#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b4t n LYS 2 N 0.00 3.44 -3.76 -1.46 5.02 -1.26 -4.87 118.16 115.27 3b4t n LYS 2 Ca 0.00 -3.04 -0.35 0.00 -2.02 0.00 0.00 58.31 52.90 3b4t n LYS 2 Cb 0.00 -2.21 -0.05 0.00 -0.02 0.00 0.00 35.03 32.75 3b4t n LYS 2 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3b4t s ARG 3 N -3.02 3.58 0.53 1.97 0.52 -1.26 -4.99 118.95 116.29 3b4t s ARG 3 Ca 0.55 -0.05 0.26 0.00 -0.52 0.00 0.00 55.73 55.98 3b4t s ARG 3 Cb 0.45 -3.11 1.41 0.00 0.52 0.00 0.00 34.95 34.21 3b4t s ARG 3 CO 0.13 0.68 1.98 1.49 0.02 0.00 0.00 175.30 179.60 3b4t h GLU 4 N 4.24 0.00 -0.54 3.54 4.81 -1.92 0.32 114.58 125.03 3b4t h GLU 4 Ca -0.51 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 3b4t h GLU 4 Cb 1.21 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.59 3b4t h GLU 4 CO 0.64 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 178.52 3b4t n ASP 5 N -4.34 3.97 0.00 1.04 5.68 -1.26 -4.95 116.55 116.68 3b4t n ASP 5 Ca 0.11 -2.28 0.00 0.00 -0.50 0.00 0.00 54.79 52.12 3b4t n ASP 5 Cb 0.65 -0.46 0.00 0.00 -1.14 0.00 0.00 41.12 40.17 3b4t n ASP 5 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3b4t n GLY 6 N 0.90 0.88 3.82 6.12 0.00 0.10 -5.04 105.19 111.98 3b4t n GLY 6 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.37 3.58 0.62 1.61 0.52 -1.26 -4.88 118.95 118.78 3b4t s ARG 7 Ca 0.00 1.09 -0.11 0.00 -0.52 0.00 0.00 55.73 56.19 3b4t s ARG 7 Cb 0.00 -2.08 -0.03 0.00 0.52 0.00 0.00 34.95 33.36 3b4t s ARG 7 CO 0.00 -0.59 1.03 -0.51 0.02 0.00 0.00 175.30 175.25 3b4t s LEU 8 N -4.35 3.21 0.36 2.53 1.43 -1.26 -4.02 118.68 116.58 3b4t s LEU 8 Ca 0.61 1.36 0.10 0.00 -1.03 0.00 0.00 54.13 55.18 3b4t s LEU 8 Cb -0.13 -4.38 0.85 0.00 0.03 0.00 0.00 46.19 42.55 3b4t s LEU 8 CO 0.35 -0.91 1.85 0.44 0.23 0.00 0.00 176.35 178.31 3b4t h ASP 9 N -0.33 0.64 0.04 2.29 3.32 -1.97 -1.65 116.42 118.76 3b4t h ASP 9 Ca -0.44 0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.66 3b4t h ASP 9 Cb 1.20 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.68 3b4t h ASP 9 CO 0.62 0.29 -0.10 0.00 -1.72 0.00 0.00 179.24 178.33 3b4t n HIS 10 N -4.59 0.00 -3.02 4.55 1.44 -1.26 -2.01 115.22 110.33 3b4t n HIS 10 Ca 0.19 0.00 -0.39 0.00 -2.01 0.00 0.00 57.72 55.51 3b4t n HIS 10 Cb 0.53 -0.03 -0.06 0.00 0.12 0.00 0.00 29.99 30.55 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 -2.16 4.51 0.54 -1.40 2.02 -0.62 -4.86 118.70 116.73 3b4t s GLU 11 Ca 0.31 1.09 -0.15 0.00 0.02 0.00 0.00 54.97 56.24 3b4t s GLU 11 Cb 0.20 -3.28 -0.07 0.00 0.10 0.00 0.00 34.13 31.09 3b4t s GLU 11 CO 0.39 0.53 1.00 -0.51 0.02 0.00 0.00 175.26 176.69 3b4t s LEU 12 N -0.94 3.53 0.83 1.80 1.43 -1.26 -4.74 118.68 119.33 3b4t s LEU 12 Ca 0.35 1.56 -0.11 0.00 -1.03 0.00 0.00 54.13 54.91 3b4t s LEU 12 Cb -0.22 -4.50 0.09 0.00 0.03 0.00 0.00 46.19 41.59 3b4t s LEU 12 CO 0.25 -0.70 1.10 -0.13 0.23 0.00 0.00 176.35 177.09 3b4t s ARG 13 N -4.29 1.79 0.16 1.70 0.52 -1.26 -4.94 118.95 112.62 3b4t s ARG 13 Ca 0.58 1.10 -0.33 0.00 -0.52 0.00 0.00 55.73 56.56 3b4t s ARG 13 Cb -0.11 -1.85 -0.13 0.00 0.52 0.00 0.00 34.95 33.39 3b4t s ARG 13 CO 0.36 -1.95 1.66 -2.30 0.02 0.00 0.00 175.30 173.10 3b4t n PRO 14 N -3.72 2.41 -3.94 3.54 -0.02 -1.26 -4.59 135.00 127.41 3b4t n PRO 14 Ca 0.09 0.87 -0.35 0.00 -2.02 0.00 0.00 63.50 62.09 3b4t n PRO 14 Cb 0.54 -2.68 -0.11 0.00 -0.02 0.00 0.00 33.50 31.23 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 1.34 4.67 -0.13 -1.45 1.01 -1.26 -0.87 120.40 123.71 3b4t s VAL 15 Ca 0.79 -0.07 0.02 0.00 0.00 0.00 0.00 61.98 62.72 3b4t s VAL 15 Cb -0.61 -3.13 0.01 0.00 0.00 0.00 0.00 36.38 32.66 3b4t s VAL 15 CO 0.37 0.42 -0.19 -0.63 0.00 0.00 0.00 175.10 175.07 3b4t s ILE 16 N 0.76 1.79 -0.19 2.22 1.01 -0.48 -4.97 121.20 121.34 3b4t s ILE 16 Ca 0.04 -0.82 0.01 0.00 0.00 0.00 0.00 60.65 59.87 3b4t s ILE 16 Cb -0.13 -1.61 0.02 0.00 0.01 0.00 0.00 42.46 40.75 3b4t s ILE 16 CO 0.02 0.50 -0.18 -0.63 0.00 0.00 0.00 174.94 174.65 3b4t s ILE 17 N 0.93 2.20 -0.30 2.92 1.01 -1.26 -0.35 121.20 126.34 3b4t s ILE 17 Ca -0.06 -0.94 0.03 0.00 0.00 0.00 0.00 60.65 59.69 3b4t s ILE 17 Cb -0.15 -1.95 0.08 0.00 0.01 0.00 0.00 42.46 40.45 3b4t s ILE 17 CO -0.02 0.49 -0.02 -0.89 0.00 0.00 0.00 174.94 174.50 3b4t s THR 18 N 1.30 2.26 0.66 2.92 2.01 -0.17 -4.97 115.64 119.66 3b4t s THR 18 Ca 0.04 -2.01 -0.11 0.00 0.31 0.00 0.00 61.69 59.92 3b4t s THR 18 Cb -0.14 -2.52 -0.01 0.00 0.01 0.00 0.00 72.50 69.85 3b4t s THR 18 CO -0.12 -0.34 1.05 -0.13 -0.69 0.00 0.00 174.62 174.40 3b4t s ARG 19 N 1.00 3.16 -1.48 4.92 0.52 -1.26 -1.38 118.95 124.42 3b4t s ARG 19 Ca 0.02 0.93 -0.06 0.00 -0.52 0.00 0.00 55.73 56.10 3b4t s ARG 19 Cb -0.20 -2.02 0.02 0.00 0.52 0.00 0.00 34.95 33.28 3b4t s ARG 19 CO -0.06 -0.93 0.62 0.41 0.02 0.00 0.00 175.30 175.36 3b4t n GLY 20 N -2.06 -0.52 0.30 -3.53 0.00 0.11 -4.89 105.19 94.61 3b4t n GLY 20 Ca 0.07 0.13 -0.04 0.00 0.00 0.00 0.00 46.02 46.18 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 -1.38 0.97 -2.16 1.61 3.57 -1.30 -3.41 116.94 114.84 3b4t h PHE 21 Ca -0.51 0.02 -0.61 0.00 3.53 0.00 0.00 57.97 60.40 3b4t h PHE 21 Cb 1.35 -0.33 -0.14 0.00 2.79 0.00 0.00 35.95 39.62 3b4t h PHE 21 CO 0.56 0.61 -0.74 0.95 -2.23 0.00 0.00 178.31 177.46 3b4t s THR 22 N -6.13 2.46 -0.41 4.41 -4.23 -1.26 -5.08 115.64 105.40 3b4t s THR 22 Ca -0.13 -2.36 0.13 0.00 -1.18 0.00 0.00 61.69 58.14 3b4t s THR 22 Cb 0.15 -2.37 -0.16 0.00 1.34 0.00 0.00 72.50 71.46 3b4t s THR 22 CO 0.78 -0.37 0.46 -0.62 -0.54 0.00 0.00 174.62 174.33 3b4t n GLU 23 N -0.66 2.05 -0.05 3.99 1.02 -1.26 -4.58 120.64 121.15 3b4t n GLU 23 Ca -0.05 -0.04 -0.13 0.00 -0.02 0.00 0.00 57.16 56.92 3b4t n GLU 23 Cb 0.61 -1.16 -0.07 0.00 -0.02 0.00 0.00 31.44 30.79 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 0.33 -4.23 1.62 2.35 -1.98 -3.45 115.58 110.23 3b4t h ASN 24 Ca 0.00 -0.45 -0.49 0.00 -0.55 0.00 0.00 56.30 54.81 3b4t h ASN 24 Cb 0.39 -0.09 0.06 0.00 0.05 0.00 0.00 38.32 38.74 3b4t h ASN 24 CO 0.00 0.71 0.38 -2.84 -1.65 0.00 0.00 177.43 174.03 3b4t s PRO 25 N -4.42 3.32 0.39 0.81 0.02 -1.26 -4.95 135.00 128.91 3b4t s PRO 25 Ca -0.14 1.12 0.09 0.00 0.02 0.00 0.00 61.00 62.08 3b4t s PRO 25 Cb 0.05 -2.04 0.79 0.00 0.02 0.00 0.00 34.50 33.32 3b4t s PRO 25 CO 0.74 -0.80 1.94 0.00 -0.33 0.00 0.00 177.00 178.55 3b4t h ALA 26 N 0.25 1.54 -3.94 -1.55 0.00 -1.79 -3.41 119.26 110.36 3b4t h ALA 26 Ca -0.46 -0.17 -0.40 0.00 0.00 0.00 0.00 54.91 53.88 3b4t h ALA 26 Cb 1.21 -0.10 -0.30 0.00 0.00 0.00 0.00 17.79 18.61 3b4t h ALA 26 CO 0.58 0.33 -0.78 0.20 0.00 0.00 0.00 179.25 179.58 3b4t s GLY 27 N -3.96 0.45 -0.28 0.00 0.00 -0.90 -3.93 107.32 98.70 3b4t s GLY 27 Ca -0.06 -0.34 0.01 0.00 0.00 0.00 0.00 44.72 44.32 3b4t s GLY 27 CO 0.73 -0.21 0.43 -0.45 0.00 0.00 0.00 173.10 173.61 3b4t s SER 28 N -0.04 0.02 -0.14 1.64 0.15 -1.26 -0.46 113.70 113.61 3b4t s SER 28 Ca 0.01 -0.06 0.01 0.00 0.70 0.00 0.00 55.95 56.61 3b4t s SER 28 Cb -0.05 1.28 0.02 0.00 -1.71 0.00 0.00 66.02 65.55 3b4t s SER 28 CO -0.00 -0.33 -0.16 -0.69 1.20 0.00 0.00 173.24 173.26 3b4t s VAL 29 N 2.60 1.67 -0.32 4.45 1.01 0.67 0.07 120.40 130.55 3b4t s VAL 29 Ca 0.11 -0.72 -0.19 0.00 0.00 0.00 0.00 61.98 61.19 3b4t s VAL 29 Cb -0.13 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.71 3b4t s VAL 29 CO -0.25 0.47 0.57 -0.22 0.00 0.00 0.00 175.10 175.67 3b4t s LEU 30 N 1.20 4.21 -0.01 3.92 2.96 -0.48 0.36 118.68 130.84 3b4t s LEU 30 Ca -0.01 0.24 0.04 0.00 -0.22 0.00 0.00 54.13 54.18 3b4t s LEU 30 Cb -0.14 -2.70 -0.03 0.00 0.50 0.00 0.00 46.19 43.82 3b4t s LEU 30 CO -0.07 -0.46 -0.11 -0.51 -1.32 0.00 0.00 176.35 173.87 3b4t s ILE 31 N 2.50 3.29 -0.08 6.68 2.07 -0.36 -1.00 121.20 134.30 3b4t s ILE 31 Ca 0.22 -0.81 0.01 0.00 -1.41 0.00 0.00 60.65 58.66 3b4t s ILE 31 Cb -0.15 -2.37 0.02 0.00 0.13 0.00 0.00 42.46 40.09 3b4t s ILE 31 CO 0.12 0.47 -0.08 -1.61 -1.91 0.00 0.00 174.94 171.94 3b4t s GLU 32 N -1.13 1.37 -0.55 3.50 2.02 0.52 -1.53 118.70 122.89 3b4t s GLU 32 Ca 0.14 -0.24 -0.08 0.00 0.02 0.00 0.00 54.97 54.81 3b4t s GLU 32 Cb -0.11 -1.34 0.14 0.00 0.10 0.00 0.00 34.13 32.92 3b4t s GLU 32 CO 0.04 -0.15 0.42 -0.06 0.02 0.00 0.00 175.26 175.54 3b4t s PHE 33 N 1.28 3.48 0.00 1.61 0.40 -0.62 -1.39 117.98 122.74 3b4t s PHE 33 Ca -0.04 -2.08 0.00 0.00 -0.60 0.00 0.00 56.93 54.22 3b4t s PHE 33 Cb -0.14 -3.48 0.00 0.00 0.51 0.00 0.00 43.02 39.91 3b4t s PHE 33 CO -0.03 -0.96 0.00 0.41 0.70 0.00 0.00 175.22 175.34 3b4t n GLY 34 N 4.48 3.59 0.01 4.36 0.00 -0.05 -1.54 105.19 116.03 3b4t n GLY 34 Ca -0.01 0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.25 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 0.05 -2.46 1.61 8.25 -1.26 -4.80 115.22 130.61 3b4t n HIS 35 Ca 0.00 0.01 -0.41 0.00 -0.26 0.00 0.00 57.72 57.06 3b4t n HIS 35 Cb 0.00 -0.45 -0.03 0.00 1.12 0.00 0.00 29.99 30.63 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 -3.01 3.95 -0.06 1.59 2.01 -0.59 -4.65 115.64 114.87 3b4t s THR 36 Ca 0.13 1.53 0.00 0.00 0.31 0.00 0.00 61.69 63.66 3b4t s THR 36 Cb 0.18 -3.98 0.02 0.00 0.01 0.00 0.00 72.50 68.74 3b4t s THR 36 CO 0.59 0.19 -0.03 -0.54 -0.69 0.00 0.00 174.62 174.14 3b4t s LYS 37 N 0.32 0.87 -0.04 4.92 1.02 -0.01 -1.59 119.74 125.23 3b4t s LYS 37 Ca 0.54 -0.06 0.01 0.00 0.02 0.00 0.00 55.97 56.48 3b4t s LYS 37 Cb -0.29 -1.00 0.02 0.00 -0.52 0.00 0.00 37.83 36.04 3b4t s LYS 37 CO 0.32 -0.18 -0.05 0.08 -0.92 0.00 0.00 175.35 174.61 3b4t s VAL 38 N 1.38 0.55 -0.36 3.17 1.01 -0.58 -0.11 120.40 125.47 3b4t s VAL 38 Ca -0.03 -0.14 -0.18 0.00 0.00 0.00 0.00 61.98 61.62 3b4t s VAL 38 Cb -0.13 -0.57 -0.00 0.00 0.00 0.00 0.00 36.38 35.68 3b4t s VAL 38 CO -0.03 0.22 0.53 -0.22 0.00 0.00 0.00 175.10 175.61 3b4t s LEU 39 N 0.83 4.36 -0.30 3.92 2.96 -0.12 -1.22 118.68 129.11 3b4t s LEU 39 Ca -0.11 -0.04 -0.05 0.00 -0.22 0.00 0.00 54.13 53.71 3b4t s LEU 39 Cb -0.14 -2.61 0.03 0.00 0.50 0.00 0.00 46.19 43.97 3b4t s LEU 39 CO 0.00 -0.51 0.04 0.00 -1.32 0.00 0.00 176.35 174.57 3b4t s THR 41 N 1.39 3.45 -0.22 0.00 -4.23 -0.08 -0.23 115.64 115.72 3b4t s THR 41 Ca -0.01 -1.79 -0.02 0.00 -1.18 0.00 0.00 61.69 58.69 3b4t s THR 41 Cb -0.18 -2.81 0.07 0.00 1.34 0.00 0.00 72.50 70.92 3b4t s THR 41 CO 0.00 -0.29 0.04 0.00 -0.54 0.00 0.00 174.62 173.84 3b4t s ALA 42 N -2.13 1.12 -0.19 3.99 0.00 0.39 -1.42 121.76 123.52 3b4t s ALA 42 Ca 0.30 -0.90 -0.09 0.00 0.00 0.00 0.00 51.96 51.27 3b4t s ALA 42 Cb -0.07 -1.27 -0.05 0.00 0.00 0.00 0.00 23.12 21.73 3b4t s ALA 42 CO 0.19 -1.27 0.12 -1.12 0.00 0.00 0.00 175.76 173.67 3b4t s SER 43 N 1.81 6.11 -0.11 0.00 0.01 -0.24 -2.12 113.70 119.16 3b4t s SER 43 Ca 0.01 0.23 -0.09 0.00 1.31 0.00 0.00 55.95 57.40 3b4t s SER 43 Cb -0.17 -2.06 -0.04 0.00 0.21 0.00 0.00 66.02 63.96 3b4t s SER 43 CO -0.12 0.21 0.19 -0.69 0.41 0.00 0.00 173.24 173.24 3b4t s VAL 44 N 0.20 5.41 0.13 3.43 1.01 -1.26 -0.64 120.40 128.67 3b4t s VAL 44 Ca 0.08 0.34 0.06 0.00 0.00 0.00 0.00 61.98 62.46 3b4t s VAL 44 Cb -0.11 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 3b4t s VAL 44 CO -0.01 0.59 -0.15 -0.89 0.00 0.00 0.00 175.10 174.64 3b4t s THR 45 N -0.87 1.40 -0.27 3.92 2.01 -0.37 -5.02 115.64 116.44 3b4t s THR 45 Ca 0.16 -1.73 -0.22 0.00 0.31 0.00 0.00 61.69 60.20 3b4t s THR 45 Cb -0.13 -1.57 -0.01 0.00 0.01 0.00 0.00 72.50 70.81 3b4t s THR 45 CO 0.05 -0.39 0.74 -0.70 -0.69 0.00 0.00 174.62 173.63 3b4t s GLU 46 N -2.66 4.07 0.22 4.92 2.56 -1.26 -2.51 118.70 124.05 3b4t s GLU 46 Ca 0.10 0.65 0.00 0.00 0.00 0.00 0.00 54.97 55.72 3b4t s GLU 46 Cb -0.05 -3.68 0.00 0.00 2.00 0.00 0.00 34.13 32.40 3b4t s GLU 46 CO 0.03 -0.54 0.00 0.41 -0.56 0.00 0.00 175.26 174.61 3b4t n GLY 47 N 4.08 -1.77 3.11 -1.50 0.00 -0.48 -4.90 105.19 103.73 3b4t n GLY 47 Ca 0.02 -1.92 -0.11 0.00 0.00 0.00 0.00 46.02 44.01 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 0.09 -1.07 1.61 1.01 -1.26 -1.76 120.40 119.02 3b4t s VAL 48 Ca 0.00 -0.72 -0.02 0.00 0.00 0.00 0.00 61.98 61.24 3b4t s VAL 48 Cb 0.00 -0.47 0.29 0.00 0.00 0.00 0.00 36.38 36.20 3b4t s VAL 48 CO 0.00 -0.39 1.85 -0.81 0.00 0.00 0.00 175.10 175.75 3b4t n PRO 49 N 1.38 5.20 0.00 2.72 -0.05 -1.26 -5.09 135.00 137.90 3b4t n PRO 49 Ca -0.23 -4.50 0.00 0.00 -0.05 0.00 0.00 63.50 58.73 3b4t n PRO 49 Cb 0.56 -2.50 0.00 0.00 -0.05 0.00 0.00 33.50 31.50 3b4t n PRO 49 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 3b4t n ALA 54 N 0.40 0.00 -0.09 0.55 0.00 -1.26 -5.14 120.51 114.97 3b4t n ALA 54 Ca 0.46 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.67 3b4t n ALA 54 Cb 0.27 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.60 3b4t n ALA 54 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3b4t n THR 55 N 0.00 1.59 0.00 0.00 -2.24 -1.26 -4.99 114.28 107.38 3b4t n THR 55 Ca 0.00 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 3b4t n THR 55 Cb 0.03 -1.79 0.00 0.00 -2.10 0.00 0.00 70.33 66.47 3b4t n THR 55 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3b4t n GLY 56 N 1.71 -0.54 3.44 3.38 0.00 -1.26 -5.15 105.19 106.78 3b4t n GLY 56 Ca -0.41 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.28 3b4t n GLY 56 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3b4t s LEU 57 N 0.00 2.73 0.00 0.99 1.02 -1.26 -4.17 118.68 117.99 3b4t s LEU 57 Ca 0.00 -0.24 -0.17 0.00 0.02 0.00 0.00 54.13 53.74 3b4t s LEU 57 Cb 0.00 -1.58 0.26 0.00 0.02 0.00 0.00 46.19 44.89 3b4t s LEU 57 CO 0.00 0.28 0.70 0.61 0.02 0.00 0.00 176.35 177.96 3b4t n GLY 58 N 2.77 -3.44 3.12 -3.19 0.00 0.31 -4.74 105.19 100.01 3b4t n GLY 58 Ca -0.18 -1.35 -0.11 0.00 0.00 0.00 0.00 46.02 44.38 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 -2.05 -0.00 -0.09 1.61 -0.00 -0.71 -4.85 118.94 112.84 3b4t s TRP 59 Ca 0.50 -0.04 0.02 0.00 -0.00 0.00 0.00 56.10 56.58 3b4t s TRP 59 Cb -0.07 -0.02 0.02 0.00 -0.00 0.00 0.00 33.47 33.39 3b4t s TRP 59 CO 0.40 -0.28 -0.12 -1.17 -0.00 0.00 0.00 176.95 175.78 3b4t s LEU 60 N -1.25 1.59 0.22 5.86 0.20 -1.26 -0.30 118.68 123.73 3b4t s LEU 60 Ca -0.13 -0.35 0.10 0.00 0.69 0.00 0.00 54.13 54.44 3b4t s LEU 60 Cb -0.07 -0.92 -0.04 0.00 -0.43 0.00 0.00 46.19 44.72 3b4t s LEU 60 CO 0.02 -0.00 -0.12 0.42 -0.29 0.00 0.00 176.35 176.38 3b4t s THR 61 N 0.97 2.99 0.00 3.68 -4.23 -0.62 -4.96 115.64 113.47 3b4t s THR 61 Ca -0.08 -1.90 0.02 0.00 -1.18 0.00 0.00 61.69 58.54 3b4t s THR 61 Cb -0.15 -2.52 -0.01 0.00 1.34 0.00 0.00 72.50 71.17 3b4t s THR 61 CO -0.00 -0.22 -0.06 0.00 -0.54 0.00 0.00 174.62 173.80 3b4t s ALA 62 N -1.97 0.46 -0.01 3.99 0.00 -1.26 -0.16 121.76 122.80 3b4t s ALA 62 Ca 0.27 -0.28 0.01 0.00 0.00 0.00 0.00 51.96 51.96 3b4t s ALA 62 Cb -0.07 -0.10 0.00 0.00 0.00 0.00 0.00 23.12 22.95 3b4t s ALA 62 CO 0.15 0.10 -0.04 -1.21 0.00 0.00 0.00 175.76 174.77 3b4t s GLU 63 N -0.26 0.39 -0.03 0.00 2.02 0.02 -4.62 118.70 116.23 3b4t s GLU 63 Ca 0.01 -0.11 0.06 0.00 0.02 0.00 0.00 54.97 54.95 3b4t s GLU 63 Cb -0.03 -0.41 -0.01 0.00 0.10 0.00 0.00 34.13 33.78 3b4t s GLU 63 CO -0.00 0.04 -0.23 -0.47 0.02 0.00 0.00 175.26 174.62 3b4t s TYR 64 N 0.18 2.16 0.05 1.61 5.04 -1.26 -0.39 117.35 124.74 3b4t s TYR 64 Ca -0.02 -0.52 -0.11 0.00 -2.44 0.00 0.00 57.07 53.99 3b4t s TYR 64 Cb -0.05 -1.41 0.01 0.00 0.35 0.00 0.00 41.96 40.86 3b4t s TYR 64 CO -0.00 -0.11 0.24 0.00 -1.34 0.00 0.00 175.55 174.33 3b4t s ALA 65 N -0.34 -0.48 -0.17 3.97 0.00 -0.15 -4.85 121.76 119.76 3b4t s ALA 65 Ca 0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 51.96 51.77 3b4t s ALA 65 Cb -0.11 0.33 -0.01 0.00 0.00 0.00 0.00 23.12 23.33 3b4t s ALA 65 CO 0.01 -0.40 -0.11 -1.64 0.00 0.00 0.00 175.76 173.62 3b4t s MET 66 N -2.73 3.33 0.48 0.00 1.00 -1.26 -0.39 119.30 119.73 3b4t s MET 66 Ca -0.04 -0.68 -0.24 0.00 0.00 0.00 0.00 55.69 54.73 3b4t s MET 66 Cb -0.00 -2.75 -0.07 0.00 0.00 0.00 0.00 34.83 32.01 3b4t s MET 66 CO -0.05 0.03 1.38 1.28 0.00 0.00 0.00 175.02 177.67 3b4t n LEU 67 N 4.07 5.11 -0.36 -0.03 4.77 -0.70 -4.88 117.00 124.98 3b4t n LEU 67 Ca -0.18 1.07 0.12 0.00 -0.03 0.00 0.00 56.01 56.98 3b4t n LEU 67 Cb 0.52 -1.58 0.30 0.00 -2.33 0.00 0.00 43.42 40.33 3b4t n LEU 67 CO 0.29 -0.38 1.20 -0.65 -1.33 0.00 0.00 177.39 176.53 3b4t h PRO 68 N 1.96 0.80 -0.07 3.23 0.11 -1.90 -0.53 132.00 135.60 3b4t h PRO 68 Ca -0.50 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.56 3b4t h PRO 68 Cb 1.28 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3b4t h PRO 68 CO 0.59 0.53 0.00 -1.13 -0.21 0.00 0.00 178.00 177.78 3b4t n SER 69 N -4.73 1.20 -0.22 -2.05 3.41 -1.26 -0.97 113.62 109.00 3b4t n SER 69 Ca 0.22 -1.52 -0.09 0.00 -0.26 0.00 0.00 58.87 57.23 3b4t n SER 69 Cb 0.52 -0.04 0.03 0.00 -0.26 0.00 0.00 64.21 64.45 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 4.09 0.82 -2.36 7.33 0.00 -1.23 -3.44 119.26 124.47 3b4t h ALA 70 Ca 0.00 -0.29 -0.50 0.00 0.00 0.00 0.00 54.91 54.12 3b4t h ALA 70 Cb 0.37 -0.23 0.10 0.00 0.00 0.00 0.00 17.79 18.03 3b4t h ALA 70 CO 0.00 0.63 0.35 0.95 0.00 0.00 0.00 179.25 181.18 3b4t s THR 71 N -5.11 3.62 0.14 0.00 -4.23 -1.26 -1.36 115.64 107.45 3b4t s THR 71 Ca -0.12 0.53 -0.19 0.00 -1.18 0.00 0.00 61.69 60.73 3b4t s THR 71 Cb 0.13 -3.24 0.01 0.00 1.34 0.00 0.00 72.50 70.74 3b4t s THR 71 CO 0.85 -0.69 1.70 0.45 -0.54 0.00 0.00 174.62 176.39 3b4t h HIS 72 N -0.89 -0.09 -3.29 3.99 3.86 -1.86 -3.37 115.15 113.50 3b4t h HIS 72 Ca -0.45 0.02 -0.63 0.00 -1.16 0.00 0.00 60.37 58.16 3b4t h HIS 72 Cb 1.23 0.08 -0.19 0.00 1.06 0.00 0.00 27.41 29.59 3b4t h HIS 72 CO 0.56 -0.09 -0.62 -1.54 0.86 0.00 0.00 177.93 177.10 3b4t s SER 73 N -5.22 5.16 0.14 2.45 1.04 -1.26 -5.06 113.70 110.94 3b4t s SER 73 Ca -0.13 -0.04 -0.34 0.00 0.48 0.00 0.00 55.95 55.92 3b4t s SER 73 Cb 0.11 -1.86 -0.16 0.00 0.10 0.00 0.00 66.02 64.21 3b4t s SER 73 CO 0.69 0.17 1.18 -1.14 0.98 0.00 0.00 173.24 175.12 3b4t n ARG 74 N 3.51 1.03 -4.07 4.02 0.63 -1.26 -4.98 116.66 115.54 3b4t n ARG 74 Ca -0.17 0.37 -0.23 0.00 -0.92 0.00 0.00 57.85 56.90 3b4t n ARG 74 Cb 0.52 -1.88 -0.04 0.00 0.45 0.00 0.00 32.46 31.51 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 0.08 5.73 0.36 6.15 1.04 -0.14 -5.01 113.70 121.91 3b4t s SER 75 Ca 0.77 -0.15 -0.22 0.00 0.48 0.00 0.00 55.95 56.83 3b4t s SER 75 Cb -0.91 -1.53 -0.10 0.00 0.10 0.00 0.00 66.02 63.58 3b4t s SER 75 CO 0.51 -0.03 0.91 -1.81 0.98 0.00 0.00 173.24 173.81 3b4t s ASP 76 N -3.74 7.10 0.36 7.02 1.01 -1.26 -4.41 116.67 122.75 3b4t s ASP 76 Ca 0.33 1.70 -0.28 0.00 0.71 0.00 0.00 52.55 55.01 3b4t s ASP 76 Cb -0.09 -2.53 -0.10 0.00 1.01 0.00 0.00 42.92 41.21 3b4t s ASP 76 CO 0.26 -0.20 1.35 -0.13 0.21 0.00 0.00 175.17 176.66 3b4t s ARG 77 N -2.62 4.19 0.37 8.23 0.52 -1.26 -4.91 118.95 123.47 3b4t s ARG 77 Ca 0.55 2.30 0.16 0.00 -0.52 0.00 0.00 55.73 58.22 3b4t s ARG 77 Cb -0.14 -2.97 0.72 0.00 0.52 0.00 0.00 34.95 33.09 3b4t s ARG 77 CO 0.18 -0.36 1.78 0.93 0.02 0.00 0.00 175.30 177.86 3b4t h GLU 78 N 3.10 0.00 -0.13 3.54 5.08 -1.93 -1.91 114.58 122.33 3b4t h GLU 78 Ca -0.50 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 57.76 3b4t h GLU 78 Cb 1.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 3b4t h GLU 78 CO 0.64 0.39 -0.36 0.66 -1.00 0.00 0.00 179.01 179.35 3b4t h SER 79 N 0.00 0.28 0.06 1.42 4.64 -1.91 0.60 113.55 118.64 3b4t h SER 79 Ca -0.00 -0.11 -0.21 0.00 -0.47 0.00 0.00 61.79 61.00 3b4t h SER 79 Cb 0.78 -0.08 0.02 0.00 -0.31 0.00 0.00 62.40 62.82 3b4t h SER 79 CO 0.05 0.62 -0.85 0.58 -0.87 0.00 0.00 176.83 176.37 3b4t h VAL 80 N 0.24 1.40 0.00 0.95 2.07 -1.84 -3.09 116.25 115.98 3b4t h VAL 80 Ca 0.03 -2.30 -0.03 0.00 0.82 0.00 0.00 66.70 65.22 3b4t h VAL 80 Cb 0.75 2.76 -0.00 0.00 -1.52 0.00 0.00 31.29 33.27 3b4t h VAL 80 CO 0.06 0.67 -0.16 0.03 0.02 0.00 0.00 177.57 178.19 3b4t h ARG 81 N -0.04 0.00 -1.34 1.57 3.08 -1.33 -3.47 114.38 112.85 3b4t h ARG 81 Ca -0.12 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.88 3b4t h ARG 81 Cb 1.57 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.64 3b4t h ARG 81 CO 0.16 0.16 -0.07 0.41 -1.07 0.00 0.00 179.97 179.57 3b4t n GLY 82 N -0.85 0.73 3.64 0.04 0.00 0.12 -5.05 105.19 103.83 3b4t n GLY 82 Ca -0.02 -0.61 -0.05 0.00 0.00 0.00 0.00 46.02 45.34 3b4t n GLY 82 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3b4t s ARG 83 N -4.99 0.36 0.08 1.61 3.52 -0.71 -5.04 118.95 113.78 3b4t s ARG 83 Ca 0.05 0.51 -0.28 0.00 -0.13 0.00 0.00 55.73 55.89 3b4t s ARG 83 Cb -0.02 0.13 -0.06 0.00 -1.56 0.00 0.00 34.95 33.45 3b4t s ARG 83 CO 0.07 -0.06 0.88 -0.51 -0.81 0.00 0.00 175.30 174.87 3b4t s LEU 84 N 0.68 4.47 0.56 -0.88 1.43 -1.26 -4.67 118.68 119.01 3b4t s LEU 84 Ca -0.02 1.65 -0.18 0.00 -1.03 0.00 0.00 54.13 54.55 3b4t s LEU 84 Cb -0.04 -3.45 -0.05 0.00 0.03 0.00 0.00 46.19 42.68 3b4t s LEU 84 CO -0.11 -0.04 1.10 -0.94 0.23 0.00 0.00 176.35 176.58 3b4t s SER 85 N 0.02 5.77 0.33 2.29 1.04 -1.26 -4.92 113.70 116.97 3b4t s SER 85 Ca 0.44 2.04 0.01 0.00 0.48 0.00 0.00 55.95 58.92 3b4t s SER 85 Cb -0.22 -2.56 0.56 0.00 0.10 0.00 0.00 66.02 63.90 3b4t s SER 85 CO 0.27 -1.18 1.98 1.23 0.98 0.00 0.00 173.24 176.52 3b4t h GLY 86 N 0.98 1.05 0.84 7.32 0.00 -1.99 -1.94 103.07 109.33 3b4t h GLY 86 Ca -0.49 -0.38 0.03 0.00 0.00 0.00 0.00 47.33 46.49 3b4t h GLY 86 CO 0.57 0.35 0.30 -0.09 0.00 0.00 0.00 176.54 177.67 3b4t h ARG 87 N 0.97 0.58 0.09 4.80 2.43 -1.99 -0.22 114.38 121.04 3b4t h ARG 87 Ca 0.29 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.42 3b4t h ARG 87 Cb -0.04 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.38 3b4t h ARG 87 CO -0.07 0.38 -0.04 1.15 -1.51 0.00 0.00 179.97 179.88 3b4t h THR 88 N 0.60 0.94 -0.67 0.20 2.02 -1.72 -1.60 112.91 112.67 3b4t h THR 88 Ca 0.22 -0.07 -0.05 0.00 0.77 0.00 0.00 66.41 67.27 3b4t h THR 88 Cb 0.05 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.42 3b4t h THR 88 CO -0.11 0.02 0.22 1.56 0.37 0.00 0.00 175.52 177.58 3b4t h GLN 89 N -0.15 1.02 0.05 6.66 4.20 -1.28 0.27 115.11 125.88 3b4t h GLN 89 Ca -0.01 -0.20 0.01 0.00 0.06 0.00 0.00 58.65 58.51 3b4t h GLN 89 Cb 0.12 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 3b4t h GLN 89 CO 0.02 0.86 -0.09 1.49 -0.67 0.00 0.00 178.83 180.44 3b4t h GLU 90 N 0.99 -0.17 -0.41 1.46 4.81 -0.84 -1.66 114.58 118.75 3b4t h GLU 90 Ca 0.22 0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.36 3b4t h GLU 90 Cb 0.26 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 3b4t h GLU 90 CO -0.01 -0.12 -0.16 0.82 -0.73 0.00 0.00 179.01 178.81 3b4t h ILE 91 N -0.18 1.28 -0.74 2.32 2.04 -1.12 -2.53 117.51 118.58 3b4t h ILE 91 Ca 0.02 -1.29 0.07 0.00 1.00 0.00 0.00 64.86 64.65 3b4t h ILE 91 Cb 0.19 1.24 -0.06 0.00 -0.74 0.00 0.00 36.82 37.46 3b4t h ILE 91 CO -0.05 0.44 0.43 0.28 0.00 0.00 0.00 178.15 179.24 3b4t h SER 92 N 0.65 0.64 -0.35 1.72 0.02 -0.82 -0.79 113.55 114.62 3b4t h SER 92 Ca 0.10 0.03 -0.15 0.00 -0.84 0.00 0.00 61.79 60.93 3b4t h SER 92 Cb 0.72 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.15 3b4t h SER 92 CO 0.05 0.40 -0.36 0.03 -1.14 0.00 0.00 176.83 175.82 3b4t h ARG 93 N 0.77 0.86 -0.57 3.45 3.08 -1.25 -2.86 114.38 117.87 3b4t h ARG 93 Ca 0.34 -0.46 -0.03 0.00 0.07 0.00 0.00 59.98 59.89 3b4t h ARG 93 Cb 0.22 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.26 3b4t h ARG 93 CO -0.19 1.10 0.23 1.25 -1.07 0.00 0.00 179.97 181.29 3b4t h LEU 94 N 0.66 0.79 -0.33 3.04 5.85 -1.05 -1.48 115.31 122.79 3b4t h LEU 94 Ca 0.06 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.61 3b4t h LEU 94 Cb 0.95 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 3b4t h LEU 94 CO 0.09 0.74 0.20 0.40 -0.34 0.00 0.00 178.44 179.53 3b4t h ILE 95 N 0.78 1.05 -0.55 4.05 2.04 -1.14 0.14 117.51 123.89 3b4t h ILE 95 Ca 0.19 -0.14 -0.06 0.00 1.00 0.00 0.00 64.86 65.85 3b4t h ILE 95 Cb 0.20 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 3b4t h ILE 95 CO -0.02 0.08 0.10 1.23 0.00 0.00 0.00 178.15 179.54 3b4t h GLY 96 N 0.41 0.97 1.05 5.37 0.00 -1.41 -1.86 103.07 107.60 3b4t h GLY 96 Ca 0.13 -0.63 -0.05 0.00 0.00 0.00 0.00 47.33 46.77 3b4t h GLY 96 CO -0.05 0.59 0.27 -0.09 0.00 0.00 0.00 176.54 177.25 3b4t h ARG 97 N 0.79 1.15 -0.35 4.80 2.43 -1.04 -1.96 114.38 120.20 3b4t h ARG 97 Ca 0.17 -0.23 -0.05 0.00 -0.81 0.00 0.00 59.98 59.06 3b4t h ARG 97 Cb 0.39 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 3b4t h ARG 97 CO 0.01 0.96 0.04 0.77 -1.51 0.00 0.00 179.97 180.23 3b4t h SER 98 N 1.10 0.58 0.23 -3.80 0.02 -0.46 -3.07 113.55 108.15 3b4t h SER 98 Ca 0.25 -0.28 -0.15 0.00 -0.84 0.00 0.00 61.79 60.77 3b4t h SER 98 Cb 0.27 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 3b4t h SER 98 CO -0.01 0.71 -0.58 -0.07 -1.14 0.00 0.00 176.83 175.74 3b4t h LEU 99 N 0.42 0.40 -1.78 5.07 3.38 -1.27 -3.00 115.31 118.54 3b4t h LEU 99 Ca 0.10 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 3b4t h LEU 99 Cb 0.40 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 3b4t h LEU 99 CO 0.01 0.89 -0.01 0.03 0.09 0.00 0.00 178.44 179.45 3b4t h ARG 100 N 0.27 0.00 0.00 1.13 3.08 -1.33 -2.71 114.38 114.82 3b4t h ARG 100 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3b4t h ARG 100 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.14 3b4t h ARG 100 CO 0.10 0.01 0.00 0.00 -1.07 0.00 0.00 179.97 179.01 3b4t h ALA 101 N 1.99 1.00 0.00 0.04 0.00 -1.43 -3.07 119.26 117.79 3b4t h ALA 101 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3b4t h ALA 101 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3b4t h ALA 101 CO 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 179.25 179.25 3b4t s ILE 103 N -1.05 1.78 -0.69 0.00 1.10 -1.16 -0.83 121.20 120.36 3b4t s ILE 103 Ca 0.02 -0.85 -0.23 0.00 -0.51 0.00 0.00 60.65 59.08 3b4t s ILE 103 Cb 0.02 -1.56 0.07 0.00 0.15 0.00 0.00 42.46 41.14 3b4t s ILE 103 CO 0.00 0.50 1.01 -0.62 -2.11 0.00 0.00 174.94 173.72 3b4t s ASP 104 N 0.46 6.20 0.44 4.50 -1.08 0.14 -4.89 116.67 122.44 3b4t s ASP 104 Ca -0.17 -1.00 0.21 0.00 -0.52 0.00 0.00 52.55 51.07 3b4t s ASP 104 Cb -0.17 -2.43 1.04 0.00 -1.46 0.00 0.00 42.92 39.89 3b4t s ASP 104 CO 0.07 -1.47 1.91 -0.07 0.52 0.00 0.00 175.17 176.13 3b4t h LEU 105 N 11.50 0.00 0.10 -1.34 3.38 -1.89 -0.22 115.31 126.84 3b4t h LEU 105 Ca -0.26 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 3b4t h LEU 105 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 3b4t h LEU 105 CO 1.19 0.25 -0.05 0.00 0.09 0.00 0.00 178.44 179.92 3b4t h ALA 106 N 1.75 -0.14 0.00 1.53 0.00 -1.87 0.94 119.26 121.48 3b4t h ALA 106 Ca -0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3b4t h ALA 106 Cb 0.58 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3b4t h ALA 106 CO 0.03 -0.30 0.00 0.00 0.00 0.00 0.00 179.25 178.98 3b4t n ALA 107 N -2.46 1.29 0.10 0.00 0.00 -1.01 -0.90 120.51 117.53 3b4t n ALA 107 Ca -0.08 0.04 -0.03 0.00 0.00 0.00 0.00 53.44 53.37 3b4t n ALA 107 Cb 0.27 -1.19 -0.05 0.00 0.00 0.00 0.00 19.45 18.48 3b4t n ALA 107 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3b4t h LEU 108 N 0.00 0.00 0.00 0.00 5.85 -0.89 0.15 115.31 120.41 3b4t h LEU 108 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3b4t h LEU 108 Cb 0.13 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.16 3b4t h LEU 108 CO 0.00 0.77 0.00 0.61 -0.34 0.00 0.00 178.44 179.48 3b4t n GLY 109 N 1.29 -0.92 2.64 3.75 0.00 -0.08 -3.94 105.19 107.94 3b4t n GLY 109 Ca 0.01 -1.67 -0.41 0.00 0.00 0.00 0.00 46.02 43.95 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 -0.89 2.95 -4.57 1.61 1.02 -1.26 -1.20 120.64 118.30 3b4t n GLU 110 Ca 0.00 -2.41 -0.26 0.00 -0.02 0.00 0.00 57.16 54.47 3b4t n GLU 110 Cb 0.00 -3.11 -0.14 0.00 -0.02 0.00 0.00 31.44 28.17 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 3.07 2.67 -0.12 1.62 0.01 -1.26 -1.38 114.94 119.55 3b4t s ASN 111 Ca 0.53 -0.59 -0.00 0.00 -0.71 0.00 0.00 52.86 52.09 3b4t s ASN 111 Cb 0.15 -0.20 -0.02 0.00 0.41 0.00 0.00 41.25 41.59 3b4t s ASN 111 CO -0.07 0.15 -0.11 0.28 -1.51 0.00 0.00 177.10 175.85 3b4t s THR 112 N -0.91 3.25 -0.21 1.60 -1.32 -0.72 -1.73 115.64 115.59 3b4t s THR 112 Ca 0.08 -0.60 -0.05 0.00 -1.21 0.00 0.00 61.69 59.92 3b4t s THR 112 Cb -0.09 -2.37 -0.02 0.00 -1.51 0.00 0.00 72.50 68.51 3b4t s THR 112 CO 0.03 0.53 -0.01 -0.63 -2.21 0.00 0.00 174.62 172.32 3b4t s ILE 113 N 0.19 3.75 -0.31 5.08 1.01 0.59 -1.24 121.20 130.27 3b4t s ILE 113 Ca -0.06 -0.37 -0.11 0.00 0.00 0.00 0.00 60.65 60.10 3b4t s ILE 113 Cb -0.15 -2.70 -0.02 0.00 0.01 0.00 0.00 42.46 39.60 3b4t s ILE 113 CO 0.04 0.42 0.18 0.00 0.00 0.00 0.00 174.94 175.59 3b4t s ALA 114 N 1.24 3.39 -0.18 9.38 0.00 0.18 -1.59 121.76 134.18 3b4t s ALA 114 Ca 0.03 -1.32 -0.16 0.00 0.00 0.00 0.00 51.96 50.51 3b4t s ALA 114 Cb -0.15 -2.48 -0.04 0.00 0.00 0.00 0.00 23.12 20.45 3b4t s ALA 114 CO 0.00 -0.84 0.40 0.42 0.00 0.00 0.00 175.76 175.74 3b4t s ILE 115 N 1.68 5.21 -0.15 0.00 -1.09 0.77 -1.08 121.20 126.54 3b4t s ILE 115 Ca 0.06 0.73 0.01 0.00 -2.23 0.00 0.00 60.65 59.21 3b4t s ILE 115 Cb -0.17 -3.73 0.02 0.00 -1.58 0.00 0.00 42.46 37.00 3b4t s ILE 115 CO 0.08 0.28 -0.15 -1.81 -1.23 0.00 0.00 174.94 172.11 3b4t s ASP 116 N 0.89 2.74 -0.34 3.58 1.01 -0.51 -0.80 116.67 123.25 3b4t s ASP 116 Ca 0.20 -0.51 -0.00 0.00 0.71 0.00 0.00 52.55 52.95 3b4t s ASP 116 Cb -0.14 -1.22 0.08 0.00 1.01 0.00 0.00 42.92 42.64 3b4t s ASP 116 CO 0.08 -0.04 0.06 0.00 0.21 0.00 0.00 175.17 175.48 3b4t s ASP 118 N 1.33 4.70 -0.13 0.00 1.11 -0.42 -0.97 116.67 122.28 3b4t s ASP 118 Ca 0.03 -0.56 -0.29 0.00 0.18 0.00 0.00 52.55 51.90 3b4t s ASP 118 Cb -0.21 -1.80 -0.02 0.00 1.07 0.00 0.00 42.92 41.96 3b4t s ASP 118 CO -0.04 -0.10 1.32 -0.69 1.18 0.00 0.00 175.17 176.84 3b4t s VAL 119 N 1.48 4.15 -0.08 -1.27 1.01 0.47 -0.94 120.40 125.22 3b4t s VAL 119 Ca 0.04 1.41 0.02 0.00 0.00 0.00 0.00 61.98 63.45 3b4t s VAL 119 Cb -0.16 -3.91 -0.25 0.00 0.00 0.00 0.00 36.38 32.06 3b4t s VAL 119 CO -0.01 -0.11 0.53 -0.07 0.00 0.00 0.00 175.10 175.45 3b4t h LEU 120 N 9.61 0.23 -7.50 3.92 3.38 -0.86 -1.87 115.31 122.23 3b4t h LEU 120 Ca -0.29 -0.51 -0.21 0.00 0.09 0.00 0.00 57.88 56.95 3b4t h LEU 120 Cb 1.12 -0.08 -0.29 0.00 0.09 0.00 0.00 40.66 41.51 3b4t h LEU 120 CO 0.96 1.46 -0.56 -1.58 0.09 0.00 0.00 178.44 178.80 3b4t s GLN 121 N -2.58 0.14 -0.25 1.13 0.74 -0.93 -4.05 119.66 113.87 3b4t s GLN 121 Ca -0.14 0.30 -0.01 0.00 0.05 0.00 0.00 55.36 55.57 3b4t s GLN 121 Cb 0.07 -0.05 0.03 0.00 1.10 0.00 0.00 33.01 34.17 3b4t s GLN 121 CO 0.80 -0.09 -0.08 0.00 -0.55 0.00 0.00 175.29 175.37 3b4t s ALA 122 N 0.65 2.66 -0.30 1.58 0.00 -0.46 -0.83 121.76 125.05 3b4t s ALA 122 Ca -0.05 -1.49 0.19 0.00 0.00 0.00 0.00 51.96 50.62 3b4t s ALA 122 Cb -0.06 -1.64 0.48 0.00 0.00 0.00 0.00 23.12 21.89 3b4t s ALA 122 CO -0.03 -0.84 1.01 -3.47 0.00 0.00 0.00 175.76 172.44 3b4t n ASP 123 N 4.64 1.67 0.00 0.00 2.03 -1.26 -4.62 116.55 119.00 3b4t n ASP 123 Ca -0.16 -2.54 0.00 0.00 0.52 0.00 0.00 54.79 52.61 3b4t n ASP 123 Cb 0.47 -0.51 0.00 0.00 -0.72 0.00 0.00 41.12 40.36 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 -0.27 -2.42 2.27 0.27 0.00 -1.26 -2.02 105.19 101.76 3b4t n GLY 124 Ca 0.10 -1.34 -0.12 0.00 0.00 0.00 0.00 46.02 44.66 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 -1.27 0.43 0.18 -0.02 0.00 -1.23 -4.77 105.19 98.51 3b4t n GLY 125 Ca 0.00 -0.42 -0.05 0.00 0.00 0.00 0.00 46.02 45.55 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 1.36 0.03 2.61 1.35 -1.93 -0.54 112.91 115.79 3b4t h THR 126 Ca -0.27 -1.87 -0.23 0.00 -0.55 0.00 0.00 66.41 63.49 3b4t h THR 126 Cb 1.04 1.91 -0.03 0.00 -1.73 0.00 0.00 68.15 69.35 3b4t h THR 126 CO 0.34 0.56 -1.15 0.08 -0.25 0.00 0.00 175.52 175.10 3b4t h ARG 127 N 0.21 0.05 -0.28 4.72 0.11 -1.98 -0.31 114.38 116.90 3b4t h ARG 127 Ca 0.00 -0.09 -0.18 0.00 0.10 0.00 0.00 59.98 59.81 3b4t h ARG 127 Cb 1.04 0.03 -0.00 0.00 1.11 0.00 0.00 29.97 32.16 3b4t h ARG 127 CO 0.09 0.98 -0.54 1.79 0.10 0.00 0.00 179.97 182.39 3b4t h THR 128 N 0.01 1.28 -0.52 0.08 1.35 -1.86 -1.81 112.91 111.45 3b4t h THR 128 Ca -0.07 -1.73 -0.04 0.00 -0.55 0.00 0.00 66.41 64.02 3b4t h THR 128 Cb 1.84 1.63 -0.02 0.00 -1.73 0.00 0.00 68.15 69.87 3b4t h THR 128 CO 0.14 0.56 0.17 0.00 -0.25 0.00 0.00 175.52 176.14 3b4t h ALA 129 N 0.75 0.68 -0.36 6.62 0.00 -1.11 -1.42 119.26 124.42 3b4t h ALA 129 Ca 0.02 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.79 3b4t h ALA 129 Cb 1.13 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 3b4t h ALA 129 CO 0.12 0.33 0.11 0.00 0.00 0.00 0.00 179.25 179.81 3b4t h ALA 130 N 1.03 0.41 -0.10 0.00 0.00 -0.96 0.62 119.26 120.26 3b4t h ALA 130 Ca 0.17 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 3b4t h ALA 130 Cb 0.26 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 3b4t h ALA 130 CO -0.01 -0.28 0.04 0.82 0.00 0.00 0.00 179.25 179.83 3b4t h ILE 131 N 0.26 1.12 -0.94 0.00 2.04 -1.22 0.18 117.51 118.94 3b4t h ILE 131 Ca 0.16 -0.37 0.03 0.00 1.00 0.00 0.00 64.86 65.69 3b4t h ILE 131 Cb 0.15 1.19 -0.05 0.00 -0.74 0.00 0.00 36.82 37.36 3b4t h ILE 131 CO -0.18 0.11 0.62 0.74 0.00 0.00 0.00 178.15 179.44 3b4t h THR 132 N 0.02 1.17 0.02 -0.27 2.02 -0.97 -2.35 112.91 112.55 3b4t h THR 132 Ca 0.03 -0.41 -0.23 0.00 0.77 0.00 0.00 66.41 66.57 3b4t h THR 132 Cb 0.14 -0.14 0.00 0.00 -1.74 0.00 0.00 68.15 66.41 3b4t h THR 132 CO -0.00 0.22 -0.99 1.23 0.37 0.00 0.00 175.52 176.34 3b4t h GLY 133 N 1.20 0.44 1.50 2.16 0.00 -0.74 -3.26 103.07 104.36 3b4t h GLY 133 Ca 0.37 -0.81 -0.02 0.00 0.00 0.00 0.00 47.33 46.87 3b4t h GLY 133 CO -0.12 0.72 0.23 0.00 0.00 0.00 0.00 176.54 177.37 3b4t h ALA 134 N 0.71 1.51 -0.69 3.60 0.00 -0.31 -1.92 119.26 122.16 3b4t h ALA 134 Ca -0.09 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 3b4t h ALA 134 Cb 1.64 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 19.21 3b4t h ALA 134 CO 0.17 0.39 0.28 -0.92 0.00 0.00 0.00 179.25 179.18 3b4t h TYR 135 N 0.66 1.04 -0.53 0.00 3.20 -1.47 0.20 116.97 120.07 3b4t h TYR 135 Ca 0.17 -0.08 -0.04 0.00 3.14 0.00 0.00 58.73 61.92 3b4t h TYR 135 Cb 0.07 -0.31 -0.02 0.00 1.54 0.00 0.00 36.73 38.01 3b4t h TYR 135 CO 0.01 0.80 0.17 0.28 -1.64 0.00 0.00 178.16 177.78 3b4t h VAL 136 N 0.98 1.23 -0.80 1.81 2.07 -1.50 0.15 116.25 120.19 3b4t h VAL 136 Ca 0.23 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 3b4t h VAL 136 Cb 0.20 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 3b4t h VAL 136 CO -0.02 0.28 0.46 0.00 0.02 0.00 0.00 177.57 178.32 3b4t h ALA 137 N 1.03 1.03 -0.42 1.67 0.00 -1.08 -0.88 119.26 120.61 3b4t h ALA 137 Ca 0.17 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3b4t h ALA 137 Cb 0.26 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3b4t h ALA 137 CO -0.01 0.52 0.24 1.25 0.00 0.00 0.00 179.25 181.25 3b4t h LEU 138 N 1.11 0.52 -0.97 0.00 5.85 -0.13 -0.03 115.31 121.66 3b4t h LEU 138 Ca 0.29 -0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.97 3b4t h LEU 138 Cb -0.01 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 40.84 3b4t h LEU 138 CO -0.05 0.44 0.63 0.00 -0.34 0.00 0.00 178.44 179.13 3b4t h ALA 139 N 1.10 1.28 -0.43 1.25 0.00 -0.29 -0.19 119.26 121.98 3b4t h ALA 139 Ca 0.15 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 3b4t h ALA 139 Cb 0.03 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 3b4t h ALA 139 CO -0.03 0.52 -0.25 -0.44 0.00 0.00 0.00 179.25 179.05 3b4t h ASP 140 N 1.23 0.94 -0.73 0.00 3.32 -0.77 -1.14 116.42 119.27 3b4t h ASP 140 Ca 0.38 -0.37 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 3b4t h ASP 140 Cb -0.00 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.25 3b4t h ASP 140 CO -0.12 1.14 0.42 0.00 -1.72 0.00 0.00 179.24 178.96 3b4t h ALA 141 N 0.92 1.34 -0.48 3.45 0.00 -0.47 -0.43 119.26 123.60 3b4t h ALA 141 Ca 0.10 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 3b4t h ALA 141 Cb 0.82 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3b4t h ALA 141 CO 0.07 0.55 -0.14 0.28 0.00 0.00 0.00 179.25 180.01 3b4t h VAL 142 N 1.03 1.27 -0.86 0.00 2.07 -0.78 -1.01 116.25 117.98 3b4t h VAL 142 Ca 0.26 -1.28 0.01 0.00 0.82 0.00 0.00 66.70 66.52 3b4t h VAL 142 Cb 0.00 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 3b4t h VAL 142 CO -0.05 0.44 0.56 0.74 0.02 0.00 0.00 177.57 179.29 3b4t h THR 143 N 0.79 1.20 0.28 2.57 2.02 -0.75 0.16 112.91 119.18 3b4t h THR 143 Ca 0.12 -0.39 -0.01 0.00 0.77 0.00 0.00 66.41 66.89 3b4t h THR 143 Cb 0.70 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.07 3b4t h THR 143 CO 0.05 0.21 -0.13 0.22 0.37 0.00 0.00 175.52 176.24 3b4t h TYR 144 N 1.14 -0.35 -0.68 3.16 3.20 -0.81 -2.19 116.97 120.45 3b4t h TYR 144 Ca 0.32 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.17 3b4t h TYR 144 Cb -0.11 0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.25 3b4t h TYR 144 CO -0.01 -0.17 0.37 -0.07 -1.64 0.00 0.00 178.16 176.64 3b4t h LEU 145 N -0.43 0.83 -0.30 2.82 3.38 -0.98 -1.73 115.31 118.89 3b4t h LEU 145 Ca -0.04 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 3b4t h LEU 145 Cb 0.33 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3b4t h LEU 145 CO 0.06 0.66 0.18 -1.28 0.09 0.00 0.00 178.44 178.16 3b4t h SER 146 N 0.94 0.36 -0.26 -0.43 0.87 -0.85 -1.38 113.55 112.81 3b4t h SER 146 Ca 0.24 -0.05 -0.08 0.00 -1.23 0.00 0.00 61.79 60.67 3b4t h SER 146 Cb 0.02 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 61.87 3b4t h SER 146 CO -0.04 0.31 -0.09 0.00 -0.53 0.00 0.00 176.83 176.48 3b4t h ALA 147 N 1.07 1.14 0.00 6.23 0.00 -0.96 -1.75 119.26 124.98 3b4t h ALA 147 Ca 0.11 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3b4t h ALA 147 Cb 0.02 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3b4t h ALA 147 CO -0.02 0.54 0.00 0.00 0.00 0.00 0.00 179.25 179.77 3b4t n ALA 148 N -2.48 2.45 -3.25 0.00 0.00 -0.69 -4.70 120.51 111.84 3b4t n ALA 148 Ca 0.01 -0.15 -0.19 0.00 0.00 0.00 0.00 53.44 53.12 3b4t n ALA 148 Cb 0.33 -1.46 0.06 0.00 0.00 0.00 0.00 19.45 18.38 3b4t n ALA 148 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3b4t n GLY 149 N 0.97 -0.23 1.12 0.00 0.00 -0.66 -4.91 105.19 101.47 3b4t n GLY 149 Ca 0.16 0.03 0.08 0.00 0.00 0.00 0.00 46.02 46.30 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 -3.89 3.18 -4.24 1.61 4.76 -0.59 -4.97 118.16 114.01 3b4t n LYS 150 Ca -0.01 -2.57 -0.35 0.00 -2.87 0.00 0.00 58.31 52.51 3b4t n LYS 150 Cb 0.56 -1.63 -0.10 0.00 -1.84 0.00 0.00 35.03 32.02 3b4t n LYS 150 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3b4t s LEU 151 N -1.62 3.66 0.43 -0.35 1.43 -1.26 -4.72 118.68 116.26 3b4t s LEU 151 Ca 0.40 0.11 0.24 0.00 -1.03 0.00 0.00 54.13 53.85 3b4t s LEU 151 Cb 0.25 -1.87 0.84 0.00 0.03 0.00 0.00 46.19 45.44 3b4t s LEU 151 CO 0.20 0.29 1.79 0.28 0.23 0.00 0.00 176.35 179.14 3b4t h SER 152 N 5.80 0.00 -3.76 2.29 0.02 -1.65 -3.44 113.55 112.81 3b4t h SER 152 Ca -0.44 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.32 3b4t h SER 152 Cb 1.19 0.00 -0.27 0.00 0.14 0.00 0.00 62.40 63.46 3b4t h SER 152 CO 0.60 0.23 -0.52 -1.81 -1.14 0.00 0.00 176.83 174.19 3b4t s ASP 153 N -6.19 -0.18 0.64 3.07 1.01 0.03 -4.99 116.67 110.05 3b4t s ASP 153 Ca 0.01 0.35 0.40 0.00 0.71 0.00 0.00 52.55 54.02 3b4t s ASP 153 Cb 0.10 0.35 2.20 0.00 1.01 0.00 0.00 42.92 46.58 3b4t s ASP 153 CO 0.64 -0.07 2.32 1.55 0.21 0.00 0.00 175.17 179.83 3b4t h PRO 154 N 5.99 0.00 -2.33 8.23 0.13 -1.85 -3.36 132.00 138.81 3b4t h PRO 154 Ca -0.27 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.28 3b4t h PRO 154 Cb 1.19 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 31.95 3b4t h PRO 154 CO 0.40 0.00 -0.98 0.54 -0.23 0.00 0.00 178.00 177.73 3b4t n ARG 155 N -3.32 0.20 0.26 0.86 1.74 -1.26 -4.95 116.66 110.19 3b4t n ARG 155 Ca -0.03 -3.16 0.16 0.00 -0.77 0.00 0.00 57.85 54.05 3b4t n ARG 155 Cb 0.09 -1.65 0.59 0.00 -1.02 0.00 0.00 32.46 30.46 3b4t n ARG 155 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3b4t h PRO 156 N 5.56 0.00 -5.77 5.56 0.11 -1.85 -3.44 132.00 132.18 3b4t h PRO 156 Ca 0.26 0.00 -0.60 0.00 0.11 0.00 0.00 66.00 65.77 3b4t h PRO 156 Cb 0.91 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 31.93 3b4t h PRO 156 CO 0.37 0.00 0.43 -0.51 -0.21 0.00 0.00 178.00 178.08 3b4t s LEU 157 N -6.09 4.08 0.01 2.35 1.43 -1.26 0.26 118.68 119.45 3b4t s LEU 157 Ca 0.02 0.86 0.22 0.00 -1.03 0.00 0.00 54.13 54.20 3b4t s LEU 157 Cb 0.08 -3.12 -0.23 0.00 0.03 0.00 0.00 46.19 42.95 3b4t s LEU 157 CO 0.56 -0.55 0.71 -1.54 0.23 0.00 0.00 176.35 175.75 3b4t n SER 158 N 6.09 0.38 -3.39 2.29 3.41 -0.01 -5.00 113.62 117.39 3b4t n SER 158 Ca 0.04 -0.22 -0.07 0.00 -0.26 0.00 0.00 58.87 58.36 3b4t n SER 158 Cb 0.48 1.46 0.00 0.00 -0.26 0.00 0.00 64.21 65.90 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 -2.93 3.47 -0.13 0.00 0.00 -1.26 -4.85 121.76 116.07 3b4t s ALA 160 Ca 0.14 -0.86 -0.01 0.00 0.00 0.00 0.00 51.96 51.24 3b4t s ALA 160 Cb -0.05 -1.53 -0.02 0.00 0.00 0.00 0.00 23.12 21.52 3b4t s ALA 160 CO 0.08 0.65 -0.09 0.42 0.00 0.00 0.00 175.76 176.82 3b4t s ILE 161 N -1.09 3.42 0.15 0.00 -1.09 -1.26 -1.68 121.20 119.65 3b4t s ILE 161 Ca 0.19 -0.54 -0.03 0.00 -2.23 0.00 0.00 60.65 58.05 3b4t s ILE 161 Cb -0.12 -2.45 -0.03 0.00 -1.58 0.00 0.00 42.46 38.28 3b4t s ILE 161 CO 0.10 0.52 0.12 0.00 -1.23 0.00 0.00 174.94 174.45 3b4t s ALA 162 N 0.18 0.75 -0.02 9.38 0.00 -0.88 -4.62 121.76 126.55 3b4t s ALA 162 Ca -0.05 -1.40 -0.20 0.00 0.00 0.00 0.00 51.96 50.31 3b4t s ALA 162 Cb -0.14 0.97 0.04 0.00 0.00 0.00 0.00 23.12 23.99 3b4t s ALA 162 CO 0.04 -0.54 0.43 0.00 0.00 0.00 0.00 175.76 175.69 3b4t s ALA 163 N -4.06 -1.09 -0.00 0.00 0.00 -1.26 -1.30 121.76 114.05 3b4t s ALA 163 Ca 0.26 0.60 -0.11 0.00 0.00 0.00 0.00 51.96 52.71 3b4t s ALA 163 Cb 0.06 0.10 0.01 0.00 0.00 0.00 0.00 23.12 23.29 3b4t s ALA 163 CO 0.04 -0.32 0.23 0.54 0.00 0.00 0.00 175.76 176.24 3b4t s VAL 164 N -1.46 0.07 0.27 0.00 0.11 -0.82 -4.59 120.40 113.98 3b4t s VAL 164 Ca -0.12 -0.61 -0.16 0.00 -2.93 0.00 0.00 61.98 58.17 3b4t s VAL 164 Cb -0.03 -0.57 -0.08 0.00 -1.53 0.00 0.00 36.38 34.17 3b4t s VAL 164 CO 0.05 -0.33 0.70 -0.94 -3.33 0.00 0.00 175.10 171.25 3b4t s SER 165 N -1.44 6.84 0.00 3.54 1.04 -1.26 -1.14 113.70 121.28 3b4t s SER 165 Ca -0.13 1.27 -0.13 0.00 0.48 0.00 0.00 55.95 57.43 3b4t s SER 165 Cb -0.06 -2.36 0.02 0.00 0.10 0.00 0.00 66.02 63.72 3b4t s SER 165 CO 0.02 -0.11 0.28 0.54 0.98 0.00 0.00 173.24 174.96 3b4t s VAL 166 N -1.81 0.07 -0.03 5.02 0.11 -0.21 0.56 120.40 124.11 3b4t s VAL 166 Ca 0.49 -0.56 -0.17 0.00 -2.93 0.00 0.00 61.98 58.81 3b4t s VAL 166 Cb -0.12 -0.66 0.06 0.00 -1.53 0.00 0.00 36.38 34.12 3b4t s VAL 166 CO 0.19 -0.31 0.78 0.61 -3.33 0.00 0.00 175.10 173.04 3b4t n GLY 167 N 1.14 0.33 3.39 6.54 0.00 -0.61 -0.91 105.19 115.08 3b4t n GLY 167 Ca -0.21 -0.95 -0.43 0.00 0.00 0.00 0.00 46.02 44.43 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 -2.05 4.94 -0.09 1.61 1.01 0.87 -0.90 120.40 125.80 3b4t s VAL 168 Ca 0.18 -0.95 0.04 0.00 0.00 0.00 0.00 61.98 61.25 3b4t s VAL 168 Cb -0.00 -3.86 -0.00 0.00 0.00 0.00 0.00 36.38 32.51 3b4t s VAL 168 CO -0.01 -0.41 -0.23 -0.69 0.00 0.00 0.00 175.10 173.76 3b4t s VAL 169 N 1.60 1.94 -1.41 2.92 1.01 0.44 -1.14 120.40 125.76 3b4t s VAL 169 Ca 0.04 -0.96 -0.08 0.00 0.00 0.00 0.00 61.98 60.97 3b4t s VAL 169 Cb -0.21 -1.68 0.05 0.00 0.00 0.00 0.00 36.38 34.53 3b4t s VAL 169 CO 0.07 0.54 0.61 0.47 0.00 0.00 0.00 175.10 176.78 3b4t n ASP 170 N 3.46 -4.79 -0.15 3.32 8.00 -1.26 -0.97 116.55 124.16 3b4t n ASP 170 Ca -0.19 -0.40 -0.02 0.00 0.71 0.00 0.00 54.79 54.89 3b4t n ASP 170 Cb 0.53 -3.90 -0.01 0.00 -0.02 0.00 0.00 41.12 37.72 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 -1.38 0.49 3.21 0.44 0.00 -1.26 -5.00 105.19 101.68 3b4t n GLY 171 Ca -0.04 -0.19 -0.24 0.00 0.00 0.00 0.00 46.02 45.54 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 -1.20 1.32 -0.18 1.61 0.52 -0.14 -5.10 118.95 115.78 3b4t s ARG 172 Ca 0.00 -0.82 -0.29 0.00 -0.52 0.00 0.00 55.73 54.10 3b4t s ARG 172 Cb 0.00 -1.37 -0.00 0.00 0.52 0.00 0.00 34.95 34.10 3b4t s ARG 172 CO 0.00 0.36 1.16 0.42 0.02 0.00 0.00 175.30 177.25 3b4t s ILE 173 N -0.70 4.47 0.07 1.52 1.01 -1.26 -0.42 121.20 125.89 3b4t s ILE 173 Ca 0.06 1.77 0.03 0.00 0.00 0.00 0.00 60.65 62.52 3b4t s ILE 173 Cb -0.08 -4.14 -0.03 0.00 0.01 0.00 0.00 42.46 38.22 3b4t s ILE 173 CO 0.01 -0.14 -0.10 -0.13 0.00 0.00 0.00 174.94 174.58 3b4t s ARG 174 N 3.25 0.70 0.08 2.79 0.52 -0.07 -4.70 118.95 121.52 3b4t s ARG 174 Ca 0.50 -0.96 0.07 0.00 -0.52 0.00 0.00 55.73 54.82 3b4t s ARG 174 Cb -0.19 -0.47 -0.04 0.00 0.52 0.00 0.00 34.95 34.78 3b4t s ARG 174 CO 0.11 0.08 -0.13 0.54 0.02 0.00 0.00 175.30 175.92 3b4t s VAL 175 N -1.83 3.15 -0.67 3.52 0.11 -0.85 -1.57 120.40 122.25 3b4t s VAL 175 Ca -0.02 -1.25 -0.01 0.00 -2.93 0.00 0.00 61.98 57.77 3b4t s VAL 175 Cb -0.07 -2.43 0.00 0.00 -1.53 0.00 0.00 36.38 32.36 3b4t s VAL 175 CO 0.00 0.19 0.64 -0.67 -3.33 0.00 0.00 175.10 171.93 3b4t n ASP 176 N 1.00 -7.38 -4.71 3.54 2.03 0.19 -4.77 116.55 106.45 3b4t n ASP 176 Ca -0.15 -0.05 -0.41 0.00 0.52 0.00 0.00 54.79 54.71 3b4t n ASP 176 Cb 0.52 -5.00 -0.04 0.00 -0.72 0.00 0.00 41.12 35.89 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 -3.80 4.33 1.11 -2.67 1.43 -1.26 -4.78 118.68 113.04 3b4t s LEU 177 Ca 0.01 1.42 -0.18 0.00 -1.03 0.00 0.00 54.13 54.35 3b4t s LEU 177 Cb -0.00 -3.34 0.25 0.00 0.03 0.00 0.00 46.19 43.13 3b4t s LEU 177 CO 0.69 -0.21 1.20 -2.84 0.23 0.00 0.00 176.35 175.42 3b4t s PRO 178 N 1.03 -0.49 0.16 1.29 0.02 -1.26 -3.58 135.00 132.16 3b4t s PRO 178 Ca 0.45 -0.23 -0.24 0.00 0.02 0.00 0.00 61.00 60.99 3b4t s PRO 178 Cb -0.19 -1.70 0.04 0.00 0.02 0.00 0.00 34.50 32.67 3b4t s PRO 178 CO 0.22 -3.20 1.59 -0.92 -0.33 0.00 0.00 177.00 174.37 3b4t h TYR 179 N -2.21 -0.99 -0.69 6.54 3.20 -1.72 -1.27 116.97 119.83 3b4t h TYR 179 Ca -0.44 0.06 -0.06 0.00 3.14 0.00 0.00 58.73 61.42 3b4t h TYR 179 Cb 1.27 0.49 -0.03 0.00 1.54 0.00 0.00 36.73 40.00 3b4t h TYR 179 CO -1.80 -0.40 0.19 1.49 -1.64 0.00 0.00 178.16 176.00 3b4t h GLU 180 N -0.29 1.10 -0.44 1.82 4.57 -1.93 -1.83 114.58 117.58 3b4t h GLU 180 Ca 0.16 -0.25 -0.07 0.00 -1.18 0.00 0.00 59.36 58.01 3b4t h GLU 180 Cb 0.55 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 28.98 3b4t h GLU 180 CO -0.53 0.96 -0.02 0.93 -1.18 0.00 0.00 179.01 179.18 3b4t h GLU 181 N 1.03 0.79 -0.88 1.92 5.08 -1.85 -3.05 114.58 117.63 3b4t h GLU 181 Ca 0.22 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 3b4t h GLU 181 Cb 0.34 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.48 3b4t h GLU 181 CO -0.00 0.86 0.49 0.22 -1.00 0.00 0.00 179.01 179.58 3b4t h ASP 182 N 0.63 1.08 0.64 1.42 3.58 -0.96 -2.19 116.42 120.63 3b4t h ASP 182 Ca 0.12 -0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.49 3b4t h ASP 182 Cb 0.52 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 41.29 3b4t h ASP 182 CO 0.03 0.86 0.00 -1.54 -2.88 0.00 0.00 179.24 175.71 3b4t n SER 183 N -4.34 0.25 0.00 2.28 3.41 -0.71 -2.92 113.62 111.59 3b4t n SER 183 Ca 0.09 0.56 0.00 0.00 -0.26 0.00 0.00 58.87 59.26 3b4t n SER 183 Cb 0.09 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 63.43 3b4t n SER 183 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 3b4t n ARG 184 N -1.77 0.52 -2.08 4.33 1.85 -1.04 -5.06 116.66 113.40 3b4t n ARG 184 Ca 0.03 -0.78 -0.42 0.00 -1.00 0.00 0.00 57.85 55.68 3b4t n ARG 184 Cb 0.21 -0.91 -0.03 0.00 -1.05 0.00 0.00 32.46 30.68 3b4t n ARG 184 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3b4t s ALA 185 N -0.34 3.62 0.10 2.89 0.00 -0.85 -4.77 121.76 122.42 3b4t s ALA 185 Ca 0.00 1.23 -0.26 0.00 0.00 0.00 0.00 51.96 52.93 3b4t s ALA 185 Cb 0.00 -3.55 -0.12 0.00 0.00 0.00 0.00 23.12 19.45 3b4t s ALA 185 CO 0.00 -0.67 1.67 0.93 0.00 0.00 0.00 175.76 177.69 3b4t h GLU 186 N 5.83 -0.38 -4.66 0.00 5.08 -1.49 -3.43 114.58 115.53 3b4t h GLU 186 Ca -0.44 0.03 -0.40 0.00 -1.00 0.00 0.00 59.36 57.54 3b4t h GLU 186 Cb 1.21 0.09 -0.29 0.00 0.50 0.00 0.00 28.75 30.25 3b4t h GLU 186 CO 0.82 -0.25 -0.78 0.08 -1.00 0.00 0.00 179.01 177.88 3b4t s VAL 187 N -6.12 0.72 0.05 3.13 1.01 -1.23 -4.73 120.40 113.23 3b4t s VAL 187 Ca -0.15 -0.37 -0.17 0.00 0.00 0.00 0.00 61.98 61.29 3b4t s VAL 187 Cb 0.07 -0.62 0.03 0.00 0.00 0.00 0.00 36.38 35.86 3b4t s VAL 187 CO 0.65 0.21 0.39 1.51 0.00 0.00 0.00 175.10 177.86 3b4t s ASP 188 N -0.06 -0.25 0.13 3.32 1.47 -1.26 -0.09 116.67 119.93 3b4t s ASP 188 Ca 0.01 -0.05 -0.24 0.00 1.18 0.00 0.00 52.55 53.45 3b4t s ASP 188 Cb -0.05 0.41 0.07 0.00 -0.34 0.00 0.00 42.92 43.01 3b4t s ASP 188 CO -0.00 -0.66 0.68 0.00 0.68 0.00 0.00 175.17 175.87 3b4t s MET 189 N -2.54 1.20 -0.24 2.11 0.23 -0.08 -3.06 119.30 116.91 3b4t s MET 189 Ca -0.05 -0.47 -0.07 0.00 -1.03 0.00 0.00 55.69 54.08 3b4t s MET 189 Cb -0.01 0.54 -0.03 0.00 -1.53 0.00 0.00 34.83 33.80 3b4t s MET 189 CO -0.03 -0.53 0.05 -0.80 -2.03 0.00 0.00 175.02 171.69 3b4t s ASN 190 N -2.70 5.01 -0.27 -1.18 0.01 0.82 -1.05 114.94 115.58 3b4t s ASN 190 Ca 0.03 -0.23 -0.14 0.00 -0.71 0.00 0.00 52.86 51.81 3b4t s ASN 190 Cb -0.01 -1.90 -0.04 0.00 0.41 0.00 0.00 41.25 39.71 3b4t s ASN 190 CO -0.11 -0.03 0.31 -0.69 -1.51 0.00 0.00 177.10 175.07 3b4t s VAL 191 N 1.59 5.22 -0.20 1.60 1.01 -0.29 -0.17 120.40 129.16 3b4t s VAL 191 Ca 0.06 0.43 -0.06 0.00 0.00 0.00 0.00 61.98 62.41 3b4t s VAL 191 Cb -0.15 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.56 3b4t s VAL 191 CO 0.03 0.19 0.04 -0.69 0.00 0.00 0.00 175.10 174.67 3b4t s VAL 192 N 1.93 4.34 0.25 2.92 1.01 0.30 -1.95 120.40 129.21 3b4t s VAL 192 Ca 0.12 -0.18 0.02 0.00 0.00 0.00 0.00 61.98 61.94 3b4t s VAL 192 Cb -0.16 -2.98 -0.05 0.00 0.00 0.00 0.00 36.38 33.19 3b4t s VAL 192 CO 0.10 0.42 0.07 0.00 0.00 0.00 0.00 175.10 175.69 3b4t s ALA 193 N 0.92 1.75 0.41 5.51 0.00 -0.42 -0.50 121.76 129.43 3b4t s ALA 193 Ca 0.03 -1.85 0.08 0.00 0.00 0.00 0.00 51.96 50.22 3b4t s ALA 193 Cb -0.14 0.92 -0.02 0.00 0.00 0.00 0.00 23.12 23.87 3b4t s ALA 193 CO 0.02 -0.41 0.38 0.95 0.00 0.00 0.00 175.76 176.70 3b4t s THR 194 N -3.68 2.68 -1.05 0.00 -4.23 -0.36 -2.07 115.64 106.92 3b4t s THR 194 Ca 0.35 -1.34 0.09 0.00 -1.18 0.00 0.00 61.69 59.61 3b4t s THR 194 Cb 0.08 -3.00 0.40 0.00 1.34 0.00 0.00 72.50 71.32 3b4t s THR 194 CO 0.12 -0.00 1.20 -0.90 -0.54 0.00 0.00 174.62 174.50 3b4t n ASP 195 N -1.55 3.04 -1.03 3.99 3.85 -0.68 -3.67 116.55 120.51 3b4t n ASP 195 Ca 0.03 -2.33 0.00 0.00 -0.71 0.00 0.00 54.79 51.79 3b4t n ASP 195 Cb 0.62 -0.49 0.22 0.00 -1.35 0.00 0.00 41.12 40.11 3b4t n ASP 195 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 3b4t n THR 196 N 0.43 2.44 -2.14 2.12 -2.24 -1.26 -4.93 114.28 108.70 3b4t n THR 196 Ca 0.14 -2.42 -0.13 0.00 -2.27 0.00 0.00 64.05 59.36 3b4t n THR 196 Cb 0.61 -0.30 -0.01 0.00 -2.10 0.00 0.00 70.33 68.53 3b4t n THR 196 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3b4t n GLY 197 N -0.94 0.04 3.40 3.38 0.00 -1.24 -5.02 105.19 104.80 3b4t n GLY 197 Ca 0.29 -0.34 -0.22 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.64 2.09 -0.02 2.61 -4.23 -1.26 -5.02 115.64 107.17 3b4t s THR 198 Ca 0.00 -2.20 -0.05 0.00 -1.18 0.00 0.00 61.69 58.26 3b4t s THR 198 Cb 0.00 -2.10 -0.04 0.00 1.34 0.00 0.00 72.50 71.70 3b4t s THR 198 CO 0.00 -0.41 0.21 -0.76 -0.54 0.00 0.00 174.62 173.12 3b4t s LEU 199 N -3.16 4.37 -0.24 4.79 1.43 -1.26 -1.22 118.68 123.39 3b4t s LEU 199 Ca 0.23 0.46 -0.09 0.00 -1.03 0.00 0.00 54.13 53.70 3b4t s LEU 199 Cb -0.04 -2.55 -0.11 0.00 0.03 0.00 0.00 46.19 43.52 3b4t s LEU 199 CO 0.10 0.28 -0.29 0.52 0.23 0.00 0.00 176.35 177.20 3b4t n VAL 200 N 1.20 1.32 -3.54 -1.59 0.31 0.34 -4.89 118.33 111.48 3b4t n VAL 200 Ca -0.13 -0.38 -0.13 0.00 -0.01 0.00 0.00 64.34 63.70 3b4t n VAL 200 Cb 0.53 -1.70 -0.05 0.00 -0.91 0.00 0.00 33.84 31.71 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 -2.45 0.83 -0.53 5.55 2.12 -1.03 -5.00 118.70 118.18 3b4t s GLU 201 Ca -0.33 0.12 0.02 0.00 0.36 0.00 0.00 54.97 55.13 3b4t s GLU 201 Cb 0.12 0.39 0.14 0.00 0.26 0.00 0.00 34.13 35.03 3b4t s GLU 201 CO 0.45 -0.28 0.29 0.42 -0.54 0.00 0.00 175.26 175.61 3b4t s ILE 202 N -1.47 2.89 -0.34 -3.70 1.01 -1.26 -0.54 121.20 117.80 3b4t s ILE 202 Ca -0.05 -3.14 -0.27 0.00 0.00 0.00 0.00 60.65 57.20 3b4t s ILE 202 Cb -0.00 -2.97 0.01 0.00 0.01 0.00 0.00 42.46 39.51 3b4t s ILE 202 CO 0.03 -0.81 0.97 -1.58 0.00 0.00 0.00 174.94 173.55 3b4t s GLN 203 N -0.13 3.95 0.26 2.79 0.74 0.76 -4.86 119.66 123.17 3b4t s GLN 203 Ca 0.16 0.78 -0.30 0.00 0.05 0.00 0.00 55.36 56.06 3b4t s GLN 203 Cb -0.24 -3.77 -0.10 0.00 1.10 0.00 0.00 33.01 30.01 3b4t s GLN 203 CO -0.02 -0.89 1.31 0.20 -0.55 0.00 0.00 175.29 175.34 3b4t s GLY 204 N 1.76 2.69 0.26 2.59 0.00 -1.26 -0.13 107.32 113.23 3b4t s GLY 204 Ca 0.40 1.18 0.02 0.00 0.00 0.00 0.00 44.72 46.33 3b4t s GLY 204 CO 0.17 1.99 0.07 -0.51 0.00 0.00 0.00 173.10 174.81 3b4t s THR 205 N -0.49 0.77 0.00 0.90 -4.23 -1.17 -4.90 115.64 106.51 3b4t s THR 205 Ca 0.53 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.04 3b4t s THR 205 Cb -0.38 -2.58 0.00 0.00 1.34 0.00 0.00 72.50 70.87 3b4t s THR 205 CO 0.45 -0.09 0.00 0.61 -0.54 0.00 0.00 174.62 175.05 3b4t n GLY 206 N -0.49 -1.71 0.11 3.99 0.00 -1.26 -4.44 105.19 101.38 3b4t n GLY 206 Ca -0.02 -1.63 -0.05 0.00 0.00 0.00 0.00 46.02 44.33 3b4t n GLY 206 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3b4t h GLU 207 N 0.00 0.04 0.00 1.61 4.81 -1.96 -3.49 114.58 115.59 3b4t h GLU 207 Ca 0.00 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 3b4t h GLU 207 Cb 0.00 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.39 3b4t h GLU 207 CO 0.00 0.82 0.00 0.41 -0.73 0.00 0.00 179.01 179.51 3b4t n GLY 208 N 0.78 4.01 3.51 1.92 0.00 -1.26 -5.18 105.19 108.97 3b4t n GLY 208 Ca -0.01 -1.21 -0.09 0.00 0.00 0.00 0.00 46.02 44.71 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 -0.02 -0.78 0.15 4.61 0.00 -1.26 -5.08 121.76 119.37 3b4t s ALA 209 Ca 0.00 -0.35 0.05 0.00 0.00 0.00 0.00 51.96 51.67 3b4t s ALA 209 Cb 0.00 0.86 -0.04 0.00 0.00 0.00 0.00 23.12 23.94 3b4t s ALA 209 CO 0.00 -0.79 0.10 0.95 0.00 0.00 0.00 175.76 176.02 3b4t s THR 210 N -3.89 4.33 -0.11 0.00 -4.23 -1.26 -5.08 115.64 105.39 3b4t s THR 210 Ca 0.11 -1.10 -0.15 0.00 -1.18 0.00 0.00 61.69 59.36 3b4t s THR 210 Cb -0.01 -3.18 0.04 0.00 1.34 0.00 0.00 72.50 70.69 3b4t s THR 210 CO -0.02 -0.07 0.40 0.72 -0.54 0.00 0.00 174.62 175.11 3b4t s PHE 211 N -1.68 -0.38 0.75 3.99 -0.71 -1.26 -4.96 117.98 113.73 3b4t s PHE 211 Ca 0.30 0.85 -0.14 0.00 -1.04 0.00 0.00 56.93 56.90 3b4t s PHE 211 Cb -0.10 0.15 0.05 0.00 -1.21 0.00 0.00 43.02 41.91 3b4t s PHE 211 CO 0.22 -0.29 1.16 0.00 -1.34 0.00 0.00 175.22 174.97 3b4t s ALA 212 N -0.33 2.11 0.35 1.99 0.00 -1.26 -4.87 121.76 119.75 3b4t s ALA 212 Ca -0.05 0.69 0.07 0.00 0.00 0.00 0.00 51.96 52.68 3b4t s ALA 212 Cb -0.03 -3.41 0.65 0.00 0.00 0.00 0.00 23.12 20.33 3b4t s ALA 212 CO 0.02 -1.87 1.85 -0.09 0.00 0.00 0.00 175.76 175.67 3b4t h ARG 213 N -0.57 0.32 -0.17 0.00 2.43 -2.01 -1.97 114.38 112.41 3b4t h ARG 213 Ca -0.46 -0.09 -0.09 0.00 -0.81 0.00 0.00 59.98 58.53 3b4t h ARG 213 Cb 1.27 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.77 3b4t h ARG 213 CO 0.49 0.48 -0.27 0.66 -1.51 0.00 0.00 179.97 179.83 3b4t h SER 214 N 0.29 0.31 -0.35 -3.80 4.64 -2.00 -1.93 113.55 110.72 3b4t h SER 214 Ca 0.05 -0.10 -0.13 0.00 -0.47 0.00 0.00 61.79 61.15 3b4t h SER 214 Cb 0.47 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.47 3b4t h SER 214 CO 0.03 0.59 -0.27 0.74 -0.87 0.00 0.00 176.83 177.04 3b4t h THR 215 N 0.28 1.29 -0.58 2.95 2.02 -1.75 -2.62 112.91 114.50 3b4t h THR 215 Ca 0.04 -1.43 0.05 0.00 0.77 0.00 0.00 66.41 65.84 3b4t h THR 215 Cb 0.63 1.43 -0.05 0.00 -1.74 0.00 0.00 68.15 68.43 3b4t h THR 215 CO 0.05 0.47 0.31 0.25 0.37 0.00 0.00 175.52 176.96 3b4t h LEU 216 N 0.59 0.45 -1.26 2.58 5.85 -1.06 0.83 115.31 123.29 3b4t h LEU 216 Ca 0.06 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.82 3b4t h LEU 216 Cb 0.85 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.78 3b4t h LEU 216 CO 0.07 0.30 0.50 0.44 -0.34 0.00 0.00 178.44 179.42 3b4t h ASP 217 N 0.58 0.86 -0.20 1.25 3.32 -1.27 0.52 116.42 121.49 3b4t h ASP 217 Ca 0.26 -0.02 -0.18 0.00 0.02 0.00 0.00 57.03 57.11 3b4t h ASP 217 Cb 0.15 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.48 3b4t h ASP 217 CO -0.17 0.62 -0.53 0.11 -1.72 0.00 0.00 179.24 177.55 3b4t h LYS 218 N 1.02 0.79 -0.48 3.56 1.57 -0.98 -1.54 116.57 120.51 3b4t h LYS 218 Ca 0.28 -0.49 -0.02 0.00 -1.87 0.00 0.00 60.65 58.54 3b4t h LYS 218 Cb -0.10 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 3b4t h LYS 218 CO -0.06 1.12 0.20 -0.07 -0.57 0.00 0.00 179.45 180.07 3b4t h LEU 219 N 0.61 0.65 -0.51 2.94 3.38 -0.11 -2.32 115.31 119.96 3b4t h LEU 219 Ca 0.02 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.76 3b4t h LEU 219 Cb 1.12 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.68 3b4t h LEU 219 CO 0.11 0.63 0.03 -0.07 0.09 0.00 0.00 178.44 179.24 3b4t h LEU 220 N 0.63 0.85 -0.09 1.67 3.38 -0.90 -1.04 115.31 119.81 3b4t h LEU 220 Ca 0.16 -0.29 0.04 0.00 0.09 0.00 0.00 57.88 57.89 3b4t h LEU 220 Cb 0.17 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 40.64 3b4t h LEU 220 CO -0.02 0.92 -0.28 0.44 0.09 0.00 0.00 178.44 179.60 3b4t h ASP 221 N 0.74 -0.87 -0.17 -0.43 3.32 -1.07 0.73 116.42 118.67 3b4t h ASP 221 Ca 0.15 0.13 -0.17 0.00 0.02 0.00 0.00 57.03 57.16 3b4t h ASP 221 Cb 0.47 0.37 -0.00 0.00 0.22 0.00 0.00 39.33 40.38 3b4t h ASP 221 CO 0.02 -0.34 -0.50 -0.03 -1.72 0.00 0.00 179.24 176.67 3b4t h MET 222 N -0.38 0.75 -0.24 3.56 4.05 -1.37 -2.00 114.93 119.29 3b4t h MET 222 Ca 0.09 -0.45 -0.01 0.00 -0.28 0.00 0.00 59.70 59.04 3b4t h MET 222 Cb 0.51 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.34 3b4t h MET 222 CO -0.30 1.08 0.11 0.00 0.23 0.00 0.00 176.91 178.02 3b4t h ALA 223 N 0.84 0.31 -0.18 0.39 0.00 -1.00 -1.42 119.26 118.21 3b4t h ALA 223 Ca 0.02 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 3b4t h ALA 223 Cb 1.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 3b4t h ALA 223 CO 0.11 -0.11 -0.22 -0.07 0.00 0.00 0.00 179.25 178.97 3b4t h LEU 224 N 0.25 0.31 -0.97 0.00 3.38 -0.84 -0.42 115.31 117.02 3b4t h LEU 224 Ca 0.08 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 3b4t h LEU 224 Cb 0.15 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 3b4t h LEU 224 CO -0.01 0.54 -0.12 1.23 0.09 0.00 0.00 178.44 180.18 3b4t h GLY 225 N 0.94 0.66 1.67 0.83 0.00 -1.13 -2.79 103.07 103.26 3b4t h GLY 225 Ca 0.05 -0.47 -0.19 0.00 0.00 0.00 0.00 47.33 46.72 3b4t h GLY 225 CO 0.04 0.44 -0.78 0.00 0.00 0.00 0.00 176.54 176.23 3b4t h ALA 226 N 1.32 0.58 -0.01 3.60 0.00 -0.55 -3.15 119.26 121.05 3b4t h ALA 226 Ca 0.10 -0.65 -0.03 0.00 0.00 0.00 0.00 54.91 54.33 3b4t h ALA 226 Cb 0.53 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 3b4t h ALA 226 CO 0.03 0.81 -0.14 0.00 0.00 0.00 0.00 179.25 179.96 3b4t h ASP 228 N 0.01 0.62 -0.64 0.00 3.32 -1.45 0.17 116.42 118.45 3b4t h ASP 228 Ca 0.00 -0.04 0.03 0.00 0.02 0.00 0.00 57.03 57.05 3b4t h ASP 228 Cb 0.25 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.60 3b4t h ASP 228 CO 0.02 0.47 0.39 0.74 -1.72 0.00 0.00 179.24 179.14 3b4t h THR 229 N 0.72 1.07 -0.64 0.35 2.02 -1.53 -1.77 112.91 113.14 3b4t h THR 229 Ca 0.19 -0.26 -0.01 0.00 0.77 0.00 0.00 66.41 67.10 3b4t h THR 229 Cb -0.05 0.24 -0.03 0.00 -1.74 0.00 0.00 68.15 66.57 3b4t h THR 229 CO -0.04 0.14 0.36 -0.07 0.37 0.00 0.00 175.52 176.28 3b4t h LEU 230 N 0.76 0.79 -1.16 2.58 3.38 -0.90 -0.87 115.31 119.88 3b4t h LEU 230 Ca 0.26 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 3b4t h LEU 230 Cb 0.04 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 3b4t h LEU 230 CO -0.11 0.64 0.39 -0.26 0.09 0.00 0.00 178.44 179.20 3b4t h PHE 231 N 0.87 0.95 -0.42 1.13 0.04 -0.39 -0.56 116.94 118.56 3b4t h PHE 231 Ca 0.23 -0.01 -0.14 0.00 2.80 0.00 0.00 57.97 60.84 3b4t h PHE 231 Cb 0.02 -0.31 -0.01 0.00 2.20 0.00 0.00 35.95 37.85 3b4t h PHE 231 CO -0.01 0.66 -0.29 0.00 -0.60 0.00 0.00 178.31 178.07 3b4t h ALA 232 N 1.45 0.69 -0.78 2.45 0.00 -0.85 -1.26 119.26 120.95 3b4t h ALA 232 Ca 0.25 -0.42 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 3b4t h ALA 232 Cb 0.01 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 3b4t h ALA 232 CO -0.04 0.67 0.33 0.00 0.00 0.00 0.00 179.25 180.20 3b4t h ALA 233 N 0.88 1.01 -0.15 0.00 0.00 -0.54 0.51 119.26 120.97 3b4t h ALA 233 Ca 0.09 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3b4t h ALA 233 Cb 0.86 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3b4t h ALA 233 CO 0.08 0.62 0.06 1.96 0.00 0.00 0.00 179.25 181.97 3b4t h GLN 234 N 1.12 0.23 -0.08 0.00 4.20 -1.01 -2.23 115.11 117.33 3b4t h GLN 234 Ca 0.26 -0.04 0.03 0.00 0.06 0.00 0.00 58.65 58.96 3b4t h GLN 234 Cb 0.19 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.90 3b4t h GLN 234 CO -0.02 0.31 -0.12 0.00 -0.67 0.00 0.00 178.83 178.33 3b4t h ARG 235 N 0.10 -0.15 -0.62 1.46 3.08 -0.92 -0.74 114.38 116.58 3b4t h ARG 235 Ca 0.05 0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.16 3b4t h ARG 235 Cb 0.16 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.21 3b4t h ARG 235 CO -0.00 -0.10 0.41 -0.44 -1.07 0.00 0.00 179.97 178.76 3b4t h ASP 236 N -0.16 0.59 -0.09 7.04 3.32 -0.85 0.00 116.42 126.26 3b4t h ASP 236 Ca 0.07 -0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.89 3b4t h ASP 236 Cb 0.26 -0.13 0.01 0.00 0.22 0.00 0.00 39.33 39.69 3b4t h ASP 236 CO -0.18 0.40 -0.84 0.00 -1.72 0.00 0.00 179.24 176.90 3b4t h ALA 237 N 1.65 0.28 0.00 3.45 0.00 -1.04 -3.18 119.26 120.41 3b4t h ALA 237 Ca 0.26 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3b4t h ALA 237 Cb 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3b4t h ALA 237 CO -0.07 0.69 0.00 -0.07 0.00 0.00 0.00 179.25 179.80 3b4t h LEU 238 N 0.50 0.00 -1.23 0.00 3.38 -0.43 -2.76 115.31 114.78 3b4t h LEU 238 Ca -0.07 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 3b4t h LEU 238 Cb 1.47 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.22 3b4t h LEU 238 CO 0.17 0.00 -0.05 0.00 0.09 0.00 0.00 178.44 178.65 3b4t h ALA 239 N 2.35 1.00 -2.34 1.53 0.00 -1.00 -3.44 119.26 117.36 3b4t h ALA 239 Ca 0.00 -0.04 -0.50 0.00 0.00 0.00 0.00 54.91 54.36 3b4t h ALA 239 Cb 0.58 -0.01 0.13 0.00 0.00 0.00 0.00 17.79 18.48 3b4t h ALA 239 CO 0.00 0.06 0.31 -0.51 0.00 0.00 0.00 179.25 179.11 3b4t s LEU 240 N -6.31 2.81 0.54 0.00 1.43 -1.04 -5.00 118.68 111.11 3b4t s LEU 240 Ca 0.02 1.64 -0.22 0.00 -1.03 0.00 0.00 54.13 54.54 3b4t s LEU 240 Cb 0.09 -4.30 -0.05 0.00 0.03 0.00 0.00 46.19 41.96 3b4t s LEU 240 CO 0.58 -2.06 1.30 -2.84 0.23 0.00 0.00 176.35 173.55 3b4t s PRO 241 N -4.97 3.23 0.08 1.29 0.02 -1.26 -4.92 135.00 128.48 3b4t s PRO 241 Ca 0.61 2.09 -0.31 0.00 0.02 0.00 0.00 61.00 63.41 3b4t s PRO 241 Cb -0.16 -2.24 -0.10 0.00 0.02 0.00 0.00 34.50 32.02 3b4t s PRO 241 CO 0.56 -1.07 1.90 0.98 -0.33 0.00 0.00 177.00 179.04 3b4t n TYR 242 N -1.00 2.58 0.23 6.54 9.36 -1.26 -4.86 117.16 128.75 3b4t n TYR 242 Ca 0.10 -0.25 0.07 0.00 3.32 0.00 0.00 57.90 61.14 3b4t n TYR 242 Cb 0.46 -2.77 0.35 0.00 -0.63 0.00 0.00 39.34 36.75 3b4t n TYR 242 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 3b4t n PRO 243 N 6.50 0.09 -2.60 2.98 -0.02 -1.26 -4.76 135.00 135.92 3b4t n PRO 243 Ca 0.19 0.48 -0.11 0.00 -2.02 0.00 0.00 63.50 62.04 3b4t n PRO 243 Cb 0.39 -1.72 -0.01 0.00 -0.02 0.00 0.00 33.50 32.14 3b4t n PRO 243 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3b4t n GLY 244 N -0.82 3.22 3.15 -1.23 0.00 -1.26 -5.00 105.19 103.26 3b4t n GLY 244 Ca 0.01 -2.24 -0.39 0.00 0.00 0.00 0.00 46.02 43.41 3b4t n GLY 244 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3b4t s VAL 245 N -1.25 4.32 0.10 1.61 -7.23 -1.26 -5.06 120.40 111.63 3b4t s VAL 245 Ca 0.09 -3.17 -0.35 0.00 -1.81 0.00 0.00 61.98 56.74 3b4t s VAL 245 Cb -0.01 -3.73 -0.17 0.00 0.56 0.00 0.00 36.38 33.03 3b4t s VAL 245 CO 0.06 -0.98 1.13 0.18 -0.31 0.00 0.00 175.10 175.18 3b4t n LEU 246 N 3.19 0.90 0.00 1.32 4.77 -1.26 -5.15 117.00 120.77 3b4t n LEU 246 Ca 0.14 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 57.25 3b4t n LEU 246 Cb 0.39 -1.11 0.00 0.00 -2.33 0.00 0.00 43.42 40.38 3b4t n LEU 246 CO 0.35 -1.55 0.14 -2.65 -1.33 0.00 0.00 177.39 172.35