#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dro h SER 2 N 0.00 0.00 -4.88 1.61 0.02 -2.10 -3.48 113.55 104.72 1dro h SER 2 Ca 0.00 -0.07 -0.38 0.00 -0.84 0.00 0.00 61.79 60.50 1dro h SER 2 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1dro h SER 2 CO 0.00 0.79 -0.57 0.61 -1.14 0.00 0.00 176.83 176.52 1dro n GLY 3 N 1.63 -0.50 0.05 -3.77 0.00 -1.26 -4.88 105.19 96.45 1dro n GLY 3 Ca -0.08 0.10 -0.01 0.00 0.00 0.00 0.00 46.02 46.03 1dro n GLY 3 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1dro h THR 4 N -1.10 0.00 0.00 2.61 2.02 -2.10 -3.49 112.91 110.86 1dro h THR 4 Ca -0.47 -0.88 0.00 0.00 0.77 0.00 0.00 66.41 65.83 1dro h THR 4 Cb 1.32 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 1dro h THR 4 CO 0.54 0.00 0.00 0.61 0.37 0.00 0.00 175.52 177.04 1dro n GLY 5 N 1.78 1.83 0.00 2.16 0.00 -1.26 -4.81 105.19 104.89 1dro n GLY 5 Ca -0.01 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1dro n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dro n ALA 6 N 9.82 0.00 0.01 4.61 0.00 -1.26 -5.03 120.51 128.66 1dro n ALA 6 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1dro n ALA 6 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1dro n ALA 6 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dro n GLY 7 N 3.71 -1.87 2.52 0.00 0.00 -1.26 -5.17 105.19 103.11 1dro n GLY 7 Ca 0.00 0.66 -0.17 0.00 0.00 0.00 0.00 46.02 46.50 1dro n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1dro n GLU 8 N -2.17 0.49 0.00 1.61 1.02 -1.26 -5.14 120.64 115.19 1dro n GLU 8 Ca 0.00 -2.61 0.00 0.00 -0.02 0.00 0.00 57.16 54.53 1dro n GLU 8 Cb 0.00 1.76 0.00 0.00 -0.02 0.00 0.00 31.44 33.18 1dro n GLU 8 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1dro n GLY 9 N -0.29 -1.51 3.30 0.62 0.00 -1.26 -5.03 105.19 101.01 1dro n GLY 9 Ca 0.01 -0.04 -0.16 0.00 0.00 0.00 0.00 46.02 45.82 1dro n GLY 9 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1dro s HIS 10 N 0.00 1.46 -0.11 1.61 3.76 -1.13 -4.95 115.29 115.93 1dro s HIS 10 Ca 0.00 -0.75 -0.05 0.00 -0.15 0.00 0.00 55.06 54.11 1dro s HIS 10 Cb 0.00 -0.75 0.05 0.00 1.11 0.00 0.00 32.58 32.99 1dro s HIS 10 CO 0.00 0.13 0.24 -1.83 -0.85 0.00 0.00 174.74 172.42 1dro s GLU 11 N -3.75 0.17 0.00 1.40 -1.05 -1.26 -2.54 118.70 111.68 1dro s GLU 11 Ca 0.21 0.57 0.00 0.00 -0.15 0.00 0.00 54.97 55.60 1dro s GLU 11 Cb 0.03 -0.11 0.00 0.00 -0.44 0.00 0.00 34.13 33.60 1dro s GLU 11 CO 0.04 -0.20 0.00 0.41 0.95 0.00 0.00 175.26 176.46 1dro n GLY 12 N 4.55 2.41 2.96 -3.83 0.00 -1.06 -4.95 105.19 105.27 1dro n GLY 12 Ca -0.20 -1.00 -0.30 0.00 0.00 0.00 0.00 46.02 44.52 1dro n GLY 12 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1dro s TYR 13 N -7.08 2.23 0.00 1.61 6.14 -1.26 -1.75 117.35 117.24 1dro s TYR 13 Ca 0.00 -1.48 0.00 0.00 0.64 0.00 0.00 57.07 56.23 1dro s TYR 13 Cb 0.00 -1.55 0.00 0.00 0.42 0.00 0.00 41.96 40.83 1dro s TYR 13 CO 0.00 -0.71 0.00 1.33 0.64 0.00 0.00 175.55 176.81 1dro n VAL 14 N 4.73 0.00 -3.43 3.14 0.24 -1.03 -4.67 118.33 117.32 1dro n VAL 14 Ca -0.14 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.73 1dro n VAL 14 Cb 0.47 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.81 1dro n VAL 14 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1dro s THR 15 N -2.55 5.42 0.67 3.34 2.01 -0.92 -2.44 115.64 121.17 1dro s THR 15 Ca 0.00 -3.27 -0.03 0.00 0.31 0.00 0.00 61.69 58.71 1dro s THR 15 Cb 0.00 -4.30 0.14 0.00 0.01 0.00 0.00 72.50 68.34 1dro s THR 15 CO 0.00 -1.11 0.92 -1.14 -0.69 0.00 0.00 174.62 172.60 1dro n ARG 16 N 2.97 -0.21 -0.01 4.92 0.63 -0.47 -2.31 116.66 122.19 1dro n ARG 16 Ca 0.20 -2.26 0.00 0.00 -0.92 0.00 0.00 57.85 54.87 1dro n ARG 16 Cb 0.40 -0.68 0.00 0.00 0.45 0.00 0.00 32.46 32.63 1dro n ARG 16 CO 0.00 0.00 0.00 0.36 -2.51 0.00 0.00 177.63 175.48 1dro n LYS 17 N -2.75 3.78 0.00 -0.14 0.00 -1.17 -2.18 118.16 115.71 1dro n LYS 17 Ca 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.45 1dro n LYS 17 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.54 1dro n LYS 17 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.40 175.01 1dro n HIS 18 N -0.00 0.00 -0.92 5.58 1.44 -1.26 -4.87 115.22 115.19 1dro n HIS 18 Ca 0.00 0.00 -0.29 0.00 -2.01 0.00 0.00 57.72 55.42 1dro n HIS 18 Cb 0.00 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.12 1dro n HIS 18 CO 0.00 0.00 0.00 -0.85 -2.81 0.00 0.00 176.34 172.68 1dro n GLU 19 N -0.09 0.00 -3.97 -1.40 0.28 0.02 -4.59 120.64 110.89 1dro n GLU 19 Ca 0.00 0.00 -0.09 0.00 -0.16 0.00 0.00 57.16 56.91 1dro n GLU 19 Cb 0.00 -0.76 -0.10 0.00 1.43 0.00 0.00 31.44 32.01 1dro n GLU 19 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 1dro s TRP 20 N -1.52 0.26 0.43 -1.84 0.51 -1.24 -4.80 118.94 110.74 1dro s TRP 20 Ca 0.41 -0.58 0.06 0.00 -2.12 0.00 0.00 56.10 53.87 1dro s TRP 20 Cb -0.34 -0.19 -0.07 0.00 -0.81 0.00 0.00 33.47 32.07 1dro s TRP 20 CO 0.53 -0.31 0.01 -0.51 -0.51 0.00 0.00 176.95 176.15 1dro s ASP 21 N -2.03 3.90 -0.08 2.95 1.01 -1.26 -4.44 116.67 116.72 1dro s ASP 21 Ca -0.07 -1.43 -0.00 0.00 0.71 0.00 0.00 52.55 51.76 1dro s ASP 21 Cb -0.02 -0.21 -0.05 0.00 1.01 0.00 0.00 42.92 43.65 1dro s ASP 21 CO -0.04 -0.53 -0.08 -0.24 0.21 0.00 0.00 175.17 174.49 1dro n SER 22 N -1.02 2.83 -4.56 0.27 2.88 -1.26 -4.93 113.62 107.83 1dro n SER 22 Ca -0.08 -0.01 -0.43 0.00 -1.33 0.00 0.00 58.87 57.02 1dro n SER 22 Cb 0.67 -0.15 -0.03 0.00 -0.75 0.00 0.00 64.21 63.95 1dro n SER 22 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1dro s THR 23 N -2.16 4.22 -0.30 2.46 -4.23 -1.26 -4.93 115.64 109.44 1dro s THR 23 Ca -0.11 0.65 -0.28 0.00 -1.18 0.00 0.00 61.69 60.78 1dro s THR 23 Cb 0.03 -4.62 0.20 0.00 1.34 0.00 0.00 72.50 69.45 1dro s THR 23 CO 0.17 -1.18 1.42 0.42 -0.54 0.00 0.00 174.62 174.91 1dro s THR 24 N 4.40 0.00 0.08 3.99 -4.23 -1.26 -5.04 115.64 113.58 1dro s THR 24 Ca 0.38 0.00 -0.32 0.00 -1.18 0.00 0.00 61.69 60.57 1dro s THR 24 Cb -0.10 -1.00 -0.17 0.00 1.34 0.00 0.00 72.50 72.57 1dro s THR 24 CO 0.23 0.00 1.63 0.07 -0.54 0.00 0.00 174.62 176.02 1dro h LYS 25 N 2.30 -0.76 0.00 3.99 2.10 -2.03 -3.46 116.57 118.70 1dro h LYS 25 Ca -0.13 0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.57 1dro h LYS 25 Cb 1.19 0.17 0.00 0.00 -0.90 0.00 0.00 32.23 32.70 1dro h LYS 25 CO 0.20 -0.51 0.00 1.17 -2.00 0.00 0.00 179.45 178.32 1dro n LYS 26 N -5.45 0.00 0.00 0.07 3.00 -1.26 -5.19 118.16 109.33 1dro n LYS 26 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.19 1dro n LYS 26 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.37 1dro n LYS 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1dro n ALA 27 N 0.00 0.00 -2.01 3.14 0.00 -1.26 -5.11 120.51 115.27 1dro n ALA 27 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 1dro n ALA 27 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 1dro n ALA 27 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1dro n SER 28 N 0.00 -4.00 -0.78 0.00 7.64 -1.26 -4.94 113.62 110.27 1dro n SER 28 Ca 0.00 0.61 0.03 0.00 1.01 0.00 0.00 58.87 60.53 1dro n SER 28 Cb 0.00 -2.87 -0.01 0.00 -1.01 0.00 0.00 64.21 60.32 1dro n SER 28 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1dro n ASN 29 N 0.38 -4.68 -3.84 6.43 5.03 -1.26 -4.58 115.26 112.74 1dro n ASN 29 Ca -0.03 0.24 -0.28 0.00 0.87 0.00 0.00 54.58 55.38 1dro n ASN 29 Cb 0.05 -0.69 -0.12 0.00 -1.02 0.00 0.00 39.78 38.00 1dro n ASN 29 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1dro s ARG 30 N -0.41 2.12 3.29 3.52 0.52 -1.26 -5.08 118.95 121.65 1dro s ARG 30 Ca 0.00 -2.99 0.00 0.00 -0.52 0.00 0.00 55.73 52.22 1dro s ARG 30 Cb 0.00 -3.10 0.00 0.00 0.52 0.00 0.00 34.95 32.37 1dro s ARG 30 CO 0.00 -1.26 0.00 0.43 0.02 0.00 0.00 175.30 174.49 1dro n SER 31 N 2.38 0.00 -4.73 0.23 7.64 -1.26 -4.60 113.62 113.27 1dro n SER 31 Ca 0.18 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.76 1dro n SER 31 Cb 0.36 0.00 0.13 0.00 -1.01 0.00 0.00 64.21 63.69 1dro n SER 31 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1dro s TRP 32 N 0.00 2.40 0.01 1.43 0.52 -1.26 -4.99 118.94 117.04 1dro s TRP 32 Ca 0.00 1.24 0.01 0.00 0.02 0.00 0.00 56.10 57.36 1dro s TRP 32 Cb 0.00 -3.16 -0.01 0.00 -1.15 0.00 0.00 33.47 29.16 1dro s TRP 32 CO 0.00 -2.30 -0.03 0.16 0.02 0.00 0.00 176.95 174.81 1dro s ASP 33 N -3.50 0.27 -0.09 2.95 -4.77 -0.92 -5.01 116.67 105.60 1dro s ASP 33 Ca 0.63 -0.14 -0.25 0.00 -3.30 0.00 0.00 52.55 49.49 1dro s ASP 33 Cb -0.17 -0.00 -0.03 0.00 -1.09 0.00 0.00 42.92 41.63 1dro s ASP 33 CO 0.56 -0.04 0.78 -0.75 0.70 0.00 0.00 175.17 176.42 1dro s LYS 34 N -0.37 4.41 0.22 2.11 2.20 -1.26 -1.37 119.74 125.68 1dro s LYS 34 Ca -0.03 1.00 -0.21 0.00 -0.36 0.00 0.00 55.97 56.37 1dro s LYS 34 Cb -0.03 -3.49 0.07 0.00 -1.51 0.00 0.00 37.83 32.87 1dro s LYS 34 CO -0.00 -0.07 0.97 0.14 -0.36 0.00 0.00 175.35 176.03 1dro s VAL 35 N 1.24 0.00 -0.08 4.02 -7.23 -1.02 -4.96 120.40 112.36 1dro s VAL 35 Ca 0.40 -0.69 -0.02 0.00 -1.81 0.00 0.00 61.98 59.85 1dro s VAL 35 Cb -0.18 -2.73 -0.03 0.00 0.56 0.00 0.00 36.38 34.00 1dro s VAL 35 CO 0.18 0.00 0.03 -0.47 -0.31 0.00 0.00 175.10 174.53 1dro s TYR 36 N -2.41 3.24 0.12 2.82 6.14 -0.94 -2.46 117.35 123.86 1dro s TYR 36 Ca 0.19 0.25 -0.02 0.00 0.64 0.00 0.00 57.07 58.13 1dro s TYR 36 Cb -0.03 -1.80 -0.04 0.00 0.42 0.00 0.00 41.96 40.51 1dro s TYR 36 CO 0.06 0.52 0.06 -1.64 0.64 0.00 0.00 175.55 175.19 1dro s MET 37 N -1.00 0.90 -0.44 4.97 -1.94 -0.72 -1.94 119.30 119.13 1dro s MET 37 Ca 0.15 -1.40 0.06 0.00 -1.71 0.00 0.00 55.69 52.79 1dro s MET 37 Cb -0.11 0.25 0.22 0.00 2.01 0.00 0.00 34.83 37.19 1dro s MET 37 CO 0.04 -0.25 0.63 0.00 -0.01 0.00 0.00 175.02 175.42 1dro n ALA 38 N -0.08 0.68 -3.01 3.03 0.00 -0.33 -2.56 120.51 118.24 1dro n ALA 38 Ca -0.07 -2.37 -0.13 0.00 0.00 0.00 0.00 53.44 50.88 1dro n ALA 38 Cb 0.63 -1.07 -0.04 0.00 0.00 0.00 0.00 19.45 18.98 1dro n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dro s ALA 39 N -0.05 0.44 0.00 0.00 0.00 -1.05 -1.98 121.76 119.12 1dro s ALA 39 Ca 0.33 -1.33 0.00 0.00 0.00 0.00 0.00 51.96 50.96 1dro s ALA 39 Cb 0.13 1.10 0.00 0.00 0.00 0.00 0.00 23.12 24.35 1dro s ALA 39 CO -0.16 -0.82 0.00 0.36 0.00 0.00 0.00 175.76 175.15 1dro n LYS 40 N -0.52 0.00 0.00 0.00 0.00 -1.11 -2.84 118.16 113.70 1dro n LYS 40 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1dro n LYS 40 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.65 1dro n LYS 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1dro n ALA 41 N -1.11 0.00 -0.30 0.58 0.00 -1.26 -4.70 120.51 113.71 1dro n ALA 41 Ca 0.00 0.00 0.23 0.00 0.00 0.00 0.00 53.44 53.67 1dro n ALA 41 Cb 0.00 0.00 0.37 0.00 0.00 0.00 0.00 19.45 19.82 1dro n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dro n GLY 42 N -0.03 -0.45 3.82 0.00 0.00 0.18 -1.31 105.19 107.40 1dro n GLY 42 Ca 0.00 0.34 -0.08 0.00 0.00 0.00 0.00 46.02 46.28 1dro n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1dro s ARG 43 N -4.05 2.07 0.01 1.61 0.52 -1.26 0.22 118.95 118.07 1dro s ARG 43 Ca -0.03 -1.30 -0.02 0.00 -0.52 0.00 0.00 55.73 53.86 1dro s ARG 43 Cb 0.13 0.60 -0.01 0.00 0.52 0.00 0.00 34.95 36.19 1dro s ARG 43 CO 0.41 -0.97 0.02 0.42 0.02 0.00 0.00 175.30 175.20 1dro s ILE 44 N -2.60 0.09 -0.15 1.52 1.09 -0.80 -2.74 121.20 117.62 1dro s ILE 44 Ca 0.15 -0.77 -0.05 0.00 -1.10 0.00 0.00 60.65 58.88 1dro s ILE 44 Cb -0.05 -0.28 0.07 0.00 -1.06 0.00 0.00 42.46 41.14 1dro s ILE 44 CO 0.10 -0.42 0.30 -0.55 -0.10 0.00 0.00 174.94 174.26 1dro s SER 45 N -1.30 0.23 -0.01 3.58 0.15 -0.84 -2.60 113.70 112.91 1dro s SER 45 Ca -0.14 0.67 0.01 0.00 0.70 0.00 0.00 55.95 57.18 1dro s SER 45 Cb -0.09 0.84 -0.04 0.00 -1.71 0.00 0.00 66.02 65.03 1dro s SER 45 CO -0.00 -0.24 0.03 -0.36 1.20 0.00 0.00 173.24 173.87 1dro s PHE 46 N 2.46 3.16 -0.31 3.44 0.08 -1.10 -1.18 117.98 124.53 1dro s PHE 46 Ca 0.01 0.14 0.06 0.00 0.12 0.00 0.00 56.93 57.25 1dro s PHE 46 Cb -0.12 -1.70 0.20 0.00 -0.57 0.00 0.00 43.02 40.82 1dro s PHE 46 CO -0.09 0.50 0.61 1.52 -0.10 0.00 0.00 175.22 177.65 1dro s TYR 47 N -1.12 -1.82 0.33 0.36 1.13 -0.82 -4.70 117.35 110.72 1dro s TYR 47 Ca 0.21 0.94 0.10 0.00 -1.41 0.00 0.00 57.07 56.91 1dro s TYR 47 Cb -0.12 0.31 0.90 0.00 -1.10 0.00 0.00 41.96 41.96 1dro s TYR 47 CO 0.11 -1.08 1.74 -0.22 -2.51 0.00 0.00 175.55 173.59 1dro h LYS 48 N 7.82 0.56 0.00 -3.49 3.64 -1.85 -2.51 116.57 120.74 1dro h LYS 48 Ca -0.00 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.27 1dro h LYS 48 Cb 1.19 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.87 1dro h LYS 48 CO 0.14 0.37 0.04 -0.25 -2.27 0.00 0.00 179.45 177.48 1dro n ASP 49 N -4.85 -0.95 0.31 4.20 8.00 -1.26 -3.20 116.55 118.81 1dro n ASP 49 Ca 0.27 -1.87 0.21 0.00 0.71 0.00 0.00 54.79 54.10 1dro n ASP 49 Cb 0.75 1.64 1.10 0.00 -0.02 0.00 0.00 41.12 44.59 1dro n ASP 49 CO 0.00 0.00 0.00 0.06 -0.39 0.00 0.00 177.20 176.87 1dro h GLN 50 N 0.00 0.00 0.00 -1.24 3.07 -1.99 -3.39 115.11 111.56 1dro h GLN 50 Ca -0.15 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.59 1dro h GLN 50 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.17 1dro h GLN 50 CO 0.20 0.00 0.00 0.36 0.09 0.00 0.00 178.83 179.48 1dro n LYS 51 N -2.99 0.00 -0.06 0.06 2.85 -1.26 0.19 118.16 116.95 1dro n LYS 51 Ca -0.02 0.58 -0.13 0.00 -1.05 0.00 0.00 58.31 57.69 1dro n LYS 51 Cb 0.09 -0.89 -0.07 0.00 -0.65 0.00 0.00 35.03 33.52 1dro n LYS 51 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 177.40 178.13 1dro h GLY 52 N 0.00 0.39 -0.63 2.58 0.00 -1.76 -1.43 103.07 102.21 1dro h GLY 52 Ca 0.00 -0.38 0.37 0.00 0.00 0.00 0.00 47.33 47.32 1dro h GLY 52 CO 0.00 0.34 0.96 -0.97 0.00 0.00 0.00 176.54 176.88 1dro h TYR 53 N 0.01 0.00 0.01 5.60 -1.99 -1.31 1.06 116.97 120.34 1dro h TYR 53 Ca 0.03 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.74 1dro h TYR 53 Cb 0.63 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.36 1dro h TYR 53 CO 0.08 0.00 -0.08 -0.22 -0.00 0.00 0.00 178.16 177.93 1dro h LYS 54 N 0.00 0.05 0.00 4.88 3.64 0.31 -3.37 116.57 122.08 1dro h LYS 54 Ca 0.60 -0.06 -0.17 0.00 -1.27 0.00 0.00 60.65 59.75 1dro h LYS 54 Cb 2.52 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 34.33 1dro h LYS 54 CO -0.01 0.89 -1.34 0.45 -2.27 0.00 0.00 179.45 177.17 1dro n SER 55 N -4.62 1.90 -3.79 4.20 2.88 -0.56 -4.85 113.62 108.78 1dro n SER 55 Ca -0.10 0.43 -0.30 0.00 -1.33 0.00 0.00 58.87 57.57 1dro n SER 55 Cb 0.45 -0.84 -0.14 0.00 -0.75 0.00 0.00 64.21 62.93 1dro n SER 55 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 1dro s ASN 56 N -6.48 3.99 0.58 -3.46 -0.87 0.36 -5.00 114.94 104.05 1dro s ASN 56 Ca -0.28 -2.36 0.28 0.00 -1.57 0.00 0.00 52.86 48.93 1dro s ASN 56 Cb 0.07 -1.15 1.55 0.00 -0.02 0.00 0.00 41.25 41.70 1dro s ASN 56 CO 0.43 -0.32 2.03 -0.65 -2.57 0.00 0.00 177.10 176.02 1dro h PRO 57 N 7.17 0.00 0.13 -0.60 0.11 -1.67 0.62 132.00 137.77 1dro h PRO 57 Ca -0.06 0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.78 1dro h PRO 57 Cb 0.96 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1dro h PRO 57 CO 0.51 0.00 -1.26 1.05 -0.21 0.00 0.00 178.00 178.09 1dro h GLU 58 N 0.00 0.28 -3.55 1.05 9.09 -1.94 -3.40 114.58 116.12 1dro h GLU 58 Ca 0.15 -0.47 -0.74 0.00 0.05 0.00 0.00 59.36 58.34 1dro h GLU 58 Cb 0.74 0.18 -0.32 0.00 -1.65 0.00 0.00 28.75 27.70 1dro h GLU 58 CO -0.00 1.22 0.01 -0.51 0.05 0.00 0.00 179.01 179.78 1dro s LEU 59 N -7.15 5.94 0.00 3.06 1.43 0.21 -4.92 118.68 117.24 1dro s LEU 59 Ca -0.04 -3.26 0.00 0.00 -1.03 0.00 0.00 54.13 49.80 1dro s LEU 59 Cb 0.07 -2.03 0.00 0.00 0.03 0.00 0.00 46.19 44.26 1dro s LEU 59 CO 0.88 -0.34 0.00 0.35 0.23 0.00 0.00 176.35 177.48 1dro n THR 60 N 3.06 0.00 -1.51 5.49 -2.24 -1.21 -4.34 114.28 113.52 1dro n THR 60 Ca 0.17 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.52 1dro n THR 60 Cb 0.40 -0.55 -0.00 0.00 -2.10 0.00 0.00 70.33 68.07 1dro n THR 60 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1dro n PHE 61 N -0.60 0.27 0.17 4.78 7.35 -1.26 -4.48 117.46 123.69 1dro n PHE 61 Ca 0.00 0.66 0.06 0.00 -0.76 0.00 0.00 57.45 57.41 1dro n PHE 61 Cb 0.00 -2.10 0.32 0.00 0.35 0.00 0.00 39.48 38.06 1dro n PHE 61 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1dro h ARG 62 N 1.26 0.00 -2.51 -4.13 3.08 -1.99 0.65 114.38 110.75 1dro h ARG 62 Ca -0.40 0.00 -0.72 0.00 0.07 0.00 0.00 59.98 58.94 1dro h ARG 62 Cb 1.38 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 31.28 1dro h ARG 62 CO 0.55 0.00 2.04 0.41 -1.07 0.00 0.00 179.97 181.91 1dro n GLY 63 N -1.27 5.20 0.11 0.04 0.00 -1.26 -4.70 105.19 103.31 1dro n GLY 63 Ca -0.01 -2.08 0.02 0.00 0.00 0.00 0.00 46.02 43.95 1dro n GLY 63 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1dro h GLU 64 N 4.36 0.00 -4.22 1.61 -0.00 0.06 -3.40 114.58 112.99 1dro h GLU 64 Ca 0.65 0.00 -0.36 0.00 -0.00 0.00 0.00 59.36 59.65 1dro h GLU 64 Cb 0.35 0.00 0.18 0.00 -0.00 0.00 0.00 28.75 29.28 1dro h GLU 64 CO 1.38 0.31 -1.71 -2.30 -0.00 0.00 0.00 179.01 176.68 1dro n PRO 65 N -2.96 0.00 -4.06 1.06 -0.02 -1.26 -3.62 135.00 124.13 1dro n PRO 65 Ca -0.05 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.33 1dro n PRO 65 Cb 0.77 -0.70 -0.07 0.00 -0.02 0.00 0.00 33.50 33.47 1dro n PRO 65 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1dro s SER 66 N -0.70 0.02 0.26 2.55 1.04 -1.26 -2.69 113.70 112.92 1dro s SER 66 Ca 0.26 -1.07 -0.05 0.00 0.48 0.00 0.00 55.95 55.57 1dro s SER 66 Cb 0.01 0.48 -0.02 0.00 0.10 0.00 0.00 66.02 66.59 1dro s SER 66 CO 0.51 -0.98 0.36 -0.31 0.98 0.00 0.00 173.24 173.79 1dro s TYR 67 N -4.05 0.89 -0.41 5.02 1.51 -1.07 -4.81 117.35 114.42 1dro s TYR 67 Ca 0.27 -1.14 0.06 0.00 -1.01 0.00 0.00 57.07 55.24 1dro s TYR 67 Cb 0.03 -0.17 0.20 0.00 -0.11 0.00 0.00 41.96 41.91 1dro s TYR 67 CO 0.08 -0.92 0.42 -3.47 -1.11 0.00 0.00 175.55 170.55 1dro n ASP 68 N -0.70 -0.16 -3.80 2.29 2.03 -1.26 -1.90 116.55 113.05 1dro n ASP 68 Ca 0.01 -2.52 -0.31 0.00 0.52 0.00 0.00 54.79 52.49 1dro n ASP 68 Cb 0.63 -0.59 -0.08 0.00 -0.72 0.00 0.00 41.12 40.36 1dro n ASP 68 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1dro n LEU 69 N 2.25 3.92 -0.61 -2.67 4.32 0.13 -4.79 117.00 119.55 1dro n LEU 69 Ca 0.26 -5.28 0.03 0.00 -0.02 0.00 0.00 56.01 51.01 1dro n LEU 69 Cb 0.50 -0.87 0.11 0.00 -1.62 0.00 0.00 43.42 41.55 1dro n LEU 69 CO 0.12 1.81 0.54 0.00 -1.22 0.00 0.00 177.39 178.64 1dro n GLN 70 N 1.59 1.79 -0.10 3.23 6.02 -1.24 0.50 117.38 129.17 1dro n GLN 70 Ca 0.24 -0.90 -0.17 0.00 -0.01 0.00 0.00 57.00 56.16 1dro n GLN 70 Cb 0.37 -1.38 -0.13 0.00 1.02 0.00 0.00 30.24 30.13 1dro n GLN 70 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1dro n ASN 71 N 0.19 1.61 -4.29 1.08 3.02 -0.96 -3.33 115.26 112.58 1dro n ASN 71 Ca 0.08 -0.04 -0.34 0.00 -0.03 0.00 0.00 54.58 54.26 1dro n ASN 71 Cb 0.32 -0.22 0.09 0.00 -0.61 0.00 0.00 39.78 39.36 1dro n ASN 71 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1dro n ALA 72 N -3.10 -3.47 -2.16 5.41 0.00 -1.00 -4.69 120.51 111.50 1dro n ALA 72 Ca -0.40 -0.62 -0.22 0.00 0.00 0.00 0.00 53.44 52.20 1dro n ALA 72 Cb 1.03 -1.60 0.03 0.00 0.00 0.00 0.00 19.45 18.92 1dro n ALA 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dro s ALA 73 N -2.26 4.60 0.05 0.00 0.00 -0.08 -2.94 121.76 121.12 1dro s ALA 73 Ca 0.52 -1.82 0.03 0.00 0.00 0.00 0.00 51.96 50.69 1dro s ALA 73 Cb -0.21 -1.20 -0.03 0.00 0.00 0.00 0.00 23.12 21.69 1dro s ALA 73 CO 0.72 -0.69 -0.11 0.42 0.00 0.00 0.00 175.76 176.11 1dro s ILE 74 N -2.69 0.79 0.01 0.00 1.01 -1.26 -0.86 121.20 118.20 1dro s ILE 74 Ca 0.52 -1.13 -0.02 0.00 0.00 0.00 0.00 60.65 60.02 1dro s ILE 74 Cb -0.05 -0.80 0.01 0.00 0.01 0.00 0.00 42.46 41.63 1dro s ILE 74 CO 0.32 -0.28 0.08 -1.84 0.00 0.00 0.00 174.94 173.22 1dro n GLU 75 N 1.47 0.05 -4.51 2.79 0.00 0.10 -4.91 120.64 115.64 1dro n GLU 75 Ca -0.22 -0.11 -0.26 0.00 0.00 0.00 0.00 57.16 56.57 1dro n GLU 75 Cb 0.55 0.15 -0.10 0.00 0.00 0.00 0.00 31.44 32.04 1dro n GLU 75 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 1dro s ILE 76 N -2.54 2.27 0.71 3.84 1.09 -1.26 -2.13 121.20 123.18 1dro s ILE 76 Ca 0.02 -2.12 -0.15 0.00 -1.10 0.00 0.00 60.65 57.29 1dro s ILE 76 Cb -0.00 -2.73 0.03 0.00 -1.06 0.00 0.00 42.46 38.69 1dro s ILE 76 CO 0.00 -0.17 1.20 0.00 -0.10 0.00 0.00 174.94 175.87 1dro s ALA 77 N -2.61 2.20 0.00 9.38 0.00 -1.25 -4.91 121.76 124.56 1dro s ALA 77 Ca 0.33 0.85 0.00 0.00 0.00 0.00 0.00 51.96 53.15 1dro s ALA 77 Cb 0.03 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.70 1dro s ALA 77 CO 0.17 -1.75 0.00 0.45 0.00 0.00 0.00 175.76 174.64 1dro n SER 78 N -2.59 1.93 -3.55 0.00 2.88 -1.26 -4.82 113.62 106.22 1dro n SER 78 Ca 0.13 0.00 -0.40 0.00 -1.33 0.00 0.00 58.87 57.27 1dro n SER 78 Cb 0.50 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.98 1dro n SER 78 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1dro n ASP 79 N -2.33 7.14 0.00 -3.46 2.03 -1.26 -4.84 116.55 113.83 1dro n ASP 79 Ca 0.00 -3.70 0.00 0.00 0.52 0.00 0.00 54.79 51.61 1dro n ASP 79 Cb 0.33 -1.11 0.00 0.00 -0.72 0.00 0.00 41.12 39.61 1dro n ASP 79 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1dro n TYR 80 N -0.10 0.00 -2.76 -0.67 4.11 -1.26 -4.98 117.16 111.50 1dro n TYR 80 Ca 0.46 0.00 -0.07 0.00 -0.00 0.00 0.00 57.90 58.29 1dro n TYR 80 Cb 0.27 -0.26 0.01 0.00 -0.00 0.00 0.00 39.34 39.36 1dro n TYR 80 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.86 179.27 1dro n THR 81 N -1.29-10.57 0.00 -3.48 -1.04 -1.26 -3.76 114.28 92.89 1dro n THR 81 Ca 0.00 0.85 0.00 0.00 -2.04 0.00 0.00 64.05 62.86 1dro n THR 81 Cb 0.00 -7.11 0.00 0.00 -1.82 0.00 0.00 70.33 61.40 1dro n THR 81 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 1dro n LYS 82 N -0.31 0.00 0.00 -2.82 2.85 -1.26 -4.79 118.16 111.83 1dro n LYS 82 Ca 0.11 0.00 0.08 0.00 -1.05 0.00 0.00 58.31 57.45 1dro n LYS 82 Cb 0.43 0.00 0.46 0.00 -0.65 0.00 0.00 35.03 35.27 1dro n LYS 82 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1dro n LYS 83 N 0.00 0.83 0.00 -1.58 5.02 -1.25 -3.89 118.16 117.29 1dro n LYS 83 Ca 0.00 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.30 1dro n LYS 83 Cb 0.00 -1.29 0.05 0.00 -0.02 0.00 0.00 35.03 33.77 1dro n LYS 83 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1dro n LYS 84 N -0.79 0.30 -1.21 1.97 2.85 -1.26 -1.42 118.16 118.60 1dro n LYS 84 Ca 0.12 0.00 -0.06 0.00 -1.05 0.00 0.00 58.31 57.31 1dro n LYS 84 Cb 0.05 -1.09 0.13 0.00 -0.65 0.00 0.00 35.03 33.47 1dro n LYS 84 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1dro n HIS 85 N -0.59 1.14 -4.29 5.58 8.25 -1.25 -5.05 115.22 119.01 1dro n HIS 85 Ca 0.01 -1.79 -0.21 0.00 -0.26 0.00 0.00 57.72 55.47 1dro n HIS 85 Cb 0.01 -0.29 -0.12 0.00 1.12 0.00 0.00 29.99 30.71 1dro n HIS 85 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1dro s VAL 86 N -3.76 1.64 0.33 1.59 0.11 -0.51 -4.14 120.40 115.66 1dro s VAL 86 Ca 0.43 -1.71 0.07 0.00 -2.93 0.00 0.00 61.98 57.83 1dro s VAL 86 Cb 0.39 -1.63 -0.07 0.00 -1.53 0.00 0.00 36.38 33.54 1dro s VAL 86 CO -0.03 -0.25 -0.02 -1.48 -3.33 0.00 0.00 175.10 170.00 1dro s LEU 87 N -2.31 2.55 -0.26 2.54 2.34 -0.29 -3.97 118.68 119.27 1dro s LEU 87 Ca 0.10 -1.28 -0.14 0.00 0.06 0.00 0.00 54.13 52.87 1dro s LEU 87 Cb -0.07 -0.70 0.08 0.00 -0.56 0.00 0.00 46.19 44.94 1dro s LEU 87 CO 0.05 -0.41 0.64 -0.13 -1.06 0.00 0.00 176.35 175.44 1dro s ARG 88 N -3.74 0.64 -0.36 1.48 0.52 -0.91 0.19 118.95 116.77 1dro s ARG 88 Ca 0.33 1.16 -0.05 0.00 -0.52 0.00 0.00 55.73 56.65 1dro s ARG 88 Cb 0.06 0.15 0.06 0.00 0.52 0.00 0.00 34.95 35.75 1dro s ARG 88 CO 0.15 -0.16 0.13 0.54 0.02 0.00 0.00 175.30 175.99 1dro s VAL 89 N 1.68 3.62 0.69 3.52 0.11 -1.03 -0.72 120.40 128.26 1dro s VAL 89 Ca -0.10 -1.41 -0.11 0.00 -2.93 0.00 0.00 61.98 57.43 1dro s VAL 89 Cb -0.06 -3.17 0.01 0.00 -1.53 0.00 0.00 36.38 31.63 1dro s VAL 89 CO -0.19 -0.33 1.09 -0.54 -3.33 0.00 0.00 175.10 171.80 1dro s LYS 90 N 1.33 2.96 0.45 1.54 1.02 -0.04 -2.44 119.74 124.56 1dro s LYS 90 Ca 0.00 0.52 0.05 0.00 0.02 0.00 0.00 55.97 56.56 1dro s LYS 90 Cb -0.21 -2.03 -0.05 0.00 -0.52 0.00 0.00 37.83 35.03 1dro s LYS 90 CO 0.01 -0.97 0.06 -0.51 -0.92 0.00 0.00 175.35 173.01 1dro s LEU 91 N -5.34 2.70 -0.00 3.17 1.43 -1.26 -0.91 118.68 118.47 1dro s LEU 91 Ca 0.58 -1.42 -0.03 0.00 -1.03 0.00 0.00 54.13 52.23 1dro s LEU 91 Cb -0.11 -0.94 -0.27 0.00 0.03 0.00 0.00 46.19 44.90 1dro s LEU 91 CO 0.52 -0.64 0.83 0.00 0.23 0.00 0.00 176.35 177.29 1dro h ALA 92 N 1.51 0.30 0.00 4.21 0.00 -1.94 -3.35 119.26 120.00 1dro h ALA 92 Ca -0.43 -1.14 -0.05 0.00 0.00 0.00 0.00 54.91 53.29 1dro h ALA 92 Cb 1.27 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 19.36 1dro h ALA 92 CO 0.76 1.16 -0.24 -2.95 0.00 0.00 0.00 179.25 177.98 1dro h ASN 93 N 0.07 0.00 0.00 0.00 7.08 -2.02 -3.46 115.58 117.24 1dro h ASN 93 Ca -0.25 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.97 1dro h ASN 93 Cb 2.02 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 38.26 1dro h ASN 93 CO 0.16 0.24 0.00 0.61 -2.08 0.00 0.00 177.43 176.35 1dro n GLY 94 N 0.45 2.05 3.56 9.14 0.00 -1.26 -5.06 105.19 114.08 1dro n GLY 94 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1dro n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dro s ALA 95 N -1.97 2.73 0.15 4.61 0.00 -1.26 -3.69 121.76 122.33 1dro s ALA 95 Ca 0.00 -2.14 -0.05 0.00 0.00 0.00 0.00 51.96 49.77 1dro s ALA 95 Cb 0.00 -4.48 -0.06 0.00 0.00 0.00 0.00 23.12 18.59 1dro s ALA 95 CO 0.00 -3.56 0.38 -0.48 0.00 0.00 0.00 175.76 172.11 1dro s LEU 96 N 5.04 4.26 -0.67 0.00 0.05 -1.26 -4.07 118.68 122.03 1dro s LEU 96 Ca 0.44 0.59 0.03 0.00 0.05 0.00 0.00 54.13 55.24 1dro s LEU 96 Cb -0.01 -3.32 0.16 0.00 -2.05 0.00 0.00 46.19 40.97 1dro s LEU 96 CO -0.06 0.04 0.46 -0.36 -0.55 0.00 0.00 176.35 175.87 1dro s PHE 97 N -1.68 3.49 0.97 3.48 0.08 -1.02 -0.80 117.98 122.49 1dro s PHE 97 Ca 0.41 -3.21 -0.12 0.00 0.12 0.00 0.00 56.93 54.13 1dro s PHE 97 Cb -0.12 -2.85 0.17 0.00 -0.57 0.00 0.00 43.02 39.65 1dro s PHE 97 CO 0.25 -0.65 1.09 -0.51 -0.10 0.00 0.00 175.22 175.30 1dro s LEU 98 N -0.99 1.83 -0.20 -0.37 1.43 -1.26 -2.48 118.68 116.64 1dro s LEU 98 Ca 0.22 1.33 -0.05 0.00 -1.03 0.00 0.00 54.13 54.61 1dro s LEU 98 Cb -0.13 -3.60 0.10 0.00 0.03 0.00 0.00 46.19 42.60 1dro s LEU 98 CO -0.10 -3.00 0.36 -0.76 0.23 0.00 0.00 176.35 173.08 1dro s LEU 99 N -6.41 -0.53 -0.49 1.79 1.43 0.50 -3.07 118.68 111.90 1dro s LEU 99 Ca 0.65 0.56 -0.08 0.00 -1.03 0.00 0.00 54.13 54.23 1dro s LEU 99 Cb -0.19 1.07 0.13 0.00 0.03 0.00 0.00 46.19 47.22 1dro s LEU 99 CO 0.58 -0.26 0.35 -1.58 0.23 0.00 0.00 176.35 175.66 1dro s GLN 100 N 2.53 2.45 0.70 1.70 0.74 -0.98 -1.14 119.66 125.67 1dro s GLN 100 Ca 0.04 -1.86 -0.11 0.00 0.05 0.00 0.00 55.36 53.48 1dro s GLN 100 Cb -0.13 -3.88 0.01 0.00 1.10 0.00 0.00 33.01 30.11 1dro s GLN 100 CO -0.13 -1.18 1.09 0.00 -0.55 0.00 0.00 175.29 174.52 1dro s ALA 101 N 1.17 2.86 -0.09 1.58 0.00 -1.26 -2.15 121.76 123.87 1dro s ALA 101 Ca 0.07 -0.28 -0.04 0.00 0.00 0.00 0.00 51.96 51.72 1dro s ALA 101 Cb -0.25 -3.05 -0.26 0.00 0.00 0.00 0.00 23.12 19.56 1dro s ALA 101 CO -0.02 -1.13 0.50 1.25 0.00 0.00 0.00 175.76 176.36 1dro h HIS 102 N -0.65 0.43 0.11 0.00 2.76 -1.95 -3.40 115.15 112.45 1dro h HIS 102 Ca -0.45 -0.31 -0.31 0.00 -2.20 0.00 0.00 60.37 57.10 1dro h HIS 102 Cb 1.24 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 30.18 1dro h HIS 102 CO 0.53 1.61 -1.60 0.22 -1.30 0.00 0.00 177.93 177.39 1dro h ASP 103 N 0.06 0.36 0.00 3.26 1.82 -1.95 -3.48 116.42 116.50 1dro h ASP 103 Ca -0.38 -0.55 0.00 0.00 -0.39 0.00 0.00 57.03 55.72 1dro h ASP 103 Cb 2.04 -0.12 0.00 0.00 0.68 0.00 0.00 39.33 41.93 1dro h ASP 103 CO 0.10 1.46 0.00 -0.90 -1.61 0.00 0.00 179.24 178.30 1dro n ASP 104 N -3.42 0.00 0.04 2.28 5.75 -1.26 -4.72 116.55 115.22 1dro n ASP 104 Ca -0.18 0.00 -0.14 0.00 -0.01 0.00 0.00 54.79 54.46 1dro n ASP 104 Cb 1.04 0.00 -0.14 0.00 -1.03 0.00 0.00 41.12 41.00 1dro n ASP 104 CO 0.00 0.00 0.00 0.74 -0.11 0.00 0.00 177.20 177.83 1dro h THR 105 N 0.00 1.11 0.00 2.12 2.02 -1.97 -3.28 112.91 112.92 1dro h THR 105 Ca 0.00 -2.82 -0.06 0.00 0.77 0.00 0.00 66.41 64.30 1dro h THR 105 Cb 0.00 2.67 -0.01 0.00 -1.74 0.00 0.00 68.15 69.08 1dro h THR 105 CO 0.00 0.77 -0.26 1.05 0.37 0.00 0.00 175.52 177.45 1dro h GLU 106 N 0.04 0.00 -0.82 6.66 4.11 -1.98 -2.91 114.58 119.68 1dro h GLU 106 Ca -0.24 0.00 0.16 0.00 0.07 0.00 0.00 59.36 59.36 1dro h GLU 106 Cb 1.98 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 31.13 1dro h GLU 106 CO 0.13 0.26 0.37 1.98 0.07 0.00 0.00 179.01 181.83 1dro h MET 107 N 0.00 0.48 0.63 1.06 4.05 -1.90 0.49 114.93 119.75 1dro h MET 107 Ca -0.00 -0.03 -0.03 0.00 -0.28 0.00 0.00 59.70 59.36 1dro h MET 107 Cb 1.17 -0.11 0.01 0.00 -0.80 0.00 0.00 31.60 31.87 1dro h MET 107 CO 0.03 0.32 -0.30 0.77 0.23 0.00 0.00 176.91 177.96 1dro h SER 108 N 0.50 -0.72 -1.29 1.39 0.02 -1.64 -2.83 113.55 108.98 1dro h SER 108 Ca 0.47 0.02 0.37 0.00 -0.84 0.00 0.00 61.79 61.82 1dro h SER 108 Cb 0.74 0.19 -0.05 0.00 0.14 0.00 0.00 62.40 63.42 1dro h SER 108 CO -0.42 -0.37 1.12 1.56 -1.14 0.00 0.00 176.83 177.58 1dro h GLN 109 N -1.13 0.00 0.36 3.45 1.08 -1.22 0.52 115.11 118.17 1dro h GLN 109 Ca -0.09 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.10 1dro h GLN 109 Cb 0.65 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.09 1dro h GLN 109 CO 0.14 0.00 -0.17 -1.49 -0.95 0.00 0.00 178.83 176.36 1dro h TRP 110 N 0.00 -0.45 -0.98 2.96 4.06 0.04 -1.70 115.95 119.88 1dro h TRP 110 Ca 0.61 -0.01 0.26 0.00 2.06 0.00 0.00 58.89 61.82 1dro h TRP 110 Cb 2.85 0.15 -0.13 0.00 -1.00 0.00 0.00 29.16 31.02 1dro h TRP 110 CO 0.00 -0.18 0.53 -0.24 -3.56 0.00 0.00 178.44 174.99 1dro h VAL 111 N -1.06 0.44 -0.01 1.49 3.04 0.17 0.98 116.25 121.31 1dro h VAL 111 Ca -0.05 -0.16 -0.19 0.00 -1.01 0.00 0.00 66.70 65.30 1dro h VAL 111 Cb 0.47 -0.05 -0.01 0.00 -2.01 0.00 0.00 31.29 29.69 1dro h VAL 111 CO 0.08 0.08 -0.83 0.71 -1.01 0.00 0.00 177.57 176.61 1dro h THR 112 N 0.45 1.48 -0.36 3.17 1.35 -0.94 1.00 112.91 119.07 1dro h THR 112 Ca 0.65 -2.52 -0.09 0.00 -0.55 0.00 0.00 66.41 63.90 1dro h THR 112 Cb 1.33 2.39 -0.01 0.00 -1.73 0.00 0.00 68.15 70.13 1dro h THR 112 CO -0.53 0.74 -0.12 -1.28 -0.25 0.00 0.00 175.52 174.07 1dro h SER 113 N 0.11 0.73 0.55 5.36 0.87 0.04 -2.87 113.55 118.35 1dro h SER 113 Ca -0.04 -0.38 -0.13 0.00 -1.23 0.00 0.00 61.79 60.01 1dro h SER 113 Cb 1.44 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 63.18 1dro h SER 113 CO 0.13 0.95 -0.60 -0.07 -0.53 0.00 0.00 176.83 176.70 1dro h LEU 114 N 0.51 0.05 -0.99 2.23 3.38 -0.79 -2.49 115.31 117.21 1dro h LEU 114 Ca 0.09 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.05 1dro h LEU 114 Cb 0.65 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.33 1dro h LEU 114 CO 0.04 0.64 0.65 0.50 0.09 0.00 0.00 178.44 180.36 1dro h LYS 115 N 0.03 1.27 0.00 1.13 3.64 -0.77 0.12 116.57 121.99 1dro h LYS 115 Ca -0.01 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 59.25 1dro h LYS 115 Cb 1.07 -0.29 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 1dro h LYS 115 CO 0.08 0.84 -0.24 0.00 -2.27 0.00 0.00 179.45 177.86 1dro h ALA 116 N 1.38 1.59 -1.51 5.00 0.00 -1.22 -3.39 119.26 121.11 1dro h ALA 116 Ca 0.38 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1dro h ALA 116 Cb -0.09 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1dro h ALA 116 CO -0.10 0.30 0.00 1.04 0.00 0.00 0.00 179.25 180.49 1dro n GLN 117 N -4.24 0.00 -0.10 0.00 3.00 -0.62 -4.62 117.38 110.79 1dro n GLN 117 Ca -0.02 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 56.96 1dro n GLN 117 Cb 0.30 -0.24 0.00 0.00 0.00 0.00 0.00 30.24 30.30 1dro n GLN 117 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 1dro n SER 118 N -1.99 -0.19 -4.28 1.08 7.64 0.34 -2.72 113.62 113.49 1dro n SER 118 Ca 0.00 0.46 -0.37 0.00 1.01 0.00 0.00 58.87 59.97 1dro n SER 118 Cb 0.00 -0.10 -0.13 0.00 -1.01 0.00 0.00 64.21 62.98 1dro n SER 118 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1dro s ASP 119 N -5.10 5.22 0.13 6.43 2.15 -1.15 -2.27 116.67 122.08 1dro s ASP 119 Ca -0.04 -1.04 0.07 0.00 0.43 0.00 0.00 52.55 51.97 1dro s ASP 119 Cb 0.05 -1.86 -0.04 0.00 -0.30 0.00 0.00 42.92 40.77 1dro s ASP 119 CO 0.18 -0.29 -0.05 -0.44 -0.17 0.00 0.00 175.17 174.40 1dro s SER 120 N 1.41 4.59 0.00 -0.34 0.01 -1.10 -4.77 113.70 113.50 1dro s SER 120 Ca -0.01 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 56.87 1dro s SER 120 Cb -0.19 -0.93 0.00 0.00 0.21 0.00 0.00 66.02 65.11 1dro s SER 120 CO 0.02 0.14 0.00 0.35 0.41 0.00 0.00 173.24 174.16 1dro n THR 121 N 0.33 0.00 0.01 1.44 -2.24 -1.26 -5.03 114.28 107.53 1dro n THR 121 Ca -0.11 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 1dro n THR 121 Cb 0.54 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 1dro n THR 121 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50