#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b2d n SER 2 N 0.00 0.00 -0.35 0.00 2.88 -1.26 -5.06 113.62 109.83 2b2d n SER 2 Ca 0.00 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.67 2b2d n SER 2 Cb 0.00 0.00 0.34 0.00 -0.75 0.00 0.00 64.21 63.80 2b2d n SER 2 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2b2d n ASN 3 N 0.00 1.32 -3.13 -3.46 2.04 -1.26 -4.57 115.26 106.20 2b2d n ASN 3 Ca 0.00 -1.12 -0.35 0.00 -0.44 0.00 0.00 54.58 52.66 2b2d n ASN 3 Cb 0.00 0.15 -0.05 0.00 -2.53 0.00 0.00 39.78 37.36 2b2d n ASN 3 CO 0.00 0.00 0.00 0.33 -0.44 0.00 0.00 177.26 177.15 2b2d n PHE 4 N -0.34 2.09 -4.34 -2.53 7.35 -1.26 -4.86 117.46 113.57 2b2d n PHE 4 Ca 0.13 -2.84 -0.24 0.00 -0.76 0.00 0.00 57.45 53.74 2b2d n PHE 4 Cb 0.37 -2.30 -0.08 0.00 0.35 0.00 0.00 39.48 37.82 2b2d n PHE 4 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2b2d s THR 5 N 1.65 3.13 0.51 -2.13 -4.23 -1.26 -4.80 115.64 108.50 2b2d s THR 5 Ca 0.68 -1.99 -0.21 0.00 -1.18 0.00 0.00 61.69 58.99 2b2d s THR 5 Cb 0.20 -2.63 -0.06 0.00 1.34 0.00 0.00 72.50 71.34 2b2d s THR 5 CO -0.06 -0.32 1.17 0.00 -0.54 0.00 0.00 174.62 174.88 2b2d s GLN 6 N -3.43 3.50 0.30 3.99 -2.07 -1.26 -4.76 119.66 115.93 2b2d s GLN 6 Ca 0.29 1.76 0.02 0.00 -1.82 0.00 0.00 55.36 55.62 2b2d s GLN 6 Cb -0.07 -2.21 -0.03 0.00 -1.09 0.00 0.00 33.01 29.62 2b2d s GLN 6 CO 0.17 -0.77 0.29 -0.59 -1.32 0.00 0.00 175.29 173.08 2b2d s PHE 7 N -1.61 1.41 -0.34 9.60 -0.71 -0.72 -4.99 117.98 120.64 2b2d s PHE 7 Ca 0.69 -1.48 -0.15 0.00 -1.04 0.00 0.00 56.93 54.95 2b2d s PHE 7 Cb -0.28 -0.51 -0.02 0.00 -1.21 0.00 0.00 43.02 41.00 2b2d s PHE 7 CO 0.33 -0.87 0.33 0.08 -1.34 0.00 0.00 175.22 173.75 2b2d s VAL 8 N -3.57 5.20 -0.14 -2.49 1.01 -1.26 -0.90 120.40 118.24 2b2d s VAL 8 Ca 0.37 0.02 -0.20 0.00 0.00 0.00 0.00 61.98 62.18 2b2d s VAL 8 Cb 0.03 -3.78 -0.17 0.00 0.00 0.00 0.00 36.38 32.45 2b2d s VAL 8 CO 0.22 -0.05 0.44 0.25 0.00 0.00 0.00 175.10 175.95 2b2d h LEU 9 N 8.67 0.00 -8.17 3.92 5.85 -1.36 -3.44 115.31 120.79 2b2d h LEU 9 Ca -0.30 -0.62 -0.68 0.00 0.84 0.00 0.00 57.88 57.11 2b2d h LEU 9 Cb 1.15 0.00 -0.31 0.00 0.37 0.00 0.00 40.66 41.87 2b2d h LEU 9 CO 0.67 0.96 -0.69 -0.69 -0.34 0.00 0.00 178.44 178.36 2b2d s VAL 10 N -2.10 3.26 -0.29 1.05 1.01 -1.07 -5.00 120.40 117.27 2b2d s VAL 10 Ca -0.16 -1.09 -0.11 0.00 0.00 0.00 0.00 61.98 60.62 2b2d s VAL 10 Cb -0.00 -2.76 -0.04 0.00 0.00 0.00 0.00 36.38 33.57 2b2d s VAL 10 CO 0.49 0.02 0.18 -0.62 0.00 0.00 0.00 175.10 175.17 2b2d s ASP 11 N 1.35 5.92 -0.27 3.32 2.15 -1.26 -0.56 116.67 127.31 2b2d s ASP 11 Ca -0.01 -0.12 0.08 0.00 0.43 0.00 0.00 52.55 52.93 2b2d s ASP 11 Cb -0.18 -2.10 0.45 0.00 -0.30 0.00 0.00 42.92 40.79 2b2d s ASP 11 CO -0.01 -0.09 1.20 0.59 -0.17 0.00 0.00 175.17 176.69 2b2d n ASN 12 N 5.05 4.02 -3.03 -0.34 3.02 -1.26 -4.95 115.26 117.77 2b2d n ASN 12 Ca -0.14 -3.78 -0.14 0.00 -0.03 0.00 0.00 54.58 50.49 2b2d n ASN 12 Cb 0.51 -0.39 0.07 0.00 -0.61 0.00 0.00 39.78 39.36 2b2d n ASN 12 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2b2d n GLY 13 N -0.82 -0.42 4.97 7.41 0.00 -1.26 -3.92 105.19 111.15 2b2d n GLY 13 Ca 0.37 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.53 2b2d n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b2d n GLY 14 N -1.16 1.80 3.58 -0.02 0.00 -1.26 -4.90 105.19 103.23 2b2d n GLY 14 Ca -0.19 -0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 2b2d n GLY 14 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2b2d s THR 15 N 0.00 3.37 0.00 2.61 -1.32 -1.25 -2.86 115.64 116.19 2b2d s THR 15 Ca 0.00 0.32 0.00 0.00 -1.21 0.00 0.00 61.69 60.80 2b2d s THR 15 Cb 0.00 -3.64 0.00 0.00 -1.51 0.00 0.00 72.50 67.35 2b2d s THR 15 CO 0.00 -0.51 0.00 0.61 -2.21 0.00 0.00 174.62 172.51 2b2d n GLY 16 N 5.58 0.74 3.79 6.08 0.00 -1.26 -4.71 105.19 115.41 2b2d n GLY 16 Ca 0.24 -0.69 -0.33 0.00 0.00 0.00 0.00 46.02 45.24 2b2d n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2b2d s ASP 17 N -2.76 5.68 -0.35 1.61 1.01 -1.13 -4.64 116.67 116.07 2b2d s ASP 17 Ca 0.00 1.89 -0.03 0.00 0.71 0.00 0.00 52.55 55.12 2b2d s ASP 17 Cb 0.00 -2.54 0.08 0.00 1.01 0.00 0.00 42.92 41.46 2b2d s ASP 17 CO 0.00 -1.24 0.11 -0.69 0.21 0.00 0.00 175.17 173.56 2b2d s VAL 18 N -2.35 3.22 -0.02 -1.27 1.01 0.27 -5.00 120.40 116.27 2b2d s VAL 18 Ca 0.65 -1.66 -0.11 0.00 0.00 0.00 0.00 61.98 60.86 2b2d s VAL 18 Cb -0.17 -3.02 -0.05 0.00 0.00 0.00 0.00 36.38 33.13 2b2d s VAL 18 CO 0.36 -0.39 0.32 -0.89 0.00 0.00 0.00 175.10 174.51 2b2d s THR 19 N 1.22 5.19 -0.08 3.92 2.01 -1.26 -0.88 115.64 125.76 2b2d s THR 19 Ca 0.02 0.54 0.03 0.00 0.31 0.00 0.00 61.69 62.58 2b2d s THR 19 Cb -0.21 -3.61 0.01 0.00 0.01 0.00 0.00 72.50 68.70 2b2d s THR 19 CO -0.02 0.52 -0.16 0.54 -0.69 0.00 0.00 174.62 174.80 2b2d s VAL 20 N -1.14 1.49 0.18 3.82 0.11 -0.08 -4.47 120.40 120.30 2b2d s VAL 20 Ca 0.23 -0.68 0.10 0.00 -2.93 0.00 0.00 61.98 58.70 2b2d s VAL 20 Cb -0.15 -1.32 -0.04 0.00 -1.53 0.00 0.00 36.38 33.34 2b2d s VAL 20 CO 0.12 0.43 -0.15 0.00 -3.33 0.00 0.00 175.10 172.17 2b2d s ALA 21 N 0.60 2.79 0.24 1.54 0.00 -0.89 -1.75 121.76 124.28 2b2d s ALA 21 Ca -0.15 -1.51 -0.31 0.00 0.00 0.00 0.00 51.96 49.99 2b2d s ALA 21 Cb -0.16 -0.60 -0.13 0.00 0.00 0.00 0.00 23.12 22.22 2b2d s ALA 21 CO 0.05 0.47 1.42 -0.35 0.00 0.00 0.00 175.76 177.35 2b2d n PRO 22 N 0.20 2.06 0.00 0.00 -0.04 -1.26 -1.50 135.00 134.46 2b2d n PRO 22 Ca -0.12 0.73 0.00 0.00 -0.04 0.00 0.00 63.50 64.07 2b2d n PRO 22 Cb 0.55 -2.40 0.00 0.00 -0.04 0.00 0.00 33.50 31.61 2b2d n PRO 22 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2b2d n SER 23 N 2.19 0.09 -3.58 3.54 3.41 0.29 -4.85 113.62 114.72 2b2d n SER 23 Ca 0.12 -0.55 -0.09 0.00 -0.26 0.00 0.00 58.87 58.08 2b2d n SER 23 Cb 0.32 0.09 -0.05 0.00 -0.26 0.00 0.00 64.21 64.31 2b2d n SER 23 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2b2d s ASN 24 N -0.09 -0.32 0.00 4.04 3.84 -1.18 -4.99 114.94 116.25 2b2d s ASN 24 Ca 0.00 0.31 0.13 0.00 0.21 0.00 0.00 52.86 53.51 2b2d s ASN 24 Cb 0.00 0.27 0.21 0.00 -0.55 0.00 0.00 41.25 41.18 2b2d s ASN 24 CO 0.00 -0.32 1.06 0.33 -2.79 0.00 0.00 177.10 175.38 2b2d n PHE 25 N 0.60 0.00 -2.16 0.43 7.35 -1.26 -1.24 117.46 121.18 2b2d n PHE 25 Ca -0.08 -0.45 -0.42 0.00 -0.76 0.00 0.00 57.45 55.73 2b2d n PHE 25 Cb 0.58 0.14 -0.03 0.00 0.35 0.00 0.00 39.48 40.53 2b2d n PHE 25 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2b2d s ALA 26 N 0.00 3.60 -1.10 3.13 0.00 -1.25 -2.78 121.76 123.35 2b2d s ALA 26 Ca 0.17 1.02 0.00 0.00 0.00 0.00 0.00 51.96 53.15 2b2d s ALA 26 Cb 0.19 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.73 2b2d s ALA 26 CO -0.08 -0.81 0.00 0.09 0.00 0.00 0.00 175.76 174.96 2b2d n ASN 27 N 4.79 -4.00 0.00 0.00 3.02 -1.26 -2.57 115.26 115.23 2b2d n ASN 27 Ca 0.13 0.03 0.00 0.00 -0.03 0.00 0.00 54.58 54.71 2b2d n ASN 27 Cb 0.43 -3.12 0.00 0.00 -0.61 0.00 0.00 39.78 36.47 2b2d n ASN 27 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2b2d n GLY 28 N -1.08 0.96 3.53 7.41 0.00 -1.12 -4.93 105.19 109.96 2b2d n GLY 28 Ca -0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 2b2d n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b2d s VAL 29 N -2.48 4.23 0.24 1.61 1.01 -1.06 -4.77 120.40 119.18 2b2d s VAL 29 Ca 0.00 0.34 -0.30 0.00 0.00 0.00 0.00 61.98 62.02 2b2d s VAL 29 Cb 0.00 -4.64 -0.09 0.00 0.00 0.00 0.00 36.38 31.65 2b2d s VAL 29 CO 0.00 -1.29 1.22 0.00 0.00 0.00 0.00 175.10 175.03 2b2d s ALA 30 N 4.37 3.46 -0.01 5.51 0.00 -0.75 -3.89 121.76 130.45 2b2d s ALA 30 Ca 0.32 1.04 0.03 0.00 0.00 0.00 0.00 51.96 53.35 2b2d s ALA 30 Cb -0.12 -3.42 -0.00 0.00 0.00 0.00 0.00 23.12 19.58 2b2d s ALA 30 CO 0.19 -0.42 -0.10 -2.00 0.00 0.00 0.00 175.76 173.44 2b2d s GLU 31 N -0.76 0.86 -0.05 0.00 2.12 -0.37 -1.62 118.70 118.87 2b2d s GLU 31 Ca 0.51 -0.34 0.05 0.00 0.36 0.00 0.00 54.97 55.56 2b2d s GLU 31 Cb -0.35 -0.82 -0.01 0.00 0.26 0.00 0.00 34.13 33.22 2b2d s GLU 31 CO 0.41 0.18 -0.21 -1.58 -0.54 0.00 0.00 175.26 173.52 2b2d s TRP 32 N -0.09 2.11 0.05 5.30 0.51 0.10 -0.55 118.94 126.37 2b2d s TRP 32 Ca 0.01 -0.63 0.03 0.00 -2.12 0.00 0.00 56.10 53.39 2b2d s TRP 32 Cb -0.05 -1.40 -0.02 0.00 -0.81 0.00 0.00 33.47 31.18 2b2d s TRP 32 CO -0.00 -0.20 -0.10 -1.50 -0.51 0.00 0.00 176.95 174.64 2b2d s ILE 33 N -0.05 0.71 0.75 2.03 2.07 -0.56 -0.76 121.20 125.39 2b2d s ILE 33 Ca -0.04 -1.07 -0.08 0.00 -1.41 0.00 0.00 60.65 58.05 2b2d s ILE 33 Cb -0.13 -0.73 0.09 0.00 0.13 0.00 0.00 42.46 41.82 2b2d s ILE 33 CO 0.03 -0.28 1.07 -0.94 -1.91 0.00 0.00 174.94 172.91 2b2d s SER 34 N -1.49 4.45 -1.35 4.50 1.04 -0.36 -2.10 113.70 118.38 2b2d s SER 34 Ca -0.06 0.32 -0.15 0.00 0.48 0.00 0.00 55.95 56.54 2b2d s SER 34 Cb -0.09 -0.83 0.08 0.00 0.10 0.00 0.00 66.02 65.28 2b2d s SER 34 CO 0.01 -1.84 1.92 -0.24 0.98 0.00 0.00 173.24 174.08 2b2d n SER 35 N -3.06 4.56 -2.48 7.02 2.88 -1.26 -4.72 113.62 116.56 2b2d n SER 35 Ca 0.10 -2.92 -0.11 0.00 -1.33 0.00 0.00 58.87 54.61 2b2d n SER 35 Cb 0.60 -1.65 -0.03 0.00 -0.75 0.00 0.00 64.21 62.38 2b2d n SER 35 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2b2d n ASN 36 N 6.48 -0.90 -4.74 -3.46 3.02 -1.26 -5.05 115.26 109.35 2b2d n ASN 36 Ca 0.47 -2.42 -0.41 0.00 -0.03 0.00 0.00 54.58 52.20 2b2d n ASN 36 Cb 0.41 1.73 -0.05 0.00 -0.61 0.00 0.00 39.78 41.26 2b2d n ASN 36 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2b2d s SER 37 N -2.60 7.41 0.61 6.41 1.04 -1.26 -4.75 113.70 120.57 2b2d s SER 37 Ca 0.23 2.02 0.25 0.00 0.48 0.00 0.00 55.95 58.93 2b2d s SER 37 Cb -0.00 -2.61 1.03 0.00 0.10 0.00 0.00 66.02 64.54 2b2d s SER 37 CO 0.16 -0.08 1.47 0.03 0.98 0.00 0.00 173.24 175.80 2b2d h ARG 38 N 4.78 0.00 0.00 4.02 2.47 -1.96 0.60 114.38 124.29 2b2d h ARG 38 Ca -0.45 0.00 -0.18 0.00 -1.26 0.00 0.00 59.98 58.10 2b2d h ARG 38 Cb 1.21 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.50 2b2d h ARG 38 CO 0.70 0.00 -0.85 0.66 0.56 0.00 0.00 179.97 181.05 2b2d h SER 39 N 0.00 0.03 -0.08 7.04 4.64 -1.98 -3.33 113.55 119.87 2b2d h SER 39 Ca 0.34 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 2b2d h SER 39 Cb 2.24 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 64.32 2b2d h SER 39 CO -0.00 0.86 0.00 0.00 -0.87 0.00 0.00 176.83 176.82 2b2d n GLN 40 N -3.55 0.89 -1.73 4.77 6.02 0.19 -5.00 117.38 118.97 2b2d n GLN 40 Ca -0.01 -1.24 -0.30 0.00 -0.01 0.00 0.00 57.00 55.45 2b2d n GLN 40 Cb 0.81 -1.17 0.08 0.00 1.02 0.00 0.00 30.24 30.98 2b2d n GLN 40 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b2d s ALA 41 N -0.77 2.49 -0.16 -1.58 0.00 -0.15 -4.68 121.76 116.92 2b2d s ALA 41 Ca 0.12 -0.37 -0.14 0.00 0.00 0.00 0.00 51.96 51.56 2b2d s ALA 41 Cb 0.07 -3.04 -0.05 0.00 0.00 0.00 0.00 23.12 20.10 2b2d s ALA 41 CO 0.11 -1.58 0.30 0.71 0.00 0.00 0.00 175.76 175.30 2b2d s TYR 42 N -3.32 3.46 0.02 0.00 1.51 -1.26 -4.39 117.35 113.37 2b2d s TYR 42 Ca 0.60 0.61 0.07 0.00 -1.01 0.00 0.00 57.07 57.35 2b2d s TYR 42 Cb -0.13 -2.36 -0.02 0.00 -0.11 0.00 0.00 41.96 39.34 2b2d s TYR 42 CO 0.52 0.22 -0.22 0.21 -1.11 0.00 0.00 175.55 175.18 2b2d s LYS 43 N 0.51 1.62 -0.02 -0.62 2.20 -0.83 -1.23 119.74 121.37 2b2d s LYS 43 Ca 0.17 -0.90 0.01 0.00 -0.36 0.00 0.00 55.97 54.89 2b2d s LYS 43 Cb -0.13 -1.67 0.02 0.00 -1.51 0.00 0.00 37.83 34.53 2b2d s LYS 43 CO 0.04 0.44 -0.03 0.08 -0.36 0.00 0.00 175.35 175.53 2b2d s VAL 44 N -0.68 0.31 0.06 4.02 1.01 0.06 -0.58 120.40 124.61 2b2d s VAL 44 Ca 0.09 -0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.04 2b2d s VAL 44 Cb -0.09 -0.34 -0.03 0.00 0.00 0.00 0.00 36.38 35.92 2b2d s VAL 44 CO 0.01 0.14 -0.09 0.42 0.00 0.00 0.00 175.10 175.58 2b2d s THR 45 N 0.60 0.75 -0.15 3.92 -4.23 -0.15 0.00 115.64 116.39 2b2d s THR 45 Ca -0.06 -1.32 -0.19 0.00 -1.18 0.00 0.00 61.69 58.93 2b2d s THR 45 Cb -0.10 -0.96 0.05 0.00 1.34 0.00 0.00 72.50 72.83 2b2d s THR 45 CO -0.01 -0.44 0.50 0.00 -0.54 0.00 0.00 174.62 174.14 2b2d s SER 47 N -0.17 -0.54 0.03 0.00 1.04 -0.96 -1.81 113.70 111.29 2b2d s SER 47 Ca -0.04 0.23 0.04 0.00 0.48 0.00 0.00 55.95 56.66 2b2d s SER 47 Cb -0.03 0.55 -0.02 0.00 0.10 0.00 0.00 66.02 66.61 2b2d s SER 47 CO 0.02 -0.80 -0.11 -0.69 0.98 0.00 0.00 173.24 172.64 2b2d s VAL 48 N -2.69 0.89 0.23 5.02 1.01 -1.26 -0.98 120.40 122.62 2b2d s VAL 48 Ca -0.04 -0.91 -0.22 0.00 0.00 0.00 0.00 61.98 60.81 2b2d s VAL 48 Cb -0.01 -0.83 0.04 0.00 0.00 0.00 0.00 36.38 35.59 2b2d s VAL 48 CO -0.04 -0.07 0.68 0.00 0.00 0.00 0.00 175.10 175.68 2b2d s ARG 49 N -1.10 1.57 -0.74 2.72 1.70 -1.04 -4.98 118.95 117.08 2b2d s ARG 49 Ca -0.01 -0.78 -0.21 0.00 -0.47 0.00 0.00 55.73 54.26 2b2d s ARG 49 Cb -0.08 0.60 0.09 0.00 -0.57 0.00 0.00 34.95 35.00 2b2d s ARG 49 CO 0.01 -0.71 0.98 -0.65 -1.08 0.00 0.00 175.30 173.85 2b2d s GLN 50 N -3.84 3.26 0.25 3.89 -0.21 -1.26 0.11 119.66 121.87 2b2d s GLN 50 Ca 0.07 -1.20 -0.05 0.00 0.02 0.00 0.00 55.36 54.20 2b2d s GLN 50 Cb -0.04 -4.46 0.33 0.00 1.00 0.00 0.00 33.01 29.84 2b2d s GLN 50 CO -0.01 -1.76 1.90 0.66 -2.12 0.00 0.00 175.29 173.95 2b2d h SER 51 N 9.28 1.05 -2.42 5.90 4.64 -1.80 -3.46 113.55 126.73 2b2d h SER 51 Ca -0.14 -0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.10 2b2d h SER 51 Cb 1.06 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.89 2b2d h SER 51 CO 1.15 0.71 -0.07 -1.54 -0.87 0.00 0.00 176.83 176.21 2b2d n SER 52 N -4.47 -0.04 0.02 4.97 3.41 -1.14 -5.01 113.62 111.35 2b2d n SER 52 Ca 0.13 -1.31 0.14 0.00 -0.26 0.00 0.00 58.87 57.57 2b2d n SER 52 Cb 0.11 0.23 0.58 0.00 -0.26 0.00 0.00 64.21 64.87 2b2d n SER 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b2d n ALA 53 N -2.68 2.32 -0.03 7.33 0.00 -1.26 -3.81 120.51 122.39 2b2d n ALA 53 Ca -0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 53.44 53.33 2b2d n ALA 53 Cb 0.09 -1.47 -0.07 0.00 0.00 0.00 0.00 19.45 18.00 2b2d n ALA 53 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2b2d n GLN 54 N -1.63 1.77 -4.37 0.00 -0.06 -1.26 -4.95 117.38 106.89 2b2d n GLN 54 Ca 0.07 -0.03 -0.22 0.00 -2.00 0.00 0.00 57.00 54.81 2b2d n GLN 54 Cb 0.36 -1.21 -0.11 0.00 -4.06 0.00 0.00 30.24 25.21 2b2d n GLN 54 CO 0.00 0.00 0.00 -0.80 -0.20 0.00 0.00 177.06 176.06 2b2d s ASN 55 N -3.65 2.89 0.24 1.69 0.01 -1.25 0.20 114.94 115.07 2b2d s ASN 55 Ca -0.04 -0.91 0.09 0.00 -0.71 0.00 0.00 52.86 51.29 2b2d s ASN 55 Cb 0.04 -0.19 -0.04 0.00 0.41 0.00 0.00 41.25 41.47 2b2d s ASN 55 CO 0.35 -0.02 0.02 -0.13 -1.51 0.00 0.00 177.10 175.81 2b2d s ARG 56 N -3.02 2.40 -0.09 -0.60 0.52 -0.17 -2.73 118.95 115.27 2b2d s ARG 56 Ca 0.19 -1.28 -0.03 0.00 -0.52 0.00 0.00 55.73 54.09 2b2d s ARG 56 Cb -0.05 -2.27 0.05 0.00 0.52 0.00 0.00 34.95 33.20 2b2d s ARG 56 CO 0.08 0.39 0.15 0.21 0.02 0.00 0.00 175.30 176.16 2b2d s LYS 57 N -3.49 0.03 0.06 3.54 2.20 0.12 -1.24 119.74 120.97 2b2d s LYS 57 Ca 0.30 0.49 -0.24 0.00 -0.36 0.00 0.00 55.97 56.16 2b2d s LYS 57 Cb -0.07 -0.44 -0.06 0.00 -1.51 0.00 0.00 37.83 35.74 2b2d s LYS 57 CO 0.20 -0.35 0.72 0.71 -0.36 0.00 0.00 175.35 176.27 2b2d s TYR 58 N 2.28 3.77 -0.21 4.03 1.51 -0.11 -2.51 117.35 126.11 2b2d s TYR 58 Ca 0.04 1.44 0.01 0.00 -1.01 0.00 0.00 57.07 57.54 2b2d s TYR 58 Cb -0.12 -2.75 0.05 0.00 -0.11 0.00 0.00 41.96 39.03 2b2d s TYR 58 CO -0.06 0.36 -0.08 0.99 -1.11 0.00 0.00 175.55 175.65 2b2d s THR 59 N -0.38 1.52 -0.07 -0.71 2.01 -0.15 -1.47 115.64 116.39 2b2d s THR 59 Ca 0.36 -1.04 0.03 0.00 0.31 0.00 0.00 61.69 61.35 2b2d s THR 59 Cb -0.21 -1.69 -0.02 0.00 0.01 0.00 0.00 72.50 70.60 2b2d s THR 59 CO 0.22 0.05 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.40 2b2d s ILE 60 N 1.43 2.75 -0.02 1.82 1.01 -0.41 -2.27 121.20 125.50 2b2d s ILE 60 Ca -0.03 -0.81 0.03 0.00 0.00 0.00 0.00 60.65 59.84 2b2d s ILE 60 Cb -0.17 -2.08 -0.00 0.00 0.01 0.00 0.00 42.46 40.22 2b2d s ILE 60 CO -0.07 0.57 -0.12 -0.54 0.00 0.00 0.00 174.94 174.78 2b2d s LYS 61 N -0.26 1.06 0.00 2.79 1.02 -0.63 -0.21 119.74 123.51 2b2d s LYS 61 Ca 0.01 -0.41 0.04 0.00 0.02 0.00 0.00 55.97 55.62 2b2d s LYS 61 Cb -0.13 -0.99 -0.01 0.00 -0.52 0.00 0.00 37.83 36.17 2b2d s LYS 61 CO 0.03 0.21 -0.12 0.08 -0.92 0.00 0.00 175.35 174.63 2b2d s VAL 62 N -0.10 0.95 -0.12 3.17 1.01 0.07 -0.97 120.40 124.41 2b2d s VAL 62 Ca 0.01 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.40 2b2d s VAL 62 Cb -0.07 -0.81 0.02 0.00 0.00 0.00 0.00 36.38 35.52 2b2d s VAL 62 CO 0.00 0.20 -0.14 -1.61 0.00 0.00 0.00 175.10 173.55 2b2d s GLU 63 N -0.46 2.14 -0.14 2.72 2.02 0.25 -0.44 118.70 124.80 2b2d s GLU 63 Ca 0.04 -0.52 0.01 0.00 0.02 0.00 0.00 54.97 54.51 2b2d s GLU 63 Cb -0.05 -1.90 -0.00 0.00 0.10 0.00 0.00 34.13 32.28 2b2d s GLU 63 CO -0.00 -0.13 -0.16 0.08 0.02 0.00 0.00 175.26 175.07 2b2d s VAL 64 N 1.19 2.65 0.41 2.63 1.01 -0.68 -1.96 120.40 125.66 2b2d s VAL 64 Ca -0.02 -0.79 -0.22 0.00 0.00 0.00 0.00 61.98 60.95 2b2d s VAL 64 Cb -0.14 -2.10 -0.11 0.00 0.00 0.00 0.00 36.38 34.03 2b2d s VAL 64 CO -0.05 0.52 0.96 -2.16 0.00 0.00 0.00 175.10 174.38 2b2d s PRO 65 N 0.63 4.26 -0.22 2.72 0.04 -1.26 -1.05 135.00 140.11 2b2d s PRO 65 Ca -0.09 1.19 -0.27 0.00 0.04 0.00 0.00 61.00 61.87 2b2d s PRO 65 Cb -0.16 -2.30 0.00 0.00 0.04 0.00 0.00 34.50 32.09 2b2d s PRO 65 CO 0.03 -0.01 0.96 0.21 0.04 0.00 0.00 177.00 178.23 2b2d s LYS 66 N -2.96 4.25 -0.14 4.56 2.20 -0.34 -4.91 119.74 122.40 2b2d s LYS 66 Ca 0.60 1.22 0.05 0.00 -0.36 0.00 0.00 55.97 57.48 2b2d s LYS 66 Cb -0.12 -3.63 -0.23 0.00 -1.51 0.00 0.00 37.83 32.34 2b2d s LYS 66 CO 0.16 -0.55 0.28 0.28 -0.36 0.00 0.00 175.35 175.15 2b2d n VAL 67 N 5.20 1.61 -1.66 4.02 0.31 -1.26 -4.68 118.33 121.87 2b2d n VAL 67 Ca 0.09 -0.71 -0.48 0.00 -0.01 0.00 0.00 64.34 63.23 2b2d n VAL 67 Cb 0.47 -1.25 -0.05 0.00 -0.91 0.00 0.00 33.84 32.10 2b2d n VAL 67 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2b2d n ALA 68 N -2.88 0.70 -1.96 3.52 0.00 -1.26 -0.97 120.51 117.66 2b2d n ALA 68 Ca -0.31 0.43 -0.17 0.00 0.00 0.00 0.00 53.44 53.39 2b2d n ALA 68 Cb 1.06 -2.31 -0.04 0.00 0.00 0.00 0.00 19.45 18.16 2b2d n ALA 68 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2b2d n THR 69 N 3.54 -0.42 -2.24 0.00 -2.24 -1.26 -4.96 114.28 106.70 2b2d n THR 69 Ca 0.19 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.64 2b2d n THR 69 Cb 0.26 -2.08 -0.01 0.00 -2.10 0.00 0.00 70.33 66.40 2b2d n THR 69 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2b2d s GLN 70 N -4.26 3.57 -0.43 -0.78 0.74 -0.14 -5.03 119.66 113.32 2b2d s GLN 70 Ca 0.00 1.18 0.03 0.00 0.05 0.00 0.00 55.36 56.62 2b2d s GLN 70 Cb 0.00 -2.07 0.12 0.00 1.10 0.00 0.00 33.01 32.16 2b2d s GLN 70 CO 0.00 -0.60 0.17 0.99 -0.55 0.00 0.00 175.29 175.29 2b2d s THR 71 N -2.38 2.57 -0.37 -0.34 2.01 -1.26 -5.06 115.64 110.81 2b2d s THR 71 Ca 0.63 -2.74 -0.42 0.00 0.31 0.00 0.00 61.69 59.47 2b2d s THR 71 Cb -0.15 -2.83 -0.17 0.00 0.01 0.00 0.00 72.50 69.37 2b2d s THR 71 CO 0.32 -0.70 1.81 0.52 -0.69 0.00 0.00 174.62 175.87 2b2d n VAL 72 N 3.78 0.19 -0.80 3.82 0.31 -1.26 -0.16 118.33 124.21 2b2d n VAL 72 Ca 0.04 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 2b2d n VAL 72 Cb 0.38 -1.02 0.00 0.00 -0.91 0.00 0.00 33.84 32.28 2b2d n VAL 72 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2b2d n GLY 73 N 4.80 0.90 3.95 2.92 0.00 -1.26 -5.04 105.19 111.45 2b2d n GLY 73 Ca 0.32 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.09 2b2d n GLY 73 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b2d s GLY 74 N -1.80 1.73 -0.45 -0.02 0.00 0.77 -5.04 107.32 102.52 2b2d s GLY 74 Ca 0.00 -1.22 -0.16 0.00 0.00 0.00 0.00 44.72 43.34 2b2d s GLY 74 CO 0.00 -0.69 0.39 0.14 0.00 0.00 0.00 173.10 172.94 2b2d s VAL 75 N -3.34 5.19 -0.23 1.40 1.01 -1.26 -5.01 120.40 118.16 2b2d s VAL 75 Ca 0.65 -0.79 -0.03 0.00 0.00 0.00 0.00 61.98 61.80 2b2d s VAL 75 Cb -0.08 -4.07 0.00 0.00 0.00 0.00 0.00 36.38 32.24 2b2d s VAL 75 CO 0.46 -0.49 -0.05 -1.61 0.00 0.00 0.00 175.10 173.41 2b2d s GLU 76 N 1.80 3.19 0.14 2.72 2.02 -1.26 -5.10 118.70 122.21 2b2d s GLU 76 Ca 0.06 -0.75 0.10 0.00 0.02 0.00 0.00 54.97 54.40 2b2d s GLU 76 Cb -0.21 -3.00 -0.04 0.00 0.10 0.00 0.00 34.13 30.98 2b2d s GLU 76 CO 0.09 -0.27 -0.22 -0.51 0.02 0.00 0.00 175.26 174.37 2b2d s LEU 77 N 1.43 2.37 0.46 1.80 2.01 -1.26 -4.12 118.68 121.36 2b2d s LEU 77 Ca 0.04 -0.78 -0.20 0.00 0.01 0.00 0.00 54.13 53.20 2b2d s LEU 77 Cb -0.15 -1.00 -0.10 0.00 0.01 0.00 0.00 46.19 44.95 2b2d s LEU 77 CO -0.04 0.07 0.96 -2.16 1.01 0.00 0.00 176.35 176.20 2b2d s PRO 78 N -2.33 4.13 0.48 1.29 0.04 -1.26 -5.00 135.00 132.35 2b2d s PRO 78 Ca 0.13 1.08 0.15 0.00 0.04 0.00 0.00 61.00 62.40 2b2d s PRO 78 Cb -0.08 -2.16 1.14 0.00 0.04 0.00 0.00 34.50 33.43 2b2d s PRO 78 CO 0.06 -0.11 2.07 0.28 0.04 0.00 0.00 177.00 179.34 2b2d h VAL 79 N 1.61 0.97 0.00 -0.36 2.07 -2.00 -1.53 116.25 117.01 2b2d h VAL 79 Ca -0.48 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 66.94 2b2d h VAL 79 Cb 1.18 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 31.68 2b2d h VAL 79 CO 0.61 0.04 -0.11 0.00 0.02 0.00 0.00 177.57 178.13 2b2d h ALA 80 N 1.84 1.33 0.00 1.67 0.00 -1.93 -2.44 119.26 119.74 2b2d h ALA 80 Ca 0.13 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2b2d h ALA 80 Cb 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2b2d h ALA 80 CO -0.02 0.14 -0.35 0.00 0.00 0.00 0.00 179.25 179.01 2b2d h ALA 81 N 1.89 0.77 -0.25 0.00 0.00 -1.66 -3.35 119.26 116.66 2b2d h ALA 81 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2b2d h ALA 81 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2b2d h ALA 81 CO 0.01 0.00 0.00 0.91 0.00 0.00 0.00 179.25 180.17 2b2d n TRP 82 N -2.28 0.53 -3.81 0.00 7.02 -0.92 -4.94 117.44 113.04 2b2d n TRP 82 Ca 0.04 -0.66 -0.12 0.00 -1.02 0.00 0.00 57.50 55.73 2b2d n TRP 82 Cb 0.45 -0.14 -0.12 0.00 -2.42 0.00 0.00 31.31 29.08 2b2d n TRP 82 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 2b2d s ARG 83 N -1.76 0.25 -0.03 -0.99 0.52 -1.19 -1.20 118.95 114.55 2b2d s ARG 83 Ca 0.27 0.23 0.01 0.00 -0.52 0.00 0.00 55.73 55.73 2b2d s ARG 83 Cb 0.19 0.12 -0.03 0.00 0.52 0.00 0.00 34.95 35.75 2b2d s ARG 83 CO 0.10 -0.03 -0.05 -1.12 0.02 0.00 0.00 175.30 174.23 2b2d s SER 84 N 0.01 4.81 -0.12 0.23 0.01 -0.22 -4.91 113.70 113.50 2b2d s SER 84 Ca -0.01 -0.04 0.03 0.00 1.31 0.00 0.00 55.95 57.24 2b2d s SER 84 Cb -0.02 -1.21 0.00 0.00 0.21 0.00 0.00 66.02 65.00 2b2d s SER 84 CO 0.00 0.32 -0.22 -0.31 0.41 0.00 0.00 173.24 173.45 2b2d s TYR 85 N -0.93 2.64 -0.12 2.43 2.02 -1.26 -1.68 117.35 120.44 2b2d s TYR 85 Ca 0.15 -1.16 -0.00 0.00 -0.37 0.00 0.00 57.07 55.69 2b2d s TYR 85 Cb -0.11 -1.78 -0.02 0.00 -0.40 0.00 0.00 41.96 39.65 2b2d s TYR 85 CO 0.05 -0.50 -0.10 -1.17 -1.57 0.00 0.00 175.55 172.26 2b2d s LEU 86 N 0.60 2.90 -0.26 -1.29 2.96 0.42 -5.00 118.68 119.00 2b2d s LEU 86 Ca -0.12 -0.23 -0.02 0.00 -0.22 0.00 0.00 54.13 53.54 2b2d s LEU 86 Cb -0.17 -1.65 0.08 0.00 0.50 0.00 0.00 46.19 44.96 2b2d s LEU 86 CO 0.03 0.21 0.08 -0.55 -1.32 0.00 0.00 176.35 174.80 2b2d s SER 87 N 0.07 3.49 -0.05 3.68 0.15 -1.26 -0.75 113.70 119.03 2b2d s SER 87 Ca -0.04 -1.25 -0.04 0.00 0.70 0.00 0.00 55.95 55.32 2b2d s SER 87 Cb -0.14 -0.66 -0.04 0.00 -1.71 0.00 0.00 66.02 63.47 2b2d s SER 87 CO 0.04 -0.38 0.17 -0.04 1.20 0.00 0.00 173.24 174.23 2b2d s MET 88 N 1.81 3.44 -0.14 5.44 -1.94 0.71 -5.00 119.30 123.63 2b2d s MET 88 Ca 0.05 -0.24 -0.04 0.00 -1.71 0.00 0.00 55.69 53.75 2b2d s MET 88 Cb -0.17 -3.13 0.05 0.00 2.01 0.00 0.00 34.83 33.59 2b2d s MET 88 CO -0.21 0.71 0.06 0.15 -0.01 0.00 0.00 175.02 175.73 2b2d s LYS 89 N -1.60 0.20 -0.30 2.03 -0.14 -1.26 -1.29 119.74 117.37 2b2d s LYS 89 Ca 0.23 -0.03 -0.06 0.00 -1.36 0.00 0.00 55.97 54.75 2b2d s LYS 89 Cb -0.12 -1.52 0.02 0.00 -1.68 0.00 0.00 37.83 34.53 2b2d s LYS 89 CO 0.13 -0.56 0.06 -1.17 -0.76 0.00 0.00 175.35 173.06 2b2d s LEU 90 N 2.08 3.89 -0.23 3.17 2.96 -0.54 -4.99 118.68 125.02 2b2d s LEU 90 Ca 0.02 -0.90 -0.11 0.00 -0.22 0.00 0.00 54.13 52.93 2b2d s LEU 90 Cb -0.15 -1.83 -0.05 0.00 0.50 0.00 0.00 46.19 44.66 2b2d s LEU 90 CO -0.07 -0.23 0.19 -0.89 -1.32 0.00 0.00 176.35 174.04 2b2d s THR 91 N 1.43 5.34 -0.10 3.68 2.01 -1.26 -0.93 115.64 125.81 2b2d s THR 91 Ca 0.00 0.27 -0.01 0.00 0.31 0.00 0.00 61.69 62.26 2b2d s THR 91 Cb -0.18 -3.53 0.03 0.00 0.01 0.00 0.00 72.50 68.82 2b2d s THR 91 CO 0.01 0.35 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.61 2b2d s ILE 92 N 0.97 0.85 0.62 1.82 1.01 -0.37 -4.98 121.20 121.12 2b2d s ILE 92 Ca 0.09 -0.18 -0.18 0.00 0.00 0.00 0.00 60.65 60.39 2b2d s ILE 92 Cb -0.13 -0.91 -0.04 0.00 0.01 0.00 0.00 42.46 41.39 2b2d s ILE 92 CO 0.04 0.34 1.00 -2.65 0.00 0.00 0.00 174.94 173.67 2b2d n PRO 93 N 5.00 0.87 0.00 2.79 -0.02 -1.26 -1.00 135.00 141.39 2b2d n PRO 93 Ca -0.11 0.34 0.05 0.00 -2.02 0.00 0.00 63.50 61.77 2b2d n PRO 93 Cb 0.50 -2.22 0.27 0.00 -0.02 0.00 0.00 33.50 32.04 2b2d n PRO 93 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 2b2d n ILE 94 N -1.85 0.76 0.97 4.25 -5.35 0.13 -2.27 119.36 116.00 2b2d n ILE 94 Ca 0.14 0.19 0.12 0.00 -0.27 0.00 0.00 62.75 62.94 2b2d n ILE 94 Cb 0.48 -1.01 0.32 0.00 -1.74 0.00 0.00 39.64 37.69 2b2d n ILE 94 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 2b2d n PHE 95 N -1.30 0.04 -1.94 4.28 3.72 -1.26 -4.88 117.46 116.11 2b2d n PHE 95 Ca 0.05 0.01 -0.42 0.00 -0.05 0.00 0.00 57.45 57.04 2b2d n PHE 95 Cb 0.09 -0.33 -0.03 0.00 -0.94 0.00 0.00 39.48 38.28 2b2d n PHE 95 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2b2d s ALA 96 N -3.01 3.63 0.78 4.37 0.00 -0.96 -5.00 121.76 121.57 2b2d s ALA 96 Ca 0.11 1.06 -0.09 0.00 0.00 0.00 0.00 51.96 53.05 2b2d s ALA 96 Cb 0.18 -3.74 0.11 0.00 0.00 0.00 0.00 23.12 19.66 2b2d s ALA 96 CO 0.67 -1.33 1.11 0.95 0.00 0.00 0.00 175.76 177.16 2b2d s THR 97 N 3.67 2.15 0.24 0.00 -4.23 -1.26 -4.86 115.64 111.35 2b2d s THR 97 Ca 0.75 -0.23 -0.05 0.00 -1.18 0.00 0.00 61.69 60.99 2b2d s THR 97 Cb -0.36 -2.93 0.20 0.00 1.34 0.00 0.00 72.50 70.75 2b2d s THR 97 CO 0.32 0.00 1.81 0.78 -0.54 0.00 0.00 174.62 176.99 2b2d h ASN 98 N -0.90 0.66 0.05 3.99 2.35 -1.99 -1.72 115.58 118.02 2b2d h ASN 98 Ca -0.43 0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.36 2b2d h ASN 98 Cb 1.29 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 39.57 2b2d h ASN 98 CO 0.52 0.38 -0.05 0.28 -1.65 0.00 0.00 177.43 176.91 2b2d h SER 99 N 0.78 -0.14 -0.91 5.81 0.02 -1.99 -0.41 113.55 116.71 2b2d h SER 99 Ca 0.38 0.01 0.20 0.00 -0.84 0.00 0.00 61.79 61.54 2b2d h SER 99 Cb 0.33 0.05 -0.11 0.00 0.14 0.00 0.00 62.40 62.81 2b2d h SER 99 CO -0.24 -0.08 0.46 0.44 -1.14 0.00 0.00 176.83 176.27 2b2d h ASP 100 N -0.12 0.49 -0.09 3.07 3.32 -1.73 0.22 116.42 121.59 2b2d h ASP 100 Ca 0.00 0.12 -0.13 0.00 0.02 0.00 0.00 57.03 57.05 2b2d h ASP 100 Cb 0.11 0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 2b2d h ASP 100 CO -0.02 0.12 -0.38 0.00 -1.72 0.00 0.00 179.24 177.24 2b2d h GLU 102 N 0.51 1.05 -0.32 0.00 5.08 0.66 -0.95 114.58 120.61 2b2d h GLU 102 Ca 0.05 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 2b2d h GLU 102 Cb 0.88 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 2b2d h GLU 102 CO 0.08 0.76 0.10 1.25 -1.00 0.00 0.00 179.01 180.20 2b2d h LEU 103 N 1.06 0.48 -1.57 1.33 5.85 -0.89 -1.11 115.31 120.45 2b2d h LEU 103 Ca 0.27 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2b2d h LEU 103 Cb 0.01 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 2b2d h LEU 103 CO -0.04 0.56 0.29 0.40 -0.34 0.00 0.00 178.44 179.31 2b2d h ILE 104 N 0.37 1.11 -0.14 4.05 2.04 -0.90 0.21 117.51 124.25 2b2d h ILE 104 Ca 0.10 -0.20 -0.09 0.00 1.00 0.00 0.00 64.86 65.67 2b2d h ILE 104 Cb 0.26 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 2b2d h ILE 104 CO -0.00 0.11 -0.25 0.58 0.00 0.00 0.00 178.15 178.59 2b2d h VAL 105 N 0.59 1.37 -0.81 1.67 2.07 -0.80 -2.52 116.25 117.82 2b2d h VAL 105 Ca 0.16 -1.50 0.07 0.00 0.82 0.00 0.00 66.70 66.25 2b2d h VAL 105 Cb -0.07 2.01 -0.05 0.00 -1.52 0.00 0.00 31.29 31.66 2b2d h VAL 105 CO -0.03 0.44 0.53 0.11 0.02 0.00 0.00 177.57 178.64 2b2d h LYS 106 N 0.01 0.84 -0.51 1.57 1.57 -0.28 -1.05 116.57 118.72 2b2d h LYS 106 Ca 0.01 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.66 2b2d h LYS 106 Cb 0.83 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.94 2b2d h LYS 106 CO 0.06 0.55 0.02 0.00 -0.57 0.00 0.00 179.45 179.51 2b2d h ALA 107 N 1.57 0.68 -0.19 3.86 0.00 -0.89 -1.28 119.26 123.01 2b2d h ALA 107 Ca 0.36 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 2b2d h ALA 107 Cb 0.28 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2b2d h ALA 107 CO -0.13 0.48 -0.23 0.52 0.00 0.00 0.00 179.25 179.89 2b2d h MET 108 N 0.76 0.35 -0.42 0.00 2.86 -0.84 -1.09 114.93 116.54 2b2d h MET 108 Ca 0.15 -0.12 -0.13 0.00 -2.06 0.00 0.00 59.70 57.54 2b2d h MET 108 Cb 0.49 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.11 2b2d h MET 108 CO 0.02 0.56 -0.25 1.96 1.06 0.00 0.00 176.91 180.27 2b2d h GLN 109 N 0.32 0.91 -0.53 1.72 4.20 -0.92 -3.00 115.11 117.81 2b2d h GLN 109 Ca 0.05 -0.42 -0.11 0.00 0.06 0.00 0.00 58.65 58.24 2b2d h GLN 109 Cb 0.58 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.33 2b2d h GLN 109 CO 0.04 1.07 -0.09 0.78 -0.67 0.00 0.00 178.83 179.97 2b2d h GLY 110 N 0.74 1.07 0.10 3.46 0.00 -0.90 -1.40 103.07 106.15 2b2d h GLY 110 Ca 0.09 -0.86 0.08 0.00 0.00 0.00 0.00 47.33 46.65 2b2d h GLY 110 CO 0.07 0.78 -0.15 -2.00 0.00 0.00 0.00 176.54 175.24 2b2d h LEU 111 N 0.86 -0.52 -1.16 3.11 5.85 -1.13 -2.20 115.31 120.12 2b2d h LEU 111 Ca 0.14 0.14 0.00 0.00 0.84 0.00 0.00 57.88 59.00 2b2d h LEU 111 Cb 0.65 0.31 0.00 0.00 0.37 0.00 0.00 40.66 41.98 2b2d h LEU 111 CO 0.04 -0.18 0.00 0.18 -0.34 0.00 0.00 178.44 178.14 2b2d n LEU 112 N -5.35 1.75 -4.72 2.25 4.77 -1.14 -4.38 117.00 110.18 2b2d n LEU 112 Ca 0.02 -0.73 -0.38 0.00 -0.03 0.00 0.00 56.01 54.89 2b2d n LEU 112 Cb 0.26 -0.11 0.05 0.00 -2.33 0.00 0.00 43.42 41.29 2b2d n LEU 112 CO 0.13 0.36 0.91 1.17 -1.33 0.00 0.00 177.39 178.64 2b2d n LYS 113 N 0.38 1.47 -1.68 3.23 4.81 -0.54 -4.77 118.16 121.06 2b2d n LYS 113 Ca 0.16 0.55 -0.44 0.00 -0.87 0.00 0.00 58.31 57.71 2b2d n LYS 113 Cb 0.34 -2.51 -0.03 0.00 0.02 0.00 0.00 35.03 32.84 2b2d n LYS 113 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2b2d n ASP 114 N -1.15 3.87 0.00 3.14 2.03 -1.26 -2.16 116.55 121.01 2b2d n ASP 114 Ca 0.12 0.98 0.00 0.00 0.52 0.00 0.00 54.79 56.41 2b2d n ASP 114 Cb 0.45 -1.50 0.00 0.00 -0.72 0.00 0.00 41.12 39.36 2b2d n ASP 114 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2b2d n GLY 115 N 4.25 2.89 3.79 0.27 0.00 -1.26 -5.07 105.19 110.05 2b2d n GLY 115 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 2b2d n GLY 115 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2b2d s ASN 116 N -0.58 5.94 0.28 1.61 0.01 -0.92 -4.85 114.94 116.43 2b2d s ASN 116 Ca 0.00 2.04 -0.01 0.00 -0.71 0.00 0.00 52.86 54.18 2b2d s ASN 116 Cb 0.00 -2.57 0.63 0.00 0.41 0.00 0.00 41.25 39.72 2b2d s ASN 116 CO 0.00 -1.06 1.64 1.55 -1.51 0.00 0.00 177.10 177.71 2b2d h PRO 117 N 1.21 0.16 0.77 -0.60 0.13 -1.89 -2.46 132.00 129.32 2b2d h PRO 117 Ca -0.49 -0.01 -0.04 0.00 -0.87 0.00 0.00 66.00 64.59 2b2d h PRO 117 Cb 1.24 -0.04 0.01 0.00 0.13 0.00 0.00 31.00 32.34 2b2d h PRO 117 CO 0.58 0.10 -0.37 0.82 -0.23 0.00 0.00 178.00 178.90 2b2d h ILE 118 N 0.16 0.16 -0.41 -3.56 1.08 -1.93 -1.51 117.51 111.51 2b2d h ILE 118 Ca 0.51 -0.13 -0.04 0.00 -0.39 0.00 0.00 64.86 64.81 2b2d h ILE 118 Cb 1.00 0.19 -0.02 0.00 -3.07 0.00 0.00 36.82 34.92 2b2d h ILE 118 CO -0.68 0.01 0.07 1.55 -0.69 0.00 0.00 178.15 178.41 2b2d h PRO 119 N -1.15 0.62 0.00 2.37 0.13 -1.74 -2.27 132.00 129.96 2b2d h PRO 119 Ca -0.11 -0.12 -0.04 0.00 -0.87 0.00 0.00 66.00 64.87 2b2d h PRO 119 Cb 0.81 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 2b2d h PRO 119 CO 0.17 0.59 -0.17 0.66 -0.23 0.00 0.00 178.00 179.02 2b2d h SER 120 N 0.60 0.00 0.04 1.44 4.64 -1.42 -1.33 113.55 117.52 2b2d h SER 120 Ca 0.13 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.32 2b2d h SER 120 Cb 0.27 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.37 2b2d h SER 120 CO 0.00 0.17 -0.55 0.00 -0.87 0.00 0.00 176.83 175.58 2b2d h ALA 121 N 1.83 0.01 -0.26 5.18 0.00 -0.71 -3.16 119.26 122.15 2b2d h ALA 121 Ca -0.00 -0.58 0.01 0.00 0.00 0.00 0.00 54.91 54.33 2b2d h ALA 121 Cb 0.57 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2b2d h ALA 121 CO 0.02 0.28 0.16 0.82 0.00 0.00 0.00 179.25 180.53 2b2d h ILE 122 N -0.34 1.05 0.00 0.00 2.04 -1.27 -0.93 117.51 118.05 2b2d h ILE 122 Ca -0.08 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.67 2b2d h ILE 122 Cb 1.33 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 38.10 2b2d h ILE 122 CO 0.11 0.06 0.00 0.00 0.00 0.00 0.00 178.15 178.32 2b2d n ALA 123 N -2.18 1.34 -0.97 1.87 0.00 -0.52 -2.10 120.51 117.96 2b2d n ALA 123 Ca -0.02 -0.03 0.09 0.00 0.00 0.00 0.00 53.44 53.48 2b2d n ALA 123 Cb 0.04 -1.12 0.16 0.00 0.00 0.00 0.00 19.45 18.53 2b2d n ALA 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2b2d n ALA 124 N -1.49 2.42 -3.87 0.00 0.00 -0.75 -4.97 120.51 111.86 2b2d n ALA 124 Ca 0.02 -2.42 -0.30 0.00 0.00 0.00 0.00 53.44 50.73 2b2d n ALA 124 Cb 0.08 -0.44 0.01 0.00 0.00 0.00 0.00 19.45 19.10 2b2d n ALA 124 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2b2d n ASN 125 N -1.12 -4.34 -4.60 0.00 3.02 -0.89 -4.95 115.26 102.38 2b2d n ASN 125 Ca 0.16 -0.75 -0.30 0.00 -0.03 0.00 0.00 54.58 53.66 2b2d n ASN 125 Cb 0.67 -3.50 -0.08 0.00 -0.61 0.00 0.00 39.78 36.26 2b2d n ASN 125 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2b2d s SER 126 N -3.17 3.76 0.00 6.41 0.01 -0.43 -5.05 113.70 115.22 2b2d s SER 126 Ca 0.63 -1.61 0.00 0.00 1.31 0.00 0.00 55.95 56.29 2b2d s SER 126 Cb -0.33 0.36 0.00 0.00 0.21 0.00 0.00 66.02 66.26 2b2d s SER 126 CO 0.78 -0.80 0.00 0.61 0.41 0.00 0.00 173.24 174.24 2b2d n GLY 127 N -1.13 6.68 3.88 3.44 0.00 -1.26 -4.38 105.19 112.41 2b2d n GLY 127 Ca -0.14 -1.94 -0.34 0.00 0.00 0.00 0.00 46.02 43.60 2b2d n GLY 127 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b2d s ILE 128 N 1.42 5.18 0.00 -0.61 -1.09 -1.26 -4.87 121.20 119.96 2b2d s ILE 128 Ca 0.00 0.31 0.00 0.00 -2.23 0.00 0.00 60.65 58.73 2b2d s ILE 128 Cb 0.00 -3.62 0.00 0.00 -1.58 0.00 0.00 42.46 37.26 2b2d s ILE 128 CO 0.00 0.29 0.00 0.00 -1.23 0.00 0.00 174.94 174.00