#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vsm s VAL 32 N 0.00 4.71 0.66 1.39 1.01 -1.26 -1.35 120.40 125.56 2vsm s VAL 32 Ca 0.00 0.91 -0.12 0.00 0.00 0.00 0.00 61.98 62.77 2vsm s VAL 32 Cb 0.00 -4.23 -0.01 0.00 0.00 0.00 0.00 36.38 32.14 2vsm s VAL 32 CO 0.00 -0.45 1.05 -0.76 0.00 0.00 0.00 175.10 174.94 2vsm s LEU 33 N 3.15 3.23 0.19 3.92 1.43 0.89 -4.96 118.68 126.52 2vsm s LEU 33 Ca 0.32 1.62 -0.32 0.00 -1.03 0.00 0.00 54.13 54.73 2vsm s LEU 33 Cb -0.13 -4.50 -0.11 0.00 0.03 0.00 0.00 46.19 41.48 2vsm s LEU 33 CO 0.17 -1.29 1.68 -0.70 0.23 0.00 0.00 176.35 176.44 2vsm s GLU 34 N -4.86 4.16 0.52 1.70 2.12 -1.26 -4.68 118.70 116.40 2vsm s GLU 34 Ca 0.59 2.52 -0.22 0.00 0.36 0.00 0.00 54.97 58.22 2vsm s GLU 34 Cb -0.14 -3.13 -0.06 0.00 0.26 0.00 0.00 34.13 31.06 2vsm s GLU 34 CO 0.51 -0.71 1.29 -2.30 -0.54 0.00 0.00 175.26 173.51 2vsm n PRO 35 N 4.09 1.68 -3.72 4.30 -0.02 -1.26 -4.77 135.00 135.30 2vsm n PRO 35 Ca 0.15 0.61 -0.37 0.00 -2.02 0.00 0.00 63.50 61.88 2vsm n PRO 35 Cb 0.36 -2.48 -0.12 0.00 -0.02 0.00 0.00 33.50 31.24 2vsm n PRO 35 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2vsm s ILE 36 N -1.29 4.65 -0.35 4.25 1.01 -0.06 -5.01 121.20 124.41 2vsm s ILE 36 Ca 0.69 -0.06 -0.21 0.00 0.00 0.00 0.00 60.65 61.07 2vsm s ILE 36 Cb -0.44 -3.18 0.00 0.00 0.01 0.00 0.00 42.46 38.85 2vsm s ILE 36 CO 0.51 0.32 0.69 -0.31 0.00 0.00 0.00 174.94 176.16 2vsm s TYR 37 N 1.57 3.15 -1.15 3.97 2.02 -1.26 -0.84 117.35 124.81 2vsm s TYR 37 Ca 0.06 0.49 -0.18 0.00 -0.37 0.00 0.00 57.07 57.07 2vsm s TYR 37 Cb -0.15 -3.20 0.11 0.00 -0.40 0.00 0.00 41.96 38.32 2vsm s TYR 37 CO 0.06 -0.63 1.49 -0.46 -1.57 0.00 0.00 175.55 174.43 2vsm s TRP 38 N 2.83 2.99 0.00 2.71 -0.11 0.65 -4.78 118.94 123.23 2vsm s TRP 38 Ca 0.27 -1.57 -0.28 0.00 1.22 0.00 0.00 56.10 55.74 2vsm s TRP 38 Cb -0.14 -4.54 0.07 0.00 -1.50 0.00 0.00 33.47 27.36 2vsm s TRP 38 CO 0.15 -1.66 0.63 1.21 -4.62 0.00 0.00 176.95 172.66 2vsm s ASN 39 N 3.88 -0.60 0.15 5.86 2.47 -1.26 -4.62 114.94 120.82 2vsm s ASN 39 Ca 0.45 0.49 0.26 0.00 0.42 0.00 0.00 52.86 54.49 2vsm s ASN 39 Cb -0.00 0.54 0.83 0.00 -1.45 0.00 0.00 41.25 41.17 2vsm s ASN 39 CO -0.01 -0.69 1.74 -1.54 -3.72 0.00 0.00 177.10 172.88 2vsm n SER 40 N 0.60 0.64 0.06 -4.21 3.41 -1.26 -1.86 113.62 111.00 2vsm n SER 40 Ca -0.19 0.48 0.12 0.00 -0.26 0.00 0.00 58.87 59.03 2vsm n SER 40 Cb 0.59 -0.60 0.47 0.00 -0.26 0.00 0.00 64.21 64.41 2vsm n SER 40 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2vsm n SER 41 N -2.08 0.39 -4.60 4.04 3.41 -1.26 -4.79 113.62 108.73 2vsm n SER 41 Ca 0.06 0.56 -0.43 0.00 -0.26 0.00 0.00 58.87 58.80 2vsm n SER 41 Cb 0.41 -0.66 -0.02 0.00 -0.26 0.00 0.00 64.21 63.68 2vsm n SER 41 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2vsm s ASN 42 N -3.74 6.03 0.39 4.04 3.84 -0.78 -4.86 114.94 119.87 2vsm s ASN 42 Ca 0.09 1.15 0.28 0.00 0.21 0.00 0.00 52.86 54.60 2vsm s ASN 42 Cb 0.13 -2.53 1.37 0.00 -0.55 0.00 0.00 41.25 39.67 2vsm s ASN 42 CO 0.47 -1.62 1.84 0.28 -2.79 0.00 0.00 177.10 175.28 2vsm h SER 43 N 12.17 0.00 0.79 -4.21 0.02 -1.90 -2.35 113.55 118.07 2vsm h SER 43 Ca -0.32 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.61 2vsm h SER 43 Cb 1.15 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.69 2vsm h SER 43 CO 1.05 0.00 -0.08 0.11 -1.14 0.00 0.00 176.83 176.77 2vsm h LYS 44 N 0.00 0.00 -6.08 3.45 1.57 -1.96 -3.35 116.57 110.20 2vsm h LYS 44 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 2vsm h LYS 44 Cb 0.17 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.39 2vsm h LYS 44 CO 0.00 0.08 1.29 -0.06 -0.57 0.00 0.00 179.45 180.19 2vsm s PHE 45 N -3.80 2.32 0.27 -1.35 0.08 -0.88 -3.90 117.98 110.72 2vsm s PHE 45 Ca -0.00 -0.37 -0.29 0.00 0.12 0.00 0.00 56.93 56.38 2vsm s PHE 45 Cb 0.10 -4.55 -0.09 0.00 -0.57 0.00 0.00 43.02 37.91 2vsm s PHE 45 CO 0.56 -1.95 1.19 -0.51 -0.10 0.00 0.00 175.22 174.42 2vsm s LEU 46 N 6.19 4.49 0.46 -0.37 1.43 -0.89 -4.83 118.68 125.16 2vsm s LEU 46 Ca 0.49 2.39 0.17 0.00 -1.03 0.00 0.00 54.13 56.15 2vsm s LEU 46 Cb -0.03 -3.63 1.14 0.00 0.03 0.00 0.00 46.19 43.70 2vsm s LEU 46 CO -0.03 -0.32 1.99 1.55 0.23 0.00 0.00 176.35 179.77 2vsm h PRO 47 N 4.09 0.27 0.09 1.29 0.13 -1.88 0.41 132.00 136.41 2vsm h PRO 47 Ca -0.47 -0.02 -0.24 0.00 -0.87 0.00 0.00 66.00 64.41 2vsm h PRO 47 Cb 1.22 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.28 2vsm h PRO 47 CO 0.69 0.18 -1.20 0.78 -0.23 0.00 0.00 178.00 178.22 2vsm h GLY 48 N 0.28 0.22 -0.32 1.56 0.00 -1.94 -3.42 103.07 99.45 2vsm h GLY 48 Ca 0.26 -0.57 0.00 0.00 0.00 0.00 0.00 47.33 47.02 2vsm h GLY 48 CO -0.06 0.50 -0.16 0.61 0.00 0.00 0.00 176.54 177.43 2vsm n GLN 49 N -4.07 2.35 0.00 4.80 10.64 -1.14 -5.04 117.38 124.93 2vsm n GLN 49 Ca -0.23 -0.49 0.00 0.00 -1.83 0.00 0.00 57.00 54.44 2vsm n GLN 49 Cb 0.83 -0.99 0.00 0.00 -0.86 0.00 0.00 30.24 29.21 2vsm n GLN 49 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2vsm n GLY 50 N 0.80 -0.01 3.52 2.61 0.00 0.12 -4.64 105.19 107.59 2vsm n GLY 50 Ca 0.03 -0.96 -0.41 0.00 0.00 0.00 0.00 46.02 44.67 2vsm n GLY 50 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2vsm s LEU 51 N 0.00 4.64 -0.17 0.99 0.20 0.55 -2.09 118.68 122.80 2vsm s LEU 51 Ca 0.00 -0.48 -0.06 0.00 0.69 0.00 0.00 54.13 54.28 2vsm s LEU 51 Cb 0.00 -2.23 -0.04 0.00 -0.43 0.00 0.00 46.19 43.49 2vsm s LEU 51 CO 0.00 -0.34 0.03 -0.69 -0.29 0.00 0.00 176.35 175.06 2vsm s VAL 52 N 1.85 4.52 0.09 1.68 1.01 -1.26 -0.82 120.40 127.47 2vsm s VAL 52 Ca 0.08 -0.13 0.06 0.00 0.00 0.00 0.00 61.98 61.99 2vsm s VAL 52 Cb -0.17 -3.02 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 2vsm s VAL 52 CO 0.11 0.47 -0.17 -0.76 0.00 0.00 0.00 175.10 174.76 2vsm s LEU 53 N 0.34 2.31 -0.61 3.92 1.02 0.26 -4.98 118.68 120.93 2vsm s LEU 53 Ca 0.01 -0.68 0.06 0.00 0.02 0.00 0.00 54.13 53.55 2vsm s LEU 53 Cb -0.13 -0.66 0.25 0.00 0.02 0.00 0.00 46.19 45.68 2vsm s LEU 53 CO 0.01 -0.04 0.73 -1.22 0.02 0.00 0.00 176.35 175.85 2vsm n TYR 54 N 1.07 3.24 -2.32 0.29 4.01 -1.26 -0.52 117.16 121.68 2vsm n TYR 54 Ca -0.20 -4.09 -0.37 0.00 -0.16 0.00 0.00 57.90 53.08 2vsm n TYR 54 Cb 0.54 -0.54 -0.02 0.00 -0.31 0.00 0.00 39.34 39.02 2vsm n TYR 54 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2vsm s PRO 55 N -2.36 3.87 0.11 -0.72 0.04 -1.25 -4.74 135.00 129.95 2vsm s PRO 55 Ca 0.40 1.73 0.02 0.00 0.04 0.00 0.00 61.00 63.19 2vsm s PRO 55 Cb 0.15 -2.47 -0.04 0.00 0.04 0.00 0.00 34.50 32.19 2vsm s PRO 55 CO -0.02 -0.44 0.23 -0.65 0.04 0.00 0.00 177.00 176.16 2vsm s GLN 56 N -2.61 3.39 0.21 4.56 -1.52 -1.26 0.02 119.66 122.44 2vsm s GLN 56 Ca 0.62 -0.55 -0.32 0.00 -1.95 0.00 0.00 55.36 53.15 2vsm s GLN 56 Cb -0.28 -2.97 -0.13 0.00 -0.22 0.00 0.00 33.01 29.41 2vsm s GLN 56 CO 0.34 0.56 1.53 -0.89 -0.25 0.00 0.00 175.29 176.58 2vsm n ILE 57 N -0.13 0.44 0.00 1.08 2.08 -1.26 -1.29 119.36 120.28 2vsm n ILE 57 Ca -0.06 -0.11 0.00 0.00 0.56 0.00 0.00 62.75 63.14 2vsm n ILE 57 Cb 0.53 -1.59 0.00 0.00 -0.75 0.00 0.00 39.64 37.83 2vsm n ILE 57 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2vsm n GLY 58 N 2.88 1.89 3.80 7.39 0.00 0.12 -4.98 105.19 116.29 2vsm n GLY 58 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 2vsm n GLY 58 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2vsm s ASP 59 N -1.98 4.73 0.07 1.61 1.01 -0.41 -4.20 116.67 117.49 2vsm s ASP 59 Ca 0.00 1.48 0.05 0.00 0.71 0.00 0.00 52.55 54.80 2vsm s ASP 59 Cb 0.00 -2.26 -0.03 0.00 1.01 0.00 0.00 42.92 41.64 2vsm s ASP 59 CO 0.00 -1.84 -0.15 -0.54 0.21 0.00 0.00 175.17 172.85 2vsm s LYS 60 N -5.07 0.89 -0.08 8.23 1.02 -0.46 -1.25 119.74 123.02 2vsm s LYS 60 Ca 0.60 -0.93 -0.05 0.00 0.02 0.00 0.00 55.97 55.61 2vsm s LYS 60 Cb -0.15 -0.92 0.03 0.00 -0.52 0.00 0.00 37.83 36.27 2vsm s LYS 60 CO 0.55 0.21 0.19 -1.17 -0.92 0.00 0.00 175.35 174.21 2vsm s LEU 61 N -1.60 0.90 -0.11 3.17 2.96 -0.12 -0.08 118.68 123.81 2vsm s LEU 61 Ca -0.00 0.39 -0.05 0.00 -0.22 0.00 0.00 54.13 54.25 2vsm s LEU 61 Cb -0.09 0.59 -0.04 0.00 0.50 0.00 0.00 46.19 47.15 2vsm s LEU 61 CO 0.02 -0.11 0.08 -1.81 -1.32 0.00 0.00 176.35 173.21 2vsm s ASP 62 N 0.70 5.90 -0.14 3.68 1.01 -1.26 -0.47 116.67 126.09 2vsm s ASP 62 Ca -0.05 0.33 0.02 0.00 0.71 0.00 0.00 52.55 53.56 2vsm s ASP 62 Cb -0.06 -1.82 0.01 0.00 1.01 0.00 0.00 42.92 42.05 2vsm s ASP 62 CO -0.04 0.39 -0.21 -0.63 0.21 0.00 0.00 175.17 174.90 2vsm s ILE 63 N -0.93 1.98 -0.05 0.77 1.01 0.33 -0.88 121.20 123.43 2vsm s ILE 63 Ca 0.14 -0.93 0.03 0.00 0.00 0.00 0.00 60.65 59.89 2vsm s ILE 63 Cb -0.12 -1.77 0.01 0.00 0.01 0.00 0.00 42.46 40.59 2vsm s ILE 63 CO 0.03 0.53 -0.12 -0.63 0.00 0.00 0.00 174.94 174.76 2vsm s ILE 64 N 0.93 1.04 -0.39 2.92 1.01 -0.02 -0.79 121.20 125.90 2vsm s ILE 64 Ca -0.05 -0.46 -0.17 0.00 0.00 0.00 0.00 60.65 59.98 2vsm s ILE 64 Cb -0.15 -0.94 0.01 0.00 0.01 0.00 0.00 42.46 41.39 2vsm s ILE 64 CO -0.04 0.33 0.45 0.00 0.00 0.00 0.00 174.94 175.67 2vsm s PRO 66 N 2.21 4.55 0.84 0.00 0.04 -1.26 -1.69 135.00 139.68 2vsm s PRO 66 Ca 0.14 1.90 -0.12 0.00 0.04 0.00 0.00 61.00 62.96 2vsm s PRO 66 Cb -0.16 -3.18 0.10 0.00 0.04 0.00 0.00 34.50 31.29 2vsm s PRO 66 CO 0.13 0.05 1.20 -1.59 0.04 0.00 0.00 177.00 176.83 2vsm s LYS 67 N -1.16 1.46 0.36 4.56 -2.85 -1.25 -4.86 119.74 116.00 2vsm s LYS 67 Ca 0.48 1.72 -0.25 0.00 -1.00 0.00 0.00 55.97 56.92 2vsm s LYS 67 Cb -0.34 -1.76 -0.09 0.00 -2.06 0.00 0.00 37.83 33.58 2vsm s LYS 67 CO 0.42 -2.34 1.03 0.54 0.10 0.00 0.00 175.35 175.09 2vsm s VAL 68 N -2.25 3.82 0.01 1.79 0.11 0.40 -4.99 120.40 119.29 2vsm s VAL 68 Ca 0.72 1.49 0.00 0.00 -2.93 0.00 0.00 61.98 61.26 2vsm s VAL 68 Cb -0.28 -3.81 0.00 0.00 -1.53 0.00 0.00 36.38 30.76 2vsm s VAL 68 CO 0.52 0.10 0.00 0.47 -3.33 0.00 0.00 175.10 172.86 2vsm n ASP 69 N 0.30 0.03 0.00 3.54 8.00 -1.26 -4.85 116.55 122.31 2vsm n ASP 69 Ca 0.03 0.02 0.00 0.00 0.71 0.00 0.00 54.79 55.56 2vsm n ASP 69 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.59 2vsm n ASP 69 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2vsm n VAL 73 N -2.57 0.00 -4.40 2.53 0.31 -1.26 -5.16 118.33 107.78 2vsm n VAL 73 Ca 0.00 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.12 2vsm n VAL 73 Cb 0.00 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 32.84 2vsm n VAL 73 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2vsm s GLY 74 N -0.41 2.18 0.61 2.92 0.00 -1.26 -5.17 107.32 106.19 2vsm s GLY 74 Ca 0.00 -1.68 -0.06 0.00 0.00 0.00 0.00 44.72 42.98 2vsm s GLY 74 CO 0.00 -1.68 0.92 -0.86 0.00 0.00 0.00 173.10 171.47 2vsm s GLN 75 N -3.82 2.75 0.32 2.90 -2.07 -1.26 -4.96 119.66 113.52 2vsm s GLN 75 Ca 0.33 -0.11 -0.29 0.00 -1.82 0.00 0.00 55.36 53.47 2vsm s GLN 75 Cb 0.05 -2.27 -0.11 0.00 -1.09 0.00 0.00 33.01 29.60 2vsm s GLN 75 CO 0.16 -0.81 1.45 -0.47 -1.32 0.00 0.00 175.29 174.30 2vsm s TYR 76 N -3.03 2.83 -0.26 9.60 5.04 -1.26 -4.99 117.35 125.28 2vsm s TYR 76 Ca 0.55 1.14 -0.09 0.00 -2.44 0.00 0.00 57.07 56.23 2vsm s TYR 76 Cb -0.11 -3.90 -0.04 0.00 0.35 0.00 0.00 41.96 38.27 2vsm s TYR 76 CO 0.45 -2.73 0.12 -1.21 -1.34 0.00 0.00 175.55 170.84 2vsm s GLU 77 N -1.38 3.79 -0.03 4.97 2.02 -1.26 -4.91 118.70 121.91 2vsm s GLU 77 Ca 0.55 -0.40 -0.20 0.00 0.02 0.00 0.00 54.97 54.93 2vsm s GLU 77 Cb -0.44 -3.46 -0.05 0.00 0.10 0.00 0.00 34.13 30.28 2vsm s GLU 77 CO 0.54 -0.17 0.58 0.71 0.02 0.00 0.00 175.26 176.94 2vsm s TYR 78 N 1.62 3.64 -0.10 1.61 2.02 -0.33 -4.88 117.35 120.93 2vsm s TYR 78 Ca 0.07 1.13 -0.12 0.00 -0.37 0.00 0.00 57.07 57.78 2vsm s TYR 78 Cb -0.15 -2.61 0.03 0.00 -0.40 0.00 0.00 41.96 38.83 2vsm s TYR 78 CO 0.07 0.30 0.31 0.71 -1.57 0.00 0.00 175.55 175.36 2vsm s TYR 79 N 0.05 -0.31 -0.19 2.71 2.02 -0.92 -3.20 117.35 117.51 2vsm s TYR 79 Ca 0.30 0.73 -0.07 0.00 -0.37 0.00 0.00 57.07 57.66 2vsm s TYR 79 Cb -0.17 0.11 -0.04 0.00 -0.40 0.00 0.00 41.96 41.46 2vsm s TYR 79 CO 0.16 -0.21 0.06 0.15 -1.57 0.00 0.00 175.55 174.14 2vsm s LYS 80 N -0.13 3.95 -0.07 -0.62 1.02 -1.26 -0.17 119.74 122.46 2vsm s LYS 80 Ca -0.03 -0.35 0.05 0.00 0.02 0.00 0.00 55.97 55.66 2vsm s LYS 80 Cb -0.03 -3.23 -0.01 0.00 -0.52 0.00 0.00 37.83 34.04 2vsm s LYS 80 CO 0.01 0.23 -0.23 0.08 -0.92 0.00 0.00 175.35 174.53 2vsm s VAL 81 N 0.48 2.27 0.04 3.17 1.01 -0.17 -4.39 120.40 122.81 2vsm s VAL 81 Ca 0.03 -0.98 0.04 0.00 0.00 0.00 0.00 61.98 61.07 2vsm s VAL 81 Cb -0.13 -1.85 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 2vsm s VAL 81 CO 0.01 0.57 -0.12 -0.31 0.00 0.00 0.00 175.10 175.25 2vsm s TYR 82 N -0.15 1.03 -0.14 5.22 2.02 -0.26 0.31 117.35 125.37 2vsm s TYR 82 Ca -0.03 -0.37 -0.22 0.00 -0.37 0.00 0.00 57.07 56.08 2vsm s TYR 82 Cb -0.14 -0.61 -0.03 0.00 -0.40 0.00 0.00 41.96 40.78 2vsm s TYR 82 CO 0.04 0.01 0.66 1.41 -1.57 0.00 0.00 175.55 176.09 2vsm s MET 83 N -1.19 4.31 0.28 -0.62 -2.45 -1.26 -1.24 119.30 117.14 2vsm s MET 83 Ca -0.01 0.73 0.02 0.00 -1.25 0.00 0.00 55.69 55.18 2vsm s MET 83 Cb -0.08 -3.52 -0.05 0.00 1.25 0.00 0.00 34.83 32.43 2vsm s MET 83 CO 0.01 -0.11 0.10 0.14 1.05 0.00 0.00 175.02 176.21 2vsm s VAL 84 N 1.44 0.64 0.72 10.11 -7.23 -0.19 -4.97 120.40 120.91 2vsm s VAL 84 Ca 0.32 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.40 2vsm s VAL 84 Cb -0.16 -2.63 0.05 0.00 0.56 0.00 0.00 36.38 34.19 2vsm s VAL 84 CO 0.13 0.00 1.06 1.51 -0.31 0.00 0.00 175.10 177.49 2vsm s ASP 85 N -3.37 4.95 0.21 4.85 1.47 -1.26 -3.81 116.67 119.71 2vsm s ASP 85 Ca 0.37 0.71 -0.10 0.00 1.18 0.00 0.00 52.55 54.70 2vsm s ASP 85 Cb 0.07 -1.39 0.29 0.00 -0.34 0.00 0.00 42.92 41.55 2vsm s ASP 85 CO 0.15 -1.56 1.71 0.50 0.68 0.00 0.00 175.17 176.64 2vsm h LYS 86 N -0.68 0.27 -0.61 2.11 3.64 -1.96 -1.64 116.57 117.70 2vsm h LYS 86 Ca -0.45 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 58.93 2vsm h LYS 86 Cb 1.30 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 33.02 2vsm h LYS 86 CO 0.63 0.18 0.39 -0.44 -2.27 0.00 0.00 179.45 177.93 2vsm h ASP 87 N 0.27 0.64 -0.67 4.20 3.32 -1.99 0.00 116.42 122.20 2vsm h ASP 87 Ca 0.31 -0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.33 2vsm h ASP 87 Cb 0.45 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 2vsm h ASP 87 CO -0.39 0.45 0.33 1.56 -1.72 0.00 0.00 179.24 179.48 2vsm h GLN 88 N 0.77 0.96 -0.23 3.56 4.20 -1.70 0.37 115.11 123.05 2vsm h GLN 88 Ca 0.24 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.82 2vsm h GLN 88 Cb -0.01 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 2vsm h GLN 88 CO -0.09 0.76 0.15 0.00 -0.67 0.00 0.00 178.83 178.98 2vsm h ALA 89 N 1.16 0.30 -0.66 3.87 0.00 -0.81 0.90 119.26 124.02 2vsm h ALA 89 Ca 0.23 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 2vsm h ALA 89 Cb 0.10 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2vsm h ALA 89 CO -0.03 -0.22 0.32 -0.44 0.00 0.00 0.00 179.25 178.88 2vsm h ASP 90 N 0.31 0.84 0.15 0.00 3.32 -0.66 -2.95 116.42 117.43 2vsm h ASP 90 Ca 0.09 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2vsm h ASP 90 Cb -0.02 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.31 2vsm h ASP 90 CO -0.02 0.70 -0.36 0.54 -1.72 0.00 0.00 179.24 178.38 2vsm n ARG 91 N -4.35 0.92 -3.82 3.56 1.74 0.09 -5.00 116.66 109.80 2vsm n ARG 91 Ca 0.06 -0.64 -0.37 0.00 -0.77 0.00 0.00 57.85 56.13 2vsm n ARG 91 Cb 0.13 -1.49 0.04 0.00 -1.02 0.00 0.00 32.46 30.12 2vsm n ARG 91 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2vsm s THR 93 N -3.48 0.58 0.18 0.00 -4.23 -0.86 -0.50 115.64 107.31 2vsm s THR 93 Ca 0.48 -0.59 0.10 0.00 -1.18 0.00 0.00 61.69 60.51 2vsm s THR 93 Cb -0.21 -0.54 -0.04 0.00 1.34 0.00 0.00 72.50 73.05 2vsm s THR 93 CO 0.90 -0.03 -0.17 0.27 -0.54 0.00 0.00 174.62 175.05 2vsm s ILE 94 N -0.59 2.78 0.13 2.99 -4.36 -0.63 -4.64 121.20 116.88 2vsm s ILE 94 Ca -0.01 -1.79 0.04 0.00 -0.26 0.00 0.00 60.65 58.63 2vsm s ILE 94 Cb -0.05 -2.34 -0.04 0.00 1.25 0.00 0.00 42.46 41.28 2vsm s ILE 94 CO 0.00 -0.08 0.10 -0.54 0.24 0.00 0.00 174.94 174.66 2vsm s LYS 95 N -2.65 2.83 0.45 0.37 1.02 -1.26 -4.87 119.74 115.63 2vsm s LYS 95 Ca 0.22 -0.82 0.21 0.00 0.02 0.00 0.00 55.97 55.60 2vsm s LYS 95 Cb -0.09 -2.65 1.17 0.00 -0.52 0.00 0.00 37.83 35.75 2vsm s LYS 95 CO 0.12 0.51 1.87 1.57 -0.92 0.00 0.00 175.35 178.50 2vsm h LYS 96 N 2.81 0.30 0.00 1.68 2.10 -2.01 -0.66 116.57 120.80 2vsm h LYS 96 Ca -0.47 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.16 2vsm h LYS 96 Cb 1.18 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 32.45 2vsm h LYS 96 CO 0.63 0.20 0.00 0.93 -2.00 0.00 0.00 179.45 179.21 2vsm h GLU 97 N 0.31 0.00 -7.03 0.07 3.07 -2.06 -3.45 114.58 105.49 2vsm h GLU 97 Ca 0.45 0.00 -0.45 0.00 -0.50 0.00 0.00 59.36 58.86 2vsm h GLU 97 Cb 1.27 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.18 2vsm h GLU 97 CO -0.14 0.00 0.36 -0.80 -1.40 0.00 0.00 179.01 177.03 2vsm s ASN 98 N -4.94 6.81 -0.07 1.42 0.02 -0.26 -5.06 114.94 112.86 2vsm s ASN 98 Ca -0.00 1.80 0.05 0.00 -1.02 0.00 0.00 52.86 53.69 2vsm s ASN 98 Cb 0.10 -2.55 -0.01 0.00 0.02 0.00 0.00 41.25 38.80 2vsm s ASN 98 CO 0.42 -0.45 -0.24 -0.89 0.02 0.00 0.00 177.10 175.96 2vsm s THR 99 N -2.02 2.09 0.55 1.60 2.01 -1.26 -4.99 115.64 113.62 2vsm s THR 99 Ca 0.62 -1.04 -0.20 0.00 0.31 0.00 0.00 61.69 61.37 2vsm s THR 99 Cb -0.13 -1.77 -0.05 0.00 0.01 0.00 0.00 72.50 70.56 2vsm s THR 99 CO 0.17 0.57 1.20 -2.84 -0.69 0.00 0.00 174.62 173.03 2vsm s PRO 100 N -0.01 3.22 0.09 4.92 0.02 -1.26 -4.70 135.00 137.26 2vsm s PRO 100 Ca -0.08 1.83 0.18 0.00 0.02 0.00 0.00 61.00 62.95 2vsm s PRO 100 Cb -0.15 -2.07 -0.11 0.00 0.02 0.00 0.00 34.50 32.18 2vsm s PRO 100 CO 0.05 -1.01 0.85 1.47 -0.33 0.00 0.00 177.00 178.03 2vsm n LEU 101 N -1.26 0.83 -3.93 -5.54 -0.00 0.15 -4.87 117.00 102.38 2vsm n LEU 101 Ca 0.12 0.35 -0.17 0.00 -0.00 0.00 0.00 56.01 56.31 2vsm n LEU 101 Cb 0.49 0.05 -0.15 0.00 -0.00 0.00 0.00 43.42 43.81 2vsm n LEU 101 CO 0.46 0.07 -0.40 -0.76 -0.00 0.00 0.00 177.39 176.76 2vsm s LEU 102 N -5.66 1.79 -0.63 1.47 1.43 -0.98 -4.81 118.68 111.29 2vsm s LEU 102 Ca -0.03 -0.09 0.05 0.00 -1.03 0.00 0.00 54.13 53.03 2vsm s LEU 102 Cb 0.09 -0.30 0.15 0.00 0.03 0.00 0.00 46.19 46.17 2vsm s LEU 102 CO 0.81 0.02 0.39 0.21 0.23 0.00 0.00 176.35 178.02 2vsm s ASN 103 N 0.19 4.61 -0.95 2.29 3.04 -1.26 -1.00 114.94 121.86 2vsm s ASN 103 Ca -0.02 -3.50 -0.19 0.00 0.04 0.00 0.00 52.86 49.19 2vsm s ASN 103 Cb -0.06 -1.64 0.12 0.00 -1.54 0.00 0.00 41.25 38.13 2vsm s ASN 103 CO -0.00 -0.15 1.20 0.00 -3.04 0.00 0.00 177.10 175.10 2vsm n ALA 105 N 6.96 2.65 -3.66 0.00 0.00 -1.26 -2.17 120.51 123.03 2vsm n ALA 105 Ca 0.26 -2.05 -0.29 0.00 0.00 0.00 0.00 53.44 51.36 2vsm n ALA 105 Cb 0.49 -0.68 -0.12 0.00 0.00 0.00 0.00 19.45 19.14 2vsm n ALA 105 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2vsm s LYS 106 N -0.39 1.39 0.57 0.00 1.02 -1.26 -5.01 119.74 116.05 2vsm s LYS 106 Ca 0.26 -2.26 0.29 0.00 0.02 0.00 0.00 55.97 54.29 2vsm s LYS 106 Cb 0.31 -2.28 1.47 0.00 -0.52 0.00 0.00 37.83 36.81 2vsm s LYS 106 CO -0.12 -1.24 1.90 -1.35 -0.92 0.00 0.00 175.35 173.61 2vsm h PRO 107 N 6.23 0.00 -0.50 -1.68 0.11 -1.96 -2.31 132.00 131.89 2vsm h PRO 107 Ca 0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 2vsm h PRO 107 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.00 2vsm h PRO 107 CO 0.49 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.88 2vsm n ASP 108 N -3.91 4.95 -3.73 -2.05 5.68 -1.26 -0.46 116.55 115.78 2vsm n ASP 108 Ca 0.11 -2.83 -0.16 0.00 -0.50 0.00 0.00 54.79 51.42 2vsm n ASP 108 Cb 0.75 -0.61 -0.16 0.00 -1.14 0.00 0.00 41.12 39.96 2vsm n ASP 108 CO 0.00 0.00 0.00 -1.58 -1.33 0.00 0.00 177.20 174.29 2vsm s GLN 109 N -2.54 0.01 0.26 0.11 0.74 -0.87 -4.95 119.66 112.42 2vsm s GLN 109 Ca 0.49 0.34 -0.30 0.00 0.05 0.00 0.00 55.36 55.95 2vsm s GLN 109 Cb 0.37 -0.28 -0.09 0.00 1.10 0.00 0.00 33.01 34.11 2vsm s GLN 109 CO 0.16 -0.22 1.29 -0.51 -0.55 0.00 0.00 175.29 175.46 2vsm s ASP 110 N 1.50 6.89 -0.15 6.67 1.01 -1.26 -3.91 116.67 127.41 2vsm s ASP 110 Ca -0.05 2.50 0.00 0.00 0.71 0.00 0.00 52.55 55.72 2vsm s ASP 110 Cb -0.12 -2.63 -0.00 0.00 1.01 0.00 0.00 42.92 41.18 2vsm s ASP 110 CO -0.04 -0.49 -0.15 -0.63 0.21 0.00 0.00 175.17 174.06 2vsm s ILE 111 N -0.50 2.66 -0.03 0.77 1.01 -0.68 -4.94 121.20 119.49 2vsm s ILE 111 Ca 0.53 -0.77 0.07 0.00 0.00 0.00 0.00 60.65 60.47 2vsm s ILE 111 Cb -0.37 -2.12 -0.02 0.00 0.01 0.00 0.00 42.46 39.96 2vsm s ILE 111 CO 0.44 0.52 -0.24 -0.75 0.00 0.00 0.00 174.94 174.90 2vsm s LYS 112 N 0.81 2.14 -0.14 2.79 2.20 -1.26 -0.69 119.74 125.59 2vsm s LYS 112 Ca -0.05 -0.87 0.03 0.00 -0.36 0.00 0.00 55.97 54.71 2vsm s LYS 112 Cb -0.15 -1.97 0.01 0.00 -1.51 0.00 0.00 37.83 34.20 2vsm s LYS 112 CO -0.00 0.47 -0.22 0.12 -0.36 0.00 0.00 175.35 175.36 2vsm s PHE 113 N -0.42 2.65 -0.17 4.03 5.36 0.03 -4.99 117.98 124.46 2vsm s PHE 113 Ca 0.05 -1.32 -0.03 0.00 -0.96 0.00 0.00 56.93 54.66 2vsm s PHE 113 Cb -0.11 -1.80 -0.02 0.00 -0.34 0.00 0.00 43.02 40.75 2vsm s PHE 113 CO 0.01 -0.60 -0.05 0.99 -1.46 0.00 0.00 175.22 174.11 2vsm s THR 114 N 0.78 3.62 -0.11 0.12 2.01 -1.26 -0.51 115.64 120.27 2vsm s THR 114 Ca -0.08 -0.44 -0.01 0.00 0.31 0.00 0.00 61.69 61.47 2vsm s THR 114 Cb -0.16 -2.60 -0.03 0.00 0.01 0.00 0.00 72.50 69.73 2vsm s THR 114 CO -0.01 0.47 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.69 2vsm s ILE 115 N 0.75 3.68 -0.14 1.82 1.01 0.38 -4.98 121.20 123.72 2vsm s ILE 115 Ca -0.02 -0.46 -0.04 0.00 0.00 0.00 0.00 60.65 60.13 2vsm s ILE 115 Cb -0.15 -2.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.73 2vsm s ILE 115 CO 0.02 0.54 0.01 -0.75 0.00 0.00 0.00 174.94 174.76 2vsm s LYS 116 N -0.15 3.52 -1.07 2.79 2.20 -1.26 -0.95 119.74 124.82 2vsm s LYS 116 Ca 0.02 -0.43 -0.21 0.00 -0.36 0.00 0.00 55.97 54.99 2vsm s LYS 116 Cb -0.13 -2.96 0.07 0.00 -1.51 0.00 0.00 37.83 33.31 2vsm s LYS 116 CO 0.03 0.42 1.45 -0.06 -0.36 0.00 0.00 175.35 176.83 2vsm s PHE 117 N -0.09 2.73 0.32 4.03 0.08 -0.38 -4.85 117.98 119.83 2vsm s PHE 117 Ca 0.04 -1.15 -0.10 0.00 0.12 0.00 0.00 56.93 55.83 2vsm s PHE 117 Cb -0.13 -4.62 0.04 0.00 -0.57 0.00 0.00 43.02 37.74 2vsm s PHE 117 CO 0.02 -1.81 0.61 0.00 -0.10 0.00 0.00 175.22 173.94 2vsm n GLN 118 N 8.24 0.88 0.07 0.44 10.64 -1.26 0.12 117.38 136.50 2vsm n GLN 118 Ca 0.35 -1.93 -0.02 0.00 -1.83 0.00 0.00 57.00 53.57 2vsm n GLN 118 Cb 0.49 2.29 -0.06 0.00 -0.86 0.00 0.00 30.24 32.10 2vsm n GLN 118 CO 0.00 0.00 0.00 0.93 -1.83 0.00 0.00 177.06 176.16 2vsm h GLU 119 N 0.00 0.00 -5.95 2.61 5.08 -1.89 -2.63 114.58 111.81 2vsm h GLU 119 Ca -0.27 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.49 2vsm h GLU 119 Cb 1.02 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.23 2vsm h GLU 119 CO 0.34 0.56 -0.49 -0.06 -1.00 0.00 0.00 179.01 178.36 2vsm s PHE 120 N -2.84 3.51 0.08 4.33 0.08 -1.26 -4.84 117.98 117.04 2vsm s PHE 120 Ca 0.00 0.22 -0.27 0.00 0.12 0.00 0.00 56.93 57.00 2vsm s PHE 120 Cb 0.09 -1.74 0.09 0.00 -0.57 0.00 0.00 43.02 40.88 2vsm s PHE 120 CO 0.79 0.57 1.11 -1.54 -0.10 0.00 0.00 175.22 176.05 2vsm s SER 121 N -2.69 -0.12 0.00 1.36 1.04 -1.26 -4.96 113.70 107.08 2vsm s SER 121 Ca 0.35 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.49 2vsm s SER 121 Cb -0.12 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.33 2vsm s SER 121 CO 0.28 -0.63 0.92 -2.65 0.98 0.00 0.00 173.24 172.14 2vsm n PRO 122 N -0.49 0.98 -2.54 4.02 -0.02 -1.26 -4.86 135.00 130.82 2vsm n PRO 122 Ca -0.07 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.00 2vsm n PRO 122 Cb 0.62 -1.06 -0.04 0.00 -0.02 0.00 0.00 33.50 33.00 2vsm n PRO 122 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2vsm s ASN 123 N -0.91 7.26 0.00 2.55 3.84 -1.26 -4.94 114.94 121.47 2vsm s ASN 123 Ca 0.00 1.97 0.24 0.00 0.21 0.00 0.00 52.86 55.28 2vsm s ASN 123 Cb 0.00 -2.59 0.22 0.00 -0.55 0.00 0.00 41.25 38.33 2vsm s ASN 123 CO 0.00 -0.28 1.27 0.18 -2.79 0.00 0.00 177.10 175.49 2vsm n LEU 124 N 3.07 3.05 -0.70 3.21 4.77 -1.26 -4.38 117.00 124.76 2vsm n LEU 124 Ca 0.05 -1.07 0.13 0.00 -0.03 0.00 0.00 56.01 55.09 2vsm n LEU 124 Cb 0.47 -0.03 0.33 0.00 -2.33 0.00 0.00 43.42 41.86 2vsm n LEU 124 CO 0.54 0.53 0.76 0.79 -1.33 0.00 0.00 177.39 178.68 2vsm n TRP 125 N 1.36 0.02 -0.74 -1.77 7.02 -1.26 -4.94 117.44 117.14 2vsm n TRP 125 Ca 0.15 -0.01 0.00 0.00 -1.02 0.00 0.00 57.50 56.62 2vsm n TRP 125 Cb 0.60 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.49 2vsm n TRP 125 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2vsm n GLY 126 N 1.26 0.59 3.71 6.99 0.00 -1.26 -5.04 105.19 111.44 2vsm n GLY 126 Ca 0.17 -0.36 -0.40 0.00 0.00 0.00 0.00 46.02 45.42 2vsm n GLY 126 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vsm s LEU 127 N 0.00 4.33 0.37 0.99 1.43 -1.26 -5.04 118.68 119.49 2vsm s LEU 127 Ca 0.00 1.33 -0.04 0.00 -1.03 0.00 0.00 54.13 54.39 2vsm s LEU 127 Cb 0.00 -3.24 0.02 0.00 0.03 0.00 0.00 46.19 43.00 2vsm s LEU 127 CO 0.00 -0.17 0.55 -1.83 0.23 0.00 0.00 176.35 175.12 2vsm s GLU 128 N 0.93 2.05 -0.07 1.70 -1.05 -1.26 -4.88 118.70 116.12 2vsm s GLU 128 Ca 0.42 -1.77 0.05 0.00 -0.15 0.00 0.00 54.97 53.51 2vsm s GLU 128 Cb -0.19 0.48 -0.00 0.00 -0.44 0.00 0.00 34.13 33.98 2vsm s GLU 128 CO 0.21 -0.87 -0.21 -0.06 0.95 0.00 0.00 175.26 175.27 2vsm s PHE 129 N -2.74 2.15 0.09 4.83 0.08 -0.99 -5.03 117.98 116.37 2vsm s PHE 129 Ca 0.28 -0.73 0.05 0.00 0.12 0.00 0.00 56.93 56.65 2vsm s PHE 129 Cb -0.02 -1.44 -0.03 0.00 -0.57 0.00 0.00 43.02 40.96 2vsm s PHE 129 CO 0.20 -0.27 -0.13 -0.65 -0.10 0.00 0.00 175.22 174.28 2vsm s GLN 130 N 0.14 0.88 0.69 0.44 -0.21 -1.26 -4.24 119.66 116.10 2vsm s GLN 130 Ca -0.09 -1.10 -0.16 0.00 0.02 0.00 0.00 55.36 54.03 2vsm s GLN 130 Cb -0.15 -0.74 0.02 0.00 1.00 0.00 0.00 33.01 33.14 2vsm s GLN 130 CO 0.05 0.14 1.24 -1.59 -2.12 0.00 0.00 175.29 173.01 2vsm s LYS 131 N -2.34 2.34 -1.63 2.91 -2.85 -1.26 -3.47 119.74 113.44 2vsm s LYS 131 Ca 0.03 1.87 -0.03 0.00 -1.00 0.00 0.00 55.97 56.85 2vsm s LYS 131 Cb -0.06 -1.84 0.01 0.00 -2.06 0.00 0.00 37.83 33.87 2vsm s LYS 131 CO 0.02 -1.71 0.30 0.09 0.10 0.00 0.00 175.35 174.15 2vsm n ASN 132 N -2.35 -5.83 -4.18 0.03 3.02 0.33 -4.97 115.26 101.31 2vsm n ASN 132 Ca 0.14 -0.14 -0.19 0.00 -0.03 0.00 0.00 54.58 54.36 2vsm n ASN 132 Cb 0.49 -4.79 -0.12 0.00 -0.61 0.00 0.00 39.78 34.75 2vsm n ASN 132 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2vsm s LYS 133 N -5.39 0.87 -0.12 3.52 1.02 -1.22 -5.00 119.74 113.42 2vsm s LYS 133 Ca 0.16 -0.96 -0.05 0.00 0.02 0.00 0.00 55.97 55.13 2vsm s LYS 133 Cb -0.07 -0.91 -0.04 0.00 -0.52 0.00 0.00 37.83 36.29 2vsm s LYS 133 CO 0.19 0.21 0.08 -0.51 -0.92 0.00 0.00 175.35 174.40 2vsm s ASP 134 N -1.70 5.90 0.06 2.83 1.01 -1.26 -1.57 116.67 121.94 2vsm s ASP 134 Ca -0.01 0.30 0.05 0.00 0.71 0.00 0.00 52.55 53.61 2vsm s ASP 134 Cb -0.10 -1.85 -0.03 0.00 1.01 0.00 0.00 42.92 41.95 2vsm s ASP 134 CO 0.02 0.36 -0.15 -0.31 0.21 0.00 0.00 175.17 175.31 2vsm s TYR 135 N -0.77 1.25 -0.04 4.23 2.02 -0.14 -4.97 117.35 118.93 2vsm s TYR 135 Ca 0.13 -0.42 0.04 0.00 -0.37 0.00 0.00 57.07 56.45 2vsm s TYR 135 Cb -0.12 -0.72 -0.00 0.00 -0.40 0.00 0.00 41.96 40.72 2vsm s TYR 135 CO 0.03 0.06 -0.16 0.71 -1.57 0.00 0.00 175.55 174.61 2vsm s TYR 136 N -1.11 1.59 -0.08 2.71 2.02 -1.25 -0.52 117.35 120.72 2vsm s TYR 136 Ca -0.00 -0.45 0.01 0.00 -0.37 0.00 0.00 57.07 56.26 2vsm s TYR 136 Cb -0.09 -1.08 0.02 0.00 -0.40 0.00 0.00 41.96 40.41 2vsm s TYR 136 CO 0.02 -0.15 -0.10 0.42 -1.57 0.00 0.00 175.55 174.17 2vsm s ILE 137 N 0.05 1.05 0.20 2.71 1.01 -0.01 -1.02 121.20 125.20 2vsm s ILE 137 Ca -0.03 -0.38 -0.00 0.00 0.00 0.00 0.00 60.65 60.23 2vsm s ILE 137 Cb -0.11 -1.01 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 2vsm s ILE 137 CO 0.02 0.35 0.09 0.27 0.00 0.00 0.00 174.94 175.67 2vsm s ILE 138 N 1.09 0.26 -0.02 2.92 -4.36 -0.37 -0.42 121.20 120.30 2vsm s ILE 138 Ca -0.07 -1.98 0.02 0.00 -0.26 0.00 0.00 60.65 58.36 2vsm s ILE 138 Cb -0.14 -2.42 0.00 0.00 1.25 0.00 0.00 42.46 41.15 2vsm s ILE 138 CO -0.01 -0.13 -0.08 -0.55 0.24 0.00 0.00 174.94 174.40 2vsm s SER 139 N -3.19 1.08 0.00 4.36 0.15 -1.23 -1.10 113.70 113.77 2vsm s SER 139 Ca 0.34 -0.16 0.16 0.00 0.70 0.00 0.00 55.95 56.99 2vsm s SER 139 Cb 0.07 -0.30 0.40 0.00 -1.71 0.00 0.00 66.02 64.48 2vsm s SER 139 CO 0.10 0.05 1.31 0.35 1.20 0.00 0.00 173.24 176.25 2vsm n THR 140 N 3.34 0.79 -1.38 6.45 -2.24 -1.26 -1.39 114.28 118.59 2vsm n THR 140 Ca -0.18 -0.89 -0.34 0.00 -2.27 0.00 0.00 64.05 60.36 2vsm n THR 140 Cb 0.54 0.68 0.10 0.00 -2.10 0.00 0.00 70.33 69.55 2vsm n THR 140 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2vsm s SER 141 N -1.09 4.13 0.00 3.42 0.01 -1.25 -3.63 113.70 115.28 2vsm s SER 141 Ca 0.32 2.32 0.19 0.00 1.31 0.00 0.00 55.95 60.10 2vsm s SER 141 Cb 0.17 -2.58 0.09 0.00 0.21 0.00 0.00 66.02 63.91 2vsm s SER 141 CO 0.23 -2.31 1.05 -0.46 0.41 0.00 0.00 173.24 172.17 2vsm n ASN 142 N -2.84 2.28 0.00 2.44 0.23 -1.21 -1.21 115.26 114.94 2vsm n ASN 142 Ca 0.13 -1.64 0.00 0.00 -0.53 0.00 0.00 54.58 52.54 2vsm n ASN 142 Cb 0.50 0.21 0.00 0.00 -2.08 0.00 0.00 39.78 38.41 2vsm n ASN 142 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2vsm n GLY 143 N 1.18 2.74 3.88 4.83 0.00 -1.19 -4.83 105.19 111.79 2vsm n GLY 143 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 2vsm n GLY 143 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2vsm s SER 144 N -0.74 6.57 0.26 1.61 1.04 -1.26 -1.19 113.70 119.99 2vsm s SER 144 Ca 0.00 0.90 -0.01 0.00 0.48 0.00 0.00 55.95 57.33 2vsm s SER 144 Cb 0.00 -2.22 0.53 0.00 0.10 0.00 0.00 66.02 64.42 2vsm s SER 144 CO 0.00 -0.16 1.77 0.25 0.98 0.00 0.00 173.24 176.09 2vsm h LEU 145 N 2.12 0.59 -1.66 2.42 5.85 -1.92 -1.95 115.31 120.76 2vsm h LEU 145 Ca -0.47 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.31 2vsm h LEU 145 Cb 1.18 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.19 2vsm h LEU 145 CO 0.67 0.27 -0.09 -0.33 -0.34 0.00 0.00 178.44 178.62 2vsm h GLU 146 N 0.68 0.00 -0.57 1.25 3.07 -1.99 -2.67 114.58 114.35 2vsm h GLU 146 Ca 0.46 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.32 2vsm h GLU 146 Cb 0.61 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.52 2vsm h GLU 146 CO -0.34 0.09 0.00 0.41 -1.40 0.00 0.00 179.01 177.77 2vsm n GLY 147 N -0.24 2.85 0.35 -3.84 0.00 -0.75 -4.66 105.19 98.90 2vsm n GLY 147 Ca -0.01 -0.77 0.04 0.00 0.00 0.00 0.00 46.02 45.28 2vsm n GLY 147 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2vsm h LEU 148 N 3.52 0.92 -3.01 0.99 5.85 -1.29 -2.40 115.31 119.89 2vsm h LEU 148 Ca 0.00 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2vsm h LEU 148 Cb 1.23 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.10 2vsm h LEU 148 CO 0.14 0.55 0.00 0.47 -0.34 0.00 0.00 178.44 179.26 2vsm n ASP 149 N -4.60 4.20 -4.70 1.25 8.00 -1.26 -4.05 116.55 115.39 2vsm n ASP 149 Ca 0.16 -2.30 -0.43 0.00 0.71 0.00 0.00 54.79 52.93 2vsm n ASP 149 Cb 0.25 -0.50 -0.02 0.00 -0.02 0.00 0.00 41.12 40.84 2vsm n ASP 149 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2vsm n ASN 150 N 1.04 3.07 -0.34 -2.24 3.02 -0.91 -4.93 115.26 113.99 2vsm n ASN 150 Ca 0.23 1.17 0.08 0.00 -0.03 0.00 0.00 54.58 56.02 2vsm n ASN 150 Cb 0.75 -1.49 -0.01 0.00 -0.61 0.00 0.00 39.78 38.41 2vsm n ASN 150 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vsm n GLN 151 N 1.57 1.66 -3.83 3.52 1.13 -1.26 -3.94 117.38 116.23 2vsm n GLN 151 Ca 0.08 -0.74 -0.12 0.00 -1.94 0.00 0.00 57.00 54.28 2vsm n GLN 151 Cb 0.34 -1.28 -0.12 0.00 0.11 0.00 0.00 30.24 29.29 2vsm n GLN 151 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 2vsm s GLU 152 N -1.99 0.21 5.33 -1.09 -6.30 -1.26 -1.60 118.70 112.00 2vsm s GLU 152 Ca 0.13 0.14 0.00 0.00 -2.50 0.00 0.00 54.97 52.74 2vsm s GLU 152 Cb 0.13 0.10 0.00 0.00 0.00 0.00 0.00 34.13 34.36 2vsm s GLU 152 CO 0.44 -0.03 0.00 0.41 0.02 0.00 0.00 175.26 176.10 2vsm n GLY 153 N 2.82 1.73 7.00 -1.50 0.00 0.34 -4.94 105.19 110.63 2vsm n GLY 153 Ca -0.14 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.31 2vsm n GLY 153 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vsm n GLY 154 N 0.00 0.98 0.27 -0.02 0.00 -1.24 -3.24 105.19 101.94 2vsm n GLY 154 Ca 0.00 -0.71 0.14 0.00 0.00 0.00 0.00 46.02 45.45 2vsm n GLY 154 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2vsm h VAL 155 N 0.00 0.45 -0.71 1.61 -1.51 -1.25 -0.36 116.25 114.48 2vsm h VAL 155 Ca 0.00 -0.56 0.09 0.00 -1.23 0.00 0.00 66.70 65.00 2vsm h VAL 155 Cb 0.00 1.39 -0.07 0.00 -2.13 0.00 0.00 31.29 30.48 2vsm h VAL 155 CO 0.00 0.11 0.36 0.00 -1.23 0.00 0.00 177.57 176.81 2vsm h GLN 157 N 0.62 0.05 0.00 0.00 4.15 -1.19 -3.07 115.11 115.66 2vsm h GLN 157 Ca 0.35 -0.08 -0.04 0.00 0.77 0.00 0.00 58.65 59.65 2vsm h GLN 157 Cb 0.35 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 2vsm h GLN 157 CO -0.26 1.04 -0.18 1.79 -1.93 0.00 0.00 178.83 179.29 2vsm h THR 158 N -0.86 0.31 0.00 2.39 1.35 -1.16 -3.37 112.91 111.56 2vsm h THR 158 Ca -0.25 -1.40 0.00 0.00 -0.55 0.00 0.00 66.41 64.21 2vsm h THR 158 Cb 1.32 2.12 0.00 0.00 -1.73 0.00 0.00 68.15 69.86 2vsm h THR 158 CO -0.10 0.17 0.00 0.54 -0.25 0.00 0.00 175.52 175.88 2vsm n ARG 159 N -3.15 0.12 -3.78 4.72 1.74 -0.58 -5.02 116.66 110.71 2vsm n ARG 159 Ca 0.03 -0.33 -0.26 0.00 -0.77 0.00 0.00 57.85 56.52 2vsm n ARG 159 Cb 0.59 -0.59 0.04 0.00 -1.02 0.00 0.00 32.46 31.47 2vsm n ARG 159 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2vsm n ALA 160 N -0.04 -1.59 -2.75 7.54 0.00 -0.71 -4.73 120.51 118.24 2vsm n ALA 160 Ca 0.00 0.08 -0.43 0.00 0.00 0.00 0.00 53.44 53.09 2vsm n ALA 160 Cb 0.30 -3.60 -0.01 0.00 0.00 0.00 0.00 19.45 16.14 2vsm n ALA 160 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2vsm s MET 161 N -6.29 3.94 -0.00 0.00 -1.94 -0.57 -4.11 119.30 110.34 2vsm s MET 161 Ca 0.39 -2.09 -0.10 0.00 -1.71 0.00 0.00 55.69 52.18 2vsm s MET 161 Cb -0.19 -5.28 0.01 0.00 2.01 0.00 0.00 34.83 31.38 2vsm s MET 161 CO 0.81 -2.02 0.19 -1.59 -0.01 0.00 0.00 175.02 172.40 2vsm s LYS 162 N 3.17 0.55 -0.10 2.03 -2.85 -1.26 -3.50 119.74 117.78 2vsm s LYS 162 Ca 0.47 -0.35 0.04 0.00 -1.00 0.00 0.00 55.97 55.12 2vsm s LYS 162 Cb 0.00 0.23 0.00 0.00 -2.06 0.00 0.00 37.83 36.01 2vsm s LYS 162 CO 0.01 -0.14 -0.22 0.42 0.10 0.00 0.00 175.35 175.52 2vsm s ILE 163 N -1.43 1.92 -0.27 3.79 1.01 0.44 -0.33 121.20 126.33 2vsm s ILE 163 Ca -0.14 -0.93 -0.06 0.00 0.00 0.00 0.00 60.65 59.51 2vsm s ILE 163 Cb -0.07 -1.67 -0.00 0.00 0.01 0.00 0.00 42.46 40.73 2vsm s ILE 163 CO 0.02 0.53 0.06 -0.22 0.00 0.00 0.00 174.94 175.33 2vsm s LEU 164 N 0.44 3.60 -0.38 2.97 2.96 -0.00 -0.83 118.68 127.44 2vsm s LEU 164 Ca -0.17 -0.55 -0.08 0.00 -0.22 0.00 0.00 54.13 53.11 2vsm s LEU 164 Cb -0.17 -1.86 0.06 0.00 0.50 0.00 0.00 46.19 44.71 2vsm s LEU 164 CO 0.07 -0.13 0.19 -0.04 -1.32 0.00 0.00 176.35 175.12 2vsm s MET 165 N 1.52 2.61 -1.00 1.98 -1.94 0.33 -0.58 119.30 122.22 2vsm s MET 165 Ca 0.04 -1.32 -0.14 0.00 -1.71 0.00 0.00 55.69 52.56 2vsm s MET 165 Cb -0.16 -3.65 0.21 0.00 2.01 0.00 0.00 34.83 33.24 2vsm s MET 165 CO 0.02 -0.82 1.08 0.15 -0.01 0.00 0.00 175.02 175.44 2vsm s LYS 166 N 1.42 3.86 0.10 2.03 1.02 0.32 -0.97 119.74 127.53 2vsm s LYS 166 Ca 0.01 -2.54 -0.31 0.00 0.02 0.00 0.00 55.97 53.16 2vsm s LYS 166 Cb -0.21 -4.70 -0.07 0.00 -0.52 0.00 0.00 37.83 32.33 2vsm s LYS 166 CO 0.03 -1.48 1.24 0.08 -0.92 0.00 0.00 175.35 174.30 2vsm s VAL 167 N 0.63 3.78 -1.39 3.17 1.01 -0.61 -2.71 120.40 124.28 2vsm s VAL 167 Ca 0.30 1.32 0.00 0.00 0.00 0.00 0.00 61.98 63.60 2vsm s VAL 167 Cb -0.07 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.46 2vsm s VAL 167 CO -0.07 0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.76 2vsm n GLY 168 N 3.06 1.39 3.86 4.51 0.00 0.10 -0.52 105.19 117.60 2vsm n GLY 168 Ca 0.08 -0.39 -0.21 0.00 0.00 0.00 0.00 46.02 45.50 2vsm n GLY 168 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2vsm s HIS 169 N -2.48 2.80 0.00 1.61 4.02 -1.10 -4.29 115.29 115.86 2vsm s HIS 169 Ca 0.00 -0.39 0.00 0.00 1.02 0.00 0.00 55.06 55.69 2vsm s HIS 169 Cb 0.00 -1.96 0.00 0.00 -1.02 0.00 0.00 32.58 29.60 2vsm s HIS 169 CO 0.00 0.05 0.00 1.58 1.02 0.00 0.00 174.74 177.39