#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i8s s LYS 2 N 0.00 4.32 0.43 2.12 2.20 -1.26 -5.01 119.74 122.54 3i8s s LYS 2 Ca 0.00 1.89 0.03 0.00 -0.36 0.00 0.00 55.97 57.53 3i8s s LYS 2 Cb 0.00 -3.51 0.00 0.00 -1.51 0.00 0.00 37.83 32.81 3i8s s LYS 2 CO 0.00 -0.50 0.62 0.15 -0.36 0.00 0.00 175.35 175.27 3i8s s LYS 3 N 2.07 2.98 -0.20 4.03 -0.14 -1.26 -4.97 119.74 122.25 3i8s s LYS 3 Ca 0.62 -0.74 -0.25 0.00 -1.36 0.00 0.00 55.97 54.24 3i8s s LYS 3 Cb -0.30 -2.64 -0.01 0.00 -1.68 0.00 0.00 37.83 33.20 3i8s s LYS 3 CO 0.26 -0.25 0.83 -1.17 -0.76 0.00 0.00 175.35 174.27 3i8s s LEU 4 N -4.46 4.13 -0.26 3.17 2.96 0.20 -4.90 118.68 119.52 3i8s s LEU 4 Ca 0.49 1.11 -0.12 0.00 -0.22 0.00 0.00 54.13 55.40 3i8s s LEU 4 Cb -0.10 -3.22 -0.05 0.00 0.50 0.00 0.00 46.19 43.33 3i8s s LEU 4 CO 0.36 -0.46 0.21 -0.89 -1.32 0.00 0.00 176.35 174.25 3i8s s THR 5 N 2.49 5.30 -0.11 3.68 2.01 -1.26 -0.98 115.64 126.77 3i8s s THR 5 Ca 0.37 0.25 0.03 0.00 0.31 0.00 0.00 61.69 62.65 3i8s s THR 5 Cb -0.16 -3.55 0.00 0.00 0.01 0.00 0.00 72.50 68.80 3i8s s THR 5 CO 0.10 0.27 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.43 3i8s s ILE 6 N 1.55 2.07 -0.11 1.82 1.01 -0.14 0.04 121.20 127.44 3i8s s ILE 6 Ca 0.09 -1.00 -0.20 0.00 0.00 0.00 0.00 60.65 59.53 3i8s s ILE 6 Cb -0.15 -1.80 -0.04 0.00 0.01 0.00 0.00 42.46 40.48 3i8s s ILE 6 CO 0.09 0.56 0.56 -0.83 0.00 0.00 0.00 174.94 175.32 3i8s s GLY 7 N 0.48 2.43 -0.28 6.18 0.00 -0.75 -0.84 107.32 114.54 3i8s s GLY 7 Ca -0.15 -0.10 -0.10 0.00 0.00 0.00 0.00 44.72 44.36 3i8s s GLY 7 CO 0.06 0.96 0.17 -2.27 0.00 0.00 0.00 173.10 172.01 3i8s s LEU 8 N 0.83 3.92 -0.02 0.66 2.96 0.56 -0.71 118.68 126.89 3i8s s LEU 8 Ca 0.30 -0.07 -0.01 0.00 -0.22 0.00 0.00 54.13 54.13 3i8s s LEU 8 Cb -0.16 -2.08 0.00 0.00 0.50 0.00 0.00 46.19 44.45 3i8s s LEU 8 CO 0.13 -0.05 0.04 -0.51 -1.32 0.00 0.00 176.35 174.63 3i8s s ILE 9 N 1.73 -0.00 0.06 6.68 2.07 -0.60 -0.65 121.20 130.49 3i8s s ILE 9 Ca 0.07 0.00 -0.23 0.00 -1.41 0.00 0.00 60.65 59.08 3i8s s ILE 9 Cb -0.16 -0.07 0.08 0.00 0.13 0.00 0.00 42.46 42.44 3i8s s ILE 9 CO 0.10 0.00 1.04 0.61 -1.91 0.00 0.00 174.94 174.78 3i8s n GLY 10 N 3.06 0.43 3.78 1.50 0.00 -1.26 -0.87 105.19 111.83 3i8s n GLY 10 Ca -0.12 -1.07 -0.30 0.00 0.00 0.00 0.00 46.02 44.53 3i8s n GLY 10 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3i8s s ASN 11 N -3.37 4.15 0.42 1.61 -0.87 -1.21 -1.34 114.94 114.33 3i8s s ASN 11 Ca 0.24 1.35 -0.26 0.00 -1.57 0.00 0.00 52.86 52.62 3i8s s ASN 11 Cb -0.01 -2.06 -0.10 0.00 -0.02 0.00 0.00 41.25 39.06 3i8s s ASN 11 CO 0.02 -2.20 1.33 -2.65 -2.57 0.00 0.00 177.10 171.04 3i8s n PRO 12 N -3.58 2.09 -3.92 -0.60 -0.02 -1.26 -3.03 135.00 124.68 3i8s n PRO 12 Ca 0.07 0.74 -0.29 0.00 -2.02 0.00 0.00 63.50 62.00 3i8s n PRO 12 Cb 0.56 -2.47 0.02 0.00 -0.02 0.00 0.00 33.50 31.59 3i8s n PRO 12 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3i8s n ASN 13 N 0.14 -4.05 -0.98 2.55 5.15 -1.26 -4.87 115.26 111.95 3i8s n ASN 13 Ca 0.06 -0.81 0.12 0.00 -0.60 0.00 0.00 54.58 53.34 3i8s n ASN 13 Cb 0.40 -3.78 0.11 0.00 -0.53 0.00 0.00 39.78 35.98 3i8s n ASN 13 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 3i8s n SER 14 N -2.85 3.04 0.00 1.20 3.41 -1.17 -4.93 113.62 112.32 3i8s n SER 14 Ca -0.01 -1.99 0.00 0.00 -0.26 0.00 0.00 58.87 56.61 3i8s n SER 14 Cb 0.55 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 3i8s n SER 14 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3i8s n GLY 15 N 1.36 0.74 0.28 5.00 0.00 -1.26 -4.41 105.19 106.90 3i8s n GLY 15 Ca 0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 3i8s n GLY 15 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3i8s h LYS 16 N 3.74 0.97 -0.52 1.61 3.64 -1.92 -1.71 116.57 122.39 3i8s h LYS 16 Ca 0.00 -0.34 -0.03 0.00 -1.27 0.00 0.00 60.65 59.01 3i8s h LYS 16 Cb 0.00 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 3i8s h LYS 16 CO 0.00 1.01 0.19 1.15 -2.27 0.00 0.00 179.45 179.53 3i8s h THR 17 N 0.84 1.22 -0.40 1.00 2.02 -1.96 -0.12 112.91 115.51 3i8s h THR 17 Ca 0.14 -0.71 0.00 0.00 0.77 0.00 0.00 66.41 66.62 3i8s h THR 17 Cb 0.60 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 3i8s h THR 17 CO 0.04 0.27 0.26 0.74 0.37 0.00 0.00 175.52 177.20 3i8s h THR 18 N 0.70 1.11 -0.39 3.16 2.02 -1.95 -1.55 112.91 116.00 3i8s h THR 18 Ca 0.17 -0.21 -0.00 0.00 0.77 0.00 0.00 66.41 67.14 3i8s h THR 18 Cb 0.23 0.53 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 3i8s h THR 18 CO -0.01 0.10 0.23 0.25 0.37 0.00 0.00 175.52 176.47 3i8s h LEU 19 N 0.54 0.48 -0.17 2.58 5.85 -1.12 0.40 115.31 123.88 3i8s h LEU 19 Ca 0.15 -0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.85 3i8s h LEU 19 Cb -0.05 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 40.81 3i8s h LEU 19 CO -0.03 0.40 -0.13 0.15 -0.34 0.00 0.00 178.44 178.50 3i8s h PHE 20 N 0.52 -0.32 -0.63 1.25 3.57 -0.82 -0.63 116.94 119.88 3i8s h PHE 20 Ca 0.14 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.61 3i8s h PHE 20 Cb 0.02 0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.90 3i8s h PHE 20 CO -0.03 -0.19 0.19 -0.91 -2.23 0.00 0.00 178.31 175.14 3i8s h ASN 21 N -0.13 0.89 -0.62 0.41 2.35 -0.99 -1.83 115.58 115.65 3i8s h ASN 21 Ca 0.10 -0.15 -0.08 0.00 -0.55 0.00 0.00 56.30 55.62 3i8s h ASN 21 Cb 0.29 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 3i8s h ASN 21 CO -0.25 0.84 0.06 1.56 -1.65 0.00 0.00 177.43 177.99 3i8s h GLN 22 N 0.92 1.05 -0.14 0.81 4.20 -0.52 -0.64 115.11 120.79 3i8s h GLN 22 Ca 0.21 -0.30 -0.23 0.00 0.06 0.00 0.00 58.65 58.39 3i8s h GLN 22 Cb 0.28 -0.11 0.01 0.00 0.30 0.00 0.00 27.48 27.95 3i8s h GLN 22 CO -0.01 1.00 -0.81 -0.07 -0.67 0.00 0.00 178.83 178.27 3i8s h LEU 23 N 0.96 0.94 0.00 1.46 3.38 -0.86 -3.36 115.31 117.82 3i8s h LEU 23 Ca 0.18 -0.63 -0.02 0.00 0.09 0.00 0.00 57.88 57.50 3i8s h LEU 23 Cb 0.48 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 3i8s h LEU 23 CO 0.02 1.43 -1.97 0.35 0.09 0.00 0.00 178.44 178.36 3i8s n THR 24 N -3.92 0.08 0.00 0.22 -2.24 -0.71 -4.66 114.28 103.04 3i8s n THR 24 Ca -0.08 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.21 3i8s n THR 24 Cb 0.76 -0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 3i8s n THR 24 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3i8s n GLY 25 N 1.35 3.39 0.01 3.38 0.00 -0.25 -1.21 105.19 111.86 3i8s n GLY 25 Ca -0.05 -0.04 0.14 0.00 0.00 0.00 0.00 46.02 46.06 3i8s n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3i8s n SER 26 N 4.27 0.14 -3.71 1.61 3.41 -1.26 -4.49 113.62 113.59 3i8s n SER 26 Ca 0.00 0.39 -0.42 0.00 -0.26 0.00 0.00 58.87 58.59 3i8s n SER 26 Cb 0.00 -0.40 -0.00 0.00 -0.26 0.00 0.00 64.21 63.54 3i8s n SER 26 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3i8s n ARG 27 N -1.56 3.62 -4.00 4.33 1.74 -0.35 -4.89 116.66 115.54 3i8s n ARG 27 Ca 0.07 -3.17 -0.09 0.00 -0.77 0.00 0.00 57.85 53.89 3i8s n ARG 27 Cb 0.35 -2.95 -0.10 0.00 -1.02 0.00 0.00 32.46 28.74 3i8s n ARG 27 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 3i8s s GLN 28 N 0.95 0.46 0.12 5.56 -2.07 -1.26 -1.46 119.66 121.96 3i8s s GLN 28 Ca 0.47 -0.80 0.06 0.00 -1.82 0.00 0.00 55.36 53.26 3i8s s GLN 28 Cb 0.13 0.17 -0.04 0.00 -1.09 0.00 0.00 33.01 32.18 3i8s s GLN 28 CO -0.04 -0.09 -0.14 -0.98 -1.32 0.00 0.00 175.29 172.73 3i8s s ARG 29 N -2.37 1.02 -0.02 9.60 1.70 0.60 -4.98 118.95 124.50 3i8s s ARG 29 Ca -0.07 -1.26 0.05 0.00 -0.47 0.00 0.00 55.73 53.98 3i8s s ARG 29 Cb -0.03 -0.87 -0.01 0.00 -0.57 0.00 0.00 34.95 33.47 3i8s s ARG 29 CO -0.04 0.16 -0.16 0.08 -1.08 0.00 0.00 175.30 174.26 3i8s s VAL 30 N -2.25 1.30 0.00 4.99 1.01 -1.26 -1.85 120.40 122.33 3i8s s VAL 30 Ca 0.09 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.39 3i8s s VAL 30 Cb -0.04 -1.09 0.00 0.00 0.00 0.00 0.00 36.38 35.25 3i8s s VAL 30 CO 0.03 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.11 3i8s n GLY 31 N 2.79 4.68 3.42 4.51 0.00 0.29 -4.99 105.19 115.89 3i8s n GLY 31 Ca -0.15 -1.03 -0.29 0.00 0.00 0.00 0.00 46.02 44.55 3i8s n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i8s s ASN 32 N 1.32 3.48 0.35 1.61 4.22 -1.26 -0.55 114.94 124.11 3i8s s ASN 32 Ca 0.00 -0.72 -0.28 0.00 -2.14 0.00 0.00 52.86 49.71 3i8s s ASN 32 Cb 0.00 -0.30 -0.11 0.00 1.28 0.00 0.00 41.25 42.12 3i8s s ASN 32 CO 0.00 0.17 1.39 0.26 -2.04 0.00 0.00 177.10 176.88 3i8s s TRP 33 N -1.19 2.85 0.03 1.54 0.52 -0.07 -4.66 118.94 117.96 3i8s s TRP 33 Ca 0.16 1.29 -0.35 0.00 0.02 0.00 0.00 56.10 57.22 3i8s s TRP 33 Cb -0.10 -3.84 -0.14 0.00 -1.15 0.00 0.00 33.47 28.25 3i8s s TRP 33 CO 0.08 -2.40 1.66 0.00 0.02 0.00 0.00 176.95 176.30 3i8s n ALA 34 N 0.74 0.74 -0.79 0.98 0.00 -1.26 -2.27 120.51 118.64 3i8s n ALA 34 Ca 0.01 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.85 3i8s n ALA 34 Cb 0.41 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.51 3i8s n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i8s n GLY 35 N 3.68 0.87 3.25 0.00 0.00 -1.26 -5.01 105.19 106.72 3i8s n GLY 35 Ca 0.20 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.07 3i8s n GLY 35 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3i8s s VAL 36 N -3.45 0.15 -2.51 1.61 -7.23 -0.96 -5.06 120.40 102.94 3i8s s VAL 36 Ca 0.00 -2.00 0.27 0.00 -1.81 0.00 0.00 61.98 58.44 3i8s s VAL 36 Cb 0.00 -2.53 0.44 0.00 0.56 0.00 0.00 36.38 34.85 3i8s s VAL 36 CO 0.00 0.00 1.61 0.35 -0.31 0.00 0.00 175.10 176.75 3i8s n THR 37 N -0.38 0.00 -2.38 5.32 -2.24 -1.26 -4.28 114.28 109.05 3i8s n THR 37 Ca 0.02 -0.29 -0.41 0.00 -2.27 0.00 0.00 64.05 61.10 3i8s n THR 37 Cb 0.66 0.71 -0.03 0.00 -2.10 0.00 0.00 70.33 69.56 3i8s n THR 37 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3i8s s VAL 38 N -2.06 3.72 0.32 2.28 1.01 -1.26 -4.87 120.40 119.54 3i8s s VAL 38 Ca 0.34 1.36 -0.29 0.00 0.00 0.00 0.00 61.98 63.39 3i8s s VAL 38 Cb 0.21 -3.87 -0.10 0.00 0.00 0.00 0.00 36.38 32.61 3i8s s VAL 38 CO 0.35 0.18 1.39 -0.70 0.00 0.00 0.00 175.10 176.32 3i8s s GLU 39 N 0.26 4.26 -0.23 2.72 2.12 -1.26 -0.89 118.70 125.68 3i8s s GLU 39 Ca 0.55 2.34 0.00 0.00 0.36 0.00 0.00 54.97 58.23 3i8s s GLU 39 Cb -0.32 -3.05 0.03 0.00 0.26 0.00 0.00 34.13 31.05 3i8s s GLU 39 CO 0.34 -0.35 -0.12 0.50 -0.54 0.00 0.00 175.26 175.09 3i8s s ARG 40 N -1.47 2.71 -0.07 4.30 3.52 0.29 -4.66 118.95 123.57 3i8s s ARG 40 Ca 0.53 -1.04 0.00 0.00 -0.13 0.00 0.00 55.73 55.09 3i8s s ARG 40 Cb -0.42 -2.83 -0.03 0.00 -1.56 0.00 0.00 34.95 30.11 3i8s s ARG 40 CO 0.53 -0.39 -0.06 0.15 -0.81 0.00 0.00 175.30 174.72 3i8s s LYS 41 N 1.25 2.82 0.11 5.12 1.02 -1.26 -0.54 119.74 128.25 3i8s s LYS 41 Ca -0.01 -0.53 -0.09 0.00 0.02 0.00 0.00 55.97 55.36 3i8s s LYS 41 Cb -0.16 -2.63 -0.00 0.00 -0.52 0.00 0.00 37.83 34.51 3i8s s LYS 41 CO -0.07 0.65 0.23 -1.83 -0.92 0.00 0.00 175.35 173.41 3i8s s GLU 42 N -0.76 0.94 0.37 1.68 -1.05 -0.77 -1.51 118.70 117.59 3i8s s GLU 42 Ca 0.12 -0.99 -0.11 0.00 -0.15 0.00 0.00 54.97 53.83 3i8s s GLU 42 Cb -0.11 0.36 0.04 0.00 -0.44 0.00 0.00 34.13 33.98 3i8s s GLU 42 CO 0.02 -0.32 0.68 0.20 0.95 0.00 0.00 175.26 176.79 3i8s s GLY 43 N -2.88 0.79 0.11 -3.83 0.00 -0.26 -0.30 107.32 100.96 3i8s s GLY 43 Ca 0.08 -1.04 0.08 0.00 0.00 0.00 0.00 44.72 43.84 3i8s s GLY 43 CO -0.08 -0.56 -0.20 1.20 0.00 0.00 0.00 173.10 173.45 3i8s s GLN 44 N -2.54 1.15 0.22 2.90 -1.52 -0.54 -0.72 119.66 118.60 3i8s s GLN 44 Ca 0.21 -1.21 -0.23 0.00 -1.95 0.00 0.00 55.36 52.19 3i8s s GLN 44 Cb -0.03 -1.36 0.04 0.00 -0.22 0.00 0.00 33.01 31.43 3i8s s GLN 44 CO 0.15 0.31 0.82 -0.59 -0.25 0.00 0.00 175.29 175.73 3i8s s PHE 45 N -1.34 -0.17 0.07 0.91 -0.71 -0.83 -4.46 117.98 111.46 3i8s s PHE 45 Ca 0.08 -0.22 0.08 0.00 -1.04 0.00 0.00 56.93 55.84 3i8s s PHE 45 Cb -0.09 0.68 -0.03 0.00 -1.21 0.00 0.00 43.02 42.36 3i8s s PHE 45 CO 0.05 -1.05 -0.22 -1.12 -1.34 0.00 0.00 175.22 171.53 3i8s s SER 46 N -2.92 2.70 0.16 1.98 0.01 -1.26 -0.23 113.70 114.13 3i8s s SER 46 Ca 0.11 -0.62 0.01 0.00 1.31 0.00 0.00 55.95 56.77 3i8s s SER 46 Cb -0.04 -0.20 0.01 0.00 0.21 0.00 0.00 66.02 66.01 3i8s s SER 46 CO 0.05 0.14 0.09 0.35 0.41 0.00 0.00 173.24 174.28 3i8s n THR 47 N 1.46 0.00 -0.25 1.44 -2.24 0.04 -4.99 114.28 109.74 3i8s n THR 47 Ca -0.18 -0.65 -0.00 0.00 -2.27 0.00 0.00 64.05 60.94 3i8s n THR 47 Cb 0.53 -0.25 0.12 0.00 -2.10 0.00 0.00 70.33 68.63 3i8s n THR 47 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3i8s h THR 48 N 0.67 0.97 0.00 4.28 2.02 -2.00 -3.28 112.91 115.56 3i8s h THR 48 Ca -0.11 -0.26 -0.09 0.00 0.77 0.00 0.00 66.41 66.72 3i8s h THR 48 Cb 0.37 0.16 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 3i8s h THR 48 CO 0.17 0.14 -1.87 0.47 0.37 0.00 0.00 175.52 174.79 3i8s n ASP 49 N -4.76 1.13 -4.17 4.18 8.00 -1.26 -5.04 116.55 114.63 3i8s n ASP 49 Ca 0.10 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.37 3i8s n ASP 49 Cb 0.19 1.49 -0.14 0.00 -0.02 0.00 0.00 41.12 42.64 3i8s n ASP 49 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 3i8s s HIS 50 N -2.92 1.47 -0.26 1.24 3.76 -1.24 -5.10 115.29 112.24 3i8s s HIS 50 Ca -0.07 -0.33 -0.16 0.00 -0.15 0.00 0.00 55.06 54.35 3i8s s HIS 50 Cb 0.09 -0.90 -0.03 0.00 1.11 0.00 0.00 32.58 32.85 3i8s s HIS 50 CO 0.68 0.03 0.41 -0.65 -0.85 0.00 0.00 174.74 174.37 3i8s s GLN 51 N -0.89 4.06 -0.07 1.40 -1.52 -1.26 -0.78 119.66 120.60 3i8s s GLN 51 Ca 0.05 0.14 0.02 0.00 -1.95 0.00 0.00 55.36 53.62 3i8s s GLN 51 Cb -0.08 -3.63 -0.02 0.00 -0.22 0.00 0.00 33.01 29.06 3i8s s GLN 51 CO 0.01 -0.26 -0.13 0.08 -0.25 0.00 0.00 175.29 174.74 3i8s s VAL 52 N 2.00 3.14 -0.22 1.09 1.01 0.68 -0.63 120.40 127.47 3i8s s VAL 52 Ca 0.17 -0.68 -0.08 0.00 0.00 0.00 0.00 61.98 61.39 3i8s s VAL 52 Cb -0.16 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 3i8s s VAL 52 CO 0.09 0.57 0.09 -0.89 0.00 0.00 0.00 175.10 174.97 3i8s s THR 53 N -0.45 4.76 -0.24 3.92 2.01 -0.16 -1.96 115.64 123.53 3i8s s THR 53 Ca 0.06 -0.03 -0.05 0.00 0.31 0.00 0.00 61.69 61.98 3i8s s THR 53 Cb -0.12 -3.20 -0.00 0.00 0.01 0.00 0.00 72.50 69.19 3i8s s THR 53 CO 0.02 0.38 -0.00 -0.22 -0.69 0.00 0.00 174.62 174.10 3i8s s LEU 54 N 1.06 3.19 -0.29 4.42 2.96 0.10 -0.97 118.68 129.15 3i8s s LEU 54 Ca 0.05 -0.47 -0.09 0.00 -0.22 0.00 0.00 54.13 53.40 3i8s s LEU 54 Cb -0.14 -1.79 -0.02 0.00 0.50 0.00 0.00 46.19 44.74 3i8s s LEU 54 CO 0.04 -0.07 0.13 -0.69 -1.32 0.00 0.00 176.35 174.44 3i8s s VAL 55 N 1.49 4.63 -0.34 1.68 1.01 -0.02 -1.10 120.40 127.75 3i8s s VAL 55 Ca 0.05 -0.25 -0.26 0.00 0.00 0.00 0.00 61.98 61.52 3i8s s VAL 55 Cb -0.15 -3.28 0.01 0.00 0.00 0.00 0.00 36.38 32.96 3i8s s VAL 55 CO -0.01 0.18 0.93 -0.62 0.00 0.00 0.00 175.10 175.58 3i8s s ASP 56 N 1.64 6.75 0.19 3.32 2.15 -0.57 -0.32 116.67 129.83 3i8s s ASP 56 Ca 0.06 0.74 -0.08 0.00 0.43 0.00 0.00 52.55 53.69 3i8s s ASP 56 Cb -0.16 -2.47 -0.07 0.00 -0.30 0.00 0.00 42.92 39.92 3i8s s ASP 56 CO 0.06 -0.80 0.49 -0.76 -0.17 0.00 0.00 175.17 173.99 3i8s s LEU 57 N 3.39 4.21 0.52 -1.34 1.43 0.18 -4.40 118.68 122.67 3i8s s LEU 57 Ca 0.39 0.81 -0.23 0.00 -1.03 0.00 0.00 54.13 54.07 3i8s s LEU 57 Cb -0.13 -3.53 -0.06 0.00 0.03 0.00 0.00 46.19 42.51 3i8s s LEU 57 CO 0.16 -0.02 1.38 -2.65 0.23 0.00 0.00 176.35 175.45 3i8s n PRO 58 N -0.01 1.85 -1.89 1.29 -0.02 -1.26 -4.77 135.00 130.19 3i8s n PRO 58 Ca -0.01 0.67 -0.40 0.00 -2.02 0.00 0.00 63.50 61.74 3i8s n PRO 58 Cb 0.52 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 3i8s n PRO 58 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3i8s s GLY 59 N -0.79 2.94 -0.07 -1.23 0.00 -1.26 -4.74 107.32 102.17 3i8s s GLY 59 Ca 0.69 1.43 -0.25 0.00 0.00 0.00 0.00 44.72 46.58 3i8s s GLY 59 CO 0.52 2.06 0.57 -1.08 0.00 0.00 0.00 173.10 175.16 3i8s s THR 60 N -1.19 0.02 0.02 0.90 -1.32 -0.45 -4.62 115.64 109.00 3i8s s THR 60 Ca 0.56 -0.13 0.10 0.00 -1.21 0.00 0.00 61.69 61.02 3i8s s THR 60 Cb -0.43 -0.87 -0.13 0.00 -1.51 0.00 0.00 72.50 69.57 3i8s s THR 60 CO 0.56 -0.07 1.27 0.22 -2.21 0.00 0.00 174.62 174.39 3i8s h TYR 61 N 3.61 0.00 -3.18 9.09 3.20 -1.95 -3.20 116.97 124.53 3i8s h TYR 61 Ca -0.28 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.54 3i8s h TYR 61 Cb 1.15 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.41 3i8s h TYR 61 CO 0.42 0.84 0.19 -1.54 -1.64 0.00 0.00 178.16 176.43 3i8s s SER 62 N -6.56 0.14 -0.03 -2.11 1.04 -1.26 -3.23 113.70 101.69 3i8s s SER 62 Ca 0.01 -1.17 0.16 0.00 0.48 0.00 0.00 55.95 55.44 3i8s s SER 62 Cb 0.09 0.81 0.51 0.00 0.10 0.00 0.00 66.02 67.54 3i8s s SER 62 CO 0.80 -1.61 1.43 0.18 0.98 0.00 0.00 173.24 175.02 3i8s n LEU 63 N -0.53 3.67 -4.81 2.42 4.77 -1.26 -4.80 117.00 116.46 3i8s n LEU 63 Ca -0.07 -2.16 -0.37 0.00 -0.03 0.00 0.00 56.01 53.39 3i8s n LEU 63 Cb 0.60 -0.40 -0.06 0.00 -2.33 0.00 0.00 43.42 41.22 3i8s n LEU 63 CO 0.26 0.83 -0.04 -0.89 -1.33 0.00 0.00 177.39 176.22 3i8s s THR 64 N -1.29 5.30 0.03 -5.08 2.01 -1.26 -4.82 115.64 110.54 3i8s s THR 64 Ca 0.38 0.50 0.09 0.00 0.31 0.00 0.00 61.69 62.97 3i8s s THR 64 Cb 0.22 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 69.13 3i8s s THR 64 CO 0.23 0.52 -0.25 -0.89 -0.69 0.00 0.00 174.62 173.54 3i8s s THR 65 N -0.47 2.27 0.00 -0.82 2.01 -1.26 -4.95 115.64 112.43 3i8s s THR 65 Ca 0.17 -1.30 0.00 0.00 0.31 0.00 0.00 61.69 60.88 3i8s s THR 65 Cb -0.14 -1.89 0.00 0.00 0.01 0.00 0.00 72.50 70.49 3i8s s THR 65 CO 0.06 0.40 0.00 1.07 -0.69 0.00 0.00 174.62 175.46 3i8s n THR 70 N 1.84 0.00 -1.63 -0.82 5.66 -1.26 -4.59 114.28 113.47 3i8s n THR 70 Ca -0.17 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.41 3i8s n THR 70 Cb 0.52 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 3i8s n THR 70 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 3i8s n SER 71 N 0.00 1.70 -0.21 1.09 3.41 -1.26 -4.88 113.62 113.47 3i8s n SER 71 Ca 0.00 1.10 -0.01 0.00 -0.26 0.00 0.00 58.87 59.71 3i8s n SER 71 Cb 0.00 -1.38 0.10 0.00 -0.26 0.00 0.00 64.21 62.67 3i8s n SER 71 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3i8s h LEU 72 N 1.88 0.35 -0.72 1.04 3.38 -2.01 -3.09 115.31 116.14 3i8s h LEU 72 Ca -0.44 0.06 0.16 0.00 0.09 0.00 0.00 57.88 57.75 3i8s h LEU 72 Cb 1.32 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.97 3i8s h LEU 72 CO 0.59 0.21 0.13 0.44 0.09 0.00 0.00 178.44 179.91 3i8s h ASP 73 N 0.50 -0.07 -0.60 -0.43 5.19 -1.90 0.53 116.42 119.64 3i8s h ASP 73 Ca 0.30 0.15 -0.05 0.00 -0.62 0.00 0.00 57.03 56.82 3i8s h ASP 73 Cb 0.31 0.23 -0.03 0.00 0.18 0.00 0.00 39.33 40.02 3i8s h ASP 73 CO -0.25 -0.07 0.20 -0.08 -3.12 0.00 0.00 179.24 175.91 3i8s h GLU 74 N 0.22 0.92 -0.29 3.56 4.22 -1.80 -2.41 114.58 119.01 3i8s h GLU 74 Ca 0.40 -0.19 -0.13 0.00 0.08 0.00 0.00 59.36 59.53 3i8s h GLU 74 Cb 0.70 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 3i8s h GLU 74 CO -0.54 0.82 -0.34 1.96 -2.18 0.00 0.00 179.01 178.74 3i8s h GLN 75 N 0.85 0.64 -0.33 1.92 4.20 -1.05 -1.49 115.11 119.85 3i8s h GLN 75 Ca 0.19 -0.30 -0.00 0.00 0.06 0.00 0.00 58.65 58.60 3i8s h GLN 75 Cb 0.27 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 3i8s h GLN 75 CO -0.01 0.89 0.20 0.82 -0.67 0.00 0.00 178.83 180.07 3i8s h ILE 76 N 0.54 1.11 0.32 2.54 2.04 -0.93 0.14 117.51 123.27 3i8s h ILE 76 Ca 0.06 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 3i8s h ILE 76 Cb 0.84 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 37.60 3i8s h ILE 76 CO 0.07 0.11 -0.17 0.00 0.00 0.00 0.00 178.15 178.16 3i8s h ALA 77 N 1.09 -0.45 -0.57 1.87 0.00 -1.37 -1.32 119.26 118.50 3i8s h ALA 77 Ca 0.12 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.99 3i8s h ALA 77 Cb 0.00 0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 3i8s h ALA 77 CO -0.02 -0.76 0.30 0.00 0.00 0.00 0.00 179.25 178.77 3i8s h HIS 79 N 0.56 0.77 -0.43 0.00 6.17 -0.57 -1.05 115.15 120.60 3i8s h HIS 79 Ca 0.26 -0.07 -0.00 0.00 0.71 0.00 0.00 60.37 61.26 3i8s h HIS 79 Cb 0.17 -0.23 -0.02 0.00 2.52 0.00 0.00 27.41 29.85 3i8s h HIS 79 CO -0.10 0.67 0.26 -0.92 0.71 0.00 0.00 177.93 178.55 3i8s h TYR 80 N 0.65 0.58 -0.84 5.26 3.20 -1.00 -1.93 116.97 122.90 3i8s h TYR 80 Ca 0.16 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.02 3i8s h TYR 80 Cb 0.25 -0.19 -0.04 0.00 1.54 0.00 0.00 36.73 38.29 3i8s h TYR 80 CO 0.01 0.41 0.50 0.82 -1.64 0.00 0.00 178.16 178.27 3i8s h ILE 81 N 0.57 1.24 0.00 1.81 2.04 -0.96 -1.53 117.51 120.67 3i8s h ILE 81 Ca 0.15 -0.52 0.00 0.00 1.00 0.00 0.00 64.86 65.49 3i8s h ILE 81 Cb 0.01 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.15 3i8s h ILE 81 CO -0.03 0.25 0.00 0.18 0.00 0.00 0.00 178.15 178.55 3i8s n LEU 82 N -4.43 0.02 0.20 1.44 4.77 -0.43 -3.54 117.00 115.03 3i8s n LEU 82 Ca 0.09 0.50 0.07 0.00 -0.03 0.00 0.00 56.01 56.64 3i8s n LEU 82 Cb 0.06 -0.50 0.36 0.00 -2.33 0.00 0.00 43.42 41.01 3i8s n LEU 82 CO 0.38 -0.03 0.71 0.77 -1.33 0.00 0.00 177.39 177.89 3i8s h SER 83 N 0.00 0.00 -0.01 -1.43 4.64 -0.46 -3.47 113.55 112.83 3i8s h SER 83 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3i8s h SER 83 Cb 0.48 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.57 3i8s h SER 83 CO 0.00 0.34 -0.00 0.61 -0.87 0.00 0.00 176.83 176.90 3i8s n GLY 84 N 0.24 0.46 0.18 -0.77 0.00 -1.23 -4.94 105.19 99.12 3i8s n GLY 84 Ca -0.00 -0.41 -0.11 0.00 0.00 0.00 0.00 46.02 45.50 3i8s n GLY 84 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3i8s h ASP 85 N 0.00 0.52 -3.75 1.61 3.32 -1.87 -3.44 116.42 112.82 3i8s h ASP 85 Ca -0.00 -0.35 -0.49 0.00 0.02 0.00 0.00 57.03 56.21 3i8s h ASP 85 Cb 0.02 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 3i8s h ASP 85 CO 0.00 1.10 0.30 0.00 -1.72 0.00 0.00 179.24 178.92 3i8s s ALA 86 N -3.60 3.32 0.04 3.45 0.00 -1.26 -4.77 121.76 118.94 3i8s s ALA 86 Ca -0.06 0.51 0.10 0.00 0.00 0.00 0.00 51.96 52.51 3i8s s ALA 86 Cb 0.10 -3.13 -0.19 0.00 0.00 0.00 0.00 23.12 19.91 3i8s s ALA 86 CO 0.85 0.22 1.10 -0.44 0.00 0.00 0.00 175.76 177.49 3i8s h ASP 87 N 3.78 0.00 -5.02 0.00 3.32 -0.69 -3.49 116.42 114.31 3i8s h ASP 87 Ca -0.46 0.00 0.06 0.00 0.02 0.00 0.00 57.03 56.65 3i8s h ASP 87 Cb 1.20 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.70 3i8s h ASP 87 CO 0.66 0.93 0.26 -1.48 -1.72 0.00 0.00 179.24 177.89 3i8s s LEU 88 N -6.47 -0.21 0.03 1.55 2.34 -1.15 -4.58 118.68 110.19 3i8s s LEU 88 Ca -0.00 -0.68 0.07 0.00 0.06 0.00 0.00 54.13 53.58 3i8s s LEU 88 Cb 0.09 2.71 -0.02 0.00 -0.56 0.00 0.00 46.19 48.41 3i8s s LEU 88 CO 0.81 -1.37 -0.21 -0.76 -1.06 0.00 0.00 176.35 173.76 3i8s s LEU 89 N -2.95 2.13 -0.26 1.48 1.43 -0.26 -1.80 118.68 118.46 3i8s s LEU 89 Ca 0.12 -0.49 -0.06 0.00 -1.03 0.00 0.00 54.13 52.67 3i8s s LEU 89 Cb -0.06 -1.04 -0.01 0.00 0.03 0.00 0.00 46.19 45.11 3i8s s LEU 89 CO 0.07 0.20 0.03 -0.63 0.23 0.00 0.00 176.35 176.26 3i8s s ILE 90 N -0.72 3.86 -0.43 -0.59 1.01 0.11 -1.13 121.20 123.32 3i8s s ILE 90 Ca 0.08 -0.47 -0.14 0.00 0.00 0.00 0.00 60.65 60.12 3i8s s ILE 90 Cb -0.09 -2.86 0.05 0.00 0.01 0.00 0.00 42.46 39.57 3i8s s ILE 90 CO 0.01 0.27 0.32 0.21 0.00 0.00 0.00 174.94 175.76 3i8s s ASN 91 N 1.52 6.04 -0.31 3.58 2.47 0.03 -1.55 114.94 126.73 3i8s s ASN 91 Ca 0.05 -1.13 -0.28 0.00 0.42 0.00 0.00 52.86 51.92 3i8s s ASN 91 Cb -0.16 -2.14 0.01 0.00 -1.45 0.00 0.00 41.25 37.52 3i8s s ASN 91 CO 0.01 -0.53 1.00 -0.69 -3.72 0.00 0.00 177.10 173.18 3i8s s VAL 92 N 1.63 4.59 -0.16 -5.21 1.01 -0.05 -0.84 120.40 121.37 3i8s s VAL 92 Ca 0.04 1.64 0.01 0.00 0.00 0.00 0.00 61.98 63.68 3i8s s VAL 92 Cb -0.21 -4.34 0.01 0.00 0.00 0.00 0.00 36.38 31.84 3i8s s VAL 92 CO 0.08 -0.39 -0.20 -0.69 0.00 0.00 0.00 175.10 173.89 3i8s s VAL 93 N 3.44 2.11 -0.51 2.92 1.01 -0.08 -4.28 120.40 125.01 3i8s s VAL 93 Ca 0.42 -0.94 -0.27 0.00 0.00 0.00 0.00 61.98 61.19 3i8s s VAL 93 Cb -0.13 -1.87 -0.01 0.00 0.00 0.00 0.00 36.38 34.37 3i8s s VAL 93 CO 0.14 0.54 1.71 -0.62 0.00 0.00 0.00 175.10 176.86 3i8s s ASP 94 N 1.09 5.71 0.59 3.32 2.15 -1.26 -0.87 116.67 127.40 3i8s s ASP 94 Ca 0.00 0.60 0.29 0.00 0.43 0.00 0.00 52.55 53.87 3i8s s ASP 94 Cb -0.14 -2.53 1.53 0.00 -0.30 0.00 0.00 42.92 41.48 3i8s s ASP 94 CO -0.08 -1.98 1.97 0.00 -0.17 0.00 0.00 175.17 174.90 3i8s h ALA 95 N 13.20 2.06 -0.00 3.66 0.00 -1.21 -1.66 119.26 135.30 3i8s h ALA 95 Ca -0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3i8s h ALA 95 Cb 1.14 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3i8s h ALA 95 CO 1.15 -0.57 -0.12 -1.13 0.00 0.00 0.00 179.25 178.58 3i8s n SER 96 N -3.76 0.30 -2.73 0.00 3.41 -1.26 -3.67 113.62 105.90 3i8s n SER 96 Ca 0.06 -0.23 -0.05 0.00 -0.26 0.00 0.00 58.87 58.39 3i8s n SER 96 Cb 0.55 -0.15 0.05 0.00 -0.26 0.00 0.00 64.21 64.40 3i8s n SER 96 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3i8s n ASN 97 N -1.20 1.08 -0.03 4.04 3.02 -0.65 -4.97 115.26 116.56 3i8s n ASN 97 Ca 0.12 -2.41 -0.09 0.00 -0.03 0.00 0.00 54.58 52.17 3i8s n ASN 97 Cb 0.29 -0.33 -0.03 0.00 -0.61 0.00 0.00 39.78 39.11 3i8s n ASN 97 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3i8s h LEU 98 N 2.67 -0.30 -0.33 3.41 5.85 -1.57 -0.29 115.31 124.75 3i8s h LEU 98 Ca -0.15 0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.66 3i8s h LEU 98 Cb 1.23 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.40 3i8s h LEU 98 CO 0.30 -0.12 0.20 -0.08 -0.34 0.00 0.00 178.44 178.40 3i8s h GLU 99 N -0.08 0.40 -0.36 1.25 4.81 -1.92 0.58 114.58 119.26 3i8s h GLU 99 Ca 0.10 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.28 3i8s h GLU 99 Cb 0.22 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.50 3i8s h GLU 99 CO -0.22 0.26 0.13 0.00 -0.73 0.00 0.00 179.01 178.45 3i8s h ARG 100 N 0.41 0.54 0.00 1.92 3.08 -1.92 -2.93 114.38 115.48 3i8s h ARG 100 Ca 0.13 -0.10 -0.05 0.00 0.07 0.00 0.00 59.98 60.02 3i8s h ARG 100 Cb -0.01 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 3i8s h ARG 100 CO -0.05 0.54 -0.25 -0.91 -1.07 0.00 0.00 179.97 178.22 3i8s h ASN 101 N 0.43 0.00 0.79 7.04 -0.26 -0.44 -2.91 115.58 120.23 3i8s h ASN 101 Ca 0.12 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.86 3i8s h ASN 101 Cb 0.21 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.47 3i8s h ASN 101 CO -0.01 0.25 0.00 0.18 -1.06 0.00 0.00 177.43 176.79 3i8s n LEU 102 N -3.90 0.53 0.03 1.61 4.77 0.14 -3.17 117.00 117.00 3i8s n LEU 102 Ca -0.02 0.61 -0.12 0.00 -0.03 0.00 0.00 56.01 56.46 3i8s n LEU 102 Cb 0.33 -0.52 -0.06 0.00 -2.33 0.00 0.00 43.42 40.84 3i8s n LEU 102 CO 0.35 -0.43 0.88 0.22 -1.33 0.00 0.00 177.39 177.09 3i8s h TYR 103 N 0.00 0.03 -0.08 -1.77 3.20 -1.60 -0.96 116.97 115.79 3i8s h TYR 103 Ca 0.00 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.89 3i8s h TYR 103 Cb 0.40 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.64 3i8s h TYR 103 CO 0.00 0.02 -0.03 1.25 -1.64 0.00 0.00 178.16 177.76 3i8s h LEU 104 N 0.04 -0.11 -0.55 2.82 5.85 -1.51 -2.52 115.31 119.32 3i8s h LEU 104 Ca 0.01 0.03 0.11 0.00 0.84 0.00 0.00 57.88 58.87 3i8s h LEU 104 Cb -0.00 0.06 -0.10 0.00 0.37 0.00 0.00 40.66 40.99 3i8s h LEU 104 CO -0.01 -0.04 -0.08 0.74 -0.34 0.00 0.00 178.44 178.71 3i8s h THR 105 N -0.02 0.48 -0.77 1.05 2.02 -1.55 -1.12 112.91 113.01 3i8s h THR 105 Ca 0.04 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 3i8s h THR 105 Cb 0.08 0.44 -0.04 0.00 -1.74 0.00 0.00 68.15 66.90 3i8s h THR 105 CO -0.10 0.01 0.46 -0.07 0.37 0.00 0.00 175.52 176.19 3i8s h LEU 106 N 0.04 0.92 -0.59 2.58 4.07 -1.00 -0.73 115.31 120.59 3i8s h LEU 106 Ca 0.27 -0.05 -0.03 0.00 0.08 0.00 0.00 57.88 58.16 3i8s h LEU 106 Cb 0.43 -0.23 -0.03 0.00 1.08 0.00 0.00 40.66 41.91 3i8s h LEU 106 CO -0.53 0.71 0.27 1.56 -1.08 0.00 0.00 178.44 179.37 3i8s h GLN 107 N 1.06 0.87 -0.56 1.13 4.20 -0.79 -0.94 115.11 120.07 3i8s h GLN 107 Ca 0.28 -0.14 -0.01 0.00 0.06 0.00 0.00 58.65 58.84 3i8s h GLN 107 Cb -0.03 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.57 3i8s h GLN 107 CO -0.05 0.71 0.32 -0.07 -0.67 0.00 0.00 178.83 179.07 3i8s h LEU 108 N 0.82 0.69 -0.69 1.46 3.38 -0.73 -2.39 115.31 117.85 3i8s h LEU 108 Ca 0.20 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.98 3i8s h LEU 108 Cb 0.14 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 3i8s h LEU 108 CO -0.02 0.57 -0.19 -0.07 0.09 0.00 0.00 178.44 178.81 3i8s h LEU 109 N 0.76 0.82 -1.47 1.67 3.38 -0.95 -2.53 115.31 116.99 3i8s h LEU 109 Ca 0.20 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 3i8s h LEU 109 Cb 0.02 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3i8s h LEU 109 CO -0.03 1.00 -0.25 -0.33 0.09 0.00 0.00 178.44 178.92 3i8s h GLU 110 N 0.71 0.03 0.00 1.13 5.08 -0.99 -1.30 114.58 119.24 3i8s h GLU 110 Ca 0.10 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3i8s h GLU 110 Cb 0.71 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 3i8s h GLU 110 CO 0.05 0.27 0.00 -0.07 -1.00 0.00 0.00 179.01 178.27 3i8s h LEU 111 N 0.03 0.00 0.00 1.33 3.38 -1.02 -3.45 115.31 115.58 3i8s h LEU 111 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3i8s h LEU 111 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3i8s h LEU 111 CO 0.03 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.17 3i8s n GLY 112 N 0.40 0.51 3.73 0.83 0.00 -0.49 -4.44 105.19 105.73 3i8s n GLY 112 Ca 0.02 -0.38 -0.41 0.00 0.00 0.00 0.00 46.02 45.24 3i8s n GLY 112 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3i8s s ILE 113 N -2.00 4.19 0.29 -0.61 -1.09 -1.22 -4.80 121.20 115.97 3i8s s ILE 113 Ca 0.00 1.82 -0.29 0.00 -2.23 0.00 0.00 60.65 59.94 3i8s s ILE 113 Cb 0.00 -4.16 -0.13 0.00 -1.58 0.00 0.00 42.46 36.59 3i8s s ILE 113 CO 0.00 0.28 1.35 -2.65 -1.23 0.00 0.00 174.94 172.69 3i8s n PRO 114 N 2.73 2.10 -3.77 2.79 -0.02 -1.26 -4.77 135.00 132.80 3i8s n PRO 114 Ca 0.03 0.74 -0.13 0.00 -2.02 0.00 0.00 63.50 62.13 3i8s n PRO 114 Cb 0.48 -2.36 -0.12 0.00 -0.02 0.00 0.00 33.50 31.47 3i8s n PRO 114 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3i8s s ILE 116 N 0.49 2.83 -0.09 0.00 1.01 -0.28 -4.21 121.20 120.94 3i8s s ILE 116 Ca -0.03 -0.72 -0.25 0.00 0.00 0.00 0.00 60.65 59.65 3i8s s ILE 116 Cb -0.04 -2.20 -0.03 0.00 0.01 0.00 0.00 42.46 40.20 3i8s s ILE 116 CO -0.02 0.51 0.78 -0.69 0.00 0.00 0.00 174.94 175.52 3i8s s VAL 117 N 0.74 4.96 -0.36 2.92 1.01 -0.02 -0.79 120.40 128.87 3i8s s VAL 117 Ca -0.06 1.59 -0.10 0.00 0.00 0.00 0.00 61.98 63.41 3i8s s VAL 117 Cb -0.15 -4.11 0.02 0.00 0.00 0.00 0.00 36.38 32.14 3i8s s VAL 117 CO 0.01 0.16 0.19 0.00 0.00 0.00 0.00 175.10 175.46 3i8s s ALA 118 N 1.32 3.26 -0.37 5.51 0.00 -0.02 -0.27 121.76 131.19 3i8s s ALA 118 Ca 0.40 -1.65 -0.22 0.00 0.00 0.00 0.00 51.96 50.49 3i8s s ALA 118 Cb -0.18 -2.52 0.01 0.00 0.00 0.00 0.00 23.12 20.43 3i8s s ALA 118 CO 0.17 -1.27 0.71 -1.17 0.00 0.00 0.00 175.76 174.20 3i8s s LEU 119 N 1.55 4.21 0.49 0.00 2.96 0.09 -0.91 118.68 127.09 3i8s s LEU 119 Ca 0.02 0.20 0.06 0.00 -0.22 0.00 0.00 54.13 54.19 3i8s s LEU 119 Cb -0.19 -2.90 0.01 0.00 0.50 0.00 0.00 46.19 43.61 3i8s s LEU 119 CO 0.06 -0.68 0.35 0.21 -1.32 0.00 0.00 176.35 174.97 3i8s s ASN 120 N 1.84 4.66 -1.43 3.68 3.84 -0.05 0.23 114.94 127.72 3i8s s ASN 120 Ca 0.28 -1.13 -0.07 0.00 0.21 0.00 0.00 52.86 52.15 3i8s s ASN 120 Cb -0.14 0.06 0.04 0.00 -0.55 0.00 0.00 41.25 40.66 3i8s s ASN 120 CO 0.16 -0.90 0.57 0.23 -2.79 0.00 0.00 177.10 174.37 3i8s n MET 121 N -1.61 -4.32 -0.14 0.43 2.81 -1.26 -0.80 117.12 112.22 3i8s n MET 121 Ca -0.01 0.71 0.01 0.00 -1.81 0.00 0.00 57.70 56.61 3i8s n MET 121 Cb 0.64 -5.51 0.30 0.00 -0.71 0.00 0.00 33.22 27.93 3i8s n MET 121 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 3i8s h LEU 122 N -1.25 0.73 -0.44 4.03 3.38 -1.89 -1.86 115.31 118.01 3i8s h LEU 122 Ca -0.49 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.44 3i8s h LEU 122 Cb 1.33 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 3i8s h LEU 122 CO 0.55 0.55 0.21 -2.24 0.09 0.00 0.00 178.44 177.60 3i8s h ASP 123 N 0.85 0.58 -0.34 -0.43 2.03 -1.96 -2.02 116.42 115.13 3i8s h ASP 123 Ca 0.23 -0.13 -0.03 0.00 -0.73 0.00 0.00 57.03 56.37 3i8s h ASP 123 Cb -0.06 -0.15 -0.01 0.00 -0.83 0.00 0.00 39.33 38.27 3i8s h ASP 123 CO -0.05 0.55 0.11 0.40 -1.03 0.00 0.00 179.24 179.22 3i8s h ILE 124 N 0.58 1.20 -0.55 4.15 2.04 -1.85 -1.86 117.51 121.21 3i8s h ILE 124 Ca 0.15 -0.66 0.02 0.00 1.00 0.00 0.00 64.86 65.38 3i8s h ILE 124 Cb 0.12 1.00 -0.04 0.00 -0.74 0.00 0.00 36.82 37.17 3i8s h ILE 124 CO -0.02 0.23 0.33 0.00 0.00 0.00 0.00 178.15 178.69 3i8s h ALA 125 N 0.95 0.71 -0.37 1.87 0.00 -1.26 -1.12 119.26 120.03 3i8s h ALA 125 Ca 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3i8s h ALA 125 Cb 0.24 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3i8s h ALA 125 CO -0.00 0.06 0.24 1.49 0.00 0.00 0.00 179.25 181.03 3i8s h GLU 126 N 0.66 0.49 0.00 0.00 4.81 -1.17 0.63 114.58 120.00 3i8s h GLU 126 Ca 0.22 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.41 3i8s h GLU 126 Cb 0.02 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.29 3i8s h GLU 126 CO -0.09 0.34 -0.05 0.87 -0.73 0.00 0.00 179.01 179.35 3i8s h LYS 127 N 0.49 0.00 -0.54 1.92 1.79 -0.89 0.11 116.57 119.46 3i8s h LYS 127 Ca 0.13 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.60 3i8s h LYS 127 Cb -0.03 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.62 3i8s h LYS 127 CO -0.03 0.05 0.00 1.04 -1.08 0.00 0.00 179.45 179.43 3i8s n GLN 128 N -3.26 2.46 -2.82 3.15 6.02 -0.47 -4.94 117.38 117.52 3i8s n GLN 128 Ca -0.01 -1.73 -0.16 0.00 -0.01 0.00 0.00 57.00 55.09 3i8s n GLN 128 Cb 0.23 -1.54 0.03 0.00 1.02 0.00 0.00 30.24 29.98 3i8s n GLN 128 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 3i8s n ASN 129 N 0.71 -4.85 -4.15 1.08 4.05 0.39 -4.98 115.26 107.50 3i8s n ASN 129 Ca 0.16 -0.21 -0.31 0.00 0.45 0.00 0.00 54.58 54.67 3i8s n ASN 129 Cb 0.52 -3.70 -0.17 0.00 1.23 0.00 0.00 39.78 37.66 3i8s n ASN 129 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 177.26 173.70 3i8s s ILE 130 N -3.01 1.86 -0.10 -1.44 2.07 0.11 -1.82 121.20 118.87 3i8s s ILE 130 Ca 0.23 -0.88 -0.01 0.00 -1.41 0.00 0.00 60.65 58.58 3i8s s ILE 130 Cb -0.10 -1.64 -0.03 0.00 0.13 0.00 0.00 42.46 40.82 3i8s s ILE 130 CO 0.28 0.51 -0.04 -0.60 -1.91 0.00 0.00 174.94 173.18 3i8s s ARG 131 N 0.68 3.15 -0.22 3.50 3.52 -0.66 -3.36 118.95 125.56 3i8s s ARG 131 Ca -0.12 -0.51 -0.09 0.00 -0.13 0.00 0.00 55.73 54.89 3i8s s ARG 131 Cb -0.16 -2.76 -0.04 0.00 -1.56 0.00 0.00 34.95 30.43 3i8s s ARG 131 CO 0.02 0.51 0.11 0.42 -0.81 0.00 0.00 175.30 175.56 3i8s s ILE 132 N -0.38 5.01 -0.73 4.11 -1.09 -1.26 -1.40 121.20 125.46 3i8s s ILE 132 Ca 0.06 0.06 -0.27 0.00 -2.23 0.00 0.00 60.65 58.27 3i8s s ILE 132 Cb -0.12 -3.31 0.03 0.00 -1.58 0.00 0.00 42.46 37.47 3i8s s ILE 132 CO 0.02 0.39 1.30 -1.61 -1.23 0.00 0.00 174.94 173.81 3i8s s GLU 133 N 0.87 3.18 0.06 2.79 2.02 0.67 -4.90 118.70 123.40 3i8s s GLU 133 Ca 0.06 -0.19 -0.19 0.00 0.02 0.00 0.00 54.97 54.67 3i8s s GLU 133 Cb -0.13 -4.18 -0.11 0.00 0.10 0.00 0.00 34.13 29.80 3i8s s GLU 133 CO 0.03 -2.15 1.44 0.82 0.02 0.00 0.00 175.26 175.41 3i8s h ILE 134 N 6.07 1.29 -0.32 -1.63 2.04 -1.97 -1.70 117.51 121.30 3i8s h ILE 134 Ca -0.28 -1.07 -0.11 0.00 1.00 0.00 0.00 64.86 64.40 3i8s h ILE 134 Cb 1.05 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.71 3i8s h ILE 134 CO 1.27 0.32 -0.28 0.44 0.00 0.00 0.00 178.15 179.91 3i8s h ASP 135 N 0.10 0.67 -0.77 1.72 5.19 -1.91 -0.58 116.42 120.83 3i8s h ASP 135 Ca 0.05 -0.25 0.06 0.00 -0.62 0.00 0.00 57.03 56.27 3i8s h ASP 135 Cb 0.52 -0.18 -0.06 0.00 0.18 0.00 0.00 39.33 39.79 3i8s h ASP 135 CO 0.02 0.91 0.46 0.00 -3.12 0.00 0.00 179.24 177.51 3i8s h ALA 136 N 1.13 1.05 -0.16 3.45 0.00 -1.95 -0.56 119.26 122.23 3i8s h ALA 136 Ca 0.07 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 3i8s h ALA 136 Cb 0.76 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 3i8s h ALA 136 CO 0.06 0.16 0.02 1.25 0.00 0.00 0.00 179.25 180.74 3i8s h LEU 137 N 0.83 0.26 -0.55 0.00 5.85 -0.81 -2.81 115.31 118.08 3i8s h LEU 137 Ca 0.34 -0.27 0.06 0.00 0.84 0.00 0.00 57.88 58.85 3i8s h LEU 137 Cb 0.20 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.10 3i8s h LEU 137 CO -0.18 0.47 0.25 -1.28 -0.34 0.00 0.00 178.44 177.35 3i8s h SER 138 N 0.04 0.33 -0.99 1.25 0.87 -0.89 -1.18 113.55 112.98 3i8s h SER 138 Ca 0.05 0.05 0.13 0.00 -1.23 0.00 0.00 61.79 60.78 3i8s h SER 138 Cb 0.32 -0.01 -0.09 0.00 -0.44 0.00 0.00 62.40 62.19 3i8s h SER 138 CO 0.00 0.22 0.62 0.00 -0.53 0.00 0.00 176.83 177.14 3i8s h ALA 139 N 1.33 1.51 0.00 6.23 0.00 -1.09 0.12 119.26 127.36 3i8s h ALA 139 Ca 0.26 0.03 -0.21 0.00 0.00 0.00 0.00 54.91 54.99 3i8s h ALA 139 Cb 0.22 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3i8s h ALA 139 CO -0.21 0.17 -1.02 0.00 0.00 0.00 0.00 179.25 178.19 3i8s h ARG 140 N 0.94 0.00 0.04 0.00 3.08 -1.09 -3.32 114.38 114.04 3i8s h ARG 140 Ca 0.50 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 60.30 3i8s h ARG 140 Cb 0.54 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.57 3i8s h ARG 140 CO -0.28 0.94 -1.24 -0.07 -1.07 0.00 0.00 179.97 178.24 3i8s h LEU 141 N 0.00 0.14 0.28 3.04 3.38 -1.05 -3.45 115.31 117.64 3i8s h LEU 141 Ca -0.03 -0.17 -0.09 0.00 0.09 0.00 0.00 57.88 57.68 3i8s h LEU 141 Cb 1.76 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 42.44 3i8s h LEU 141 CO 0.12 1.14 -0.09 0.61 0.09 0.00 0.00 178.44 180.31 3i8s n GLY 142 N 1.47 0.63 3.12 0.83 0.00 0.39 -4.75 105.19 106.87 3i8s n GLY 142 Ca -0.07 -0.84 -0.08 0.00 0.00 0.00 0.00 46.02 45.02 3i8s n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i8s n PRO 144 N 0.33 1.92 -3.95 0.00 -0.02 -1.26 -4.47 135.00 127.55 3i8s n PRO 144 Ca -0.16 0.68 -0.30 0.00 -2.02 0.00 0.00 63.50 61.70 3i8s n PRO 144 Cb 0.60 -2.39 -0.16 0.00 -0.02 0.00 0.00 33.50 31.53 3i8s n PRO 144 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3i8s s VAL 145 N -1.21 1.44 -0.24 -1.45 1.01 -1.26 -0.84 120.40 117.85 3i8s s VAL 145 Ca 0.61 -0.95 -0.05 0.00 0.00 0.00 0.00 61.98 61.59 3i8s s VAL 145 Cb -0.50 -1.61 -0.01 0.00 0.00 0.00 0.00 36.38 34.26 3i8s s VAL 145 CO 0.58 0.08 0.00 -0.63 0.00 0.00 0.00 175.10 175.13 3i8s s ILE 146 N 1.47 3.65 -0.06 2.22 -1.09 0.63 -4.93 121.20 123.09 3i8s s ILE 146 Ca -0.02 -0.51 -0.30 0.00 -2.23 0.00 0.00 60.65 57.60 3i8s s ILE 146 Cb -0.17 -2.73 -0.03 0.00 -1.58 0.00 0.00 42.46 37.95 3i8s s ILE 146 CO -0.07 0.32 1.18 -2.16 -1.23 0.00 0.00 174.94 172.98 3i8s s PRO 147 N 1.50 4.36 -1.25 2.79 0.04 -1.26 -0.73 135.00 140.45 3i8s s PRO 147 Ca 0.05 1.65 -0.13 0.00 0.04 0.00 0.00 61.00 62.61 3i8s s PRO 147 Cb -0.15 -3.55 0.15 0.00 0.04 0.00 0.00 34.50 30.99 3i8s s PRO 147 CO -0.01 -0.43 1.62 1.28 0.04 0.00 0.00 177.00 179.50 3i8s n LEU 148 N 5.15 5.57 -4.67 -3.56 4.77 0.14 -4.48 117.00 119.91 3i8s n LEU 148 Ca 0.11 -4.40 -0.42 0.00 -0.03 0.00 0.00 56.01 51.26 3i8s n LEU 148 Cb 0.46 -1.61 -0.03 0.00 -2.33 0.00 0.00 43.42 39.92 3i8s n LEU 148 CO 0.55 0.80 1.25 -0.69 -1.33 0.00 0.00 177.39 177.97 3i8s s VAL 149 N 1.79 3.73 0.13 4.08 1.01 -1.26 -4.83 120.40 125.06 3i8s s VAL 149 Ca 0.44 0.96 -0.12 0.00 0.00 0.00 0.00 61.98 63.26 3i8s s VAL 149 Cb 0.02 -3.62 -0.06 0.00 0.00 0.00 0.00 36.38 32.72 3i8s s VAL 149 CO 0.01 -0.06 1.45 0.77 0.00 0.00 0.00 175.10 177.27 3i8s h SER 150 N 8.79 0.95 -1.98 3.32 4.64 -1.97 -0.56 113.55 126.74 3i8s h SER 150 Ca -0.36 -0.48 -0.63 0.00 -0.47 0.00 0.00 61.79 59.85 3i8s h SER 150 Cb 1.16 -0.27 0.03 0.00 -0.31 0.00 0.00 62.40 63.02 3i8s h SER 150 CO 0.94 1.24 0.93 1.07 -0.87 0.00 0.00 176.83 180.14 3i8s n THR 151 N -4.10 0.33 -2.55 2.95 5.66 -1.26 -2.19 114.28 113.13 3i8s n THR 151 Ca -0.03 -0.06 -0.17 0.00 -3.05 0.00 0.00 64.05 60.74 3i8s n THR 151 Cb 0.54 -1.58 -0.00 0.00 -1.55 0.00 0.00 70.33 67.74 3i8s n THR 151 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 3i8s n ARG 152 N 5.20 -2.37 -1.67 1.09 1.74 -1.26 -2.06 116.66 117.34 3i8s n ARG 152 Ca 0.21 0.76 -0.20 0.00 -0.77 0.00 0.00 57.85 57.85 3i8s n ARG 152 Cb 0.26 -5.42 -0.08 0.00 -1.02 0.00 0.00 32.46 26.20 3i8s n ARG 152 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3i8s n GLY 153 N -0.97 1.74 0.23 -0.13 0.00 -0.93 -4.91 105.19 100.22 3i8s n GLY 153 Ca -0.17 -0.03 -0.07 0.00 0.00 0.00 0.00 46.02 45.75 3i8s n GLY 153 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3i8s h ARG 154 N 0.00 0.73 -0.52 1.61 3.08 -1.50 -1.94 114.38 115.83 3i8s h ARG 154 Ca -0.43 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.55 3i8s h ARG 154 Cb 1.34 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 31.22 3i8s h ARG 154 CO 0.61 0.56 0.34 0.78 -1.07 0.00 0.00 179.97 181.19 3i8s h GLY 155 N 0.71 0.74 1.01 0.04 0.00 -1.32 -0.74 103.07 103.51 3i8s h GLY 155 Ca 0.19 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.22 3i8s h GLY 155 CO -0.03 0.28 0.46 -2.22 0.00 0.00 0.00 176.54 175.02 3i8s h ILE 156 N 0.71 1.23 -0.57 2.60 2.04 -1.70 0.04 117.51 121.86 3i8s h ILE 156 Ca 0.19 -0.56 -0.05 0.00 1.00 0.00 0.00 64.86 65.44 3i8s h ILE 156 Cb -0.07 0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 36.12 3i8s h ILE 156 CO -0.04 0.25 0.16 -0.33 0.00 0.00 0.00 178.15 178.19 3i8s h GLU 157 N 1.11 0.90 -0.59 2.37 4.39 -0.99 -1.19 114.58 120.57 3i8s h GLU 157 Ca 0.29 -0.20 -0.04 0.00 0.34 0.00 0.00 59.36 59.75 3i8s h GLU 157 Cb 0.00 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.50 3i8s h GLU 157 CO -0.05 0.82 0.22 0.00 -1.16 0.00 0.00 179.01 178.84 3i8s h ALA 158 N 1.04 1.28 -0.47 3.43 0.00 -0.78 -1.89 119.26 121.87 3i8s h ALA 158 Ca 0.18 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 3i8s h ALA 158 Cb 0.31 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3i8s h ALA 158 CO -0.00 0.53 0.16 1.25 0.00 0.00 0.00 179.25 181.18 3i8s h LEU 159 N 0.85 0.68 -0.80 0.00 5.85 -0.70 -1.38 115.31 119.81 3i8s h LEU 159 Ca 0.20 -0.20 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 3i8s h LEU 159 Cb 0.19 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 3i8s h LEU 159 CO -0.02 0.70 0.19 0.11 -0.34 0.00 0.00 178.44 179.08 3i8s h LYS 160 N 0.62 1.09 -0.14 1.25 1.57 -0.93 -0.37 116.57 119.66 3i8s h LYS 160 Ca 0.15 -0.24 0.04 0.00 -1.87 0.00 0.00 60.65 58.73 3i8s h LYS 160 Cb 0.25 -0.15 -0.05 0.00 0.08 0.00 0.00 32.23 32.36 3i8s h LYS 160 CO -0.01 0.95 -0.16 1.25 -0.57 0.00 0.00 179.45 180.91 3i8s h LEU 161 N 1.04 -0.49 -0.83 2.94 5.85 -1.22 -2.04 115.31 120.56 3i8s h LEU 161 Ca 0.22 0.09 0.08 0.00 0.84 0.00 0.00 57.88 59.12 3i8s h LEU 161 Cb 0.34 0.23 -0.07 0.00 0.37 0.00 0.00 40.66 41.53 3i8s h LEU 161 CO -0.00 -0.20 0.49 0.00 -0.34 0.00 0.00 178.44 178.39 3i8s h ALA 162 N 0.87 1.18 -0.32 1.25 0.00 -0.79 -2.13 119.26 119.31 3i8s h ALA 162 Ca 0.10 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.04 3i8s h ALA 162 Cb 0.33 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3i8s h ALA 162 CO -0.25 0.15 0.20 0.82 0.00 0.00 0.00 179.25 180.17 3i8s h ILE 163 N 0.84 1.06 0.00 0.00 2.04 -0.76 -2.02 117.51 118.67 3i8s h ILE 163 Ca 0.39 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 66.11 3i8s h ILE 163 Cb 0.31 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 3i8s h ILE 163 CO -0.22 0.08 0.00 0.47 0.00 0.00 0.00 178.15 178.47 3i8s n ASP 164 N -4.88 0.50 -0.70 1.72 10.43 -0.79 -1.65 116.55 121.18 3i8s n ASP 164 Ca -0.01 0.68 0.07 0.00 2.57 0.00 0.00 54.79 58.10 3i8s n ASP 164 Cb 0.04 -0.76 0.20 0.00 1.84 0.00 0.00 41.12 42.43 3i8s n ASP 164 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 3i8s n ARG 165 N -2.11 2.82 -1.72 -1.24 1.74 -0.83 -5.05 116.66 110.26 3i8s n ARG 165 Ca 0.01 -2.46 -0.41 0.00 -0.77 0.00 0.00 57.85 54.21 3i8s n ARG 165 Cb 0.12 -1.57 0.00 0.00 -1.02 0.00 0.00 32.46 30.00 3i8s n ARG 165 CO 0.00 0.00 0.00 2.48 -1.52 0.00 0.00 177.63 178.59 3i8s n TYR 166 N -0.19 2.42 -4.03 -1.55 4.11 -0.66 -5.00 117.16 112.27 3i8s n TYR 166 Ca 0.16 0.50 -0.12 0.00 -0.00 0.00 0.00 57.90 58.44 3i8s n TYR 166 Cb 0.67 -2.43 -0.04 0.00 -0.00 0.00 0.00 39.34 37.54 3i8s n TYR 166 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 176.86 175.27 3i8s s LYS 167 N -2.12 1.79 0.52 -3.48 -2.85 -1.26 -5.10 119.74 107.24 3i8s s LYS 167 Ca 0.58 -1.55 -0.22 0.00 -1.00 0.00 0.00 55.97 53.78 3i8s s LYS 167 Cb -0.51 0.46 -0.06 0.00 -2.06 0.00 0.00 37.83 35.67 3i8s s LYS 167 CO 0.60 -0.75 1.25 0.00 0.10 0.00 0.00 175.35 176.56 3i8s s ALA 168 N -3.36 2.83 0.68 0.59 0.00 -1.26 -4.57 121.76 116.68 3i8s s ALA 168 Ca 0.27 1.12 -0.16 0.00 0.00 0.00 0.00 51.96 53.18 3i8s s ALA 168 Cb -0.01 -3.47 0.01 0.00 0.00 0.00 0.00 23.12 19.65 3i8s s ALA 168 CO 0.15 -1.05 1.19 -0.80 0.00 0.00 0.00 175.76 175.26 3i8s s ASN 169 N -1.23 4.59 0.44 0.00 0.01 -1.26 -4.98 114.94 112.51 3i8s s ASN 169 Ca 0.69 2.31 -0.21 0.00 -0.71 0.00 0.00 52.86 54.94 3i8s s ASN 169 Cb -0.34 -2.59 -0.10 0.00 0.41 0.00 0.00 41.25 38.63 3i8s s ASN 169 CO 0.40 -1.99 0.97 -1.61 -1.51 0.00 0.00 177.10 173.36 3i8s s GLU 170 N -3.80 4.14 -0.37 -0.60 2.02 0.19 -4.93 118.70 115.36 3i8s s GLU 170 Ca 0.74 1.20 -0.06 0.00 0.02 0.00 0.00 54.97 56.87 3i8s s GLU 170 Cb -0.28 -2.20 -0.21 0.00 0.10 0.00 0.00 34.13 31.54 3i8s s GLU 170 CO 0.42 -0.11 3.22 0.27 0.02 0.00 0.00 175.26 179.07 3i8s n ASN 171 N -0.63 5.59 -4.72 -0.19 6.94 -1.26 -4.64 115.26 116.34 3i8s n ASN 171 Ca 0.07 -2.43 -0.33 0.00 -0.02 0.00 0.00 54.58 51.88 3i8s n ASN 171 Cb 0.53 -1.34 0.10 0.00 -2.36 0.00 0.00 39.78 36.72 3i8s n ASN 171 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 3i8s s VAL 172 N 1.49 2.48 0.01 3.53 -7.23 -1.26 -4.96 120.40 114.46 3i8s s VAL 172 Ca 0.62 0.21 -0.30 0.00 -1.81 0.00 0.00 61.98 60.69 3i8s s VAL 172 Cb 0.26 -2.65 -0.06 0.00 0.56 0.00 0.00 36.38 34.49 3i8s s VAL 172 CO -0.01 -0.15 1.39 -0.70 -0.31 0.00 0.00 175.10 175.31 3i8s s GLU 173 N -4.18 4.29 0.00 4.82 2.56 -1.26 -4.94 118.70 119.99 3i8s s GLU 173 Ca 0.70 1.96 0.00 0.00 0.00 0.00 0.00 54.97 57.64 3i8s s GLU 173 Cb -0.25 -3.53 0.00 0.00 2.00 0.00 0.00 34.13 32.35 3i8s s GLU 173 CO 0.48 -0.54 0.00 1.28 -0.56 0.00 0.00 175.26 175.92 3i8s n LEU 174 N 5.16 0.00 -4.74 2.70 4.77 -1.26 -4.96 117.00 118.67 3i8s n LEU 174 Ca 0.13 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.70 3i8s n LEU 174 Cb 0.44 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.48 3i8s n LEU 174 CO 0.58 0.00 0.77 -0.69 -1.33 0.00 0.00 177.39 176.73 3i8s s VAL 175 N 1.92 3.85 -0.86 4.08 1.01 -1.26 -4.93 120.40 124.21 3i8s s VAL 175 Ca 0.00 1.66 -0.07 0.00 0.00 0.00 0.00 61.98 63.57 3i8s s VAL 175 Cb 0.00 -4.06 0.22 0.00 0.00 0.00 0.00 36.38 32.54 3i8s s VAL 175 CO 0.00 0.31 0.76 -2.28 0.00 0.00 0.00 175.10 173.90 3i8s s HIS 176 N -0.46 3.82 0.41 5.22 2.46 -1.26 -5.06 115.29 120.42 3i8s s HIS 176 Ca 0.48 -2.62 -0.23 0.00 0.47 0.00 0.00 55.06 53.15 3i8s s HIS 176 Cb -0.29 -3.50 -0.09 0.00 -0.13 0.00 0.00 32.58 28.56 3i8s s HIS 176 CO 0.35 -0.87 1.02 0.71 -2.47 0.00 0.00 174.74 173.48 3i8s s TYR 177 N -0.64 3.28 0.29 3.88 1.51 -1.26 -4.90 117.35 119.51 3i8s s TYR 177 Ca 0.23 1.65 -0.30 0.00 -1.01 0.00 0.00 57.07 57.64 3i8s s TYR 177 Cb -0.12 -3.05 -0.13 0.00 -0.11 0.00 0.00 41.96 38.56 3i8s s TYR 177 CO -0.08 -0.47 1.35 0.00 -1.11 0.00 0.00 175.55 175.23 3i8s n ALA 178 N -0.22 1.21 -0.27 3.71 0.00 -1.26 -4.82 120.51 118.85 3i8s n ALA 178 Ca 0.06 0.39 0.06 0.00 0.00 0.00 0.00 53.44 53.94 3i8s n ALA 178 Cb 0.51 -2.26 0.29 0.00 0.00 0.00 0.00 19.45 17.98 3i8s n ALA 178 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 3i8s h GLN 179 N 3.40 0.88 -0.60 0.00 5.75 -2.00 -1.31 115.11 121.23 3i8s h GLN 179 Ca -0.45 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 57.99 3i8s h GLN 179 Cb 1.28 -0.20 -0.03 0.00 1.07 0.00 0.00 27.48 29.60 3i8s h GLN 179 CO 0.69 0.58 0.35 -1.35 -2.65 0.00 0.00 178.83 176.46 3i8s h PRO 180 N 0.91 0.81 -0.38 -2.39 0.11 -1.99 0.43 132.00 129.51 3i8s h PRO 180 Ca 0.39 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.43 3i8s h PRO 180 Cb 0.32 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.24 3i8s h PRO 180 CO -0.15 0.58 0.24 -0.07 -0.21 0.00 0.00 178.00 178.39 3i8s h LEU 181 N 0.83 0.44 -0.52 2.35 3.38 -1.61 -0.84 115.31 119.34 3i8s h LEU 181 Ca 0.22 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.13 3i8s h LEU 181 Cb -0.01 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 3i8s h LEU 181 CO -0.04 0.33 0.19 -0.07 0.09 0.00 0.00 178.44 178.94 3i8s h LEU 182 N 0.51 0.73 -0.11 1.67 3.38 -1.18 -0.71 115.31 119.60 3i8s h LEU 182 Ca 0.14 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 57.95 3i8s h LEU 182 Cb -0.05 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 3i8s h LEU 182 CO -0.03 0.71 -0.05 0.78 0.09 0.00 0.00 178.44 179.95 3i8s h ASN 183 N 0.70 -0.15 -0.53 -0.43 2.35 -0.60 -0.37 115.58 116.54 3i8s h ASN 183 Ca 0.17 0.04 -0.09 0.00 -0.55 0.00 0.00 56.30 55.87 3i8s h ASN 183 Cb 0.22 0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.66 3i8s h ASN 183 CO -0.01 -0.06 -0.02 -0.33 -1.65 0.00 0.00 177.43 175.36 3i8s h GLU 184 N -0.03 0.95 -0.75 0.81 4.39 -1.06 -1.07 114.58 117.81 3i8s h GLU 184 Ca 0.06 -0.31 0.00 0.00 0.34 0.00 0.00 59.36 59.45 3i8s h GLU 184 Cb 0.12 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 28.65 3i8s h GLU 184 CO -0.13 0.97 0.48 0.00 -1.16 0.00 0.00 179.01 179.17 3i8s h ALA 185 N 0.94 0.95 -0.48 3.43 0.00 -0.98 -0.90 119.26 122.24 3i8s h ALA 185 Ca 0.15 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 3i8s h ALA 185 Cb 0.55 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3i8s h ALA 185 CO 0.03 0.40 -0.15 0.22 0.00 0.00 0.00 179.25 179.75 3i8s h ASP 186 N 1.02 0.95 -0.72 0.00 -0.00 -0.91 0.54 116.42 117.30 3i8s h ASP 186 Ca 0.27 -0.37 -0.00 0.00 -0.00 0.00 0.00 57.03 56.93 3i8s h ASP 186 Cb -0.08 -0.26 -0.04 0.00 -0.00 0.00 0.00 39.33 38.96 3i8s h ASP 186 CO -0.06 1.11 0.44 0.28 -0.00 0.00 0.00 179.24 181.01 3i8s h SER 187 N 0.79 0.86 -0.23 2.28 0.02 -0.87 -0.73 113.55 115.67 3i8s h SER 187 Ca 0.12 -0.05 -0.04 0.00 -0.84 0.00 0.00 61.79 60.98 3i8s h SER 187 Cb 0.71 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.02 3i8s h SER 187 CO 0.05 0.66 -0.01 -0.07 -1.14 0.00 0.00 176.83 176.32 3i8s h LEU 188 N 1.00 0.40 -0.93 5.07 3.38 -0.83 -3.16 115.31 120.25 3i8s h LEU 188 Ca 0.26 -0.32 0.17 0.00 0.09 0.00 0.00 57.88 58.08 3i8s h LEU 188 Cb -0.05 -0.11 -0.10 0.00 0.09 0.00 0.00 40.66 40.49 3i8s h LEU 188 CO -0.05 0.63 0.52 0.00 0.09 0.00 0.00 178.44 179.63 3i8s h ALA 189 N 0.79 1.47 -0.38 1.53 0.00 -0.31 -1.93 119.26 120.44 3i8s h ALA 189 Ca 0.06 0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.10 3i8s h ALA 189 Cb 0.43 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3i8s h ALA 189 CO 0.01 -0.08 0.25 0.87 0.00 0.00 0.00 179.25 180.31 3i8s h LYS 190 N 0.69 0.33 -0.41 0.00 1.57 -1.11 -2.56 116.57 115.07 3i8s h LYS 190 Ca 0.52 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 3i8s h LYS 190 Cb 0.78 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.02 3i8s h LYS 190 CO -0.38 0.22 0.00 1.33 -0.57 0.00 0.00 179.45 180.05 3i8s n VAL 191 N -4.48 0.57 -1.62 0.50 0.24 -0.73 -4.97 118.33 107.83 3i8s n VAL 191 Ca 0.04 -0.78 -0.30 0.00 -2.04 0.00 0.00 64.34 61.26 3i8s n VAL 191 Cb 0.20 0.92 0.08 0.00 -1.47 0.00 0.00 33.84 33.57 3i8s n VAL 191 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 3i8s s MET 192 N -1.38 2.23 -0.16 7.34 -1.94 -0.97 -4.06 119.30 120.37 3i8s s MET 192 Ca 0.38 0.59 -0.40 0.00 -1.71 0.00 0.00 55.69 54.55 3i8s s MET 192 Cb 0.22 -1.94 -0.17 0.00 2.01 0.00 0.00 34.83 34.95 3i8s s MET 192 CO 0.30 -1.51 1.52 -2.30 -0.01 0.00 0.00 175.02 173.03 3i8s n PRO 193 N -3.35 0.87 0.25 2.03 -0.02 -1.26 -4.86 135.00 128.66 3i8s n PRO 193 Ca 0.07 0.32 0.11 0.00 -2.02 0.00 0.00 63.50 61.98 3i8s n PRO 193 Cb 0.57 -1.94 0.63 0.00 -0.02 0.00 0.00 33.50 32.73 3i8s n PRO 193 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3i8s h SER 194 N 5.61 0.00 1.06 2.55 4.64 -1.95 -2.33 113.55 123.13 3i8s h SER 194 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 3i8s h SER 194 Cb 1.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 3i8s h SER 194 CO 0.87 0.16 0.00 -0.90 -0.87 0.00 0.00 176.83 176.09 3i8s n ASP 195 N -3.58 0.28 -4.71 4.97 5.75 -1.26 -4.71 116.55 113.29 3i8s n ASP 195 Ca -0.01 0.53 -0.42 0.00 -0.01 0.00 0.00 54.79 54.88 3i8s n ASP 195 Cb 0.30 -0.61 -0.03 0.00 -1.03 0.00 0.00 41.12 39.76 3i8s n ASP 195 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 3i8s s ILE 196 N -3.05 4.38 0.40 2.12 1.01 -0.88 -4.99 121.20 120.19 3i8s s ILE 196 Ca 0.12 1.70 -0.24 0.00 0.00 0.00 0.00 60.65 62.23 3i8s s ILE 196 Cb 0.15 -4.09 -0.12 0.00 0.01 0.00 0.00 42.46 38.41 3i8s s ILE 196 CO 0.51 0.10 0.85 -2.65 0.00 0.00 0.00 174.94 173.75 3i8s n PRO 197 N 4.21 1.06 -0.21 2.79 -0.02 -1.26 -4.67 135.00 136.90 3i8s n PRO 197 Ca 0.08 0.38 -0.01 0.00 -2.02 0.00 0.00 63.50 61.93 3i8s n PRO 197 Cb 0.48 -1.82 0.10 0.00 -0.02 0.00 0.00 33.50 32.24 3i8s n PRO 197 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3i8s h LEU 198 N 1.32 0.41 -0.82 2.45 5.85 -1.94 -0.69 115.31 121.90 3i8s h LEU 198 Ca -0.42 0.05 0.11 0.00 0.84 0.00 0.00 57.88 58.46 3i8s h LEU 198 Cb 1.36 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 42.29 3i8s h LEU 198 CO 0.55 0.26 0.45 0.11 -0.34 0.00 0.00 178.44 179.48 3i8s h LYS 199 N 0.56 0.71 -0.06 1.25 1.57 -1.89 0.24 116.57 118.94 3i8s h LYS 199 Ca 0.30 -0.04 -0.19 0.00 -1.87 0.00 0.00 60.65 58.84 3i8s h LYS 199 Cb 0.27 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 3i8s h LYS 199 CO -0.23 0.47 -0.78 1.96 -0.57 0.00 0.00 179.45 180.30 3i8s h GLN 200 N 0.73 0.39 -0.59 3.15 4.20 -1.49 -1.04 115.11 120.46 3i8s h GLN 200 Ca 0.41 -0.34 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 3i8s h GLN 200 Cb 0.44 0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.27 3i8s h GLN 200 CO -0.28 0.99 0.29 0.00 -0.67 0.00 0.00 178.83 179.17 3i8s h ARG 201 N 0.26 0.85 -0.61 1.46 3.08 -0.48 0.19 114.38 119.13 3i8s h ARG 201 Ca -0.04 -0.12 -0.09 0.00 0.07 0.00 0.00 59.98 59.80 3i8s h ARG 201 Cb 1.37 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 31.24 3i8s h ARG 201 CO 0.13 0.68 0.02 0.00 -1.07 0.00 0.00 179.97 179.73 3i8s h ARG 202 N 0.81 1.06 -0.19 0.04 3.08 -0.73 -0.51 114.38 117.94 3i8s h ARG 202 Ca 0.20 -0.32 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 3i8s h ARG 202 Cb 0.11 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 3i8s h ARG 202 CO -0.03 1.02 0.09 2.35 -1.07 0.00 0.00 179.97 182.33 3i8s h TRP 203 N 0.97 0.28 -0.69 3.04 7.01 -1.02 -2.20 115.95 123.35 3i8s h TRP 203 Ca 0.18 -0.02 0.07 0.00 2.11 0.00 0.00 58.89 61.23 3i8s h TRP 203 Cb 0.53 -0.08 -0.06 0.00 -2.10 0.00 0.00 29.16 27.44 3i8s h TRP 203 CO 0.04 0.30 0.37 -0.07 -2.79 0.00 0.00 178.44 176.29 3i8s h LEU 204 N 0.17 0.52 -0.43 0.65 3.38 -0.73 -0.47 115.31 118.40 3i8s h LEU 204 Ca 0.06 0.04 0.08 0.00 0.09 0.00 0.00 57.88 58.15 3i8s h LEU 204 Cb 0.13 -0.06 -0.07 0.00 0.09 0.00 0.00 40.66 40.76 3i8s h LEU 204 CO -0.01 0.33 0.00 1.23 0.09 0.00 0.00 178.44 180.08 3i8s h GLY 205 N 0.66 0.43 1.19 0.83 0.00 -0.83 -0.54 103.07 104.82 3i8s h GLY 205 Ca 0.32 0.05 -0.11 0.00 0.00 0.00 0.00 47.33 47.59 3i8s h GLY 205 CO -0.21 -0.11 -0.12 1.41 0.00 0.00 0.00 176.54 177.51 3i8s h LEU 206 N 0.11 0.94 -0.95 3.11 3.38 -0.95 -1.86 115.31 119.10 3i8s h LEU 206 Ca 0.21 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 3i8s h LEU 206 Cb 0.31 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 3i8s h LEU 206 CO -0.35 1.07 0.48 1.56 0.09 0.00 0.00 178.44 181.28 3i8s h GLN 207 N 0.84 1.21 -0.43 1.13 1.08 -0.72 -0.84 115.11 117.38 3i8s h GLN 207 Ca 0.13 -0.14 -0.11 0.00 -1.45 0.00 0.00 58.65 57.08 3i8s h GLN 207 Cb 0.66 -0.24 -0.01 0.00 -0.05 0.00 0.00 27.48 27.84 3i8s h GLN 207 CO 0.05 0.89 -0.17 0.52 -0.95 0.00 0.00 178.83 179.16 3i8s h MET 208 N 1.22 0.88 -0.34 1.46 2.86 -0.81 -0.44 114.93 119.76 3i8s h MET 208 Ca 0.31 -0.37 -0.03 0.00 -2.06 0.00 0.00 59.70 57.54 3i8s h MET 208 Cb 0.03 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 3i8s h MET 208 CO -0.05 1.01 0.07 -0.07 1.06 0.00 0.00 176.91 178.93 3i8s h LEU 209 N 0.71 0.46 -1.11 1.22 3.38 -1.03 -1.51 115.31 117.43 3i8s h LEU 209 Ca 0.10 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3i8s h LEU 209 Cb 0.73 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.36 3i8s h LEU 209 CO 0.06 0.48 0.00 -0.08 0.09 0.00 0.00 178.44 178.99 3i8s h GLU 210 N 0.50 0.00 0.00 1.13 4.81 -0.81 -3.41 114.58 116.79 3i8s h GLU 210 Ca 0.12 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 3i8s h GLU 210 Cb 0.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.60 3i8s h GLU 210 CO -0.00 0.00 0.00 0.41 -0.73 0.00 0.00 179.01 178.69 3i8s n GLY 211 N -0.11 1.05 3.63 1.92 0.00 -0.57 -4.90 105.19 106.22 3i8s n GLY 211 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 3i8s n GLY 211 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3i8s s ASP 212 N -2.00 6.47 0.10 1.61 -1.08 -0.21 -4.90 116.67 116.67 3i8s s ASP 212 Ca 0.00 1.60 -0.13 0.00 -0.52 0.00 0.00 52.55 53.50 3i8s s ASP 212 Cb 0.00 -2.53 -0.13 0.00 -1.46 0.00 0.00 42.92 38.80 3i8s s ASP 212 CO 0.00 -1.18 1.35 0.40 0.52 0.00 0.00 175.17 176.26 3i8s h ILE 213 N 6.04 1.29 -0.84 4.11 1.08 -1.88 -3.28 117.51 124.03 3i8s h ILE 213 Ca -0.32 -1.82 -0.04 0.00 -0.39 0.00 0.00 64.86 62.29 3i8s h ILE 213 Cb 1.14 1.83 -0.04 0.00 -3.07 0.00 0.00 36.82 36.68 3i8s h ILE 213 CO 1.00 0.58 0.38 0.22 -0.69 0.00 0.00 178.15 179.65 3i8s h TYR 214 N 0.55 1.23 -0.08 1.37 3.20 -1.92 -2.48 116.97 118.83 3i8s h TYR 214 Ca -0.02 -0.07 0.02 0.00 3.14 0.00 0.00 58.73 61.81 3i8s h TYR 214 Cb 1.24 -0.38 -0.00 0.00 1.54 0.00 0.00 36.73 39.13 3i8s h TYR 214 CO 0.08 0.90 0.09 0.77 -1.64 0.00 0.00 178.16 178.36 3i8s h SER 215 N 1.20 0.00 -0.46 -2.11 0.02 -1.94 -1.10 113.55 109.16 3i8s h SER 215 Ca 0.29 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.20 3i8s h SER 215 Cb 0.15 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.66 3i8s h SER 215 CO -0.03 0.00 0.17 0.03 -1.14 0.00 0.00 176.83 175.86 3i8s h ARG 216 N 0.00 0.76 -0.64 3.45 3.08 -1.56 -2.48 114.38 116.98 3i8s h ARG 216 Ca 0.04 -0.13 0.10 0.00 0.07 0.00 0.00 59.98 60.06 3i8s h ARG 216 Cb 0.22 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.11 3i8s h ARG 216 CO -0.00 0.65 0.43 0.00 -1.07 0.00 0.00 179.97 179.98 3i8s h ALA 217 N 1.45 1.97 0.00 0.04 0.00 -1.32 -1.96 119.26 119.45 3i8s h ALA 217 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3i8s h ALA 217 Cb 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3i8s h ALA 217 CO -0.01 -0.12 0.00 1.88 0.00 0.00 0.00 179.25 181.00 3i8s h TYR 218 N 0.47 0.00 -0.01 0.00 -1.99 -1.54 -3.37 116.97 110.52 3i8s h TYR 218 Ca 0.30 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.03 3i8s h TYR 218 Cb 0.54 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.27 3i8s h TYR 218 CO -0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 178.16 178.01 3i8s n ALA 219 N -2.08 2.86 -0.71 3.88 0.00 -0.73 -4.64 120.51 119.08 3i8s n ALA 219 Ca 0.03 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.01 3i8s n ALA 219 Cb 0.49 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.84 3i8s n ALA 219 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i8s n GLY 220 N 1.28 3.50 0.28 0.00 0.00 -1.25 -1.69 105.19 107.31 3i8s n GLY 220 Ca 0.15 0.05 0.16 0.00 0.00 0.00 0.00 46.02 46.38 3i8s n GLY 220 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3i8s h GLU 221 N 0.00 0.00 -0.75 1.61 4.39 -1.94 -2.92 114.58 114.97 3i8s h GLU 221 Ca 0.00 0.00 0.16 0.00 0.34 0.00 0.00 59.36 59.86 3i8s h GLU 221 Cb 0.00 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.60 3i8s h GLU 221 CO 0.00 0.07 0.51 0.00 -1.16 0.00 0.00 179.01 178.43 3i8s h ALA 222 N 1.93 2.22 0.00 3.43 0.00 -1.47 -2.31 119.26 123.05 3i8s h ALA 222 Ca -0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3i8s h ALA 222 Cb 0.36 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 3i8s h ALA 222 CO 0.01 -0.43 -0.04 1.03 0.00 0.00 0.00 179.25 179.83 3i8s h SER 223 N 0.34 0.00 0.69 0.00 0.87 -1.69 -0.31 113.55 113.44 3i8s h SER 223 Ca 0.37 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.93 3i8s h SER 223 Cb 0.95 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.91 3i8s h SER 223 CO -0.10 0.04 0.00 0.00 -0.53 0.00 0.00 176.83 176.23 3i8s n GLN 224 N -4.03 0.13 0.00 2.24 1.13 -0.87 -3.24 117.38 112.74 3i8s n GLN 224 Ca -0.03 0.35 0.06 0.00 -1.94 0.00 0.00 57.00 55.44 3i8s n GLN 224 Cb 0.12 -1.74 0.03 0.00 0.11 0.00 0.00 30.24 28.77 3i8s n GLN 224 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 3i8s n HIS 225 N -1.97 0.00 -0.10 1.08 8.25 -0.13 -4.66 115.22 117.69 3i8s n HIS 225 Ca 0.03 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.36 3i8s n HIS 225 Cb 0.22 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.29 3i8s n HIS 225 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3i8s h LEU 226 N 1.97 0.77 -0.78 2.41 5.85 -1.52 -1.91 115.31 122.10 3i8s h LEU 226 Ca 0.00 -0.47 0.00 0.00 0.84 0.00 0.00 57.88 58.25 3i8s h LEU 226 Cb 0.46 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.24 3i8s h LEU 226 CO 0.00 1.08 0.50 0.44 -0.34 0.00 0.00 178.44 180.12 3i8s h ASP 227 N 0.47 0.91 -0.66 1.25 3.32 -1.83 0.53 116.42 120.42 3i8s h ASP 227 Ca 0.05 -0.04 -0.08 0.00 0.02 0.00 0.00 57.03 56.97 3i8s h ASP 227 Cb 0.86 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.15 3i8s h ASP 227 CO 0.07 0.68 0.08 0.00 -1.72 0.00 0.00 179.24 178.35 3i8s h ALA 228 N 1.27 0.89 -0.29 3.45 0.00 -1.85 -1.56 119.26 121.17 3i8s h ALA 228 Ca 0.28 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3i8s h ALA 228 Cb -0.09 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 3i8s h ALA 228 CO -0.06 0.67 0.11 0.00 0.00 0.00 0.00 179.25 179.97 3i8s h ALA 229 N 1.04 0.38 -0.37 0.00 0.00 -0.78 -2.46 119.26 117.07 3i8s h ALA 229 Ca 0.20 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3i8s h ALA 229 Cb 0.48 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3i8s h ALA 229 CO 0.02 -0.02 0.06 -0.07 0.00 0.00 0.00 179.25 179.24 3i8s h LEU 230 N 0.31 0.50 -0.13 0.00 3.38 -0.74 -1.91 115.31 116.73 3i8s h LEU 230 Ca 0.10 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3i8s h LEU 230 Cb 0.20 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3i8s h LEU 230 CO -0.01 0.53 0.06 0.00 0.09 0.00 0.00 178.44 179.12 3i8s h ALA 231 N 1.54 0.17 -0.26 1.53 0.00 -1.08 -0.05 119.26 121.10 3i8s h ALA 231 Ca 0.12 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.00 3i8s h ALA 231 Cb 0.26 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 3i8s h ALA 231 CO 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 179.25 178.98 3i8s h ARG 232 N 0.08 0.07 -0.72 0.00 3.08 -1.25 -2.17 114.38 113.47 3i8s h ARG 232 Ca 0.05 -0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.04 3i8s h ARG 232 Cb 0.13 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.13 3i8s h ARG 232 CO -0.01 0.05 0.26 -0.07 -1.07 0.00 0.00 179.97 179.13 3i8s h LEU 233 N 0.07 1.01 -1.38 3.04 3.38 -1.06 -1.74 115.31 118.63 3i8s h LEU 233 Ca 0.13 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 3i8s h LEU 233 Cb 0.17 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3i8s h LEU 233 CO -0.22 0.91 -0.17 0.03 0.09 0.00 0.00 178.44 179.09 3i8s h ARG 234 N 1.05 0.20 -0.38 1.13 3.08 -0.82 0.20 114.38 118.85 3i8s h ARG 234 Ca 0.24 -0.05 -0.15 0.00 0.07 0.00 0.00 59.98 60.09 3i8s h ARG 234 Cb 0.24 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 3i8s h ARG 234 CO -0.02 0.37 -0.35 -0.97 -1.07 0.00 0.00 179.97 177.93 3i8s h ASN 235 N 0.19 0.92 0.59 7.04 -1.24 -0.78 -3.31 115.58 118.98 3i8s h ASN 235 Ca 0.04 -0.40 -0.18 0.00 0.71 0.00 0.00 56.30 56.47 3i8s h ASN 235 Cb 0.42 -0.26 -0.01 0.00 0.73 0.00 0.00 38.32 39.19 3i8s h ASN 235 CO 0.03 1.17 -0.80 -0.33 -1.29 0.00 0.00 177.43 176.21 3i8s h GLU 236 N 0.72 0.16 -3.67 6.67 5.08 -0.68 -3.48 114.58 119.38 3i8s h GLU 236 Ca 0.07 -0.15 -0.07 0.00 -1.00 0.00 0.00 59.36 58.20 3i8s h GLU 236 Cb 0.92 0.04 -0.12 0.00 0.50 0.00 0.00 28.75 30.09 3i8s h GLU 236 CO 0.09 0.87 -0.22 0.00 -1.00 0.00 0.00 179.01 178.75 3i8s s MET 237 N -3.32 1.11 -0.04 2.33 0.23 -0.00 -5.10 119.30 114.50 3i8s s MET 237 Ca -0.02 -0.98 -0.30 0.00 -1.03 0.00 0.00 55.69 53.35 3i8s s MET 237 Cb 0.11 0.41 -0.04 0.00 -1.53 0.00 0.00 34.83 33.78 3i8s s MET 237 CO 0.81 -0.41 1.22 -0.51 -2.03 0.00 0.00 175.02 174.10 3i8s s ASP 238 N -2.90 7.03 -0.75 -1.18 1.01 -1.26 -4.41 116.67 114.21 3i8s s ASP 238 Ca 0.10 1.86 -0.05 0.00 0.71 0.00 0.00 52.55 55.17 3i8s s ASP 238 Cb 0.03 -2.56 0.01 0.00 1.01 0.00 0.00 42.92 41.40 3i8s s ASP 238 CO -0.05 -0.59 0.64 -0.67 0.21 0.00 0.00 175.17 174.70 3i8s n ASP 239 N 5.17 -5.89 -0.19 0.27 -0.08 -1.26 -4.73 116.55 109.84 3i8s n ASP 239 Ca 0.11 -0.57 0.10 0.00 -1.51 0.00 0.00 54.79 52.93 3i8s n ASP 239 Cb 0.46 -2.87 0.40 0.00 2.34 0.00 0.00 41.12 41.45 3i8s n ASP 239 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3i8s h PRO 240 N 0.27 0.62 -0.48 -0.67 0.11 -1.86 -1.56 132.00 128.42 3i8s h PRO 240 Ca -0.42 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.59 3i8s h PRO 240 Cb 1.27 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 3i8s h PRO 240 CO 0.33 0.41 0.06 0.00 -0.21 0.00 0.00 178.00 178.59 3i8s h ALA 241 N 1.62 1.21 -0.05 -0.75 0.00 -1.89 -1.39 119.26 118.01 3i8s h ALA 241 Ca 0.35 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 3i8s h ALA 241 Cb 0.51 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3i8s h ALA 241 CO -0.13 0.53 -0.60 1.25 0.00 0.00 0.00 179.25 180.30 3i8s h LEU 242 N 0.72 0.21 -1.09 0.00 5.85 -1.66 -2.82 115.31 116.50 3i8s h LEU 242 Ca 0.15 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 3i8s h LEU 242 Cb 0.35 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 3i8s h LEU 242 CO 0.01 0.76 0.21 0.45 -0.34 0.00 0.00 178.44 179.53 3i8s h HIS 243 N 0.14 0.86 0.34 1.25 3.86 -0.42 0.12 115.15 121.29 3i8s h HIS 243 Ca -0.01 -0.05 -0.01 0.00 -1.16 0.00 0.00 60.37 59.13 3i8s h HIS 243 Cb 1.09 -0.26 0.00 0.00 1.06 0.00 0.00 27.41 29.30 3i8s h HIS 243 CO 0.02 0.68 -0.18 0.82 0.86 0.00 0.00 177.93 180.13 3i8s h ILE 244 N 0.84 0.63 -0.63 2.45 2.04 -1.26 -1.40 117.51 120.19 3i8s h ILE 244 Ca 0.20 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.04 3i8s h ILE 244 Cb 0.20 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 36.88 3i8s h ILE 244 CO -0.01 0.00 0.32 0.00 0.00 0.00 0.00 178.15 178.46 3i8s h ALA 245 N 0.18 0.81 -0.63 1.87 0.00 -1.30 -2.85 119.26 117.35 3i8s h ALA 245 Ca -0.04 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 3i8s h ALA 245 Cb 0.38 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3i8s h ALA 245 CO 0.06 0.35 0.05 -0.44 0.00 0.00 0.00 179.25 179.27 3i8s h ASP 246 N 0.86 1.04 -0.66 0.00 3.32 -0.72 -1.51 116.42 118.76 3i8s h ASP 246 Ca 0.22 -0.29 0.07 0.00 0.02 0.00 0.00 57.03 57.06 3i8s h ASP 246 Cb 0.08 -0.28 -0.06 0.00 0.22 0.00 0.00 39.33 39.29 3i8s h ASP 246 CO -0.03 1.07 0.34 0.00 -1.72 0.00 0.00 179.24 178.89 3i8s h ALA 247 N 1.01 0.89 -0.03 3.45 0.00 -1.06 0.99 119.26 124.51 3i8s h ALA 247 Ca 0.18 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 3i8s h ALA 247 Cb 0.51 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 3i8s h ALA 247 CO 0.02 -0.03 0.01 0.00 0.00 0.00 0.00 179.25 179.26 3i8s h ARG 248 N 0.60 0.05 -0.47 0.00 3.08 -1.15 -1.71 114.38 114.77 3i8s h ARG 248 Ca 0.31 -0.01 -0.07 0.00 0.07 0.00 0.00 59.98 60.29 3i8s h ARG 248 Cb 0.27 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 3i8s h ARG 248 CO -0.23 0.18 0.02 1.88 -1.07 0.00 0.00 179.97 180.75 3i8s h TYR 249 N -0.10 0.81 -0.63 3.04 0.05 -1.01 -1.90 116.97 117.23 3i8s h TYR 249 Ca 0.01 -0.10 -0.04 0.00 0.05 0.00 0.00 58.73 58.65 3i8s h TYR 249 Cb 0.15 -0.22 -0.03 0.00 1.01 0.00 0.00 36.73 37.64 3i8s h TYR 249 CO -0.03 0.74 0.23 1.96 -1.05 0.00 0.00 178.16 180.01 3i8s h GLN 250 N 0.72 0.96 -0.16 4.88 1.08 -0.63 0.28 115.11 122.22 3i8s h GLN 250 Ca 0.15 -0.19 0.02 0.00 -1.45 0.00 0.00 58.65 57.18 3i8s h GLN 250 Cb 0.41 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 27.67 3i8s h GLN 250 CO 0.01 0.82 0.02 0.00 -0.95 0.00 0.00 178.83 178.73 3i8s h ILE 252 N 0.08 1.27 -0.84 0.00 2.04 -1.08 -1.88 117.51 117.10 3i8s h ILE 252 Ca 0.08 -1.13 0.05 0.00 1.00 0.00 0.00 64.86 64.86 3i8s h ILE 252 Cb 0.08 1.04 -0.06 0.00 -0.74 0.00 0.00 36.82 37.15 3i8s h ILE 252 CO -0.11 0.39 0.52 0.00 0.00 0.00 0.00 178.15 178.95 3i8s h ALA 253 N 0.91 1.13 -0.49 1.87 0.00 -0.78 -0.61 119.26 121.29 3i8s h ALA 253 Ca 0.13 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 3i8s h ALA 253 Cb 0.56 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3i8s h ALA 253 CO 0.03 0.30 0.01 0.00 0.00 0.00 0.00 179.25 179.59 3i8s h ALA 254 N 1.38 0.66 -0.00 0.00 0.00 -0.86 -1.18 119.26 119.26 3i8s h ALA 254 Ca 0.35 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3i8s h ALA 254 Cb 0.11 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 3i8s h ALA 254 CO -0.15 0.46 -0.01 0.82 0.00 0.00 0.00 179.25 180.37 3i8s h ILE 255 N 0.73 0.98 -0.04 0.00 2.04 -1.06 -3.10 117.51 117.05 3i8s h ILE 255 Ca 0.14 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.93 3i8s h ILE 255 Cb 0.50 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 3i8s h ILE 255 CO 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 178.15 177.86 3i8s h ASP 257 N 0.07 0.56 0.08 0.00 3.32 -1.14 -1.54 116.42 117.78 3i8s h ASP 257 Ca 0.01 -0.01 -0.21 0.00 0.02 0.00 0.00 57.03 56.84 3i8s h ASP 257 Cb 0.59 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.00 3i8s h ASP 257 CO 0.04 0.40 -1.06 0.58 -1.72 0.00 0.00 179.24 177.48 3i8s h VAL 258 N 0.66 1.22 0.08 -1.35 2.07 -1.34 -3.42 116.25 114.16 3i8s h VAL 258 Ca 0.20 -2.38 -0.26 0.00 0.82 0.00 0.00 66.70 65.08 3i8s h VAL 258 Cb 0.01 2.83 -0.01 0.00 -1.52 0.00 0.00 31.29 32.60 3i8s h VAL 258 CO -0.05 0.63 -1.23 0.58 0.02 0.00 0.00 177.57 177.52 3i8s h VAL 259 N -0.53 1.48 -3.62 2.57 2.07 -1.04 -3.44 116.25 113.74 3i8s h VAL 259 Ca -0.23 -3.12 -0.65 0.00 0.82 0.00 0.00 66.70 63.51 3i8s h VAL 259 Cb 1.55 2.86 -0.23 0.00 -1.52 0.00 0.00 31.29 33.95 3i8s h VAL 259 CO 0.03 0.89 -0.63 -0.55 0.02 0.00 0.00 177.57 177.32 3i8s s SER 260 N -6.92 5.07 0.20 0.57 0.15 -0.59 -0.24 113.70 111.95 3i8s s SER 260 Ca -0.03 -0.22 0.08 0.00 0.70 0.00 0.00 55.95 56.48 3i8s s SER 260 Cb 0.08 -1.91 -0.05 0.00 -1.71 0.00 0.00 66.02 62.44 3i8s s SER 260 CO 0.85 -0.03 -0.15 0.20 1.20 0.00 0.00 173.24 175.31 3i8s s ASN 261 N 1.60 2.59 0.31 5.45 0.02 -0.50 -4.73 114.94 119.68 3i8s s ASN 261 Ca 0.06 -0.99 -0.29 0.00 -1.02 0.00 0.00 52.86 50.62 3i8s s ASN 261 Cb -0.15 -0.14 -0.10 0.00 0.02 0.00 0.00 41.25 40.88 3i8s s ASN 261 CO 0.03 -0.14 1.35 -0.89 0.02 0.00 0.00 177.10 177.47 3i8s s THR 262 N -2.79 2.68 0.16 1.60 2.01 -1.26 -1.66 115.64 116.38 3i8s s THR 262 Ca 0.21 0.65 0.05 0.00 0.31 0.00 0.00 61.69 62.91 3i8s s THR 262 Cb -0.02 -3.41 -0.16 0.00 0.01 0.00 0.00 72.50 68.91 3i8s s THR 262 CO 0.07 0.14 1.36 0.25 -0.69 0.00 0.00 174.62 175.75 3i8s h LEU 263 N 3.86 0.13 0.00 4.42 5.85 -1.69 -3.43 115.31 124.45 3i8s h LEU 263 Ca -0.48 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.12 3i8s h LEU 263 Cb 1.22 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.21 3i8s h LEU 263 CO 0.69 0.97 0.00 0.41 -0.34 0.00 0.00 178.44 180.17