#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 0.00 1.61 3.41 -1.26 -5.07 113.62 112.31 2c34 n SER -1 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2c34 n SER -1 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2c34 n SER -1 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2c34 n HIS 0 N 0.00 0.00 -2.19 7.33 -0.00 -1.26 -4.74 115.22 114.35 2c34 n HIS 0 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 57.72 57.35 2c34 n HIS 0 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 2c34 n HIS 0 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2c34 s MET 1 N 0.00 3.58 0.00 1.57 0.00 -1.26 -4.92 119.30 118.28 2c34 s MET 1 Ca 0.00 1.80 0.24 0.00 0.00 0.00 0.00 55.69 57.73 2c34 s MET 1 Cb 0.00 -2.30 1.14 0.00 0.00 0.00 0.00 34.83 33.67 2c34 s MET 1 CO 0.00 -0.71 1.77 0.44 0.00 0.00 0.00 175.02 176.52 2c34 n ILE 2 N -0.74 0.07 -1.25 3.16 -5.35 -1.26 -5.03 119.36 108.95 2c34 n ILE 2 Ca 0.09 -0.17 0.00 0.00 -0.27 0.00 0.00 62.75 62.40 2c34 n ILE 2 Cb 0.48 0.07 0.00 0.00 -1.74 0.00 0.00 39.64 38.45 2c34 n ILE 2 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2c34 n ALA 3 N -0.25 -1.66 1.15 -1.28 0.00 -1.26 -4.26 120.51 112.94 2c34 n ALA 3 Ca 0.18 0.39 0.12 0.00 0.00 0.00 0.00 53.44 54.12 2c34 n ALA 3 Cb 0.23 -1.27 0.60 0.00 0.00 0.00 0.00 19.45 19.01 2c34 n ALA 3 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2c34 n PRO 4 N -2.34 0.37 0.06 0.00 -0.04 -1.26 -3.87 135.00 127.93 2c34 n PRO 4 Ca 0.00 0.06 -0.03 0.00 -0.04 0.00 0.00 63.50 63.49 2c34 n PRO 4 Cb 0.37 -1.50 -0.01 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 -0.17 -9.57 1.53 5.85 -2.03 -3.45 115.31 107.48 2c34 h LEU 5 Ca 0.00 0.01 -0.53 0.00 0.84 0.00 0.00 57.88 58.19 2c34 h LEU 5 Cb 0.20 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 2c34 h LEU 5 CO 0.00 0.01 0.24 -0.94 -0.34 0.00 0.00 178.44 177.41 2c34 s SER 6 N -3.62 7.34 0.42 1.25 1.04 -1.25 -4.84 113.70 114.04 2c34 s SER 6 Ca -0.03 1.60 0.00 0.00 0.48 0.00 0.00 55.95 58.00 2c34 s SER 6 Cb 0.00 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.61 2c34 s SER 6 CO 0.09 0.01 0.00 0.52 0.98 0.00 0.00 173.24 174.83 2c34 n VAL 7 N 2.67 -3.23 -3.64 5.02 0.31 -1.26 -4.76 118.33 113.43 2c34 n VAL 7 Ca -0.01 1.46 -0.03 0.00 -0.01 0.00 0.00 64.34 65.75 2c34 n VAL 7 Cb 0.50 -2.18 -0.07 0.00 -0.91 0.00 0.00 33.84 31.18 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 -4.67 0.36 -0.02 5.55 2.47 -1.26 -4.82 119.74 117.34 2c34 s LYS 8 Ca 0.00 0.57 -0.30 0.00 -1.56 0.00 0.00 55.97 54.68 2c34 s LYS 8 Cb 0.00 0.10 -0.06 0.00 -1.46 0.00 0.00 37.83 36.41 2c34 s LYS 8 CO 0.00 -0.07 1.59 -0.51 0.16 0.00 0.00 175.35 176.53 2c34 s ASP 9 N 1.05 6.70 0.00 1.43 1.11 -1.26 -4.90 116.67 120.81 2c34 s ASP 9 Ca -0.06 2.24 0.00 0.00 0.18 0.00 0.00 52.55 54.91 2c34 s ASP 9 Cb -0.04 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.41 2c34 s ASP 9 CO -0.13 -0.87 0.00 -0.46 1.18 0.00 0.00 175.17 174.89 2c34 n ASN 10 N 6.49 0.00 -4.53 0.27 6.94 -1.26 -4.95 115.26 118.22 2c34 n ASN 10 Ca 0.16 0.00 -0.38 0.00 -0.02 0.00 0.00 54.58 54.34 2c34 n ASN 10 Cb 0.43 0.00 -0.07 0.00 -2.36 0.00 0.00 39.78 37.77 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 0.00 1.63 -4.45 0.53 5.68 -1.26 -4.21 116.55 114.48 2c34 n ASP 11 Ca 0.00 -0.29 -0.44 0.00 -0.50 0.00 0.00 54.79 53.57 2c34 n ASP 11 Cb 0.00 -1.36 -0.03 0.00 -1.14 0.00 0.00 41.12 38.59 2c34 n ASP 11 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 2c34 s LYS 12 N 8.54 3.52 -0.67 0.11 2.20 -0.93 -4.88 119.74 127.63 2c34 s LYS 12 Ca 1.11 -1.63 -0.27 0.00 -0.36 0.00 0.00 55.97 54.82 2c34 s LYS 12 Cb -0.54 -4.80 -0.00 0.00 -1.51 0.00 0.00 37.83 30.98 2c34 s LYS 12 CO 0.34 -1.77 1.64 -1.58 -0.36 0.00 0.00 175.35 173.62 2c34 s TRP 13 N 2.84 1.90 0.08 4.03 0.52 -1.26 -1.16 118.94 125.89 2c34 s TRP 13 Ca 0.30 0.45 -0.01 0.00 0.02 0.00 0.00 56.10 56.87 2c34 s TRP 13 Cb -0.07 -4.30 0.00 0.00 -1.15 0.00 0.00 33.47 27.95 2c34 s TRP 13 CO -0.06 -2.21 0.12 1.33 0.02 0.00 0.00 176.95 176.14 2c34 n VAL 14 N 6.90 0.00 -3.84 4.03 0.24 -0.94 -4.99 118.33 119.73 2c34 n VAL 14 Ca 0.14 -0.39 -0.15 0.00 -2.04 0.00 0.00 64.34 61.91 2c34 n VAL 14 Cb 0.51 0.25 -0.01 0.00 -1.47 0.00 0.00 33.84 33.12 2c34 n VAL 14 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2c34 n ASP 15 N -1.94 2.09 -2.95 -1.34 5.75 -1.26 0.27 116.55 117.17 2c34 n ASP 15 Ca -0.00 -2.04 0.01 0.00 -0.01 0.00 0.00 54.79 52.75 2c34 n ASP 15 Cb 0.13 0.02 0.01 0.00 -1.03 0.00 0.00 41.12 40.25 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 -1.08 0.00 -2.56 2.12 5.66 -1.24 -4.55 114.28 112.63 2c34 n THR 16 Ca -0.03 -0.20 0.00 0.00 -3.05 0.00 0.00 64.05 60.77 2c34 n THR 16 Cb 0.33 0.46 0.00 0.00 -1.55 0.00 0.00 70.33 69.57 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 -0.63 0.00 -3.58 1.09 8.25 -1.26 -1.62 115.22 117.47 2c34 n HIS 17 Ca 0.02 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.11 2c34 n HIS 17 Cb 0.42 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.45 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 1.44 5.32 0.00 1.59 1.01 -1.26 -4.21 120.40 124.29 2c34 s VAL 18 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.39 2c34 s VAL 18 Cb 0.00 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.80 2c34 s VAL 18 CO 0.00 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.08 2c34 n GLY 19 N 3.72 0.37 3.52 4.51 0.00 -0.16 -4.86 105.19 112.29 2c34 n GLY 19 Ca -0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.51 0.31 -1.55 1.61 3.00 -1.26 -4.61 118.16 114.15 2c34 n LYS 20 Ca 0.00 -1.02 -0.22 0.00 -0.00 0.00 0.00 58.31 57.08 2c34 n LYS 20 Cb 0.16 -3.36 -0.07 0.00 0.00 0.00 0.00 35.03 31.76 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 8.32 -0.03 -2.77 3.15 -1.04 -1.26 -4.39 114.28 116.26 2c34 n THR 21 Ca 0.44 -0.58 -0.42 0.00 -2.04 0.00 0.00 64.05 61.44 2c34 n THR 21 Cb 0.42 -2.09 -0.04 0.00 -1.82 0.00 0.00 70.33 66.80 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 13.04 4.16 -0.04 12.58 2.01 -0.97 -4.83 115.64 141.59 2c34 s THR 22 Ca 0.98 -0.18 -0.27 0.00 0.31 0.00 0.00 61.69 62.53 2c34 s THR 22 Cb -0.22 -4.76 -0.03 0.00 0.01 0.00 0.00 72.50 67.50 2c34 s THR 22 CO 0.18 -1.57 0.87 -0.70 -0.69 0.00 0.00 174.62 172.70 2c34 s GLU 23 N 4.51 4.50 -0.22 4.92 2.12 -1.25 -2.42 118.70 130.86 2c34 s GLU 23 Ca 0.26 1.19 -0.03 0.00 0.36 0.00 0.00 54.97 56.76 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 0.11 -0.02 0.06 0.42 -0.54 0.00 0.00 175.26 175.28 2c34 s ILE 24 N 1.00 0.53 -0.74 -3.70 1.01 -0.60 -4.96 121.20 113.74 2c34 s ILE 24 Ca 0.46 -0.73 -0.21 0.00 0.00 0.00 0.00 60.65 60.17 2c34 s ILE 24 Cb -0.19 -1.14 0.09 0.00 0.01 0.00 0.00 42.46 41.23 2c34 s ILE 24 CO 0.23 -0.34 1.01 -1.00 0.00 0.00 0.00 174.94 174.84 2c34 s HIS 25 N 1.84 2.82 0.19 3.97 3.76 -1.26 -2.40 115.29 124.20 2c34 s HIS 25 Ca 0.02 -0.83 -0.10 0.00 -0.15 0.00 0.00 55.06 53.99 2c34 s HIS 25 Cb -0.17 -4.28 -0.07 0.00 1.11 0.00 0.00 32.58 29.17 2c34 s HIS 25 CO -0.14 -1.59 0.52 -0.51 -0.85 0.00 0.00 174.74 172.18 2c34 s LEU 26 N 3.59 4.24 0.26 0.89 1.43 -0.96 -4.88 118.68 123.26 2c34 s LEU 26 Ca 0.25 0.92 0.06 0.00 -1.03 0.00 0.00 54.13 54.33 2c34 s LEU 26 Cb -0.13 -3.47 -0.03 0.00 0.03 0.00 0.00 46.19 42.58 2c34 s LEU 26 CO 0.04 0.01 0.31 -0.54 0.23 0.00 0.00 176.35 176.39 2c34 s LYS 27 N -2.49 3.16 0.00 1.70 1.02 -1.26 -1.64 119.74 120.23 2c34 s LYS 27 Ca 0.43 -0.94 0.00 0.00 0.02 0.00 0.00 55.97 55.48 2c34 s LYS 27 Cb -0.12 -2.73 0.00 0.00 -0.52 0.00 0.00 37.83 34.45 2c34 s LYS 27 CO 0.21 0.35 0.00 0.41 -0.92 0.00 0.00 175.35 175.39 2c34 n GLY 28 N -1.36 -0.86 2.90 -3.33 0.00 -1.26 -4.95 105.19 96.34 2c34 n GLY 28 Ca -0.07 -0.19 0.03 0.00 0.00 0.00 0.00 46.02 45.79 2c34 n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c34 s ASN 29 N -4.00 -0.29 0.00 1.61 4.22 -1.26 -4.97 114.94 110.25 2c34 s ASN 29 Ca 0.00 -0.08 0.02 0.00 -2.14 0.00 0.00 52.86 50.66 2c34 s ASN 29 Cb 0.00 0.68 0.07 0.00 1.28 0.00 0.00 41.25 43.28 2c34 s ASN 29 CO 0.00 -0.04 1.03 -0.81 -2.04 0.00 0.00 177.10 175.24 2c34 n PRO 30 N 4.20 0.00 0.31 3.55 -0.04 -1.26 -2.19 135.00 139.57 2c34 n PRO 30 Ca 0.07 0.45 0.18 0.00 -0.04 0.00 0.00 63.50 64.16 2c34 n PRO 30 Cb 0.61 -1.50 1.03 0.00 -0.04 0.00 0.00 33.50 33.60 2c34 n PRO 30 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 2c34 h THR 31 N 0.00 0.28 0.00 0.52 1.35 -1.95 -3.14 112.91 109.97 2c34 h THR 31 Ca 0.00 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 65.79 2c34 h THR 31 Cb 0.03 1.06 0.00 0.00 -1.73 0.00 0.00 68.15 67.50 2c34 h THR 31 CO 0.00 0.01 -0.09 0.71 -0.25 0.00 0.00 175.52 175.90 2c34 h THR 32 N 0.00 0.00 0.00 6.82 1.35 -1.89 -3.49 112.91 115.70 2c34 h THR 32 Ca -0.00 -0.66 0.00 0.00 -0.55 0.00 0.00 66.41 65.20 2c34 h THR 32 Cb 0.05 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.47 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 1.80 0.24 3.93 5.82 0.00 -1.19 -5.16 105.19 110.64 2c34 n GLY 33 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 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 1.57 0.00 1.61 1.51 -1.26 -4.12 117.35 116.66 2c34 s TYR 34 Ca 0.00 0.30 -0.23 0.00 -1.01 0.00 0.00 57.07 56.13 2c34 s TYR 34 Cb 0.00 -4.13 0.05 0.00 -0.11 0.00 0.00 41.96 37.77 2c34 s TYR 34 CO 0.00 -2.66 0.52 1.41 -1.11 0.00 0.00 175.55 173.71 2c34 s MET 35 N -5.89 0.95 -0.84 -0.62 -2.45 0.55 -4.51 119.30 106.49 2c34 s MET 35 Ca 0.74 -0.07 -0.06 0.00 -1.25 0.00 0.00 55.69 55.05 2c34 s MET 35 Cb -0.04 0.44 0.21 0.00 1.25 0.00 0.00 34.83 36.70 2c34 s MET 35 CO 0.53 -0.31 0.74 -1.58 1.05 0.00 0.00 175.02 175.44 2c34 s TRP 36 N -1.78 3.79 0.00 4.11 0.52 -1.26 -1.29 118.94 123.02 2c34 s TRP 36 Ca -0.09 -2.65 0.00 0.00 0.02 0.00 0.00 56.10 53.38 2c34 s TRP 36 Cb -0.01 -3.46 0.00 0.00 -1.15 0.00 0.00 33.47 28.84 2c34 s TRP 36 CO 0.03 -0.86 0.00 -2.37 0.02 0.00 0.00 176.95 173.78 2c34 n THR 37 N 3.09 0.00 -3.25 2.01 5.66 -1.03 -4.89 114.28 115.87 2c34 n THR 37 Ca 0.16 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.85 2c34 n THR 37 Cb 0.40 0.00 -0.05 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 -0.64 3.82 0.16 1.09 0.52 -1.26 -0.78 118.95 121.86 2c34 s ARG 38 Ca 0.00 0.35 -0.30 0.00 -0.52 0.00 0.00 55.73 55.26 2c34 s ARG 38 Cb 0.00 -2.56 -0.08 0.00 0.52 0.00 0.00 34.95 32.84 2c34 s ARG 38 CO 0.00 0.21 1.23 0.08 0.02 0.00 0.00 175.30 176.84 2c34 s VAL 39 N -1.99 3.57 0.00 3.52 1.01 0.15 -2.69 120.40 123.97 2c34 s VAL 39 Ca 0.49 1.26 0.00 0.00 0.00 0.00 0.00 61.98 63.73 2c34 s VAL 39 Cb -0.11 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.47 2c34 s VAL 39 CO 0.23 0.17 0.00 0.61 0.00 0.00 0.00 175.10 176.11 2c34 n GLY 40 N 2.53 0.81 0.00 4.51 0.00 -1.26 -4.79 105.19 106.98 2c34 n GLY 40 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.31 0.00 -1.52 1.61 3.72 -1.10 -4.98 117.46 112.89 2c34 n PHE 41 Ca 0.00 0.00 -0.47 0.00 -0.05 0.00 0.00 57.45 56.93 2c34 n PHE 41 Cb 0.00 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.49 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 -0.04 0.25 0.00 -4.37 0.31 -1.13 -0.40 118.33 112.95 2c34 n VAL 42 Ca 0.00 -0.37 0.00 0.00 -0.01 0.00 0.00 64.34 63.96 2c34 n VAL 42 Cb 0.11 -2.09 0.00 0.00 -0.91 0.00 0.00 33.84 30.94 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 6.18 2.16 3.52 2.92 0.00 -1.26 -4.88 105.19 113.83 2c34 n GLY 43 Ca 0.36 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.09 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 -0.12 -0.98 0.20 1.61 1.02 0.46 -4.95 119.74 116.98 2c34 s LYS 44 Ca 0.00 0.51 0.15 0.00 0.02 0.00 0.00 55.97 56.65 2c34 s LYS 44 Cb 0.00 -1.57 -0.02 0.00 -0.52 0.00 0.00 37.83 35.72 2c34 s LYS 44 CO 0.00 -3.68 1.23 -0.44 -0.92 0.00 0.00 175.35 171.54 2c34 h ASP 45 N -2.57 0.00 -3.99 2.83 5.19 -1.98 -3.46 116.42 112.43 2c34 h ASP 45 Ca -0.56 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 55.66 2c34 h ASP 45 Cb 1.33 0.00 -0.26 0.00 0.18 0.00 0.00 39.33 40.59 2c34 h ASP 45 CO 0.48 0.55 -0.56 0.54 -3.12 0.00 0.00 179.24 177.13 2c34 s VAL 46 N -2.94 0.02 -0.20 -1.35 0.11 -1.26 -5.06 120.40 109.71 2c34 s VAL 46 Ca 0.01 -0.13 -0.16 0.00 -2.93 0.00 0.00 61.98 58.77 2c34 s VAL 46 Cb 0.08 -0.22 -0.12 0.00 -1.53 0.00 0.00 36.38 34.59 2c34 s VAL 46 CO 0.77 -0.07 -0.06 0.18 -3.33 0.00 0.00 175.10 172.59 2c34 n LEU 47 N 2.74 1.88 -4.10 2.54 4.77 -1.26 -4.92 117.00 118.65 2c34 n LEU 47 Ca -0.14 0.45 -0.23 0.00 -0.03 0.00 0.00 56.01 56.05 2c34 n LEU 47 Cb 0.58 -0.89 0.16 0.00 -2.33 0.00 0.00 43.42 40.94 2c34 n LEU 47 CO 0.22 0.09 -0.23 -0.24 -1.33 0.00 0.00 177.39 175.90 2c34 n SER 48 N -4.45 -2.87 0.00 -1.43 2.88 -1.24 -4.95 113.62 101.57 2c34 n SER 48 Ca -0.28 -0.32 0.00 0.00 -1.33 0.00 0.00 58.87 56.94 2c34 n SER 48 Cb 0.60 -0.82 0.00 0.00 -0.75 0.00 0.00 64.21 63.24 2c34 n SER 48 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2c34 n ASP 49 N -1.34 0.00 0.00 -3.46 8.00 -1.26 -4.95 116.55 113.54 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 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.56 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 -0.37 0.38 0.00 -1.24 0.28 -1.26 -4.97 120.64 113.46 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 -0.58 0.00 0.00 1.43 0.00 0.00 31.44 32.29 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 -1.11 0.00 -3.52 3.84 2.08 -1.26 -4.45 119.36 114.94 2c34 n ILE 51 Ca 0.00 0.64 -0.41 0.00 0.56 0.00 0.00 62.75 63.54 2c34 n ILE 51 Cb 0.08 -1.29 -0.11 0.00 -0.75 0.00 0.00 39.64 37.57 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 -1.96 4.77 -1.02 1.39 1.43 -1.26 -1.56 118.68 120.47 2c34 s LEU 52 Ca 0.00 -0.73 -0.25 0.00 -1.03 0.00 0.00 54.13 52.12 2c34 s LEU 52 Cb 0.00 -2.11 -0.17 0.00 0.03 0.00 0.00 46.19 43.94 2c34 s LEU 52 CO 0.00 -0.35 1.97 1.21 0.23 0.00 0.00 176.35 179.41 2c34 n GLU 53 N 5.10 1.00 -2.81 1.70 2.13 0.97 -4.05 120.64 124.67 2c34 n GLU 53 Ca -0.12 -2.06 -0.43 0.00 0.66 0.00 0.00 57.16 55.22 2c34 n GLU 53 Cb 0.48 -3.63 -0.03 0.00 0.27 0.00 0.00 31.44 28.53 2c34 n GLU 53 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2c34 s VAL 54 N 12.18 4.46 -1.06 6.31 1.01 -1.25 -0.59 120.40 141.47 2c34 s VAL 54 Ca 0.72 -1.25 -0.18 0.00 0.00 0.00 0.00 61.98 61.26 2c34 s VAL 54 Cb 0.01 -4.86 0.11 0.00 0.00 0.00 0.00 36.38 31.64 2c34 s VAL 54 CO 0.17 -1.64 1.34 -0.69 0.00 0.00 0.00 175.10 174.28 2c34 s VAL 55 N 3.47 4.55 -0.23 2.92 1.01 0.20 -3.63 120.40 128.68 2c34 s VAL 55 Ca 0.36 -1.68 -0.10 0.00 0.00 0.00 0.00 61.98 60.56 2c34 s VAL 55 Cb -0.04 -4.92 -0.05 0.00 0.00 0.00 0.00 36.38 31.37 2c34 s VAL 55 CO -0.08 -1.69 0.13 0.00 0.00 0.00 0.00 175.10 173.46 2c34 s LYS 57 N 1.05 2.36 -0.20 0.00 1.02 0.74 -4.96 119.74 119.74 2c34 s LYS 57 Ca 0.06 -1.31 -0.29 0.00 0.02 0.00 0.00 55.97 54.45 2c34 s LYS 57 Cb -0.14 -3.14 0.00 0.00 -0.52 0.00 0.00 37.83 34.04 2c34 s LYS 57 CO 0.04 -0.63 1.04 -0.47 -0.92 0.00 0.00 175.35 174.41 2c34 s TYR 58 N 1.21 3.35 -0.19 3.18 6.14 -1.26 -2.32 117.35 127.46 2c34 s TYR 58 Ca -0.05 1.47 0.01 0.00 0.64 0.00 0.00 57.07 59.14 2c34 s TYR 58 Cb -0.20 -3.27 0.02 0.00 0.42 0.00 0.00 41.96 38.94 2c34 s TYR 58 CO -0.02 -0.49 -0.19 0.99 0.64 0.00 0.00 175.55 176.48 2c34 s THR 59 N 2.99 2.11 0.36 4.34 2.01 -1.01 -5.01 115.64 121.43 2c34 s THR 59 Ca 0.45 -1.00 -0.02 0.00 0.31 0.00 0.00 61.69 61.43 2c34 s THR 59 Cb -0.16 -1.92 -0.04 0.00 0.01 0.00 0.00 72.50 70.39 2c34 s THR 59 CO 0.09 0.48 0.60 -2.16 -0.69 0.00 0.00 174.62 172.94 2c34 s PRO 60 N 1.28 3.54 0.26 4.92 0.04 -1.26 0.18 135.00 143.96 2c34 s PRO 60 Ca 0.04 -0.11 -0.25 0.00 0.04 0.00 0.00 61.00 60.71 2c34 s PRO 60 Cb -0.14 -2.59 -0.09 0.00 0.04 0.00 0.00 34.50 31.72 2c34 s PRO 60 CO -0.12 0.09 0.86 0.99 0.04 0.00 0.00 177.00 178.86 2c34 s THR 61 N -2.34 4.31 0.83 1.26 2.01 -1.26 -0.58 115.64 119.86 2c34 s THR 61 Ca 0.43 1.70 -0.12 0.00 0.31 0.00 0.00 61.69 64.00 2c34 s THR 61 Cb -0.10 -4.03 0.10 0.00 0.01 0.00 0.00 72.50 68.47 2c34 s THR 61 CO 0.36 0.27 1.18 -2.84 -0.69 0.00 0.00 174.62 172.90 2c34 s PRO 62 N -1.78 1.53 0.00 4.92 0.02 -1.26 -4.54 135.00 133.90 2c34 s PRO 62 Ca 0.45 1.66 0.00 0.00 0.02 0.00 0.00 61.00 63.12 2c34 s PRO 62 Cb -0.20 -1.77 0.00 0.00 0.02 0.00 0.00 34.50 32.55 2c34 s PRO 62 CO 0.24 -2.28 0.00 0.45 -0.33 0.00 0.00 177.00 175.09 2c34 n SER 63 N -3.55 1.17 -0.05 2.53 2.88 -1.18 -4.98 113.62 110.44 2c34 n SER 63 Ca 0.13 -0.47 -0.06 0.00 -1.33 0.00 0.00 58.87 57.14 2c34 n SER 63 Cb 0.51 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.95 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 -0.87 1.32 -0.00 -3.46 2.88 -1.26 -4.77 113.62 107.46 2c34 n SER 64 Ca 0.00 0.22 -0.13 0.00 -1.33 0.00 0.00 58.87 57.63 2c34 n SER 64 Cb 0.00 -0.61 -0.09 0.00 -0.75 0.00 0.00 64.21 62.76 2c34 n SER 64 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 2c34 h THR 65 N -0.62 1.31 -0.69 2.46 2.02 -2.01 -3.45 112.91 111.92 2c34 h THR 65 Ca 0.00 -0.90 0.00 0.00 0.77 0.00 0.00 66.41 66.28 2c34 h THR 65 Cb 0.62 1.92 0.00 0.00 -1.74 0.00 0.00 68.15 68.95 2c34 h THR 65 CO 0.00 0.23 0.00 -2.65 0.37 0.00 0.00 175.52 173.47 2c34 n PRO 66 N -4.90 0.90 -0.43 6.66 -0.02 -1.26 -5.03 135.00 130.91 2c34 n PRO 66 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.40 2c34 n PRO 66 Cb 0.20 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.68 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 -0.08 0.00 -3.63 -0.52 2.81 -1.26 -4.79 117.12 109.65 2c34 n MET 67 Ca 0.00 -0.67 -0.36 0.00 -1.81 0.00 0.00 57.70 54.86 2c34 n MET 67 Cb 0.00 -0.36 -0.06 0.00 -0.71 0.00 0.00 33.22 32.10 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 0.00 5.18 0.00 2.03 0.11 -1.26 -4.96 120.40 121.50 2c34 s VAL 68 Ca 0.00 0.50 0.00 0.00 -2.93 0.00 0.00 61.98 59.55 2c34 s VAL 68 Cb 0.00 -3.61 0.00 0.00 -1.53 0.00 0.00 36.38 31.24 2c34 s VAL 68 CO 0.00 0.46 0.00 0.61 -3.33 0.00 0.00 175.10 172.84 2c34 n GLY 69 N 1.45 3.86 0.23 6.54 0.00 -1.26 -3.11 105.19 112.90 2c34 n GLY 69 Ca -0.13 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.53 2c34 n GLY 69 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2c34 n VAL 70 N -0.23 0.00 0.00 1.61 3.14 -0.04 -4.31 118.33 118.50 2c34 n VAL 70 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2c34 n VAL 70 Cb 0.00 0.19 0.00 0.00 -1.06 0.00 0.00 33.84 32.97 2c34 n VAL 70 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2c34 n GLY 71 N 0.00 -0.44 0.00 7.55 0.00 0.25 -4.94 105.19 107.60 2c34 n GLY 71 Ca 0.00 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.36 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 1.67 0.00 -0.02 0.00 0.11 -4.29 105.19 102.66 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 -0.73 0.00 -3.67 -0.61 -5.35 0.13 -4.15 119.36 104.97 2c34 n ILE 73 Ca 0.00 0.00 -0.28 0.00 -0.27 0.00 0.00 62.75 62.20 2c34 n ILE 73 Cb 0.00 0.00 -0.16 0.00 -1.74 0.00 0.00 39.64 37.74 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 -2.13 0.89 -0.55 4.28 1.51 -0.65 -2.40 117.35 118.30 2c34 s TYR 74 Ca 0.00 -0.96 -0.22 0.00 -1.01 0.00 0.00 57.07 54.88 2c34 s TYR 74 Cb 0.00 -1.09 0.06 0.00 -0.11 0.00 0.00 41.96 40.81 2c34 s TYR 74 CO 0.00 -0.70 0.80 0.08 -1.11 0.00 0.00 175.55 174.62 2c34 s VAL 75 N 1.90 4.60 -0.24 0.71 1.01 -0.98 -2.25 120.40 125.15 2c34 s VAL 75 Ca 0.04 -0.19 -0.07 0.00 0.00 0.00 0.00 61.98 61.76 2c34 s VAL 75 Cb -0.17 -4.46 -0.03 0.00 0.00 0.00 0.00 36.38 31.73 2c34 s VAL 75 CO -0.18 -1.03 0.05 -0.69 0.00 0.00 0.00 175.10 173.25 2c34 s VAL 76 N 3.35 4.17 -0.43 2.92 1.01 -1.01 -0.19 120.40 130.22 2c34 s VAL 76 Ca 0.22 -0.22 -0.05 0.00 0.00 0.00 0.00 61.98 61.93 2c34 s VAL 76 Cb -0.16 -2.94 0.11 0.00 0.00 0.00 0.00 36.38 33.38 2c34 s VAL 76 CO 0.14 0.35 0.25 -0.76 0.00 0.00 0.00 175.10 175.09 2c34 s LEU 77 N 1.58 5.39 -0.55 3.92 1.43 -0.68 -1.56 118.68 128.22 2c34 s LEU 77 Ca 0.06 -2.01 -0.19 0.00 -1.03 0.00 0.00 54.13 50.97 2c34 s LEU 77 Cb -0.15 -1.89 0.08 0.00 0.03 0.00 0.00 46.19 44.27 2c34 s LEU 77 CO 0.03 -0.59 0.65 -0.69 0.23 0.00 0.00 176.35 175.98 2c34 s VAL 78 N 1.19 4.86 -0.45 -1.59 1.01 -1.01 0.60 120.40 125.01 2c34 s VAL 78 Ca 0.08 -0.77 -0.12 0.00 0.00 0.00 0.00 61.98 61.17 2c34 s VAL 78 Cb -0.24 -4.39 0.09 0.00 0.00 0.00 0.00 36.38 31.84 2c34 s VAL 78 CO -0.03 -0.95 0.33 -0.54 0.00 0.00 0.00 175.10 173.90 2c34 s LYS 79 N 2.61 2.73 -0.74 2.72 1.02 0.25 -2.30 119.74 126.03 2c34 s LYS 79 Ca 0.13 -1.48 -0.26 0.00 0.02 0.00 0.00 55.97 54.37 2c34 s LYS 79 Cb -0.22 -3.94 -0.15 0.00 -0.52 0.00 0.00 37.83 32.99 2c34 s LYS 79 CO 0.09 -1.03 2.49 -2.30 -0.92 0.00 0.00 175.35 173.68 2c34 n PRO 80 N 5.03 0.54 -0.10 -1.68 -0.02 -1.26 -0.02 135.00 137.48 2c34 n PRO 80 Ca -0.11 -0.10 -0.13 0.00 -2.02 0.00 0.00 63.50 61.14 2c34 n PRO 80 Cb 0.43 -2.61 -0.04 0.00 -0.02 0.00 0.00 33.50 31.26 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 15.53 0.78 -6.00 -0.52 3.08 -1.55 -0.40 114.38 125.30 2c34 h ARG 81 Ca -0.12 -0.42 -0.58 0.00 0.07 0.00 0.00 59.98 58.93 2c34 h ARG 81 Cb 1.24 0.02 -0.10 0.00 0.08 0.00 0.00 29.97 31.20 2c34 h ARG 81 CO 1.26 1.04 -0.60 0.15 -1.07 0.00 0.00 179.97 180.76 2c34 s LYS 82 N -4.37 2.12 -0.29 0.04 1.02 -1.10 -4.91 119.74 112.25 2c34 s LYS 82 Ca -0.12 -1.75 -0.11 0.00 0.02 0.00 0.00 55.97 54.02 2c34 s LYS 82 Cb 0.09 -1.95 -0.04 0.00 -0.52 0.00 0.00 37.83 35.41 2c34 s LYS 82 CO 0.85 0.11 0.18 1.03 -0.92 0.00 0.00 175.35 176.60 2c34 s ARG 83 N -3.74 3.83 0.00 1.68 0.52 -1.26 -4.92 118.95 115.06 2c34 s ARG 83 Ca 0.36 -0.40 0.00 0.00 -0.52 0.00 0.00 55.73 55.17 2c34 s ARG 83 Cb 0.00 -3.64 0.00 0.00 0.52 0.00 0.00 34.95 31.84 2c34 s ARG 83 CO 0.20 -0.23 0.00 0.41 0.02 0.00 0.00 175.30 175.70 2c34 n GLY 84 N 5.05 -0.27 3.48 -3.53 0.00 -0.12 -4.96 105.19 104.85 2c34 n GLY 84 Ca -0.14 -0.94 -0.43 0.00 0.00 0.00 0.00 46.02 44.51 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 -3.96 2.67 0.35 1.61 2.46 -1.26 0.24 115.29 117.41 2c34 s HIS 85 Ca 0.00 -0.35 0.09 0.00 0.47 0.00 0.00 55.06 55.27 2c34 s HIS 85 Cb 0.00 -4.25 -0.06 0.00 -0.13 0.00 0.00 32.58 28.14 2c34 s HIS 85 CO 0.00 -1.60 0.00 -1.01 -2.47 0.00 0.00 174.74 169.66 2c34 s HIS 86 N 4.18 2.52 -0.08 3.88 3.76 -0.63 -4.96 115.29 123.95 2c34 s HIS 86 Ca 0.26 -0.49 -0.30 0.00 -0.15 0.00 0.00 55.06 54.38 2c34 s HIS 86 Cb -0.15 -1.53 0.07 0.00 1.11 0.00 0.00 32.58 32.08 2c34 s HIS 86 CO 0.13 0.47 0.68 0.99 -0.85 0.00 0.00 174.74 176.17 2c34 s THR 87 N -2.56 0.00 -0.54 1.30 2.01 -1.26 -1.44 115.64 113.15 2c34 s THR 87 Ca 0.35 -0.01 -0.01 0.00 0.31 0.00 0.00 61.69 62.33 2c34 s THR 87 Cb 0.02 -0.99 0.14 0.00 0.01 0.00 0.00 72.50 71.67 2c34 s THR 87 CO 0.19 -0.00 0.32 -0.22 -0.69 0.00 0.00 174.62 174.22 2c34 s LEU 88 N -0.98 5.04 -0.75 4.42 2.96 0.76 -4.91 118.68 125.22 2c34 s LEU 88 Ca -0.10 -2.64 -0.26 0.00 -0.22 0.00 0.00 54.13 50.91 2c34 s LEU 88 Cb -0.01 -1.79 0.02 0.00 0.50 0.00 0.00 46.19 44.91 2c34 s LEU 88 CO 0.09 -0.39 1.47 -1.61 -1.32 0.00 0.00 176.35 174.59 2c34 s GLU 89 N 0.25 3.08 -0.16 1.98 2.02 -1.26 0.00 118.70 124.61 2c34 s GLU 89 Ca 0.14 -0.16 -0.05 0.00 0.02 0.00 0.00 54.97 54.93 2c34 s GLU 89 Cb -0.22 -4.42 -0.03 0.00 0.10 0.00 0.00 34.13 29.56 2c34 s GLU 89 CO -0.03 -2.36 -0.01 -0.51 0.02 0.00 0.00 175.26 172.37 2c34 s LEU 90 N 6.64 3.40 0.08 1.80 1.43 -0.56 0.29 118.68 131.75 2c34 s LEU 90 Ca 0.46 -0.07 0.02 0.00 -1.03 0.00 0.00 54.13 53.51 2c34 s LEU 90 Cb -0.08 -1.83 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 2c34 s LEU 90 CO 0.12 0.18 -0.07 0.54 0.23 0.00 0.00 176.35 177.35 2c34 s VAL 91 N 0.31 0.66 -0.93 -1.59 0.11 0.04 -0.21 120.40 118.80 2c34 s VAL 91 Ca -0.02 -1.61 -0.12 0.00 -2.93 0.00 0.00 61.98 57.30 2c34 s VAL 91 Cb -0.14 -1.27 0.24 0.00 -1.53 0.00 0.00 36.38 33.68 2c34 s VAL 91 CO 0.02 -0.67 0.89 -0.47 -3.33 0.00 0.00 175.10 171.54 2c34 s TYR 92 N -2.73 3.93 0.40 1.54 5.04 -0.99 -2.45 117.35 122.09 2c34 s TYR 92 Ca 0.03 -2.23 0.07 0.00 -2.44 0.00 0.00 57.07 52.51 2c34 s TYR 92 Cb -0.01 -3.83 -0.08 0.00 0.35 0.00 0.00 41.96 38.39 2c34 s TYR 92 CO -0.03 -0.98 -0.00 -0.08 -1.34 0.00 0.00 175.55 173.12 2c34 s THR 93 N -0.29 2.00 -0.69 4.34 -1.32 -0.41 -3.98 115.64 115.28 2c34 s THR 93 Ca 0.22 -2.03 -0.15 0.00 -1.21 0.00 0.00 61.69 58.53 2c34 s THR 93 Cb -0.10 -2.94 0.18 0.00 -1.51 0.00 0.00 72.50 68.12 2c34 s THR 93 CO -0.09 -0.03 0.64 -0.13 -2.21 0.00 0.00 174.62 172.80 2c34 s ARG 94 N -3.70 3.30 0.44 7.08 0.52 -1.19 0.21 118.95 125.61 2c34 s ARG 94 Ca 0.35 -2.10 0.31 0.00 -0.52 0.00 0.00 55.73 53.76 2c34 s ARG 94 Cb 0.09 -4.36 1.43 0.00 0.52 0.00 0.00 34.95 32.63 2c34 s ARG 94 CO 0.18 -1.31 1.63 -1.35 0.02 0.00 0.00 175.30 174.46 2c34 h PRO 95 N 8.31 0.08 -0.28 3.54 0.11 -1.87 0.47 132.00 142.37 2c34 h PRO 95 Ca -0.09 -0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.93 2c34 h PRO 95 Cb 1.07 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 2c34 h PRO 95 CO 0.89 0.05 -0.15 0.74 -0.21 0.00 0.00 178.00 179.32 2c34 h PHE 96 N 0.09 0.69 0.00 0.65 -1.00 -1.92 -3.41 116.94 112.03 2c34 h PHE 96 Ca 0.82 -0.18 0.00 0.00 2.81 0.00 0.00 57.97 61.42 2c34 h PHE 96 Cb 2.60 -0.16 0.00 0.00 3.61 0.00 0.00 35.95 42.00 2c34 h PHE 96 CO -0.00 0.84 0.00 0.39 -1.61 0.00 0.00 178.31 177.93 2c34 n GLU 97 N -4.42 0.00 0.00 1.51 -0.58 0.14 -5.14 120.64 112.15 2c34 n GLU 97 Ca -0.04 0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.72 2c34 n GLU 97 Cb 0.37 -0.19 0.00 0.00 -0.57 0.00 0.00 31.44 31.05 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 2.44 -0.42 3.89 0.62 0.00 0.30 -5.01 105.19 107.01 2c34 n GLY 98 Ca 0.00 -1.10 -0.31 0.00 0.00 0.00 0.00 46.02 44.61 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 5.00 0.10 -0.61 1.01 -1.26 -3.17 121.20 120.27 2c34 s ILE 99 Ca 0.00 0.27 -0.03 0.00 0.00 0.00 0.00 60.65 60.90 2c34 s ILE 99 Cb 0.00 -3.65 -0.03 0.00 0.01 0.00 0.00 42.46 38.79 2c34 s ILE 99 CO 0.00 -0.12 0.06 -0.54 0.00 0.00 0.00 174.94 174.34 2c34 s LYS 100 N -2.99 0.84 0.16 2.79 1.02 -1.26 -5.05 119.74 115.25 2c34 s LYS 100 Ca 0.45 -1.30 -0.10 0.00 0.02 0.00 0.00 55.97 55.04 2c34 s LYS 100 Cb -0.11 0.26 0.02 0.00 -0.52 0.00 0.00 37.83 37.47 2c34 s LYS 100 CO 0.24 -0.23 1.57 -1.00 -0.92 0.00 0.00 175.35 175.02 2c34 h PRO 101 N 2.91 1.01 0.00 -1.68 0.13 -1.99 -2.83 132.00 129.56 2c34 h PRO 101 Ca -0.34 -0.40 -0.02 0.00 -0.87 0.00 0.00 66.00 64.37 2c34 h PRO 101 Cb 1.18 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 32.26 2c34 h PRO 101 CO 0.60 1.08 -0.08 1.05 -0.23 0.00 0.00 178.00 180.42 2c34 h GLU 102 N 0.88 0.00 -6.84 0.86 4.11 -1.99 -3.44 114.58 108.16 2c34 h GLU 102 Ca 0.13 0.00 -0.57 0.00 0.07 0.00 0.00 59.36 58.99 2c34 h GLU 102 Cb 0.72 0.00 0.16 0.00 0.50 0.00 0.00 28.75 30.13 2c34 h GLU 102 CO 0.06 0.08 0.18 0.09 0.07 0.00 0.00 179.01 179.48 2c34 n ASN 103 N -4.16 1.00 -4.55 3.06 5.03 -1.07 -4.93 115.26 109.63 2c34 n ASN 103 Ca -0.03 0.84 -0.32 0.00 0.87 0.00 0.00 54.58 55.95 2c34 n ASN 103 Cb 0.17 -1.40 0.16 0.00 -1.02 0.00 0.00 39.78 37.68 2c34 n ASN 103 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2c34 n GLU 104 N -0.92 -0.53 -4.31 3.52 4.71 -1.26 -4.82 120.64 117.04 2c34 n GLU 104 Ca 0.13 -0.10 -0.17 0.00 -0.01 0.00 0.00 57.16 57.01 2c34 n GLU 104 Cb 0.46 -2.15 -0.10 0.00 -1.01 0.00 0.00 31.44 28.64 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 -4.22 1.26 -0.33 3.49 6.06 -1.26 -2.33 118.95 121.62 2c34 s ARG 105 Ca 0.63 -1.60 -0.02 0.00 -2.50 0.00 0.00 55.73 52.24 2c34 s ARG 105 Cb -0.22 -0.73 0.28 0.00 0.06 0.00 0.00 34.95 34.33 2c34 s ARG 105 CO 0.62 0.01 1.24 0.98 -2.50 0.00 0.00 175.30 175.65 2c34 n TYR 106 N -0.35 -0.58 -3.00 5.12 9.36 0.71 -4.54 117.16 123.88 2c34 n TYR 106 Ca -0.07 -0.72 -0.44 0.00 3.32 0.00 0.00 57.90 59.98 2c34 n TYR 106 Cb 0.62 1.10 -0.03 0.00 -0.63 0.00 0.00 39.34 40.41 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 0.12 4.86 -0.80 2.97 2.01 -1.25 -1.50 115.64 122.04 2c34 s THR 107 Ca 0.26 -1.61 -0.25 0.00 0.31 0.00 0.00 61.69 60.40 2c34 s THR 107 Cb 0.21 -4.70 -0.02 0.00 0.01 0.00 0.00 72.50 68.00 2c34 s THR 107 CO -0.09 -1.40 1.82 -0.22 -0.69 0.00 0.00 174.62 174.04 2c34 s LEU 108 N 2.35 3.24 0.32 4.42 2.96 0.10 -2.20 118.68 129.87 2c34 s LEU 108 Ca 0.28 -0.36 -0.27 0.00 -0.22 0.00 0.00 54.13 53.56 2c34 s LEU 108 Cb -0.08 -2.55 -0.09 0.00 0.50 0.00 0.00 46.19 43.97 2c34 s LEU 108 CO -0.07 -2.43 0.99 -1.00 -1.32 0.00 0.00 176.35 172.51 2c34 s HIS 109 N 8.93 3.64 -0.25 5.38 3.76 -0.31 -0.17 115.29 136.27 2c34 s HIS 109 Ca 0.64 1.77 -0.02 0.00 -0.15 0.00 0.00 55.06 57.30 2c34 s HIS 109 Cb -0.08 -3.03 0.11 0.00 1.11 0.00 0.00 32.58 30.70 2c34 s HIS 109 CO 0.07 -0.02 0.25 -0.51 -0.85 0.00 0.00 174.74 173.68 2c34 s LEU 110 N -1.93 -0.13 -1.36 0.89 1.43 -0.52 -2.20 118.68 114.85 2c34 s LEU 110 Ca 0.49 -0.54 -0.15 0.00 -1.03 0.00 0.00 54.13 52.91 2c34 s LEU 110 Cb -0.22 0.40 -0.00 0.00 0.03 0.00 0.00 46.19 46.40 2c34 s LEU 110 CO 0.28 -0.36 2.25 -3.20 0.23 0.00 0.00 176.35 175.55 2c34 n ASN 111 N 5.31 4.13 -4.63 2.29 5.15 0.14 -1.61 115.26 126.04 2c34 n ASN 111 Ca -0.04 -2.78 -0.53 0.00 -0.60 0.00 0.00 54.58 50.63 2c34 n ASN 111 Cb 0.47 -1.56 -0.06 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 5.08 0.09 1.22 3.44 0.31 0.14 -3.69 118.33 124.91 2c34 n VAL 112 Ca 0.54 -0.02 0.10 0.00 -0.01 0.00 0.00 64.34 64.95 2c34 n VAL 112 Cb 0.37 -0.98 0.58 0.00 -0.91 0.00 0.00 33.84 32.90 2c34 n VAL 112 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80