#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i15 s THR 7 N 0.00 3.12 -0.03 3.15 2.01 -1.26 -4.82 115.64 117.81 3i15 s THR 7 Ca 0.00 0.14 0.07 0.00 0.31 0.00 0.00 61.69 62.21 3i15 s THR 7 Cb 0.00 -3.10 -0.02 0.00 0.01 0.00 0.00 72.50 69.39 3i15 s THR 7 CO 0.00 -0.03 -0.24 -0.69 -0.69 0.00 0.00 174.62 172.97 3i15 s VAL 8 N 5.14 1.95 -0.05 3.82 1.01 -1.26 -0.86 120.40 130.16 3i15 s VAL 8 Ca 0.88 -1.04 -0.01 0.00 0.00 0.00 0.00 61.98 61.80 3i15 s VAL 8 Cb -0.39 -1.63 0.03 0.00 0.00 0.00 0.00 36.38 34.39 3i15 s VAL 8 CO 0.38 0.55 0.03 -0.63 0.00 0.00 0.00 175.10 175.43 3i15 s ILE 9 N -0.46 0.12 0.20 2.22 1.01 -0.05 -4.98 121.20 119.26 3i15 s ILE 9 Ca 0.06 0.26 0.06 0.00 0.00 0.00 0.00 60.65 61.04 3i15 s ILE 9 Cb -0.11 -0.31 -0.04 0.00 0.01 0.00 0.00 42.46 42.01 3i15 s ILE 9 CO 0.00 0.21 0.12 -0.54 0.00 0.00 0.00 174.94 174.73 3i15 s LYS 10 N 1.93 2.78 0.55 2.79 3.01 -1.26 -0.39 119.74 129.16 3i15 s LYS 10 Ca 0.03 -1.01 -0.08 0.00 -1.01 0.00 0.00 55.97 53.90 3i15 s LYS 10 Cb -0.12 -2.54 0.12 0.00 -1.01 0.00 0.00 37.83 34.29 3i15 s LYS 10 CO -0.04 0.44 0.75 0.27 0.51 0.00 0.00 175.35 177.29 3i15 n ASN 11 N -0.62 0.20 -4.70 2.83 6.94 -0.43 -5.00 115.26 114.48 3i15 n ASN 11 Ca -0.08 -1.36 -0.42 0.00 -0.02 0.00 0.00 54.58 52.70 3i15 n ASN 11 Cb 0.56 -0.56 -0.03 0.00 -2.36 0.00 0.00 39.78 37.39 3i15 n ASN 11 CO 0.00 0.00 0.00 -1.83 -1.03 0.00 0.00 177.26 174.40 3i15 s GLU 12 N -4.59 4.38 0.00 -3.83 4.04 -1.26 -4.48 118.70 112.95 3i15 s GLU 12 Ca 0.44 1.74 0.00 0.00 0.04 0.00 0.00 54.97 57.18 3i15 s GLU 12 Cb -0.01 -3.48 0.00 0.00 0.02 0.00 0.00 34.13 30.66 3i15 s GLU 12 CO 0.30 -0.38 0.00 0.25 -1.84 0.00 0.00 175.26 173.59 3i15 n THR 13 N 4.35 0.00 0.47 1.83 -2.24 -1.26 -4.70 114.28 112.73 3i15 n THR 13 Ca 0.10 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.91 3i15 n THR 13 Cb 0.46 0.00 0.13 0.00 -2.10 0.00 0.00 70.33 68.82 3i15 n THR 13 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3i15 n GLY 14 N -0.14 1.82 0.21 3.38 0.00 -1.26 -4.55 105.19 104.65 3i15 n GLY 14 Ca 0.00 -0.29 0.09 0.00 0.00 0.00 0.00 46.02 45.82 3i15 n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i15 h THR 15 N 1.27 0.54 -3.48 2.61 1.03 -1.85 -3.43 112.91 109.59 3i15 h THR 15 Ca 0.00 -1.29 -0.32 0.00 -0.01 0.00 0.00 66.41 64.79 3i15 h THR 15 Cb 0.92 1.90 -0.35 0.00 -1.07 0.00 0.00 68.15 69.55 3i15 h THR 15 CO 0.14 0.24 -0.73 -0.63 -0.01 0.00 0.00 175.52 174.53 3i15 s ILE 16 N -3.49 -0.04 -0.01 0.00 1.01 -1.26 -1.79 121.20 115.62 3i15 s ILE 16 Ca 0.02 0.23 0.04 0.00 0.00 0.00 0.00 60.65 60.95 3i15 s ILE 16 Cb 0.09 -0.12 -0.01 0.00 0.01 0.00 0.00 42.46 42.44 3i15 s ILE 16 CO 0.66 0.11 -0.14 -0.55 0.00 0.00 0.00 174.94 175.01 3i15 s SER 17 N 1.24 1.67 -0.05 3.58 0.15 -0.12 -1.31 113.70 118.85 3i15 s SER 17 Ca -0.07 -0.26 0.06 0.00 0.70 0.00 0.00 55.95 56.38 3i15 s SER 17 Cb -0.13 -0.19 -0.01 0.00 -1.71 0.00 0.00 66.02 63.99 3i15 s SER 17 CO -0.03 0.17 -0.24 0.27 1.20 0.00 0.00 173.24 174.61 3i15 s ILE 18 N -0.34 1.98 -0.08 6.45 -4.36 0.48 -0.36 121.20 124.97 3i15 s ILE 18 Ca 0.05 -1.03 0.02 0.00 -0.26 0.00 0.00 60.65 59.44 3i15 s ILE 18 Cb -0.05 -1.67 0.01 0.00 1.25 0.00 0.00 42.46 41.99 3i15 s ILE 18 CO -0.01 0.55 -0.15 -0.44 0.24 0.00 0.00 174.94 175.13 3i15 s SER 19 N -0.17 2.22 -0.07 4.36 0.01 0.03 -0.87 113.70 119.21 3i15 s SER 19 Ca -0.03 -0.39 -0.30 0.00 1.31 0.00 0.00 55.95 56.55 3i15 s SER 19 Cb -0.13 -1.01 -0.02 0.00 0.21 0.00 0.00 66.02 65.06 3i15 s SER 19 CO 0.03 0.05 1.11 -1.58 0.41 0.00 0.00 173.24 173.27 3i15 s GLN 20 N 0.69 4.39 -0.12 12.44 0.74 -0.04 -0.31 119.66 137.45 3i15 s GLN 20 Ca -0.13 1.55 -0.07 0.00 0.05 0.00 0.00 55.36 56.76 3i15 s GLN 20 Cb -0.16 -3.54 -0.26 0.00 1.10 0.00 0.00 33.01 30.15 3i15 s GLN 20 CO 0.03 -0.37 0.36 1.28 -0.55 0.00 0.00 175.29 176.05 3i15 n LEU 21 N 5.02 2.63 0.00 3.68 4.77 0.42 -4.61 117.00 128.91 3i15 n LEU 21 Ca 0.10 0.21 -0.03 0.00 -0.03 0.00 0.00 56.01 56.26 3i15 n LEU 21 Cb 0.47 -1.12 0.01 0.00 -2.33 0.00 0.00 43.42 40.45 3i15 n LEU 21 CO 0.54 0.85 0.17 -0.46 -1.33 0.00 0.00 177.39 177.15 3i15 n ASN 22 N -3.50 -0.76 -0.32 -1.43 0.23 -0.70 -4.99 115.26 103.78 3i15 n ASN 22 Ca -0.32 -1.55 0.28 0.00 -0.53 0.00 0.00 54.58 52.46 3i15 n ASN 22 Cb 1.04 1.27 0.53 0.00 -2.08 0.00 0.00 39.78 40.55 3i15 n ASN 22 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 3i15 h LYS 23 N 0.00 0.09 0.00 -3.83 5.09 -2.02 -2.56 116.57 113.35 3i15 h LYS 23 Ca -0.11 -0.01 0.00 0.00 0.09 0.00 0.00 60.65 60.62 3i15 h LYS 23 Cb 0.42 -0.02 0.00 0.00 0.10 0.00 0.00 32.23 32.73 3i15 h LYS 23 CO 0.14 0.06 0.00 0.09 -2.09 0.00 0.00 179.45 177.66 3i15 n ASN 24 N -5.21 1.14 -3.92 7.07 5.03 -1.26 -4.97 115.26 113.14 3i15 n ASN 24 Ca 0.35 -1.50 -0.26 0.00 0.87 0.00 0.00 54.58 54.03 3i15 n ASN 24 Cb 1.16 0.00 -0.17 0.00 -1.02 0.00 0.00 39.78 39.75 3i15 n ASN 24 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3i15 s VAL 25 N -0.50 1.01 0.10 2.41 1.01 -0.96 -0.59 120.40 122.87 3i15 s VAL 25 Ca 0.00 -0.30 0.09 0.00 0.00 0.00 0.00 61.98 61.77 3i15 s VAL 25 Cb 0.00 -1.02 -0.03 0.00 0.00 0.00 0.00 36.38 35.32 3i15 s VAL 25 CO 0.00 0.36 -0.22 0.26 0.00 0.00 0.00 175.10 175.50 3i15 s TRP 26 N 1.57 1.89 -0.17 5.22 0.52 -0.15 -0.44 118.94 127.39 3i15 s TRP 26 Ca 0.02 -0.41 -0.17 0.00 0.02 0.00 0.00 56.10 55.57 3i15 s TRP 26 Cb -0.13 -1.05 -0.04 0.00 -1.15 0.00 0.00 33.47 31.10 3i15 s TRP 26 CO -0.07 0.22 0.44 0.08 0.02 0.00 0.00 176.95 177.64 3i15 s VAL 27 N -1.10 5.19 -0.12 4.03 1.01 0.58 -0.04 120.40 129.94 3i15 s VAL 27 Ca 0.08 0.83 -0.10 0.00 0.00 0.00 0.00 61.98 62.80 3i15 s VAL 27 Cb -0.10 -3.78 -0.05 0.00 0.00 0.00 0.00 36.38 32.46 3i15 s VAL 27 CO 0.04 0.28 0.20 -1.38 0.00 0.00 0.00 175.10 174.24 3i15 s HIS 28 N 1.04 3.57 -0.05 5.22 -3.43 -0.29 -0.79 115.29 120.55 3i15 s HIS 28 Ca 0.22 0.58 0.01 0.00 -0.80 0.00 0.00 55.06 55.08 3i15 s HIS 28 Cb -0.15 -2.09 0.02 0.00 -1.43 0.00 0.00 32.58 28.93 3i15 s HIS 28 CO 0.09 0.58 -0.06 0.99 -2.00 0.00 0.00 174.74 174.33 3i15 s THR 29 N -0.59 0.65 0.03 -5.38 2.01 0.51 -0.63 115.64 112.24 3i15 s THR 29 Ca 0.15 -0.20 0.07 0.00 0.31 0.00 0.00 61.69 62.03 3i15 s THR 29 Cb -0.13 -0.65 -0.02 0.00 0.01 0.00 0.00 72.50 71.71 3i15 s THR 29 CO 0.04 0.25 -0.20 -1.61 -0.69 0.00 0.00 174.62 172.41 3i15 s GLU 30 N 0.84 1.41 -0.25 4.92 8.01 -0.52 -0.95 118.70 132.17 3i15 s GLU 30 Ca -0.12 -0.87 -0.18 0.00 0.01 0.00 0.00 54.97 53.81 3i15 s GLU 30 Cb -0.15 -1.48 -0.03 0.00 -4.31 0.00 0.00 34.13 28.17 3i15 s GLU 30 CO 0.01 0.38 0.51 -0.48 0.01 0.00 0.00 175.26 175.69 3i15 s LEU 31 N -0.98 4.07 -0.19 1.80 -0.00 -0.74 -1.38 118.68 121.25 3i15 s LEU 31 Ca 0.07 0.54 0.01 0.00 -0.00 0.00 0.00 54.13 54.75 3i15 s LEU 31 Cb -0.08 -2.66 0.02 0.00 -0.00 0.00 0.00 46.19 43.47 3i15 s LEU 31 CO 0.01 -0.26 -0.18 -2.16 -0.00 0.00 0.00 176.35 173.76 3i15 s PRO 40 N 2.13 2.92 -0.09 1.48 0.04 -1.26 -5.04 135.00 135.18 3i15 s PRO 40 Ca 0.21 -0.88 -0.08 0.00 0.04 0.00 0.00 61.00 60.29 3i15 s PRO 40 Cb -0.16 -2.63 -0.04 0.00 0.04 0.00 0.00 34.50 31.71 3i15 s PRO 40 CO 0.09 -0.25 0.19 0.45 0.04 0.00 0.00 177.00 177.52 3i15 s SER 41 N 1.28 6.47 0.20 6.66 0.15 -0.48 -3.70 113.70 124.27 3i15 s SER 41 Ca 0.03 0.56 0.07 0.00 0.70 0.00 0.00 55.95 57.31 3i15 s SER 41 Cb -0.14 -2.10 -0.04 0.00 -1.71 0.00 0.00 66.02 62.03 3i15 s SER 41 CO -0.12 0.38 0.04 0.20 1.20 0.00 0.00 173.24 174.95 3i15 s ASN 42 N -1.10 4.94 0.00 5.45 0.01 0.26 -1.43 114.94 123.07 3i15 s ASN 42 Ca 0.18 -0.38 -0.00 0.00 -0.71 0.00 0.00 52.86 51.95 3i15 s ASN 42 Cb -0.13 -1.10 0.00 0.00 0.41 0.00 0.00 41.25 40.43 3i15 s ASN 42 CO 0.07 0.06 0.00 0.61 -1.51 0.00 0.00 177.10 176.32 3i15 n GLY 43 N -0.41 2.70 3.50 0.66 0.00 0.20 -4.86 105.19 106.97 3i15 n GLY 43 Ca -0.09 -1.24 -0.29 0.00 0.00 0.00 0.00 46.02 44.41 3i15 n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i15 s LEU 44 N 0.00 2.73 -0.18 0.99 1.43 -0.22 -1.14 118.68 122.30 3i15 s LEU 44 Ca 0.00 -0.56 -0.01 0.00 -1.03 0.00 0.00 54.13 52.52 3i15 s LEU 44 Cb -0.00 -1.56 -0.01 0.00 0.03 0.00 0.00 46.19 44.66 3i15 s LEU 44 CO 0.00 0.17 -0.11 -0.69 0.23 0.00 0.00 176.35 175.95 3i15 s VAL 45 N -1.22 2.98 -0.27 -1.59 1.01 0.94 -0.57 120.40 121.67 3i15 s VAL 45 Ca 0.19 -0.65 -0.07 0.00 0.00 0.00 0.00 61.98 61.44 3i15 s VAL 45 Cb -0.10 -2.30 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 3i15 s VAL 45 CO 0.11 0.49 0.08 -0.76 0.00 0.00 0.00 175.10 175.02 3i15 s LEU 46 N 1.01 3.67 -0.55 3.92 1.43 0.60 -0.98 118.68 127.78 3i15 s LEU 46 Ca -0.01 -0.43 -0.20 0.00 -1.03 0.00 0.00 54.13 52.45 3i15 s LEU 46 Cb -0.15 -1.92 0.06 0.00 0.03 0.00 0.00 46.19 44.22 3i15 s LEU 46 CO -0.02 -0.11 0.74 0.21 0.23 0.00 0.00 176.35 177.40 3i15 s ASN 47 N 1.57 6.23 0.38 2.29 2.47 0.24 -1.43 114.94 126.69 3i15 s ASN 47 Ca 0.05 -0.90 0.08 0.00 0.42 0.00 0.00 52.86 52.51 3i15 s ASN 47 Cb -0.16 -2.34 -0.06 0.00 -1.45 0.00 0.00 41.25 37.25 3i15 s ASN 47 CO 0.03 -1.06 0.10 0.42 -3.72 0.00 0.00 177.10 172.88 3i15 s THR 48 N 3.06 2.43 -0.56 -5.21 -4.23 -0.84 -4.80 115.64 105.49 3i15 s THR 48 Ca 0.18 -1.82 0.22 0.00 -1.18 0.00 0.00 61.69 59.09 3i15 s THR 48 Cb -0.18 -2.93 0.23 0.00 1.34 0.00 0.00 72.50 70.95 3i15 s THR 48 CO 0.12 -0.08 1.68 -1.54 -0.54 0.00 0.00 174.62 174.26 3i15 n SER 49 N -1.10 0.57 -0.61 3.99 3.41 -1.26 -2.29 113.62 116.33 3i15 n SER 49 Ca -0.03 0.64 0.06 0.00 -0.26 0.00 0.00 58.87 59.29 3i15 n SER 49 Cb 0.64 -0.76 0.10 0.00 -0.26 0.00 0.00 64.21 63.93 3i15 n SER 49 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3i15 n LYS 50 N -2.13 1.62 0.00 4.33 4.76 -1.26 -4.97 118.16 120.51 3i15 n LYS 50 Ca 0.02 -1.62 0.00 0.00 -2.87 0.00 0.00 58.31 53.84 3i15 n LYS 50 Cb 0.23 -1.27 0.00 0.00 -1.84 0.00 0.00 35.03 32.14 3i15 n LYS 50 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3i15 n GLY 51 N 0.70 0.99 3.78 0.72 0.00 -0.97 -4.93 105.19 105.49 3i15 n GLY 51 Ca 0.10 -2.01 -0.38 0.00 0.00 0.00 0.00 46.02 43.72 3i15 n GLY 51 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i15 s LEU 52 N 0.00 4.42 -0.09 0.99 1.43 0.65 -1.99 118.68 124.09 3i15 s LEU 52 Ca 0.00 1.05 0.03 0.00 -1.03 0.00 0.00 54.13 54.18 3i15 s LEU 52 Cb 0.00 -2.77 -0.01 0.00 0.03 0.00 0.00 46.19 43.44 3i15 s LEU 52 CO 0.00 0.18 -0.21 -0.69 0.23 0.00 0.00 176.35 175.86 3i15 s VAL 53 N -0.43 2.41 -0.09 -1.59 1.01 -0.52 -0.91 120.40 120.28 3i15 s VAL 53 Ca 0.27 -0.91 -0.03 0.00 0.00 0.00 0.00 61.98 61.31 3i15 s VAL 53 Cb -0.17 -1.94 -0.03 0.00 0.00 0.00 0.00 36.38 34.24 3i15 s VAL 53 CO 0.15 0.56 0.03 -0.76 0.00 0.00 0.00 175.10 175.08 3i15 s LEU 54 N 0.11 3.77 -0.45 3.92 1.43 -0.31 -0.29 118.68 126.86 3i15 s LEU 54 Ca -0.10 0.22 -0.16 0.00 -1.03 0.00 0.00 54.13 53.06 3i15 s LEU 54 Cb -0.16 -1.88 0.05 0.00 0.03 0.00 0.00 46.19 44.24 3i15 s LEU 54 CO 0.06 0.39 0.38 -0.69 0.23 0.00 0.00 176.35 176.71 3i15 s VAL 55 N -0.92 5.22 0.29 -1.59 1.01 0.27 -0.71 120.40 123.97 3i15 s VAL 55 Ca 0.14 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.23 3i15 s VAL 55 Cb -0.11 -4.07 0.00 0.00 0.00 0.00 0.00 36.38 32.19 3i15 s VAL 55 CO 0.03 -0.50 0.00 0.47 0.00 0.00 0.00 175.10 175.10 3i15 n ASP 56 N 5.25 -4.62 0.00 3.32 8.00 0.60 -1.06 116.55 128.04 3i15 n ASP 56 Ca -0.12 0.81 0.00 0.00 0.71 0.00 0.00 54.79 56.19 3i15 n ASP 56 Cb 0.45 -2.07 0.00 0.00 -0.02 0.00 0.00 41.12 39.48 3i15 n ASP 56 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3i15 n SER 57 N -1.53 0.00 -2.50 -2.24 3.41 -1.26 -4.67 113.62 104.83 3i15 n SER 57 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.52 3i15 n SER 57 Cb 0.13 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.06 3i15 n SER 57 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3i15 n SER 58 N 0.00 1.66 -0.34 4.04 2.88 -1.26 -4.86 113.62 115.74 3i15 n SER 58 Ca 0.00 -1.69 0.04 0.00 -1.33 0.00 0.00 58.87 55.89 3i15 n SER 58 Cb 0.00 0.23 0.19 0.00 -0.75 0.00 0.00 64.21 63.88 3i15 n SER 58 CO 0.00 0.00 0.00 -0.50 -1.23 0.00 0.00 175.04 173.31 3i15 h TRP 59 N 1.16 1.07 -3.59 0.66 4.06 -1.92 -3.31 115.95 114.07 3i15 h TRP 59 Ca -0.11 0.03 -0.21 0.00 2.06 0.00 0.00 58.89 60.66 3i15 h TRP 59 Cb 0.39 -0.34 -0.05 0.00 -1.00 0.00 0.00 29.16 28.16 3i15 h TRP 59 CO 0.00 0.48 -0.06 -0.40 -3.56 0.00 0.00 178.44 174.89 3i15 n ASP 60 N -4.62 -1.31 -0.10 -3.49 5.68 -1.26 -4.24 116.55 107.21 3i15 n ASP 60 Ca 0.16 -2.59 -0.13 0.00 -0.50 0.00 0.00 54.79 51.73 3i15 n ASP 60 Cb 0.27 2.39 -0.04 0.00 -1.14 0.00 0.00 41.12 42.59 3i15 n ASP 60 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 3i15 h ASP 61 N 1.71 0.79 -0.25 -1.12 3.32 -1.88 -1.73 116.42 117.26 3i15 h ASP 61 Ca -0.24 -0.46 0.05 0.00 0.02 0.00 0.00 57.03 56.39 3i15 h ASP 61 Cb 1.03 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 40.32 3i15 h ASP 61 CO 0.33 1.09 -0.04 0.50 -1.72 0.00 0.00 179.24 179.40 3i15 h LYS 62 N 0.50 0.02 -0.07 3.56 3.64 -1.97 -0.55 116.57 121.70 3i15 h LYS 62 Ca 0.05 -0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.26 3i15 h LYS 62 Cb 0.86 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.67 3i15 h LYS 62 CO 0.07 0.01 -0.68 -0.07 -2.27 0.00 0.00 179.45 176.51 3i15 h LEU 63 N 0.02 0.35 -0.45 5.20 3.38 -1.96 -2.42 115.31 119.44 3i15 h LEU 63 Ca 0.12 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 3i15 h LEU 63 Cb 0.17 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 3i15 h LEU 63 CO -0.24 0.93 0.20 0.74 0.09 0.00 0.00 178.44 180.16 3i15 h THR 64 N 0.21 1.19 -0.40 0.22 2.02 -1.05 0.13 112.91 115.23 3i15 h THR 64 Ca -0.02 -0.58 -0.00 0.00 0.77 0.00 0.00 66.41 66.58 3i15 h THR 64 Cb 1.23 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 68.37 3i15 h THR 64 CO 0.11 0.22 0.25 0.11 0.37 0.00 0.00 175.52 176.58 3i15 h LYS 65 N 0.58 0.54 -0.77 6.66 1.57 -1.00 -0.91 116.57 123.24 3i15 h LYS 65 Ca 0.15 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.84 3i15 h LYS 65 Cb 0.16 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 3i15 h LYS 65 CO -0.02 0.39 0.31 1.49 -0.57 0.00 0.00 179.45 181.05 3i15 h GLU 66 N 0.53 1.15 -0.06 3.15 4.81 -1.20 -0.40 114.58 122.55 3i15 h GLU 66 Ca 0.14 -0.21 -0.00 0.00 -0.13 0.00 0.00 59.36 59.16 3i15 h GLU 66 Cb -0.02 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.17 3i15 h GLU 66 CO -0.03 0.93 0.02 1.25 -0.73 0.00 0.00 179.01 180.46 3i15 h LEU 67 N 1.11 0.09 -0.18 1.64 5.85 -0.65 -0.84 115.31 122.32 3i15 h LEU 67 Ca 0.26 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 3i15 h LEU 67 Cb 0.21 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 3i15 h LEU 67 CO -0.02 0.23 0.10 0.40 -0.34 0.00 0.00 178.44 178.80 3i15 h ILE 68 N -0.06 1.10 -0.88 4.05 2.04 -0.92 -1.78 117.51 121.07 3i15 h ILE 68 Ca 0.02 -0.28 0.02 0.00 1.00 0.00 0.00 64.86 65.62 3i15 h ILE 68 Cb 0.17 0.96 -0.05 0.00 -0.74 0.00 0.00 36.82 37.16 3i15 h ILE 68 CO -0.00 0.10 0.58 -0.33 0.00 0.00 0.00 178.15 178.49 3i15 h GLU 69 N 0.19 1.12 -0.28 2.37 5.08 -0.95 0.07 114.58 122.18 3i15 h GLU 69 Ca 0.06 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 3i15 h GLU 69 Cb 0.07 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 3i15 h GLU 69 CO -0.01 0.74 0.10 1.98 -1.00 0.00 0.00 179.01 180.83 3i15 h MET 70 N 1.16 0.42 -0.06 2.33 4.05 -0.82 -2.25 114.93 119.75 3i15 h MET 70 Ca 0.33 -0.08 -0.19 0.00 -0.28 0.00 0.00 59.70 59.48 3i15 h MET 70 Cb -0.08 -0.07 -0.00 0.00 -0.80 0.00 0.00 31.60 30.65 3i15 h MET 70 CO -0.09 0.46 -0.78 -0.39 0.23 0.00 0.00 176.91 176.35 3i15 h VAL 71 N 0.29 1.38 -0.69 -5.77 -1.51 -0.99 -1.77 116.25 107.20 3i15 h VAL 71 Ca 0.09 -2.21 -0.02 0.00 -1.23 0.00 0.00 66.70 63.33 3i15 h VAL 71 Cb 0.20 2.18 -0.03 0.00 -2.13 0.00 0.00 31.29 31.51 3i15 h VAL 71 CO -0.01 0.66 0.34 -0.33 -1.23 0.00 0.00 177.57 177.01 3i15 h GLU 72 N 0.27 0.99 -0.22 5.19 5.08 -0.98 -0.73 114.58 124.18 3i15 h GLU 72 Ca -0.04 -0.14 -0.08 0.00 -1.00 0.00 0.00 59.36 58.10 3i15 h GLU 72 Cb 1.37 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 3i15 h GLU 72 CO 0.13 0.77 -0.18 -0.22 -1.00 0.00 0.00 179.01 178.52 3i15 h LYS 73 N 0.96 0.51 0.16 2.33 3.64 -1.30 -0.36 116.57 122.51 3i15 h LYS 73 Ca 0.24 -0.25 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 3i15 h LYS 73 Cb 0.10 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 3i15 h LYS 73 CO -0.03 0.83 -0.08 -0.22 -2.27 0.00 0.00 179.45 177.68 3i15 h LYS 74 N 0.21 -0.21 -0.00 1.90 3.64 -1.16 -3.27 116.57 117.68 3i15 h LYS 74 Ca 0.04 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 3i15 h LYS 74 Cb 0.71 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.58 3i15 h LYS 74 CO 0.05 0.03 -0.31 1.19 -2.27 0.00 0.00 179.45 178.15 3i15 n PHE 75 N -5.09 0.00 -3.63 1.91 3.72 -0.30 -4.97 117.46 109.12 3i15 n PHE 75 Ca -0.09 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.08 3i15 n PHE 75 Cb 0.19 -0.29 0.07 0.00 -0.94 0.00 0.00 39.48 38.50 3i15 n PHE 75 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3i15 n GLN 76 N -1.35 -6.74 -3.74 -1.08 1.13 -0.15 -5.00 117.38 100.45 3i15 n GLN 76 Ca 0.08 0.76 -0.10 0.00 -1.94 0.00 0.00 57.00 55.80 3i15 n GLN 76 Cb 0.33 -5.71 -0.04 0.00 0.11 0.00 0.00 30.24 24.93 3i15 n GLN 76 CO 0.00 0.00 0.00 -1.59 -1.44 0.00 0.00 177.06 174.03 3i15 s LYS 77 N -6.06 1.39 0.32 -1.09 -2.85 -1.21 -5.08 119.74 105.17 3i15 s LYS 77 Ca 0.36 -0.87 -0.11 0.00 -1.00 0.00 0.00 55.97 54.35 3i15 s LYS 77 Cb -0.17 0.52 -0.07 0.00 -2.06 0.00 0.00 37.83 36.05 3i15 s LYS 77 CO 0.76 -0.59 0.68 1.03 0.10 0.00 0.00 175.35 177.33 3i15 s ARG 78 N -3.88 3.83 -0.08 1.78 1.81 -1.26 -4.34 118.95 116.81 3i15 s ARG 78 Ca 0.09 0.42 -0.30 0.00 -1.72 0.00 0.00 55.73 54.23 3i15 s ARG 78 Cb -0.01 -2.49 -0.03 0.00 -0.45 0.00 0.00 34.95 31.97 3i15 s ARG 78 CO -0.02 0.14 1.17 0.08 -0.68 0.00 0.00 175.30 175.99 3i15 s VAL 79 N -2.09 4.35 -0.09 3.52 1.01 -1.26 -0.25 120.40 125.58 3i15 s VAL 79 Ca 0.50 1.66 0.11 0.00 0.00 0.00 0.00 61.98 64.25 3i15 s VAL 79 Cb -0.11 -4.07 -0.15 0.00 0.00 0.00 0.00 36.38 32.05 3i15 s VAL 79 CO 0.24 -0.02 0.09 0.35 0.00 0.00 0.00 175.10 175.77 3i15 n THR 80 N 4.72 0.60 -3.80 3.92 -2.24 -0.08 -4.80 114.28 112.60 3i15 n THR 80 Ca 0.11 -0.44 -0.13 0.00 -2.27 0.00 0.00 64.05 61.32 3i15 n THR 80 Cb 0.46 -0.48 -0.09 0.00 -2.10 0.00 0.00 70.33 68.12 3i15 n THR 80 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3i15 s ASP 81 N -4.18 -0.13 -0.01 3.42 1.11 -1.23 -1.89 116.67 113.76 3i15 s ASP 81 Ca -0.05 0.05 0.01 0.00 0.18 0.00 0.00 52.55 52.74 3i15 s ASP 81 Cb 0.04 0.31 0.00 0.00 1.07 0.00 0.00 42.92 44.35 3i15 s ASP 81 CO 0.48 -0.38 -0.03 -0.69 1.18 0.00 0.00 175.17 175.73 3i15 s VAL 82 N -1.17 0.27 -0.24 -1.27 1.01 0.48 -1.16 120.40 118.31 3i15 s VAL 82 Ca -0.12 -0.11 -0.08 0.00 0.00 0.00 0.00 61.98 61.67 3i15 s VAL 82 Cb -0.06 -0.25 -0.04 0.00 0.00 0.00 0.00 36.38 36.03 3i15 s VAL 82 CO 0.03 0.09 0.10 -0.63 0.00 0.00 0.00 175.10 174.70 3i15 s ILE 83 N 0.15 4.70 -0.27 2.22 1.01 0.12 -0.18 121.20 128.94 3i15 s ILE 83 Ca -0.01 -0.04 -0.11 0.00 0.00 0.00 0.00 60.65 60.48 3i15 s ILE 83 Cb -0.04 -3.19 -0.05 0.00 0.01 0.00 0.00 42.46 39.19 3i15 s ILE 83 CO -0.00 0.34 0.20 -0.63 0.00 0.00 0.00 174.94 174.84 3i15 s ILE 84 N 1.38 5.31 -0.45 2.92 1.01 -0.29 -0.29 121.20 130.79 3i15 s ILE 84 Ca 0.06 0.21 0.23 0.00 0.00 0.00 0.00 60.65 61.15 3i15 s ILE 84 Cb -0.15 -3.54 0.11 0.00 0.01 0.00 0.00 42.46 38.90 3i15 s ILE 84 CO 0.05 0.27 1.32 0.71 0.00 0.00 0.00 174.94 177.29 3i15 h THR 85 N 5.26 0.00 -2.22 2.92 1.35 -1.89 -3.43 112.91 114.90 3i15 h THR 85 Ca -0.36 -0.80 0.20 0.00 -0.55 0.00 0.00 66.41 64.91 3i15 h THR 85 Cb 1.18 1.47 -0.08 0.00 -1.73 0.00 0.00 68.15 69.00 3i15 h THR 85 CO 0.59 0.00 0.58 -1.38 -0.25 0.00 0.00 175.52 175.06 3i15 s HIS 86 N -3.25 -0.06 -2.27 4.73 0.00 -1.26 -1.65 115.29 111.53 3i15 s HIS 86 Ca 0.04 -0.23 0.20 0.00 -3.00 0.00 0.00 55.06 52.07 3i15 s HIS 86 Cb 0.10 0.64 0.59 0.00 -4.00 0.00 0.00 32.58 29.91 3i15 s HIS 86 CO 0.73 -0.74 1.46 0.00 -1.00 0.00 0.00 174.74 175.18 3i15 n ALA 87 N -0.54 2.48 -1.59 -1.38 0.00 -1.26 -4.17 120.51 114.05 3i15 n ALA 87 Ca -0.06 -0.68 -0.39 0.00 0.00 0.00 0.00 53.44 52.31 3i15 n ALA 87 Cb 0.61 -1.01 0.03 0.00 0.00 0.00 0.00 19.45 19.08 3i15 n ALA 87 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3i15 n HIS 88 N 0.69 0.76 -0.32 0.00 8.25 -1.26 -4.56 115.22 118.78 3i15 n HIS 88 Ca 0.17 0.49 0.20 0.00 -0.26 0.00 0.00 57.72 58.31 3i15 n HIS 88 Cb 0.40 -2.15 0.39 0.00 1.12 0.00 0.00 29.99 29.75 3i15 n HIS 88 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3i15 h ALA 89 N 0.93 1.57 -0.00 -1.41 0.00 -1.96 0.89 119.26 119.29 3i15 h ALA 89 Ca -0.46 0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3i15 h ALA 89 Cb 1.36 0.38 0.00 0.00 0.00 0.00 0.00 17.79 19.53 3i15 h ALA 89 CO 0.53 -0.64 -0.09 -0.25 0.00 0.00 0.00 179.25 178.80 3i15 n ASP 90 N -5.29 0.11 -0.11 0.00 8.00 -1.26 -1.49 116.55 116.51 3i15 n ASP 90 Ca 0.28 0.27 -0.14 0.00 0.71 0.00 0.00 54.79 55.90 3i15 n ASP 90 Cb 0.91 -0.33 -0.12 0.00 -0.02 0.00 0.00 41.12 41.55 3i15 n ASP 90 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3i15 n ARG 91 N -1.46 0.70 0.00 -1.24 5.12 0.17 -3.64 116.66 116.32 3i15 n ARG 91 Ca 0.08 0.09 0.14 0.00 -1.93 0.00 0.00 57.85 56.23 3i15 n ARG 91 Cb 0.33 -1.48 0.61 0.00 -1.16 0.00 0.00 32.46 30.76 3i15 n ARG 91 CO 0.00 0.00 0.00 1.51 -1.93 0.00 0.00 177.63 177.21 3i15 n ILE 92 N -3.05 0.00 0.27 0.55 0.13 -0.40 -4.48 119.36 112.37 3i15 n ILE 92 Ca -0.39 -0.00 0.12 0.00 -1.10 0.00 0.00 62.75 61.38 3i15 n ILE 92 Cb 1.00 -0.40 0.75 0.00 -0.84 0.00 0.00 39.64 40.15 3i15 n ILE 92 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 3i15 h GLY 93 N 5.00 0.00 -2.33 4.50 0.00 -1.42 -1.12 103.07 107.70 3i15 h GLY 93 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3i15 h GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 3i15 n GLY 94 N -1.02 1.93 0.37 4.60 0.00 -1.25 -3.36 105.19 106.46 3i15 n GLY 94 Ca -0.02 -0.64 0.03 0.00 0.00 0.00 0.00 46.02 45.38 3i15 n GLY 94 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3i15 h ILE 95 N 3.27 1.10 -0.48 -0.61 6.09 -1.53 -1.47 117.51 123.87 3i15 h ILE 95 Ca 0.00 -0.40 0.06 0.00 -1.37 0.00 0.00 64.86 63.16 3i15 h ILE 95 Cb 1.00 -0.16 -0.05 0.00 0.47 0.00 0.00 36.82 38.07 3i15 h ILE 95 CO 0.10 0.21 0.18 0.50 -3.07 0.00 0.00 178.15 176.07 3i15 h LYS 96 N 1.16 0.35 -0.39 2.19 3.64 -1.83 -0.72 116.57 120.95 3i15 h LYS 96 Ca 0.42 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.76 3i15 h LYS 96 Cb 0.15 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 3i15 h LYS 96 CO -0.16 0.23 0.19 1.15 -2.27 0.00 0.00 179.45 178.59 3i15 h THR 97 N 0.36 1.17 -0.32 1.00 2.02 -1.65 -1.68 112.91 113.81 3i15 h THR 97 Ca 0.23 -0.47 0.01 0.00 0.77 0.00 0.00 66.41 66.96 3i15 h THR 97 Cb 0.23 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 3i15 h THR 97 CO -0.23 0.18 0.18 -0.07 0.37 0.00 0.00 175.52 175.95 3i15 h LEU 98 N 0.49 0.30 -0.46 2.58 3.38 -0.72 -2.27 115.31 118.61 3i15 h LEU 98 Ca 0.13 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 3i15 h LEU 98 Cb 0.11 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 3i15 h LEU 98 CO -0.02 0.22 0.05 0.11 0.09 0.00 0.00 178.44 178.89 3i15 h LYS 99 N 0.38 0.78 0.00 1.13 1.79 -1.02 -1.36 116.57 118.27 3i15 h LYS 99 Ca 0.13 -0.22 -0.06 0.00 -2.18 0.00 0.00 60.65 58.32 3i15 h LYS 99 Cb 0.01 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.57 3i15 h LYS 99 CO -0.06 0.81 -0.27 1.05 -1.08 0.00 0.00 179.45 179.90 3i15 h GLU 100 N 0.64 0.00 -0.01 3.15 4.11 -1.19 -2.79 114.58 118.49 3i15 h GLU 100 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.57 3i15 h GLU 100 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 3i15 h GLU 100 CO 0.01 0.27 -0.15 0.54 0.07 0.00 0.00 179.01 179.76 3i15 n ARG 101 N -3.37 1.05 -2.19 1.06 1.74 -0.86 -4.95 116.66 109.14 3i15 n ARG 101 Ca 0.01 -0.56 -0.06 0.00 -0.77 0.00 0.00 57.85 56.47 3i15 n ARG 101 Cb 0.48 -1.49 -0.00 0.00 -1.02 0.00 0.00 32.46 30.43 3i15 n ARG 101 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3i15 n GLY 102 N 1.27 0.17 3.65 -0.13 0.00 -1.02 -5.03 105.19 104.10 3i15 n GLY 102 Ca 0.15 -0.61 -0.39 0.00 0.00 0.00 0.00 46.02 45.17 3i15 n GLY 102 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3i15 s ILE 103 N -2.39 5.13 -0.02 -0.61 1.01 -0.54 -4.98 121.20 118.81 3i15 s ILE 103 Ca 0.02 0.82 -0.30 0.00 0.00 0.00 0.00 60.65 61.19 3i15 s ILE 103 Cb -0.01 -3.79 -0.05 0.00 0.01 0.00 0.00 42.46 38.63 3i15 s ILE 103 CO 0.02 0.18 1.38 -0.54 0.00 0.00 0.00 174.94 175.98 3i15 s LYS 104 N 1.73 4.28 -0.48 2.79 1.02 -0.79 -4.32 119.74 123.96 3i15 s LYS 104 Ca 0.21 1.92 -0.07 0.00 0.02 0.00 0.00 55.97 58.04 3i15 s LYS 104 Cb -0.15 -3.61 0.13 0.00 -0.52 0.00 0.00 37.83 33.68 3i15 s LYS 104 CO 0.09 -0.58 0.34 0.00 -0.92 0.00 0.00 175.35 174.28 3i15 s ALA 105 N 2.54 3.38 0.26 5.17 0.00 -1.26 -0.39 121.76 131.47 3i15 s ALA 105 Ca 0.63 -2.64 -0.23 0.00 0.00 0.00 0.00 51.96 49.72 3i15 s ALA 105 Cb -0.30 -2.74 -0.09 0.00 0.00 0.00 0.00 23.12 19.99 3i15 s ALA 105 CO 0.25 -1.91 0.83 -1.01 0.00 0.00 0.00 175.76 173.91 3i15 s HIS 106 N 1.13 3.68 0.21 0.00 3.76 0.74 -0.37 115.29 124.44 3i15 s HIS 106 Ca 0.08 1.58 -0.23 0.00 -0.15 0.00 0.00 55.06 56.34 3i15 s HIS 106 Cb -0.24 -2.76 0.05 0.00 1.11 0.00 0.00 32.58 30.73 3i15 s HIS 106 CO -0.02 0.29 0.73 -1.54 -0.85 0.00 0.00 174.74 173.35 3i15 s SER 107 N -1.61 -0.35 0.82 1.40 1.04 -1.26 -1.14 113.70 112.60 3i15 s SER 107 Ca 0.46 -0.36 -0.11 0.00 0.48 0.00 0.00 55.95 56.42 3i15 s SER 107 Cb -0.18 0.63 0.08 0.00 0.10 0.00 0.00 66.02 66.66 3i15 s SER 107 CO 0.23 -1.12 1.09 0.42 0.98 0.00 0.00 173.24 174.83 3i15 s THR 108 N -3.72 3.06 0.26 2.02 -4.23 -1.26 -0.84 115.64 110.93 3i15 s THR 108 Ca 0.08 0.34 -0.05 0.00 -1.18 0.00 0.00 61.69 60.88 3i15 s THR 108 Cb -0.04 -2.96 0.25 0.00 1.34 0.00 0.00 72.50 71.09 3i15 s THR 108 CO -0.01 -0.45 1.92 0.00 -0.54 0.00 0.00 174.62 175.55 3i15 h ALA 109 N -1.22 1.29 -0.41 3.99 0.00 -1.69 -1.97 119.26 119.25 3i15 h ALA 109 Ca -0.47 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.34 3i15 h ALA 109 Cb 1.26 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 3i15 h ALA 109 CO 0.56 0.63 0.18 1.25 0.00 0.00 0.00 179.25 181.87 3i15 h LEU 110 N 1.25 0.56 -0.74 0.00 5.85 -1.92 0.57 115.31 120.88 3i15 h LEU 110 Ca 0.33 -0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.92 3i15 h LEU 110 Cb -0.09 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 40.75 3i15 h LEU 110 CO -0.07 0.55 0.48 0.74 -0.34 0.00 0.00 178.44 179.80 3i15 h THR 111 N 0.53 1.16 -0.65 1.05 2.02 -1.83 -0.67 112.91 114.51 3i15 h THR 111 Ca 0.14 -0.33 -0.09 0.00 0.77 0.00 0.00 66.41 66.90 3i15 h THR 111 Cb 0.15 0.11 -0.03 0.00 -1.74 0.00 0.00 68.15 66.65 3i15 h THR 111 CO -0.01 0.18 0.07 0.00 0.37 0.00 0.00 175.52 176.12 3i15 h ALA 112 N 1.28 0.89 -0.00 6.16 0.00 -0.88 -0.14 119.26 126.56 3i15 h ALA 112 Ca 0.28 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 3i15 h ALA 112 Cb -0.07 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 3i15 h ALA 112 CO -0.08 0.67 -0.63 1.05 0.00 0.00 0.00 179.25 180.26 3i15 h GLU 113 N 1.02 0.02 -0.52 0.00 4.11 -0.36 -1.48 114.58 117.38 3i15 h GLU 113 Ca 0.19 -0.01 -0.12 0.00 0.07 0.00 0.00 59.36 59.49 3i15 h GLU 113 Cb 0.48 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 3i15 h GLU 113 CO 0.02 0.64 -0.15 -0.07 0.07 0.00 0.00 179.01 179.52 3i15 h LEU 114 N 0.01 1.02 -0.17 3.06 3.38 -0.98 -0.39 115.31 121.26 3i15 h LEU 114 Ca -0.01 -0.37 0.04 0.00 0.09 0.00 0.00 57.88 57.63 3i15 h LEU 114 Cb 1.12 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.55 3i15 h LEU 114 CO 0.08 1.16 -0.07 0.00 0.09 0.00 0.00 178.44 179.71 3i15 h ALA 115 N 0.90 0.08 -0.25 1.53 0.00 -0.72 -1.94 119.26 118.87 3i15 h ALA 115 Ca 0.13 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 3i15 h ALA 115 Cb 0.72 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 3i15 h ALA 115 CO 0.06 -0.50 0.13 -0.22 0.00 0.00 0.00 179.25 178.71 3i15 h LYS 116 N -0.04 0.35 -0.96 0.00 3.64 -1.10 -0.02 116.57 118.44 3i15 h LYS 116 Ca 0.09 -0.04 0.19 0.00 -1.27 0.00 0.00 60.65 59.61 3i15 h LYS 116 Cb 0.17 -0.07 -0.09 0.00 -0.41 0.00 0.00 32.23 31.84 3i15 h LYS 116 CO -0.19 0.33 0.61 -0.22 -2.27 0.00 0.00 179.45 177.70 3i15 h LYS 117 N 0.29 0.62 -0.51 1.90 3.64 -0.85 -1.74 116.57 119.91 3i15 h LYS 117 Ca 0.09 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 3i15 h LYS 117 Cb 0.08 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.76 3i15 h LYS 117 CO -0.01 0.41 0.00 0.09 -2.27 0.00 0.00 179.45 177.67 3i15 n ASN 118 N -4.64 2.75 0.00 4.20 5.03 -0.75 -4.92 115.26 116.93 3i15 n ASN 118 Ca 0.21 -2.01 0.00 0.00 0.87 0.00 0.00 54.58 53.65 3i15 n ASN 118 Cb 0.60 -0.34 0.00 0.00 -1.02 0.00 0.00 39.78 39.02 3i15 n ASN 118 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3i15 n GLY 119 N 1.30 0.69 3.90 7.41 0.00 -0.65 -5.06 105.19 112.78 3i15 n GLY 119 Ca 0.17 -0.14 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 3i15 n GLY 119 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3i15 s TYR 120 N -2.00 3.47 0.65 1.61 1.51 -0.07 -5.01 117.35 117.51 3i15 s TYR 120 Ca 0.00 0.67 -0.18 0.00 -1.01 0.00 0.00 57.07 56.55 3i15 s TYR 120 Cb 0.00 -2.12 -0.01 0.00 -0.11 0.00 0.00 41.96 39.72 3i15 s TYR 120 CO 0.00 0.22 1.28 -1.21 -1.11 0.00 0.00 175.55 174.74 3i15 s GLU 121 N -3.31 2.54 -0.17 -0.62 2.02 -1.26 -3.90 118.70 113.99 3i15 s GLU 121 Ca 0.44 2.03 -0.15 0.00 0.02 0.00 0.00 54.97 57.31 3i15 s GLU 121 Cb -0.11 -1.85 -0.04 0.00 0.10 0.00 0.00 34.13 32.23 3i15 s GLU 121 CO 0.28 -1.60 0.37 -1.21 0.02 0.00 0.00 175.26 173.11 3i15 s GLU 122 N -3.41 4.23 0.93 1.61 2.02 -1.26 -4.74 118.70 118.07 3i15 s GLU 122 Ca 0.82 0.19 -0.16 0.00 0.02 0.00 0.00 54.97 55.85 3i15 s GLU 122 Cb -0.37 -3.48 0.23 0.00 0.10 0.00 0.00 34.13 30.62 3i15 s GLU 122 CO 0.40 0.10 0.83 -0.35 0.02 0.00 0.00 175.26 176.26 3i15 n PRO 123 N 3.99 -2.58 0.16 0.39 -0.04 -1.26 -4.97 135.00 130.69 3i15 n PRO 123 Ca -0.10 -1.33 0.04 0.00 -0.04 0.00 0.00 63.50 62.08 3i15 n PRO 123 Cb 0.51 -1.23 0.11 0.00 -0.04 0.00 0.00 33.50 32.85 3i15 n PRO 123 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3i15 h LEU 124 N 0.00 0.00 2.67 1.53 3.38 -0.99 -3.46 115.31 118.43 3i15 h LEU 124 Ca -0.31 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.29 3i15 h LEU 124 Cb 0.95 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.68 3i15 h LEU 124 CO 0.20 0.42 -0.48 0.61 0.09 0.00 0.00 178.44 179.28 3i15 n GLY 125 N 1.02 -0.40 0.12 0.83 0.00 -1.12 -4.91 105.19 100.73 3i15 n GLY 125 Ca 0.02 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.06 3i15 n GLY 125 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3i15 h ASP 126 N -0.00 0.00 -3.50 1.61 2.03 -1.26 -3.29 116.42 112.01 3i15 h ASP 126 Ca -0.44 -0.06 -0.53 0.00 -0.73 0.00 0.00 57.03 55.26 3i15 h ASP 126 Cb 1.33 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.80 3i15 h ASP 126 CO 0.52 0.03 0.22 -0.76 -1.03 0.00 0.00 179.24 178.22 3i15 s LEU 127 N -5.15 4.51 0.00 0.15 1.43 -0.26 -4.99 118.68 114.37 3i15 s LEU 127 Ca 0.03 1.60 0.00 0.00 -1.03 0.00 0.00 54.13 54.73 3i15 s LEU 127 Cb 0.10 -3.35 0.00 0.00 0.03 0.00 0.00 46.19 42.97 3i15 s LEU 127 CO 0.75 0.06 0.00 0.00 0.23 0.00 0.00 176.35 177.39 3i15 n GLN 128 N 2.39 2.73 -0.14 1.70 1.13 -1.26 -3.98 117.38 119.96 3i15 n GLN 128 Ca -0.02 0.00 -0.10 0.00 -1.94 0.00 0.00 57.00 54.94 3i15 n GLN 128 Cb 0.49 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.83 3i15 n GLN 128 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 3i15 h THR 129 N -0.00 1.25 -3.15 5.09 2.02 -1.92 -3.41 112.91 112.79 3i15 h THR 129 Ca 0.00 -0.95 -0.57 0.00 0.77 0.00 0.00 66.41 65.66 3i15 h THR 129 Cb 0.00 1.08 -0.36 0.00 -1.74 0.00 0.00 68.15 67.13 3i15 h THR 129 CO 0.00 0.32 -0.82 -0.69 0.37 0.00 0.00 175.52 174.70 3i15 s VAL 130 N -5.08 1.35 -0.06 3.16 1.01 -1.26 -0.65 120.40 118.87 3i15 s VAL 130 Ca -0.13 -0.50 0.04 0.00 0.00 0.00 0.00 61.98 61.39 3i15 s VAL 130 Cb 0.10 -1.31 0.00 0.00 0.00 0.00 0.00 36.38 35.17 3i15 s VAL 130 CO 0.79 0.42 -0.18 -0.89 0.00 0.00 0.00 175.10 175.23 3i15 s THR 131 N 1.57 1.54 -0.23 3.92 2.01 -0.67 -5.00 115.64 118.79 3i15 s THR 131 Ca 0.05 -0.75 -0.04 0.00 0.31 0.00 0.00 61.69 61.26 3i15 s THR 131 Cb -0.13 -1.34 -0.01 0.00 0.01 0.00 0.00 72.50 71.03 3i15 s THR 131 CO -0.10 0.44 -0.02 0.20 -0.69 0.00 0.00 174.62 174.46 3i15 s ASN 132 N 0.27 4.47 0.13 3.53 0.01 -1.26 -0.79 114.94 121.30 3i15 s ASN 132 Ca -0.10 -0.39 0.08 0.00 -0.71 0.00 0.00 52.86 51.74 3i15 s ASN 132 Cb -0.14 -1.77 -0.04 0.00 0.41 0.00 0.00 41.25 39.70 3i15 s ASN 132 CO 0.04 -0.03 -0.14 -0.76 -1.51 0.00 0.00 177.10 174.71 3i15 s LEU 133 N 1.50 2.87 -0.05 0.60 1.43 0.54 -5.00 118.68 120.57 3i15 s LEU 133 Ca 0.06 -0.51 0.01 0.00 -1.03 0.00 0.00 54.13 52.65 3i15 s LEU 133 Cb -0.15 -1.66 0.02 0.00 0.03 0.00 0.00 46.19 44.44 3i15 s LEU 133 CO -0.02 0.16 -0.04 -0.75 0.23 0.00 0.00 176.35 175.93 3i15 s LYS 134 N -2.32 0.79 -0.29 1.70 2.20 -1.26 -1.09 119.74 119.46 3i15 s LYS 134 Ca 0.21 -0.07 0.03 0.00 -0.36 0.00 0.00 55.97 55.77 3i15 s LYS 134 Cb -0.10 -0.85 0.08 0.00 -1.51 0.00 0.00 37.83 35.44 3i15 s LYS 134 CO 0.12 -0.11 -0.03 -0.06 -0.36 0.00 0.00 175.35 174.91 3i15 s PHE 135 N 1.06 3.30 0.00 4.03 0.08 -0.04 -4.96 117.98 121.45 3i15 s PHE 135 Ca -0.09 -2.51 0.00 0.00 0.12 0.00 0.00 56.93 54.45 3i15 s PHE 135 Cb -0.14 -2.28 0.00 0.00 -0.57 0.00 0.00 43.02 40.03 3i15 s PHE 135 CO -0.01 -0.90 0.00 0.41 -0.10 0.00 0.00 175.22 174.63 3i15 n GLY 136 N 4.40 3.99 0.86 4.36 0.00 -1.26 -0.57 105.19 116.97 3i15 n GLY 136 Ca -0.06 0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.12 3i15 n GLY 136 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3i15 n ASN 137 N 8.58 2.68 -4.65 1.61 4.05 -1.26 -4.94 115.26 121.33 3i15 n ASN 137 Ca 0.00 -1.89 -0.42 0.00 0.45 0.00 0.00 54.58 52.71 3i15 n ASN 137 Cb 0.00 -0.00 -0.03 0.00 1.23 0.00 0.00 39.78 40.98 3i15 n ASN 137 CO 0.00 0.00 0.00 -0.32 -3.05 0.00 0.00 177.26 173.89 3i15 s MET 138 N -2.00 4.21 -0.04 1.20 1.75 0.27 -5.04 119.30 119.65 3i15 s MET 138 Ca 0.30 1.12 -0.17 0.00 -1.25 0.00 0.00 55.69 55.69 3i15 s MET 138 Cb 0.20 -3.65 -0.05 0.00 2.84 0.00 0.00 34.83 34.17 3i15 s MET 138 CO 0.31 -0.59 0.47 0.15 -0.65 0.00 0.00 175.02 174.71 3i15 s LYS 139 N 3.04 4.16 -0.04 4.11 1.02 -1.26 -0.86 119.74 129.91 3i15 s LYS 139 Ca 0.39 0.49 0.01 0.00 0.02 0.00 0.00 55.97 56.88 3i15 s LYS 139 Cb -0.15 -3.32 0.02 0.00 -0.52 0.00 0.00 37.83 33.86 3i15 s LYS 139 CO 0.07 0.45 -0.03 0.08 -0.92 0.00 0.00 175.35 175.00 3i15 s VAL 140 N -0.34 0.40 -0.10 3.17 1.01 -0.25 -4.20 120.40 120.08 3i15 s VAL 140 Ca 0.26 -0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.21 3i15 s VAL 140 Cb -0.17 -0.45 -0.01 0.00 0.00 0.00 0.00 36.38 35.76 3i15 s VAL 140 CO 0.13 0.19 -0.19 -0.70 0.00 0.00 0.00 175.10 174.53 3i15 s GLU 141 N 0.88 3.10 -0.03 2.72 2.12 0.25 -0.34 118.70 127.41 3i15 s GLU 141 Ca -0.11 -0.80 -0.01 0.00 0.36 0.00 0.00 54.97 54.42 3i15 s GLU 141 Cb -0.14 -2.42 -0.04 0.00 0.26 0.00 0.00 34.13 31.80 3i15 s GLU 141 CO -0.00 0.24 0.04 0.95 -0.54 0.00 0.00 175.26 175.94 3i15 s THR 142 N 0.24 4.48 -0.04 -1.70 -4.23 0.03 -0.25 115.64 114.18 3i15 s THR 142 Ca -0.13 -0.39 -0.01 0.00 -1.18 0.00 0.00 61.69 59.98 3i15 s THR 142 Cb -0.16 -2.99 0.03 0.00 1.34 0.00 0.00 72.50 70.72 3i15 s THR 142 CO 0.07 0.44 0.07 0.12 -0.54 0.00 0.00 174.62 174.78 3i15 s PHE 143 N -1.07 -0.00 -0.46 3.99 5.36 -0.38 -1.67 117.98 123.74 3i15 s PHE 143 Ca 0.19 0.26 -0.20 0.00 -0.96 0.00 0.00 56.93 56.22 3i15 s PHE 143 Cb -0.12 -0.31 0.04 0.00 -0.34 0.00 0.00 43.02 42.28 3i15 s PHE 143 CO 0.09 -0.15 0.62 -0.47 -1.46 0.00 0.00 175.22 173.84 3i15 s TYR 144 N 1.62 3.06 -1.90 10.12 5.04 0.17 -1.06 117.35 134.41 3i15 s TYR 144 Ca -0.03 -0.27 0.27 0.00 -2.44 0.00 0.00 57.07 54.60 3i15 s TYR 144 Cb -0.12 -3.37 0.90 0.00 0.35 0.00 0.00 41.96 39.72 3i15 s TYR 144 CO -0.04 -0.92 1.66 -0.35 -1.34 0.00 0.00 175.55 174.56 3i15 n PRO 145 N 6.18 0.99 0.00 4.97 -0.04 -1.26 -4.93 135.00 140.91 3i15 n PRO 145 Ca -0.04 -0.55 0.00 0.00 -0.04 0.00 0.00 63.50 62.87 3i15 n PRO 145 Cb 0.47 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 3i15 n PRO 145 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3i15 n GLY 146 N 1.29 1.16 3.79 0.55 0.00 -1.26 -4.41 105.19 106.31 3i15 n GLY 146 Ca 0.14 -2.27 -0.34 0.00 0.00 0.00 0.00 46.02 43.56 3i15 n GLY 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i15 s LYS 147 N -1.21 3.60 0.00 1.61 1.02 -1.26 -4.65 119.74 118.85 3i15 s LYS 147 Ca 0.00 1.37 0.00 0.00 0.02 0.00 0.00 55.97 57.36 3i15 s LYS 147 Cb 0.00 -2.06 0.00 0.00 -0.52 0.00 0.00 37.83 35.25 3i15 s LYS 147 CO 0.00 -0.60 0.00 0.41 -0.92 0.00 0.00 175.35 174.24 3i15 n GLY 148 N -0.33 -0.40 0.35 -3.33 0.00 -1.26 -2.96 105.19 97.27 3i15 n GLY 148 Ca 0.10 0.53 0.01 0.00 0.00 0.00 0.00 46.02 46.65 3i15 n GLY 148 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3i15 h HIS 149 N 0.00 1.14 -4.38 1.61 -0.00 -1.89 0.87 115.15 112.49 3i15 h HIS 149 Ca 0.00 0.03 -0.34 0.00 -0.00 0.00 0.00 60.37 60.06 3i15 h HIS 149 Cb 0.00 -0.38 -0.14 0.00 -0.00 0.00 0.00 27.41 26.89 3i15 h HIS 149 CO 0.00 0.62 -0.58 0.95 -0.00 0.00 0.00 177.93 178.92 3i15 s THR 150 N -6.07 0.15 0.35 6.26 -4.23 -1.26 -3.08 115.64 107.76 3i15 s THR 150 Ca -0.13 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.62 3i15 s THR 150 Cb 0.19 -2.52 0.25 0.00 1.34 0.00 0.00 72.50 71.76 3i15 s THR 150 CO 0.81 0.00 1.98 1.05 -0.54 0.00 0.00 174.62 177.92 3i15 h GLU 151 N 2.40 0.00 -0.00 3.99 4.11 -1.85 -3.31 114.58 119.91 3i15 h GLU 151 Ca -0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.09 3i15 h GLU 151 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 3i15 h GLU 151 CO 0.51 0.18 -0.52 -0.40 0.07 0.00 0.00 179.01 178.85 3i15 n ASP 152 N -3.68 0.63 -4.63 3.06 5.75 -1.26 -4.35 116.55 112.07 3i15 n ASP 152 Ca -0.01 -0.81 -0.48 0.00 -0.01 0.00 0.00 54.79 53.47 3i15 n ASP 152 Cb 0.30 0.95 -0.04 0.00 -1.03 0.00 0.00 41.12 41.30 3i15 n ASP 152 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 3i15 n ASN 153 N -1.16 2.16 -4.59 -1.12 2.04 -1.25 -4.79 115.26 106.56 3i15 n ASN 153 Ca 0.02 1.13 -0.23 0.00 -0.44 0.00 0.00 54.58 55.06 3i15 n ASN 153 Cb 0.19 -1.31 -0.08 0.00 -2.53 0.00 0.00 39.78 36.04 3i15 n ASN 153 CO 0.00 0.00 0.00 0.27 -0.44 0.00 0.00 177.26 177.09 3i15 s ILE 154 N 0.21 3.04 0.32 1.53 -4.36 -0.66 -4.36 121.20 116.92 3i15 s ILE 154 Ca 0.75 -2.08 0.09 0.00 -0.26 0.00 0.00 60.65 59.15 3i15 s ILE 154 Cb -0.78 -2.66 -0.04 0.00 1.25 0.00 0.00 42.46 40.22 3i15 s ILE 154 CO 0.47 -0.36 0.08 0.68 0.24 0.00 0.00 174.94 176.05 3i15 s VAL 155 N -2.41 3.07 -0.04 8.37 -7.23 -0.22 -4.70 120.40 117.24 3i15 s VAL 155 Ca 0.31 -1.80 0.03 0.00 -1.81 0.00 0.00 61.98 58.72 3i15 s VAL 155 Cb -0.05 -2.92 0.00 0.00 0.56 0.00 0.00 36.38 33.97 3i15 s VAL 155 CO 0.18 -0.23 -0.12 -0.69 -0.31 0.00 0.00 175.10 173.93 3i15 s VAL 156 N -2.42 1.03 -0.04 1.32 1.01 -0.73 -1.25 120.40 119.32 3i15 s VAL 156 Ca 0.36 -0.47 0.06 0.00 0.00 0.00 0.00 61.98 61.92 3i15 s VAL 156 Cb -0.03 -0.91 -0.01 0.00 0.00 0.00 0.00 36.38 35.43 3i15 s VAL 156 CO 0.21 0.32 -0.21 0.86 0.00 0.00 0.00 175.10 176.28 3i15 s TRP 157 N 0.28 2.02 -0.60 5.22 -0.11 0.65 -0.21 118.94 126.20 3i15 s TRP 157 Ca -0.06 -0.53 -0.05 0.00 1.22 0.00 0.00 56.10 56.68 3i15 s TRP 157 Cb -0.11 -1.33 0.16 0.00 -1.50 0.00 0.00 33.47 30.68 3i15 s TRP 157 CO 0.02 -0.14 0.44 -0.51 -4.62 0.00 0.00 176.95 172.13 3i15 s LEU 158 N -0.19 5.49 0.60 5.86 1.02 -0.35 -0.58 118.68 130.52 3i15 s LEU 158 Ca -0.00 -2.61 0.38 0.00 0.02 0.00 0.00 54.13 51.92 3i15 s LEU 158 Cb -0.11 -1.92 1.85 0.00 0.02 0.00 0.00 46.19 46.03 3i15 s LEU 158 CO 0.02 -0.46 2.17 1.55 0.02 0.00 0.00 176.35 179.65 3i15 h PRO 159 N 7.44 0.00 0.00 1.29 0.13 -1.87 0.09 132.00 139.08 3i15 h PRO 159 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 3i15 h PRO 159 Cb 0.99 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.12 3i15 h PRO 159 CO 0.73 0.02 0.00 1.96 -0.23 0.00 0.00 178.00 180.48 3i15 h GLN 160 N 0.00 0.00 0.00 0.86 4.20 -1.94 -3.29 115.11 114.94 3i15 h GLN 160 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3i15 h GLN 160 Cb 0.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.05 3i15 h GLN 160 CO 0.00 0.00 0.00 0.66 -0.67 0.00 0.00 178.83 178.82 3i15 n TYR 161 N -2.52 0.00 -4.14 2.96 4.01 -0.86 -5.03 117.16 111.58 3i15 n TYR 161 Ca 0.03 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.47 3i15 n TYR 161 Cb 0.34 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.32 3i15 n TYR 161 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3i15 n ASN 162 N -0.60 -0.62 -4.54 7.72 4.13 -0.04 -4.62 115.26 116.69 3i15 n ASN 162 Ca 0.00 -1.10 -0.35 0.00 1.68 0.00 0.00 54.58 54.81 3i15 n ASN 162 Cb 0.01 -2.50 -0.11 0.00 -1.54 0.00 0.00 39.78 35.64 3i15 n ASN 162 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3i15 s ILE 163 N -3.91 4.52 -0.19 2.41 1.01 -1.16 -0.53 121.20 123.35 3i15 s ILE 163 Ca 0.20 -0.12 -0.06 0.00 0.00 0.00 0.00 60.65 60.67 3i15 s ILE 163 Cb -0.11 -3.07 -0.03 0.00 0.01 0.00 0.00 42.46 39.26 3i15 s ILE 163 CO 0.94 0.41 0.03 -0.22 0.00 0.00 0.00 174.94 176.09 3i15 s LEU 164 N 0.93 3.52 -0.50 2.97 2.96 -0.29 -1.21 118.68 127.07 3i15 s LEU 164 Ca 0.04 -0.06 -0.18 0.00 -0.22 0.00 0.00 54.13 53.70 3i15 s LEU 164 Cb -0.14 -1.89 0.06 0.00 0.50 0.00 0.00 46.19 44.72 3i15 s LEU 164 CO 0.03 0.13 0.57 -0.69 -1.32 0.00 0.00 176.35 175.06 3i15 s VAL 165 N 0.64 4.96 -0.21 1.68 1.01 0.71 -0.31 120.40 128.89 3i15 s VAL 165 Ca 0.01 -0.63 0.19 0.00 0.00 0.00 0.00 61.98 61.55 3i15 s VAL 165 Cb -0.14 -4.26 0.18 0.00 0.00 0.00 0.00 36.38 32.17 3i15 s VAL 165 CO 0.02 -0.75 1.56 1.23 0.00 0.00 0.00 175.10 177.16 3i15 h GLY 166 N 9.48 0.00 0.00 4.51 0.00 -1.19 -1.95 103.07 113.92 3i15 h GLY 166 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.05 3i15 h GLY 166 CO 0.94 0.00 0.00 0.61 0.00 0.00 0.00 176.54 178.09 3i15 n GLY 167 N 1.02 0.25 4.23 4.60 0.00 -1.22 -3.64 105.19 110.42 3i15 n GLY 167 Ca 0.02 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.66 3i15 n GLY 167 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3i15 n LEU 169 N 0.00 0.00 -4.26 0.99 7.94 -1.26 -0.99 117.00 119.42 3i15 n LEU 169 Ca 0.00 0.00 -0.33 0.00 -1.11 0.00 0.00 56.01 54.57 3i15 n LEU 169 Cb 0.00 0.00 -0.15 0.00 0.53 0.00 0.00 43.42 43.80 3i15 n LEU 169 CO 0.00 0.00 -0.47 -0.69 -1.11 0.00 0.00 177.39 175.12 3i15 s VAL 170 N 0.00 2.68 0.05 1.96 1.01 -1.24 -4.86 120.40 120.01 3i15 s VAL 170 Ca 0.00 -0.76 -0.11 0.00 0.00 0.00 0.00 61.98 61.11 3i15 s VAL 170 Cb 0.00 -2.14 -0.06 0.00 0.00 0.00 0.00 36.38 34.18 3i15 s VAL 170 CO 0.00 0.51 0.40 -0.54 0.00 0.00 0.00 175.10 175.47 3i15 s LYS 171 N 0.88 3.80 0.72 2.72 -0.14 -1.26 -3.25 119.74 123.20 3i15 s LYS 171 Ca -0.04 0.23 -0.11 0.00 -1.36 0.00 0.00 55.97 54.70 3i15 s LYS 171 Cb -0.15 -3.06 0.02 0.00 -1.68 0.00 0.00 37.83 32.96 3i15 s LYS 171 CO -0.01 0.60 1.07 -1.54 -0.76 0.00 0.00 175.35 174.71 3i15 s SER 172 N -1.56 5.16 0.30 2.83 1.04 -1.25 -4.68 113.70 115.54 3i15 s SER 172 Ca 0.30 1.54 0.06 0.00 0.48 0.00 0.00 55.95 58.33 3i15 s SER 172 Cb -0.15 -2.38 0.76 0.00 0.10 0.00 0.00 66.02 64.36 3i15 s SER 172 CO 0.16 -1.57 1.75 0.74 0.98 0.00 0.00 173.24 175.30 3i15 h THR 173 N -0.81 0.62 0.00 2.02 2.02 -1.93 -0.53 112.91 114.30 3i15 h THR 173 Ca -0.45 -0.22 -0.01 0.00 0.77 0.00 0.00 66.41 66.51 3i15 h THR 173 Cb 1.22 -0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 67.56 3i15 h THR 173 CO 0.57 0.12 -0.05 0.77 0.37 0.00 0.00 175.52 177.30 3i15 h SER 174 N 0.64 0.00 -3.00 4.18 4.64 -1.95 -3.42 113.55 114.63 3i15 h SER 174 Ca 0.59 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 61.34 3i15 h SER 174 Cb 1.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.06 3i15 h SER 174 CO -0.43 0.05 0.81 0.00 -0.87 0.00 0.00 176.83 176.38 3i15 s ALA 175 N -3.71 3.59 -1.64 5.18 0.00 -0.21 -4.90 121.76 120.08 3i15 s ALA 175 Ca 0.01 0.51 0.15 0.00 0.00 0.00 0.00 51.96 52.63 3i15 s ALA 175 Cb 0.09 -3.57 0.26 0.00 0.00 0.00 0.00 23.12 19.91 3i15 s ALA 175 CO 0.56 -0.98 1.16 1.63 0.00 0.00 0.00 175.76 178.12 3i15 n LYS 176 N 5.96 1.92 -3.92 0.00 4.76 -1.26 -4.84 118.16 120.77 3i15 n LYS 176 Ca 0.12 -1.81 -0.11 0.00 -2.87 0.00 0.00 58.31 53.65 3i15 n LYS 176 Cb 0.46 -1.33 -0.00 0.00 -1.84 0.00 0.00 35.03 32.31 3i15 n LYS 176 CO 0.00 0.00 0.00 0.16 -1.37 0.00 0.00 177.40 176.19 3i15 s ASP 177 N -1.16 0.32 0.00 4.39 1.47 -1.26 -5.05 116.67 115.38 3i15 s ASP 177 Ca 0.25 -1.23 0.28 0.00 1.18 0.00 0.00 52.55 53.03 3i15 s ASP 177 Cb 0.15 0.77 1.29 0.00 -0.34 0.00 0.00 42.92 44.78 3i15 s ASP 177 CO 0.20 -1.51 1.94 0.18 0.68 0.00 0.00 175.17 176.66 3i15 n LEU 178 N -0.53 0.00 0.00 2.11 4.77 -1.26 -5.02 117.00 117.07 3i15 n LEU 178 Ca -0.05 0.43 0.00 0.00 -0.03 0.00 0.00 56.01 56.36 3i15 n LEU 178 Cb 0.60 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 3i15 n LEU 178 CO 0.27 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 3i15 n GLY 179 N 1.32 0.69 3.59 -0.72 0.00 -1.26 -4.67 105.19 104.13 3i15 n GLY 179 Ca 0.09 -0.86 -0.42 0.00 0.00 0.00 0.00 46.02 44.83 3i15 n GLY 179 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3i15 s ASN 180 N -4.00 5.84 -0.10 1.61 2.47 -1.26 -4.86 114.94 114.64 3i15 s ASN 180 Ca 0.00 0.89 0.18 0.00 0.42 0.00 0.00 52.86 54.35 3i15 s ASN 180 Cb 0.00 -2.53 0.65 0.00 -1.45 0.00 0.00 41.25 37.92 3i15 s ASN 180 CO 0.00 -1.82 1.56 1.33 -3.72 0.00 0.00 177.10 174.45 3i15 n VAL 181 N 7.26 1.73 -0.13 -5.21 0.24 -1.26 -4.64 118.33 116.32 3i15 n VAL 181 Ca 0.20 -1.23 0.02 0.00 -2.04 0.00 0.00 64.34 61.30 3i15 n VAL 181 Cb 0.48 0.16 0.32 0.00 -1.47 0.00 0.00 33.84 33.34 3i15 n VAL 181 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3i15 h ALA 182 N 3.65 1.58 -0.43 2.33 0.00 -1.91 -2.25 119.26 122.23 3i15 h ALA 182 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3i15 h ALA 182 Cb 1.34 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3i15 h ALA 182 CO 0.19 0.39 0.00 -0.25 0.00 0.00 0.00 179.25 179.58 3i15 n ASP 183 N -4.45 3.59 -4.96 0.00 8.00 -1.26 -5.03 116.55 112.45 3i15 n ASP 183 Ca 0.06 -2.30 -0.22 0.00 0.71 0.00 0.00 54.79 53.04 3i15 n ASP 183 Cb 0.05 -0.39 0.01 0.00 -0.02 0.00 0.00 41.12 40.78 3i15 n ASP 183 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3i15 s ALA 184 N -1.55 3.85 -0.50 2.24 0.00 -0.85 -3.88 121.76 121.08 3i15 s ALA 184 Ca 0.35 -1.17 0.03 0.00 0.00 0.00 0.00 51.96 51.18 3i15 s ALA 184 Cb 0.22 -2.06 0.15 0.00 0.00 0.00 0.00 23.12 21.43 3i15 s ALA 184 CO 0.18 -0.40 0.31 0.71 0.00 0.00 0.00 175.76 176.56 3i15 s TYR 185 N -2.54 2.24 -0.44 0.00 1.51 0.30 -4.98 117.35 113.43 3i15 s TYR 185 Ca 0.50 -2.65 0.26 0.00 -1.01 0.00 0.00 57.07 54.17 3i15 s TYR 185 Cb -0.10 -1.95 0.83 0.00 -0.11 0.00 0.00 41.96 40.63 3i15 s TYR 185 CO 0.37 -0.74 1.76 -0.39 -1.11 0.00 0.00 175.55 175.44 3i15 h VAL 186 N 4.97 0.00 0.00 0.71 -1.51 -1.95 -0.74 116.25 117.74 3i15 h VAL 186 Ca 0.07 -0.58 0.00 0.00 -1.23 0.00 0.00 66.70 64.96 3i15 h VAL 186 Cb 0.88 1.52 0.00 0.00 -2.13 0.00 0.00 31.29 31.56 3i15 h VAL 186 CO 0.53 0.00 -0.56 -1.13 -1.23 0.00 0.00 177.57 175.18 3i15 h ASN 187 N 0.00 0.00 0.00 4.19 -1.24 -1.96 -3.36 115.58 113.22 3i15 h ASN 187 Ca 0.00 -0.18 -0.17 0.00 0.71 0.00 0.00 56.30 56.65 3i15 h ASN 187 Cb 0.69 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.70 3i15 h ASN 187 CO 0.00 0.09 -2.06 -0.62 -1.29 0.00 0.00 177.43 173.55 3i15 n GLU 188 N -2.15 0.86 -0.33 6.67 4.71 -1.01 -4.68 120.64 124.70 3i15 n GLU 188 Ca 0.03 -0.09 0.04 0.00 -0.01 0.00 0.00 57.16 57.14 3i15 n GLU 188 Cb 0.44 -1.46 0.20 0.00 -1.01 0.00 0.00 31.44 29.61 3i15 n GLU 188 CO 0.00 0.00 0.00 2.35 0.09 0.00 0.00 177.13 179.57 3i15 h TRP 189 N 0.00 1.01 -0.36 -0.32 2.91 -1.03 0.16 115.95 118.32 3i15 h TRP 189 Ca -0.26 0.03 -0.07 0.00 1.13 0.00 0.00 58.89 59.72 3i15 h TRP 189 Cb 1.53 -0.32 -0.01 0.00 -0.51 0.00 0.00 29.16 29.85 3i15 h TRP 189 CO 0.00 0.42 -0.05 0.77 -1.03 0.00 0.00 178.44 178.56 3i15 h SER 190 N 0.92 0.67 -0.90 2.65 0.02 -1.83 -1.29 113.55 113.78 3i15 h SER 190 Ca 0.44 -0.34 -0.00 0.00 -0.84 0.00 0.00 61.79 61.05 3i15 h SER 190 Cb 0.39 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 62.70 3i15 h SER 190 CO -0.24 0.85 0.55 0.74 -1.14 0.00 0.00 176.83 177.58 3i15 h THR 191 N 0.48 1.25 -0.54 -2.27 2.02 -1.63 0.41 112.91 112.62 3i15 h THR 191 Ca 0.10 -0.54 -0.00 0.00 0.77 0.00 0.00 66.41 66.74 3i15 h THR 191 Cb 0.54 -0.02 -0.03 0.00 -1.74 0.00 0.00 68.15 66.90 3i15 h THR 191 CO 0.03 0.26 0.34 0.28 0.37 0.00 0.00 175.52 176.80 3i15 h SER 192 N 1.24 0.64 -0.47 4.18 0.02 -0.71 0.75 113.55 119.20 3i15 h SER 192 Ca 0.32 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.22 3i15 h SER 192 Cb -0.06 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.30 3i15 h SER 192 CO -0.06 0.50 0.24 0.40 -1.14 0.00 0.00 176.83 176.77 3i15 h ILE 193 N 0.73 1.18 -0.79 3.27 1.08 -0.91 -2.08 117.51 120.00 3i15 h ILE 193 Ca 0.20 -0.47 0.05 0.00 -0.39 0.00 0.00 64.86 64.24 3i15 h ILE 193 Cb -0.04 0.63 -0.05 0.00 -3.07 0.00 0.00 36.82 34.30 3i15 h ILE 193 CO -0.04 0.19 0.52 -0.33 -0.69 0.00 0.00 178.15 177.80 3i15 h GLU 194 N 0.61 0.88 -0.55 2.37 4.39 -0.50 -0.20 114.58 121.59 3i15 h GLU 194 Ca 0.16 -0.05 -0.05 0.00 0.34 0.00 0.00 59.36 59.76 3i15 h GLU 194 Cb 0.08 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 28.51 3i15 h GLU 194 CO -0.02 0.58 0.14 -0.91 -1.16 0.00 0.00 179.01 177.64 3i15 h ASN 195 N 0.91 0.78 0.09 1.42 2.35 -0.25 -0.45 115.58 120.43 3i15 h ASN 195 Ca 0.33 -0.14 -0.00 0.00 -0.55 0.00 0.00 56.30 55.93 3i15 h ASN 195 Cb 0.14 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.31 3i15 h ASN 195 CO -0.11 0.76 -0.04 0.58 -1.65 0.00 0.00 177.43 176.97 3i15 h VAL 196 N 0.81 1.03 -0.75 2.81 2.07 -0.65 -1.79 116.25 119.78 3i15 h VAL 196 Ca 0.18 -0.45 0.07 0.00 0.82 0.00 0.00 66.70 67.32 3i15 h VAL 196 Cb 0.29 1.33 -0.05 0.00 -1.52 0.00 0.00 31.29 31.34 3i15 h VAL 196 CO -0.00 0.11 0.49 -0.07 0.02 0.00 0.00 177.57 178.12 3i15 h LEU 197 N -0.33 0.67 -0.20 2.57 3.38 -0.74 -0.45 115.31 120.21 3i15 h LEU 197 Ca -0.01 0.01 -0.22 0.00 0.09 0.00 0.00 57.88 57.74 3i15 h LEU 197 Cb 0.28 -0.14 0.01 0.00 0.09 0.00 0.00 40.66 40.90 3i15 h LEU 197 CO 0.02 0.42 -0.84 0.11 0.09 0.00 0.00 178.44 178.24 3i15 h LYS 198 N 0.76 0.60 -0.15 1.13 1.57 -0.97 -3.27 116.57 116.24 3i15 h LYS 198 Ca 0.33 -0.54 -0.19 0.00 -1.87 0.00 0.00 60.65 58.37 3i15 h LYS 198 Cb 0.31 0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.75 3i15 h LYS 198 CO -0.12 1.16 -0.69 -0.09 -0.57 0.00 0.00 179.45 179.15 3i15 h ARG 199 N 0.39 0.63 -3.18 3.15 2.43 -0.95 -3.40 114.38 113.45 3i15 h ARG 199 Ca -0.07 -0.48 -0.63 0.00 -0.81 0.00 0.00 59.98 58.00 3i15 h ARG 199 Cb 1.46 0.09 -0.41 0.00 -0.42 0.00 0.00 29.97 30.69 3i15 h ARG 199 CO 0.16 1.10 -0.63 0.71 -1.51 0.00 0.00 179.97 179.80 3i15 s TYR 200 N -3.80 3.15 -0.67 2.20 2.02 -0.21 -4.94 117.35 115.11 3i15 s TYR 200 Ca -0.08 -3.14 0.25 0.00 -0.37 0.00 0.00 57.07 53.73 3i15 s TYR 200 Cb 0.10 -2.61 0.65 0.00 -0.40 0.00 0.00 41.96 39.70 3i15 s TYR 200 CO 0.87 -0.67 1.66 0.00 -1.57 0.00 0.00 175.55 175.84 3i15 h ARG 201 N 6.02 0.00 -3.81 -0.62 2.47 -1.78 -3.41 114.38 113.24 3i15 h ARG 201 Ca 0.03 0.00 -0.61 0.00 -1.26 0.00 0.00 59.98 58.14 3i15 h ARG 201 Cb 0.84 0.00 -0.40 0.00 -1.65 0.00 0.00 29.97 28.76 3i15 h ARG 201 CO 0.67 0.00 -0.74 1.21 0.56 0.00 0.00 179.97 181.67 3i15 s ASN 202 N -4.70 4.21 -0.19 7.04 2.47 -1.26 -5.11 114.94 117.41 3i15 s ASN 202 Ca 0.09 -1.96 -0.02 0.00 0.42 0.00 0.00 52.86 51.39 3i15 s ASN 202 Cb 0.12 -1.14 -0.01 0.00 -1.45 0.00 0.00 41.25 38.77 3i15 s ASN 202 CO 0.63 -0.38 -0.09 -0.63 -3.72 0.00 0.00 177.10 172.91 3i15 s ILE 203 N 1.18 3.11 -0.00 -5.21 1.01 -1.26 -4.85 121.20 115.18 3i15 s ILE 203 Ca 0.11 -0.60 -0.16 0.00 0.00 0.00 0.00 60.65 60.01 3i15 s ILE 203 Cb -0.19 -2.37 -0.34 0.00 0.01 0.00 0.00 42.46 39.57 3i15 s ILE 203 CO -0.16 0.47 0.89 0.78 0.00 0.00 0.00 174.94 176.93 3i15 h ASN 204 N 7.62 0.73 -3.90 3.58 2.35 -1.07 -3.42 115.58 121.47 3i15 h ASN 204 Ca -0.37 -0.93 -0.14 0.00 -0.55 0.00 0.00 56.30 54.32 3i15 h ASN 204 Cb 1.17 -0.24 -0.24 0.00 0.05 0.00 0.00 38.32 39.06 3i15 h ASN 204 CO 0.60 1.68 -0.30 0.00 -1.65 0.00 0.00 177.43 177.75 3i15 s ALA 205 N -2.56 -0.87 -0.15 -0.83 0.00 -1.20 -4.79 121.76 111.36 3i15 s ALA 205 Ca -0.12 0.97 0.01 0.00 0.00 0.00 0.00 51.96 52.82 3i15 s ALA 205 Cb 0.04 -0.55 -0.00 0.00 0.00 0.00 0.00 23.12 22.60 3i15 s ALA 205 CO 0.90 -0.17 -0.16 0.08 0.00 0.00 0.00 175.76 176.41 3i15 s VAL 206 N 0.13 2.63 -0.38 0.00 1.01 0.42 -1.13 120.40 123.09 3i15 s VAL 206 Ca -0.00 -0.79 -0.15 0.00 0.00 0.00 0.00 61.98 61.04 3i15 s VAL 206 Cb -0.03 -2.10 0.00 0.00 0.00 0.00 0.00 36.38 34.26 3i15 s VAL 206 CO 0.01 0.52 0.30 -0.69 0.00 0.00 0.00 175.10 175.24 3i15 s VAL 207 N 0.72 5.24 0.88 2.92 1.01 0.58 -0.93 120.40 130.81 3i15 s VAL 207 Ca -0.07 -0.39 -0.12 0.00 0.00 0.00 0.00 61.98 61.39 3i15 s VAL 207 Cb -0.16 -3.86 0.12 0.00 0.00 0.00 0.00 36.38 32.48 3i15 s VAL 207 CO 0.01 -0.20 1.15 -2.16 0.00 0.00 0.00 175.10 173.91 3i15 s PRO 208 N 1.78 1.43 0.22 2.72 0.04 -1.26 -0.68 135.00 139.25 3i15 s PRO 208 Ca 0.07 0.23 -0.07 0.00 0.04 0.00 0.00 61.00 61.27 3i15 s PRO 208 Cb -0.18 -1.88 0.18 0.00 0.04 0.00 0.00 34.50 32.66 3i15 s PRO 208 CO 0.11 -1.99 1.74 0.78 0.04 0.00 0.00 177.00 177.68 3i15 h GLY 209 N -1.34 1.16 -5.50 0.56 0.00 -1.04 -3.42 103.07 93.48 3i15 h GLY 209 Ca -0.49 -0.72 -0.32 0.00 0.00 0.00 0.00 47.33 45.81 3i15 h GLY 209 CO 0.63 0.67 -0.75 0.30 0.00 0.00 0.00 176.54 177.39 3i15 s HIS 210 N -5.29 0.41 0.00 5.60 3.76 -1.26 -0.57 115.29 117.93 3i15 s HIS 210 Ca -0.12 -0.07 0.00 0.00 -0.15 0.00 0.00 55.06 54.72 3i15 s HIS 210 Cb 0.15 -0.29 0.00 0.00 1.11 0.00 0.00 32.58 33.55 3i15 s HIS 210 CO 0.84 -0.02 0.00 0.41 -0.85 0.00 0.00 174.74 175.11 3i15 n GLY 211 N 3.11 -1.22 3.77 -2.22 0.00 -1.24 -3.97 105.19 103.42 3i15 n GLY 211 Ca -0.14 -2.12 -0.38 0.00 0.00 0.00 0.00 46.02 43.38 3i15 n GLY 211 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i15 s GLU 212 N 0.00 4.34 0.33 1.61 0.41 -1.26 -4.71 118.70 119.42 3i15 s GLU 212 Ca 0.00 1.63 -0.29 0.00 -0.41 0.00 0.00 54.97 55.90 3i15 s GLU 212 Cb 0.00 -2.79 -0.12 0.00 -1.78 0.00 0.00 34.13 29.44 3i15 s GLU 212 CO 0.00 -0.01 1.47 0.28 -0.49 0.00 0.00 175.26 176.51 3i15 n VAL 213 N 0.41 1.60 -1.22 2.63 0.31 -1.26 -4.56 118.33 116.24 3i15 n VAL 213 Ca 0.03 -0.40 0.00 0.00 -0.01 0.00 0.00 64.34 63.96 3i15 n VAL 213 Cb 0.48 -1.83 0.00 0.00 -0.91 0.00 0.00 33.84 31.58 3i15 n VAL 213 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3i15 n GLY 214 N 1.20 5.48 0.00 2.92 0.00 -0.11 -4.98 105.19 109.71 3i15 n GLY 214 Ca 0.05 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.92 3i15 n GLY 214 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3i15 n ASP 215 N 0.00 0.55 -0.08 1.61 5.68 -1.26 -0.44 116.55 122.61 3i15 n ASP 215 Ca 0.00 -0.15 0.26 0.00 -0.50 0.00 0.00 54.79 54.40 3i15 n ASP 215 Cb 0.00 0.00 0.68 0.00 -1.14 0.00 0.00 41.12 40.66 3i15 n ASP 215 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 3i15 h LYS 216 N 0.00 0.00 -0.49 0.11 3.64 -1.92 -0.50 116.57 117.41 3i15 h LYS 216 Ca 0.00 0.00 0.14 0.00 -1.27 0.00 0.00 60.65 59.52 3i15 h LYS 216 Cb 0.00 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 3i15 h LYS 216 CO 0.00 0.00 0.37 0.78 -2.27 0.00 0.00 179.45 178.33 3i15 h GLY 217 N 0.00 0.00 1.77 5.01 0.00 -1.98 -0.22 103.07 107.65 3i15 h GLY 217 Ca 0.35 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.59 3i15 h GLY 217 CO -0.00 0.00 -0.36 1.41 0.00 0.00 0.00 176.54 177.59 3i15 h LEU 218 N 0.00 0.26 -0.41 3.11 3.38 -1.39 0.14 115.31 120.40 3i15 h LEU 218 Ca 0.23 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 58.01 3i15 h LEU 218 Cb 0.98 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 3i15 h LEU 218 CO -0.00 0.61 -0.10 -0.07 0.09 0.00 0.00 178.44 178.96 3i15 h LEU 219 N 0.22 0.80 -0.99 1.67 3.38 -1.21 -1.27 115.31 117.90 3i15 h LEU 219 Ca 0.03 -0.36 -0.07 0.00 0.09 0.00 0.00 57.88 57.56 3i15 h LEU 219 Cb 0.74 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 3i15 h LEU 219 CO 0.06 0.98 -0.03 -0.07 0.09 0.00 0.00 178.44 179.46 3i15 h LEU 220 N 0.61 0.67 -0.67 1.67 3.38 -1.18 -1.19 115.31 118.60 3i15 h LEU 220 Ca 0.10 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 3i15 h LEU 220 Cb 0.63 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 3i15 h LEU 220 CO 0.04 0.76 0.38 -0.74 0.09 0.00 0.00 178.44 178.97 3i15 h HIS 221 N 0.65 0.90 -0.51 1.13 2.76 -0.56 -1.39 115.15 118.13 3i15 h HIS 221 Ca 0.13 -0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.24 3i15 h HIS 221 Cb 0.45 -0.29 -0.02 0.00 1.55 0.00 0.00 27.41 29.09 3i15 h HIS 221 CO 0.02 0.63 0.17 1.15 -1.30 0.00 0.00 177.93 178.59 3i15 h THR 222 N 0.91 1.23 -0.75 6.26 2.02 -0.86 -0.99 112.91 120.73 3i15 h THR 222 Ca 0.24 -0.76 0.07 0.00 0.77 0.00 0.00 66.41 66.73 3i15 h THR 222 Cb 0.01 0.76 -0.06 0.00 -1.74 0.00 0.00 68.15 67.12 3i15 h THR 222 CO -0.04 0.28 0.42 -0.07 0.37 0.00 0.00 175.52 176.49 3i15 h LEU 223 N 0.70 0.63 -0.78 2.58 3.38 -0.95 -1.90 115.31 118.96 3i15 h LEU 223 Ca 0.17 0.04 -0.09 0.00 0.09 0.00 0.00 57.88 58.08 3i15 h LEU 223 Cb 0.27 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 3i15 h LEU 223 CO -0.01 0.39 -0.05 -0.78 0.09 0.00 0.00 178.44 178.08 3i15 h ASP 224 N 0.76 0.85 0.20 -0.43 3.58 -0.46 -2.70 116.42 118.21 3i15 h ASP 224 Ca 0.34 -0.24 -0.02 0.00 0.42 0.00 0.00 57.03 57.54 3i15 h ASP 224 Cb 0.25 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 41.07 3i15 h ASP 224 CO -0.21 0.94 -0.09 -0.07 -2.88 0.00 0.00 179.24 176.94 3i15 h LEU 225 N 0.80 0.00 -0.00 2.28 3.38 -0.58 -2.21 115.31 118.97 3i15 h LEU 225 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3i15 h LEU 225 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 3i15 h LEU 225 CO 0.03 0.09 -0.00 0.18 0.09 0.00 0.00 178.44 178.83 3i15 n LEU 226 N -3.88 0.01 0.00 1.67 4.77 -0.77 -4.80 117.00 114.00 3i15 n LEU 226 Ca -0.02 0.41 0.15 0.00 -0.03 0.00 0.00 56.01 56.52 3i15 n LEU 226 Cb 0.18 -0.41 0.88 0.00 -2.33 0.00 0.00 43.42 41.74 3i15 n LEU 226 CO 0.31 0.00 1.05 0.29 -1.33 0.00 0.00 177.39 177.71