#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o4t s VAL 8 N 0.00 2.32 -0.18 3.17 1.01 -1.26 -5.11 120.40 120.35 1o4t s VAL 8 Ca 0.00 -0.96 -0.00 0.00 0.00 0.00 0.00 61.98 61.02 1o4t s VAL 8 Cb 0.00 -1.88 0.01 0.00 0.00 0.00 0.00 36.38 34.51 1o4t s VAL 8 CO 0.00 0.56 -0.15 -0.69 0.00 0.00 0.00 175.10 174.82 1o4t s VAL 9 N -0.07 2.55 -0.51 2.92 1.01 -1.26 -5.10 120.40 119.95 1o4t s VAL 9 Ca -0.06 -0.79 -0.19 0.00 0.00 0.00 0.00 61.98 60.95 1o4t s VAL 9 Cb -0.14 -2.09 0.06 0.00 0.00 0.00 0.00 36.38 34.21 1o4t s VAL 9 CO 0.05 0.51 0.61 -0.60 0.00 0.00 0.00 175.10 175.66 1o4t s ARG 10 N 1.13 3.11 0.30 2.72 3.52 -1.26 -4.95 118.95 123.52 1o4t s ARG 10 Ca 0.01 -0.95 0.02 0.00 -0.13 0.00 0.00 55.73 54.68 1o4t s ARG 10 Cb -0.14 -4.11 0.75 0.00 -1.56 0.00 0.00 34.95 29.89 1o4t s ARG 10 CO -0.06 -1.22 1.59 0.77 -0.81 0.00 0.00 175.30 175.57 1o4t h SER 11 N 8.98 -0.36 0.38 -2.12 0.02 -1.98 0.15 113.55 118.62 1o4t h SER 11 Ca -0.28 0.26 -0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1o4t h SER 11 Cb 1.10 0.43 -0.00 0.00 0.14 0.00 0.00 62.40 64.07 1o4t h SER 11 CO 0.96 -0.32 -0.02 0.77 -1.14 0.00 0.00 176.83 177.09 1o4t h SER 12 N 0.05 0.00 -0.18 3.07 4.64 -2.05 -2.04 113.55 117.04 1o4t h SER 12 Ca 0.59 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.91 1o4t h SER 12 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1o4t h SER 12 CO -0.85 0.02 0.00 -0.62 -0.87 0.00 0.00 176.83 174.51 1o4t n GLU 13 N -3.21 2.16 -3.44 4.77 1.02 0.53 -4.86 120.64 117.61 1o4t n GLU 13 Ca -0.02 -1.72 -0.37 0.00 -0.02 0.00 0.00 57.16 55.03 1o4t n GLU 13 Cb 0.17 -1.47 -0.06 0.00 -0.02 0.00 0.00 31.44 30.06 1o4t n GLU 13 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1o4t s ILE 14 N -1.78 5.19 -0.27 -3.67 1.01 -0.77 -5.04 121.20 115.87 1o4t s ILE 14 Ca 0.34 0.78 -0.29 0.00 0.00 0.00 0.00 60.65 61.48 1o4t s ILE 14 Cb 0.21 -3.73 0.01 0.00 0.01 0.00 0.00 42.46 38.96 1o4t s ILE 14 CO 0.30 0.41 1.12 -0.89 0.00 0.00 0.00 174.94 175.88 1o4t s THR 15 N 0.14 4.49 0.68 2.92 2.01 -1.26 -5.01 115.64 119.60 1o4t s THR 15 Ca 0.22 1.75 -0.14 0.00 0.31 0.00 0.00 61.69 63.83 1o4t s THR 15 Cb -0.15 -4.30 0.01 0.00 0.01 0.00 0.00 72.50 68.08 1o4t s THR 15 CO 0.09 -0.34 1.12 -2.16 -0.69 0.00 0.00 174.62 172.64 1o4t s PRO 16 N 3.55 2.63 -0.12 4.92 0.04 -1.26 -4.84 135.00 139.92 1o4t s PRO 16 Ca 0.47 1.40 -0.19 0.00 0.04 0.00 0.00 61.00 62.73 1o4t s PRO 16 Cb -0.15 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 1o4t s PRO 16 CO 0.13 -1.38 0.53 -1.83 0.04 0.00 0.00 177.00 174.49 1o4t s GLU 17 N -4.18 4.34 0.02 4.56 -1.05 0.20 -4.85 118.70 117.73 1o4t s GLU 17 Ca 0.67 0.54 -0.30 0.00 -0.15 0.00 0.00 54.97 55.73 1o4t s GLU 17 Cb -0.21 -3.46 -0.04 0.00 -0.44 0.00 0.00 34.13 29.99 1o4t s GLU 17 CO 0.44 0.09 0.96 1.03 0.95 0.00 0.00 175.26 178.73 1o4t s ARG 18 N 0.83 4.58 -0.12 -4.83 0.52 -1.26 -1.10 118.95 117.57 1o4t s ARG 18 Ca 0.28 1.40 -0.00 0.00 -0.52 0.00 0.00 55.73 56.89 1o4t s ARG 18 Cb -0.16 -3.44 0.03 0.00 0.52 0.00 0.00 34.95 31.90 1o4t s ARG 18 CO 0.12 0.02 -0.07 0.42 0.02 0.00 0.00 175.30 175.80 1o4t s ILE 19 N 0.77 1.04 0.06 1.52 1.01 0.17 -5.00 121.20 120.76 1o4t s ILE 19 Ca 0.50 -0.33 -0.19 0.00 0.00 0.00 0.00 60.65 60.63 1o4t s ILE 19 Cb -0.21 -1.08 -0.06 0.00 0.01 0.00 0.00 42.46 41.12 1o4t s ILE 19 CO 0.28 0.34 0.55 -0.44 0.00 0.00 0.00 174.94 175.67 1o4t s SER 20 N 1.70 7.03 -1.24 3.58 0.01 -1.26 -0.82 113.70 122.69 1o4t s SER 20 Ca 0.05 1.22 -0.08 0.00 1.31 0.00 0.00 55.95 58.44 1o4t s SER 20 Cb -0.13 -2.35 -0.01 0.00 0.21 0.00 0.00 66.02 63.74 1o4t s SER 20 CO -0.08 0.27 0.70 0.59 0.41 0.00 0.00 173.24 175.13 1o4t n ASN 21 N 1.82 -3.07 -4.71 2.44 4.13 -0.28 -4.84 115.26 110.75 1o4t n ASN 21 Ca -0.10 -0.92 -0.42 0.00 1.68 0.00 0.00 54.58 54.82 1o4t n ASN 21 Cb 0.51 -3.74 -0.03 0.00 -1.54 0.00 0.00 39.78 34.98 1o4t n ASN 21 CO 0.00 0.00 0.00 -0.32 0.28 0.00 0.00 177.26 177.22 1o4t s MET 22 N -5.93 4.21 -1.71 3.52 1.75 -1.26 -1.46 119.30 118.42 1o4t s MET 22 Ca 0.22 2.35 -0.17 0.00 -1.25 0.00 0.00 55.69 56.83 1o4t s MET 22 Cb -0.07 -3.31 0.15 0.00 2.84 0.00 0.00 34.83 34.45 1o4t s MET 22 CO 0.84 -0.65 0.68 0.54 -0.65 0.00 0.00 175.02 175.78 1o4t n ARG 23 N 4.52 -2.59 -1.16 4.11 5.12 -1.26 0.04 116.66 125.44 1o4t n ARG 23 Ca 0.14 0.32 -0.06 0.00 -1.93 0.00 0.00 57.85 56.32 1o4t n ARG 23 Cb 0.39 -4.90 -0.02 0.00 -1.16 0.00 0.00 32.46 26.76 1o4t n ARG 23 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1o4t n GLY 24 N -1.44 0.79 0.92 -0.13 0.00 -0.54 -3.49 105.19 101.30 1o4t n GLY 24 Ca 0.03 -0.50 -0.07 0.00 0.00 0.00 0.00 46.02 45.48 1o4t n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o4t n GLY 25 N -1.89 -1.52 3.88 -0.02 0.00 0.11 -4.60 105.19 101.14 1o4t n GLY 25 Ca -0.06 -1.63 -0.35 0.00 0.00 0.00 0.00 46.02 43.99 1o4t n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o4t s LYS 26 N -3.68 3.63 2.68 1.61 1.02 -1.20 -4.12 119.74 119.69 1o4t s LYS 26 Ca 0.18 -0.00 0.00 0.00 0.02 0.00 0.00 55.97 56.17 1o4t s LYS 26 Cb -0.01 -3.05 0.00 0.00 -0.52 0.00 0.00 37.83 34.25 1o4t s LYS 26 CO 0.13 0.62 0.00 0.41 -0.92 0.00 0.00 175.35 175.59 1o4t n GLY 27 N 1.04 0.19 3.19 -3.33 0.00 -1.26 -1.05 105.19 103.96 1o4t n GLY 27 Ca -0.10 -0.98 -0.33 0.00 0.00 0.00 0.00 46.02 44.62 1o4t n GLY 27 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1o4t s GLU 28 N 0.00 3.06 0.43 1.61 2.12 -1.26 -1.13 118.70 123.52 1o4t s GLU 28 Ca 0.00 -0.83 0.08 0.00 0.36 0.00 0.00 54.97 54.57 1o4t s GLU 28 Cb 0.00 -2.48 -0.01 0.00 0.26 0.00 0.00 34.13 31.90 1o4t s GLU 28 CO 0.00 -0.02 0.41 0.14 -0.54 0.00 0.00 175.26 175.25 1o4t s VAL 29 N 0.84 2.62 -0.07 3.70 -7.23 -0.00 -4.44 120.40 115.82 1o4t s VAL 29 Ca -0.06 -1.31 0.05 0.00 -1.81 0.00 0.00 61.98 58.85 1o4t s VAL 29 Cb -0.15 -2.93 -0.00 0.00 0.56 0.00 0.00 36.38 33.86 1o4t s VAL 29 CO -0.02 0.00 -0.22 -1.61 -0.31 0.00 0.00 175.10 172.94 1o4t s GLU 30 N -4.18 2.44 -0.12 4.82 2.02 -0.28 -0.66 118.70 122.75 1o4t s GLU 30 Ca 0.49 -0.78 0.02 0.00 0.02 0.00 0.00 54.97 54.71 1o4t s GLU 30 Cb -0.04 -1.99 0.01 0.00 0.10 0.00 0.00 34.13 32.22 1o4t s GLU 30 CO 0.28 0.26 -0.16 1.41 0.02 0.00 0.00 175.26 177.07 1o4t s MET 31 N 0.11 2.31 -0.32 1.61 -2.45 -0.26 -0.64 119.30 119.65 1o4t s MET 31 Ca -0.09 -0.59 -0.07 0.00 -1.25 0.00 0.00 55.69 53.68 1o4t s MET 31 Cb -0.15 -1.96 0.02 0.00 1.25 0.00 0.00 34.83 34.00 1o4t s MET 31 CO 0.05 -0.07 0.11 0.00 1.05 0.00 0.00 175.02 176.16 1o4t s ALA 32 N 1.01 3.09 -0.09 4.11 0.00 -0.41 0.59 121.76 130.05 1o4t s ALA 32 Ca -0.06 -1.61 -0.30 0.00 0.00 0.00 0.00 51.96 50.00 1o4t s ALA 32 Cb -0.15 -2.26 -0.02 0.00 0.00 0.00 0.00 23.12 20.69 1o4t s ALA 32 CO -0.02 -1.16 1.18 -1.01 0.00 0.00 0.00 175.76 174.74 1o4t s HIS 33 N 1.47 3.17 -0.23 0.00 3.76 -1.26 -1.51 115.29 120.69 1o4t s HIS 33 Ca 0.01 1.24 0.07 0.00 -0.15 0.00 0.00 55.06 56.23 1o4t s HIS 33 Cb -0.18 -3.40 -0.20 0.00 1.11 0.00 0.00 32.58 29.91 1o4t s HIS 33 CO 0.03 -1.20 -0.11 1.28 -0.85 0.00 0.00 174.74 173.90 1o4t n LEU 34 N 5.52 1.98 -3.94 0.89 4.77 0.93 -4.96 117.00 122.19 1o4t n LEU 34 Ca 0.11 -0.08 -0.11 0.00 -0.03 0.00 0.00 56.01 55.90 1o4t n LEU 34 Cb 0.46 -0.45 -0.13 0.00 -2.33 0.00 0.00 43.42 40.98 1o4t n LEU 34 CO 0.55 0.79 -0.37 -0.76 -1.33 0.00 0.00 177.39 176.27 1o4t s LEU 35 N -6.20 2.12 0.53 2.23 1.43 -1.17 -4.97 118.68 112.66 1o4t s LEU 35 Ca -0.26 -0.27 -0.09 0.00 -1.03 0.00 0.00 54.13 52.48 1o4t s LEU 35 Cb 0.08 -0.01 -0.04 0.00 0.03 0.00 0.00 46.19 46.24 1o4t s LEU 35 CO 0.68 -0.13 0.90 -0.94 0.23 0.00 0.00 176.35 177.09 1o4t s SER 36 N -0.76 6.31 0.24 2.29 1.04 -1.26 -4.04 113.70 117.52 1o4t s SER 36 Ca -0.07 1.21 -0.04 0.00 0.48 0.00 0.00 55.95 57.53 1o4t s SER 36 Cb -0.05 -2.37 0.44 0.00 0.10 0.00 0.00 66.02 64.13 1o4t s SER 36 CO -0.00 -0.68 1.74 0.50 0.98 0.00 0.00 173.24 175.77 1o4t h LYS 37 N 0.17 0.47 -0.16 4.02 3.64 -1.81 -2.68 116.57 120.22 1o4t h LYS 37 Ca -0.46 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 58.94 1o4t h LYS 37 Cb 1.19 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 32.86 1o4t h LYS 37 CO 0.62 0.31 -0.13 0.93 -2.27 0.00 0.00 179.45 178.91 1o4t h GLU 38 N 0.48 -0.13 0.00 1.90 5.08 -1.94 -0.41 114.58 119.56 1o4t h GLU 38 Ca 0.40 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.76 1o4t h GLU 38 Cb 0.58 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 1o4t h GLU 38 CO -0.37 -0.09 -0.05 0.00 -1.00 0.00 0.00 179.01 177.50 1o4t h ALA 39 N 0.96 1.77 -0.56 3.43 0.00 -1.88 0.71 119.26 123.69 1o4t h ALA 39 Ca 0.10 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 1o4t h ALA 39 Cb 0.29 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.00 1o4t h ALA 39 CO -0.24 0.06 0.15 -1.33 0.00 0.00 0.00 179.25 177.88 1o4t n MET 40 N -4.27 3.59 -2.21 0.00 2.81 -0.75 -4.92 117.12 111.37 1o4t n MET 40 Ca -0.03 -2.53 -0.21 0.00 -1.81 0.00 0.00 57.70 53.12 1o4t n MET 40 Cb 0.13 -2.08 -0.03 0.00 -0.71 0.00 0.00 33.22 30.53 1o4t n MET 40 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 1o4t n HIS 41 N 0.14 -0.76 -1.77 2.03 -0.00 0.24 -1.27 115.22 113.82 1o4t n HIS 41 Ca 0.30 0.00 -0.18 0.00 -0.00 0.00 0.00 57.72 57.84 1o4t n HIS 41 Cb 1.14 -3.88 -0.06 0.00 -0.00 0.00 0.00 29.99 27.20 1o4t n HIS 41 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 1o4t n ASN 42 N -1.87 -5.22 -0.01 0.41 3.02 -0.24 -4.86 115.26 106.49 1o4t n ASN 42 Ca -0.24 0.31 0.00 0.00 -0.03 0.00 0.00 54.58 54.62 1o4t n ASN 42 Cb 0.69 -4.32 -0.12 0.00 -0.61 0.00 0.00 39.78 35.43 1o4t n ASN 42 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1o4t n LYS 43 N -2.55 0.65 -4.23 3.52 4.76 -0.40 -4.90 118.16 115.00 1o4t n LYS 43 Ca -0.19 0.07 -0.17 0.00 -2.87 0.00 0.00 58.31 55.15 1o4t n LYS 43 Cb 0.62 -1.68 -0.13 0.00 -1.84 0.00 0.00 35.03 32.00 1o4t n LYS 43 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1o4t s ALA 44 N -2.96 0.91 -1.11 7.82 0.00 -1.25 -1.68 121.76 123.49 1o4t s ALA 44 Ca -0.06 -0.74 0.15 0.00 0.00 0.00 0.00 51.96 51.31 1o4t s ALA 44 Cb 0.09 -0.10 -0.06 0.00 0.00 0.00 0.00 23.12 23.04 1o4t s ALA 44 CO 0.84 0.14 0.74 2.89 0.00 0.00 0.00 175.76 180.36 1o4t n ARG 45 N 1.88 1.94 -3.70 0.00 1.85 -0.13 -4.35 116.66 114.16 1o4t n ARG 45 Ca -0.19 -0.48 -0.11 0.00 -1.00 0.00 0.00 57.85 56.07 1o4t n ARG 45 Cb 0.55 -1.22 -0.10 0.00 -1.05 0.00 0.00 32.46 30.65 1o4t n ARG 45 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 1o4t s LEU 46 N -2.24 -0.06 -0.33 2.89 2.96 -1.25 -4.58 118.68 116.07 1o4t s LEU 46 Ca 0.10 0.99 -0.01 0.00 -0.22 0.00 0.00 54.13 54.99 1o4t s LEU 46 Cb 0.12 1.60 0.13 0.00 0.50 0.00 0.00 46.19 48.53 1o4t s LEU 46 CO 0.46 -0.19 0.20 0.12 -1.32 0.00 0.00 176.35 175.63 1o4t s PHE 47 N 0.88 0.43 0.10 5.38 2.19 -1.25 -2.07 117.98 123.63 1o4t s PHE 47 Ca -0.05 -1.21 0.05 0.00 0.33 0.00 0.00 56.93 56.05 1o4t s PHE 47 Cb -0.06 -0.84 -0.03 0.00 -1.31 0.00 0.00 43.02 40.78 1o4t s PHE 47 CO -0.07 -0.85 -0.13 0.00 1.83 0.00 0.00 175.22 176.00 1o4t s ALA 48 N 1.54 1.30 -0.27 11.12 0.00 -0.51 -0.05 121.76 134.89 1o4t s ALA 48 Ca 0.14 -1.16 -0.08 0.00 0.00 0.00 0.00 51.96 50.86 1o4t s ALA 48 Cb -0.19 -0.06 -0.02 0.00 0.00 0.00 0.00 23.12 22.85 1o4t s ALA 48 CO -0.15 0.10 0.08 0.50 0.00 0.00 0.00 175.76 176.29 1o4t s ARG 49 N -2.36 3.50 0.03 0.00 3.52 -0.57 -0.44 118.95 122.64 1o4t s ARG 49 Ca 0.04 -0.59 0.01 0.00 -0.13 0.00 0.00 55.73 55.06 1o4t s ARG 49 Cb -0.06 -3.37 -0.04 0.00 -1.56 0.00 0.00 34.95 29.92 1o4t s ARG 49 CO 0.02 -0.27 0.09 -1.64 -0.81 0.00 0.00 175.30 172.69 1o4t s MET 50 N 1.59 3.02 -0.09 5.12 -1.94 0.96 -1.29 119.30 126.67 1o4t s MET 50 Ca 0.05 -0.56 -0.01 0.00 -1.71 0.00 0.00 55.69 53.46 1o4t s MET 50 Cb -0.16 -2.82 0.03 0.00 2.01 0.00 0.00 34.83 33.89 1o4t s MET 50 CO 0.04 0.62 -0.00 0.21 -0.01 0.00 0.00 175.02 175.87 1o4t s LYS 51 N -2.01 0.71 -0.31 2.03 2.36 0.19 -1.90 119.74 120.80 1o4t s LYS 51 Ca 0.26 0.03 -0.07 0.00 -2.55 0.00 0.00 55.97 53.64 1o4t s LYS 51 Cb -0.12 -1.13 0.02 0.00 -1.05 0.00 0.00 37.83 35.55 1o4t s LYS 51 CO 0.18 -0.33 0.10 -0.51 1.55 0.00 0.00 175.35 176.33 1o4t s LEU 52 N 1.94 4.03 0.92 5.43 1.02 0.48 -1.12 118.68 131.37 1o4t s LEU 52 Ca 0.05 -0.83 -0.11 0.00 0.02 0.00 0.00 54.13 53.25 1o4t s LEU 52 Cb -0.13 -1.89 0.14 0.00 0.02 0.00 0.00 46.19 44.34 1o4t s LEU 52 CO -0.06 -0.24 1.10 -2.84 0.02 0.00 0.00 176.35 174.33 1o4t s PRO 53 N 1.48 1.07 0.25 1.29 0.02 -1.26 -1.46 135.00 136.39 1o4t s PRO 53 Ca 0.01 1.13 -0.31 0.00 0.02 0.00 0.00 61.00 61.86 1o4t s PRO 53 Cb -0.18 -1.76 -0.13 0.00 0.02 0.00 0.00 34.50 32.44 1o4t s PRO 53 CO 0.03 -2.46 1.34 -2.30 -0.33 0.00 0.00 177.00 173.28 1o4t n PRO 54 N -4.07 1.93 0.00 5.54 -0.02 -1.26 -1.46 135.00 135.67 1o4t n PRO 54 Ca 0.08 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 1o4t n PRO 54 Cb 0.54 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 1o4t n PRO 54 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1o4t n GLY 55 N 1.87 2.57 3.92 -1.23 0.00 -0.21 -5.04 105.19 107.07 1o4t n GLY 55 Ca 0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 1o4t n GLY 55 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1o4t s SER 56 N -1.64 6.11 0.05 1.61 0.01 -0.53 -4.66 113.70 114.65 1o4t s SER 56 Ca 0.00 0.70 -0.18 0.00 1.31 0.00 0.00 55.95 57.77 1o4t s SER 56 Cb 0.00 -2.01 0.04 0.00 0.21 0.00 0.00 66.02 64.26 1o4t s SER 56 CO 0.00 -0.61 0.43 -0.94 0.41 0.00 0.00 173.24 172.53 1o4t s SER 57 N -4.14 -0.30 -0.26 2.44 1.04 -0.21 -0.84 113.70 111.44 1o4t s SER 57 Ca 0.47 -0.01 -0.15 0.00 0.48 0.00 0.00 55.95 56.74 1o4t s SER 57 Cb -0.10 0.44 -0.04 0.00 0.10 0.00 0.00 66.02 66.42 1o4t s SER 57 CO 0.42 -0.69 0.39 -0.69 0.98 0.00 0.00 173.24 173.65 1o4t s VAL 58 N -2.60 5.17 0.96 5.02 1.01 -0.03 -3.23 120.40 126.71 1o4t s VAL 58 Ca -0.04 0.63 -0.14 0.00 0.00 0.00 0.00 61.98 62.43 1o4t s VAL 58 Cb -0.01 -3.72 0.17 0.00 0.00 0.00 0.00 36.38 32.83 1o4t s VAL 58 CO -0.03 0.17 1.15 -0.83 0.00 0.00 0.00 175.10 175.55 1o4t s GLY 59 N 1.50 1.59 0.21 4.51 0.00 -0.49 -1.95 107.32 112.69 1o4t s GLY 59 Ca 0.16 -0.63 -0.30 0.00 0.00 0.00 0.00 44.72 43.95 1o4t s GLY 59 CO 0.09 -0.00 1.44 -2.27 0.00 0.00 0.00 173.10 172.37 1o4t s LEU 60 N -6.19 4.38 0.06 0.66 2.96 -1.25 -4.55 118.68 114.75 1o4t s LEU 60 Ca 0.66 2.58 -0.24 0.00 -0.22 0.00 0.00 54.13 56.91 1o4t s LEU 60 Cb -0.14 -3.61 0.06 0.00 0.50 0.00 0.00 46.19 43.00 1o4t s LEU 60 CO 0.54 -0.70 0.56 -1.38 -1.32 0.00 0.00 176.35 174.05 1o4t s HIS 61 N 0.38 -0.48 -0.07 5.38 -3.43 -0.62 -4.91 115.29 111.54 1o4t s HIS 61 Ca 0.62 0.54 -0.04 0.00 -0.80 0.00 0.00 55.06 55.38 1o4t s HIS 61 Cb -0.41 0.40 -0.04 0.00 -1.43 0.00 0.00 32.58 31.10 1o4t s HIS 61 CO 0.39 -0.68 0.11 0.21 -2.00 0.00 0.00 174.74 172.76 1o4t s LYS 62 N -2.53 3.26 -0.12 -0.38 2.20 -1.26 -0.65 119.74 120.26 1o4t s LYS 62 Ca -0.05 -0.30 -0.01 0.00 -0.36 0.00 0.00 55.97 55.25 1o4t s LYS 62 Cb -0.01 -3.02 -0.02 0.00 -1.51 0.00 0.00 37.83 33.27 1o4t s LYS 62 CO -0.02 0.72 -0.09 -1.01 -0.36 0.00 0.00 175.35 174.58 1o4t s HIS 63 N -1.09 2.88 -0.01 4.03 3.76 -0.40 -4.98 115.29 119.48 1o4t s HIS 63 Ca 0.19 -0.39 0.02 0.00 -0.15 0.00 0.00 55.06 54.72 1o4t s HIS 63 Cb -0.12 -1.84 -0.00 0.00 1.11 0.00 0.00 32.58 31.73 1o4t s HIS 63 CO 0.09 -0.04 -0.07 -1.21 -0.85 0.00 0.00 174.74 172.66 1o4t s GLU 64 N 0.08 0.61 -0.81 1.40 0.41 -1.26 0.11 118.70 119.24 1o4t s GLU 64 Ca -0.03 -0.22 0.00 0.00 -0.41 0.00 0.00 54.97 54.30 1o4t s GLU 64 Cb -0.14 -0.59 0.00 0.00 -1.78 0.00 0.00 34.13 31.62 1o4t s GLU 64 CO 0.04 0.11 0.00 0.41 -0.49 0.00 0.00 175.26 175.33 1o4t n GLY 65 N 3.10 0.93 3.78 -1.39 0.00 -1.26 -4.96 105.19 105.40 1o4t n GLY 65 Ca -0.15 -0.39 -0.04 0.00 0.00 0.00 0.00 46.02 45.43 1o4t n GLY 65 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1o4t s GLU 66 N -2.37 1.35 0.17 1.61 -1.05 -1.25 0.87 118.70 118.02 1o4t s GLU 66 Ca 0.00 -0.76 0.02 0.00 -0.15 0.00 0.00 54.97 54.08 1o4t s GLU 66 Cb 0.00 0.45 -0.05 0.00 -0.44 0.00 0.00 34.13 34.10 1o4t s GLU 66 CO 0.00 -0.62 -0.00 -0.59 0.95 0.00 0.00 175.26 175.00 1o4t s PHE 67 N -3.33 1.17 0.01 4.83 -0.71 -0.12 -3.17 117.98 116.67 1o4t s PHE 67 Ca 0.13 -1.02 0.01 0.00 -1.04 0.00 0.00 56.93 55.01 1o4t s PHE 67 Cb -0.02 -0.67 -0.01 0.00 -1.21 0.00 0.00 43.02 41.11 1o4t s PHE 67 CO 0.04 -0.22 -0.03 -2.00 -1.34 0.00 0.00 175.22 171.67 1o4t s GLU 68 N -3.91 0.27 -0.06 1.99 2.12 -0.41 -0.31 118.70 118.38 1o4t s GLU 68 Ca 0.23 -0.29 0.04 0.00 0.36 0.00 0.00 54.97 55.31 1o4t s GLU 68 Cb 0.06 -0.16 -0.00 0.00 0.26 0.00 0.00 34.13 34.29 1o4t s GLU 68 CO 0.03 0.04 -0.18 0.42 -0.54 0.00 0.00 175.26 175.02 1o4t s ILE 69 N -0.51 1.56 -0.12 -3.70 1.01 -0.26 -0.41 121.20 118.77 1o4t s ILE 69 Ca -0.04 -0.77 -0.02 0.00 0.00 0.00 0.00 60.65 59.83 1o4t s ILE 69 Cb -0.04 -1.35 -0.03 0.00 0.01 0.00 0.00 42.46 41.05 1o4t s ILE 69 CO -0.00 0.45 -0.05 -0.31 0.00 0.00 0.00 174.94 175.02 1o4t s TYR 70 N 0.19 2.99 -0.26 3.97 4.12 -0.22 -0.97 117.35 127.17 1o4t s TYR 70 Ca -0.09 -0.17 -0.03 0.00 0.02 0.00 0.00 57.07 56.80 1o4t s TYR 70 Cb -0.14 -1.85 0.02 0.00 -1.52 0.00 0.00 41.96 38.47 1o4t s TYR 70 CO 0.04 0.13 -0.02 -0.47 0.02 0.00 0.00 175.55 175.24 1o4t s TYR 71 N -0.16 3.08 -0.03 2.71 5.04 -0.64 -0.01 117.35 127.34 1o4t s TYR 71 Ca 0.03 -1.34 -0.30 0.00 -2.44 0.00 0.00 57.07 53.02 1o4t s TYR 71 Cb -0.13 -2.11 -0.04 0.00 0.35 0.00 0.00 41.96 40.02 1o4t s TYR 71 CO 0.03 -0.67 1.30 0.42 -1.34 0.00 0.00 175.55 175.29 1o4t s ILE 72 N 1.39 3.98 -0.16 3.14 -1.09 0.87 -0.89 121.20 128.43 1o4t s ILE 72 Ca 0.01 1.33 -0.07 0.00 -2.23 0.00 0.00 60.65 59.69 1o4t s ILE 72 Cb -0.17 -3.86 -0.24 0.00 -1.58 0.00 0.00 42.46 36.62 1o4t s ILE 72 CO -0.03 -0.00 0.24 0.18 -1.23 0.00 0.00 174.94 174.10 1o4t n LEU 73 N 5.31 2.59 -3.69 2.97 4.77 0.13 -0.72 117.00 128.37 1o4t n LEU 73 Ca 0.12 0.18 -0.14 0.00 -0.03 0.00 0.00 56.01 56.15 1o4t n LEU 73 Cb 0.45 -1.06 -0.09 0.00 -2.33 0.00 0.00 43.42 40.39 1o4t n LEU 73 CO 0.57 0.80 0.23 -0.76 -1.33 0.00 0.00 177.39 176.89 1o4t s LEU 74 N -7.07 -0.07 0.00 2.23 1.43 -1.10 -4.71 118.68 109.39 1o4t s LEU 74 Ca -0.26 1.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.92 1o4t s LEU 74 Cb 0.07 1.86 0.00 0.00 0.03 0.00 0.00 46.19 48.16 1o4t s LEU 74 CO 0.72 -0.20 0.00 0.61 0.23 0.00 0.00 176.35 177.71 1o4t n GLY 75 N 2.73 -1.81 3.37 -3.19 0.00 -1.25 -0.85 105.19 104.19 1o4t n GLY 75 Ca -0.14 -1.91 -0.10 0.00 0.00 0.00 0.00 46.02 43.88 1o4t n GLY 75 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1o4t s GLU 76 N 0.00 1.22 0.00 1.61 -1.05 -1.26 -1.83 118.70 117.39 1o4t s GLU 76 Ca 0.00 -1.20 0.00 0.00 -0.15 0.00 0.00 54.97 53.62 1o4t s GLU 76 Cb 0.00 0.39 0.00 0.00 -0.44 0.00 0.00 34.13 34.08 1o4t s GLU 76 CO 0.00 -0.45 0.00 0.41 0.95 0.00 0.00 175.26 176.17 1o4t n GLY 77 N -0.24 -0.65 2.86 -3.83 0.00 -0.34 -3.58 105.19 99.40 1o4t n GLY 77 Ca -0.06 -0.52 -0.21 0.00 0.00 0.00 0.00 46.02 45.22 1o4t n GLY 77 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1o4t s VAL 78 N -3.46 0.52 -0.23 1.61 1.01 -0.36 -1.01 120.40 118.49 1o4t s VAL 78 Ca 0.00 -0.06 -0.08 0.00 0.00 0.00 0.00 61.98 61.84 1o4t s VAL 78 Cb 0.00 -0.59 -0.04 0.00 0.00 0.00 0.00 36.38 35.75 1o4t s VAL 78 CO 0.00 0.25 0.10 0.12 0.00 0.00 0.00 175.10 175.56 1o4t s PHE 79 N 1.30 3.18 -0.24 5.22 5.36 -0.09 -1.02 117.98 131.69 1o4t s PHE 79 Ca -0.05 -0.10 -0.10 0.00 -0.96 0.00 0.00 56.93 55.72 1o4t s PHE 79 Cb -0.14 -2.21 -0.05 0.00 -0.34 0.00 0.00 43.02 40.28 1o4t s PHE 79 CO -0.02 -0.12 0.16 -1.58 -1.46 0.00 0.00 175.22 172.20 1o4t s HIS 80 N 1.18 3.31 -0.19 10.12 5.65 -0.10 -0.93 115.29 134.33 1o4t s HIS 80 Ca 0.05 0.21 -0.17 0.00 0.25 0.00 0.00 55.06 55.40 1o4t s HIS 80 Cb -0.14 -2.27 0.05 0.00 -1.18 0.00 0.00 32.58 29.04 1o4t s HIS 80 CO 0.04 0.05 0.50 0.34 -0.65 0.00 0.00 174.74 175.02 1o4t s ASP 81 N 1.09 -0.53 -1.46 9.88 2.15 -0.62 -2.54 116.67 124.63 1o4t s ASP 81 Ca 0.07 1.02 -0.08 0.00 0.43 0.00 0.00 52.55 53.99 1o4t s ASP 81 Cb -0.14 1.02 0.05 0.00 -0.30 0.00 0.00 42.92 43.56 1o4t s ASP 81 CO 0.05 -0.18 0.81 -3.20 -0.17 0.00 0.00 175.17 172.48 1o4t n ASN 82 N 2.92 -2.97 0.00 -0.34 5.15 -1.25 -1.79 115.26 116.98 1o4t n ASN 82 Ca -0.14 -0.84 0.00 0.00 -0.60 0.00 0.00 54.58 53.00 1o4t n ASN 82 Cb 0.56 -3.74 0.00 0.00 -0.53 0.00 0.00 39.78 36.07 1o4t n ASN 82 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1o4t n GLY 83 N -1.67 0.57 3.29 8.20 0.00 -1.26 -5.00 105.19 109.32 1o4t n GLY 83 Ca -0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.60 1o4t n GLY 83 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o4t s LYS 84 N -0.30 2.42 -0.17 1.61 1.02 -0.74 -5.11 119.74 118.47 1o4t s LYS 84 Ca 0.00 -0.90 -0.17 0.00 0.02 0.00 0.00 55.97 54.91 1o4t s LYS 84 Cb 0.00 -2.14 -0.04 0.00 -0.52 0.00 0.00 37.83 35.14 1o4t s LYS 84 CO 0.00 0.45 0.46 -0.51 -0.92 0.00 0.00 175.35 174.83 1o4t s ASP 85 N -0.32 6.56 -0.13 2.83 1.01 -1.26 -1.60 116.67 123.76 1o4t s ASP 85 Ca 0.01 0.67 0.01 0.00 0.71 0.00 0.00 52.55 53.95 1o4t s ASP 85 Cb -0.12 -2.27 0.02 0.00 1.01 0.00 0.00 42.92 41.56 1o4t s ASP 85 CO 0.02 -0.09 -0.15 -0.69 0.21 0.00 0.00 175.17 174.48 1o4t s VAL 86 N 1.20 1.56 0.19 -1.27 1.01 -0.11 -4.96 120.40 118.02 1o4t s VAL 86 Ca 0.23 -0.65 -0.32 0.00 0.00 0.00 0.00 61.98 61.24 1o4t s VAL 86 Cb -0.15 -1.45 -0.11 0.00 0.00 0.00 0.00 36.38 34.67 1o4t s VAL 86 CO 0.09 0.46 1.65 -2.84 0.00 0.00 0.00 175.10 174.46 1o4t s PRO 87 N 1.29 4.17 0.24 2.72 0.02 -1.26 -0.91 135.00 141.25 1o4t s PRO 87 Ca 0.00 2.49 0.05 0.00 0.02 0.00 0.00 61.00 63.57 1o4t s PRO 87 Cb -0.14 -3.12 -0.05 0.00 0.02 0.00 0.00 34.50 31.21 1o4t s PRO 87 CO -0.07 -0.69 -0.05 0.96 -0.33 0.00 0.00 177.00 176.83 1o4t s ILE 88 N 1.18 1.34 0.25 2.83 -5.25 -0.18 -4.89 121.20 116.48 1o4t s ILE 88 Ca 0.73 -2.09 -0.17 0.00 -0.99 0.00 0.00 60.65 58.13 1o4t s ILE 88 Cb -0.47 -2.30 0.01 0.00 2.95 0.00 0.00 42.46 42.66 1o4t s ILE 88 CO 0.32 -0.39 0.59 -1.59 -1.79 0.00 0.00 174.94 172.07 1o4t s LYS 89 N -3.78 1.61 0.12 0.37 -2.85 -1.26 -1.20 119.74 112.75 1o4t s LYS 89 Ca 0.27 -1.06 -0.35 0.00 -1.00 0.00 0.00 55.97 53.82 1o4t s LYS 89 Cb 0.04 0.54 -0.16 0.00 -2.06 0.00 0.00 37.83 36.19 1o4t s LYS 89 CO 0.09 -0.70 1.31 0.00 0.10 0.00 0.00 175.35 176.15 1o4t n ALA 90 N -0.41 -0.70 0.00 0.59 0.00 -0.76 -1.65 120.51 117.58 1o4t n ALA 90 Ca -0.04 0.50 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1o4t n ALA 90 Cb 0.61 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.97 1o4t n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o4t n GLY 91 N 2.44 2.60 3.78 0.00 0.00 0.10 -4.99 105.19 109.14 1o4t n GLY 91 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1o4t n GLY 91 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1o4t s ASP 92 N -1.37 7.12 -0.19 1.61 1.01 -0.66 -4.83 116.67 119.36 1o4t s ASP 92 Ca 0.00 1.95 -0.07 0.00 0.71 0.00 0.00 52.55 55.15 1o4t s ASP 92 Cb 0.00 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.31 1o4t s ASP 92 CO 0.00 -0.23 0.05 -0.69 0.21 0.00 0.00 175.17 174.51 1o4t s VAL 93 N -1.59 4.57 -0.17 -1.27 1.01 -1.26 -0.09 120.40 121.60 1o4t s VAL 93 Ca 0.52 -0.11 -0.01 0.00 0.00 0.00 0.00 61.98 62.38 1o4t s VAL 93 Cb -0.21 -3.06 -0.01 0.00 0.00 0.00 0.00 36.38 33.10 1o4t s VAL 93 CO 0.27 0.44 -0.10 0.00 0.00 0.00 0.00 175.10 175.71 1o4t s PHE 95 N 0.92 2.77 -0.19 0.00 5.36 -1.26 -1.06 117.98 124.51 1o4t s PHE 95 Ca -0.02 -0.81 0.01 0.00 -0.96 0.00 0.00 56.93 55.15 1o4t s PHE 95 Cb -0.15 -1.84 0.03 0.00 -0.34 0.00 0.00 43.02 40.73 1o4t s PHE 95 CO -0.00 -0.31 -0.15 0.99 -1.46 0.00 0.00 175.22 174.29 1o4t s THR 96 N 0.48 1.85 0.59 0.12 2.01 0.45 -5.02 115.64 116.11 1o4t s THR 96 Ca -0.11 -0.99 -0.03 0.00 0.31 0.00 0.00 61.69 60.87 1o4t s THR 96 Cb -0.16 -1.79 0.03 0.00 0.01 0.00 0.00 72.50 70.58 1o4t s THR 96 CO 0.05 0.34 0.86 -0.62 -0.69 0.00 0.00 174.62 174.56 1o4t s ASP 97 N 1.34 5.31 0.24 3.53 -1.08 -1.26 -1.29 116.67 123.46 1o4t s ASP 97 Ca 0.01 0.36 -0.31 0.00 -0.52 0.00 0.00 52.55 52.10 1o4t s ASP 97 Cb -0.15 -1.26 -0.11 0.00 -1.46 0.00 0.00 42.92 39.94 1o4t s ASP 97 CO -0.10 -1.18 1.58 -0.55 0.52 0.00 0.00 175.17 175.43 1o4t s SER 98 N -4.39 6.48 0.00 -0.34 0.15 -1.19 -1.99 113.70 112.42 1o4t s SER 98 Ca 0.56 2.81 0.00 0.00 0.70 0.00 0.00 55.95 60.01 1o4t s SER 98 Cb -0.10 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.59 1o4t s SER 98 CO 0.42 -0.86 0.00 0.61 1.20 0.00 0.00 173.24 174.61 1o4t n GLY 99 N 2.80 2.62 3.91 9.45 0.00 0.31 -4.97 105.19 119.31 1o4t n GLY 99 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.85 1o4t n GLY 99 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1o4t s GLU 100 N -0.74 3.55 -0.01 1.61 2.02 -0.84 -4.80 118.70 119.50 1o4t s GLU 100 Ca 0.00 0.12 0.08 0.00 0.02 0.00 0.00 54.97 55.19 1o4t s GLU 100 Cb 0.00 -2.44 -0.02 0.00 0.10 0.00 0.00 34.13 31.77 1o4t s GLU 100 CO 0.00 -0.12 -0.25 -1.12 0.02 0.00 0.00 175.26 173.80 1o4t s SER 101 N -3.99 3.21 0.14 -0.19 0.01 -1.26 -1.28 113.70 110.34 1o4t s SER 101 Ca 0.46 -0.47 -0.05 0.00 1.31 0.00 0.00 55.95 57.21 1o4t s SER 101 Cb -0.10 -0.39 -0.02 0.00 0.21 0.00 0.00 66.02 65.71 1o4t s SER 101 CO 0.42 0.31 0.16 -1.38 0.41 0.00 0.00 173.24 173.16 1o4t s HIS 102 N -0.68 0.60 0.24 2.43 -3.43 0.18 -3.85 115.29 110.78 1o4t s HIS 102 Ca 0.11 -0.98 -0.13 0.00 -0.80 0.00 0.00 55.06 53.26 1o4t s HIS 102 Cb -0.10 -0.26 -0.00 0.00 -1.43 0.00 0.00 32.58 30.78 1o4t s HIS 102 CO 0.00 -0.60 0.46 -1.54 -2.00 0.00 0.00 174.74 171.06 1o4t s SER 103 N -3.00 -0.09 -0.17 7.38 1.04 -1.05 -1.58 113.70 116.23 1o4t s SER 103 Ca 0.19 -0.90 -0.14 0.00 0.48 0.00 0.00 55.95 55.57 1o4t s SER 103 Cb 0.05 0.57 0.05 0.00 0.10 0.00 0.00 66.02 66.79 1o4t s SER 103 CO -0.00 -1.11 0.44 -0.51 0.98 0.00 0.00 173.24 173.04 1o4t s ILE 104 N -4.01 -0.00 -0.02 -1.02 2.07 -0.82 -0.92 121.20 116.48 1o4t s ILE 104 Ca 0.21 0.02 0.04 0.00 -1.41 0.00 0.00 60.65 59.51 1o4t s ILE 104 Cb -0.00 -0.63 -0.01 0.00 0.13 0.00 0.00 42.46 41.95 1o4t s ILE 104 CO 0.08 0.01 -0.12 -0.70 -1.91 0.00 0.00 174.94 172.29 1o4t s GLU 105 N 0.46 1.07 -0.66 3.50 2.12 -0.19 -0.85 118.70 124.16 1o4t s GLU 105 Ca -0.02 -0.42 -0.23 0.00 0.36 0.00 0.00 54.97 54.66 1o4t s GLU 105 Cb -0.04 -1.01 0.06 0.00 0.26 0.00 0.00 34.13 33.40 1o4t s GLU 105 CO -0.02 0.23 1.00 1.21 -0.54 0.00 0.00 175.26 177.13 1o4t s ASN 106 N -0.13 6.18 0.00 -1.70 2.47 -0.02 -1.23 114.94 120.52 1o4t s ASN 106 Ca 0.02 -0.88 0.25 0.00 0.42 0.00 0.00 52.86 52.67 1o4t s ASN 106 Cb -0.06 -2.43 0.55 0.00 -1.45 0.00 0.00 41.25 37.85 1o4t s ASN 106 CO 0.00 -1.47 1.46 0.35 -3.72 0.00 0.00 177.10 173.73 1o4t n THR 107 N 5.99 0.05 -1.42 -5.21 -2.24 -1.25 -1.04 114.28 109.16 1o4t n THR 107 Ca -0.03 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 1o4t n THR 107 Cb 0.46 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.72 1o4t n THR 107 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1o4t n GLY 108 N 1.29 0.17 0.00 3.38 0.00 -1.23 -4.95 105.19 103.84 1o4t n GLY 108 Ca 0.16 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.35 1o4t n GLY 108 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1o4t n ASN 109 N -1.88 0.92 -4.72 1.61 0.23 -1.26 -4.56 115.26 105.59 1o4t n ASN 109 Ca 0.00 -1.07 -0.32 0.00 -0.53 0.00 0.00 54.58 52.66 1o4t n ASN 109 Cb 0.00 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 37.62 1o4t n ASN 109 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 1o4t s THR 110 N -0.07 1.27 0.52 5.53 -4.23 -1.26 -4.89 115.64 112.52 1o4t s THR 110 Ca 0.00 -2.00 -0.22 0.00 -1.18 0.00 0.00 61.69 58.29 1o4t s THR 110 Cb 0.00 -2.30 -0.06 0.00 1.34 0.00 0.00 72.50 71.48 1o4t s THR 110 CO 0.00 0.00 1.25 -1.81 -0.54 0.00 0.00 174.62 173.52 1o4t s ASP 111 N -3.84 5.63 -0.24 3.99 1.01 -1.26 -4.23 116.67 117.73 1o4t s ASP 111 Ca 0.11 2.51 -0.05 0.00 0.71 0.00 0.00 52.55 55.83 1o4t s ASP 111 Cb 0.03 -2.62 -0.01 0.00 1.01 0.00 0.00 42.92 41.33 1o4t s ASP 111 CO 0.06 -1.31 -0.00 -0.22 0.21 0.00 0.00 175.17 173.91 1o4t s LEU 112 N -3.42 3.12 0.04 1.23 2.96 -0.54 -3.92 118.68 118.16 1o4t s LEU 112 Ca 0.69 -0.39 0.09 0.00 -0.22 0.00 0.00 54.13 54.30 1o4t s LEU 112 Cb -0.34 -1.79 -0.03 0.00 0.50 0.00 0.00 46.19 44.53 1o4t s LEU 112 CO 0.40 -0.04 -0.26 -1.61 -1.32 0.00 0.00 176.35 173.52 1o4t s GLU 113 N 1.51 1.75 0.02 1.98 2.02 -0.03 -0.39 118.70 125.57 1o4t s GLU 113 Ca 0.05 -1.08 -0.28 0.00 0.02 0.00 0.00 54.97 53.69 1o4t s GLU 113 Cb -0.15 -1.91 0.07 0.00 0.10 0.00 0.00 34.13 32.24 1o4t s GLU 113 CO -0.01 0.49 0.64 -0.59 0.02 0.00 0.00 175.26 175.81 1o4t s PHE 114 N -0.80 -0.60 0.22 1.61 -0.12 -0.80 0.23 117.98 117.72 1o4t s PHE 114 Ca 0.11 0.82 -0.20 0.00 -0.05 0.00 0.00 56.93 57.61 1o4t s PHE 114 Cb -0.10 0.45 -0.08 0.00 -0.63 0.00 0.00 43.02 42.66 1o4t s PHE 114 CO 0.02 -0.68 0.73 -0.51 -0.05 0.00 0.00 175.22 174.73 1o4t s LEU 115 N -1.73 4.37 -0.06 -1.99 1.02 -0.07 -0.03 118.68 120.19 1o4t s LEU 115 Ca -0.07 1.45 0.02 0.00 0.02 0.00 0.00 54.13 55.55 1o4t s LEU 115 Cb -0.00 -3.56 0.02 0.00 0.02 0.00 0.00 46.19 42.66 1o4t s LEU 115 CO 0.02 0.05 -0.10 0.00 0.02 0.00 0.00 176.35 176.34 1o4t s ALA 116 N -1.48 1.10 -0.06 4.21 0.00 0.42 -1.61 121.76 124.34 1o4t s ALA 116 Ca 0.42 -0.32 0.01 0.00 0.00 0.00 0.00 51.96 52.07 1o4t s ALA 116 Cb -0.17 -0.55 0.02 0.00 0.00 0.00 0.00 23.12 22.42 1o4t s ALA 116 CO 0.21 0.04 -0.06 0.54 0.00 0.00 0.00 175.76 176.49 1o4t s VAL 117 N 0.80 0.71 -0.27 0.00 0.11 -0.14 -1.43 120.40 120.19 1o4t s VAL 117 Ca -0.12 -0.21 -0.04 0.00 -2.93 0.00 0.00 61.98 58.68 1o4t s VAL 117 Cb -0.15 -0.72 0.02 0.00 -1.53 0.00 0.00 36.38 34.00 1o4t s VAL 117 CO 0.02 0.27 0.01 -0.63 -3.33 0.00 0.00 175.10 171.44 1o4t s ILE 118 N 0.97 3.38 -0.12 7.04 1.01 -0.88 -1.10 121.20 131.51 1o4t s ILE 118 Ca -0.10 -0.88 -0.02 0.00 0.00 0.00 0.00 60.65 59.65 1o4t s ILE 118 Cb -0.14 -2.74 -0.03 0.00 0.01 0.00 0.00 42.46 39.56 1o4t s ILE 118 CO 0.00 0.14 -0.03 -0.63 0.00 0.00 0.00 174.94 174.42 1o4t s ILE 119 N 1.40 3.96 0.18 2.92 1.01 0.57 -0.96 121.20 130.29 1o4t s ILE 119 Ca 0.01 -0.36 -0.27 0.00 0.00 0.00 0.00 60.65 60.04 1o4t s ILE 119 Cb -0.17 -2.69 -0.08 0.00 0.01 0.00 0.00 42.46 39.53 1o4t s ILE 119 CO -0.01 0.54 0.82 -0.76 0.00 0.00 0.00 174.94 175.53 1o4t s LEU 120 N -0.19 4.60 0.00 2.97 1.43 -0.67 -0.94 118.68 125.88 1o4t s LEU 120 Ca 0.04 1.73 0.00 0.00 -1.03 0.00 0.00 54.13 54.86 1o4t s LEU 120 Cb -0.13 -3.38 0.00 0.00 0.03 0.00 0.00 46.19 42.71 1o4t s LEU 120 CO 0.02 0.18 0.00 0.18 0.23 0.00 0.00 176.35 176.97