70 103.64 2c34 s SER 6 Ca -0.26 -0.75 0.00 0.00 0.48 0.00 0.00 55.95 55.42 2c34 s SER 6 Cb 0.05 0.19 0.00 0.00 0.10 0.00 0.00 66.02 66.36 2c34 s SER 6 CO 0.64 -0.51 0.00 0.52 0.98 0.00 0.00 173.24 174.87 2c34 n VAL 7 N 0.62 -4.42 -3.64 5.02 0.31 -1.26 -4.35 118.33 110.60 2c34 n VAL 7 Ca -0.18 1.90 -0.04 0.00 -0.01 0.00 0.00 64.34 66.01 2c34 n VAL 7 Cb 0.59 -2.64 -0.07 0.00 -0.91 0.00 0.00 33.84 30.81 2c34 n VAL 7 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2c34 s LYS 8 N -3.95 0.30 -0.35 5.55 2.47 -1.26 -4.70 119.74 117.80 2c34 s LYS 8 Ca 0.00 0.42 -0.26 0.00 -1.56 0.00 0.00 55.97 54.57 2c34 s LYS 8 Cb 0.00 0.11 0.01 0.00 -1.46 0.00 0.00 37.83 36.50 2c34 s LYS 8 CO 0.00 -0.05 0.93 0.34 0.16 0.00 0.00 175.35 176.73 2c34 s ASP 9 N 0.59 6.72 0.00 1.43 -1.08 -1.26 -4.88 116.67 118.19 2c34 s ASP 9 Ca -0.01 0.68 0.00 0.00 -0.52 0.00 0.00 52.55 52.71 2c34 s ASP 9 Cb -0.04 -2.47 0.00 0.00 -1.46 0.00 0.00 42.92 38.95 2c34 s ASP 9 CO -0.11 -0.81 0.00 -0.46 0.52 0.00 0.00 175.17 174.30 2c34 n ASN 10 N 6.68 0.00 -2.23 -0.34 6.94 -1.26 -5.02 115.26 120.02 2c34 n ASN 10 Ca 0.07 0.00 -0.25 0.00 -0.02 0.00 0.00 54.58 54.38 2c34 n ASN 10 Cb 0.48 0.00 -0.07 0.00 -2.36 0.00 0.00 39.78 37.83 2c34 n ASN 10 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 2c34 n ASP 11 N -0.89 0.25 -4.41 0.53 8.00 -1.26 -4.51 116.55 114.26 2c34 n ASP 11 Ca 0.00 0.21 -0.45 0.00 0.71 0.00 0.00 54.79 55.26 2c34 n ASP 11 Cb 0.00 -0.46 -0.02 0.00 -0.02 0.00 0.00 41.12 40.61 2c34 n ASP 11 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2c34 s LYS 12 N 3.88 3.61 -0.68 -1.24 2.47 0.69 -4.88 119.74 123.59 2c34 s LYS 12 Ca 0.65 -2.02 -0.27 0.00 -1.56 0.00 0.00 55.97 52.78 2c34 s LYS 12 Cb -0.70 -4.75 0.02 0.00 -1.46 0.00 0.00 37.83 30.94 2c34 s LYS 12 CO 0.29 -1.61 1.37 -1.58 0.16 0.00 0.00 175.35 173.99 2c34 s TRP 13 N 1.80 2.22 0.21 4.03 0.52 -1.26 -0.09 118.94 126.36 2c34 s TRP 13 Ca 0.28 0.18 -0.02 0.00 0.02 0.00 0.00 56.10 56.56 2c34 s TRP 13 Cb -0.07 -4.51 0.01 0.00 -1.15 0.00 0.00 33.47 27.75 2c34 s TRP 13 CO -0.09 -2.05 0.30 1.33 0.02 0.00 0.00 176.95 176.45 2c34 n VAL 14 N 6.59 0.00 -2.98 4.03 0.24 -0.93 -4.98 118.33 120.30 2c34 n VAL 14 Ca 0.07 -1.01 -0.08 0.00 -2.04 0.00 0.00 64.34 61.29 2c34 n VAL 14 Cb 0.49 0.64 0.03 0.00 -1.47 0.00 0.00 33.84 33.53 2c34 n VAL 14 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2c34 n ASP 15 N -1.81 0.79 -2.55 -1.34 9.92 -1.26 0.22 116.55 120.52 2c34 n ASP 15 Ca 0.00 -1.58 0.01 0.00 -0.53 0.00 0.00 54.79 52.69 2c34 n ASP 15 Cb 0.34 -0.17 0.01 0.00 -0.64 0.00 0.00 41.12 40.66 2c34 n ASP 15 CO 0.00 0.00 0.00 1.07 0.13 0.00 0.00 177.20 178.40 2c34 n THR 16 N -1.51 0.00 -3.06 -3.53 5.66 -1.24 -4.39 114.28 106.20 2c34 n THR 16 Ca 0.06 -0.16 0.00 0.00 -3.05 0.00 0.00 64.05 60.90 2c34 n THR 16 Cb 0.23 0.37 0.00 0.00 -1.55 0.00 0.00 70.33 69.38 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 -0.50 -0.11 -3.65 1.09 8.25 -1.26 -3.19 115.22 115.86 2c34 n HIS 17 Ca 0.01 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.10 2c34 n HIS 17 Cb 0.34 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.34 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 0.75 5.25 -0.13 1.59 1.01 -1.26 -4.32 120.40 123.29 2c34 s VAL 18 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.12 2c34 s VAL 18 Cb 0.00 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.91 2c34 s VAL 18 CO 0.00 0.30 0.00 0.61 0.00 0.00 0.00 175.10 176.01 2c34 n GLY 19 N 4.66 0.20 3.57 4.51 0.00 0.97 -4.84 105.19 114.26 2c34 n GLY 19 Ca -0.15 -0.01 -0.18 0.00 0.00 0.00 0.00 46.02 45.69 2c34 n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2c34 s LYS 20 N -1.81 1.64 -0.83 1.61 2.47 -1.26 -4.64 119.74 116.93 2c34 s LYS 20 Ca 0.00 -0.24 -0.30 0.00 -1.56 0.00 0.00 55.97 53.87 2c34 s LYS 20 Cb 0.00 -4.97 -0.18 0.00 -1.46 0.00 0.00 37.83 31.23 2c34 s LYS 20 CO 0.00 -4.74 2.59 2.41 0.16 0.00 0.00 175.35 175.78 2c34 n THR 21 N 8.66 -0.02 -3.02 3.43 -1.04 -1.26 -4.66 114.28 116.37 2c34 n THR 21 Ca 0.43 -0.21 -0.44 0.00 -2.04 0.00 0.00 64.05 61.80 2c34 n THR 21 Cb 0.46 -1.12 -0.05 0.00 -1.82 0.00 0.00 70.33 67.80 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 9.66 4.66 -0.02 12.58 2.01 -0.93 -4.86 115.64 138.73 2c34 s THR 22 Ca 1.25 -0.46 -0.23 0.00 0.31 0.00 0.00 61.69 62.56 2c34 s THR 22 Cb -0.98 -4.47 -0.04 0.00 0.01 0.00 0.00 72.50 67.01 2c34 s THR 22 CO 0.44 -1.08 0.70 -0.70 -0.69 0.00 0.00 174.62 173.29 2c34 s GLU 23 N 3.19 4.43 -0.23 4.92 2.12 -1.23 -2.44 118.70 129.45 2c34 s GLU 23 Ca 0.18 0.91 -0.04 0.00 0.36 0.00 0.00 54.97 56.38 2c34 s GLU 23 Cb -0.19 -3.40 0.08 0.00 0.26 0.00 0.00 34.13 30.88 2c34 s GLU 23 CO 0.11 0.18 0.11 0.42 -0.54 0.00 0.00 175.26 175.54 2c34 s ILE 24 N 0.38 0.01 -0.85 -3.70 1.01 -0.54 -4.95 121.20 112.56 2c34 s ILE 24 Ca 0.37 -0.53 -0.25 0.00 0.00 0.00 0.00 60.65 60.23 2c34 s ILE 24 Cb -0.19 -0.85 0.04 0.00 0.01 0.00 0.00 42.46 41.47 2c34 s ILE 24 CO 0.19 -0.50 1.37 -1.00 0.00 0.00 0.00 174.94 175.00 2c34 s HIS 25 N 2.07 2.36 0.16 3.97 3.76 -1.26 -2.30 115.29 124.06 2c34 s HIS 25 Ca 0.05 -0.34 -0.17 0.00 -0.15 0.00 0.00 55.06 54.45 2c34 s HIS 25 Cb -0.16 -4.64 -0.07 0.00 1.11 0.00 0.00 32.58 28.82 2c34 s HIS 25 CO -0.23 -2.02 0.60 -0.51 -0.85 0.00 0.00 174.74 171.73 2c34 s LEU 26 N 5.57 4.37 0.41 0.89 1.43 -0.98 -4.86 118.68 125.50 2c34 s LEU 26 Ca 0.41 1.21 0.04 0.00 -1.03 0.00 0.00 54.13 54.76 2c34 s LEU 26 Cb -0.05 -3.30 0.00 0.00 0.03 0.00 0.00 46.19 42.88 2c34 s LEU 26 CO 0.05 0.11 0.58 -0.54 0.23 0.00 0.00 176.35 176.78 2c34 s LYS 27 N -1.81 3.00 0.00 1.70 1.02 -1.26 -1.11 119.74 121.27 2c34 s LYS 27 Ca 0.38 -0.84 0.00 0.00 0.02 0.00 0.00 55.97 55.53 2c34 s LYS 27 Cb -0.16 -2.69 0.00 0.00 -0.52 0.00 0.00 37.83 34.46 2c34 s LYS 27 CO 0.20 -0.17 0.00 0.41 -0.92 0.00 0.00 175.35 174.86 2c34 n GLY 28 N -1.89 -0.69 3.00 -3.33 0.00 -1.25 -4.90 105.19 96.14 2c34 n GLY 28 Ca 0.02 -0.47 0.04 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.33 0.44 1.61 2.47 -1.26 -4.92 114.94 108.94 2c34 s ASN 29 Ca 0.00 -0.04 0.24 0.00 0.42 0.00 0.00 52.86 53.48 2c34 s ASN 29 Cb 0.00 0.91 1.30 0.00 -1.45 0.00 0.00 41.25 42.00 2c34 s ASN 29 CO 0.00 -0.05 1.70 1.55 -3.72 0.00 0.00 177.10 176.58 2c34 h PRO 30 N 6.52 0.00 -0.10 0.43 0.13 -1.95 -0.18 132.00 136.84 2c34 h PRO 30 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2c34 h PRO 30 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2c34 h PRO 30 CO -0.10 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 177.92 2c34 n THR 31 N -2.43 0.14 -0.08 1.56 -2.24 -1.26 -4.00 114.28 105.96 2c34 n THR 31 Ca -0.02 -0.14 -0.07 0.00 -2.27 0.00 0.00 64.05 61.55 2c34 n THR 31 Cb 0.19 0.05 -0.02 0.00 -2.10 0.00 0.00 70.33 68.45 2c34 n THR 31 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2c34 n THR 32 N -0.22 1.36 0.00 4.28 -2.24 -0.08 -5.06 114.28 112.33 2c34 n THR 32 Ca 0.05 0.19 0.00 0.00 -2.27 0.00 0.00 64.05 62.02 2c34 n THR 32 Cb 0.10 -2.29 0.00 0.00 -2.10 0.00 0.00 70.33 66.04 2c34 n THR 32 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c34 n GLY 33 N 1.50 0.37 3.98 3.38 0.00 -1.26 -5.16 105.19 108.01 2c34 n GLY 33 Ca -0.11 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.70 2c34 n GLY 33 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2c34 s TYR 34 N 0.00 2.01 -0.02 1.61 1.51 -1.26 -4.12 117.35 117.08 2c34 s TYR 34 Ca 0.00 -0.62 -0.11 0.00 -1.01 0.00 0.00 57.07 55.32 2c34 s TYR 34 Cb 0.00 -2.20 0.02 0.00 -0.11 0.00 0.00 41.96 39.66 2c34 s TYR 34 CO 0.00 -0.70 0.24 1.41 -1.11 0.00 0.00 175.55 175.39 2c34 s MET 35 N -4.44 0.56 -1.13 -0.62 -2.45 0.39 -4.56 119.30 107.05 2c34 s MET 35 Ca 0.54 -0.21 -0.13 0.00 -1.25 0.00 0.00 55.69 54.64 2c34 s MET 35 Cb -0.06 0.24 0.21 0.00 1.25 0.00 0.00 34.83 36.47 2c34 s MET 35 CO 0.33 -0.14 1.27 -1.58 1.05 0.00 0.00 175.02 175.94 2c34 s TRP 36 N -1.19 3.75 0.06 4.11 0.52 -1.26 -1.44 118.94 123.49 2c34 s TRP 36 Ca -0.13 -2.26 0.07 0.00 0.02 0.00 0.00 56.10 53.81 2c34 s TRP 36 Cb -0.06 -4.13 -0.03 0.00 -1.15 0.00 0.00 33.47 28.11 2c34 s TRP 36 CO 0.03 -1.23 -0.20 -0.08 0.02 0.00 0.00 176.95 175.49 2c34 s THR 37 N 0.63 1.62 1.16 2.01 -1.32 -0.73 -4.89 115.64 114.12 2c34 s THR 37 Ca 0.37 -1.30 -0.17 0.00 -1.21 0.00 0.00 61.69 59.37 2c34 s THR 37 Cb -0.06 -1.44 0.23 0.00 -1.51 0.00 0.00 72.50 69.72 2c34 s THR 37 CO -0.04 0.09 0.47 0.54 -2.21 0.00 0.00 174.62 173.47 2c34 n ARG 38 N 1.58 -2.93 -2.63 7.08 1.74 -1.26 -1.95 116.66 118.28 2c34 n ARG 38 Ca -0.18 -0.86 -0.42 0.00 -0.77 0.00 0.00 57.85 55.62 2c34 n ARG 38 Cb 0.54 -1.66 -0.03 0.00 -1.02 0.00 0.00 32.46 30.28 2c34 n ARG 38 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2c34 s VAL 39 N -2.12 3.95 0.00 1.55 1.01 -0.85 -3.41 120.40 120.52 2c34 s VAL 39 Ca 0.49 0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.88 2c34 s VAL 39 Cb -0.10 -4.80 0.00 0.00 0.00 0.00 0.00 36.38 31.48 2c34 s VAL 39 CO 0.46 -1.60 0.00 0.61 0.00 0.00 0.00 175.10 174.56 2c34 n GLY 40 N 5.27 1.11 0.19 4.51 0.00 -1.26 -4.94 105.19 110.06 2c34 n GLY 40 Ca 0.03 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.88 2c34 n GLY 40 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 2c34 h PHE 41 N 0.00 0.86 0.00 1.61 -5.15 -1.89 -3.44 116.94 108.94 2c34 h PHE 41 Ca 0.00 -0.40 -0.12 0.00 -0.20 0.00 0.00 57.97 57.25 2c34 h PHE 41 Cb 0.00 -0.13 -0.04 0.00 0.22 0.00 0.00 35.95 36.00 2c34 h PHE 41 CO 0.00 1.21 0.68 1.55 -2.00 0.00 0.00 178.31 179.75 2c34 n VAL 42 N -4.09 0.00 -1.03 0.88 3.14 -1.26 0.13 118.33 116.11 2c34 n VAL 42 Ca -0.08 -0.16 0.00 0.00 -2.96 0.00 0.00 64.34 61.14 2c34 n VAL 42 Cb 0.69 -0.01 0.00 0.00 -1.06 0.00 0.00 33.84 33.46 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 1.86 0.47 0.00 7.55 0.00 -1.26 -5.04 105.19 108.77 2c34 n GLY 43 Ca 0.23 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2c34 n GLY 43 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2c34 n LYS 44 N -0.51 2.94 -0.02 1.61 -0.00 0.36 -5.07 118.16 117.46 2c34 n LYS 44 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 58.31 58.28 2c34 n LYS 44 Cb 0.26 0.00 -0.03 0.00 -0.00 0.00 0.00 35.03 35.25 2c34 n LYS 44 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2c34 n ASP 45 N -0.60 3.82 -3.61 -5.58 8.00 -1.26 -5.00 116.55 112.31 2c34 n ASP 45 Ca 0.00 -0.01 -0.05 0.00 0.71 0.00 0.00 54.79 55.44 2c34 n ASP 45 Cb 0.00 0.41 -0.07 0.00 -0.02 0.00 0.00 41.12 41.44 2c34 n ASP 45 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2c34 s VAL 46 N -2.11 -0.79 0.08 2.53 1.01 -1.26 -5.07 120.40 114.79 2c34 s VAL 46 Ca -0.04 0.09 -0.26 0.00 0.00 0.00 0.00 61.98 61.77 2c34 s VAL 46 Cb 0.01 -0.81 -0.11 0.00 0.00 0.00 0.00 36.38 35.48 2c34 s VAL 46 CO 0.17 0.03 1.41 -0.07 0.00 0.00 0.00 175.10 176.63 2c34 h LEU 47 N 8.10 -1.17 0.00 3.92 3.38 -1.94 -3.43 115.31 124.18 2c34 h LEU 47 Ca -0.17 0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2c34 h LEU 47 Cb 1.11 0.43 0.00 0.00 0.09 0.00 0.00 40.66 42.29 2c34 h LEU 47 CO 0.13 -0.42 0.00 -1.54 0.09 0.00 0.00 178.44 176.70 2c34 n SER 48 N -4.67 -0.69 0.00 -0.43 3.41 -1.26 -4.86 113.62 105.13 2c34 n SER 48 Ca -0.06 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 2c34 n SER 48 Cb 0.31 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 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 -1.31 0.00 0.00 4.04 8.00 -1.26 -4.96 116.55 121.06 2c34 n ASP 49 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2c34 n ASP 49 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 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 -0.95 0.05 0.00 -1.24 0.28 -1.26 -5.00 120.64 112.52 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 -0.51 0.00 0.00 1.43 0.00 0.00 31.44 32.36 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 -0.65 0.00 -3.36 3.84 2.08 -1.26 -4.41 119.36 115.60 2c34 n ILE 51 Ca 0.00 0.20 -0.43 0.00 0.56 0.00 0.00 62.75 63.07 2c34 n ILE 51 Cb 0.01 -0.48 -0.09 0.00 -0.75 0.00 0.00 39.64 38.33 2c34 n ILE 51 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 2c34 s LEU 52 N -0.39 5.03 0.56 1.39 0.20 -1.26 -1.58 118.68 122.62 2c34 s LEU 52 Ca 0.00 -0.83 -0.21 0.00 0.69 0.00 0.00 54.13 53.78 2c34 s LEU 52 Cb 0.00 -2.30 -0.04 0.00 -0.43 0.00 0.00 46.19 43.41 2c34 s LEU 52 CO 0.00 -0.57 1.31 -0.70 -0.29 0.00 0.00 176.35 176.09 2c34 s GLU 53 N 1.98 3.09 -0.10 1.98 -6.30 0.62 -4.33 118.70 115.66 2c34 s GLU 53 Ca 0.09 2.10 -0.06 0.00 -2.50 0.00 0.00 54.97 54.60 2c34 s GLU 53 Cb -0.19 -2.16 0.04 0.00 0.00 0.00 0.00 34.13 31.82 2c34 s GLU 53 CO 0.12 -1.19 0.24 0.08 0.02 0.00 0.00 175.26 174.52 2c34 s VAL 54 N -1.38 -0.03 -0.39 3.70 1.01 -1.25 0.03 120.40 122.09 2c34 s VAL 54 Ca 0.73 0.09 0.02 0.00 0.00 0.00 0.00 61.98 62.82 2c34 s VAL 54 Cb -0.37 -0.35 0.15 0.00 0.00 0.00 0.00 36.38 35.80 2c34 s VAL 54 CO 0.43 0.04 0.27 -0.69 0.00 0.00 0.00 175.10 175.14 2c34 s VAL 55 N 0.82 0.47 -0.67 2.92 1.01 0.14 -4.19 120.40 120.90 2c34 s VAL 55 Ca -0.06 -2.22 -0.19 0.00 0.00 0.00 0.00 61.98 59.52 2c34 s VAL 55 Cb -0.07 -1.34 0.12 0.00 0.00 0.00 0.00 36.38 35.09 2c34 s VAL 55 CO -0.05 -1.06 0.79 0.00 0.00 0.00 0.00 175.10 174.79 2c34 n LYS 57 N 6.25 1.90 -1.78 0.00 5.02 0.15 -4.77 118.16 124.93 2c34 n LYS 57 Ca -0.02 -2.27 -0.39 0.00 -2.02 0.00 0.00 58.31 53.61 2c34 n LYS 57 Cb 0.44 -3.25 -0.03 0.00 -0.02 0.00 0.00 35.03 32.17 2c34 n LYS 57 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 2c34 s TYR 58 N 6.28 1.39 -0.20 2.13 6.14 -1.26 -2.45 117.35 129.38 2c34 s TYR 58 Ca 0.58 1.00 -0.05 0.00 0.64 0.00 0.00 57.07 59.24 2c34 s TYR 58 Cb 0.09 -3.88 -0.02 0.00 0.42 0.00 0.00 41.96 38.57 2c34 s TYR 58 CO 0.09 -2.83 0.00 0.99 0.64 0.00 0.00 175.55 174.44 2c34 s THR 59 N 9.67 3.98 0.00 4.34 2.01 -0.13 -4.99 115.64 130.51 2c34 s THR 59 Ca 0.87 -0.31 0.00 0.00 0.31 0.00 0.00 61.69 62.56 2c34 s THR 59 Cb -0.20 -2.80 0.00 0.00 0.01 0.00 0.00 72.50 69.52 2c34 s THR 59 CO 0.28 0.43 0.00 -0.81 -0.69 0.00 0.00 174.62 173.83 2c34 n PRO 60 N 4.19 1.21 -1.74 4.92 -0.04 -1.26 0.22 135.00 142.49 2c34 n PRO 60 Ca -0.17 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.87 2c34 n PRO 60 Cb 0.52 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.96 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 -0.91 1.03 -0.73 0.52 -1.04 -1.26 -0.53 114.28 111.35 2c34 n THR 61 Ca 0.00 -0.26 -0.32 0.00 -2.04 0.00 0.00 64.05 61.43 2c34 n THR 61 Cb 0.00 -1.95 0.15 0.00 -1.82 0.00 0.00 70.33 66.71 2c34 n THR 61 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2c34 n PRO 62 N 2.13 -0.81 -0.16 -2.82 -0.04 -1.26 -4.85 135.00 127.19 2c34 n PRO 62 Ca 0.09 -0.20 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 2c34 n PRO 62 Cb 0.37 -1.87 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 2c34 n PRO 62 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2c34 n SER 63 N -1.86 0.00 -0.07 3.54 7.64 -1.26 -4.91 113.62 116.69 2c34 n SER 63 Ca 0.05 -0.61 0.00 0.00 1.01 0.00 0.00 58.87 59.32 2c34 n SER 63 Cb 0.56 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 2c34 n SER 63 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2c34 n SER 64 N -1.84 0.13 -4.59 6.43 3.41 -1.26 -4.89 113.62 111.01 2c34 n SER 64 Ca 0.00 -1.72 -0.34 0.00 -0.26 0.00 0.00 58.87 56.56 2c34 n SER 64 Cb 0.00 -0.06 0.12 0.00 -0.26 0.00 0.00 64.21 64.00 2c34 n SER 64 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2c34 n THR 65 N -0.41 1.45 1.30 6.66 -2.24 -1.26 -4.84 114.28 114.93 2c34 n THR 65 Ca 0.00 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 2c34 n THR 65 Cb 0.03 -0.98 0.00 0.00 -2.10 0.00 0.00 70.33 67.28 2c34 n THR 65 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2c34 n PRO 66 N -2.54 0.76 -3.64 -0.78 -0.04 -1.26 -4.23 135.00 123.27 2c34 n PRO 66 Ca 0.11 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.29 2c34 n PRO 66 Cb 0.51 -1.11 -0.12 0.00 -0.04 0.00 0.00 33.50 32.74 2c34 n PRO 66 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 2c34 s MET 67 N -1.71 1.29 0.01 0.54 0.00 -1.26 -5.10 119.30 113.07 2c34 s MET 67 Ca 0.00 -2.15 -0.30 0.00 0.00 0.00 0.00 55.69 53.24 2c34 s MET 67 Cb 0.00 -2.16 -0.07 0.00 0.00 0.00 0.00 34.83 32.59 2c34 s MET 67 CO 0.00 -1.24 1.70 0.08 0.00 0.00 0.00 175.02 175.57 2c34 s VAL 68 N 0.10 3.27 0.00 10.11 1.01 -1.26 -4.47 120.40 129.15 2c34 s VAL 68 Ca 0.22 0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.71 2c34 s VAL 68 Cb -0.15 -3.32 0.00 0.00 0.00 0.00 0.00 36.38 32.91 2c34 s VAL 68 CO -0.07 -0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.61 2c34 n GLY 69 N 4.14 0.46 0.03 4.51 0.00 -1.26 -5.07 105.19 108.00 2c34 n GLY 69 Ca 0.17 -0.61 0.01 0.00 0.00 0.00 0.00 46.02 45.59 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 0.33 0.00 1.61 0.31 -1.26 -5.00 118.33 114.31 2c34 n VAL 70 Ca 0.00 -0.37 0.00 0.00 -0.01 0.00 0.00 64.34 63.96 2c34 n VAL 70 Cb 0.00 -0.16 0.00 0.00 -0.91 0.00 0.00 33.84 32.77 2c34 n VAL 70 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2c34 n GLY 71 N 1.99 2.56 0.00 2.92 0.00 -1.18 -4.91 105.19 106.57 2c34 n GLY 71 Ca -0.09 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 1.01 0.00 -0.02 0.00 0.13 -4.79 105.19 101.53 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 -1.96 0.00 -3.63 -0.61 -5.35 0.95 -3.80 119.36 104.95 2c34 n ILE 73 Ca 0.00 0.00 -0.29 0.00 -0.27 0.00 0.00 62.75 62.19 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 -4.14 0.94 -1.01 4.28 1.51 -0.27 -0.96 117.35 117.70 2c34 s TYR 74 Ca 0.00 -1.23 -0.23 0.00 -1.01 0.00 0.00 57.07 54.60 2c34 s TYR 74 Cb 0.00 -1.25 0.04 0.00 -0.11 0.00 0.00 41.96 40.65 2c34 s TYR 74 CO 0.00 -0.83 1.48 0.08 -1.11 0.00 0.00 175.55 175.17 2c34 s VAL 75 N 1.88 3.89 -0.21 0.71 1.01 -1.02 -2.33 120.40 124.33 2c34 s VAL 75 Ca 0.09 -0.74 -0.26 0.00 0.00 0.00 0.00 61.98 61.07 2c34 s VAL 75 Cb -0.17 -5.00 -0.00 0.00 0.00 0.00 0.00 36.38 31.21 2c34 s VAL 75 CO -0.30 -1.88 0.89 -0.69 0.00 0.00 0.00 175.10 173.11 2c34 s VAL 76 N 5.27 4.81 -0.40 2.92 1.01 -0.97 0.35 120.40 133.38 2c34 s VAL 76 Ca 0.47 1.72 0.01 0.00 0.00 0.00 0.00 61.98 64.18 2c34 s VAL 76 Cb -0.00 -4.18 0.11 0.00 0.00 0.00 0.00 36.38 32.31 2c34 s VAL 76 CO -0.09 -0.07 0.15 -0.76 0.00 0.00 0.00 175.10 174.33 2c34 s LEU 77 N 2.68 4.93 -0.41 3.92 1.43 0.04 -1.47 118.68 129.80 2c34 s LEU 77 Ca 0.39 -2.25 -0.17 0.00 -1.03 0.00 0.00 54.13 51.06 2c34 s LEU 77 Cb -0.16 -1.72 0.02 0.00 0.03 0.00 0.00 46.19 44.36 2c34 s LEU 77 CO 0.09 -0.42 0.46 -0.69 0.23 0.00 0.00 176.35 176.01 2c34 s VAL 78 N 0.79 5.06 -0.40 -1.59 1.01 -1.02 0.24 120.40 124.49 2c34 s VAL 78 Ca 0.11 -0.24 -0.05 0.00 0.00 0.00 0.00 61.98 61.80 2c34 s VAL 78 Cb -0.21 -4.04 0.10 0.00 0.00 0.00 0.00 36.38 32.23 2c34 s VAL 78 CO -0.06 -0.41 0.21 -0.54 0.00 0.00 0.00 175.10 174.31 2c34 s LYS 79 N 2.21 2.27 -0.61 2.72 1.02 0.11 -2.19 119.74 125.26 2c34 s LYS 79 Ca 0.13 -1.65 -0.27 0.00 0.02 0.00 0.00 55.97 54.20 2c34 s LYS 79 Cb -0.17 -3.62 -0.11 0.00 -0.52 0.00 0.00 37.83 33.42 2c34 s LYS 79 CO 0.14 -1.00 2.49 -2.30 -0.92 0.00 0.00 175.35 173.76 2c34 n PRO 80 N 4.72 0.79 -0.10 -1.68 -0.02 -1.26 -0.27 135.00 137.17 2c34 n PRO 80 Ca -0.06 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.29 2c34 n PRO 80 Cb 0.42 -2.94 -0.04 0.00 -0.02 0.00 0.00 33.50 30.92 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 17.58 0.73 0.00 -0.52 3.08 -1.56 0.28 114.38 133.96 2c34 h ARG 81 Ca -0.19 -0.39 -0.46 0.00 0.07 0.00 0.00 59.98 59.00 2c34 h ARG 81 Cb 1.28 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 31.29 2c34 h ARG 81 CO 1.21 1.01 -0.25 1.63 -1.07 0.00 0.00 179.97 182.50 2c34 n LYS 82 N -4.24 0.90 -4.91 0.04 5.02 -1.03 -4.87 118.16 109.07 2c34 n LYS 82 Ca -0.04 -2.72 -0.31 0.00 -2.02 0.00 0.00 58.31 53.22 2c34 n LYS 82 Cb 0.48 0.40 -0.14 0.00 -0.02 0.00 0.00 35.03 35.75 2c34 n LYS 82 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2c34 s ARG 83 N -3.67 2.09 0.00 1.97 0.52 -1.26 -4.88 118.95 113.71 2c34 s ARG 83 Ca 0.18 -0.95 0.00 0.00 -0.52 0.00 0.00 55.73 54.44 2c34 s ARG 83 Cb -0.01 -2.14 0.00 0.00 0.52 0.00 0.00 34.95 33.32 2c34 s ARG 83 CO 0.12 0.55 0.00 0.41 0.02 0.00 0.00 175.30 176.40 2c34 n GLY 84 N 1.95 0.48 3.30 -3.53 0.00 0.35 -4.99 105.19 102.76 2c34 n GLY 84 Ca -0.16 -1.20 -0.46 0.00 0.00 0.00 0.00 46.02 44.20 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 -1.91 3.68 0.32 1.61 3.76 -1.26 -0.28 115.29 121.21 2c34 s HIS 85 Ca 0.00 -2.00 0.08 0.00 -0.15 0.00 0.00 55.06 52.99 2c34 s HIS 85 Cb 0.00 -3.75 -0.03 0.00 1.11 0.00 0.00 32.58 29.91 2c34 s HIS 85 CO 0.00 -0.98 0.24 -1.01 -0.85 0.00 0.00 174.74 172.14 2c34 s HIS 86 N 0.29 2.89 0.04 1.40 3.76 -0.86 -4.99 115.29 117.82 2c34 s HIS 86 Ca 0.16 -0.28 -0.27 0.00 -0.15 0.00 0.00 55.06 54.52 2c34 s HIS 86 Cb -0.13 -1.67 0.07 0.00 1.11 0.00 0.00 32.58 31.96 2c34 s HIS 86 CO -0.07 0.29 0.67 0.99 -0.85 0.00 0.00 174.74 175.77 2c34 s THR 87 N -2.30 0.00 -0.38 1.30 2.01 -1.26 -1.72 115.64 113.29 2c34 s THR 87 Ca 0.39 0.00 0.02 0.00 0.31 0.00 0.00 61.69 62.41 2c34 s THR 87 Cb -0.06 -1.00 0.11 0.00 0.01 0.00 0.00 72.50 71.57 2c34 s THR 87 CO 0.25 0.00 0.14 -0.22 -0.69 0.00 0.00 174.62 174.10 2c34 s LEU 88 N -1.96 3.50 -0.71 4.42 2.96 -0.48 -4.87 118.68 121.53 2c34 s LEU 88 Ca -0.04 -2.24 -0.24 0.00 -0.22 0.00 0.00 54.13 51.39 2c34 s LEU 88 Cb -0.01 -1.28 0.05 0.00 0.50 0.00 0.00 46.19 45.46 2c34 s LEU 88 CO -0.02 -0.34 1.12 -1.61 -1.32 0.00 0.00 176.35 174.18 2c34 s GLU 89 N 0.81 3.17 -0.17 1.98 2.02 -1.26 0.46 118.70 125.72 2c34 s GLU 89 Ca 0.13 -0.61 -0.14 0.00 0.02 0.00 0.00 54.97 54.36 2c34 s GLU 89 Cb -0.21 -4.27 -0.05 0.00 0.10 0.00 0.00 34.13 29.71 2c34 s GLU 89 CO -0.10 -1.97 0.31 -0.51 0.02 0.00 0.00 175.26 173.01 2c34 s LEU 90 N 4.78 4.23 0.13 1.80 1.43 -0.53 -2.00 118.68 128.51 2c34 s LEU 90 Ca 0.29 0.51 0.05 0.00 -1.03 0.00 0.00 54.13 53.94 2c34 s LEU 90 Cb -0.12 -2.40 -0.04 0.00 0.03 0.00 0.00 46.19 43.66 2c34 s LEU 90 CO 0.11 0.07 -0.12 0.54 0.23 0.00 0.00 176.35 177.18 2c34 s VAL 91 N 0.61 1.21 -0.67 -1.59 0.11 -0.82 0.15 120.40 119.39 2c34 s VAL 91 Ca 0.17 -1.86 -0.14 0.00 -2.93 0.00 0.00 61.98 57.21 2c34 s VAL 91 Cb -0.13 -1.65 0.17 0.00 -1.53 0.00 0.00 36.38 33.24 2c34 s VAL 91 CO 0.05 -0.59 0.61 -0.47 -3.33 0.00 0.00 175.10 171.37 2c34 s TYR 92 N -2.71 3.51 0.38 1.54 5.04 -1.00 -1.78 117.35 122.33 2c34 s TYR 92 Ca 0.12 -1.71 0.08 0.00 -2.44 0.00 0.00 57.07 53.12 2c34 s TYR 92 Cb -0.01 -3.77 -0.06 0.00 0.35 0.00 0.00 41.96 38.47 2c34 s TYR 92 CO 0.02 -1.00 0.04 -0.08 -1.34 0.00 0.00 175.55 173.19 2c34 s THR 93 N 0.85 2.31 -0.68 4.34 -1.32 -0.52 -4.09 115.64 116.53 2c34 s THR 93 Ca 0.11 -1.94 -0.12 0.00 -1.21 0.00 0.00 61.69 58.53 2c34 s THR 93 Cb -0.20 -2.89 0.18 0.00 -1.51 0.00 0.00 72.50 68.08 2c34 s THR 93 CO -0.03 -0.09 0.59 -0.13 -2.21 0.00 0.00 174.62 172.75 2c34 s ARG 94 N -3.75 3.13 0.54 7.08 0.52 -1.18 0.15 118.95 125.44 2c34 s ARG 94 Ca 0.36 -2.22 0.35 0.00 -0.52 0.00 0.00 55.73 53.70 2c34 s ARG 94 Cb 0.04 -4.21 1.53 0.00 0.52 0.00 0.00 34.95 32.83 2c34 s ARG 94 CO 0.19 -1.26 1.82 -1.35 0.02 0.00 0.00 175.30 174.72 2c34 h PRO 95 N 7.98 0.00 -0.03 3.54 0.11 -1.84 0.62 132.00 142.38 2c34 h PRO 95 Ca -0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.07 2c34 h PRO 95 Cb 1.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2c34 h PRO 95 CO 0.82 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 179.80 2c34 n PHE 96 N -4.18 0.00 0.00 0.65 3.01 -1.26 -4.45 117.46 111.23 2c34 n PHE 96 Ca 0.23 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.69 2c34 n PHE 96 Cb 1.16 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.63 2c34 n PHE 96 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 2c34 n GLU 97 N -0.48 0.00 0.00 -1.08 -0.58 0.19 -5.19 120.64 113.50 2c34 n GLU 97 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2c34 n GLU 97 Cb 0.01 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.88 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 -0.07 0.15 3.90 0.62 0.00 0.68 -5.05 105.19 105.42 2c34 n GLY 98 Ca 0.00 -1.12 -0.31 0.00 0.00 0.00 0.00 46.02 44.59 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 -2.00 5.10 0.18 -0.61 1.01 -1.26 -3.13 121.20 120.49 2c34 s ILE 99 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 60.65 60.76 2c34 s ILE 99 Cb 0.00 -3.64 -0.04 0.00 0.01 0.00 0.00 42.46 38.79 2c34 s ILE 99 CO 0.00 -0.04 0.06 -0.54 0.00 0.00 0.00 174.94 174.43 2c34 s LYS 100 N -2.83 1.12 -0.09 2.79 -0.14 -1.26 -5.05 119.74 114.28 2c34 s LYS 100 Ca 0.43 -1.56 -0.26 0.00 -1.36 0.00 0.00 55.97 53.21 2c34 s LYS 100 Cb -0.12 0.01 -0.26 0.00 -1.68 0.00 0.00 37.83 35.79 2c34 s LYS 100 CO 0.25 -0.26 0.89 -1.35 -0.76 0.00 0.00 175.35 174.12 2c34 h PRO 101 N 2.68 0.10 0.00 -1.68 0.11 -1.98 -3.27 132.00 127.96 2c34 h PRO 101 Ca -0.36 -0.15 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2c34 h PRO 101 Cb 1.22 0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2c34 h PRO 101 CO 0.59 1.00 0.16 1.05 -0.21 0.00 0.00 178.00 180.59 2c34 h GLU 102 N -0.72 0.00 -7.25 1.05 4.11 -1.99 -3.43 114.58 106.35 2c34 h GLU 102 Ca -0.03 0.00 -0.49 0.00 0.07 0.00 0.00 59.36 58.90 2c34 h GLU 102 Cb 1.10 0.00 0.19 0.00 0.50 0.00 0.00 28.75 30.53 2c34 h GLU 102 CO 0.04 0.00 0.18 -0.80 0.07 0.00 0.00 179.01 178.51 2c34 s ASN 103 N -4.40 2.64 0.96 3.06 0.02 -1.24 -4.97 114.94 111.02 2c34 s ASN 103 Ca -0.03 1.91 -0.11 0.00 -1.02 0.00 0.00 52.86 53.61 2c34 s ASN 103 Cb 0.09 -2.46 0.16 0.00 0.02 0.00 0.00 41.25 39.06 2c34 s ASN 103 CO 0.27 -3.23 1.06 -0.62 0.02 0.00 0.00 177.10 174.61 2c34 n GLU 104 N -4.30 -0.73 -4.24 -0.60 4.71 -1.26 -4.84 120.64 109.39 2c34 n GLU 104 Ca 0.09 -0.15 -0.13 0.00 -0.01 0.00 0.00 57.16 56.95 2c34 n GLU 104 Cb 0.53 -2.30 -0.10 0.00 -1.01 0.00 0.00 31.44 28.56 2c34 n GLU 104 CO 0.00 0.00 0.00 0.50 0.09 0.00 0.00 177.13 177.72 2c34 s ARG 105 N -4.52 1.09 -0.35 3.49 6.06 -1.26 -2.37 118.95 121.10 2c34 s ARG 105 Ca 0.66 -1.52 0.00 0.00 -2.50 0.00 0.00 55.73 52.37 2c34 s ARG 105 Cb -0.23 -0.25 0.28 0.00 0.06 0.00 0.00 34.95 34.81 2c34 s ARG 105 CO 0.60 -0.13 1.22 0.98 -2.50 0.00 0.00 175.30 175.47 2c34 n TYR 106 N -0.23 -0.93 -2.83 5.12 4.19 0.12 -4.64 117.16 117.97 2c34 n TYR 106 Ca -0.07 -0.88 -0.43 0.00 3.31 0.00 0.00 57.90 59.83 2c34 n TYR 106 Cb 0.63 1.18 -0.03 0.00 0.49 0.00 0.00 39.34 41.61 2c34 n TYR 106 CO 0.00 0.00 0.00 0.99 0.91 0.00 0.00 176.86 178.76 2c34 s THR 107 N 0.17 4.33 -1.04 2.97 2.01 -1.26 -1.46 115.64 121.37 2c34 s THR 107 Ca 0.26 -0.53 -0.23 0.00 0.31 0.00 0.00 61.69 61.50 2c34 s THR 107 Cb 0.23 -4.74 0.02 0.00 0.01 0.00 0.00 72.50 68.02 2c34 s THR 107 CO -0.12 -1.52 1.65 -0.22 -0.69 0.00 0.00 174.62 173.72 2c34 s LEU 108 N 4.00 3.42 0.35 4.42 2.96 0.17 -0.22 118.68 133.78 2c34 s LEU 108 Ca 0.26 -1.39 -0.27 0.00 -0.22 0.00 0.00 54.13 52.52 2c34 s LEU 108 Cb -0.13 -2.57 -0.09 0.00 0.50 0.00 0.00 46.19 43.90 2c34 s LEU 108 CO 0.06 -1.90 1.10 -1.00 -1.32 0.00 0.00 176.35 173.29 2c34 s HIS 109 N 6.66 3.36 -0.21 5.38 3.76 0.86 -1.39 115.29 133.72 2c34 s HIS 109 Ca 0.55 1.65 -0.04 0.00 -0.15 0.00 0.00 55.06 57.07 2c34 s HIS 109 Cb -0.01 -3.25 0.09 0.00 1.11 0.00 0.00 32.58 30.51 2c34 s HIS 109 CO -0.04 -0.74 0.19 -0.51 -0.85 0.00 0.00 174.74 172.79 2c34 s LEU 110 N -2.08 0.04 -1.40 0.89 1.43 -0.70 -2.20 118.68 114.66 2c34 s LEU 110 Ca 0.52 -0.43 -0.14 0.00 -1.03 0.00 0.00 54.13 53.05 2c34 s LEU 110 Cb -0.28 0.19 0.07 0.00 0.03 0.00 0.00 46.19 46.19 2c34 s LEU 110 CO 0.36 -0.34 2.07 -3.20 0.23 0.00 0.00 176.35 175.46 2c34 n ASN 111 N 5.30 4.27 -4.68 2.29 2.85 0.13 -2.04 115.26 123.39 2c34 n ASN 111 Ca -0.06 -2.89 -0.50 0.00 -0.11 0.00 0.00 54.58 51.02 2c34 n ASN 111 Cb 0.49 -1.65 -0.05 0.00 1.24 0.00 0.00 39.78 39.80 2c34 n ASN 111 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 2c34 n VAL 112 N 5.11 0.37 1.38 3.44 0.31 0.62 -3.68 118.33 125.87 2c34 n VAL 112 Ca 0.49 -0.07 0.14 0.00 -0.01 0.00 0.00 64.34 64.89 2c34 n VAL 112 Cb 0.40 -1.59 0.42 0.00 -0.91 0.00 0.00 33.84 32.17 2c34 n VAL 112 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80