#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b2d s SER 2 N 0.00 -0.52 0.00 0.00 0.15 -1.26 -5.01 113.70 107.06 2b2d s SER 2 Ca 0.00 0.98 0.04 0.00 0.70 0.00 0.00 55.95 57.67 2b2d s SER 2 Cb 0.00 0.99 0.08 0.00 -1.71 0.00 0.00 66.02 65.38 2b2d s SER 2 CO 0.00 -0.19 0.91 -0.46 1.20 0.00 0.00 173.24 174.71 2b2d n ASN 3 N 2.25 1.95 -4.03 5.45 0.23 -1.26 -4.74 115.26 115.10 2b2d n ASN 3 Ca -0.13 -1.67 -0.43 0.00 -0.53 0.00 0.00 54.58 51.82 2b2d n ASN 3 Cb 0.56 -0.05 0.00 0.00 -2.08 0.00 0.00 39.78 38.21 2b2d n ASN 3 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 2b2d n PHE 4 N 0.02 3.31 -4.38 -2.53 7.35 -1.26 -4.91 117.46 115.05 2b2d n PHE 4 Ca 0.04 -2.92 -0.21 0.00 -0.76 0.00 0.00 57.45 53.59 2b2d n PHE 4 Cb 0.23 -1.83 -0.08 0.00 0.35 0.00 0.00 39.48 38.15 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 -0.20 0.32 0.48 -2.13 -4.23 -1.26 -4.82 115.64 103.80 2b2d s THR 5 Ca 0.38 -2.00 -0.19 0.00 -1.18 0.00 0.00 61.69 58.70 2b2d s THR 5 Cb 0.05 -2.45 -0.09 0.00 1.34 0.00 0.00 72.50 71.35 2b2d s THR 5 CO 0.02 0.00 0.98 0.00 -0.54 0.00 0.00 174.62 175.08 2b2d s GLN 6 N -3.67 4.02 0.18 3.99 -2.07 -1.26 -4.53 119.66 116.32 2b2d s GLN 6 Ca 0.33 1.07 -0.11 0.00 -1.82 0.00 0.00 55.36 54.83 2b2d s GLN 6 Cb 0.03 -2.15 -0.00 0.00 -1.09 0.00 0.00 33.01 29.81 2b2d s GLN 6 CO 0.19 -0.21 0.35 -0.59 -1.32 0.00 0.00 175.29 173.72 2b2d s PHE 7 N -2.38 0.32 -0.24 9.60 -0.71 -0.82 -5.00 117.98 118.74 2b2d s PHE 7 Ca 0.61 -0.67 -0.23 0.00 -1.04 0.00 0.00 56.93 55.59 2b2d s PHE 7 Cb -0.10 0.05 -0.01 0.00 -1.21 0.00 0.00 43.02 41.75 2b2d s PHE 7 CO 0.23 -0.80 0.77 0.08 -1.34 0.00 0.00 175.22 174.17 2b2d s VAL 8 N -3.96 4.88 -0.19 -2.49 1.01 -1.26 -1.39 120.40 117.00 2b2d s VAL 8 Ca 0.17 1.45 -0.22 0.00 0.00 0.00 0.00 61.98 63.37 2b2d s VAL 8 Cb 0.02 -4.06 -0.21 0.00 0.00 0.00 0.00 36.38 32.13 2b2d s VAL 8 CO 0.01 -0.04 0.34 0.25 0.00 0.00 0.00 175.10 175.66 2b2d h LEU 9 N 9.07 0.03 -8.40 3.92 5.85 -0.87 -3.45 115.31 121.47 2b2d h LEU 9 Ca -0.24 -0.63 -0.66 0.00 0.84 0.00 0.00 57.88 57.19 2b2d h LEU 9 Cb 1.10 -0.01 -0.30 0.00 0.37 0.00 0.00 40.66 41.83 2b2d h LEU 9 CO 0.84 1.42 -0.79 -0.69 -0.34 0.00 0.00 178.44 178.88 2b2d s VAL 10 N -2.35 2.80 -0.38 1.05 1.01 -1.00 -4.99 120.40 116.55 2b2d s VAL 10 Ca -0.26 -0.72 -0.12 0.00 0.00 0.00 0.00 61.98 60.88 2b2d s VAL 10 Cb 0.04 -2.20 0.02 0.00 0.00 0.00 0.00 36.38 34.24 2b2d s VAL 10 CO 0.62 0.50 0.23 -0.62 0.00 0.00 0.00 175.10 175.83 2b2d s ASP 11 N 0.89 5.82 -0.57 3.32 3.68 -1.26 -0.83 116.67 127.72 2b2d s ASP 11 Ca -0.03 -0.92 0.03 0.00 2.13 0.00 0.00 52.55 53.76 2b2d s ASP 11 Cb -0.15 -2.06 0.39 0.00 -1.45 0.00 0.00 42.92 39.65 2b2d s ASP 11 CO -0.01 -0.38 1.31 0.59 0.13 0.00 0.00 175.17 176.81 2b2d n ASN 12 N 5.04 5.37 0.00 -0.34 3.02 -1.26 -4.96 115.26 122.12 2b2d n ASN 12 Ca -0.12 -3.74 0.00 0.00 -0.03 0.00 0.00 54.58 50.69 2b2d n ASN 12 Cb 0.47 -0.63 0.00 0.00 -0.61 0.00 0.00 39.78 39.01 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 -0.45 1.90 0.00 7.41 0.00 -1.26 -2.75 105.19 110.04 2b2d n GLY 13 Ca 0.41 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.26 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 0.00 0.83 0.00 -0.02 0.00 -1.26 -4.92 105.19 99.82 2b2d n GLY 14 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2b2d n GLY 14 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2b2d n THR 15 N -0.02 0.00 0.00 2.61 -2.24 -1.11 -4.59 114.28 108.93 2b2d n THR 15 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2b2d n THR 15 Cb 0.18 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.41 2b2d n THR 15 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b2d n GLY 16 N 4.13 0.00 3.07 3.38 0.00 -1.26 -4.80 105.19 109.72 2b2d n GLY 16 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.46 2b2d n GLY 16 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2b2d n ASP 17 N -0.56 0.91 -4.58 1.61 9.92 -1.26 -4.74 116.55 117.85 2b2d n ASP 17 Ca 0.00 0.88 -0.41 0.00 -0.53 0.00 0.00 54.79 54.73 2b2d n ASP 17 Cb 0.00 -0.76 -0.08 0.00 -0.64 0.00 0.00 41.12 39.64 2b2d n ASP 17 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2b2d s VAL 18 N 3.38 5.06 -0.02 2.53 1.01 -0.01 -4.98 120.40 127.37 2b2d s VAL 18 Ca 0.94 0.46 0.01 0.00 0.00 0.00 0.00 61.98 63.39 2b2d s VAL 18 Cb -1.28 -3.89 -0.03 0.00 0.00 0.00 0.00 36.38 31.18 2b2d s VAL 18 CO 0.66 -0.09 -0.02 -0.89 0.00 0.00 0.00 175.10 174.76 2b2d s THR 19 N 2.30 4.05 -0.04 3.92 2.01 -1.26 -0.12 115.64 126.50 2b2d s THR 19 Ca 0.18 -0.57 0.06 0.00 0.31 0.00 0.00 61.69 61.67 2b2d s THR 19 Cb -0.16 -2.77 -0.01 0.00 0.01 0.00 0.00 72.50 69.57 2b2d s THR 19 CO 0.12 0.43 -0.23 0.54 -0.69 0.00 0.00 174.62 174.79 2b2d s VAL 20 N -1.02 1.89 0.13 3.82 0.11 -0.49 -4.22 120.40 120.63 2b2d s VAL 20 Ca 0.18 -0.99 0.09 0.00 -2.93 0.00 0.00 61.98 58.33 2b2d s VAL 20 Cb -0.11 -1.59 -0.04 0.00 -1.53 0.00 0.00 36.38 33.11 2b2d s VAL 20 CO 0.08 0.53 -0.22 0.00 -3.33 0.00 0.00 175.10 172.15 2b2d s ALA 21 N -0.26 2.10 0.15 1.54 0.00 -0.45 -1.95 121.76 122.89 2b2d s ALA 21 Ca 0.01 -1.41 -0.34 0.00 0.00 0.00 0.00 51.96 50.22 2b2d s ALA 21 Cb -0.12 -0.28 -0.16 0.00 0.00 0.00 0.00 23.12 22.56 2b2d s ALA 21 CO 0.02 0.40 1.24 -2.30 0.00 0.00 0.00 175.76 175.12 2b2d n PRO 22 N 0.77 1.25 -0.01 0.00 -0.02 -1.26 -1.24 135.00 134.49 2b2d n PRO 22 Ca -0.17 0.45 -0.02 0.00 -2.02 0.00 0.00 63.50 61.74 2b2d n PRO 22 Cb 0.54 -2.00 -0.01 0.00 -0.02 0.00 0.00 33.50 32.01 2b2d n PRO 22 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2b2d n SER 23 N 2.22 0.29 -3.52 2.55 2.88 0.67 -4.80 113.62 113.91 2b2d n SER 23 Ca 0.16 0.02 -0.14 0.00 -1.33 0.00 0.00 58.87 57.58 2b2d n SER 23 Cb 0.24 -0.06 -0.04 0.00 -0.75 0.00 0.00 64.21 63.59 2b2d n SER 23 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 2b2d s ASN 24 N -5.14 -0.51 -0.34 -3.46 3.84 -1.17 -5.02 114.94 103.13 2b2d s ASN 24 Ca -0.03 0.20 0.16 0.00 0.21 0.00 0.00 52.86 53.40 2b2d s ASN 24 Cb 0.01 0.53 0.44 0.00 -0.55 0.00 0.00 41.25 41.68 2b2d s ASN 24 CO 0.04 -0.78 0.99 0.33 -2.79 0.00 0.00 177.10 174.88 2b2d n PHE 25 N 0.22 0.48 -3.28 0.43 -0.00 -1.26 -0.75 117.46 113.29 2b2d n PHE 25 Ca -0.18 -2.75 -0.39 0.00 -0.00 0.00 0.00 57.45 54.13 2b2d n PHE 25 Cb 0.61 -0.07 -0.06 0.00 -0.00 0.00 0.00 39.48 39.97 2b2d n PHE 25 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2b2d s ALA 26 N -2.53 3.58 -1.31 3.13 0.00 -1.21 -4.29 121.76 119.12 2b2d s ALA 26 Ca 0.27 0.01 -0.05 0.00 0.00 0.00 0.00 51.96 52.20 2b2d s ALA 26 Cb 0.44 -2.63 0.01 0.00 0.00 0.00 0.00 23.12 20.93 2b2d s ALA 26 CO 0.01 0.36 0.65 0.09 0.00 0.00 0.00 175.76 176.87 2b2d n ASN 27 N 1.92 -5.61 -0.20 0.00 5.03 -1.26 -2.26 115.26 112.88 2b2d n ASN 27 Ca -0.10 -0.30 -0.03 0.00 0.87 0.00 0.00 54.58 55.02 2b2d n ASN 27 Cb 0.51 -4.39 -0.01 0.00 -1.02 0.00 0.00 39.78 34.86 2b2d n ASN 27 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2b2d n GLY 28 N -1.52 0.50 3.15 7.41 0.00 -1.26 -4.98 105.19 108.50 2b2d n GLY 28 Ca -0.07 -0.17 -0.34 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.77 2.81 0.14 1.61 1.01 -0.96 -4.48 120.40 118.76 2b2d s VAL 29 Ca 0.00 -1.41 -0.29 0.00 0.00 0.00 0.00 61.98 60.28 2b2d s VAL 29 Cb 0.00 -2.61 -0.07 0.00 0.00 0.00 0.00 36.38 33.71 2b2d s VAL 29 CO 0.00 -0.07 0.93 0.00 0.00 0.00 0.00 175.10 175.96 2b2d s ALA 30 N 1.23 3.29 -0.02 5.51 0.00 -0.21 -3.35 121.76 128.20 2b2d s ALA 30 Ca -0.06 0.55 0.03 0.00 0.00 0.00 0.00 51.96 52.49 2b2d s ALA 30 Cb -0.20 -3.22 -0.00 0.00 0.00 0.00 0.00 23.12 19.70 2b2d s ALA 30 CO -0.02 0.06 -0.12 -2.00 0.00 0.00 0.00 175.76 173.68 2b2d s GLU 31 N -0.37 1.16 0.02 0.00 2.12 0.07 -1.11 118.70 120.60 2b2d s GLU 31 Ca 0.44 -0.42 0.07 0.00 0.36 0.00 0.00 54.97 55.42 2b2d s GLU 31 Cb -0.24 -1.08 -0.02 0.00 0.26 0.00 0.00 34.13 33.05 2b2d s GLU 31 CO 0.30 0.20 -0.21 -1.58 -0.54 0.00 0.00 175.26 173.43 2b2d s TRP 32 N -0.01 1.83 0.01 5.30 0.51 0.55 -0.23 118.94 126.90 2b2d s TRP 32 Ca -0.01 -0.36 0.01 0.00 -2.12 0.00 0.00 56.10 53.62 2b2d s TRP 32 Cb -0.08 -1.12 -0.01 0.00 -0.81 0.00 0.00 33.47 31.45 2b2d s TRP 32 CO 0.00 0.05 -0.04 0.42 -0.51 0.00 0.00 176.95 176.88 2b2d s ILE 33 N -0.68 0.24 0.92 2.03 -1.09 -0.37 -1.51 121.20 120.74 2b2d s ILE 33 Ca 0.08 -0.42 -0.14 0.00 -2.23 0.00 0.00 60.65 57.94 2b2d s ILE 33 Cb -0.08 -0.27 0.15 0.00 -1.58 0.00 0.00 42.46 40.68 2b2d s ILE 33 CO 0.01 -0.12 1.20 -0.94 -1.23 0.00 0.00 174.94 173.86 2b2d s SER 34 N -0.58 3.52 0.90 3.58 1.04 -0.72 -1.35 113.70 120.10 2b2d s SER 34 Ca -0.04 0.68 -0.14 0.00 0.48 0.00 0.00 55.95 56.92 2b2d s SER 34 Cb -0.04 -1.05 0.15 0.00 0.10 0.00 0.00 66.02 65.19 2b2d s SER 34 CO -0.00 -2.52 1.27 -0.55 0.98 0.00 0.00 173.24 172.42 2b2d s SER 35 N -4.45 3.64 0.40 7.02 0.15 -1.26 -4.73 113.70 114.48 2b2d s SER 35 Ca 0.67 0.47 0.00 0.00 0.70 0.00 0.00 55.95 57.78 2b2d s SER 35 Cb -0.10 -0.68 0.00 0.00 -1.71 0.00 0.00 66.02 63.53 2b2d s SER 35 CO 0.52 -2.42 0.00 0.59 1.20 0.00 0.00 173.24 173.13 2b2d n ASN 36 N -3.60 -2.34 -3.98 5.45 3.02 -1.26 -4.78 115.26 107.77 2b2d n ASN 36 Ca 0.12 0.00 -0.57 0.00 -0.03 0.00 0.00 54.58 54.10 2b2d n ASN 36 Cb 0.60 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.68 2b2d n ASN 36 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2b2d n SER 37 N -0.63 0.99 -0.25 6.41 7.64 -1.26 -4.73 113.62 121.79 2b2d n SER 37 Ca 0.00 0.97 0.15 0.00 1.01 0.00 0.00 58.87 61.00 2b2d n SER 37 Cb 0.00 -0.75 0.45 0.00 -1.01 0.00 0.00 64.21 62.90 2b2d n SER 37 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 2b2d h ARG 38 N 4.54 0.53 -0.03 1.43 9.65 -1.91 -0.04 114.38 128.55 2b2d h ARG 38 Ca -0.35 -0.03 0.01 0.00 -1.10 0.00 0.00 59.98 58.51 2b2d h ARG 38 Cb 1.16 -0.12 -0.00 0.00 -1.39 0.00 0.00 29.97 29.62 2b2d h ARG 38 CO 0.84 0.35 0.08 0.66 2.80 0.00 0.00 179.97 184.70 2b2d h SER 39 N 0.54 0.00 0.00 -3.80 4.64 -1.87 -2.21 113.55 110.85 2b2d h SER 39 Ca 0.45 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.74 2b2d h SER 39 Cb 0.92 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.94 2b2d h SER 39 CO -0.19 0.00 -0.49 0.00 -0.87 0.00 0.00 176.83 175.27 2b2d n GLN 40 N -3.35 1.13 -3.34 4.77 6.02 -0.05 -3.73 117.38 118.84 2b2d n GLN 40 Ca -0.02 -2.76 -0.24 0.00 -0.01 0.00 0.00 57.00 53.97 2b2d n GLN 40 Cb 0.16 -1.22 -0.01 0.00 1.02 0.00 0.00 30.24 30.19 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 -2.35 3.68 0.30 -1.58 0.00 -0.83 -4.86 121.76 116.10 2b2d s ALA 41 Ca 0.33 -0.86 -0.16 0.00 0.00 0.00 0.00 51.96 51.27 2b2d s ALA 41 Cb 0.33 -2.15 -0.09 0.00 0.00 0.00 0.00 23.12 21.21 2b2d s ALA 41 CO -0.06 -0.02 0.73 0.71 0.00 0.00 0.00 175.76 177.12 2b2d s TYR 42 N -2.32 3.44 -0.01 0.00 1.51 -1.26 -4.58 117.35 114.13 2b2d s TYR 42 Ca 0.41 1.25 0.02 0.00 -1.01 0.00 0.00 57.07 57.74 2b2d s TYR 42 Cb -0.10 -2.55 -0.01 0.00 -0.11 0.00 0.00 41.96 39.20 2b2d s TYR 42 CO 0.36 0.16 -0.07 0.21 -1.11 0.00 0.00 175.55 175.10 2b2d s LYS 43 N -2.73 0.57 -0.03 -0.62 2.20 -1.12 -1.75 119.74 116.27 2b2d s LYS 43 Ca 0.51 -0.25 0.01 0.00 -0.36 0.00 0.00 55.97 55.88 2b2d s LYS 43 Cb -0.12 -0.55 0.02 0.00 -1.51 0.00 0.00 37.83 35.67 2b2d s LYS 43 CO 0.18 0.15 -0.04 0.08 -0.36 0.00 0.00 175.35 175.37 2b2d s VAL 44 N -0.17 0.41 0.06 4.02 1.01 -0.57 -0.46 120.40 124.69 2b2d s VAL 44 Ca 0.03 -0.10 0.02 0.00 0.00 0.00 0.00 61.98 61.93 2b2d s VAL 44 Cb -0.03 -0.43 -0.03 0.00 0.00 0.00 0.00 36.38 35.90 2b2d s VAL 44 CO -0.00 0.17 -0.08 0.42 0.00 0.00 0.00 175.10 175.61 2b2d s THR 45 N 0.62 0.63 -0.03 3.92 -4.23 0.07 -0.33 115.64 116.28 2b2d s THR 45 Ca -0.07 -1.26 -0.13 0.00 -1.18 0.00 0.00 61.69 59.05 2b2d s THR 45 Cb -0.11 -0.85 0.02 0.00 1.34 0.00 0.00 72.50 72.90 2b2d s THR 45 CO -0.00 -0.46 0.28 0.00 -0.54 0.00 0.00 174.62 173.90 2b2d s SER 47 N -1.07 -0.63 -0.05 0.00 1.04 -1.06 -1.05 113.70 110.88 2b2d s SER 47 Ca -0.11 0.92 0.05 0.00 0.48 0.00 0.00 55.95 57.28 2b2d s SER 47 Cb -0.05 0.83 -0.00 0.00 0.10 0.00 0.00 66.02 66.90 2b2d s SER 47 CO 0.03 -0.42 -0.20 -0.69 0.98 0.00 0.00 173.24 172.95 2b2d s VAL 48 N -0.55 1.66 0.07 5.02 1.01 -1.26 -0.62 120.40 125.72 2b2d s VAL 48 Ca -0.05 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.10 2b2d s VAL 48 Cb -0.02 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.90 2b2d s VAL 48 CO 0.04 0.47 -0.04 0.00 0.00 0.00 0.00 175.10 175.57 2b2d s ARG 49 N 0.03 0.69 -0.85 2.72 1.70 -0.85 -4.97 118.95 117.42 2b2d s ARG 49 Ca -0.06 -1.25 -0.21 0.00 -0.47 0.00 0.00 55.73 53.75 2b2d s ARG 49 Cb -0.13 0.05 0.09 0.00 -0.57 0.00 0.00 34.95 34.39 2b2d s ARG 49 CO 0.03 -0.07 1.14 -1.14 -1.08 0.00 0.00 175.30 174.18 2b2d s GLN 50 N -3.82 3.43 0.42 3.89 2.00 -1.26 -0.29 119.66 124.02 2b2d s GLN 50 Ca 0.08 -1.30 0.30 0.00 -2.00 0.00 0.00 55.36 52.44 2b2d s GLN 50 Cb 0.06 -4.75 1.39 0.00 0.80 0.00 0.00 33.01 30.52 2b2d s GLN 50 CO -0.08 -1.88 1.89 0.66 -0.50 0.00 0.00 175.29 175.39 2b2d h SER 51 N 9.27 0.00 -0.70 6.67 4.64 -1.54 -3.47 113.55 128.43 2b2d h SER 51 Ca 0.01 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.34 2b2d h SER 51 Cb 1.04 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.12 2b2d h SER 51 CO 1.19 0.00 0.06 -1.54 -0.87 0.00 0.00 176.83 175.67 2b2d n SER 52 N -2.61 -0.15 -0.30 4.97 3.41 -1.05 -4.94 113.62 112.94 2b2d n SER 52 Ca -0.00 -1.08 -0.01 0.00 -0.26 0.00 0.00 58.87 57.52 2b2d n SER 52 Cb 0.17 0.25 0.16 0.00 -0.26 0.00 0.00 64.21 64.53 2b2d n SER 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b2d h ALA 53 N 2.00 1.33 -0.01 7.33 0.00 -2.04 -3.25 119.26 124.63 2b2d h ALA 53 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2b2d h ALA 53 Cb 0.11 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2b2d h ALA 53 CO 0.03 0.60 -0.25 1.04 0.00 0.00 0.00 179.25 180.67 2b2d n GLN 54 N -4.39 2.28 -4.58 0.00 6.02 -1.26 -4.93 117.38 110.52 2b2d n GLN 54 Ca 0.10 -0.53 -0.27 0.00 -0.01 0.00 0.00 57.00 56.29 2b2d n GLN 54 Cb 0.04 -1.08 -0.14 0.00 1.02 0.00 0.00 30.24 30.08 2b2d n GLN 54 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 2b2d s ASN 55 N -1.48 2.85 -0.03 1.08 0.01 -1.23 0.45 114.94 116.60 2b2d s ASN 55 Ca 0.08 -0.62 0.03 0.00 -0.71 0.00 0.00 52.86 51.64 2b2d s ASN 55 Cb 0.08 -0.22 -0.03 0.00 0.41 0.00 0.00 41.25 41.50 2b2d s ASN 55 CO 0.29 0.17 -0.11 -0.13 -1.51 0.00 0.00 177.10 175.80 2b2d s ARG 56 N -1.53 2.51 -0.11 -0.60 0.52 -0.68 -1.39 118.95 117.66 2b2d s ARG 56 Ca 0.10 -0.71 0.02 0.00 -0.52 0.00 0.00 55.73 54.62 2b2d s ARG 56 Cb -0.10 -2.43 0.01 0.00 0.52 0.00 0.00 34.95 32.96 2b2d s ARG 56 CO 0.03 0.62 -0.17 0.21 0.02 0.00 0.00 175.30 176.01 2b2d s LYS 57 N -1.01 2.36 0.02 3.54 2.20 0.60 -1.33 119.74 126.11 2b2d s LYS 57 Ca 0.13 -0.61 -0.11 0.00 -0.36 0.00 0.00 55.97 55.02 2b2d s LYS 57 Cb -0.11 -1.98 -0.05 0.00 -1.51 0.00 0.00 37.83 34.18 2b2d s LYS 57 CO 0.03 -0.04 0.37 0.71 -0.36 0.00 0.00 175.35 176.05 2b2d s TYR 58 N 0.93 3.65 -0.30 4.03 1.51 0.58 -2.00 117.35 125.75 2b2d s TYR 58 Ca -0.07 0.84 0.00 0.00 -1.01 0.00 0.00 57.07 56.83 2b2d s TYR 58 Cb -0.15 -2.18 0.09 0.00 -0.11 0.00 0.00 41.96 39.61 2b2d s TYR 58 CO -0.01 0.61 0.07 0.99 -1.11 0.00 0.00 175.55 176.09 2b2d s THR 59 N -1.21 1.21 -0.11 -0.71 2.01 0.21 -1.56 115.64 115.47 2b2d s THR 59 Ca 0.27 -1.53 -0.07 0.00 0.31 0.00 0.00 61.69 60.66 2b2d s THR 59 Cb -0.15 -1.86 -0.04 0.00 0.01 0.00 0.00 72.50 70.46 2b2d s THR 59 CO 0.14 -0.58 0.15 -0.63 -0.69 0.00 0.00 174.62 173.01 2b2d s ILE 60 N 1.46 5.49 -0.01 1.82 -1.09 -0.19 -2.56 121.20 126.12 2b2d s ILE 60 Ca 0.08 0.23 0.01 0.00 -2.23 0.00 0.00 60.65 58.73 2b2d s ILE 60 Cb -0.18 -3.41 0.01 0.00 -1.58 0.00 0.00 42.46 37.30 2b2d s ILE 60 CO -0.19 0.62 -0.01 -0.54 -1.23 0.00 0.00 174.94 173.58 2b2d s LYS 61 N -1.04 0.20 0.01 2.79 1.02 -0.22 -0.57 119.74 121.93 2b2d s LYS 61 Ca 0.15 -0.02 0.03 0.00 0.02 0.00 0.00 55.97 56.16 2b2d s LYS 61 Cb -0.12 -0.27 -0.01 0.00 -0.52 0.00 0.00 37.83 36.90 2b2d s LYS 61 CO 0.04 -0.02 -0.09 0.08 -0.92 0.00 0.00 175.35 174.44 2b2d s VAL 62 N 0.34 0.74 -0.11 3.17 1.01 -0.74 -0.75 120.40 124.05 2b2d s VAL 62 Ca -0.03 -0.54 0.03 0.00 0.00 0.00 0.00 61.98 61.44 2b2d s VAL 62 Cb -0.05 -0.65 0.01 0.00 0.00 0.00 0.00 36.38 35.69 2b2d s VAL 62 CO -0.01 0.11 -0.19 -1.61 0.00 0.00 0.00 175.10 173.41 2b2d s GLU 63 N -0.48 2.53 -0.24 2.72 2.02 0.39 -0.92 118.70 124.71 2b2d s GLU 63 Ca 0.02 -0.69 -0.02 0.00 0.02 0.00 0.00 54.97 54.30 2b2d s GLU 63 Cb -0.05 -2.04 0.02 0.00 0.10 0.00 0.00 34.13 32.16 2b2d s GLU 63 CO -0.00 0.03 -0.06 0.08 0.02 0.00 0.00 175.26 175.32 2b2d s VAL 64 N 0.72 2.92 0.29 2.63 1.01 -0.54 -2.77 120.40 124.65 2b2d s VAL 64 Ca -0.11 -0.92 -0.05 0.00 0.00 0.00 0.00 61.98 60.89 2b2d s VAL 64 Cb -0.16 -2.44 -0.05 0.00 0.00 0.00 0.00 36.38 33.72 2b2d s VAL 64 CO 0.02 0.26 0.55 -2.16 0.00 0.00 0.00 175.10 173.77 2b2d s PRO 65 N 1.35 3.64 -0.50 2.72 0.04 -1.26 -0.53 135.00 140.46 2b2d s PRO 65 Ca 0.01 0.02 -0.13 0.00 0.04 0.00 0.00 61.00 60.95 2b2d s PRO 65 Cb -0.16 -2.65 0.12 0.00 0.04 0.00 0.00 34.50 31.85 2b2d s PRO 65 CO -0.05 0.22 0.42 0.21 0.04 0.00 0.00 177.00 177.84 2b2d s LYS 66 N -3.51 2.75 0.20 4.56 2.47 -0.17 -4.97 119.74 121.08 2b2d s LYS 66 Ca 0.44 -1.70 -0.32 0.00 -1.56 0.00 0.00 55.97 52.83 2b2d s LYS 66 Cb -0.11 -4.10 -0.11 0.00 -1.46 0.00 0.00 37.83 32.05 2b2d s LYS 66 CO 0.29 -1.24 1.64 0.08 0.16 0.00 0.00 175.35 176.29 2b2d s VAL 67 N 1.49 2.27 0.23 4.02 1.01 -1.26 -0.08 120.40 128.08 2b2d s VAL 67 Ca 0.04 0.20 -0.19 0.00 0.00 0.00 0.00 61.98 62.03 2b2d s VAL 67 Cb -0.28 -3.13 0.03 0.00 0.00 0.00 0.00 36.38 33.00 2b2d s VAL 67 CO 0.02 0.02 0.61 0.00 0.00 0.00 0.00 175.10 175.75 2b2d s ALA 68 N 1.00 -1.09 -0.14 5.51 0.00 -0.97 -4.75 121.76 121.32 2b2d s ALA 68 Ca 0.71 -0.21 -0.03 0.00 0.00 0.00 0.00 51.96 52.43 2b2d s ALA 68 Cb -0.47 0.88 -0.03 0.00 0.00 0.00 0.00 23.12 23.50 2b2d s ALA 68 CO 0.34 -0.90 -0.05 0.99 0.00 0.00 0.00 175.76 176.14 2b2d s THR 69 N -3.89 3.81 -0.20 0.00 2.01 -1.26 -1.12 115.64 114.99 2b2d s THR 69 Ca 0.10 -0.40 -0.06 0.00 0.31 0.00 0.00 61.69 61.64 2b2d s THR 69 Cb -0.03 -2.65 -0.03 0.00 0.01 0.00 0.00 72.50 69.80 2b2d s THR 69 CO 0.01 0.51 0.04 -1.58 -0.69 0.00 0.00 174.62 172.90 2b2d s GLN 70 N 0.22 3.78 -0.17 4.92 0.74 0.03 -4.93 119.66 124.25 2b2d s GLN 70 Ca -0.03 -0.44 -0.01 0.00 0.05 0.00 0.00 55.36 54.93 2b2d s GLN 70 Cb -0.14 -3.16 -0.01 0.00 1.10 0.00 0.00 33.01 30.80 2b2d s GLN 70 CO 0.03 0.11 -0.12 0.99 -0.55 0.00 0.00 175.29 175.75 2b2d s THR 71 N 0.78 2.90 -0.11 -0.34 2.01 -1.26 -0.60 115.64 119.01 2b2d s THR 71 Ca 0.02 -0.69 -0.04 0.00 0.31 0.00 0.00 61.69 61.30 2b2d s THR 71 Cb -0.14 -2.25 0.06 0.00 0.01 0.00 0.00 72.50 70.18 2b2d s THR 71 CO 0.02 0.50 0.18 -0.69 -0.69 0.00 0.00 174.62 173.94 2b2d s VAL 72 N 0.88 -0.28 -0.68 3.82 1.01 -0.41 -4.78 120.40 119.97 2b2d s VAL 72 Ca -0.03 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.19 2b2d s VAL 72 Cb -0.15 -0.39 0.00 0.00 0.00 0.00 0.00 36.38 35.84 2b2d s VAL 72 CO -0.00 0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.77 2b2d n GLY 73 N 5.32 0.85 1.98 4.51 0.00 -1.26 -2.00 105.19 114.60 2b2d n GLY 73 Ca -0.05 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2b2d n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b2d n GLY 74 N -1.72 0.83 3.61 -0.02 0.00 -1.26 -5.01 105.19 101.62 2b2d n GLY 74 Ca -0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 2b2d n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b2d s VAL 75 N -3.31 5.30 -0.04 1.61 1.01 -0.85 -5.08 120.40 119.05 2b2d s VAL 75 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.22 2b2d s VAL 75 Cb 0.00 -3.55 -0.03 0.00 0.00 0.00 0.00 36.38 32.80 2b2d s VAL 75 CO 0.00 0.26 -0.00 -1.83 0.00 0.00 0.00 175.10 173.53 2b2d s GLU 76 N 1.60 2.85 0.05 2.72 -1.05 -1.26 -1.28 118.70 122.32 2b2d s GLU 76 Ca 0.08 -0.54 0.05 0.00 -0.15 0.00 0.00 54.97 54.42 2b2d s GLU 76 Cb -0.15 -2.71 -0.02 0.00 -0.44 0.00 0.00 34.13 30.81 2b2d s GLU 76 CO 0.09 0.65 -0.15 -0.51 0.95 0.00 0.00 175.26 176.30 2b2d s LEU 77 N -1.27 2.20 -0.16 1.83 1.43 0.24 -4.96 118.68 117.99 2b2d s LEU 77 Ca 0.17 -0.50 -0.29 0.00 -1.03 0.00 0.00 54.13 52.47 2b2d s LEU 77 Cb -0.11 -0.62 -0.01 0.00 0.03 0.00 0.00 46.19 45.48 2b2d s LEU 77 CO 0.07 0.02 1.09 -2.84 0.23 0.00 0.00 176.35 174.92 2b2d s PRO 78 N -1.29 4.31 0.01 1.29 0.02 -1.26 -0.79 135.00 137.29 2b2d s PRO 78 Ca 0.01 1.47 0.00 0.00 0.02 0.00 0.00 61.00 62.50 2b2d s PRO 78 Cb -0.08 -3.62 -0.00 0.00 0.02 0.00 0.00 34.50 30.81 2b2d s PRO 78 CO 0.02 -0.53 0.01 1.33 -0.33 0.00 0.00 177.00 177.49 2b2d n VAL 79 N 5.02 0.00 -4.07 3.83 0.24 -0.28 -4.71 118.33 118.36 2b2d n VAL 79 Ca 0.11 -0.07 -0.32 0.00 -2.04 0.00 0.00 64.34 62.03 2b2d n VAL 79 Cb 0.47 0.03 -0.16 0.00 -1.47 0.00 0.00 33.84 32.70 2b2d n VAL 79 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2b2d s ALA 80 N -2.03 2.18 0.24 2.33 0.00 -1.24 -2.28 121.76 120.96 2b2d s ALA 80 Ca 0.01 -1.17 -0.04 0.00 0.00 0.00 0.00 51.96 50.76 2b2d s ALA 80 Cb 0.00 -1.18 0.44 0.00 0.00 0.00 0.00 23.12 22.38 2b2d s ALA 80 CO 0.01 -0.47 1.76 0.00 0.00 0.00 0.00 175.76 177.05 2b2d h ALA 81 N 7.96 1.11 -2.85 0.00 0.00 -0.79 -3.45 119.26 121.24 2b2d h ALA 81 Ca -0.40 0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.65 2b2d h ALA 81 Cb 1.13 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 2b2d h ALA 81 CO 0.58 -0.12 0.33 1.67 0.00 0.00 0.00 179.25 181.71 2b2d s TRP 82 N -6.02 -0.01 0.02 0.00 1.48 -1.26 -5.02 118.94 108.14 2b2d s TRP 82 Ca -0.12 -0.53 0.02 0.00 -1.06 0.00 0.00 56.10 54.41 2b2d s TRP 82 Cb 0.20 0.76 -0.01 0.00 -1.16 0.00 0.00 33.47 33.26 2b2d s TRP 82 CO 0.77 -1.29 -0.06 1.03 -4.06 0.00 0.00 176.95 173.33 2b2d s ARG 83 N -2.86 0.46 -0.14 3.25 0.52 -1.26 -1.00 118.95 117.91 2b2d s ARG 83 Ca 0.15 -0.44 -0.10 0.00 -0.52 0.00 0.00 55.73 54.82 2b2d s ARG 83 Cb -0.05 -0.34 -0.05 0.00 0.52 0.00 0.00 34.95 35.04 2b2d s ARG 83 CO 0.08 0.08 0.19 0.45 0.02 0.00 0.00 175.30 176.12 2b2d s SER 84 N -0.78 6.38 -0.22 0.23 0.15 0.31 -4.94 113.70 114.83 2b2d s SER 84 Ca -0.04 0.45 -0.01 0.00 0.70 0.00 0.00 55.95 57.06 2b2d s SER 84 Cb -0.06 -2.11 0.01 0.00 -1.71 0.00 0.00 66.02 62.16 2b2d s SER 84 CO 0.00 0.29 -0.11 -0.31 1.20 0.00 0.00 173.24 174.31 2b2d s TYR 85 N -0.40 2.94 -0.11 3.44 1.51 -1.26 -1.47 117.35 121.99 2b2d s TYR 85 Ca 0.14 -1.44 -0.05 0.00 -1.01 0.00 0.00 57.07 54.71 2b2d s TYR 85 Cb -0.12 -2.02 -0.04 0.00 -0.11 0.00 0.00 41.96 39.67 2b2d s TYR 85 CO 0.03 -0.71 0.11 -1.17 -1.11 0.00 0.00 175.55 172.70 2b2d s LEU 86 N 1.35 4.18 -0.21 -1.29 2.96 -0.10 -4.99 118.68 120.58 2b2d s LEU 86 Ca 0.03 0.38 -0.04 0.00 -0.22 0.00 0.00 54.13 54.29 2b2d s LEU 86 Cb -0.15 -2.03 0.10 0.00 0.50 0.00 0.00 46.19 44.62 2b2d s LEU 86 CO -0.07 0.40 0.25 -0.55 -1.32 0.00 0.00 176.35 175.06 2b2d s SER 87 N -1.03 1.15 0.05 3.68 0.15 -1.26 -1.80 113.70 114.65 2b2d s SER 87 Ca 0.15 -0.14 0.09 0.00 0.70 0.00 0.00 55.95 56.75 2b2d s SER 87 Cb -0.12 0.53 -0.03 0.00 -1.71 0.00 0.00 66.02 64.69 2b2d s SER 87 CO 0.04 -0.32 -0.24 0.00 1.20 0.00 0.00 173.24 173.92 2b2d s MET 88 N 2.37 1.60 -0.14 5.44 0.23 0.27 -5.01 119.30 124.07 2b2d s MET 88 Ca 0.08 -1.08 0.01 0.00 -1.03 0.00 0.00 55.69 53.68 2b2d s MET 88 Cb -0.16 -1.79 0.02 0.00 -1.53 0.00 0.00 34.83 31.37 2b2d s MET 88 CO -0.13 0.46 -0.16 0.15 -2.03 0.00 0.00 175.02 173.31 2b2d s LYS 89 N -1.31 2.41 -0.17 3.16 1.02 -1.26 -1.02 119.74 122.56 2b2d s LYS 89 Ca 0.10 -0.61 0.01 0.00 0.02 0.00 0.00 55.97 55.49 2b2d s LYS 89 Cb -0.10 -2.10 0.02 0.00 -0.52 0.00 0.00 37.83 35.13 2b2d s LYS 89 CO 0.02 -0.15 -0.19 -1.17 -0.92 0.00 0.00 175.35 172.95 2b2d s LEU 90 N 1.21 2.05 -0.18 3.17 2.96 -0.60 -4.97 118.68 122.33 2b2d s LEU 90 Ca -0.01 -0.62 -0.07 0.00 -0.22 0.00 0.00 54.13 53.22 2b2d s LEU 90 Cb -0.14 -1.43 -0.04 0.00 0.50 0.00 0.00 46.19 45.09 2b2d s LEU 90 CO -0.07 -0.01 0.04 -0.89 -1.32 0.00 0.00 176.35 174.11 2b2d s THR 91 N 1.32 4.53 -0.10 3.68 2.01 -1.26 -0.31 115.64 125.52 2b2d s THR 91 Ca 0.05 -0.12 -0.00 0.00 0.31 0.00 0.00 61.69 61.92 2b2d s THR 91 Cb -0.13 -3.04 0.02 0.00 0.01 0.00 0.00 72.50 69.36 2b2d s THR 91 CO -0.13 0.45 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.57 2b2d s ILE 92 N 0.51 0.86 0.59 1.82 1.01 -0.44 -4.99 121.20 120.56 2b2d s ILE 92 Ca 0.02 -0.20 -0.20 0.00 0.00 0.00 0.00 60.65 60.27 2b2d s ILE 92 Cb -0.13 -0.90 -0.03 0.00 0.01 0.00 0.00 42.46 41.40 2b2d s ILE 92 CO 0.01 0.33 1.30 -2.84 0.00 0.00 0.00 174.94 173.75 2b2d s PRO 93 N 1.63 2.91 0.00 2.79 0.02 -1.26 -1.69 135.00 139.41 2b2d s PRO 93 Ca 0.02 2.08 0.13 0.00 0.02 0.00 0.00 61.00 63.25 2b2d s PRO 93 Cb -0.13 -2.05 0.62 0.00 0.02 0.00 0.00 34.50 32.96 2b2d s PRO 93 CO -0.06 -1.32 1.33 0.44 -0.33 0.00 0.00 177.00 177.06 2b2d n ILE 94 N -1.44 0.74 0.84 2.83 -5.35 0.17 -2.12 119.36 115.04 2b2d n ILE 94 Ca 0.13 0.18 0.13 0.00 -0.27 0.00 0.00 62.75 62.93 2b2d n ILE 94 Cb 0.47 -0.98 0.45 0.00 -1.74 0.00 0.00 39.64 37.85 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 -1.32 0.35 -2.10 4.28 3.72 -1.26 -4.86 117.46 116.27 2b2d n PHE 95 Ca 0.06 0.10 -0.42 0.00 -0.05 0.00 0.00 57.45 57.14 2b2d n PHE 95 Cb 0.11 -0.62 -0.03 0.00 -0.94 0.00 0.00 39.48 38.00 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 -3.05 3.64 0.81 4.37 0.00 -0.90 -5.01 121.76 121.62 2b2d s ALA 96 Ca 0.12 1.16 -0.04 0.00 0.00 0.00 0.00 51.96 53.19 2b2d s ALA 96 Cb 0.16 -3.58 0.17 0.00 0.00 0.00 0.00 23.12 19.87 2b2d s ALA 96 CO 0.60 -0.74 1.10 0.95 0.00 0.00 0.00 175.76 177.67 2b2d s THR 97 N 1.44 2.01 0.44 0.00 -4.23 -1.26 -4.88 115.64 109.16 2b2d s THR 97 Ca 0.67 -0.47 0.16 0.00 -1.18 0.00 0.00 61.69 60.87 2b2d s THR 97 Cb -0.38 -2.54 0.19 0.00 1.34 0.00 0.00 72.50 71.11 2b2d s THR 97 CO 0.30 0.00 1.99 0.78 -0.54 0.00 0.00 174.62 177.15 2b2d h ASN 98 N -0.88 0.00 -0.25 3.99 4.21 -1.99 -1.94 115.58 118.71 2b2d h ASN 98 Ca -0.37 0.00 -0.17 0.00 1.21 0.00 0.00 56.30 56.97 2b2d h ASN 98 Cb 1.25 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.45 2b2d h ASN 98 CO 0.36 0.19 -0.50 0.28 -1.29 0.00 0.00 177.43 176.47 2b2d h SER 99 N 0.00 0.88 -0.97 5.81 0.02 -1.99 -1.61 113.55 115.68 2b2d h SER 99 Ca -0.00 -0.54 0.03 0.00 -0.84 0.00 0.00 61.79 60.44 2b2d h SER 99 Cb 0.36 -0.25 -0.06 0.00 0.14 0.00 0.00 62.40 62.59 2b2d h SER 99 CO 0.03 1.26 0.63 0.44 -1.14 0.00 0.00 176.83 178.04 2b2d h ASP 100 N 0.53 1.06 -0.51 3.07 3.32 -1.77 -2.22 116.42 119.91 2b2d h ASP 100 Ca 0.01 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 56.93 2b2d h ASP 100 Cb 1.11 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 40.40 2b2d h ASP 100 CO 0.11 0.73 -0.14 0.00 -1.72 0.00 0.00 179.24 178.22 2b2d h GLU 102 N 0.88 1.01 -0.34 0.00 5.08 -0.88 -1.13 114.58 119.20 2b2d h GLU 102 Ca 0.13 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.37 2b2d h GLU 102 Cb 0.70 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 2b2d h GLU 102 CO 0.05 0.69 0.04 1.25 -1.00 0.00 0.00 179.01 180.04 2b2d h LEU 103 N 1.03 0.56 -1.11 1.33 5.85 -1.08 -1.08 115.31 120.81 2b2d h LEU 103 Ca 0.27 -0.28 0.01 0.00 0.84 0.00 0.00 57.88 58.73 2b2d h LEU 103 Cb -0.08 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 40.75 2b2d h LEU 103 CO -0.06 0.69 0.60 0.40 -0.34 0.00 0.00 178.44 179.74 2b2d h ILE 104 N 0.40 1.23 -0.32 4.05 2.04 -0.91 -0.41 117.51 123.59 2b2d h ILE 104 Ca 0.10 -0.42 -0.05 0.00 1.00 0.00 0.00 64.86 65.50 2b2d h ILE 104 Cb 0.38 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.35 2b2d h ILE 104 CO 0.01 0.22 0.02 0.58 0.00 0.00 0.00 178.15 178.98 2b2d h VAL 105 N 1.22 1.25 -0.49 1.67 2.07 -0.91 -2.19 116.25 118.88 2b2d h VAL 105 Ca 0.33 -0.92 -0.00 0.00 0.82 0.00 0.00 66.70 66.94 2b2d h VAL 105 Cb -0.13 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 2b2d h VAL 105 CO -0.07 0.30 0.29 0.11 0.02 0.00 0.00 177.57 178.22 2b2d h LYS 106 N 0.37 0.65 -0.50 1.57 1.57 -0.45 -0.96 116.57 118.82 2b2d h LYS 106 Ca 0.09 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 2b2d h LYS 106 Cb 0.42 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 2b2d h LYS 106 CO 0.01 0.46 0.13 0.00 -0.57 0.00 0.00 179.45 179.48 2b2d h ALA 107 N 1.66 0.66 -0.75 3.86 0.00 -0.78 0.68 119.26 124.59 2b2d h ALA 107 Ca 0.18 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2b2d h ALA 107 Cb -0.03 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 2b2d h ALA 107 CO -0.03 0.35 0.34 0.52 0.00 0.00 0.00 179.25 180.43 2b2d h MET 108 N 0.70 1.09 -0.36 0.00 2.86 -0.68 -0.47 114.93 118.06 2b2d h MET 108 Ca 0.16 -0.16 -0.14 0.00 -2.06 0.00 0.00 59.70 57.49 2b2d h MET 108 Cb 0.33 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 2b2d h MET 108 CO 0.00 0.85 -0.32 1.96 1.06 0.00 0.00 176.91 180.46 2b2d h GLN 109 N 1.07 0.85 -0.54 1.72 4.20 -0.85 -3.01 115.11 118.56 2b2d h GLN 109 Ca 0.26 -0.44 -0.04 0.00 0.06 0.00 0.00 58.65 58.49 2b2d h GLN 109 Cb 0.14 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 2b2d h GLN 109 CO -0.03 1.08 0.17 0.78 -0.67 0.00 0.00 178.83 180.16 2b2d h GLY 110 N 0.65 0.90 0.04 3.46 0.00 -0.53 -0.83 103.07 106.75 2b2d h GLY 110 Ca 0.06 -0.54 0.16 0.00 0.00 0.00 0.00 47.33 47.01 2b2d h GLY 110 CO 0.08 0.50 0.28 -2.00 0.00 0.00 0.00 176.54 175.41 2b2d h LEU 111 N 0.75 0.22 -1.72 3.11 5.85 -1.03 -2.05 115.31 120.44 2b2d h LEU 111 Ca 0.17 0.12 0.00 0.00 0.84 0.00 0.00 57.88 59.02 2b2d h LEU 111 Cb 0.28 0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.43 2b2d h LEU 111 CO -0.01 0.05 0.00 0.18 -0.34 0.00 0.00 178.44 178.33 2b2d n LEU 112 N -5.05 2.60 -4.73 2.25 4.77 -1.03 -4.29 117.00 111.52 2b2d n LEU 112 Ca 0.15 -1.02 -0.41 0.00 -0.03 0.00 0.00 56.01 54.70 2b2d n LEU 112 Cb 0.46 -0.12 0.01 0.00 -2.33 0.00 0.00 43.42 41.44 2b2d n LEU 112 CO 0.16 0.51 1.00 1.17 -1.33 0.00 0.00 177.39 178.90 2b2d n LYS 113 N 0.97 2.27 -1.65 3.23 4.81 -0.35 -4.77 118.16 122.67 2b2d n LYS 113 Ca 0.17 0.80 -0.47 0.00 -0.87 0.00 0.00 58.31 57.94 2b2d n LYS 113 Cb 0.50 -2.50 -0.04 0.00 0.02 0.00 0.00 35.03 33.00 2b2d n LYS 113 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2b2d n ASP 114 N 0.34 2.63 0.00 3.14 8.00 -1.26 -2.18 116.55 127.22 2b2d n ASP 114 Ca 0.04 1.11 0.00 0.00 0.71 0.00 0.00 54.79 56.65 2b2d n ASP 114 Cb 0.39 -1.37 0.00 0.00 -0.02 0.00 0.00 41.12 40.11 2b2d n ASP 114 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b2d n GLY 115 N 2.79 3.31 3.82 0.44 0.00 -1.26 -5.06 105.19 109.23 2b2d n GLY 115 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.52 5.55 0.11 1.61 0.01 -0.93 -4.86 114.94 115.91 2b2d s ASN 116 Ca 0.00 1.65 -0.23 0.00 -0.71 0.00 0.00 52.86 53.57 2b2d s ASN 116 Cb 0.00 -2.50 -0.06 0.00 0.41 0.00 0.00 41.25 39.10 2b2d s ASN 116 CO 0.00 -1.33 1.39 -0.65 -1.51 0.00 0.00 177.10 175.00 2b2d h PRO 117 N -0.40 -0.10 0.01 -0.60 0.11 -1.89 -2.75 132.00 126.37 2b2d h PRO 117 Ca -0.45 0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.70 2b2d h PRO 117 Cb 1.21 0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.30 2b2d h PRO 117 CO 0.57 -0.07 -0.23 0.82 -0.21 0.00 0.00 178.00 178.88 2b2d h ILE 118 N -0.10 0.46 -0.36 4.15 5.03 -1.94 -0.09 117.51 124.65 2b2d h ILE 118 Ca 0.09 0.00 -0.04 0.00 -0.12 0.00 0.00 64.86 64.79 2b2d h ILE 118 Cb 0.34 0.46 -0.02 0.00 -3.03 0.00 0.00 36.82 34.58 2b2d h ILE 118 CO -0.59 0.00 0.04 1.55 -0.68 0.00 0.00 178.15 178.47 2b2d h PRO 119 N -0.37 0.55 -0.42 2.37 0.13 -1.73 -1.53 132.00 131.00 2b2d h PRO 119 Ca 0.06 -0.11 -0.09 0.00 -0.87 0.00 0.00 66.00 65.00 2b2d h PRO 119 Cb 0.45 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.48 2b2d h PRO 119 CO -0.21 0.55 -0.07 0.77 -0.23 0.00 0.00 178.00 178.81 2b2d h SER 120 N 0.53 0.79 0.18 1.44 0.02 -1.18 -0.10 113.55 115.24 2b2d h SER 120 Ca 0.12 -0.35 -0.01 0.00 -0.84 0.00 0.00 61.79 60.71 2b2d h SER 120 Cb 0.28 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.61 2b2d h SER 120 CO 0.00 0.96 -0.09 0.00 -1.14 0.00 0.00 176.83 176.56 2b2d h ALA 121 N 0.87 -0.24 -0.03 3.77 0.00 -0.71 -2.91 119.26 120.01 2b2d h ALA 121 Ca 0.11 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.96 2b2d h ALA 121 Cb 0.59 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 2b2d h ALA 121 CO 0.04 -0.61 -0.08 0.82 0.00 0.00 0.00 179.25 179.42 2b2d h ILE 122 N -0.30 0.79 0.00 0.00 2.04 -1.20 -0.82 117.51 118.02 2b2d h ILE 122 Ca -0.02 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.84 2b2d h ILE 122 Cb 0.24 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 2b2d h ILE 122 CO 0.04 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.19 2b2d n ALA 123 N -2.32 1.01 -1.59 1.87 0.00 -0.06 -2.19 120.51 117.22 2b2d n ALA 123 Ca -0.05 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.45 2b2d n ALA 123 Cb 0.13 -0.99 0.14 0.00 0.00 0.00 0.00 19.45 18.73 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 -1.48 2.92 -3.26 0.00 0.00 -0.90 -4.97 120.51 112.82 2b2d n ALA 124 Ca 0.00 -2.77 -0.23 0.00 0.00 0.00 0.00 53.44 50.44 2b2d n ALA 124 Cb 0.00 -0.42 0.01 0.00 0.00 0.00 0.00 19.45 19.04 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 -0.90 -4.46 -4.52 0.00 3.02 -0.93 -4.94 115.26 102.53 2b2d n ASN 125 Ca 0.15 -0.36 -0.28 0.00 -0.03 0.00 0.00 54.58 54.06 2b2d n ASN 125 Cb 0.74 -3.66 -0.09 0.00 -0.61 0.00 0.00 39.78 36.16 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 -2.72 3.45 0.00 6.41 0.01 -0.36 -5.05 113.70 115.44 2b2d s SER 126 Ca 0.37 -1.56 0.00 0.00 1.31 0.00 0.00 55.95 56.07 2b2d s SER 126 Cb -0.19 0.25 0.00 0.00 0.21 0.00 0.00 66.02 66.29 2b2d s SER 126 CO 0.46 -0.76 0.00 0.61 0.41 0.00 0.00 173.24 173.96 2b2d n GLY 127 N -1.03 5.93 3.89 3.44 0.00 -1.26 -4.20 105.19 111.97 2b2d n GLY 127 Ca -0.10 -1.91 -0.32 0.00 0.00 0.00 0.00 46.02 43.69 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 1.65 5.21 0.00 -0.61 -1.09 -1.26 -4.77 121.20 120.33 2b2d s ILE 128 Ca 0.00 0.04 0.00 0.00 -2.23 0.00 0.00 60.65 58.46 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 0.13 0.00 0.00 -1.23 0.00 0.00 174.94 173.84