#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 4.17 0.05 2.62 1.01 -1.26 -3.81 120.40 123.18 3c2a s VAL 2 Ca 0.00 1.57 -0.27 0.00 0.00 0.00 0.00 61.98 63.28 3c2a s VAL 2 Cb 0.00 -4.01 0.07 0.00 0.00 0.00 0.00 36.38 32.44 3c2a s VAL 2 CO 0.00 0.13 0.65 0.00 0.00 0.00 0.00 175.10 175.88 3c2a s GLN 3 N 0.98 1.16 -0.06 2.72 -2.07 -0.14 -4.99 119.66 117.25 3c2a s GLN 3 Ca 0.57 -0.11 0.03 0.00 -1.82 0.00 0.00 55.36 54.04 3c2a s GLN 3 Cb -0.28 0.54 0.01 0.00 -1.09 0.00 0.00 33.01 32.18 3c2a s GLN 3 CO 0.29 -0.44 -0.16 -0.51 -1.32 0.00 0.00 175.29 173.15 3c2a s LEU 4 N -1.97 1.82 -0.20 2.60 1.43 -1.26 -1.52 118.68 119.58 3c2a s LEU 4 Ca -0.05 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 52.69 3c2a s LEU 4 Cb -0.01 -0.98 0.05 0.00 0.03 0.00 0.00 46.19 45.28 3c2a s LEU 4 CO -0.02 0.10 -0.06 -0.69 0.23 0.00 0.00 176.35 175.91 3c2a s VAL 5 N 0.39 1.33 0.22 -1.59 1.01 -0.12 -4.15 120.40 117.48 3c2a s VAL 5 Ca -0.12 -0.90 -0.10 0.00 0.00 0.00 0.00 61.98 60.86 3c2a s VAL 5 Cb -0.15 -1.53 -0.07 0.00 0.00 0.00 0.00 36.38 34.63 3c2a s VAL 5 CO 0.04 0.04 0.55 -1.83 0.00 0.00 0.00 175.10 173.91 3c2a s GLU 6 N 1.52 3.83 0.23 2.72 1.03 -1.26 -0.81 118.70 125.95 3c2a s GLU 6 Ca -0.02 0.31 -0.12 0.00 0.03 0.00 0.00 54.97 55.17 3c2a s GLU 6 Cb -0.17 -2.68 -0.01 0.00 -0.80 0.00 0.00 34.13 30.48 3c2a s GLU 6 CO -0.07 0.34 0.43 -1.54 -1.33 0.00 0.00 175.26 173.09 3c2a s SER 7 N -2.27 -0.07 0.00 0.83 1.04 0.08 -4.69 113.70 108.62 3c2a s SER 7 Ca 0.46 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.97 3c2a s SER 7 Cb -0.12 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.56 3c2a s SER 7 CO 0.21 -1.08 0.00 0.61 0.98 0.00 0.00 173.24 173.96 3c2a n GLY 8 N -0.35 0.82 3.76 7.32 0.00 -1.26 -1.38 105.19 114.10 3c2a n GLY 8 Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.73 2.46 0.00 -0.02 0.00 -1.26 -4.76 107.32 102.01 3c2a s GLY 9 Ca 0.00 0.77 0.00 0.00 0.00 0.00 0.00 44.72 45.49 3c2a s GLY 9 CO 0.00 1.14 0.00 0.61 0.00 0.00 0.00 173.10 174.85 3c2a n GLY 10 N 0.02 -1.24 3.70 0.20 0.00 -0.57 -4.84 105.19 102.46 3c2a n GLY 10 Ca 0.12 -0.81 -0.42 0.00 0.00 0.00 0.00 46.02 44.91 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 -0.03 0.99 2.96 -1.26 -1.11 118.68 124.55 3c2a s LEU 11 Ca 0.00 1.55 0.01 0.00 -0.22 0.00 0.00 54.13 55.47 3c2a s LEU 11 Cb 0.00 -3.50 0.01 0.00 0.50 0.00 0.00 46.19 43.20 3c2a s LEU 11 CO 0.00 -0.31 -0.04 -0.69 -1.32 0.00 0.00 176.35 173.99 3c2a s VAL 12 N 1.37 0.41 0.45 1.68 1.01 0.12 -4.97 120.40 120.46 3c2a s VAL 12 Ca 0.49 -0.11 -0.25 0.00 0.00 0.00 0.00 61.98 62.11 3c2a s VAL 12 Cb -0.20 -0.42 -0.08 0.00 0.00 0.00 0.00 36.38 35.69 3c2a s VAL 12 CO 0.23 0.17 1.37 -0.54 0.00 0.00 0.00 175.10 176.33 3c2a s LYS 13 N 0.56 3.72 0.31 2.72 -0.14 -1.26 -1.42 119.74 124.22 3c2a s LYS 13 Ca -0.06 2.29 -0.29 0.00 -1.36 0.00 0.00 55.97 56.55 3c2a s LYS 13 Cb -0.10 -2.64 -0.13 0.00 -1.68 0.00 0.00 37.83 33.28 3c2a s LYS 13 CO -0.00 -0.75 1.21 -2.30 -0.76 0.00 0.00 175.35 172.75 3c2a n PRO 14 N -0.19 1.83 -0.02 -1.68 -0.02 -1.26 -0.62 135.00 133.03 3c2a n PRO 14 Ca 0.05 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 3c2a n PRO 14 Cb 0.43 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 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 1.12 1.21 3.83 -1.23 0.00 0.28 -4.95 105.19 105.45 3c2a n GLY 15 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.97 1.68 0.24 -0.02 0.00 0.21 -4.27 107.32 103.19 3c2a s GLY 16 Ca 0.00 -0.95 0.11 0.00 0.00 0.00 0.00 44.72 43.88 3c2a s GLY 16 CO 0.00 -0.24 -0.16 -0.56 0.00 0.00 0.00 173.10 172.14 3c2a s SER 17 N -4.50 3.81 -0.14 1.64 0.01 -1.26 -0.69 113.70 112.58 3c2a s SER 17 Ca 0.70 -0.84 -0.29 0.00 1.31 0.00 0.00 55.95 56.83 3c2a s SER 17 Cb -0.08 -0.45 0.07 0.00 0.21 0.00 0.00 66.02 65.77 3c2a s SER 17 CO 0.53 0.07 0.70 -0.22 0.41 0.00 0.00 173.24 174.73 3c2a s LEU 18 N -3.18 -0.69 -0.16 2.44 2.96 -0.17 -5.01 118.68 114.87 3c2a s LEU 18 Ca 0.27 1.01 0.01 0.00 -0.22 0.00 0.00 54.13 55.20 3c2a s LEU 18 Cb -0.07 2.50 0.01 0.00 0.50 0.00 0.00 46.19 49.13 3c2a s LEU 18 CO 0.14 -0.46 -0.18 -0.60 -1.32 0.00 0.00 176.35 173.93 3c2a s ARG 19 N -0.56 3.11 0.05 1.98 3.52 -1.26 -0.45 118.95 125.35 3c2a s ARG 19 Ca -0.06 -0.79 0.00 0.00 -0.13 0.00 0.00 55.73 54.74 3c2a s ARG 19 Cb -0.02 -2.58 -0.04 0.00 -1.56 0.00 0.00 34.95 30.75 3c2a s ARG 19 CO 0.06 -0.06 0.17 -0.51 -0.81 0.00 0.00 175.30 174.16 3c2a s LEU 20 N 0.96 4.23 0.08 -0.88 1.43 0.14 -4.67 118.68 119.96 3c2a s LEU 20 Ca -0.03 0.22 0.08 0.00 -1.03 0.00 0.00 54.13 53.36 3c2a s LEU 20 Cb -0.15 -2.79 -0.03 0.00 0.03 0.00 0.00 46.19 43.25 3c2a s LEU 20 CO -0.04 0.19 -0.20 0.42 0.23 0.00 0.00 176.35 176.95 3c2a s THR 21 N -1.45 1.63 -0.10 5.49 -4.23 -0.48 -0.78 115.64 115.72 3c2a s THR 21 Ca 0.32 -1.38 0.01 0.00 -1.18 0.00 0.00 61.69 59.47 3c2a s THR 21 Cb -0.13 -1.47 0.02 0.00 1.34 0.00 0.00 72.50 72.26 3c2a s THR 21 CO 0.25 0.03 -0.14 0.00 -0.54 0.00 0.00 174.62 174.22 3c2a s VAL 23 N 1.04 4.19 0.02 0.00 1.01 0.01 -0.75 120.40 125.90 3c2a s VAL 23 Ca -0.06 -0.24 -0.02 0.00 0.00 0.00 0.00 61.98 61.66 3c2a s VAL 23 Cb -0.15 -2.88 -0.04 0.00 0.00 0.00 0.00 36.38 33.31 3c2a s VAL 23 CO -0.02 0.44 0.20 0.00 0.00 0.00 0.00 175.10 175.72 3c2a s ALA 24 N 0.75 3.97 0.00 5.51 0.00 -0.15 -0.95 121.76 130.90 3c2a s ALA 24 Ca 0.01 -0.78 -0.19 0.00 0.00 0.00 0.00 51.96 51.01 3c2a s ALA 24 Cb -0.14 -1.88 0.04 0.00 0.00 0.00 0.00 23.12 21.14 3c2a s ALA 24 CO 0.02 0.77 0.41 -1.54 0.00 0.00 0.00 175.76 175.42 3c2a s SER 25 N -2.12 -0.30 0.00 0.00 1.04 -0.58 -4.85 113.70 106.89 3c2a s SER 25 Ca 0.30 0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.87 3c2a s SER 25 Cb -0.13 0.39 0.00 0.00 0.10 0.00 0.00 66.02 66.39 3c2a s SER 25 CO 0.22 -0.56 0.00 0.61 0.98 0.00 0.00 173.24 174.48 3c2a n GLY 26 N 0.89 0.70 3.26 7.32 0.00 -1.25 -0.96 105.19 115.16 3c2a n GLY 26 Ca -0.20 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.70 -0.09 -0.74 1.61 -0.71 -1.26 -4.51 117.98 109.58 3c2a s PHE 27 Ca 0.00 -0.16 -0.26 0.00 -1.04 0.00 0.00 56.93 55.48 3c2a s PHE 27 Cb 0.00 0.12 -0.05 0.00 -1.21 0.00 0.00 43.02 41.88 3c2a s PHE 27 CO 0.00 -0.57 1.99 0.99 -1.34 0.00 0.00 175.22 176.28 3c2a s THR 28 N -3.19 3.34 0.21 -4.49 2.01 -1.26 -4.82 115.64 107.44 3c2a s THR 28 Ca -0.01 -0.08 -0.07 0.00 0.31 0.00 0.00 61.69 61.84 3c2a s THR 28 Cb 0.01 -3.82 0.11 0.00 0.01 0.00 0.00 72.50 68.81 3c2a s THR 28 CO -0.07 -0.79 1.72 0.15 -0.69 0.00 0.00 174.62 174.94 3c2a h PHE 29 N 13.52 1.14 0.00 4.92 3.57 -1.96 -2.71 116.94 135.42 3c2a h PHE 29 Ca -0.08 -0.15 0.00 0.00 3.53 0.00 0.00 57.97 61.27 3c2a h PHE 29 Cb 1.09 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 39.51 3c2a h PHE 29 CO 1.12 0.95 0.00 0.66 -2.23 0.00 0.00 178.31 178.81 3c2a h SER 30 N 1.02 0.00 1.17 0.41 4.64 -1.87 -2.70 113.55 116.21 3c2a h SER 30 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 3c2a h SER 30 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 3c2a h SER 30 CO 0.01 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.44 3c2a n ASP 31 N -2.92 0.31 -4.46 4.97 8.00 -1.02 -4.33 116.55 117.10 3c2a n ASP 31 Ca -0.02 0.53 -0.26 0.00 0.71 0.00 0.00 54.79 55.76 3c2a n ASP 31 Cb 0.13 -0.61 -0.11 0.00 -0.02 0.00 0.00 41.12 40.51 3c2a n ASP 31 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3c2a s VAL 32 N -3.04 2.50 0.26 2.53 -7.23 -1.02 -4.91 120.40 109.50 3c2a s VAL 32 Ca 0.13 -2.13 -0.12 0.00 -1.81 0.00 0.00 61.98 58.04 3c2a s VAL 32 Cb 0.16 -2.25 -0.08 0.00 0.56 0.00 0.00 36.38 34.77 3c2a s VAL 32 CO 0.55 -0.23 0.62 0.26 -0.31 0.00 0.00 175.10 176.00 3c2a s TRP 33 N -1.99 3.41 0.06 2.82 0.52 -1.26 -4.23 118.94 118.27 3c2a s TRP 33 Ca 0.25 1.02 0.05 0.00 0.02 0.00 0.00 56.10 57.44 3c2a s TRP 33 Cb -0.07 -2.38 -0.03 0.00 -1.15 0.00 0.00 33.47 29.85 3c2a s TRP 33 CO 0.12 0.21 -0.15 -0.51 0.02 0.00 0.00 176.95 176.64 3c2a s LEU 34 N -2.83 2.24 0.11 2.99 1.43 -0.90 -1.12 118.68 120.59 3c2a s LEU 34 Ca 0.50 -0.56 0.09 0.00 -1.03 0.00 0.00 54.13 53.13 3c2a s LEU 34 Cb -0.11 -0.59 -0.04 0.00 0.03 0.00 0.00 46.19 45.48 3c2a s LEU 34 CO 0.20 -0.02 -0.23 0.20 0.23 0.00 0.00 176.35 176.73 3c2a s ASN 35 N -1.51 2.82 -0.13 2.29 0.01 0.78 -1.04 114.94 118.16 3c2a s ASN 35 Ca 0.00 -0.69 -0.05 0.00 -0.71 0.00 0.00 52.86 51.41 3c2a s ASN 35 Cb -0.09 -0.18 -0.04 0.00 0.41 0.00 0.00 41.25 41.36 3c2a s ASN 35 CO 0.02 0.11 0.04 0.26 -1.51 0.00 0.00 177.10 176.03 3c2a s TRP 36 N -1.09 3.26 0.24 2.20 0.52 0.11 -0.65 118.94 123.53 3c2a s TRP 36 Ca 0.09 0.18 0.03 0.00 0.02 0.00 0.00 56.10 56.42 3c2a s TRP 36 Cb -0.10 -1.92 -0.05 0.00 -1.15 0.00 0.00 33.47 30.25 3c2a s TRP 36 CO 0.05 0.38 0.03 0.14 0.02 0.00 0.00 176.95 177.56 3c2a s VAL 37 N -0.42 0.91 0.01 4.03 -7.23 0.48 -0.58 120.40 117.59 3c2a s VAL 37 Ca 0.09 -2.02 -0.15 0.00 -1.81 0.00 0.00 61.98 58.10 3c2a s VAL 37 Cb -0.12 -2.43 0.02 0.00 0.56 0.00 0.00 36.38 34.41 3c2a s VAL 37 CO 0.02 -0.24 0.31 0.00 -0.31 0.00 0.00 175.10 174.89 3c2a s ARG 38 N -3.91 0.72 -0.09 4.82 1.70 -0.06 -0.08 118.95 122.05 3c2a s ARG 38 Ca 0.31 -0.30 -0.03 0.00 -0.47 0.00 0.00 55.73 55.24 3c2a s ARG 38 Cb 0.07 0.32 0.04 0.00 -0.57 0.00 0.00 34.95 34.80 3c2a s ARG 38 CO 0.10 -0.21 0.06 -1.14 -1.08 0.00 0.00 175.30 173.02 3c2a s GLN 39 N -1.76 0.13 0.60 3.89 0.74 0.51 -1.30 119.66 122.47 3c2a s GLN 39 Ca -0.10 0.17 -0.17 0.00 0.05 0.00 0.00 55.36 55.31 3c2a s GLN 39 Cb -0.04 -1.02 -0.03 0.00 1.10 0.00 0.00 33.01 33.03 3c2a s GLN 39 CO 0.02 -0.43 1.08 0.00 -0.55 0.00 0.00 175.29 175.41 3c2a s ALA 40 N 2.11 2.66 0.33 1.58 0.00 -1.26 -1.11 121.76 126.06 3c2a s ALA 40 Ca 0.04 0.53 -0.29 0.00 0.00 0.00 0.00 51.96 52.24 3c2a s ALA 40 Cb -0.13 -3.28 -0.11 0.00 0.00 0.00 0.00 23.12 19.59 3c2a s ALA 40 CO -0.05 -0.91 1.52 -2.30 0.00 0.00 0.00 175.76 174.02 3c2a n PRO 41 N -1.94 2.63 -1.37 0.00 -0.02 -1.26 -1.66 135.00 131.38 3c2a n PRO 41 Ca 0.10 0.93 -0.13 0.00 -2.02 0.00 0.00 63.50 62.37 3c2a n PRO 41 Cb 0.52 -2.67 -0.06 0.00 -0.02 0.00 0.00 33.50 31.27 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 1.34 1.28 3.57 -1.23 0.00 -1.26 -4.98 105.19 103.91 3c2a n GLY 42 Ca 0.05 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 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 -3.10 1.87 0.64 1.61 2.20 -0.66 -5.15 119.74 117.15 3c2a s LYS 43 Ca 0.00 -2.06 -0.09 0.00 -0.36 0.00 0.00 55.97 53.47 3c2a s LYS 43 Cb 0.00 -1.41 0.01 0.00 -1.51 0.00 0.00 37.83 34.92 3c2a s LYS 43 CO 0.00 -0.10 1.00 0.20 -0.36 0.00 0.00 175.35 176.09 3c2a s GLY 44 N -3.65 1.61 0.48 5.54 0.00 -1.26 -4.65 107.32 105.40 3c2a s GLY 44 Ca 0.35 -0.49 -0.23 0.00 0.00 0.00 0.00 44.72 44.35 3c2a s GLY 44 CO 0.17 -0.17 1.26 -2.27 0.00 0.00 0.00 173.10 172.09 3c2a s LEU 45 N -5.17 3.99 -0.02 0.66 2.96 -1.26 -4.48 118.68 115.36 3c2a s LEU 45 Ca 0.56 2.54 0.00 0.00 -0.22 0.00 0.00 54.13 57.01 3c2a s LEU 45 Cb -0.11 -4.19 0.02 0.00 0.50 0.00 0.00 46.19 42.42 3c2a s LEU 45 CO 0.49 -1.14 0.00 -0.70 -1.32 0.00 0.00 176.35 173.68 3c2a s GLU 46 N -2.68 0.25 0.10 1.98 2.12 -0.42 -4.99 118.70 115.06 3c2a s GLU 46 Ca 0.65 0.06 -0.29 0.00 0.36 0.00 0.00 54.97 55.75 3c2a s GLU 46 Cb -0.35 -0.42 -0.06 0.00 0.26 0.00 0.00 34.13 33.57 3c2a s GLU 46 CO 0.42 -0.11 0.93 -0.46 -0.54 0.00 0.00 175.26 175.50 3c2a s TRP 47 N 0.87 3.80 -0.22 5.30 -0.00 -1.26 -0.89 118.94 126.54 3c2a s TRP 47 Ca -0.09 1.75 -0.14 0.00 -0.00 0.00 0.00 56.10 57.62 3c2a s TRP 47 Cb -0.12 -3.01 -0.09 0.00 -0.00 0.00 0.00 33.47 30.24 3c2a s TRP 47 CO -0.02 0.22 -0.33 0.28 -0.00 0.00 0.00 176.95 177.11 3c2a n VAL 48 N 2.78 1.43 -3.92 5.86 0.31 0.25 -4.54 118.33 120.50 3c2a n VAL 48 Ca 0.01 -0.19 0.01 0.00 -0.01 0.00 0.00 64.34 64.17 3c2a n VAL 48 Cb 0.49 -1.99 0.01 0.00 -0.91 0.00 0.00 33.84 31.44 3c2a n VAL 48 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 3c2a s GLY 49 N -5.26 -0.10 0.14 2.92 0.00 -1.05 -0.88 107.32 103.08 3c2a s GLY 49 Ca -0.33 0.01 0.03 0.00 0.00 0.00 0.00 44.72 44.43 3c2a s GLY 49 CO 0.43 4.28 -0.06 1.09 0.00 0.00 0.00 173.10 178.85 3c2a s ARG 50 N -2.11 1.01 -0.03 2.90 1.70 -0.30 -0.71 118.95 121.41 3c2a s ARG 50 Ca 0.26 -1.45 0.02 0.00 -0.47 0.00 0.00 55.73 54.09 3c2a s ARG 50 Cb -0.00 -0.40 0.01 0.00 -0.57 0.00 0.00 34.95 33.98 3c2a s ARG 50 CO 0.00 -0.01 -0.06 -1.50 -1.08 0.00 0.00 175.30 172.65 3c2a s ILE 51 N -3.51 0.56 0.92 4.99 2.07 -0.21 -1.56 121.20 124.47 3c2a s ILE 51 Ca 0.17 -0.21 -0.16 0.00 -1.41 0.00 0.00 60.65 59.05 3c2a s ILE 51 Cb 0.04 -0.54 0.21 0.00 0.13 0.00 0.00 42.46 42.31 3c2a s ILE 51 CO 0.00 0.20 1.26 0.29 -1.91 0.00 0.00 174.94 174.78 3c2a n LYS 52 N 3.58 -1.22 -2.84 3.50 5.02 -0.49 -2.12 118.16 123.60 3c2a n LYS 52 Ca -0.21 -1.96 -0.29 0.00 -2.02 0.00 0.00 58.31 53.83 3c2a n LYS 52 Cb 0.53 -1.29 -0.02 0.00 -0.02 0.00 0.00 35.03 34.23 3c2a n LYS 52 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3c2a s SER 52 N -5.60 6.44 0.27 4.39 1.04 -1.26 -4.34 113.70 114.65 3c2a s SER 52 Ca 0.71 1.04 -0.00 0.00 0.48 0.00 0.00 55.95 58.18 3c2a s SER 52 Cb -0.02 -2.29 0.61 0.00 0.10 0.00 0.00 66.02 64.43 3c2a s SER 52 CO 0.50 -0.43 1.69 -0.09 0.98 0.00 0.00 173.24 175.89 3c2a h ARG 52 N 1.02 0.32 -0.27 4.02 2.43 -1.90 -0.24 114.38 119.76 3c2a h ARG 52 Ca -0.47 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 58.64 3c2a h ARG 52 Cb 1.19 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.65 3c2a h ARG 52 CO 0.63 0.21 0.01 1.79 -1.51 0.00 0.00 179.97 181.11 3c2a h THR 52 N 0.33 1.16 -0.26 0.20 1.35 -1.93 -0.46 112.91 113.30 3c2a h THR 52 Ca 0.50 -0.61 -0.03 0.00 -0.55 0.00 0.00 66.41 65.72 3c2a h THR 52 Cb 0.91 0.95 -0.02 0.00 -1.73 0.00 0.00 68.15 68.27 3c2a h THR 52 CO -0.54 0.21 0.03 0.47 -0.25 0.00 0.00 175.52 175.45 3c2a n ASP 53 N -4.33 3.03 0.00 5.36 8.00 -0.46 -4.88 116.55 123.27 3c2a n ASP 53 Ca 0.01 -2.42 0.00 0.00 0.71 0.00 0.00 54.79 53.08 3c2a n ASP 53 Cb 0.20 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 40.72 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 0.21 2.13 2.45 0.44 0.00 -0.18 -4.57 105.19 105.66 3c2a n GLY 54 Ca 0.13 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.10 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 -2.00 0.70 3.91 -0.02 0.00 -0.23 -4.89 105.19 102.67 3c2a n GLY 55 Ca 0.00 -0.22 -0.28 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.90 2.13 0.17 2.61 -4.23 -1.26 -4.49 115.64 108.66 3c2a s THR 56 Ca 0.00 -0.10 0.11 0.00 -1.18 0.00 0.00 61.69 60.53 3c2a s THR 56 Cb 0.00 -3.01 -0.04 0.00 1.34 0.00 0.00 72.50 70.79 3c2a s THR 56 CO 0.00 -0.01 -0.25 0.42 -0.54 0.00 0.00 174.62 174.24 3c2a s THR 57 N -3.45 2.31 0.04 3.99 -4.23 -1.26 -1.39 115.64 111.65 3c2a s THR 57 Ca 0.61 -1.92 0.05 0.00 -1.18 0.00 0.00 61.69 59.25 3c2a s THR 57 Cb -0.11 -2.07 -0.02 0.00 1.34 0.00 0.00 72.50 71.64 3c2a s THR 57 CO 0.47 -0.03 -0.14 -1.81 -0.54 0.00 0.00 174.62 172.58 3c2a s ASP 58 N -2.41 1.64 0.03 3.99 1.01 -0.60 -4.98 116.67 115.35 3c2a s ASP 58 Ca 0.18 -0.45 0.06 0.00 0.71 0.00 0.00 52.55 53.05 3c2a s ASP 58 Cb -0.09 -0.11 -0.02 0.00 1.01 0.00 0.00 42.92 43.71 3c2a s ASP 58 CO 0.08 0.03 -0.17 -0.31 0.21 0.00 0.00 175.17 175.01 3c2a s TYR 59 N -0.83 1.53 0.54 4.23 2.02 -1.26 -1.16 117.35 122.42 3c2a s TYR 59 Ca 0.02 -0.35 -0.22 0.00 -0.37 0.00 0.00 57.07 56.15 3c2a s TYR 59 Cb -0.08 -0.92 -0.05 0.00 -0.40 0.00 0.00 41.96 40.51 3c2a s TYR 59 CO 0.01 0.05 1.33 0.00 -1.57 0.00 0.00 175.55 175.37 3c2a n ALA 60 N 2.01 1.47 0.30 3.71 0.00 -0.06 -4.79 120.51 123.16 3c2a n ALA 60 Ca -0.17 0.13 0.20 0.00 0.00 0.00 0.00 53.44 53.60 3c2a n ALA 60 Cb 0.54 -2.33 1.00 0.00 0.00 0.00 0.00 19.45 18.65 3c2a n ALA 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3c2a h ALA 61 N 1.42 1.00 0.00 0.00 0.00 -1.93 -0.81 119.26 118.94 3c2a h ALA 61 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 3c2a h ALA 61 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 3c2a h ALA 61 CO 0.57 0.00 -0.23 -1.13 0.00 0.00 0.00 179.25 178.46 3c2a n SER 62 N -2.92 0.53 0.00 0.00 3.41 -1.26 -4.12 113.62 109.26 3c2a n SER 62 Ca -0.02 0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.92 3c2a n SER 62 Cb 0.12 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 63.73 3c2a n SER 62 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3c2a n VAL 63 N -1.92 0.00 -1.75 -3.33 0.24 -0.44 -5.02 118.33 106.11 3c2a n VAL 63 Ca 0.05 -0.32 -0.42 0.00 -2.04 0.00 0.00 64.34 61.62 3c2a n VAL 63 Cb 0.40 1.03 -0.02 0.00 -1.47 0.00 0.00 33.84 33.78 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 -0.59 4.11 0.00 7.34 2.20 -0.45 -1.68 119.74 130.66 3c2a s LYS 64 Ca 0.00 2.61 0.00 0.00 -0.36 0.00 0.00 55.97 58.22 3c2a s LYS 64 Cb 0.00 -3.03 0.00 0.00 -1.51 0.00 0.00 37.83 33.29 3c2a s LYS 64 CO 0.00 -0.68 0.00 0.41 -0.36 0.00 0.00 175.35 174.72 3c2a n GLY 65 N 2.55 3.28 0.06 5.54 0.00 -1.26 -4.81 105.19 110.54 3c2a n GLY 65 Ca 0.10 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.75 1.19 -4.34 1.61 1.74 -0.68 -5.03 116.66 109.42 3c2a n ARG 66 Ca 0.00 0.04 -0.31 0.00 -0.77 0.00 0.00 57.85 56.81 3c2a n ARG 66 Cb 0.00 -1.27 -0.10 0.00 -1.02 0.00 0.00 32.46 30.07 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 -2.27 2.91 -0.03 -1.55 0.40 -0.69 -1.22 117.98 115.53 3c2a s PHE 67 Ca -0.13 -0.04 0.01 0.00 -0.60 0.00 0.00 56.93 56.18 3c2a s PHE 67 Cb 0.04 -1.58 0.02 0.00 0.51 0.00 0.00 43.02 42.01 3c2a s PHE 67 CO 0.37 0.41 -0.05 0.99 0.70 0.00 0.00 175.22 177.65 3c2a s THR 68 N -1.10 0.49 -0.07 0.64 2.01 0.17 -4.83 115.64 112.95 3c2a s THR 68 Ca 0.20 -0.15 0.02 0.00 0.31 0.00 0.00 61.69 62.07 3c2a s THR 68 Cb -0.11 -0.50 -0.03 0.00 0.01 0.00 0.00 72.50 71.87 3c2a s THR 68 CO 0.11 0.19 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.50 3c2a s ILE 69 N 0.62 3.41 0.06 1.82 1.01 -1.26 -1.29 121.20 125.57 3c2a s ILE 69 Ca -0.08 -0.58 -0.09 0.00 0.00 0.00 0.00 60.65 59.90 3c2a s ILE 69 Cb -0.11 -2.38 0.00 0.00 0.01 0.00 0.00 42.46 39.98 3c2a s ILE 69 CO -0.00 0.59 0.19 -0.94 0.00 0.00 0.00 174.94 174.77 3c2a s SER 70 N -0.65 0.09 0.11 3.58 1.04 -1.02 -4.99 113.70 111.86 3c2a s SER 70 Ca 0.10 -0.52 0.07 0.00 0.48 0.00 0.00 55.95 56.07 3c2a s SER 70 Cb -0.11 0.31 -0.04 0.00 0.10 0.00 0.00 66.02 66.28 3c2a s SER 70 CO 0.01 -0.65 -0.17 0.00 0.98 0.00 0.00 173.24 173.42 3c2a s ARG 71 N -3.25 1.06 -0.40 4.02 1.70 -1.26 0.35 118.95 121.17 3c2a s ARG 71 Ca 0.00 -1.18 0.03 0.00 -0.47 0.00 0.00 55.73 54.12 3c2a s ARG 71 Cb 0.02 -1.13 0.11 0.00 -0.57 0.00 0.00 34.95 33.38 3c2a s ARG 71 CO -0.08 0.24 0.12 0.34 -1.08 0.00 0.00 175.30 174.85 3c2a s ASP 72 N -2.14 4.69 0.24 -2.89 3.68 0.21 -4.98 116.67 115.47 3c2a s ASP 72 Ca 0.07 -2.40 -0.05 0.00 2.13 0.00 0.00 52.55 52.30 3c2a s ASP 72 Cb -0.08 -1.65 0.36 0.00 -1.45 0.00 0.00 42.92 40.10 3c2a s ASP 72 CO 0.04 -0.35 1.84 0.44 0.13 0.00 0.00 175.17 177.27 3c2a h ASP 73 N 7.33 0.78 0.11 -0.34 3.32 -1.97 -0.49 116.42 125.16 3c2a h ASP 73 Ca -0.05 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.02 3c2a h ASP 73 Cb 0.99 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.40 3c2a h ASP 73 CO 0.58 0.48 0.00 0.77 -1.72 0.00 0.00 179.24 179.35 3c2a h SER 74 N 0.91 0.00 -0.06 6.45 4.64 -1.95 -2.40 113.55 121.14 3c2a h SER 74 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 3c2a h SER 74 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3c2a h SER 74 CO -0.20 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.05 3c2a n LYS 75 N -3.00 2.86 -3.94 4.77 5.02 -0.29 -4.97 118.16 118.61 3c2a n LYS 75 Ca -0.02 -1.68 -0.30 0.00 -2.02 0.00 0.00 58.31 54.28 3c2a n LYS 75 Cb 0.09 -1.09 0.02 0.00 -0.02 0.00 0.00 35.03 34.03 3c2a n LYS 75 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3c2a n ASN 76 N -0.40 -3.92 -4.16 4.39 3.02 -0.61 -4.81 115.26 108.77 3c2a n ASN 76 Ca 0.03 -0.83 -0.24 0.00 -0.03 0.00 0.00 54.58 53.51 3c2a n ASN 76 Cb 0.32 -3.69 -0.15 0.00 -0.61 0.00 0.00 39.78 35.65 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 -3.38 1.35 0.01 3.41 2.01 -0.83 -0.97 115.64 117.24 3c2a s THR 77 Ca 0.56 -0.77 0.07 0.00 0.31 0.00 0.00 61.69 61.87 3c2a s THR 77 Cb -0.29 -1.13 -0.03 0.00 0.01 0.00 0.00 72.50 71.06 3c2a s THR 77 CO 0.85 0.35 -0.22 -0.22 -0.69 0.00 0.00 174.62 174.69 3c2a s LEU 78 N -0.48 2.34 0.16 4.42 2.96 0.07 0.63 118.68 128.78 3c2a s LEU 78 Ca 0.06 -0.45 0.08 0.00 -0.22 0.00 0.00 54.13 53.61 3c2a s LEU 78 Cb -0.07 -1.41 -0.04 0.00 0.50 0.00 0.00 46.19 45.18 3c2a s LEU 78 CO -0.00 0.29 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.84 3c2a s TYR 79 N -0.76 1.73 -0.18 5.38 2.02 0.16 -0.45 117.35 125.24 3c2a s TYR 79 Ca 0.12 -0.50 -0.04 0.00 -0.37 0.00 0.00 57.07 56.28 3c2a s TYR 79 Cb -0.10 -0.86 0.06 0.00 -0.40 0.00 0.00 41.96 40.66 3c2a s TYR 79 CO 0.02 0.30 0.06 -1.17 -1.57 0.00 0.00 175.55 173.19 3c2a s LEU 80 N -2.74 0.79 -0.37 -1.29 2.96 0.04 -2.42 118.68 115.64 3c2a s LEU 80 Ca 0.16 -0.74 -0.19 0.00 -0.22 0.00 0.00 54.13 53.14 3c2a s LEU 80 Cb -0.05 -0.43 0.00 0.00 0.50 0.00 0.00 46.19 46.22 3c2a s LEU 80 CO 0.06 -0.33 0.56 -1.58 -1.32 0.00 0.00 176.35 173.74 3c2a s GLN 81 N 1.99 3.54 -0.29 1.98 2.00 -0.41 0.27 119.66 128.74 3c2a s GLN 81 Ca 0.01 -0.18 -0.06 0.00 -2.00 0.00 0.00 55.36 53.13 3c2a s GLN 81 Cb -0.17 -3.84 0.02 0.00 0.80 0.00 0.00 33.01 29.82 3c2a s GLN 81 CO -0.09 -0.74 0.06 -1.64 -0.50 0.00 0.00 175.29 172.38 3c2a s MET 82 N 2.52 2.97 0.25 1.67 -1.94 0.40 -0.66 119.30 124.52 3c2a s MET 82 Ca 0.20 -0.93 0.09 0.00 -1.71 0.00 0.00 55.69 53.34 3c2a s MET 82 Cb -0.15 -3.31 -0.04 0.00 2.01 0.00 0.00 34.83 33.34 3c2a s MET 82 CO 0.15 -0.47 0.03 -0.80 -0.01 0.00 0.00 175.02 173.92 3c2a s ASN 82 N 1.45 4.75 -1.36 3.03 0.01 -0.36 -1.00 114.94 121.46 3c2a s ASN 82 Ca 0.01 -0.55 -0.02 0.00 -0.71 0.00 0.00 52.86 51.59 3c2a s ASN 82 Cb -0.17 -0.97 0.02 0.00 0.41 0.00 0.00 41.25 40.53 3c2a s ASN 82 CO 0.01 0.00 0.71 -1.20 -1.51 0.00 0.00 177.10 175.11 3c2a n SER 82 N -0.88 -1.65 -4.77 -1.22 7.64 -1.04 -4.66 113.62 107.04 3c2a n SER 82 Ca -0.07 -0.84 -0.41 0.00 1.01 0.00 0.00 58.87 58.56 3c2a n SER 82 Cb 0.58 -3.88 0.00 0.00 -1.01 0.00 0.00 64.21 59.91 3c2a n SER 82 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3c2a n LEU 82 N -4.36 4.84 -4.69 -3.43 4.77 0.14 -4.62 117.00 109.65 3c2a n LEU 82 Ca -0.24 1.21 -0.24 0.00 -0.03 0.00 0.00 56.01 56.71 3c2a n LEU 82 Cb 0.65 -1.62 -0.07 0.00 -2.33 0.00 0.00 43.42 40.06 3c2a n LEU 82 CO 0.71 0.11 -0.30 -0.54 -1.33 0.00 0.00 177.39 176.04 3c2a s LYS 83 N -2.16 2.47 0.35 3.23 1.02 -1.26 -0.56 119.74 122.83 3c2a s LYS 83 Ca 0.54 -1.21 0.09 0.00 0.02 0.00 0.00 55.97 55.41 3c2a s LYS 83 Cb -0.47 -2.33 0.81 0.00 -0.52 0.00 0.00 37.83 35.33 3c2a s LYS 83 CO 0.63 0.41 1.86 1.79 -0.92 0.00 0.00 175.35 179.12 3c2a h THR 84 N 2.05 0.83 0.00 2.17 1.35 -1.96 0.42 112.91 117.77 3c2a h THR 84 Ca -0.46 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.16 3c2a h THR 84 Cb 1.23 0.07 0.00 0.00 -1.73 0.00 0.00 68.15 67.72 3c2a h THR 84 CO 0.60 0.13 0.00 -1.84 -0.25 0.00 0.00 175.52 174.15 3c2a n GLU 85 N -4.57 0.20 -0.00 4.72 0.00 -1.26 -1.99 120.64 117.74 3c2a n GLU 85 Ca 0.18 0.14 0.15 0.00 0.00 0.00 0.00 57.16 57.63 3c2a n GLU 85 Cb 0.48 -1.50 0.81 0.00 0.00 0.00 0.00 31.44 31.22 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 -1.31 0.43 -4.72 -1.84 8.00 0.14 -4.90 116.55 112.36 3c2a n ASP 86 Ca 0.07 -1.17 -0.42 0.00 0.71 0.00 0.00 54.79 53.99 3c2a n ASP 86 Cb 0.13 -0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.20 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 -2.00 3.31 0.00 -3.53 2.01 -0.84 -4.89 115.64 109.70 3c2a s THR 87 Ca 0.44 0.97 0.00 0.00 0.31 0.00 0.00 61.69 63.41 3c2a s THR 87 Cb 0.21 -3.62 0.00 0.00 0.01 0.00 0.00 72.50 69.10 3c2a s THR 87 CO 0.35 0.09 0.00 0.00 -0.69 0.00 0.00 174.62 174.38 3c2a n ALA 88 N 3.58 0.00 -2.65 7.40 0.00 -0.74 -4.44 120.51 123.67 3c2a n ALA 88 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.12 3c2a n ALA 88 Cb 0.43 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.84 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 4.81 -0.22 0.00 1.01 -0.27 -0.91 120.40 122.82 3c2a s VAL 89 Ca 0.00 1.66 -0.11 0.00 0.00 0.00 0.00 61.98 63.53 3c2a s VAL 89 Cb 0.00 -4.16 -0.05 0.00 0.00 0.00 0.00 36.38 32.18 3c2a s VAL 89 CO 0.00 -0.09 0.18 -0.31 0.00 0.00 0.00 175.10 174.87 3c2a s TYR 90 N 2.91 3.35 0.12 5.22 1.51 -0.51 -0.36 117.35 129.59 3c2a s TYR 90 Ca 0.37 0.30 0.10 0.00 -1.01 0.00 0.00 57.07 56.83 3c2a s TYR 90 Cb -0.15 -2.26 -0.04 0.00 -0.11 0.00 0.00 41.96 39.40 3c2a s TYR 90 CO 0.07 0.13 -0.24 -1.12 -1.11 0.00 0.00 175.55 173.28 3c2a s SER 91 N 0.84 3.48 -0.03 2.29 0.01 0.88 -1.77 113.70 119.41 3c2a s SER 91 Ca 0.09 -0.68 -0.06 0.00 1.31 0.00 0.00 55.95 56.60 3c2a s SER 91 Cb -0.13 -0.32 -0.04 0.00 0.21 0.00 0.00 66.02 65.74 3c2a s SER 91 CO 0.03 0.18 0.22 0.00 0.41 0.00 0.00 173.24 174.09 3c2a s THR 93 N -1.22 0.61 0.30 0.00 -4.23 0.18 -1.36 115.64 109.92 3c2a s THR 93 Ca 0.24 -1.43 -0.01 0.00 -1.18 0.00 0.00 61.69 59.31 3c2a s THR 93 Cb -0.13 -1.05 -0.04 0.00 1.34 0.00 0.00 72.50 72.62 3c2a s THR 93 CO 0.13 -0.58 0.51 0.42 -0.54 0.00 0.00 174.62 174.57 3c2a s THR 94 N -2.29 5.11 -0.30 3.99 -4.23 0.01 -0.16 115.64 117.76 3c2a s THR 94 Ca -0.01 -0.31 -0.22 0.00 -1.18 0.00 0.00 61.69 59.97 3c2a s THR 94 Cb -0.04 -3.80 -0.00 0.00 1.34 0.00 0.00 72.50 70.00 3c2a s THR 94 CO -0.02 -0.42 0.71 -1.81 -0.54 0.00 0.00 174.62 172.55 3c2a s ASP 95 N -3.63 6.58 0.46 3.99 1.11 -0.27 -0.72 116.67 124.18 3c2a s ASP 95 Ca 0.41 0.55 0.06 0.00 0.18 0.00 0.00 52.55 53.75 3c2a s ASP 95 Cb -0.10 -2.37 0.06 0.00 1.07 0.00 0.00 42.92 41.58 3c2a s ASP 95 CO 0.33 -0.54 0.49 0.61 1.18 0.00 0.00 175.17 177.24 3c2a n GLY 96 N 4.30 2.38 3.25 0.21 0.00 0.17 -4.51 105.19 110.99 3c2a n GLY 96 Ca 0.01 -2.24 -0.12 0.00 0.00 0.00 0.00 46.02 43.68 3c2a n GLY 96 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3c2a s PHE 97 N -2.06 -0.11 -0.18 1.61 -0.12 -1.26 -1.62 117.98 114.24 3c2a s PHE 97 Ca 0.37 -0.02 -0.02 0.00 -0.05 0.00 0.00 56.93 57.21 3c2a s PHE 97 Cb -0.03 0.10 -0.01 0.00 -0.63 0.00 0.00 43.02 42.45 3c2a s PHE 97 CO 0.24 -0.50 -0.08 0.42 -0.05 0.00 0.00 175.22 175.25 3c2a s ILE 98 N -2.54 3.33 -0.18 -4.49 1.01 -1.26 -5.02 121.20 112.05 3c2a s ILE 98 Ca -0.05 -0.54 -0.07 0.00 0.00 0.00 0.00 60.65 59.99 3c2a s ILE 98 Cb -0.01 -2.46 -0.04 0.00 0.01 0.00 0.00 42.46 39.96 3c2a s ILE 98 CO -0.03 0.47 0.06 -0.32 0.00 0.00 0.00 174.94 175.12 3c2a s MET 99 N 0.87 3.93 -0.23 2.79 1.75 -1.26 -5.08 119.30 122.06 3c2a s MET 99 Ca -0.02 -0.35 -0.05 0.00 -1.25 0.00 0.00 55.69 54.03 3c2a s MET 99 Cb -0.15 -3.19 -0.01 0.00 2.84 0.00 0.00 34.83 34.32 3c2a s MET 99 CO 0.01 0.30 -0.01 0.42 -0.65 0.00 0.00 175.02 175.09 3c2a s ILE 100 N 0.29 3.63 -0.64 10.11 1.01 -1.26 -5.05 121.20 129.29 3c2a s ILE 100 Ca 0.03 -0.42 -0.28 0.00 0.00 0.00 0.00 60.65 59.99 3c2a s ILE 100 Cb -0.12 -2.67 0.03 0.00 0.01 0.00 0.00 42.46 39.70 3c2a s ILE 100 CO 0.00 0.39 1.27 -0.13 0.00 0.00 0.00 174.94 176.47 3c2a s ARG 100 N 1.51 3.34 0.76 2.79 0.52 -1.26 -4.46 118.95 122.16 3c2a s ARG 100 Ca 0.06 0.08 -0.12 0.00 -0.52 0.00 0.00 55.73 55.23 3c2a s ARG 100 Cb -0.15 -4.10 0.05 0.00 0.52 0.00 0.00 34.95 31.27 3c2a s ARG 100 CO -0.01 -1.92 1.14 0.20 0.02 0.00 0.00 175.30 174.73 3c2a s GLY 100 N 3.54 1.61 0.00 -3.53 0.00 -0.32 -4.92 107.32 103.70 3c2a s GLY 100 Ca 0.41 -0.50 0.04 0.00 0.00 0.00 0.00 44.72 44.67 3c2a s GLY 100 CO 0.21 -0.07 1.08 1.55 0.00 0.00 0.00 173.10 175.87 3c2a n VAL 100 N -3.17 1.57 0.00 1.40 3.14 -1.26 -3.10 118.33 116.90 3c2a n VAL 100 Ca 0.07 0.39 0.00 0.00 -2.96 0.00 0.00 64.34 61.85 3c2a n VAL 100 Cb 0.59 -1.33 0.00 0.00 -1.06 0.00 0.00 33.84 32.04 3c2a n VAL 100 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 3c2a n SER 100 N -1.45 0.00 -3.60 6.55 2.88 -1.26 -5.14 113.62 111.60 3c2a n SER 100 Ca 0.01 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.40 3c2a n SER 100 Cb 0.04 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.43 3c2a n SER 100 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 3c2a s GLU 100 N -0.69 0.90 0.00 -1.46 -1.05 -1.18 -5.23 118.70 110.00 3c2a s GLU 100 Ca 0.00 0.64 0.00 0.00 -0.15 0.00 0.00 54.97 55.46 3c2a s GLU 100 Cb 0.00 0.43 0.00 0.00 -0.44 0.00 0.00 34.13 34.12 3c2a s GLU 100 CO 0.00 -0.19 0.00 -0.25 0.95 0.00 0.00 175.26 175.77 3c2a n ASP 100 N 1.93 0.00 0.00 0.83 8.00 -1.26 -1.17 116.55 124.88 3c2a n ASP 100 Ca -0.16 -0.78 0.00 0.00 0.71 0.00 0.00 54.79 54.56 3c2a n ASP 100 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.66 3c2a n ASP 100 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3c2a n TYR 100 N -0.80 0.00 -1.99 1.24 4.11 -0.64 -4.95 117.16 114.13 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 -3.38 3.85 0.00 -3.48 -1.94 -1.26 0.44 119.30 113.53 3c2a s MET 100 Ca 0.00 1.93 0.00 0.00 -1.71 0.00 0.00 55.69 55.91 3c2a s MET 100 Cb 0.00 -4.07 0.00 0.00 2.01 0.00 0.00 34.83 32.77 3c2a s MET 100 CO 0.00 -1.24 0.00 -3.47 -0.01 0.00 0.00 175.02 170.30 3c2a n ASP 101 N 8.40 0.00 -4.69 3.03 2.03 0.10 -4.85 116.55 120.56 3c2a n ASP 101 Ca 0.20 0.00 -0.39 0.00 0.52 0.00 0.00 54.79 55.12 3c2a n ASP 101 Cb 0.44 -0.35 -0.06 0.00 -0.72 0.00 0.00 41.12 40.43 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 -0.89 5.12 -0.08 5.18 1.01 -1.26 -4.93 120.40 124.54 3c2a s VAL 102 Ca 0.00 1.04 0.04 0.00 0.00 0.00 0.00 61.98 63.06 3c2a s VAL 102 Cb 0.00 -3.87 -0.01 0.00 0.00 0.00 0.00 36.38 32.50 3c2a s VAL 102 CO 0.00 0.24 -0.22 0.26 0.00 0.00 0.00 175.10 175.38 3c2a s TRP 103 N 1.16 2.57 0.79 5.22 0.52 -1.26 -0.81 118.94 127.13 3c2a s TRP 103 Ca 0.27 -0.76 -0.12 0.00 0.02 0.00 0.00 56.10 55.51 3c2a s TRP 103 Cb -0.16 -1.68 0.07 0.00 -1.15 0.00 0.00 33.47 30.55 3c2a s TRP 103 CO 0.11 -0.24 1.14 0.20 0.02 0.00 0.00 176.95 178.18 3c2a s GLY 104 N 0.04 1.60 0.36 0.98 0.00 -0.46 -4.66 107.32 105.17 3c2a s GLY 104 Ca -0.08 -0.50 0.25 0.00 0.00 0.00 0.00 44.72 44.39 3c2a s GLY 104 CO 0.05 -0.04 1.70 0.50 0.00 0.00 0.00 173.10 175.32 3c2a h LYS 105 N -1.01 0.00 0.00 2.90 1.57 -1.91 -3.44 116.57 114.68 3c2a h LYS 105 Ca -0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 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 0.64 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.93 3c2a n GLY 106 N 1.04 1.71 2.96 3.86 0.00 -1.26 -5.00 105.19 108.50 3c2a n GLY 106 Ca 0.04 -1.80 -0.19 0.00 0.00 0.00 0.00 46.02 44.08 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 -2.72 0.60 -0.12 2.61 -1.32 -0.73 -4.85 115.64 109.11 3c2a s THR 107 Ca 0.00 -0.26 -0.23 0.00 -1.21 0.00 0.00 61.69 59.99 3c2a s THR 107 Cb 0.00 -0.54 -0.03 0.00 -1.51 0.00 0.00 72.50 70.42 3c2a s THR 107 CO 0.00 0.20 0.70 -0.89 -2.21 0.00 0.00 174.62 172.42 3c2a s THR 108 N 0.22 5.01 -0.20 5.08 2.01 -1.26 -1.42 115.64 125.09 3c2a s THR 108 Ca -0.03 1.40 -0.03 0.00 0.31 0.00 0.00 61.69 63.33 3c2a s THR 108 Cb -0.07 -4.03 -0.01 0.00 0.01 0.00 0.00 72.50 68.40 3c2a s THR 108 CO 0.00 0.17 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.36 3c2a s VAL 109 N 1.35 3.40 -0.34 3.82 1.01 -0.09 -1.52 120.40 128.04 3c2a s VAL 109 Ca 0.35 -0.50 -0.03 0.00 0.00 0.00 0.00 61.98 61.81 3c2a s VAL 109 Cb -0.17 -2.52 0.07 0.00 0.00 0.00 0.00 36.38 33.76 3c2a s VAL 109 CO 0.15 0.45 0.07 -0.89 0.00 0.00 0.00 175.10 174.88 3c2a s THR 110 N 1.15 3.16 -0.65 3.92 2.01 -0.27 -1.78 115.64 123.17 3c2a s THR 110 Ca 0.02 -1.56 -0.19 0.00 0.31 0.00 0.00 61.69 60.26 3c2a s THR 110 Cb -0.14 -2.92 0.11 0.00 0.01 0.00 0.00 72.50 69.55 3c2a s THR 110 CO -0.01 -0.29 0.79 -0.69 -0.69 0.00 0.00 174.62 173.73 3c2a s VAL 111 N 1.23 4.78 0.01 3.82 1.01 -1.25 0.15 120.40 130.15 3c2a s VAL 111 Ca -0.01 -1.05 -0.19 0.00 0.00 0.00 0.00 61.98 60.74 3c2a s VAL 111 Cb -0.21 -4.55 0.04 0.00 0.00 0.00 0.00 36.38 31.66 3c2a s VAL 111 CO -0.02 -1.21 0.41 -0.55 0.00 0.00 0.00 175.10 173.74 3c2a s SER 112 N 3.55 -0.30 0.00 3.32 0.15 -0.51 -4.28 113.70 115.63 3c2a s SER 112 Ca 0.16 0.14 0.29 0.00 0.70 0.00 0.00 55.95 57.23 3c2a s SER 112 Cb -0.20 0.40 1.25 0.00 -1.71 0.00 0.00 66.02 65.75 3c2a s SER 112 CO 0.04 -0.57 1.87 -1.54 1.20 0.00 0.00 173.24 174.24 3c2a n SER 113 N 0.85 0.53 -4.75 5.45 3.41 -1.26 -4.03 113.62 113.83 3c2a n SER 113 Ca -0.20 -0.69 -0.35 0.00 -0.26 0.00 0.00 58.87 57.38 3c2a n SER 113 Cb 0.58 -0.05 0.06 0.00 -0.26 0.00 0.00 64.21 64.53 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 -2.40 2.39 0.25 7.33 0.00 -1.26 -5.05 121.76 123.02 3c2a s ALA 114 Ca 0.31 0.85 -0.13 0.00 0.00 0.00 0.00 51.96 52.99 3c2a s ALA 114 Cb 0.20 -3.42 -0.00 0.00 0.00 0.00 0.00 23.12 19.90 3c2a s ALA 114 CO 0.46 -1.41 0.50 -1.54 0.00 0.00 0.00 175.76 173.77 3c2a s SER 115 N -1.97 -0.07 -0.01 0.00 1.04 -1.26 -5.07 113.70 106.36 3c2a s SER 115 Ca 0.74 -0.93 -0.36 0.00 0.48 0.00 0.00 55.95 55.87 3c2a s SER 115 Cb -0.27 0.60 -0.15 0.00 0.10 0.00 0.00 66.02 66.30 3c2a s SER 115 CO 0.39 -1.17 1.58 0.41 0.98 0.00 0.00 173.24 175.43 3c2a n THR 116 N -0.39 0.17 -3.72 2.02 -1.04 -1.26 -4.66 114.28 105.39 3c2a n THR 116 Ca -0.02 -0.03 -0.12 0.00 -2.04 0.00 0.00 64.05 61.84 3c2a n THR 116 Cb 0.62 -1.27 -0.12 0.00 -1.82 0.00 0.00 70.33 67.74 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 1.89 0.28 0.54 -2.82 2.20 0.28 -4.94 119.74 117.16 3c2a s LYS 117 Ca 0.88 0.61 -0.11 0.00 -0.36 0.00 0.00 55.97 56.98 3c2a s LYS 117 Cb -0.87 -0.07 -0.05 0.00 -1.51 0.00 0.00 37.83 35.33 3c2a s LYS 117 CO 0.50 -0.15 0.95 0.20 -0.36 0.00 0.00 175.35 176.48 3c2a s GLY 118 N 1.22 1.77 0.50 5.54 0.00 -1.26 -1.47 107.32 113.62 3c2a s GLY 118 Ca -0.09 -0.11 -0.20 0.00 0.00 0.00 0.00 44.72 44.33 3c2a s GLY 118 CO -0.09 0.14 1.04 2.56 0.00 0.00 0.00 173.10 176.74 3c2a s PRO 119 N -4.67 3.76 0.05 2.90 0.04 -1.26 -4.63 135.00 131.20 3c2a s PRO 119 Ca 0.54 1.32 -0.25 0.00 0.04 0.00 0.00 61.00 62.66 3c2a s PRO 119 Cb -0.11 -2.09 -0.06 0.00 0.04 0.00 0.00 34.50 32.29 3c2a s PRO 119 CO 0.44 -0.46 0.75 0.45 0.04 0.00 0.00 177.00 178.22 3c2a s SER 120 N -2.13 7.20 -0.09 6.66 0.15 0.12 -4.87 113.70 120.74 3c2a s SER 120 Ca 0.66 1.44 0.04 0.00 0.70 0.00 0.00 55.95 58.79 3c2a s SER 120 Cb -0.16 -2.46 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 3c2a s SER 120 CO 0.22 0.04 -0.22 -0.69 1.20 0.00 0.00 173.24 173.80 3c2a s VAL 121 N -0.17 1.87 0.08 4.45 1.01 -1.26 0.65 120.40 127.03 3c2a s VAL 121 Ca 0.38 -0.91 0.08 0.00 0.00 0.00 0.00 61.98 61.53 3c2a s VAL 121 Cb -0.20 -1.63 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 3c2a s VAL 121 CO 0.23 0.52 -0.22 -0.36 0.00 0.00 0.00 175.10 175.26 3c2a s PHE 122 N 0.40 1.91 0.39 5.22 0.08 -0.13 -4.96 117.98 120.89 3c2a s PHE 122 Ca -0.18 -0.40 -0.24 0.00 0.12 0.00 0.00 56.93 56.23 3c2a s PHE 122 Cb -0.18 -1.08 -0.09 0.00 -0.57 0.00 0.00 43.02 41.11 3c2a s PHE 122 CO 0.08 0.18 1.07 -1.25 -0.10 0.00 0.00 175.22 175.20 3c2a s PRO 123 N -1.65 4.16 -0.26 0.24 0.04 -1.26 -0.04 135.00 136.23 3c2a s PRO 123 Ca 0.08 1.57 -0.03 0.00 0.04 0.00 0.00 61.00 62.66 3c2a s PRO 123 Cb -0.10 -2.59 0.02 0.00 0.04 0.00 0.00 34.50 31.87 3c2a s PRO 123 CO 0.04 -0.15 -0.01 -0.51 0.04 0.00 0.00 177.00 176.40 3c2a s LEU 124 N -2.57 3.38 0.06 -3.56 1.43 0.26 -4.74 118.68 112.94 3c2a s LEU 124 Ca 0.57 -0.78 0.03 0.00 -1.03 0.00 0.00 54.13 52.93 3c2a s LEU 124 Cb -0.24 -1.74 -0.03 0.00 0.03 0.00 0.00 46.19 44.21 3c2a s LEU 124 CO 0.30 -0.14 -0.10 0.00 0.23 0.00 0.00 176.35 176.64 3c2a s ALA 125 N 1.40 0.81 0.57 4.21 0.00 -1.26 -0.44 121.76 127.04 3c2a s ALA 125 Ca 0.01 -0.90 -0.20 0.00 0.00 0.00 0.00 51.96 50.88 3c2a s ALA 125 Cb -0.17 0.01 -0.06 0.00 0.00 0.00 0.00 23.12 22.90 3c2a s ALA 125 CO -0.02 0.02 0.99 -0.35 0.00 0.00 0.00 175.76 176.40 3c2a n PRO 126 N 1.26 1.03 0.04 0.00 -0.04 -1.26 -4.96 135.00 131.05 3c2a n PRO 126 Ca -0.21 0.39 -0.13 0.00 -0.04 0.00 0.00 63.50 63.51 3c2a n PRO 126 Cb 0.55 -2.16 -0.09 0.00 -0.04 0.00 0.00 33.50 31.76 3c2a n PRO 126 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3c2a s SER 128 N -5.52 7.06 -0.40 0.00 0.15 -1.26 -4.91 113.70 108.81 3c2a s SER 128 Ca -0.15 2.06 -0.43 0.00 0.70 0.00 0.00 55.95 58.13 3c2a s SER 128 Cb 0.01 -2.58 -0.17 0.00 -1.71 0.00 0.00 66.02 61.57 3c2a s SER 128 CO 0.60 -0.47 1.80 -1.14 1.20 0.00 0.00 173.24 175.23 3c2a n ARG 129 N 3.81 0.56 -3.12 5.44 0.63 -1.26 -4.79 116.66 117.93 3c2a n ARG 129 Ca 0.09 0.20 -0.44 0.00 -0.92 0.00 0.00 57.85 56.78 3c2a n ARG 129 Cb 0.46 -1.83 0.00 0.00 0.45 0.00 0.00 32.46 31.54 3c2a n ARG 129 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 3c2a n SER 130 N 5.65 5.93 -4.11 6.15 2.88 -1.26 -4.96 113.62 123.89 3c2a n SER 130 Ca 0.34 -3.22 -0.08 0.00 -1.33 0.00 0.00 58.87 54.58 3c2a n SER 130 Cb 0.05 -1.34 -0.10 0.00 -0.75 0.00 0.00 64.21 62.06 3c2a n SER 130 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 3c2a s THR 133 N -1.82 0.21 0.26 2.46 2.01 -1.26 -4.90 115.64 112.59 3c2a s THR 133 Ca 0.32 -1.85 0.00 0.00 0.31 0.00 0.00 61.69 60.47 3c2a s THR 133 Cb -0.02 -1.70 0.00 0.00 0.01 0.00 0.00 72.50 70.79 3c2a s THR 133 CO 0.02 -0.81 0.00 -0.24 -0.69 0.00 0.00 174.62 172.89 3c2a n SER 134 N 0.03 -3.40 0.00 3.53 2.88 -1.26 -5.01 113.62 110.39 3c2a n SER 134 Ca -0.11 0.59 0.00 0.00 -1.33 0.00 0.00 58.87 58.02 3c2a n SER 134 Cb 0.62 -2.09 0.00 0.00 -0.75 0.00 0.00 64.21 61.99 3c2a n SER 134 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3c2a n GLY 135 N -3.05 1.34 0.00 0.46 0.00 -1.26 -4.64 105.19 98.04 3c2a n GLY 135 Ca -0.04 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.36 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 1.45 3.68 -0.02 0.00 -1.26 -4.08 105.19 104.96 3c2a n GLY 136 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 0.00 2.33 0.06 2.61 -4.23 -1.26 -0.27 115.64 114.88 3c2a s THR 137 Ca 0.00 -1.85 0.05 0.00 -1.18 0.00 0.00 61.69 58.71 3c2a s THR 137 Cb 0.00 -2.94 -0.03 0.00 1.34 0.00 0.00 72.50 70.88 3c2a s THR 137 CO 0.00 -0.06 -0.14 0.00 -0.54 0.00 0.00 174.62 173.88 3c2a s ALA 138 N -2.60 1.17 -0.09 3.99 0.00 0.02 -4.58 121.76 119.66 3c2a s ALA 138 Ca 0.38 -0.91 0.01 0.00 0.00 0.00 0.00 51.96 51.43 3c2a s ALA 138 Cb 0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 23.12 23.00 3c2a s ALA 138 CO 0.20 0.19 -0.10 0.00 0.00 0.00 0.00 175.76 176.06 3c2a s ALA 139 N -1.07 2.81 0.15 0.00 0.00 -1.26 -1.40 121.76 120.98 3c2a s ALA 139 Ca -0.00 -0.90 -0.01 0.00 0.00 0.00 0.00 51.96 51.05 3c2a s ALA 139 Cb -0.09 -1.20 -0.04 0.00 0.00 0.00 0.00 23.12 21.79 3c2a s ALA 139 CO 0.02 0.44 0.06 -0.48 0.00 0.00 0.00 175.76 175.80 3c2a s LEU 140 N -0.33 1.72 0.00 0.00 0.05 -0.46 -4.37 118.68 115.28 3c2a s LEU 140 Ca 0.04 -1.23 0.00 0.00 0.05 0.00 0.00 54.13 52.99 3c2a s LEU 140 Cb -0.13 0.27 0.00 0.00 -2.05 0.00 0.00 46.19 44.29 3c2a s LEU 140 CO 0.02 -0.73 0.00 0.61 -0.55 0.00 0.00 176.35 175.70 3c2a n GLY 141 N -0.14 0.70 2.86 -3.48 0.00 0.42 -0.20 105.19 105.35 3c2a n GLY 141 Ca -0.04 -0.75 -0.22 0.00 0.00 0.00 0.00 46.02 45.01 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 1.29 4.11 -0.50 0.00 2.96 0.94 -1.56 118.68 125.92 3c2a s LEU 143 Ca -0.05 0.29 -0.09 0.00 -0.22 0.00 0.00 54.13 54.06 3c2a s LEU 143 Cb -0.14 -2.53 0.13 0.00 0.50 0.00 0.00 46.19 44.15 3c2a s LEU 143 CO -0.02 -0.28 0.38 -0.69 -1.32 0.00 0.00 176.35 174.42 3c2a s VAL 144 N 2.20 4.26 -0.11 1.68 1.01 0.71 -0.95 120.40 129.20 3c2a s VAL 144 Ca 0.18 -1.90 -0.04 0.00 0.00 0.00 0.00 61.98 60.21 3c2a s VAL 144 Cb -0.16 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 3c2a s VAL 144 CO 0.10 -0.80 0.06 -0.54 0.00 0.00 0.00 175.10 173.93 3c2a s LYS 145 N 1.20 3.23 -0.72 2.72 1.02 0.21 -1.05 119.74 126.35 3c2a s LYS 145 Ca 0.07 -0.29 -0.04 0.00 0.02 0.00 0.00 55.97 55.73 3c2a s LYS 145 Cb -0.25 -2.98 -0.05 0.00 -0.52 0.00 0.00 37.83 34.04 3c2a s LYS 145 CO -0.01 0.71 0.64 -0.25 -0.92 0.00 0.00 175.35 175.51 3c2a n ASP 146 N 2.17 -5.36 -4.42 2.83 8.00 0.36 -0.70 116.55 119.42 3c2a n ASP 146 Ca -0.19 -0.47 -0.21 0.00 0.71 0.00 0.00 54.79 54.63 3c2a n ASP 146 Cb 0.54 -3.85 -0.10 0.00 -0.02 0.00 0.00 41.12 37.69 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 -3.25 2.01 -0.22 1.24 -0.85 -0.10 -4.44 117.35 111.74 3c2a s TYR 147 Ca 0.30 -0.50 -0.21 0.00 -0.52 0.00 0.00 57.07 56.14 3c2a s TYR 147 Cb -0.04 -0.96 0.06 0.00 0.38 0.00 0.00 41.96 41.39 3c2a s TYR 147 CO 0.52 0.49 0.60 0.12 -1.52 0.00 0.00 175.55 175.76 3c2a s PHE 148 N -2.79 -0.65 0.00 -3.49 5.36 -0.54 -0.32 117.98 115.55 3c2a s PHE 148 Ca 0.27 1.59 0.00 0.00 -0.96 0.00 0.00 56.93 57.83 3c2a s PHE 148 Cb -0.01 0.23 0.00 0.00 -0.34 0.00 0.00 43.02 42.89 3c2a s PHE 148 CO 0.11 -0.32 0.00 -0.35 -1.46 0.00 0.00 175.22 173.20 3c2a n PRO 149 N 2.73 0.58 -1.79 10.12 -0.04 -1.26 -0.56 135.00 144.79 3c2a n PRO 149 Ca -0.14 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.02 3c2a n PRO 149 Cb 0.56 0.00 0.07 0.00 -0.04 0.00 0.00 33.50 34.08 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 -1.75 2.49 0.41 0.54 0.41 -1.26 -4.75 118.70 114.80 3c2a s GLU 150 Ca 0.00 0.46 0.04 0.00 -0.41 0.00 0.00 54.97 55.06 3c2a s GLU 150 Cb 0.00 -1.98 0.00 0.00 -1.78 0.00 0.00 34.13 30.37 3c2a s GLU 150 CO 0.00 -1.29 0.59 -1.25 -0.49 0.00 0.00 175.26 172.82 3c2a s PRO 151 N -5.33 2.99 0.09 0.39 0.04 -1.26 -4.91 135.00 127.01 3c2a s PRO 151 Ca 0.59 -0.83 0.07 0.00 0.04 0.00 0.00 61.00 60.88 3c2a s PRO 151 Cb -0.12 -2.68 -0.04 0.00 0.04 0.00 0.00 34.50 31.70 3c2a s PRO 151 CO 0.52 -0.19 -0.14 0.08 0.04 0.00 0.00 177.00 177.31 3c2a s VAL 152 N -2.40 3.12 -0.11 -0.36 1.01 -1.26 -4.37 120.40 116.01 3c2a s VAL 152 Ca 0.49 -1.30 0.01 0.00 0.00 0.00 0.00 61.98 61.19 3c2a s VAL 152 Cb -0.10 -2.42 -0.01 0.00 0.00 0.00 0.00 36.38 33.85 3c2a s VAL 152 CO 0.35 0.17 -0.16 -0.89 0.00 0.00 0.00 175.10 174.56 3c2a s THR 153 N -1.13 2.81 -0.08 3.92 2.01 -0.45 -4.97 115.64 117.75 3c2a s THR 153 Ca 0.19 -0.76 0.03 0.00 0.31 0.00 0.00 61.69 61.46 3c2a s THR 153 Cb -0.11 -2.15 0.01 0.00 0.01 0.00 0.00 72.50 70.26 3c2a s THR 153 CO 0.11 0.54 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.71 3c2a s VAL 154 N 0.22 1.58 0.37 3.82 1.01 -1.26 -0.57 120.40 125.57 3c2a s VAL 154 Ca -0.10 -0.74 0.05 0.00 0.00 0.00 0.00 61.98 61.18 3c2a s VAL 154 Cb -0.16 -1.39 -0.06 0.00 0.00 0.00 0.00 36.38 34.77 3c2a s VAL 154 CO 0.06 0.45 0.04 -0.94 0.00 0.00 0.00 175.10 174.71 3c2a s SER 156 N 0.48 3.05 -0.07 3.32 1.04 -0.67 -4.97 113.70 115.88 3c2a s SER 156 Ca -0.16 -1.42 0.04 0.00 0.48 0.00 0.00 55.95 54.89 3c2a s SER 156 Cb -0.17 -0.11 0.00 0.00 0.10 0.00 0.00 66.02 65.85 3c2a s SER 156 CO 0.06 -0.59 -0.19 0.26 0.98 0.00 0.00 173.24 173.76 3c2a s TRP 157 N -3.06 1.97 -1.54 5.02 0.52 -1.26 -0.56 118.94 120.03 3c2a s TRP 157 Ca 0.33 -0.69 -0.10 0.00 0.02 0.00 0.00 56.10 55.66 3c2a s TRP 157 Cb 0.08 -1.34 0.08 0.00 -1.15 0.00 0.00 33.47 31.14 3c2a s TRP 157 CO 0.15 -0.28 0.69 0.09 0.02 0.00 0.00 176.95 177.63 3c2a n ASN 162 N 3.42 -2.42 -2.01 2.95 3.02 0.80 -1.54 115.26 119.49 3c2a n ASN 162 Ca -0.20 -0.95 -0.17 0.00 -0.03 0.00 0.00 54.58 53.23 3c2a n ASN 162 Cb 0.52 -3.16 -0.01 0.00 -0.61 0.00 0.00 39.78 36.53 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 -5.11 0.00 6.41 7.64 -1.26 -1.48 113.62 116.99 3c2a n SER 163 Ca -0.09 -0.02 0.00 0.00 1.01 0.00 0.00 58.87 59.77 3c2a n SER 163 Cb 0.58 -4.19 0.00 0.00 -1.01 0.00 0.00 64.21 59.59 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 -1.03 1.64 0.21 0.23 0.00 -0.59 -4.90 105.19 100.75 3c2a n GLY 164 Ca -0.20 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.86 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 1.50 -3.16 4.61 0.00 -1.27 -3.43 119.26 117.51 3c2a h ALA 165 Ca 0.00 -0.25 -0.63 0.00 0.00 0.00 0.00 54.91 54.03 3c2a h ALA 165 Cb 0.00 -0.04 -0.19 0.00 0.00 0.00 0.00 17.79 17.55 3c2a h ALA 165 CO 0.00 0.34 -0.60 -1.17 0.00 0.00 0.00 179.25 177.81 3c2a s LEU 166 N -8.28 3.58 0.00 0.00 0.20 -1.15 -4.87 118.68 108.15 3c2a s LEU 166 Ca -0.03 -0.06 0.00 0.00 0.69 0.00 0.00 54.13 54.73 3c2a s LEU 166 Cb 0.15 -1.92 0.00 0.00 -0.43 0.00 0.00 46.19 43.99 3c2a s LEU 166 CO 0.70 0.10 0.00 0.41 -0.29 0.00 0.00 176.35 177.27 3c2a n THR 167 N 4.03 0.00 -2.25 3.68 -1.04 -1.26 -4.23 114.28 113.20 3c2a n THR 167 Ca -0.17 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.42 3c2a n THR 167 Cb 0.52 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 69.01 3c2a n THR 167 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 3c2a s SER 168 N -1.27 6.84 0.00 8.00 0.15 -1.26 -2.65 113.70 123.51 3c2a s SER 168 Ca 0.00 1.94 0.00 0.00 0.70 0.00 0.00 55.95 58.59 3c2a s SER 168 Cb 0.00 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 3c2a s SER 168 CO 0.00 -0.80 0.00 0.61 1.20 0.00 0.00 173.24 174.25 3c2a n GLY 169 N 3.78 0.69 3.69 9.45 0.00 -1.26 -4.78 105.19 116.76 3c2a n GLY 169 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.56 4.99 -0.21 1.61 1.01 -1.09 -1.62 120.40 122.53 3c2a s VAL 171 Ca 0.00 1.44 -0.03 0.00 0.00 0.00 0.00 61.98 63.40 3c2a s VAL 171 Cb 0.00 -4.05 0.07 0.00 0.00 0.00 0.00 36.38 32.40 3c2a s VAL 171 CO 0.00 0.15 0.05 -2.28 0.00 0.00 0.00 175.10 173.01 3c2a s HIS 172 N 1.48 1.10 -0.21 5.22 2.46 0.12 -4.99 115.29 120.47 3c2a s HIS 172 Ca 0.36 -0.98 -0.16 0.00 0.47 0.00 0.00 55.06 54.75 3c2a s HIS 172 Cb -0.17 -1.11 -0.04 0.00 -0.13 0.00 0.00 32.58 31.13 3c2a s HIS 172 CO 0.14 -0.66 0.39 0.99 -2.47 0.00 0.00 174.74 173.14 3c2a s THR 173 N 1.83 5.21 0.17 0.89 2.01 -1.26 -0.31 115.64 124.18 3c2a s THR 173 Ca 0.01 0.68 -0.12 0.00 0.31 0.00 0.00 61.69 62.57 3c2a s THR 173 Cb -0.17 -3.72 -0.07 0.00 0.01 0.00 0.00 72.50 68.55 3c2a s THR 173 CO -0.11 0.25 0.53 -0.36 -0.69 0.00 0.00 174.62 174.24 3c2a s PHE 174 N 1.32 3.52 0.55 4.92 0.40 -0.41 -5.01 117.98 123.28 3c2a s PHE 174 Ca 0.18 0.94 -0.20 0.00 -0.60 0.00 0.00 56.93 57.25 3c2a s PHE 174 Cb -0.15 -2.29 -0.07 0.00 0.51 0.00 0.00 43.02 41.02 3c2a s PHE 174 CO 0.08 0.37 0.87 -2.30 0.70 0.00 0.00 175.22 174.94 3c2a n PRO 175 N 0.40 0.91 -2.46 0.24 -0.02 -1.26 -4.47 135.00 128.34 3c2a n PRO 175 Ca -0.03 0.34 -0.34 0.00 -2.02 0.00 0.00 63.50 61.46 3c2a n PRO 175 Cb 0.52 -2.03 -0.03 0.00 -0.02 0.00 0.00 33.50 31.95 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 -1.51 2.86 -0.07 3.55 0.00 -1.26 -4.74 121.76 120.59 3c2a s ALA 176 Ca 0.71 0.55 -0.04 0.00 0.00 0.00 0.00 51.96 53.18 3c2a s ALA 176 Cb -0.46 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.38 3c2a s ALA 176 CO 0.51 -0.39 0.10 0.54 0.00 0.00 0.00 175.76 176.52 3c2a s VAL 177 N -2.09 5.01 -0.28 0.00 0.11 0.18 -4.90 120.40 118.43 3c2a s VAL 177 Ca 0.66 -0.10 -0.16 0.00 -2.93 0.00 0.00 61.98 59.45 3c2a s VAL 177 Cb -0.16 -3.21 -0.03 0.00 -1.53 0.00 0.00 36.38 31.46 3c2a s VAL 177 CO 0.23 0.52 0.43 -0.22 -3.33 0.00 0.00 175.10 172.73 3c2a s LEU 178 N -1.26 4.10 0.54 2.54 2.96 -1.26 -0.62 118.68 125.68 3c2a s LEU 178 Ca 0.18 0.28 -0.04 0.00 -0.22 0.00 0.00 54.13 54.33 3c2a s LEU 178 Cb -0.12 -2.50 0.00 0.00 0.50 0.00 0.00 46.19 44.07 3c2a s LEU 178 CO 0.08 -0.26 0.83 -1.10 -1.32 0.00 0.00 176.35 174.58 3c2a s GLN 179 N 2.17 3.00 0.47 1.98 -0.21 -0.50 -4.98 119.66 121.58 3c2a s GLN 179 Ca 0.17 -0.13 0.32 0.00 0.02 0.00 0.00 55.36 55.73 3c2a s GLN 179 Cb -0.16 -2.36 1.60 0.00 1.00 0.00 0.00 33.01 33.09 3c2a s GLN 179 CO 0.10 -0.55 1.97 0.77 -2.12 0.00 0.00 175.29 175.46 3c2a h SER 180 N 0.01 0.00 0.84 5.90 0.02 -1.98 -1.08 113.55 117.26 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 0.60 0.00 0.00 0.77 -1.14 0.00 0.00 176.83 177.06 3c2a h SER 182 N 0.00 0.00 0.00 3.07 4.64 -2.02 -3.46 113.55 115.77 3c2a h SER 182 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3c2a h SER 182 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 3c2a h SER 182 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3c2a n GLY 183 N -0.06 0.20 3.88 -0.77 0.00 -0.41 -4.12 105.19 103.92 3c2a n GLY 183 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 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 4.31 0.20 0.99 1.43 -1.25 -4.85 118.68 119.52 3c2a s LEU 184 Ca 0.00 0.66 -0.02 0.00 -1.03 0.00 0.00 54.13 53.74 3c2a s LEU 184 Cb 0.00 -3.08 -0.05 0.00 0.03 0.00 0.00 46.19 43.09 3c2a s LEU 184 CO 0.00 0.13 0.41 -0.31 0.23 0.00 0.00 176.35 176.81 3c2a s TYR 185 N -1.50 3.48 0.01 0.29 1.51 0.56 -1.41 117.35 120.30 3c2a s TYR 185 Ca 0.36 0.42 0.01 0.00 -1.01 0.00 0.00 57.07 56.85 3c2a s TYR 185 Cb -0.13 -1.91 -0.01 0.00 -0.11 0.00 0.00 41.96 39.80 3c2a s TYR 185 CO 0.21 0.37 -0.05 -1.12 -1.11 0.00 0.00 175.55 173.85 3c2a s SER 186 N -3.00 0.52 0.14 2.29 0.01 0.21 -0.49 113.70 113.37 3c2a s SER 186 Ca 0.40 -0.24 0.02 0.00 1.31 0.00 0.00 55.95 57.44 3c2a s SER 186 Cb -0.11 -0.01 -0.04 0.00 0.21 0.00 0.00 66.02 66.06 3c2a s SER 186 CO 0.28 -0.06 -0.03 -1.48 0.41 0.00 0.00 173.24 172.36 3c2a s LEU 187 N -0.61 2.30 0.09 2.44 0.05 -0.21 0.52 118.68 123.26 3c2a s LEU 187 Ca -0.03 -1.09 0.09 0.00 0.05 0.00 0.00 54.13 53.15 3c2a s LEU 187 Cb -0.05 -0.07 -0.04 0.00 -2.05 0.00 0.00 46.19 43.98 3c2a s LEU 187 CO -0.00 -0.51 -0.23 -0.44 -0.55 0.00 0.00 176.35 174.62 3c2a s SER 188 N -3.11 3.52 -0.09 1.48 0.01 -1.26 -0.21 113.70 114.03 3c2a s SER 188 Ca 0.18 -0.61 0.02 0.00 1.31 0.00 0.00 55.95 56.85 3c2a s SER 188 Cb 0.05 -0.39 0.01 0.00 0.21 0.00 0.00 66.02 65.91 3c2a s SER 188 CO -0.00 0.21 -0.16 -0.55 0.41 0.00 0.00 173.24 173.15 3c2a s SER 189 N -1.81 2.38 0.19 2.44 0.15 -0.60 -1.29 113.70 115.16 3c2a s SER 189 Ca 0.15 -0.42 0.11 0.00 0.70 0.00 0.00 55.95 56.49 3c2a s SER 189 Cb -0.10 -1.08 -0.04 0.00 -1.71 0.00 0.00 66.02 63.09 3c2a s SER 189 CO 0.06 0.05 -0.24 0.68 1.20 0.00 0.00 173.24 174.99 3c2a s VAL 190 N 0.77 2.29 -0.06 4.45 -7.23 0.58 -1.66 120.40 119.54 3c2a s VAL 190 Ca -0.11 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.09 3c2a s VAL 190 Cb -0.16 -2.08 0.00 0.00 0.56 0.00 0.00 36.38 34.70 3c2a s VAL 190 CO 0.02 -0.12 -0.16 -0.69 -0.31 0.00 0.00 175.10 173.84 3c2a s VAL 191 N -1.66 1.39 -0.16 1.32 1.01 0.72 0.12 120.40 123.14 3c2a s VAL 191 Ca 0.20 -0.66 -0.08 0.00 0.00 0.00 0.00 61.98 61.44 3c2a s VAL 191 Cb -0.08 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 3c2a s VAL 191 CO 0.09 0.41 0.12 -0.89 0.00 0.00 0.00 175.10 174.83 3c2a s THR 192 N 0.36 5.31 0.07 3.92 2.01 -0.64 -1.36 115.64 125.31 3c2a s THR 192 Ca -0.11 0.14 0.00 0.00 0.31 0.00 0.00 61.69 62.04 3c2a s THR 192 Cb -0.14 -3.37 -0.04 0.00 0.01 0.00 0.00 72.50 68.96 3c2a s THR 192 CO 0.04 0.52 -0.05 0.68 -0.69 0.00 0.00 174.62 175.12 3c2a s VAL 193 N -0.23 0.45 0.27 3.82 -7.23 -0.49 -4.69 120.40 112.30 3c2a s VAL 193 Ca 0.10 -1.84 -0.30 0.00 -1.81 0.00 0.00 61.98 58.14 3c2a s VAL 193 Cb -0.12 -1.55 -0.10 0.00 0.56 0.00 0.00 36.38 35.17 3c2a s VAL 193 CO 0.01 -0.92 1.47 -2.84 -0.31 0.00 0.00 175.10 172.52 3c2a s PRO 194 N -3.78 4.23 0.15 4.82 0.02 -1.26 -0.80 135.00 138.37 3c2a s PRO 194 Ca 0.09 2.37 -0.15 0.00 0.02 0.00 0.00 61.00 63.33 3c2a s PRO 194 Cb 0.06 -3.08 0.02 0.00 0.02 0.00 0.00 34.50 31.52 3c2a s PRO 194 CO -0.07 -0.47 1.74 0.77 -0.33 0.00 0.00 177.00 178.64 3c2a h SER 195 N 4.87 0.57 -0.46 2.53 0.02 -0.81 -2.01 113.55 118.26 3c2a h SER 195 Ca -0.46 -0.11 0.13 0.00 -0.84 0.00 0.00 61.79 60.51 3c2a h SER 195 Cb 1.22 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.60 3c2a h SER 195 CO 0.77 0.52 0.44 0.77 -1.14 0.00 0.00 176.83 178.19 3c2a h SER 196 N 0.58 0.00 -0.02 3.07 4.64 -1.77 -2.03 113.55 118.01 3c2a h SER 196 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 3c2a h SER 196 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 3c2a h SER 196 CO -0.02 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.40 3c2a n SER 197 N -3.86 0.88 -0.36 4.97 3.41 -0.75 -4.73 113.62 113.17 3c2a n SER 197 Ca 0.08 -1.33 0.06 0.00 -0.26 0.00 0.00 58.87 57.42 3c2a n SER 197 Cb 0.63 -0.01 0.22 0.00 -0.26 0.00 0.00 64.21 64.80 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 1.34 0.94 -1.66 1.04 3.38 -1.47 -1.86 115.31 117.02 3c2a h LEU 198 Ca 0.00 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3c2a h LEU 198 Cb 0.29 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3c2a h LEU 198 CO 0.00 0.52 0.00 0.61 0.09 0.00 0.00 178.44 179.66 3c2a n GLY 199 N -1.35 1.04 0.27 0.83 0.00 -1.26 -4.47 105.19 100.24 3c2a n GLY 199 Ca 0.18 -0.53 0.06 0.00 0.00 0.00 0.00 46.02 45.73 3c2a n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c2a h THR 200 N 2.93 1.06 -3.40 2.61 1.03 -1.70 -3.47 112.91 111.98 3c2a h THR 200 Ca 0.00 -0.16 -0.17 0.00 -0.01 0.00 0.00 66.41 66.06 3c2a h THR 200 Cb 0.66 0.87 -0.04 0.00 -1.07 0.00 0.00 68.15 68.57 3c2a h THR 200 CO 0.00 0.06 -0.03 0.00 -0.01 0.00 0.00 175.52 175.54 3c2a n GLN 203 N -4.48 0.65 -4.18 0.00 10.64 -1.26 -5.18 117.38 113.56 3c2a n GLN 203 Ca -0.01 -2.11 -0.23 0.00 -1.83 0.00 0.00 57.00 52.82 3c2a n GLN 203 Cb 0.10 2.16 -0.06 0.00 -0.86 0.00 0.00 30.24 31.58 3c2a n GLN 203 CO 0.00 0.00 0.00 0.95 -1.83 0.00 0.00 177.06 176.18 3c2a s THR 205 N -2.63 4.05 -0.10 -0.39 -4.23 -1.26 -5.07 115.64 106.01 3c2a s THR 205 Ca 0.20 -1.53 0.01 0.00 -1.18 0.00 0.00 61.69 59.20 3c2a s THR 205 Cb -0.02 -3.15 0.02 0.00 1.34 0.00 0.00 72.50 70.70 3c2a s THR 205 CO 0.15 -0.30 -0.10 -0.31 -0.54 0.00 0.00 174.62 173.52 3c2a s TYR 206 N -2.09 1.53 -0.06 3.99 2.02 -1.26 -4.96 117.35 116.52 3c2a s TYR 206 Ca 0.31 -0.69 -0.01 0.00 -0.37 0.00 0.00 57.07 56.32 3c2a s TYR 206 Cb -0.08 -1.19 0.03 0.00 -0.40 0.00 0.00 41.96 40.32 3c2a s TYR 206 CO 0.22 -0.42 -0.01 0.99 -1.57 0.00 0.00 175.55 174.77 3c2a s THR 207 N 1.23 0.34 -0.03 -0.71 2.01 -1.26 0.03 115.64 117.26 3c2a s THR 207 Ca -0.04 0.08 -0.16 0.00 0.31 0.00 0.00 61.69 61.88 3c2a s THR 207 Cb -0.14 -0.47 -0.05 0.00 0.01 0.00 0.00 72.50 71.85 3c2a s THR 207 CO -0.03 0.23 0.44 0.00 -0.69 0.00 0.00 174.62 174.56 3c2a s ASN 209 N -0.60 5.30 -0.20 0.00 -0.87 0.27 -1.82 114.94 117.02 3c2a s ASN 209 Ca 0.24 -1.59 -0.09 0.00 -1.57 0.00 0.00 52.86 49.86 3c2a s ASN 209 Cb -0.16 -1.86 -0.04 0.00 -0.02 0.00 0.00 41.25 39.17 3c2a s ASN 209 CO 0.13 -0.45 0.10 -0.69 -2.57 0.00 0.00 177.10 173.62 3c2a s VAL 210 N 1.28 5.04 -0.18 1.60 1.01 0.12 -1.67 120.40 127.61 3c2a s VAL 210 Ca 0.02 0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.07 3c2a s VAL 210 Cb -0.22 -3.30 0.02 0.00 0.00 0.00 0.00 36.38 32.88 3c2a s VAL 210 CO -0.01 0.42 -0.17 0.21 0.00 0.00 0.00 175.10 175.55 3c2a s ASN 211 N 0.59 3.07 -0.64 3.32 2.47 0.27 -1.02 114.94 123.00 3c2a s ASN 211 Ca 0.05 -0.65 -0.01 0.00 0.42 0.00 0.00 52.86 52.67 3c2a s ASN 211 Cb -0.12 -1.38 0.16 0.00 -1.45 0.00 0.00 41.25 38.46 3c2a s ASN 211 CO 0.01 -0.03 0.45 -2.28 -3.72 0.00 0.00 177.10 171.52 3c2a s HIS 212 N 1.35 3.41 0.18 0.43 5.65 0.14 -1.34 115.29 125.11 3c2a s HIS 212 Ca 0.04 -2.84 -0.13 0.00 0.25 0.00 0.00 55.06 52.38 3c2a s HIS 212 Cb -0.13 -3.13 0.14 0.00 -1.18 0.00 0.00 32.58 28.28 3c2a s HIS 212 CO -0.12 -0.80 1.79 0.87 -0.65 0.00 0.00 174.74 175.83 3c2a h LYS 213 N 6.78 0.52 -0.48 2.88 1.57 -1.79 -1.22 116.57 124.83 3c2a h LYS 213 Ca -0.00 -0.03 0.14 0.00 -1.87 0.00 0.00 60.65 58.89 3c2a h LYS 213 Cb 0.92 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.10 3c2a h LYS 213 CO 0.72 0.35 0.35 -1.35 -0.57 0.00 0.00 179.45 178.94 3c2a h PRO 214 N 0.54 0.00 -0.36 3.15 0.11 -1.90 -1.08 132.00 132.46 3c2a h PRO 214 Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 3c2a h PRO 214 Cb 0.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.23 3c2a h PRO 214 CO -0.15 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.51 3c2a n SER 215 N -4.37 2.97 -4.00 -2.05 3.41 -0.92 -4.97 113.62 103.69 3c2a n SER 215 Ca 0.09 -1.93 -0.28 0.00 -0.26 0.00 0.00 58.87 56.48 3c2a n SER 215 Cb 0.56 -0.24 -0.03 0.00 -0.26 0.00 0.00 64.21 64.25 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 0.74 -0.79 -4.35 4.04 4.13 -0.41 -4.90 115.26 113.72 3c2a n ASN 216 Ca 0.13 -1.08 -0.32 0.00 1.68 0.00 0.00 54.58 54.99 3c2a n ASN 216 Cb 0.44 -2.72 -0.15 0.00 -1.54 0.00 0.00 39.78 35.81 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 -3.97 2.72 0.04 3.41 2.01 -0.77 -5.01 115.64 114.07 3c2a s THR 217 Ca 0.08 -0.80 0.07 0.00 0.31 0.00 0.00 61.69 61.34 3c2a s THR 217 Cb -0.03 -2.09 -0.02 0.00 0.01 0.00 0.00 72.50 70.36 3c2a s THR 217 CO 0.91 0.55 -0.19 -0.54 -0.69 0.00 0.00 174.62 174.66 3c2a s LYS 218 N 0.02 1.29 -0.04 4.92 1.02 -1.26 0.27 119.74 125.96 3c2a s LYS 218 Ca -0.06 -0.89 -0.00 0.00 0.02 0.00 0.00 55.97 55.04 3c2a s LYS 218 Cb -0.15 -1.38 0.03 0.00 -0.52 0.00 0.00 37.83 35.81 3c2a s LYS 218 CO 0.05 0.35 0.01 0.08 -0.92 0.00 0.00 175.35 174.92 3c2a s VAL 219 N -0.80 0.13 -0.15 3.17 1.01 -0.19 -4.99 120.40 118.58 3c2a s VAL 219 Ca 0.06 0.16 -0.03 0.00 0.00 0.00 0.00 61.98 62.18 3c2a s VAL 219 Cb -0.09 -0.27 -0.02 0.00 0.00 0.00 0.00 36.38 36.01 3c2a s VAL 219 CO 0.02 0.16 -0.06 -1.81 0.00 0.00 0.00 175.10 173.40 3c2a s ASP 220 N 1.35 4.55 -0.08 3.32 1.01 -1.26 0.13 116.67 125.69 3c2a s ASP 220 Ca -0.05 -0.20 -0.02 0.00 0.71 0.00 0.00 52.55 52.98 3c2a s ASP 220 Cb -0.13 -1.73 0.03 0.00 1.01 0.00 0.00 42.92 42.10 3c2a s ASP 220 CO -0.03 0.15 0.03 -0.75 0.21 0.00 0.00 175.17 174.79 3c2a s LYS 221 N 0.46 0.33 0.18 8.23 2.47 -0.76 -4.97 119.74 125.68 3c2a s LYS 221 Ca -0.05 0.15 -0.30 0.00 -1.56 0.00 0.00 55.97 54.21 3c2a s LYS 221 Cb -0.15 -0.96 -0.08 0.00 -1.46 0.00 0.00 37.83 35.19 3c2a s LYS 221 CO 0.03 -0.37 1.10 0.50 0.16 0.00 0.00 175.35 176.77 3c2a s ARG 222 N 2.05 4.60 -0.29 4.03 3.52 -1.26 -1.02 118.95 130.57 3c2a s ARG 222 Ca 0.04 1.71 -0.08 0.00 -0.13 0.00 0.00 55.73 57.27 3c2a s ARG 222 Cb -0.13 -3.28 -0.01 0.00 -1.56 0.00 0.00 34.95 29.97 3c2a s ARG 222 CO -0.05 0.08 0.12 0.08 -0.81 0.00 0.00 175.30 174.72 3c2a s VAL 223 N -0.24 4.40 -0.19 7.11 1.01 0.11 -4.95 120.40 127.65 3c2a s VAL 223 Ca 0.49 -0.40 -0.08 0.00 0.00 0.00 0.00 61.98 61.99 3c2a s VAL 223 Cb -0.29 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 32.85 3c2a s VAL 223 CO 0.35 0.15 0.09 -1.61 0.00 0.00 0.00 175.10 174.07 3c2a s GLU 226 N 1.59 4.05 0.00 2.72 0.41 -1.26 -4.40 118.70 121.81 3c2a s GLU 226 Ca 0.05 -0.29 0.06 0.00 -0.41 0.00 0.00 54.97 54.38 3c2a s GLU 226 Cb -0.17 -3.29 0.05 0.00 -1.78 0.00 0.00 34.13 28.94 3c2a s GLU 226 CO 0.05 0.30 0.69 1.28 -0.49 0.00 0.00 175.26 177.09