#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rcu s LYS 3 N 0.00 3.87 -0.15 1.64 1.02 -1.26 -2.91 119.74 121.94 1rcu s LYS 3 Ca 0.00 -0.38 -0.01 0.00 0.02 0.00 0.00 55.97 55.60 1rcu s LYS 3 Cb 0.00 -3.66 -0.01 0.00 -0.52 0.00 0.00 37.83 33.64 1rcu s LYS 3 CO 0.00 -0.22 -0.11 0.54 -0.92 0.00 0.00 175.35 174.64 1rcu s VAL 4 N 1.74 3.14 -0.17 3.17 0.11 -0.82 0.94 120.40 128.52 1rcu s VAL 4 Ca 0.07 -0.61 -0.09 0.00 -2.93 0.00 0.00 61.98 58.41 1rcu s VAL 4 Cb -0.16 -2.35 -0.05 0.00 -1.53 0.00 0.00 36.38 32.29 1rcu s VAL 4 CO 0.10 0.50 0.15 -0.69 -3.33 0.00 0.00 175.10 171.84 1rcu s VAL 5 N 0.62 5.43 -0.06 2.04 1.01 -0.37 -1.95 120.40 127.12 1rcu s VAL 5 Ca -0.06 0.24 0.05 0.00 0.00 0.00 0.00 61.98 62.20 1rcu s VAL 5 Cb -0.15 -3.46 -0.02 0.00 0.00 0.00 0.00 36.38 32.75 1rcu s VAL 5 CO 0.03 0.50 -0.21 0.68 0.00 0.00 0.00 175.10 176.10 1rcu s VAL 6 N -0.13 2.45 0.05 2.92 -7.23 -0.56 -0.03 120.40 117.87 1rcu s VAL 6 Ca 0.11 -0.93 0.01 0.00 -1.81 0.00 0.00 61.98 59.36 1rcu s VAL 6 Cb -0.12 -1.92 -0.03 0.00 0.56 0.00 0.00 36.38 34.87 1rcu s VAL 6 CO 0.01 0.57 -0.06 0.68 -0.31 0.00 0.00 175.10 175.99 1rcu s VAL 7 N -0.35 0.43 -1.42 1.32 -7.23 -0.22 -4.45 120.40 108.47 1rcu s VAL 7 Ca 0.02 -1.27 0.00 0.00 -1.81 0.00 0.00 61.98 58.92 1rcu s VAL 7 Cb -0.12 -0.82 0.00 0.00 0.56 0.00 0.00 36.38 36.00 1rcu s VAL 7 CO 0.02 -0.57 0.00 0.61 -0.31 0.00 0.00 175.10 174.85 1rcu n GLY 8 N 1.08 -1.11 3.41 2.32 0.00 -1.26 -1.51 105.19 108.11 1rcu n GLY 8 Ca -0.20 -0.88 -0.44 0.00 0.00 0.00 0.00 46.02 44.50 1rcu n GLY 8 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1rcu n TYR 9 N 2.56 -0.81 -4.37 1.61 4.01 -1.21 -4.67 117.16 114.29 1rcu n TYR 9 Ca 0.00 0.71 -0.26 0.00 -0.16 0.00 0.00 57.90 58.19 1rcu n TYR 9 Cb 0.00 -1.94 -0.09 0.00 -0.31 0.00 0.00 39.34 36.99 1rcu n TYR 9 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1rcu s SER 10 N -0.94 4.15 0.00 7.72 1.04 -1.26 -0.06 113.70 124.35 1rcu s SER 10 Ca 0.62 -1.22 0.00 0.00 0.48 0.00 0.00 55.95 55.82 1rcu s SER 10 Cb -0.71 -0.44 0.00 0.00 0.10 0.00 0.00 66.02 64.97 1rcu s SER 10 CO 0.59 -0.50 0.00 0.61 0.98 0.00 0.00 173.24 174.92 1rcu n GLY 11 N -1.11 1.01 3.65 7.32 0.00 -1.26 -4.69 105.19 110.12 1rcu n GLY 11 Ca -0.03 -2.24 -0.57 0.00 0.00 0.00 0.00 46.02 43.19 1rcu n GLY 11 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rcu n PRO 12 N -0.58 0.91 -0.00 1.61 -0.04 -1.26 -1.86 135.00 133.78 1rcu n PRO 12 Ca 0.00 0.33 0.14 0.00 -0.04 0.00 0.00 63.50 63.93 1rcu n PRO 12 Cb 0.00 -1.96 0.78 0.00 -0.04 0.00 0.00 33.50 32.27 1rcu n PRO 12 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1rcu n VAL 13 N 3.52 0.01 0.31 0.52 3.14 -1.26 -3.49 118.33 121.08 1rcu n VAL 13 Ca 0.24 -0.05 0.04 0.00 -2.96 0.00 0.00 64.34 61.60 1rcu n VAL 13 Cb 0.12 -0.29 0.02 0.00 -1.06 0.00 0.00 33.84 32.64 1rcu n VAL 13 CO 0.00 0.00 0.00 -0.46 -6.46 0.00 0.00 176.83 169.91 1rcu n ASN 14 N -0.74 1.43 -4.56 6.55 0.23 -1.26 -4.31 115.26 112.61 1rcu n ASN 14 Ca 0.21 -1.22 -0.26 0.00 -0.53 0.00 0.00 54.58 52.78 1rcu n ASN 14 Cb 0.14 0.14 -0.11 0.00 -2.08 0.00 0.00 39.78 37.87 1rcu n ASN 14 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 1rcu s LYS 15 N -0.75 1.84 0.52 -3.83 1.02 -1.23 -4.72 119.74 112.60 1rcu s LYS 15 Ca 0.08 -2.03 -0.23 0.00 0.02 0.00 0.00 55.97 53.81 1rcu s LYS 15 Cb 0.06 -1.37 -0.06 0.00 -0.52 0.00 0.00 37.83 35.94 1rcu s LYS 15 CO 0.12 -0.09 1.37 0.43 -0.92 0.00 0.00 175.35 176.26 1rcu n SER 16 N -0.86 2.83 -0.63 2.83 7.64 -1.26 -1.28 113.62 122.89 1rcu n SER 16 Ca -0.04 1.01 0.13 0.00 1.01 0.00 0.00 58.87 60.98 1rcu n SER 16 Cb 0.67 -1.58 0.25 0.00 -1.01 0.00 0.00 64.21 62.53 1rcu n SER 16 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1rcu n PRO 17 N -0.80 1.71 0.08 1.43 -0.04 -1.26 -4.84 135.00 131.27 1rcu n PRO 17 Ca 0.09 -1.27 -0.05 0.00 -0.04 0.00 0.00 63.50 62.23 1rcu n PRO 17 Cb 0.44 -1.47 -0.09 0.00 -0.04 0.00 0.00 33.50 32.33 1rcu n PRO 17 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 1rcu h VAL 18 N 3.09 1.55 -0.95 0.52 3.04 -1.75 -3.35 116.25 118.40 1rcu h VAL 18 Ca 0.00 -3.20 0.08 0.00 -1.01 0.00 0.00 66.70 62.58 1rcu h VAL 18 Cb 0.73 2.77 -0.07 0.00 -2.01 0.00 0.00 31.29 32.71 1rcu h VAL 18 CO 0.00 0.88 0.61 0.77 -1.01 0.00 0.00 177.57 178.83 1rcu h SER 19 N 0.00 0.92 0.28 3.17 4.64 -1.38 -1.80 113.55 119.39 1rcu h SER 19 Ca -0.01 0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.29 1rcu h SER 19 Cb 1.70 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 63.61 1rcu h SER 19 CO 0.12 0.56 -0.19 -0.33 -0.87 0.00 0.00 176.83 176.12 1rcu h GLU 20 N 1.03 0.00 -0.05 4.77 3.07 -1.84 -1.39 114.58 120.17 1rcu h GLU 20 Ca 0.43 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.29 1rcu h GLU 20 Cb 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 1rcu h GLU 20 CO -0.18 0.19 0.00 1.28 -1.40 0.00 0.00 179.01 178.90 1rcu n LEU 21 N -4.05 0.66 -0.32 1.33 7.99 -0.68 -4.40 117.00 117.52 1rcu n LEU 21 Ca -0.02 -0.26 0.20 0.00 -0.01 0.00 0.00 56.01 55.92 1rcu n LEU 21 Cb 0.27 -0.03 0.38 0.00 -0.11 0.00 0.00 43.42 43.93 1rcu n LEU 21 CO 0.35 0.13 0.84 -1.14 -1.51 0.00 0.00 177.39 176.06 1rcu n ARG 22 N -0.39 -0.07 0.10 3.23 0.63 -0.53 -1.44 116.66 118.19 1rcu n ARG 22 Ca 0.17 1.39 -0.23 0.00 -0.92 0.00 0.00 57.85 58.26 1rcu n ARG 22 Cb 0.18 -2.30 -0.15 0.00 0.45 0.00 0.00 32.46 30.64 1rcu n ARG 22 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1rcu h ASP 23 N 0.00 0.67 0.01 6.15 3.32 -1.84 -2.70 116.42 122.03 1rcu h ASP 23 Ca 0.66 -0.93 -0.07 0.00 0.02 0.00 0.00 57.03 56.71 1rcu h ASP 23 Cb 1.52 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.84 1rcu h ASP 23 CO -0.84 1.59 -0.18 0.16 -1.72 0.00 0.00 179.24 178.25 1rcu h ILE 24 N -0.08 1.22 0.23 0.35 -2.65 -1.73 -0.17 117.51 114.68 1rcu h ILE 24 Ca -0.22 -1.00 -0.01 0.00 1.03 0.00 0.00 64.86 64.66 1rcu h ILE 24 Cb 1.94 1.28 0.00 0.00 -2.05 0.00 0.00 36.82 37.99 1rcu h ILE 24 CO 0.21 0.31 -0.11 0.00 0.03 0.00 0.00 178.15 178.60 1rcu h LEU 26 N -0.83 0.93 -0.30 0.00 3.38 -1.47 -0.94 115.31 116.08 1rcu h LEU 26 Ca -0.03 -0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.75 1rcu h LEU 26 Cb 0.51 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 1rcu h LEU 26 CO 0.05 0.63 -0.50 -0.08 0.09 0.00 0.00 178.44 178.63 1rcu h GLU 27 N 1.07 0.88 -0.59 1.13 4.81 -1.02 -1.61 114.58 119.24 1rcu h GLU 27 Ca 0.35 -0.54 -0.02 0.00 -0.13 0.00 0.00 59.36 59.02 1rcu h GLU 27 Cb 0.06 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.47 1rcu h GLU 27 CO -0.11 1.18 0.29 1.25 -0.73 0.00 0.00 179.01 180.88 1rcu h LEU 28 N 0.66 0.77 0.30 1.64 5.85 -0.57 -1.11 115.31 122.85 1rcu h LEU 28 Ca 0.02 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.62 1rcu h LEU 28 Cb 1.11 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.92 1rcu h LEU 28 CO 0.11 0.69 -0.35 1.23 -0.34 0.00 0.00 178.44 179.78 1rcu h GLY 29 N 0.81 -0.79 1.04 3.75 0.00 -0.99 0.67 103.07 107.55 1rcu h GLY 29 Ca 0.20 0.41 -0.00 0.00 0.00 0.00 0.00 47.33 47.94 1rcu h GLY 29 CO -0.03 -0.29 0.58 3.21 0.00 0.00 0.00 176.54 180.02 1rcu h ARG 30 N -0.70 1.28 -0.10 4.80 3.08 -0.84 -1.56 114.38 120.34 1rcu h ARG 30 Ca -0.01 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 1rcu h ARG 30 Cb 0.65 -0.27 -0.00 0.00 0.08 0.00 0.00 29.97 30.42 1rcu h ARG 30 CO -0.10 0.88 0.00 1.15 -1.07 0.00 0.00 179.97 180.84 1rcu h THR 31 N 1.30 1.24 -0.65 2.04 2.02 -1.00 0.16 112.91 118.02 1rcu h THR 31 Ca 0.34 -0.77 0.11 0.00 0.77 0.00 0.00 66.41 66.86 1rcu h THR 31 Cb -0.08 1.57 -0.08 0.00 -1.74 0.00 0.00 68.15 67.82 1rcu h THR 31 CO -0.07 0.22 0.23 -0.07 0.37 0.00 0.00 175.52 176.20 1rcu h LEU 32 N -0.10 0.20 -0.04 2.58 3.38 -0.60 -0.90 115.31 119.83 1rcu h LEU 32 Ca 0.03 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1rcu h LEU 32 Cb 0.34 0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 1rcu h LEU 32 CO 0.00 0.10 0.01 0.00 0.09 0.00 0.00 178.44 178.64 1rcu h ALA 33 N 1.47 0.05 0.00 1.53 0.00 -1.08 -2.10 119.26 119.13 1rcu h ALA 33 Ca 0.34 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1rcu h ALA 33 Cb 0.47 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 1rcu h ALA 33 CO -0.36 -0.31 -0.05 0.87 0.00 0.00 0.00 179.25 179.40 1rcu h LYS 34 N -0.19 0.00 0.00 0.00 1.57 -0.21 -0.30 116.57 117.44 1rcu h LYS 34 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1rcu h LYS 34 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1rcu h LYS 34 CO 0.00 0.05 0.00 1.63 -0.57 0.00 0.00 179.45 180.56 1rcu n LYS 35 N -4.37 0.51 -0.51 3.15 4.76 -0.39 -4.90 118.16 116.43 1rcu n LYS 35 Ca -0.03 0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.42 1rcu n LYS 35 Cb 0.13 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.82 1rcu n LYS 35 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1rcu n GLY 36 N 1.13 0.75 3.77 0.72 0.00 -0.12 -5.05 105.19 106.39 1rcu n GLY 36 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 1rcu n GLY 36 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1rcu s TYR 37 N -2.85 3.29 -0.08 1.61 2.02 -0.80 -4.80 117.35 115.75 1rcu s TYR 37 Ca 0.00 1.63 -0.22 0.00 -0.37 0.00 0.00 57.07 58.12 1rcu s TYR 37 Cb 0.00 -3.24 -0.04 0.00 -0.40 0.00 0.00 41.96 38.28 1rcu s TYR 37 CO 0.00 -0.80 0.64 -1.17 -1.57 0.00 0.00 175.55 172.64 1rcu s LEU 38 N -2.29 4.31 -0.08 -1.29 2.96 -1.15 -4.43 118.68 116.71 1rcu s LEU 38 Ca 0.54 1.09 0.01 0.00 -0.22 0.00 0.00 54.13 55.55 1rcu s LEU 38 Cb -0.27 -2.97 -0.03 0.00 0.50 0.00 0.00 46.19 43.42 1rcu s LEU 38 CO 0.34 -0.08 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.51 1rcu s VAL 39 N 0.71 3.41 0.05 1.68 1.01 -1.01 -1.94 120.40 124.32 1rcu s VAL 39 Ca 0.34 -0.57 0.08 0.00 0.00 0.00 0.00 61.98 61.83 1rcu s VAL 39 Cb -0.17 -2.39 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 1rcu s VAL 39 CO 0.16 0.57 -0.23 -0.36 0.00 0.00 0.00 175.10 175.24 1rcu s PHE 40 N -0.45 2.02 0.26 5.22 0.40 -0.82 0.24 117.98 124.85 1rcu s PHE 40 Ca 0.06 -0.39 -0.18 0.00 -0.60 0.00 0.00 56.93 55.82 1rcu s PHE 40 Cb -0.12 -1.19 0.01 0.00 0.51 0.00 0.00 43.02 42.23 1rcu s PHE 40 CO 0.02 0.13 0.62 0.54 0.70 0.00 0.00 175.22 177.23 1rcu s ASN 41 N -1.31 -0.20 0.00 1.36 2.20 -0.88 -1.50 114.94 114.61 1rcu s ASN 41 Ca 0.09 -0.71 0.01 0.00 -0.94 0.00 0.00 52.86 51.30 1rcu s ASN 41 Cb -0.09 0.67 0.03 0.00 -2.00 0.00 0.00 41.25 39.86 1rcu s ASN 41 CO 0.02 -1.26 0.22 0.61 -2.94 0.00 0.00 177.10 173.75 1rcu n GLY 42 N -0.43 -0.15 3.11 0.45 0.00 -1.26 -1.32 105.19 105.59 1rcu n GLY 42 Ca -0.03 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1rcu n GLY 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rcu n GLY 43 N -0.38 0.00 0.00 -0.02 0.00 -1.26 -4.54 105.19 98.99 1rcu n GLY 43 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1rcu n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rcu n ARG 44 N -0.56 3.64 0.00 1.61 5.12 -1.26 -0.94 116.66 124.27 1rcu n ARG 44 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1rcu n ARG 44 Cb 0.06 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.36 1rcu n ARG 44 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 1rcu n ASP 45 N 0.00 0.49 0.00 0.55 5.75 -1.26 -3.84 116.55 118.24 1rcu n ASP 45 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1rcu n ASP 45 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1rcu n ASP 45 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1rcu n GLY 46 N 5.00 1.33 1.44 6.12 0.00 -0.78 -3.66 105.19 114.64 1rcu n GLY 46 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.31 1rcu n GLY 46 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1rcu n VAL 47 N 0.00 0.00 0.00 1.61 0.31 0.91 -3.09 118.33 118.07 1rcu n VAL 47 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1rcu n VAL 47 Cb 0.00 -0.34 0.00 0.00 -0.91 0.00 0.00 33.84 32.59 1rcu n VAL 47 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1rcu n GLU 49 N 0.97 0.00 -0.07 5.55 2.13 -1.24 -1.98 120.64 126.00 1rcu n GLU 49 Ca 0.00 0.00 -0.07 0.00 0.66 0.00 0.00 57.16 57.75 1rcu n GLU 49 Cb 0.00 0.00 0.12 0.00 0.27 0.00 0.00 31.44 31.83 1rcu n GLU 49 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1rcu h LEU 50 N 0.00 0.72 -0.93 4.31 3.38 -1.90 0.16 115.31 121.05 1rcu h LEU 50 Ca 0.00 -0.25 -0.10 0.00 0.09 0.00 0.00 57.88 57.62 1rcu h LEU 50 Cb 0.00 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1rcu h LEU 50 CO 0.00 0.92 -0.29 0.58 0.09 0.00 0.00 178.44 179.74 1rcu h VAL 51 N 0.62 1.27 0.11 1.22 2.07 -1.55 0.20 116.25 120.20 1rcu h VAL 51 Ca 0.09 -1.32 -0.01 0.00 0.82 0.00 0.00 66.70 66.28 1rcu h VAL 51 Cb 0.70 1.43 0.00 0.00 -1.52 0.00 0.00 31.29 31.90 1rcu h VAL 51 CO 0.05 0.41 -0.05 0.28 0.02 0.00 0.00 177.57 178.29 1rcu h SER 52 N 0.38 -0.12 -0.79 0.57 0.02 -1.64 -1.93 113.55 110.03 1rcu h SER 52 Ca 0.05 -0.22 0.09 0.00 -0.84 0.00 0.00 61.79 60.87 1rcu h SER 52 Cb 0.71 0.03 -0.05 0.00 0.14 0.00 0.00 62.40 63.23 1rcu h SER 52 CO 0.05 0.16 0.52 -0.61 -1.14 0.00 0.00 176.83 175.81 1rcu h GLN 53 N -0.41 0.72 -0.01 3.45 4.15 -0.41 -1.35 115.11 121.25 1rcu h GLN 53 Ca -0.01 -0.04 -0.12 0.00 0.77 0.00 0.00 58.65 59.24 1rcu h GLN 53 Cb 0.34 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 27.85 1rcu h GLN 53 CO 0.02 0.48 -0.56 0.78 -1.93 0.00 0.00 178.83 177.62 1rcu h GLY 54 N 0.75 0.04 1.34 2.39 0.00 -0.34 -1.26 103.07 105.98 1rcu h GLY 54 Ca 0.36 -0.04 -0.21 0.00 0.00 0.00 0.00 47.33 47.43 1rcu h GLY 54 CO -0.14 0.04 -0.79 -2.08 0.00 0.00 0.00 176.54 173.57 1rcu h VAL 55 N 0.03 1.32 -0.05 4.60 2.07 -0.47 -2.50 116.25 121.24 1rcu h VAL 55 Ca -0.00 -2.07 -0.24 0.00 0.82 0.00 0.00 66.70 65.20 1rcu h VAL 55 Cb 1.00 2.08 0.01 0.00 -1.52 0.00 0.00 31.29 32.85 1rcu h VAL 55 CO 0.07 0.64 -0.92 0.03 0.02 0.00 0.00 177.57 177.42 1rcu h ARG 56 N 0.43 0.63 -0.17 1.57 2.47 -1.32 0.57 114.38 118.55 1rcu h ARG 56 Ca -0.05 -0.61 0.05 0.00 -1.26 0.00 0.00 59.98 58.11 1rcu h ARG 56 Cb 1.41 0.16 -0.01 0.00 -1.65 0.00 0.00 29.97 29.88 1rcu h ARG 56 CO 0.15 1.22 0.14 0.93 0.56 0.00 0.00 179.97 182.98 1rcu h GLU 57 N 0.38 0.00 -0.58 0.04 5.08 -1.26 0.26 114.58 118.50 1rcu h GLU 57 Ca -0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1rcu h GLU 57 Cb 1.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.81 1rcu h GLU 57 CO 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.19 1rcu n ALA 58 N -2.48 2.31 -2.66 3.43 0.00 -1.13 -4.99 120.51 114.99 1rcu n ALA 58 Ca 0.01 -1.23 -0.13 0.00 0.00 0.00 0.00 53.44 52.09 1rcu n ALA 58 Cb 0.27 -0.75 0.02 0.00 0.00 0.00 0.00 19.45 18.99 1rcu n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rcu n GLY 59 N 1.25 -0.03 0.00 0.00 0.00 0.93 -4.68 105.19 102.65 1rcu n GLY 59 Ca 0.20 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1rcu n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rcu n GLY 60 N -1.18 2.63 3.25 -0.02 0.00 0.19 -4.98 105.19 105.08 1rcu n GLY 60 Ca -0.07 -2.05 -0.30 0.00 0.00 0.00 0.00 46.02 43.59 1rcu n GLY 60 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rcu s THR 61 N 1.69 1.89 -0.11 2.61 2.01 -1.26 -4.59 115.64 117.88 1rcu s THR 61 Ca 0.00 -0.99 -0.03 0.00 0.31 0.00 0.00 61.69 60.98 1rcu s THR 61 Cb 0.00 -1.59 0.04 0.00 0.01 0.00 0.00 72.50 70.96 1rcu s THR 61 CO 0.00 0.53 0.05 0.54 -0.69 0.00 0.00 174.62 175.05 1rcu s VAL 62 N -0.29 0.16 -0.19 3.82 0.11 -1.26 -2.39 120.40 120.36 1rcu s VAL 62 Ca 0.02 -0.01 -0.11 0.00 -2.93 0.00 0.00 61.98 58.94 1rcu s VAL 62 Cb -0.12 -0.55 -0.05 0.00 -1.53 0.00 0.00 36.38 34.14 1rcu s VAL 62 CO 0.02 0.01 0.19 -0.69 -3.33 0.00 0.00 175.10 171.29 1rcu s VAL 63 N 2.04 5.37 -0.10 2.04 1.01 0.14 -0.84 120.40 130.06 1rcu s VAL 63 Ca 0.03 0.32 -0.02 0.00 0.00 0.00 0.00 61.98 62.30 1rcu s VAL 63 Cb -0.14 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 1rcu s VAL 63 CO -0.06 0.41 0.01 -0.83 0.00 0.00 0.00 175.10 174.62 1rcu s GLY 64 N 0.48 1.85 -0.32 4.51 0.00 -0.58 -2.07 107.32 111.20 1rcu s GLY 64 Ca 0.11 -0.80 -0.07 0.00 0.00 0.00 0.00 44.72 43.96 1rcu s GLY 64 CO 0.01 -0.50 0.10 -0.42 0.00 0.00 0.00 173.10 172.30 1rcu s ILE 65 N -0.74 4.01 0.12 0.90 -1.09 -0.44 -0.42 121.20 123.55 1rcu s ILE 65 Ca 0.12 -0.82 -0.11 0.00 -2.23 0.00 0.00 60.65 57.60 1rcu s ILE 65 Cb -0.12 -3.15 -0.06 0.00 -1.58 0.00 0.00 42.46 37.56 1rcu s ILE 65 CO 0.02 -0.03 0.47 -0.76 -1.23 0.00 0.00 174.94 173.41 1rcu s LEU 66 N 1.48 4.32 0.13 2.97 1.43 0.11 -4.03 118.68 125.09 1rcu s LEU 66 Ca 0.01 0.89 -0.30 0.00 -1.03 0.00 0.00 54.13 53.71 1rcu s LEU 66 Cb -0.18 -3.17 -0.06 0.00 0.03 0.00 0.00 46.19 42.81 1rcu s LEU 66 CO 0.03 0.12 0.98 -2.16 0.23 0.00 0.00 176.35 175.55 1rcu s PRO 67 N -2.06 4.69 0.00 1.29 0.04 -1.26 -3.09 135.00 134.61 1rcu s PRO 67 Ca 0.37 1.50 0.00 0.00 0.04 0.00 0.00 61.00 62.90 1rcu s PRO 67 Cb -0.14 -3.36 0.00 0.00 0.04 0.00 0.00 34.50 31.04 1rcu s PRO 67 CO 0.19 0.20 0.00 -3.47 0.04 0.00 0.00 177.00 173.96 1rcu n ASP 68 N 2.67 0.00 -0.45 6.66 4.64 0.29 -2.37 116.55 128.00 1rcu n ASP 68 Ca 0.02 0.00 0.05 0.00 -1.38 0.00 0.00 54.79 53.49 1rcu n ASP 68 Cb 0.49 0.00 0.09 0.00 -1.04 0.00 0.00 41.12 40.65 1rcu n ASP 68 CO 0.00 0.00 0.00 -1.84 -0.82 0.00 0.00 177.20 174.54 1rcu n GLU 69 N 0.00 0.74 -1.52 -0.67 0.28 -1.26 -2.84 120.64 115.37 1rcu n GLU 69 Ca 0.00 -2.08 -0.31 0.00 -0.16 0.00 0.00 57.16 54.61 1rcu n GLU 69 Cb 0.00 -1.01 0.06 0.00 1.43 0.00 0.00 31.44 31.92 1rcu n GLU 69 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 1rcu s GLU 70 N -1.63 2.75 0.01 3.44 2.02 -1.00 -5.02 118.70 119.27 1rcu s GLU 70 Ca 0.22 0.95 -0.22 0.00 0.02 0.00 0.00 54.97 55.95 1rcu s GLU 70 Cb 0.21 -1.97 -0.18 0.00 0.10 0.00 0.00 34.13 32.29 1rcu s GLU 70 CO -0.02 -1.23 1.22 0.00 0.02 0.00 0.00 175.26 175.25 1rcu h ALA 71 N -0.82 0.14 0.00 5.21 0.00 -1.95 -3.47 119.26 118.37 1rcu h ALA 71 Ca -0.44 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.08 1rcu h ALA 71 Cb 1.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1rcu h ALA 71 CO 0.56 0.11 0.00 0.41 0.00 0.00 0.00 179.25 180.33 1rcu n GLY 72 N 0.54 0.01 3.37 0.00 0.00 -1.26 -5.00 105.19 102.86 1rcu n GLY 72 Ca -0.08 -1.31 -0.37 0.00 0.00 0.00 0.00 46.02 44.26 1rcu n GLY 72 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1rcu n ASN 73 N -0.26 -2.17 0.00 1.61 0.23 -0.11 -4.84 115.26 109.72 1rcu n ASN 73 Ca 0.00 0.59 0.02 0.00 -0.53 0.00 0.00 54.58 54.66 1rcu n ASN 73 Cb 0.00 -1.09 0.13 0.00 -2.08 0.00 0.00 39.78 36.75 1rcu n ASN 73 CO 0.00 0.00 0.00 -0.81 -0.93 0.00 0.00 177.26 175.52 1rcu n PRO 74 N 0.18 0.60 -0.00 -0.53 -0.04 -1.26 -3.43 135.00 130.51 1rcu n PRO 74 Ca 0.09 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.63 1rcu n PRO 74 Cb 0.49 -1.12 -0.12 0.00 -0.04 0.00 0.00 33.50 32.72 1rcu n PRO 74 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1rcu n TYR 75 N -0.62 0.00 -1.63 0.54 4.01 -1.26 -5.00 117.16 113.21 1rcu n TYR 75 Ca 0.03 0.00 -0.49 0.00 -0.16 0.00 0.00 57.90 57.29 1rcu n TYR 75 Cb 0.02 -0.15 -0.05 0.00 -0.31 0.00 0.00 39.34 38.84 1rcu n TYR 75 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1rcu n LEU 76 N -1.68 2.37 -0.00 7.72 4.77 -1.22 -4.86 117.00 124.09 1rcu n LEU 76 Ca 0.01 1.11 -0.11 0.00 -0.03 0.00 0.00 56.01 56.99 1rcu n LEU 76 Cb 0.35 -1.31 0.03 0.00 -2.33 0.00 0.00 43.42 40.16 1rcu n LEU 76 CO 0.37 -0.69 0.44 0.28 -1.33 0.00 0.00 177.39 176.47 1rcu h SER 77 N 5.10 0.68 -3.56 -1.43 0.02 -1.37 -3.44 113.55 109.55 1rcu h SER 77 Ca -0.46 -0.38 -0.23 0.00 -0.84 0.00 0.00 61.79 59.89 1rcu h SER 77 Cb 1.30 -0.20 -0.30 0.00 0.14 0.00 0.00 62.40 63.34 1rcu h SER 77 CO 0.82 1.11 -0.59 -0.69 -1.14 0.00 0.00 176.83 176.35 1rcu s VAL 78 N -3.96 -0.03 -0.31 2.27 1.01 -1.22 -5.02 120.40 113.14 1rcu s VAL 78 Ca -0.08 0.11 -0.03 0.00 0.00 0.00 0.00 61.98 61.99 1rcu s VAL 78 Cb 0.11 -0.22 0.05 0.00 0.00 0.00 0.00 36.38 36.32 1rcu s VAL 78 CO 0.85 0.05 0.03 0.00 0.00 0.00 0.00 175.10 176.03 1rcu s ALA 79 N 0.76 2.89 -0.29 5.51 0.00 -1.26 -1.52 121.76 127.84 1rcu s ALA 79 Ca -0.06 -1.80 -0.14 0.00 0.00 0.00 0.00 51.96 49.97 1rcu s ALA 79 Cb -0.08 -2.04 -0.04 0.00 0.00 0.00 0.00 23.12 20.97 1rcu s ALA 79 CO -0.04 -1.31 0.30 0.08 0.00 0.00 0.00 175.76 174.79 1rcu s VAL 80 N 1.28 5.22 0.25 0.00 1.01 0.44 -4.98 120.40 123.62 1rcu s VAL 80 Ca -0.04 0.30 -0.17 0.00 0.00 0.00 0.00 61.98 62.08 1rcu s VAL 80 Cb -0.20 -3.66 -0.08 0.00 0.00 0.00 0.00 36.38 32.43 1rcu s VAL 80 CO -0.00 0.14 0.70 -0.54 0.00 0.00 0.00 175.10 175.39 1rcu s LYS 81 N 1.94 4.09 0.00 2.72 1.02 -1.26 0.08 119.74 128.33 1rcu s LYS 81 Ca 0.11 0.71 0.00 0.00 0.02 0.00 0.00 55.97 56.81 1rcu s LYS 81 Cb -0.16 -2.69 0.00 0.00 -0.52 0.00 0.00 37.83 34.46 1rcu s LYS 81 CO 0.11 0.30 0.00 0.25 -0.92 0.00 0.00 175.35 175.09 1rcu n THR 82 N 0.24 0.00 -0.56 2.17 -2.24 -1.18 -4.88 114.28 107.83 1rcu n THR 82 Ca -0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1rcu n THR 82 Cb 0.52 -0.53 0.00 0.00 -2.10 0.00 0.00 70.33 68.22 1rcu n THR 82 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rcu n GLY 83 N 3.35 0.67 3.59 3.38 0.00 -1.13 -4.89 105.19 110.16 1rcu n GLY 83 Ca 0.00 -0.47 -0.27 0.00 0.00 0.00 0.00 46.02 45.29 1rcu n GLY 83 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rcu s LEU 84 N 0.00 3.03 0.00 0.99 1.02 -1.26 -4.70 118.68 117.76 1rcu s LEU 84 Ca 0.00 -0.56 -0.16 0.00 0.02 0.00 0.00 54.13 53.44 1rcu s LEU 84 Cb 0.00 -1.70 0.22 0.00 0.02 0.00 0.00 46.19 44.73 1rcu s LEU 84 CO 0.00 0.10 0.94 -0.90 0.02 0.00 0.00 176.35 176.51 1rcu n ASP 85 N -0.02 -1.24 -0.25 2.29 5.68 -1.26 0.10 116.55 121.86 1rcu n ASP 85 Ca -0.10 -1.15 -0.01 0.00 -0.50 0.00 0.00 54.79 53.02 1rcu n ASP 85 Cb 0.56 -0.81 0.11 0.00 -1.14 0.00 0.00 41.12 39.83 1rcu n ASP 85 CO 0.00 0.00 0.00 -0.26 -1.33 0.00 0.00 177.20 175.61 1rcu h PHE 86 N -2.21 0.74 0.00 2.11 0.04 -1.97 -1.60 116.94 114.05 1rcu h PHE 86 Ca -0.34 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.46 1rcu h PHE 86 Cb 0.99 -0.23 0.00 0.00 2.20 0.00 0.00 35.95 38.91 1rcu h PHE 86 CO 0.00 0.36 0.00 1.04 -0.60 0.00 0.00 178.31 179.11 1rcu n GLN 87 N -4.76 0.71 0.00 1.51 3.00 -1.26 -2.77 117.38 113.81 1rcu n GLN 87 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 1rcu n GLN 87 Cb 0.18 -1.25 0.00 0.00 0.00 0.00 0.00 30.24 29.16 1rcu n GLN 87 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 1rcu n ARG 89 N 0.39 0.00 -0.33 -1.09 0.00 -0.60 -2.87 116.66 112.16 1rcu n ARG 89 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 57.85 57.87 1rcu n ARG 89 Cb 0.26 0.00 0.19 0.00 0.00 0.00 0.00 32.46 32.92 1rcu n ARG 89 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.63 178.40 1rcu h SER 90 N 0.00 1.00 0.64 6.15 0.02 -1.77 -0.19 113.55 119.40 1rcu h SER 90 Ca 0.00 -0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.81 1rcu h SER 90 Cb 0.00 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.30 1rcu h SER 90 CO 0.00 0.67 -0.63 -0.26 -1.14 0.00 0.00 176.83 175.47 1rcu h PHE 91 N 1.14 0.00 -0.01 3.45 0.04 -1.84 0.53 116.94 120.25 1rcu h PHE 91 Ca 0.39 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.98 1rcu h PHE 91 Cb 0.08 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.21 1rcu h PHE 91 CO -0.00 0.63 -0.81 -0.39 -0.60 0.00 0.00 178.31 177.13 1rcu h VAL 92 N 0.00 1.50 -0.14 -0.55 -1.51 -1.68 -2.92 116.25 110.95 1rcu h VAL 92 Ca -0.01 -2.56 0.00 0.00 -1.23 0.00 0.00 66.70 62.90 1rcu h VAL 92 Cb 1.12 2.40 -0.01 0.00 -2.13 0.00 0.00 31.29 32.67 1rcu h VAL 92 CO 0.08 0.74 0.09 0.25 -1.23 0.00 0.00 177.57 177.50 1rcu h LEU 93 N 0.08 0.16 -2.04 4.19 6.46 -0.69 -2.77 115.31 120.71 1rcu h LEU 93 Ca -0.03 -0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 57.69 1rcu h LEU 93 Cb 1.41 -0.04 -0.00 0.00 -0.73 0.00 0.00 40.66 41.30 1rcu h LEU 93 CO 0.12 0.14 -0.06 -0.07 -0.62 0.00 0.00 178.44 177.95 1rcu h LEU 94 N 0.17 0.00 -1.45 2.25 3.38 -0.83 -1.19 115.31 117.64 1rcu h LEU 94 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1rcu h LEU 94 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1rcu h LEU 94 CO -0.01 0.06 0.00 0.03 0.09 0.00 0.00 178.44 178.61 1rcu h ARG 95 N 0.00 0.00 -0.64 1.13 2.47 -1.29 -2.65 114.38 113.39 1rcu h ARG 95 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1rcu h ARG 95 Cb 0.12 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.44 1rcu h ARG 95 CO 0.01 0.00 0.00 0.09 0.56 0.00 0.00 179.97 180.63 1rcu n ASN 96 N -2.54 4.55 -4.51 7.04 3.02 -0.45 -4.95 115.26 117.41 1rcu n ASN 96 Ca -0.00 -2.51 -0.33 0.00 -0.03 0.00 0.00 54.58 51.71 1rcu n ASN 96 Cb 0.16 -0.58 -0.12 0.00 -0.61 0.00 0.00 39.78 38.63 1rcu n ASN 96 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1rcu s ALA 97 N -2.01 2.77 -0.12 5.41 0.00 -1.00 -4.59 121.76 122.22 1rcu s ALA 97 Ca 0.47 -0.96 0.20 0.00 0.00 0.00 0.00 51.96 51.66 1rcu s ALA 97 Cb 0.31 -1.05 -0.26 0.00 0.00 0.00 0.00 23.12 22.13 1rcu s ALA 97 CO 0.20 0.56 0.41 -0.25 0.00 0.00 0.00 175.76 176.69 1rcu n ASP 98 N 2.24 0.19 -3.60 0.00 8.00 0.27 -4.95 116.55 118.69 1rcu n ASP 98 Ca -0.17 0.08 -0.16 0.00 0.71 0.00 0.00 54.79 55.25 1rcu n ASP 98 Cb 0.52 1.23 -0.07 0.00 -0.02 0.00 0.00 41.12 42.79 1rcu n ASP 98 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1rcu s VAL 99 N -3.03 0.01 -0.11 2.53 0.11 -1.16 -4.32 120.40 114.44 1rcu s VAL 99 Ca -0.08 -0.08 0.01 0.00 -2.93 0.00 0.00 61.98 58.91 1rcu s VAL 99 Cb 0.10 -0.90 -0.01 0.00 -1.53 0.00 0.00 36.38 34.04 1rcu s VAL 99 CO 0.86 -0.04 -0.16 -0.69 -3.33 0.00 0.00 175.10 171.73 1rcu s VAL 100 N -0.72 2.79 -0.15 2.04 1.01 -0.00 -1.24 120.40 124.13 1rcu s VAL 100 Ca -0.08 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.12 1rcu s VAL 100 Cb -0.02 -2.14 -0.02 0.00 0.00 0.00 0.00 36.38 34.20 1rcu s VAL 100 CO 0.06 0.54 -0.10 -0.69 0.00 0.00 0.00 175.10 174.91 1rcu s VAL 101 N 0.24 3.30 -0.12 2.92 1.01 0.96 0.10 120.40 128.82 1rcu s VAL 101 Ca -0.11 -0.56 -0.01 0.00 0.00 0.00 0.00 61.98 61.30 1rcu s VAL 101 Cb -0.16 -2.42 -0.02 0.00 0.00 0.00 0.00 36.38 33.78 1rcu s VAL 101 CO 0.06 0.51 -0.07 -0.55 0.00 0.00 0.00 175.10 175.04 1rcu s SER 102 N 0.46 4.53 -0.06 3.32 0.15 -0.34 -1.06 113.70 120.70 1rcu s SER 102 Ca -0.07 -0.15 0.02 0.00 0.70 0.00 0.00 55.95 56.45 1rcu s SER 102 Cb -0.15 -1.51 0.02 0.00 -1.71 0.00 0.00 66.02 62.66 1rcu s SER 102 CO 0.04 0.24 -0.09 -0.63 1.20 0.00 0.00 173.24 173.99 1rcu s ILE 103 N -0.05 0.90 0.00 6.45 1.01 -0.57 -1.33 121.20 127.61 1rcu s ILE 103 Ca -0.00 -0.34 0.00 0.00 0.00 0.00 0.00 60.65 60.31 1rcu s ILE 103 Cb -0.13 -0.85 0.00 0.00 0.01 0.00 0.00 42.46 41.48 1rcu s ILE 103 CO 0.03 0.30 0.00 0.61 0.00 0.00 0.00 174.94 175.88 1rcu n GLY 104 N 3.91 2.74 0.00 6.18 0.00 -1.25 -3.29 105.19 113.48 1rcu n GLY 104 Ca -0.24 0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1rcu n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rcu n GLY 105 N 0.00 0.61 0.00 -0.02 0.00 -1.26 -1.96 105.19 102.55 1rcu n GLY 105 Ca 0.00 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.40 1rcu n GLY 105 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1rcu n GLU 106 N 0.85 3.84 -0.25 1.61 -0.58 -1.26 -1.00 120.64 123.86 1rcu n GLU 106 Ca 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 57.16 56.73 1rcu n GLU 106 Cb 0.00 0.00 0.20 0.00 -0.57 0.00 0.00 31.44 31.07 1rcu n GLU 106 CO 0.00 0.00 0.00 0.97 -0.48 0.00 0.00 177.13 177.62 1rcu h ILE 107 N 0.00 1.21 -0.73 -3.67 6.09 -1.99 -1.93 117.51 116.49 1rcu h ILE 107 Ca 0.00 -0.44 0.07 0.00 -1.37 0.00 0.00 64.86 63.11 1rcu h ILE 107 Cb 0.00 0.09 -0.06 0.00 0.47 0.00 0.00 36.82 37.32 1rcu h ILE 107 CO 0.00 0.22 0.42 1.23 -3.07 0.00 0.00 178.15 176.95 1rcu h GLY 108 N 1.09 1.09 1.50 8.18 0.00 -1.97 -0.40 103.07 112.57 1rcu h GLY 108 Ca 0.28 -0.29 -0.12 0.00 0.00 0.00 0.00 47.33 47.20 1rcu h GLY 108 CO -0.06 0.17 -0.37 -0.84 0.00 0.00 0.00 176.54 175.45 1rcu h THR 109 N 0.76 1.29 -0.45 4.70 2.02 -1.75 -2.24 112.91 117.24 1rcu h THR 109 Ca 0.33 -1.50 -0.03 0.00 0.77 0.00 0.00 66.41 65.98 1rcu h THR 109 Cb 0.21 1.50 -0.02 0.00 -1.74 0.00 0.00 68.15 68.10 1rcu h THR 109 CO -0.19 0.48 0.16 0.00 0.37 0.00 0.00 175.52 176.34 1rcu h ALA 110 N 1.14 0.59 -0.88 6.16 0.00 -0.54 0.83 119.26 126.55 1rcu h ALA 110 Ca 0.05 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1rcu h ALA 110 Cb 0.85 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 1rcu h ALA 110 CO 0.07 0.21 0.52 0.82 0.00 0.00 0.00 179.25 180.87 1rcu h ILE 111 N 0.58 1.25 -0.48 0.00 2.04 -0.98 -0.66 117.51 119.27 1rcu h ILE 111 Ca 0.15 -0.56 -0.08 0.00 1.00 0.00 0.00 64.86 65.37 1rcu h ILE 111 Cb 0.22 0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.31 1rcu h ILE 111 CO -0.01 0.27 -0.01 -0.33 0.00 0.00 0.00 178.15 178.07 1rcu h GLU 112 N 1.22 0.84 -0.28 2.37 5.08 -0.84 0.31 114.58 123.29 1rcu h GLU 112 Ca 0.32 -0.27 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1rcu h GLU 112 Cb -0.03 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1rcu h GLU 112 CO -0.06 0.89 0.17 0.82 -1.00 0.00 0.00 179.01 179.84 1rcu h ILE 113 N 0.70 1.09 -0.43 3.13 2.04 -0.45 0.27 117.51 123.87 1rcu h ILE 113 Ca 0.13 -0.21 -0.11 0.00 1.00 0.00 0.00 64.86 65.67 1rcu h ILE 113 Cb 0.52 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 1rcu h ILE 113 CO 0.03 0.09 -0.17 -0.07 0.00 0.00 0.00 178.15 178.03 1rcu h LEU 114 N 0.36 0.83 -0.78 1.44 4.07 -1.00 -2.88 115.31 117.35 1rcu h LEU 114 Ca 0.10 -0.28 -0.11 0.00 0.08 0.00 0.00 57.88 57.66 1rcu h LEU 114 Cb 0.00 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.50 1rcu h LEU 114 CO -0.02 0.99 -0.31 1.23 -1.08 0.00 0.00 178.44 179.25 1rcu h GLY 115 N 0.96 0.61 0.88 0.83 0.00 0.08 -1.80 103.07 104.62 1rcu h GLY 115 Ca 0.11 -0.55 0.03 0.00 0.00 0.00 0.00 47.33 46.92 1rcu h GLY 115 CO 0.05 0.50 0.37 0.00 0.00 0.00 0.00 176.54 177.46 1rcu h ALA 116 N 1.18 0.78 -0.63 3.60 0.00 -0.32 -1.32 119.26 122.55 1rcu h ALA 116 Ca 0.06 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 1rcu h ALA 116 Cb 0.78 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1rcu h ALA 116 CO 0.06 0.11 0.04 -0.92 0.00 0.00 0.00 179.25 178.54 1rcu h TYR 117 N 0.73 1.17 0.00 0.00 5.03 -1.28 0.14 116.97 122.77 1rcu h TYR 117 Ca 0.24 -0.19 -0.06 0.00 2.58 0.00 0.00 58.73 61.30 1rcu h TYR 117 Cb 0.02 -0.31 -0.01 0.00 1.55 0.00 0.00 36.73 37.98 1rcu h TYR 117 CO -0.05 1.01 -0.30 0.00 -1.32 0.00 0.00 178.16 177.50 1rcu h ALA 118 N 1.01 1.28 -0.00 1.82 0.00 -0.90 -2.11 119.26 120.35 1rcu h ALA 118 Ca 0.18 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1rcu h ALA 118 Cb 0.52 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1rcu h ALA 118 CO 0.02 0.38 -0.29 1.28 0.00 0.00 0.00 179.25 180.64 1rcu n LEU 119 N -3.85 0.50 0.00 0.00 4.77 -0.54 -4.94 117.00 112.94 1rcu n LEU 119 Ca -0.01 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1rcu n LEU 119 Cb 0.38 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1rcu n LEU 119 CO 0.36 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1rcu n GLY 120 N 1.43 0.78 3.69 -0.72 0.00 -0.70 -5.06 105.19 104.61 1rcu n GLY 120 Ca 0.09 -0.21 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 1rcu n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rcu s LYS 121 N -0.70 4.28 0.30 1.61 -0.14 0.42 -4.85 119.74 120.66 1rcu s LYS 121 Ca 0.00 0.54 -0.29 0.00 -1.36 0.00 0.00 55.97 54.85 1rcu s LYS 121 Cb 0.00 -3.51 -0.11 0.00 -1.68 0.00 0.00 37.83 32.53 1rcu s LYS 121 CO 0.00 -0.04 1.52 -1.25 -0.76 0.00 0.00 175.35 174.81 1rcu s PRO 122 N 1.26 4.17 -0.08 -1.68 0.04 -1.26 -4.20 135.00 133.25 1rcu s PRO 122 Ca 0.28 2.49 0.02 0.00 0.04 0.00 0.00 61.00 63.83 1rcu s PRO 122 Cb -0.16 -3.03 -0.02 0.00 0.04 0.00 0.00 34.50 31.33 1rcu s PRO 122 CO 0.11 -0.53 -0.15 0.08 0.04 0.00 0.00 177.00 176.55 1rcu s VAL 123 N -0.34 2.97 -0.25 -0.36 1.01 -1.22 -0.82 120.40 121.38 1rcu s VAL 123 Ca 0.59 -0.73 -0.01 0.00 0.00 0.00 0.00 61.98 61.83 1rcu s VAL 123 Cb -0.46 -2.19 0.03 0.00 0.00 0.00 0.00 36.38 33.77 1rcu s VAL 123 CO 0.51 0.56 -0.08 -0.63 0.00 0.00 0.00 175.10 175.46 1rcu s ILE 124 N -0.25 2.68 -0.11 2.22 1.01 0.12 0.10 121.20 126.97 1rcu s ILE 124 Ca 0.01 -1.17 -0.23 0.00 0.00 0.00 0.00 60.65 59.26 1rcu s ILE 124 Cb -0.13 -2.40 -0.03 0.00 0.01 0.00 0.00 42.46 39.91 1rcu s ILE 124 CO 0.03 0.15 0.69 -0.76 0.00 0.00 0.00 174.94 175.05 1rcu s LEU 125 N 1.27 4.26 -0.84 2.97 1.43 0.16 -1.20 118.68 126.74 1rcu s LEU 125 Ca -0.02 1.09 -0.17 0.00 -1.03 0.00 0.00 54.13 54.01 1rcu s LEU 125 Cb -0.17 -3.04 0.17 0.00 0.03 0.00 0.00 46.19 43.18 1rcu s LEU 125 CO -0.05 -0.18 0.90 -0.22 0.23 0.00 0.00 176.35 177.03 1rcu s LEU 126 N 1.21 5.89 0.58 1.79 2.96 -0.44 -0.61 118.68 130.06 1rcu s LEU 126 Ca 0.35 -2.26 -0.20 0.00 -0.22 0.00 0.00 54.13 51.80 1rcu s LEU 126 Cb -0.17 -2.30 -0.03 0.00 0.50 0.00 0.00 46.19 44.19 1rcu s LEU 126 CO 0.15 -0.84 1.28 -0.13 -1.32 0.00 0.00 176.35 175.49 1rcu s ARG 127 N 1.52 2.95 0.00 1.98 1.81 0.25 -3.43 118.95 124.04 1rcu s ARG 127 Ca 0.23 2.03 0.00 0.00 -1.72 0.00 0.00 55.73 56.27 1rcu s ARG 127 Cb -0.10 -2.04 0.00 0.00 -0.45 0.00 0.00 34.95 32.36 1rcu s ARG 127 CO -0.07 -1.28 0.00 0.41 -0.68 0.00 0.00 175.30 173.68 1rcu n GLY 128 N 0.70 0.86 0.24 -3.53 0.00 -1.26 -4.68 105.19 97.52 1rcu n GLY 128 Ca 0.13 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.28 1rcu n GLY 128 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rcu n THR 129 N -2.00 0.00 -3.26 2.61 -2.24 -1.22 -5.04 114.28 103.13 1rcu n THR 129 Ca 0.00 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1rcu n THR 129 Cb 0.00 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 1rcu n THR 129 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rcu n GLY 130 N 1.33 -0.30 7.00 3.38 0.00 -1.26 -3.88 105.19 111.46 1rcu n GLY 130 Ca 0.12 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.90 1rcu n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rcu n GLY 131 N 0.00 0.73 0.30 -0.02 0.00 -1.26 -1.99 105.19 102.95 1rcu n GLY 131 Ca 0.00 -0.72 0.19 0.00 0.00 0.00 0.00 46.02 45.49 1rcu n GLY 131 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1rcu h TRP 132 N 0.00 0.00 -0.74 1.61 4.06 -1.00 -2.62 115.95 117.26 1rcu h TRP 132 Ca 0.00 0.00 0.03 0.00 2.06 0.00 0.00 58.89 60.98 1rcu h TRP 132 Cb 0.00 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.11 1rcu h TRP 132 CO 0.00 0.01 0.47 1.15 -3.56 0.00 0.00 178.44 176.51 1rcu h THR 133 N 0.00 1.10 0.20 1.49 2.02 -1.00 0.11 112.91 116.83 1rcu h THR 133 Ca -0.00 -0.31 -0.33 0.00 0.77 0.00 0.00 66.41 66.54 1rcu h THR 133 Cb 0.32 0.11 0.02 0.00 -1.74 0.00 0.00 68.15 66.87 1rcu h THR 133 CO 0.00 0.17 -1.56 0.44 0.37 0.00 0.00 175.52 174.94 1rcu h ASP 134 N 0.91 0.65 -0.83 4.18 3.45 -1.25 -3.35 116.42 120.17 1rcu h ASP 134 Ca 0.30 -0.81 0.00 0.00 0.43 0.00 0.00 57.03 56.95 1rcu h ASP 134 Cb 0.02 -0.21 -0.04 0.00 -0.56 0.00 0.00 39.33 38.54 1rcu h ASP 134 CO -0.11 1.66 0.54 -0.09 -1.57 0.00 0.00 179.24 179.66 1rcu h ARG 135 N 0.11 1.10 0.00 3.56 2.43 -1.19 -2.59 114.38 117.81 1rcu h ARG 135 Ca -0.27 -0.08 -0.03 0.00 -0.81 0.00 0.00 59.98 58.79 1rcu h ARG 135 Cb 2.10 -0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 31.41 1rcu h ARG 135 CO 0.22 0.74 -0.14 0.97 -1.51 0.00 0.00 179.97 180.25 1rcu h ILE 136 N 1.13 0.53 0.00 1.20 6.09 -0.92 -2.67 117.51 122.87 1rcu h ILE 136 Ca 0.30 -0.65 0.00 0.00 -1.37 0.00 0.00 64.86 63.14 1rcu h ILE 136 Cb -0.11 1.43 0.00 0.00 0.47 0.00 0.00 36.82 38.62 1rcu h ILE 136 CO -0.06 0.14 0.00 0.77 -3.07 0.00 0.00 178.15 175.92 1rcu h SER 137 N 0.00 0.00 0.95 2.19 4.64 -1.59 -2.77 113.55 116.97 1rcu h SER 137 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rcu h SER 137 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1rcu h SER 137 CO 0.02 0.00 -0.09 0.00 -0.87 0.00 0.00 176.83 175.89 1rcu n GLN 138 N -2.75 0.02 -0.60 4.77 1.13 -1.01 -3.81 117.38 115.14 1rcu n GLN 138 Ca 0.00 0.02 0.06 0.00 -1.94 0.00 0.00 57.00 55.14 1rcu n GLN 138 Cb 0.21 -1.52 0.20 0.00 0.11 0.00 0.00 30.24 29.23 1rcu n GLN 138 CO 0.00 0.00 0.00 1.33 -1.44 0.00 0.00 177.06 176.95 1rcu n VAL 139 N -1.56 2.11 -2.77 5.09 0.24 -1.04 -5.04 118.33 115.35 1rcu n VAL 139 Ca 0.07 -3.11 -0.42 0.00 -2.04 0.00 0.00 64.34 58.84 1rcu n VAL 139 Cb 0.35 -0.20 -0.03 0.00 -1.47 0.00 0.00 33.84 32.49 1rcu n VAL 139 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1rcu s LEU 140 N -3.10 4.30 0.01 1.34 1.43 -1.25 -4.89 118.68 116.52 1rcu s LEU 140 Ca 0.37 1.50 -0.30 0.00 -1.03 0.00 0.00 54.13 54.67 1rcu s LEU 140 Cb 0.36 -3.46 -0.05 0.00 0.03 0.00 0.00 46.19 43.07 1rcu s LEU 140 CO -0.07 -0.31 1.28 -0.63 0.23 0.00 0.00 176.35 176.86 1rcu s ILE 141 N 1.41 3.92 -1.55 -0.59 1.01 -0.27 -2.28 121.20 122.85 1rcu s ILE 141 Ca 0.47 1.32 0.00 0.00 0.00 0.00 0.00 60.65 62.45 1rcu s ILE 141 Cb -0.19 -3.85 0.00 0.00 0.01 0.00 0.00 42.46 38.43 1rcu s ILE 141 CO 0.22 0.04 0.00 0.47 0.00 0.00 0.00 174.94 175.66 1rcu n ASP 142 N 4.80 -4.73 -0.18 3.58 8.00 -1.26 -1.60 116.55 125.16 1rcu n ASP 142 Ca 0.11 0.36 -0.02 0.00 0.71 0.00 0.00 54.79 55.95 1rcu n ASP 142 Cb 0.45 -3.99 -0.01 0.00 -0.02 0.00 0.00 41.12 37.55 1rcu n ASP 142 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rcu n GLY 143 N -0.13 0.40 0.00 0.44 0.00 -0.97 -4.75 105.19 100.19 1rcu n GLY 143 Ca -0.15 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1rcu n GLY 143 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1rcu n LYS 144 N -0.86 1.77 -4.42 1.61 5.02 -0.75 -4.91 118.16 115.62 1rcu n LYS 144 Ca -0.02 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.06 1rcu n LYS 144 Cb 0.34 -0.16 -0.10 0.00 -0.02 0.00 0.00 35.03 35.09 1rcu n LYS 144 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1rcu s TYR 145 N -0.07 1.96 -1.13 2.13 2.02 -0.63 -0.29 117.35 121.35 1rcu s TYR 145 Ca 0.00 -0.59 0.14 0.00 -0.37 0.00 0.00 57.07 56.25 1rcu s TYR 145 Cb 0.00 -1.01 -0.03 0.00 -0.40 0.00 0.00 41.96 40.51 1rcu s TYR 145 CO 0.00 0.40 0.72 1.28 -1.57 0.00 0.00 175.55 176.38 1rcu n LEU 146 N -0.54 1.29 -3.57 -1.29 7.99 -1.26 -1.11 117.00 118.51 1rcu n LEU 146 Ca -0.06 -0.71 -0.08 0.00 -0.01 0.00 0.00 56.01 55.14 1rcu n LEU 146 Cb 0.62 0.00 -0.02 0.00 -0.11 0.00 0.00 43.42 43.91 1rcu n LEU 146 CO 0.38 0.26 0.59 1.51 -1.51 0.00 0.00 177.39 178.62 1rcu s ASP 147 N -1.80 -0.37 0.00 -1.43 3.84 -1.26 -4.97 116.67 110.68 1rcu s ASP 147 Ca 0.10 -0.15 0.01 0.00 -0.00 0.00 0.00 52.55 52.52 1rcu s ASP 147 Cb 0.11 0.51 0.09 0.00 -1.38 0.00 0.00 42.92 42.24 1rcu s ASP 147 CO 0.38 -0.86 0.44 0.59 -0.00 0.00 0.00 175.17 175.73 1rcu n ASN 148 N -0.35 0.00 -0.80 2.11 5.03 -1.26 -1.56 115.26 118.43 1rcu n ASN 148 Ca -0.10 -0.64 0.10 0.00 0.87 0.00 0.00 54.58 54.81 1rcu n ASN 148 Cb 0.62 0.00 0.09 0.00 -1.02 0.00 0.00 39.78 39.48 1rcu n ASN 148 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1rcu n ARG 149 N -0.57 1.78 -3.93 3.52 1.74 -1.26 -4.98 116.66 112.96 1rcu n ARG 149 Ca 0.01 -1.72 -0.29 0.00 -0.77 0.00 0.00 57.85 55.08 1rcu n ARG 149 Cb 0.01 -1.38 -0.03 0.00 -1.02 0.00 0.00 32.46 30.03 1rcu n ARG 149 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1rcu n ARG 150 N 1.11 -0.70 -0.06 5.56 3.00 -0.60 -4.83 116.66 120.14 1rcu n ARG 150 Ca 0.12 -0.01 -0.07 0.00 -0.01 0.00 0.00 57.85 57.88 1rcu n ARG 150 Cb 0.49 -2.19 -0.01 0.00 0.00 0.00 0.00 32.46 30.76 1rcu n ARG 150 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.63 178.45 1rcu h ILE 151 N -1.17 0.49 -3.07 0.55 2.04 -1.87 -3.45 117.51 111.03 1rcu h ILE 151 Ca -0.52 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.28 1rcu h ILE 151 Cb 1.06 0.49 -0.15 0.00 -0.74 0.00 0.00 36.82 37.48 1rcu h ILE 151 CO 0.47 0.00 -0.02 0.54 0.00 0.00 0.00 178.15 179.14 1rcu s VAL 152 N -6.13 0.05 0.39 1.67 0.11 -1.26 -4.93 120.40 110.29 1rcu s VAL 152 Ca -0.14 -0.39 -0.23 0.00 -2.93 0.00 0.00 61.98 58.28 1rcu s VAL 152 Cb 0.12 -1.04 -0.10 0.00 -1.53 0.00 0.00 36.38 33.84 1rcu s VAL 152 CO 0.69 -0.21 0.97 -0.70 -3.33 0.00 0.00 175.10 172.52 1rcu s GLU 153 N -3.04 4.32 -0.33 1.54 2.12 -1.26 -4.75 118.70 117.30 1rcu s GLU 153 Ca -0.02 1.30 -0.10 0.00 0.36 0.00 0.00 54.97 56.51 1rcu s GLU 153 Cb 0.00 -2.48 0.00 0.00 0.26 0.00 0.00 34.13 31.91 1rcu s GLU 153 CO -0.06 0.04 0.17 0.42 -0.54 0.00 0.00 175.26 175.28 1rcu s ILE 154 N -1.85 4.62 0.23 -3.70 -1.09 0.60 -3.44 121.20 116.57 1rcu s ILE 154 Ca 0.57 -0.52 -0.08 0.00 -2.23 0.00 0.00 60.65 58.39 1rcu s ILE 154 Cb -0.16 -3.41 -0.07 0.00 -1.58 0.00 0.00 42.46 37.25 1rcu s ILE 154 CO 0.20 -0.01 0.53 -1.00 -1.23 0.00 0.00 174.94 173.43 1rcu s HIS 155 N 1.60 3.44 -0.06 3.97 3.76 0.28 -4.70 115.29 123.59 1rcu s HIS 155 Ca 0.04 0.78 0.06 0.00 -0.15 0.00 0.00 55.06 55.78 1rcu s HIS 155 Cb -0.18 -2.19 -0.01 0.00 1.11 0.00 0.00 32.58 31.32 1rcu s HIS 155 CO 0.06 0.27 -0.23 -0.65 -0.85 0.00 0.00 174.74 173.34 1rcu s GLN 156 N -2.96 2.39 -0.01 1.40 -0.21 -1.26 0.40 119.66 119.42 1rcu s GLN 156 Ca 0.46 -0.83 0.00 0.00 0.02 0.00 0.00 55.36 55.01 1rcu s GLN 156 Cb -0.11 -2.02 0.01 0.00 1.00 0.00 0.00 33.01 31.88 1rcu s GLN 156 CO 0.24 0.34 0.01 0.00 -2.12 0.00 0.00 175.29 173.75 1rcu s ALA 157 N -0.08 0.04 -2.29 6.09 0.00 0.22 -4.92 121.76 120.82 1rcu s ALA 157 Ca -0.05 0.07 0.22 0.00 0.00 0.00 0.00 51.96 52.20 1rcu s ALA 157 Cb -0.13 -0.07 0.41 0.00 0.00 0.00 0.00 23.12 23.33 1rcu s ALA 157 CO 0.04 -0.02 1.37 0.91 0.00 0.00 0.00 175.76 178.05 1rcu n TRP 158 N 3.35 0.49 -3.78 0.00 7.02 -1.26 -0.58 117.44 122.68 1rcu n TRP 158 Ca -0.16 -0.27 -0.13 0.00 -1.02 0.00 0.00 57.50 55.93 1rcu n TRP 158 Cb 0.57 -0.00 -0.09 0.00 -2.42 0.00 0.00 31.31 29.37 1rcu n TRP 158 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 1rcu s THR 159 N -1.40 0.06 0.21 -0.99 2.01 -1.26 -4.85 115.64 109.42 1rcu s THR 159 Ca 0.37 -0.52 -0.10 0.00 0.31 0.00 0.00 61.69 61.75 1rcu s THR 159 Cb 0.22 -0.58 0.15 0.00 0.01 0.00 0.00 72.50 72.29 1rcu s THR 159 CO 0.30 -0.28 1.85 0.58 -0.69 0.00 0.00 174.62 176.38 1rcu h VAL 160 N 3.93 1.21 -0.62 3.82 2.07 -1.94 0.37 116.25 125.09 1rcu h VAL 160 Ca -0.30 -0.44 -0.05 0.00 0.82 0.00 0.00 66.70 66.73 1rcu h VAL 160 Cb 1.18 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 1rcu h VAL 160 CO 0.40 0.21 0.17 -0.08 0.02 0.00 0.00 177.57 178.30 1rcu h GLU 161 N 1.02 0.96 -0.59 1.57 4.81 -1.98 -1.77 114.58 118.60 1rcu h GLU 161 Ca 0.27 -0.20 -0.10 0.00 -0.13 0.00 0.00 59.36 59.20 1rcu h GLU 161 Cb -0.06 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.16 1rcu h GLU 161 CO -0.05 0.84 -0.01 1.49 -0.73 0.00 0.00 179.01 180.54 1rcu h GLU 162 N 0.92 1.04 0.37 1.92 4.81 -1.66 -2.37 114.58 119.61 1rcu h GLU 162 Ca 0.20 -0.33 -0.02 0.00 -0.13 0.00 0.00 59.36 59.08 1rcu h GLU 162 Cb 0.29 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.58 1rcu h GLU 162 CO -0.00 1.02 -0.18 0.00 -0.73 0.00 0.00 179.01 179.12 1rcu h ALA 163 N 1.02 -0.50 -0.72 2.92 0.00 0.28 -2.02 119.26 120.25 1rcu h ALA 163 Ca 0.17 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1rcu h ALA 163 Cb 0.56 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 1rcu h ALA 163 CO 0.03 -0.76 0.33 0.28 0.00 0.00 0.00 179.25 179.14 1rcu h VAL 164 N -0.54 1.23 -0.62 0.00 2.07 -1.38 -1.37 116.25 115.64 1rcu h VAL 164 Ca -0.05 -0.67 0.10 0.00 0.82 0.00 0.00 66.70 66.90 1rcu h VAL 164 Cb 0.41 0.32 -0.07 0.00 -1.52 0.00 0.00 31.29 30.43 1rcu h VAL 164 CO 0.08 0.28 0.22 -0.61 0.02 0.00 0.00 177.57 177.57 1rcu h GLN 165 N 1.02 0.39 -0.58 1.57 4.15 -1.24 0.14 115.11 120.56 1rcu h GLN 165 Ca 0.25 -0.02 -0.08 0.00 0.77 0.00 0.00 58.65 59.57 1rcu h GLN 165 Cb 0.12 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.70 1rcu h GLN 165 CO -0.03 0.26 0.05 0.82 -1.93 0.00 0.00 178.83 178.00 1rcu h ILE 166 N 0.40 1.25 -0.63 2.39 2.04 -0.58 -0.29 117.51 122.09 1rcu h ILE 166 Ca 0.31 -1.03 -0.05 0.00 1.00 0.00 0.00 64.86 65.09 1rcu h ILE 166 Cb 0.40 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 1rcu h ILE 166 CO -0.32 0.38 0.21 0.40 0.00 0.00 0.00 178.15 178.82 1rcu h ILE 167 N 0.90 1.25 -0.33 -0.67 2.04 0.04 -1.54 117.51 119.20 1rcu h ILE 167 Ca 0.18 -0.82 -0.04 0.00 1.00 0.00 0.00 64.86 65.17 1rcu h ILE 167 Cb 0.46 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 1rcu h ILE 167 CO 0.02 0.32 0.05 -0.33 0.00 0.00 0.00 178.15 178.21 1rcu h GLU 168 N 0.91 0.55 0.00 2.37 5.08 -0.53 -1.01 114.58 121.95 1rcu h GLU 168 Ca 0.21 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1rcu h GLU 168 Cb 0.27 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1rcu h GLU 168 CO -0.01 0.63 0.00 1.04 -1.00 0.00 0.00 179.01 179.67 1rcu n GLN 169 N -4.60 0.00 -0.79 2.33 6.02 -0.14 -5.11 117.38 115.09 1rcu n GLN 169 Ca -0.02 0.43 0.00 0.00 -0.01 0.00 0.00 57.00 57.41 1rcu n GLN 169 Cb 0.22 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.98 1rcu n GLN 169 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16