#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g0i s ILE 2 N 0.00 1.35 -0.16 -1.33 1.01 0.27 -4.81 121.20 117.53 2g0i s ILE 2 Ca 0.00 -0.61 0.01 0.00 0.00 0.00 0.00 60.65 60.05 2g0i s ILE 2 Cb 0.00 -1.21 0.01 0.00 0.01 0.00 0.00 42.46 41.28 2g0i s ILE 2 CO 0.00 0.40 -0.20 -1.10 0.00 0.00 0.00 174.94 174.05 2g0i s GLN 3 N 0.53 3.04 -0.09 2.79 -0.21 -0.63 -1.07 119.66 124.01 2g0i s GLN 3 Ca -0.14 -0.82 0.01 0.00 0.02 0.00 0.00 55.36 54.42 2g0i s GLN 3 Cb -0.16 -2.54 -0.02 0.00 1.00 0.00 0.00 33.01 31.29 2g0i s GLN 3 CO 0.05 -0.11 -0.10 0.00 -2.12 0.00 0.00 175.29 173.01 2g0i s ALA 4 N 1.07 2.82 -0.20 6.09 0.00 -0.46 -1.31 121.76 129.77 2g0i s ALA 4 Ca -0.01 -0.90 -0.00 0.00 0.00 0.00 0.00 51.96 51.05 2g0i s ALA 4 Cb -0.14 -1.22 0.05 0.00 0.00 0.00 0.00 23.12 21.81 2g0i s ALA 4 CO -0.07 0.43 -0.04 0.99 0.00 0.00 0.00 175.76 177.07 2g0i s THR 5 N -0.31 1.20 -0.11 0.00 2.01 -0.14 -0.06 115.64 118.24 2g0i s THR 5 Ca 0.04 -0.86 -0.09 0.00 0.31 0.00 0.00 61.69 61.09 2g0i s THR 5 Cb -0.13 -1.46 -0.04 0.00 0.01 0.00 0.00 72.50 70.88 2g0i s THR 5 CO 0.03 -0.01 0.19 -0.36 -0.69 0.00 0.00 174.62 173.78 2g0i s PHE 6 N 1.57 3.60 -0.18 4.92 0.08 0.54 -0.91 117.98 127.60 2g0i s PHE 6 Ca -0.02 0.59 -0.01 0.00 0.12 0.00 0.00 56.93 57.61 2g0i s PHE 6 Cb -0.17 -2.04 -0.00 0.00 -0.57 0.00 0.00 43.02 40.24 2g0i s PHE 6 CO -0.07 0.66 -0.11 0.42 -0.10 0.00 0.00 175.22 176.01 2g0i s ILE 7 N -0.83 2.95 -0.13 0.64 1.01 -0.22 -4.36 121.20 120.26 2g0i s ILE 7 Ca 0.16 -0.66 -0.04 0.00 0.00 0.00 0.00 60.65 60.11 2g0i s ILE 7 Cb -0.13 -2.28 -0.03 0.00 0.01 0.00 0.00 42.46 40.03 2g0i s ILE 7 CO 0.05 0.49 0.01 -0.60 0.00 0.00 0.00 174.94 174.88 2g0i s ARG 8 N 1.00 3.48 -0.08 2.79 3.52 -1.26 -0.64 118.95 127.77 2g0i s ARG 8 Ca -0.01 -0.42 0.00 0.00 -0.13 0.00 0.00 55.73 55.17 2g0i s ARG 8 Cb -0.15 -2.95 0.02 0.00 -1.56 0.00 0.00 34.95 30.31 2g0i s ARG 8 CO -0.02 0.44 -0.07 1.03 -0.81 0.00 0.00 175.30 175.88 2g0i s ARG 9 N -0.15 1.24 -1.50 5.12 0.52 -0.23 -2.54 118.95 121.41 2g0i s ARG 9 Ca 0.05 -0.19 -0.12 0.00 -0.52 0.00 0.00 55.73 54.95 2g0i s ARG 9 Cb -0.13 -1.26 0.07 0.00 0.52 0.00 0.00 34.95 34.16 2g0i s ARG 9 CO 0.02 -0.16 0.89 1.63 0.02 0.00 0.00 175.30 177.69 2g0i n LYS 10 N 4.52 -5.26 0.00 3.54 4.76 -1.26 -2.39 118.16 122.07 2g0i n LYS 10 Ca -0.17 0.62 0.00 0.00 -2.87 0.00 0.00 58.31 55.89 2g0i n LYS 10 Cb 0.51 -5.49 0.00 0.00 -1.84 0.00 0.00 35.03 28.20 2g0i n LYS 10 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2g0i n GLY 11 N -1.61 2.94 3.73 0.72 0.00 -1.26 -5.03 105.19 104.68 2g0i n GLY 11 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 2g0i n GLY 11 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2g0i s ILE 12 N -2.26 4.61 0.09 -0.61 -4.36 -1.00 -5.07 121.20 112.60 2g0i s ILE 12 Ca 0.00 -0.14 -0.31 0.00 -0.26 0.00 0.00 60.65 59.94 2g0i s ILE 12 Cb 0.00 -2.96 -0.08 0.00 1.25 0.00 0.00 42.46 40.67 2g0i s ILE 12 CO 0.00 0.60 1.51 -0.76 0.24 0.00 0.00 174.94 176.53 2g0i s LEU 13 N -0.95 4.36 -0.08 0.37 1.43 -1.26 -1.07 118.68 121.48 2g0i s LEU 13 Ca 0.14 2.39 0.04 0.00 -1.03 0.00 0.00 54.13 55.66 2g0i s LEU 13 Cb -0.11 -3.58 -0.07 0.00 0.03 0.00 0.00 46.19 42.45 2g0i s LEU 13 CO 0.03 -0.77 -0.03 -0.62 0.23 0.00 0.00 176.35 175.19 2g0i n GLU 14 N 4.73 1.50 -3.64 1.70 1.02 0.19 -4.95 120.64 121.19 2g0i n GLU 14 Ca 0.14 0.03 -0.11 0.00 -0.02 0.00 0.00 57.16 57.19 2g0i n GLU 14 Cb 0.41 -1.19 -0.05 0.00 -0.02 0.00 0.00 31.44 30.60 2g0i n GLU 14 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2g0i s SER 15 N -4.40 -0.25 -0.03 1.62 1.04 -1.12 -0.18 113.70 110.39 2g0i s SER 15 Ca -0.08 -0.22 -0.02 0.00 0.48 0.00 0.00 55.95 56.11 2g0i s SER 15 Cb 0.03 0.46 0.01 0.00 0.10 0.00 0.00 66.02 66.62 2g0i s SER 15 CO 0.25 -0.79 0.06 0.54 0.98 0.00 0.00 173.24 174.28 2g0i s VAL 16 N -3.38 -0.02 -0.10 5.02 0.11 -0.50 -1.05 120.40 120.47 2g0i s VAL 16 Ca 0.00 0.06 0.03 0.00 -2.93 0.00 0.00 61.98 59.14 2g0i s VAL 16 Cb 0.01 -0.10 0.01 0.00 -1.53 0.00 0.00 36.38 34.76 2g0i s VAL 16 CO -0.09 0.03 -0.20 -0.70 -3.33 0.00 0.00 175.10 170.81 2g0i s GLU 17 N 0.36 2.66 0.02 1.54 2.12 -0.09 -0.77 118.70 124.54 2g0i s GLU 17 Ca -0.03 -0.74 0.07 0.00 0.36 0.00 0.00 54.97 54.64 2g0i s GLU 17 Cb -0.04 -2.10 -0.02 0.00 0.26 0.00 0.00 34.13 32.23 2g0i s GLU 17 CO -0.01 0.07 -0.22 -0.51 -0.54 0.00 0.00 175.26 174.05 2g0i s LEU 18 N 0.61 2.12 0.08 2.70 1.02 -1.26 -0.96 118.68 122.99 2g0i s LEU 18 Ca -0.14 -0.48 0.05 0.00 0.02 0.00 0.00 54.13 53.58 2g0i s LEU 18 Cb -0.17 -1.08 -0.03 0.00 0.02 0.00 0.00 46.19 44.93 2g0i s LEU 18 CO 0.04 0.22 -0.13 0.42 0.02 0.00 0.00 176.35 176.92 2g0i s THR 19 N -0.69 1.04 0.00 5.49 -4.23 -0.43 -4.22 115.64 112.60 2g0i s THR 19 Ca 0.09 -1.41 0.00 0.00 -1.18 0.00 0.00 61.69 59.18 2g0i s THR 19 Cb -0.09 -1.15 0.00 0.00 1.34 0.00 0.00 72.50 72.60 2g0i s THR 19 CO 0.01 -0.34 0.00 0.61 -0.54 0.00 0.00 174.62 174.35 2g0i n GLY 20 N 1.03 1.22 0.00 3.99 0.00 -0.71 -1.61 105.19 109.11 2g0i n GLY 20 Ca -0.19 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.95 2g0i n GLY 20 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2g0i n HIS 21 N -2.00 0.00 0.60 1.61 -0.00 -1.04 -3.22 115.22 111.17 2g0i n HIS 21 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 57.72 57.79 2g0i n HIS 21 Cb 0.00 -0.36 0.34 0.00 -0.00 0.00 0.00 29.99 29.97 2g0i n HIS 21 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2g0i n ALA 22 N -1.36 1.75 0.00 1.59 0.00 -0.62 -4.79 120.51 117.08 2g0i n ALA 22 Ca 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2g0i n ALA 22 Cb 0.24 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.46 2g0i n ALA 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g0i n GLY 23 N -0.02 1.15 0.00 0.00 0.00 -1.20 -4.97 105.19 100.16 2g0i n GLY 23 Ca 0.05 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.23 2g0i n GLY 23 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2g0i n SER 24 N -0.40 0.93 0.00 1.61 3.41 -1.26 -4.85 113.62 113.06 2g0i n SER 24 Ca 0.00 -0.12 0.00 0.00 -0.26 0.00 0.00 58.87 58.49 2g0i n SER 24 Cb 0.00 0.43 0.00 0.00 -0.26 0.00 0.00 64.21 64.38 2g0i n SER 24 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2g0i n GLY 25 N 0.71 0.96 3.43 5.00 0.00 -1.26 -5.09 105.19 108.94 2g0i n GLY 25 Ca 0.00 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 2g0i n GLY 25 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2g0i s GLU 26 N -0.75 3.56 0.09 1.61 2.02 -1.26 -5.05 118.70 118.92 2g0i s GLU 26 Ca 0.00 -0.55 -0.22 0.00 0.02 0.00 0.00 54.97 54.21 2g0i s GLU 26 Cb 0.00 -3.00 -0.08 0.00 0.10 0.00 0.00 34.13 31.16 2g0i s GLU 26 CO 0.00 0.04 1.37 -0.92 0.02 0.00 0.00 175.26 175.77 2g0i h TYR 27 N 7.38 -1.15 -0.72 1.61 3.20 -1.98 0.16 116.97 125.47 2g0i h TYR 27 Ca -0.35 0.05 0.13 0.00 3.14 0.00 0.00 58.73 61.71 2g0i h TYR 27 Cb 1.18 0.53 -0.09 0.00 1.54 0.00 0.00 36.73 39.89 2g0i h TYR 27 CO 0.57 -0.34 0.27 0.78 -1.64 0.00 0.00 178.16 177.81 2g0i h GLY 28 N -0.29 1.06 1.40 1.82 0.00 -2.00 -0.93 103.07 104.14 2g0i h GLY 28 Ca 0.05 -0.13 -0.18 0.00 0.00 0.00 0.00 47.33 47.06 2g0i h GLY 28 CO -0.39 -0.09 -0.64 -2.75 0.00 0.00 0.00 176.54 172.68 2g0i h PHE 29 N 0.42 0.79 0.00 5.60 3.57 -1.84 -2.66 116.94 122.83 2g0i h PHE 29 Ca 0.39 -0.31 -0.08 0.00 3.53 0.00 0.00 57.97 61.50 2g0i h PHE 29 Cb 0.57 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 2g0i h PHE 29 CO -0.18 1.08 -0.37 -0.44 -2.23 0.00 0.00 178.31 176.18 2g0i h ASP 30 N 0.45 0.00 -0.34 0.41 3.32 0.60 0.22 116.42 121.07 2g0i h ASP 30 Ca -0.01 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 2g0i h ASP 30 Cb 1.21 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.75 2g0i h ASP 30 CO 0.12 0.37 0.01 0.40 -1.72 0.00 0.00 179.24 178.42 2g0i h ILE 31 N 0.00 1.26 -0.78 0.35 1.08 -1.18 -0.76 117.51 117.47 2g0i h ILE 31 Ca -0.00 -0.96 -0.04 0.00 -0.39 0.00 0.00 64.86 63.47 2g0i h ILE 31 Cb 0.79 1.20 -0.04 0.00 -3.07 0.00 0.00 36.82 35.71 2g0i h ILE 31 CO 0.05 0.32 0.35 0.58 -0.69 0.00 0.00 178.15 178.75 2g0i h VAL 32 N 0.41 1.25 -0.76 1.67 2.07 -1.04 -1.81 116.25 118.04 2g0i h VAL 32 Ca 0.10 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.87 2g0i h VAL 32 Cb 0.44 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 30.47 2g0i h VAL 32 CO 0.02 0.31 0.48 0.00 0.02 0.00 0.00 177.57 178.40 2g0i h ALA 34 N 1.26 0.59 -0.23 0.00 0.00 -0.85 0.58 119.26 120.61 2g0i h ALA 34 Ca 0.28 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.19 2g0i h ALA 34 Cb -0.07 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.49 2g0i h ALA 34 CO -0.06 0.04 -0.02 0.00 0.00 0.00 0.00 179.25 179.22 2g0i h ALA 35 N 1.17 0.18 -0.21 0.00 0.00 -0.82 -0.84 119.26 118.74 2g0i h ALA 35 Ca 0.17 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2g0i h ALA 35 Cb -0.07 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2g0i h ALA 35 CO -0.04 -0.44 0.11 0.28 0.00 0.00 0.00 179.25 179.16 2g0i h VAL 36 N 0.04 1.12 -0.82 0.00 2.07 -0.76 -2.46 116.25 115.45 2g0i h VAL 36 Ca 0.11 -0.32 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 2g0i h VAL 36 Cb 0.15 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 2g0i h VAL 36 CO -0.21 0.11 0.38 0.28 0.02 0.00 0.00 177.57 178.16 2g0i h SER 37 N 0.22 1.08 -0.30 0.57 0.02 -0.77 -0.39 113.55 113.98 2g0i h SER 37 Ca 0.07 -0.13 0.02 0.00 -0.84 0.00 0.00 61.79 60.91 2g0i h SER 37 Cb 0.08 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.32 2g0i h SER 37 CO -0.01 0.91 0.13 0.74 -1.14 0.00 0.00 176.83 177.47 2g0i h THR 38 N 1.17 0.97 -0.34 -2.27 2.02 -1.07 -2.96 112.91 110.41 2g0i h THR 38 Ca 0.28 -0.10 -0.05 0.00 0.77 0.00 0.00 66.41 67.31 2g0i h THR 38 Cb 0.13 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.19 2g0i h THR 38 CO -0.03 0.05 0.02 -0.07 0.37 0.00 0.00 175.52 175.86 2g0i h LEU 39 N 0.28 0.58 -0.31 2.58 3.38 -1.28 -1.31 115.31 119.23 2g0i h LEU 39 Ca 0.13 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2g0i h LEU 39 Cb 0.06 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2g0i h LEU 39 CO -0.10 0.72 0.00 -1.20 0.09 0.00 0.00 178.44 177.95 2g0i n SER 40 N -4.54 0.00 0.00 -0.43 7.64 -0.17 -1.16 113.62 114.96 2g0i n SER 40 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.86 2g0i n SER 40 Cb 0.25 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 2g0i n SER 40 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2g0i n ASN 42 N -0.16 0.00 0.05 6.43 4.05 -0.50 -2.37 115.26 122.76 2g0i n ASN 42 Ca 0.00 0.00 -0.11 0.00 0.45 0.00 0.00 54.58 54.92 2g0i n ASN 42 Cb 0.00 0.00 -0.05 0.00 1.23 0.00 0.00 39.78 40.96 2g0i n ASN 42 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 2g0i h LEU 43 N 0.00 -0.34 -0.21 1.20 5.85 -1.40 0.33 115.31 120.74 2g0i h LEU 43 Ca 0.00 0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.80 2g0i h LEU 43 Cb 0.00 0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 2g0i h LEU 43 CO 0.00 -0.17 0.01 0.58 -0.34 0.00 0.00 178.44 178.52 2g0i h VAL 44 N -0.20 0.86 -0.24 1.05 2.07 -1.75 0.11 116.25 118.16 2g0i h VAL 44 Ca 0.04 -0.03 -0.07 0.00 0.82 0.00 0.00 66.70 67.46 2g0i h VAL 44 Cb 0.25 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 2g0i h VAL 44 CO -0.12 0.01 -0.14 0.78 0.02 0.00 0.00 177.57 178.13 2g0i h ASN 45 N 0.08 0.53 -0.63 0.57 2.35 -1.83 -2.66 115.58 113.99 2g0i h ASN 45 Ca 0.10 -0.42 -0.03 0.00 -0.55 0.00 0.00 56.30 55.40 2g0i h ASN 45 Cb 0.12 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.31 2g0i h ASN 45 CO -0.16 0.84 0.29 0.00 -1.65 0.00 0.00 177.43 176.76 2g0i h ALA 46 N 0.71 0.81 -0.23 -0.83 0.00 -0.25 0.45 119.26 119.93 2g0i h ALA 46 Ca 0.05 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.87 2g0i h ALA 46 Cb 0.65 -0.25 -0.06 0.00 0.00 0.00 0.00 17.79 18.13 2g0i h ALA 46 CO 0.04 0.38 -0.15 -0.07 0.00 0.00 0.00 179.25 179.45 2g0i h LEU 47 N 0.87 -0.49 0.51 0.00 3.38 -0.93 0.25 115.31 118.89 2g0i h LEU 47 Ca 0.21 0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.26 2g0i h LEU 47 Cb 0.13 0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2g0i h LEU 47 CO -0.03 -0.19 -0.24 -0.33 0.09 0.00 0.00 178.44 177.74 2g0i h GLU 48 N -0.14 -0.65 -0.20 1.13 5.08 -1.20 -2.03 114.58 116.57 2g0i h GLU 48 Ca 0.13 0.04 -0.17 0.00 -1.00 0.00 0.00 59.36 58.36 2g0i h GLU 48 Cb 0.33 0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.73 2g0i h GLU 48 CO -0.31 -0.40 -0.54 0.28 -1.00 0.00 0.00 179.01 177.03 2g0i h VAL 49 N -0.75 1.31 0.00 3.13 2.07 -0.88 -3.32 116.25 117.81 2g0i h VAL 49 Ca -0.07 -1.77 -0.02 0.00 0.82 0.00 0.00 66.70 65.67 2g0i h VAL 49 Cb 0.55 1.88 -0.00 0.00 -1.52 0.00 0.00 31.29 32.20 2g0i h VAL 49 CO 0.11 0.56 -1.52 0.18 0.02 0.00 0.00 177.57 176.92 2g0i n LEU 50 N -4.11 0.00 -0.23 2.57 4.77 0.85 -4.62 117.00 116.22 2g0i n LEU 50 Ca -0.06 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 55.94 2g0i n LEU 50 Cb 0.62 0.02 0.04 0.00 -2.33 0.00 0.00 43.42 41.77 2g0i n LEU 50 CO 0.49 0.02 0.41 0.00 -1.33 0.00 0.00 177.39 176.98 2g0i n ALA 51 N -1.93 2.34 -3.55 -1.18 0.00 -0.85 -5.01 120.51 110.33 2g0i n ALA 51 Ca -0.03 -0.73 -0.20 0.00 0.00 0.00 0.00 53.44 52.47 2g0i n ALA 51 Cb 0.34 -0.18 0.07 0.00 0.00 0.00 0.00 19.45 19.68 2g0i n ALA 51 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2g0i n ASP 52 N 0.16 -2.83 -3.60 0.00 2.03 -0.87 -4.73 116.55 106.71 2g0i n ASP 52 Ca 0.04 -0.66 -0.26 0.00 0.52 0.00 0.00 54.79 54.42 2g0i n ASP 52 Cb 0.20 -4.80 -0.17 0.00 -0.72 0.00 0.00 41.12 35.64 2g0i n ASP 52 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2g0i s THR 54 N 2.13 5.11 0.47 0.00 2.01 -1.26 -2.57 115.64 121.53 2g0i s THR 54 Ca 0.03 0.84 -0.04 0.00 0.31 0.00 0.00 61.69 62.83 2g0i s THR 54 Cb -0.16 -3.80 -0.03 0.00 0.01 0.00 0.00 72.50 68.52 2g0i s THR 54 CO -0.12 0.15 0.75 0.68 -0.69 0.00 0.00 174.62 175.39 2g0i s VAL 55 N 1.90 4.66 0.02 3.82 -7.23 -1.26 -4.99 120.40 117.32 2g0i s VAL 55 Ca 0.21 -0.02 -0.23 0.00 -1.81 0.00 0.00 61.98 60.13 2g0i s VAL 55 Cb -0.15 -3.76 -0.05 0.00 0.56 0.00 0.00 36.38 32.97 2g0i s VAL 55 CO 0.09 -0.69 0.70 -0.55 -0.31 0.00 0.00 175.10 174.34 2g0i s SER 56 N -4.14 7.12 -0.08 4.85 0.15 -1.16 -4.99 113.70 115.45 2g0i s SER 56 Ca 0.47 1.33 -0.03 0.00 0.70 0.00 0.00 55.95 58.42 2g0i s SER 56 Cb -0.10 -2.43 0.04 0.00 -1.71 0.00 0.00 66.02 61.82 2g0i s SER 56 CO 0.43 0.04 0.16 -0.22 1.20 0.00 0.00 173.24 174.84 2g0i s LEU 57 N -0.07 0.25 0.41 3.45 2.96 -1.26 -1.14 118.68 123.28 2g0i s LEU 57 Ca 0.36 0.33 0.07 0.00 -0.22 0.00 0.00 54.13 54.67 2g0i s LEU 57 Cb -0.20 0.32 -0.05 0.00 0.50 0.00 0.00 46.19 46.76 2g0i s LEU 57 CO 0.21 -0.21 0.16 -1.58 -1.32 0.00 0.00 176.35 173.61 2g0i s GLN 58 N 1.83 2.20 0.00 1.98 2.00 -0.53 -4.98 119.66 122.16 2g0i s GLN 58 Ca -0.02 -1.86 0.00 0.00 -2.00 0.00 0.00 55.36 51.48 2g0i s GLN 58 Cb -0.12 -1.95 0.00 0.00 0.80 0.00 0.00 33.01 31.74 2g0i s GLN 58 CO -0.06 -0.09 0.00 -0.40 -0.50 0.00 0.00 175.29 174.24 2g0i n ASP 60 N -1.20 0.00 -0.58 6.67 5.75 -0.02 -0.85 116.55 126.32 2g0i n ASP 60 Ca -0.02 0.00 0.06 0.00 -0.01 0.00 0.00 54.79 54.83 2g0i n ASP 60 Cb 0.65 0.00 0.10 0.00 -1.03 0.00 0.00 41.12 40.83 2g0i n ASP 60 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2g0i n GLU 61 N -0.02 1.55 -1.93 0.11 -0.58 -1.26 -1.40 120.64 117.11 2g0i n GLU 61 Ca 0.00 -1.58 -0.34 0.00 -0.42 0.00 0.00 57.16 54.82 2g0i n GLU 61 Cb 0.00 -1.26 0.03 0.00 -0.57 0.00 0.00 31.44 29.64 2g0i n GLU 61 CO 0.00 0.00 0.00 -0.59 -0.48 0.00 0.00 177.13 176.06 2g0i s PHE 62 N -1.02 2.64 -0.38 -0.32 -0.71 -1.26 -3.99 117.98 112.94 2g0i s PHE 62 Ca 0.19 1.55 -0.07 0.00 -1.04 0.00 0.00 56.93 57.56 2g0i s PHE 62 Cb 0.12 -3.21 0.01 0.00 -1.21 0.00 0.00 43.02 38.73 2g0i s PHE 62 CO 0.16 -1.64 0.13 -0.25 -1.34 0.00 0.00 175.22 172.28 2g0i n ASP 63 N -2.04 -0.71 0.00 1.98 8.00 -1.26 0.03 116.55 122.56 2g0i n ASP 63 Ca 0.11 -0.37 0.00 0.00 0.71 0.00 0.00 54.79 55.23 2g0i n ASP 63 Cb 0.52 -0.45 0.00 0.00 -0.02 0.00 0.00 41.12 41.16 2g0i n ASP 63 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2g0i n GLY 64 N -1.33 1.99 0.00 0.44 0.00 -1.26 -4.81 105.19 100.22 2g0i n GLY 64 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2g0i n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2g0i n GLY 65 N -2.00 2.15 3.29 -0.02 0.00 0.10 -1.60 105.19 107.12 2g0i n GLY 65 Ca 0.00 -1.63 -0.17 0.00 0.00 0.00 0.00 46.02 44.22 2g0i n GLY 65 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2g0i s TYR 66 N -1.36 1.54 -0.30 1.61 5.04 -0.50 -1.74 117.35 121.64 2g0i s TYR 66 Ca 0.00 -1.45 -0.17 0.00 -2.44 0.00 0.00 57.07 53.01 2g0i s TYR 66 Cb 0.00 -0.75 0.18 0.00 0.35 0.00 0.00 41.96 41.74 2g0i s TYR 66 CO 0.00 -0.64 1.12 0.21 -1.34 0.00 0.00 175.55 174.90 2g0i s LYS 68 N -3.80 0.19 -0.24 4.97 2.20 -0.03 -0.84 119.74 122.19 2g0i s LYS 68 Ca 0.38 0.43 -0.10 0.00 -0.36 0.00 0.00 55.97 56.32 2g0i s LYS 68 Cb 0.05 0.20 -0.05 0.00 -1.51 0.00 0.00 37.83 36.52 2g0i s LYS 68 CO 0.19 -0.06 0.14 0.42 -0.36 0.00 0.00 175.35 175.68 2g0i s ILE 69 N 1.95 5.13 -0.12 5.43 1.01 0.05 -1.45 121.20 133.20 2g0i s ILE 69 Ca -0.03 0.10 -0.02 0.00 0.00 0.00 0.00 60.65 60.70 2g0i s ILE 69 Cb -0.03 -3.39 0.04 0.00 0.01 0.00 0.00 42.46 39.08 2g0i s ILE 69 CO -0.16 0.35 -0.00 -0.62 0.00 0.00 0.00 174.94 174.51 2g0i s ASP 70 N 1.14 2.14 0.00 3.58 -1.08 -0.30 -1.41 116.67 120.74 2g0i s ASP 70 Ca 0.07 -0.37 0.20 0.00 -0.52 0.00 0.00 52.55 51.93 2g0i s ASP 70 Cb -0.14 -0.58 0.19 0.00 -1.46 0.00 0.00 42.92 40.93 2g0i s ASP 70 CO 0.05 -0.21 1.16 0.18 0.52 0.00 0.00 175.17 176.86 2g0i n LEU 71 N 5.07 2.74 -0.34 -1.34 4.77 0.75 -3.00 117.00 125.65 2g0i n LEU 71 Ca -0.09 -1.09 0.23 0.00 -0.03 0.00 0.00 56.01 55.03 2g0i n LEU 71 Cb 0.49 -0.04 0.47 0.00 -2.33 0.00 0.00 43.42 42.01 2g0i n LEU 71 CO 0.13 0.50 1.15 0.28 -1.33 0.00 0.00 177.39 178.11 2g0i h SER 72 N 3.86 0.54 -0.06 -1.43 0.02 -1.93 -0.45 113.55 114.09 2g0i h SER 72 Ca 0.00 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 2g0i h SER 72 Cb 0.83 0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.46 2g0i h SER 72 CO 0.00 -0.04 0.00 -1.22 -1.14 0.00 0.00 176.83 174.43 2g0i n TYR 73 N -4.92 0.04 -3.11 3.45 4.01 -1.26 -4.95 117.16 110.42 2g0i n TYR 73 Ca 0.30 -0.02 -0.39 0.00 -0.16 0.00 0.00 57.90 57.62 2g0i n TYR 73 Cb 0.93 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.91 2g0i n TYR 73 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2g0i s ILE 74 N -1.96 5.06 0.27 -0.72 -1.09 -0.18 -4.95 121.20 117.65 2g0i s ILE 74 Ca 0.30 1.29 0.18 0.00 -2.23 0.00 0.00 60.65 60.19 2g0i s ILE 74 Cb 0.20 -3.98 0.14 0.00 -1.58 0.00 0.00 42.46 37.25 2g0i s ILE 74 CO 0.30 0.23 1.81 0.71 -1.23 0.00 0.00 174.94 176.76 2g0i h THR 75 N 4.86 0.96 -0.78 2.92 1.35 -1.93 -2.16 112.91 118.14 2g0i h THR 75 Ca -0.38 -1.31 -0.29 0.00 -0.55 0.00 0.00 66.41 63.87 2g0i h THR 75 Cb 1.18 1.77 -0.18 0.00 -1.73 0.00 0.00 68.15 69.19 2g0i h THR 75 CO 0.76 0.34 0.37 -0.46 -0.25 0.00 0.00 175.52 176.28 2g0i n ASN 76 N -3.72 4.40 -0.18 5.36 6.94 -1.26 -4.52 115.26 122.28 2g0i n ASN 76 Ca -0.01 -3.26 0.27 0.00 -0.02 0.00 0.00 54.58 51.56 2g0i n ASN 76 Cb 0.44 -0.76 0.70 0.00 -2.36 0.00 0.00 39.78 37.79 2g0i n ASN 76 CO 0.00 0.00 0.00 0.07 -1.03 0.00 0.00 177.26 176.30 2g0i h LYS 77 N 2.05 0.05 -0.01 -3.83 2.10 -1.66 -1.50 116.57 113.76 2g0i h LYS 77 Ca 0.36 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.01 2g0i h LYS 77 Cb 2.42 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 33.74 2g0i h LYS 77 CO 0.81 0.03 0.00 -1.13 -2.00 0.00 0.00 179.45 177.16 2g0i n SER 78 N -4.30 0.89 -4.71 7.07 3.41 -1.26 -4.50 113.62 110.21 2g0i n SER 78 Ca 0.18 -1.31 -0.38 0.00 -0.26 0.00 0.00 58.87 57.10 2g0i n SER 78 Cb 0.92 -0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.92 2g0i n SER 78 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2g0i n ASP 79 N -0.30 2.16 -0.08 4.04 9.92 -0.57 -4.81 116.55 126.92 2g0i n ASP 79 Ca 0.21 0.92 -0.08 0.00 -0.53 0.00 0.00 54.79 55.30 2g0i n ASP 79 Cb 0.25 -1.53 -0.01 0.00 -0.64 0.00 0.00 41.12 39.19 2g0i n ASP 79 CO 0.00 0.00 0.00 -0.08 0.13 0.00 0.00 177.20 177.25 2g0i h GLU 80 N 1.05 0.27 -0.39 -1.24 4.81 -1.92 -0.78 114.58 116.39 2g0i h GLU 80 Ca -0.50 -0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 58.60 2g0i h GLU 80 Cb 1.32 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.63 2g0i h GLU 80 CO 0.55 0.18 -0.23 0.87 -0.73 0.00 0.00 179.01 179.65 2g0i h LYS 81 N 0.28 0.78 0.03 1.92 1.57 -1.93 -1.10 116.57 118.11 2g0i h LYS 81 Ca 0.12 -0.32 -0.00 0.00 -1.87 0.00 0.00 60.65 58.58 2g0i h LYS 81 Cb 0.05 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.33 2g0i h LYS 81 CO -0.09 0.93 -0.01 0.28 -0.57 0.00 0.00 179.45 179.98 2g0i h VAL 82 N 0.68 1.01 -0.11 0.50 2.07 -1.78 -2.24 116.25 116.38 2g0i h VAL 82 Ca 0.09 -0.11 -0.11 0.00 0.82 0.00 0.00 66.70 67.39 2g0i h VAL 82 Cb 0.74 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 2g0i h VAL 82 CO 0.06 0.03 -0.44 1.56 0.02 0.00 0.00 177.57 178.80 2g0i h GLN 83 N -0.09 0.25 -0.27 1.57 1.08 -1.03 -1.79 115.11 114.82 2g0i h GLN 83 Ca -0.00 -0.12 -0.02 0.00 -1.45 0.00 0.00 58.65 57.05 2g0i h GLN 83 Cb 0.08 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.50 2g0i h GLN 83 CO 0.01 0.64 0.09 1.25 -0.95 0.00 0.00 178.83 179.87 2g0i h LEU 84 N 0.21 0.39 -0.61 1.46 5.85 -1.10 0.11 115.31 121.63 2g0i h LEU 84 Ca 0.02 -0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.53 2g0i h LEU 84 Cb 0.86 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.75 2g0i h LEU 84 CO 0.07 0.49 0.36 -0.07 -0.34 0.00 0.00 178.44 178.95 2g0i h LEU 85 N 0.27 0.73 -0.69 2.25 3.38 -1.22 -0.77 115.31 119.28 2g0i h LEU 85 Ca 0.09 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 2g0i h LEU 85 Cb 0.23 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2g0i h LEU 85 CO -0.00 0.58 -0.01 0.15 0.09 0.00 0.00 178.44 179.25 2g0i h PHE 86 N 0.82 1.09 -0.30 1.13 -0.00 -1.17 -1.30 116.94 117.21 2g0i h PHE 86 Ca 0.22 -0.18 -0.14 0.00 -0.00 0.00 0.00 57.97 57.86 2g0i h PHE 86 Cb -0.02 -0.29 -0.01 0.00 -0.00 0.00 0.00 35.95 35.64 2g0i h PHE 86 CO -0.02 0.97 -0.38 0.93 -0.00 0.00 0.00 178.31 179.82 2g0i h GLU 87 N 0.92 0.71 -0.87 1.11 4.39 -0.60 -0.74 114.58 119.50 2g0i h GLU 87 Ca 0.16 -0.35 -0.00 0.00 0.34 0.00 0.00 59.36 59.51 2g0i h GLU 87 Cb 0.55 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.16 2g0i h GLU 87 CO 0.03 0.97 0.54 0.00 -1.16 0.00 0.00 179.01 179.38 2g0i h ALA 88 N 0.99 1.10 -0.15 3.43 0.00 -0.86 0.19 119.26 123.96 2g0i h ALA 88 Ca 0.05 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2g0i h ALA 88 Cb 0.91 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2g0i h ALA 88 CO 0.08 0.55 0.07 0.35 0.00 0.00 0.00 179.25 180.29 2g0i h PHE 89 N 1.18 0.23 -0.90 0.00 3.57 -1.03 -1.21 116.94 118.79 2g0i h PHE 89 Ca 0.31 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.86 2g0i h PHE 89 Cb -0.07 -0.07 -0.06 0.00 2.79 0.00 0.00 35.95 38.53 2g0i h PHE 89 CO -0.00 0.28 0.56 1.25 -2.23 0.00 0.00 178.31 178.17 2g0i h LEU 90 N 0.10 0.89 -0.49 0.59 5.85 -0.82 -1.19 115.31 120.25 2g0i h LEU 90 Ca 0.05 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2g0i h LEU 90 Cb 0.15 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 2g0i h LEU 90 CO -0.01 0.57 0.31 0.25 -0.34 0.00 0.00 178.44 179.22 2g0i h LEU 91 N 1.02 0.57 -0.34 2.25 5.85 -0.36 -0.19 115.31 124.12 2g0i h LEU 91 Ca 0.39 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 59.05 2g0i h LEU 91 Cb 0.18 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 2g0i h LEU 91 CO -0.18 0.43 0.10 1.23 -0.34 0.00 0.00 178.44 179.68 2g0i h GLY 92 N 0.66 0.57 0.95 3.75 0.00 -0.66 -0.30 103.07 108.05 2g0i h GLY 92 Ca 0.18 -0.34 -0.00 0.00 0.00 0.00 0.00 47.33 47.16 2g0i h GLY 92 CO -0.04 0.32 0.09 -2.22 0.00 0.00 0.00 176.54 174.70 2g0i h ILE 93 N 0.39 1.08 -0.88 2.60 1.08 -1.15 -1.43 117.51 119.20 2g0i h ILE 93 Ca 0.11 -0.22 0.07 0.00 -0.39 0.00 0.00 64.86 64.43 2g0i h ILE 93 Cb 0.27 0.94 -0.07 0.00 -3.07 0.00 0.00 36.82 34.90 2g0i h ILE 93 CO -0.00 0.08 0.54 0.74 -0.69 0.00 0.00 178.15 178.82 2g0i h THR 94 N 0.17 1.01 -0.42 -0.27 2.02 -0.95 0.56 112.91 115.04 2g0i h THR 94 Ca 0.06 -0.33 -0.05 0.00 0.77 0.00 0.00 66.41 66.86 2g0i h THR 94 Cb 0.05 -0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 66.41 2g0i h THR 94 CO -0.01 0.18 0.05 0.78 0.37 0.00 0.00 175.52 176.88 2g0i h ASN 95 N 0.96 0.60 -0.43 4.18 2.35 -0.79 -1.19 115.58 121.27 2g0i h ASN 95 Ca 0.39 -0.11 -0.13 0.00 -0.55 0.00 0.00 56.30 55.90 2g0i h ASN 95 Cb 0.23 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 2g0i h ASN 95 CO -0.19 0.64 -0.22 -0.07 -1.65 0.00 0.00 177.43 175.94 2g0i h LEU 96 N 0.62 0.96 -1.46 1.61 3.38 -0.59 -1.55 115.31 118.29 2g0i h LEU 96 Ca 0.13 -0.36 -0.03 0.00 0.09 0.00 0.00 57.88 57.71 2g0i h LEU 96 Cb 0.32 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2g0i h LEU 96 CO 0.01 1.14 0.00 0.00 0.09 0.00 0.00 178.44 179.68 2g0i h ALA 97 N 0.93 1.57 -0.07 1.53 0.00 -0.62 0.28 119.26 122.87 2g0i h ALA 97 Ca 0.11 -0.14 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 2g0i h ALA 97 Cb 0.78 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.47 2g0i h ALA 97 CO 0.06 0.32 -0.58 0.93 0.00 0.00 0.00 179.25 179.98 2g0i h GLU 98 N 0.35 0.53 0.09 0.00 4.39 -1.02 -3.02 114.58 115.89 2g0i h GLU 98 Ca 0.08 -0.47 -0.29 0.00 0.34 0.00 0.00 59.36 59.02 2g0i h GLU 98 Cb 0.23 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.97 2g0i h GLU 98 CO 0.00 1.10 -1.50 -0.91 -1.16 0.00 0.00 179.01 176.55 2g0i h ASN 99 N 0.11 0.29 -2.17 1.42 -0.26 -1.16 -3.39 115.58 110.43 2g0i h ASN 99 Ca -0.05 -0.42 -0.56 0.00 -0.56 0.00 0.00 56.30 54.72 2g0i h ASN 99 Cb 1.25 -0.10 -0.41 0.00 -1.06 0.00 0.00 38.32 38.00 2g0i h ASN 99 CO 0.12 1.35 -0.84 -1.20 -1.06 0.00 0.00 177.43 175.80 2g0i n SER 100 N -3.39 2.98 0.26 5.81 7.64 0.98 -4.92 113.62 122.97 2g0i n SER 100 Ca -0.15 -3.38 0.17 0.00 1.01 0.00 0.00 58.87 56.52 2g0i n SER 100 Cb 1.03 -0.60 0.91 0.00 -1.01 0.00 0.00 64.21 64.55 2g0i n SER 100 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2g0i h PRO 101 N 3.20 0.00 0.00 1.43 0.13 -1.70 0.39 132.00 135.45 2g0i h PRO 101 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2g0i h PRO 101 Cb 0.69 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.82 2g0i h PRO 101 CO 0.70 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 179.52 2g0i h GLU 102 N 0.00 0.00 0.00 0.86 9.09 -1.91 -3.30 114.58 119.32 2g0i h GLU 102 Ca 0.04 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.45 2g0i h GLU 102 Cb 0.27 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.37 2g0i h GLU 102 CO -0.00 0.00 -1.07 1.19 0.05 0.00 0.00 179.01 179.18 2g0i n PHE 103 N -2.57 0.00 -3.89 2.06 3.72 0.03 -4.97 117.46 111.84 2g0i n PHE 103 Ca 0.03 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.27 2g0i n PHE 103 Cb 0.36 -0.10 -0.16 0.00 -0.94 0.00 0.00 39.48 38.64 2g0i n PHE 103 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2g0i s VAL 104 N -2.23 0.11 -0.05 -4.37 1.01 -0.62 -0.56 120.40 113.70 2g0i s VAL 104 Ca -0.01 0.11 0.04 0.00 0.00 0.00 0.00 61.98 62.12 2g0i s VAL 104 Cb 0.04 -0.21 -0.00 0.00 0.00 0.00 0.00 36.38 36.21 2g0i s VAL 104 CO 0.23 0.12 -0.18 -0.89 0.00 0.00 0.00 175.10 174.39 2g0i s THR 105 N 0.94 1.50 -0.00 3.92 2.01 -0.24 -4.42 115.64 119.35 2g0i s THR 105 Ca -0.09 -0.75 0.08 0.00 0.31 0.00 0.00 61.69 61.24 2g0i s THR 105 Cb -0.12 -1.29 -0.02 0.00 0.01 0.00 0.00 72.50 71.07 2g0i s THR 105 CO -0.02 0.43 -0.24 0.00 -0.69 0.00 0.00 174.62 174.11 2g0i s ALA 106 N 0.05 2.30 -0.12 7.40 0.00 -1.26 -1.36 121.76 128.78 2g0i s ALA 106 Ca -0.05 -1.14 0.03 0.00 0.00 0.00 0.00 51.96 50.80 2g0i s ALA 106 Cb -0.12 -0.61 0.00 0.00 0.00 0.00 0.00 23.12 22.39 2g0i s ALA 106 CO 0.03 0.54 -0.23 0.15 0.00 0.00 0.00 175.76 176.24 2g0i s LYS 107 N -0.86 3.04 0.56 0.00 1.02 0.92 -4.96 119.74 119.45 2g0i s LYS 107 Ca 0.11 -0.87 0.05 0.00 0.02 0.00 0.00 55.97 55.28 2g0i s LYS 107 Cb -0.10 -2.36 0.04 0.00 -0.52 0.00 0.00 37.83 34.89 2g0i s LYS 107 CO 0.01 0.10 0.38 0.42 -0.92 0.00 0.00 175.35 175.33 2g0i s ILE 108 N 0.54 1.50 -0.34 2.17 -1.09 -1.26 -0.34 121.20 122.37 2g0i s ILE 108 Ca -0.14 -1.54 -0.01 0.00 -2.23 0.00 0.00 60.65 56.73 2g0i s ILE 108 Cb -0.17 -2.04 0.19 0.00 -1.58 0.00 0.00 42.46 38.86 2g0i s ILE 108 CO 0.04 0.00 0.82 0.42 -1.23 0.00 0.00 174.94 174.99 2g0i s THR 110 N -2.81 -0.63 -0.51 2.92 -4.23 -1.26 -4.96 115.64 104.15 2g0i s THR 110 Ca 0.30 0.00 0.04 0.00 -1.18 0.00 0.00 61.69 60.85 2g0i s THR 110 Cb -0.02 -0.23 0.03 0.00 1.34 0.00 0.00 72.50 73.62 2g0i s THR 110 CO 0.19 0.00 0.63 0.00 -0.54 0.00 0.00 174.62 174.90