#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aif s VAL 2 N 0.00 0.00 -0.32 3.84 -7.23 -1.26 -4.80 120.40 110.63 1aif s VAL 2 Ca 0.00 -0.03 0.02 0.00 -1.81 0.00 0.00 61.98 60.16 1aif s VAL 2 Cb 0.00 -2.06 0.19 0.00 0.56 0.00 0.00 36.38 35.07 1aif s VAL 2 CO 0.00 0.00 0.72 -0.54 -0.31 0.00 0.00 175.10 174.97 1aif s LYS 3 N -2.06 0.51 -0.20 4.82 1.02 -1.23 -5.00 119.74 117.60 1aif s LYS 3 Ca 0.16 0.25 -0.02 0.00 0.02 0.00 0.00 55.97 56.38 1aif s LYS 3 Cb 0.07 0.17 0.00 0.00 -0.52 0.00 0.00 37.83 37.55 1aif s LYS 3 CO -0.06 -0.88 -0.10 -0.51 -0.92 0.00 0.00 175.35 172.88 1aif s LEU 4 N 2.57 2.63 -0.18 3.17 1.02 -1.26 -2.12 118.68 124.52 1aif s LEU 4 Ca 0.15 -0.47 0.00 0.00 0.02 0.00 0.00 54.13 53.83 1aif s LEU 4 Cb -0.06 -1.65 0.04 0.00 0.02 0.00 0.00 46.19 44.54 1aif s LEU 4 CO -0.20 -0.00 -0.09 -1.58 0.02 0.00 0.00 176.35 174.50 1aif s GLN 5 N 1.34 1.83 -0.19 1.70 0.74 -1.23 -4.44 119.66 119.40 1aif s GLN 5 Ca 0.04 -0.66 -0.07 0.00 0.05 0.00 0.00 55.36 54.73 1aif s GLN 5 Cb -0.14 -2.19 -0.04 0.00 1.10 0.00 0.00 33.01 31.75 1aif s GLN 5 CO -0.06 -0.40 0.04 -1.83 -0.55 0.00 0.00 175.29 172.50 1aif s GLU 6 N 1.51 3.84 0.38 1.67 -1.05 -1.26 -1.98 118.70 121.81 1aif s GLU 6 Ca 0.01 -0.41 0.08 0.00 -0.15 0.00 0.00 54.97 54.50 1aif s GLU 6 Cb -0.15 -3.17 -0.07 0.00 -0.44 0.00 0.00 34.13 30.31 1aif s GLU 6 CO -0.08 0.18 0.03 0.45 0.95 0.00 0.00 175.26 176.78 1aif s SER 7 N 0.61 4.03 0.00 0.83 0.15 -1.19 -4.81 113.70 113.33 1aif s SER 7 Ca 0.02 -1.20 0.00 0.00 0.70 0.00 0.00 55.95 55.47 1aif s SER 7 Cb -0.13 -0.44 0.00 0.00 -1.71 0.00 0.00 66.02 63.74 1aif s SER 7 CO 0.02 -0.38 0.00 0.61 1.20 0.00 0.00 173.24 174.69 1aif n GLY 8 N -0.99 0.62 3.57 9.45 0.00 -1.26 -2.08 105.19 114.50 1aif n GLY 8 Ca -0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 1aif n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1aif s GLY 9 N -0.87 1.55 0.00 -0.02 0.00 -1.26 -4.74 107.32 101.98 1aif s GLY 9 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 44.72 44.01 1aif s GLY 9 CO 0.00 0.11 0.00 0.61 0.00 0.00 0.00 173.10 173.82 1aif n GLY 10 N -0.56 -0.51 3.24 0.20 0.00 -0.41 -4.99 105.19 102.16 1aif n GLY 10 Ca 0.10 -0.51 -0.13 0.00 0.00 0.00 0.00 46.02 45.48 1aif n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1aif s LEU 11 N 0.00 0.66 0.02 0.99 2.96 -1.26 -0.43 118.68 121.62 1aif s LEU 11 Ca 0.00 0.70 0.00 0.00 -0.22 0.00 0.00 54.13 54.62 1aif s LEU 11 Cb 0.00 1.20 -0.02 0.00 0.50 0.00 0.00 46.19 47.87 1aif s LEU 11 CO 0.00 -0.12 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.18 1aif s VAL 12 N 0.19 0.18 0.58 1.68 1.01 0.10 -4.92 120.40 119.22 1aif s VAL 12 Ca -0.00 -0.75 -0.20 0.00 0.00 0.00 0.00 61.98 61.03 1aif s VAL 12 Cb -0.02 -0.28 -0.04 0.00 0.00 0.00 0.00 36.38 36.03 1aif s VAL 12 CO 0.00 -0.36 1.26 0.00 0.00 0.00 0.00 175.10 176.00 1aif n GLN 13 N 1.90 1.38 -1.39 2.72 6.02 -1.26 -3.03 117.38 123.73 1aif n GLN 13 Ca -0.21 0.52 -0.35 0.00 -0.01 0.00 0.00 57.00 56.94 1aif n GLN 13 Cb 0.56 -2.48 0.10 0.00 1.02 0.00 0.00 30.24 29.44 1aif n GLN 13 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1aif n PRO 14 N -1.22 0.59 0.00 -1.09 -0.02 -1.25 -1.09 135.00 130.91 1aif n PRO 14 Ca 0.12 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 1aif n PRO 14 Cb 0.46 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 1aif n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1aif n GLY 15 N 0.85 2.88 3.50 -1.23 0.00 -0.38 -4.94 105.19 105.86 1aif n GLY 15 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 1aif n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aif n GLY 16 N -0.70 -1.48 3.75 -0.02 0.00 -0.25 -3.28 105.19 103.21 1aif n GLY 16 Ca 0.00 -0.78 -0.23 0.00 0.00 0.00 0.00 46.02 45.01 1aif n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1aif s SER 17 N -2.26 4.73 0.37 1.61 0.01 -1.26 -3.65 113.70 113.25 1aif s SER 17 Ca 0.61 -0.78 -0.06 0.00 1.31 0.00 0.00 55.95 57.04 1aif s SER 17 Cb -0.21 -0.72 0.02 0.00 0.21 0.00 0.00 66.02 65.32 1aif s SER 17 CO 0.64 -0.35 0.58 -0.04 0.41 0.00 0.00 173.24 174.48 1aif s MET 18 N -3.88 2.05 -0.47 12.44 -1.94 -1.04 -5.01 119.30 121.45 1aif s MET 18 Ca 0.39 -1.69 0.07 0.00 -1.71 0.00 0.00 55.69 52.74 1aif s MET 18 Cb -0.02 0.50 0.18 0.00 2.01 0.00 0.00 34.83 37.50 1aif s MET 18 CO 0.23 -0.89 0.64 0.21 -0.01 0.00 0.00 175.02 175.20 1aif s LYS 19 N -2.74 0.97 0.99 2.03 2.20 -1.26 -3.27 119.74 118.67 1aif s LYS 19 Ca 0.26 -1.00 -0.11 0.00 -0.36 0.00 0.00 55.97 54.76 1aif s LYS 19 Cb -0.02 -0.23 0.18 0.00 -1.51 0.00 0.00 37.83 36.25 1aif s LYS 19 CO 0.18 -1.30 1.07 1.28 -0.36 0.00 0.00 175.35 176.22 1aif n LEU 20 N 3.35 1.88 -3.99 5.43 7.99 -0.93 -4.74 117.00 125.99 1aif n LEU 20 Ca 0.17 0.26 -0.13 0.00 -0.01 0.00 0.00 56.01 56.31 1aif n LEU 20 Cb 0.54 -1.40 -0.02 0.00 -0.11 0.00 0.00 43.42 42.43 1aif n LEU 20 CO 0.01 -2.53 0.27 -0.44 -1.51 0.00 0.00 177.39 173.19 1aif s SER 21 N -2.54 0.59 -0.30 -1.43 0.01 -0.88 -1.10 113.70 108.05 1aif s SER 21 Ca 0.67 -1.35 -0.25 0.00 1.31 0.00 0.00 55.95 56.32 1aif s SER 21 Cb -0.23 0.73 0.20 0.00 0.21 0.00 0.00 66.02 66.92 1aif s SER 21 CO 0.60 -1.42 1.47 0.00 0.41 0.00 0.00 173.24 174.30 1aif s VAL 23 N -0.09 2.47 0.10 0.00 0.11 -0.84 -0.86 120.40 121.29 1aif s VAL 23 Ca 0.08 -0.99 -0.19 0.00 -2.93 0.00 0.00 61.98 57.95 1aif s VAL 23 Cb -0.05 -1.92 -0.07 0.00 -1.53 0.00 0.00 36.38 32.82 1aif s VAL 23 CO -0.16 0.56 0.60 0.00 -3.33 0.00 0.00 175.10 172.77 1aif s ALA 24 N -0.68 3.56 0.14 1.54 0.00 -0.80 -3.53 121.76 121.99 1aif s ALA 24 Ca 0.11 0.06 0.06 0.00 0.00 0.00 0.00 51.96 52.19 1aif s ALA 24 Cb -0.10 -2.67 -0.04 0.00 0.00 0.00 0.00 23.12 20.31 1aif s ALA 24 CO 0.00 0.39 -0.13 0.45 0.00 0.00 0.00 175.76 176.47 1aif s SER 25 N -1.21 1.97 0.00 0.00 0.15 -0.90 -4.81 113.70 108.90 1aif s SER 25 Ca 0.32 -0.90 0.00 0.00 0.70 0.00 0.00 55.95 56.07 1aif s SER 25 Cb -0.19 -0.05 0.00 0.00 -1.71 0.00 0.00 66.02 64.06 1aif s SER 25 CO 0.20 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.04 1aif n GLY 26 N 0.20 1.63 3.55 9.45 0.00 -1.26 -3.55 105.19 115.21 1aif n GLY 26 Ca -0.13 -0.08 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 1aif n GLY 26 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1aif n PHE 27 N 0.00 0.56 -2.73 1.61 -0.00 -1.26 -4.87 117.46 110.77 1aif n PHE 27 Ca 0.00 0.58 -0.05 0.00 -0.00 0.00 0.00 57.45 57.98 1aif n PHE 27 Cb 0.00 -2.14 0.03 0.00 -0.00 0.00 0.00 39.48 37.37 1aif n PHE 27 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.76 174.39 1aif n THR 28 N -0.65 0.00 -3.48 -2.13 5.66 -1.26 -5.08 114.28 107.34 1aif n THR 28 Ca 0.11 -0.94 -0.42 0.00 -3.05 0.00 0.00 64.05 59.74 1aif n THR 28 Cb 0.39 1.06 -0.04 0.00 -1.55 0.00 0.00 70.33 70.18 1aif n THR 28 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 1aif s PHE 29 N 0.77 3.75 0.00 1.09 0.08 -1.26 -4.94 117.98 117.48 1aif s PHE 29 Ca 0.29 -2.43 0.00 0.00 0.12 0.00 0.00 56.93 54.91 1aif s PHE 29 Cb 0.10 -3.58 0.00 0.00 -0.57 0.00 0.00 43.02 38.98 1aif s PHE 29 CO -0.11 -0.91 0.00 0.09 -0.10 0.00 0.00 175.22 174.19 1aif n ASN 30 N 3.44 0.00 -3.93 1.36 3.02 -1.26 -3.30 115.26 114.59 1aif n ASN 30 Ca 0.15 0.00 -0.27 0.00 -0.03 0.00 0.00 54.58 54.42 1aif n ASN 30 Cb 0.42 0.00 -0.17 0.00 -0.61 0.00 0.00 39.78 39.42 1aif n ASN 30 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1aif s ASN 31 N -0.53 2.29 0.00 6.41 0.01 -1.26 -4.93 114.94 116.94 1aif s ASN 31 Ca 0.00 -0.35 0.00 0.00 -0.71 0.00 0.00 52.86 51.80 1aif s ASN 31 Cb 0.00 -0.91 0.00 0.00 0.41 0.00 0.00 41.25 40.75 1aif s ASN 31 CO 0.00 -0.11 0.00 0.00 -1.51 0.00 0.00 177.10 175.48 1aif n TYR 32 N 4.91 0.00 -3.52 2.20 0.18 -1.21 -1.69 117.16 118.03 1aif n TYR 32 Ca -0.13 0.00 -0.12 0.00 1.88 0.00 0.00 57.90 59.53 1aif n TYR 32 Cb 0.50 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.43 1aif n TYR 32 CO 0.00 0.00 0.00 1.67 -2.08 0.00 0.00 176.86 176.45 1aif s TRP 33 N -0.99 -0.40 -0.01 -3.48 1.48 -0.65 -2.71 118.94 112.19 1aif s TRP 33 Ca 0.00 0.18 -0.14 0.00 -1.06 0.00 0.00 56.10 55.08 1aif s TRP 33 Cb 0.00 0.42 0.02 0.00 -1.16 0.00 0.00 33.47 32.75 1aif s TRP 33 CO 0.00 -0.77 0.29 -1.64 -4.06 0.00 0.00 176.95 170.77 1aif s MET 34 N -3.62 0.65 0.15 3.25 -1.94 -1.24 -2.48 119.30 114.08 1aif s MET 34 Ca 0.01 -0.24 -0.21 0.00 -1.71 0.00 0.00 55.69 53.54 1aif s MET 34 Cb 0.00 0.29 0.06 0.00 2.01 0.00 0.00 34.83 37.19 1aif s MET 34 CO -0.11 -0.18 0.53 -1.54 -0.01 0.00 0.00 175.02 173.71 1aif s SER 35 N -1.39 -0.45 -0.20 3.03 1.04 -1.03 -1.59 113.70 113.11 1aif s SER 35 Ca -0.13 -0.12 -0.05 0.00 0.48 0.00 0.00 55.95 56.13 1aif s SER 35 Cb -0.05 0.56 -0.02 0.00 0.10 0.00 0.00 66.02 66.60 1aif s SER 35 CO 0.03 -0.93 0.00 0.26 0.98 0.00 0.00 173.24 173.58 1aif s TRP 36 N -3.77 3.03 0.14 5.02 0.52 -1.21 -2.50 118.94 120.17 1aif s TRP 36 Ca 0.02 -0.49 0.06 0.00 0.02 0.00 0.00 56.10 55.71 1aif s TRP 36 Cb -0.00 -2.09 -0.04 0.00 -1.15 0.00 0.00 33.47 30.18 1aif s TRP 36 CO -0.12 -0.27 0.02 0.08 0.02 0.00 0.00 176.95 176.68 1aif s VAL 37 N 1.07 3.94 0.00 4.03 1.01 -0.78 -0.86 120.40 128.82 1aif s VAL 37 Ca 0.02 -1.22 -0.04 0.00 0.00 0.00 0.00 61.98 60.75 1aif s VAL 37 Cb -0.14 -2.95 -0.00 0.00 0.00 0.00 0.00 36.38 33.28 1aif s VAL 37 CO 0.01 -0.03 0.07 -0.60 0.00 0.00 0.00 175.10 174.55 1aif s ARG 38 N -2.75 0.33 -0.07 2.72 3.52 -0.68 0.16 118.95 122.19 1aif s ARG 38 Ca 0.27 -0.35 -0.03 0.00 -0.13 0.00 0.00 55.73 55.50 1aif s ARG 38 Cb -0.10 0.13 0.04 0.00 -1.56 0.00 0.00 34.95 33.46 1aif s ARG 38 CO 0.19 -0.07 0.13 -1.14 -0.81 0.00 0.00 175.30 173.61 1aif s GLN 39 N -1.07 0.01 0.19 5.12 0.74 -0.30 -1.01 119.66 123.34 1aif s GLN 39 Ca -0.12 0.49 0.07 0.00 0.05 0.00 0.00 55.36 55.85 1aif s GLN 39 Cb -0.07 -0.32 -0.05 0.00 1.10 0.00 0.00 33.01 33.68 1aif s GLN 39 CO 0.00 -0.29 -0.14 -1.54 -0.55 0.00 0.00 175.29 172.77 1aif s SER 40 N 2.11 2.37 0.49 6.67 1.04 -1.21 -1.87 113.70 123.31 1aif s SER 40 Ca 0.02 -1.00 0.14 0.00 0.48 0.00 0.00 55.95 55.59 1aif s SER 40 Cb -0.12 -0.11 1.18 0.00 0.10 0.00 0.00 66.02 67.08 1aif s SER 40 CO -0.05 -0.20 2.12 1.55 0.98 0.00 0.00 173.24 177.64 1aif h PRO 41 N 2.69 0.13 -0.73 4.02 0.13 -1.91 0.23 132.00 136.56 1aif h PRO 41 Ca -0.38 -0.01 0.01 0.00 -0.87 0.00 0.00 66.00 64.75 1aif h PRO 41 Cb 1.21 -0.03 -0.04 0.00 0.13 0.00 0.00 31.00 32.28 1aif h PRO 41 CO 0.61 0.08 0.49 0.93 -0.23 0.00 0.00 178.00 179.88 1aif h GLU 42 N 0.13 0.96 0.00 0.86 5.08 -1.96 -3.32 114.58 116.33 1aif h GLU 42 Ca 0.05 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1aif h GLU 42 Cb 0.04 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.07 1aif h GLU 42 CO -0.01 0.64 -0.47 0.36 -1.00 0.00 0.00 179.01 178.53 1aif n LYS 43 N -4.58 3.96 0.00 2.33 2.85 -0.85 -5.10 118.16 116.78 1aif n LYS 43 Ca 0.07 -0.01 0.00 0.00 -1.05 0.00 0.00 58.31 57.32 1aif n LYS 43 Cb 0.02 -0.91 0.00 0.00 -0.65 0.00 0.00 35.03 33.49 1aif n LYS 43 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1aif n GLY 44 N 1.26 0.31 3.78 2.58 0.00 0.76 -4.73 105.19 109.14 1aif n GLY 44 Ca 0.01 -0.87 -0.38 0.00 0.00 0.00 0.00 46.02 44.77 1aif n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aif s LEU 45 N 0.00 4.51 -0.12 0.99 1.43 -1.26 -3.32 118.68 120.91 1aif s LEU 45 Ca 0.00 1.66 -0.06 0.00 -1.03 0.00 0.00 54.13 54.70 1aif s LEU 45 Cb 0.00 -3.49 0.05 0.00 0.03 0.00 0.00 46.19 42.78 1aif s LEU 45 CO 0.00 0.13 0.29 -0.70 0.23 0.00 0.00 176.35 176.30 1aif s GLU 46 N -1.45 0.24 -0.06 1.70 2.12 -0.18 -4.97 118.70 116.10 1aif s GLU 46 Ca 0.40 0.63 -0.30 0.00 0.36 0.00 0.00 54.97 56.06 1aif s GLU 46 Cb -0.21 -0.07 -0.06 0.00 0.26 0.00 0.00 34.13 34.05 1aif s GLU 46 CO 0.25 -0.18 1.67 -0.46 -0.54 0.00 0.00 175.26 176.00 1aif s TRP 47 N 1.51 1.95 -0.03 5.30 -0.00 -1.26 -1.68 118.94 124.73 1aif s TRP 47 Ca -0.08 0.19 -0.02 0.00 -0.00 0.00 0.00 56.10 56.19 1aif s TRP 47 Cb -0.10 -3.93 -0.01 0.00 -0.00 0.00 0.00 33.47 29.43 1aif s TRP 47 CO -0.10 -3.87 -0.04 0.28 -0.00 0.00 0.00 176.95 173.22 1aif n VAL 48 N 5.54 0.28 -3.57 5.86 0.31 -0.04 -4.93 118.33 121.77 1aif n VAL 48 Ca 0.17 0.44 0.00 0.00 -0.01 0.00 0.00 64.34 64.95 1aif n VAL 48 Cb 0.43 -1.67 0.00 0.00 -0.91 0.00 0.00 33.84 31.69 1aif n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1aif n ALA 49 N -2.56 0.00 0.00 3.52 0.00 -0.93 -4.16 120.51 116.38 1aif n ALA 49 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1aif n ALA 49 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.51 1aif n ALA 49 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1aif n GLU 50 N 0.00 0.00 -1.60 0.00 2.13 -1.22 -3.30 120.64 116.64 1aif n GLU 50 Ca 0.00 0.00 -0.16 0.00 0.66 0.00 0.00 57.16 57.66 1aif n GLU 50 Cb 0.00 0.00 0.10 0.00 0.27 0.00 0.00 31.44 31.81 1aif n GLU 50 CO 0.00 0.00 0.00 1.51 -0.41 0.00 0.00 177.13 178.23 1aif n ILE 51 N 0.00 0.00 -3.49 6.31 3.06 -0.62 -2.71 119.36 121.91 1aif n ILE 51 Ca 0.00 -0.85 -0.06 0.00 -2.50 0.00 0.00 62.75 59.34 1aif n ILE 51 Cb 0.00 -1.32 -0.07 0.00 0.54 0.00 0.00 39.64 38.79 1aif n ILE 51 CO 0.00 0.00 0.00 -0.60 -2.50 0.00 0.00 176.55 173.45 1aif s ARG 52 N -4.41 0.40 0.00 9.51 3.52 -0.17 -3.59 118.95 124.21 1aif s ARG 52 Ca 0.44 0.93 0.21 0.00 -0.13 0.00 0.00 55.73 57.19 1aif s ARG 52 Cb -0.02 0.18 -0.02 0.00 -1.56 0.00 0.00 34.95 33.53 1aif s ARG 52 CO 0.30 -0.42 1.04 -0.11 -0.81 0.00 0.00 175.30 175.30 1aif n LEU 53 N 5.40 1.92 0.00 -0.88 7.94 -1.10 -3.72 117.00 126.55 1aif n LEU 53 Ca -0.06 -0.75 0.00 0.00 -1.11 0.00 0.00 56.01 54.09 1aif n LEU 53 Cb 0.50 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.45 1aif n LEU 53 CO 0.02 0.36 0.00 -3.20 -1.11 0.00 0.00 177.39 173.46 1aif n ASN 54 N -0.11 0.00 0.00 1.96 2.85 -1.20 -3.92 115.26 114.85 1aif n ASN 54 Ca 0.09 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.56 1aif n ASN 54 Cb 0.44 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.46 1aif n ASN 54 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 1aif n SER 55 N -0.35 0.00 -4.68 1.20 7.64 -1.26 -4.87 113.62 111.30 1aif n SER 55 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 1aif n SER 55 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 1aif n SER 55 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1aif s ASP 56 N 0.00 6.67 0.00 6.43 2.15 -1.25 -4.91 116.67 125.75 1aif s ASP 56 Ca 0.00 2.34 0.00 0.00 0.43 0.00 0.00 52.55 55.32 1aif s ASP 56 Cb 0.00 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.07 1aif s ASP 56 CO 0.00 -0.87 0.43 -0.46 -0.17 0.00 0.00 175.17 174.10 1aif n ASN 57 N 6.03 0.00 -4.01 -0.34 6.94 -1.26 -4.54 115.26 118.08 1aif n ASN 57 Ca 0.16 0.43 -0.23 0.00 -0.02 0.00 0.00 54.58 54.91 1aif n ASN 57 Cb 0.42 -0.13 -0.16 0.00 -2.36 0.00 0.00 39.78 37.54 1aif n ASN 57 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 1aif s PHE 58 N -1.89 1.27 -0.03 -2.53 0.40 -1.26 -4.69 117.98 109.24 1aif s PHE 58 Ca 0.00 -0.42 -0.02 0.00 -0.60 0.00 0.00 56.93 55.89 1aif s PHE 58 Cb 0.00 -0.94 0.02 0.00 0.51 0.00 0.00 43.02 42.61 1aif s PHE 58 CO 0.00 -0.22 0.07 0.00 0.70 0.00 0.00 175.22 175.78 1aif s ALA 59 N 0.55 -0.13 0.33 5.36 0.00 -1.24 -4.99 121.76 121.63 1aif s ALA 59 Ca -0.11 0.31 0.04 0.00 0.00 0.00 0.00 51.96 52.20 1aif s ALA 59 Cb -0.14 -0.21 -0.06 0.00 0.00 0.00 0.00 23.12 22.71 1aif s ALA 59 CO 0.02 -0.07 0.06 0.95 0.00 0.00 0.00 175.76 176.72 1aif s THR 60 N 0.49 1.14 -0.28 0.00 -4.23 -1.26 -1.00 115.64 110.51 1aif s THR 60 Ca -0.04 -2.00 -0.19 0.00 -1.18 0.00 0.00 61.69 58.28 1aif s THR 60 Cb -0.05 -2.76 0.09 0.00 1.34 0.00 0.00 72.50 71.12 1aif s THR 60 CO -0.02 0.00 0.75 -1.00 -0.54 0.00 0.00 174.62 173.81 1aif s HIS 61 N -3.29 -0.91 0.00 3.99 3.76 -1.10 -5.00 115.29 112.74 1aif s HIS 61 Ca 0.35 1.91 0.00 0.00 -0.15 0.00 0.00 55.06 57.18 1aif s HIS 61 Cb 0.08 0.50 0.00 0.00 1.11 0.00 0.00 32.58 34.27 1aif s HIS 61 CO 0.15 -0.45 0.00 0.66 -0.85 0.00 0.00 174.74 174.26 1aif n TYR 62 N 3.72 0.00 -3.88 1.40 4.02 -1.26 -3.44 117.16 117.72 1aif n TYR 62 Ca -0.18 0.00 -0.07 0.00 -0.01 0.00 0.00 57.90 57.64 1aif n TYR 62 Cb 0.58 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.87 1aif n TYR 62 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1aif s ALA 63 N -2.00 -1.03 0.00 -0.72 0.00 -1.26 -4.98 121.76 111.77 1aif s ALA 63 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 51.96 51.54 1aif s ALA 63 Cb 0.00 0.89 0.00 0.00 0.00 0.00 0.00 23.12 24.01 1aif s ALA 63 CO 0.00 -1.00 0.00 -0.85 0.00 0.00 0.00 175.76 173.91 1aif n GLU 64 N -0.44 0.00 -3.18 0.00 0.28 -1.26 -1.52 120.64 114.51 1aif n GLU 64 Ca -0.04 0.00 -0.23 0.00 -0.16 0.00 0.00 57.16 56.74 1aif n GLU 64 Cb 0.60 0.00 -0.05 0.00 1.43 0.00 0.00 31.44 33.42 1aif n GLU 64 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1aif n SER 65 N -1.67 1.63 0.00 -1.84 7.64 -1.26 -4.68 113.62 113.44 1aif n SER 65 Ca 0.00 -3.08 0.00 0.00 1.01 0.00 0.00 58.87 56.80 1aif n SER 65 Cb 0.00 -0.62 0.00 0.00 -1.01 0.00 0.00 64.21 62.58 1aif n SER 65 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1aif n VAL 66 N 0.61 0.00 -0.69 0.44 0.24 -0.58 -5.08 118.33 113.27 1aif n VAL 66 Ca 0.25 0.00 -0.31 0.00 -2.04 0.00 0.00 64.34 62.24 1aif n VAL 66 Cb 0.54 0.00 0.16 0.00 -1.47 0.00 0.00 33.84 33.07 1aif n VAL 66 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 1aif n LYS 67 N -0.86 -0.54 0.00 7.34 2.85 -1.22 -1.44 118.16 124.29 1aif n LYS 67 Ca 0.00 -0.10 0.00 0.00 -1.05 0.00 0.00 58.31 57.16 1aif n LYS 67 Cb 0.00 -2.22 0.00 0.00 -0.65 0.00 0.00 35.03 32.16 1aif n LYS 67 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1aif n GLY 68 N 0.66 1.21 0.13 2.58 0.00 -1.26 -4.56 105.19 103.94 1aif n GLY 68 Ca 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.93 1aif n GLY 68 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1aif n LYS 69 N 0.00 0.73 -4.29 1.61 5.02 -0.52 -4.91 118.16 115.80 1aif n LYS 69 Ca 0.00 0.24 -0.16 0.00 -2.02 0.00 0.00 58.31 56.37 1aif n LYS 69 Cb 0.00 -1.68 -0.10 0.00 -0.02 0.00 0.00 35.03 33.23 1aif n LYS 69 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1aif s PHE 70 N -2.55 1.44 -0.04 2.13 0.08 -0.76 0.34 117.98 118.62 1aif s PHE 70 Ca -0.23 -0.77 -0.01 0.00 0.12 0.00 0.00 56.93 56.04 1aif s PHE 70 Cb 0.07 -0.76 0.03 0.00 -0.57 0.00 0.00 43.02 41.80 1aif s PHE 70 CO 0.75 0.10 0.06 0.96 -0.10 0.00 0.00 175.22 176.99 1aif s ILE 71 N -3.28 -0.09 0.49 0.64 -5.25 -0.75 -4.80 121.20 108.15 1aif s ILE 71 Ca 0.21 0.31 -0.19 0.00 -0.99 0.00 0.00 60.65 60.00 1aif s ILE 71 Cb 0.03 -0.14 -0.09 0.00 2.95 0.00 0.00 42.46 45.22 1aif s ILE 71 CO 0.04 0.13 0.99 -0.51 -1.79 0.00 0.00 174.94 173.80 1aif s ILE 72 N 1.63 4.29 -0.15 8.37 2.07 -1.26 -3.27 121.20 132.88 1aif s ILE 72 Ca -0.02 1.26 -0.30 0.00 -1.41 0.00 0.00 60.65 60.18 1aif s ILE 72 Cb -0.12 -3.60 0.13 0.00 0.13 0.00 0.00 42.46 38.99 1aif s ILE 72 CO -0.03 -0.47 0.99 -0.94 -1.91 0.00 0.00 174.94 172.58 1aif s SER 73 N -2.56 -0.36 -0.29 4.50 1.04 -1.00 -4.96 113.70 110.06 1aif s SER 73 Ca 0.62 0.35 -0.16 0.00 0.48 0.00 0.00 55.95 57.24 1aif s SER 73 Cb -0.11 0.31 0.17 0.00 0.10 0.00 0.00 66.02 66.48 1aif s SER 73 CO 0.24 -0.37 1.05 -0.60 0.98 0.00 0.00 173.24 174.54 1aif s ARG 74 N -1.35 0.28 -0.11 4.02 3.52 -1.26 -0.33 118.95 123.72 1aif s ARG 74 Ca -0.01 0.52 0.04 0.00 -0.13 0.00 0.00 55.73 56.15 1aif s ARG 74 Cb -0.01 0.13 0.00 0.00 -1.56 0.00 0.00 34.95 33.52 1aif s ARG 74 CO 0.00 -0.07 -0.23 -0.51 -0.81 0.00 0.00 175.30 173.68 1aif s ASP 75 N 1.54 3.11 0.24 -2.12 1.11 -1.15 -4.97 116.67 114.43 1aif s ASP 75 Ca -0.07 -0.57 -0.04 0.00 0.18 0.00 0.00 52.55 52.05 1aif s ASP 75 Cb -0.04 -1.42 0.44 0.00 1.07 0.00 0.00 42.92 42.97 1aif s ASP 75 CO -0.14 0.14 1.76 0.44 1.18 0.00 0.00 175.17 178.55 1aif h ASP 76 N 6.84 0.46 -0.76 0.27 5.19 -1.92 0.32 116.42 126.83 1aif h ASP 76 Ca -0.22 0.08 0.17 0.00 -0.62 0.00 0.00 57.03 56.45 1aif h ASP 76 Cb 1.23 0.01 -0.13 0.00 0.18 0.00 0.00 39.33 40.62 1aif h ASP 76 CO 0.49 0.22 0.03 0.77 -3.12 0.00 0.00 179.24 177.63 1aif h SER 77 N 0.59 -0.30 1.67 6.45 4.64 -1.95 0.93 113.55 125.58 1aif h SER 77 Ca 0.41 0.19 -0.02 0.00 -0.47 0.00 0.00 61.79 61.90 1aif h SER 77 Cb 0.53 0.33 -0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1aif h SER 77 CO -0.33 -0.17 -0.09 0.11 -0.87 0.00 0.00 176.83 175.48 1aif h LYS 78 N 0.12 0.00 0.00 4.77 1.57 -1.45 -3.47 116.57 118.11 1aif h LYS 78 Ca 0.42 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.20 1aif h LYS 78 Cb 0.74 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.05 1aif h LYS 78 CO -0.65 0.09 0.00 0.43 -0.57 0.00 0.00 179.45 178.75 1aif n SER 79 N -3.14 -3.27 -4.82 0.86 7.64 0.32 -4.99 113.62 106.22 1aif n SER 79 Ca 0.03 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.69 1aif n SER 79 Cb 0.51 -2.37 -0.04 0.00 -1.01 0.00 0.00 64.21 61.30 1aif n SER 79 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1aif s ARG 80 N -1.19 2.51 -0.25 1.43 0.52 -1.18 -1.90 118.95 118.89 1aif s ARG 80 Ca 0.00 -1.51 -0.02 0.00 -0.52 0.00 0.00 55.73 53.68 1aif s ARG 80 Cb 0.00 -2.31 0.08 0.00 0.52 0.00 0.00 34.95 33.24 1aif s ARG 80 CO 0.00 -0.03 0.07 -1.17 0.02 0.00 0.00 175.30 174.19 1aif s LEU 81 N -4.00 1.49 0.10 2.53 0.20 -0.04 -2.95 118.68 116.00 1aif s LEU 81 Ca 0.43 -1.19 -0.17 0.00 0.69 0.00 0.00 54.13 53.89 1aif s LEU 81 Cb -0.03 -0.66 -0.07 0.00 -0.43 0.00 0.00 46.19 45.00 1aif s LEU 81 CO 0.26 -0.36 0.54 -0.31 -0.29 0.00 0.00 176.35 176.18 1aif s TYR 82 N 1.80 3.71 -0.35 5.38 1.51 0.55 -3.11 117.35 126.84 1aif s TYR 82 Ca 0.04 1.15 -0.01 0.00 -1.01 0.00 0.00 57.07 57.24 1aif s TYR 82 Cb -0.17 -2.42 0.12 0.00 -0.11 0.00 0.00 41.96 39.39 1aif s TYR 82 CO -0.19 0.52 0.18 -1.17 -1.11 0.00 0.00 175.55 173.79 1aif s LEU 83 N -1.49 1.50 -0.15 -1.29 2.96 -0.26 -2.36 118.68 117.58 1aif s LEU 83 Ca 0.32 -1.98 -0.24 0.00 -0.22 0.00 0.00 54.13 52.01 1aif s LEU 83 Cb -0.17 -0.61 -0.02 0.00 0.50 0.00 0.00 46.19 45.88 1aif s LEU 83 CO 0.18 -0.35 0.75 -1.10 -1.32 0.00 0.00 176.35 174.52 1aif s GLN 84 N 1.24 4.30 -0.13 1.98 -0.21 -1.20 -2.19 119.66 123.46 1aif s GLN 84 Ca 0.14 0.88 0.02 0.00 0.02 0.00 0.00 55.36 56.43 1aif s GLN 84 Cb -0.21 -3.55 0.00 0.00 1.00 0.00 0.00 33.01 30.25 1aif s GLN 84 CO -0.12 -0.22 -0.20 0.00 -2.12 0.00 0.00 175.29 172.62 1aif s MET 85 N 1.80 3.12 0.17 2.91 0.23 -1.20 -1.81 119.30 124.52 1aif s MET 85 Ca 0.36 -0.82 0.08 0.00 -1.03 0.00 0.00 55.69 54.28 1aif s MET 85 Cb -0.17 -2.45 -0.04 0.00 -1.53 0.00 0.00 34.83 30.64 1aif s MET 85 CO 0.13 0.09 -0.18 -0.80 -2.03 0.00 0.00 175.02 172.24 1aif s ASN 86 N 0.58 2.65 -1.03 -1.18 -0.87 0.15 -2.49 114.94 112.75 1aif s ASN 86 Ca -0.12 -0.87 -0.05 0.00 -1.57 0.00 0.00 52.86 50.26 1aif s ASN 86 Cb -0.16 -0.15 0.01 0.00 -0.02 0.00 0.00 41.25 40.92 1aif s ASN 86 CO 0.03 -0.05 0.66 -0.24 -2.57 0.00 0.00 177.10 174.94 1aif n SER 87 N 0.26 -4.99 -4.76 -1.22 2.88 -1.21 -4.57 113.62 100.01 1aif n SER 87 Ca -0.13 -0.30 -0.41 0.00 -1.33 0.00 0.00 58.87 56.69 1aif n SER 87 Cb 0.57 -3.70 -0.00 0.00 -0.75 0.00 0.00 64.21 60.33 1aif n SER 87 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1aif n LEU 88 N -3.36 4.56 -4.69 2.46 4.77 -1.24 -4.66 117.00 114.84 1aif n LEU 88 Ca -0.03 1.22 -0.31 0.00 -0.03 0.00 0.00 56.01 56.86 1aif n LEU 88 Cb 0.56 -1.60 -0.09 0.00 -2.33 0.00 0.00 43.42 39.97 1aif n LEU 88 CO 0.40 0.06 -0.26 -0.13 -1.33 0.00 0.00 177.39 176.14 1aif s ARG 89 N -1.91 2.08 0.09 3.23 0.52 -1.26 -1.25 118.95 120.46 1aif s ARG 89 Ca 0.55 -2.28 -0.26 0.00 -0.52 0.00 0.00 55.73 53.21 1aif s ARG 89 Cb -0.49 -1.45 -0.15 0.00 0.52 0.00 0.00 34.95 33.38 1aif s ARG 89 CO 0.62 -0.28 1.70 0.00 0.02 0.00 0.00 175.30 177.36 1aif h ALA 90 N 1.54 -0.28 -0.74 2.13 0.00 -1.97 -1.97 119.26 117.96 1aif h ALA 90 Ca -0.43 -0.05 0.27 0.00 0.00 0.00 0.00 54.91 54.70 1aif h ALA 90 Cb 1.29 0.14 -0.14 0.00 0.00 0.00 0.00 17.79 19.08 1aif h ALA 90 CO 0.74 -0.66 0.26 0.39 0.00 0.00 0.00 179.25 179.98 1aif n GLU 91 N -5.23 -0.05 0.00 0.00 4.71 -1.26 -0.63 120.64 118.19 1aif n GLU 91 Ca -0.09 1.06 0.11 0.00 -0.01 0.00 0.00 57.16 58.24 1aif n GLU 91 Cb 0.15 -1.82 0.68 0.00 -1.01 0.00 0.00 31.44 29.44 1aif n GLU 91 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1aif n ASP 92 N -4.81 0.00 -4.75 1.62 8.00 -0.74 -4.83 116.55 111.04 1aif n ASP 92 Ca 0.24 -0.69 -0.41 0.00 0.71 0.00 0.00 54.79 54.64 1aif n ASP 92 Cb 0.82 -0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.88 1aif n ASP 92 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1aif s THR 93 N -2.02 2.81 -2.65 -3.53 2.01 0.20 -4.93 115.64 107.53 1aif s THR 93 Ca 0.34 0.70 0.00 0.00 0.31 0.00 0.00 61.69 63.04 1aif s THR 93 Cb 0.16 -3.45 0.00 0.00 0.01 0.00 0.00 72.50 69.22 1aif s THR 93 CO 0.27 0.12 0.00 0.61 -0.69 0.00 0.00 174.62 174.93 1aif n GLY 94 N 1.90 -0.95 3.49 4.40 0.00 -0.78 -4.53 105.19 108.71 1aif n GLY 94 Ca 0.05 -0.96 -0.34 0.00 0.00 0.00 0.00 46.02 44.78 1aif n GLY 94 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1aif s ILE 95 N -3.00 3.75 -0.33 -0.61 1.01 -0.78 -0.68 121.20 120.56 1aif s ILE 95 Ca 0.00 -0.41 -0.11 0.00 0.00 0.00 0.00 60.65 60.12 1aif s ILE 95 Cb 0.00 -2.62 -0.01 0.00 0.01 0.00 0.00 42.46 39.83 1aif s ILE 95 CO 0.00 0.51 0.20 -0.31 0.00 0.00 0.00 174.94 175.34 1aif s TYR 96 N 0.24 3.21 0.17 3.97 1.51 -1.16 -1.15 117.35 124.14 1aif s TYR 96 Ca -0.04 -0.36 -0.16 0.00 -1.01 0.00 0.00 57.07 55.50 1aif s TYR 96 Cb -0.14 -2.42 -0.07 0.00 -0.11 0.00 0.00 41.96 39.22 1aif s TYR 96 CO 0.03 -0.40 0.61 0.71 -1.11 0.00 0.00 175.55 175.40 1aif s TYR 97 N 1.68 3.62 -0.26 2.71 2.02 0.12 -3.85 117.35 123.39 1aif s TYR 97 Ca 0.05 1.17 -0.00 0.00 -0.37 0.00 0.00 57.07 57.92 1aif s TYR 97 Cb -0.17 -2.46 0.04 0.00 -0.40 0.00 0.00 41.96 38.97 1aif s TYR 97 CO 0.09 0.40 -0.07 0.00 -1.57 0.00 0.00 175.55 174.40 1aif s VAL 99 N 1.25 1.44 -0.03 0.00 0.11 -1.04 -2.40 120.40 119.73 1aif s VAL 99 Ca -0.03 -0.65 0.05 0.00 -2.93 0.00 0.00 61.98 58.42 1aif s VAL 99 Cb -0.18 -1.29 -0.01 0.00 -1.53 0.00 0.00 36.38 33.38 1aif s VAL 99 CO -0.04 0.42 -0.18 -1.48 -3.33 0.00 0.00 175.10 170.49 1aif s LEU 100 N 0.60 1.97 -0.03 2.54 0.05 -1.00 -2.46 118.68 120.36 1aif s LEU 100 Ca -0.15 -0.36 0.02 0.00 0.05 0.00 0.00 54.13 53.69 1aif s LEU 100 Cb -0.16 -1.00 0.00 0.00 -2.05 0.00 0.00 46.19 42.98 1aif s LEU 100 CO 0.05 0.19 -0.09 -0.60 -0.55 0.00 0.00 176.35 175.34 1aif s ARG 101 N -0.16 1.02 0.28 1.48 6.06 -1.03 -0.73 118.95 125.87 1aif s ARG 101 Ca 0.00 -0.31 -0.10 0.00 -2.50 0.00 0.00 55.73 52.82 1aif s ARG 101 Cb -0.10 -0.95 -0.07 0.00 0.06 0.00 0.00 34.95 33.89 1aif s ARG 101 CO 0.01 0.11 0.62 -1.25 -2.50 0.00 0.00 175.30 172.29 1aif s PRO 102 N 0.24 3.82 -0.32 5.12 0.04 -1.26 -1.63 135.00 141.01 1aif s PRO 102 Ca -0.04 0.35 -0.02 0.00 0.04 0.00 0.00 61.00 61.34 1aif s PRO 102 Cb -0.09 -2.57 0.15 0.00 0.04 0.00 0.00 34.50 32.03 1aif s PRO 102 CO 0.01 0.23 2.24 1.28 0.04 0.00 0.00 177.00 180.79 1aif n LEU 103 N -0.42 6.37 -4.67 -3.56 4.77 -0.68 -4.87 117.00 113.93 1aif n LEU 103 Ca 0.01 -3.41 -0.29 0.00 -0.03 0.00 0.00 56.01 52.29 1aif n LEU 103 Cb 0.53 -1.11 0.19 0.00 -2.33 0.00 0.00 43.42 40.69 1aif n LEU 103 CO 0.45 1.34 0.65 -0.36 -1.33 0.00 0.00 177.39 178.14 1aif s PHE 104 N -1.59 1.78 0.07 -1.77 0.40 -1.26 -4.91 117.98 110.70 1aif s PHE 104 Ca 0.37 0.83 -0.31 0.00 -0.60 0.00 0.00 56.93 57.22 1aif s PHE 104 Cb 0.26 -3.34 -0.18 0.00 0.51 0.00 0.00 43.02 40.27 1aif s PHE 104 CO -0.05 -3.08 1.64 -0.92 0.70 0.00 0.00 175.22 173.51 1aif h TYR 105 N -2.02 -0.66 -3.14 0.36 3.20 -2.01 -3.44 116.97 109.26 1aif h TYR 105 Ca -0.52 -0.02 -0.17 0.00 3.14 0.00 0.00 58.73 61.16 1aif h TYR 105 Cb 1.32 0.22 -0.26 0.00 1.54 0.00 0.00 36.73 39.55 1aif h TYR 105 CO -0.26 -0.40 -0.44 0.71 -1.64 0.00 0.00 178.16 176.12 1aif s TYR 106 N -6.04 -0.27 0.00 -3.82 2.02 -1.26 -5.11 117.35 102.87 1aif s TYR 106 Ca -0.17 0.66 0.00 0.00 -0.37 0.00 0.00 57.07 57.19 1aif s TYR 106 Cb 0.04 0.09 0.00 0.00 -0.40 0.00 0.00 41.96 41.68 1aif s TYR 106 CO 0.63 -0.14 0.00 0.00 -1.57 0.00 0.00 175.55 174.47 1aif n ALA 107 N 3.08 0.00 -2.30 3.71 0.00 -1.26 -5.18 120.51 118.57 1aif n ALA 107 Ca -0.14 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.14 1aif n ALA 107 Cb 0.58 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.93 1aif n ALA 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1aif s VAL 108 N -2.12 1.42 1.08 0.00 0.11 -1.26 -5.08 120.40 114.56 1aif s VAL 108 Ca 0.00 -2.13 -0.18 0.00 -2.93 0.00 0.00 61.98 56.75 1aif s VAL 108 Cb 0.00 -1.97 0.24 0.00 -1.53 0.00 0.00 36.38 33.12 1aif s VAL 108 CO 0.00 -0.65 1.21 1.51 -3.33 0.00 0.00 175.10 173.84 1aif s ASP 109 N -3.25 2.02 0.27 3.54 -4.77 -1.26 -4.72 116.67 108.51 1aif s ASP 109 Ca 0.20 0.45 0.05 0.00 -3.30 0.00 0.00 52.55 49.95 1aif s ASP 109 Cb 0.01 -0.60 -0.06 0.00 -1.09 0.00 0.00 42.92 41.19 1aif s ASP 109 CO 0.04 -3.43 -0.00 -0.31 0.70 0.00 0.00 175.17 172.17 1aif s TYR 110 N -3.44 1.81 0.18 2.11 1.51 0.09 -4.95 117.35 114.65 1aif s TYR 110 Ca 0.72 -0.86 -0.02 0.00 -1.01 0.00 0.00 57.07 55.90 1aif s TYR 110 Cb -0.07 -1.08 -0.04 0.00 -0.11 0.00 0.00 41.96 40.66 1aif s TYR 110 CO 0.54 0.08 0.13 -1.58 -1.11 0.00 0.00 175.55 173.61 1aif s TRP 111 N -3.25 0.99 0.00 2.71 0.52 -1.26 -2.37 118.94 116.28 1aif s TRP 111 Ca 0.31 -1.27 0.00 0.00 0.02 0.00 0.00 56.10 55.16 1aif s TRP 111 Cb 0.06 -0.47 0.00 0.00 -1.15 0.00 0.00 33.47 31.90 1aif s TRP 111 CO 0.12 -0.62 0.00 0.41 0.02 0.00 0.00 176.95 176.88 1aif n GLY 112 N -0.22 4.95 0.00 0.98 0.00 -1.01 -4.75 105.19 105.15 1aif n GLY 112 Ca -0.01 -1.70 0.01 0.00 0.00 0.00 0.00 46.02 44.32 1aif n GLY 112 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1aif n GLN 113 N 0.00 0.77 0.00 1.61 3.00 -1.26 -4.85 117.38 116.65 1aif n GLN 113 Ca 0.00 -0.03 0.00 0.00 -0.01 0.00 0.00 57.00 56.96 1aif n GLN 113 Cb 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 30.24 29.15 1aif n GLN 113 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1aif n GLY 114 N 2.39 -1.49 3.64 1.08 0.00 -1.26 -4.92 105.19 104.62 1aif n GLY 114 Ca -0.02 -2.08 -0.06 0.00 0.00 0.00 0.00 46.02 43.87 1aif n GLY 114 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1aif s THR 115 N 0.00 0.00 0.40 2.61 -4.23 -1.25 -4.77 115.64 108.40 1aif s THR 115 Ca 0.00 0.00 -0.25 0.00 -1.18 0.00 0.00 61.69 60.26 1aif s THR 115 Cb 0.00 -1.00 -0.09 0.00 1.34 0.00 0.00 72.50 72.75 1aif s THR 115 CO 0.00 0.00 1.11 -0.55 -0.54 0.00 0.00 174.62 174.64 1aif s SER 116 N -0.19 6.64 -0.07 3.99 0.15 -1.26 -2.99 113.70 119.97 1aif s SER 116 Ca 0.05 2.20 0.02 0.00 0.70 0.00 0.00 55.95 58.92 1aif s SER 116 Cb -0.04 -2.60 0.01 0.00 -1.71 0.00 0.00 66.02 61.68 1aif s SER 116 CO -0.10 -0.59 -0.12 -0.69 1.20 0.00 0.00 173.24 172.95 1aif s VAL 117 N -1.52 1.15 -0.20 4.45 1.01 0.14 -1.29 120.40 124.14 1aif s VAL 117 Ca 0.57 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 62.07 1aif s VAL 117 Cb -0.27 -1.05 0.05 0.00 0.00 0.00 0.00 36.38 35.11 1aif s VAL 117 CO 0.33 0.36 -0.07 -0.89 0.00 0.00 0.00 175.10 174.84 1aif s THR 118 N 0.66 1.38 -0.44 3.92 2.01 0.43 -1.87 115.64 121.73 1aif s THR 118 Ca -0.15 -0.92 -0.17 0.00 0.31 0.00 0.00 61.69 60.76 1aif s THR 118 Cb -0.16 -1.56 0.03 0.00 0.01 0.00 0.00 72.50 70.82 1aif s THR 118 CO 0.04 0.06 0.45 -0.69 -0.69 0.00 0.00 174.62 173.79 1aif s VAL 119 N 1.50 5.08 0.01 3.82 1.01 -1.26 -0.72 120.40 129.83 1aif s VAL 119 Ca -0.02 -0.44 -0.06 0.00 0.00 0.00 0.00 61.98 61.45 1aif s VAL 119 Cb -0.17 -4.08 -0.00 0.00 0.00 0.00 0.00 36.38 32.13 1aif s VAL 119 CO -0.07 -0.49 0.12 -0.55 0.00 0.00 0.00 175.10 174.11 1aif s SER 120 N 2.00 0.06 0.00 3.32 0.15 -1.17 -4.73 113.70 113.33 1aif s SER 120 Ca 0.12 -0.26 0.29 0.00 0.70 0.00 0.00 55.95 56.79 1aif s SER 120 Cb -0.18 0.19 1.18 0.00 -1.71 0.00 0.00 66.02 65.51 1aif s SER 120 CO 0.13 -0.38 1.89 -1.20 1.20 0.00 0.00 173.24 174.88 1aif n SER 121 N 1.41 0.05 -1.75 5.45 7.64 -1.26 -3.90 113.62 121.26 1aif n SER 121 Ca -0.23 0.45 0.00 0.00 1.01 0.00 0.00 58.87 60.10 1aif n SER 121 Cb 0.56 -0.45 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 1aif n SER 121 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1aif n ALA 122 N -1.50 0.00 -2.84 -0.43 0.00 -1.26 -4.95 120.51 109.52 1aif n ALA 122 Ca 0.07 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.42 1aif n ALA 122 Cb 0.34 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.69 1aif n ALA 122 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1aif s LYS 123 N 1.43 0.46 0.74 0.00 2.47 -1.26 -4.90 119.74 118.67 1aif s LYS 123 Ca 0.00 -0.67 -0.16 0.00 -1.56 0.00 0.00 55.97 53.59 1aif s LYS 123 Cb 0.00 0.17 0.00 0.00 -1.46 0.00 0.00 37.83 36.55 1aif s LYS 123 CO 0.00 -0.10 0.82 2.41 0.16 0.00 0.00 175.35 178.64 1aif n THR 124 N 1.18 2.22 -3.64 3.43 -1.04 -1.26 -4.83 114.28 110.34 1aif n THR 124 Ca -0.21 -0.35 -0.07 0.00 -2.04 0.00 0.00 64.05 61.38 1aif n THR 124 Cb 0.57 -0.96 -0.07 0.00 -1.82 0.00 0.00 70.33 68.05 1aif n THR 124 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1aif s THR 125 N -1.91 -0.07 0.87 12.58 2.01 -1.26 -4.91 115.64 122.94 1aif s THR 125 Ca 0.70 0.00 -0.11 0.00 0.31 0.00 0.00 61.69 62.58 1aif s THR 125 Cb -0.33 -1.00 0.11 0.00 0.01 0.00 0.00 72.50 71.29 1aif s THR 125 CO 0.54 0.00 1.09 -2.16 -0.69 0.00 0.00 174.62 173.40 1aif s PRO 126 N 1.73 1.49 0.26 4.92 0.04 -1.26 -0.79 135.00 141.38 1aif s PRO 126 Ca -0.10 0.82 -0.15 0.00 0.04 0.00 0.00 61.00 61.61 1aif s PRO 126 Cb -0.05 -1.84 -0.08 0.00 0.04 0.00 0.00 34.50 32.57 1aif s PRO 126 CO -0.20 -2.08 0.67 -1.25 0.04 0.00 0.00 177.00 174.18 1aif s PRO 127 N -4.97 4.02 -0.99 0.56 0.04 -1.24 -3.78 135.00 128.64 1aif s PRO 127 Ca 0.63 0.62 -0.05 0.00 0.04 0.00 0.00 61.00 62.24 1aif s PRO 127 Cb -0.17 -2.64 0.24 0.00 0.04 0.00 0.00 34.50 31.97 1aif s PRO 127 CO 0.56 0.28 0.92 -1.12 0.04 0.00 0.00 177.00 177.69 1aif s SER 128 N -2.07 6.57 1.16 6.66 0.01 -0.46 -4.98 113.70 120.60 1aif s SER 128 Ca 0.48 -3.66 -0.16 0.00 1.31 0.00 0.00 55.95 53.92 1aif s SER 128 Cb -0.12 -2.04 0.20 0.00 0.21 0.00 0.00 66.02 64.27 1aif s SER 128 CO 0.19 -0.23 0.49 0.52 0.41 0.00 0.00 173.24 174.62 1aif n VAL 129 N 2.51 0.00 -3.47 3.43 0.31 -1.26 -3.07 118.33 116.77 1aif n VAL 129 Ca 0.22 -0.39 -0.12 0.00 -0.01 0.00 0.00 64.34 64.04 1aif n VAL 129 Cb 0.38 -0.80 -0.03 0.00 -0.91 0.00 0.00 33.84 32.48 1aif n VAL 129 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 1aif s TYR 130 N -2.31 -0.51 0.42 3.52 2.02 -0.96 -4.89 117.35 114.64 1aif s TYR 130 Ca 0.62 0.49 -0.08 0.00 -0.37 0.00 0.00 57.07 57.73 1aif s TYR 130 Cb -0.19 0.52 -0.05 0.00 -0.40 0.00 0.00 41.96 41.84 1aif s TYR 130 CO 0.66 -0.70 0.76 -1.25 -1.57 0.00 0.00 175.55 173.45 1aif s PRO 131 N -2.89 3.69 -0.46 -1.71 0.04 -1.26 -2.69 135.00 129.72 1aif s PRO 131 Ca -0.01 0.35 0.09 0.00 0.04 0.00 0.00 61.00 61.47 1aif s PRO 131 Cb -0.01 -2.40 0.31 0.00 0.04 0.00 0.00 34.50 32.44 1aif s PRO 131 CO -0.06 -0.08 0.74 1.28 0.04 0.00 0.00 177.00 178.93 1aif n LEU 132 N -1.58 1.98 0.00 -3.56 4.77 0.11 -4.81 117.00 113.90 1aif n LEU 132 Ca 0.02 -5.17 -0.25 0.00 -0.03 0.00 0.00 56.01 50.57 1aif n LEU 132 Cb 0.54 0.21 0.25 0.00 -2.33 0.00 0.00 43.42 42.09 1aif n LEU 132 CO 0.49 2.23 0.29 0.00 -1.33 0.00 0.00 177.39 179.08 1aif n ALA 133 N 0.45 -4.40 0.01 -1.18 0.00 -1.26 -2.68 120.51 111.45 1aif n ALA 133 Ca 0.26 -1.28 -0.19 0.00 0.00 0.00 0.00 53.44 52.23 1aif n ALA 133 Cb 0.53 -0.11 -0.09 0.00 0.00 0.00 0.00 19.45 19.78 1aif n ALA 133 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1aif h PRO 134 N 0.00 0.72 0.00 0.00 0.11 -1.99 -3.46 132.00 127.38 1aif h PRO 134 Ca -0.33 -0.70 0.00 0.00 0.11 0.00 0.00 66.00 65.08 1aif h PRO 134 Cb 1.11 0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1aif h PRO 134 CO 0.20 1.29 0.00 0.41 -0.21 0.00 0.00 178.00 179.69 1aif n GLY 135 N 0.93 1.44 0.00 -0.55 0.00 -1.26 -4.77 105.19 100.99 1aif n GLY 135 Ca -0.10 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1aif n GLY 135 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1aif n SER 136 N 0.00 0.09 -3.15 1.61 3.41 -1.26 -5.09 113.62 109.23 1aif n SER 136 Ca 0.00 -0.52 0.06 0.00 -0.26 0.00 0.00 58.87 58.15 1aif n SER 136 Cb 0.00 0.10 -0.01 0.00 -0.26 0.00 0.00 64.21 64.04 1aif n SER 136 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1aif s ALA 137 N -0.10 -4.19 -0.57 7.33 0.00 -1.26 -5.12 121.76 117.85 1aif s ALA 137 Ca 0.00 1.36 -0.24 0.00 0.00 0.00 0.00 51.96 53.09 1aif s ALA 137 Cb 0.00 -2.78 0.05 0.00 0.00 0.00 0.00 23.12 20.38 1aif s ALA 137 CO 0.00 -1.88 0.92 0.00 0.00 0.00 0.00 175.76 174.81 1aif s ALA 138 N 2.99 3.17 -0.21 0.00 0.00 -1.26 -4.95 121.76 121.49 1aif s ALA 138 Ca 0.14 -1.38 -0.06 0.00 0.00 0.00 0.00 51.96 50.66 1aif s ALA 138 Cb -0.04 -3.73 -0.11 0.00 0.00 0.00 0.00 23.12 19.25 1aif s ALA 138 CO -0.16 -2.43 -0.24 1.04 0.00 0.00 0.00 175.76 173.97 1aif n GLN 139 N 7.42 0.47 -0.72 0.00 1.13 -1.26 -4.88 117.38 119.54 1aif n GLN 139 Ca 0.00 0.17 -0.09 0.00 -1.94 0.00 0.00 57.00 55.14 1aif n GLN 139 Cb 0.47 -1.32 -0.09 0.00 0.11 0.00 0.00 30.24 29.41 1aif n GLN 139 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1aif n THR 140 N -3.65 0.00 -3.31 5.09 -1.04 -1.26 -4.44 114.28 105.67 1aif n THR 140 Ca -0.40 -0.26 0.05 0.00 -2.04 0.00 0.00 64.05 61.40 1aif n THR 140 Cb 0.83 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 69.33 1aif n THR 140 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1aif n ASN 141 N 2.73 -5.61 -4.53 8.00 3.02 -1.26 -4.64 115.26 112.99 1aif n ASN 141 Ca 0.27 0.37 -0.42 0.00 -0.03 0.00 0.00 54.58 54.77 1aif n ASN 141 Cb 0.11 -1.07 -0.03 0.00 -0.61 0.00 0.00 39.78 38.18 1aif n ASN 141 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1aif s SER 142 N -4.62 6.25 0.00 6.41 1.04 -1.26 -4.91 113.70 116.61 1aif s SER 142 Ca 0.00 -0.47 0.00 0.00 0.48 0.00 0.00 55.95 55.96 1aif s SER 142 Cb 0.00 -2.50 0.00 0.00 0.10 0.00 0.00 66.02 63.62 1aif s SER 142 CO 0.00 -1.56 0.00 1.15 0.98 0.00 0.00 173.24 173.81 1aif n MET 143 N 8.42 0.00 -4.01 4.02 0.00 -1.24 -3.17 117.12 121.13 1aif n MET 143 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 57.70 57.62 1aif n MET 143 Cb 0.48 0.00 -0.11 0.00 0.00 0.00 0.00 33.22 33.59 1aif n MET 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1aif s VAL 144 N -2.00 0.25 -0.16 3.17 0.11 -1.25 -4.73 120.40 115.80 1aif s VAL 144 Ca 0.00 -1.04 -0.03 0.00 -2.93 0.00 0.00 61.98 57.98 1aif s VAL 144 Cb 0.00 -0.48 -0.02 0.00 -1.53 0.00 0.00 36.38 34.35 1aif s VAL 144 CO 0.00 -0.51 -0.05 -0.89 -3.33 0.00 0.00 175.10 170.32 1aif s THR 145 N -1.66 3.71 0.13 5.04 2.01 -1.26 -2.23 115.64 121.38 1aif s THR 145 Ca -0.12 -0.42 0.05 0.00 0.31 0.00 0.00 61.69 61.51 1aif s THR 145 Cb -0.08 -2.62 -0.04 0.00 0.01 0.00 0.00 72.50 69.76 1aif s THR 145 CO -0.01 0.49 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.53 1aif s LEU 146 N 0.45 2.45 0.00 4.42 1.43 -0.92 -4.55 118.68 121.96 1aif s LEU 146 Ca -0.05 -0.88 -0.09 0.00 -1.03 0.00 0.00 54.13 52.08 1aif s LEU 146 Cb -0.15 -0.43 0.04 0.00 0.03 0.00 0.00 46.19 45.68 1aif s LEU 146 CO 0.03 -0.23 0.48 0.61 0.23 0.00 0.00 176.35 177.47 1aif n GLY 147 N 0.28 1.41 2.91 -3.19 0.00 -1.09 -1.88 105.19 103.63 1aif n GLY 147 Ca -0.14 -1.17 -0.13 0.00 0.00 0.00 0.00 46.02 44.58 1aif n GLY 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aif s LEU 149 N 0.78 3.49 -0.46 0.00 0.20 -1.09 -1.43 118.68 120.17 1aif s LEU 149 Ca -0.06 -0.18 -0.03 0.00 0.69 0.00 0.00 54.13 54.55 1aif s LEU 149 Cb -0.08 -1.93 0.12 0.00 -0.43 0.00 0.00 46.19 43.87 1aif s LEU 149 CO -0.03 -0.02 0.26 -0.69 -0.29 0.00 0.00 176.35 175.58 1aif s VAL 150 N 1.53 3.41 -0.26 1.68 1.01 0.29 -2.27 120.40 125.79 1aif s VAL 150 Ca 0.06 -2.26 -0.09 0.00 0.00 0.00 0.00 61.98 59.69 1aif s VAL 150 Cb -0.15 -3.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 1aif s VAL 150 CO 0.04 -0.74 0.14 -0.75 0.00 0.00 0.00 175.10 173.79 1aif s LYS 151 N 0.87 3.84 0.00 2.72 2.20 -1.18 -0.68 119.74 127.52 1aif s LYS 151 Ca 0.10 -0.38 0.00 0.00 -0.36 0.00 0.00 55.97 55.33 1aif s LYS 151 Cb -0.22 -3.51 0.00 0.00 -1.51 0.00 0.00 37.83 32.58 1aif s LYS 151 CO -0.04 -0.16 0.00 0.41 -0.36 0.00 0.00 175.35 175.20 1aif n GLY 152 N 4.94 -0.38 3.17 5.54 0.00 0.13 -1.35 105.19 117.23 1aif n GLY 152 Ca -0.15 -0.21 -0.10 0.00 0.00 0.00 0.00 46.02 45.57 1aif n GLY 152 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1aif s TYR 153 N -1.90 0.87 0.08 1.61 1.13 -1.21 -3.72 117.35 114.20 1aif s TYR 153 Ca 0.00 -1.22 -0.01 0.00 -1.41 0.00 0.00 57.07 54.42 1aif s TYR 153 Cb 0.00 -0.46 -0.00 0.00 -1.10 0.00 0.00 41.96 40.39 1aif s TYR 153 CO 0.00 -0.55 -0.02 0.34 -2.51 0.00 0.00 175.55 172.81 1aif n PHE 154 N -0.12 0.00 -1.75 -3.49 7.35 0.03 -2.52 117.46 116.96 1aif n PHE 154 Ca -0.05 0.00 -0.39 0.00 -0.76 0.00 0.00 57.45 56.25 1aif n PHE 154 Cb 0.64 -0.03 0.03 0.00 0.35 0.00 0.00 39.48 40.47 1aif n PHE 154 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 1aif n PRO 155 N -3.52 1.89 -0.15 -7.13 -0.04 -1.26 -4.87 135.00 119.92 1aif n PRO 155 Ca -0.01 0.69 -0.00 0.00 -0.04 0.00 0.00 63.50 64.14 1aif n PRO 155 Cb 0.03 -2.60 0.25 0.00 -0.04 0.00 0.00 33.50 31.14 1aif n PRO 155 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1aif h GLU 156 N 1.73 0.86 -6.49 0.54 4.57 -1.97 -3.45 114.58 110.39 1aif h GLU 156 Ca -0.51 -0.10 -0.58 0.00 -1.18 0.00 0.00 59.36 56.99 1aif h GLU 156 Cb 1.29 -0.17 0.05 0.00 -0.16 0.00 0.00 28.75 29.76 1aif h GLU 156 CO 0.58 0.65 0.86 -2.30 -1.18 0.00 0.00 179.01 177.62 1aif n PRO 157 N -4.37 2.21 -3.69 0.92 -0.02 -1.26 -4.95 135.00 123.84 1aif n PRO 157 Ca 0.06 0.80 -0.10 0.00 -2.02 0.00 0.00 63.50 62.24 1aif n PRO 157 Cb 0.11 -2.59 -0.05 0.00 -0.02 0.00 0.00 33.50 30.95 1aif n PRO 157 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1aif s VAL 158 N 1.39 0.08 -0.19 -1.45 0.11 -1.26 -4.60 120.40 114.48 1aif s VAL 158 Ca 0.80 -0.69 -0.14 0.00 -2.93 0.00 0.00 61.98 59.02 1aif s VAL 158 Cb -0.66 -1.17 0.06 0.00 -1.53 0.00 0.00 36.38 33.07 1aif s VAL 158 CO 0.39 -0.38 0.50 0.28 -3.33 0.00 0.00 175.10 172.56 1aif s THR 159 N -3.64 -0.01 -0.22 5.04 -1.32 -0.38 -5.03 115.64 110.08 1aif s THR 159 Ca 0.02 0.03 -0.02 0.00 -1.21 0.00 0.00 61.69 60.52 1aif s THR 159 Cb 0.02 -0.71 0.07 0.00 -1.51 0.00 0.00 72.50 70.37 1aif s THR 159 CO -0.11 0.01 0.03 -0.69 -2.21 0.00 0.00 174.62 171.66 1aif s VAL 160 N 0.87 0.71 0.48 5.08 1.01 -1.26 0.90 120.40 128.18 1aif s VAL 160 Ca -0.05 -0.79 0.05 0.00 0.00 0.00 0.00 61.98 61.19 1aif s VAL 160 Cb -0.05 -1.24 0.02 0.00 0.00 0.00 0.00 36.38 35.11 1aif s VAL 160 CO -0.07 -0.28 0.66 0.42 0.00 0.00 0.00 175.10 175.83 1aif s THR 161 N 1.76 2.94 -0.20 3.92 -4.23 -0.79 -5.00 115.64 114.04 1aif s THR 161 Ca 0.00 -0.83 0.02 0.00 -1.18 0.00 0.00 61.69 59.70 1aif s THR 161 Cb -0.17 -3.04 0.03 0.00 1.34 0.00 0.00 72.50 70.66 1aif s THR 161 CO -0.11 -0.02 -0.16 0.26 -0.54 0.00 0.00 174.62 174.05 1aif s TRP 162 N -2.54 2.85 -0.36 3.99 0.52 -1.26 -2.73 118.94 119.41 1aif s TRP 162 Ca 0.55 -1.82 -0.19 0.00 0.02 0.00 0.00 56.10 54.67 1aif s TRP 162 Cb -0.10 -1.87 0.03 0.00 -1.15 0.00 0.00 33.47 30.37 1aif s TRP 162 CO 0.36 -0.81 0.44 -1.71 0.02 0.00 0.00 176.95 175.24 1aif n ASN 163 N 4.58 -7.02 -3.49 2.95 4.05 0.31 -2.39 115.26 114.25 1aif n ASN 163 Ca -0.18 0.45 -0.19 0.00 0.45 0.00 0.00 54.58 55.11 1aif n ASN 163 Cb 0.47 -3.71 -0.06 0.00 1.23 0.00 0.00 39.78 37.72 1aif n ASN 163 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 177.26 173.01 1aif n SER 164 N 0.12 0.26 -1.30 1.20 7.64 -1.26 0.43 113.62 120.71 1aif n SER 164 Ca 0.02 -0.73 -0.13 0.00 1.01 0.00 0.00 58.87 59.04 1aif n SER 164 Cb 0.46 -0.91 -0.06 0.00 -1.01 0.00 0.00 64.21 62.69 1aif n SER 164 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1aif n GLY 165 N -1.71 1.27 0.13 0.23 0.00 -1.01 -4.82 105.19 99.28 1aif n GLY 165 Ca -0.14 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.71 1aif n GLY 165 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1aif h SER 166 N 0.00 0.57 -3.76 1.61 4.64 0.02 -3.44 113.55 113.19 1aif h SER 166 Ca -0.27 -0.55 -0.68 0.00 -0.47 0.00 0.00 61.79 59.82 1aif h SER 166 Cb 0.93 -0.18 -0.34 0.00 -0.31 0.00 0.00 62.40 62.51 1aif h SER 166 CO 0.40 1.39 -0.73 -0.76 -0.87 0.00 0.00 176.83 176.26 1aif s LEU 167 N -7.47 3.71 -0.20 5.97 2.01 -1.24 -4.96 118.68 116.50 1aif s LEU 167 Ca -0.06 -1.25 0.03 0.00 0.01 0.00 0.00 54.13 52.86 1aif s LEU 167 Cb 0.07 -1.67 -0.21 0.00 0.01 0.00 0.00 46.19 44.39 1aif s LEU 167 CO 0.89 -0.23 0.05 -1.54 1.01 0.00 0.00 176.35 176.53 1aif n SER 168 N 4.59 1.62 -3.93 2.29 3.41 -1.26 -4.65 113.62 115.69 1aif n SER 168 Ca -0.14 0.02 -0.05 0.00 -0.26 0.00 0.00 58.87 58.44 1aif n SER 168 Cb 0.43 -0.28 -0.05 0.00 -0.26 0.00 0.00 64.21 64.06 1aif n SER 168 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1aif n SER 169 N -3.22 -1.80 0.00 4.04 7.64 -1.26 0.49 113.62 119.51 1aif n SER 169 Ca -0.38 -1.16 0.00 0.00 1.01 0.00 0.00 58.87 58.34 1aif n SER 169 Cb 1.04 -0.56 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 1aif n SER 169 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1aif n GLY 170 N 4.51 1.05 3.77 0.23 0.00 -1.26 -4.60 105.19 108.90 1aif n GLY 170 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 1aif n GLY 170 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aif s VAL 171 N -2.00 3.55 -0.34 1.61 0.11 0.18 -3.19 120.40 120.32 1aif s VAL 171 Ca 0.00 1.36 -0.00 0.00 -2.93 0.00 0.00 61.98 60.41 1aif s VAL 171 Cb 0.00 -3.79 0.13 0.00 -1.53 0.00 0.00 36.38 31.20 1aif s VAL 171 CO 0.00 0.17 0.22 -1.00 -3.33 0.00 0.00 175.10 171.17 1aif s HIS 172 N -1.41 0.40 0.40 1.54 3.76 0.07 -4.95 115.29 115.10 1aif s HIS 172 Ca 0.52 -1.25 -0.10 0.00 -0.15 0.00 0.00 55.06 54.07 1aif s HIS 172 Cb -0.27 -0.80 -0.06 0.00 1.11 0.00 0.00 32.58 32.55 1aif s HIS 172 CO 0.35 -0.86 0.76 0.99 -0.85 0.00 0.00 174.74 175.13 1aif s THR 173 N 1.42 4.80 0.08 1.30 2.01 -1.26 -1.24 115.64 122.75 1aif s THR 173 Ca 0.15 0.58 0.10 0.00 0.31 0.00 0.00 61.69 62.83 1aif s THR 173 Cb -0.20 -3.74 -0.03 0.00 0.01 0.00 0.00 72.50 68.54 1aif s THR 173 CO -0.10 -0.52 -0.26 -0.36 -0.69 0.00 0.00 174.62 172.70 1aif s PHE 174 N -2.37 2.24 0.12 4.92 0.08 -1.19 -4.97 117.98 116.81 1aif s PHE 174 Ca 0.51 -0.40 -0.31 0.00 0.12 0.00 0.00 56.93 56.85 1aif s PHE 174 Cb -0.10 -1.29 -0.10 0.00 -0.57 0.00 0.00 43.02 40.96 1aif s PHE 174 CO 0.32 0.21 1.76 -2.14 -0.10 0.00 0.00 175.22 175.26 1aif s PRO 175 N -1.58 4.16 1.16 0.24 0.02 -1.26 -4.62 135.00 133.11 1aif s PRO 175 Ca 0.12 2.52 -0.13 0.00 0.02 0.00 0.00 61.00 63.53 1aif s PRO 175 Cb -0.10 -3.52 0.28 0.00 0.02 0.00 0.00 34.50 31.19 1aif s PRO 175 CO 0.04 -0.79 1.03 0.00 -0.33 0.00 0.00 177.00 176.95 1aif s ALA 176 N 2.46 -0.42 0.41 -1.55 0.00 -1.26 -4.96 121.76 116.43 1aif s ALA 176 Ca 0.78 -0.15 0.03 0.00 0.00 0.00 0.00 51.96 52.62 1aif s ALA 176 Cb -0.45 -3.24 -0.01 0.00 0.00 0.00 0.00 23.12 19.42 1aif s ALA 176 CO 0.35 -3.82 0.12 1.33 0.00 0.00 0.00 175.76 173.74 1aif n VAL 177 N -4.90 0.00 -3.60 0.00 0.24 -1.10 -5.00 118.33 103.98 1aif n VAL 177 Ca 0.03 -2.28 -0.04 0.00 -2.04 0.00 0.00 64.34 60.01 1aif n VAL 177 Cb 0.54 0.76 -0.06 0.00 -1.47 0.00 0.00 33.84 33.61 1aif n VAL 177 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1aif s LEU 178 N 0.00 -0.92 -0.25 1.34 0.20 -1.26 -3.28 118.68 114.52 1aif s LEU 178 Ca 0.16 1.19 -0.04 0.00 0.69 0.00 0.00 54.13 56.13 1aif s LEU 178 Cb 0.01 1.81 0.09 0.00 -0.43 0.00 0.00 46.19 47.67 1aif s LEU 178 CO 0.12 -0.23 0.12 0.00 -0.29 0.00 0.00 176.35 176.07 1aif s GLN 179 N 2.75 0.15 0.00 1.98 0.00 -1.05 -4.94 119.66 118.56 1aif s GLN 179 Ca -0.01 -0.35 0.00 0.00 -0.00 0.00 0.00 55.36 54.99 1aif s GLN 179 Cb -0.12 -1.38 0.00 0.00 0.00 0.00 0.00 33.01 31.51 1aif s GLN 179 CO -0.16 -0.90 0.00 0.45 0.00 0.00 0.00 175.29 174.68 1aif n SER 180 N 5.26 -1.18 -3.78 12.60 2.88 -1.26 -4.38 113.62 123.77 1aif n SER 180 Ca -0.06 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.25 1aif n SER 180 Cb 0.45 -0.35 -0.05 0.00 -0.75 0.00 0.00 64.21 63.51 1aif n SER 180 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1aif n ASP 181 N -0.83 0.07 -3.60 -3.46 9.92 -1.26 -4.89 116.55 112.49 1aif n ASP 181 Ca 0.00 -0.87 -0.13 0.00 -0.53 0.00 0.00 54.79 53.26 1aif n ASP 181 Cb 0.29 -1.08 -0.07 0.00 -0.64 0.00 0.00 41.12 39.63 1aif n ASP 181 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1aif s LEU 182 N -6.10 -0.60 0.30 0.64 2.96 -1.26 -4.91 118.68 109.72 1aif s LEU 182 Ca 0.06 0.99 0.10 0.00 -0.22 0.00 0.00 54.13 55.05 1aif s LEU 182 Cb -0.03 2.24 -0.05 0.00 0.50 0.00 0.00 46.19 48.85 1aif s LEU 182 CO 0.68 -0.32 -0.02 -0.31 -1.32 0.00 0.00 176.35 175.06 1aif s TYR 183 N -0.21 2.57 -0.21 5.38 1.51 -1.05 -2.52 117.35 122.83 1aif s TYR 183 Ca -0.02 -0.34 -0.12 0.00 -1.01 0.00 0.00 57.07 55.58 1aif s TYR 183 Cb -0.03 -1.31 0.07 0.00 -0.11 0.00 0.00 41.96 40.57 1aif s TYR 183 CO 0.01 0.56 0.51 -0.08 -1.11 0.00 0.00 175.55 175.45 1aif s THR 184 N -2.44 -0.01 0.06 -0.71 -1.32 -1.20 0.17 115.64 110.18 1aif s THR 184 Ca 0.33 0.05 -0.21 0.00 -1.21 0.00 0.00 61.69 60.66 1aif s THR 184 Cb -0.03 -0.75 0.05 0.00 -1.51 0.00 0.00 72.50 70.25 1aif s THR 184 CO 0.19 0.02 0.48 -0.22 -2.21 0.00 0.00 174.62 172.89 1aif s LEU 185 N 1.37 0.06 0.08 9.08 0.20 0.14 -2.70 118.68 126.92 1aif s LEU 185 Ca -0.09 0.06 -0.15 0.00 0.69 0.00 0.00 54.13 54.64 1aif s LEU 185 Cb -0.07 2.03 0.03 0.00 -0.43 0.00 0.00 46.19 47.75 1aif s LEU 185 CO -0.14 -0.74 0.34 -0.94 -0.29 0.00 0.00 176.35 174.58 1aif s SER 186 N -2.14 -0.16 0.03 3.68 1.04 -1.26 0.11 113.70 115.00 1aif s SER 186 Ca -0.04 -0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.12 1aif s SER 186 Cb -0.00 0.41 -0.00 0.00 0.10 0.00 0.00 66.02 66.53 1aif s SER 186 CO -0.04 -0.73 0.00 -0.24 0.98 0.00 0.00 173.24 173.21 1aif n SER 187 N 0.16 1.97 -3.64 7.02 2.88 -0.52 -3.16 113.62 118.34 1aif n SER 187 Ca -0.17 -1.14 -0.06 0.00 -1.33 0.00 0.00 58.87 56.18 1aif n SER 187 Cb 0.62 0.03 -0.07 0.00 -0.75 0.00 0.00 64.21 64.03 1aif n SER 187 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1aif s SER 188 N -1.17 -0.33 -0.08 -3.46 0.15 -0.37 -3.17 113.70 105.27 1aif s SER 188 Ca 0.00 0.61 0.05 0.00 0.70 0.00 0.00 55.95 57.30 1aif s SER 188 Cb 0.00 0.73 -0.00 0.00 -1.71 0.00 0.00 66.02 65.04 1aif s SER 188 CO 0.00 -0.10 -0.23 0.54 1.20 0.00 0.00 173.24 174.65 1aif s VAL 189 N 0.40 1.93 -0.38 4.45 0.11 -0.79 -0.75 120.40 125.37 1aif s VAL 189 Ca 0.02 -0.96 -0.06 0.00 -2.93 0.00 0.00 61.98 58.04 1aif s VAL 189 Cb -0.05 -1.66 0.07 0.00 -1.53 0.00 0.00 36.38 33.22 1aif s VAL 189 CO -0.10 0.53 0.18 0.42 -3.33 0.00 0.00 175.10 172.80 1aif s THR 190 N 0.18 3.80 0.00 5.04 -4.23 -1.19 -2.17 115.64 117.07 1aif s THR 190 Ca -0.12 -1.45 0.00 0.00 -1.18 0.00 0.00 61.69 58.93 1aif s THR 190 Cb -0.16 -3.32 0.00 0.00 1.34 0.00 0.00 72.50 70.36 1aif s THR 190 CO 0.06 -0.42 0.00 1.33 -0.54 0.00 0.00 174.62 175.06 1aif n VAL 191 N 4.80 0.00 -3.27 2.29 0.24 -0.95 -4.82 118.33 116.61 1aif n VAL 191 Ca -0.09 0.00 -0.36 0.00 -2.04 0.00 0.00 64.34 61.84 1aif n VAL 191 Cb 0.43 -1.02 -0.06 0.00 -1.47 0.00 0.00 33.84 31.72 1aif n VAL 191 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1aif s PRO 192 N 0.60 4.10 0.00 7.34 0.04 -1.26 -3.89 135.00 141.93 1aif s PRO 192 Ca 0.00 0.65 0.00 0.00 0.04 0.00 0.00 61.00 61.69 1aif s PRO 192 Cb 0.00 -3.00 0.00 0.00 0.04 0.00 0.00 34.50 31.54 1aif s PRO 192 CO 0.00 0.50 0.00 0.43 0.04 0.00 0.00 177.00 177.97 1aif n SER 193 N 1.02 0.00 -4.60 6.66 7.64 -1.19 -3.71 113.62 119.44 1aif n SER 193 Ca -0.06 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.39 1aif n SER 193 Cb 0.51 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.69 1aif n SER 193 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1aif s THR 194 N -3.90 3.54 -0.15 0.44 -1.32 -1.26 -3.64 115.64 109.35 1aif s THR 194 Ca 0.00 0.56 -0.38 0.00 -1.21 0.00 0.00 61.69 60.66 1aif s THR 194 Cb 0.00 -3.69 -0.15 0.00 -1.51 0.00 0.00 72.50 67.15 1aif s THR 194 CO 0.00 -0.42 1.67 0.79 -2.21 0.00 0.00 174.62 174.46 1aif n TRP 195 N 9.82 2.00 -2.80 9.09 7.02 -1.24 -4.89 117.44 136.44 1aif n TRP 195 Ca 0.22 0.46 -0.05 0.00 -1.02 0.00 0.00 57.50 57.10 1aif n TRP 195 Cb 0.46 -2.47 0.02 0.00 -2.42 0.00 0.00 31.31 26.90 1aif n TRP 195 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 1aif n ARG 196 N 4.89 0.76 -2.32 -0.99 1.74 -1.26 -4.84 116.66 114.64 1aif n ARG 196 Ca 0.24 -0.73 -0.35 0.00 -0.77 0.00 0.00 57.85 56.24 1aif n ARG 196 Cb 0.18 -0.09 -0.03 0.00 -1.02 0.00 0.00 32.46 31.49 1aif n ARG 196 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1aif s PRO 197 N -2.77 3.18 0.66 5.56 0.04 -1.26 -4.61 135.00 135.81 1aif s PRO 197 Ca 0.15 -1.29 0.08 0.00 0.04 0.00 0.00 61.00 59.98 1aif s PRO 197 Cb -0.01 -5.33 0.41 0.00 0.04 0.00 0.00 34.50 29.61 1aif s PRO 197 CO 0.10 -3.01 1.23 0.77 0.04 0.00 0.00 177.00 176.13 1aif h SER 198 N 9.29 0.00 -0.71 6.66 0.02 -1.90 -1.92 113.55 124.99 1aif h SER 198 Ca 0.27 0.00 0.22 0.00 -0.84 0.00 0.00 61.79 61.44 1aif h SER 198 Cb 0.94 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.43 1aif h SER 198 CO 1.33 0.00 0.49 -0.62 -1.14 0.00 0.00 176.83 176.89 1aif n GLU 199 N -2.60 -0.01 -0.04 3.45 1.02 -1.26 0.17 120.64 121.38 1aif n GLU 199 Ca -0.00 0.50 -0.12 0.00 -0.02 0.00 0.00 57.16 57.51 1aif n GLU 199 Cb 0.84 -1.06 -0.10 0.00 -0.02 0.00 0.00 31.44 31.10 1aif n GLU 199 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 1aif h THR 200 N 0.00 1.42 -1.55 2.62 2.02 -1.75 -3.47 112.91 112.21 1aif h THR 200 Ca 0.39 -1.78 -0.64 0.00 0.77 0.00 0.00 66.41 65.15 1aif h THR 200 Cb 1.40 2.55 -0.00 0.00 -1.74 0.00 0.00 68.15 70.36 1aif h THR 200 CO -0.10 0.43 1.36 0.52 0.37 0.00 0.00 175.52 178.10 1aif n VAL 201 N -4.73 0.32 -4.33 3.16 0.31 0.46 -5.00 118.33 108.51 1aif n VAL 201 Ca -0.09 -0.28 -0.29 0.00 -0.01 0.00 0.00 64.34 63.67 1aif n VAL 201 Cb 0.36 -1.95 -0.17 0.00 -0.91 0.00 0.00 33.84 31.17 1aif n VAL 201 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1aif s THR 202 N 6.85 1.55 -0.74 2.52 -4.23 -1.26 -4.11 115.64 116.23 1aif s THR 202 Ca 1.03 -0.66 -0.14 0.00 -1.18 0.00 0.00 61.69 60.74 1aif s THR 202 Cb -0.68 -1.43 0.19 0.00 1.34 0.00 0.00 72.50 71.92 1aif s THR 202 CO 0.46 0.45 0.68 0.00 -0.54 0.00 0.00 174.62 175.68 1aif s ASN 204 N 2.47 7.06 0.01 0.00 0.01 -1.10 -3.21 114.94 120.19 1aif s ASN 204 Ca 0.14 1.96 0.02 0.00 -0.71 0.00 0.00 52.86 54.28 1aif s ASN 204 Cb -0.16 -2.59 -0.01 0.00 0.41 0.00 0.00 41.25 38.91 1aif s ASN 204 CO -0.06 -0.27 -0.07 -0.69 -1.51 0.00 0.00 177.10 174.50 1aif s VAL 205 N -1.60 0.55 -0.11 1.60 1.01 -1.22 -1.88 120.40 118.74 1aif s VAL 205 Ca 0.53 -0.57 0.03 0.00 0.00 0.00 0.00 61.98 61.97 1aif s VAL 205 Cb -0.21 -0.52 0.01 0.00 0.00 0.00 0.00 36.38 35.66 1aif s VAL 205 CO 0.27 -0.03 -0.21 0.00 0.00 0.00 0.00 175.10 175.13 1aif s ALA 206 N -0.58 2.04 -0.26 5.51 0.00 0.26 -2.36 121.76 126.37 1aif s ALA 206 Ca -0.01 -0.92 -0.02 0.00 0.00 0.00 0.00 51.96 51.00 1aif s ALA 206 Cb -0.05 -0.85 0.12 0.00 0.00 0.00 0.00 23.12 22.33 1aif s ALA 206 CO 0.00 0.11 0.25 -1.58 0.00 0.00 0.00 175.76 174.54 1aif s HIS 207 N 0.63 -0.31 0.55 0.00 5.04 -1.24 -1.25 115.29 118.71 1aif s HIS 207 Ca -0.13 -0.10 0.46 0.00 -1.54 0.00 0.00 55.06 53.75 1aif s HIS 207 Cb -0.16 -0.47 1.68 0.00 0.04 0.00 0.00 32.58 33.66 1aif s HIS 207 CO 0.03 -0.79 1.66 -1.00 -2.34 0.00 0.00 174.74 172.30 1aif h PRO 208 N 8.30 0.00 -2.70 2.88 0.13 -1.83 0.14 132.00 138.92 1aif h PRO 208 Ca -0.16 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.29 1aif h PRO 208 Cb 1.10 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.16 1aif h PRO 208 CO 0.33 0.00 2.74 0.00 -0.23 0.00 0.00 178.00 180.84 1aif n ALA 209 N -2.87 7.06 -0.70 -0.56 0.00 -1.26 -4.72 120.51 117.47 1aif n ALA 209 Ca 0.38 -3.75 0.00 0.00 0.00 0.00 0.00 53.44 50.07 1aif n ALA 209 Cb 1.74 -2.94 0.00 0.00 0.00 0.00 0.00 19.45 18.25 1aif n ALA 209 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1aif n SER 210 N 2.38 -1.15 -4.69 0.00 3.41 -1.14 -4.77 113.62 107.67 1aif n SER 210 Ca 0.67 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 59.02 1aif n SER 210 Cb 0.28 -0.19 -0.09 0.00 -0.26 0.00 0.00 64.21 63.95 1aif n SER 210 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1aif s SER 211 N -2.45 4.18 -0.32 4.04 0.15 0.47 -5.04 113.70 114.73 1aif s SER 211 Ca 0.00 -1.21 -0.06 0.00 0.70 0.00 0.00 55.95 55.37 1aif s SER 211 Cb 0.00 -0.43 0.19 0.00 -1.71 0.00 0.00 66.02 64.07 1aif s SER 211 CO 0.00 -0.51 0.95 -0.89 1.20 0.00 0.00 173.24 174.00 1aif s THR 212 N -2.65 -0.39 0.00 6.45 2.01 -1.26 -3.61 115.64 116.18 1aif s THR 212 Ca 0.38 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.38 1aif s THR 212 Cb 0.07 -0.16 0.00 0.00 0.01 0.00 0.00 72.50 72.42 1aif s THR 212 CO 0.20 0.00 0.00 1.17 -0.69 0.00 0.00 174.62 175.30 1aif n LYS 213 N 4.38 2.25 -3.57 4.92 3.00 -0.99 -4.94 118.16 123.20 1aif n LYS 213 Ca 0.08 0.00 0.03 0.00 -0.00 0.00 0.00 58.31 58.42 1aif n LYS 213 Cb 0.60 0.00 -0.00 0.00 0.00 0.00 0.00 35.03 35.63 1aif n LYS 213 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1aif s VAL 214 N 1.11 0.00 0.00 3.15 1.01 -1.26 -3.42 120.40 120.98 1aif s VAL 214 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.93 1aif s VAL 214 Cb 0.00 -1.98 0.00 0.00 0.00 0.00 0.00 36.38 34.40 1aif s VAL 214 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 175.10 175.57 1aif n ASP 215 N -0.49 0.00 -3.57 3.32 9.92 -1.20 -4.89 116.55 119.65 1aif n ASP 215 Ca -0.09 -0.97 -0.13 0.00 -0.53 0.00 0.00 54.79 53.06 1aif n ASP 215 Cb 0.64 0.00 -0.05 0.00 -0.64 0.00 0.00 41.12 41.07 1aif n ASP 215 CO 0.00 0.00 0.00 -1.59 0.13 0.00 0.00 177.20 175.74 1aif s LYS 216 N -1.92 1.07 0.27 -1.24 -2.85 -1.26 -3.67 119.74 110.13 1aif s LYS 216 Ca 0.00 -0.34 0.09 0.00 -1.00 0.00 0.00 55.97 54.72 1aif s LYS 216 Cb 0.00 0.48 -0.04 0.00 -2.06 0.00 0.00 37.83 36.21 1aif s LYS 216 CO 0.00 -0.40 0.00 0.15 0.10 0.00 0.00 175.35 175.20 1aif s LYS 217 N -2.82 2.31 0.00 1.78 -0.14 -1.26 -4.72 119.74 114.90 1aif s LYS 217 Ca -0.03 -1.41 0.26 0.00 -1.36 0.00 0.00 55.97 53.43 1aif s LYS 217 Cb -0.00 -2.17 1.57 0.00 -1.68 0.00 0.00 37.83 35.54 1aif s LYS 217 CO -0.05 0.36 1.92 1.51 -0.76 0.00 0.00 175.35 178.34