#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i11 s THR 7 N 0.00 3.67 -0.10 3.15 -1.32 -1.26 -4.77 115.64 115.01 3i11 s THR 7 Ca 0.00 1.44 -0.01 0.00 -1.21 0.00 0.00 61.69 61.92 3i11 s THR 7 Cb 0.00 -3.92 0.03 0.00 -1.51 0.00 0.00 72.50 67.10 3i11 s THR 7 CO 0.00 0.25 -0.04 -0.69 -2.21 0.00 0.00 174.62 171.93 3i11 s VAL 8 N -0.23 0.77 -0.07 5.08 1.01 -1.26 -1.12 120.40 124.58 3i11 s VAL 8 Ca 0.51 -0.17 0.04 0.00 0.00 0.00 0.00 61.98 62.37 3i11 s VAL 8 Cb -0.31 -0.87 -0.00 0.00 0.00 0.00 0.00 36.38 35.20 3i11 s VAL 8 CO 0.36 0.29 -0.21 -0.63 0.00 0.00 0.00 175.10 174.92 3i11 s ILE 9 N 1.81 1.76 0.22 2.22 1.01 -0.01 -4.97 121.20 123.24 3i11 s ILE 9 Ca 0.05 -0.88 0.07 0.00 0.00 0.00 0.00 60.65 59.88 3i11 s ILE 9 Cb -0.13 -1.52 -0.04 0.00 0.01 0.00 0.00 42.46 40.79 3i11 s ILE 9 CO -0.07 0.50 0.14 -0.54 0.00 0.00 0.00 174.94 174.97 3i11 s LYS 10 N 0.17 2.81 1.20 2.79 1.02 -1.26 -0.86 119.74 125.61 3i11 s LYS 10 Ca -0.10 -1.03 -0.20 0.00 0.02 0.00 0.00 55.97 54.66 3i11 s LYS 10 Cb -0.15 -2.54 0.30 0.00 -0.52 0.00 0.00 37.83 34.93 3i11 s LYS 10 CO 0.05 0.43 0.95 0.27 -0.92 0.00 0.00 175.35 176.14 3i11 n ASN 11 N -0.77 -2.57 0.01 2.83 2.04 0.50 -4.95 115.26 112.35 3i11 n ASN 11 Ca -0.08 -1.03 -0.10 0.00 -0.44 0.00 0.00 54.58 52.92 3i11 n ASN 11 Cb 0.57 -0.93 -0.05 0.00 -2.53 0.00 0.00 39.78 36.84 3i11 n ASN 11 CO 0.00 0.00 0.00 1.05 -0.44 0.00 0.00 177.26 177.87 3i11 h GLU 12 N 0.00 -0.06 0.00 -3.83 4.11 -2.00 -3.35 114.58 109.45 3i11 h GLU 12 Ca -0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.06 3i11 h GLU 12 Cb 1.18 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.44 3i11 h GLU 12 CO 0.24 -0.04 -0.34 0.25 0.07 0.00 0.00 179.01 179.19 3i11 n THR 13 N -5.18 0.33 -0.00 -1.06 -2.24 -1.26 -4.93 114.28 99.94 3i11 n THR 13 Ca -0.05 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 3i11 n THR 13 Cb 0.11 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.08 3i11 n THR 13 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3i11 n GLY 14 N 1.38 1.09 0.28 3.38 0.00 -1.26 -4.94 105.19 105.11 3i11 n GLY 14 Ca 0.05 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.24 3i11 n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i11 h THR 15 N 0.00 0.07 -3.46 2.61 1.03 -1.91 -3.43 112.91 107.82 3i11 h THR 15 Ca 0.00 -0.49 -0.38 0.00 -0.01 0.00 0.00 66.41 65.53 3i11 h THR 15 Cb 0.00 1.45 -0.34 0.00 -1.07 0.00 0.00 68.15 68.19 3i11 h THR 15 CO 0.00 0.02 -0.76 -0.63 -0.01 0.00 0.00 175.52 174.14 3i11 s ILE 16 N -3.76 0.35 -0.01 0.00 1.01 -1.26 -2.01 121.20 115.52 3i11 s ILE 16 Ca 0.00 -0.00 0.01 0.00 0.00 0.00 0.00 60.65 60.66 3i11 s ILE 16 Cb 0.10 -0.42 -0.00 0.00 0.01 0.00 0.00 42.46 42.15 3i11 s ILE 16 CO 0.53 0.19 -0.03 -0.55 0.00 0.00 0.00 174.94 175.08 3i11 s SER 17 N 1.04 0.44 -0.01 3.58 0.15 -0.26 -0.37 113.70 118.27 3i11 s SER 17 Ca -0.09 -0.07 0.07 0.00 0.70 0.00 0.00 55.95 56.56 3i11 s SER 17 Cb -0.14 -0.06 -0.02 0.00 -1.71 0.00 0.00 66.02 64.09 3i11 s SER 17 CO -0.01 0.04 -0.22 0.27 1.20 0.00 0.00 173.24 174.51 3i11 s ILE 18 N -0.01 1.76 -0.06 6.45 -4.36 -0.04 -0.11 121.20 124.83 3i11 s ILE 18 Ca 0.01 -0.98 0.01 0.00 -0.26 0.00 0.00 60.65 59.42 3i11 s ILE 18 Cb -0.02 -1.47 0.02 0.00 1.25 0.00 0.00 42.46 42.24 3i11 s ILE 18 CO -0.00 0.47 -0.06 -0.55 0.24 0.00 0.00 174.94 175.03 3i11 s SER 19 N -0.60 1.36 0.06 4.36 0.15 -0.41 -0.83 113.70 117.79 3i11 s SER 19 Ca 0.09 -0.19 -0.30 0.00 0.70 0.00 0.00 55.95 56.25 3i11 s SER 19 Cb -0.09 -0.59 -0.05 0.00 -1.71 0.00 0.00 66.02 63.59 3i11 s SER 19 CO -0.01 -0.05 1.09 -1.58 1.20 0.00 0.00 173.24 173.89 3i11 s GLN 20 N 1.05 4.52 -0.22 5.44 0.74 -0.28 -0.75 119.66 130.16 3i11 s GLN 20 Ca -0.09 1.62 -0.09 0.00 0.05 0.00 0.00 55.36 56.85 3i11 s GLN 20 Cb -0.14 -3.38 -0.19 0.00 1.10 0.00 0.00 33.01 30.41 3i11 s GLN 20 CO -0.00 -0.09 -0.01 1.28 -0.55 0.00 0.00 175.29 175.91 3i11 n LEU 21 N 3.56 2.39 0.00 3.68 4.77 0.44 -4.49 117.00 127.35 3i11 n LEU 21 Ca 0.06 0.19 -0.01 0.00 -0.03 0.00 0.00 56.01 56.23 3i11 n LEU 21 Cb 0.48 -0.95 -0.00 0.00 -2.33 0.00 0.00 43.42 40.62 3i11 n LEU 21 CO 0.54 0.68 0.01 -0.46 -1.33 0.00 0.00 177.39 176.83 3i11 n ASN 22 N -3.83 -0.08 -0.35 -1.43 0.23 -0.95 -5.00 115.26 103.85 3i11 n ASN 22 Ca -0.42 -1.09 0.25 0.00 -0.53 0.00 0.00 54.58 52.79 3i11 n ASN 22 Cb 0.91 0.14 0.50 0.00 -2.08 0.00 0.00 39.78 39.26 3i11 n ASN 22 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 3i11 h LYS 23 N 0.00 0.34 0.00 -3.83 5.09 -2.01 -2.97 116.57 113.18 3i11 h LYS 23 Ca -0.01 -0.02 0.00 0.00 0.09 0.00 0.00 60.65 60.71 3i11 h LYS 23 Cb 0.06 -0.08 0.00 0.00 0.10 0.00 0.00 32.23 32.31 3i11 h LYS 23 CO 0.02 0.22 0.00 0.09 -2.09 0.00 0.00 179.45 177.69 3i11 n ASN 24 N -4.83 1.16 -3.93 7.07 5.03 -1.26 -4.96 115.26 113.54 3i11 n ASN 24 Ca 0.30 -1.38 -0.24 0.00 0.87 0.00 0.00 54.58 54.14 3i11 n ASN 24 Cb 0.99 0.00 -0.17 0.00 -1.02 0.00 0.00 39.78 39.59 3i11 n ASN 24 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3i11 s VAL 25 N -0.38 0.87 0.06 2.41 1.01 -1.12 -0.50 120.40 122.74 3i11 s VAL 25 Ca 0.00 -0.27 0.05 0.00 0.00 0.00 0.00 61.98 61.76 3i11 s VAL 25 Cb 0.00 -0.86 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 3i11 s VAL 25 CO 0.00 0.31 -0.15 0.26 0.00 0.00 0.00 175.10 175.52 3i11 s TRP 26 N 1.13 1.30 -0.18 5.22 0.52 -0.20 -0.42 118.94 126.32 3i11 s TRP 26 Ca -0.07 -0.41 -0.15 0.00 0.02 0.00 0.00 56.10 55.50 3i11 s TRP 26 Cb -0.14 -0.75 -0.04 0.00 -1.15 0.00 0.00 33.47 31.39 3i11 s TRP 26 CO -0.01 0.06 0.33 0.08 0.02 0.00 0.00 176.95 177.44 3i11 s VAL 27 N -1.07 5.26 -0.13 4.03 1.01 0.07 0.03 120.40 129.60 3i11 s VAL 27 Ca 0.01 0.60 -0.10 0.00 0.00 0.00 0.00 61.98 62.49 3i11 s VAL 27 Cb -0.09 -3.67 -0.05 0.00 0.00 0.00 0.00 36.38 32.57 3i11 s VAL 27 CO 0.02 0.32 0.19 -1.38 0.00 0.00 0.00 175.10 174.25 3i11 s HIS 28 N 0.90 3.56 -0.07 5.22 -3.43 0.21 -1.29 115.29 120.38 3i11 s HIS 28 Ca 0.17 0.55 0.02 0.00 -0.80 0.00 0.00 55.06 55.00 3i11 s HIS 28 Cb -0.14 -2.08 0.02 0.00 -1.43 0.00 0.00 32.58 28.94 3i11 s HIS 28 CO 0.06 0.56 -0.10 0.99 -2.00 0.00 0.00 174.74 174.25 3i11 s THR 29 N -0.53 1.00 0.09 -5.38 2.01 0.84 -0.49 115.64 113.18 3i11 s THR 29 Ca 0.15 -0.38 0.06 0.00 0.31 0.00 0.00 61.69 61.83 3i11 s THR 29 Cb -0.12 -0.94 -0.03 0.00 0.01 0.00 0.00 72.50 71.41 3i11 s THR 29 CO 0.04 0.33 -0.17 -1.61 -0.69 0.00 0.00 174.62 172.52 3i11 s GLU 30 N 0.88 0.96 0.20 4.92 8.01 -0.42 -1.11 118.70 132.15 3i11 s GLU 30 Ca -0.11 -1.07 0.06 0.00 0.01 0.00 0.00 54.97 53.86 3i11 s GLU 30 Cb -0.15 -1.06 -0.04 0.00 -4.31 0.00 0.00 34.13 28.57 3i11 s GLU 30 CO 0.01 0.24 0.19 -0.51 0.01 0.00 0.00 175.26 175.20 3i11 s LEU 31 N -1.88 3.91 0.00 1.80 1.43 -0.85 -0.91 118.68 122.18 3i11 s LEU 31 Ca 0.02 -0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.00 3i11 s LEU 31 Cb -0.10 -2.48 0.00 0.00 0.03 0.00 0.00 46.19 43.65 3i11 s LEU 31 CO 0.03 0.02 0.00 0.55 0.23 0.00 0.00 176.35 177.18 3i11 n VAL 39 N -0.76 0.00 -3.58 -1.59 3.14 -1.26 -4.95 118.33 109.33 3i11 n VAL 39 Ca -0.08 0.00 -0.37 0.00 -2.96 0.00 0.00 64.34 60.93 3i11 n VAL 39 Cb 0.56 0.00 -0.08 0.00 -1.06 0.00 0.00 33.84 33.26 3i11 n VAL 39 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 3i11 s PRO 40 N 0.00 4.17 0.05 1.45 0.04 -1.26 -5.09 135.00 134.37 3i11 s PRO 40 Ca 0.00 -0.05 0.07 0.00 0.04 0.00 0.00 61.00 61.06 3i11 s PRO 40 Cb 0.00 -3.48 -0.03 0.00 0.04 0.00 0.00 34.50 31.02 3i11 s PRO 40 CO 0.00 0.14 -0.18 0.45 0.04 0.00 0.00 177.00 177.44 3i11 s SER 41 N 0.75 3.78 0.08 6.66 0.15 -0.08 -4.05 113.70 120.99 3i11 s SER 41 Ca 0.13 -0.45 0.06 0.00 0.70 0.00 0.00 55.95 56.39 3i11 s SER 41 Cb -0.13 -0.59 -0.04 0.00 -1.71 0.00 0.00 66.02 63.55 3i11 s SER 41 CO 0.04 0.25 -0.10 0.20 1.20 0.00 0.00 173.24 174.82 3i11 s ASN 42 N -1.51 4.37 0.01 5.45 0.01 -0.03 -1.30 114.94 121.95 3i11 s ASN 42 Ca 0.15 -0.35 0.00 0.00 -0.71 0.00 0.00 52.86 51.94 3i11 s ASN 42 Cb -0.10 -0.85 -0.00 0.00 0.41 0.00 0.00 41.25 40.70 3i11 s ASN 42 CO 0.06 0.20 0.01 0.61 -1.51 0.00 0.00 177.10 176.47 3i11 n GLY 43 N 0.92 3.41 3.49 0.66 0.00 0.35 -4.84 105.19 109.17 3i11 n GLY 43 Ca -0.14 -1.47 -0.28 0.00 0.00 0.00 0.00 46.02 44.12 3i11 n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i11 s LEU 44 N 0.00 2.68 -0.20 0.99 1.43 -0.47 -0.62 118.68 122.50 3i11 s LEU 44 Ca 0.01 -0.64 -0.01 0.00 -1.03 0.00 0.00 54.13 52.45 3i11 s LEU 44 Cb -0.00 -1.47 0.00 0.00 0.03 0.00 0.00 46.19 44.76 3i11 s LEU 44 CO 0.00 0.15 -0.12 -0.69 0.23 0.00 0.00 176.35 175.92 3i11 s VAL 45 N -1.38 2.76 -0.26 -1.59 1.01 0.10 -1.15 120.40 119.90 3i11 s VAL 45 Ca 0.20 -0.70 -0.07 0.00 0.00 0.00 0.00 61.98 61.40 3i11 s VAL 45 Cb -0.10 -2.22 -0.01 0.00 0.00 0.00 0.00 36.38 34.05 3i11 s VAL 45 CO 0.11 0.48 0.07 -0.76 0.00 0.00 0.00 175.10 175.00 3i11 s LEU 46 N 1.32 3.54 -0.64 3.92 1.43 0.51 -1.03 118.68 127.73 3i11 s LEU 46 Ca 0.04 -0.39 -0.21 0.00 -1.03 0.00 0.00 54.13 52.55 3i11 s LEU 46 Cb -0.14 -1.90 0.09 0.00 0.03 0.00 0.00 46.19 44.28 3i11 s LEU 46 CO -0.07 -0.09 0.85 0.21 0.23 0.00 0.00 176.35 177.48 3i11 s ASN 47 N 1.57 6.21 0.37 2.29 2.47 0.34 -1.51 114.94 126.68 3i11 s ASN 47 Ca 0.05 -1.28 0.08 0.00 0.42 0.00 0.00 52.86 52.13 3i11 s ASN 47 Cb -0.16 -2.36 -0.04 0.00 -1.45 0.00 0.00 41.25 37.24 3i11 s ASN 47 CO 0.03 -1.26 0.22 0.42 -3.72 0.00 0.00 177.10 172.78 3i11 s THR 48 N 3.30 2.87 -0.54 -5.21 -4.23 -0.81 -4.78 115.64 106.24 3i11 s THR 48 Ca 0.18 -1.58 0.24 0.00 -1.18 0.00 0.00 61.69 59.34 3i11 s THR 48 Cb -0.20 -3.01 0.25 0.00 1.34 0.00 0.00 72.50 70.88 3i11 s THR 48 CO 0.07 -0.11 1.72 -1.54 -0.54 0.00 0.00 174.62 174.22 3i11 n SER 49 N -1.28 0.68 -0.79 3.99 3.41 -1.26 -2.63 113.62 115.74 3i11 n SER 49 Ca -0.01 0.65 0.08 0.00 -0.26 0.00 0.00 58.87 59.32 3i11 n SER 49 Cb 0.62 -0.80 0.14 0.00 -0.26 0.00 0.00 64.21 63.92 3i11 n SER 49 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3i11 n LYS 50 N -2.22 2.02 0.00 4.33 4.76 -1.26 -4.99 118.16 120.80 3i11 n LYS 50 Ca 0.03 -1.88 0.00 0.00 -2.87 0.00 0.00 58.31 53.59 3i11 n LYS 50 Cb 0.26 -1.35 0.00 0.00 -1.84 0.00 0.00 35.03 32.10 3i11 n LYS 50 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3i11 n GLY 51 N 0.95 1.84 3.76 0.72 0.00 -1.08 -4.94 105.19 106.44 3i11 n GLY 51 Ca 0.13 -1.97 -0.38 0.00 0.00 0.00 0.00 46.02 43.80 3i11 n GLY 51 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i11 s LEU 52 N 0.00 4.40 -0.12 0.99 1.43 0.11 -1.92 118.68 123.57 3i11 s LEU 52 Ca 0.00 1.06 0.02 0.00 -1.03 0.00 0.00 54.13 54.19 3i11 s LEU 52 Cb 0.00 -2.83 -0.00 0.00 0.03 0.00 0.00 46.19 43.39 3i11 s LEU 52 CO 0.00 0.11 -0.20 -0.69 0.23 0.00 0.00 176.35 175.80 3i11 s VAL 53 N -0.15 2.34 -0.06 -1.59 1.01 -0.57 -0.86 120.40 120.53 3i11 s VAL 53 Ca 0.29 -0.91 -0.04 0.00 0.00 0.00 0.00 61.98 61.32 3i11 s VAL 53 Cb -0.17 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 3i11 s VAL 53 CO 0.15 0.54 0.13 -0.76 0.00 0.00 0.00 175.10 175.17 3i11 s LEU 54 N 0.52 4.23 -0.43 3.92 1.43 -0.39 -0.36 118.68 127.59 3i11 s LEU 54 Ca -0.13 0.34 -0.15 0.00 -1.03 0.00 0.00 54.13 53.17 3i11 s LEU 54 Cb -0.17 -2.27 0.04 0.00 0.03 0.00 0.00 46.19 43.83 3i11 s LEU 54 CO 0.05 0.33 0.33 -0.69 0.23 0.00 0.00 176.35 176.60 3i11 s VAL 55 N -1.15 5.17 0.30 -1.59 1.01 -0.30 -0.69 120.40 123.16 3i11 s VAL 55 Ca 0.20 -0.86 0.00 0.00 0.00 0.00 0.00 61.98 61.32 3i11 s VAL 55 Cb -0.12 -3.97 0.00 0.00 0.00 0.00 0.00 36.38 32.28 3i11 s VAL 55 CO 0.11 -0.42 0.00 0.47 0.00 0.00 0.00 175.10 175.25 3i11 n ASP 56 N 5.16 -4.65 0.00 3.32 8.00 0.12 -1.36 116.55 127.13 3i11 n ASP 56 Ca -0.12 0.88 0.00 0.00 0.71 0.00 0.00 54.79 56.27 3i11 n ASP 56 Cb 0.45 -2.17 0.00 0.00 -0.02 0.00 0.00 41.12 39.38 3i11 n ASP 56 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3i11 n SER 57 N -1.71 0.00 -2.39 -2.24 3.41 -1.26 -4.70 113.62 104.74 3i11 n SER 57 Ca 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.49 3i11 n SER 57 Cb 0.17 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.08 3i11 n SER 57 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3i11 n SER 58 N 0.00 -0.04 -0.12 4.04 2.88 -1.26 -4.86 113.62 114.26 3i11 n SER 58 Ca 0.00 -2.23 0.13 0.00 -1.33 0.00 0.00 58.87 55.44 3i11 n SER 58 Cb 0.00 0.85 0.49 0.00 -0.75 0.00 0.00 64.21 64.80 3i11 n SER 58 CO 0.00 0.00 0.00 -0.50 -1.23 0.00 0.00 175.04 173.31 3i11 h TRP 59 N 1.55 0.48 -3.50 0.66 4.06 -1.80 -3.07 115.95 114.33 3i11 h TRP 59 Ca -0.14 0.01 -0.17 0.00 2.06 0.00 0.00 58.89 60.65 3i11 h TRP 59 Cb 0.68 -0.15 -0.03 0.00 -1.00 0.00 0.00 29.16 28.65 3i11 h TRP 59 CO 0.00 0.21 0.01 -0.40 -3.56 0.00 0.00 178.44 174.71 3i11 n ASP 60 N -4.47 -1.59 -0.04 -3.49 5.68 -1.26 -4.37 116.55 107.00 3i11 n ASP 60 Ca 0.11 -2.64 -0.13 0.00 -0.50 0.00 0.00 54.79 51.63 3i11 n ASP 60 Cb 0.41 2.80 -0.01 0.00 -1.14 0.00 0.00 41.12 43.19 3i11 n ASP 60 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 3i11 h ASP 61 N 1.82 0.83 -0.26 -1.12 3.32 -1.86 -2.50 116.42 116.66 3i11 h ASP 61 Ca -0.27 -0.46 0.06 0.00 0.02 0.00 0.00 57.03 56.38 3i11 h ASP 61 Cb 1.11 -0.24 -0.06 0.00 0.22 0.00 0.00 39.33 40.36 3i11 h ASP 61 CO 0.36 1.23 -0.15 0.50 -1.72 0.00 0.00 179.24 179.46 3i11 h LYS 62 N 0.56 -0.12 -0.19 3.56 3.64 -1.97 -0.31 116.57 121.75 3i11 h LYS 62 Ca 0.00 0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.25 3i11 h LYS 62 Cb 1.16 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 33.00 3i11 h LYS 62 CO 0.12 -0.08 -0.49 -0.07 -2.27 0.00 0.00 179.45 176.66 3i11 h LEU 63 N -0.12 0.55 -0.12 5.20 3.38 -1.96 -2.42 115.31 119.80 3i11 h LEU 63 Ca 0.14 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 3i11 h LEU 63 Cb 0.34 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 3i11 h LEU 63 CO -0.34 0.95 0.03 0.74 0.09 0.00 0.00 178.44 179.91 3i11 h THR 64 N 0.40 1.20 -0.34 0.22 2.02 -1.23 0.12 112.91 115.30 3i11 h THR 64 Ca 0.02 -0.63 0.06 0.00 0.77 0.00 0.00 66.41 66.63 3i11 h THR 64 Cb 1.00 1.39 -0.06 0.00 -1.74 0.00 0.00 68.15 68.74 3i11 h THR 64 CO 0.09 0.18 -0.01 0.11 0.37 0.00 0.00 175.52 176.26 3i11 h LYS 65 N -0.01 0.08 -0.64 6.66 1.57 -1.00 -1.34 116.57 121.90 3i11 h LYS 65 Ca 0.04 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 3i11 h LYS 65 Cb 0.26 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.52 3i11 h LYS 65 CO 0.00 0.05 0.27 1.49 -0.57 0.00 0.00 179.45 180.69 3i11 h GLU 66 N 0.08 0.93 0.11 3.15 4.81 -1.21 0.29 114.58 122.74 3i11 h GLU 66 Ca 0.17 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 3i11 h GLU 66 Cb 0.23 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.45 3i11 h GLU 66 CO -0.29 0.75 -0.05 1.25 -0.73 0.00 0.00 179.01 179.94 3i11 h LEU 67 N 0.92 -0.12 -0.48 1.64 5.85 -0.47 -0.98 115.31 121.67 3i11 h LEU 67 Ca 0.22 -0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.91 3i11 h LEU 67 Cb 0.15 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.18 3i11 h LEU 67 CO -0.02 -0.02 0.28 0.40 -0.34 0.00 0.00 178.44 178.74 3i11 h ILE 68 N -0.21 1.04 -0.38 4.05 2.04 -0.97 -1.72 117.51 121.37 3i11 h ILE 68 Ca -0.01 -0.19 -0.10 0.00 1.00 0.00 0.00 64.86 65.55 3i11 h ILE 68 Cb 0.17 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 3i11 h ILE 68 CO 0.02 0.10 -0.19 -0.33 0.00 0.00 0.00 178.15 177.75 3i11 h GLU 69 N 0.56 0.72 -0.17 2.37 5.08 -0.76 -0.15 114.58 122.24 3i11 h GLU 69 Ca 0.19 -0.27 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 3i11 h GLU 69 Cb 0.02 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 3i11 h GLU 69 CO -0.09 0.87 0.03 1.98 -1.00 0.00 0.00 179.01 180.79 3i11 h MET 70 N 0.64 0.29 -0.21 2.33 4.05 -0.84 -2.59 114.93 118.61 3i11 h MET 70 Ca 0.10 -0.08 -0.18 0.00 -0.28 0.00 0.00 59.70 59.26 3i11 h MET 70 Cb 0.68 -0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 31.44 3i11 h MET 70 CO 0.05 0.46 -0.58 -0.39 0.23 0.00 0.00 176.91 176.68 3i11 h VAL 71 N 0.08 1.31 -0.85 -5.77 -1.51 -1.03 -1.67 116.25 106.80 3i11 h VAL 71 Ca 0.05 -1.81 -0.02 0.00 -1.23 0.00 0.00 66.70 63.70 3i11 h VAL 71 Cb 0.31 1.76 -0.04 0.00 -2.13 0.00 0.00 31.29 31.19 3i11 h VAL 71 CO 0.00 0.57 0.46 -0.33 -1.23 0.00 0.00 177.57 177.04 3i11 h GLU 72 N 0.51 1.18 -0.21 5.19 5.08 -1.03 -0.52 114.58 124.78 3i11 h GLU 72 Ca 0.00 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.17 3i11 h GLU 72 Cb 1.15 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 3i11 h GLU 72 CO 0.12 0.87 -0.05 -0.22 -1.00 0.00 0.00 179.01 178.73 3i11 h LYS 73 N 1.18 0.41 -0.01 2.33 3.64 -1.39 0.22 116.57 122.96 3i11 h LYS 73 Ca 0.30 -0.16 -0.00 0.00 -1.27 0.00 0.00 60.65 59.52 3i11 h LYS 73 Cb 0.04 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.83 3i11 h LYS 73 CO -0.05 0.66 -0.00 -0.22 -2.27 0.00 0.00 179.45 177.56 3i11 h LYS 74 N 0.14 0.02 -0.00 1.90 3.64 -1.13 -3.24 116.57 117.89 3i11 h LYS 74 Ca 0.05 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 3i11 h LYS 74 Cb 0.50 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 3i11 h LYS 74 CO 0.02 0.46 -0.29 1.19 -2.27 0.00 0.00 179.45 178.55 3i11 n PHE 75 N -4.86 0.00 -3.53 1.91 3.72 -0.22 -4.96 117.46 109.52 3i11 n PHE 75 Ca -0.08 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.11 3i11 n PHE 75 Cb 0.23 -0.31 0.08 0.00 -0.94 0.00 0.00 39.48 38.55 3i11 n PHE 75 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3i11 n GLN 76 N -1.39 -7.13 -3.65 -1.08 1.13 0.06 -4.99 117.38 100.34 3i11 n GLN 76 Ca 0.07 0.83 -0.10 0.00 -1.94 0.00 0.00 57.00 55.86 3i11 n GLN 76 Cb 0.33 -5.84 -0.03 0.00 0.11 0.00 0.00 30.24 24.81 3i11 n GLN 76 CO 0.00 0.00 0.00 -1.59 -1.44 0.00 0.00 177.06 174.03 3i11 s LYS 77 N -5.83 1.38 0.32 -1.09 -2.85 -1.19 -5.08 119.74 105.41 3i11 s LYS 77 Ca 0.27 -0.74 -0.07 0.00 -1.00 0.00 0.00 55.97 54.42 3i11 s LYS 77 Cb -0.12 0.55 -0.06 0.00 -2.06 0.00 0.00 37.83 36.14 3i11 s LYS 77 CO 0.74 -0.60 0.62 1.03 0.10 0.00 0.00 175.35 177.24 3i11 s ARG 78 N -3.83 3.70 -0.13 1.78 1.81 -1.26 -4.33 118.95 116.69 3i11 s ARG 78 Ca 0.06 0.18 -0.29 0.00 -1.72 0.00 0.00 55.73 53.96 3i11 s ARG 78 Cb -0.01 -2.57 -0.01 0.00 -0.45 0.00 0.00 34.95 31.91 3i11 s ARG 78 CO -0.05 0.15 1.09 0.08 -0.68 0.00 0.00 175.30 175.88 3i11 s VAL 79 N -2.14 4.59 -0.09 3.52 1.01 -1.26 -0.71 120.40 125.32 3i11 s VAL 79 Ca 0.47 1.89 0.12 0.00 0.00 0.00 0.00 61.98 64.46 3i11 s VAL 79 Cb -0.11 -4.22 -0.18 0.00 0.00 0.00 0.00 36.38 31.88 3i11 s VAL 79 CO 0.29 -0.06 0.13 0.35 0.00 0.00 0.00 175.10 175.81 3i11 n THR 80 N 4.86 0.56 -3.72 3.92 -2.24 -0.03 -4.80 114.28 112.83 3i11 n THR 80 Ca 0.11 -0.46 -0.14 0.00 -2.27 0.00 0.00 64.05 61.29 3i11 n THR 80 Cb 0.47 -0.36 -0.08 0.00 -2.10 0.00 0.00 70.33 68.26 3i11 n THR 80 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3i11 s ASP 81 N -4.21 -0.25 -0.00 3.42 1.11 -1.24 -1.87 116.67 113.63 3i11 s ASP 81 Ca -0.06 0.12 0.01 0.00 0.18 0.00 0.00 52.55 52.80 3i11 s ASP 81 Cb 0.05 0.36 -0.00 0.00 1.07 0.00 0.00 42.92 44.40 3i11 s ASP 81 CO 0.53 -0.51 -0.02 -0.69 1.18 0.00 0.00 175.17 175.66 3i11 s VAL 82 N -1.59 0.19 -0.28 -1.27 1.01 0.52 -1.27 120.40 117.71 3i11 s VAL 82 Ca -0.11 -0.09 -0.08 0.00 0.00 0.00 0.00 61.98 61.69 3i11 s VAL 82 Cb -0.04 -0.17 -0.02 0.00 0.00 0.00 0.00 36.38 36.16 3i11 s VAL 82 CO 0.03 0.06 0.11 -0.63 0.00 0.00 0.00 175.10 174.68 3i11 s ILE 83 N 0.01 4.44 -0.27 2.22 1.01 0.14 -0.04 121.20 128.71 3i11 s ILE 83 Ca 0.00 -0.33 -0.17 0.00 0.00 0.00 0.00 60.65 60.15 3i11 s ILE 83 Cb -0.02 -3.19 -0.03 0.00 0.01 0.00 0.00 42.46 39.23 3i11 s ILE 83 CO -0.00 0.18 0.45 -0.63 0.00 0.00 0.00 174.94 174.94 3i11 s ILE 84 N 1.61 5.12 -0.39 2.92 -1.09 -0.39 0.12 121.20 129.09 3i11 s ILE 84 Ca 0.05 0.73 0.23 0.00 -2.23 0.00 0.00 60.65 59.43 3i11 s ILE 84 Cb -0.16 -3.77 -0.02 0.00 -1.58 0.00 0.00 42.46 36.92 3i11 s ILE 84 CO 0.05 0.11 1.08 0.35 -1.23 0.00 0.00 174.94 175.31 3i11 n THR 85 N 5.15 0.45 -3.77 2.92 -2.24 -1.26 -4.64 114.28 110.88 3i11 n THR 85 Ca -0.06 -0.42 -0.03 0.00 -2.27 0.00 0.00 64.05 61.27 3i11 n THR 85 Cb 0.50 -0.17 -0.01 0.00 -2.10 0.00 0.00 70.33 68.55 3i11 n THR 85 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 3i11 s HIS 86 N -3.29 -0.09 -2.11 4.78 -3.43 -1.26 -1.13 115.29 108.76 3i11 s HIS 86 Ca 0.02 -0.23 0.15 0.00 -0.80 0.00 0.00 55.06 54.20 3i11 s HIS 86 Cb 0.12 0.65 0.63 0.00 -1.43 0.00 0.00 32.58 32.55 3i11 s HIS 86 CO 0.78 -0.82 1.45 0.00 -2.00 0.00 0.00 174.74 174.15 3i11 n ALA 87 N -0.51 2.52 -1.67 -1.38 0.00 -1.26 -4.17 120.51 114.04 3i11 n ALA 87 Ca -0.06 -0.38 -0.34 0.00 0.00 0.00 0.00 53.44 52.67 3i11 n ALA 87 Cb 0.61 -1.10 0.01 0.00 0.00 0.00 0.00 19.45 18.97 3i11 n ALA 87 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3i11 s HIS 88 N -1.81 2.75 0.29 0.00 3.76 -1.26 -4.65 115.29 114.38 3i11 s HIS 88 Ca 0.25 1.54 0.03 0.00 -0.15 0.00 0.00 55.06 56.73 3i11 s HIS 88 Cb 0.13 -3.17 0.74 0.00 1.11 0.00 0.00 32.58 31.39 3i11 s HIS 88 CO 0.19 -1.44 1.63 0.00 -0.85 0.00 0.00 174.74 174.27 3i11 h ALA 89 N 0.71 1.28 -0.00 -1.40 0.00 -1.93 -0.41 119.26 117.50 3i11 h ALA 89 Ca -0.48 0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3i11 h ALA 89 Cb 1.24 0.38 -0.00 0.00 0.00 0.00 0.00 17.79 19.41 3i11 h ALA 89 CO 0.56 -0.51 0.01 0.38 0.00 0.00 0.00 179.25 179.68 3i11 h ASP 90 N 0.15 0.00 0.00 0.00 2.03 -1.86 -0.25 116.42 116.49 3i11 h ASP 90 Ca 0.57 0.00 -0.34 0.00 -0.73 0.00 0.00 57.03 56.53 3i11 h ASP 90 Cb 1.18 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 39.62 3i11 h ASP 90 CO -0.72 0.00 -2.21 0.54 -1.03 0.00 0.00 179.24 175.83 3i11 n ARG 91 N -3.26 0.49 0.00 4.15 5.12 -0.36 -3.70 116.66 119.10 3i11 n ARG 91 Ca -0.03 0.17 0.12 0.00 -1.93 0.00 0.00 57.85 56.18 3i11 n ARG 91 Cb 0.08 -1.34 0.29 0.00 -1.16 0.00 0.00 32.46 30.33 3i11 n ARG 91 CO 0.00 0.00 0.00 1.51 -1.93 0.00 0.00 177.63 177.21 3i11 n ILE 92 N -3.58 0.00 0.25 0.55 0.13 -0.31 -4.06 119.36 112.34 3i11 n ILE 92 Ca -0.40 -0.13 0.11 0.00 -1.10 0.00 0.00 62.75 61.22 3i11 n ILE 92 Cb 0.84 0.53 0.68 0.00 -0.84 0.00 0.00 39.64 40.85 3i11 n ILE 92 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 3i11 h GLY 93 N 4.92 0.00 -2.54 4.50 0.00 -1.08 -1.24 103.07 107.64 3i11 h GLY 93 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3i11 h GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 3i11 n GLY 94 N -0.83 2.24 0.37 4.60 0.00 -1.16 -3.26 105.19 107.14 3i11 n GLY 94 Ca -0.02 -0.61 0.03 0.00 0.00 0.00 0.00 46.02 45.41 3i11 n GLY 94 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3i11 h ILE 95 N 2.79 1.11 -0.80 -0.61 6.09 -1.57 -1.70 117.51 122.82 3i11 h ILE 95 Ca 0.00 -0.38 0.01 0.00 -1.37 0.00 0.00 64.86 63.12 3i11 h ILE 95 Cb 1.31 -0.09 -0.04 0.00 0.47 0.00 0.00 36.82 38.47 3i11 h ILE 95 CO 0.26 0.20 0.53 0.50 -3.07 0.00 0.00 178.15 176.57 3i11 h LYS 96 N 1.10 1.04 -0.22 2.19 3.64 -1.84 -0.36 116.57 122.12 3i11 h LYS 96 Ca 0.38 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.68 3i11 h LYS 96 Cb 0.11 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 3i11 h LYS 96 CO -0.13 0.69 0.07 1.15 -2.27 0.00 0.00 179.45 178.96 3i11 h THR 97 N 1.07 1.19 -0.41 1.00 2.02 -1.68 -1.39 112.91 114.71 3i11 h THR 97 Ca 0.30 -0.58 0.04 0.00 0.77 0.00 0.00 66.41 66.93 3i11 h THR 97 Cb -0.10 1.16 -0.04 0.00 -1.74 0.00 0.00 68.15 67.43 3i11 h THR 97 CO -0.07 0.19 0.18 -0.07 0.37 0.00 0.00 175.52 176.11 3i11 h LEU 98 N 0.19 0.23 -0.49 2.58 3.38 -0.88 -2.18 115.31 118.13 3i11 h LEU 98 Ca 0.07 0.03 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 3i11 h LEU 98 Cb 0.22 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 3i11 h LEU 98 CO -0.00 0.17 -0.03 0.11 0.09 0.00 0.00 178.44 178.77 3i11 h LYS 99 N 0.36 0.90 0.00 1.13 1.79 -0.90 -0.64 116.57 119.21 3i11 h LYS 99 Ca 0.18 -0.30 -0.03 0.00 -2.18 0.00 0.00 60.65 58.32 3i11 h LYS 99 Cb 0.13 -0.07 -0.00 0.00 -1.58 0.00 0.00 32.23 30.70 3i11 h LYS 99 CO -0.15 0.95 -0.13 1.05 -1.08 0.00 0.00 179.45 180.09 3i11 h GLU 100 N 0.75 0.00 -0.02 3.15 4.11 -1.12 -2.60 114.58 118.85 3i11 h GLU 100 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.57 3i11 h GLU 100 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 3i11 h GLU 100 CO 0.03 0.13 -0.05 0.54 0.07 0.00 0.00 179.01 179.73 3i11 n ARG 101 N -3.19 1.70 -1.95 1.06 1.74 -0.83 -4.95 116.66 110.24 3i11 n ARG 101 Ca 0.02 -1.14 -0.08 0.00 -0.77 0.00 0.00 57.85 55.89 3i11 n ARG 101 Cb 0.46 -1.48 -0.01 0.00 -1.02 0.00 0.00 32.46 30.42 3i11 n ARG 101 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3i11 n GLY 102 N 1.25 0.25 3.65 -0.13 0.00 -0.95 -5.02 105.19 104.24 3i11 n GLY 102 Ca 0.17 -0.60 -0.40 0.00 0.00 0.00 0.00 46.02 45.18 3i11 n GLY 102 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3i11 s ILE 103 N -2.35 5.00 0.05 -0.61 1.01 -0.29 -4.97 121.20 119.03 3i11 s ILE 103 Ca 0.00 1.19 -0.31 0.00 0.00 0.00 0.00 60.65 61.54 3i11 s ILE 103 Cb 0.00 -3.95 -0.07 0.00 0.01 0.00 0.00 42.46 38.45 3i11 s ILE 103 CO 0.00 0.08 1.53 -0.54 0.00 0.00 0.00 174.94 176.01 3i11 s LYS 104 N 2.14 4.24 -0.46 2.79 1.02 -0.78 -4.39 119.74 124.29 3i11 s LYS 104 Ca 0.28 2.17 -0.05 0.00 0.02 0.00 0.00 55.97 58.40 3i11 s LYS 104 Cb -0.16 -3.54 0.12 0.00 -0.52 0.00 0.00 37.83 33.74 3i11 s LYS 104 CO 0.10 -0.64 0.29 0.00 -0.92 0.00 0.00 175.35 174.17 3i11 s ALA 105 N 2.34 3.30 0.23 5.17 0.00 -1.26 -0.35 121.76 131.19 3i11 s ALA 105 Ca 0.69 -2.64 -0.23 0.00 0.00 0.00 0.00 51.96 49.78 3i11 s ALA 105 Cb -0.37 -2.60 -0.09 0.00 0.00 0.00 0.00 23.12 20.07 3i11 s ALA 105 CO 0.30 -1.88 0.80 -1.01 0.00 0.00 0.00 175.76 173.97 3i11 s HIS 106 N 1.05 3.75 0.26 0.00 3.76 0.94 -0.33 115.29 124.73 3i11 s HIS 106 Ca 0.09 1.58 -0.21 0.00 -0.15 0.00 0.00 55.06 56.36 3i11 s HIS 106 Cb -0.23 -2.75 0.03 0.00 1.11 0.00 0.00 32.58 30.73 3i11 s HIS 106 CO -0.03 0.37 0.76 -1.54 -0.85 0.00 0.00 174.74 173.44 3i11 s SER 107 N -1.47 -0.24 0.84 1.40 1.04 -1.26 -1.26 113.70 112.75 3i11 s SER 107 Ca 0.42 -0.59 -0.12 0.00 0.48 0.00 0.00 55.95 56.15 3i11 s SER 107 Cb -0.19 0.70 0.09 0.00 0.10 0.00 0.00 66.02 66.72 3i11 s SER 107 CO 0.24 -1.29 1.10 0.42 0.98 0.00 0.00 173.24 174.68 3i11 s THR 108 N -3.81 2.87 0.27 2.02 -4.23 -1.26 -0.87 115.64 110.64 3i11 s THR 108 Ca 0.11 0.28 -0.03 0.00 -1.18 0.00 0.00 61.69 60.87 3i11 s THR 108 Cb -0.05 -2.93 0.20 0.00 1.34 0.00 0.00 72.50 71.06 3i11 s THR 108 CO 0.06 -0.37 1.88 0.00 -0.54 0.00 0.00 174.62 175.65 3i11 h ALA 109 N -1.28 1.26 -0.27 3.99 0.00 -1.70 -1.53 119.26 119.72 3i11 h ALA 109 Ca -0.48 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.27 3i11 h ALA 109 Cb 1.28 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 3i11 h ALA 109 CO 0.58 0.57 0.09 1.25 0.00 0.00 0.00 179.25 181.74 3i11 h LEU 110 N 1.02 0.39 -0.79 0.00 5.85 -1.92 -0.16 115.31 119.70 3i11 h LEU 110 Ca 0.25 -0.19 0.07 0.00 0.84 0.00 0.00 57.88 58.84 3i11 h LEU 110 Cb 0.10 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 40.96 3i11 h LEU 110 CO -0.03 0.48 0.47 0.74 -0.34 0.00 0.00 178.44 179.75 3i11 h THR 111 N 0.28 0.98 -0.73 1.05 2.02 -1.83 -0.44 112.91 114.25 3i11 h THR 111 Ca 0.09 -0.29 -0.07 0.00 0.77 0.00 0.00 66.41 66.91 3i11 h THR 111 Cb 0.23 0.07 -0.03 0.00 -1.74 0.00 0.00 68.15 66.68 3i11 h THR 111 CO -0.00 0.15 0.19 0.00 0.37 0.00 0.00 175.52 176.23 3i11 h ALA 112 N 1.40 0.96 -0.28 6.16 0.00 -0.87 -0.40 119.26 126.24 3i11 h ALA 112 Ca 0.36 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3i11 h ALA 112 Cb 0.23 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3i11 h ALA 112 CO -0.20 0.67 0.15 1.49 0.00 0.00 0.00 179.25 181.36 3i11 h GLU 113 N 1.10 0.39 -0.40 0.00 4.81 -0.47 -1.10 114.58 118.91 3i11 h GLU 113 Ca 0.23 -0.05 -0.12 0.00 -0.13 0.00 0.00 59.36 59.30 3i11 h GLU 113 Cb 0.35 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 3i11 h GLU 113 CO -0.00 0.34 -0.23 -0.07 -0.73 0.00 0.00 179.01 178.32 3i11 h LEU 114 N 0.33 0.81 -0.19 1.64 3.38 -0.95 -0.85 115.31 119.47 3i11 h LEU 114 Ca 0.10 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 57.77 3i11 h LEU 114 Cb 0.07 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 3i11 h LEU 114 CO -0.02 1.01 0.11 0.00 0.09 0.00 0.00 178.44 179.63 3i11 h ALA 115 N 1.05 0.25 -0.12 1.53 0.00 -0.72 -1.35 119.26 119.90 3i11 h ALA 115 Ca 0.09 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.97 3i11 h ALA 115 Cb 0.75 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 3i11 h ALA 115 CO 0.06 -0.23 0.00 -0.22 0.00 0.00 0.00 179.25 178.87 3i11 h LYS 116 N 0.21 0.04 -0.87 0.00 3.64 -1.11 -1.13 116.57 117.35 3i11 h LYS 116 Ca 0.07 -0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.52 3i11 h LYS 116 Cb 0.06 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 31.81 3i11 h LYS 116 CO -0.01 0.03 0.57 -0.22 -2.27 0.00 0.00 179.45 177.54 3i11 h LYS 117 N 0.04 0.90 -0.36 1.90 3.64 -0.89 -1.64 116.57 120.16 3i11 h LYS 117 Ca 0.05 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3i11 h LYS 117 Cb 0.06 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.68 3i11 h LYS 117 CO -0.09 0.60 0.00 0.09 -2.27 0.00 0.00 179.45 177.78 3i11 n ASN 118 N -4.50 2.04 0.00 4.20 5.03 -0.53 -4.93 115.26 116.57 3i11 n ASN 118 Ca 0.14 -1.96 0.00 0.00 0.87 0.00 0.00 54.58 53.63 3i11 n ASN 118 Cb 0.24 -0.24 0.00 0.00 -1.02 0.00 0.00 39.78 38.77 3i11 n ASN 118 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3i11 n GLY 119 N 1.13 0.76 3.89 7.41 0.00 -0.62 -5.05 105.19 112.71 3i11 n GLY 119 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 3i11 n GLY 119 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3i11 s TYR 120 N -2.13 3.45 0.74 1.61 1.51 -0.49 -5.00 117.35 117.05 3i11 s TYR 120 Ca 0.00 0.77 -0.15 0.00 -1.01 0.00 0.00 57.07 56.68 3i11 s TYR 120 Cb 0.00 -2.19 0.05 0.00 -0.11 0.00 0.00 41.96 39.71 3i11 s TYR 120 CO 0.00 0.24 1.23 -1.21 -1.11 0.00 0.00 175.55 174.69 3i11 s GLU 121 N -3.08 2.03 -0.14 -0.62 2.02 -1.26 -3.79 118.70 113.85 3i11 s GLU 121 Ca 0.46 1.82 -0.13 0.00 0.02 0.00 0.00 54.97 57.14 3i11 s GLU 121 Cb -0.11 -1.81 -0.05 0.00 0.10 0.00 0.00 34.13 32.26 3i11 s GLU 121 CO 0.25 -1.94 0.29 -1.21 0.02 0.00 0.00 175.26 172.67 3i11 s GLU 122 N -3.89 4.16 1.21 1.61 2.02 -1.26 -4.75 118.70 117.81 3i11 s GLU 122 Ca 0.76 0.11 -0.20 0.00 0.02 0.00 0.00 54.97 55.66 3i11 s GLU 122 Cb -0.31 -3.39 0.29 0.00 0.10 0.00 0.00 34.13 30.83 3i11 s GLU 122 CO 0.46 0.32 1.13 -1.25 0.02 0.00 0.00 175.26 175.94 3i11 s PRO 123 N 0.21 -1.28 0.42 0.39 0.04 -1.26 -4.97 135.00 128.56 3i11 s PRO 123 Ca 0.17 -0.17 0.21 0.00 0.04 0.00 0.00 61.00 61.26 3i11 s PRO 123 Cb -0.13 -1.60 0.89 0.00 0.04 0.00 0.00 34.50 33.70 3i11 s PRO 123 CO 0.05 -3.73 1.83 -0.07 0.04 0.00 0.00 177.00 175.11 3i11 h LEU 124 N -2.59 0.00 2.02 -3.56 3.38 -0.97 -3.46 115.31 110.13 3i11 h LEU 124 Ca -0.44 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.16 3i11 h LEU 124 Cb 1.28 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.97 3i11 h LEU 124 CO 0.31 0.28 -0.43 0.61 0.09 0.00 0.00 178.44 179.30 3i11 n GLY 125 N -0.00 0.42 0.16 0.83 0.00 -1.13 -4.90 105.19 100.56 3i11 n GLY 125 Ca -0.01 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.03 3i11 n GLY 125 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3i11 h ASP 126 N 0.00 0.00 -3.52 1.61 2.03 -1.27 -3.28 116.42 111.98 3i11 h ASP 126 Ca -0.42 -0.01 -0.53 0.00 -0.73 0.00 0.00 57.03 55.34 3i11 h ASP 126 Cb 1.29 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.76 3i11 h ASP 126 CO 0.54 0.00 0.26 -0.76 -1.03 0.00 0.00 179.24 178.26 3i11 s LEU 127 N -5.69 4.50 0.00 0.15 1.43 -0.14 -4.99 118.68 113.94 3i11 s LEU 127 Ca 0.03 1.66 0.00 0.00 -1.03 0.00 0.00 54.13 54.79 3i11 s LEU 127 Cb 0.08 -3.42 0.00 0.00 0.03 0.00 0.00 46.19 42.87 3i11 s LEU 127 CO 0.73 0.01 0.00 0.00 0.23 0.00 0.00 176.35 177.32 3i11 n GLN 128 N 2.58 2.03 -0.15 1.70 1.13 -1.26 -4.05 117.38 119.36 3i11 n GLN 128 Ca -0.01 0.00 -0.09 0.00 -1.94 0.00 0.00 57.00 54.97 3i11 n GLN 128 Cb 0.49 0.00 -0.00 0.00 0.11 0.00 0.00 30.24 30.84 3i11 n GLN 128 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 3i11 h THR 129 N -0.06 1.20 -3.23 5.09 2.02 -1.92 -3.41 112.91 112.60 3i11 h THR 129 Ca 0.00 -0.61 -0.60 0.00 0.77 0.00 0.00 66.41 65.97 3i11 h THR 129 Cb 0.00 0.79 -0.35 0.00 -1.74 0.00 0.00 68.15 66.85 3i11 h THR 129 CO 0.00 0.22 -0.84 -0.69 0.37 0.00 0.00 175.52 174.59 3i11 s VAL 130 N -5.57 1.58 -0.04 3.16 1.01 -1.26 -0.96 120.40 118.32 3i11 s VAL 130 Ca -0.13 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.19 3i11 s VAL 130 Cb 0.11 -1.44 0.01 0.00 0.00 0.00 0.00 36.38 35.05 3i11 s VAL 130 CO 0.76 0.46 -0.09 -0.89 0.00 0.00 0.00 175.10 175.33 3i11 s THR 131 N 1.06 0.85 -0.21 3.92 2.01 -0.61 -4.99 115.64 117.67 3i11 s THR 131 Ca -0.05 -0.37 -0.04 0.00 0.31 0.00 0.00 61.69 61.55 3i11 s THR 131 Cb -0.15 -0.77 -0.01 0.00 0.01 0.00 0.00 72.50 71.58 3i11 s THR 131 CO -0.03 0.27 -0.05 0.20 -0.69 0.00 0.00 174.62 174.32 3i11 s ASN 132 N 0.38 4.31 0.12 3.53 0.01 -1.26 -0.66 114.94 121.38 3i11 s ASN 132 Ca -0.07 -0.37 0.09 0.00 -0.71 0.00 0.00 52.86 51.81 3i11 s ASN 132 Cb -0.11 -1.73 -0.04 0.00 0.41 0.00 0.00 41.25 39.78 3i11 s ASN 132 CO 0.01 0.00 -0.20 -0.76 -1.51 0.00 0.00 177.10 174.65 3i11 s LEU 133 N 1.33 2.63 -0.08 0.60 1.43 0.87 -5.00 118.68 120.47 3i11 s LEU 133 Ca 0.04 -0.60 0.01 0.00 -1.03 0.00 0.00 54.13 52.55 3i11 s LEU 133 Cb -0.14 -1.48 0.02 0.00 0.03 0.00 0.00 46.19 44.62 3i11 s LEU 133 CO -0.02 0.18 -0.10 -0.75 0.23 0.00 0.00 176.35 175.88 3i11 s LYS 134 N -2.16 1.55 -0.35 1.70 2.20 -1.26 -1.14 119.74 120.28 3i11 s LYS 134 Ca 0.17 -0.33 0.03 0.00 -0.36 0.00 0.00 55.97 55.48 3i11 s LYS 134 Cb -0.10 -1.40 0.10 0.00 -1.51 0.00 0.00 37.83 34.92 3i11 s LYS 134 CO 0.09 -0.08 0.08 -0.06 -0.36 0.00 0.00 175.35 175.03 3i11 s PHE 135 N 1.02 3.74 0.00 4.03 0.08 0.26 -4.95 117.98 122.15 3i11 s PHE 135 Ca -0.08 -2.91 0.00 0.00 0.12 0.00 0.00 56.93 54.06 3i11 s PHE 135 Cb -0.15 -2.98 0.00 0.00 -0.57 0.00 0.00 43.02 39.32 3i11 s PHE 135 CO -0.00 -0.95 0.00 0.41 -0.10 0.00 0.00 175.22 174.57 3i11 n GLY 136 N 4.31 3.58 0.18 4.36 0.00 -1.26 -0.69 105.19 115.67 3i11 n GLY 136 Ca 0.03 0.22 0.11 0.00 0.00 0.00 0.00 46.02 46.37 3i11 n GLY 136 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 3i11 h ASN 137 N 0.00 0.00 -3.32 1.61 -1.07 -1.95 -3.47 115.58 107.38 3i11 h ASN 137 Ca 0.00 0.00 -0.59 0.00 0.07 0.00 0.00 56.30 55.78 3i11 h ASN 137 Cb 0.00 0.00 -0.09 0.00 -2.07 0.00 0.00 38.32 36.16 3i11 h ASN 137 CO 0.00 0.07 0.40 -0.32 0.07 0.00 0.00 177.43 177.65 3i11 s MET 138 N -3.21 4.20 -0.08 4.14 0.00 0.13 -5.04 119.30 119.44 3i11 s MET 138 Ca 0.05 0.89 -0.12 0.00 0.00 0.00 0.00 55.69 56.51 3i11 s MET 138 Cb 0.06 -3.63 -0.05 0.00 0.00 0.00 0.00 34.83 31.22 3i11 s MET 138 CO 0.71 -0.45 0.30 0.15 0.00 0.00 0.00 175.02 175.72 3i11 s LYS 139 N 2.62 3.86 -0.04 4.11 1.02 -1.26 -0.57 119.74 129.49 3i11 s LYS 139 Ca 0.34 0.16 -0.00 0.00 0.02 0.00 0.00 55.97 56.49 3i11 s LYS 139 Cb -0.16 -3.27 0.03 0.00 -0.52 0.00 0.00 37.83 33.91 3i11 s LYS 139 CO 0.08 0.59 0.01 0.08 -0.92 0.00 0.00 175.35 175.19 3i11 s VAL 140 N -0.64 0.18 -0.13 3.17 1.01 -0.29 -4.24 120.40 119.46 3i11 s VAL 140 Ca 0.19 0.12 -0.02 0.00 0.00 0.00 0.00 61.98 62.28 3i11 s VAL 140 Cb -0.14 -0.30 -0.02 0.00 0.00 0.00 0.00 36.38 35.92 3i11 s VAL 140 CO 0.08 0.16 -0.07 -0.70 0.00 0.00 0.00 175.10 174.57 3i11 s GLU 141 N 1.26 3.38 -0.01 2.72 2.12 -0.18 -0.09 118.70 127.90 3i11 s GLU 141 Ca -0.06 -0.58 0.00 0.00 0.36 0.00 0.00 54.97 54.69 3i11 s GLU 141 Cb -0.13 -2.76 -0.04 0.00 0.26 0.00 0.00 34.13 31.46 3i11 s GLU 141 CO -0.02 0.33 0.04 0.95 -0.54 0.00 0.00 175.26 176.01 3i11 s THR 142 N 0.09 4.43 -0.07 -1.70 -4.23 0.17 -0.38 115.64 113.96 3i11 s THR 142 Ca -0.02 -0.48 -0.03 0.00 -1.18 0.00 0.00 61.69 59.98 3i11 s THR 142 Cb -0.14 -2.99 0.04 0.00 1.34 0.00 0.00 72.50 70.75 3i11 s THR 142 CO 0.03 0.39 0.12 0.12 -0.54 0.00 0.00 174.62 174.74 3i11 s PHE 143 N -1.11 -0.10 -0.47 3.99 5.36 -0.33 -1.57 117.98 123.75 3i11 s PHE 143 Ca 0.20 0.47 -0.21 0.00 -0.96 0.00 0.00 56.93 56.44 3i11 s PHE 143 Cb -0.12 -0.30 0.04 0.00 -0.34 0.00 0.00 43.02 42.30 3i11 s PHE 143 CO 0.11 -0.23 0.67 -0.47 -1.46 0.00 0.00 175.22 173.85 3i11 s TYR 144 N 2.07 3.03 -2.10 10.12 5.04 -0.14 -0.86 117.35 134.51 3i11 s TYR 144 Ca 0.02 -0.18 0.28 0.00 -2.44 0.00 0.00 57.07 54.74 3i11 s TYR 144 Cb -0.12 -3.48 1.00 0.00 0.35 0.00 0.00 41.96 39.71 3i11 s TYR 144 CO -0.05 -0.97 1.71 -0.35 -1.34 0.00 0.00 175.55 174.56 3i11 n PRO 145 N 6.38 1.21 0.00 4.97 -0.04 -1.26 -4.92 135.00 141.34 3i11 n PRO 145 Ca -0.03 -0.66 0.00 0.00 -0.04 0.00 0.00 63.50 62.78 3i11 n PRO 145 Cb 0.47 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 3i11 n PRO 145 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3i11 n GLY 146 N 1.24 1.16 3.79 0.55 0.00 -1.26 -4.38 105.19 106.28 3i11 n GLY 146 Ca 0.16 -2.22 -0.35 0.00 0.00 0.00 0.00 46.02 43.61 3i11 n GLY 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i11 s LYS 147 N -1.28 3.98 0.00 1.61 1.02 -1.26 -4.65 119.74 119.16 3i11 s LYS 147 Ca 0.00 1.43 0.00 0.00 0.02 0.00 0.00 55.97 57.42 3i11 s LYS 147 Cb 0.00 -2.30 0.00 0.00 -0.52 0.00 0.00 37.83 35.01 3i11 s LYS 147 CO 0.00 -0.29 0.00 0.41 -0.92 0.00 0.00 175.35 174.55 3i11 n GLY 148 N 0.02 0.01 0.36 -3.33 0.00 -1.26 -3.03 105.19 97.95 3i11 n GLY 148 Ca 0.07 0.46 0.01 0.00 0.00 0.00 0.00 46.02 46.56 3i11 n GLY 148 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3i11 h HIS 149 N 0.00 1.06 -4.69 1.61 -0.00 -1.88 0.14 115.15 111.39 3i11 h HIS 149 Ca 0.00 0.03 -0.36 0.00 -0.00 0.00 0.00 60.37 60.04 3i11 h HIS 149 Cb 0.00 -0.36 -0.14 0.00 -0.00 0.00 0.00 27.41 26.91 3i11 h HIS 149 CO 0.00 0.64 -0.56 0.95 -0.00 0.00 0.00 177.93 178.97 3i11 s THR 150 N -5.94 0.02 0.28 6.26 -4.23 -1.26 -3.21 115.64 107.57 3i11 s THR 150 Ca -0.12 -2.00 0.19 0.00 -1.18 0.00 0.00 61.69 58.58 3i11 s THR 150 Cb 0.18 -2.50 0.16 0.00 1.34 0.00 0.00 72.50 71.68 3i11 s THR 150 CO 0.80 0.00 1.84 1.05 -0.54 0.00 0.00 174.62 177.76 3i11 h GLU 151 N 2.37 0.00 -0.01 3.99 4.11 -1.85 -3.29 114.58 119.90 3i11 h GLU 151 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.12 3i11 h GLU 151 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 3i11 h GLU 151 CO 0.45 0.31 -0.58 -0.40 0.07 0.00 0.00 179.01 178.87 3i11 n ASP 152 N -3.71 1.15 -4.64 3.06 5.75 -1.26 -4.33 116.55 112.58 3i11 n ASP 152 Ca -0.01 -1.08 -0.48 0.00 -0.01 0.00 0.00 54.79 53.21 3i11 n ASP 152 Cb 0.42 0.77 -0.04 0.00 -1.03 0.00 0.00 41.12 41.23 3i11 n ASP 152 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 3i11 n ASN 153 N -0.82 2.44 -4.67 -1.12 2.04 -1.24 -4.79 115.26 107.10 3i11 n ASN 153 Ca 0.05 1.11 -0.24 0.00 -0.44 0.00 0.00 54.58 55.06 3i11 n ASN 153 Cb 0.29 -1.34 -0.08 0.00 -2.53 0.00 0.00 39.78 36.13 3i11 n ASN 153 CO 0.00 0.00 0.00 0.27 -0.44 0.00 0.00 177.26 177.09 3i11 s ILE 154 N 0.54 2.83 0.29 1.53 -4.36 -0.28 -4.36 121.20 117.38 3i11 s ILE 154 Ca 0.78 -1.87 0.10 0.00 -0.26 0.00 0.00 60.65 59.41 3i11 s ILE 154 Cb -0.77 -2.87 -0.05 0.00 1.25 0.00 0.00 42.46 40.02 3i11 s ILE 154 CO 0.44 -0.21 -0.05 0.68 0.24 0.00 0.00 174.94 176.04 3i11 s VAL 155 N -2.47 3.01 -0.04 8.37 -7.23 -0.04 -4.68 120.40 117.33 3i11 s VAL 155 Ca 0.36 -2.05 0.04 0.00 -1.81 0.00 0.00 61.98 58.52 3i11 s VAL 155 Cb -0.01 -2.70 -0.00 0.00 0.56 0.00 0.00 36.38 34.23 3i11 s VAL 155 CO 0.21 -0.34 -0.15 -0.69 -0.31 0.00 0.00 175.10 173.82 3i11 s VAL 156 N -2.42 1.26 -0.05 1.32 1.01 -0.69 -1.19 120.40 119.65 3i11 s VAL 156 Ca 0.32 -0.63 0.04 0.00 0.00 0.00 0.00 61.98 61.71 3i11 s VAL 156 Cb -0.05 -1.09 -0.00 0.00 0.00 0.00 0.00 36.38 35.25 3i11 s VAL 156 CO 0.19 0.37 -0.17 0.86 0.00 0.00 0.00 175.10 176.34 3i11 s TRP 157 N 0.02 1.78 -0.55 5.22 -0.11 0.49 -0.06 118.94 125.73 3i11 s TRP 157 Ca -0.02 -0.55 -0.06 0.00 1.22 0.00 0.00 56.10 56.69 3i11 s TRP 157 Cb -0.10 -1.20 0.14 0.00 -1.50 0.00 0.00 33.47 30.81 3i11 s TRP 157 CO 0.01 -0.20 0.39 -0.51 -4.62 0.00 0.00 176.95 172.02 3i11 s LEU 158 N 0.12 5.53 0.63 5.86 1.43 -0.06 -1.01 118.68 131.18 3i11 s LEU 158 Ca -0.06 -2.36 0.40 0.00 -1.03 0.00 0.00 54.13 51.08 3i11 s LEU 158 Cb -0.13 -1.93 2.12 0.00 0.03 0.00 0.00 46.19 46.29 3i11 s LEU 158 CO 0.03 -0.53 2.27 1.55 0.23 0.00 0.00 176.35 179.90 3i11 h PRO 159 N 7.77 0.00 0.00 1.29 0.13 -1.86 -0.65 132.00 138.67 3i11 h PRO 159 Ca -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 3i11 h PRO 159 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 3i11 h PRO 159 CO 0.76 0.01 0.00 1.04 -0.23 0.00 0.00 178.00 179.58 3i11 n GLN 160 N -3.18 0.11 0.00 0.86 6.02 -1.26 -3.95 117.38 115.98 3i11 n GLN 160 Ca -0.02 0.03 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 3i11 n GLN 160 Cb 0.13 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.89 3i11 n GLN 160 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3i11 n TYR 161 N -1.44 0.00 -3.95 1.08 4.01 -0.88 -5.03 117.16 110.95 3i11 n TYR 161 Ca 0.08 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.57 3i11 n TYR 161 Cb 0.29 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.30 3i11 n TYR 161 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3i11 n ASN 162 N -0.32 -0.35 -4.42 7.72 4.13 -0.30 -4.57 115.26 117.15 3i11 n ASN 162 Ca 0.00 -1.00 -0.35 0.00 1.68 0.00 0.00 54.58 54.91 3i11 n ASN 162 Cb 0.00 -3.06 -0.13 0.00 -1.54 0.00 0.00 39.78 35.05 3i11 n ASN 162 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3i11 s ILE 163 N -3.95 3.72 -0.19 2.41 1.01 -1.16 -0.38 121.20 122.67 3i11 s ILE 163 Ca 0.01 -0.39 -0.07 0.00 0.00 0.00 0.00 60.65 60.20 3i11 s ILE 163 Cb -0.01 -2.67 -0.04 0.00 0.01 0.00 0.00 42.46 39.76 3i11 s ILE 163 CO 0.89 0.45 0.04 -0.22 0.00 0.00 0.00 174.94 176.09 3i11 s LEU 164 N 0.95 3.63 -0.50 2.97 2.96 -0.22 -0.88 118.68 127.59 3i11 s LEU 164 Ca 0.00 -0.01 -0.19 0.00 -0.22 0.00 0.00 54.13 53.72 3i11 s LEU 164 Cb -0.14 -1.92 0.06 0.00 0.50 0.00 0.00 46.19 44.69 3i11 s LEU 164 CO 0.01 0.14 0.59 -0.69 -1.32 0.00 0.00 176.35 175.08 3i11 s VAL 165 N 0.54 4.93 -0.22 1.68 1.01 0.92 0.06 120.40 129.33 3i11 s VAL 165 Ca 0.02 -0.58 0.19 0.00 0.00 0.00 0.00 61.98 61.61 3i11 s VAL 165 Cb -0.13 -4.27 0.17 0.00 0.00 0.00 0.00 36.38 32.15 3i11 s VAL 165 CO 0.01 -0.76 1.54 1.23 0.00 0.00 0.00 175.10 177.12 3i11 h GLY 166 N 9.55 0.00 0.00 4.51 0.00 -1.16 -1.83 103.07 114.14 3i11 h GLY 166 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.05 3i11 h GLY 166 CO 0.95 0.00 0.00 0.61 0.00 0.00 0.00 176.54 178.10 3i11 n GLY 167 N 1.07 0.93 0.17 4.60 0.00 -1.22 -3.29 105.19 107.45 3i11 n GLY 167 Ca 0.02 -0.68 0.14 0.00 0.00 0.00 0.00 46.02 45.51 3i11 n GLY 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i11 h LEU 169 N 0.83 0.00 -8.28 0.00 5.85 -1.91 -3.44 115.31 108.36 3i11 h LEU 169 Ca 0.00 0.00 -0.67 0.00 0.84 0.00 0.00 57.88 58.05 3i11 h LEU 169 Cb 0.32 0.00 -0.32 0.00 0.37 0.00 0.00 40.66 41.03 3i11 h LEU 169 CO 0.00 0.04 -0.83 -0.69 -0.34 0.00 0.00 178.44 176.62 3i11 s VAL 170 N -4.73 2.42 0.02 1.05 1.01 -0.93 -4.85 120.40 114.40 3i11 s VAL 170 Ca -0.05 -0.85 -0.11 0.00 0.00 0.00 0.00 61.98 60.98 3i11 s VAL 170 Cb 0.16 -2.01 -0.05 0.00 0.00 0.00 0.00 36.38 34.47 3i11 s VAL 170 CO 0.61 0.52 0.37 -0.54 0.00 0.00 0.00 175.10 176.06 3i11 s LYS 171 N 0.91 3.77 0.72 2.72 -0.14 -1.26 -3.32 119.74 123.15 3i11 s LYS 171 Ca -0.04 0.22 -0.11 0.00 -1.36 0.00 0.00 55.97 54.68 3i11 s LYS 171 Cb -0.15 -3.11 0.02 0.00 -1.68 0.00 0.00 37.83 32.91 3i11 s LYS 171 CO -0.03 0.64 1.07 -1.54 -0.76 0.00 0.00 175.35 174.74 3i11 s SER 172 N -1.41 5.11 0.30 2.83 1.04 -1.25 -4.68 113.70 115.62 3i11 s SER 172 Ca 0.27 1.59 0.05 0.00 0.48 0.00 0.00 55.95 58.34 3i11 s SER 172 Cb -0.15 -2.42 0.72 0.00 0.10 0.00 0.00 66.02 64.27 3i11 s SER 172 CO 0.15 -1.61 1.76 0.74 0.98 0.00 0.00 173.24 175.25 3i11 h THR 173 N -0.84 0.66 0.00 2.02 2.02 -1.92 -0.31 112.91 114.54 3i11 h THR 173 Ca -0.44 -0.23 -0.03 0.00 0.77 0.00 0.00 66.41 66.48 3i11 h THR 173 Cb 1.22 -0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 67.56 3i11 h THR 173 CO 0.56 0.12 -0.12 0.77 0.37 0.00 0.00 175.52 177.22 3i11 h SER 174 N 0.67 0.00 -2.81 4.18 4.64 -1.95 -3.42 113.55 114.86 3i11 h SER 174 Ca 0.56 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 61.32 3i11 h SER 174 Cb 0.92 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.98 3i11 h SER 174 CO -0.41 0.12 1.01 0.00 -0.87 0.00 0.00 176.83 176.68 3i11 s ALA 175 N -4.37 3.55 -1.78 5.18 0.00 -0.13 -4.89 121.76 119.32 3i11 s ALA 175 Ca -0.03 0.58 0.18 0.00 0.00 0.00 0.00 51.96 52.69 3i11 s ALA 175 Cb 0.14 -3.72 0.40 0.00 0.00 0.00 0.00 23.12 19.94 3i11 s ALA 175 CO 0.61 -1.44 1.32 1.63 0.00 0.00 0.00 175.76 177.88 3i11 n LYS 176 N 7.03 2.42 -3.80 0.00 4.76 -1.26 -4.86 118.16 122.47 3i11 n LYS 176 Ca 0.16 -2.17 -0.10 0.00 -2.87 0.00 0.00 58.31 53.33 3i11 n LYS 176 Cb 0.44 -1.42 0.02 0.00 -1.84 0.00 0.00 35.03 32.23 3i11 n LYS 176 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 3i11 n ASP 177 N 1.15 -2.15 0.04 4.39 5.68 -1.26 -5.06 116.55 119.35 3i11 n ASP 177 Ca 0.17 -2.64 0.13 0.00 -0.50 0.00 0.00 54.79 51.95 3i11 n ASP 177 Cb 0.52 3.62 0.46 0.00 -1.14 0.00 0.00 41.12 44.57 3i11 n ASP 177 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3i11 n LEU 178 N 0.00 0.41 0.00 -2.12 4.77 -1.26 -5.02 117.00 113.78 3i11 n LEU 178 Ca -0.07 0.44 0.00 0.00 -0.03 0.00 0.00 56.01 56.35 3i11 n LEU 178 Cb 0.59 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 3i11 n LEU 178 CO 0.28 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.90 3i11 n GLY 179 N 1.42 0.94 3.59 -0.72 0.00 -1.26 -4.72 105.19 104.44 3i11 n GLY 179 Ca 0.06 -0.79 -0.43 0.00 0.00 0.00 0.00 46.02 44.87 3i11 n GLY 179 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3i11 s ASN 180 N -4.00 6.17 0.00 1.61 2.47 -1.26 -4.87 114.94 115.06 3i11 s ASN 180 Ca 0.00 0.82 0.18 0.00 0.42 0.00 0.00 52.86 54.28 3i11 s ASN 180 Cb 0.00 -2.54 0.51 0.00 -1.45 0.00 0.00 41.25 37.77 3i11 s ASN 180 CO 0.00 -1.57 1.42 1.33 -3.72 0.00 0.00 177.10 174.56 3i11 n VAL 181 N 7.13 0.99 -0.10 -5.21 0.24 -1.26 -4.61 118.33 115.50 3i11 n VAL 181 Ca 0.17 -0.99 0.09 0.00 -2.04 0.00 0.00 64.34 61.58 3i11 n VAL 181 Cb 0.48 0.51 0.45 0.00 -1.47 0.00 0.00 33.84 33.81 3i11 n VAL 181 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3i11 h ALA 182 N 3.40 1.89 -0.34 2.33 0.00 -1.92 -1.89 119.26 122.73 3i11 h ALA 182 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3i11 h ALA 182 Cb 0.89 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3i11 h ALA 182 CO 0.00 -0.01 0.00 -0.25 0.00 0.00 0.00 179.25 178.99 3i11 n ASP 183 N -4.48 3.85 -4.98 0.00 8.00 -1.26 -5.03 116.55 112.66 3i11 n ASP 183 Ca 0.09 -2.71 -0.19 0.00 0.71 0.00 0.00 54.79 52.69 3i11 n ASP 183 Cb 0.30 -0.48 -0.00 0.00 -0.02 0.00 0.00 41.12 40.91 3i11 n ASP 183 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3i11 s ALA 184 N -2.29 4.27 -0.53 2.24 0.00 -0.71 -3.91 121.76 120.83 3i11 s ALA 184 Ca 0.39 -1.54 0.04 0.00 0.00 0.00 0.00 51.96 50.84 3i11 s ALA 184 Cb 0.29 -1.60 0.15 0.00 0.00 0.00 0.00 23.12 21.96 3i11 s ALA 184 CO 0.12 -0.10 0.33 0.71 0.00 0.00 0.00 175.76 176.83 3i11 s TYR 185 N -2.24 2.54 -0.46 0.00 1.51 0.50 -4.99 117.35 114.20 3i11 s TYR 185 Ca 0.47 -2.81 0.26 0.00 -1.01 0.00 0.00 57.07 53.98 3i11 s TYR 185 Cb -0.09 -2.16 0.83 0.00 -0.11 0.00 0.00 41.96 40.44 3i11 s TYR 185 CO 0.31 -0.71 1.76 -0.39 -1.11 0.00 0.00 175.55 175.41 3i11 h VAL 186 N 4.96 0.00 0.39 0.71 -1.51 -1.94 -0.76 116.25 118.09 3i11 h VAL 186 Ca 0.06 -0.55 -0.02 0.00 -1.23 0.00 0.00 66.70 64.96 3i11 h VAL 186 Cb 0.87 1.49 0.00 0.00 -2.13 0.00 0.00 31.29 31.52 3i11 h VAL 186 CO 0.57 0.00 -0.19 -1.13 -1.23 0.00 0.00 177.57 175.59 3i11 h ASN 187 N 0.00 -0.45 0.15 4.19 -1.24 -1.96 -3.36 115.58 112.92 3i11 h ASN 187 Ca 0.00 0.02 0.00 0.00 0.71 0.00 0.00 56.30 57.03 3i11 h ASN 187 Cb 0.68 0.12 0.00 0.00 0.73 0.00 0.00 38.32 39.84 3i11 h ASN 187 CO 0.00 -0.04 0.00 -0.33 -1.29 0.00 0.00 177.43 175.77 3i11 h GLU 188 N -1.10 0.00 -0.78 6.67 5.08 -1.77 -2.98 114.58 119.70 3i11 h GLU 188 Ca -0.05 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 3i11 h GLU 188 Cb 0.40 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.62 3i11 h GLU 188 CO 0.09 0.00 0.34 2.35 -1.00 0.00 0.00 179.01 180.79 3i11 h TRP 189 N 0.00 1.15 -0.45 4.33 2.91 -1.05 -0.84 115.95 121.99 3i11 h TRP 189 Ca 0.00 -0.07 -0.05 0.00 1.13 0.00 0.00 58.89 59.90 3i11 h TRP 189 Cb 0.07 -0.35 -0.02 0.00 -0.51 0.00 0.00 29.16 28.35 3i11 h TRP 189 CO 0.00 0.85 0.09 0.77 -1.03 0.00 0.00 178.44 179.12 3i11 h SER 190 N 1.12 0.70 -0.73 2.65 0.02 -1.74 -0.95 113.55 114.62 3i11 h SER 190 Ca 0.26 -0.25 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 3i11 h SER 190 Cb 0.16 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.48 3i11 h SER 190 CO -0.03 0.77 0.32 0.74 -1.14 0.00 0.00 176.83 177.50 3i11 h THR 191 N 0.61 1.24 -0.40 -2.27 2.02 -1.65 0.05 112.91 112.51 3i11 h THR 191 Ca 0.14 -0.73 -0.01 0.00 0.77 0.00 0.00 66.41 66.58 3i11 h THR 191 Cb 0.36 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 67.07 3i11 h THR 191 CO 0.01 0.30 0.22 0.28 0.37 0.00 0.00 175.52 176.70 3i11 h SER 192 N 1.07 0.50 -0.66 4.18 0.02 -0.82 0.10 113.55 117.94 3i11 h SER 192 Ca 0.25 -0.08 -0.05 0.00 -0.84 0.00 0.00 61.79 61.07 3i11 h SER 192 Cb 0.16 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.55 3i11 h SER 192 CO -0.03 0.44 0.20 0.40 -1.14 0.00 0.00 176.83 176.70 3i11 h ILE 193 N 0.52 1.25 -0.85 3.27 2.04 -0.86 -2.18 117.51 120.70 3i11 h ILE 193 Ca 0.14 -0.87 0.03 0.00 1.00 0.00 0.00 64.86 65.16 3i11 h ILE 193 Cb 0.05 0.57 -0.05 0.00 -0.74 0.00 0.00 36.82 36.65 3i11 h ILE 193 CO -0.02 0.34 0.56 -0.33 0.00 0.00 0.00 178.15 178.69 3i11 h GLU 194 N 0.96 1.03 -1.01 2.37 4.39 -0.62 -1.11 114.58 120.60 3i11 h GLU 194 Ca 0.21 -0.06 0.02 0.00 0.34 0.00 0.00 59.36 59.87 3i11 h GLU 194 Cb 0.30 -0.23 -0.05 0.00 -0.10 0.00 0.00 28.75 28.67 3i11 h GLU 194 CO -0.01 0.68 0.67 -0.91 -1.16 0.00 0.00 179.01 178.28 3i11 h ASN 195 N 1.06 1.14 -0.30 1.42 2.35 -0.24 -0.42 115.58 120.59 3i11 h ASN 195 Ca 0.34 -0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 56.02 3i11 h ASN 195 Cb 0.03 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.11 3i11 h ASN 195 CO -0.10 0.81 0.02 0.58 -1.65 0.00 0.00 177.43 177.08 3i11 h VAL 196 N 1.33 1.25 -0.48 2.81 2.07 -0.78 -2.13 116.25 120.32 3i11 h VAL 196 Ca 0.38 -0.90 -0.02 0.00 0.82 0.00 0.00 66.70 66.98 3i11 h VAL 196 Cb -0.10 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 3i11 h VAL 196 CO -0.10 0.29 0.22 -0.07 0.02 0.00 0.00 177.57 177.93 3i11 h LEU 197 N 0.33 0.61 -0.42 2.57 3.38 -0.79 -0.40 115.31 120.58 3i11 h LEU 197 Ca 0.09 -0.06 -0.18 0.00 0.09 0.00 0.00 57.88 57.82 3i11 h LEU 197 Cb 0.41 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 3i11 h LEU 197 CO 0.01 0.53 -0.66 0.11 0.09 0.00 0.00 178.44 178.52 3i11 h LYS 198 N 0.68 0.51 -0.05 1.13 1.57 -1.03 -3.27 116.57 116.11 3i11 h LYS 198 Ca 0.17 -0.38 -0.24 0.00 -1.87 0.00 0.00 60.65 58.33 3i11 h LYS 198 Cb 0.10 0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.49 3i11 h LYS 198 CO -0.02 1.00 -0.93 -0.09 -0.57 0.00 0.00 179.45 178.84 3i11 h ARG 199 N 0.37 0.68 -3.21 3.15 2.43 -1.02 -3.40 114.38 113.38 3i11 h ARG 199 Ca -0.02 -0.66 -0.63 0.00 -0.81 0.00 0.00 59.98 57.86 3i11 h ARG 199 Cb 1.23 0.17 -0.41 0.00 -0.42 0.00 0.00 29.97 30.54 3i11 h ARG 199 CO 0.12 1.26 -0.65 0.71 -1.51 0.00 0.00 179.97 179.90 3i11 s TYR 200 N -3.47 2.93 -0.68 2.20 2.02 -0.19 -4.95 117.35 115.21 3i11 s TYR 200 Ca -0.09 -3.02 0.25 0.00 -0.37 0.00 0.00 57.07 53.84 3i11 s TYR 200 Cb 0.08 -2.54 0.58 0.00 -0.40 0.00 0.00 41.96 39.68 3i11 s TYR 200 CO 0.91 -0.71 1.56 0.00 -1.57 0.00 0.00 175.55 175.73 3i11 h ARG 201 N 6.30 0.00 -3.45 -0.62 2.47 -1.79 -3.41 114.38 113.87 3i11 h ARG 201 Ca -0.01 0.00 -0.59 0.00 -1.26 0.00 0.00 59.98 58.12 3i11 h ARG 201 Cb 0.87 0.00 -0.40 0.00 -1.65 0.00 0.00 29.97 28.79 3i11 h ARG 201 CO 0.64 0.00 -0.75 1.21 0.56 0.00 0.00 179.97 181.63 3i11 s ASN 202 N -4.47 3.95 -0.18 7.04 3.04 -1.26 -5.11 114.94 117.95 3i11 s ASN 202 Ca 0.08 -1.91 -0.02 0.00 0.04 0.00 0.00 52.86 51.05 3i11 s ASN 202 Cb 0.12 -0.93 -0.01 0.00 -1.54 0.00 0.00 41.25 38.90 3i11 s ASN 202 CO 0.66 -0.38 -0.09 -0.63 -3.04 0.00 0.00 177.10 173.62 3i11 s ILE 203 N 1.27 3.17 -0.03 -5.21 1.01 -1.26 -4.86 121.20 115.29 3i11 s ILE 203 Ca 0.12 -0.59 -0.21 0.00 0.00 0.00 0.00 60.65 59.97 3i11 s ILE 203 Cb -0.19 -2.39 -0.30 0.00 0.01 0.00 0.00 42.46 39.58 3i11 s ILE 203 CO -0.17 0.48 0.95 0.78 0.00 0.00 0.00 174.94 176.97 3i11 h ASN 204 N 7.47 0.52 -4.39 3.58 2.35 -0.96 -3.42 115.58 120.73 3i11 h ASN 204 Ca -0.35 -0.91 -0.18 0.00 -0.55 0.00 0.00 56.30 54.30 3i11 h ASN 204 Cb 1.18 -0.17 -0.24 0.00 0.05 0.00 0.00 38.32 39.14 3i11 h ASN 204 CO 0.59 1.39 -0.63 0.00 -1.65 0.00 0.00 177.43 177.13 3i11 s ALA 205 N -2.60 -0.11 -0.13 -0.83 0.00 -1.18 -4.79 121.76 112.12 3i11 s ALA 205 Ca -0.13 -0.12 0.02 0.00 0.00 0.00 0.00 51.96 51.73 3i11 s ALA 205 Cb 0.02 0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.17 3i11 s ALA 205 CO 0.84 -0.11 -0.19 0.08 0.00 0.00 0.00 175.76 176.38 3i11 s VAL 206 N -0.73 1.83 -0.39 0.00 1.01 0.27 -1.06 120.40 121.34 3i11 s VAL 206 Ca -0.08 -0.84 -0.15 0.00 0.00 0.00 0.00 61.98 60.92 3i11 s VAL 206 Cb -0.05 -1.64 0.01 0.00 0.00 0.00 0.00 36.38 34.70 3i11 s VAL 206 CO 0.00 0.51 0.30 -0.69 0.00 0.00 0.00 175.10 175.22 3i11 s VAL 207 N 0.95 5.25 0.82 2.92 1.01 0.11 -1.31 120.40 130.15 3i11 s VAL 207 Ca -0.05 -0.52 -0.12 0.00 0.00 0.00 0.00 61.98 61.29 3i11 s VAL 207 Cb -0.15 -3.89 0.08 0.00 0.00 0.00 0.00 36.38 32.42 3i11 s VAL 207 CO -0.03 -0.25 1.10 -2.16 0.00 0.00 0.00 175.10 173.76 3i11 s PRO 208 N 1.73 1.93 0.29 2.72 0.04 -1.26 -0.64 135.00 139.81 3i11 s PRO 208 Ca 0.06 0.64 -0.02 0.00 0.04 0.00 0.00 61.00 61.71 3i11 s PRO 208 Cb -0.18 -1.90 0.41 0.00 0.04 0.00 0.00 34.50 32.87 3i11 s PRO 208 CO 0.10 -1.73 1.95 0.78 0.04 0.00 0.00 177.00 178.14 3i11 h GLY 209 N -1.17 1.27 -5.38 0.56 0.00 -0.97 -3.42 103.07 93.95 3i11 h GLY 209 Ca -0.47 -0.45 -0.29 0.00 0.00 0.00 0.00 47.33 46.11 3i11 h GLY 209 CO 0.59 0.42 -0.74 0.30 0.00 0.00 0.00 176.54 177.11 3i11 s HIS 210 N -5.97 0.34 0.00 5.60 3.76 -1.26 -0.85 115.29 116.91 3i11 s HIS 210 Ca -0.12 -0.09 0.00 0.00 -0.15 0.00 0.00 55.06 54.70 3i11 s HIS 210 Cb 0.18 -0.22 0.00 0.00 1.11 0.00 0.00 32.58 33.66 3i11 s HIS 210 CO 0.80 -0.01 0.00 0.41 -0.85 0.00 0.00 174.74 175.09 3i11 n GLY 211 N 2.91 -2.71 3.78 -2.22 0.00 -1.26 -3.97 105.19 101.72 3i11 n GLY 211 Ca -0.13 -2.09 -0.36 0.00 0.00 0.00 0.00 46.02 43.44 3i11 n GLY 211 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i11 s GLU 212 N -0.40 3.92 0.32 1.61 0.41 -1.26 -4.72 118.70 118.57 3i11 s GLU 212 Ca 0.00 1.56 -0.29 0.00 -0.41 0.00 0.00 54.97 55.83 3i11 s GLU 212 Cb 0.00 -2.37 -0.12 0.00 -1.78 0.00 0.00 34.13 29.86 3i11 s GLU 212 CO 0.00 -0.36 1.52 0.28 -0.49 0.00 0.00 175.26 176.21 3i11 n VAL 213 N -0.46 1.37 -0.51 2.63 0.31 -1.26 -4.58 118.33 115.83 3i11 n VAL 213 Ca 0.07 -0.34 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 3i11 n VAL 213 Cb 0.50 -1.88 0.00 0.00 -0.91 0.00 0.00 33.84 31.55 3i11 n VAL 213 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3i11 n GLY 214 N 1.57 5.49 0.00 2.92 0.00 -0.42 -4.99 105.19 109.76 3i11 n GLY 214 Ca 0.07 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.90 3i11 n GLY 214 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3i11 n ASP 215 N 0.00 0.07 0.09 1.61 5.68 -1.26 -0.56 116.55 122.17 3i11 n ASP 215 Ca 0.00 0.00 0.20 0.00 -0.50 0.00 0.00 54.79 54.49 3i11 n ASP 215 Cb 0.00 0.00 0.75 0.00 -1.14 0.00 0.00 41.12 40.73 3i11 n ASP 215 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 3i11 h LYS 216 N 0.00 0.00 -0.78 0.11 3.64 -1.92 -0.50 116.57 117.13 3i11 h LYS 216 Ca 0.00 0.00 0.22 0.00 -1.27 0.00 0.00 60.65 59.60 3i11 h LYS 216 Cb 0.00 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.79 3i11 h LYS 216 CO 0.00 0.00 0.56 0.78 -2.27 0.00 0.00 179.45 178.52 3i11 h GLY 217 N 0.00 0.05 1.77 5.01 0.00 -1.98 -0.18 103.07 107.74 3i11 h GLY 217 Ca 0.20 -0.01 -0.09 0.00 0.00 0.00 0.00 47.33 47.42 3i11 h GLY 217 CO -0.00 0.00 -0.33 1.41 0.00 0.00 0.00 176.54 177.62 3i11 h LEU 218 N 0.03 0.27 -0.37 3.11 3.38 -1.39 0.11 115.31 120.45 3i11 h LEU 218 Ca 0.37 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 58.16 3i11 h LEU 218 Cb 1.45 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.11 3i11 h LEU 218 CO -0.01 0.60 -0.09 -0.07 0.09 0.00 0.00 178.44 178.95 3i11 h LEU 219 N 0.24 0.72 -0.78 1.67 3.38 -1.20 -1.56 115.31 117.77 3i11 h LEU 219 Ca 0.03 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.61 3i11 h LEU 219 Cb 0.71 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 3i11 h LEU 219 CO 0.05 0.92 0.40 -0.07 0.09 0.00 0.00 178.44 179.83 3i11 h LEU 220 N 0.51 1.00 -0.48 1.67 3.38 -1.21 -1.47 115.31 118.71 3i11 h LEU 220 Ca 0.09 -0.12 0.02 0.00 0.09 0.00 0.00 57.88 57.97 3i11 h LEU 220 Cb 0.61 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 3i11 h LEU 220 CO 0.04 0.83 0.28 -0.74 0.09 0.00 0.00 178.44 178.94 3i11 h HIS 221 N 1.09 0.52 -0.38 1.13 2.76 -0.64 -1.92 115.15 117.72 3i11 h HIS 221 Ca 0.27 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.46 3i11 h HIS 221 Cb 0.08 -0.17 -0.02 0.00 1.55 0.00 0.00 27.41 28.85 3i11 h HIS 221 CO 0.01 0.30 0.24 1.15 -1.30 0.00 0.00 177.93 178.33 3i11 h THR 222 N 0.56 1.08 -0.79 6.26 2.02 -0.99 -0.87 112.91 120.18 3i11 h THR 222 Ca 0.19 -0.17 0.13 0.00 0.77 0.00 0.00 66.41 67.34 3i11 h THR 222 Cb 0.03 0.54 -0.09 0.00 -1.74 0.00 0.00 68.15 66.89 3i11 h THR 222 CO -0.09 0.09 0.38 -0.07 0.37 0.00 0.00 175.52 176.20 3i11 h LEU 223 N 0.50 0.44 -0.59 2.58 3.38 -1.04 -2.26 115.31 118.32 3i11 h LEU 223 Ca 0.14 0.09 -0.14 0.00 0.09 0.00 0.00 57.88 58.06 3i11 h LEU 223 Cb -0.04 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 3i11 h LEU 223 CO -0.04 0.20 -0.45 -0.78 0.09 0.00 0.00 178.44 177.46 3i11 h ASP 224 N 0.57 0.65 0.11 -0.43 3.58 -0.61 -2.73 116.42 117.56 3i11 h ASP 224 Ca 0.43 -0.31 -0.01 0.00 0.42 0.00 0.00 57.03 57.56 3i11 h ASP 224 Cb 0.59 -0.18 -0.00 0.00 1.72 0.00 0.00 39.33 41.45 3i11 h ASP 224 CO -0.35 1.01 -0.03 -0.07 -2.88 0.00 0.00 179.24 176.91 3i11 h LEU 225 N 0.49 0.00 -0.12 2.28 3.38 -0.66 -1.95 115.31 118.72 3i11 h LEU 225 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3i11 h LEU 225 Cb 0.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.72 3i11 h LEU 225 CO 0.09 0.03 -0.11 0.18 0.09 0.00 0.00 178.44 178.73 3i11 n LEU 226 N -3.72 0.30 0.00 1.67 4.77 -0.90 -4.81 117.00 114.30 3i11 n LEU 226 Ca -0.03 0.14 0.15 0.00 -0.03 0.00 0.00 56.01 56.24 3i11 n LEU 226 Cb 0.13 -0.26 0.87 0.00 -2.33 0.00 0.00 43.42 41.82 3i11 n LEU 226 CO 0.28 0.06 1.04 0.29 -1.33 0.00 0.00 177.39 177.72