#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i92 n LYS 3 N 0.00 1.10 -3.70 1.64 4.01 -1.26 -4.19 118.16 115.75 3i92 n LYS 3 Ca 0.00 0.43 -0.16 0.00 -0.51 0.00 0.00 58.31 58.07 3i92 n LYS 3 Cb 0.00 -2.50 -0.15 0.00 -0.51 0.00 0.00 35.03 31.86 3i92 n LYS 3 CO 0.00 0.00 0.00 -1.17 -1.11 0.00 0.00 177.40 175.12 3i92 s LEU 4 N -4.13 0.32 -0.20 -0.35 2.96 -1.04 -4.97 118.68 111.27 3i92 s LEU 4 Ca 0.82 0.28 -0.16 0.00 -0.22 0.00 0.00 54.13 54.85 3i92 s LEU 4 Cb -0.38 0.25 -0.04 0.00 0.50 0.00 0.00 46.19 46.52 3i92 s LEU 4 CO 0.41 -0.20 0.42 -0.89 -1.32 0.00 0.00 176.35 174.77 3i92 s THR 5 N 1.78 5.18 -0.03 3.68 2.01 -1.26 -0.96 115.64 126.04 3i92 s THR 5 Ca -0.02 0.76 0.07 0.00 0.31 0.00 0.00 61.69 62.81 3i92 s THR 5 Cb -0.12 -3.75 -0.02 0.00 0.01 0.00 0.00 72.50 68.62 3i92 s THR 5 CO -0.05 0.24 -0.26 -0.63 -0.69 0.00 0.00 174.62 173.23 3i92 s ILE 6 N 1.37 2.07 -0.24 1.82 1.01 -0.05 -1.00 121.20 126.18 3i92 s ILE 6 Ca 0.20 -1.09 -0.08 0.00 0.00 0.00 0.00 60.65 59.68 3i92 s ILE 6 Cb -0.15 -1.72 -0.03 0.00 0.01 0.00 0.00 42.46 40.57 3i92 s ILE 6 CO 0.08 0.58 0.08 -0.83 0.00 0.00 0.00 174.94 174.85 3i92 s GLY 7 N -0.50 1.81 -0.43 6.18 0.00 -1.17 -1.50 107.32 111.72 3i92 s GLY 7 Ca 0.07 -1.03 -0.24 0.00 0.00 0.00 0.00 44.72 43.51 3i92 s GLY 7 CO 0.00 0.43 0.86 -2.27 0.00 0.00 0.00 173.10 172.12 3i92 s LEU 8 N 1.33 4.09 0.08 0.66 2.96 0.84 -1.99 118.68 126.66 3i92 s LEU 8 Ca 0.05 0.17 0.07 0.00 -0.22 0.00 0.00 54.13 54.21 3i92 s LEU 8 Cb -0.15 -3.11 -0.03 0.00 0.50 0.00 0.00 46.19 43.41 3i92 s LEU 8 CO 0.04 -0.92 -0.20 -0.51 -1.32 0.00 0.00 176.35 173.44 3i92 s ILE 9 N 3.46 1.59 0.00 6.68 2.07 -0.42 -1.30 121.20 133.28 3i92 s ILE 9 Ca 0.34 -1.38 0.00 0.00 -1.41 0.00 0.00 60.65 58.20 3i92 s ILE 9 Cb -0.11 -1.43 0.00 0.00 0.13 0.00 0.00 42.46 41.04 3i92 s ILE 9 CO 0.22 0.00 0.00 0.61 -1.91 0.00 0.00 174.94 173.87 3i92 n GLY 10 N 1.38 -0.51 3.77 1.50 0.00 -1.26 -0.91 105.19 109.16 3i92 n GLY 10 Ca -0.19 -0.98 -0.36 0.00 0.00 0.00 0.00 46.02 44.49 3i92 n GLY 10 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3i92 s ASN 11 N 0.00 5.83 0.39 1.61 -0.87 -1.23 -1.82 114.94 118.85 3i92 s ASN 11 Ca 0.00 2.31 -0.26 0.00 -1.57 0.00 0.00 52.86 53.34 3i92 s ASN 11 Cb 0.00 -2.60 -0.11 0.00 -0.02 0.00 0.00 41.25 38.52 3i92 s ASN 11 CO 0.00 -1.15 1.10 -2.65 -2.57 0.00 0.00 177.10 171.83 3i92 n PRO 12 N -0.94 1.58 -2.08 -0.60 -0.02 -1.26 -2.82 135.00 128.85 3i92 n PRO 12 Ca 0.10 0.56 -0.13 0.00 -2.02 0.00 0.00 63.50 62.00 3i92 n PRO 12 Cb 0.49 -2.12 -0.02 0.00 -0.02 0.00 0.00 33.50 31.83 3i92 n PRO 12 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3i92 n ASN 13 N 0.58 -4.23 -0.78 2.55 5.15 -1.26 -4.89 115.26 112.38 3i92 n ASN 13 Ca 0.08 0.05 0.12 0.00 -0.60 0.00 0.00 54.58 54.24 3i92 n ASN 13 Cb 0.38 -3.32 0.29 0.00 -0.53 0.00 0.00 39.78 36.60 3i92 n ASN 13 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 3i92 n SER 14 N -0.47 2.40 0.00 1.20 3.41 -1.13 -4.91 113.62 114.12 3i92 n SER 14 Ca -0.15 -1.80 0.00 0.00 -0.26 0.00 0.00 58.87 56.66 3i92 n SER 14 Cb 0.58 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 3i92 n SER 14 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3i92 n GLY 15 N 1.29 1.05 0.26 5.00 0.00 -1.26 -4.59 105.19 106.93 3i92 n GLY 15 Ca 0.17 -0.28 -0.08 0.00 0.00 0.00 0.00 46.02 45.83 3i92 n GLY 15 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3i92 h LYS 16 N 0.00 0.75 0.01 1.61 3.64 -1.91 -2.80 116.57 117.87 3i92 h LYS 16 Ca 0.00 -0.31 -0.00 0.00 -1.27 0.00 0.00 60.65 59.07 3i92 h LYS 16 Cb 0.08 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 3i92 h LYS 16 CO 0.00 0.92 -0.00 1.15 -2.27 0.00 0.00 179.45 179.24 3i92 h THR 17 N 0.66 1.57 -1.00 1.00 2.02 -1.98 -2.75 112.91 112.43 3i92 h THR 17 Ca 0.09 -1.81 0.32 0.00 0.77 0.00 0.00 66.41 65.78 3i92 h THR 17 Cb 0.74 2.78 -0.18 0.00 -1.74 0.00 0.00 68.15 69.74 3i92 h THR 17 CO 0.06 0.46 0.20 0.74 0.37 0.00 0.00 175.52 177.35 3i92 h THR 18 N -0.80 0.01 -0.28 3.16 2.02 -1.93 0.50 112.91 115.59 3i92 h THR 18 Ca -0.00 -0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.09 3i92 h THR 18 Cb 0.77 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 3i92 h THR 18 CO 0.00 0.00 -0.18 0.25 0.37 0.00 0.00 175.52 175.96 3i92 h LEU 19 N 0.01 0.64 -0.60 2.58 5.85 -1.52 -2.14 115.31 120.13 3i92 h LEU 19 Ca 0.69 -0.43 0.08 0.00 0.84 0.00 0.00 57.88 59.05 3i92 h LEU 19 Cb 1.58 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 42.37 3i92 h LEU 19 CO -0.87 0.94 0.26 0.15 -0.34 0.00 0.00 178.44 178.58 3i92 h PHE 20 N 0.35 0.47 -0.20 1.25 3.57 0.10 -0.40 116.94 122.08 3i92 h PHE 20 Ca 0.06 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 3i92 h PHE 20 Cb 0.72 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.32 3i92 h PHE 20 CO 0.07 0.17 -0.14 -0.91 -2.23 0.00 0.00 178.31 175.27 3i92 h ASN 21 N 0.48 0.32 -0.13 0.41 2.35 -0.41 -1.48 115.58 117.13 3i92 h ASN 21 Ca 0.29 -0.07 -0.15 0.00 -0.55 0.00 0.00 56.30 55.81 3i92 h ASN 21 Cb 0.30 -0.09 0.01 0.00 0.05 0.00 0.00 38.32 38.59 3i92 h ASN 21 CO -0.25 0.49 -0.52 1.56 -1.65 0.00 0.00 177.43 177.06 3i92 h GLN 22 N 0.32 0.57 -0.26 0.81 1.08 -0.62 -0.54 115.11 116.46 3i92 h GLN 22 Ca 0.06 -0.45 -0.19 0.00 -1.45 0.00 0.00 58.65 56.63 3i92 h GLN 22 Cb 0.44 0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.95 3i92 h GLN 22 CO 0.03 1.07 -0.58 -0.07 -0.95 0.00 0.00 178.83 178.33 3i92 h LEU 23 N 0.20 0.92 0.00 1.46 3.38 -1.02 -3.35 115.31 116.90 3i92 h LEU 23 Ca -0.03 -0.51 -0.03 0.00 0.09 0.00 0.00 57.88 57.40 3i92 h LEU 23 Cb 1.15 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 3i92 h LEU 23 CO 0.11 1.30 -1.81 0.35 0.09 0.00 0.00 178.44 178.47 3i92 n THR 24 N -3.99 0.25 0.00 0.22 -2.24 -0.57 -4.68 114.28 103.27 3i92 n THR 24 Ca -0.05 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.20 3i92 n THR 24 Cb 0.64 -0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 3i92 n THR 24 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3i92 n GLY 25 N 1.28 3.50 0.06 3.38 0.00 -0.21 -1.46 105.19 111.74 3i92 n GLY 25 Ca -0.05 -0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.05 3i92 n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3i92 n SER 26 N 4.70 0.66 -3.66 1.61 3.41 -1.26 -4.60 113.62 114.48 3i92 n SER 26 Ca 0.00 0.23 -0.42 0.00 -0.26 0.00 0.00 58.87 58.41 3i92 n SER 26 Cb 0.00 -0.13 -0.03 0.00 -0.26 0.00 0.00 64.21 63.79 3i92 n SER 26 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3i92 n ARG 27 N -2.04 2.12 -3.83 4.33 1.74 -0.53 -4.84 116.66 113.61 3i92 n ARG 27 Ca 0.04 -2.17 -0.09 0.00 -0.77 0.00 0.00 57.85 54.86 3i92 n ARG 27 Cb 0.42 -3.07 -0.06 0.00 -1.02 0.00 0.00 32.46 28.72 3i92 n ARG 27 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 3i92 s GLN 28 N 4.16 1.01 0.04 5.56 -2.07 -1.26 -2.06 119.66 125.04 3i92 s GLN 28 Ca 0.53 -0.96 0.03 0.00 -1.82 0.00 0.00 55.36 53.14 3i92 s GLN 28 Cb 0.14 0.39 -0.02 0.00 -1.09 0.00 0.00 33.01 32.43 3i92 s GLN 28 CO 0.02 -0.36 -0.10 0.50 -1.32 0.00 0.00 175.29 174.03 3i92 s ARG 29 N -3.88 0.63 -0.27 9.60 3.52 0.26 -4.99 118.95 123.83 3i92 s ARG 29 Ca 0.08 -0.73 0.01 0.00 -0.13 0.00 0.00 55.73 54.97 3i92 s ARG 29 Cb 0.03 -0.51 0.07 0.00 -1.56 0.00 0.00 34.95 32.98 3i92 s ARG 29 CO -0.08 0.11 -0.02 0.08 -0.81 0.00 0.00 175.30 174.59 3i92 s VAL 30 N -1.12 1.62 0.00 7.11 1.01 -1.26 -1.78 120.40 125.98 3i92 s VAL 30 Ca -0.05 -1.48 0.00 0.00 0.00 0.00 0.00 61.98 60.45 3i92 s VAL 30 Cb -0.09 -1.97 0.00 0.00 0.00 0.00 0.00 36.38 34.32 3i92 s VAL 30 CO 0.01 -0.26 0.00 0.61 0.00 0.00 0.00 175.10 175.46 3i92 n GLY 31 N 4.60 5.11 3.12 4.51 0.00 -0.94 -4.95 105.19 116.64 3i92 n GLY 31 Ca -0.08 -1.70 -0.08 0.00 0.00 0.00 0.00 46.02 44.17 3i92 n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i92 s ASN 32 N 1.00 0.41 -0.10 1.61 4.22 -1.26 -0.56 114.94 120.25 3i92 s ASN 32 Ca 0.00 -0.96 -0.30 0.00 -2.14 0.00 0.00 52.86 49.46 3i92 s ASN 32 Cb 0.00 0.23 -0.02 0.00 1.28 0.00 0.00 41.25 42.75 3i92 s ASN 32 CO 0.00 -0.63 1.11 0.26 -2.04 0.00 0.00 177.10 175.79 3i92 s TRP 33 N -3.92 3.31 -0.31 1.54 0.52 -0.70 -4.72 118.94 114.66 3i92 s TRP 33 Ca 0.08 1.38 -0.08 0.00 0.02 0.00 0.00 56.10 57.50 3i92 s TRP 33 Cb 0.07 -3.32 -0.07 0.00 -1.15 0.00 0.00 33.47 29.00 3i92 s TRP 33 CO -0.09 -0.81 0.79 0.00 0.02 0.00 0.00 176.95 176.87 3i92 n ALA 34 N 5.37 0.14 0.00 0.98 0.00 -1.26 -0.76 120.51 124.98 3i92 n ALA 34 Ca 0.10 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.43 3i92 n ALA 34 Cb 0.47 -0.70 0.00 0.00 0.00 0.00 0.00 19.45 19.22 3i92 n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i92 n GLY 35 N 1.93 3.08 3.88 0.00 0.00 -1.26 -5.05 105.19 107.77 3i92 n GLY 35 Ca 0.20 -0.89 -0.31 0.00 0.00 0.00 0.00 46.02 45.03 3i92 n GLY 35 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3i92 s VAL 36 N -0.39 4.55 -0.79 1.61 -7.23 0.06 -4.96 120.40 113.25 3i92 s VAL 36 Ca 0.00 0.76 0.22 0.00 -1.81 0.00 0.00 61.98 61.15 3i92 s VAL 36 Cb 0.00 -3.81 0.21 0.00 0.56 0.00 0.00 36.38 33.34 3i92 s VAL 36 CO 0.00 -1.05 1.69 0.35 -0.31 0.00 0.00 175.10 175.78 3i92 n THR 37 N -2.74 0.68 -1.85 5.32 -2.24 -1.26 -4.26 114.28 107.92 3i92 n THR 37 Ca 0.06 0.10 -0.41 0.00 -2.27 0.00 0.00 64.05 61.52 3i92 n THR 37 Cb 0.55 -0.88 -0.02 0.00 -2.10 0.00 0.00 70.33 67.88 3i92 n THR 37 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3i92 s VAL 38 N -3.12 2.26 0.25 2.28 1.01 -1.26 -4.92 120.40 116.90 3i92 s VAL 38 Ca 0.08 0.21 -0.22 0.00 0.00 0.00 0.00 61.98 62.05 3i92 s VAL 38 Cb 0.12 -3.14 -0.09 0.00 0.00 0.00 0.00 36.38 33.27 3i92 s VAL 38 CO 0.42 0.03 0.81 -0.70 0.00 0.00 0.00 175.10 175.66 3i92 s GLU 39 N -0.38 4.39 -0.40 2.72 2.12 -1.26 -1.71 118.70 124.17 3i92 s GLU 39 Ca 0.63 1.05 0.01 0.00 0.36 0.00 0.00 54.97 57.02 3i92 s GLU 39 Cb -0.46 -2.88 0.13 0.00 0.26 0.00 0.00 34.13 31.19 3i92 s GLU 39 CO 0.46 0.37 0.22 0.50 -0.54 0.00 0.00 175.26 176.26 3i92 s ARG 40 N -1.94 1.01 -0.06 4.30 3.52 0.27 -4.74 118.95 121.30 3i92 s ARG 40 Ca 0.45 -1.71 -0.25 0.00 -0.13 0.00 0.00 55.73 54.08 3i92 s ARG 40 Cb -0.18 -1.99 -0.03 0.00 -1.56 0.00 0.00 34.95 31.19 3i92 s ARG 40 CO 0.22 -1.16 0.80 0.15 -0.81 0.00 0.00 175.30 174.50 3i92 s LYS 41 N 0.69 4.45 0.02 5.12 1.02 -1.26 -2.22 119.74 127.55 3i92 s LYS 41 Ca 0.17 1.05 0.07 0.00 0.02 0.00 0.00 55.97 57.28 3i92 s LYS 41 Cb -0.23 -3.47 -0.02 0.00 -0.52 0.00 0.00 37.83 33.58 3i92 s LYS 41 CO -0.02 -0.03 -0.21 -2.00 -0.92 0.00 0.00 175.35 172.18 3i92 s GLU 42 N 1.06 1.51 0.10 1.68 2.12 -0.73 -1.86 118.70 122.57 3i92 s GLU 42 Ca 0.42 -0.85 -0.11 0.00 0.36 0.00 0.00 54.97 54.78 3i92 s GLU 42 Cb -0.18 -1.55 0.01 0.00 0.26 0.00 0.00 34.13 32.67 3i92 s GLU 42 CO 0.20 0.41 0.26 0.20 -0.54 0.00 0.00 175.26 175.79 3i92 s GLY 43 N -0.88 -0.03 0.09 -1.50 0.00 0.23 -0.57 107.32 104.66 3i92 s GLY 43 Ca 0.08 -0.41 0.09 0.00 0.00 0.00 0.00 44.72 44.47 3i92 s GLY 43 CO 0.01 -0.62 -0.22 -0.86 0.00 0.00 0.00 173.10 171.40 3i92 s GLN 44 N -3.77 1.25 0.23 2.90 0.00 -0.87 0.97 119.66 120.37 3i92 s GLN 44 Ca 0.04 -1.16 -0.17 0.00 -0.00 0.00 0.00 55.36 54.07 3i92 s GLN 44 Cb 0.04 -1.53 0.02 0.00 0.00 0.00 0.00 33.01 31.53 3i92 s GLN 44 CO -0.11 0.37 0.57 -0.59 0.00 0.00 0.00 175.29 175.52 3i92 s PHE 45 N -1.06 0.01 0.12 9.60 -0.71 -1.19 -4.70 117.98 120.05 3i92 s PHE 45 Ca 0.08 -0.39 0.06 0.00 -1.04 0.00 0.00 56.93 55.64 3i92 s PHE 45 Cb -0.10 0.42 -0.04 0.00 -1.21 0.00 0.00 43.02 42.09 3i92 s PHE 45 CO 0.04 -1.03 0.01 -1.12 -1.34 0.00 0.00 175.22 171.78 3i92 s SER 46 N -2.93 4.99 0.38 1.98 0.01 -1.26 0.91 113.70 117.78 3i92 s SER 46 Ca 0.14 -0.24 0.04 0.00 1.31 0.00 0.00 55.95 57.19 3i92 s SER 46 Cb -0.02 -1.16 -0.04 0.00 0.21 0.00 0.00 66.02 65.00 3i92 s SER 46 CO 0.04 0.14 0.07 0.42 0.41 0.00 0.00 173.24 174.32 3i92 s THR 47 N -1.47 1.02 0.54 1.44 -4.23 0.63 -4.93 115.64 108.63 3i92 s THR 47 Ca 0.27 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 59.09 3i92 s THR 47 Cb -0.11 -2.57 0.48 0.00 1.34 0.00 0.00 72.50 71.64 3i92 s THR 47 CO 0.19 0.00 1.89 0.74 -0.54 0.00 0.00 174.62 176.90 3i92 h THR 48 N 1.88 0.56 0.00 3.99 2.02 -2.01 -3.16 112.91 116.20 3i92 h THR 48 Ca -0.39 -0.00 -0.17 0.00 0.77 0.00 0.00 66.41 66.62 3i92 h THR 48 Cb 1.26 0.55 -0.03 0.00 -1.74 0.00 0.00 68.15 68.19 3i92 h THR 48 CO 0.66 0.00 -1.63 0.47 0.37 0.00 0.00 175.52 175.39 3i92 n ASP 49 N -4.27 2.87 -4.30 4.18 8.00 -1.26 -5.08 116.55 116.69 3i92 n ASP 49 Ca 0.18 -0.02 -0.16 0.00 0.71 0.00 0.00 54.79 55.50 3i92 n ASP 49 Cb 0.95 0.45 -0.10 0.00 -0.02 0.00 0.00 41.12 42.40 3i92 n ASP 49 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 3i92 s HIS 50 N -2.22 1.46 -0.29 1.24 3.76 -1.19 -4.97 115.29 113.07 3i92 s HIS 50 Ca -0.08 -0.82 -0.14 0.00 -0.15 0.00 0.00 55.06 53.87 3i92 s HIS 50 Cb 0.03 -0.79 -0.03 0.00 1.11 0.00 0.00 32.58 32.90 3i92 s HIS 50 CO 0.34 0.05 0.33 -1.14 -0.85 0.00 0.00 174.74 173.47 3i92 s GLN 51 N -3.79 3.90 0.55 1.40 2.00 -1.26 -0.27 119.66 122.19 3i92 s GLN 51 Ca 0.23 -0.13 -0.05 0.00 -2.00 0.00 0.00 55.36 53.41 3i92 s GLN 51 Cb 0.04 -3.69 -0.00 0.00 0.80 0.00 0.00 33.01 30.16 3i92 s GLN 51 CO 0.05 -0.31 0.84 0.08 -0.50 0.00 0.00 175.29 175.45 3i92 s VAL 52 N 2.00 3.96 -0.24 1.34 1.01 0.26 -2.50 120.40 126.23 3i92 s VAL 52 Ca 0.13 -0.04 -0.03 0.00 0.00 0.00 0.00 61.98 62.04 3i92 s VAL 52 Cb -0.16 -3.54 0.08 0.00 0.00 0.00 0.00 36.38 32.76 3i92 s VAL 52 CO 0.11 -0.52 0.08 -0.89 0.00 0.00 0.00 175.10 173.87 3i92 s THR 53 N -2.87 0.41 0.09 3.92 2.01 -0.14 -3.14 115.64 115.94 3i92 s THR 53 Ca 0.52 -0.76 -0.08 0.00 0.31 0.00 0.00 61.69 61.67 3i92 s THR 53 Cb -0.10 -1.12 -0.06 0.00 0.01 0.00 0.00 72.50 71.23 3i92 s THR 53 CO 0.44 -0.44 0.39 -0.22 -0.69 0.00 0.00 174.62 174.10 3i92 s LEU 54 N 1.88 4.32 -0.17 4.42 2.96 0.27 -0.87 118.68 131.49 3i92 s LEU 54 Ca 0.04 0.73 -0.01 0.00 -0.22 0.00 0.00 54.13 54.67 3i92 s LEU 54 Cb -0.17 -3.06 0.05 0.00 0.50 0.00 0.00 46.19 43.51 3i92 s LEU 54 CO -0.18 0.14 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.27 3i92 s VAL 55 N -1.47 0.92 -1.23 1.68 1.01 -0.56 -0.60 120.40 120.15 3i92 s VAL 55 Ca 0.35 -0.62 -0.20 0.00 0.00 0.00 0.00 61.98 61.51 3i92 s VAL 55 Cb -0.13 -1.21 -0.00 0.00 0.00 0.00 0.00 36.38 35.04 3i92 s VAL 55 CO 0.20 0.01 1.81 -0.62 0.00 0.00 0.00 175.10 176.50 3i92 s ASP 56 N 1.70 6.02 0.79 3.32 -1.08 -0.78 -0.11 116.67 126.53 3i92 s ASP 56 Ca -0.00 -2.03 -0.13 0.00 -0.52 0.00 0.00 52.55 49.87 3i92 s ASP 56 Cb -0.16 -2.58 0.07 0.00 -1.46 0.00 0.00 42.92 38.79 3i92 s ASP 56 CO -0.07 -2.03 1.16 -0.76 0.52 0.00 0.00 175.17 173.98 3i92 s LEU 57 N 7.28 3.13 0.22 -1.34 1.43 -0.42 -4.52 118.68 124.45 3i92 s LEU 57 Ca 0.60 2.18 -0.32 0.00 -1.03 0.00 0.00 54.13 55.56 3i92 s LEU 57 Cb 0.02 -4.57 -0.13 0.00 0.03 0.00 0.00 46.19 41.54 3i92 s LEU 57 CO 0.09 -2.43 1.56 -2.65 0.23 0.00 0.00 176.35 173.15 3i92 n PRO 58 N -3.31 2.32 -1.77 1.29 -0.02 -1.26 -4.84 135.00 127.41 3i92 n PRO 58 Ca 0.12 0.83 -0.37 0.00 -2.02 0.00 0.00 63.50 62.06 3i92 n PRO 58 Cb 0.51 -2.58 0.06 0.00 -0.02 0.00 0.00 33.50 31.47 3i92 n PRO 58 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3i92 s GLY 59 N 0.70 2.81 -0.25 -1.23 0.00 -1.26 -4.75 107.32 103.34 3i92 s GLY 59 Ca 0.72 1.17 -0.26 0.00 0.00 0.00 0.00 44.72 46.35 3i92 s GLY 59 CO 0.42 1.59 0.99 -1.08 0.00 0.00 0.00 173.10 175.02 3i92 s THR 60 N -1.46 0.00 -0.17 0.90 -1.32 -0.76 -4.56 115.64 108.28 3i92 s THR 60 Ca 0.81 0.00 0.16 0.00 -1.21 0.00 0.00 61.69 61.46 3i92 s THR 60 Cb -0.36 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 69.65 3i92 s THR 60 CO 0.39 0.00 1.25 1.88 -2.21 0.00 0.00 174.62 175.93 3i92 h TYR 61 N 3.92 0.00 -3.06 9.09 0.05 -1.96 -3.27 116.97 121.74 3i92 h TYR 61 Ca -0.26 0.00 0.03 0.00 0.05 0.00 0.00 58.73 58.54 3i92 h TYR 61 Cb 1.17 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.87 3i92 h TYR 61 CO 0.32 0.47 0.22 -1.54 -1.05 0.00 0.00 178.16 176.57 3i92 s SER 62 N -6.18 -0.14 0.00 3.88 1.04 -1.26 -3.67 113.70 107.36 3i92 s SER 62 Ca 0.02 -0.81 0.24 0.00 0.48 0.00 0.00 55.95 55.87 3i92 s SER 62 Cb 0.08 0.76 0.21 0.00 0.10 0.00 0.00 66.02 67.17 3i92 s SER 62 CO 0.76 -1.45 1.22 0.18 0.98 0.00 0.00 173.24 174.94 3i92 n LEU 63 N -0.48 1.40 -3.73 2.42 4.77 -1.26 -4.90 117.00 115.21 3i92 n LEU 63 Ca -0.05 -0.49 -0.24 0.00 -0.03 0.00 0.00 56.01 55.20 3i92 n LEU 63 Cb 0.59 -0.06 -0.17 0.00 -2.33 0.00 0.00 43.42 41.45 3i92 n LEU 63 CO 0.19 0.28 -0.37 0.42 -1.33 0.00 0.00 177.39 176.58 3i92 s THR 64 N -2.64 0.28 -0.13 -5.08 -4.23 -1.26 -4.95 115.64 97.63 3i92 s THR 64 Ca 0.17 0.03 -0.27 0.00 -1.18 0.00 0.00 61.69 60.44 3i92 s THR 64 Cb 0.18 -0.56 -0.02 0.00 1.34 0.00 0.00 72.50 73.44 3i92 s THR 64 CO 0.63 0.11 0.88 0.28 -0.54 0.00 0.00 174.62 175.99 3i92 s THR 65 N 2.00 4.86 -1.38 3.99 -1.32 -1.26 -4.90 115.64 117.63 3i92 s THR 65 Ca 0.04 1.77 0.16 0.00 -1.21 0.00 0.00 61.69 62.44 3i92 s THR 65 Cb -0.13 -4.19 -0.02 0.00 -1.51 0.00 0.00 72.50 66.64 3i92 s THR 65 CO -0.06 0.04 0.83 2.30 -2.21 0.00 0.00 174.62 175.52 3i92 n ILE 66 N 4.56 0.00 -3.00 5.08 -5.35 -1.26 -4.13 119.36 115.25 3i92 n ILE 66 Ca 0.05 -0.32 0.00 0.00 -0.27 0.00 0.00 62.75 62.22 3i92 n ILE 66 Cb 0.49 1.17 0.00 0.00 -1.74 0.00 0.00 39.64 39.56 3i92 n ILE 66 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3i92 n SER 67 N -0.24 0.82 -4.25 7.28 3.41 -1.26 -4.94 113.62 114.44 3i92 n SER 67 Ca 0.06 -0.59 -0.37 0.00 -0.26 0.00 0.00 58.87 57.71 3i92 n SER 67 Cb 0.32 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.32 3i92 n SER 67 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3i92 n SER 68 N -1.29 -3.51 -1.89 4.04 2.88 -1.26 -4.80 113.62 107.80 3i92 n SER 68 Ca 0.00 0.48 -0.23 0.00 -1.33 0.00 0.00 58.87 57.79 3i92 n SER 68 Cb 0.00 -0.96 -0.03 0.00 -0.75 0.00 0.00 64.21 62.48 3i92 n SER 68 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 3i92 n GLN 69 N 0.93 0.00 -2.95 -1.46 7.27 -1.26 -4.97 117.38 114.94 3i92 n GLN 69 Ca 0.06 0.00 -0.23 0.00 0.07 0.00 0.00 57.00 56.90 3i92 n GLN 69 Cb 0.51 -0.56 0.01 0.00 2.41 0.00 0.00 30.24 32.61 3i92 n GLN 69 CO 0.00 0.00 0.00 -0.08 0.07 0.00 0.00 177.06 177.05 3i92 s THR 70 N -0.15 3.82 0.64 1.69 -1.32 -1.26 -5.10 115.64 113.96 3i92 s THR 70 Ca 0.34 -0.53 -0.08 0.00 -1.21 0.00 0.00 61.69 60.21 3i92 s THR 70 Cb -0.49 -3.41 0.01 0.00 -1.51 0.00 0.00 72.50 67.11 3i92 s THR 70 CO 0.24 -0.29 0.98 -0.94 -2.21 0.00 0.00 174.62 172.40 3i92 s SER 71 N -4.24 5.48 0.08 8.08 1.04 -1.26 -4.91 113.70 117.97 3i92 s SER 71 Ca 0.49 0.84 -0.36 0.00 0.48 0.00 0.00 55.95 57.41 3i92 s SER 71 Cb -0.10 -1.74 -0.18 0.00 0.10 0.00 0.00 66.02 64.10 3i92 s SER 71 CO 0.38 -1.20 1.57 -0.07 0.98 0.00 0.00 173.24 174.90 3i92 h LEU 72 N -0.37 -1.31 -0.78 2.42 3.38 -1.98 -1.29 115.31 115.38 3i92 h LEU 72 Ca -0.45 0.10 0.08 0.00 0.09 0.00 0.00 57.88 57.69 3i92 h LEU 72 Cb 1.26 0.42 -0.10 0.00 0.09 0.00 0.00 40.66 42.33 3i92 h LEU 72 CO 0.62 -0.68 -0.42 0.47 0.09 0.00 0.00 178.44 178.51 3i92 n ASP 73 N -5.58 -0.75 0.07 -0.43 10.43 -1.26 0.22 116.55 119.25 3i92 n ASP 73 Ca -0.13 1.37 -0.11 0.00 2.57 0.00 0.00 54.79 58.49 3i92 n ASP 73 Cb 0.47 -0.21 -0.05 0.00 1.84 0.00 0.00 41.12 43.18 3i92 n ASP 73 CO 0.00 0.00 0.00 -0.33 -1.07 0.00 0.00 177.20 175.80 3i92 h GLU 74 N 0.00 -0.33 -0.39 -1.24 5.08 -1.75 -1.78 114.58 114.17 3i92 h GLU 74 Ca 0.16 0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.58 3i92 h GLU 74 Cb 0.35 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.63 3i92 h GLU 74 CO -0.74 -0.22 0.14 1.96 -1.00 0.00 0.00 179.01 179.15 3i92 h GLN 75 N -0.34 0.29 0.54 2.33 4.20 0.59 -0.92 115.11 121.80 3i92 h GLN 75 Ca 0.05 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.72 3i92 h GLN 75 Cb 0.40 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.12 3i92 h GLN 75 CO -0.17 0.19 -0.32 0.82 -0.67 0.00 0.00 178.83 178.67 3i92 h ILE 76 N 0.30 0.34 -0.82 2.54 1.08 0.05 0.41 117.51 121.40 3i92 h ILE 76 Ca 0.18 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.70 3i92 h ILE 76 Cb 0.15 0.34 -0.06 0.00 -3.07 0.00 0.00 36.82 34.18 3i92 h ILE 76 CO -0.18 0.00 0.51 0.00 -0.69 0.00 0.00 178.15 177.79 3i92 h ALA 77 N -0.41 1.12 -0.34 1.87 0.00 -1.26 0.84 119.26 121.08 3i92 h ALA 77 Ca -0.06 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3i92 h ALA 77 Cb 0.66 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3i92 h ALA 77 CO 0.07 0.25 0.02 0.00 0.00 0.00 0.00 179.25 179.59 3i92 h HIS 79 N 0.40 1.03 -0.65 0.00 6.17 0.25 -2.75 115.15 119.60 3i92 h HIS 79 Ca 0.10 -0.00 -0.08 0.00 0.71 0.00 0.00 60.37 61.09 3i92 h HIS 79 Cb 0.41 -0.34 -0.02 0.00 2.52 0.00 0.00 27.41 29.98 3i92 h HIS 79 CO 0.03 0.69 0.08 -0.92 0.71 0.00 0.00 177.93 178.52 3i92 h TYR 80 N 1.07 1.17 -0.24 5.26 3.20 -0.63 -2.55 116.97 124.25 3i92 h TYR 80 Ca 0.28 -0.17 0.01 0.00 3.14 0.00 0.00 58.73 61.98 3i92 h TYR 80 Cb -0.03 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 37.91 3i92 h TYR 80 CO 0.00 0.99 0.15 0.82 -1.64 0.00 0.00 178.16 178.48 3i92 h ILE 81 N 1.01 1.04 0.00 1.81 1.08 -1.08 -2.85 117.51 118.52 3i92 h ILE 81 Ca 0.19 -0.10 -0.05 0.00 -0.39 0.00 0.00 64.86 64.51 3i92 h ILE 81 Cb 0.47 0.71 -0.01 0.00 -3.07 0.00 0.00 36.82 34.93 3i92 h ILE 81 CO 0.02 0.05 -0.23 -0.07 -0.69 0.00 0.00 178.15 177.23 3i92 h LEU 82 N 0.30 0.00 -1.31 1.44 3.38 -1.48 -3.21 115.31 114.43 3i92 h LEU 82 Ca 0.09 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 3i92 h LEU 82 Cb -0.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 3i92 h LEU 82 CO -0.03 0.23 -0.13 0.77 0.09 0.00 0.00 178.44 179.37 3i92 h SER 83 N 0.00 0.29 -0.43 -0.43 4.64 -1.20 -3.47 113.55 112.95 3i92 h SER 83 Ca -0.00 -0.06 -0.08 0.00 -0.47 0.00 0.00 61.79 61.17 3i92 h SER 83 Cb 0.78 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.78 3i92 h SER 83 CO 0.03 0.45 -0.09 0.61 -0.87 0.00 0.00 176.83 176.96 3i92 n GLY 84 N -0.81 0.39 0.28 -0.77 0.00 -1.21 -4.94 105.19 98.12 3i92 n GLY 84 Ca -0.00 -0.78 -0.09 0.00 0.00 0.00 0.00 46.02 45.14 3i92 n GLY 84 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3i92 h ASP 85 N 0.00 0.89 -3.56 1.61 3.32 -1.88 -3.43 116.42 113.37 3i92 h ASP 85 Ca -0.09 -0.31 -0.52 0.00 0.02 0.00 0.00 57.03 56.13 3i92 h ASP 85 Cb 0.76 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 40.05 3i92 h ASP 85 CO 0.12 1.05 0.34 0.00 -1.72 0.00 0.00 179.24 179.03 3i92 s ALA 86 N -4.70 3.26 0.15 3.45 0.00 -1.26 -4.74 121.76 117.92 3i92 s ALA 86 Ca -0.10 0.55 0.16 0.00 0.00 0.00 0.00 51.96 52.56 3i92 s ALA 86 Cb 0.13 -3.25 0.47 0.00 0.00 0.00 0.00 23.12 20.47 3i92 s ALA 86 CO 0.85 -0.00 1.64 -0.44 0.00 0.00 0.00 175.76 177.80 3i92 h ASP 87 N 5.50 0.00 -5.11 0.00 3.32 -1.34 -3.47 116.42 115.32 3i92 h ASP 87 Ca -0.43 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.59 3i92 h ASP 87 Cb 1.21 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.65 3i92 h ASP 87 CO 0.71 0.49 -0.03 -1.48 -1.72 0.00 0.00 179.24 177.22 3i92 s LEU 88 N -7.09 0.22 0.12 1.55 2.34 -1.23 -4.61 118.68 109.97 3i92 s LEU 88 Ca 0.00 -0.53 0.07 0.00 0.06 0.00 0.00 54.13 53.73 3i92 s LEU 88 Cb 0.11 1.99 -0.04 0.00 -0.56 0.00 0.00 46.19 47.69 3i92 s LEU 88 CO 0.72 -1.02 -0.07 -0.76 -1.06 0.00 0.00 176.35 174.15 3i92 s LEU 89 N -2.88 3.13 -0.24 1.48 1.43 -0.21 -3.02 118.68 118.36 3i92 s LEU 89 Ca 0.10 -0.37 -0.02 0.00 -1.03 0.00 0.00 54.13 52.81 3i92 s LEU 89 Cb -0.00 -1.89 0.02 0.00 0.03 0.00 0.00 46.19 44.34 3i92 s LEU 89 CO -0.03 0.16 -0.06 -0.63 0.23 0.00 0.00 176.35 176.02 3i92 s ILE 90 N -1.32 2.98 -0.47 -0.59 1.01 -0.84 -1.39 121.20 120.59 3i92 s ILE 90 Ca 0.23 -0.85 -0.16 0.00 0.00 0.00 0.00 60.65 59.86 3i92 s ILE 90 Cb -0.11 -2.45 0.06 0.00 0.01 0.00 0.00 42.46 39.97 3i92 s ILE 90 CO 0.15 0.29 0.44 0.21 0.00 0.00 0.00 174.94 176.03 3i92 s ASN 91 N 1.37 6.16 -0.26 3.58 2.47 -0.62 -1.30 114.94 126.35 3i92 s ASN 91 Ca 0.02 -1.11 -0.28 0.00 0.42 0.00 0.00 52.86 51.91 3i92 s ASN 91 Cb -0.16 -2.21 0.01 0.00 -1.45 0.00 0.00 41.25 37.44 3i92 s ASN 91 CO -0.05 -0.67 1.00 -0.69 -3.72 0.00 0.00 177.10 172.97 3i92 s VAL 92 N 1.92 4.67 -0.10 -5.21 1.01 -0.08 0.13 120.40 122.73 3i92 s VAL 92 Ca 0.07 1.83 0.04 0.00 0.00 0.00 0.00 61.98 63.92 3i92 s VAL 92 Cb -0.22 -4.30 -0.00 0.00 0.00 0.00 0.00 36.38 31.86 3i92 s VAL 92 CO 0.09 -0.25 -0.23 -0.69 0.00 0.00 0.00 175.10 174.03 3i92 s VAL 93 N 3.24 2.18 -0.27 2.92 1.01 -0.58 -4.15 120.40 124.76 3i92 s VAL 93 Ca 0.42 -0.98 -0.29 0.00 0.00 0.00 0.00 61.98 61.13 3i92 s VAL 93 Cb -0.14 -1.84 0.00 0.00 0.00 0.00 0.00 36.38 34.40 3i92 s VAL 93 CO 0.09 0.56 1.20 -0.62 0.00 0.00 0.00 175.10 176.33 3i92 s ASP 94 N 0.32 6.85 0.43 3.32 2.15 -1.26 0.30 116.67 128.79 3i92 s ASP 94 Ca -0.17 1.29 0.16 0.00 0.43 0.00 0.00 52.55 54.26 3i92 s ASP 94 Cb -0.18 -2.54 0.98 0.00 -0.30 0.00 0.00 42.92 40.88 3i92 s ASP 94 CO 0.08 -0.91 1.95 0.00 -0.17 0.00 0.00 175.17 176.12 3i92 h ALA 95 N 8.52 1.51 0.00 3.66 0.00 -0.57 -2.45 119.26 129.94 3i92 h ALA 95 Ca -0.24 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3i92 h ALA 95 Cb 1.08 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3i92 h ALA 95 CO 1.01 0.30 0.00 -1.13 0.00 0.00 0.00 179.25 179.43 3i92 n SER 96 N -4.12 0.55 -2.59 0.00 3.41 -1.26 -3.86 113.62 105.76 3i92 n SER 96 Ca -0.02 0.58 -0.14 0.00 -0.26 0.00 0.00 58.87 59.03 3i92 n SER 96 Cb 0.30 -0.72 0.02 0.00 -0.26 0.00 0.00 64.21 63.56 3i92 n SER 96 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3i92 n ASN 97 N -2.04 2.63 -0.13 4.04 3.02 -0.93 -4.98 115.26 116.87 3i92 n ASN 97 Ca 0.05 -2.95 -0.10 0.00 -0.03 0.00 0.00 54.58 51.55 3i92 n ASN 97 Cb 0.34 -0.49 -0.07 0.00 -0.61 0.00 0.00 39.78 38.95 3i92 n ASN 97 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 3i92 h LEU 98 N 2.75 -1.39 -1.34 3.41 3.38 -1.66 -0.76 115.31 119.70 3i92 h LEU 98 Ca 0.04 0.19 0.18 0.00 0.09 0.00 0.00 57.88 58.37 3i92 h LEU 98 Cb 1.16 0.58 -0.07 0.00 0.09 0.00 0.00 40.66 42.41 3i92 h LEU 98 CO 0.56 -0.27 0.59 -0.08 0.09 0.00 0.00 178.44 179.33 3i92 h GLU 99 N -0.25 0.56 -0.01 1.13 4.81 -1.93 0.34 114.58 119.24 3i92 h GLU 99 Ca 0.06 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 3i92 h GLU 99 Cb 0.41 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.67 3i92 h GLU 99 CO -0.47 0.37 -0.02 -0.09 -0.73 0.00 0.00 179.01 178.07 3i92 h ARG 100 N 0.58 0.03 -0.11 1.92 9.65 -1.83 -3.32 114.38 121.29 3i92 h ARG 100 Ca 0.48 -0.02 -0.11 0.00 -1.10 0.00 0.00 59.98 59.23 3i92 h ARG 100 Cb 0.94 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.51 3i92 h ARG 100 CO -0.22 0.60 -0.41 -0.91 2.80 0.00 0.00 179.97 181.83 3i92 h ASN 101 N -0.55 0.25 -0.00 -3.80 -0.26 0.39 -3.24 115.58 108.38 3i92 h ASN 101 Ca 0.00 -0.11 0.00 0.00 -0.56 0.00 0.00 56.30 55.63 3i92 h ASN 101 Cb 0.60 -0.07 -0.00 0.00 -1.06 0.00 0.00 38.32 37.79 3i92 h ASN 101 CO 0.00 0.64 0.01 -0.07 -1.06 0.00 0.00 177.43 176.95 3i92 h LEU 102 N 0.20 0.00 0.36 1.61 3.38 -0.50 -3.01 115.31 117.36 3i92 h LEU 102 Ca 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3i92 h LEU 102 Cb 0.81 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 3i92 h LEU 102 CO 0.06 0.00 -0.27 0.22 0.09 0.00 0.00 178.44 178.55 3i92 h TYR 103 N 0.00 -0.71 -0.77 1.13 5.03 -1.73 0.15 116.97 120.07 3i92 h TYR 103 Ca 0.00 -0.00 0.08 0.00 2.58 0.00 0.00 58.73 61.39 3i92 h TYR 103 Cb 0.01 0.26 -0.07 0.00 1.55 0.00 0.00 36.73 38.49 3i92 h TYR 103 CO 0.00 -0.40 0.43 1.25 -1.32 0.00 0.00 178.16 178.12 3i92 h LEU 104 N -0.63 0.63 -0.77 2.82 5.85 -1.60 -2.42 115.31 119.19 3i92 h LEU 104 Ca -0.03 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.75 3i92 h LEU 104 Cb 0.54 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 3i92 h LEU 104 CO 0.00 0.37 0.50 0.74 -0.34 0.00 0.00 178.44 179.72 3i92 h THR 105 N 0.75 1.17 -0.56 1.05 2.02 -1.47 -2.31 112.91 113.56 3i92 h THR 105 Ca 0.36 -0.35 -0.05 0.00 0.77 0.00 0.00 66.41 67.14 3i92 h THR 105 Cb 0.30 0.07 -0.03 0.00 -1.74 0.00 0.00 68.15 66.75 3i92 h THR 105 CO -0.23 0.18 0.13 0.25 0.37 0.00 0.00 175.52 176.23 3i92 h LEU 106 N 1.01 0.81 -1.00 2.58 6.46 -0.25 -2.47 115.31 122.45 3i92 h LEU 106 Ca 0.29 -0.15 -0.07 0.00 -0.12 0.00 0.00 57.88 57.83 3i92 h LEU 106 Cb -0.07 -0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 39.63 3i92 h LEU 106 CO -0.08 0.80 -0.05 1.56 -0.62 0.00 0.00 178.44 180.05 3i92 h GLN 107 N 0.84 0.66 -0.09 1.25 4.20 -1.07 0.51 115.11 121.40 3i92 h GLN 107 Ca 0.18 -0.18 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 3i92 h GLN 107 Cb 0.31 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 3i92 h GLN 107 CO -0.00 0.72 -0.25 -0.07 -0.67 0.00 0.00 178.83 178.55 3i92 h LEU 108 N 0.62 0.16 0.19 1.46 3.38 -1.10 -2.48 115.31 117.54 3i92 h LEU 108 Ca 0.12 -0.05 -0.32 0.00 0.09 0.00 0.00 57.88 57.73 3i92 h LEU 108 Cb 0.46 -0.04 0.02 0.00 0.09 0.00 0.00 40.66 41.19 3i92 h LEU 108 CO 0.02 0.42 -1.48 -0.07 0.09 0.00 0.00 178.44 177.43 3i92 h LEU 109 N 0.15 0.62 -1.14 1.67 3.38 -0.86 -2.56 115.31 116.58 3i92 h LEU 109 Ca 0.02 -0.73 -0.06 0.00 0.09 0.00 0.00 57.88 57.20 3i92 h LEU 109 Cb 0.54 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 3i92 h LEU 109 CO 0.04 1.58 -0.05 -0.33 0.09 0.00 0.00 178.44 179.78 3i92 h GLU 110 N 0.11 0.55 -0.09 1.13 5.08 -0.95 -2.01 114.58 118.40 3i92 h GLU 110 Ca -0.24 -0.14 -0.08 0.00 -1.00 0.00 0.00 59.36 57.90 3i92 h GLU 110 Cb 2.08 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 31.25 3i92 h GLU 110 CO 0.22 0.61 -0.33 -0.07 -1.00 0.00 0.00 179.01 178.44 3i92 h LEU 111 N 0.52 0.17 -0.29 1.33 -0.00 -1.49 -3.42 115.31 112.13 3i92 h LEU 111 Ca 0.11 -0.06 0.00 0.00 -0.00 0.00 0.00 57.88 57.93 3i92 h LEU 111 Cb 0.40 -0.05 0.00 0.00 -0.00 0.00 0.00 40.66 41.02 3i92 h LEU 111 CO 0.02 0.49 0.00 0.61 -0.00 0.00 0.00 178.44 179.56 3i92 n GLY 112 N -0.45 0.79 3.74 0.83 0.00 -0.76 -3.95 105.19 105.40 3i92 n GLY 112 Ca -0.01 -0.66 -0.39 0.00 0.00 0.00 0.00 46.02 44.96 3i92 n GLY 112 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3i92 s ILE 113 N -2.29 4.95 0.09 -0.61 1.01 -1.09 -4.83 121.20 118.43 3i92 s ILE 113 Ca 0.00 1.36 -0.31 0.00 0.00 0.00 0.00 60.65 61.70 3i92 s ILE 113 Cb 0.00 -3.99 -0.09 0.00 0.01 0.00 0.00 42.46 38.39 3i92 s ILE 113 CO 0.00 0.34 1.70 -2.84 0.00 0.00 0.00 174.94 174.15 3i92 s PRO 114 N 0.24 4.18 0.17 2.79 0.02 -1.26 -4.81 135.00 136.32 3i92 s PRO 114 Ca 0.34 2.42 -0.08 0.00 0.02 0.00 0.00 61.00 63.70 3i92 s PRO 114 Cb -0.18 -3.57 -0.01 0.00 0.02 0.00 0.00 34.50 30.76 3i92 s PRO 114 CO 0.18 -0.76 0.25 0.00 -0.33 0.00 0.00 177.00 176.34 3i92 s ILE 116 N -3.99 1.15 -0.04 0.00 1.01 -0.48 -4.24 121.20 114.60 3i92 s ILE 116 Ca 0.20 -0.71 -0.30 0.00 0.00 0.00 0.00 60.65 59.84 3i92 s ILE 116 Cb 0.04 -1.35 -0.05 0.00 0.01 0.00 0.00 42.46 41.12 3i92 s ILE 116 CO 0.01 0.09 1.39 -0.69 0.00 0.00 0.00 174.94 175.74 3i92 s VAL 117 N 1.61 3.86 -0.55 2.92 1.01 -0.49 -1.58 120.40 127.17 3i92 s VAL 117 Ca -0.00 1.18 -0.10 0.00 0.00 0.00 0.00 61.98 63.05 3i92 s VAL 117 Cb -0.16 -3.76 0.14 0.00 0.00 0.00 0.00 36.38 32.60 3i92 s VAL 117 CO -0.08 -0.03 0.44 0.00 0.00 0.00 0.00 175.10 175.43 3i92 s ALA 118 N 2.78 3.55 -0.77 5.51 0.00 0.12 -0.88 121.76 132.08 3i92 s ALA 118 Ca 0.63 -2.72 -0.26 0.00 0.00 0.00 0.00 51.96 49.61 3i92 s ALA 118 Cb -0.29 -2.99 0.02 0.00 0.00 0.00 0.00 23.12 19.86 3i92 s ALA 118 CO 0.24 -2.00 1.49 -1.17 0.00 0.00 0.00 175.76 174.32 3i92 s LEU 119 N 1.10 3.24 0.27 0.00 2.96 -0.76 -1.53 118.68 123.96 3i92 s LEU 119 Ca 0.08 -0.45 -0.02 0.00 -0.22 0.00 0.00 54.13 53.52 3i92 s LEU 119 Cb -0.24 -2.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.85 3i92 s LEU 119 CO -0.01 -1.97 0.50 0.21 -1.32 0.00 0.00 176.35 173.75 3i92 s ASN 120 N 5.23 6.39 -0.79 3.68 2.47 0.15 -0.20 114.94 131.86 3i92 s ASN 120 Ca 0.46 0.55 -0.02 0.00 0.42 0.00 0.00 52.86 54.28 3i92 s ASN 120 Cb -0.08 -2.07 0.00 0.00 -1.45 0.00 0.00 41.25 37.65 3i92 s ASN 120 CO 0.11 -0.17 0.67 0.23 -3.72 0.00 0.00 177.10 174.23 3i92 n MET 121 N -1.02 -4.48 0.13 0.43 2.81 -1.12 0.04 117.12 113.90 3i92 n MET 121 Ca -0.03 0.53 -0.01 0.00 -1.81 0.00 0.00 57.70 56.37 3i92 n MET 121 Cb 0.54 -4.63 0.16 0.00 -0.71 0.00 0.00 33.22 28.58 3i92 n MET 121 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 3i92 h LEU 122 N -1.38 0.00 -0.81 4.03 3.38 -1.78 -1.99 115.31 116.76 3i92 h LEU 122 Ca -0.37 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.57 3i92 h LEU 122 Cb 1.22 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.93 3i92 h LEU 122 CO 0.33 0.63 0.39 -2.24 0.09 0.00 0.00 178.44 177.64 3i92 h ASP 123 N 0.00 1.07 -0.49 -0.43 2.03 -1.92 1.04 116.42 117.72 3i92 h ASP 123 Ca -0.01 -0.14 -0.05 0.00 -0.73 0.00 0.00 57.03 56.11 3i92 h ASP 123 Cb 1.13 -0.27 -0.02 0.00 -0.83 0.00 0.00 39.33 39.33 3i92 h ASP 123 CO 0.08 0.90 0.12 0.40 -1.03 0.00 0.00 179.24 179.72 3i92 h ILE 124 N 1.15 1.24 -0.83 4.15 2.04 -1.93 0.13 117.51 123.46 3i92 h ILE 124 Ca 0.28 -0.84 0.04 0.00 1.00 0.00 0.00 64.86 65.34 3i92 h ILE 124 Cb 0.12 0.85 -0.05 0.00 -0.74 0.00 0.00 36.82 37.00 3i92 h ILE 124 CO -0.03 0.30 0.53 0.00 0.00 0.00 0.00 178.15 178.95 3i92 h ALA 125 N 0.99 1.11 0.08 1.87 0.00 -0.72 0.46 119.26 123.04 3i92 h ALA 125 Ca 0.15 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 3i92 h ALA 125 Cb 0.33 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3i92 h ALA 125 CO 0.00 0.33 -0.04 1.49 0.00 0.00 0.00 179.25 181.03 3i92 h GLU 126 N 1.01 -0.11 -0.97 0.00 4.81 0.14 0.29 114.58 119.75 3i92 h GLU 126 Ca 0.34 0.01 0.18 0.00 -0.13 0.00 0.00 59.36 59.76 3i92 h GLU 126 Cb 0.06 0.02 -0.10 0.00 0.63 0.00 0.00 28.75 29.36 3i92 h GLU 126 CO -0.13 0.18 0.57 0.87 -0.73 0.00 0.00 179.01 179.76 3i92 h LYS 127 N -0.39 0.71 -0.01 1.92 1.79 -0.79 0.18 116.57 119.98 3i92 h LYS 127 Ca -0.01 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.42 3i92 h LYS 127 Cb 0.34 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 30.82 3i92 h LYS 127 CO 0.02 0.47 0.00 0.94 -1.08 0.00 0.00 179.45 179.80 3i92 n GLN 128 N -4.79 1.03 -3.18 3.15 -0.06 0.13 -4.88 117.38 108.78 3i92 n GLN 128 Ca 0.22 -0.04 -0.21 0.00 -2.00 0.00 0.00 57.00 54.97 3i92 n GLN 128 Cb 0.54 -1.30 0.05 0.00 -4.06 0.00 0.00 30.24 25.47 3i92 n GLN 128 CO 0.00 0.00 0.00 -1.71 -0.20 0.00 0.00 177.06 175.15 3i92 n ASN 129 N -0.76 -5.78 -4.36 1.69 2.85 0.63 -5.00 115.26 104.52 3i92 n ASN 129 Ca 0.14 -0.36 -0.33 0.00 -0.11 0.00 0.00 54.58 53.93 3i92 n ASN 129 Cb 0.08 -4.52 -0.14 0.00 1.24 0.00 0.00 39.78 36.43 3i92 n ASN 129 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 3i92 s ILE 130 N -3.19 2.98 0.08 -1.44 1.01 0.97 -5.00 121.20 116.61 3i92 s ILE 130 Ca 0.38 -0.69 0.09 0.00 0.00 0.00 0.00 60.65 60.43 3i92 s ILE 130 Cb -0.17 -2.24 -0.04 0.00 0.01 0.00 0.00 42.46 40.03 3i92 s ILE 130 CO 0.48 0.53 -0.22 0.00 0.00 0.00 0.00 174.94 175.73 3i92 s ARG 131 N 0.30 1.79 -0.12 2.79 1.70 -1.26 -3.79 118.95 120.36 3i92 s ARG 131 Ca -0.11 -1.15 0.03 0.00 -0.47 0.00 0.00 55.73 54.04 3i92 s ARG 131 Cb -0.16 -2.06 0.00 0.00 -0.57 0.00 0.00 34.95 32.16 3i92 s ARG 131 CO 0.06 0.50 -0.23 0.42 -1.08 0.00 0.00 175.30 174.96 3i92 s ILE 132 N -0.99 2.06 -1.06 4.99 1.09 -1.26 -2.88 121.20 123.15 3i92 s ILE 132 Ca 0.15 -1.00 -0.23 0.00 -1.10 0.00 0.00 60.65 58.47 3i92 s ILE 132 Cb -0.10 -1.80 -0.02 0.00 -1.06 0.00 0.00 42.46 39.48 3i92 s ILE 132 CO 0.06 0.56 1.80 -1.61 -0.10 0.00 0.00 174.94 175.64 3i92 s GLU 133 N 0.53 2.99 0.18 2.79 0.41 -0.76 -4.83 118.70 120.01 3i92 s GLU 133 Ca -0.14 -0.94 -0.13 0.00 -0.41 0.00 0.00 54.97 53.35 3i92 s GLU 133 Cb -0.17 -5.24 0.16 0.00 -1.78 0.00 0.00 34.13 27.10 3i92 s GLU 133 CO 0.05 -3.09 1.76 0.82 -0.49 0.00 0.00 175.26 174.31 3i92 h ILE 134 N 6.65 0.88 -0.40 -1.63 2.04 -1.97 0.19 117.51 123.27 3i92 h ILE 134 Ca 0.20 -0.14 -0.08 0.00 1.00 0.00 0.00 64.86 65.84 3i92 h ILE 134 Cb 0.97 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 3i92 h ILE 134 CO 1.30 0.07 -0.07 -0.78 0.00 0.00 0.00 178.15 178.68 3i92 h ASP 135 N 0.41 0.66 -0.19 1.72 3.58 -1.92 0.35 116.42 121.02 3i92 h ASP 135 Ca 0.23 -0.17 -0.10 0.00 0.42 0.00 0.00 57.03 57.41 3i92 h ASP 135 Cb 0.21 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.07 3i92 h ASP 135 CO -0.21 0.77 -0.22 0.00 -2.88 0.00 0.00 179.24 176.70 3i92 h ALA 136 N 1.30 0.98 -0.11 -0.78 0.00 -1.59 -1.49 119.26 117.56 3i92 h ALA 136 Ca 0.12 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 3i92 h ALA 136 Cb 0.50 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 3i92 h ALA 136 CO 0.03 0.60 -0.07 1.25 0.00 0.00 0.00 179.25 181.06 3i92 h LEU 137 N 0.57 0.26 -0.91 0.00 6.46 -0.14 -2.85 115.31 118.70 3i92 h LEU 137 Ca 0.08 -0.43 0.15 0.00 -0.12 0.00 0.00 57.88 57.56 3i92 h LEU 137 Cb 0.69 -0.07 -0.09 0.00 -0.73 0.00 0.00 40.66 40.46 3i92 h LEU 137 CO 0.05 0.63 0.51 -1.28 -0.62 0.00 0.00 178.44 177.73 3i92 h SER 138 N -0.12 0.67 -0.47 1.25 0.87 -0.89 -2.10 113.55 112.76 3i92 h SER 138 Ca 0.02 0.08 -0.04 0.00 -1.23 0.00 0.00 61.79 60.63 3i92 h SER 138 Cb 0.54 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.44 3i92 h SER 138 CO 0.02 0.29 0.14 0.00 -0.53 0.00 0.00 176.83 176.75 3i92 h ALA 139 N 1.57 0.61 -0.23 6.23 0.00 -1.15 0.90 119.26 127.19 3i92 h ALA 139 Ca 0.49 -0.19 -0.18 0.00 0.00 0.00 0.00 54.91 55.04 3i92 h ALA 139 Cb 0.65 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3i92 h ALA 139 CO -0.34 0.28 -0.54 0.00 0.00 0.00 0.00 179.25 178.65 3i92 h ARG 140 N 0.62 0.77 -0.09 0.00 2.47 -1.28 -3.27 114.38 113.60 3i92 h ARG 140 Ca 0.15 -0.52 -0.18 0.00 -1.26 0.00 0.00 59.98 58.17 3i92 h ARG 140 Cb 0.29 0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 28.67 3i92 h ARG 140 CO -0.00 1.15 -0.68 -0.07 0.56 0.00 0.00 179.97 180.92 3i92 h LEU 141 N 0.51 0.48 0.00 3.04 3.38 -1.35 -3.45 115.31 117.91 3i92 h LEU 141 Ca -0.00 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.67 3i92 h LEU 141 Cb 1.15 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.76 3i92 h LEU 141 CO 0.12 1.02 0.00 0.61 0.09 0.00 0.00 178.44 180.28 3i92 n GLY 142 N 0.47 0.62 3.54 0.83 0.00 0.30 -4.78 105.19 106.17 3i92 n GLY 142 Ca -0.04 -0.77 -0.10 0.00 0.00 0.00 0.00 46.02 45.11 3i92 n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i92 s PRO 144 N -3.94 2.82 -0.22 0.00 0.02 -1.26 -4.46 135.00 127.96 3i92 s PRO 144 Ca 0.25 1.87 -0.01 0.00 0.02 0.00 0.00 61.00 63.13 3i92 s PRO 144 Cb 0.00 -1.90 0.06 0.00 0.02 0.00 0.00 34.50 32.68 3i92 s PRO 144 CO 0.10 -1.34 0.00 0.08 -0.33 0.00 0.00 177.00 175.51 3i92 s VAL 145 N -1.58 0.98 -0.31 3.83 1.01 -1.26 -1.40 120.40 121.68 3i92 s VAL 145 Ca 0.78 -0.91 -0.10 0.00 0.00 0.00 0.00 61.98 61.76 3i92 s VAL 145 Cb -0.32 -1.41 -0.01 0.00 0.00 0.00 0.00 36.38 34.65 3i92 s VAL 145 CO 0.35 -0.20 0.16 -0.63 0.00 0.00 0.00 175.10 174.78 3i92 s ILE 146 N 1.64 4.63 0.27 2.22 -1.09 -0.05 -4.95 121.20 123.87 3i92 s ILE 146 Ca -0.02 -0.42 -0.30 0.00 -2.23 0.00 0.00 60.65 57.69 3i92 s ILE 146 Cb -0.18 -3.37 -0.10 0.00 -1.58 0.00 0.00 42.46 37.24 3i92 s ILE 146 CO -0.08 0.06 1.35 -2.16 -1.23 0.00 0.00 174.94 172.88 3i92 s PRO 147 N 1.62 4.34 0.03 2.79 0.04 -1.26 -1.84 135.00 140.72 3i92 s PRO 147 Ca 0.05 2.20 0.02 0.00 0.04 0.00 0.00 61.00 63.30 3i92 s PRO 147 Cb -0.17 -3.12 -0.02 0.00 0.04 0.00 0.00 34.50 31.23 3i92 s PRO 147 CO 0.06 -0.28 -0.06 -0.51 0.04 0.00 0.00 177.00 176.25 3i92 s LEU 148 N -0.87 2.24 -0.54 -3.56 1.02 0.72 -4.25 118.68 113.43 3i92 s LEU 148 Ca 0.54 -0.51 0.04 0.00 0.02 0.00 0.00 54.13 54.23 3i92 s LEU 148 Cb -0.40 -0.11 0.17 0.00 0.02 0.00 0.00 46.19 45.87 3i92 s LEU 148 CO 0.46 -0.21 0.40 -0.69 0.02 0.00 0.00 176.35 176.32 3i92 s VAL 149 N -1.31 1.57 0.64 -1.59 1.01 -0.99 -2.80 120.40 116.91 3i92 s VAL 149 Ca -0.11 -3.35 0.35 0.00 0.00 0.00 0.00 61.98 58.87 3i92 s VAL 149 Cb -0.09 -2.05 0.38 0.00 0.00 0.00 0.00 36.38 34.62 3i92 s VAL 149 CO 0.00 -1.10 2.18 0.28 0.00 0.00 0.00 175.10 176.46 3i92 h SER 150 N 5.65 0.00 0.42 3.32 0.02 -1.93 0.67 113.55 121.69 3i92 h SER 150 Ca 0.19 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.12 3i92 h SER 150 Cb 0.84 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.39 3i92 h SER 150 CO 0.53 0.00 -0.20 0.71 -1.14 0.00 0.00 176.83 176.73 3i92 h THR 151 N 0.00 0.22 0.00 -2.27 1.35 -1.94 -3.31 112.91 106.95 3i92 h THR 151 Ca 0.03 -0.62 0.00 0.00 -0.55 0.00 0.00 66.41 65.26 3i92 h THR 151 Cb 0.30 0.34 0.00 0.00 -1.73 0.00 0.00 68.15 67.06 3i92 h THR 151 CO -0.00 0.05 0.00 0.03 -0.25 0.00 0.00 175.52 175.35 3i92 h ARG 152 N -1.08 0.00 0.00 4.72 2.47 -1.35 -3.46 114.38 115.68 3i92 h ARG 152 Ca -0.06 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.66 3i92 h ARG 152 Cb 0.51 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.83 3i92 h ARG 152 CO 0.09 0.00 0.00 0.41 0.56 0.00 0.00 179.97 181.03 3i92 n GLY 153 N -0.81 0.61 3.70 0.04 0.00 -0.62 -5.03 105.19 103.08 3i92 n GLY 153 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 3i92 n GLY 153 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3i92 s ARG 154 N -0.22 4.30 0.00 1.61 3.00 -1.19 -3.18 118.95 123.28 3i92 s ARG 154 Ca 0.00 1.97 0.00 0.00 0.00 0.00 0.00 55.73 57.70 3i92 s ARG 154 Cb 0.00 -3.49 0.00 0.00 0.00 0.00 0.00 34.95 31.46 3i92 s ARG 154 CO 0.00 -0.52 0.00 0.41 0.00 0.00 0.00 175.30 175.19 3i92 n GLY 155 N 3.58 1.09 0.29 -3.53 0.00 -1.26 -2.35 105.19 103.01 3i92 n GLY 155 Ca 0.12 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.04 3i92 n GLY 155 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3i92 h ILE 156 N 0.00 0.38 -0.22 -0.61 1.08 -1.85 0.18 117.51 116.47 3i92 h ILE 156 Ca 0.00 0.00 -0.07 0.00 -0.39 0.00 0.00 64.86 64.40 3i92 h ILE 156 Cb 0.00 0.38 -0.01 0.00 -3.07 0.00 0.00 36.82 34.12 3i92 h ILE 156 CO 0.00 0.00 -0.18 -0.33 -0.69 0.00 0.00 178.15 176.95 3i92 h GLU 157 N -0.35 0.37 -0.32 2.37 4.39 -1.91 -0.50 114.58 118.63 3i92 h GLU 157 Ca 0.09 -0.11 -0.07 0.00 0.34 0.00 0.00 59.36 59.61 3i92 h GLU 157 Cb 0.49 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.08 3i92 h GLU 157 CO -0.30 0.54 -0.12 0.00 -1.16 0.00 0.00 179.01 177.97 3i92 h ALA 158 N 1.48 1.21 -0.12 3.43 0.00 -1.80 -1.37 119.26 122.08 3i92 h ALA 158 Ca 0.06 -0.28 -0.22 0.00 0.00 0.00 0.00 54.91 54.48 3i92 h ALA 158 Cb 0.51 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.17 3i92 h ALA 158 CO 0.03 0.51 -0.80 1.25 0.00 0.00 0.00 179.25 180.25 3i92 h LEU 159 N 0.50 0.85 -1.35 0.00 5.85 -0.10 -2.75 115.31 118.30 3i92 h LEU 159 Ca 0.09 -0.57 0.04 0.00 0.84 0.00 0.00 57.88 58.28 3i92 h LEU 159 Cb 0.50 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.24 3i92 h LEU 159 CO 0.03 1.36 0.47 0.11 -0.34 0.00 0.00 178.44 180.07 3i92 h LYS 160 N 0.48 0.81 -0.75 1.25 1.57 -0.93 -1.81 116.57 117.19 3i92 h LYS 160 Ca -0.06 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.67 3i92 h LYS 160 Cb 1.42 -0.18 -0.04 0.00 0.08 0.00 0.00 32.23 33.51 3i92 h LYS 160 CO 0.16 0.54 0.46 1.25 -0.57 0.00 0.00 179.45 181.28 3i92 h LEU 161 N 0.84 0.90 -1.10 2.94 6.46 -1.12 -2.97 115.31 121.25 3i92 h LEU 161 Ca 0.29 -0.06 -0.09 0.00 -0.12 0.00 0.00 57.88 57.90 3i92 h LEU 161 Cb 0.09 -0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 39.78 3i92 h LEU 161 CO -0.08 0.70 -0.32 0.00 -0.62 0.00 0.00 178.44 178.11 3i92 h ALA 162 N 1.24 1.25 -0.32 1.25 0.00 -1.05 -2.76 119.26 118.87 3i92 h ALA 162 Ca 0.27 -0.34 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 3i92 h ALA 162 Cb -0.04 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3i92 h ALA 162 CO -0.05 0.51 -0.31 0.82 0.00 0.00 0.00 179.25 180.22 3i92 h ILE 163 N 0.20 1.28 0.00 0.00 2.04 -1.30 -0.18 117.51 119.55 3i92 h ILE 163 Ca 0.03 -1.44 0.00 0.00 1.00 0.00 0.00 64.86 64.44 3i92 h ILE 163 Cb 0.67 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 38.12 3i92 h ILE 163 CO 0.05 0.47 0.00 0.44 0.00 0.00 0.00 178.15 179.11 3i92 h ASP 164 N 0.58 0.00 -0.21 1.72 3.45 -1.36 -2.82 116.42 117.78 3i92 h ASP 164 Ca 0.07 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.53 3i92 h ASP 164 Cb 0.82 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.59 3i92 h ASP 164 CO 0.07 0.00 0.00 0.54 -1.57 0.00 0.00 179.24 178.28 3i92 n ARG 165 N -2.66 1.95 -1.68 3.56 1.74 -1.01 -5.02 116.66 113.53 3i92 n ARG 165 Ca 0.02 -1.68 -0.39 0.00 -0.77 0.00 0.00 57.85 55.03 3i92 n ARG 165 Cb 0.30 -1.23 0.04 0.00 -1.02 0.00 0.00 32.46 30.54 3i92 n ARG 165 CO 0.00 0.00 0.00 2.48 -1.52 0.00 0.00 177.63 178.59 3i92 n TYR 166 N 0.50 1.72 -3.84 -1.55 4.11 -0.11 -5.00 117.16 112.98 3i92 n TYR 166 Ca 0.09 0.46 -0.09 0.00 -0.00 0.00 0.00 57.90 58.36 3i92 n TYR 166 Cb 0.36 -2.29 0.01 0.00 -0.00 0.00 0.00 39.34 37.42 3i92 n TYR 166 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 176.86 175.27 3i92 s LYS 167 N -2.61 2.15 0.26 -3.48 -2.85 -1.26 -5.07 119.74 106.88 3i92 s LYS 167 Ca 0.70 -1.42 -0.30 0.00 -1.00 0.00 0.00 55.97 53.95 3i92 s LYS 167 Cb -0.45 0.60 -0.13 0.00 -2.06 0.00 0.00 37.83 35.79 3i92 s LYS 167 CO 0.51 -0.99 1.29 0.00 0.10 0.00 0.00 175.35 176.26 3i92 n ALA 168 N -0.52 0.73 -1.70 0.59 0.00 -1.26 -4.67 120.51 113.67 3i92 n ALA 168 Ca -0.07 0.40 -0.42 0.00 0.00 0.00 0.00 53.44 53.35 3i92 n ALA 168 Cb 0.60 -2.20 -0.00 0.00 0.00 0.00 0.00 19.45 17.85 3i92 n ALA 168 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3i92 n ASN 169 N 1.65 2.79 -4.66 0.00 3.02 -1.26 -4.89 115.26 111.90 3i92 n ASN 169 Ca 0.10 1.19 -0.42 0.00 -0.03 0.00 0.00 54.58 55.42 3i92 n ASN 169 Cb 0.32 -1.49 -0.03 0.00 -0.61 0.00 0.00 39.78 37.97 3i92 n ASN 169 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3i92 s GLU 170 N -1.94 4.13 -1.03 3.52 2.02 0.56 -4.85 118.70 121.10 3i92 s GLU 170 Ca 0.56 2.43 -0.25 0.00 0.02 0.00 0.00 54.97 57.73 3i92 s GLU 170 Cb -0.55 -4.10 -0.13 0.00 0.10 0.00 0.00 34.13 29.45 3i92 s GLU 170 CO 0.62 -0.95 2.08 1.21 0.02 0.00 0.00 175.26 178.24 3i92 s ASN 171 N 4.11 4.35 0.24 -0.19 3.84 -1.26 -4.52 114.94 121.51 3i92 s ASN 171 Ca 0.83 -0.95 -0.02 0.00 0.21 0.00 0.00 52.86 52.93 3i92 s ASN 171 Cb -0.39 -2.58 -0.04 0.00 -0.55 0.00 0.00 41.25 37.69 3i92 s ASN 171 CO 0.37 -3.68 0.45 0.68 -2.79 0.00 0.00 177.10 172.12 3i92 s VAL 172 N 13.39 5.15 0.66 -5.21 -7.23 -1.26 -5.09 120.40 120.81 3i92 s VAL 172 Ca 0.77 -0.27 -0.16 0.00 -1.81 0.00 0.00 61.98 60.52 3i92 s VAL 172 Cb -0.05 -3.75 0.00 0.00 0.56 0.00 0.00 36.38 33.14 3i92 s VAL 172 CO 0.11 -0.25 1.14 -1.61 -0.31 0.00 0.00 175.10 174.18 3i92 s GLU 173 N -3.48 2.69 0.00 4.82 2.02 -1.26 -4.98 118.70 118.51 3i92 s GLU 173 Ca 0.40 1.54 0.00 0.00 0.02 0.00 0.00 54.97 56.93 3i92 s GLU 173 Cb -0.11 -1.92 0.00 0.00 0.10 0.00 0.00 34.13 32.20 3i92 s GLU 173 CO 0.30 -1.36 0.00 1.28 0.02 0.00 0.00 175.26 175.50 3i92 n LEU 174 N -2.33 0.00 -4.75 1.80 4.77 -1.26 -4.92 117.00 110.31 3i92 n LEU 174 Ca 0.11 0.00 -0.35 0.00 -0.03 0.00 0.00 56.01 55.74 3i92 n LEU 174 Cb 0.51 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.52 3i92 n LEU 174 CO 0.47 0.00 -0.26 -0.69 -1.33 0.00 0.00 177.39 175.58 3i92 s VAL 175 N 0.00 4.72 -0.80 4.08 1.01 -1.26 -4.82 120.40 123.33 3i92 s VAL 175 Ca 0.00 -0.13 -0.07 0.00 0.00 0.00 0.00 61.98 61.78 3i92 s VAL 175 Cb 0.00 -3.03 0.20 0.00 0.00 0.00 0.00 36.38 33.55 3i92 s VAL 175 CO 0.00 0.58 0.69 -2.28 0.00 0.00 0.00 175.10 174.08 3i92 s HIS 176 N -0.97 3.71 0.38 5.22 2.46 -1.26 -5.07 115.29 119.76 3i92 s HIS 176 Ca 0.15 -2.54 -0.25 0.00 0.47 0.00 0.00 55.06 52.89 3i92 s HIS 176 Cb -0.12 -3.48 -0.09 0.00 -0.13 0.00 0.00 32.58 28.77 3i92 s HIS 176 CO 0.04 -0.88 1.04 0.71 -2.47 0.00 0.00 174.74 173.19 3i92 s TYR 177 N -0.38 3.33 0.61 3.88 1.51 -1.26 -4.98 117.35 120.06 3i92 s TYR 177 Ca 0.21 1.66 -0.18 0.00 -1.01 0.00 0.00 57.07 57.74 3i92 s TYR 177 Cb -0.13 -3.12 -0.04 0.00 -0.11 0.00 0.00 41.96 38.55 3i92 s TYR 177 CO -0.07 -0.55 1.00 0.00 -1.11 0.00 0.00 175.55 174.82 3i92 n ALA 178 N 0.08 0.28 -0.22 3.71 0.00 -1.26 -4.78 120.51 118.33 3i92 n ALA 178 Ca 0.04 0.01 -0.08 0.00 0.00 0.00 0.00 53.44 53.41 3i92 n ALA 178 Cb 0.49 -2.13 0.03 0.00 0.00 0.00 0.00 19.45 17.84 3i92 n ALA 178 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 3i92 h GLN 179 N 0.50 0.97 -1.00 0.00 5.75 -2.00 -1.75 115.11 117.59 3i92 h GLN 179 Ca -0.49 -0.23 0.08 0.00 -0.15 0.00 0.00 58.65 57.87 3i92 h GLN 179 Cb 1.36 -0.13 -0.07 0.00 1.07 0.00 0.00 27.48 29.71 3i92 h GLN 179 CO 0.51 0.88 0.64 -1.35 -2.65 0.00 0.00 178.83 176.86 3i92 h PRO 180 N 0.89 1.07 -0.66 -2.39 0.11 -1.96 0.13 132.00 129.20 3i92 h PRO 180 Ca 0.19 -0.06 0.03 0.00 0.11 0.00 0.00 66.00 66.27 3i92 h PRO 180 Cb 0.34 -0.24 -0.04 0.00 0.11 0.00 0.00 31.00 31.16 3i92 h PRO 180 CO -0.00 0.71 0.41 -0.07 -0.21 0.00 0.00 178.00 178.85 3i92 h LEU 181 N 1.11 0.69 -0.21 2.35 3.38 -1.68 -0.76 115.31 120.17 3i92 h LEU 181 Ca 0.45 -0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.25 3i92 h LEU 181 Cb 0.28 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3i92 h LEU 181 CO -0.21 0.48 -0.53 -0.07 0.09 0.00 0.00 178.44 178.21 3i92 h LEU 182 N 0.82 0.83 -0.08 1.67 3.38 -1.06 0.12 115.31 120.99 3i92 h LEU 182 Ca 0.26 -0.57 0.04 0.00 0.09 0.00 0.00 57.88 57.71 3i92 h LEU 182 Cb 0.00 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.45 3i92 h LEU 182 CO -0.10 1.25 -0.29 0.78 0.09 0.00 0.00 178.44 180.17 3i92 h ASN 183 N 0.46 -0.88 -0.40 -0.43 2.35 -0.59 -0.91 115.58 115.17 3i92 h ASN 183 Ca -0.01 0.13 -0.09 0.00 -0.55 0.00 0.00 56.30 55.78 3i92 h ASN 183 Cb 1.14 0.37 -0.01 0.00 0.05 0.00 0.00 38.32 39.87 3i92 h ASN 183 CO 0.11 -0.34 -0.10 -0.33 -1.65 0.00 0.00 177.43 175.12 3i92 h GLU 184 N -0.39 0.77 0.15 0.81 4.39 -1.10 -0.87 114.58 118.34 3i92 h GLU 184 Ca 0.09 -0.30 0.01 0.00 0.34 0.00 0.00 59.36 59.50 3i92 h GLU 184 Cb 0.52 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.09 3i92 h GLU 184 CO -0.30 0.91 -0.27 0.00 -1.16 0.00 0.00 179.01 178.19 3i92 h ALA 185 N 0.84 -0.47 0.00 3.43 0.00 -0.64 -0.60 119.26 121.82 3i92 h ALA 185 Ca 0.10 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3i92 h ALA 185 Cb 0.63 0.42 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 3i92 h ALA 185 CO 0.04 -0.81 -0.03 0.22 0.00 0.00 0.00 179.25 178.67 3i92 h ASP 186 N -0.49 0.00 0.18 0.00 3.58 -1.10 -1.71 116.42 116.89 3i92 h ASP 186 Ca 0.02 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.46 3i92 h ASP 186 Cb 0.51 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.56 3i92 h ASP 186 CO -0.14 0.03 -0.09 -1.28 -2.88 0.00 0.00 179.24 174.88 3i92 h SER 187 N 0.00 -0.21 -0.84 2.28 0.87 -0.18 -2.62 113.55 112.87 3i92 h SER 187 Ca -0.00 -0.14 0.07 0.00 -1.23 0.00 0.00 61.79 60.49 3i92 h SER 187 Cb 0.05 0.05 -0.05 0.00 -0.44 0.00 0.00 62.40 62.01 3i92 h SER 187 CO 0.00 0.02 0.55 -0.07 -0.53 0.00 0.00 176.83 176.80 3i92 h LEU 188 N -0.43 0.81 -0.74 2.23 3.38 -0.64 -2.94 115.31 116.98 3i92 h LEU 188 Ca -0.03 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 3i92 h LEU 188 Cb 0.34 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 3i92 h LEU 188 CO 0.04 0.52 0.33 0.00 0.09 0.00 0.00 178.44 179.42 3i92 h ALA 189 N 1.55 0.95 -0.41 1.53 0.00 -1.20 -3.10 119.26 118.58 3i92 h ALA 189 Ca 0.36 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.19 3i92 h ALA 189 Cb 0.23 -0.29 -0.08 0.00 0.00 0.00 0.00 17.79 17.65 3i92 h ALA 189 CO -0.13 0.54 -0.10 0.87 0.00 0.00 0.00 179.25 180.43 3i92 h LYS 190 N 1.04 0.00 -1.65 0.00 1.57 -1.28 -1.96 116.57 114.29 3i92 h LYS 190 Ca 0.25 -0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.83 3i92 h LYS 190 Cb 0.16 -0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.38 3i92 h LYS 190 CO -0.03 0.00 0.26 1.33 -0.57 0.00 0.00 179.45 180.45 3i92 n VAL 191 N -5.31 2.45 -4.35 0.50 0.24 -1.17 -4.86 118.33 105.82 3i92 n VAL 191 Ca 0.02 -1.20 -0.25 0.00 -2.04 0.00 0.00 64.34 60.87 3i92 n VAL 191 Cb 0.22 -1.36 -0.09 0.00 -1.47 0.00 0.00 33.84 31.14 3i92 n VAL 191 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 3i92 s MET 192 N -1.16 2.08 0.30 7.34 -1.94 -0.74 -1.97 119.30 123.21 3i92 s MET 192 Ca 0.20 -1.87 -0.30 0.00 -1.71 0.00 0.00 55.69 52.01 3i92 s MET 192 Cb 0.16 -1.86 -0.11 0.00 2.01 0.00 0.00 34.83 35.02 3i92 s MET 192 CO -0.00 0.02 1.61 -1.25 -0.01 0.00 0.00 175.02 175.39 3i92 s PRO 193 N -3.76 4.10 0.01 2.03 0.04 -1.26 -4.92 135.00 131.24 3i92 s PRO 193 Ca 0.37 2.61 0.21 0.00 0.04 0.00 0.00 61.00 64.23 3i92 s PRO 193 Cb 0.04 -3.01 0.90 0.00 0.04 0.00 0.00 34.50 32.46 3i92 s PRO 193 CO 0.20 -0.65 1.68 0.43 0.04 0.00 0.00 177.00 178.69 3i92 n SER 194 N 2.13 0.03 -0.21 6.66 7.64 -1.26 -2.93 113.62 125.68 3i92 n SER 194 Ca 0.08 0.51 0.12 0.00 1.01 0.00 0.00 58.87 60.58 3i92 n SER 194 Cb 0.37 -0.51 0.58 0.00 -1.01 0.00 0.00 64.21 63.63 3i92 n SER 194 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 3i92 n ASP 195 N -1.53 0.65 -4.85 6.43 5.75 -1.26 -4.75 116.55 116.98 3i92 n ASP 195 Ca 0.05 -1.43 -0.37 0.00 -0.01 0.00 0.00 54.79 53.03 3i92 n ASP 195 Cb 0.25 -0.03 -0.06 0.00 -1.03 0.00 0.00 41.12 40.25 3i92 n ASP 195 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 3i92 s ILE 196 N -1.94 5.30 0.19 2.12 1.01 -1.15 -5.07 121.20 121.66 3i92 s ILE 196 Ca 0.34 0.49 -0.32 0.00 0.00 0.00 0.00 60.65 61.16 3i92 s ILE 196 Cb 0.17 -3.54 -0.11 0.00 0.01 0.00 0.00 42.46 38.99 3i92 s ILE 196 CO 0.27 0.59 1.64 -2.84 0.00 0.00 0.00 174.94 174.61 3i92 s PRO 197 N -0.98 4.17 0.27 2.79 0.02 -1.26 -4.80 135.00 135.21 3i92 s PRO 197 Ca 0.19 2.49 -0.09 0.00 0.02 0.00 0.00 61.00 63.60 3i92 s PRO 197 Cb -0.14 -3.11 0.42 0.00 0.02 0.00 0.00 34.50 31.69 3i92 s PRO 197 CO 0.08 -0.67 1.57 1.25 -0.33 0.00 0.00 177.00 178.89 3i92 h LEU 198 N 6.70 -0.93 -0.57 -5.54 5.85 -1.96 0.68 115.31 119.54 3i92 h LEU 198 Ca -0.43 0.29 0.11 0.00 0.84 0.00 0.00 57.88 58.69 3i92 h LEU 198 Cb 1.20 0.61 -0.09 0.00 0.37 0.00 0.00 40.66 42.75 3i92 h LEU 198 CO 0.93 -0.32 0.04 0.50 -0.34 0.00 0.00 178.44 179.25 3i92 h LYS 199 N -0.00 0.15 -0.40 1.25 3.64 -1.89 -0.00 116.57 119.32 3i92 h LYS 199 Ca 0.45 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.76 3i92 h LYS 199 Cb 0.70 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.46 3i92 h LYS 199 CO -0.99 0.10 -0.03 1.96 -2.27 0.00 0.00 179.45 178.22 3i92 h GLN 200 N 0.16 0.65 -0.56 1.90 4.20 0.14 -2.78 115.11 118.82 3i92 h GLN 200 Ca 0.30 -0.17 -0.07 0.00 0.06 0.00 0.00 58.65 58.77 3i92 h GLN 200 Cb 0.46 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.14 3i92 h GLN 200 CO -0.45 0.70 0.07 0.00 -0.67 0.00 0.00 178.83 178.47 3i92 h ARG 201 N 0.61 0.93 -0.88 1.46 3.08 0.70 -1.75 114.38 118.54 3i92 h ARG 201 Ca 0.12 -0.26 0.02 0.00 0.07 0.00 0.00 59.98 59.93 3i92 h ARG 201 Cb 0.44 -0.10 -0.05 0.00 0.08 0.00 0.00 29.97 30.34 3i92 h ARG 201 CO 0.02 0.91 0.58 0.00 -1.07 0.00 0.00 179.97 180.41 3i92 h ARG 202 N 0.82 1.12 -0.47 0.04 2.47 -0.96 -2.10 114.38 115.30 3i92 h ARG 202 Ca 0.17 -0.07 -0.03 0.00 -1.26 0.00 0.00 59.98 58.79 3i92 h ARG 202 Cb 0.44 -0.25 -0.02 0.00 -1.65 0.00 0.00 29.97 28.49 3i92 h ARG 202 CO 0.01 0.74 0.17 2.35 0.56 0.00 0.00 179.97 183.81 3i92 h TRP 203 N 1.16 0.74 -0.41 3.04 7.01 -1.19 -2.84 115.95 123.46 3i92 h TRP 203 Ca 0.33 -0.06 -0.01 0.00 2.11 0.00 0.00 58.89 61.26 3i92 h TRP 203 Cb -0.08 -0.22 -0.02 0.00 -2.10 0.00 0.00 29.16 26.74 3i92 h TRP 203 CO -0.00 0.64 0.23 -0.07 -2.79 0.00 0.00 178.44 176.45 3i92 h LEU 204 N 0.62 0.50 -0.49 0.65 3.38 -0.68 -0.91 115.31 118.37 3i92 h LEU 204 Ca 0.15 -0.08 0.08 0.00 0.09 0.00 0.00 57.88 58.12 3i92 h LEU 204 Cb 0.23 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 3i92 h LEU 204 CO -0.01 0.44 0.14 1.23 0.09 0.00 0.00 178.44 180.32 3i92 h GLY 205 N 0.53 0.63 1.14 0.83 0.00 -1.43 0.25 103.07 105.02 3i92 h GLY 205 Ca 0.14 -0.06 0.01 0.00 0.00 0.00 0.00 47.33 47.42 3i92 h GLY 205 CO -0.02 -0.03 0.58 1.41 0.00 0.00 0.00 176.54 178.47 3i92 h LEU 206 N 0.29 1.00 -0.20 3.11 3.38 -1.19 0.30 115.31 122.00 3i92 h LEU 206 Ca 0.24 -0.03 -0.12 0.00 0.09 0.00 0.00 57.88 58.07 3i92 h LEU 206 Cb 0.29 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 3i92 h LEU 206 CO -0.28 0.72 -0.34 1.56 0.09 0.00 0.00 178.44 180.19 3i92 h GLN 207 N 1.18 0.58 -0.60 1.13 1.08 -0.35 -0.86 115.11 117.28 3i92 h GLN 207 Ca 0.32 -0.36 0.02 0.00 -1.45 0.00 0.00 58.65 57.18 3i92 h GLN 207 Cb -0.14 0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.30 3i92 h GLN 207 CO -0.07 0.97 0.38 0.52 -0.95 0.00 0.00 178.83 179.68 3i92 h MET 208 N 0.25 0.75 -0.40 1.46 2.86 -0.19 0.17 114.93 119.83 3i92 h MET 208 Ca 0.01 -0.04 -0.05 0.00 -2.06 0.00 0.00 59.70 57.56 3i92 h MET 208 Cb 0.93 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 32.40 3i92 h MET 208 CO 0.08 0.49 0.04 -0.07 1.06 0.00 0.00 176.91 178.51 3i92 h LEU 209 N 0.77 0.59 -0.16 1.22 3.38 -0.36 -3.02 115.31 117.71 3i92 h LEU 209 Ca 0.23 -0.11 -0.16 0.00 0.09 0.00 0.00 57.88 57.94 3i92 h LEU 209 Cb -0.04 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.56 3i92 h LEU 209 CO -0.07 0.63 -0.50 -0.08 0.09 0.00 0.00 178.44 178.50 3i92 h GLU 210 N 0.60 0.63 0.00 1.13 4.81 -0.79 -3.39 114.58 117.57 3i92 h GLU 210 Ca 0.13 -0.46 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 3i92 h GLU 210 Cb 0.32 0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.78 3i92 h GLU 210 CO 0.01 1.08 0.00 0.41 -0.73 0.00 0.00 179.01 179.78 3i92 n GLY 211 N 0.56 0.41 3.68 1.92 0.00 -0.18 -4.58 105.19 107.00 3i92 n GLY 211 Ca -0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 3i92 n GLY 211 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3i92 s ASP 212 N -0.41 7.18 0.08 1.61 2.15 0.42 -4.55 116.67 123.15 3i92 s ASP 212 Ca 0.00 1.56 -0.08 0.00 0.43 0.00 0.00 52.55 54.46 3i92 s ASP 212 Cb 0.00 -2.55 -0.23 0.00 -0.30 0.00 0.00 42.92 39.84 3i92 s ASP 212 CO 0.00 -0.52 1.17 0.40 -0.17 0.00 0.00 175.17 176.05 3i92 h ILE 213 N 5.16 1.39 0.03 4.11 5.03 -1.89 -3.36 117.51 127.98 3i92 h ILE 213 Ca -0.29 -2.68 -0.22 0.00 -0.12 0.00 0.00 64.86 61.54 3i92 h ILE 213 Cb 1.13 2.72 -0.02 0.00 -3.03 0.00 0.00 36.82 37.62 3i92 h ILE 213 CO 0.88 0.80 -1.04 1.88 -0.68 0.00 0.00 178.15 179.99 3i92 h TYR 214 N 0.18 0.12 0.00 1.37 -1.99 -1.91 -3.16 116.97 111.58 3i92 h TYR 214 Ca -0.14 -0.09 -0.02 0.00 2.00 0.00 0.00 58.73 60.48 3i92 h TYR 214 Cb 1.85 -0.01 -0.00 0.00 2.00 0.00 0.00 36.73 40.57 3i92 h TYR 214 CO 0.08 1.05 -0.09 0.66 -0.00 0.00 0.00 178.16 179.87 3i92 h SER 215 N 0.02 0.00 -0.96 3.88 4.64 -1.96 -2.01 113.55 117.16 3i92 h SER 215 Ca -0.04 0.00 0.20 0.00 -0.47 0.00 0.00 61.79 61.48 3i92 h SER 215 Cb 1.79 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.79 3i92 h SER 215 CO 0.15 0.09 0.61 0.03 -0.87 0.00 0.00 176.83 176.84 3i92 h ARG 216 N 0.00 0.57 -0.80 4.77 3.08 -1.73 -1.14 114.38 119.13 3i92 h ARG 216 Ca -0.00 -0.03 0.06 0.00 0.07 0.00 0.00 59.98 60.07 3i92 h ARG 216 Cb 0.38 -0.13 -0.06 0.00 0.08 0.00 0.00 29.97 30.24 3i92 h ARG 216 CO 0.01 0.38 0.49 0.00 -1.07 0.00 0.00 179.97 179.78 3i92 h ALA 217 N 1.62 1.09 0.00 0.04 0.00 -1.56 -0.52 119.26 119.93 3i92 h ALA 217 Ca 0.53 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.43 3i92 h ALA 217 Cb 1.05 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3i92 h ALA 217 CO -0.28 0.22 -0.32 1.88 0.00 0.00 0.00 179.25 180.75 3i92 h TYR 218 N 0.89 0.00 0.00 0.00 -1.99 -1.57 -3.36 116.97 110.95 3i92 h TYR 218 Ca 0.35 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 61.05 3i92 h TYR 218 Cb 0.17 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.89 3i92 h TYR 218 CO -0.04 0.00 -0.16 0.00 -0.00 0.00 0.00 178.16 177.96 3i92 h ALA 219 N 2.49 1.17 -0.37 3.88 0.00 0.15 -3.44 119.26 123.14 3i92 h ALA 219 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3i92 h ALA 219 Cb 0.75 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.52 3i92 h ALA 219 CO 0.00 0.20 0.00 0.41 0.00 0.00 0.00 179.25 179.86 3i92 n GLY 220 N -0.36 1.38 0.36 0.00 0.00 -1.21 -2.83 105.19 102.53 3i92 n GLY 220 Ca -0.01 -0.66 0.10 0.00 0.00 0.00 0.00 46.02 45.45 3i92 n GLY 220 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3i92 h GLU 221 N 0.00 0.60 -1.10 1.61 5.08 -1.94 -2.55 114.58 116.28 3i92 h GLU 221 Ca 0.00 -0.04 0.31 0.00 -1.00 0.00 0.00 59.36 58.63 3i92 h GLU 221 Cb 0.00 -0.14 -0.06 0.00 0.50 0.00 0.00 28.75 29.05 3i92 h GLU 221 CO 0.00 0.40 0.77 0.00 -1.00 0.00 0.00 179.01 179.18 3i92 h ALA 222 N 1.63 2.83 -1.01 3.43 0.00 -1.23 -0.18 119.26 124.74 3i92 h ALA 222 Ca 0.34 -0.01 0.22 0.00 0.00 0.00 0.00 54.91 55.46 3i92 h ALA 222 Cb 0.49 0.07 -0.12 0.00 0.00 0.00 0.00 17.79 18.23 3i92 h ALA 222 CO -0.12 -1.18 0.61 1.03 0.00 0.00 0.00 179.25 179.59 3i92 h SER 223 N 0.11 0.72 -0.35 0.00 0.87 -1.62 -0.98 113.55 112.29 3i92 h SER 223 Ca 0.55 0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 61.22 3i92 h SER 223 Cb 1.97 -0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.91 3i92 h SER 223 CO -0.09 0.18 0.18 1.56 -0.53 0.00 0.00 176.83 178.13 3i92 h GLN 224 N 0.66 0.53 -0.57 2.24 4.20 -1.24 -3.11 115.11 117.81 3i92 h GLN 224 Ca 0.61 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 59.27 3i92 h GLN 224 Cb 1.09 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.76 3i92 h GLN 224 CO -0.43 0.42 0.00 0.72 -0.67 0.00 0.00 178.83 178.88 3i92 n HIS 225 N -4.41 0.80 -0.18 2.96 8.25 -0.38 -4.25 115.22 118.01 3i92 n HIS 225 Ca 0.03 -0.39 -0.08 0.00 -0.26 0.00 0.00 57.72 57.02 3i92 n HIS 225 Cb 0.12 -0.02 0.07 0.00 1.12 0.00 0.00 29.99 31.28 3i92 n HIS 225 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3i92 h LEU 226 N 3.31 0.96 -0.73 2.41 5.85 -1.47 -2.43 115.31 123.20 3i92 h LEU 226 Ca 0.00 -0.27 -0.10 0.00 0.84 0.00 0.00 57.88 58.35 3i92 h LEU 226 Cb 0.80 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 3i92 h LEU 226 CO 0.02 1.03 -0.09 -0.78 -0.34 0.00 0.00 178.44 178.27 3i92 h ASP 227 N 0.90 0.86 -0.10 1.25 1.82 -1.83 -0.12 116.42 119.21 3i92 h ASP 227 Ca 0.16 -0.26 -0.02 0.00 -0.39 0.00 0.00 57.03 56.52 3i92 h ASP 227 Cb 0.55 -0.23 -0.00 0.00 0.68 0.00 0.00 39.33 40.32 3i92 h ASP 227 CO 0.03 0.98 -0.01 0.00 -1.61 0.00 0.00 179.24 178.62 3i92 h ALA 228 N 1.10 0.13 -0.63 -0.78 0.00 -1.83 -0.02 119.26 117.24 3i92 h ALA 228 Ca 0.13 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3i92 h ALA 228 Cb 0.60 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 3i92 h ALA 228 CO 0.04 -0.15 0.39 0.00 0.00 0.00 0.00 179.25 179.53 3i92 h ALA 229 N 0.70 0.81 -0.00 0.00 0.00 -1.33 -1.20 119.26 118.24 3i92 h ALA 229 Ca 0.03 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 3i92 h ALA 229 Cb 0.40 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3i92 h ALA 229 CO 0.01 0.27 -0.55 -0.07 0.00 0.00 0.00 179.25 178.91 3i92 h LEU 230 N 0.86 0.00 -0.45 0.00 3.38 -1.00 -2.43 115.31 115.67 3i92 h LEU 230 Ca 0.23 -0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.03 3i92 h LEU 230 Cb -0.04 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3i92 h LEU 230 CO -0.04 0.55 -0.76 0.00 0.09 0.00 0.00 178.44 178.28 3i92 h ALA 231 N 1.45 0.68 0.06 1.53 0.00 -0.65 -3.12 119.26 119.20 3i92 h ALA 231 Ca -0.01 -0.65 -0.00 0.00 0.00 0.00 0.00 54.91 54.25 3i92 h ALA 231 Cb 0.98 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.68 3i92 h ALA 231 CO 0.07 0.85 -0.03 0.00 0.00 0.00 0.00 179.25 180.14 3i92 h ARG 232 N 0.12 -0.07 -1.16 0.00 3.08 -1.18 -3.27 114.38 111.89 3i92 h ARG 232 Ca -0.03 0.00 0.37 0.00 0.07 0.00 0.00 59.98 60.40 3i92 h ARG 232 Cb 1.33 0.02 -0.13 0.00 0.08 0.00 0.00 29.97 31.27 3i92 h ARG 232 CO 0.11 0.48 0.72 -0.07 -1.07 0.00 0.00 179.97 180.15 3i92 h LEU 233 N -0.69 0.35 -0.86 3.04 3.38 -1.51 -1.60 115.31 117.43 3i92 h LEU 233 Ca -0.01 0.15 0.05 0.00 0.09 0.00 0.00 57.88 58.16 3i92 h LEU 233 Cb 0.58 0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.39 3i92 h LEU 233 CO 0.01 -0.14 0.54 -0.09 0.09 0.00 0.00 178.44 178.85 3i92 h ARG 234 N 0.20 0.97 -0.10 1.13 2.43 -1.59 0.21 114.38 117.63 3i92 h ARG 234 Ca 0.76 -0.06 -0.15 0.00 -0.81 0.00 0.00 59.98 59.72 3i92 h ARG 234 Cb 2.13 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 31.45 3i92 h ARG 234 CO -0.47 0.64 -0.59 -0.91 -1.51 0.00 0.00 179.97 177.14 3i92 h ASN 235 N 1.00 0.36 1.38 -3.80 2.35 -1.45 -3.31 115.58 112.11 3i92 h ASN 235 Ca 0.36 -0.20 -0.05 0.00 -0.55 0.00 0.00 56.30 55.86 3i92 h ASN 235 Cb 0.12 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 3i92 h ASN 235 CO -0.16 0.86 -0.64 -0.33 -1.65 0.00 0.00 177.43 175.52 3i92 h GLU 236 N 0.24 0.00 -1.87 0.81 5.08 -1.17 -3.46 114.58 114.21 3i92 h GLU 236 Ca -0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3i92 h GLU 236 Cb 1.10 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 30.13 3i92 h GLU 236 CO 0.10 0.17 0.27 0.00 -1.00 0.00 0.00 179.01 178.54 3i92 s MET 237 N -3.14 0.83 -0.06 2.33 0.23 0.63 -5.03 119.30 115.09 3i92 s MET 237 Ca 0.03 0.53 -0.30 0.00 -1.03 0.00 0.00 55.69 54.91 3i92 s MET 237 Cb 0.07 0.40 -0.04 0.00 -1.53 0.00 0.00 34.83 33.73 3i92 s MET 237 CO 0.75 -0.19 1.35 0.16 -2.03 0.00 0.00 175.02 175.06 3i92 s ASP 238 N -0.47 6.90 -0.54 -1.18 -4.77 -1.26 -4.26 116.67 111.09 3i92 s ASP 238 Ca -0.04 1.96 -0.12 0.00 -3.30 0.00 0.00 52.55 51.05 3i92 s ASP 238 Cb -0.02 -2.55 0.02 0.00 -1.09 0.00 0.00 42.92 39.27 3i92 s ASP 238 CO 0.03 -0.72 0.63 -0.67 0.70 0.00 0.00 175.17 175.14 3i92 n ASP 239 N 5.85 -7.69 -0.25 2.11 -0.08 -1.26 -4.82 116.55 110.41 3i92 n ASP 239 Ca 0.13 0.27 -0.07 0.00 -1.51 0.00 0.00 54.79 53.62 3i92 n ASP 239 Cb 0.44 -5.06 0.06 0.00 2.34 0.00 0.00 41.12 38.91 3i92 n ASP 239 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3i92 h PRO 240 N 1.47 1.12 -0.01 -0.67 0.13 -1.91 -2.90 132.00 129.23 3i92 h PRO 240 Ca -0.05 -0.26 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 3i92 h PRO 240 Cb 1.04 -0.15 -0.00 0.00 0.13 0.00 0.00 31.00 32.01 3i92 h PRO 240 CO 0.24 0.98 0.18 0.00 -0.23 0.00 0.00 178.00 179.16 3i92 h ALA 241 N 1.13 1.20 0.00 -0.56 0.00 -1.81 -1.65 119.26 117.57 3i92 h ALA 241 Ca 0.22 -0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.79 3i92 h ALA 241 Cb 0.35 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 3i92 h ALA 241 CO -0.00 -0.18 -2.26 -0.11 0.00 0.00 0.00 179.25 176.70 3i92 n LEU 242 N -3.02 0.14 0.08 0.00 7.94 -1.11 -3.82 117.00 117.21 3i92 n LEU 242 Ca -0.02 0.07 0.00 0.00 -1.11 0.00 0.00 56.01 54.94 3i92 n LEU 242 Cb 0.24 0.43 0.31 0.00 0.53 0.00 0.00 43.42 44.92 3i92 n LEU 242 CO 0.17 0.46 0.81 0.45 -1.11 0.00 0.00 177.39 178.17 3i92 h HIS 243 N 0.00 0.34 0.07 1.96 3.86 -1.17 -1.08 115.15 119.14 3i92 h HIS 243 Ca -0.48 -0.06 -0.00 0.00 -1.16 0.00 0.00 60.37 58.67 3i92 h HIS 243 Cb 2.16 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 30.54 3i92 h HIS 243 CO 0.00 0.50 -0.03 0.82 0.86 0.00 0.00 177.93 180.08 3i92 h ILE 244 N 0.29 1.11 -0.94 2.45 2.04 -1.58 -1.97 117.51 118.91 3i92 h ILE 244 Ca 0.05 -0.63 -0.00 0.00 1.00 0.00 0.00 64.86 65.27 3i92 h ILE 244 Cb 0.52 1.52 -0.05 0.00 -0.74 0.00 0.00 36.82 38.08 3i92 h ILE 244 CO 0.03 0.16 0.57 0.00 0.00 0.00 0.00 178.15 178.91 3i92 h ALA 245 N 0.53 1.23 -0.03 1.87 0.00 -1.62 -2.07 119.26 119.16 3i92 h ALA 245 Ca -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3i92 h ALA 245 Cb 0.33 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 3i92 h ALA 245 CO 0.02 0.66 -0.00 -0.44 0.00 0.00 0.00 179.25 179.48 3i92 h ASP 246 N 1.30 0.05 -0.85 0.00 5.19 -1.21 -2.42 116.42 118.48 3i92 h ASP 246 Ca 0.34 -0.33 0.10 0.00 -0.62 0.00 0.00 57.03 56.51 3i92 h ASP 246 Cb -0.06 -0.01 -0.06 0.00 0.18 0.00 0.00 39.33 39.38 3i92 h ASP 246 CO -0.06 0.37 0.55 0.00 -3.12 0.00 0.00 179.24 176.98 3i92 h ALA 247 N 0.68 1.68 -0.85 3.45 0.00 -1.19 0.26 119.26 123.30 3i92 h ALA 247 Ca 0.01 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3i92 h ALA 247 Cb 0.35 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 3i92 h ALA 247 CO 0.00 0.14 0.41 0.00 0.00 0.00 0.00 179.25 179.81 3i92 h ARG 248 N 0.83 1.23 -0.03 0.00 3.08 -1.31 -2.19 114.38 115.99 3i92 h ARG 248 Ca 0.39 -0.18 -0.00 0.00 0.07 0.00 0.00 59.98 60.26 3i92 h ARG 248 Cb 0.42 -0.22 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 3i92 h ARG 248 CO -0.16 0.94 -0.00 -0.92 -1.07 0.00 0.00 179.97 178.76 3i92 h TYR 249 N 1.22 0.06 -0.79 3.04 3.20 -0.23 -2.53 116.97 120.93 3i92 h TYR 249 Ca 0.29 -0.01 0.18 0.00 3.14 0.00 0.00 58.73 62.33 3i92 h TYR 249 Cb 0.12 -0.01 -0.12 0.00 1.54 0.00 0.00 36.73 38.25 3i92 h TYR 249 CO 0.01 0.36 0.22 0.37 -1.64 0.00 0.00 178.16 177.49 3i92 h GLN 250 N -0.26 0.28 0.15 1.82 4.15 -0.58 -0.31 115.11 120.35 3i92 h GLN 250 Ca 0.01 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.40 3i92 h GLN 250 Cb 0.34 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.96 3i92 h GLN 250 CO 0.00 0.19 -0.07 0.00 -1.93 0.00 0.00 178.83 177.02 3i92 h ILE 252 N -0.33 1.29 -0.38 0.00 2.04 -1.00 -2.69 117.51 116.44 3i92 h ILE 252 Ca -0.02 -1.32 0.07 0.00 1.00 0.00 0.00 64.86 64.59 3i92 h ILE 252 Cb 0.27 1.44 -0.07 0.00 -0.74 0.00 0.00 36.82 37.72 3i92 h ILE 252 CO 0.03 0.43 -0.05 0.00 0.00 0.00 0.00 178.15 178.56 3i92 h ALA 253 N 0.76 0.29 -0.19 1.87 0.00 -1.10 -0.78 119.26 120.12 3i92 h ALA 253 Ca 0.07 0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.16 3i92 h ALA 253 Cb 0.74 0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.72 3i92 h ALA 253 CO 0.06 -0.43 -0.16 0.00 0.00 0.00 0.00 179.25 178.72 3i92 h ALA 254 N 1.36 -0.03 -0.95 0.00 0.00 -1.30 0.15 119.26 118.49 3i92 h ALA 254 Ca 0.18 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.19 3i92 h ALA 254 Cb 0.27 0.34 -0.05 0.00 0.00 0.00 0.00 17.79 18.35 3i92 h ALA 254 CO -0.36 -0.59 0.62 0.82 0.00 0.00 0.00 179.25 179.75 3i92 h ILE 255 N -0.17 1.19 -0.04 0.00 1.08 -1.11 -2.57 117.51 115.89 3i92 h ILE 255 Ca 0.12 -0.42 -0.17 0.00 -0.39 0.00 0.00 64.86 63.99 3i92 h ILE 255 Cb 0.34 -0.15 -0.01 0.00 -3.07 0.00 0.00 36.82 33.93 3i92 h ILE 255 CO -0.29 0.22 -0.74 0.00 -0.69 0.00 0.00 178.15 176.66 3i92 h ASP 257 N 0.17 0.57 0.10 0.00 3.32 -0.34 -1.32 116.42 118.91 3i92 h ASP 257 Ca -0.03 -0.06 -0.27 0.00 0.02 0.00 0.00 57.03 56.70 3i92 h ASP 257 Cb 1.30 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.70 3i92 h ASP 257 CO 0.12 0.51 -1.39 0.58 -1.72 0.00 0.00 179.24 177.33 3i92 h VAL 258 N 0.63 1.01 0.06 -1.35 2.07 -1.37 -3.42 116.25 113.88 3i92 h VAL 258 Ca 0.16 -2.37 -0.24 0.00 0.82 0.00 0.00 66.70 65.07 3i92 h VAL 258 Cb 0.11 2.66 -0.01 0.00 -1.52 0.00 0.00 31.29 32.53 3i92 h VAL 258 CO -0.02 0.67 -1.24 0.58 0.02 0.00 0.00 177.57 177.58 3i92 h VAL 259 N -0.38 1.05 -4.32 2.57 2.07 -1.08 -3.47 116.25 112.69 3i92 h VAL 259 Ca -0.31 -2.31 -0.50 0.00 0.82 0.00 0.00 66.70 64.40 3i92 h VAL 259 Cb 1.70 2.61 0.07 0.00 -1.52 0.00 0.00 31.29 34.15 3i92 h VAL 259 CO 0.03 0.58 0.38 -0.55 0.02 0.00 0.00 177.57 178.02 3i92 s SER 260 N -6.88 5.81 0.00 0.57 0.15 -0.50 -1.82 113.70 111.03 3i92 s SER 260 Ca -0.23 1.20 0.00 0.00 0.70 0.00 0.00 55.95 57.62 3i92 s SER 260 Cb 0.04 -2.14 0.00 0.00 -1.71 0.00 0.00 66.02 62.21 3i92 s SER 260 CO 0.70 -1.09 0.42 -3.20 1.20 0.00 0.00 173.24 171.26