#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c2a s VAL 2 N 0.00 4.11 0.16 3.84 1.01 -1.26 -3.77 120.40 124.49 3c2a s VAL 2 Ca 0.00 1.48 -0.24 0.00 0.00 0.00 0.00 61.98 63.22 3c2a s VAL 2 Cb 0.00 -3.95 0.06 0.00 0.00 0.00 0.00 36.38 32.49 3c2a s VAL 2 CO 0.00 0.04 0.71 0.00 0.00 0.00 0.00 175.10 175.85 3c2a s GLN 3 N 1.80 1.33 -0.02 2.72 -2.07 -0.93 -5.02 119.66 117.47 3c2a s GLN 3 Ca 0.58 -0.59 0.04 0.00 -1.82 0.00 0.00 55.36 53.56 3c2a s GLN 3 Cb -0.27 0.54 -0.01 0.00 -1.09 0.00 0.00 33.01 32.19 3c2a s GLN 3 CO 0.25 -0.59 -0.12 -0.51 -1.32 0.00 0.00 175.29 173.00 3c2a s LEU 4 N -2.77 1.94 -0.11 2.60 1.43 -1.26 -2.51 118.68 118.00 3c2a s LEU 4 Ca 0.05 -0.23 -0.00 0.00 -1.03 0.00 0.00 54.13 52.92 3c2a s LEU 4 Cb -0.02 -0.66 0.03 0.00 0.03 0.00 0.00 46.19 45.57 3c2a s LEU 4 CO -0.06 0.13 -0.07 -0.69 0.23 0.00 0.00 176.35 175.89 3c2a s VAL 5 N -0.11 1.01 0.19 -1.59 1.01 -0.74 -4.06 120.40 116.10 3c2a s VAL 5 Ca 0.02 -0.28 -0.05 0.00 0.00 0.00 0.00 61.98 61.66 3c2a s VAL 5 Cb -0.07 -1.04 -0.06 0.00 0.00 0.00 0.00 36.38 35.22 3c2a s VAL 5 CO 0.00 0.36 0.44 -1.83 0.00 0.00 0.00 175.10 174.07 3c2a s GLU 6 N 1.72 3.65 0.18 2.72 1.03 -1.26 -1.50 118.70 125.22 3c2a s GLU 6 Ca 0.05 -0.03 -0.06 0.00 0.03 0.00 0.00 54.97 54.96 3c2a s GLU 6 Cb -0.13 -2.77 -0.02 0.00 -0.80 0.00 0.00 34.13 30.41 3c2a s GLU 6 CO -0.08 0.38 0.22 -1.54 -1.33 0.00 0.00 175.26 172.92 3c2a s SER 7 N -2.63 0.11 0.00 0.83 1.04 -0.51 -4.75 113.70 107.79 3c2a s SER 7 Ca 0.43 -1.08 0.00 0.00 0.48 0.00 0.00 55.95 55.78 3c2a s SER 7 Cb -0.12 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.42 3c2a s SER 7 CO 0.25 -0.88 0.00 0.61 0.98 0.00 0.00 173.24 174.21 3c2a n GLY 8 N -0.22 0.71 3.79 7.32 0.00 -1.26 -1.69 105.19 113.84 3c2a n GLY 8 Ca -0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.62 3c2a n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3c2a s GLY 9 N -0.60 2.65 0.00 -0.02 0.00 -1.26 -4.69 107.32 103.40 3c2a s GLY 9 Ca 0.00 0.70 0.00 0.00 0.00 0.00 0.00 44.72 45.42 3c2a s GLY 9 CO 0.00 1.09 0.00 0.61 0.00 0.00 0.00 173.10 174.80 3c2a n GLY 10 N 0.13 1.56 3.72 0.20 0.00 -0.87 -4.85 105.19 105.09 3c2a n GLY 10 Ca 0.07 -0.65 -0.39 0.00 0.00 0.00 0.00 46.02 45.05 3c2a n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3c2a s LEU 11 N 0.00 4.32 0.01 0.99 2.96 -1.26 -0.73 118.68 124.96 3c2a s LEU 11 Ca 0.00 1.06 0.03 0.00 -0.22 0.00 0.00 54.13 55.00 3c2a s LEU 11 Cb 0.00 -2.93 -0.01 0.00 0.50 0.00 0.00 46.19 43.75 3c2a s LEU 11 CO 0.00 -0.05 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.19 3c2a s VAL 12 N 0.60 0.77 0.45 1.68 1.01 -0.00 -4.98 120.40 119.93 3c2a s VAL 12 Ca 0.33 -0.58 -0.16 0.00 0.00 0.00 0.00 61.98 61.57 3c2a s VAL 12 Cb -0.17 -0.68 -0.08 0.00 0.00 0.00 0.00 36.38 35.45 3c2a s VAL 12 CO 0.15 0.10 0.89 -0.54 0.00 0.00 0.00 175.10 175.70 3c2a s LYS 13 N -0.55 3.98 0.38 2.72 1.02 -1.26 -1.86 119.74 124.16 3c2a s LYS 13 Ca 0.02 0.84 -0.28 0.00 0.02 0.00 0.00 55.97 56.57 3c2a s LYS 13 Cb -0.05 -2.24 -0.11 0.00 -0.52 0.00 0.00 37.83 34.91 3c2a s LYS 13 CO 0.00 -0.11 1.44 -2.30 -0.92 0.00 0.00 175.35 173.46 3c2a n PRO 14 N -1.16 2.53 -0.05 -1.68 -0.02 -1.26 -1.48 135.00 131.88 3c2a n PRO 14 Ca 0.05 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 3c2a n PRO 14 Cb 0.54 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 3c2a n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3c2a n GLY 15 N 0.53 0.76 3.96 -1.23 0.00 0.18 -4.95 105.19 104.44 3c2a n GLY 15 Ca 0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.79 3c2a n GLY 15 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3c2a s GLY 16 N -1.86 1.76 0.27 -0.02 0.00 -0.55 -4.37 107.32 102.55 3c2a s GLY 16 Ca 0.00 -1.40 0.10 0.00 0.00 0.00 0.00 44.72 43.42 3c2a s GLY 16 CO 0.00 -0.83 -0.07 -0.56 0.00 0.00 0.00 173.10 171.64 3c2a s SER 17 N -4.71 4.23 -0.22 1.64 0.01 -1.26 -0.78 113.70 112.61 3c2a s SER 17 Ca 0.66 -0.77 -0.26 0.00 1.31 0.00 0.00 55.95 56.89 3c2a s SER 17 Cb -0.06 -0.67 0.08 0.00 0.21 0.00 0.00 66.02 65.58 3c2a s SER 17 CO 0.46 0.01 0.76 -0.22 0.41 0.00 0.00 173.24 174.67 3c2a s LEU 18 N -3.62 -0.68 -0.21 2.44 2.96 0.62 -4.98 118.68 115.20 3c2a s LEU 18 Ca 0.31 1.18 0.01 0.00 -0.22 0.00 0.00 54.13 55.41 3c2a s LEU 18 Cb -0.06 2.38 0.03 0.00 0.50 0.00 0.00 46.19 49.04 3c2a s LEU 18 CO 0.18 -0.31 -0.15 -0.60 -1.32 0.00 0.00 176.35 174.14 3c2a s ARG 19 N -0.02 2.84 -0.11 1.98 6.06 -1.26 -0.05 118.95 128.39 3c2a s ARG 19 Ca -0.02 -0.94 -0.06 0.00 -2.50 0.00 0.00 55.73 52.21 3c2a s ARG 19 Cb -0.04 -2.72 -0.04 0.00 0.06 0.00 0.00 34.95 32.22 3c2a s ARG 19 CO 0.02 -0.31 0.13 -0.51 -2.50 0.00 0.00 175.30 172.13 3c2a s LEU 20 N 1.27 4.31 0.20 -0.88 1.43 -0.33 -4.67 118.68 120.00 3c2a s LEU 20 Ca 0.02 0.43 0.09 0.00 -1.03 0.00 0.00 54.13 53.63 3c2a s LEU 20 Cb -0.15 -2.09 -0.04 0.00 0.03 0.00 0.00 46.19 43.93 3c2a s LEU 20 CO -0.10 0.39 -0.10 0.42 0.23 0.00 0.00 176.35 177.20 3c2a s THR 21 N -1.04 3.13 -0.13 5.49 -4.23 -0.68 -1.10 115.64 117.07 3c2a s THR 21 Ca 0.16 -1.77 -0.04 0.00 -1.18 0.00 0.00 61.69 58.86 3c2a s THR 21 Cb -0.12 -2.57 0.07 0.00 1.34 0.00 0.00 72.50 71.21 3c2a s THR 21 CO 0.05 -0.17 0.22 0.00 -0.54 0.00 0.00 174.62 174.18 3c2a s VAL 23 N 2.35 5.15 0.12 0.00 1.01 -0.56 0.25 120.40 128.71 3c2a s VAL 23 Ca 0.03 0.09 0.04 0.00 0.00 0.00 0.00 61.98 62.14 3c2a s VAL 23 Cb -0.13 -3.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.92 3c2a s VAL 23 CO -0.08 0.52 0.13 0.00 0.00 0.00 0.00 175.10 175.66 3c2a s ALA 24 N -0.19 3.63 0.00 5.51 0.00 0.56 -1.80 121.76 129.48 3c2a s ALA 24 Ca 0.09 -1.08 -0.27 0.00 0.00 0.00 0.00 51.96 50.70 3c2a s ALA 24 Cb -0.12 -1.46 0.06 0.00 0.00 0.00 0.00 23.12 21.60 3c2a s ALA 24 CO 0.01 0.64 0.61 -1.54 0.00 0.00 0.00 175.76 175.48 3c2a s SER 25 N -2.75 -0.57 0.00 0.00 1.04 -1.05 -4.83 113.70 105.54 3c2a s SER 25 Ca 0.31 0.46 0.00 0.00 0.48 0.00 0.00 55.95 57.20 3c2a s SER 25 Cb -0.11 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.53 3c2a s SER 25 CO 0.24 -0.67 0.00 0.61 0.98 0.00 0.00 173.24 174.39 3c2a n GLY 26 N 0.65 0.69 3.26 7.32 0.00 -1.25 -2.20 105.19 113.67 3c2a n GLY 26 Ca -0.19 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.74 3c2a n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3c2a s PHE 27 N -2.83 0.31 -0.72 1.61 -0.71 -1.26 -4.45 117.98 109.93 3c2a s PHE 27 Ca 0.00 -0.71 -0.26 0.00 -1.04 0.00 0.00 56.93 54.92 3c2a s PHE 27 Cb 0.00 -0.08 0.00 0.00 -1.21 0.00 0.00 43.02 41.73 3c2a s PHE 27 CO 0.00 -0.62 1.59 0.99 -1.34 0.00 0.00 175.22 175.83 3c2a s THR 28 N -3.92 3.56 0.32 -4.49 2.01 -1.26 -4.87 115.64 106.99 3c2a s THR 28 Ca 0.12 0.18 0.11 0.00 0.31 0.00 0.00 61.69 62.40 3c2a s THR 28 Cb 0.04 -4.45 0.03 0.00 0.01 0.00 0.00 72.50 68.14 3c2a s THR 28 CO -0.05 -1.40 1.72 0.15 -0.69 0.00 0.00 174.62 174.35 3c2a h PHE 29 N 12.17 0.03 0.00 4.92 3.57 -1.96 -2.57 116.94 133.11 3c2a h PHE 29 Ca -0.21 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.25 3c2a h PHE 29 Cb 1.09 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.82 3c2a h PHE 29 CO 1.11 0.51 -0.16 0.66 -2.23 0.00 0.00 178.31 178.20 3c2a h SER 30 N 0.02 0.00 1.42 0.41 4.64 -1.90 -3.10 113.55 115.04 3c2a h SER 30 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3c2a h SER 30 Cb 0.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 3c2a h SER 30 CO 0.06 0.16 0.00 0.44 -0.87 0.00 0.00 176.83 176.62 3c2a h ASP 31 N 0.00 0.00 -3.84 4.97 5.19 -1.88 -3.38 116.42 117.48 3c2a h ASP 31 Ca -0.00 0.00 -0.68 0.00 -0.62 0.00 0.00 57.03 55.72 3c2a h ASP 31 Cb 0.56 0.00 -0.21 0.00 0.18 0.00 0.00 39.33 39.87 3c2a h ASP 31 CO 0.02 0.00 -0.83 0.68 -3.12 0.00 0.00 179.24 175.99 3c2a s VAL 32 N -3.15 2.57 0.36 -1.35 -7.23 -1.17 -4.89 120.40 105.54 3c2a s VAL 32 Ca 0.09 -1.58 -0.22 0.00 -1.81 0.00 0.00 61.98 58.46 3c2a s VAL 32 Cb 0.11 -2.15 -0.10 0.00 0.56 0.00 0.00 36.38 34.80 3c2a s VAL 32 CO 0.58 0.12 0.90 0.26 -0.31 0.00 0.00 175.10 176.65 3c2a s TRP 33 N -1.08 3.47 0.03 2.82 0.52 -1.26 -4.27 118.94 119.18 3c2a s TRP 33 Ca 0.16 1.60 0.07 0.00 0.02 0.00 0.00 56.10 57.94 3c2a s TRP 33 Cb -0.10 -2.81 -0.02 0.00 -1.15 0.00 0.00 33.47 29.38 3c2a s TRP 33 CO 0.08 0.06 -0.20 -0.51 0.02 0.00 0.00 176.95 176.40 3c2a s LEU 34 N -2.67 2.15 0.11 2.99 1.43 -0.89 -0.65 118.68 121.14 3c2a s LEU 34 Ca 0.55 -0.49 0.07 0.00 -1.03 0.00 0.00 54.13 53.23 3c2a s LEU 34 Cb -0.13 -0.95 -0.04 0.00 0.03 0.00 0.00 46.19 45.10 3c2a s LEU 34 CO 0.18 0.16 -0.10 0.20 0.23 0.00 0.00 176.35 177.02 3c2a s ASN 35 N -1.07 4.37 -0.15 2.29 0.01 0.12 -1.51 114.94 118.99 3c2a s ASN 35 Ca 0.07 -0.40 -0.08 0.00 -0.71 0.00 0.00 52.86 51.74 3c2a s ASN 35 Cb -0.09 -0.82 -0.04 0.00 0.41 0.00 0.00 41.25 40.71 3c2a s ASN 35 CO 0.01 0.17 0.11 0.26 -1.51 0.00 0.00 177.10 176.15 3c2a s TRP 36 N -1.24 3.44 0.29 2.20 0.52 0.46 -1.53 118.94 123.10 3c2a s TRP 36 Ca 0.21 0.36 0.03 0.00 0.02 0.00 0.00 56.10 56.73 3c2a s TRP 36 Cb -0.11 -2.02 -0.06 0.00 -1.15 0.00 0.00 33.47 30.13 3c2a s TRP 36 CO 0.14 0.47 0.05 0.14 0.02 0.00 0.00 176.95 177.77 3c2a s VAL 37 N -0.33 1.07 -0.01 4.03 -7.23 0.28 -1.10 120.40 117.11 3c2a s VAL 37 Ca 0.11 -2.01 -0.18 0.00 -1.81 0.00 0.00 61.98 58.08 3c2a s VAL 37 Cb -0.12 -2.67 0.03 0.00 0.56 0.00 0.00 36.38 34.19 3c2a s VAL 37 CO 0.01 -0.07 0.39 0.00 -0.31 0.00 0.00 175.10 175.12 3c2a s ARG 38 N -3.91 0.78 -0.08 4.82 1.70 0.58 0.04 118.95 122.88 3c2a s ARG 38 Ca 0.35 -0.15 -0.03 0.00 -0.47 0.00 0.00 55.73 55.43 3c2a s ARG 38 Cb 0.08 0.35 0.05 0.00 -0.57 0.00 0.00 34.95 34.85 3c2a s ARG 38 CO 0.14 -0.23 0.15 -1.14 -1.08 0.00 0.00 175.30 173.14 3c2a s GLN 39 N -1.51 0.03 0.43 3.89 0.74 0.09 -0.72 119.66 122.60 3c2a s GLN 39 Ca -0.12 0.54 -0.23 0.00 0.05 0.00 0.00 55.36 55.60 3c2a s GLN 39 Cb -0.03 -0.28 -0.09 0.00 1.10 0.00 0.00 33.01 33.71 3c2a s GLN 39 CO 0.04 -0.30 1.06 0.00 -0.55 0.00 0.00 175.29 175.54 3c2a s ALA 40 N 2.20 3.01 0.14 1.58 0.00 -1.26 -1.13 121.76 126.30 3c2a s ALA 40 Ca 0.02 0.70 -0.34 0.00 0.00 0.00 0.00 51.96 52.34 3c2a s ALA 40 Cb -0.12 -3.28 -0.14 0.00 0.00 0.00 0.00 23.12 19.58 3c2a s ALA 40 CO -0.06 -0.29 1.53 -2.30 0.00 0.00 0.00 175.76 174.64 3c2a n PRO 41 N -0.36 1.94 -1.35 0.00 -0.02 -1.26 -1.73 135.00 132.21 3c2a n PRO 41 Ca 0.06 0.70 -0.12 0.00 -2.02 0.00 0.00 63.50 62.12 3c2a n PRO 41 Cb 0.50 -2.44 -0.05 0.00 -0.02 0.00 0.00 33.50 31.49 3c2a n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3c2a n GLY 42 N 3.24 1.28 3.46 -1.23 0.00 -1.26 -4.99 105.19 105.69 3c2a n GLY 42 Ca 0.17 -0.25 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 3c2a n GLY 42 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3c2a s LYS 43 N -2.93 1.65 0.52 1.61 2.36 -0.71 -5.16 119.74 117.09 3c2a s LYS 43 Ca 0.00 -1.90 0.05 0.00 -2.55 0.00 0.00 55.97 51.56 3c2a s LYS 43 Cb 0.00 -0.97 0.04 0.00 -1.05 0.00 0.00 37.83 35.85 3c2a s LYS 43 CO 0.00 -0.14 0.72 0.20 1.55 0.00 0.00 175.35 177.68 3c2a s GLY 44 N -3.49 1.85 0.42 5.54 0.00 -1.26 -4.56 107.32 105.81 3c2a s GLY 44 Ca 0.35 -1.61 -0.24 0.00 0.00 0.00 0.00 44.72 43.23 3c2a s GLY 44 CO 0.15 -1.31 1.11 -2.27 0.00 0.00 0.00 173.10 170.78 3c2a s LEU 45 N -4.63 4.12 -0.03 0.66 2.96 -1.26 -4.50 118.68 116.00 3c2a s LEU 45 Ca 0.58 2.18 0.01 0.00 -0.22 0.00 0.00 54.13 56.68 3c2a s LEU 45 Cb -0.09 -4.16 0.01 0.00 0.50 0.00 0.00 46.19 42.45 3c2a s LEU 45 CO 0.37 -0.65 -0.04 -0.70 -1.32 0.00 0.00 176.35 174.01 3c2a s GLU 46 N -2.50 0.61 -0.09 1.98 2.12 0.10 -4.99 118.70 115.92 3c2a s GLU 46 Ca 0.59 -0.12 -0.28 0.00 0.36 0.00 0.00 54.97 55.52 3c2a s GLU 46 Cb -0.26 -0.64 -0.02 0.00 0.26 0.00 0.00 34.13 33.48 3c2a s GLU 46 CO 0.32 -0.01 0.93 -0.46 -0.54 0.00 0.00 175.26 175.50 3c2a s TRP 47 N 0.52 3.53 -0.17 5.30 -0.00 -1.26 -0.31 118.94 126.55 3c2a s TRP 47 Ca -0.06 1.50 -0.15 0.00 -0.00 0.00 0.00 56.10 57.39 3c2a s TRP 47 Cb -0.10 -3.09 -0.11 0.00 -0.00 0.00 0.00 33.47 30.17 3c2a s TRP 47 CO -0.00 -0.15 0.03 0.28 -0.00 0.00 0.00 176.95 177.11 3c2a h VAL 48 N 5.02 0.46 -1.72 5.86 2.07 -1.45 -3.40 116.25 123.09 3c2a h VAL 48 Ca -0.34 -1.57 0.38 0.00 0.82 0.00 0.00 66.70 65.99 3c2a h VAL 48 Cb 1.16 1.10 -0.10 0.00 -1.52 0.00 0.00 31.29 31.93 3c2a h VAL 48 CO 0.82 0.16 0.97 -0.83 0.02 0.00 0.00 177.57 178.70 3c2a s GLY 49 N -4.50 -0.29 0.04 2.17 0.00 -1.07 -0.01 107.32 103.67 3c2a s GLY 49 Ca -0.21 0.39 -0.05 0.00 0.00 0.00 0.00 44.72 44.86 3c2a s GLY 49 CO 0.39 4.20 0.08 1.09 0.00 0.00 0.00 173.10 178.86 3c2a s ARG 50 N -2.05 0.60 -0.14 2.90 1.70 -0.28 -0.40 118.95 121.27 3c2a s ARG 50 Ca 0.25 -0.83 0.00 0.00 -0.47 0.00 0.00 55.73 54.69 3c2a s ARG 50 Cb 0.02 0.23 0.02 0.00 -0.57 0.00 0.00 34.95 34.66 3c2a s ARG 50 CO -0.03 -0.15 -0.12 -1.50 -1.08 0.00 0.00 175.30 172.42 3c2a s ILE 51 N -2.82 1.43 1.29 4.99 2.07 -0.57 -1.26 121.20 126.33 3c2a s ILE 51 Ca -0.03 -0.56 -0.20 0.00 -1.41 0.00 0.00 60.65 58.45 3c2a s ILE 51 Cb 0.00 -1.37 0.32 0.00 0.13 0.00 0.00 42.46 41.54 3c2a s ILE 51 CO -0.06 0.42 1.02 -0.54 -1.91 0.00 0.00 174.94 173.87 3c2a s LYS 52 N 1.54 -1.93 0.64 3.50 1.02 -0.85 -2.10 119.74 121.56 3c2a s LYS 52 Ca 0.05 0.11 -0.12 0.00 0.02 0.00 0.00 55.97 56.03 3c2a s LYS 52 Cb -0.13 -1.50 -0.03 0.00 -0.52 0.00 0.00 37.83 35.66 3c2a s LYS 52 CO -0.10 -4.21 1.04 -1.54 -0.92 0.00 0.00 175.35 169.62 3c2a s SER 52 N -3.44 5.94 0.19 2.83 1.04 -1.26 -4.47 113.70 114.53 3c2a s SER 52 Ca 0.70 1.52 -0.11 0.00 0.48 0.00 0.00 55.95 58.53 3c2a s SER 52 Cb -0.13 -2.49 0.11 0.00 0.10 0.00 0.00 66.02 63.62 3c2a s SER 52 CO 0.58 -1.06 1.80 -0.09 0.98 0.00 0.00 173.24 175.44 3c2a h ARG 52 N -0.32 0.92 -0.91 4.02 2.43 -1.88 0.93 114.38 119.57 3c2a h ARG 52 Ca -0.44 -0.11 0.20 0.00 -0.81 0.00 0.00 59.98 58.81 3c2a h ARG 52 Cb 1.20 -0.18 -0.11 0.00 -0.42 0.00 0.00 29.97 30.46 3c2a h ARG 52 CO 0.60 0.70 0.46 1.79 -1.51 0.00 0.00 179.97 182.01 3c2a h THR 52 N 0.90 0.59 -0.55 0.20 1.35 -1.94 0.62 112.91 114.08 3c2a h THR 52 Ca 0.23 -0.18 -0.19 0.00 -0.55 0.00 0.00 66.41 65.72 3c2a h THR 52 Cb 0.05 0.01 -0.11 0.00 -1.73 0.00 0.00 68.15 66.36 3c2a h THR 52 CO -0.04 0.10 0.24 0.47 -0.25 0.00 0.00 175.52 176.04 3c2a n ASP 53 N -4.94 3.85 0.00 5.36 8.00 -0.84 -4.92 116.55 123.05 3c2a n ASP 53 Ca 0.21 -2.88 0.00 0.00 0.71 0.00 0.00 54.79 52.83 3c2a n ASP 53 Cb 0.59 -0.68 0.00 0.00 -0.02 0.00 0.00 41.12 41.01 3c2a n ASP 53 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3c2a n GLY 54 N -0.14 2.99 1.85 0.44 0.00 0.21 -4.66 105.19 105.89 3c2a n GLY 54 Ca 0.31 -0.39 -0.02 0.00 0.00 0.00 0.00 46.02 45.92 3c2a n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3c2a n GLY 55 N 0.00 0.58 3.96 -0.02 0.00 0.26 -4.83 105.19 105.14 3c2a n GLY 55 Ca 0.00 -0.68 -0.27 0.00 0.00 0.00 0.00 46.02 45.07 3c2a n GLY 55 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3c2a s THR 56 N -2.63 2.05 0.11 2.61 -4.23 -1.26 -4.67 115.64 107.61 3c2a s THR 56 Ca 0.03 -0.29 0.07 0.00 -1.18 0.00 0.00 61.69 60.32 3c2a s THR 56 Cb -0.01 -2.75 -0.03 0.00 1.34 0.00 0.00 72.50 71.04 3c2a s THR 56 CO 0.04 0.00 -0.17 0.42 -0.54 0.00 0.00 174.62 174.37 3c2a s THR 57 N -3.54 1.46 0.04 3.99 -4.23 -1.26 -2.01 115.64 110.08 3c2a s THR 57 Ca 0.71 -1.56 0.05 0.00 -1.18 0.00 0.00 61.69 59.70 3c2a s THR 57 Cb -0.04 -1.44 -0.02 0.00 1.34 0.00 0.00 72.50 72.33 3c2a s THR 57 CO 0.49 -0.23 -0.13 -1.81 -0.54 0.00 0.00 174.62 172.40 3c2a s ASP 58 N -2.08 1.58 0.13 3.99 1.01 -0.39 -4.98 116.67 115.93 3c2a s ASP 58 Ca 0.06 -0.47 0.04 0.00 0.71 0.00 0.00 52.55 52.88 3c2a s ASP 58 Cb -0.08 -0.09 -0.04 0.00 1.01 0.00 0.00 42.92 43.72 3c2a s ASP 58 CO 0.04 0.00 -0.10 -0.31 0.21 0.00 0.00 175.17 175.01 3c2a s TYR 59 N -0.92 1.19 0.55 4.23 2.02 -1.26 -1.12 117.35 122.04 3c2a s TYR 59 Ca 0.00 -0.73 -0.18 0.00 -0.37 0.00 0.00 57.07 55.79 3c2a s TYR 59 Cb -0.08 -0.62 -0.05 0.00 -0.40 0.00 0.00 41.96 40.80 3c2a s TYR 59 CO 0.01 0.05 1.07 0.00 -1.57 0.00 0.00 175.55 175.11 3c2a s ALA 60 N -3.06 2.75 0.37 3.71 0.00 0.99 -4.88 121.76 121.65 3c2a s ALA 60 Ca 0.13 0.56 0.05 0.00 0.00 0.00 0.00 51.96 52.70 3c2a s ALA 60 Cb 0.01 -3.27 0.73 0.00 0.00 0.00 0.00 23.12 20.59 3c2a s ALA 60 CO 0.00 -0.67 2.02 0.00 0.00 0.00 0.00 175.76 177.10 3c2a h ALA 61 N 0.92 1.63 0.00 0.00 0.00 -1.92 -1.80 119.26 118.10 3c2a h ALA 61 Ca -0.48 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3c2a h ALA 61 Cb 1.23 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.81 3c2a h ALA 61 CO 0.58 0.32 0.00 0.66 0.00 0.00 0.00 179.25 180.81 3c2a h SER 62 N 0.74 0.00 -0.00 0.00 4.64 -1.96 -3.18 113.55 113.78 3c2a h SER 62 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 3c2a h SER 62 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 3c2a h SER 62 CO -0.05 0.00 -0.02 1.33 -0.87 0.00 0.00 176.83 177.22 3c2a n VAL 63 N -2.40 0.00 -1.89 0.95 0.24 -0.74 -5.03 118.33 109.46 3c2a n VAL 63 Ca 0.01 -0.49 -0.41 0.00 -2.04 0.00 0.00 64.34 61.40 3c2a n VAL 63 Cb 0.19 1.01 -0.02 0.00 -1.47 0.00 0.00 33.84 33.55 3c2a n VAL 63 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 3c2a s LYS 64 N -0.53 4.19 0.00 7.34 2.20 -0.83 -1.65 119.74 130.46 3c2a s LYS 64 Ca 0.01 2.45 0.00 0.00 -0.36 0.00 0.00 55.97 58.07 3c2a s LYS 64 Cb 0.01 -3.05 0.00 0.00 -1.51 0.00 0.00 37.83 33.28 3c2a s LYS 64 CO 0.02 -0.51 0.00 0.41 -0.36 0.00 0.00 175.35 174.91 3c2a n GLY 65 N 1.88 1.93 0.00 5.54 0.00 -1.26 -4.84 105.19 108.44 3c2a n GLY 65 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 3c2a n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3c2a n ARG 66 N -2.00 0.67 -4.13 1.61 1.74 -0.66 -5.01 116.66 108.88 3c2a n ARG 66 Ca 0.00 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.74 3c2a n ARG 66 Cb 0.00 -0.99 -0.07 0.00 -1.02 0.00 0.00 32.46 30.38 3c2a n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3c2a s PHE 67 N -1.98 3.31 -0.13 -1.55 0.40 -1.00 -1.18 117.98 115.86 3c2a s PHE 67 Ca 0.00 0.25 -0.01 0.00 -0.60 0.00 0.00 56.93 56.57 3c2a s PHE 67 Cb 0.00 -1.78 0.04 0.00 0.51 0.00 0.00 43.02 41.79 3c2a s PHE 67 CO 0.00 0.56 -0.03 0.99 0.70 0.00 0.00 175.22 177.44 3c2a s THR 68 N -1.10 0.80 -0.11 0.64 2.01 0.10 -4.92 115.64 113.06 3c2a s THR 68 Ca 0.20 -0.32 -0.04 0.00 0.31 0.00 0.00 61.69 61.83 3c2a s THR 68 Cb -0.12 -0.97 -0.04 0.00 0.01 0.00 0.00 72.50 71.38 3c2a s THR 68 CO 0.10 0.18 0.06 -0.63 -0.69 0.00 0.00 174.62 173.63 3c2a s ILE 69 N 1.78 4.78 0.25 1.82 1.01 -1.26 0.48 121.20 130.06 3c2a s ILE 69 Ca 0.03 -0.07 -0.13 0.00 0.00 0.00 0.00 60.65 60.48 3c2a s ILE 69 Cb -0.14 -3.05 -0.00 0.00 0.01 0.00 0.00 42.46 39.27 3c2a s ILE 69 CO -0.07 0.59 0.50 -0.94 0.00 0.00 0.00 174.94 175.02 3c2a s SER 70 N -0.77 -0.11 0.00 3.58 1.04 -1.05 -4.97 113.70 111.43 3c2a s SER 70 Ca 0.12 -0.90 -0.06 0.00 0.48 0.00 0.00 55.95 55.60 3c2a s SER 70 Cb -0.12 0.60 -0.00 0.00 0.10 0.00 0.00 66.02 66.60 3c2a s SER 70 CO 0.03 -1.15 0.11 0.00 0.98 0.00 0.00 173.24 173.20 3c2a s ARG 71 N -4.01 0.43 -0.40 4.02 1.70 -1.26 0.01 118.95 119.43 3c2a s ARG 71 Ca 0.21 -0.40 0.02 0.00 -0.47 0.00 0.00 55.73 55.10 3c2a s ARG 71 Cb -0.01 0.17 0.12 0.00 -0.57 0.00 0.00 34.95 34.66 3c2a s ARG 71 CO 0.09 -0.10 0.16 0.34 -1.08 0.00 0.00 175.30 174.71 3c2a s ASP 72 N -1.29 4.16 0.23 -2.89 3.68 0.06 -5.01 116.67 115.61 3c2a s ASP 72 Ca -0.14 -2.35 -0.06 0.00 2.13 0.00 0.00 52.55 52.13 3c2a s ASP 72 Cb -0.08 -1.27 0.33 0.00 -1.45 0.00 0.00 42.92 40.46 3c2a s ASP 72 CO 0.01 -0.32 1.82 0.44 0.13 0.00 0.00 175.17 177.25 3c2a h ASP 73 N 7.23 0.69 -0.38 -0.34 3.32 -1.96 -1.67 116.42 123.30 3c2a h ASP 73 Ca -0.06 0.03 0.11 0.00 0.02 0.00 0.00 57.03 57.13 3c2a h ASP 73 Cb 0.96 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.39 3c2a h ASP 73 CO 0.53 0.43 0.35 0.77 -1.72 0.00 0.00 179.24 179.60 3c2a h SER 74 N 0.82 0.00 -0.05 6.45 4.64 -1.96 -1.92 113.55 121.54 3c2a h SER 74 Ca 0.36 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.67 3c2a h SER 74 Cb 0.25 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.33 3c2a h SER 74 CO -0.20 0.00 -0.08 2.29 -0.87 0.00 0.00 176.83 177.96 3c2a n LYS 75 N -3.96 1.56 -2.77 4.77 2.85 -0.69 -5.00 118.16 114.93 3c2a n LYS 75 Ca 0.06 -2.76 -0.18 0.00 -1.05 0.00 0.00 58.31 54.39 3c2a n LYS 75 Cb 0.52 -1.58 0.00 0.00 -0.65 0.00 0.00 35.03 33.33 3c2a n LYS 75 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3c2a n ASN 76 N -1.26 -4.55 -4.27 -5.58 3.02 -0.72 -4.81 115.26 97.09 3c2a n ASN 76 Ca 0.18 -0.07 -0.32 0.00 -0.03 0.00 0.00 54.58 54.34 3c2a n ASN 76 Cb 0.70 -3.79 -0.16 0.00 -0.61 0.00 0.00 39.78 35.91 3c2a n ASN 76 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3c2a s THR 77 N -2.86 2.23 -0.01 3.41 2.01 -1.01 -0.33 115.64 119.08 3c2a s THR 77 Ca 0.16 -0.98 0.02 0.00 0.31 0.00 0.00 61.69 61.19 3c2a s THR 77 Cb -0.08 -1.85 -0.04 0.00 0.01 0.00 0.00 72.50 70.55 3c2a s THR 77 CO 0.19 0.56 -0.01 -0.22 -0.69 0.00 0.00 174.62 174.45 3c2a s LEU 78 N 0.13 3.45 0.09 4.42 2.96 0.14 -0.76 118.68 129.11 3c2a s LEU 78 Ca -0.12 -0.02 0.08 0.00 -0.22 0.00 0.00 54.13 53.85 3c2a s LEU 78 Cb -0.16 -1.96 -0.03 0.00 0.50 0.00 0.00 46.19 44.54 3c2a s LEU 78 CO 0.06 0.29 -0.21 -0.31 -1.32 0.00 0.00 176.35 174.86 3c2a s TYR 79 N -1.05 1.83 -0.22 5.38 2.02 0.10 0.04 117.35 125.45 3c2a s TYR 79 Ca 0.18 -0.41 -0.02 0.00 -0.37 0.00 0.00 57.07 56.46 3c2a s TYR 79 Cb -0.11 -1.01 0.07 0.00 -0.40 0.00 0.00 41.96 40.50 3c2a s TYR 79 CO 0.09 0.20 0.03 -1.17 -1.57 0.00 0.00 175.55 173.12 3c2a s LEU 80 N -1.81 1.57 -0.22 -1.29 2.96 -0.26 -2.52 118.68 117.11 3c2a s LEU 80 Ca 0.07 -1.00 -0.23 0.00 -0.22 0.00 0.00 54.13 52.74 3c2a s LEU 80 Cb -0.10 -0.74 -0.01 0.00 0.50 0.00 0.00 46.19 45.84 3c2a s LEU 80 CO 0.04 -0.31 0.76 -1.58 -1.32 0.00 0.00 176.35 173.94 3c2a s GLN 81 N 1.74 4.20 -0.32 1.98 2.00 0.18 -1.19 119.66 128.25 3c2a s GLN 81 Ca -0.00 0.83 -0.03 0.00 -2.00 0.00 0.00 55.36 54.16 3c2a s GLN 81 Cb -0.17 -3.62 0.06 0.00 0.80 0.00 0.00 33.01 30.07 3c2a s GLN 81 CO -0.10 -0.41 0.04 -1.64 -0.50 0.00 0.00 175.29 172.68 3c2a s MET 82 N 2.47 2.41 0.38 1.67 -1.94 0.92 0.02 119.30 125.24 3c2a s MET 82 Ca 0.33 -1.32 0.08 0.00 -1.71 0.00 0.00 55.69 53.07 3c2a s MET 82 Cb -0.16 -3.28 -0.02 0.00 2.01 0.00 0.00 34.83 33.39 3c2a s MET 82 CO 0.09 -0.68 0.40 -0.80 -0.01 0.00 0.00 175.02 174.01 3c2a s ASN 82 N 1.35 5.34 -1.46 3.03 0.01 -0.32 -0.28 114.94 122.60 3c2a s ASN 82 Ca -0.03 -0.55 -0.07 0.00 -0.71 0.00 0.00 52.86 51.50 3c2a s ASN 82 Cb -0.20 -0.79 0.05 0.00 0.41 0.00 0.00 41.25 40.72 3c2a s ASN 82 CO -0.01 -0.55 0.73 -1.20 -1.51 0.00 0.00 177.10 174.56 3c2a n SER 82 N -1.56 -2.38 -4.77 -1.22 7.64 -1.16 -4.67 113.62 105.50 3c2a n SER 82 Ca 0.02 -0.88 -0.41 0.00 1.01 0.00 0.00 58.87 58.61 3c2a n SER 82 Cb 0.60 -3.55 -0.01 0.00 -1.01 0.00 0.00 64.21 60.24 3c2a n SER 82 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3c2a s LEU 82 N -7.03 4.38 0.18 -3.43 1.43 0.04 -4.68 118.68 109.56 3c2a s LEU 82 Ca 0.32 2.86 0.09 0.00 -1.03 0.00 0.00 54.13 56.36 3c2a s LEU 82 Cb -0.16 -3.66 -0.04 0.00 0.03 0.00 0.00 46.19 42.36 3c2a s LEU 82 CO 0.85 -0.70 -0.08 -0.54 0.23 0.00 0.00 176.35 176.12 3c2a s LYS 83 N -1.90 2.13 0.35 1.70 1.02 -1.26 -0.64 119.74 121.13 3c2a s LYS 83 Ca 0.51 -1.24 0.09 0.00 0.02 0.00 0.00 55.97 55.35 3c2a s LYS 83 Cb -0.43 -2.20 0.81 0.00 -0.52 0.00 0.00 37.83 35.49 3c2a s LYS 83 CO 0.58 0.44 1.86 1.79 -0.92 0.00 0.00 175.35 179.09 3c2a h THR 84 N 2.69 0.82 0.00 2.17 1.35 -1.96 0.93 112.91 118.91 3c2a h THR 84 Ca -0.47 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.15 3c2a h THR 84 Cb 1.20 0.05 0.00 0.00 -1.73 0.00 0.00 68.15 67.68 3c2a h THR 84 CO 0.55 0.13 0.00 -1.84 -0.25 0.00 0.00 175.52 174.11 3c2a n GLU 85 N -4.58 0.03 0.00 4.72 0.00 -1.26 -2.01 120.64 117.54 3c2a n GLU 85 Ca 0.18 0.22 0.14 0.00 0.00 0.00 0.00 57.16 57.70 3c2a n GLU 85 Cb 0.48 -1.50 0.73 0.00 0.00 0.00 0.00 31.44 31.16 3c2a n GLU 85 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3c2a n ASP 86 N -1.47 0.00 -4.72 -1.84 8.00 0.32 -4.87 116.55 111.97 3c2a n ASP 86 Ca 0.04 -0.10 -0.42 0.00 0.71 0.00 0.00 54.79 55.02 3c2a n ASP 86 Cb 0.18 -0.29 -0.03 0.00 -0.02 0.00 0.00 41.12 40.95 3c2a n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3c2a s THR 87 N -2.59 2.15 0.00 -3.53 2.01 -0.85 -4.90 115.64 107.93 3c2a s THR 87 Ca 0.27 0.06 0.00 0.00 0.31 0.00 0.00 61.69 62.33 3c2a s THR 87 Cb 0.20 -3.04 0.00 0.00 0.01 0.00 0.00 72.50 69.67 3c2a s THR 87 CO 0.45 0.00 0.00 0.00 -0.69 0.00 0.00 174.62 174.38 3c2a n ALA 88 N 4.26 0.00 -2.63 7.40 0.00 -0.34 -4.50 120.51 124.69 3c2a n ALA 88 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.22 3c2a n ALA 88 Cb 0.36 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.72 3c2a n ALA 88 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3c2a s VAL 89 N -2.00 5.20 -0.16 0.00 1.01 -0.28 -0.49 120.40 123.67 3c2a s VAL 89 Ca 0.00 0.57 -0.08 0.00 0.00 0.00 0.00 61.98 62.47 3c2a s VAL 89 Cb 0.00 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 3c2a s VAL 89 CO 0.00 0.21 0.12 -0.31 0.00 0.00 0.00 175.10 175.12 3c2a s TYR 90 N 1.73 3.47 0.10 5.22 1.51 0.08 -0.73 117.35 128.72 3c2a s TYR 90 Ca 0.15 0.39 0.10 0.00 -1.01 0.00 0.00 57.07 56.70 3c2a s TYR 90 Cb -0.15 -2.05 -0.04 0.00 -0.11 0.00 0.00 41.96 39.62 3c2a s TYR 90 CO 0.09 0.48 -0.24 -1.12 -1.11 0.00 0.00 175.55 173.64 3c2a s SER 91 N -0.28 2.96 -0.01 2.29 0.01 0.11 -0.87 113.70 117.91 3c2a s SER 91 Ca 0.11 -0.68 -0.02 0.00 1.31 0.00 0.00 55.95 56.66 3c2a s SER 91 Cb -0.12 -0.20 -0.04 0.00 0.21 0.00 0.00 66.02 65.87 3c2a s SER 91 CO 0.01 0.15 0.15 0.00 0.41 0.00 0.00 173.24 173.96 3c2a s THR 93 N -1.28 0.61 0.24 0.00 -4.23 -0.58 0.44 115.64 110.85 3c2a s THR 93 Ca 0.26 -1.32 -0.03 0.00 -1.18 0.00 0.00 61.69 59.42 3c2a s THR 93 Cb -0.12 -0.92 -0.05 0.00 1.34 0.00 0.00 72.50 72.75 3c2a s THR 93 CO 0.17 -0.51 0.47 0.42 -0.54 0.00 0.00 174.62 174.64 3c2a s THR 94 N -1.97 5.11 -0.35 3.99 -4.23 -0.40 -0.70 115.64 117.08 3c2a s THR 94 Ca -0.04 -0.14 -0.27 0.00 -1.18 0.00 0.00 61.69 60.06 3c2a s THR 94 Cb -0.06 -3.73 0.02 0.00 1.34 0.00 0.00 72.50 70.07 3c2a s THR 94 CO -0.01 -0.24 1.00 -1.81 -0.54 0.00 0.00 174.62 173.02 3c2a s ASP 95 N -3.14 6.78 0.53 3.99 1.11 0.17 -1.10 116.67 125.01 3c2a s ASP 95 Ca 0.41 0.77 0.07 0.00 0.18 0.00 0.00 52.55 53.99 3c2a s ASP 95 Cb -0.11 -2.50 0.04 0.00 1.07 0.00 0.00 42.92 41.42 3c2a s ASP 95 CO 0.29 -0.89 0.52 -0.83 1.18 0.00 0.00 175.17 175.45 3c2a s GLY 96 N 1.82 2.13 0.03 0.21 0.00 0.21 -4.53 107.32 107.19 3c2a s GLY 96 Ca 0.42 -1.64 -0.09 0.00 0.00 0.00 0.00 44.72 43.40 3c2a s GLY 96 CO 0.18 -1.82 0.19 -0.11 0.00 0.00 0.00 173.10 171.55 3c2a s PHE 97 N -2.68 0.04 -0.21 1.90 -0.12 -1.26 -0.51 117.98 115.13 3c2a s PHE 97 Ca 0.45 -0.24 -0.03 0.00 -0.05 0.00 0.00 56.93 57.06 3c2a s PHE 97 Cb -0.04 -0.03 -0.01 0.00 -0.63 0.00 0.00 43.02 42.32 3c2a s PHE 97 CO 0.28 -0.41 -0.06 0.42 -0.05 0.00 0.00 175.22 175.40 3c2a s ILE 98 N -2.39 3.25 -0.12 -4.49 1.01 -1.26 -5.00 121.20 112.20 3c2a s ILE 98 Ca -0.06 -0.54 -0.08 0.00 0.00 0.00 0.00 60.65 59.97 3c2a s ILE 98 Cb -0.02 -2.47 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 3c2a s ILE 98 CO -0.03 0.44 0.17 -0.32 0.00 0.00 0.00 174.94 175.20 3c2a s MET 99 N 1.42 3.57 -0.14 2.79 -2.45 -1.26 -5.09 119.30 118.13 3c2a s MET 99 Ca 0.05 -0.08 0.01 0.00 -1.25 0.00 0.00 55.69 54.43 3c2a s MET 99 Cb -0.14 -3.22 0.00 0.00 1.25 0.00 0.00 34.83 32.72 3c2a s MET 99 CO -0.04 0.72 -0.18 0.42 1.05 0.00 0.00 175.02 176.99 3c2a s ILE 100 N -0.88 2.45 -0.17 10.11 1.01 -1.26 -5.09 121.20 127.37 3c2a s ILE 100 Ca 0.15 -0.85 -0.29 0.00 0.00 0.00 0.00 60.65 59.66 3c2a s ILE 100 Cb -0.12 -2.01 -0.04 0.00 0.01 0.00 0.00 42.46 40.30 3c2a s ILE 100 CO 0.04 0.53 1.69 -0.13 0.00 0.00 0.00 174.94 177.08 3c2a s ARG 100 N 0.73 3.85 0.00 2.79 0.52 -1.26 -4.58 118.95 120.99 3c2a s ARG 100 Ca -0.08 1.87 0.00 0.00 -0.52 0.00 0.00 55.73 57.00 3c2a s ARG 100 Cb -0.16 -4.06 0.00 0.00 0.52 0.00 0.00 34.95 31.25 3c2a s ARG 100 CO 0.01 -1.24 0.00 0.41 0.02 0.00 0.00 175.30 174.50 3c2a n GLY 100 N 4.62 0.78 0.01 -3.53 0.00 -0.99 -5.04 105.19 101.04 3c2a n GLY 100 Ca 0.19 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.20 3c2a n GLY 100 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3c2a n VAL 100 N 0.00 0.16 0.00 1.61 3.14 -1.26 -4.85 118.33 117.13 3c2a n VAL 100 Ca 0.00 -0.09 0.00 0.00 -2.96 0.00 0.00 64.34 61.29 3c2a n VAL 100 Cb 0.00 -0.86 0.00 0.00 -1.06 0.00 0.00 33.84 31.92 3c2a n VAL 100 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 3c2a n SER 100 N -2.21 0.40 -4.22 6.55 7.64 -1.26 -5.10 113.62 115.42 3c2a n SER 100 Ca -0.04 0.00 -0.20 0.00 1.01 0.00 0.00 58.87 59.63 3c2a n SER 100 Cb 0.57 0.08 -0.12 0.00 -1.01 0.00 0.00 64.21 63.73 3c2a n SER 100 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 3c2a s GLU 100 N -0.19 0.95 0.00 1.43 2.02 -1.26 -5.24 118.70 116.41 3c2a s GLU 100 Ca 0.00 -1.06 0.00 0.00 0.02 0.00 0.00 54.97 53.93 3c2a s GLU 100 Cb 0.00 -1.05 0.00 0.00 0.10 0.00 0.00 34.13 33.18 3c2a s GLU 100 CO 0.00 0.24 0.00 -0.25 0.02 0.00 0.00 175.26 175.27 3c2a n ASP 100 N 1.13 0.00 0.00 -0.19 9.92 -1.26 -2.35 116.55 123.80 3c2a n ASP 100 Ca -0.20 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.06 3c2a n ASP 100 Cb 0.54 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.02 3c2a n ASP 100 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3c2a n TYR 100 N 0.00 0.00 -1.86 1.24 4.11 0.34 -4.95 117.16 116.04 3c2a n TYR 100 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 57.90 57.47 3c2a n TYR 100 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 39.34 39.31 3c2a n TYR 100 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.86 175.22 3c2a s MET 100 N -2.36 3.69 0.00 -3.48 -1.94 -1.26 0.64 119.30 114.59 3c2a s MET 100 Ca 0.00 2.00 0.00 0.00 -1.71 0.00 0.00 55.69 55.98 3c2a s MET 100 Cb 0.00 -4.16 0.00 0.00 2.01 0.00 0.00 34.83 32.68 3c2a s MET 100 CO 0.00 -1.44 0.00 -3.47 -0.01 0.00 0.00 175.02 170.10 3c2a n ASP 101 N 9.13 0.00 -4.76 3.03 2.03 -0.26 -4.85 116.55 120.87 3c2a n ASP 101 Ca 0.22 0.00 -0.39 0.00 0.52 0.00 0.00 54.79 55.14 3c2a n ASP 101 Cb 0.44 -0.23 -0.05 0.00 -0.72 0.00 0.00 41.12 40.56 3c2a n ASP 101 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3c2a s VAL 102 N -0.45 4.73 -0.10 5.18 1.01 -1.26 -4.89 120.40 124.62 3c2a s VAL 102 Ca 0.00 1.47 0.03 0.00 0.00 0.00 0.00 61.98 63.47 3c2a s VAL 102 Cb 0.00 -4.03 0.01 0.00 0.00 0.00 0.00 36.38 32.36 3c2a s VAL 102 CO 0.00 0.43 -0.18 0.26 0.00 0.00 0.00 175.10 175.61 3c2a s TRP 103 N -0.41 2.15 0.97 5.22 0.52 -1.26 -1.27 118.94 124.85 3c2a s TRP 103 Ca 0.34 -0.95 -0.12 0.00 0.02 0.00 0.00 56.10 55.39 3c2a s TRP 103 Cb -0.20 -1.50 0.17 0.00 -1.15 0.00 0.00 33.47 30.80 3c2a s TRP 103 CO 0.21 -0.45 1.08 0.20 0.02 0.00 0.00 176.95 178.02 3c2a s GLY 104 N 0.72 1.61 0.39 0.98 0.00 0.17 -4.64 107.32 106.54 3c2a s GLY 104 Ca -0.12 0.01 0.21 0.00 0.00 0.00 0.00 44.72 44.83 3c2a s GLY 104 CO 0.02 0.56 1.61 0.50 0.00 0.00 0.00 173.10 175.79 3c2a h LYS 105 N -1.90 0.00 0.00 2.90 1.57 -1.89 -3.44 116.57 113.80 3c2a h LYS 105 Ca -0.52 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 3c2a h LYS 105 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 3c2a h LYS 105 CO 0.51 0.24 0.00 0.41 -0.57 0.00 0.00 179.45 180.04 3c2a n GLY 106 N 0.90 2.29 2.98 3.86 0.00 -1.26 -5.00 105.19 108.96 3c2a n GLY 106 Ca 0.02 -1.79 -0.21 0.00 0.00 0.00 0.00 46.02 44.05 3c2a n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3c2a s THR 107 N -2.29 0.76 -0.16 2.61 -1.32 -0.05 -4.81 115.64 110.39 3c2a s THR 107 Ca 0.00 -0.32 -0.25 0.00 -1.21 0.00 0.00 61.69 59.91 3c2a s THR 107 Cb 0.00 -0.70 -0.02 0.00 -1.51 0.00 0.00 72.50 70.27 3c2a s THR 107 CO 0.00 0.25 0.84 -0.89 -2.21 0.00 0.00 174.62 172.61 3c2a s THR 108 N 0.40 4.89 -0.28 5.08 2.01 -1.26 -0.74 115.64 125.73 3c2a s THR 108 Ca -0.06 1.65 -0.05 0.00 0.31 0.00 0.00 61.69 63.54 3c2a s THR 108 Cb -0.11 -4.14 0.02 0.00 0.01 0.00 0.00 72.50 68.28 3c2a s THR 108 CO 0.01 0.04 0.02 -0.69 -0.69 0.00 0.00 174.62 173.31 3c2a s VAL 109 N 2.03 3.51 -0.28 3.82 1.01 0.35 -2.04 120.40 128.79 3c2a s VAL 109 Ca 0.39 -0.85 -0.07 0.00 0.00 0.00 0.00 61.98 61.45 3c2a s VAL 109 Cb -0.17 -2.81 0.00 0.00 0.00 0.00 0.00 36.38 33.40 3c2a s VAL 109 CO 0.13 0.11 0.07 -0.89 0.00 0.00 0.00 175.10 174.53 3c2a s THR 110 N 1.42 3.97 -0.48 3.92 2.01 0.09 -1.20 115.64 125.36 3c2a s THR 110 Ca 0.01 -0.62 -0.14 0.00 0.31 0.00 0.00 61.69 61.26 3c2a s THR 110 Cb -0.17 -3.01 0.10 0.00 0.01 0.00 0.00 72.50 69.43 3c2a s THR 110 CO -0.00 0.13 0.40 -0.69 -0.69 0.00 0.00 174.62 173.76 3c2a s VAL 111 N 1.51 4.91 0.01 3.82 1.01 -1.26 -0.82 120.40 129.58 3c2a s VAL 111 Ca 0.03 -1.35 -0.18 0.00 0.00 0.00 0.00 61.98 60.48 3c2a s VAL 111 Cb -0.17 -4.05 0.03 0.00 0.00 0.00 0.00 36.38 32.20 3c2a s VAL 111 CO 0.02 -0.68 0.39 -0.55 0.00 0.00 0.00 175.10 174.29 3c2a s SER 112 N 2.82 -0.27 0.00 3.32 0.15 -0.78 -4.34 113.70 114.61 3c2a s SER 112 Ca 0.04 0.08 0.29 0.00 0.70 0.00 0.00 55.95 57.06 3c2a s SER 112 Cb -0.26 0.39 1.31 0.00 -1.71 0.00 0.00 66.02 65.75 3c2a s SER 112 CO 0.04 -0.58 1.91 -1.54 1.20 0.00 0.00 173.24 174.26 3c2a n SER 113 N 0.81 0.43 -4.78 5.45 3.41 -1.26 -4.08 113.62 113.60 3c2a n SER 113 Ca -0.20 -0.62 -0.35 0.00 -0.26 0.00 0.00 58.87 57.45 3c2a n SER 113 Cb 0.58 -0.08 -0.00 0.00 -0.26 0.00 0.00 64.21 64.44 3c2a n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3c2a s ALA 114 N -2.41 2.73 0.21 7.33 0.00 -1.25 -5.06 121.76 123.30 3c2a s ALA 114 Ca 0.31 0.77 -0.03 0.00 0.00 0.00 0.00 51.96 53.01 3c2a s ALA 114 Cb 0.20 -3.34 -0.03 0.00 0.00 0.00 0.00 23.12 19.95 3c2a s ALA 114 CO 0.46 -0.69 0.19 -1.54 0.00 0.00 0.00 175.76 174.18 3c2a s SER 115 N -1.84 0.13 -0.46 0.00 1.04 -1.26 -5.08 113.70 106.24 3c2a s SER 115 Ca 0.71 -1.32 -0.42 0.00 0.48 0.00 0.00 55.95 55.40 3c2a s SER 115 Cb -0.22 0.42 -0.18 0.00 0.10 0.00 0.00 66.02 66.13 3c2a s SER 115 CO 0.26 -0.89 1.60 0.41 0.98 0.00 0.00 173.24 175.59 3c2a n THR 116 N -0.29 0.00 -3.74 2.02 -1.04 -1.26 -4.64 114.28 105.32 3c2a n THR 116 Ca 0.02 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.90 3c2a n THR 116 Cb 0.65 -0.46 -0.12 0.00 -1.82 0.00 0.00 70.33 68.58 3c2a n THR 116 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 3c2a s LYS 117 N 3.50 0.26 0.59 -2.82 2.20 0.30 -4.93 119.74 118.83 3c2a s LYS 117 Ca 0.99 0.51 -0.08 0.00 -0.36 0.00 0.00 55.97 57.03 3c2a s LYS 117 Cb -1.37 -0.03 -0.02 0.00 -1.51 0.00 0.00 37.83 34.90 3c2a s LYS 117 CO 0.71 -0.12 0.95 0.20 -0.36 0.00 0.00 175.35 176.72 3c2a s GLY 118 N 0.93 1.60 0.53 5.54 0.00 -1.26 -1.13 107.32 113.53 3c2a s GLY 118 Ca -0.07 -0.37 -0.16 0.00 0.00 0.00 0.00 44.72 44.13 3c2a s GLY 118 CO -0.06 -0.11 0.99 2.56 0.00 0.00 0.00 173.10 176.48 3c2a s PRO 119 N -5.05 3.91 0.04 2.90 0.04 -1.26 -4.58 135.00 131.00 3c2a s PRO 119 Ca 0.53 0.94 -0.23 0.00 0.04 0.00 0.00 61.00 62.28 3c2a s PRO 119 Cb -0.11 -2.13 -0.06 0.00 0.04 0.00 0.00 34.50 32.25 3c2a s PRO 119 CO 0.49 -0.30 0.67 -1.12 0.04 0.00 0.00 177.00 176.79 3c2a s SER 120 N -3.18 7.11 -0.14 6.66 0.01 0.54 -4.89 113.70 119.82 3c2a s SER 120 Ca 0.59 1.33 0.01 0.00 1.31 0.00 0.00 55.95 59.18 3c2a s SER 120 Cb -0.10 -2.42 -0.01 0.00 0.21 0.00 0.00 66.02 63.71 3c2a s SER 120 CO 0.34 0.10 -0.16 -0.69 0.41 0.00 0.00 173.24 173.23 3c2a s VAL 121 N -0.32 2.67 0.09 3.43 1.01 -1.26 -0.13 120.40 125.90 3c2a s VAL 121 Ca 0.34 -0.78 0.07 0.00 0.00 0.00 0.00 61.98 61.61 3c2a s VAL 121 Cb -0.20 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.04 3c2a s VAL 121 CO 0.20 0.53 -0.19 -0.36 0.00 0.00 0.00 175.10 175.28 3c2a s PHE 122 N 0.59 1.65 0.38 5.22 0.08 -0.44 -4.97 117.98 120.49 3c2a s PHE 122 Ca -0.09 -0.42 -0.25 0.00 0.12 0.00 0.00 56.93 56.28 3c2a s PHE 122 Cb -0.16 -0.91 -0.09 0.00 -0.57 0.00 0.00 43.02 41.29 3c2a s PHE 122 CO 0.03 0.16 1.08 -1.25 -0.10 0.00 0.00 175.22 175.14 3c2a s PRO 123 N -1.80 4.20 -0.32 0.24 0.04 -1.26 -0.19 135.00 135.91 3c2a s PRO 123 Ca 0.04 1.62 -0.10 0.00 0.04 0.00 0.00 61.00 62.60 3c2a s PRO 123 Cb -0.10 -2.66 -0.01 0.00 0.04 0.00 0.00 34.50 31.78 3c2a s PRO 123 CO 0.04 -0.14 0.17 -0.51 0.04 0.00 0.00 177.00 176.60 3c2a s LEU 124 N -2.45 4.20 0.02 -3.56 1.43 0.70 -4.74 118.68 114.28 3c2a s LEU 124 Ca 0.56 -0.51 -0.01 0.00 -1.03 0.00 0.00 54.13 53.13 3c2a s LEU 124 Cb -0.25 -2.03 -0.02 0.00 0.03 0.00 0.00 46.19 43.92 3c2a s LEU 124 CO 0.32 -0.21 -0.00 0.00 0.23 0.00 0.00 176.35 176.69 3c2a s ALA 125 N 1.63 0.05 0.95 4.21 0.00 -1.26 -1.10 121.76 126.24 3c2a s ALA 125 Ca 0.05 -0.50 -0.11 0.00 0.00 0.00 0.00 51.96 51.40 3c2a s ALA 125 Cb -0.17 0.14 0.16 0.00 0.00 0.00 0.00 23.12 23.25 3c2a s ALA 125 CO 0.07 -0.16 1.09 -1.25 0.00 0.00 0.00 175.76 175.51 3c2a s PRO 126 N -1.39 0.75 0.00 0.00 0.04 -1.26 -5.01 135.00 128.14 3c2a s PRO 126 Ca -0.15 1.10 0.00 0.00 0.04 0.00 0.00 61.00 61.98 3c2a s PRO 126 Cb -0.09 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 32.72 3c2a s PRO 126 CO -0.01 -2.67 0.51 0.00 0.04 0.00 0.00 177.00 174.88 3c2a s SER 128 N -1.91 3.34 -0.53 0.00 0.15 -1.26 -4.86 113.70 108.63 3c2a s SER 128 Ca 0.00 1.76 -0.26 0.00 0.70 0.00 0.00 55.95 58.15 3c2a s SER 128 Cb 0.00 -2.38 -0.04 0.00 -1.71 0.00 0.00 66.02 61.89 3c2a s SER 128 CO 0.00 -2.76 2.09 -0.13 1.20 0.00 0.00 173.24 173.64 3c2a s ARG 129 N -4.80 2.46 -1.08 5.44 0.52 -1.26 -4.85 118.95 115.38 3c2a s ARG 129 Ca 0.64 1.03 -0.21 0.00 -0.52 0.00 0.00 55.73 56.67 3c2a s ARG 129 Cb -0.20 -4.46 -0.07 0.00 0.52 0.00 0.00 34.95 30.74 3c2a s ARG 129 CO 0.58 -2.89 1.94 0.45 0.02 0.00 0.00 175.30 175.40 3c2a n SER 130 N 13.88 3.25 0.00 0.23 2.88 -1.26 -3.91 113.62 128.69 3c2a n SER 130 Ca 0.27 -2.74 0.00 0.00 -1.33 0.00 0.00 58.87 55.07 3c2a n SER 130 Cb 0.53 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 62.50 3c2a n SER 130 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3c2a n THR 133 N 6.52 0.00 0.25 2.46 -2.24 -1.26 -4.79 114.28 115.22 3c2a n THR 133 Ca 0.48 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.26 3c2a n THR 133 Cb 0.43 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.67 3c2a n THR 133 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3c2a n SER 134 N -0.11 0.00 0.00 3.42 3.41 -1.25 -4.34 113.62 114.74 3c2a n SER 134 Ca 0.00 -0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.37 3c2a n SER 134 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3c2a n SER 134 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3c2a n GLY 135 N -0.40 -1.86 0.00 5.00 0.00 -1.26 -5.12 105.19 101.56 3c2a n GLY 135 Ca 0.00 0.64 0.00 0.00 0.00 0.00 0.00 46.02 46.66 3c2a n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3c2a n GLY 136 N 0.00 0.76 3.61 -0.02 0.00 -1.26 -4.00 105.19 104.28 3c2a n GLY 136 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 3c2a n GLY 136 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3c2a s THR 137 N 0.22 3.27 0.03 2.61 -4.23 -1.26 -0.82 115.64 115.47 3c2a s THR 137 Ca 0.00 -1.95 0.07 0.00 -1.18 0.00 0.00 61.69 58.63 3c2a s THR 137 Cb 0.00 -2.73 -0.02 0.00 1.34 0.00 0.00 72.50 71.09 3c2a s THR 137 CO 0.00 -0.34 -0.21 0.00 -0.54 0.00 0.00 174.62 173.53 3c2a s ALA 138 N -2.27 1.76 -0.17 3.99 0.00 0.13 -4.58 121.76 120.62 3c2a s ALA 138 Ca 0.30 -1.03 -0.09 0.00 0.00 0.00 0.00 51.96 51.15 3c2a s ALA 138 Cb -0.07 -0.36 -0.05 0.00 0.00 0.00 0.00 23.12 22.65 3c2a s ALA 138 CO 0.19 0.40 0.13 0.00 0.00 0.00 0.00 175.76 176.47 3c2a s ALA 139 N -0.74 3.73 0.14 0.00 0.00 -1.26 0.14 121.76 123.76 3c2a s ALA 139 Ca 0.08 -0.68 0.04 0.00 0.00 0.00 0.00 51.96 51.40 3c2a s ALA 139 Cb -0.09 -2.07 -0.04 0.00 0.00 0.00 0.00 23.12 20.92 3c2a s ALA 139 CO 0.01 0.33 -0.09 -0.51 0.00 0.00 0.00 175.76 175.50 3c2a s LEU 140 N -0.15 2.52 0.00 0.00 1.02 -0.67 -4.43 118.68 116.97 3c2a s LEU 140 Ca 0.10 -1.01 0.00 0.00 0.02 0.00 0.00 54.13 53.24 3c2a s LEU 140 Cb -0.11 -0.28 0.00 0.00 0.02 0.00 0.00 46.19 45.81 3c2a s LEU 140 CO 0.00 -0.36 0.00 0.61 0.02 0.00 0.00 176.35 176.62 3c2a n GLY 141 N -0.16 0.99 3.02 -3.19 0.00 -0.26 -0.75 105.19 104.84 3c2a n GLY 141 Ca -0.11 -0.85 -0.22 0.00 0.00 0.00 0.00 46.02 44.84 3c2a n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c2a s LEU 143 N 0.26 4.25 -0.48 0.00 2.96 0.73 -1.44 118.68 124.95 3c2a s LEU 143 Ca -0.05 0.12 -0.09 0.00 -0.22 0.00 0.00 54.13 53.89 3c2a s LEU 143 Cb -0.10 -2.58 0.12 0.00 0.50 0.00 0.00 46.19 44.13 3c2a s LEU 143 CO 0.01 -0.40 0.35 -0.69 -1.32 0.00 0.00 176.35 174.30 3c2a s VAL 144 N 2.33 4.18 -0.10 1.68 1.01 0.03 -1.33 120.40 128.20 3c2a s VAL 144 Ca 0.19 -1.86 -0.03 0.00 0.00 0.00 0.00 61.98 60.27 3c2a s VAL 144 Cb -0.16 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 3c2a s VAL 144 CO 0.12 -0.78 0.04 -0.54 0.00 0.00 0.00 175.10 173.93 3c2a s LYS 145 N 1.27 3.18 -0.62 2.72 1.02 0.82 -1.59 119.74 126.54 3c2a s LYS 145 Ca 0.07 -0.34 -0.03 0.00 0.02 0.00 0.00 55.97 55.68 3c2a s LYS 145 Cb -0.25 -2.92 -0.04 0.00 -0.52 0.00 0.00 37.83 34.10 3c2a s LYS 145 CO -0.01 0.67 0.55 -0.25 -0.92 0.00 0.00 175.35 175.39 3c2a n ASP 146 N 2.26 -5.08 -4.30 2.83 8.00 -0.46 -0.34 116.55 119.46 3c2a n ASP 146 Ca -0.19 -0.36 -0.16 0.00 0.71 0.00 0.00 54.79 54.79 3c2a n ASP 146 Cb 0.54 -3.52 -0.10 0.00 -0.02 0.00 0.00 41.12 38.01 3c2a n ASP 146 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3c2a s TYR 147 N -3.20 1.48 -0.27 1.24 -0.85 -0.71 -4.20 117.35 110.84 3c2a s TYR 147 Ca 0.23 -0.73 -0.25 0.00 -0.52 0.00 0.00 57.07 55.80 3c2a s TYR 147 Cb -0.03 -0.76 0.09 0.00 0.38 0.00 0.00 41.96 41.64 3c2a s TYR 147 CO 0.47 0.15 0.83 0.12 -1.52 0.00 0.00 175.55 175.60 3c2a s PHE 148 N -3.22 -0.67 0.00 -3.49 5.36 -0.28 -0.36 117.98 115.31 3c2a s PHE 148 Ca 0.21 1.64 0.00 0.00 -0.96 0.00 0.00 56.93 57.82 3c2a s PHE 148 Cb 0.02 0.31 0.00 0.00 -0.34 0.00 0.00 43.02 43.01 3c2a s PHE 148 CO 0.04 -0.33 0.00 -0.35 -1.46 0.00 0.00 175.22 173.12 3c2a n PRO 149 N 2.48 0.39 -1.35 10.12 -0.04 -1.26 -0.54 135.00 144.80 3c2a n PRO 149 Ca -0.13 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.00 3c2a n PRO 149 Cb 0.55 0.00 0.09 0.00 -0.04 0.00 0.00 33.50 34.11 3c2a n PRO 149 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3c2a s GLU 150 N -2.39 2.14 0.31 0.54 0.41 -1.26 -4.74 118.70 113.72 3c2a s GLU 150 Ca 0.00 1.50 0.06 0.00 -0.41 0.00 0.00 54.97 56.12 3c2a s GLU 150 Cb 0.00 -1.86 -0.02 0.00 -1.78 0.00 0.00 34.13 30.47 3c2a s GLU 150 CO 0.00 -1.78 0.42 -1.25 -0.49 0.00 0.00 175.26 172.16 3c2a s PRO 151 N -4.30 3.15 0.03 0.39 0.04 -1.26 -4.93 135.00 128.12 3c2a s PRO 151 Ca 0.68 -0.98 0.07 0.00 0.04 0.00 0.00 61.00 60.81 3c2a s PRO 151 Cb -0.23 -2.80 -0.03 0.00 0.04 0.00 0.00 34.50 31.48 3c2a s PRO 151 CO 0.49 0.16 -0.19 0.08 0.04 0.00 0.00 177.00 177.57 3c2a s VAL 152 N -2.14 2.68 -0.02 -0.36 1.01 -1.26 -4.31 120.40 116.00 3c2a s VAL 152 Ca 0.42 -1.18 0.06 0.00 0.00 0.00 0.00 61.98 61.29 3c2a s VAL 152 Cb -0.09 -2.10 -0.02 0.00 0.00 0.00 0.00 36.38 34.17 3c2a s VAL 152 CO 0.30 0.37 -0.22 0.28 0.00 0.00 0.00 175.10 175.84 3c2a s THR 153 N -0.88 1.71 -0.04 3.92 -1.32 -0.37 -4.98 115.64 113.69 3c2a s THR 153 Ca 0.14 -0.92 0.02 0.00 -1.21 0.00 0.00 61.69 59.72 3c2a s THR 153 Cb -0.10 -1.43 0.01 0.00 -1.51 0.00 0.00 72.50 69.47 3c2a s THR 153 CO 0.04 0.48 -0.09 -0.69 -2.21 0.00 0.00 174.62 172.16 3c2a s VAL 154 N -0.45 0.82 0.41 5.08 1.01 -1.26 -0.42 120.40 125.59 3c2a s VAL 154 Ca 0.07 -0.34 0.04 0.00 0.00 0.00 0.00 61.98 61.74 3c2a s VAL 154 Cb -0.09 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 3c2a s VAL 154 CO -0.00 0.27 0.11 -0.94 0.00 0.00 0.00 175.10 174.54 3c2a s SER 156 N 0.44 2.89 -0.03 3.32 1.04 -0.46 -4.98 113.70 115.93 3c2a s SER 156 Ca -0.07 -1.65 0.02 0.00 0.48 0.00 0.00 55.95 54.72 3c2a s SER 156 Cb -0.11 0.47 0.01 0.00 0.10 0.00 0.00 66.02 66.48 3c2a s SER 156 CO 0.01 -0.90 -0.07 0.26 0.98 0.00 0.00 173.24 173.52 3c2a s TRP 157 N -3.18 0.82 -1.55 5.02 0.52 -1.26 -0.49 118.94 118.81 3c2a s TRP 157 Ca 0.23 -0.20 -0.10 0.00 0.02 0.00 0.00 56.10 56.04 3c2a s TRP 157 Cb 0.03 -0.61 0.08 0.00 -1.15 0.00 0.00 33.47 31.82 3c2a s TRP 157 CO 0.14 -0.11 0.71 0.09 0.02 0.00 0.00 176.95 177.79 3c2a n ASN 162 N 3.44 -2.54 -2.30 2.95 3.02 0.95 -2.09 115.26 118.69 3c2a n ASN 162 Ca -0.19 -0.95 -0.18 0.00 -0.03 0.00 0.00 54.58 53.23 3c2a n ASN 162 Cb 0.54 -3.18 0.01 0.00 -0.61 0.00 0.00 39.78 36.54 3c2a n ASN 162 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3c2a n SER 163 N -2.83 -5.25 0.00 6.41 7.64 -1.26 -0.53 113.62 117.80 3c2a n SER 163 Ca -0.08 -0.14 0.00 0.00 1.01 0.00 0.00 58.87 59.66 3c2a n SER 163 Cb 0.57 -4.19 0.00 0.00 -1.01 0.00 0.00 64.21 59.58 3c2a n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3c2a n GLY 164 N -1.24 1.96 0.22 0.23 0.00 -0.89 -4.91 105.19 100.57 3c2a n GLY 164 Ca -0.14 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.02 3c2a n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c2a h ALA 165 N 0.00 1.00 -3.24 4.61 0.00 -0.74 -3.40 119.26 117.49 3c2a h ALA 165 Ca 0.00 0.00 -0.68 0.00 0.00 0.00 0.00 54.91 54.23 3c2a h ALA 165 Cb 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 17.79 17.49 3c2a h ALA 165 CO 0.00 0.00 -0.70 -1.17 0.00 0.00 0.00 179.25 177.38 3c2a s LEU 166 N -5.90 3.50 0.00 0.00 0.20 -1.04 -4.90 118.68 110.54 3c2a s LEU 166 Ca 0.05 -0.90 0.00 0.00 0.69 0.00 0.00 54.13 53.97 3c2a s LEU 166 Cb 0.08 -1.73 0.00 0.00 -0.43 0.00 0.00 46.19 44.10 3c2a s LEU 166 CO 0.59 -0.17 0.00 1.07 -0.29 0.00 0.00 176.35 177.55 3c2a n THR 167 N 4.72 0.00 -2.03 3.68 5.66 -1.26 -4.25 114.28 120.79 3c2a n THR 167 Ca -0.15 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.42 3c2a n THR 167 Cb 0.47 -0.48 -0.03 0.00 -1.55 0.00 0.00 70.33 68.74 3c2a n THR 167 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 3c2a s SER 168 N -1.98 6.69 0.00 1.09 0.15 -1.26 -2.83 113.70 115.55 3c2a s SER 168 Ca 0.00 2.29 0.00 0.00 0.70 0.00 0.00 55.95 58.94 3c2a s SER 168 Cb 0.00 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.76 3c2a s SER 168 CO 0.00 -0.87 0.00 0.61 1.20 0.00 0.00 173.24 174.18 3c2a n GLY 169 N 3.98 0.46 3.72 9.45 0.00 -1.26 -4.77 105.19 116.78 3c2a n GLY 169 Ca 0.16 -0.41 -0.40 0.00 0.00 0.00 0.00 46.02 45.37 3c2a n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3c2a s VAL 171 N -2.00 4.97 -0.24 1.61 1.01 -1.13 -1.50 120.40 123.12 3c2a s VAL 171 Ca 0.00 1.50 -0.03 0.00 0.00 0.00 0.00 61.98 63.45 3c2a s VAL 171 Cb 0.00 -4.06 0.08 0.00 0.00 0.00 0.00 36.38 32.39 3c2a s VAL 171 CO 0.00 0.28 0.07 -2.28 0.00 0.00 0.00 175.10 173.17 3c2a s HIS 172 N 0.58 0.94 -0.11 5.22 2.46 0.25 -5.01 115.29 119.63 3c2a s HIS 172 Ca 0.38 -1.00 -0.13 0.00 0.47 0.00 0.00 55.06 54.79 3c2a s HIS 172 Cb -0.18 -1.12 -0.05 0.00 -0.13 0.00 0.00 32.58 31.10 3c2a s HIS 172 CO 0.20 -0.70 0.29 0.99 -2.47 0.00 0.00 174.74 173.05 3c2a s THR 173 N 1.88 5.28 0.03 0.89 2.01 -1.26 -0.07 115.64 124.40 3c2a s THR 173 Ca 0.04 0.56 0.00 0.00 0.31 0.00 0.00 61.69 62.60 3c2a s THR 173 Cb -0.17 -3.61 -0.04 0.00 0.01 0.00 0.00 72.50 68.69 3c2a s THR 173 CO -0.18 0.48 0.11 -0.36 -0.69 0.00 0.00 174.62 173.98 3c2a s PHE 174 N -0.17 3.33 0.56 4.92 0.40 -0.03 -5.00 117.98 121.99 3c2a s PHE 174 Ca 0.18 0.19 -0.20 0.00 -0.60 0.00 0.00 56.93 56.50 3c2a s PHE 174 Cb -0.14 -1.72 -0.05 0.00 0.51 0.00 0.00 43.02 41.62 3c2a s PHE 174 CO 0.06 0.56 1.15 -2.30 0.70 0.00 0.00 175.22 175.39 3c2a n PRO 175 N 0.79 1.27 -2.24 0.24 -0.02 -1.26 -4.34 135.00 129.43 3c2a n PRO 175 Ca -0.10 0.47 -0.36 0.00 -2.02 0.00 0.00 63.50 61.49 3c2a n PRO 175 Cb 0.52 -2.34 -0.00 0.00 -0.02 0.00 0.00 33.50 31.66 3c2a n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3c2a s ALA 176 N -1.39 2.82 0.20 3.55 0.00 -1.26 -4.77 121.76 120.92 3c2a s ALA 176 Ca 0.73 0.89 -0.04 0.00 0.00 0.00 0.00 51.96 53.54 3c2a s ALA 176 Cb -0.43 -3.38 -0.05 0.00 0.00 0.00 0.00 23.12 19.26 3c2a s ALA 176 CO 0.48 -0.74 0.43 0.54 0.00 0.00 0.00 175.76 176.48 3c2a s VAL 177 N -1.65 5.13 -0.20 0.00 0.11 0.25 -4.90 120.40 119.12 3c2a s VAL 177 Ca 0.69 -0.04 -0.04 0.00 -2.93 0.00 0.00 61.98 59.65 3c2a s VAL 177 Cb -0.27 -3.68 -0.02 0.00 -1.53 0.00 0.00 36.38 30.89 3c2a s VAL 177 CO 0.31 -0.11 -0.02 -0.22 -3.33 0.00 0.00 175.10 171.73 3c2a s LEU 178 N -3.06 3.13 0.49 2.54 2.96 -1.26 -1.21 118.68 122.27 3c2a s LEU 178 Ca 0.41 -0.26 -0.01 0.00 -0.22 0.00 0.00 54.13 54.05 3c2a s LEU 178 Cb -0.11 -1.79 0.00 0.00 0.50 0.00 0.00 46.19 44.79 3c2a s LEU 178 CO 0.27 0.05 0.74 -1.10 -1.32 0.00 0.00 176.35 174.98 3c2a s GLN 179 N 1.10 3.01 0.58 1.98 -0.21 -0.42 -4.99 119.66 120.72 3c2a s GLN 179 Ca 0.02 -0.36 0.27 0.00 0.02 0.00 0.00 55.36 55.31 3c2a s GLN 179 Cb -0.14 -2.48 1.60 0.00 1.00 0.00 0.00 33.01 32.99 3c2a s GLN 179 CO 0.01 -0.40 2.09 0.77 -2.12 0.00 0.00 175.29 175.64 3c2a h SER 180 N 0.23 0.00 0.50 5.90 0.02 -1.99 -1.10 113.55 117.11 3c2a h SER 180 Ca -0.46 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 3c2a h SER 180 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 3c2a h SER 180 CO 0.58 0.00 0.00 -1.54 -1.14 0.00 0.00 176.83 174.73 3c2a n SER 182 N -3.91 0.00 0.00 3.07 3.41 -1.26 -4.84 113.62 110.08 3c2a n SER 182 Ca 0.02 0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 3c2a n SER 182 Cb 0.34 -0.34 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 3c2a n SER 182 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3c2a n GLY 183 N 0.66 0.82 3.88 5.00 0.00 -0.42 -3.93 105.19 111.19 3c2a n GLY 183 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 3c2a n GLY 183 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3c2a s LEU 184 N 0.00 4.28 0.11 0.99 1.43 -1.25 -4.85 118.68 119.39 3c2a s LEU 184 Ca 0.00 0.78 0.03 0.00 -1.03 0.00 0.00 54.13 53.91 3c2a s LEU 184 Cb 0.00 -3.29 -0.04 0.00 0.03 0.00 0.00 46.19 42.89 3c2a s LEU 184 CO 0.00 0.07 0.17 -0.31 0.23 0.00 0.00 176.35 176.51 3c2a s TYR 185 N -1.59 3.32 -0.00 0.29 1.51 0.51 -1.30 117.35 120.09 3c2a s TYR 185 Ca 0.40 0.10 -0.01 0.00 -1.01 0.00 0.00 57.07 56.55 3c2a s TYR 185 Cb -0.13 -1.63 -0.00 0.00 -0.11 0.00 0.00 41.96 40.09 3c2a s TYR 185 CO 0.21 0.53 0.01 -1.12 -1.11 0.00 0.00 175.55 174.08 3c2a s SER 186 N -2.81 0.04 0.29 2.29 0.01 -0.35 -1.35 113.70 111.83 3c2a s SER 186 Ca 0.32 -0.10 0.02 0.00 1.31 0.00 0.00 55.95 57.50 3c2a s SER 186 Cb -0.11 0.06 -0.04 0.00 0.21 0.00 0.00 66.02 66.13 3c2a s SER 186 CO 0.25 -0.09 0.12 -1.48 0.41 0.00 0.00 173.24 172.45 3c2a s LEU 187 N -0.40 1.69 0.16 2.44 0.05 -0.62 0.84 118.68 122.84 3c2a s LEU 187 Ca -0.04 -1.48 0.08 0.00 0.05 0.00 0.00 54.13 52.74 3c2a s LEU 187 Cb -0.03 0.08 -0.04 0.00 -2.05 0.00 0.00 46.19 44.15 3c2a s LEU 187 CO -0.00 -0.81 -0.16 -0.44 -0.55 0.00 0.00 176.35 174.39 3c2a s SER 188 N -3.36 2.48 -0.09 1.48 0.01 -1.26 -0.79 113.70 112.16 3c2a s SER 188 Ca 0.36 -0.89 0.00 0.00 1.31 0.00 0.00 55.95 56.74 3c2a s SER 188 Cb 0.06 -0.13 0.02 0.00 0.21 0.00 0.00 66.02 66.19 3c2a s SER 188 CO 0.15 -0.10 -0.08 -0.55 0.41 0.00 0.00 173.24 173.08 3c2a s SER 189 N -2.77 1.87 0.20 2.44 0.15 -0.52 -0.85 113.70 114.22 3c2a s SER 189 Ca 0.16 -0.26 0.08 0.00 0.70 0.00 0.00 55.95 56.63 3c2a s SER 189 Cb -0.04 -0.76 -0.04 0.00 -1.71 0.00 0.00 66.02 63.47 3c2a s SER 189 CO 0.06 -0.08 -0.03 0.68 1.20 0.00 0.00 173.24 175.07 3c2a s VAL 190 N 1.35 3.51 -0.04 4.45 -7.23 0.91 -0.51 120.40 122.83 3c2a s VAL 190 Ca -0.02 -1.61 0.03 0.00 -1.81 0.00 0.00 61.98 58.56 3c2a s VAL 190 Cb -0.14 -2.79 0.01 0.00 0.56 0.00 0.00 36.38 34.02 3c2a s VAL 190 CO -0.04 -0.18 -0.11 -0.69 -0.31 0.00 0.00 175.10 173.77 3c2a s VAL 191 N -1.87 1.00 -0.23 1.32 1.01 0.07 -0.58 120.40 121.12 3c2a s VAL 191 Ca 0.28 -0.44 -0.10 0.00 0.00 0.00 0.00 61.98 61.71 3c2a s VAL 191 Cb -0.08 -0.89 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 3c2a s VAL 191 CO 0.18 0.31 0.15 0.42 0.00 0.00 0.00 175.10 176.16 3c2a s THR 192 N 0.38 5.35 0.27 3.92 -4.23 -0.56 -1.67 115.64 119.10 3c2a s THR 192 Ca -0.08 0.17 0.09 0.00 -1.18 0.00 0.00 61.69 60.70 3c2a s THR 192 Cb -0.12 -3.48 -0.05 0.00 1.34 0.00 0.00 72.50 70.19 3c2a s THR 192 CO 0.02 0.38 -0.12 0.68 -0.54 0.00 0.00 174.62 175.03 3c2a s VAL 193 N 0.83 1.98 0.18 2.29 -7.23 0.12 -4.72 120.40 113.85 3c2a s VAL 193 Ca 0.08 -2.23 -0.32 0.00 -1.81 0.00 0.00 61.98 57.70 3c2a s VAL 193 Cb -0.13 -2.35 -0.10 0.00 0.56 0.00 0.00 36.38 34.36 3c2a s VAL 193 CO 0.02 -0.38 1.59 -2.84 -0.31 0.00 0.00 175.10 173.18 3c2a s PRO 194 N -3.63 4.20 0.07 4.82 0.02 -1.26 0.20 135.00 139.42 3c2a s PRO 194 Ca 0.28 2.40 -0.28 0.00 0.02 0.00 0.00 61.00 63.42 3c2a s PRO 194 Cb 0.00 -3.14 -0.14 0.00 0.02 0.00 0.00 34.50 31.25 3c2a s PRO 194 CO 0.12 -0.62 1.44 0.77 -0.33 0.00 0.00 177.00 178.38 3c2a h SER 195 N 6.67 -1.11 0.00 2.53 0.02 -1.20 -3.02 113.55 117.44 3c2a h SER 195 Ca -0.43 0.09 -0.33 0.00 -0.84 0.00 0.00 61.79 60.28 3c2a h SER 195 Cb 1.20 0.37 -0.00 0.00 0.14 0.00 0.00 62.40 64.11 3c2a h SER 195 CO 0.91 -0.53 1.88 -0.24 -1.14 0.00 0.00 176.83 177.71 3c2a n SER 196 N -4.84 4.98 -0.11 3.07 2.88 -1.26 -1.97 113.62 116.38 3c2a n SER 196 Ca -0.09 -2.30 0.00 0.00 -1.33 0.00 0.00 58.87 55.15 3c2a n SER 196 Cb 0.36 -1.11 0.00 0.00 -0.75 0.00 0.00 64.21 62.72 3c2a n SER 196 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3c2a n SER 197 N 3.59 0.00 0.12 -3.46 3.41 -1.14 -4.99 113.62 111.15 3c2a n SER 197 Ca 0.44 -0.97 0.13 0.00 -0.26 0.00 0.00 58.87 58.21 3c2a n SER 197 Cb 0.31 0.00 0.37 0.00 -0.26 0.00 0.00 64.21 64.63 3c2a n SER 197 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3c2a h LEU 198 N 0.00 0.00 0.31 1.04 3.38 -1.51 -3.23 115.31 115.30 3c2a h LEU 198 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3c2a h LEU 198 Cb 0.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.72 3c2a h LEU 198 CO 0.00 0.00 -0.15 1.23 0.09 0.00 0.00 178.44 179.61 3c2a h GLY 199 N 4.43 -0.43 0.00 0.83 0.00 -1.94 -3.41 103.07 102.54 3c2a h GLY 199 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.49 3c2a h GLY 199 CO 0.00 -0.16 0.00 -1.30 0.00 0.00 0.00 176.54 175.08 3c2a n THR 200 N -4.22 0.00 -4.01 4.70 -2.24 -1.22 -4.75 114.28 102.54 3c2a n THR 200 Ca -0.05 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.60 3c2a n THR 200 Cb 0.16 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.37 3c2a n THR 200 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3c2a s GLN 203 N -4.80 1.98 0.16 -0.78 -2.07 -1.26 -5.18 119.66 107.71 3c2a s GLN 203 Ca 0.00 -1.65 0.05 0.00 -1.82 0.00 0.00 55.36 51.95 3c2a s GLN 203 Cb 0.00 0.49 -0.04 0.00 -1.09 0.00 0.00 33.01 32.38 3c2a s GLN 203 CO 0.00 -0.85 0.12 0.95 -1.32 0.00 0.00 175.29 174.19 3c2a s THR 205 N -2.92 4.40 -0.14 3.63 -4.23 -1.26 -5.00 115.64 110.13 3c2a s THR 205 Ca 0.26 -1.10 -0.00 0.00 -1.18 0.00 0.00 61.69 59.66 3c2a s THR 205 Cb -0.02 -3.24 0.03 0.00 1.34 0.00 0.00 72.50 70.61 3c2a s THR 205 CO 0.17 -0.10 -0.09 -0.31 -0.54 0.00 0.00 174.62 173.76 3c2a s TYR 206 N -1.73 1.76 -0.11 3.99 2.02 -1.26 -4.95 117.35 117.06 3c2a s TYR 206 Ca 0.30 -0.98 0.00 0.00 -0.37 0.00 0.00 57.07 56.02 3c2a s TYR 206 Cb -0.10 -1.37 0.02 0.00 -0.40 0.00 0.00 41.96 40.11 3c2a s TYR 206 CO 0.23 -0.59 -0.10 0.99 -1.57 0.00 0.00 175.55 174.51 3c2a s THR 207 N 1.62 1.19 -0.15 -0.71 2.01 -1.26 -0.86 115.64 117.48 3c2a s THR 207 Ca 0.04 -0.41 -0.21 0.00 0.31 0.00 0.00 61.69 61.41 3c2a s THR 207 Cb -0.13 -1.16 -0.03 0.00 0.01 0.00 0.00 72.50 71.18 3c2a s THR 207 CO -0.09 0.39 0.63 0.00 -0.69 0.00 0.00 174.62 174.87 3c2a s ASN 209 N 1.01 5.90 -0.17 0.00 -0.87 0.36 -2.00 114.94 119.17 3c2a s ASN 209 Ca 0.31 -0.66 -0.06 0.00 -1.57 0.00 0.00 52.86 50.89 3c2a s ASN 209 Cb -0.16 -2.09 -0.03 0.00 -0.02 0.00 0.00 41.25 38.94 3c2a s ASN 209 CO 0.12 -0.30 0.01 -0.69 -2.57 0.00 0.00 177.10 173.67 3c2a s VAL 210 N 1.66 4.31 -0.11 1.60 1.01 0.15 -1.35 120.40 127.68 3c2a s VAL 210 Ca 0.05 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 61.83 3c2a s VAL 210 Cb -0.18 -2.92 0.02 0.00 0.00 0.00 0.00 36.38 33.30 3c2a s VAL 210 CO 0.09 0.47 -0.12 0.21 0.00 0.00 0.00 175.10 175.75 3c2a s ASN 211 N 0.42 2.25 -0.48 3.32 2.47 0.44 -1.17 114.94 122.19 3c2a s ASN 211 Ca -0.00 -0.37 0.03 0.00 0.42 0.00 0.00 52.86 52.93 3c2a s ASN 211 Cb -0.13 -0.97 0.13 0.00 -1.45 0.00 0.00 41.25 38.82 3c2a s ASN 211 CO 0.02 -0.03 0.23 -2.28 -3.72 0.00 0.00 177.10 171.32 3c2a s HIS 212 N 1.18 3.36 0.18 0.43 5.65 0.49 -1.24 115.29 125.35 3c2a s HIS 212 Ca -0.04 -3.06 -0.10 0.00 0.25 0.00 0.00 55.06 52.11 3c2a s HIS 212 Cb -0.14 -2.90 0.09 0.00 -1.18 0.00 0.00 32.58 28.45 3c2a s HIS 212 CO -0.03 -0.81 1.72 -0.22 -0.65 0.00 0.00 174.74 174.75 3c2a h LYS 213 N 6.88 1.00 -0.99 2.88 1.63 -1.81 0.16 116.57 126.32 3c2a h LYS 213 Ca -0.07 -0.21 0.28 0.00 -0.85 0.00 0.00 60.65 59.81 3c2a h LYS 213 Cb 0.93 -0.15 -0.14 0.00 -0.60 0.00 0.00 32.23 32.28 3c2a h LYS 213 CO 0.65 0.87 0.56 -1.35 -3.45 0.00 0.00 179.45 176.73 3c2a h PRO 214 N 0.94 0.42 -0.03 1.90 0.11 -1.91 -0.00 132.00 133.42 3c2a h PRO 214 Ca 0.21 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.30 3c2a h PRO 214 Cb 0.28 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.30 3c2a h PRO 214 CO -0.01 0.28 -0.01 -1.13 -0.21 0.00 0.00 178.00 176.91 3c2a n SER 215 N -4.99 2.87 -3.73 -2.05 3.41 -0.94 -4.97 113.62 103.22 3c2a n SER 215 Ca 0.29 -1.94 -0.22 0.00 -0.26 0.00 0.00 58.87 56.74 3c2a n SER 215 Cb 0.86 0.01 0.03 0.00 -0.26 0.00 0.00 64.21 64.85 3c2a n SER 215 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3c2a n ASN 216 N 1.24 -1.30 -4.29 4.04 4.13 0.48 -4.90 115.26 114.66 3c2a n ASN 216 Ca 0.13 -0.85 -0.31 0.00 1.68 0.00 0.00 54.58 55.22 3c2a n ASN 216 Cb 0.57 -3.91 -0.16 0.00 -1.54 0.00 0.00 39.78 34.74 3c2a n ASN 216 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 3c2a s THR 217 N -3.70 2.08 0.02 3.41 2.01 -0.83 -5.00 115.64 113.63 3c2a s THR 217 Ca 0.03 -1.07 0.03 0.00 0.31 0.00 0.00 61.69 60.99 3c2a s THR 217 Cb -0.01 -1.74 -0.01 0.00 0.01 0.00 0.00 72.50 70.75 3c2a s THR 217 CO 0.82 0.57 -0.10 -0.54 -0.69 0.00 0.00 174.62 174.69 3c2a s LYS 218 N -0.30 0.74 -0.03 4.92 1.02 -1.26 -0.38 119.74 124.45 3c2a s LYS 218 Ca 0.01 -0.52 -0.01 0.00 0.02 0.00 0.00 55.97 55.46 3c2a s LYS 218 Cb -0.13 -0.69 0.03 0.00 -0.52 0.00 0.00 37.83 36.53 3c2a s LYS 218 CO 0.02 0.18 0.06 0.08 -0.92 0.00 0.00 175.35 174.77 3c2a s VAL 219 N -0.61 -0.07 -0.19 3.17 1.01 -0.31 -4.99 120.40 118.41 3c2a s VAL 219 Ca 0.00 0.23 -0.03 0.00 0.00 0.00 0.00 61.98 62.19 3c2a s VAL 219 Cb -0.06 -0.13 -0.01 0.00 0.00 0.00 0.00 36.38 36.19 3c2a s VAL 219 CO 0.00 0.09 -0.07 -1.81 0.00 0.00 0.00 175.10 173.31 3c2a s ASP 220 N 1.21 4.20 -0.13 3.32 1.01 -1.26 0.32 116.67 125.33 3c2a s ASP 220 Ca -0.08 -0.37 -0.01 0.00 0.71 0.00 0.00 52.55 52.80 3c2a s ASP 220 Cb -0.13 -1.70 0.03 0.00 1.01 0.00 0.00 42.92 42.14 3c2a s ASP 220 CO -0.04 0.04 -0.06 -0.75 0.21 0.00 0.00 175.17 174.56 3c2a s LYS 221 N 1.13 1.45 0.33 8.23 2.47 -0.85 -4.98 119.74 127.53 3c2a s LYS 221 Ca 0.01 -0.32 -0.26 0.00 -1.56 0.00 0.00 55.97 53.84 3c2a s LYS 221 Cb -0.14 -1.70 -0.10 0.00 -1.46 0.00 0.00 37.83 34.43 3c2a s LYS 221 CO -0.02 -0.32 0.99 0.50 0.16 0.00 0.00 175.35 176.67 3c2a s ARG 222 N 1.70 4.49 -0.26 4.03 3.52 -1.26 -1.46 118.95 129.70 3c2a s ARG 222 Ca 0.04 1.45 0.01 0.00 -0.13 0.00 0.00 55.73 57.09 3c2a s ARG 222 Cb -0.13 -2.81 0.05 0.00 -1.56 0.00 0.00 34.95 30.50 3c2a s ARG 222 CO -0.08 0.17 -0.08 0.08 -0.81 0.00 0.00 175.30 174.58 3c2a s VAL 223 N -1.54 2.50 -0.39 7.11 1.01 -0.04 -4.95 120.40 124.10 3c2a s VAL 223 Ca 0.51 -1.40 -0.11 0.00 0.00 0.00 0.00 61.98 60.98 3c2a s VAL 223 Cb -0.22 -2.39 0.03 0.00 0.00 0.00 0.00 36.38 33.81 3c2a s VAL 223 CO 0.27 0.04 0.23 -1.61 0.00 0.00 0.00 175.10 174.04 3c2a s GLU 226 N 1.20 2.82 0.00 2.72 2.02 -1.26 -4.49 118.70 121.70 3c2a s GLU 226 Ca -0.05 -1.12 0.00 0.00 0.02 0.00 0.00 54.97 53.82 3c2a s GLU 226 Cb -0.19 -3.78 0.00 0.00 0.10 0.00 0.00 34.13 30.26 3c2a s GLU 226 CO -0.05 -0.74 0.00 1.28 0.02 0.00 0.00 175.26 175.77