#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s1h h TYR 29 N 0.00 0.22 -3.03 1.20 -1.99 -2.11 -3.43 116.97 107.82 1s1h h TYR 29 Ca 0.00 -0.02 -0.43 0.00 2.00 0.00 0.00 58.73 60.28 1s1h h TYR 29 Cb 0.00 -0.06 -0.15 0.00 2.00 0.00 0.00 36.73 38.52 1s1h h TYR 29 CO 0.00 0.31 -0.73 0.15 -0.00 0.00 0.00 178.16 177.88 1s1h s LYS 30 N -5.51 1.26 0.44 4.88 3.01 -1.26 -5.11 119.74 117.45 1s1h s LYS 30 Ca -0.14 -1.53 -0.24 0.00 -1.01 0.00 0.00 55.97 53.05 1s1h s LYS 30 Cb 0.06 -1.04 -0.08 0.00 -1.01 0.00 0.00 37.83 35.77 1s1h s LYS 30 CO 0.70 0.17 1.16 0.15 0.51 0.00 0.00 175.35 178.04 1s1h s LYS 31 N -3.55 3.88 -0.21 1.68 3.01 -1.26 -4.99 119.74 118.30 1s1h s LYS 31 Ca 0.20 1.78 -0.10 0.00 -1.01 0.00 0.00 55.97 56.85 1s1h s LYS 31 Cb -0.01 -2.50 -0.05 0.00 -1.01 0.00 0.00 37.83 34.26 1s1h s LYS 31 CO 0.05 -0.45 0.13 1.03 0.51 0.00 0.00 175.35 176.63 1s1h s ARG 32 N -2.56 4.12 0.46 1.68 1.81 -1.26 -5.08 118.95 118.13 1s1h s ARG 32 Ca 0.61 -0.26 -0.04 0.00 -1.72 0.00 0.00 55.73 54.32 1s1h s ARG 32 Cb -0.29 -3.44 -0.03 0.00 -0.45 0.00 0.00 34.95 30.74 1s1h s ARG 32 CO 0.36 0.20 0.75 -0.51 -0.68 0.00 0.00 175.30 175.42 1s1h s LEU 33 N 0.63 3.67 0.27 2.53 2.01 -1.26 -5.03 118.68 121.50 1s1h s LEU 33 Ca 0.07 0.81 -0.29 0.00 0.01 0.00 0.00 54.13 54.73 1s1h s LEU 33 Cb -0.12 -3.74 -0.09 0.00 0.01 0.00 0.00 46.19 42.25 1s1h s LEU 33 CO 0.01 -0.56 1.19 -0.22 1.01 0.00 0.00 176.35 177.78 1s1h s LEU 34 N -4.68 4.49 0.00 1.79 0.20 -1.26 -5.02 118.68 114.20 1s1h s LEU 34 Ca 0.46 2.40 0.00 0.00 0.69 0.00 0.00 54.13 57.69 1s1h s LEU 34 Cb -0.10 -3.63 0.00 0.00 -0.43 0.00 0.00 46.19 42.03 1s1h s LEU 34 CO 0.43 -0.33 0.00 0.61 -0.29 0.00 0.00 176.35 176.78 1s1h n GLY 35 N 1.32 0.92 3.83 7.98 0.00 -1.26 -5.06 105.19 112.92 1s1h n GLY 35 Ca 0.01 -1.94 -0.33 0.00 0.00 0.00 0.00 46.02 43.76 1s1h n GLY 35 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1s1h s THR 36 N 0.77 4.47 0.08 2.61 -4.23 -1.26 -5.06 115.64 113.03 1s1h s THR 36 Ca 0.00 1.33 0.09 0.00 -1.18 0.00 0.00 61.69 61.93 1s1h s THR 36 Cb 0.00 -3.61 -0.03 0.00 1.34 0.00 0.00 72.50 70.19 1s1h s THR 36 CO 0.00 -0.33 -0.24 0.00 -0.54 0.00 0.00 174.62 173.52 1s1h s ALA 37 N -2.18 2.43 0.47 3.99 0.00 -1.26 -5.10 121.76 120.11 1s1h s ALA 37 Ca 0.60 -1.33 -0.22 0.00 0.00 0.00 0.00 51.96 51.00 1s1h s ALA 37 Cb -0.09 -0.53 -0.07 0.00 0.00 0.00 0.00 23.12 22.43 1s1h s ALA 37 CO 0.16 0.55 1.14 -0.06 0.00 0.00 0.00 175.76 177.55 1s1h s PHE 38 N -0.96 2.90 0.16 0.00 0.08 -1.26 -4.93 117.98 113.96 1s1h s PHE 38 Ca 0.14 1.55 -0.09 0.00 0.12 0.00 0.00 56.93 58.65 1s1h s PHE 38 Cb -0.10 -3.32 0.01 0.00 -0.57 0.00 0.00 43.02 39.03 1s1h s PHE 38 CO 0.05 -1.38 1.49 0.87 -0.10 0.00 0.00 175.22 176.15 1s1h h LYS 39 N 1.95 0.84 -4.42 0.44 1.79 -1.97 -3.42 116.57 111.77 1s1h h LYS 39 Ca -0.49 -0.46 -0.51 0.00 -2.18 0.00 0.00 60.65 57.00 1s1h h LYS 39 Cb 1.24 0.03 -0.34 0.00 -1.58 0.00 0.00 32.23 31.58 1s1h h LYS 39 CO 0.60 1.10 -0.81 -1.12 -1.08 0.00 0.00 179.45 178.14 1s1h s SER 40 N -6.87 1.85 -0.96 0.86 0.01 -1.26 -5.02 113.70 102.31 1s1h s SER 40 Ca -0.10 -0.29 -0.03 0.00 1.31 0.00 0.00 55.95 56.84 1s1h s SER 40 Cb 0.11 -0.81 0.26 0.00 0.21 0.00 0.00 66.02 65.79 1s1h s SER 40 CO 0.87 -0.02 1.05 -1.20 0.41 0.00 0.00 173.24 174.36 1s1h n SER 41 N 4.16 5.05 0.00 2.44 7.64 -1.26 -4.71 113.62 126.94 1s1h n SER 41 Ca -0.20 -3.25 0.08 0.00 1.01 0.00 0.00 58.87 56.52 1s1h n SER 41 Cb 0.51 -1.12 0.50 0.00 -1.01 0.00 0.00 64.21 63.09 1s1h n SER 41 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1s1h n PRO 42 N 1.86 0.78 -1.33 1.43 -0.04 -1.26 -4.85 135.00 131.58 1s1h n PRO 42 Ca 0.25 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.71 1s1h n PRO 42 Cb 0.37 -1.34 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 1s1h n PRO 42 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1s1h n PHE 43 N -0.84 -3.65 -0.55 0.54 -0.00 -1.26 -4.49 117.46 107.20 1s1h n PHE 43 Ca 0.13 1.97 0.00 0.00 -0.00 0.00 0.00 57.45 59.55 1s1h n PHE 43 Cb 0.06 -3.13 0.00 0.00 -0.00 0.00 0.00 39.48 36.41 1s1h n PHE 43 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1s1h n GLY 44 N -2.11 0.89 2.46 7.13 0.00 -1.26 -1.85 105.19 110.45 1s1h n GLY 44 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1s1h n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s1h n GLY 45 N -2.00 -0.50 3.83 -0.02 0.00 -1.26 -4.90 105.19 100.34 1s1h n GLY 45 Ca 0.00 0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1s1h n GLY 45 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1s1h s SER 46 N -2.09 5.49 0.11 1.61 0.15 -0.77 -4.96 113.70 113.23 1s1h s SER 46 Ca 0.02 1.56 -0.13 0.00 0.70 0.00 0.00 55.95 58.11 1s1h s SER 46 Cb -0.01 -2.46 -0.09 0.00 -1.71 0.00 0.00 66.02 61.75 1s1h s SER 46 CO 0.03 -1.37 1.41 -1.28 1.20 0.00 0.00 173.24 173.23 1s1h h SER 47 N -0.66 0.88 -5.19 5.45 0.87 -1.91 -3.46 113.55 109.54 1s1h h SER 47 Ca -0.44 -0.51 -0.11 0.00 -1.23 0.00 0.00 61.79 59.50 1s1h h SER 47 Cb 1.21 -0.25 -0.15 0.00 -0.44 0.00 0.00 62.40 62.77 1s1h h SER 47 CO 0.58 1.22 -0.57 -1.00 -0.53 0.00 0.00 176.83 176.53 1s1h s HIS 48 N -4.23 0.36 -0.00 2.24 0.09 -1.26 -4.73 115.29 107.76 1s1h s HIS 48 Ca -0.11 -0.83 -0.03 0.00 -0.00 0.00 0.00 55.06 54.08 1s1h s HIS 48 Cb 0.09 -0.25 -0.00 0.00 -0.00 0.00 0.00 32.58 32.42 1s1h s HIS 48 CO 0.86 -0.42 0.05 0.00 -0.00 0.00 0.00 174.74 175.24 1s1h s ALA 49 N -3.64 -0.11 -0.00 -1.40 0.00 -1.03 -4.98 121.76 110.60 1s1h s ALA 49 Ca 0.04 -0.15 0.02 0.00 0.00 0.00 0.00 51.96 51.86 1s1h s ALA 49 Cb 0.05 0.03 -0.03 0.00 0.00 0.00 0.00 23.12 23.17 1s1h s ALA 49 CO -0.09 -0.12 -0.02 -1.59 0.00 0.00 0.00 175.76 173.93 1s1h s LYS 50 N -0.84 2.71 0.31 0.00 -2.85 -1.26 0.66 119.74 118.47 1s1h s LYS 50 Ca -0.09 -0.64 0.01 0.00 -1.00 0.00 0.00 55.97 54.25 1s1h s LYS 50 Cb -0.06 -2.61 -0.00 0.00 -2.06 0.00 0.00 37.83 33.10 1s1h s LYS 50 CO 0.00 0.62 0.38 0.41 0.10 0.00 0.00 175.35 176.86 1s1h n GLY 51 N 1.49 2.46 3.44 0.59 0.00 -0.15 -2.55 105.19 110.47 1s1h n GLY 51 Ca -0.15 -1.68 -0.32 0.00 0.00 0.00 0.00 46.02 43.87 1s1h n GLY 51 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1s1h s ILE 52 N -2.92 2.80 0.12 -0.61 -5.25 -0.52 -0.94 121.20 113.88 1s1h s ILE 52 Ca 0.29 -0.89 -0.30 0.00 -0.99 0.00 0.00 60.65 58.76 1s1h s ILE 52 Cb -0.00 -2.09 -0.07 0.00 2.95 0.00 0.00 42.46 43.26 1s1h s ILE 52 CO 0.21 0.54 1.16 -0.69 -1.79 0.00 0.00 174.94 174.38 1s1h s VAL 53 N -0.74 3.93 -0.18 8.37 1.01 -0.64 -0.57 120.40 131.57 1s1h s VAL 53 Ca 0.12 1.50 -0.24 0.00 0.00 0.00 0.00 61.98 63.35 1s1h s VAL 53 Cb -0.10 -3.96 -0.22 0.00 0.00 0.00 0.00 36.38 32.10 1s1h s VAL 53 CO 0.01 0.18 0.42 -0.07 0.00 0.00 0.00 175.10 175.64 1s1h h LEU 54 N 6.02 0.00 -7.29 3.92 3.38 -0.57 -3.37 115.31 117.40 1s1h h LEU 54 Ca -0.43 -0.69 -0.11 0.00 0.09 0.00 0.00 57.88 56.74 1s1h h LEU 54 Cb 1.21 -0.00 -0.23 0.00 0.09 0.00 0.00 40.66 41.73 1s1h h LEU 54 CO 0.77 1.31 -0.19 -1.83 0.09 0.00 0.00 178.44 178.60 1s1h s GLU 55 N -2.31 0.56 -1.09 1.13 -1.05 -1.25 -4.82 118.70 109.87 1s1h s GLU 55 Ca -0.25 0.52 -0.08 0.00 -0.15 0.00 0.00 54.97 55.01 1s1h s GLU 55 Cb 0.03 0.27 0.28 0.00 -0.44 0.00 0.00 34.13 34.26 1s1h s GLU 55 CO 0.63 -0.09 1.11 1.17 0.95 0.00 0.00 175.26 179.03 1s1h n LYS 56 N 2.59 3.52 -1.69 -4.83 4.81 -1.26 -1.64 118.16 119.65 1s1h n LYS 56 Ca -0.14 -4.47 -0.25 0.00 -0.87 0.00 0.00 58.31 52.57 1s1h n LYS 56 Cb 0.57 -2.53 0.18 0.00 0.02 0.00 0.00 35.03 33.26 1s1h n LYS 56 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1s1h n LEU 57 N 2.53 0.00 -3.70 3.14 4.77 -1.05 -4.90 117.00 117.80 1s1h n LEU 57 Ca 0.24 -1.30 -0.15 0.00 -0.03 0.00 0.00 56.01 54.77 1s1h n LEU 57 Cb 0.38 -0.88 -0.15 0.00 -2.33 0.00 0.00 43.42 40.45 1s1h n LEU 57 CO 0.48 -1.31 -0.23 -0.83 -1.33 0.00 0.00 177.39 174.17 1s1h s GLY 58 N -5.51 0.01 0.24 -0.72 0.00 -1.26 -2.69 107.32 97.39 1s1h s GLY 58 Ca 0.66 0.63 0.10 0.00 0.00 0.00 0.00 44.72 46.11 1s1h s GLY 58 CO 0.46 1.43 -0.06 -0.26 0.00 0.00 0.00 173.10 174.67 1s1h s ILE 59 N 1.86 3.24 0.27 0.90 -4.36 -0.34 -4.87 121.20 117.91 1s1h s ILE 59 Ca -0.02 -1.91 0.05 0.00 -0.26 0.00 0.00 60.65 58.51 1s1h s ILE 59 Cb -0.12 -2.70 -0.02 0.00 1.25 0.00 0.00 42.46 40.87 1s1h s ILE 59 CO -0.06 -0.31 0.40 -1.83 0.24 0.00 0.00 174.94 173.38 1s1h s GLU 60 N -3.42 3.36 0.80 0.37 -1.05 -1.26 -0.79 118.70 116.71 1s1h s GLU 60 Ca 0.29 -0.80 -0.14 0.00 -0.15 0.00 0.00 54.97 54.18 1s1h s GLU 60 Cb -0.07 -2.86 0.19 0.00 -0.44 0.00 0.00 34.13 30.95 1s1h s GLU 60 CO 0.18 0.32 1.00 0.45 0.95 0.00 0.00 175.26 178.15 1s1h n SER 61 N -1.50 -0.32 -4.60 0.83 2.88 -1.26 -4.87 113.62 104.78 1s1h n SER 61 Ca -0.06 -1.30 -0.29 0.00 -1.33 0.00 0.00 58.87 55.89 1s1h n SER 61 Cb 0.57 -0.79 -0.09 0.00 -0.75 0.00 0.00 64.21 63.15 1s1h n SER 61 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1s1h s LYS 62 N -5.20 2.01 2.94 -1.46 2.20 -1.04 -4.91 119.74 114.29 1s1h s LYS 62 Ca 0.58 -2.21 0.00 0.00 -0.36 0.00 0.00 55.97 53.98 1s1h s LYS 62 Cb -0.02 -1.39 0.00 0.00 -1.51 0.00 0.00 37.83 34.90 1s1h s LYS 62 CO 0.41 -0.23 0.00 1.04 -0.36 0.00 0.00 175.35 176.21 1s1h n GLN 63 N -1.05 0.00 0.15 4.03 1.13 -1.26 -2.95 117.38 117.43 1s1h n GLN 63 Ca -0.10 0.00 0.01 0.00 -1.94 0.00 0.00 57.00 54.97 1s1h n GLN 63 Cb 0.67 0.00 0.23 0.00 0.11 0.00 0.00 30.24 31.24 1s1h n GLN 63 CO 0.00 0.00 0.00 -1.35 -1.44 0.00 0.00 177.06 174.27 1s1h h PRO 64 N 0.00 0.00 -7.02 -1.09 0.11 -1.98 -3.46 132.00 118.57 1s1h h PRO 64 Ca 0.00 0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.59 1s1h h PRO 64 Cb 0.00 0.00 0.08 0.00 0.11 0.00 0.00 31.00 31.19 1s1h h PRO 64 CO 0.00 0.54 0.51 0.54 -0.21 0.00 0.00 178.00 179.37 1s1h s ASN 65 N -6.72 5.95 0.03 -2.05 6.03 -1.15 -5.01 114.94 112.01 1s1h s ASN 65 Ca -0.01 2.39 0.01 0.00 -1.03 0.00 0.00 52.86 54.22 1s1h s ASN 65 Cb 0.12 -2.61 -0.02 0.00 -3.03 0.00 0.00 41.25 35.71 1s1h s ASN 65 CO 0.74 -1.08 -0.05 -0.55 -2.03 0.00 0.00 177.10 174.13 1s1h s SER 66 N -1.31 0.46 0.00 3.54 0.15 -1.26 -3.92 113.70 111.36 1s1h s SER 66 Ca 0.66 -0.47 0.00 0.00 0.70 0.00 0.00 55.95 56.84 1s1h s SER 66 Cb -0.31 0.06 0.00 0.00 -1.71 0.00 0.00 66.02 64.07 1s1h s SER 66 CO 0.37 -0.23 0.00 0.00 1.20 0.00 0.00 173.24 174.58 1s1h n ALA 67 N 1.70 0.00 -3.60 5.45 0.00 -1.26 -4.94 120.51 117.87 1s1h n ALA 67 Ca -0.22 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.82 1s1h n ALA 67 Cb 0.55 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.92 1s1h n ALA 67 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1s1h s ILE 68 N -2.03 4.12 0.17 0.00 2.07 -1.26 -4.08 121.20 120.19 1s1h s ILE 68 Ca 0.00 -2.15 -0.30 0.00 -1.41 0.00 0.00 60.65 56.79 1s1h s ILE 68 Cb 0.00 -3.70 -0.07 0.00 0.13 0.00 0.00 42.46 38.82 1s1h s ILE 68 CO 0.00 -0.81 0.99 -0.13 -1.91 0.00 0.00 174.94 173.07 1s1h s ARG 69 N 0.90 4.73 -0.15 3.50 1.81 0.03 -4.86 118.95 124.91 1s1h s ARG 69 Ca 0.10 1.53 -0.19 0.00 -1.72 0.00 0.00 55.73 55.44 1s1h s ARG 69 Cb -0.23 -3.32 -0.04 0.00 -0.45 0.00 0.00 34.95 30.92 1s1h s ARG 69 CO -0.03 0.28 0.54 0.15 -0.68 0.00 0.00 175.30 175.57 1s1h s LYS 70 N -0.50 4.28 0.30 3.54 3.01 -1.26 -1.20 119.74 127.92 1s1h s LYS 70 Ca 0.45 0.52 0.03 0.00 -1.01 0.00 0.00 55.97 55.96 1s1h s LYS 70 Cb -0.26 -3.50 -0.05 0.00 -1.01 0.00 0.00 37.83 33.02 1s1h s LYS 70 CO 0.32 -0.02 0.10 0.00 0.51 0.00 0.00 175.35 176.27 1s1h s VAL 72 N -3.55 -0.01 0.20 0.00 -7.23 -0.58 -2.53 120.40 106.69 1s1h s VAL 72 Ca 0.35 0.03 -0.29 0.00 -1.81 0.00 0.00 61.98 60.26 1s1h s VAL 72 Cb 0.07 -0.68 -0.08 0.00 0.56 0.00 0.00 36.38 36.25 1s1h s VAL 72 CO 0.15 0.01 0.92 -0.13 -0.31 0.00 0.00 175.10 175.74 1s1h s ARG 73 N 0.74 4.78 0.01 4.82 1.81 -0.65 -1.12 118.95 129.33 1s1h s ARG 73 Ca -0.04 1.42 0.03 0.00 -1.72 0.00 0.00 55.73 55.42 1s1h s ARG 73 Cb -0.05 -3.30 -0.01 0.00 -0.45 0.00 0.00 34.95 31.14 1s1h s ARG 73 CO -0.05 0.46 -0.09 0.14 -0.68 0.00 0.00 175.30 175.08 1s1h s VAL 74 N -0.92 0.70 -0.42 3.52 -7.23 0.25 -0.03 120.40 116.27 1s1h s VAL 74 Ca 0.41 -0.61 -0.13 0.00 -1.81 0.00 0.00 61.98 59.85 1s1h s VAL 74 Cb -0.25 -0.63 0.05 0.00 0.56 0.00 0.00 36.38 36.11 1s1h s VAL 74 CO 0.31 0.03 0.29 -1.58 -0.31 0.00 0.00 175.10 173.84 1s1h s GLN 75 N -0.64 2.84 0.36 4.82 0.74 0.26 -0.32 119.66 127.72 1s1h s GLN 75 Ca 0.00 -1.23 -0.21 0.00 0.05 0.00 0.00 55.36 53.97 1s1h s GLN 75 Cb -0.05 -3.90 -0.10 0.00 1.10 0.00 0.00 33.01 30.06 1s1h s GLN 75 CO 0.00 -0.86 0.88 -0.51 -0.55 0.00 0.00 175.29 174.26 1s1h s LEU 76 N 1.57 4.12 -0.01 3.68 2.01 -0.24 -1.44 118.68 128.37 1s1h s LEU 76 Ca 0.03 1.63 -0.22 0.00 0.01 0.00 0.00 54.13 55.58 1s1h s LEU 76 Cb -0.21 -4.20 -0.21 0.00 0.01 0.00 0.00 46.19 41.58 1s1h s LEU 76 CO 0.06 -0.21 1.15 0.16 1.01 0.00 0.00 176.35 178.52 1s1h h ILE 77 N 2.21 1.45 0.47 -0.59 -2.65 -1.80 -2.87 117.51 113.73 1s1h h ILE 77 Ca -0.48 -1.78 -0.02 0.00 1.03 0.00 0.00 64.86 63.61 1s1h h ILE 77 Cb 1.18 2.44 0.00 0.00 -2.05 0.00 0.00 36.82 38.40 1s1h h ILE 77 CO 0.63 0.50 -0.22 0.11 0.03 0.00 0.00 178.15 179.20 1s1h h LYS 78 N -0.24 -0.61 -0.20 0.16 1.79 -1.89 -2.72 116.57 112.86 1s1h h LYS 78 Ca -0.03 0.04 -0.12 0.00 -2.18 0.00 0.00 60.65 58.36 1s1h h LYS 78 Cb 0.98 0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 31.76 1s1h h LYS 78 CO 0.06 -0.40 -0.40 -0.97 -1.08 0.00 0.00 179.45 176.66 1s1h h ASN 79 N -0.66 0.49 0.00 0.86 -0.00 -1.79 -3.44 115.58 111.04 1s1h h ASN 79 Ca -0.06 -0.21 0.00 0.00 -0.00 0.00 0.00 56.30 56.02 1s1h h ASN 79 Cb 0.48 -0.14 0.00 0.00 -0.00 0.00 0.00 38.32 38.67 1s1h h ASN 79 CO 0.11 0.84 0.00 0.61 -0.00 0.00 0.00 177.43 178.99 1s1h n GLY 80 N -0.07 0.65 3.87 1.57 0.00 -1.03 -5.01 105.19 105.17 1s1h n GLY 80 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 1s1h n GLY 80 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1s1h s LYS 81 N -0.21 3.81 -0.17 1.61 2.20 -1.25 -4.78 119.74 120.96 1s1h s LYS 81 Ca 0.00 0.38 -0.08 0.00 -0.36 0.00 0.00 55.97 55.91 1s1h s LYS 81 Cb 0.00 -2.52 -0.04 0.00 -1.51 0.00 0.00 37.83 33.76 1s1h s LYS 81 CO 0.00 0.15 0.09 0.15 -0.36 0.00 0.00 175.35 175.38 1s1h s LYS 82 N -3.30 3.93 0.21 4.03 1.02 -1.26 -1.08 119.74 123.29 1s1h s LYS 82 Ca 0.50 -0.29 -0.01 0.00 0.02 0.00 0.00 55.97 56.19 1s1h s LYS 82 Cb -0.11 -3.25 -0.04 0.00 -0.52 0.00 0.00 37.83 33.92 1s1h s LYS 82 CO 0.25 0.36 0.13 0.14 -0.92 0.00 0.00 175.35 175.31 1s1h s VAL 83 N 0.14 0.06 -0.08 3.17 -7.23 0.56 -4.93 120.40 112.09 1s1h s VAL 83 Ca 0.06 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.23 1s1h s VAL 83 Cb -0.12 -2.52 -0.03 0.00 0.56 0.00 0.00 36.38 34.28 1s1h s VAL 83 CO -0.00 0.00 -0.06 -0.89 -0.31 0.00 0.00 175.10 173.84 1s1h s THR 84 N -4.11 3.74 0.03 5.32 2.01 -1.26 0.88 115.64 122.24 1s1h s THR 84 Ca 0.39 -0.46 0.01 0.00 0.31 0.00 0.00 61.69 61.95 1s1h s THR 84 Cb 0.07 -2.54 -0.02 0.00 0.01 0.00 0.00 72.50 70.02 1s1h s THR 84 CO 0.12 0.58 -0.06 0.00 -0.69 0.00 0.00 174.62 174.58 1s1h s ALA 85 N -0.63 0.40 0.34 7.40 0.00 -0.28 -3.77 121.76 125.22 1s1h s ALA 85 Ca 0.10 -0.61 -0.24 0.00 0.00 0.00 0.00 51.96 51.21 1s1h s ALA 85 Cb -0.12 0.05 -0.10 0.00 0.00 0.00 0.00 23.12 22.96 1s1h s ALA 85 CO 0.02 -0.04 0.92 0.12 0.00 0.00 0.00 175.76 176.77 1s1h s PHE 86 N -1.16 3.58 -0.33 0.00 5.36 -0.24 -1.53 117.98 123.66 1s1h s PHE 86 Ca -0.10 1.68 0.00 0.00 -0.96 0.00 0.00 56.93 57.55 1s1h s PHE 86 Cb -0.08 -2.86 0.08 0.00 -0.34 0.00 0.00 43.02 39.81 1s1h s PHE 86 CO -0.00 0.14 0.04 0.14 -1.46 0.00 0.00 175.22 174.07 1s1h s VAL 87 N -1.76 2.76 0.69 3.12 -7.23 -0.97 0.05 120.40 117.06 1s1h s VAL 87 Ca 0.53 -1.79 -0.13 0.00 -1.81 0.00 0.00 61.98 58.78 1s1h s VAL 87 Cb -0.16 -2.76 0.01 0.00 0.56 0.00 0.00 36.38 34.04 1s1h s VAL 87 CO 0.20 -0.33 1.09 -2.16 -0.31 0.00 0.00 175.10 173.59 1s1h s PRO 88 N 1.13 2.72 0.00 4.82 0.04 -1.26 -4.73 135.00 137.72 1s1h s PRO 88 Ca 0.01 1.23 0.00 0.00 0.04 0.00 0.00 61.00 62.28 1s1h s PRO 88 Cb -0.20 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.39 1s1h s PRO 88 CO -0.04 -1.29 0.00 0.09 0.04 0.00 0.00 177.00 175.80 1s1h n ASN 89 N -2.81 0.00 -0.24 6.66 3.02 -1.26 -4.70 115.26 115.93 1s1h n ASN 89 Ca 0.09 0.00 -0.06 0.00 -0.03 0.00 0.00 54.58 54.58 1s1h n ASN 89 Cb 0.53 0.24 0.05 0.00 -0.61 0.00 0.00 39.78 39.98 1s1h n ASN 89 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1s1h h ASP 90 N 0.00 0.80 -3.82 6.41 5.19 -2.00 -3.48 116.42 119.53 1s1h h ASP 90 Ca 0.00 -0.07 0.12 0.00 -0.62 0.00 0.00 57.03 56.46 1s1h h ASP 90 Cb 0.00 -0.20 -0.04 0.00 0.18 0.00 0.00 39.33 39.27 1s1h h ASP 90 CO 0.00 0.63 -0.25 0.61 -3.12 0.00 0.00 179.24 177.11 1s1h n GLY 91 N -1.15 -1.98 0.00 2.75 0.00 -1.26 -4.74 105.19 98.81 1s1h n GLY 91 Ca 0.05 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.69 1s1h n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s1h h LEU 93 N 0.00 0.78 0.00 0.00 -0.00 -2.02 -3.48 115.31 110.58 1s1h h LEU 93 Ca 0.00 -0.15 0.00 0.00 -0.00 0.00 0.00 57.88 57.73 1s1h h LEU 93 Cb 0.00 -0.20 0.00 0.00 -0.00 0.00 0.00 40.66 40.46 1s1h h LEU 93 CO 0.00 0.71 0.00 -0.46 -0.00 0.00 0.00 178.44 178.69 1s1h n ASN 94 N -4.51 0.00 -3.29 -0.43 2.04 -1.26 -4.99 115.26 102.81 1s1h n ASN 94 Ca 0.03 0.00 -0.31 0.00 -0.44 0.00 0.00 54.58 53.86 1s1h n ASN 94 Cb 0.14 0.00 -0.03 0.00 -2.53 0.00 0.00 39.78 37.36 1s1h n ASN 94 CO 0.00 0.00 0.00 0.33 -0.44 0.00 0.00 177.26 177.15 1s1h n PHE 95 N -2.00 3.56 -4.38 -2.53 7.35 -1.26 -4.96 117.46 113.24 1s1h n PHE 95 Ca 0.00 -3.65 -0.22 0.00 -0.76 0.00 0.00 57.45 52.82 1s1h n PHE 95 Cb 0.00 -0.71 -0.16 0.00 0.35 0.00 0.00 39.48 38.96 1s1h n PHE 95 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 1s1h s VAL 96 N -3.78 0.82 0.00 -2.13 1.01 -1.26 -4.34 120.40 110.72 1s1h s VAL 96 Ca 0.43 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.11 1s1h s VAL 96 Cb 0.21 -0.78 0.00 0.00 0.00 0.00 0.00 36.38 35.81 1s1h s VAL 96 CO -0.08 0.28 0.00 -0.90 0.00 0.00 0.00 175.10 174.40 1s1h n ASP 97 N 3.83 1.66 -0.13 3.32 5.68 -1.26 -4.93 116.55 124.71 1s1h n ASP 97 Ca -0.23 -0.28 -0.08 0.00 -0.50 0.00 0.00 54.79 53.70 1s1h n ASP 97 Cb 0.52 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 1s1h n ASP 97 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1s1h h GLU 98 N 0.00 0.54 -2.09 0.11 4.39 -1.88 -3.29 114.58 112.35 1s1h h GLU 98 Ca 0.00 -0.04 -0.54 0.00 0.34 0.00 0.00 59.36 59.13 1s1h h GLU 98 Cb 0.00 -0.12 -0.41 0.00 -0.10 0.00 0.00 28.75 28.13 1s1h h GLU 98 CO 0.00 0.37 -0.98 0.09 -1.16 0.00 0.00 179.01 177.33 1s1h n ASN 99 N -4.79 1.92 -4.88 1.42 3.02 -1.26 -3.93 115.26 106.75 1s1h n ASN 99 Ca 0.01 -3.16 -0.34 0.00 -0.03 0.00 0.00 54.58 51.06 1s1h n ASN 99 Cb 0.03 -0.61 -0.05 0.00 -0.61 0.00 0.00 39.78 38.54 1s1h n ASN 99 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1s1h s ASP 100 N -2.45 6.53 0.36 6.41 1.01 -1.24 -4.75 116.67 122.54 1s1h s ASP 100 Ca 0.41 0.62 -0.26 0.00 0.71 0.00 0.00 52.55 54.04 1s1h s ASP 100 Cb 0.28 -2.11 -0.09 0.00 1.01 0.00 0.00 42.92 42.00 1s1h s ASP 100 CO -0.09 0.17 1.07 -1.61 0.21 0.00 0.00 175.17 174.92 1s1h s GLU 101 N -2.06 4.32 0.13 8.23 0.41 -1.26 -1.62 118.70 126.84 1s1h s GLU 101 Ca 0.33 1.62 -0.09 0.00 -0.41 0.00 0.00 54.97 56.42 1s1h s GLU 101 Cb -0.13 -2.77 -0.01 0.00 -1.78 0.00 0.00 34.13 29.44 1s1h s GLU 101 CO 0.19 -0.02 0.23 0.54 -0.49 0.00 0.00 175.26 175.71 1s1h s VAL 102 N -1.48 0.11 -0.07 2.63 0.11 -0.12 -1.85 120.40 119.72 1s1h s VAL 102 Ca 0.53 -1.30 0.04 0.00 -2.93 0.00 0.00 61.98 58.32 1s1h s VAL 102 Cb -0.26 -1.60 -0.02 0.00 -1.53 0.00 0.00 36.38 32.98 1s1h s VAL 102 CO 0.32 -0.48 -0.18 -0.76 -3.33 0.00 0.00 175.10 170.67 1s1h s LEU 103 N -2.92 2.47 -0.25 2.54 1.02 -1.26 -0.97 118.68 119.31 1s1h s LEU 103 Ca 0.11 -0.35 -0.06 0.00 0.02 0.00 0.00 54.13 53.85 1s1h s LEU 103 Cb 0.04 -1.50 -0.01 0.00 0.02 0.00 0.00 46.19 44.74 1s1h s LEU 103 CO -0.05 0.26 0.04 -0.76 0.02 0.00 0.00 176.35 175.85 1s1h s LEU 104 N -0.22 3.38 0.13 1.79 1.02 0.21 -1.06 118.68 123.93 1s1h s LEU 104 Ca -0.00 -0.41 -0.03 0.00 0.02 0.00 0.00 54.13 53.70 1s1h s LEU 104 Cb -0.13 -1.85 -0.08 0.00 0.02 0.00 0.00 46.19 44.14 1s1h s LEU 104 CO 0.03 -0.07 1.31 0.00 0.02 0.00 0.00 176.35 177.64 1s1h h ALA 105 N 8.20 0.38 -1.97 4.21 0.00 -1.56 -2.72 119.26 125.80 1s1h h ALA 105 Ca -0.37 -0.71 -0.29 0.00 0.00 0.00 0.00 54.91 53.53 1s1h h ALA 105 Cb 1.16 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1s1h h ALA 105 CO 0.59 0.83 -0.36 0.41 0.00 0.00 0.00 179.25 180.72 1s1h n GLY 106 N 0.94 -0.12 3.73 0.00 0.00 -1.23 -4.80 105.19 103.72 1s1h n GLY 106 Ca -0.06 -0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.26 1s1h n GLY 106 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1s1h s PHE 107 N -2.71 2.83 0.00 1.61 2.19 -1.26 -2.50 117.98 118.14 1s1h s PHE 107 Ca 0.00 0.50 0.00 0.00 0.33 0.00 0.00 56.93 57.76 1s1h s PHE 107 Cb 0.00 -4.13 0.00 0.00 -1.31 0.00 0.00 43.02 37.58 1s1h s PHE 107 CO 0.00 -4.09 0.00 0.41 1.83 0.00 0.00 175.22 173.37 1s1h n GLY 108 N 3.23 1.26 0.49 13.12 0.00 -1.26 -3.12 105.19 118.92 1s1h n GLY 108 Ca 0.13 -2.09 -0.19 0.00 0.00 0.00 0.00 46.02 43.87 1s1h n GLY 108 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1s1h h ARG 109 N 0.00 -1.20 0.13 1.61 3.08 -1.94 -3.21 114.38 112.85 1s1h h ARG 109 Ca 0.00 0.08 -0.29 0.00 0.07 0.00 0.00 59.98 59.85 1s1h h ARG 109 Cb 0.00 0.27 0.02 0.00 0.08 0.00 0.00 29.97 30.34 1s1h h ARG 109 CO 0.00 -0.80 -1.24 0.87 -1.07 0.00 0.00 179.97 177.73 1s1h h LYS 110 N -1.26 0.44 0.00 0.04 1.57 -1.87 -3.47 116.57 112.02 1s1h h LYS 110 Ca -0.13 -0.65 0.00 0.00 -1.87 0.00 0.00 60.65 58.00 1s1h h LYS 110 Cb 0.96 0.23 0.00 0.00 0.08 0.00 0.00 32.23 33.49 1s1h h LYS 110 CO 0.21 1.29 0.00 0.41 -0.57 0.00 0.00 179.45 180.79 1s1h n GLY 111 N 1.43 0.70 3.91 3.86 0.00 -1.04 -4.63 105.19 109.42 1s1h n GLY 111 Ca -0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.63 1s1h n GLY 111 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s1h s LYS 112 N -0.60 3.62 -0.68 1.61 1.02 -0.67 -2.42 119.74 121.62 1s1h s LYS 112 Ca 0.00 0.03 -0.02 0.00 0.02 0.00 0.00 55.97 56.00 1s1h s LYS 112 Cb 0.00 -2.59 0.17 0.00 -0.52 0.00 0.00 37.83 34.89 1s1h s LYS 112 CO 0.00 0.14 0.50 0.00 -0.92 0.00 0.00 175.35 175.07 1s1h s ALA 113 N -2.21 3.71 -0.02 5.17 0.00 -0.97 -4.95 121.76 122.51 1s1h s ALA 113 Ca 0.45 -3.42 -0.25 0.00 0.00 0.00 0.00 51.96 48.74 1s1h s ALA 113 Cb -0.10 -2.66 -0.20 0.00 0.00 0.00 0.00 23.12 20.16 1s1h s ALA 113 CO 0.32 -2.12 1.25 -0.22 0.00 0.00 0.00 175.76 174.99 1s1h h LYS 114 N 6.72 0.08 -0.12 0.00 1.63 -1.86 0.33 116.57 123.35 1s1h h LYS 114 Ca 0.02 -0.05 -0.01 0.00 -0.85 0.00 0.00 60.65 59.77 1s1h h LYS 114 Cb 0.91 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.54 1s1h h LYS 114 CO 0.74 0.59 0.04 0.78 -3.45 0.00 0.00 179.45 178.15 1s1h h GLY 115 N -0.41 0.19 0.24 5.01 0.00 -2.00 -3.32 103.07 102.78 1s1h h GLY 115 Ca 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.21 1s1h h GLY 115 CO 0.01 0.10 -0.11 -0.55 0.00 0.00 0.00 176.54 175.99 1s1h h ASP 116 N 0.02 -0.27 -3.24 0.19 3.32 -1.92 -3.39 116.42 111.13 1s1h h ASP 116 Ca 0.04 0.01 -0.48 0.00 0.02 0.00 0.00 57.03 56.62 1s1h h ASP 116 Cb 0.19 0.07 -0.37 0.00 0.22 0.00 0.00 39.33 39.44 1s1h h ASP 116 CO -0.00 0.03 -0.78 0.27 -1.72 0.00 0.00 179.24 177.03 1s1h s ILE 117 N -2.62 0.69 0.48 0.35 -4.36 0.12 -2.49 121.20 113.36 1s1h s ILE 117 Ca -0.05 -0.09 -0.21 0.00 -0.26 0.00 0.00 60.65 60.05 1s1h s ILE 117 Cb 0.00 -0.77 -0.08 0.00 1.25 0.00 0.00 42.46 42.86 1s1h s ILE 117 CO 0.14 0.31 1.05 -2.84 0.24 0.00 0.00 174.94 173.84 1s1h s PRO 118 N 1.74 3.82 0.00 0.37 0.02 -1.26 -3.26 135.00 136.44 1s1h s PRO 118 Ca 0.03 1.41 0.00 0.00 0.02 0.00 0.00 61.00 62.46 1s1h s PRO 118 Cb -0.13 -2.15 0.00 0.00 0.02 0.00 0.00 34.50 32.24 1s1h s PRO 118 CO -0.06 -0.42 0.00 0.41 -0.33 0.00 0.00 177.00 176.60 1s1h n GLY 119 N -0.12 0.79 3.26 0.52 0.00 -1.26 -5.01 105.19 103.36 1s1h n GLY 119 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 1s1h n GLY 119 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1s1h s VAL 120 N -2.30 4.03 0.13 1.61 -7.23 -1.20 -4.52 120.40 110.92 1s1h s VAL 120 Ca 0.00 -1.36 0.07 0.00 -1.81 0.00 0.00 61.98 58.88 1s1h s VAL 120 Cb 0.00 -3.44 -0.20 0.00 0.56 0.00 0.00 36.38 33.30 1s1h s VAL 120 CO 0.00 -0.42 1.30 0.03 -0.31 0.00 0.00 175.10 175.69 1s1h h ARG 121 N 8.32 0.01 -4.94 4.82 2.47 -1.80 -2.56 114.38 120.70 1s1h h ARG 121 Ca -0.22 -0.01 -0.32 0.00 -1.26 0.00 0.00 59.98 58.17 1s1h h ARG 121 Cb 1.08 0.00 -0.15 0.00 -1.65 0.00 0.00 29.97 29.26 1s1h h ARG 121 CO 0.71 0.98 -0.67 -0.06 0.56 0.00 0.00 179.97 181.49 1s1h s PHE 122 N -2.76 1.33 0.13 3.04 0.40 -1.01 -1.68 117.98 117.43 1s1h s PHE 122 Ca 0.01 -0.94 0.06 0.00 -0.60 0.00 0.00 56.93 55.46 1s1h s PHE 122 Cb 0.10 -0.75 -0.04 0.00 0.51 0.00 0.00 43.02 42.84 1s1h s PHE 122 CO 0.82 -0.10 -0.01 0.15 0.70 0.00 0.00 175.22 176.77 1s1h s LYS 123 N -3.87 2.42 0.01 0.44 1.02 -1.13 -1.07 119.74 117.56 1s1h s LYS 123 Ca 0.24 -0.99 -0.17 0.00 0.02 0.00 0.00 55.97 55.07 1s1h s LYS 123 Cb 0.05 -2.42 -0.06 0.00 -0.52 0.00 0.00 37.83 34.88 1s1h s LYS 123 CO 0.05 0.49 0.48 0.14 -0.92 0.00 0.00 175.35 175.59 1s1h s VAL 124 N -1.50 4.94 -0.36 3.17 -7.23 0.11 -1.51 120.40 118.02 1s1h s VAL 124 Ca 0.26 1.00 -0.18 0.00 -1.81 0.00 0.00 61.98 61.25 1s1h s VAL 124 Cb -0.10 -3.80 0.00 0.00 0.56 0.00 0.00 36.38 33.04 1s1h s VAL 124 CO 0.18 0.53 0.52 0.54 -0.31 0.00 0.00 175.10 176.56 1s1h s VAL 125 N -0.83 5.01 -0.13 1.32 0.11 -0.23 -4.52 120.40 121.12 1s1h s VAL 125 Ca 0.26 0.26 0.03 0.00 -2.93 0.00 0.00 61.98 59.60 1s1h s VAL 125 Cb -0.18 -3.99 -0.03 0.00 -1.53 0.00 0.00 36.38 30.65 1s1h s VAL 125 CO 0.15 -0.26 0.12 2.29 -3.33 0.00 0.00 175.10 174.07 1s1h n LYS 126 N 5.77 5.74 -0.20 1.54 2.85 -1.26 -4.19 118.16 128.41 1s1h n LYS 126 Ca -0.05 -0.00 -0.07 0.00 -1.05 0.00 0.00 58.31 57.14 1s1h n LYS 126 Cb 0.49 -0.66 0.03 0.00 -0.65 0.00 0.00 35.03 34.23 1s1h n LYS 126 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 1s1h h VAL 127 N 0.00 1.20 -0.29 0.58 2.07 -1.86 0.71 116.25 118.65 1s1h h VAL 127 Ca 0.00 -0.54 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 1s1h h VAL 127 Cb 0.07 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 1s1h h VAL 127 CO 0.00 0.22 0.15 0.77 0.02 0.00 0.00 177.57 178.73 1s1h h SER 128 N 0.77 0.35 -1.61 0.57 4.64 -1.90 -3.45 113.55 112.91 1s1h h SER 128 Ca 0.20 -0.02 -0.24 0.00 -0.47 0.00 0.00 61.79 61.26 1s1h h SER 128 Cb 0.09 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1s1h h SER 128 CO -0.03 0.30 -0.30 0.61 -0.87 0.00 0.00 176.83 176.54 1s1h n GLY 129 N -1.37 -0.02 3.83 -0.77 0.00 0.25 -4.95 105.19 102.15 1s1h n GLY 129 Ca 0.01 -0.39 -0.37 0.00 0.00 0.00 0.00 46.02 45.27 1s1h n GLY 129 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s1h s VAL 130 N -2.58 4.85 0.00 1.61 1.01 -1.25 -4.84 120.40 119.21 1s1h s VAL 130 Ca 0.00 0.97 0.00 0.00 0.00 0.00 0.00 61.98 62.95 1s1h s VAL 130 Cb 0.00 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.59 1s1h s VAL 130 CO 0.00 0.44 0.00 -1.20 0.00 0.00 0.00 175.10 174.34 1s1h n SER 131 N 1.38 -0.42 -0.02 3.32 7.64 -1.26 -3.53 113.62 120.73 1s1h n SER 131 Ca -0.09 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.76 1s1h n SER 131 Cb 0.51 0.00 0.20 0.00 -1.01 0.00 0.00 64.21 63.92 1s1h n SER 131 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1s1h h LEU 132 N 0.00 0.57 -9.14 -3.43 -0.00 -1.71 -3.42 115.31 98.18 1s1h h LEU 132 Ca 0.00 -0.16 -0.56 0.00 -0.00 0.00 0.00 57.88 57.16 1s1h h LEU 132 Cb 0.00 -0.15 0.00 0.00 -0.00 0.00 0.00 40.66 40.51 1s1h h LEU 132 CO 0.00 0.74 1.32 -0.76 -0.00 0.00 0.00 178.44 179.74 1s1h s LEU 133 N -8.87 3.91 0.47 1.67 1.43 -1.23 -4.92 118.68 111.15 1s1h s LEU 133 Ca -0.08 2.13 -0.05 0.00 -1.03 0.00 0.00 54.13 55.11 1s1h s LEU 133 Cb 0.14 -3.52 -0.04 0.00 0.03 0.00 0.00 46.19 42.80 1s1h s LEU 133 CO 0.79 -1.47 0.77 0.00 0.23 0.00 0.00 176.35 176.67 1s1h s ALA 134 N 6.21 3.43 0.47 4.21 0.00 -1.26 -3.83 121.76 130.99 1s1h s ALA 134 Ca 0.90 -0.54 -0.13 0.00 0.00 0.00 0.00 51.96 52.19 1s1h s ALA 134 Cb -0.35 -2.55 -0.07 0.00 0.00 0.00 0.00 23.12 20.15 1s1h s ALA 134 CO 0.36 -0.33 0.89 -1.17 0.00 0.00 0.00 175.76 175.52 1s1h s LEU 135 N -4.71 3.70 0.17 0.00 2.96 -1.24 -4.80 118.68 114.76 1s1h s LEU 135 Ca 0.47 1.36 -0.30 0.00 -0.22 0.00 0.00 54.13 55.43 1s1h s LEU 135 Cb -0.10 -4.27 -0.08 0.00 0.50 0.00 0.00 46.19 42.23 1s1h s LEU 135 CO 0.44 -0.51 1.31 0.86 -1.32 0.00 0.00 176.35 177.13 1s1h s TRP 136 N -2.53 3.28 0.40 5.38 -0.11 -1.26 -4.96 118.94 119.13 1s1h s TRP 136 Ca 0.55 1.18 -0.13 0.00 1.22 0.00 0.00 56.10 58.91 1s1h s TRP 136 Cb -0.10 -3.60 -0.08 0.00 -1.50 0.00 0.00 33.47 28.20 1s1h s TRP 136 CO 0.32 -1.91 0.81 -1.59 -4.62 0.00 0.00 176.95 169.96 1s1h s LYS 137 N 0.24 3.90 -1.40 5.86 -2.85 -1.26 -4.10 119.74 120.14 1s1h s LYS 137 Ca 0.58 0.65 -0.02 0.00 -1.00 0.00 0.00 55.97 56.18 1s1h s LYS 137 Cb -0.36 -2.35 0.01 0.00 -2.06 0.00 0.00 37.83 33.08 1s1h s LYS 137 CO 0.36 -0.02 0.56 0.39 0.10 0.00 0.00 175.35 176.74 1s1h n GLU 138 N -1.02 -3.96 -3.07 1.78 1.02 -1.26 -4.90 120.64 109.24 1s1h n GLU 138 Ca 0.04 0.49 -0.41 0.00 -0.02 0.00 0.00 57.16 57.25 1s1h n GLU 138 Cb 0.54 -4.83 -0.06 0.00 -0.02 0.00 0.00 31.44 27.07 1s1h n GLU 138 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1s1h s LYS 139 N -6.39 3.90 0.19 3.49 2.47 -1.26 -4.89 119.74 117.25 1s1h s LYS 139 Ca 0.08 0.36 -0.09 0.00 -1.56 0.00 0.00 55.97 54.76 1s1h s LYS 139 Cb -0.04 -3.73 0.10 0.00 -1.46 0.00 0.00 37.83 32.70 1s1h s LYS 139 CO 0.86 -0.61 1.71 -0.22 0.16 0.00 0.00 175.35 177.25 1s1h h LYS 140 N 8.19 1.09 -7.25 4.03 3.64 -1.97 -3.45 116.57 120.85 1s1h h LYS 140 Ca -0.26 -0.26 -0.51 0.00 -1.27 0.00 0.00 60.65 58.35 1s1h h LYS 140 Cb 1.11 -0.14 0.10 0.00 -0.41 0.00 0.00 32.23 32.89 1s1h h LYS 140 CO 0.83 0.96 0.36 -1.83 -2.27 0.00 0.00 179.45 177.50 1s1h s GLU 141 N -5.32 2.72 0.55 1.90 -1.05 -1.26 -4.92 118.70 111.32 1s1h s GLU 141 Ca -0.12 1.25 0.30 0.00 -0.15 0.00 0.00 54.97 56.25 1s1h s GLU 141 Cb 0.14 -1.95 1.63 0.00 -0.44 0.00 0.00 34.13 33.51 1s1h s GLU 141 CO 0.84 -1.29 2.14 1.57 0.95 0.00 0.00 175.26 179.47 1s1h h LYS 142 N -0.35 0.00 0.00 -4.83 5.09 -2.05 -3.13 116.57 111.30 1s1h h LYS 142 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.29 1s1h h LYS 142 Cb 1.23 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.56 1s1h h LYS 142 CO 0.54 0.07 0.00 -2.30 -2.09 0.00 0.00 179.45 175.67 1s1h n PRO 143 N -3.60 0.00 -0.33 0.07 -0.01 -1.26 -1.50 135.00 128.37 1s1h n PRO 143 Ca -0.02 0.22 0.03 0.00 -0.01 0.00 0.00 63.50 63.72 1s1h n PRO 143 Cb 0.19 -1.50 0.18 0.00 -0.01 0.00 0.00 33.50 32.36 1s1h n PRO 143 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 1s1h h ARG 144 N 0.00 0.95 0.00 -0.52 3.08 -1.87 -3.51 114.38 112.51 1s1h h ARG 144 Ca 0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1s1h h ARG 144 Cb 0.00 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 29.84 1s1h h ARG 144 CO 0.00 0.63 0.00 0.43 -1.07 0.00 0.00 179.97 179.96