#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b4t s ARG 3 N 0.00 3.14 0.09 1.97 0.52 -1.04 -4.93 118.95 118.70 3b4t s ARG 3 Ca 0.00 -0.02 0.06 0.00 -0.52 0.00 0.00 55.73 55.25 3b4t s ARG 3 Cb 0.00 -2.35 0.31 0.00 0.52 0.00 0.00 34.95 33.44 3b4t s ARG 3 CO 0.00 -0.48 1.15 0.39 0.02 0.00 0.00 175.30 176.38 3b4t n GLU 4 N -2.40 0.04 0.06 3.54 -0.58 -1.26 -0.99 120.64 119.04 3b4t n GLU 4 Ca 0.03 0.52 -0.10 0.00 -0.42 0.00 0.00 57.16 57.18 3b4t n GLU 4 Cb 0.57 -1.66 -0.13 0.00 -0.57 0.00 0.00 31.44 29.65 3b4t n GLU 4 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 3b4t h ASP 5 N 0.00 0.12 0.00 1.62 3.58 -2.02 -3.47 116.42 116.26 3b4t h ASP 5 Ca 0.00 -0.15 0.00 0.00 0.42 0.00 0.00 57.03 57.30 3b4t h ASP 5 Cb 0.06 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.07 3b4t h ASP 5 CO 0.00 1.12 0.00 0.61 -2.88 0.00 0.00 179.24 178.09 3b4t n GLY 6 N 1.45 0.56 3.93 -0.78 0.00 -0.16 -5.09 105.19 105.09 3b4t n GLY 6 Ca -0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.71 3b4t n GLY 6 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3b4t s ARG 7 N -0.94 3.52 0.65 1.61 0.52 -1.26 -4.84 118.95 118.21 3b4t s ARG 7 Ca 0.00 -0.19 -0.07 0.00 -0.52 0.00 0.00 55.73 54.95 3b4t s ARG 7 Cb 0.00 -2.61 0.03 0.00 0.52 0.00 0.00 34.95 32.89 3b4t s ARG 7 CO 0.00 0.10 0.97 -0.51 0.02 0.00 0.00 175.30 175.88 3b4t s LEU 8 N -4.25 3.03 0.52 2.53 1.43 -1.26 -2.49 118.68 118.18 3b4t s LEU 8 Ca 0.42 0.64 0.21 0.00 -1.03 0.00 0.00 54.13 54.37 3b4t s LEU 8 Cb -0.10 -3.39 1.37 0.00 0.03 0.00 0.00 46.19 44.10 3b4t s LEU 8 CO 0.37 -1.32 2.12 0.44 0.23 0.00 0.00 176.35 178.19 3b4t h ASP 9 N -0.40 0.00 -0.09 2.29 3.32 -1.97 -2.23 116.42 117.34 3b4t h ASP 9 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 3b4t h ASP 9 Cb 1.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.83 3b4t h ASP 9 CO 0.61 0.07 0.00 0.00 -1.72 0.00 0.00 179.24 178.20 3b4t n HIS 10 N -4.17 0.09 -3.08 4.55 1.44 -1.26 -2.18 115.22 110.60 3b4t n HIS 10 Ca -0.03 -0.04 -0.39 0.00 -2.01 0.00 0.00 57.72 55.25 3b4t n HIS 10 Cb 0.15 0.00 -0.05 0.00 0.12 0.00 0.00 29.99 30.21 3b4t n HIS 10 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 3b4t s GLU 11 N -1.91 4.41 0.45 -1.40 2.02 -0.84 -4.83 118.70 116.60 3b4t s GLU 11 Ca 0.30 0.90 -0.18 0.00 0.02 0.00 0.00 54.97 56.01 3b4t s GLU 11 Cb 0.21 -3.37 -0.09 0.00 0.10 0.00 0.00 34.13 30.97 3b4t s GLU 11 CO 0.30 0.27 0.92 -0.51 0.02 0.00 0.00 175.26 176.27 3b4t s LEU 12 N 0.07 3.83 0.85 1.80 1.43 -1.26 -4.74 118.68 120.65 3b4t s LEU 12 Ca 0.35 1.55 -0.10 0.00 -1.03 0.00 0.00 54.13 54.90 3b4t s LEU 12 Cb -0.19 -4.43 0.10 0.00 0.03 0.00 0.00 46.19 41.71 3b4t s LEU 12 CO 0.20 -0.43 1.12 -0.13 0.23 0.00 0.00 176.35 177.34 3b4t s ARG 13 N -3.55 1.59 -0.01 1.70 0.52 -1.26 -4.89 118.95 113.06 3b4t s ARG 13 Ca 0.59 1.35 -0.36 0.00 -0.52 0.00 0.00 55.73 56.79 3b4t s ARG 13 Cb -0.10 -1.81 -0.14 0.00 0.52 0.00 0.00 34.95 33.42 3b4t s ARG 13 CO 0.22 -2.17 1.63 -2.30 0.02 0.00 0.00 175.30 172.70 3b4t n PRO 14 N -3.90 1.72 -3.82 3.54 -0.02 -1.26 -4.55 135.00 126.71 3b4t n PRO 14 Ca 0.10 0.62 -0.35 0.00 -2.02 0.00 0.00 63.50 61.85 3b4t n PRO 14 Cb 0.53 -2.37 -0.09 0.00 -0.02 0.00 0.00 33.50 31.55 3b4t n PRO 14 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3b4t s VAL 15 N 2.13 5.09 -0.10 -1.45 1.01 -1.26 -1.68 120.40 124.14 3b4t s VAL 15 Ca 0.88 0.08 0.01 0.00 0.00 0.00 0.00 61.98 62.95 3b4t s VAL 15 Cb -0.83 -3.33 0.02 0.00 0.00 0.00 0.00 36.38 32.24 3b4t s VAL 15 CO 0.49 0.41 -0.13 -0.63 0.00 0.00 0.00 175.10 175.25 3b4t s ILE 16 N 0.64 1.31 -0.17 2.22 1.01 -0.80 -4.99 121.20 120.43 3b4t s ILE 16 Ca 0.06 -0.53 0.01 0.00 0.00 0.00 0.00 60.65 60.19 3b4t s ILE 16 Cb -0.12 -1.22 0.01 0.00 0.01 0.00 0.00 42.46 41.14 3b4t s ILE 16 CO 0.01 0.40 -0.19 -0.63 0.00 0.00 0.00 174.94 174.54 3b4t s ILE 17 N 1.09 2.21 -0.29 2.92 1.01 -1.26 -0.88 121.20 126.00 3b4t s ILE 17 Ca -0.05 -0.90 0.03 0.00 0.00 0.00 0.00 60.65 59.73 3b4t s ILE 17 Cb -0.14 -1.92 0.07 0.00 0.01 0.00 0.00 42.46 40.48 3b4t s ILE 17 CO -0.02 0.53 -0.05 -0.89 0.00 0.00 0.00 174.94 174.51 3b4t s THR 18 N 1.17 2.18 0.58 2.92 2.01 0.03 -4.95 115.64 119.58 3b4t s THR 18 Ca 0.02 -1.89 -0.15 0.00 0.31 0.00 0.00 61.69 59.98 3b4t s THR 18 Cb -0.14 -2.41 -0.05 0.00 0.01 0.00 0.00 72.50 69.91 3b4t s THR 18 CO -0.09 -0.25 1.02 -0.13 -0.69 0.00 0.00 174.62 174.49 3b4t s ARG 19 N 1.04 3.59 -1.44 4.92 0.52 -1.26 -1.24 118.95 125.08 3b4t s ARG 19 Ca -0.01 0.98 -0.09 0.00 -0.52 0.00 0.00 55.73 56.09 3b4t s ARG 19 Cb -0.20 -2.08 0.02 0.00 0.52 0.00 0.00 34.95 33.22 3b4t s ARG 19 CO -0.06 -0.57 0.99 0.41 0.02 0.00 0.00 175.30 176.08 3b4t n GLY 20 N -1.71 -0.53 0.20 -3.53 0.00 0.15 -4.91 105.19 94.86 3b4t n GLY 20 Ca 0.07 0.21 -0.08 0.00 0.00 0.00 0.00 46.02 46.22 3b4t n GLY 20 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3b4t h PHE 21 N -2.23 0.61 -1.98 1.61 3.57 -1.34 -3.43 116.94 113.76 3b4t h PHE 21 Ca -0.56 -0.02 -0.56 0.00 3.53 0.00 0.00 57.97 60.36 3b4t h PHE 21 Cb 1.37 -0.19 -0.09 0.00 2.79 0.00 0.00 35.95 39.82 3b4t h PHE 21 CO 0.53 0.48 -0.60 0.95 -2.23 0.00 0.00 178.31 177.44 3b4t s THR 22 N -5.80 2.98 -0.11 4.41 -4.23 -1.26 -5.08 115.64 106.55 3b4t s THR 22 Ca -0.13 -1.86 0.16 0.00 -1.18 0.00 0.00 61.69 58.68 3b4t s THR 22 Cb 0.11 -2.87 -0.23 0.00 1.34 0.00 0.00 72.50 70.85 3b4t s THR 22 CO 0.75 -0.24 0.18 -0.62 -0.54 0.00 0.00 174.62 174.15 3b4t n GLU 23 N -1.01 1.01 -0.10 3.99 1.02 -1.26 -4.61 120.64 119.68 3b4t n GLU 23 Ca -0.04 -0.07 -0.10 0.00 -0.02 0.00 0.00 57.16 56.93 3b4t n GLU 23 Cb 0.61 -1.43 -0.03 0.00 -0.02 0.00 0.00 31.44 30.58 3b4t n GLU 23 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 3b4t h ASN 24 N 0.00 0.45 -3.92 1.62 2.35 -1.98 -3.44 115.58 110.66 3b4t h ASN 24 Ca -0.28 -0.22 -0.49 0.00 -0.55 0.00 0.00 56.30 54.77 3b4t h ASN 24 Cb 1.58 -0.12 0.01 0.00 0.05 0.00 0.00 38.32 39.85 3b4t h ASN 24 CO 0.02 0.54 0.42 -2.84 -1.65 0.00 0.00 177.43 173.92 3b4t s PRO 25 N -5.36 4.29 0.32 0.81 0.02 -1.26 -4.93 135.00 128.89 3b4t s PRO 25 Ca -0.13 1.55 0.06 0.00 0.02 0.00 0.00 61.00 62.50 3b4t s PRO 25 Cb 0.09 -2.69 0.71 0.00 0.02 0.00 0.00 34.50 32.62 3b4t s PRO 25 CO 0.74 -0.03 1.83 0.00 -0.33 0.00 0.00 177.00 179.21 3b4t h ALA 26 N 2.82 1.69 -4.05 -1.55 0.00 -1.73 -3.39 119.26 113.04 3b4t h ALA 26 Ca -0.48 0.03 -0.56 0.00 0.00 0.00 0.00 54.91 53.91 3b4t h ALA 26 Cb 1.21 -0.14 -0.31 0.00 0.00 0.00 0.00 17.79 18.55 3b4t h ALA 26 CO 0.63 0.03 -0.84 0.20 0.00 0.00 0.00 179.25 179.28 3b4t s GLY 27 N -3.63 0.90 -0.27 0.00 0.00 -0.62 -4.17 107.32 99.54 3b4t s GLY 27 Ca -0.11 -0.72 0.00 0.00 0.00 0.00 0.00 44.72 43.90 3b4t s GLY 27 CO 0.80 -0.45 0.45 -0.45 0.00 0.00 0.00 173.10 173.44 3b4t s SER 28 N -0.12 -0.16 -0.11 1.64 0.15 -1.26 0.27 113.70 114.11 3b4t s SER 28 Ca -0.00 0.10 0.01 0.00 0.70 0.00 0.00 55.95 56.76 3b4t s SER 28 Cb -0.10 1.37 0.02 0.00 -1.71 0.00 0.00 66.02 65.60 3b4t s SER 28 CO 0.01 -0.31 -0.13 -0.69 1.20 0.00 0.00 173.24 173.32 3b4t s VAL 29 N 2.62 1.38 -0.27 4.45 1.01 0.45 0.33 120.40 130.37 3b4t s VAL 29 Ca 0.13 -0.55 -0.19 0.00 0.00 0.00 0.00 61.98 61.36 3b4t s VAL 29 Cb -0.14 -1.28 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 3b4t s VAL 29 CO -0.23 0.42 0.56 -0.22 0.00 0.00 0.00 175.10 175.63 3b4t s LEU 30 N 1.15 4.08 0.04 3.92 2.96 -0.37 0.02 118.68 130.48 3b4t s LEU 30 Ca -0.04 0.54 0.08 0.00 -0.22 0.00 0.00 54.13 54.50 3b4t s LEU 30 Cb -0.14 -2.74 -0.03 0.00 0.50 0.00 0.00 46.19 43.78 3b4t s LEU 30 CO -0.03 -0.34 -0.22 -0.51 -1.32 0.00 0.00 176.35 173.92 3b4t s ILE 31 N 2.41 2.47 -0.09 6.68 2.07 -0.51 -0.79 121.20 133.44 3b4t s ILE 31 Ca 0.23 -1.28 -0.01 0.00 -1.41 0.00 0.00 60.65 58.18 3b4t s ILE 31 Cb -0.15 -2.00 0.03 0.00 0.13 0.00 0.00 42.46 40.46 3b4t s ILE 31 CO 0.09 0.36 -0.04 -1.61 -1.91 0.00 0.00 174.94 171.83 3b4t s GLU 32 N -1.33 1.02 -0.68 3.50 2.02 -0.06 -1.17 118.70 122.00 3b4t s GLU 32 Ca 0.13 -0.07 -0.13 0.00 0.02 0.00 0.00 54.97 54.93 3b4t s GLU 32 Cb -0.10 -1.21 0.18 0.00 0.10 0.00 0.00 34.13 33.09 3b4t s GLU 32 CO 0.04 -0.26 0.60 -0.06 0.02 0.00 0.00 175.26 175.60 3b4t s PHE 33 N 1.74 3.55 0.00 1.61 0.40 -0.24 -1.90 117.98 123.14 3b4t s PHE 33 Ca 0.03 -1.89 0.00 0.00 -0.60 0.00 0.00 56.93 54.47 3b4t s PHE 33 Cb -0.13 -3.70 0.00 0.00 0.51 0.00 0.00 43.02 39.71 3b4t s PHE 33 CO -0.06 -0.98 0.00 0.41 0.70 0.00 0.00 175.22 175.29 3b4t n GLY 34 N 4.36 4.01 0.04 4.36 0.00 -0.68 -1.74 105.19 115.54 3b4t n GLY 34 Ca 0.03 0.03 0.13 0.00 0.00 0.00 0.00 46.02 46.22 3b4t n GLY 34 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3b4t n HIS 35 N 14.00 0.34 -2.40 1.61 8.25 -1.26 -4.75 115.22 131.00 3b4t n HIS 35 Ca 0.00 0.10 -0.43 0.00 -0.26 0.00 0.00 57.72 57.13 3b4t n HIS 35 Cb 0.00 -0.64 -0.02 0.00 1.12 0.00 0.00 29.99 30.45 3b4t n HIS 35 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3b4t s THR 36 N -3.04 4.17 -0.08 1.59 2.01 -0.71 -4.62 115.64 114.95 3b4t s THR 36 Ca 0.12 1.47 0.03 0.00 0.31 0.00 0.00 61.69 63.63 3b4t s THR 36 Cb 0.16 -3.95 0.01 0.00 0.01 0.00 0.00 72.50 68.73 3b4t s THR 36 CO 0.57 -0.06 -0.18 -0.54 -0.69 0.00 0.00 174.62 173.72 3b4t s LYS 37 N 2.80 2.38 -0.03 4.92 1.02 -0.09 -1.08 119.74 129.66 3b4t s LYS 37 Ca 0.57 -0.66 0.00 0.00 0.02 0.00 0.00 55.97 55.90 3b4t s LYS 37 Cb -0.25 -1.86 0.03 0.00 -0.52 0.00 0.00 37.83 35.23 3b4t s LYS 37 CO 0.20 0.12 -0.00 0.08 -0.92 0.00 0.00 175.35 174.83 3b4t s VAL 38 N 0.45 0.22 -0.31 3.17 1.01 -0.31 -0.67 120.40 123.96 3b4t s VAL 38 Ca -0.16 0.07 -0.19 0.00 0.00 0.00 0.00 61.98 61.70 3b4t s VAL 38 Cb -0.17 -0.31 -0.01 0.00 0.00 0.00 0.00 36.38 35.89 3b4t s VAL 38 CO 0.06 0.16 0.58 -0.22 0.00 0.00 0.00 175.10 175.68 3b4t s LEU 39 N 1.07 4.18 -0.27 3.92 2.96 -0.47 -1.43 118.68 128.63 3b4t s LEU 39 Ca -0.09 0.32 -0.03 0.00 -0.22 0.00 0.00 54.13 54.11 3b4t s LEU 39 Cb -0.14 -2.73 0.03 0.00 0.50 0.00 0.00 46.19 43.85 3b4t s LEU 39 CO -0.02 -0.45 -0.02 0.00 -1.32 0.00 0.00 176.35 174.55 3b4t s THR 41 N 1.35 3.06 -0.24 0.00 -4.23 0.54 -0.41 115.64 115.70 3b4t s THR 41 Ca -0.01 -1.59 -0.00 0.00 -1.18 0.00 0.00 61.69 58.92 3b4t s THR 41 Cb -0.17 -2.47 0.07 0.00 1.34 0.00 0.00 72.50 71.26 3b4t s THR 41 CO -0.02 -0.02 -0.01 0.00 -0.54 0.00 0.00 174.62 174.03 3b4t s ALA 42 N -1.47 1.75 -0.22 3.99 0.00 0.14 -1.11 121.76 124.84 3b4t s ALA 42 Ca 0.22 -1.32 -0.09 0.00 0.00 0.00 0.00 51.96 50.77 3b4t s ALA 42 Cb -0.10 -1.43 -0.04 0.00 0.00 0.00 0.00 23.12 21.55 3b4t s ALA 42 CO 0.13 -1.28 0.10 -1.12 0.00 0.00 0.00 175.76 173.59 3b4t s SER 43 N 1.50 5.71 -0.08 0.00 0.01 0.08 -1.58 113.70 119.33 3b4t s SER 43 Ca -0.02 0.03 -0.20 0.00 1.31 0.00 0.00 55.95 57.07 3b4t s SER 43 Cb -0.18 -2.01 -0.04 0.00 0.21 0.00 0.00 66.02 63.99 3b4t s SER 43 CO -0.09 0.09 0.56 -0.69 0.41 0.00 0.00 173.24 173.51 3b4t s VAL 44 N 0.92 5.10 0.01 3.43 1.01 -1.26 -0.72 120.40 128.89 3b4t s VAL 44 Ca 0.05 1.13 0.05 0.00 0.00 0.00 0.00 61.98 63.22 3b4t s VAL 44 Cb -0.13 -3.89 -0.02 0.00 0.00 0.00 0.00 36.38 32.33 3b4t s VAL 44 CO 0.03 0.33 -0.15 -0.89 0.00 0.00 0.00 175.10 174.42 3b4t s THR 45 N 0.48 1.16 0.08 3.92 2.01 0.16 -5.00 115.64 118.46 3b4t s THR 45 Ca 0.30 -0.82 -0.21 0.00 0.31 0.00 0.00 61.69 61.27 3b4t s THR 45 Cb -0.16 -1.01 -0.07 0.00 0.01 0.00 0.00 72.50 71.27 3b4t s THR 45 CO 0.14 0.18 0.61 -0.70 -0.69 0.00 0.00 174.62 174.16 3b4t s GLU 46 N -0.74 4.28 0.17 4.92 2.12 -1.26 0.94 118.70 129.14 3b4t s GLU 46 Ca 0.04 0.82 0.00 0.00 0.36 0.00 0.00 54.97 56.19 3b4t s GLU 46 Cb -0.07 -3.25 0.00 0.00 0.26 0.00 0.00 34.13 31.07 3b4t s GLU 46 CO 0.00 0.60 0.00 0.41 -0.54 0.00 0.00 175.26 175.73 3b4t n GLY 47 N 1.76 -1.82 3.30 -1.50 0.00 0.13 -4.78 105.19 102.28 3b4t n GLY 47 Ca -0.09 -1.96 -0.14 0.00 0.00 0.00 0.00 46.02 43.83 3b4t n GLY 47 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b4t s VAL 48 N 0.00 0.04 0.00 1.61 1.01 -1.26 -2.99 120.40 118.81 3b4t s VAL 48 Ca 0.00 -0.35 -0.00 0.00 0.00 0.00 0.00 61.98 61.62 3b4t s VAL 48 Cb 0.00 -0.69 -0.00 0.00 0.00 0.00 0.00 36.38 35.69 3b4t s VAL 48 CO 0.00 -0.19 1.01 -0.65 0.00 0.00 0.00 175.10 175.26 3b4t h PRO 49 N 3.76 -0.01 0.00 2.72 0.11 -1.98 -3.41 132.00 133.19 3b4t h PRO 49 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 3b4t h PRO 49 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3b4t h PRO 49 CO 0.39 -0.01 -0.25 0.54 -0.21 0.00 0.00 178.00 178.47 3b4t n ARG 50 N -2.27 3.26 0.00 1.05 1.74 -1.26 -5.28 116.66 113.90 3b4t n ARG 50 Ca -0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3b4t n ARG 50 Cb 0.00 -0.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.94 3b4t n ARG 50 CO 0.00 0.00 0.00 1.87 -1.52 0.00 0.00 177.63 177.98 3b4t n TRP 51 N -0.54 0.00 -1.37 -1.55 -0.00 -1.26 -5.30 117.44 107.42 3b4t n TRP 51 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 3b4t n TRP 51 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.31 3b4t n TRP 51 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 3b4t n LEU 57 N 0.00 -1.13 0.00 5.87 4.77 -1.26 -5.11 117.00 120.14 3b4t n LEU 57 Ca 0.00 1.68 -0.21 0.00 -0.03 0.00 0.00 56.01 57.45 3b4t n LEU 57 Cb 0.00 -2.47 0.14 0.00 -2.33 0.00 0.00 43.42 38.76 3b4t n LEU 57 CO 0.00 0.02 0.60 0.61 -1.33 0.00 0.00 177.39 177.29 3b4t n GLY 58 N -1.41 -0.69 3.06 -0.72 0.00 0.53 -4.70 105.19 101.27 3b4t n GLY 58 Ca 0.00 -1.81 -0.08 0.00 0.00 0.00 0.00 46.02 44.13 3b4t n GLY 58 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3b4t s TRP 59 N -2.95 0.45 -0.05 1.61 -0.00 -0.97 -4.84 118.94 112.19 3b4t s TRP 59 Ca 0.56 -0.89 0.01 0.00 -0.00 0.00 0.00 56.10 55.78 3b4t s TRP 59 Cb -0.02 -0.33 0.02 0.00 -0.00 0.00 0.00 33.47 33.14 3b4t s TRP 59 CO 0.39 -0.31 -0.03 -1.17 -0.00 0.00 0.00 176.95 175.83 3b4t s LEU 60 N -2.44 1.18 0.19 5.86 0.20 -1.26 -0.99 118.68 121.42 3b4t s LEU 60 Ca -0.00 -0.10 0.09 0.00 0.69 0.00 0.00 54.13 54.81 3b4t s LEU 60 Cb 0.02 -0.40 -0.04 0.00 -0.43 0.00 0.00 46.19 45.34 3b4t s LEU 60 CO -0.07 -0.09 -0.08 0.42 -0.29 0.00 0.00 176.35 176.24 3b4t s THR 61 N 1.10 3.23 -0.01 3.68 -4.23 -0.64 -4.99 115.64 113.79 3b4t s THR 61 Ca -0.08 -1.67 0.02 0.00 -1.18 0.00 0.00 61.69 58.77 3b4t s THR 61 Cb -0.14 -2.61 -0.00 0.00 1.34 0.00 0.00 72.50 71.09 3b4t s THR 61 CO -0.01 -0.13 -0.05 0.00 -0.54 0.00 0.00 174.62 173.89 3b4t s ALA 62 N -1.76 0.43 -0.02 3.99 0.00 -1.26 0.18 121.76 123.33 3b4t s ALA 62 Ca 0.26 -0.21 0.01 0.00 0.00 0.00 0.00 51.96 52.02 3b4t s ALA 62 Cb -0.09 -0.12 0.01 0.00 0.00 0.00 0.00 23.12 22.92 3b4t s ALA 62 CO 0.16 0.10 -0.02 -1.21 0.00 0.00 0.00 175.76 174.78 3b4t s GLU 63 N -0.06 0.35 0.04 0.00 2.02 -0.20 -4.64 118.70 116.20 3b4t s GLU 63 Ca 0.01 -0.04 0.09 0.00 0.02 0.00 0.00 54.97 55.05 3b4t s GLU 63 Cb -0.03 -0.42 -0.03 0.00 0.10 0.00 0.00 34.13 33.76 3b4t s GLU 63 CO -0.00 -0.02 -0.25 -0.47 0.02 0.00 0.00 175.26 174.53 3b4t s TYR 64 N 0.47 2.37 0.07 1.61 5.04 -1.26 -0.77 117.35 124.87 3b4t s TYR 64 Ca -0.05 -0.39 -0.25 0.00 -2.44 0.00 0.00 57.07 53.95 3b4t s TYR 64 Cb -0.08 -1.41 0.07 0.00 0.35 0.00 0.00 41.96 40.88 3b4t s TYR 64 CO -0.01 0.14 0.60 0.00 -1.34 0.00 0.00 175.55 174.94 3b4t s ALA 65 N -0.81 -1.57 -0.10 3.97 0.00 -0.50 -4.83 121.76 117.92 3b4t s ALA 65 Ca 0.12 0.74 0.04 0.00 0.00 0.00 0.00 51.96 52.86 3b4t s ALA 65 Cb -0.10 0.51 -0.00 0.00 0.00 0.00 0.00 23.12 23.53 3b4t s ALA 65 CO 0.02 -0.59 -0.23 -1.64 0.00 0.00 0.00 175.76 173.33 3b4t s MET 66 N -2.72 2.99 0.43 0.00 1.00 -1.26 -0.55 119.30 119.20 3b4t s MET 66 Ca -0.04 -0.85 -0.26 0.00 0.00 0.00 0.00 55.69 54.54 3b4t s MET 66 Cb -0.01 -2.32 -0.09 0.00 0.00 0.00 0.00 34.83 32.42 3b4t s MET 66 CO -0.04 0.23 1.43 -0.51 0.00 0.00 0.00 175.02 176.14 3b4t s LEU 67 N 0.23 4.16 0.35 -0.03 1.43 -0.78 -4.88 118.68 119.16 3b4t s LEU 67 Ca -0.14 2.93 0.13 0.00 -1.03 0.00 0.00 54.13 56.02 3b4t s LEU 67 Cb -0.17 -3.88 0.97 0.00 0.03 0.00 0.00 46.19 43.14 3b4t s LEU 67 CO 0.07 -1.10 1.75 -0.65 0.23 0.00 0.00 176.35 176.66 3b4t h PRO 68 N 2.48 0.50 -0.18 1.29 0.11 -1.91 0.52 132.00 134.82 3b4t h PRO 68 Ca -0.51 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.57 3b4t h PRO 68 Cb 1.26 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3b4t h PRO 68 CO 0.62 0.33 0.00 -1.13 -0.21 0.00 0.00 178.00 177.61 3b4t n SER 69 N -4.77 1.76 0.16 -2.05 3.41 -1.26 -1.16 113.62 109.70 3b4t n SER 69 Ca 0.26 -1.73 0.02 0.00 -0.26 0.00 0.00 58.87 57.17 3b4t n SER 69 Cb 0.79 -0.11 0.38 0.00 -0.26 0.00 0.00 64.21 65.00 3b4t n SER 69 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3b4t h ALA 70 N 4.07 1.45 -2.20 7.33 0.00 -1.03 -3.44 119.26 125.44 3b4t h ALA 70 Ca 0.00 -0.27 -0.47 0.00 0.00 0.00 0.00 54.91 54.17 3b4t h ALA 70 Cb 0.51 -0.07 0.05 0.00 0.00 0.00 0.00 17.79 18.28 3b4t h ALA 70 CO 0.00 0.40 0.08 0.95 0.00 0.00 0.00 179.25 180.68 3b4t s THR 71 N -4.46 3.74 0.11 0.00 -4.23 -1.26 -0.47 115.64 109.07 3b4t s THR 71 Ca -0.04 -0.17 -0.23 0.00 -1.18 0.00 0.00 61.69 60.06 3b4t s THR 71 Cb 0.15 -3.45 -0.07 0.00 1.34 0.00 0.00 72.50 70.47 3b4t s THR 71 CO 0.73 -0.41 1.69 0.45 -0.54 0.00 0.00 174.62 176.54 3b4t h HIS 72 N 0.01 -0.27 -3.31 3.99 3.86 -1.85 -3.38 115.15 114.20 3b4t h HIS 72 Ca -0.46 0.01 -0.60 0.00 -1.16 0.00 0.00 60.37 58.16 3b4t h HIS 72 Cb 1.26 0.13 -0.12 0.00 1.06 0.00 0.00 27.41 29.73 3b4t h HIS 72 CO 0.46 -0.16 -0.49 -1.12 0.86 0.00 0.00 177.93 177.48 3b4t s SER 73 N -5.06 6.20 0.18 2.45 0.01 -1.26 -5.05 113.70 111.17 3b4t s SER 73 Ca -0.14 0.22 -0.33 0.00 1.31 0.00 0.00 55.95 57.01 3b4t s SER 73 Cb 0.08 -2.09 -0.14 0.00 0.21 0.00 0.00 66.02 64.08 3b4t s SER 73 CO 0.67 0.16 1.43 -1.14 0.41 0.00 0.00 173.24 174.77 3b4t n ARG 74 N 3.62 1.82 -4.10 12.44 0.63 -1.26 -4.96 116.66 124.84 3b4t n ARG 74 Ca -0.16 0.65 -0.24 0.00 -0.92 0.00 0.00 57.85 57.19 3b4t n ARG 74 Cb 0.52 -2.33 -0.05 0.00 0.45 0.00 0.00 32.46 31.05 3b4t n ARG 74 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 3b4t s SER 75 N 0.51 5.54 0.28 6.15 1.04 -0.31 -5.02 113.70 121.89 3b4t s SER 75 Ca 0.75 -0.19 -0.29 0.00 0.48 0.00 0.00 55.95 56.70 3b4t s SER 75 Cb -0.74 -1.43 -0.10 0.00 0.10 0.00 0.00 66.02 63.85 3b4t s SER 75 CO 0.45 0.01 1.27 -1.81 0.98 0.00 0.00 173.24 174.13 3b4t s ASP 76 N -3.53 6.91 0.10 7.02 1.01 -1.26 -4.52 116.67 122.41 3b4t s ASP 76 Ca 0.32 2.51 -0.31 0.00 0.71 0.00 0.00 52.55 55.78 3b4t s ASP 76 Cb -0.09 -2.63 -0.08 0.00 1.01 0.00 0.00 42.92 41.13 3b4t s ASP 76 CO 0.24 -0.45 1.51 -0.60 0.21 0.00 0.00 175.17 176.08 3b4t s ARG 77 N -1.14 4.25 0.32 8.23 3.52 -1.26 -4.92 118.95 127.96 3b4t s ARG 77 Ca 0.51 2.20 0.00 0.00 -0.13 0.00 0.00 55.73 58.31 3b4t s ARG 77 Cb -0.37 -3.35 0.52 0.00 -1.56 0.00 0.00 34.95 30.19 3b4t s ARG 77 CO 0.45 -0.58 1.95 0.93 -0.81 0.00 0.00 175.30 177.24 3b4t h GLU 78 N 7.31 0.89 -0.04 5.12 5.08 -1.93 -0.16 114.58 130.84 3b4t h GLU 78 Ca -0.42 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 57.83 3b4t h GLU 78 Cb 1.20 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.26 3b4t h GLU 78 CO 0.90 0.65 -0.10 0.66 -1.00 0.00 0.00 179.01 180.11 3b4t h SER 79 N 0.90 0.05 0.37 1.42 4.64 -1.91 -0.29 113.55 118.73 3b4t h SER 79 Ca 0.23 -0.01 -0.32 0.00 -0.47 0.00 0.00 61.79 61.22 3b4t h SER 79 Cb 0.01 -0.01 0.02 0.00 -0.31 0.00 0.00 62.40 62.10 3b4t h SER 79 CO -0.04 0.17 -1.49 0.58 -0.87 0.00 0.00 176.83 175.18 3b4t h VAL 80 N 0.06 1.25 -0.73 0.95 2.07 -1.60 -3.26 116.25 114.99 3b4t h VAL 80 Ca 0.01 -2.77 0.05 0.00 0.82 0.00 0.00 66.70 64.81 3b4t h VAL 80 Cb 0.22 2.92 -0.05 0.00 -1.52 0.00 0.00 31.29 32.86 3b4t h VAL 80 CO 0.01 0.84 0.43 0.03 0.02 0.00 0.00 177.57 178.91 3b4t h ARG 81 N 0.11 0.79 0.00 1.57 3.08 -0.68 -3.47 114.38 115.77 3b4t h ARG 81 Ca -0.24 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.76 3b4t h ARG 81 Cb 2.08 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 31.96 3b4t h ARG 81 CO 0.22 0.52 0.00 0.41 -1.07 0.00 0.00 179.97 180.05 3b4t n GLY 82 N -1.30 1.10 3.54 0.04 0.00 -0.15 -5.09 105.19 103.33 3b4t n GLY 82 Ca 0.09 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.99 3b4t n GLY 82 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3b4t s ARG 83 N -0.79 0.79 0.45 1.61 1.70 -1.08 -5.04 118.95 116.60 3b4t s ARG 83 Ca 0.00 0.03 -0.22 0.00 -0.47 0.00 0.00 55.73 55.07 3b4t s ARG 83 Cb 0.00 0.37 -0.08 0.00 -0.57 0.00 0.00 34.95 34.67 3b4t s ARG 83 CO 0.00 -0.28 1.06 -0.51 -1.08 0.00 0.00 175.30 174.49 3b4t s LEU 84 N -1.55 3.97 0.37 -1.89 1.43 -1.26 -4.70 118.68 115.05 3b4t s LEU 84 Ca -0.02 2.03 -0.15 0.00 -1.03 0.00 0.00 54.13 54.96 3b4t s LEU 84 Cb -0.01 -4.38 -0.08 0.00 0.03 0.00 0.00 46.19 41.75 3b4t s LEU 84 CO 0.00 -0.72 0.79 -0.94 0.23 0.00 0.00 176.35 175.71 3b4t s SER 85 N -1.74 6.72 0.29 2.29 1.04 -1.26 -4.98 113.70 116.07 3b4t s SER 85 Ca 0.64 1.32 0.00 0.00 0.48 0.00 0.00 55.95 58.38 3b4t s SER 85 Cb -0.20 -2.39 0.51 0.00 0.10 0.00 0.00 66.02 64.03 3b4t s SER 85 CO 0.25 -0.30 1.90 1.23 0.98 0.00 0.00 173.24 177.29 3b4t h GLY 86 N 1.85 1.39 0.70 7.32 0.00 -2.00 -1.35 103.07 110.98 3b4t h GLY 86 Ca -0.48 -0.43 0.06 0.00 0.00 0.00 0.00 47.33 46.48 3b4t h GLY 86 CO 0.64 0.30 0.40 -0.09 0.00 0.00 0.00 176.54 177.79 3b4t h ARG 87 N 1.06 0.71 -0.02 4.80 2.43 -1.99 -0.54 114.38 120.84 3b4t h ARG 87 Ca 0.41 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.54 3b4t h ARG 87 Cb 0.22 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.61 3b4t h ARG 87 CO -0.16 0.47 0.01 1.15 -1.51 0.00 0.00 179.97 179.93 3b4t h THR 88 N 0.74 1.05 -0.41 0.20 2.02 -1.61 -1.18 112.91 113.72 3b4t h THR 88 Ca 0.31 -0.15 -0.11 0.00 0.77 0.00 0.00 66.41 67.22 3b4t h THR 88 Cb 0.17 1.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.69 3b4t h THR 88 CO -0.17 0.04 -0.19 1.56 0.37 0.00 0.00 175.52 177.13 3b4t h GLN 89 N -0.04 0.79 -0.05 6.66 4.20 -1.27 0.45 115.11 125.85 3b4t h GLN 89 Ca 0.01 -0.30 0.03 0.00 0.06 0.00 0.00 58.65 58.44 3b4t h GLN 89 Cb 0.06 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.76 3b4t h GLN 89 CO -0.00 0.92 -0.12 1.49 -0.67 0.00 0.00 178.83 180.45 3b4t h GLU 90 N 0.70 -0.17 -0.46 1.46 4.81 -0.93 -1.96 114.58 118.03 3b4t h GLU 90 Ca 0.10 0.01 -0.14 0.00 -0.13 0.00 0.00 59.36 59.20 3b4t h GLU 90 Cb 0.69 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.10 3b4t h GLU 90 CO 0.05 -0.11 -0.26 0.82 -0.73 0.00 0.00 179.01 178.78 3b4t h ILE 91 N -0.18 1.27 -0.74 2.32 2.04 -0.99 -2.44 117.51 118.79 3b4t h ILE 91 Ca 0.06 -1.43 0.06 0.00 1.00 0.00 0.00 64.86 64.55 3b4t h ILE 91 Cb 0.26 1.18 -0.06 0.00 -0.74 0.00 0.00 36.82 37.46 3b4t h ILE 91 CO -0.15 0.49 0.44 0.28 0.00 0.00 0.00 178.15 179.21 3b4t h SER 92 N 0.84 0.67 -0.32 1.72 0.02 -0.81 -1.54 113.55 114.12 3b4t h SER 92 Ca 0.10 0.02 -0.18 0.00 -0.84 0.00 0.00 61.79 60.90 3b4t h SER 92 Cb 0.84 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 63.27 3b4t h SER 92 CO 0.07 0.43 -0.49 0.03 -1.14 0.00 0.00 176.83 175.73 3b4t h ARG 93 N 0.80 0.90 -0.75 3.45 3.08 -1.27 -2.51 114.38 118.09 3b4t h ARG 93 Ca 0.33 -0.54 0.05 0.00 0.07 0.00 0.00 59.98 59.90 3b4t h ARG 93 Cb 0.18 0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.23 3b4t h ARG 93 CO -0.18 1.18 0.45 1.25 -1.07 0.00 0.00 179.97 181.60 3b4t h LEU 94 N 0.71 0.71 -0.55 3.04 5.85 -1.08 -1.60 115.31 122.38 3b4t h LEU 94 Ca 0.03 0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.71 3b4t h LEU 94 Cb 1.09 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 3b4t h LEU 94 CO 0.11 0.46 0.11 0.40 -0.34 0.00 0.00 178.44 179.19 3b4t h ILE 95 N 0.84 1.25 -0.29 4.05 2.04 -1.18 -2.06 117.51 122.16 3b4t h ILE 95 Ca 0.32 -0.92 -0.01 0.00 1.00 0.00 0.00 64.86 65.25 3b4t h ILE 95 Cb 0.14 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 3b4t h ILE 95 CO -0.16 0.34 0.14 1.23 0.00 0.00 0.00 178.15 179.70 3b4t h GLY 96 N 0.79 0.44 1.00 5.37 0.00 -1.04 -2.32 103.07 107.31 3b4t h GLY 96 Ca 0.17 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.28 3b4t h GLY 96 CO 0.01 0.20 0.39 3.21 0.00 0.00 0.00 176.54 180.35 3b4t h ARG 97 N 0.33 0.92 -0.39 4.80 3.08 -1.25 -2.51 114.38 119.37 3b4t h ARG 97 Ca 0.10 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 3b4t h ARG 97 Cb 0.11 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 3b4t h ARG 97 CO -0.01 0.67 0.19 0.77 -1.07 0.00 0.00 179.97 180.52 3b4t h SER 98 N 0.92 0.50 0.30 7.04 0.02 -1.17 -2.63 113.55 118.53 3b4t h SER 98 Ca 0.24 -0.12 -0.21 0.00 -0.84 0.00 0.00 61.79 60.86 3b4t h SER 98 Cb 0.00 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 62.41 3b4t h SER 98 CO -0.04 0.48 -0.84 -0.07 -1.14 0.00 0.00 176.83 175.22 3b4t h LEU 99 N 0.49 0.51 -1.51 5.07 3.38 -1.39 -3.08 115.31 118.77 3b4t h LEU 99 Ca 0.13 -0.37 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 3b4t h LEU 99 Cb 0.11 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 3b4t h LEU 99 CO -0.02 1.15 -0.13 0.03 0.09 0.00 0.00 178.44 179.56 3b4t h ARG 100 N 0.26 0.00 0.00 1.13 3.08 -1.38 -2.98 114.38 114.48 3b4t h ARG 100 Ca -0.06 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.96 3b4t h ARG 100 Cb 1.45 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.49 3b4t h ARG 100 CO 0.14 0.13 -0.17 0.00 -1.07 0.00 0.00 179.97 179.00 3b4t h ALA 101 N 1.87 1.42 -0.20 0.04 0.00 -1.37 -2.97 119.26 118.05 3b4t h ALA 101 Ca -0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 3b4t h ALA 101 Cb 0.54 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 3b4t h ALA 101 CO 0.02 0.21 -0.01 0.00 0.00 0.00 0.00 179.25 179.47 3b4t s ILE 103 N -2.87 0.82 -0.63 0.00 2.07 -1.12 -0.89 121.20 118.58 3b4t s ILE 103 Ca 0.40 -0.37 -0.22 0.00 -1.41 0.00 0.00 60.65 59.05 3b4t s ILE 103 Cb 0.33 -0.73 0.07 0.00 0.13 0.00 0.00 42.46 42.25 3b4t s ILE 103 CO 0.07 0.26 0.92 -0.62 -1.91 0.00 0.00 174.94 173.66 3b4t s ASP 104 N 0.26 6.21 0.46 4.50 2.15 0.18 -4.89 116.67 125.53 3b4t s ASP 104 Ca -0.04 -0.89 0.31 0.00 0.43 0.00 0.00 52.55 52.36 3b4t s ASP 104 Cb -0.09 -2.41 1.42 0.00 -0.30 0.00 0.00 42.92 41.53 3b4t s ASP 104 CO 0.01 -1.35 1.94 -0.07 -0.17 0.00 0.00 175.17 175.52 3b4t h LEU 105 N 11.10 0.00 -0.10 -1.34 3.38 -1.88 -1.41 115.31 125.06 3b4t h LEU 105 Ca -0.28 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.61 3b4t h LEU 105 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 3b4t h LEU 105 CO 1.15 0.00 -0.24 0.00 0.09 0.00 0.00 178.44 179.43 3b4t h ALA 106 N 2.08 0.16 0.00 1.53 0.00 -1.89 0.19 119.26 121.33 3b4t h ALA 106 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3b4t h ALA 106 Cb 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3b4t h ALA 106 CO 0.00 0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.39 3b4t n ALA 107 N -2.47 1.66 0.72 0.00 0.00 -0.58 -2.21 120.51 117.62 3b4t n ALA 107 Ca -0.07 -0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.43 3b4t n ALA 107 Cb 0.44 -1.22 0.12 0.00 0.00 0.00 0.00 19.45 18.80 3b4t n ALA 107 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3b4t n LEU 108 N -1.44 0.62 0.00 0.00 7.94 -0.89 -1.45 117.00 121.79 3b4t n LEU 108 Ca 0.04 0.03 0.00 0.00 -1.11 0.00 0.00 56.01 54.97 3b4t n LEU 108 Cb 0.14 -0.16 0.00 0.00 0.53 0.00 0.00 43.42 43.93 3b4t n LEU 108 CO 0.12 0.05 0.00 0.61 -1.11 0.00 0.00 177.39 177.06 3b4t n GLY 109 N 1.41 -1.64 2.55 -3.96 0.00 -0.94 -4.13 105.19 98.47 3b4t n GLY 109 Ca 0.03 -1.32 -0.30 0.00 0.00 0.00 0.00 46.02 44.43 3b4t n GLY 109 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3b4t n GLU 110 N -0.16 2.66 -4.26 1.61 1.02 -1.26 -0.35 120.64 119.90 3b4t n GLU 110 Ca 0.00 -2.61 -0.28 0.00 -0.02 0.00 0.00 57.16 54.24 3b4t n GLU 110 Cb 0.00 -2.20 -0.10 0.00 -0.02 0.00 0.00 31.44 29.12 3b4t n GLU 110 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 3b4t s ASN 111 N 0.15 4.28 -0.15 1.62 0.02 -1.25 -0.70 114.94 118.91 3b4t s ASN 111 Ca 0.57 -0.48 -0.01 0.00 -1.02 0.00 0.00 52.86 51.92 3b4t s ASN 111 Cb 0.37 -0.76 -0.02 0.00 0.02 0.00 0.00 41.25 40.87 3b4t s ASN 111 CO -0.24 0.15 -0.11 -0.89 0.02 0.00 0.00 177.10 176.03 3b4t s THR 112 N -1.40 3.21 -0.29 1.60 2.01 0.27 -2.30 115.64 118.74 3b4t s THR 112 Ca 0.22 -0.60 -0.06 0.00 0.31 0.00 0.00 61.69 61.56 3b4t s THR 112 Cb -0.10 -2.37 0.01 0.00 0.01 0.00 0.00 72.50 70.04 3b4t s THR 112 CO 0.14 0.51 0.07 -0.63 -0.69 0.00 0.00 174.62 174.01 3b4t s ILE 113 N 0.52 3.91 -0.30 1.82 1.01 -0.16 0.38 121.20 128.38 3b4t s ILE 113 Ca -0.07 -0.68 -0.13 0.00 0.00 0.00 0.00 60.65 59.77 3b4t s ILE 113 Cb -0.15 -3.00 -0.04 0.00 0.01 0.00 0.00 42.46 39.28 3b4t s ILE 113 CO 0.04 0.11 0.27 0.00 0.00 0.00 0.00 174.94 175.35 3b4t s ALA 114 N 1.50 3.53 -0.17 9.38 0.00 0.10 -1.61 121.76 134.48 3b4t s ALA 114 Ca 0.03 -1.09 -0.12 0.00 0.00 0.00 0.00 51.96 50.77 3b4t s ALA 114 Cb -0.17 -2.61 -0.05 0.00 0.00 0.00 0.00 23.12 20.29 3b4t s ALA 114 CO 0.02 -0.72 0.23 0.42 0.00 0.00 0.00 175.76 175.70 3b4t s ILE 115 N 1.86 5.35 -0.11 0.00 -1.09 0.13 -0.75 121.20 126.59 3b4t s ILE 115 Ca 0.09 0.40 0.01 0.00 -2.23 0.00 0.00 60.65 58.93 3b4t s ILE 115 Cb -0.16 -3.56 0.02 0.00 -1.58 0.00 0.00 42.46 37.17 3b4t s ILE 115 CO 0.11 0.42 -0.14 -1.81 -1.23 0.00 0.00 174.94 172.29 3b4t s ASP 116 N 0.31 2.42 -0.30 3.58 1.01 -0.27 -1.03 116.67 122.39 3b4t s ASP 116 Ca 0.13 -0.42 0.03 0.00 0.71 0.00 0.00 52.55 53.01 3b4t s ASP 116 Cb -0.12 -1.06 0.08 0.00 1.01 0.00 0.00 42.92 42.82 3b4t s ASP 116 CO 0.02 -0.01 -0.03 0.00 0.21 0.00 0.00 175.17 175.35 3b4t s ASP 118 N 1.01 5.04 -0.13 0.00 1.11 -0.25 -1.41 116.67 122.05 3b4t s ASP 118 Ca 0.01 -0.93 -0.29 0.00 0.18 0.00 0.00 52.55 51.51 3b4t s ASP 118 Cb -0.20 -1.83 -0.03 0.00 1.07 0.00 0.00 42.92 41.94 3b4t s ASP 118 CO -0.06 -0.23 1.45 -0.69 1.18 0.00 0.00 175.17 176.81 3b4t s VAL 119 N 1.42 3.95 -0.04 -1.27 1.01 0.29 -1.37 120.40 124.38 3b4t s VAL 119 Ca -0.00 1.14 -0.00 0.00 0.00 0.00 0.00 61.98 63.11 3b4t s VAL 119 Cb -0.18 -3.76 -0.26 0.00 0.00 0.00 0.00 36.38 32.18 3b4t s VAL 119 CO 0.01 -0.13 0.67 -0.07 0.00 0.00 0.00 175.10 175.58 3b4t h LEU 120 N 10.10 0.31 -7.36 3.92 3.38 -1.23 -2.06 115.31 122.36 3b4t h LEU 120 Ca -0.32 -0.54 -0.20 0.00 0.09 0.00 0.00 57.88 56.91 3b4t h LEU 120 Cb 1.14 -0.10 -0.30 0.00 0.09 0.00 0.00 40.66 41.49 3b4t h LEU 120 CO 0.97 1.47 -0.49 -1.58 0.09 0.00 0.00 178.44 178.89 3b4t s GLN 121 N -2.60 0.20 -0.20 1.13 0.74 -1.00 -4.06 119.66 113.88 3b4t s GLN 121 Ca -0.12 0.51 -0.03 0.00 0.05 0.00 0.00 55.36 55.77 3b4t s GLN 121 Cb 0.07 -0.12 -0.01 0.00 1.10 0.00 0.00 33.01 34.04 3b4t s GLN 121 CO 0.82 -0.16 -0.05 0.00 -0.55 0.00 0.00 175.29 175.35 3b4t s ALA 122 N 1.24 2.83 -0.31 1.58 0.00 0.38 -0.91 121.76 126.57 3b4t s ALA 122 Ca -0.09 -1.07 0.18 0.00 0.00 0.00 0.00 51.96 50.98 3b4t s ALA 122 Cb -0.10 -1.62 0.46 0.00 0.00 0.00 0.00 23.12 21.86 3b4t s ALA 122 CO -0.08 -0.22 1.12 -3.47 0.00 0.00 0.00 175.76 173.10 3b4t n ASP 123 N 4.40 0.72 0.00 0.00 2.03 -1.26 -4.69 116.55 117.76 3b4t n ASP 123 Ca -0.18 -2.40 0.00 0.00 0.52 0.00 0.00 54.79 52.73 3b4t n ASP 123 Cb 0.51 -0.18 0.00 0.00 -0.72 0.00 0.00 41.12 40.74 3b4t n ASP 123 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3b4t n GLY 124 N -0.47 -0.99 2.38 0.27 0.00 -1.26 -2.19 105.19 102.93 3b4t n GLY 124 Ca 0.04 -1.46 -0.17 0.00 0.00 0.00 0.00 46.02 44.43 3b4t n GLY 124 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b4t n GLY 125 N -0.25 0.37 0.28 -0.02 0.00 -1.25 -4.78 105.19 99.54 3b4t n GLY 125 Ca 0.00 -0.19 -0.09 0.00 0.00 0.00 0.00 46.02 45.74 3b4t n GLY 125 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3b4t h THR 126 N 0.00 1.27 -0.09 2.61 1.35 -1.94 -0.81 112.91 115.31 3b4t h THR 126 Ca -0.38 -1.30 -0.16 0.00 -0.55 0.00 0.00 66.41 64.02 3b4t h THR 126 Cb 1.23 1.07 -0.01 0.00 -1.73 0.00 0.00 68.15 68.71 3b4t h THR 126 CO 0.48 0.45 -0.65 0.08 -0.25 0.00 0.00 175.52 175.63 3b4t h ARG 127 N 0.81 0.35 -0.22 4.72 0.11 -1.98 0.11 114.38 118.28 3b4t h ARG 127 Ca 0.12 -0.26 -0.18 0.00 0.10 0.00 0.00 59.98 59.76 3b4t h ARG 127 Cb 0.71 0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.83 3b4t h ARG 127 CO 0.05 0.88 -0.57 1.79 0.10 0.00 0.00 179.97 182.22 3b4t h THR 128 N 0.25 1.29 -0.74 0.08 1.35 -1.86 -1.25 112.91 112.03 3b4t h THR 128 Ca -0.01 -1.78 0.02 0.00 -0.55 0.00 0.00 66.41 64.09 3b4t h THR 128 Cb 1.19 1.83 -0.04 0.00 -1.73 0.00 0.00 68.15 69.40 3b4t h THR 128 CO 0.11 0.57 0.48 0.00 -0.25 0.00 0.00 175.52 176.42 3b4t h ALA 129 N 0.61 0.96 -0.33 6.62 0.00 -1.07 -1.51 119.26 124.53 3b4t h ALA 129 Ca -0.01 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.89 3b4t h ALA 129 Cb 1.19 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 3b4t h ALA 129 CO 0.12 0.30 0.16 0.00 0.00 0.00 0.00 179.25 179.84 3b4t h ALA 130 N 1.29 0.41 -0.46 0.00 0.00 -0.53 0.01 119.26 119.99 3b4t h ALA 130 Ca 0.29 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 3b4t h ALA 130 Cb -0.04 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3b4t h ALA 130 CO -0.09 -0.21 0.18 0.82 0.00 0.00 0.00 179.25 179.94 3b4t h ILE 131 N 0.34 1.21 -0.77 0.00 2.04 -1.02 0.28 117.51 119.60 3b4t h ILE 131 Ca 0.14 -0.66 -0.04 0.00 1.00 0.00 0.00 64.86 65.29 3b4t h ILE 131 Cb 0.06 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 36.88 3b4t h ILE 131 CO -0.10 0.25 0.31 0.74 0.00 0.00 0.00 178.15 179.34 3b4t h THR 132 N 0.61 1.26 0.04 -0.27 2.02 -0.93 -2.20 112.91 113.43 3b4t h THR 132 Ca 0.15 -0.80 -0.23 0.00 0.77 0.00 0.00 66.41 66.30 3b4t h THR 132 Cb 0.21 0.35 -0.00 0.00 -1.74 0.00 0.00 68.15 66.97 3b4t h THR 132 CO -0.01 0.33 -1.01 1.23 0.37 0.00 0.00 175.52 176.43 3b4t h GLY 133 N 1.11 0.33 1.02 2.16 0.00 -0.85 -3.27 103.07 103.57 3b4t h GLY 133 Ca 0.26 -0.66 -0.01 0.00 0.00 0.00 0.00 47.33 46.92 3b4t h GLY 133 CO -0.02 0.58 0.54 0.00 0.00 0.00 0.00 176.54 177.64 3b4t h ALA 134 N 0.77 1.16 -0.61 3.60 0.00 -0.18 -2.04 119.26 121.95 3b4t h ALA 134 Ca -0.08 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.76 3b4t h ALA 134 Cb 1.67 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 19.06 3b4t h ALA 134 CO 0.17 0.62 0.36 -0.92 0.00 0.00 0.00 179.25 179.48 3b4t h TYR 135 N 1.25 0.68 -0.87 0.00 3.20 -1.46 0.30 116.97 120.07 3b4t h TYR 135 Ca 0.32 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.21 3b4t h TYR 135 Cb -0.04 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 37.97 3b4t h TYR 135 CO 0.00 0.37 0.51 0.28 -1.64 0.00 0.00 178.16 177.69 3b4t h VAL 136 N 0.71 1.24 -0.57 1.81 2.07 -1.52 0.95 116.25 120.95 3b4t h VAL 136 Ca 0.25 -0.55 -0.10 0.00 0.82 0.00 0.00 66.70 67.12 3b4t h VAL 136 Cb 0.06 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 29.84 3b4t h VAL 136 CO -0.12 0.26 -0.04 0.00 0.02 0.00 0.00 177.57 177.69 3b4t h ALA 137 N 1.28 0.85 -0.75 1.67 0.00 -0.78 -2.10 119.26 119.42 3b4t h ALA 137 Ca 0.31 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3b4t h ALA 137 Cb -0.03 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.51 3b4t h ALA 137 CO -0.06 0.66 0.49 1.25 0.00 0.00 0.00 179.25 181.59 3b4t h LEU 138 N 0.93 0.87 -0.38 0.00 5.85 0.40 -0.42 115.31 122.56 3b4t h LEU 138 Ca 0.16 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.85 3b4t h LEU 138 Cb 0.59 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 3b4t h LEU 138 CO 0.04 0.64 0.25 0.00 -0.34 0.00 0.00 178.44 179.02 3b4t h ALA 139 N 1.26 0.49 -0.45 1.25 0.00 -0.59 -0.16 119.26 121.06 3b4t h ALA 139 Ca 0.27 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 3b4t h ALA 139 Cb -0.10 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3b4t h ALA 139 CO -0.06 -0.04 0.11 -0.44 0.00 0.00 0.00 179.25 178.82 3b4t h ASP 140 N 0.51 0.61 -0.64 0.00 3.32 -0.99 0.50 116.42 119.74 3b4t h ASP 140 Ca 0.14 -0.09 -0.09 0.00 0.02 0.00 0.00 57.03 57.00 3b4t h ASP 140 Cb -0.04 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 3b4t h ASP 140 CO -0.03 0.61 0.05 0.00 -1.72 0.00 0.00 179.24 178.15 3b4t h ALA 141 N 1.47 0.85 -0.60 3.45 0.00 -0.56 -0.59 119.26 123.29 3b4t h ALA 141 Ca 0.15 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 3b4t h ALA 141 Cb 0.24 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3b4t h ALA 141 CO -0.00 0.66 0.04 0.28 0.00 0.00 0.00 179.25 180.23 3b4t h VAL 142 N 1.00 1.26 -0.66 0.00 2.07 -0.36 -1.17 116.25 118.39 3b4t h VAL 142 Ca 0.19 -1.08 0.02 0.00 0.82 0.00 0.00 66.70 66.65 3b4t h VAL 142 Cb 0.51 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 3b4t h VAL 142 CO 0.02 0.39 0.42 0.74 0.02 0.00 0.00 177.57 179.17 3b4t h THR 143 N 0.92 1.12 0.32 2.57 2.02 -0.69 -0.93 112.91 118.24 3b4t h THR 143 Ca 0.17 -0.29 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 3b4t h THR 143 Cb 0.50 0.20 -0.00 0.00 -1.74 0.00 0.00 68.15 67.11 3b4t h THR 143 CO 0.02 0.15 -0.19 0.22 0.37 0.00 0.00 175.52 176.10 3b4t h TYR 144 N 0.84 -0.49 -0.85 3.16 3.20 -0.77 -1.55 116.97 120.50 3b4t h TYR 144 Ca 0.26 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.19 3b4t h TYR 144 Cb -0.03 0.17 -0.06 0.00 1.54 0.00 0.00 36.73 38.36 3b4t h TYR 144 CO -0.04 -0.30 0.56 -0.07 -1.64 0.00 0.00 178.16 176.67 3b4t h LEU 145 N -0.49 0.83 0.18 2.82 3.38 -1.02 -1.63 115.31 119.38 3b4t h LEU 145 Ca -0.04 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 3b4t h LEU 145 Cb 0.40 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.98 3b4t h LEU 145 CO 0.04 0.53 -0.09 -1.28 0.09 0.00 0.00 178.44 177.73 3b4t h SER 146 N 0.94 -0.21 -0.07 -0.43 0.87 -0.95 0.11 113.55 113.82 3b4t h SER 146 Ca 0.37 -0.14 0.02 0.00 -1.23 0.00 0.00 61.79 60.81 3b4t h SER 146 Cb 0.24 0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.25 3b4t h SER 146 CO -0.14 0.03 0.09 0.00 -0.53 0.00 0.00 176.83 176.28 3b4t h ALA 147 N 0.34 1.55 0.00 6.23 0.00 -0.83 0.10 119.26 126.66 3b4t h ALA 147 Ca -0.02 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 3b4t h ALA 147 Cb 0.34 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3b4t h ALA 147 CO 0.04 -0.12 -1.00 0.00 0.00 0.00 0.00 179.25 178.16 3b4t h ALA 148 N 1.88 0.63 0.00 0.00 0.00 -0.97 -3.44 119.26 117.36 3b4t h ALA 148 Ca 0.03 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3b4t h ALA 148 Cb 0.21 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3b4t h ALA 148 CO -0.00 0.42 0.00 0.41 0.00 0.00 0.00 179.25 180.08 3b4t n GLY 149 N 1.26 0.80 1.03 0.00 0.00 0.35 -4.94 105.19 103.69 3b4t n GLY 149 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 3b4t n GLY 149 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3b4t n LYS 150 N -2.00 0.97 -4.79 1.61 5.02 -0.92 -4.79 118.16 113.25 3b4t n LYS 150 Ca 0.00 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.96 3b4t n LYS 150 Cb 0.00 -1.02 -0.13 0.00 -0.02 0.00 0.00 35.03 33.86 3b4t n LYS 150 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3b4t s LEU 151 N 0.00 2.79 0.14 -0.35 1.43 -1.26 -4.75 118.68 116.68 3b4t s LEU 151 Ca 0.00 -0.23 -0.08 0.00 -1.03 0.00 0.00 54.13 52.79 3b4t s LEU 151 Cb 0.00 -1.60 -0.05 0.00 0.03 0.00 0.00 46.19 44.57 3b4t s LEU 151 CO 0.00 0.26 1.38 0.28 0.23 0.00 0.00 176.35 178.50 3b4t h SER 152 N 6.00 0.77 -3.92 2.29 0.02 -1.76 -3.44 113.55 113.51 3b4t h SER 152 Ca -0.37 -0.48 -0.45 0.00 -0.84 0.00 0.00 61.79 59.65 3b4t h SER 152 Cb 1.18 -0.23 -0.30 0.00 0.14 0.00 0.00 62.40 63.19 3b4t h SER 152 CO 0.53 1.26 -0.80 -0.62 -1.14 0.00 0.00 176.83 176.06 3b4t s ASP 153 N -7.03 1.41 0.34 3.07 2.15 -0.53 -5.02 116.67 111.05 3b4t s ASP 153 Ca -0.08 -0.22 0.25 0.00 0.43 0.00 0.00 52.55 52.92 3b4t s ASP 153 Cb 0.10 -0.32 1.22 0.00 -0.30 0.00 0.00 42.92 43.62 3b4t s ASP 153 CO 0.88 0.10 1.76 -0.65 -0.17 0.00 0.00 175.17 177.09 3b4t h PRO 154 N 6.21 0.00 -2.06 4.34 0.11 -1.85 -3.33 132.00 135.42 3b4t h PRO 154 Ca -0.33 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.21 3b4t h PRO 154 Cb 1.17 0.00 -0.39 0.00 0.11 0.00 0.00 31.00 31.89 3b4t h PRO 154 CO 0.49 0.00 -1.03 0.54 -0.21 0.00 0.00 178.00 177.79 3b4t n ARG 155 N -2.37 0.92 0.24 1.05 1.74 -1.26 -4.93 116.66 112.05 3b4t n ARG 155 Ca -0.00 -3.42 0.16 0.00 -0.77 0.00 0.00 57.85 53.82 3b4t n ARG 155 Cb 0.12 -1.39 0.58 0.00 -1.02 0.00 0.00 32.46 30.75 3b4t n ARG 155 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3b4t h PRO 156 N 4.15 0.00 -5.93 5.56 0.13 -1.84 -3.42 132.00 130.65 3b4t h PRO 156 Ca 0.10 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.64 3b4t h PRO 156 Cb 0.85 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.90 3b4t h PRO 156 CO 0.51 0.00 0.56 -0.51 -0.23 0.00 0.00 178.00 178.33 3b4t s LEU 157 N -5.89 4.05 0.04 1.56 1.43 -1.26 0.49 118.68 119.11 3b4t s LEU 157 Ca 0.03 0.92 0.23 0.00 -1.03 0.00 0.00 54.13 54.28 3b4t s LEU 157 Cb 0.09 -3.26 0.03 0.00 0.03 0.00 0.00 46.19 43.07 3b4t s LEU 157 CO 0.54 -0.66 1.01 -1.54 0.23 0.00 0.00 176.35 175.93 3b4t n SER 158 N 6.32 0.61 -3.60 2.29 3.41 -0.07 -4.99 113.62 117.61 3b4t n SER 158 Ca 0.07 -0.25 -0.03 0.00 -0.26 0.00 0.00 58.87 58.40 3b4t n SER 158 Cb 0.47 0.83 -0.00 0.00 -0.26 0.00 0.00 64.21 65.25 3b4t n SER 158 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3b4t s ALA 160 N -2.82 3.55 -0.08 0.00 0.00 -1.26 -4.86 121.76 116.30 3b4t s ALA 160 Ca 0.16 -0.79 0.01 0.00 0.00 0.00 0.00 51.96 51.34 3b4t s ALA 160 Cb -0.01 -1.64 -0.03 0.00 0.00 0.00 0.00 23.12 21.44 3b4t s ALA 160 CO 0.03 0.64 -0.10 0.42 0.00 0.00 0.00 175.76 176.75 3b4t s ILE 161 N -1.05 3.42 0.06 0.00 -1.09 -1.26 -2.18 121.20 119.10 3b4t s ILE 161 Ca 0.18 -0.57 -0.12 0.00 -2.23 0.00 0.00 60.65 57.90 3b4t s ILE 161 Cb -0.12 -2.39 0.01 0.00 -1.58 0.00 0.00 42.46 38.38 3b4t s ILE 161 CO 0.08 0.58 0.27 0.00 -1.23 0.00 0.00 174.94 174.64 3b4t s ALA 162 N -0.52 -0.56 0.01 9.38 0.00 -0.71 -4.69 121.76 124.67 3b4t s ALA 162 Ca 0.07 -0.18 -0.08 0.00 0.00 0.00 0.00 51.96 51.78 3b4t s ALA 162 Cb -0.12 0.39 0.00 0.00 0.00 0.00 0.00 23.12 23.39 3b4t s ALA 162 CO 0.02 -0.45 0.15 0.00 0.00 0.00 0.00 175.76 175.48 3b4t s ALA 163 N -2.97 -0.33 0.00 0.00 0.00 -1.26 -0.73 121.76 116.47 3b4t s ALA 163 Ca -0.02 -0.17 -0.17 0.00 0.00 0.00 0.00 51.96 51.60 3b4t s ALA 163 Cb 0.01 0.15 0.03 0.00 0.00 0.00 0.00 23.12 23.31 3b4t s ALA 163 CO -0.06 -0.25 0.36 0.54 0.00 0.00 0.00 175.76 176.36 3b4t s VAL 164 N -1.69 0.06 0.32 0.00 0.11 -0.75 -4.55 120.40 113.90 3b4t s VAL 164 Ca -0.12 -0.46 -0.09 0.00 -2.93 0.00 0.00 61.98 58.37 3b4t s VAL 164 Cb -0.06 -0.77 -0.06 0.00 -1.53 0.00 0.00 36.38 33.96 3b4t s VAL 164 CO 0.00 -0.26 0.65 -0.94 -3.33 0.00 0.00 175.10 171.22 3b4t s SER 165 N -1.56 6.55 -0.04 3.54 1.04 -1.26 -1.44 113.70 120.53 3b4t s SER 165 Ca -0.10 0.97 -0.27 0.00 0.48 0.00 0.00 55.95 57.02 3b4t s SER 165 Cb -0.03 -2.25 0.06 0.00 0.10 0.00 0.00 66.02 63.90 3b4t s SER 165 CO 0.02 -0.24 0.59 0.54 0.98 0.00 0.00 173.24 175.13 3b4t s VAL 166 N -2.11 0.01 -0.00 5.02 0.11 -0.44 0.23 120.40 123.22 3b4t s VAL 166 Ca 0.48 -0.12 -0.18 0.00 -2.93 0.00 0.00 61.98 59.24 3b4t s VAL 166 Cb -0.11 -0.91 0.06 0.00 -1.53 0.00 0.00 36.38 33.89 3b4t s VAL 166 CO 0.27 -0.07 0.81 0.61 -3.33 0.00 0.00 175.10 173.40 3b4t n GLY 167 N 0.96 0.40 3.35 6.54 0.00 -0.74 -0.14 105.19 115.56 3b4t n GLY 167 Ca -0.20 -0.98 -0.40 0.00 0.00 0.00 0.00 46.02 44.45 3b4t n GLY 167 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b4t s VAL 168 N -2.08 4.40 -0.16 1.61 1.01 0.19 -1.22 120.40 124.15 3b4t s VAL 168 Ca 0.19 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.25 3b4t s VAL 168 Cb -0.01 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.91 3b4t s VAL 168 CO -0.00 -0.23 -0.16 -0.69 0.00 0.00 0.00 175.10 174.02 3b4t s VAL 169 N 1.52 2.54 -1.45 2.92 1.01 0.14 -0.89 120.40 126.19 3b4t s VAL 169 Ca 0.01 -0.81 -0.07 0.00 0.00 0.00 0.00 61.98 61.12 3b4t s VAL 169 Cb -0.19 -2.07 0.03 0.00 0.00 0.00 0.00 36.38 34.15 3b4t s VAL 169 CO 0.06 0.52 0.60 0.47 0.00 0.00 0.00 175.10 176.75 3b4t n ASP 170 N 4.14 -5.26 0.00 3.32 8.00 -1.26 -1.46 116.55 124.03 3b4t n ASP 170 Ca -0.19 -0.34 0.00 0.00 0.71 0.00 0.00 54.79 54.96 3b4t n ASP 170 Cb 0.51 -4.27 0.00 0.00 -0.02 0.00 0.00 41.12 37.35 3b4t n ASP 170 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3b4t n GLY 171 N -1.43 0.78 3.37 0.44 0.00 -1.26 -5.02 105.19 102.06 3b4t n GLY 171 Ca -0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.68 3b4t n GLY 171 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3b4t s ARG 172 N -0.09 1.34 -0.15 1.61 0.52 -0.53 -5.09 118.95 116.56 3b4t s ARG 172 Ca 0.00 -1.35 -0.18 0.00 -0.52 0.00 0.00 55.73 53.68 3b4t s ARG 172 Cb 0.00 -1.70 -0.04 0.00 0.52 0.00 0.00 34.95 33.73 3b4t s ARG 172 CO 0.00 0.39 0.50 0.42 0.02 0.00 0.00 175.30 176.63 3b4t s ILE 173 N -1.31 5.15 0.03 1.52 1.01 -1.26 0.28 121.20 126.62 3b4t s ILE 173 Ca 0.14 0.96 -0.00 0.00 0.00 0.00 0.00 60.65 61.74 3b4t s ILE 173 Cb -0.09 -3.83 -0.03 0.00 0.01 0.00 0.00 42.46 38.52 3b4t s ILE 173 CO 0.06 0.27 -0.03 -0.13 0.00 0.00 0.00 174.94 175.11 3b4t s ARG 174 N 1.02 0.45 0.15 2.79 0.52 -0.36 -4.70 118.95 118.81 3b4t s ARG 174 Ca 0.25 -0.86 0.06 0.00 -0.52 0.00 0.00 55.73 54.67 3b4t s ARG 174 Cb -0.15 0.12 -0.04 0.00 0.52 0.00 0.00 34.95 35.40 3b4t s ARG 174 CO 0.10 -0.07 0.01 0.14 0.02 0.00 0.00 175.30 175.50 3b4t s VAL 175 N -2.42 3.84 -0.78 3.52 -7.23 -0.93 -1.80 120.40 114.61 3b4t s VAL 175 Ca -0.06 -1.27 -0.01 0.00 -1.81 0.00 0.00 61.98 58.83 3b4t s VAL 175 Cb -0.03 -2.90 -0.01 0.00 0.56 0.00 0.00 36.38 34.00 3b4t s VAL 175 CO -0.04 -0.04 0.72 -0.67 -0.31 0.00 0.00 175.10 174.76 3b4t n ASP 176 N 0.08 -7.59 -4.70 4.85 2.03 0.14 -4.76 116.55 106.60 3b4t n ASP 176 Ca -0.10 -0.17 -0.42 0.00 0.52 0.00 0.00 54.79 54.62 3b4t n ASP 176 Cb 0.54 -5.18 -0.03 0.00 -0.72 0.00 0.00 41.12 35.73 3b4t n ASP 176 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3b4t s LEU 177 N -4.19 4.30 1.00 -2.67 1.43 -1.26 -4.77 118.68 112.52 3b4t s LEU 177 Ca 0.05 1.61 -0.14 0.00 -1.03 0.00 0.00 54.13 54.62 3b4t s LEU 177 Cb -0.01 -3.56 0.19 0.00 0.03 0.00 0.00 46.19 42.84 3b4t s LEU 177 CO 0.75 -0.39 1.14 -2.84 0.23 0.00 0.00 176.35 175.25 3b4t s PRO 178 N 1.64 0.41 0.25 1.29 0.02 -1.26 -3.78 135.00 133.58 3b4t s PRO 178 Ca 0.50 0.18 -0.03 0.00 0.02 0.00 0.00 61.00 61.67 3b4t s PRO 178 Cb -0.20 -1.77 0.51 0.00 0.02 0.00 0.00 34.50 33.06 3b4t s PRO 178 CO 0.22 -2.67 1.71 -0.92 -0.33 0.00 0.00 177.00 175.01 3b4t h TYR 179 N -1.84 0.47 -0.00 6.54 3.20 -1.76 0.54 116.97 124.11 3b4t h TYR 179 Ca -0.50 0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.42 3b4t h TYR 179 Cb 1.31 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.48 3b4t h TYR 179 CO -0.37 -0.00 -0.13 1.49 -1.64 0.00 0.00 178.16 177.50 3b4t h GLU 180 N 0.38 -0.16 -0.40 1.82 4.81 -1.92 -2.48 114.58 116.64 3b4t h GLU 180 Ca 0.44 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.67 3b4t h GLU 180 Cb 0.73 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.13 3b4t h GLU 180 CO -0.46 -0.10 0.20 0.93 -0.73 0.00 0.00 179.01 178.85 3b4t h GLU 181 N -0.16 0.54 -0.89 1.92 5.08 -1.85 -2.46 114.58 116.77 3b4t h GLU 181 Ca 0.00 -0.05 0.14 0.00 -1.00 0.00 0.00 59.36 58.45 3b4t h GLU 181 Cb 0.17 -0.11 -0.07 0.00 0.50 0.00 0.00 28.75 29.24 3b4t h GLU 181 CO -0.09 0.42 0.57 0.22 -1.00 0.00 0.00 179.01 179.13 3b4t h ASP 182 N 0.55 0.65 1.37 1.42 3.58 -0.53 -1.09 116.42 122.37 3b4t h ASP 182 Ca 0.14 0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.63 3b4t h ASP 182 Cb 0.04 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.00 3b4t h ASP 182 CO -0.02 0.33 -0.23 0.77 -2.88 0.00 0.00 179.24 177.22 3b4t h SER 183 N 0.69 0.00 -0.12 2.28 4.64 -1.00 -3.23 113.55 116.81 3b4t h SER 183 Ca 0.44 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 3b4t h SER 183 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 3b4t h SER 183 CO -0.20 0.03 0.00 0.54 -0.87 0.00 0.00 176.83 176.33 3b4t n ARG 184 N -2.38 2.00 -2.25 4.77 1.74 -0.48 -4.99 116.66 115.08 3b4t n ARG 184 Ca 0.04 -1.85 -0.42 0.00 -0.77 0.00 0.00 57.85 54.85 3b4t n ARG 184 Cb 0.46 -1.41 -0.03 0.00 -1.02 0.00 0.00 32.46 30.46 3b4t n ARG 184 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3b4t s ALA 185 N -1.62 3.62 0.15 7.54 0.00 -0.79 -4.51 121.76 126.15 3b4t s ALA 185 Ca 0.27 0.72 -0.18 0.00 0.00 0.00 0.00 51.96 52.77 3b4t s ALA 185 Cb 0.18 -3.65 0.04 0.00 0.00 0.00 0.00 23.12 19.69 3b4t s ALA 185 CO 0.26 -1.16 1.70 0.93 0.00 0.00 0.00 175.76 177.50 3b4t h GLU 186 N 8.49 0.06 -3.27 0.00 5.08 -1.37 -3.44 114.58 120.14 3b4t h GLU 186 Ca -0.34 -0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 57.88 3b4t h GLU 186 Cb 1.15 -0.01 -0.22 0.00 0.50 0.00 0.00 28.75 30.16 3b4t h GLU 186 CO 0.94 0.04 -0.42 0.54 -1.00 0.00 0.00 179.01 179.12 3b4t s VAL 187 N -6.19 0.05 0.12 3.13 0.11 -1.23 -4.58 120.40 111.80 3b4t s VAL 187 Ca -0.13 -0.42 -0.22 0.00 -2.93 0.00 0.00 61.98 58.28 3b4t s VAL 187 Cb 0.12 -0.45 0.06 0.00 -1.53 0.00 0.00 36.38 34.58 3b4t s VAL 187 CO 0.70 -0.23 0.55 1.51 -3.33 0.00 0.00 175.10 174.30 3b4t s ASP 188 N -0.89 -0.48 0.31 3.54 -4.77 -1.26 0.55 116.67 113.66 3b4t s ASP 188 Ca -0.10 0.01 -0.19 0.00 -3.30 0.00 0.00 52.55 48.98 3b4t s ASP 188 Cb -0.05 0.55 0.05 0.00 -1.09 0.00 0.00 42.92 42.38 3b4t s ASP 188 CO 0.02 -0.88 0.82 0.00 0.70 0.00 0.00 175.17 175.83 3b4t s MET 189 N -3.37 1.91 -0.13 2.11 0.23 0.80 -0.84 119.30 120.00 3b4t s MET 189 Ca -0.00 -1.18 0.01 0.00 -1.03 0.00 0.00 55.69 53.49 3b4t s MET 189 Cb -0.00 0.57 -0.00 0.00 -1.53 0.00 0.00 34.83 33.86 3b4t s MET 189 CO -0.09 -0.89 -0.17 -0.80 -2.03 0.00 0.00 175.02 171.03 3b4t s ASN 190 N -3.06 3.57 -0.19 -1.18 0.01 0.79 -1.33 114.94 113.55 3b4t s ASN 190 Ca 0.15 -0.46 -0.02 0.00 -0.71 0.00 0.00 52.86 51.81 3b4t s ASN 190 Cb -0.05 -1.53 -0.00 0.00 0.41 0.00 0.00 41.25 40.08 3b4t s ASN 190 CO 0.09 0.13 -0.09 -0.69 -1.51 0.00 0.00 177.10 175.02 3b4t s VAL 191 N 0.56 3.05 -0.19 1.60 1.01 -0.52 -1.32 120.40 124.59 3b4t s VAL 191 Ca -0.11 -0.62 -0.07 0.00 0.00 0.00 0.00 61.98 61.19 3b4t s VAL 191 Cb -0.16 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 3b4t s VAL 191 CO 0.04 0.47 0.04 -0.69 0.00 0.00 0.00 175.10 174.96 3b4t s VAL 192 N 1.22 4.56 0.20 2.92 1.01 0.48 -1.80 120.40 128.98 3b4t s VAL 192 Ca 0.02 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 61.89 3b4t s VAL 192 Cb -0.14 -3.06 -0.04 0.00 0.00 0.00 0.00 36.38 33.14 3b4t s VAL 192 CO -0.04 0.45 0.08 0.00 0.00 0.00 0.00 175.10 175.60 3b4t s ALA 193 N 0.53 1.30 0.34 5.51 0.00 0.10 -0.41 121.76 129.13 3b4t s ALA 193 Ca 0.02 -1.68 0.08 0.00 0.00 0.00 0.00 51.96 50.37 3b4t s ALA 193 Cb -0.13 1.04 -0.03 0.00 0.00 0.00 0.00 23.12 24.00 3b4t s ALA 193 CO 0.01 -0.48 0.28 0.95 0.00 0.00 0.00 175.76 176.52 3b4t s THR 194 N -3.93 3.46 -2.00 0.00 -4.23 -0.53 -1.73 115.64 106.68 3b4t s THR 194 Ca 0.33 -1.39 0.23 0.00 -1.18 0.00 0.00 61.69 59.67 3b4t s THR 194 Cb 0.07 -3.16 0.65 0.00 1.34 0.00 0.00 72.50 71.40 3b4t s THR 194 CO 0.09 -0.17 1.82 -0.90 -0.54 0.00 0.00 174.62 174.92 3b4t n ASP 195 N -1.36 0.00 0.13 3.99 3.85 -0.93 -2.38 116.55 119.85 3b4t n ASP 195 Ca -0.02 -1.10 0.09 0.00 -0.71 0.00 0.00 54.79 53.06 3b4t n ASP 195 Cb 0.60 0.00 0.04 0.00 -1.35 0.00 0.00 41.12 40.41 3b4t n ASP 195 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.20 176.93 3b4t h THR 196 N 0.00 0.15 0.00 2.12 2.02 -1.95 -3.48 112.91 111.77 3b4t h THR 196 Ca 0.00 -1.24 0.00 0.00 0.77 0.00 0.00 66.41 65.94 3b4t h THR 196 Cb 0.00 1.81 0.00 0.00 -1.74 0.00 0.00 68.15 68.22 3b4t h THR 196 CO 0.00 0.08 0.00 0.61 0.37 0.00 0.00 175.52 176.58 3b4t n GLY 197 N 1.19 0.99 3.97 2.16 0.00 -1.00 -5.10 105.19 107.40 3b4t n GLY 197 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 3b4t n GLY 197 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3b4t s THR 198 N -2.00 4.19 0.15 2.61 -4.23 -1.26 -4.93 115.64 110.17 3b4t s THR 198 Ca 0.00 -0.80 0.02 0.00 -1.18 0.00 0.00 61.69 59.72 3b4t s THR 198 Cb 0.00 -3.49 -0.04 0.00 1.34 0.00 0.00 72.50 70.32 3b4t s THR 198 CO 0.00 -0.25 0.30 -0.76 -0.54 0.00 0.00 174.62 173.37 3b4t s LEU 199 N -4.29 4.32 -0.05 4.79 1.43 -1.26 -1.45 118.68 122.17 3b4t s LEU 199 Ca 0.45 0.21 -0.01 0.00 -1.03 0.00 0.00 54.13 53.75 3b4t s LEU 199 Cb -0.10 -2.95 -0.03 0.00 0.03 0.00 0.00 46.19 43.14 3b4t s LEU 199 CO 0.33 0.04 -0.05 0.52 0.23 0.00 0.00 176.35 177.42 3b4t n VAL 200 N -0.53 0.28 -3.60 -1.59 0.31 0.45 -4.85 118.33 108.80 3b4t n VAL 200 Ca -0.07 -0.09 -0.10 0.00 -0.01 0.00 0.00 64.34 64.07 3b4t n VAL 200 Cb 0.54 -1.03 -0.06 0.00 -0.91 0.00 0.00 33.84 32.38 3b4t n VAL 200 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 3b4t s GLU 201 N -2.10 0.55 -0.11 5.55 2.12 -1.06 -4.98 118.70 118.67 3b4t s GLU 201 Ca -0.07 0.30 0.03 0.00 0.36 0.00 0.00 54.97 55.59 3b4t s GLU 201 Cb 0.02 0.26 0.01 0.00 0.26 0.00 0.00 34.13 34.68 3b4t s GLU 201 CO 0.11 -0.14 -0.20 0.42 -0.54 0.00 0.00 175.26 174.91 3b4t s ILE 202 N -0.60 1.85 0.21 -3.70 1.01 -1.26 -0.39 121.20 118.31 3b4t s ILE 202 Ca 0.00 -0.87 -0.22 0.00 0.00 0.00 0.00 60.65 59.56 3b4t s ILE 202 Cb -0.02 -1.63 0.05 0.00 0.01 0.00 0.00 42.46 40.87 3b4t s ILE 202 CO -0.02 0.51 0.69 0.00 0.00 0.00 0.00 174.94 176.13 3b4t s GLN 203 N 0.64 1.50 -0.21 2.79 1.03 -0.44 -4.98 119.66 120.00 3b4t s GLN 203 Ca -0.13 -0.73 -0.00 0.00 0.04 0.00 0.00 55.36 54.55 3b4t s GLN 203 Cb -0.16 0.58 0.00 0.00 0.03 0.00 0.00 33.01 33.46 3b4t s GLN 203 CO 0.03 -0.68 0.17 0.41 -2.54 0.00 0.00 175.29 172.69 3b4t n GLY 204 N -0.42 0.40 3.77 2.60 0.00 -1.26 -0.15 105.19 110.14 3b4t n GLY 204 Ca -0.10 -0.41 -0.41 0.00 0.00 0.00 0.00 46.02 45.10 3b4t n GLY 204 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3b4t n THR 205 N -1.83 2.00 -1.68 2.61 -1.04 -1.25 -4.27 114.28 108.81 3b4t n THR 205 Ca -0.04 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.05 61.07 3b4t n THR 205 Cb 0.52 -1.96 0.02 0.00 -1.82 0.00 0.00 70.33 67.09 3b4t n THR 205 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3b4t n GLY 206 N 0.46 0.37 3.69 3.41 0.00 -0.02 -4.82 105.19 108.27 3b4t n GLY 206 Ca 0.01 0.16 -0.56 0.00 0.00 0.00 0.00 46.02 45.63 3b4t n GLY 206 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3b4t n GLU 207 N -0.05 1.24 -1.01 1.61 4.07 -1.26 -1.79 120.64 123.44 3b4t n GLU 207 Ca 0.08 0.45 -0.00 0.00 -0.06 0.00 0.00 57.16 57.63 3b4t n GLU 207 Cb 0.40 -2.14 -0.00 0.00 -0.06 0.00 0.00 31.44 29.64 3b4t n GLU 207 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3b4t n GLY 208 N 3.93 0.42 3.56 8.31 0.00 -1.26 -5.04 105.19 115.11 3b4t n GLY 208 Ca 0.25 -0.97 -0.32 0.00 0.00 0.00 0.00 46.02 44.98 3b4t n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3b4t s ALA 209 N -2.01 2.90 0.19 4.61 0.00 -0.74 -5.09 121.76 121.61 3b4t s ALA 209 Ca 0.00 -1.05 0.04 0.00 0.00 0.00 0.00 51.96 50.95 3b4t s ALA 209 Cb 0.00 -1.03 -0.05 0.00 0.00 0.00 0.00 23.12 22.04 3b4t s ALA 209 CO 0.00 0.60 -0.06 0.95 0.00 0.00 0.00 175.76 177.25 3b4t s THR 210 N -0.96 1.16 -0.03 0.00 -4.23 -1.26 -4.86 115.64 105.46 3b4t s THR 210 Ca 0.16 -2.06 -0.13 0.00 -1.18 0.00 0.00 61.69 58.48 3b4t s THR 210 Cb -0.11 -2.08 0.02 0.00 1.34 0.00 0.00 72.50 71.67 3b4t s THR 210 CO 0.06 -0.55 0.29 0.72 -0.54 0.00 0.00 174.62 174.60 3b4t s PHE 211 N -3.34 -0.18 0.51 3.99 -0.71 -1.26 -4.95 117.98 112.04 3b4t s PHE 211 Ca 0.22 0.32 -0.14 0.00 -1.04 0.00 0.00 56.93 56.29 3b4t s PHE 211 Cb 0.04 0.08 -0.07 0.00 -1.21 0.00 0.00 43.02 41.86 3b4t s PHE 211 CO 0.05 -0.33 0.94 0.00 -1.34 0.00 0.00 175.22 174.53 3b4t s ALA 212 N -1.06 3.14 0.48 1.99 0.00 -1.26 -4.90 121.76 120.15 3b4t s ALA 212 Ca -0.11 0.02 0.18 0.00 0.00 0.00 0.00 51.96 52.05 3b4t s ALA 212 Cb -0.05 -3.00 1.18 0.00 0.00 0.00 0.00 23.12 21.24 3b4t s ALA 212 CO 0.03 -0.28 2.00 0.00 0.00 0.00 0.00 175.76 177.51 3b4t h ARG 213 N 0.72 0.22 -0.23 0.00 3.08 -2.01 -0.52 114.38 115.63 3b4t h ARG 213 Ca -0.46 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 59.48 3b4t h ARG 213 Cb 1.19 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.17 3b4t h ARG 213 CO 0.62 0.15 -0.28 0.66 -1.07 0.00 0.00 179.97 180.05 3b4t h SER 214 N 0.23 0.45 -0.18 7.04 4.64 -1.99 -0.08 113.55 123.66 3b4t h SER 214 Ca 0.24 -0.16 -0.11 0.00 -0.47 0.00 0.00 61.79 61.29 3b4t h SER 214 Cb 0.63 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 3b4t h SER 214 CO -0.04 0.72 -0.31 0.74 -0.87 0.00 0.00 176.83 177.07 3b4t h THR 215 N 0.39 1.34 -0.70 2.95 2.02 -1.53 -2.28 112.91 115.11 3b4t h THR 215 Ca 0.05 -1.54 0.08 0.00 0.77 0.00 0.00 66.41 65.77 3b4t h THR 215 Cb 0.70 1.90 -0.06 0.00 -1.74 0.00 0.00 68.15 68.95 3b4t h THR 215 CO 0.05 0.47 0.38 0.25 0.37 0.00 0.00 175.52 177.04 3b4t h LEU 216 N 0.17 0.53 -0.84 2.58 5.85 -0.93 0.13 115.31 122.80 3b4t h LEU 216 Ca 0.01 0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.71 3b4t h LEU 216 Cb 0.90 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.84 3b4t h LEU 216 CO 0.07 0.32 0.18 0.44 -0.34 0.00 0.00 178.44 179.11 3b4t h ASP 217 N 0.67 0.98 -0.66 1.25 3.32 -0.98 0.39 116.42 121.37 3b4t h ASP 217 Ca 0.33 -0.19 -0.08 0.00 0.02 0.00 0.00 57.03 57.10 3b4t h ASP 217 Cb 0.27 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 3b4t h ASP 217 CO -0.22 0.93 0.09 0.11 -1.72 0.00 0.00 179.24 178.43 3b4t h LYS 218 N 0.99 1.11 -0.43 3.56 1.57 -0.73 -1.59 116.57 121.06 3b4t h LYS 218 Ca 0.21 -0.31 -0.06 0.00 -1.87 0.00 0.00 60.65 58.63 3b4t h LYS 218 Cb 0.33 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 3b4t h LYS 218 CO -0.00 1.03 0.05 -0.07 -0.57 0.00 0.00 179.45 179.89 3b4t h LEU 219 N 1.03 0.70 -0.49 2.94 3.38 -0.32 -2.35 115.31 120.21 3b4t h LEU 219 Ca 0.20 -0.27 -0.07 0.00 0.09 0.00 0.00 57.88 57.83 3b4t h LEU 219 Cb 0.47 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 3b4t h LEU 219 CO 0.02 0.80 0.04 -0.07 0.09 0.00 0.00 178.44 179.31 3b4t h LEU 220 N 0.58 0.81 -0.33 1.67 3.38 -0.83 0.05 115.31 120.64 3b4t h LEU 220 Ca 0.13 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.82 3b4t h LEU 220 Cb 0.40 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 3b4t h LEU 220 CO 0.01 0.90 0.22 0.44 0.09 0.00 0.00 178.44 180.09 3b4t h ASP 221 N 0.70 0.37 -0.14 -0.43 3.32 -1.26 0.62 116.42 119.60 3b4t h ASP 221 Ca 0.14 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.18 3b4t h ASP 221 Cb 0.46 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 3b4t h ASP 221 CO 0.02 0.27 0.09 -0.03 -1.72 0.00 0.00 179.24 177.87 3b4t h MET 222 N 0.44 0.19 -0.52 3.56 4.05 -1.30 -2.46 114.93 118.89 3b4t h MET 222 Ca 0.12 -0.01 0.02 0.00 -0.28 0.00 0.00 59.70 59.55 3b4t h MET 222 Cb -0.05 -0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 30.67 3b4t h MET 222 CO -0.03 0.14 0.31 0.00 0.23 0.00 0.00 176.91 177.57 3b4t h ALA 223 N 1.04 0.66 -0.75 0.39 0.00 -0.63 -2.44 119.26 117.53 3b4t h ALA 223 Ca 0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3b4t h ALA 223 Cb -0.00 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 3b4t h ALA 223 CO -0.01 0.02 0.44 -0.07 0.00 0.00 0.00 179.25 179.63 3b4t h LEU 224 N 0.62 0.91 -0.41 0.00 3.38 -0.78 -1.13 115.31 117.91 3b4t h LEU 224 Ca 0.21 -0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.16 3b4t h LEU 224 Cb 0.02 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.49 3b4t h LEU 224 CO -0.09 0.72 0.13 1.23 0.09 0.00 0.00 178.44 180.52 3b4t h GLY 225 N 1.03 0.52 1.14 0.83 0.00 -1.13 -2.36 103.07 103.10 3b4t h GLY 225 Ca 0.27 -0.07 -0.06 0.00 0.00 0.00 0.00 47.33 47.47 3b4t h GLY 225 CO -0.05 0.00 0.19 0.00 0.00 0.00 0.00 176.54 176.69 3b4t h ALA 226 N 1.28 1.04 -0.16 3.60 0.00 -0.94 -2.43 119.26 121.65 3b4t h ALA 226 Ca 0.19 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3b4t h ALA 226 Cb 0.20 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3b4t h ALA 226 CO -0.22 0.64 0.01 0.00 0.00 0.00 0.00 179.25 179.68 3b4t h ASP 228 N 0.23 -0.36 -0.74 0.00 3.32 -0.92 0.19 116.42 118.15 3b4t h ASP 228 Ca 0.06 0.11 0.04 0.00 0.02 0.00 0.00 57.03 57.26 3b4t h ASP 228 Cb 0.15 0.24 -0.05 0.00 0.22 0.00 0.00 39.33 39.89 3b4t h ASP 228 CO 0.00 -0.13 0.46 0.74 -1.72 0.00 0.00 179.24 178.59 3b4t h THR 229 N -0.00 1.07 -0.53 0.35 2.02 -1.36 -2.21 112.91 112.25 3b4t h THR 229 Ca 0.18 -0.30 -0.05 0.00 0.77 0.00 0.00 66.41 67.02 3b4t h THR 229 Cb 0.28 0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 3b4t h THR 229 CO -0.39 0.16 0.16 -0.07 0.37 0.00 0.00 175.52 175.74 3b4t h LEU 230 N 0.87 0.79 -0.92 2.58 3.38 -0.81 -2.10 115.31 119.10 3b4t h LEU 230 Ca 0.30 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 58.06 3b4t h LEU 230 Cb 0.06 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.56 3b4t h LEU 230 CO -0.13 0.79 0.60 -0.26 0.09 0.00 0.00 178.44 179.53 3b4t h PHE 231 N 0.74 1.17 -0.40 1.13 0.04 -0.37 -0.69 116.94 118.57 3b4t h PHE 231 Ca 0.17 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.97 3b4t h PHE 231 Cb 0.30 -0.39 -0.02 0.00 2.20 0.00 0.00 35.95 38.03 3b4t h PHE 231 CO 0.02 0.75 0.25 0.00 -0.60 0.00 0.00 178.31 178.73 3b4t h ALA 232 N 1.33 0.50 -0.72 2.45 0.00 -1.18 -1.08 119.26 120.56 3b4t h ALA 232 Ca 0.34 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.28 3b4t h ALA 232 Cb -0.12 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.47 3b4t h ALA 232 CO -0.07 -0.06 0.42 0.00 0.00 0.00 0.00 179.25 179.55 3b4t h ALA 233 N 1.15 0.97 -0.08 0.00 0.00 -0.67 -0.41 119.26 120.23 3b4t h ALA 233 Ca 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 3b4t h ALA 233 Cb -0.04 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 3b4t h ALA 233 CO -0.04 0.13 0.04 1.96 0.00 0.00 0.00 179.25 181.34 3b4t h GLN 234 N 0.79 0.11 -0.48 0.00 4.20 -0.68 -1.87 115.11 117.17 3b4t h GLN 234 Ca 0.32 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 59.04 3b4t h GLN 234 Cb 0.16 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.88 3b4t h GLN 234 CO -0.17 0.19 0.27 0.00 -0.67 0.00 0.00 178.83 178.46 3b4t h ARG 235 N 0.00 0.53 -0.61 1.46 3.08 -0.91 0.30 114.38 118.23 3b4t h ARG 235 Ca 0.03 -0.03 0.07 0.00 0.07 0.00 0.00 59.98 60.11 3b4t h ARG 235 Cb 0.12 -0.12 -0.06 0.00 0.08 0.00 0.00 29.97 29.99 3b4t h ARG 235 CO -0.00 0.35 0.30 -0.44 -1.07 0.00 0.00 179.97 179.11 3b4t h ASP 236 N 0.54 0.40 -0.36 7.04 3.32 -0.90 0.46 116.42 126.92 3b4t h ASP 236 Ca 0.20 0.05 -0.17 0.00 0.02 0.00 0.00 57.03 57.13 3b4t h ASP 236 Cb 0.05 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.58 3b4t h ASP 236 CO -0.11 0.25 -0.43 0.00 -1.72 0.00 0.00 179.24 177.24 3b4t h ALA 237 N 1.36 0.53 0.00 3.45 0.00 -0.88 -3.00 119.26 120.72 3b4t h ALA 237 Ca 0.29 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3b4t h ALA 237 Cb 0.25 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3b4t h ALA 237 CO -0.22 0.67 0.00 1.28 0.00 0.00 0.00 179.25 180.98 3b4t n LEU 238 N -4.05 0.00 0.18 0.00 4.77 0.05 -2.77 117.00 115.18 3b4t n LEU 238 Ca -0.03 0.50 0.06 0.00 -0.03 0.00 0.00 56.01 56.51 3b4t n LEU 238 Cb 0.57 -0.50 0.20 0.00 -2.33 0.00 0.00 43.42 41.36 3b4t n LEU 238 CO 0.49 -0.09 0.63 0.00 -1.33 0.00 0.00 177.39 177.09 3b4t h ALA 239 N 2.82 0.84 -2.44 -1.18 0.00 -0.77 -3.45 119.26 115.09 3b4t h ALA 239 Ca 0.00 -0.31 -0.50 0.00 0.00 0.00 0.00 54.91 54.09 3b4t h ALA 239 Cb 0.41 -0.05 0.09 0.00 0.00 0.00 0.00 17.79 18.24 3b4t h ALA 239 CO 0.00 0.43 0.38 -0.51 0.00 0.00 0.00 179.25 179.55 3b4t s LEU 240 N -6.55 3.44 0.77 0.00 1.43 -1.11 -5.00 118.68 111.66 3b4t s LEU 240 Ca 0.03 1.98 -0.14 0.00 -1.03 0.00 0.00 54.13 54.96 3b4t s LEU 240 Cb 0.08 -4.55 0.06 0.00 0.03 0.00 0.00 46.19 41.82 3b4t s LEU 240 CO 0.70 -1.50 1.22 -2.16 0.23 0.00 0.00 176.35 174.84 3b4t s PRO 241 N -4.03 1.84 -0.01 1.29 0.04 -1.26 -4.89 135.00 127.99 3b4t s PRO 241 Ca 0.67 1.80 -0.32 0.00 0.04 0.00 0.00 61.00 63.18 3b4t s PRO 241 Cb -0.20 -1.79 -0.11 0.00 0.04 0.00 0.00 34.50 32.44 3b4t s PRO 241 CO 0.39 -2.07 1.90 0.98 0.04 0.00 0.00 177.00 178.24 3b4t n TYR 242 N -3.02 2.42 0.51 0.56 9.36 -1.26 -4.86 117.16 120.88 3b4t n TYR 242 Ca 0.14 -0.14 0.13 0.00 3.32 0.00 0.00 57.90 61.34 3b4t n TYR 242 Cb 0.50 -2.72 0.42 0.00 -0.63 0.00 0.00 39.34 36.91 3b4t n TYR 242 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 3b4t h PRO 243 N 9.47 0.00 0.00 2.98 0.13 -1.91 -3.45 132.00 139.22 3b4t h PRO 243 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 3b4t h PRO 243 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 3b4t h PRO 243 CO 0.94 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 179.12 3b4t n GLY 244 N 0.89 1.19 2.77 1.56 0.00 -1.26 -5.01 105.19 105.34 3b4t n GLY 244 Ca 0.04 -1.60 -0.29 0.00 0.00 0.00 0.00 46.02 44.17 3b4t n GLY 244 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b4t s VAL 245 N 0.89 1.72 0.32 1.61 1.01 -1.26 -5.11 120.40 119.58 3b4t s VAL 245 Ca 0.00 -2.83 -0.26 0.00 0.00 0.00 0.00 61.98 58.89 3b4t s VAL 245 Cb 0.00 -2.20 -0.14 0.00 0.00 0.00 0.00 36.38 34.04 3b4t s VAL 245 CO 0.00 -0.89 0.74 0.18 0.00 0.00 0.00 175.10 175.13 3b4t n LEU 246 N 3.34 0.53 0.00 3.92 4.77 -1.26 -5.20 117.00 123.10 3b4t n LEU 246 Ca 0.09 1.07 0.00 0.00 -0.03 0.00 0.00 56.01 57.14 3b4t n LEU 246 Cb 0.34 -1.16 0.00 0.00 -2.33 0.00 0.00 43.42 40.28 3b4t n LEU 246 CO 0.26 -2.27 0.18 -2.65 -1.33 0.00 0.00 177.39 171.59