#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cut n GLY 16 N 0.00 2.46 0.31 -0.72 0.00 -1.26 -4.61 105.19 101.37 2cut n GLY 16 Ca 0.00 -1.76 0.20 0.00 0.00 0.00 0.00 46.02 44.45 2cut n GLY 16 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2cut h ARG 17 N 0.00 0.00 -0.00 1.61 2.43 -2.03 -1.62 114.38 114.77 2cut h ARG 17 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2cut h ARG 17 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 2cut h ARG 17 CO 0.00 0.00 -0.01 2.41 -1.51 0.00 0.00 179.97 180.86 2cut n THR 18 N -2.91 0.00 -4.16 0.20 -1.04 -1.26 -4.64 114.28 100.46 2cut n THR 18 Ca -0.03 -0.00 -0.20 0.00 -2.04 0.00 0.00 64.05 61.78 2cut n THR 18 Cb 0.13 -0.46 -0.16 0.00 -1.82 0.00 0.00 70.33 68.02 2cut n THR 18 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2cut s THR 19 N -2.57 0.52 -0.08 12.58 2.01 -0.61 -1.11 115.64 126.38 2cut s THR 19 Ca 0.28 -0.12 -0.03 0.00 0.31 0.00 0.00 61.69 62.13 2cut s THR 19 Cb 0.20 -0.55 0.04 0.00 0.01 0.00 0.00 72.50 72.21 2cut s THR 19 CO 0.47 0.22 0.10 -0.13 -0.69 0.00 0.00 174.62 174.59 2cut s ARG 20 N 0.89 -0.01 -0.31 4.92 1.81 -1.26 -4.58 118.95 120.40 2cut s ARG 20 Ca -0.12 0.35 0.08 0.00 -1.72 0.00 0.00 55.73 54.32 2cut s ARG 20 Cb -0.14 -0.68 0.46 0.00 -0.45 0.00 0.00 34.95 34.13 2cut s ARG 20 CO 0.00 -0.39 1.17 -0.25 -0.68 0.00 0.00 175.30 175.15 2cut n ASP 21 N 5.30 4.71 -0.06 0.23 8.00 -1.25 -1.61 116.55 131.87 2cut n ASP 21 Ca -0.04 -3.65 -0.01 0.00 0.71 0.00 0.00 54.79 51.79 2cut n ASP 21 Cb 0.50 -0.37 0.26 0.00 -0.02 0.00 0.00 41.12 41.49 2cut n ASP 21 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2cut h ASP 22 N 2.27 0.61 -0.06 -2.24 3.32 -1.74 0.14 116.42 118.71 2cut h ASP 22 Ca 0.33 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.25 2cut h ASP 22 Cb 1.43 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.82 2cut h ASP 22 CO 0.74 0.63 -0.06 0.25 -1.72 0.00 0.00 179.24 179.08 2cut h LEU 23 N 0.63 0.15 -0.57 1.55 5.85 -1.90 -1.71 115.31 119.32 2cut h LEU 23 Ca 0.14 -0.48 0.03 0.00 0.84 0.00 0.00 57.88 58.41 2cut h LEU 23 Cb 0.28 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 2cut h LEU 23 CO 0.00 0.61 0.34 0.40 -0.34 0.00 0.00 178.44 179.44 2cut h ILE 24 N -0.29 1.04 -0.00 4.05 1.08 -1.89 -2.32 117.51 119.17 2cut h ILE 24 Ca 0.01 -0.23 0.00 0.00 -0.39 0.00 0.00 64.86 64.25 2cut h ILE 24 Cb 0.56 0.33 0.00 0.00 -3.07 0.00 0.00 36.82 34.64 2cut h ILE 24 CO 0.01 0.12 -0.06 0.59 -0.69 0.00 0.00 178.15 178.12 2cut n ASN 25 N -4.78 0.49 -4.93 1.72 3.02 0.02 -4.89 115.26 105.91 2cut n ASN 25 Ca 0.05 -0.77 -0.20 0.00 -0.03 0.00 0.00 54.58 53.63 2cut n ASN 25 Cb 0.09 -0.06 0.05 0.00 -0.61 0.00 0.00 39.78 39.25 2cut n ASN 25 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2cut s GLY 26 N -2.31 1.82 0.24 7.41 0.00 -0.64 -5.04 107.32 108.80 2cut s GLY 26 Ca 0.34 -1.67 -0.11 0.00 0.00 0.00 0.00 44.72 43.29 2cut s GLY 26 CO 0.43 -1.31 0.41 0.54 0.00 0.00 0.00 173.10 173.17 2cut s ASN 27 N -4.53 -0.04 0.51 1.64 2.20 -1.26 -4.97 114.94 108.48 2cut s ASN 27 Ca 0.60 -1.02 0.20 0.00 -0.94 0.00 0.00 52.86 51.70 2cut s ASN 27 Cb -0.08 0.55 1.28 0.00 -2.00 0.00 0.00 41.25 41.00 2cut s ASN 27 CO 0.39 -1.08 2.03 0.28 -2.94 0.00 0.00 177.10 175.77 2cut h SER 28 N 2.32 0.09 1.23 3.54 0.02 -1.96 -0.64 113.55 118.15 2cut h SER 28 Ca -0.28 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.63 2cut h SER 28 Cb 1.25 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.77 2cut h SER 28 CO 0.39 0.05 -0.19 0.00 -1.14 0.00 0.00 176.83 175.94 2cut h ALA 29 N 1.79 0.95 -0.34 3.77 0.00 -1.97 -3.16 119.26 120.31 2cut h ALA 29 Ca 0.20 -0.17 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 2cut h ALA 29 Cb 0.67 -0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.33 2cut h ALA 29 CO -0.02 0.24 -0.09 -1.13 0.00 0.00 0.00 179.25 178.25 2cut n SER 30 N -3.25 2.49 -4.68 0.00 3.41 -0.26 -5.05 113.62 106.28 2cut n SER 30 Ca 0.01 -3.76 -0.44 0.00 -0.26 0.00 0.00 58.87 54.43 2cut n SER 30 Cb 0.48 -0.63 -0.02 0.00 -0.26 0.00 0.00 64.21 63.78 2cut n SER 30 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2cut s ALA 32 N -0.55 3.55 0.29 0.00 0.00 -1.26 -4.99 121.76 118.81 2cut s ALA 32 Ca 0.62 -0.87 0.09 0.00 0.00 0.00 0.00 51.96 51.81 2cut s ALA 32 Cb -0.62 -2.35 0.44 0.00 0.00 0.00 0.00 23.12 20.59 2cut s ALA 32 CO 0.55 -0.52 1.67 -0.44 0.00 0.00 0.00 175.76 177.02 2cut h ASP 33 N 0.18 0.08 -3.96 0.00 3.32 -1.72 -3.43 116.42 110.89 2cut h ASP 33 Ca -0.46 -0.04 -0.53 0.00 0.02 0.00 0.00 57.03 56.02 2cut h ASP 33 Cb 1.25 -0.02 -0.31 0.00 0.22 0.00 0.00 39.33 40.47 2cut h ASP 33 CO 0.59 0.59 -0.83 -0.69 -1.72 0.00 0.00 179.24 177.19 2cut s VAL 34 N -3.84 1.29 -0.11 -1.35 1.01 -1.03 -0.35 120.40 116.02 2cut s VAL 34 Ca -0.02 -0.65 0.00 0.00 0.00 0.00 0.00 61.98 61.31 2cut s VAL 34 Cb 0.13 -1.11 0.02 0.00 0.00 0.00 0.00 36.38 35.43 2cut s VAL 34 CO 0.76 0.37 -0.09 -0.63 0.00 0.00 0.00 175.10 175.51 2cut s ILE 35 N -0.02 1.10 -0.24 2.22 1.01 -0.53 -1.01 121.20 123.72 2cut s ILE 35 Ca -0.02 -0.36 -0.07 0.00 0.00 0.00 0.00 60.65 60.21 2cut s ILE 35 Cb -0.10 -1.08 -0.02 0.00 0.01 0.00 0.00 42.46 41.26 2cut s ILE 35 CO 0.01 0.37 0.05 0.12 0.00 0.00 0.00 174.94 175.49 2cut s PHE 36 N 1.48 3.06 -0.21 3.97 5.36 0.33 -0.78 117.98 131.20 2cut s PHE 36 Ca 0.01 -0.51 -0.04 0.00 -0.96 0.00 0.00 56.93 55.44 2cut s PHE 36 Cb -0.13 -2.20 -0.01 0.00 -0.34 0.00 0.00 43.02 40.34 2cut s PHE 36 CO -0.06 -0.38 -0.05 0.42 -1.46 0.00 0.00 175.22 173.69 2cut s ILE 37 N 1.53 3.39 -0.04 3.12 1.01 -0.55 -0.97 121.20 128.69 2cut s ILE 37 Ca 0.06 -0.49 0.03 0.00 0.00 0.00 0.00 60.65 60.25 2cut s ILE 37 Cb -0.15 -2.53 0.00 0.00 0.01 0.00 0.00 42.46 39.80 2cut s ILE 37 CO 0.02 0.44 -0.14 -0.47 0.00 0.00 0.00 174.94 174.79 2cut s TYR 38 N 1.30 1.44 -0.18 3.97 5.04 -0.21 -1.36 117.35 127.34 2cut s TYR 38 Ca 0.04 -0.43 -0.02 0.00 -2.44 0.00 0.00 57.07 54.21 2cut s TYR 38 Cb -0.14 -1.00 -0.01 0.00 0.35 0.00 0.00 41.96 41.15 2cut s TYR 38 CO -0.02 -0.17 -0.09 0.00 -1.34 0.00 0.00 175.55 173.93 2cut s ALA 39 N 0.23 2.71 0.85 3.97 0.00 0.01 -0.60 121.76 128.93 2cut s ALA 39 Ca -0.06 -1.06 -0.12 0.00 0.00 0.00 0.00 51.96 50.72 2cut s ALA 39 Cb -0.12 -1.48 0.10 0.00 0.00 0.00 0.00 23.12 21.62 2cut s ALA 39 CO 0.02 -0.16 1.15 -0.98 0.00 0.00 0.00 175.76 175.79 2cut s ARG 40 N 1.02 1.63 0.81 0.00 1.70 -1.26 -1.55 118.95 121.30 2cut s ARG 40 Ca -0.00 0.27 -0.12 0.00 -0.47 0.00 0.00 55.73 55.41 2cut s ARG 40 Cb -0.15 -1.90 0.08 0.00 -0.57 0.00 0.00 34.95 32.41 2cut s ARG 40 CO -0.01 -1.86 1.16 0.20 -1.08 0.00 0.00 175.30 173.71 2cut s GLY 41 N -4.23 1.59 0.28 3.88 0.00 -1.13 -2.46 107.32 105.25 2cut s GLY 41 Ca 0.63 -0.58 -0.30 0.00 0.00 0.00 0.00 44.72 44.46 2cut s GLY 41 CO 0.52 -0.10 1.54 1.44 0.00 0.00 0.00 173.10 176.50 2cut n SER 42 N -3.34 3.55 0.00 1.64 7.64 -1.26 -2.12 113.62 119.74 2cut n SER 42 Ca 0.08 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.10 2cut n SER 42 Cb 0.60 -1.55 0.00 0.00 -1.01 0.00 0.00 64.21 62.25 2cut n SER 42 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2cut n THR 43 N 2.04 0.00 -1.87 0.44 -1.04 -0.10 -4.99 114.28 108.76 2cut n THR 43 Ca 0.09 0.00 -0.32 0.00 -2.04 0.00 0.00 64.05 61.78 2cut n THR 43 Cb 0.35 -0.12 0.03 0.00 -1.82 0.00 0.00 70.33 68.77 2cut n THR 43 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2cut s GLU 44 N -0.25 3.11 0.50 -2.82 2.02 -0.90 -5.03 118.70 115.34 2cut s GLU 44 Ca 0.00 1.18 -0.06 0.00 0.02 0.00 0.00 54.97 56.12 2cut s GLU 44 Cb 0.00 -2.00 -0.03 0.00 0.10 0.00 0.00 34.13 32.19 2cut s GLU 44 CO 0.00 -0.98 0.82 0.95 0.02 0.00 0.00 175.26 176.07 2cut s THR 45 N -2.57 4.81 0.00 3.63 -4.23 -1.26 -4.81 115.64 111.21 2cut s THR 45 Ca 0.63 0.26 0.00 0.00 -1.18 0.00 0.00 61.69 61.40 2cut s THR 45 Cb -0.16 -3.84 0.00 0.00 1.34 0.00 0.00 72.50 69.83 2cut s THR 45 CO 0.42 -0.86 0.00 0.61 -0.54 0.00 0.00 174.62 174.25 2cut n GLY 46 N -2.34 1.74 0.00 3.99 0.00 -1.26 -0.79 105.19 106.54 2cut n GLY 46 Ca 0.01 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.48 2cut n GLY 46 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2cut n ASN 47 N -0.50 1.15 -0.01 1.61 2.04 -0.28 -4.65 115.26 114.61 2cut n ASN 47 Ca 0.00 -1.30 0.02 0.00 -0.44 0.00 0.00 54.58 52.86 2cut n ASN 47 Cb 0.00 0.00 -0.07 0.00 -2.53 0.00 0.00 39.78 37.18 2cut n ASN 47 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 2cut n LEU 48 N -0.15 0.00 0.00 -4.53 4.77 -0.27 -3.62 117.00 113.20 2cut n LEU 48 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2cut n LEU 48 Cb 0.12 0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 2cut n LEU 48 CO 0.00 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.72 2cut n GLY 49 N 2.15 1.42 0.11 -0.72 0.00 0.03 -2.62 105.19 105.55 2cut n GLY 49 Ca -0.05 -0.61 -0.16 0.00 0.00 0.00 0.00 46.02 45.21 2cut n GLY 49 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2cut h THR 50 N 0.00 1.13 0.00 2.61 1.35 -1.97 -3.39 112.91 112.64 2cut h THR 50 Ca 0.00 -2.80 -0.32 0.00 -0.55 0.00 0.00 66.41 62.74 2cut h THR 50 Cb 0.00 2.72 -0.06 0.00 -1.73 0.00 0.00 68.15 69.08 2cut h THR 50 CO 0.00 0.80 -1.99 0.18 -0.25 0.00 0.00 175.52 174.26 2cut n LEU 51 N -3.41 0.53 -0.26 3.87 4.77 -1.26 -4.45 117.00 116.79 2cut n LEU 51 Ca -0.16 0.24 0.04 0.00 -0.03 0.00 0.00 56.01 56.10 2cut n LEU 51 Cb 1.04 0.30 0.17 0.00 -2.33 0.00 0.00 43.42 42.60 2cut n LEU 51 CO 0.49 0.44 1.06 1.23 -1.33 0.00 0.00 177.39 179.28 2cut h GLY 52 N 3.70 1.16 1.74 -0.72 0.00 -1.70 -2.75 103.07 104.50 2cut h GLY 52 Ca -0.40 -0.21 -0.05 0.00 0.00 0.00 0.00 47.33 46.67 2cut h GLY 52 CO 0.06 0.00 -0.11 -2.55 0.00 0.00 0.00 176.54 173.94 2cut h PRO 53 N 0.58 0.32 -0.19 4.80 0.11 -1.79 -1.76 132.00 134.06 2cut h PRO 53 Ca 0.39 -0.07 -0.20 0.00 0.11 0.00 0.00 66.00 66.23 2cut h PRO 53 Cb 0.49 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.57 2cut h PRO 53 CO -0.32 0.44 -0.68 0.77 -0.21 0.00 0.00 178.00 178.00 2cut h SER 54 N 0.30 0.88 -0.45 -2.05 0.02 -1.75 -1.41 113.55 109.09 2cut h SER 54 Ca 0.06 -0.53 -0.03 0.00 -0.84 0.00 0.00 61.79 60.45 2cut h SER 54 Cb 0.38 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.64 2cut h SER 54 CO 0.02 1.32 0.16 0.40 -1.14 0.00 0.00 176.83 177.59 2cut h ILE 55 N 0.55 1.21 -0.69 3.27 2.04 -1.38 -2.82 117.51 119.69 2cut h ILE 55 Ca -0.02 -0.68 0.03 0.00 1.00 0.00 0.00 64.86 65.19 2cut h ILE 55 Cb 1.29 0.81 -0.04 0.00 -0.74 0.00 0.00 36.82 38.13 2cut h ILE 55 CO 0.14 0.25 0.43 0.00 0.00 0.00 0.00 178.15 178.97 2cut h ALA 56 N 1.01 0.89 -0.91 1.87 0.00 -1.20 -0.90 119.26 120.03 2cut h ALA 56 Ca 0.15 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2cut h ALA 56 Cb 0.22 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 2cut h ALA 56 CO -0.01 0.22 0.50 0.77 0.00 0.00 0.00 179.25 180.73 2cut h SER 57 N 0.86 1.13 -0.24 0.00 0.02 -1.09 -1.10 113.55 113.12 2cut h SER 57 Ca 0.27 -0.10 -0.14 0.00 -0.84 0.00 0.00 61.79 60.98 2cut h SER 57 Cb -0.00 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.24 2cut h SER 57 CO -0.10 0.90 -0.37 0.78 -1.14 0.00 0.00 176.83 176.91 2cut h ASN 58 N 1.27 0.82 -0.45 3.07 2.35 -1.17 -1.93 115.58 119.53 2cut h ASN 58 Ca 0.32 -0.36 -0.10 0.00 -0.55 0.00 0.00 56.30 55.61 2cut h ASN 58 Cb 0.02 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.14 2cut h ASN 58 CO -0.05 1.10 -0.08 -0.07 -1.65 0.00 0.00 177.43 176.68 2cut h LEU 59 N 0.64 0.90 -0.64 1.61 3.38 -0.83 -2.14 115.31 118.23 2cut h LEU 59 Ca 0.06 -0.27 -0.15 0.00 0.09 0.00 0.00 57.88 57.61 2cut h LEU 59 Cb 0.92 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 2cut h LEU 59 CO 0.08 1.01 -0.64 -0.33 0.09 0.00 0.00 178.44 178.65 2cut h GLU 60 N 0.82 0.15 -0.87 1.13 5.08 -1.03 -0.59 114.58 119.28 2cut h GLU 60 Ca 0.14 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2cut h GLU 60 Cb 0.60 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.83 2cut h GLU 60 CO 0.04 0.74 0.56 0.77 -1.00 0.00 0.00 179.01 180.12 2cut h SER 61 N 0.11 1.01 -0.06 1.42 0.02 -1.22 -0.02 113.55 114.81 2cut h SER 61 Ca -0.01 -0.04 -0.11 0.00 -0.84 0.00 0.00 61.79 60.79 2cut h SER 61 Cb 1.16 -0.25 0.01 0.00 0.14 0.00 0.00 62.40 63.45 2cut h SER 61 CO 0.09 0.74 -0.41 0.00 -1.14 0.00 0.00 176.83 176.11 2cut h ALA 62 N 1.31 0.13 -0.01 3.77 0.00 -0.96 -3.36 119.26 120.14 2cut h ALA 62 Ca 0.32 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2cut h ALA 62 Cb -0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2cut h ALA 62 CO -0.07 0.26 -0.42 1.19 0.00 0.00 0.00 179.25 180.21 2cut n PHE 63 N -4.35 0.00 0.00 0.00 3.72 -0.27 -5.08 117.46 111.49 2cut n PHE 63 Ca -0.09 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.31 2cut n PHE 63 Cb 0.56 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.10 2cut n PHE 63 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2cut n GLY 64 N 1.24 -2.17 0.34 1.37 0.00 -0.02 -3.53 105.19 102.42 2cut n GLY 64 Ca 0.07 -1.38 0.07 0.00 0.00 0.00 0.00 46.02 44.78 2cut n GLY 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2cut h LYS 65 N 0.00 0.83 0.00 1.61 1.79 -1.91 -0.68 116.57 118.20 2cut h LYS 65 Ca 0.00 -0.05 -0.08 0.00 -2.18 0.00 0.00 60.65 58.34 2cut h LYS 65 Cb 0.00 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 30.45 2cut h LYS 65 CO 0.00 0.55 -0.38 -0.44 -1.08 0.00 0.00 179.45 178.10 2cut h ASP 66 N 0.86 0.00 0.58 0.86 5.19 -1.93 -3.31 116.42 118.66 2cut h ASP 66 Ca 0.48 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.89 2cut h ASP 66 Cb 0.55 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.06 2cut h ASP 66 CO -0.30 0.38 -0.23 0.61 -3.12 0.00 0.00 179.24 176.58 2cut n GLY 67 N 0.79 -1.18 2.91 2.75 0.00 -0.27 -4.47 105.19 105.71 2cut n GLY 67 Ca 0.01 -0.26 -0.14 0.00 0.00 0.00 0.00 46.02 45.63 2cut n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cut s VAL 68 N -2.81 0.21 -0.19 1.61 0.11 -1.18 -2.37 120.40 115.78 2cut s VAL 68 Ca 0.18 -0.10 -0.07 0.00 -2.93 0.00 0.00 61.98 59.05 2cut s VAL 68 Cb 0.19 -0.19 -0.04 0.00 -1.53 0.00 0.00 36.38 34.81 2cut s VAL 68 CO 0.57 0.06 0.06 0.26 -3.33 0.00 0.00 175.10 172.73 2cut s TRP 69 N -0.01 3.22 -0.11 1.54 0.51 -0.18 -4.91 118.94 119.01 2cut s TRP 69 Ca 0.00 0.01 0.02 0.00 -2.12 0.00 0.00 56.10 54.01 2cut s TRP 69 Cb -0.02 -2.10 -0.01 0.00 -0.81 0.00 0.00 33.47 30.53 2cut s TRP 69 CO -0.00 0.08 -0.17 -1.50 -0.51 0.00 0.00 176.95 174.85 2cut s ILE 70 N 0.55 2.74 -0.13 2.03 1.10 -1.26 -0.51 121.20 125.72 2cut s ILE 70 Ca 0.03 -0.78 -0.01 0.00 -0.51 0.00 0.00 60.65 59.37 2cut s ILE 70 Cb -0.13 -2.11 0.04 0.00 0.15 0.00 0.00 42.46 40.41 2cut s ILE 70 CO 0.01 0.54 -0.02 -1.58 -2.11 0.00 0.00 174.94 171.79 2cut s GLN 71 N 0.18 1.00 0.41 3.50 2.00 -0.14 -1.81 119.66 124.80 2cut s GLN 71 Ca -0.10 -0.24 -0.11 0.00 -2.00 0.00 0.00 55.36 52.91 2cut s GLN 71 Cb -0.16 -1.62 -0.07 0.00 0.80 0.00 0.00 33.01 31.97 2cut s GLN 71 CO 0.06 -0.41 0.78 0.20 -0.50 0.00 0.00 175.29 175.42 2cut s GLY 72 N 1.81 1.97 -0.40 2.59 0.00 -0.64 -1.05 107.32 111.61 2cut s GLY 72 Ca 0.02 -0.16 -0.24 0.00 0.00 0.00 0.00 44.72 44.34 2cut s GLY 72 CO -0.07 0.04 0.82 0.14 0.00 0.00 0.00 173.10 174.03 2cut s VAL 73 N -2.37 4.66 0.00 1.40 1.01 0.24 -4.84 120.40 120.49 2cut s VAL 73 Ca 0.52 0.78 0.00 0.00 0.00 0.00 0.00 61.98 63.28 2cut s VAL 73 Cb -0.10 -4.29 0.00 0.00 0.00 0.00 0.00 36.38 31.99 2cut s VAL 73 CO 0.31 -0.58 0.00 0.61 0.00 0.00 0.00 175.10 175.44 2cut n GLY 74 N 4.69 1.88 7.00 4.51 0.00 -1.26 -4.74 105.19 117.27 2cut n GLY 74 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2cut n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cut n GLY 75 N 5.00 3.81 0.00 -0.02 0.00 -1.26 -0.53 105.19 112.19 2cut n GLY 75 Ca 0.00 0.18 0.12 0.00 0.00 0.00 0.00 46.02 46.32 2cut n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cut n ALA 76 N 12.14 2.33 -2.89 4.61 0.00 -1.26 -4.44 120.51 131.00 2cut n ALA 76 Ca 0.00 -0.14 -0.44 0.00 0.00 0.00 0.00 53.44 52.87 2cut n ALA 76 Cb 0.00 -1.40 -0.05 0.00 0.00 0.00 0.00 19.45 18.00 2cut n ALA 76 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2cut s TYR 77 N -2.29 2.90 -0.86 0.00 5.04 0.31 -4.35 117.35 118.11 2cut s TYR 77 Ca 0.30 -0.62 0.25 0.00 -2.44 0.00 0.00 57.07 54.56 2cut s TYR 77 Cb 0.17 -3.97 0.46 0.00 0.35 0.00 0.00 41.96 38.96 2cut s TYR 77 CO 0.33 -1.33 1.38 0.54 -1.34 0.00 0.00 175.55 175.13 2cut n ARG 78 N 6.79 0.11 -3.68 4.97 3.00 -1.26 -4.67 116.66 121.93 2cut n ARG 78 Ca -0.06 0.03 -0.21 0.00 -0.01 0.00 0.00 57.85 57.60 2cut n ARG 78 Cb 0.45 -1.57 0.04 0.00 0.00 0.00 0.00 32.46 31.38 2cut n ARG 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2cut n ALA 79 N -1.63 -2.04 -2.48 7.54 0.00 -1.26 -4.74 120.51 115.90 2cut n ALA 79 Ca 0.05 -0.16 -0.41 0.00 0.00 0.00 0.00 53.44 52.91 2cut n ALA 79 Cb 0.38 -2.11 -0.04 0.00 0.00 0.00 0.00 19.45 17.68 2cut n ALA 79 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2cut s THR 80 N -3.65 4.69 0.34 0.00 2.01 -1.26 -0.93 115.64 116.84 2cut s THR 80 Ca 0.03 2.03 0.03 0.00 0.31 0.00 0.00 61.69 64.09 2cut s THR 80 Cb -0.01 -4.31 0.19 0.00 0.01 0.00 0.00 72.50 68.39 2cut s THR 80 CO 0.81 0.25 1.91 0.25 -0.69 0.00 0.00 174.62 177.15 2cut h LEU 81 N 6.14 0.58 -1.77 4.42 5.85 -1.94 -1.94 115.31 126.65 2cut h LEU 81 Ca -0.42 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.21 2cut h LEU 81 Cb 1.21 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 42.09 2cut h LEU 81 CO 0.73 0.56 -0.04 1.23 -0.34 0.00 0.00 178.44 180.58 2cut h GLY 82 N 0.82 0.00 2.00 3.75 0.00 -2.03 -2.76 103.07 104.86 2cut h GLY 82 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.48 2cut h GLY 82 CO -0.01 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.75 2cut n ASP 83 N -3.18 0.66 0.29 0.19 8.00 -0.73 -2.47 116.55 119.30 2cut n ASP 83 Ca -0.00 0.64 0.13 0.00 0.71 0.00 0.00 54.79 56.27 2cut n ASP 83 Cb 0.27 -0.79 0.84 0.00 -0.02 0.00 0.00 41.12 41.42 2cut n ASP 83 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 2cut h ASN 84 N 0.00 0.00 0.17 -2.24 2.35 -1.62 -0.96 115.58 113.28 2cut h ASN 84 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2cut h ASN 84 Cb 0.43 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.80 2cut h ASN 84 CO 0.00 0.01 -0.12 0.00 -1.65 0.00 0.00 177.43 175.67 2cut n ALA 85 N -2.38 2.80 -1.53 -0.83 0.00 -1.03 -4.39 120.51 113.15 2cut n ALA 85 Ca -0.03 -0.37 -0.32 0.00 0.00 0.00 0.00 53.44 52.72 2cut n ALA 85 Cb 0.09 -1.23 0.04 0.00 0.00 0.00 0.00 19.45 18.36 2cut n ALA 85 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2cut s LEU 86 N -2.29 3.30 0.26 0.00 1.02 -0.37 -4.91 118.68 115.69 2cut s LEU 86 Ca 0.32 1.81 -0.07 0.00 0.02 0.00 0.00 54.13 56.21 2cut s LEU 86 Cb 0.20 -4.53 0.46 0.00 0.02 0.00 0.00 46.19 42.34 2cut s LEU 86 CO 0.44 -1.50 1.60 -0.65 0.02 0.00 0.00 176.35 176.26 2cut h PRO 87 N -0.22 0.04 -0.28 1.29 0.11 -1.88 -0.14 132.00 130.93 2cut h PRO 87 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2cut h PRO 87 Cb 1.23 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2cut h PRO 87 CO 0.55 0.03 0.00 0.54 -0.21 0.00 0.00 178.00 178.91 2cut n ARG 88 N -5.46 1.94 -0.58 1.05 1.74 -1.26 -4.88 116.66 109.20 2cut n ARG 88 Ca 0.15 -1.42 0.00 0.00 -0.77 0.00 0.00 57.85 55.80 2cut n ARG 88 Cb 0.50 -1.40 0.00 0.00 -1.02 0.00 0.00 32.46 30.54 2cut n ARG 88 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2cut n GLY 89 N 1.21 0.74 3.30 -0.13 0.00 -0.06 -4.71 105.19 105.52 2cut n GLY 89 Ca 0.16 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.12 2cut n GLY 89 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2cut n THR 90 N -2.38 0.00 -3.19 2.61 5.66 -1.15 -4.16 114.28 111.67 2cut n THR 90 Ca 0.00 -0.76 -0.29 0.00 -3.05 0.00 0.00 64.05 59.95 2cut n THR 90 Cb 0.00 0.81 -0.03 0.00 -1.55 0.00 0.00 70.33 69.56 2cut n THR 90 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2cut s SER 91 N -2.89 6.44 0.25 1.09 1.04 -1.26 -4.69 113.70 113.69 2cut s SER 91 Ca 0.15 0.80 -0.03 0.00 0.48 0.00 0.00 55.95 57.35 2cut s SER 91 Cb -0.04 -2.18 0.40 0.00 0.10 0.00 0.00 66.02 64.30 2cut s SER 91 CO 0.09 -0.27 1.85 0.28 0.98 0.00 0.00 173.24 176.16 2cut h SER 92 N 1.43 0.86 -0.75 7.02 0.02 -2.00 -1.73 113.55 118.40 2cut h SER 92 Ca -0.48 0.03 0.03 0.00 -0.84 0.00 0.00 61.79 60.53 2cut h SER 92 Cb 1.19 -0.15 -0.05 0.00 0.14 0.00 0.00 62.40 63.54 2cut h SER 92 CO 0.65 0.52 0.48 0.00 -1.14 0.00 0.00 176.83 177.34 2cut h ALA 93 N 1.45 0.99 -0.69 3.77 0.00 -1.94 -1.74 119.26 121.10 2cut h ALA 93 Ca 0.41 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.23 2cut h ALA 93 Cb 0.27 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2cut h ALA 93 CO -0.21 0.27 0.16 0.00 0.00 0.00 0.00 179.25 179.47 2cut h ALA 94 N 1.32 0.91 -0.64 0.00 0.00 -1.53 -1.21 119.26 118.11 2cut h ALA 94 Ca 0.30 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2cut h ALA 94 Cb 0.02 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 2cut h ALA 94 CO -0.11 0.65 0.35 0.82 0.00 0.00 0.00 179.25 180.95 2cut h ILE 95 N 1.05 1.21 -0.31 0.00 2.04 -1.01 -1.29 117.51 119.19 2cut h ILE 95 Ca 0.22 -0.52 -0.06 0.00 1.00 0.00 0.00 64.86 65.50 2cut h ILE 95 Cb 0.39 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 36.83 2cut h ILE 95 CO 0.00 0.23 -0.05 0.03 0.00 0.00 0.00 178.15 178.36 2cut h ARG 96 N 0.88 0.50 -0.08 2.37 3.08 -1.06 0.12 114.38 120.18 2cut h ARG 96 Ca 0.23 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 2cut h ARG 96 Cb 0.05 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 2cut h ARG 96 CO -0.04 0.56 0.03 1.49 -1.07 0.00 0.00 179.97 180.94 2cut h GLU 97 N 0.47 0.13 -0.51 0.04 4.57 -0.19 -0.98 114.58 118.11 2cut h GLU 97 Ca 0.10 -0.03 -0.09 0.00 -1.18 0.00 0.00 59.36 58.16 2cut h GLU 97 Cb 0.38 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.94 2cut h GLU 97 CO 0.02 0.27 -0.03 1.98 -1.18 0.00 0.00 179.01 180.07 2cut h MET 98 N -0.04 0.92 -0.56 1.92 4.05 -0.76 -2.53 114.93 117.92 2cut h MET 98 Ca 0.03 -0.31 0.08 0.00 -0.28 0.00 0.00 59.70 59.22 2cut h MET 98 Cb 0.20 -0.07 -0.07 0.00 -0.80 0.00 0.00 31.60 30.86 2cut h MET 98 CO -0.00 0.96 0.21 1.25 0.23 0.00 0.00 176.91 179.55 2cut h LEU 99 N 0.78 0.21 -1.58 3.39 5.85 -0.71 -1.38 115.31 121.87 2cut h LEU 99 Ca 0.14 0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.88 2cut h LEU 99 Cb 0.56 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 2cut h LEU 99 CO 0.03 0.13 -0.22 1.23 -0.34 0.00 0.00 178.44 179.28 2cut h GLY 100 N 0.39 0.00 1.43 3.75 0.00 -0.86 -1.03 103.07 106.76 2cut h GLY 100 Ca 0.28 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.37 2cut h GLY 100 CO -0.28 0.00 -0.97 1.41 0.00 0.00 0.00 176.54 176.70 2cut h LEU 101 N 0.00 0.66 -0.80 3.11 3.38 -0.87 -1.07 115.31 119.72 2cut h LEU 101 Ca -0.00 -0.53 -0.08 0.00 0.09 0.00 0.00 57.88 57.36 2cut h LEU 101 Cb 0.47 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 2cut h LEU 101 CO 0.03 1.33 0.05 -0.26 0.09 0.00 0.00 178.44 179.67 2cut h PHE 102 N 0.29 1.02 -0.49 1.13 0.04 -0.99 -0.36 116.94 117.58 2cut h PHE 102 Ca -0.09 -0.14 -0.02 0.00 2.80 0.00 0.00 57.97 60.51 2cut h PHE 102 Cb 1.61 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 39.46 2cut h PHE 102 CO 0.07 0.89 0.23 1.96 -0.60 0.00 0.00 178.31 180.86 2cut h GLN 103 N 0.89 0.71 -0.49 1.51 4.20 -1.09 -1.76 115.11 119.08 2cut h GLN 103 Ca 0.17 -0.11 -0.07 0.00 0.06 0.00 0.00 58.65 58.70 2cut h GLN 103 Cb 0.46 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 2cut h GLN 103 CO 0.02 0.61 0.04 0.37 -0.67 0.00 0.00 178.83 179.20 2cut h GLN 104 N 0.65 0.85 -0.50 1.46 4.15 -1.00 -0.95 115.11 119.75 2cut h GLN 104 Ca 0.17 -0.25 0.05 0.00 0.77 0.00 0.00 58.65 59.39 2cut h GLN 104 Cb 0.14 -0.09 -0.05 0.00 0.21 0.00 0.00 27.48 27.69 2cut h GLN 104 CO -0.02 0.86 0.23 0.00 -1.93 0.00 0.00 178.83 177.98 2cut h ALA 105 N 0.95 0.63 -0.70 3.38 0.00 -0.83 0.11 119.26 122.80 2cut h ALA 105 Ca 0.15 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 2cut h ALA 105 Cb 0.45 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 2cut h ALA 105 CO 0.02 -0.13 0.23 -0.97 0.00 0.00 0.00 179.25 178.40 2cut h ASN 106 N 0.46 1.00 -0.01 0.00 -1.24 -1.05 0.59 115.58 115.32 2cut h ASN 106 Ca 0.23 -0.18 -0.12 0.00 0.71 0.00 0.00 56.30 56.94 2cut h ASN 106 Cb 0.16 -0.26 0.01 0.00 0.73 0.00 0.00 38.32 38.96 2cut h ASN 106 CO -0.18 0.92 -0.46 0.74 -1.29 0.00 0.00 177.43 177.17 2cut h THR 107 N 1.04 1.46 -0.32 -3.57 2.02 -0.94 -3.09 112.91 109.50 2cut h THR 107 Ca 0.23 -1.98 -0.15 0.00 0.77 0.00 0.00 66.41 65.28 2cut h THR 107 Cb 0.27 2.59 -0.01 0.00 -1.74 0.00 0.00 68.15 69.27 2cut h THR 107 CO -0.01 0.57 -0.40 0.11 0.37 0.00 0.00 175.52 176.16 2cut h LYS 108 N -0.22 0.78 -2.00 6.66 1.57 -0.86 -3.40 116.57 119.10 2cut h LYS 108 Ca -0.05 -0.41 -0.54 0.00 -1.87 0.00 0.00 60.65 57.78 2cut h LYS 108 Cb 1.17 0.01 -0.36 0.00 0.08 0.00 0.00 32.23 33.13 2cut h LYS 108 CO 0.09 1.03 -0.99 0.00 -0.57 0.00 0.00 179.45 179.01 2cut h PRO 110 N 4.74 0.00 -0.19 0.00 0.11 -1.71 -0.75 132.00 134.21 2cut h PRO 110 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 2cut h PRO 110 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 2cut h PRO 110 CO 0.39 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 177.93 2cut n ASP 111 N -4.34 2.33 -4.81 -2.05 8.00 -1.26 -4.97 116.55 109.44 2cut n ASP 111 Ca 0.03 -1.80 -0.33 0.00 0.71 0.00 0.00 54.79 53.40 2cut n ASP 111 Cb 0.33 -0.12 -0.03 0.00 -0.02 0.00 0.00 41.12 41.28 2cut n ASP 111 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2cut s ALA 112 N -1.76 2.92 0.11 2.24 0.00 -0.29 -4.99 121.76 120.00 2cut s ALA 112 Ca 0.34 0.42 -0.23 0.00 0.00 0.00 0.00 51.96 52.49 2cut s ALA 112 Cb 0.20 -3.20 -0.07 0.00 0.00 0.00 0.00 23.12 20.05 2cut s ALA 112 CO 0.29 -0.32 0.69 0.99 0.00 0.00 0.00 175.76 177.42 2cut s THR 113 N -2.28 4.58 0.00 0.00 2.01 0.53 -4.94 115.64 115.54 2cut s THR 113 Ca 0.63 1.50 0.00 0.00 0.31 0.00 0.00 61.69 64.14 2cut s THR 113 Cb -0.13 -4.04 -0.04 0.00 0.01 0.00 0.00 72.50 68.30 2cut s THR 113 CO 0.25 0.50 0.07 -0.76 -0.69 0.00 0.00 174.62 173.99 2cut s LEU 114 N -0.92 3.82 0.09 4.42 1.43 -0.37 -1.45 118.68 125.71 2cut s LEU 114 Ca 0.34 0.10 0.02 0.00 -1.03 0.00 0.00 54.13 53.56 2cut s LEU 114 Cb -0.21 -2.24 -0.04 0.00 0.03 0.00 0.00 46.19 43.72 2cut s LEU 114 CO 0.23 0.26 -0.07 0.27 0.23 0.00 0.00 176.35 177.27 2cut s ILE 115 N -1.19 0.73 0.11 -0.59 -4.36 0.04 -0.70 121.20 115.24 2cut s ILE 115 Ca 0.23 -1.80 -0.05 0.00 -0.26 0.00 0.00 60.65 58.77 2cut s ILE 115 Cb -0.12 -1.52 -0.02 0.00 1.25 0.00 0.00 42.46 42.05 2cut s ILE 115 CO 0.14 -0.77 0.13 0.00 0.24 0.00 0.00 174.94 174.68 2cut s ALA 116 N -3.20 0.31 0.10 2.27 0.00 -0.38 -1.49 121.76 119.38 2cut s ALA 116 Ca 0.09 -1.06 -0.26 0.00 0.00 0.00 0.00 51.96 50.73 2cut s ALA 116 Cb 0.02 0.65 0.08 0.00 0.00 0.00 0.00 23.12 23.87 2cut s ALA 116 CO -0.03 -0.51 0.81 0.20 0.00 0.00 0.00 175.76 176.22 2cut s GLY 117 N -2.96 -0.42 -0.17 0.00 0.00 -0.47 -1.75 107.32 101.56 2cut s GLY 117 Ca 0.14 0.55 -0.30 0.00 0.00 0.00 0.00 44.72 45.11 2cut s GLY 117 CO -0.04 0.17 1.05 -0.32 0.00 0.00 0.00 173.10 173.97 2cut s GLY 118 N -2.70 -0.23 -0.09 0.20 0.00 -0.83 -0.81 107.32 102.86 2cut s GLY 118 Ca 0.06 2.06 0.04 0.00 0.00 0.00 0.00 44.72 46.88 2cut s GLY 118 CO -0.06 0.97 -0.22 -0.47 0.00 0.00 0.00 173.10 173.32 2cut s TYR 119 N -1.29 2.32 0.00 1.90 5.04 -0.60 -0.70 117.35 124.02 2cut s TYR 119 Ca 0.01 -0.89 0.00 0.00 -2.44 0.00 0.00 57.07 53.75 2cut s TYR 119 Cb -0.01 -1.56 0.00 0.00 0.35 0.00 0.00 41.96 40.74 2cut s TYR 119 CO -0.01 -0.36 0.00 0.45 -1.34 0.00 0.00 175.55 174.30 2cut n SER 120 N 3.47 0.00 -0.06 4.32 2.88 -0.12 -0.47 113.62 123.65 2cut n SER 120 Ca -0.19 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.39 2cut n SER 120 Cb 0.53 0.00 0.39 0.00 -0.75 0.00 0.00 64.21 64.38 2cut n SER 120 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 2cut h GLN 121 N 0.00 0.62 0.00 -1.46 4.15 -1.85 -0.91 115.11 115.66 2cut h GLN 121 Ca 0.00 -0.04 -0.04 0.00 0.77 0.00 0.00 58.65 59.34 2cut h GLN 121 Cb 0.00 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.54 2cut h GLN 121 CO 0.00 0.41 -0.19 0.78 -1.93 0.00 0.00 178.83 177.90 2cut h GLY 122 N 0.64 0.00 1.21 2.39 0.00 -0.44 0.09 103.07 106.96 2cut h GLY 122 Ca 0.19 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.34 2cut h GLY 122 CO -0.05 0.00 -0.55 0.00 0.00 0.00 0.00 176.54 175.95 2cut h ALA 123 N 1.81 0.50 -0.60 3.60 0.00 -1.11 0.14 119.26 123.61 2cut h ALA 123 Ca -0.00 -0.51 -0.09 0.00 0.00 0.00 0.00 54.91 54.30 2cut h ALA 123 Cb 0.35 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2cut h ALA 123 CO 0.02 0.68 0.01 0.00 0.00 0.00 0.00 179.25 179.96 2cut h ALA 124 N 0.73 0.88 -0.29 0.00 0.00 -1.06 -2.17 119.26 117.36 2cut h ALA 124 Ca 0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2cut h ALA 124 Cb 1.15 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2cut h ALA 124 CO 0.12 0.66 0.15 1.25 0.00 0.00 0.00 179.25 181.43 2cut h LEU 125 N 0.95 0.37 -0.65 0.00 5.85 -0.85 -0.61 115.31 120.37 2cut h LEU 125 Ca 0.17 -0.10 0.03 0.00 0.84 0.00 0.00 57.88 58.82 2cut h LEU 125 Cb 0.54 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 2cut h LEU 125 CO 0.03 0.37 0.40 0.00 -0.34 0.00 0.00 178.44 178.90 2cut h ALA 126 N 1.02 0.85 -0.50 1.25 0.00 -0.61 -0.33 119.26 120.94 2cut h ALA 126 Ca 0.10 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 2cut h ALA 126 Cb 0.09 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2cut h ALA 126 CO -0.01 0.15 -0.19 0.00 0.00 0.00 0.00 179.25 179.20 2cut h ALA 127 N 1.28 0.69 -0.12 0.00 0.00 -1.14 0.31 119.26 120.28 2cut h ALA 127 Ca 0.26 -0.38 -0.18 0.00 0.00 0.00 0.00 54.91 54.61 2cut h ALA 127 Cb 0.03 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2cut h ALA 127 CO -0.11 0.66 -0.68 0.00 0.00 0.00 0.00 179.25 179.12 2cut h ALA 128 N 0.88 0.59 -0.16 0.00 0.00 -0.83 -1.92 119.26 117.82 2cut h ALA 128 Ca 0.12 -0.58 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 2cut h ALA 128 Cb 0.77 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2cut h ALA 128 CO 0.06 0.73 0.00 0.77 0.00 0.00 0.00 179.25 180.81 2cut h SER 129 N 0.35 0.27 -0.66 0.00 0.02 -0.74 -2.20 113.55 110.59 2cut h SER 129 Ca -0.02 -0.31 -0.08 0.00 -0.84 0.00 0.00 61.79 60.54 2cut h SER 129 Cb 1.25 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 63.70 2cut h SER 129 CO 0.12 0.51 0.10 0.40 -1.14 0.00 0.00 176.83 176.83 2cut h ILE 130 N 0.02 1.26 -0.79 3.27 2.04 -0.92 -1.80 117.51 120.59 2cut h ILE 130 Ca 0.04 -1.04 0.13 0.00 1.00 0.00 0.00 64.86 64.99 2cut h ILE 130 Cb 0.37 0.65 -0.09 0.00 -0.74 0.00 0.00 36.82 37.01 2cut h ILE 130 CO 0.01 0.39 0.38 -0.08 0.00 0.00 0.00 178.15 178.85 2cut h GLU 131 N 1.03 0.56 -0.00 2.37 4.81 -1.23 -2.27 114.58 119.84 2cut h GLU 131 Ca 0.20 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 2cut h GLU 131 Cb 0.45 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.70 2cut h GLU 131 CO 0.01 0.37 -0.18 -0.25 -0.73 0.00 0.00 179.01 178.23 2cut n ASP 132 N -4.90 0.53 -4.77 1.04 8.00 -0.84 -4.90 116.55 110.71 2cut n ASP 132 Ca 0.15 -0.47 -0.36 0.00 0.71 0.00 0.00 54.79 54.82 2cut n ASP 132 Cb 0.38 -0.03 -0.01 0.00 -0.02 0.00 0.00 41.12 41.44 2cut n ASP 132 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2cut s LEU 133 N -2.61 3.92 0.24 0.64 0.20 -0.72 -4.98 118.68 115.36 2cut s LEU 133 Ca 0.24 2.23 -0.31 0.00 0.69 0.00 0.00 54.13 56.97 2cut s LEU 133 Cb 0.19 -4.37 -0.14 0.00 -0.43 0.00 0.00 46.19 41.44 2cut s LEU 133 CO 0.52 -0.99 1.35 -0.67 -0.29 0.00 0.00 176.35 176.27 2cut n ASP 134 N -0.77 2.50 -0.13 3.68 2.03 -1.26 -4.82 116.55 117.78 2cut n ASP 134 Ca 0.09 1.15 0.08 0.00 0.52 0.00 0.00 54.79 56.62 2cut n ASP 134 Cb 0.49 -1.40 0.41 0.00 -0.72 0.00 0.00 41.12 39.90 2cut n ASP 134 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 2cut h SER 135 N 3.90 0.55 -0.51 1.67 4.64 -1.95 -0.99 113.55 120.86 2cut h SER 135 Ca -0.45 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.83 2cut h SER 135 Cb 1.29 -0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 63.24 2cut h SER 135 CO 0.73 0.35 0.16 0.00 -0.87 0.00 0.00 176.83 177.21 2cut h ALA 136 N 1.65 1.23 -0.05 5.18 0.00 -2.00 0.12 119.26 125.40 2cut h ALA 136 Ca 0.28 -0.19 -0.25 0.00 0.00 0.00 0.00 54.91 54.75 2cut h ALA 136 Cb 0.30 -0.23 0.02 0.00 0.00 0.00 0.00 17.79 17.88 2cut h ALA 136 CO -0.09 0.54 -0.95 0.82 0.00 0.00 0.00 179.25 179.57 2cut h ILE 137 N 0.82 1.29 -0.52 0.00 2.04 -1.71 -3.20 117.51 116.24 2cut h ILE 137 Ca 0.18 -2.18 -0.01 0.00 1.00 0.00 0.00 64.86 63.85 2cut h ILE 137 Cb 0.26 2.26 -0.03 0.00 -0.74 0.00 0.00 36.82 38.58 2cut h ILE 137 CO -0.01 0.68 0.27 -0.09 0.00 0.00 0.00 178.15 179.00 2cut h ARG 138 N 0.42 0.72 0.00 2.37 2.43 -0.73 -0.93 114.38 118.67 2cut h ARG 138 Ca -0.10 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 58.99 2cut h ARG 138 Cb 1.59 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 31.00 2cut h ARG 138 CO 0.19 0.55 -0.01 -0.44 -1.51 0.00 0.00 179.97 178.75 2cut h ASP 139 N 0.73 0.00 1.03 -3.80 3.32 -0.76 -1.54 116.42 115.40 2cut h ASP 139 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 2cut h ASP 139 Cb 0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.60 2cut h ASP 139 CO -0.03 0.01 0.00 0.29 -1.72 0.00 0.00 179.24 177.79 2cut n LYS 140 N -4.14 0.08 -2.81 3.56 5.02 -0.35 -4.62 118.16 114.90 2cut n LYS 140 Ca -0.03 0.12 -0.43 0.00 -2.02 0.00 0.00 58.31 55.95 2cut n LYS 140 Cb 0.09 -1.60 -0.04 0.00 -0.02 0.00 0.00 35.03 33.46 2cut n LYS 140 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2cut s ILE 141 N -3.05 4.26 0.33 -0.18 1.01 -0.58 -1.23 121.20 121.76 2cut s ILE 141 Ca 0.11 -0.11 0.07 0.00 0.00 0.00 0.00 60.65 60.72 2cut s ILE 141 Cb 0.15 -4.68 0.10 0.00 0.01 0.00 0.00 42.46 38.04 2cut s ILE 141 CO 0.50 -1.44 1.80 0.00 0.00 0.00 0.00 174.94 175.81 2cut h ALA 142 N 9.57 1.29 -2.01 9.38 0.00 -1.17 -3.46 119.26 132.86 2cut h ALA 142 Ca -0.28 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.27 2cut h ALA 142 Cb 1.07 -0.10 -0.19 0.00 0.00 0.00 0.00 17.79 18.57 2cut h ALA 142 CO 1.17 0.48 0.17 0.20 0.00 0.00 0.00 179.25 181.27 2cut s GLY 143 N -4.10 -0.57 -0.07 0.00 0.00 -1.26 -4.72 107.32 96.60 2cut s GLY 143 Ca -0.05 1.42 0.01 0.00 0.00 0.00 0.00 44.72 46.10 2cut s GLY 143 CO 0.76 1.08 -0.07 -1.59 0.00 0.00 0.00 173.10 173.28 2cut s THR 144 N -0.93 0.81 -0.13 0.90 2.01 -0.04 -1.24 115.64 117.02 2cut s THR 144 Ca -0.09 -0.24 -0.04 0.00 0.31 0.00 0.00 61.69 61.64 2cut s THR 144 Cb -0.01 -0.81 -0.03 0.00 0.01 0.00 0.00 72.50 71.65 2cut s THR 144 CO 0.08 0.30 0.00 0.68 -0.69 0.00 0.00 174.62 175.00 2cut s VAL 145 N 1.16 4.28 -0.08 3.82 -7.23 -0.72 -1.50 120.40 120.13 2cut s VAL 145 Ca -0.06 -0.24 0.02 0.00 -1.81 0.00 0.00 61.98 59.89 2cut s VAL 145 Cb -0.14 -2.85 0.01 0.00 0.56 0.00 0.00 36.38 33.96 2cut s VAL 145 CO -0.01 0.54 -0.15 -0.76 -0.31 0.00 0.00 175.10 174.41 2cut s LEU 146 N -0.23 1.74 -0.07 1.32 1.43 -0.18 -1.97 118.68 120.71 2cut s LEU 146 Ca 0.06 -0.37 0.04 0.00 -1.03 0.00 0.00 54.13 52.82 2cut s LEU 146 Cb -0.12 -0.98 -0.02 0.00 0.03 0.00 0.00 46.19 45.09 2cut s LEU 146 CO 0.02 0.05 -0.18 -0.36 0.23 0.00 0.00 176.35 176.11 2cut s PHE 147 N 0.67 2.62 -1.26 0.29 0.40 0.12 -0.23 117.98 120.59 2cut s PHE 147 Ca -0.14 -0.49 -0.09 0.00 -0.60 0.00 0.00 56.93 55.61 2cut s PHE 147 Cb -0.16 -1.66 -0.01 0.00 0.51 0.00 0.00 43.02 41.70 2cut s PHE 147 CO 0.04 -0.06 0.65 0.41 0.70 0.00 0.00 175.22 176.95 2cut n GLY 148 N 2.83 -0.59 3.64 4.36 0.00 0.04 -0.94 105.19 114.53 2cut n GLY 148 Ca -0.17 0.28 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 2cut n GLY 148 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2cut s TYR 149 N -3.68 2.26 0.26 1.61 5.04 -1.26 -2.91 117.35 118.67 2cut s TYR 149 Ca 0.21 0.59 0.35 0.00 -2.44 0.00 0.00 57.07 55.78 2cut s TYR 149 Cb -0.07 -3.90 1.56 0.00 0.35 0.00 0.00 41.96 39.90 2cut s TYR 149 CO 0.86 -2.75 2.06 1.79 -1.34 0.00 0.00 175.55 176.17 2cut h THR 150 N 5.94 0.11 -0.39 4.34 1.35 -1.74 -1.98 112.91 120.53 2cut h THR 150 Ca -0.33 -0.46 -0.08 0.00 -0.55 0.00 0.00 66.41 64.99 2cut h THR 150 Cb 1.14 1.41 -0.05 0.00 -1.73 0.00 0.00 68.15 68.93 2cut h THR 150 CO 0.99 0.03 0.04 0.29 -0.25 0.00 0.00 175.52 176.63 2cut n LYS 151 N -3.17 2.97 -0.11 4.72 4.76 -1.26 -4.72 118.16 121.35 2cut n LYS 151 Ca -0.00 -2.98 -0.05 0.00 -2.87 0.00 0.00 58.31 52.41 2cut n LYS 151 Cb 0.26 -1.94 0.02 0.00 -1.84 0.00 0.00 35.03 31.53 2cut n LYS 151 CO 0.00 0.00 0.00 -0.97 -1.37 0.00 0.00 177.40 175.06 2cut h ASN 152 N 1.92 -0.16 -0.08 4.39 -0.00 -1.61 0.16 115.58 120.20 2cut h ASN 152 Ca 0.10 0.09 -0.05 0.00 -0.00 0.00 0.00 56.30 56.43 2cut h ASN 152 Cb 1.69 0.16 0.00 0.00 -0.00 0.00 0.00 38.32 40.17 2cut h ASN 152 CO 0.37 -0.04 -0.15 0.25 -0.00 0.00 0.00 177.43 177.86 2cut h LEU 153 N 0.10 0.27 -1.07 0.34 6.46 -1.82 0.23 115.31 119.83 2cut h LEU 153 Ca 0.18 -0.55 -0.05 0.00 -0.12 0.00 0.00 57.88 57.34 2cut h LEU 153 Cb 0.26 -0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 40.08 2cut h LEU 153 CO -0.31 0.78 0.15 1.56 -0.62 0.00 0.00 178.44 180.00 2cut h GLN 154 N -0.22 0.82 -0.67 1.25 7.50 -1.84 -1.65 115.11 120.30 2cut h GLN 154 Ca 0.00 -0.15 0.00 0.00 0.50 0.00 0.00 58.65 59.00 2cut h GLN 154 Cb 0.73 -0.13 0.00 0.00 0.05 0.00 0.00 27.48 28.13 2cut h GLN 154 CO 0.03 0.72 0.00 0.09 -1.50 0.00 0.00 178.83 178.18 2cut n ASN 155 N -4.29 3.83 -4.02 1.46 3.02 0.53 -4.95 115.26 110.84 2cut n ASN 155 Ca 0.04 -2.00 -0.28 0.00 -0.03 0.00 0.00 54.58 52.32 2cut n ASN 155 Cb 0.21 -0.45 -0.03 0.00 -0.61 0.00 0.00 39.78 38.91 2cut n ASN 155 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2cut n ARG 156 N 1.61 -3.17 -1.33 3.52 1.74 -0.10 -2.23 116.66 116.70 2cut n ARG 156 Ca 0.24 0.38 -0.09 0.00 -0.77 0.00 0.00 57.85 57.61 2cut n ARG 156 Cb 0.61 -4.59 -0.03 0.00 -1.02 0.00 0.00 32.46 27.43 2cut n ARG 156 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2cut n GLY 157 N -1.92 0.96 3.39 -0.13 0.00 0.62 -5.00 105.19 103.12 2cut n GLY 157 Ca -0.24 -0.64 -0.20 0.00 0.00 0.00 0.00 46.02 44.95 2cut n GLY 157 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2cut s ARG 158 N -2.87 1.45 -0.22 1.61 1.81 -0.95 -4.84 118.95 114.93 2cut s ARG 158 Ca 0.00 -1.70 -0.07 0.00 -1.72 0.00 0.00 55.73 52.25 2cut s ARG 158 Cb 0.00 -1.12 -0.03 0.00 -0.45 0.00 0.00 34.95 33.35 2cut s ARG 158 CO 0.00 0.09 0.05 0.42 -0.68 0.00 0.00 175.30 175.18 2cut s ILE 159 N -3.01 4.29 0.16 1.52 1.01 -1.26 -4.77 121.20 119.13 2cut s ILE 159 Ca 0.26 -0.19 -0.34 0.00 0.00 0.00 0.00 60.65 60.39 2cut s ILE 159 Cb 0.02 -2.97 -0.15 0.00 0.01 0.00 0.00 42.46 39.37 2cut s ILE 159 CO 0.10 0.38 1.36 -2.65 0.00 0.00 0.00 174.94 174.13 2cut n PRO 160 N 4.50 1.58 -1.38 2.79 -0.02 -1.26 -1.83 135.00 139.37 2cut n PRO 160 Ca -0.16 0.57 -0.13 0.00 -2.02 0.00 0.00 63.50 61.75 2cut n PRO 160 Cb 0.52 -2.20 -0.06 0.00 -0.02 0.00 0.00 33.50 31.74 2cut n PRO 160 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2cut n ASN 161 N 2.48 -4.74 -4.04 2.55 3.02 -1.26 -3.87 115.26 109.40 2cut n ASN 161 Ca 0.15 0.33 -0.20 0.00 -0.03 0.00 0.00 54.58 54.83 2cut n ASN 161 Cb 0.26 -3.41 -0.15 0.00 -0.61 0.00 0.00 39.78 35.87 2cut n ASN 161 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2cut s TYR 162 N -2.44 1.00 0.37 3.10 5.04 -0.76 -4.96 117.35 118.69 2cut s TYR 162 Ca 0.00 -0.21 -0.28 0.00 -2.44 0.00 0.00 57.07 54.14 2cut s TYR 162 Cb 0.00 -0.66 -0.11 0.00 0.35 0.00 0.00 41.96 41.53 2cut s TYR 162 CO 0.00 -0.05 1.47 -0.35 -1.34 0.00 0.00 175.55 175.29 2cut n PRO 163 N 2.96 2.62 -0.21 4.97 -0.04 -1.26 -4.58 135.00 139.46 2cut n PRO 163 Ca -0.15 0.92 -0.01 0.00 -0.04 0.00 0.00 63.50 64.22 2cut n PRO 163 Cb 0.56 -2.64 0.20 0.00 -0.04 0.00 0.00 33.50 31.58 2cut n PRO 163 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2cut h ALA 164 N 3.01 1.33 0.00 0.55 0.00 -1.93 -1.95 119.26 120.28 2cut h ALA 164 Ca -0.50 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.30 2cut h ALA 164 Cb 1.25 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2cut h ALA 164 CO 0.65 0.54 0.00 0.38 0.00 0.00 0.00 179.25 180.82 2cut h ASP 165 N 0.99 0.00 -0.35 0.00 2.03 -2.00 -2.25 116.42 114.84 2cut h ASP 165 Ca 0.25 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.55 2cut h ASP 165 Cb 0.04 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.54 2cut h ASP 165 CO -0.04 0.00 0.00 0.54 -1.03 0.00 0.00 179.24 178.71 2cut n ARG 166 N -2.52 2.50 -4.60 4.15 1.74 -0.74 -4.95 116.66 112.24 2cut n ARG 166 Ca 0.01 -2.26 -0.33 0.00 -0.77 0.00 0.00 57.85 54.50 2cut n ARG 166 Cb 0.23 -1.51 -0.13 0.00 -1.02 0.00 0.00 32.46 30.02 2cut n ARG 166 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2cut s THR 167 N -1.55 3.45 -0.14 0.55 2.01 -0.85 -0.86 115.64 118.25 2cut s THR 167 Ca 0.38 -0.52 -0.01 0.00 0.31 0.00 0.00 61.69 61.85 2cut s THR 167 Cb 0.23 -2.48 0.04 0.00 0.01 0.00 0.00 72.50 70.29 2cut s THR 167 CO 0.32 0.51 -0.04 -0.75 -0.69 0.00 0.00 174.62 173.97 2cut s LYS 168 N 0.34 1.25 -0.20 4.92 2.20 -0.56 -4.96 119.74 122.72 2cut s LYS 168 Ca -0.08 -0.33 -0.09 0.00 -0.36 0.00 0.00 55.97 55.11 2cut s LYS 168 Cb -0.15 -1.73 -0.05 0.00 -1.51 0.00 0.00 37.83 34.39 2cut s LYS 168 CO 0.04 -0.38 0.12 0.08 -0.36 0.00 0.00 175.35 174.85 2cut s VAL 169 N 1.73 5.25 -0.31 4.02 1.01 -1.26 -1.02 120.40 129.83 2cut s VAL 169 Ca 0.02 0.13 -0.06 0.00 0.00 0.00 0.00 61.98 62.07 2cut s VAL 169 Cb -0.14 -3.40 0.02 0.00 0.00 0.00 0.00 36.38 32.86 2cut s VAL 169 CO -0.07 0.43 0.08 -0.36 0.00 0.00 0.00 175.10 175.17 2cut s PHE 170 N 0.51 3.18 -0.28 5.22 0.40 0.68 -4.95 117.98 122.74 2cut s PHE 170 Ca 0.07 -1.15 -0.02 0.00 -0.60 0.00 0.00 56.93 55.23 2cut s PHE 170 Cb -0.12 -2.25 0.09 0.00 0.51 0.00 0.00 43.02 41.25 2cut s PHE 170 CO -0.00 -0.63 0.09 0.00 0.70 0.00 0.00 175.22 175.38 2cut n ASN 172 N 5.01 1.52 -4.74 0.00 3.02 -1.26 -4.96 115.26 113.85 2cut n ASN 172 Ca -0.05 0.78 -0.41 0.00 -0.03 0.00 0.00 54.58 54.87 2cut n ASN 172 Cb 0.43 -1.50 -0.03 0.00 -0.61 0.00 0.00 39.78 38.07 2cut n ASN 172 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2cut s THR 173 N -1.53 3.42 0.00 3.41 2.01 -1.26 -2.02 115.64 119.67 2cut s THR 173 Ca 0.80 1.20 0.00 0.00 0.31 0.00 0.00 61.69 64.00 2cut s THR 173 Cb -0.38 -3.77 0.00 0.00 0.01 0.00 0.00 72.50 68.37 2cut s THR 173 CO 0.43 0.20 0.00 0.61 -0.69 0.00 0.00 174.62 175.17 2cut n GLY 174 N 2.14 2.02 3.56 4.40 0.00 -1.26 -4.80 105.19 111.25 2cut n GLY 174 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 2cut n GLY 174 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2cut s ASP 175 N -2.39 5.83 0.46 1.61 -1.08 -0.86 -4.59 116.67 115.67 2cut s ASP 175 Ca 0.00 0.17 0.32 0.00 -0.52 0.00 0.00 52.55 52.52 2cut s ASP 175 Cb 0.00 -2.54 1.50 0.00 -1.46 0.00 0.00 42.92 40.42 2cut s ASP 175 CO 0.00 -1.97 1.95 -0.07 0.52 0.00 0.00 175.17 175.61 2cut h LEU 176 N 14.23 0.00 -1.76 -1.34 3.38 -1.88 -2.42 115.31 125.51 2cut h LEU 176 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2cut h LEU 176 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 2cut h LEU 176 CO 1.21 0.00 0.00 -0.37 0.09 0.00 0.00 178.44 179.37 2cut h VAL 177 N 0.00 0.00 0.00 1.22 -1.51 -1.68 -1.74 116.25 112.55 2cut h VAL 177 Ca 0.00 -0.41 0.00 0.00 -1.23 0.00 0.00 66.70 65.06 2cut h VAL 177 Cb 0.25 1.41 0.00 0.00 -2.13 0.00 0.00 31.29 30.82 2cut h VAL 177 CO 0.00 0.00 -0.12 0.00 -1.23 0.00 0.00 177.57 176.22 2cut n THR 179 N -1.66 2.48 -0.40 0.00 -2.24 -0.67 -3.10 114.28 108.69 2cut n THR 179 Ca 0.06 -3.56 0.00 0.00 -2.27 0.00 0.00 64.05 58.28 2cut n THR 179 Cb 0.36 -0.69 0.00 0.00 -2.10 0.00 0.00 70.33 67.90 2cut n THR 179 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cut n GLY 180 N -0.94 0.71 3.01 3.38 0.00 -1.24 -4.97 105.19 105.15 2cut n GLY 180 Ca 0.34 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.10 2cut n GLY 180 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2cut n SER 181 N 0.00 3.11 -0.19 1.61 3.41 -1.10 -5.02 113.62 115.44 2cut n SER 181 Ca 0.00 -2.82 0.07 0.00 -0.26 0.00 0.00 58.87 55.86 2cut n SER 181 Cb 0.00 0.27 0.12 0.00 -0.26 0.00 0.00 64.21 64.34 2cut n SER 181 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2cut n LEU 182 N 0.00 2.49 -4.71 1.04 4.77 -1.26 -3.90 117.00 115.43 2cut n LEU 182 Ca -0.16 -2.74 -0.42 0.00 -0.03 0.00 0.00 56.01 52.66 2cut n LEU 182 Cb 0.53 -0.32 -0.03 0.00 -2.33 0.00 0.00 43.42 41.27 2cut n LEU 182 CO 0.29 0.65 0.90 -0.63 -1.33 0.00 0.00 177.39 177.27 2cut s ILE 183 N -2.28 4.06 -0.27 -0.08 -1.09 -1.26 -4.94 121.20 115.34 2cut s ILE 183 Ca 0.25 1.47 -0.20 0.00 -2.23 0.00 0.00 60.65 59.93 2cut s ILE 183 Cb 0.21 -3.94 -0.02 0.00 -1.58 0.00 0.00 42.46 37.13 2cut s ILE 183 CO 0.04 0.09 0.61 -0.69 -1.23 0.00 0.00 174.94 173.76 2cut s VAL 184 N 1.27 4.98 0.31 2.92 1.01 -1.26 -3.88 120.40 125.76 2cut s VAL 184 Ca 0.58 1.01 0.10 0.00 0.00 0.00 0.00 61.98 63.67 2cut s VAL 184 Cb -0.29 -3.94 -0.05 0.00 0.00 0.00 0.00 36.38 32.10 2cut s VAL 184 CO 0.28 -0.02 -0.02 0.00 0.00 0.00 0.00 175.10 175.34 2cut s ALA 185 N 2.51 3.13 0.35 5.51 0.00 -1.26 -5.04 121.76 126.96 2cut s ALA 185 Ca 0.25 -1.86 0.11 0.00 0.00 0.00 0.00 51.96 50.46 2cut s ALA 185 Cb -0.15 -0.47 0.90 0.00 0.00 0.00 0.00 23.12 23.39 2cut s ALA 185 CO 0.10 0.15 1.79 0.00 0.00 0.00 0.00 175.76 177.80 2cut h ALA 186 N 1.89 1.91 -0.21 0.00 0.00 -1.97 -0.36 119.26 120.52 2cut h ALA 186 Ca -0.43 0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.61 2cut h ALA 186 Cb 1.25 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2cut h ALA 186 CO 0.64 -0.28 0.18 -1.35 0.00 0.00 0.00 179.25 178.44 2cut h PRO 187 N 0.60 0.00 0.00 0.00 0.11 -1.87 -1.10 132.00 129.74 2cut h PRO 187 Ca 0.56 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.64 2cut h PRO 187 Cb 1.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 2cut h PRO 187 CO -0.32 0.00 -0.14 1.25 -0.21 0.00 0.00 178.00 178.58 2cut h HIS 188 N 0.00 0.00 -0.58 0.65 2.76 -1.35 -1.36 115.15 115.26 2cut h HIS 188 Ca 0.10 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.27 2cut h HIS 188 Cb 0.45 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.41 2cut h HIS 188 CO 0.00 0.14 0.00 1.28 -1.30 0.00 0.00 177.93 178.05 2cut n LEU 189 N -3.58 3.87 -1.34 0.26 7.99 -0.42 -4.53 117.00 119.25 2cut n LEU 189 Ca -0.01 -1.95 -0.09 0.00 -0.01 0.00 0.00 56.01 53.95 2cut n LEU 189 Cb 0.28 -0.49 0.16 0.00 -0.11 0.00 0.00 43.42 43.25 2cut n LEU 189 CO 0.31 0.75 0.61 0.00 -1.51 0.00 0.00 177.39 177.55 2cut n ALA 190 N 1.08 4.53 1.33 -1.18 0.00 -0.51 -4.67 120.51 121.09 2cut n ALA 190 Ca 0.22 -3.32 0.13 0.00 0.00 0.00 0.00 53.44 50.47 2cut n ALA 190 Cb 0.69 -0.69 0.39 0.00 0.00 0.00 0.00 19.45 19.84 2cut n ALA 190 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2cut n TYR 191 N -1.04 0.00 -0.17 0.00 4.01 -1.26 -4.45 117.16 114.25 2cut n TYR 191 Ca 0.36 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 58.06 2cut n TYR 191 Cb 0.95 -0.02 0.03 0.00 -0.31 0.00 0.00 39.34 39.98 2cut n TYR 191 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2cut h GLY 192 N 4.84 0.14 0.40 2.72 0.00 -1.97 -1.75 103.07 107.45 2cut h GLY 192 Ca 0.00 0.30 0.08 0.00 0.00 0.00 0.00 47.33 47.70 2cut h GLY 192 CO 0.00 -0.22 0.07 -2.55 0.00 0.00 0.00 176.54 173.84 2cut h PRO 193 N -0.11 0.19 -0.70 4.80 0.11 -1.99 -2.64 132.00 131.67 2cut h PRO 193 Ca 0.24 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.36 2cut h PRO 193 Cb 0.49 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 31.51 2cut h PRO 193 CO -0.60 0.13 0.44 -0.44 -0.21 0.00 0.00 178.00 177.33 2cut h ASP 194 N 0.20 0.74 0.65 -2.05 3.32 -1.64 -1.61 116.42 116.03 2cut h ASP 194 Ca 0.22 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.23 2cut h ASP 194 Cb 0.29 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.67 2cut h ASP 194 CO -0.31 0.52 -0.17 0.00 -1.72 0.00 0.00 179.24 177.56 2cut h ALA 195 N 1.29 1.13 0.00 3.45 0.00 -1.14 -1.43 119.26 122.56 2cut h ALA 195 Ca 0.28 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2cut h ALA 195 Cb -0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2cut h ALA 195 CO -0.10 0.21 -0.66 0.00 0.00 0.00 0.00 179.25 178.70 2cut h ARG 196 N 0.00 0.00 0.00 0.00 3.08 -0.96 -3.16 114.38 113.33 2cut h ARG 196 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2cut h ARG 196 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 2cut h ARG 196 CO 0.02 0.34 0.00 0.41 -1.07 0.00 0.00 179.97 179.67 2cut n GLY 197 N 1.24 0.49 0.33 0.04 0.00 -0.83 -4.90 105.19 101.55 2cut n GLY 197 Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 2cut n GLY 197 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cut h PRO 198 N 0.00 1.12 0.61 1.61 0.13 -1.77 -2.27 132.00 131.44 2cut h PRO 198 Ca 0.00 -0.07 -0.03 0.00 -0.87 0.00 0.00 66.00 65.03 2cut h PRO 198 Cb 0.00 -0.25 0.01 0.00 0.13 0.00 0.00 31.00 30.89 2cut h PRO 198 CO 0.00 0.75 -0.30 0.00 -0.23 0.00 0.00 178.00 178.22 2cut h ALA 199 N 1.30 -0.82 -0.96 -0.56 0.00 -1.57 -0.72 119.26 115.93 2cut h ALA 199 Ca 0.31 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 55.07 2cut h ALA 199 Cb -0.12 0.32 -0.06 0.00 0.00 0.00 0.00 17.79 17.93 2cut h ALA 199 CO -0.07 -0.93 0.62 -1.00 0.00 0.00 0.00 179.25 177.87 2cut h PRO 200 N -0.88 1.15 -1.01 0.00 0.13 -1.77 -2.19 132.00 127.43 2cut h PRO 200 Ca -0.08 -0.07 0.09 0.00 -0.87 0.00 0.00 66.00 65.07 2cut h PRO 200 Cb 0.65 -0.26 -0.08 0.00 0.13 0.00 0.00 31.00 31.45 2cut h PRO 200 CO 0.14 0.76 0.64 0.93 -0.23 0.00 0.00 178.00 180.24 2cut h GLU 201 N 1.18 1.05 -0.13 0.86 5.08 -1.27 0.01 114.58 121.37 2cut h GLU 201 Ca 0.39 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.67 2cut h GLU 201 Cb 0.04 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 29.05 2cut h GLU 201 CO -0.14 0.70 0.01 0.35 -1.00 0.00 0.00 179.01 178.93 2cut h PHE 202 N 1.08 0.25 -0.74 4.33 3.57 -0.59 -1.39 116.94 123.45 2cut h PHE 202 Ca 0.47 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.91 2cut h PHE 202 Cb 0.34 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.97 2cut h PHE 202 CO -0.00 0.45 0.38 -0.07 -2.23 0.00 0.00 178.31 176.84 2cut h LEU 203 N -0.02 0.94 -0.36 0.59 3.38 -0.93 -0.95 115.31 117.96 2cut h LEU 203 Ca 0.04 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 2cut h LEU 203 Cb 0.34 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2cut h LEU 203 CO 0.01 0.77 -0.08 0.40 0.09 0.00 0.00 178.44 179.63 2cut h ILE 204 N 1.04 1.28 -0.60 1.22 2.04 -0.85 -0.41 117.51 121.23 2cut h ILE 204 Ca 0.26 -1.14 -0.04 0.00 1.00 0.00 0.00 64.86 64.94 2cut h ILE 204 Cb 0.06 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 2cut h ILE 204 CO -0.04 0.38 0.23 -0.08 0.00 0.00 0.00 178.15 178.64 2cut h GLU 205 N 0.49 0.91 -0.52 2.37 4.81 -1.10 0.23 114.58 121.77 2cut h GLU 205 Ca 0.09 -0.17 -0.08 0.00 -0.13 0.00 0.00 59.36 59.07 2cut h GLU 205 Cb 0.59 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.80 2cut h GLU 205 CO 0.03 0.78 -0.02 0.87 -0.73 0.00 0.00 179.01 179.95 2cut h LYS 206 N 0.84 0.88 -0.39 1.92 1.79 -0.89 -1.35 116.57 119.37 2cut h LYS 206 Ca 0.20 -0.26 -0.06 0.00 -2.18 0.00 0.00 60.65 58.35 2cut h LYS 206 Cb 0.22 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 30.76 2cut h LYS 206 CO -0.01 0.89 0.01 0.28 -1.08 0.00 0.00 179.45 179.53 2cut h VAL 207 N 0.81 1.26 -0.22 0.50 2.07 -0.67 -3.09 116.25 116.90 2cut h VAL 207 Ca 0.15 -0.98 -0.07 0.00 0.82 0.00 0.00 66.70 66.62 2cut h VAL 207 Cb 0.51 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 2cut h VAL 207 CO 0.03 0.33 -0.18 0.03 0.02 0.00 0.00 177.57 177.79 2cut h ARG 208 N 0.51 0.39 0.00 1.57 3.08 -0.80 0.59 114.38 119.73 2cut h ARG 208 Ca 0.11 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2cut h ARG 208 Cb 0.45 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.47 2cut h ARG 208 CO 0.02 0.56 0.00 0.00 -1.07 0.00 0.00 179.97 179.48 2cut h ALA 209 N 1.46 1.00 0.00 0.04 0.00 -1.17 0.21 119.26 120.80 2cut h ALA 209 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 54.91 54.57 2cut h ALA 209 Cb 0.53 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.25 2cut h ALA 209 CO 0.03 0.00 -2.47 1.33 0.00 0.00 0.00 179.25 178.15 2cut n VAL 210 N -3.05 1.50 0.17 0.00 0.24 -0.32 -4.72 118.33 112.15 2cut n VAL 210 Ca -0.01 -0.55 0.11 0.00 -2.04 0.00 0.00 64.34 61.85 2cut n VAL 210 Cb 0.21 -1.49 -0.15 0.00 -1.47 0.00 0.00 33.84 30.94 2cut n VAL 210 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2cut n ARG 211 N -3.40 0.55 -0.86 7.34 1.74 0.05 -5.13 116.66 116.94 2cut n ARG 211 Ca -0.47 -0.15 0.00 0.00 -0.77 0.00 0.00 57.85 56.46 2cut n ARG 211 Cb 0.98 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.88 2cut n ARG 211 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52