#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i50 s VAL 2 N 0.00 3.55 -0.08 2.62 1.01 -1.26 -4.23 120.40 122.00 3i50 s VAL 2 Ca 0.00 0.81 -0.03 0.00 0.00 0.00 0.00 61.98 62.77 3i50 s VAL 2 Cb 0.00 -3.31 0.04 0.00 0.00 0.00 0.00 36.38 33.11 3i50 s VAL 2 CO 0.00 -0.35 0.10 -0.75 0.00 0.00 0.00 175.10 174.10 3i50 s LYS 3 N -3.76 -0.01 -0.47 2.72 2.20 -0.49 -4.95 119.74 114.98 3i50 s LYS 3 Ca 0.67 0.37 0.03 0.00 -0.36 0.00 0.00 55.97 56.68 3i50 s LYS 3 Cb -0.19 -0.63 0.13 0.00 -1.51 0.00 0.00 37.83 35.63 3i50 s LYS 3 CO 0.33 -0.38 0.24 -0.51 -0.36 0.00 0.00 175.35 174.66 3i50 s LEU 4 N 2.21 3.44 -0.39 5.43 2.01 -1.26 -1.66 118.68 128.46 3i50 s LEU 4 Ca 0.04 -2.75 -0.08 0.00 0.01 0.00 0.00 54.13 51.35 3i50 s LEU 4 Cb -0.13 -1.31 0.07 0.00 0.01 0.00 0.00 46.19 44.83 3i50 s LEU 4 CO -0.05 -0.26 0.21 0.54 1.01 0.00 0.00 176.35 177.80 3i50 s VAL 5 N 0.12 3.99 0.92 -1.59 0.11 -0.85 -3.00 120.40 120.10 3i50 s VAL 5 Ca 0.17 -1.39 -0.11 0.00 -2.93 0.00 0.00 61.98 57.71 3i50 s VAL 5 Cb -0.25 -3.42 0.14 0.00 -1.53 0.00 0.00 36.38 31.33 3i50 s VAL 5 CO -0.01 -0.43 1.09 -1.61 -3.33 0.00 0.00 175.10 170.82 3i50 s GLU 6 N 1.39 1.06 -0.28 1.54 8.01 -1.26 -2.44 118.70 126.71 3i50 s GLU 6 Ca 0.02 1.03 -0.26 0.00 0.01 0.00 0.00 54.97 55.78 3i50 s GLU 6 Cb -0.22 -1.77 0.15 0.00 -4.31 0.00 0.00 34.13 27.99 3i50 s GLU 6 CO 0.02 -2.43 1.22 -1.54 0.01 0.00 0.00 175.26 172.53 3i50 s SER 7 N -3.13 -0.26 0.00 -0.19 1.04 -0.15 -4.91 113.70 106.09 3i50 s SER 7 Ca 0.64 0.48 0.00 0.00 0.48 0.00 0.00 55.95 57.55 3i50 s SER 7 Cb -0.20 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.40 3i50 s SER 7 CO 0.58 -0.10 0.00 0.61 0.98 0.00 0.00 173.24 175.31 3i50 n GLY 8 N 1.76 1.70 3.86 7.32 0.00 -1.26 -0.79 105.19 117.78 3i50 n GLY 8 Ca -0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 3i50 n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3i50 s GLY 9 N -2.00 2.12 0.00 -0.02 0.00 -1.26 -4.65 107.32 101.51 3i50 s GLY 9 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 44.72 43.98 3i50 s GLY 9 CO 0.00 -0.56 0.00 0.61 0.00 0.00 0.00 173.10 173.15 3i50 n GLY 10 N 1.47 1.57 3.76 0.20 0.00 -1.05 -4.90 105.19 106.24 3i50 n GLY 10 Ca -0.15 -0.66 -0.36 0.00 0.00 0.00 0.00 46.02 44.85 3i50 n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3i50 s LEU 11 N 0.00 4.13 0.03 0.99 2.96 -1.26 -2.01 118.68 123.52 3i50 s LEU 11 Ca 0.00 0.28 0.01 0.00 -0.22 0.00 0.00 54.13 54.20 3i50 s LEU 11 Cb 0.00 -2.03 -0.02 0.00 0.50 0.00 0.00 46.19 44.64 3i50 s LEU 11 CO 0.00 0.29 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.58 3i50 s VAL 12 N -0.29 0.30 0.48 1.68 1.01 -0.57 -5.01 120.40 118.01 3i50 s VAL 12 Ca 0.10 -1.02 -0.21 0.00 0.00 0.00 0.00 61.98 60.85 3i50 s VAL 12 Cb -0.12 -0.46 -0.08 0.00 0.00 0.00 0.00 36.38 35.72 3i50 s VAL 12 CO 0.01 -0.47 1.04 -0.76 0.00 0.00 0.00 175.10 174.92 3i50 s LEU 13 N -1.58 3.87 -0.81 3.92 1.43 -1.26 -1.59 118.68 122.68 3i50 s LEU 13 Ca -0.12 1.95 -0.20 0.00 -1.03 0.00 0.00 54.13 54.72 3i50 s LEU 13 Cb -0.09 -4.52 -0.18 0.00 0.03 0.00 0.00 46.19 41.42 3i50 s LEU 13 CO -0.01 -0.76 1.96 -2.65 0.23 0.00 0.00 176.35 175.12 3i50 n PRO 14 N -0.88 0.16 0.00 1.29 -0.02 -1.26 -0.98 135.00 133.31 3i50 n PRO 14 Ca 0.09 -1.06 0.00 0.00 -2.02 0.00 0.00 63.50 60.51 3i50 n PRO 14 Cb 0.52 -3.09 0.00 0.00 -0.02 0.00 0.00 33.50 30.91 3i50 n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3i50 n GLY 15 N 5.91 0.65 2.41 -1.23 0.00 -0.30 -4.91 105.19 107.71 3i50 n GLY 15 Ca 0.36 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.19 3i50 n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i50 n GLY 16 N 0.00 -2.11 3.45 -0.02 0.00 -0.15 -2.49 105.19 103.87 3i50 n GLY 16 Ca 0.00 -1.57 -0.22 0.00 0.00 0.00 0.00 46.02 44.23 3i50 n GLY 16 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3i50 s SER 17 N -3.78 2.76 -0.26 1.61 1.04 -1.26 -1.19 113.70 112.63 3i50 s SER 17 Ca 0.48 -1.26 -0.26 0.00 0.48 0.00 0.00 55.95 55.39 3i50 s SER 17 Cb -0.03 -0.17 0.12 0.00 0.10 0.00 0.00 66.02 66.04 3i50 s SER 17 CO 0.36 -0.42 1.00 -0.22 0.98 0.00 0.00 173.24 174.93 3i50 s LEU 18 N -3.48 -0.46 -0.36 2.42 2.96 0.14 -4.96 118.68 114.94 3i50 s LEU 18 Ca 0.32 0.82 -0.01 0.00 -0.22 0.00 0.00 54.13 55.04 3i50 s LEU 18 Cb 0.06 1.93 0.09 0.00 0.50 0.00 0.00 46.19 48.76 3i50 s LEU 18 CO 0.13 -0.20 0.10 -0.60 -1.32 0.00 0.00 176.35 174.47 3i50 s ARG 19 N -0.00 2.07 0.18 1.98 3.52 -1.26 0.67 118.95 126.10 3i50 s ARG 19 Ca 0.02 -1.63 -0.30 0.00 -0.13 0.00 0.00 55.73 53.69 3i50 s ARG 19 Cb -0.04 -3.36 -0.07 0.00 -1.56 0.00 0.00 34.95 29.91 3i50 s ARG 19 CO -0.04 -0.88 0.97 -0.51 -0.81 0.00 0.00 175.30 174.03 3i50 s LEU 20 N 1.14 4.56 0.02 -0.88 1.02 -1.02 -4.81 118.68 118.71 3i50 s LEU 20 Ca 0.04 1.90 0.06 0.00 0.02 0.00 0.00 54.13 56.15 3i50 s LEU 20 Cb -0.21 -3.60 -0.03 0.00 0.02 0.00 0.00 46.19 42.37 3i50 s LEU 20 CO -0.04 0.01 -0.16 -0.44 0.02 0.00 0.00 176.35 175.75 3i50 s SER 21 N -0.54 3.96 -0.50 2.29 0.01 0.03 -1.11 113.70 117.84 3i50 s SER 21 Ca 0.45 -0.34 0.03 0.00 1.31 0.00 0.00 55.95 57.39 3i50 s SER 21 Cb -0.25 -0.72 0.15 0.00 0.21 0.00 0.00 66.02 65.40 3i50 s SER 21 CO 0.32 0.27 0.30 0.00 0.41 0.00 0.00 173.24 174.55 3i50 s ALA 23 N -0.15 3.62 0.33 0.00 0.00 -1.02 -2.49 121.76 122.06 3i50 s ALA 23 Ca 0.21 0.67 0.09 0.00 0.00 0.00 0.00 51.96 52.92 3i50 s ALA 23 Cb -0.17 -3.64 -0.05 0.00 0.00 0.00 0.00 23.12 19.26 3i50 s ALA 23 CO -0.06 -1.15 0.09 0.95 0.00 0.00 0.00 175.76 175.60 3i50 s THR 24 N 3.34 2.98 0.28 0.00 -4.23 -0.75 -2.01 115.64 115.24 3i50 s THR 24 Ca 0.61 -1.79 -0.20 0.00 -1.18 0.00 0.00 61.69 59.13 3i50 s THR 24 Cb -0.27 -2.92 0.05 0.00 1.34 0.00 0.00 72.50 70.70 3i50 s THR 24 CO 0.21 -0.21 0.84 -0.94 -0.54 0.00 0.00 174.62 173.98 3i50 s SER 25 N -3.79 -0.12 -0.15 3.99 1.04 -0.66 -4.84 113.70 109.17 3i50 s SER 25 Ca 0.36 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 56.03 3i50 s SER 25 Cb -0.02 0.69 0.00 0.00 0.10 0.00 0.00 66.02 66.79 3i50 s SER 25 CO 0.21 -1.33 0.00 0.61 0.98 0.00 0.00 173.24 173.72 3i50 n GLY 26 N -0.52 0.51 3.64 7.32 0.00 -1.26 -1.40 105.19 113.48 3i50 n GLY 26 Ca -0.06 -0.38 -0.04 0.00 0.00 0.00 0.00 46.02 45.54 3i50 n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3i50 s PHE 27 N -1.96 -0.19 -0.95 1.61 -0.12 -1.26 -4.34 117.98 110.77 3i50 s PHE 27 Ca 0.00 -0.02 -0.24 0.00 -0.05 0.00 0.00 56.93 56.62 3i50 s PHE 27 Cb 0.00 0.59 0.00 0.00 -0.63 0.00 0.00 43.02 42.98 3i50 s PHE 27 CO 0.00 -0.62 1.68 0.99 -0.05 0.00 0.00 175.22 177.22 3i50 s THR 28 N -3.06 3.69 0.16 -4.49 2.01 -1.26 -4.87 115.64 107.81 3i50 s THR 28 Ca 0.10 -0.54 -0.27 0.00 0.31 0.00 0.00 61.69 61.29 3i50 s THR 28 Cb -0.00 -4.55 0.01 0.00 0.01 0.00 0.00 72.50 67.96 3i50 s THR 28 CO -0.03 -1.46 1.57 0.15 -0.69 0.00 0.00 174.62 174.16 3i50 h PHE 29 N 10.58 -1.27 -0.93 4.92 3.57 -1.95 -2.71 116.94 129.15 3i50 h PHE 29 Ca 0.13 0.07 0.18 0.00 3.53 0.00 0.00 57.97 61.89 3i50 h PHE 29 Cb 1.01 0.62 -0.08 0.00 2.79 0.00 0.00 35.95 40.30 3i50 h PHE 29 CO 1.24 -0.44 0.60 1.79 -2.23 0.00 0.00 178.31 179.28 3i50 h THR 30 N -0.29 0.74 -0.02 4.41 1.35 -1.89 -2.33 112.91 114.87 3i50 h THR 30 Ca 0.15 -0.21 -0.01 0.00 -0.55 0.00 0.00 66.41 65.79 3i50 h THR 30 Cb 0.58 0.08 -0.00 0.00 -1.73 0.00 0.00 68.15 67.08 3i50 h THR 30 CO -0.61 0.11 -0.04 0.44 -0.25 0.00 0.00 175.52 175.17 3i50 h ASP 31 N 0.60 0.03 -3.26 5.36 3.32 -1.90 -3.38 116.42 117.19 3i50 h ASP 31 Ca 0.49 -0.00 -0.66 0.00 0.02 0.00 0.00 57.03 56.88 3i50 h ASP 31 Cb 0.95 -0.01 -0.12 0.00 0.22 0.00 0.00 39.33 40.36 3i50 h ASP 31 CO -0.24 0.07 -0.62 -0.31 -1.72 0.00 0.00 179.24 176.43 3i50 s TYR 32 N -4.97 3.16 1.27 4.55 2.02 -0.88 -4.87 117.35 117.62 3i50 s TYR 32 Ca -0.05 0.14 -0.19 0.00 -0.37 0.00 0.00 57.07 56.61 3i50 s TYR 32 Cb 0.17 -1.71 0.28 0.00 -0.40 0.00 0.00 41.96 40.30 3i50 s TYR 32 CO 0.68 0.50 0.67 0.66 -1.57 0.00 0.00 175.55 176.49 3i50 n TYR 33 N 1.42 -2.58 -3.55 2.71 4.02 -1.26 -4.51 117.16 113.40 3i50 n TYR 33 Ca -0.15 -0.36 -0.15 0.00 -0.01 0.00 0.00 57.90 57.23 3i50 n TYR 33 Cb 0.53 -1.46 -0.05 0.00 -0.02 0.00 0.00 39.34 38.33 3i50 n TYR 33 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 176.86 174.21 3i50 s MET 34 N -4.33 1.04 0.06 -0.72 -1.94 -0.98 -3.50 119.30 108.93 3i50 s MET 34 Ca 0.60 -0.05 -0.02 0.00 -1.71 0.00 0.00 55.69 54.51 3i50 s MET 34 Cb -0.14 0.48 -0.04 0.00 2.01 0.00 0.00 34.83 37.14 3i50 s MET 34 CO 0.55 -0.36 0.00 -0.08 -0.01 0.00 0.00 175.02 175.12 3i50 s THR 35 N -1.98 0.20 -0.07 2.05 -1.32 0.45 -0.38 115.64 114.58 3i50 s THR 35 Ca -0.08 -1.77 0.05 0.00 -1.21 0.00 0.00 61.69 58.69 3i50 s THR 35 Cb -0.01 -1.58 -0.01 0.00 -1.51 0.00 0.00 72.50 69.40 3i50 s THR 35 CO 0.02 -0.90 -0.24 0.26 -2.21 0.00 0.00 174.62 171.56 3i50 s TRP 36 N -3.93 2.50 -0.01 9.09 0.52 -0.20 -1.79 118.94 125.11 3i50 s TRP 36 Ca 0.09 -0.82 0.02 0.00 0.02 0.00 0.00 56.10 55.41 3i50 s TRP 36 Cb 0.08 -1.64 0.00 0.00 -1.15 0.00 0.00 33.47 30.75 3i50 s TRP 36 CO -0.08 -0.28 -0.05 0.08 0.02 0.00 0.00 176.95 176.64 3i50 s VAL 37 N 0.01 0.48 -0.04 4.03 1.01 0.84 -1.40 120.40 125.34 3i50 s VAL 37 Ca -0.09 -0.21 0.01 0.00 0.00 0.00 0.00 61.98 61.70 3i50 s VAL 37 Cb -0.15 -0.43 -0.03 0.00 0.00 0.00 0.00 36.38 35.76 3i50 s VAL 37 CO 0.05 0.16 -0.04 0.00 0.00 0.00 0.00 175.10 175.27 3i50 s ARG 38 N 0.16 2.74 -0.27 2.72 1.70 0.34 0.27 118.95 126.61 3i50 s ARG 38 Ca -0.02 -0.59 -0.00 0.00 -0.47 0.00 0.00 55.73 54.65 3i50 s ARG 38 Cb -0.06 -2.61 0.04 0.00 -0.57 0.00 0.00 34.95 31.75 3i50 s ARG 38 CO -0.00 0.64 -0.06 -1.14 -1.08 0.00 0.00 175.30 173.66 3i50 s GLN 39 N -1.16 2.52 0.66 3.89 0.74 0.34 -1.10 119.66 125.56 3i50 s GLN 39 Ca 0.15 -1.18 -0.16 0.00 0.05 0.00 0.00 55.36 54.22 3i50 s GLN 39 Cb -0.11 -3.01 0.00 0.00 1.10 0.00 0.00 33.01 30.99 3i50 s GLN 39 CO 0.05 -0.52 1.15 -2.14 -0.55 0.00 0.00 175.29 173.28 3i50 s PRO 40 N 1.23 2.67 -0.94 1.67 0.02 -1.23 0.28 135.00 138.70 3i50 s PRO 40 Ca -0.04 1.57 -0.25 0.00 0.02 0.00 0.00 61.00 62.30 3i50 s PRO 40 Cb -0.19 -1.92 -0.18 0.00 0.02 0.00 0.00 34.50 32.24 3i50 s PRO 40 CO -0.04 -1.38 1.94 -2.30 -0.33 0.00 0.00 177.00 174.89 3i50 n PRO 41 N -2.31 0.99 0.00 5.54 -0.02 -1.26 -2.09 135.00 135.85 3i50 n PRO 41 Ca 0.12 -1.98 0.00 0.00 -2.02 0.00 0.00 63.50 59.62 3i50 n PRO 41 Cb 0.51 -3.50 0.00 0.00 -0.02 0.00 0.00 33.50 30.49 3i50 n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3i50 n GLY 42 N 5.56 0.00 4.13 -1.23 0.00 -1.26 -5.01 105.19 107.38 3i50 n GLY 42 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.47 3i50 n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3i50 n LYS 43 N 0.00 0.00 -1.07 1.61 5.02 -0.89 -4.97 118.16 117.87 3i50 n LYS 43 Ca 0.00 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.93 3i50 n LYS 43 Cb 0.00 -0.07 0.03 0.00 -0.02 0.00 0.00 35.03 34.96 3i50 n LYS 43 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3i50 n ALA 44 N 0.00 -4.28 -3.70 7.82 0.00 -1.26 -4.78 120.51 114.31 3i50 n ALA 44 Ca 0.00 -0.37 -0.28 0.00 0.00 0.00 0.00 53.44 52.78 3i50 n ALA 44 Cb 0.00 -1.21 -0.16 0.00 0.00 0.00 0.00 19.45 18.08 3i50 n ALA 44 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3i50 s LEU 45 N 6.33 1.27 -0.25 0.00 2.96 -1.26 -3.53 118.68 124.19 3i50 s LEU 45 Ca 0.46 -1.07 -0.07 0.00 -0.22 0.00 0.00 54.13 53.23 3i50 s LEU 45 Cb -0.31 -0.60 -0.03 0.00 0.50 0.00 0.00 46.19 45.76 3i50 s LEU 45 CO 0.72 -0.36 0.07 -1.61 -1.32 0.00 0.00 176.35 173.85 3i50 s GLU 46 N 1.86 3.63 0.33 1.98 2.02 -0.25 -4.99 118.70 123.27 3i50 s GLU 46 Ca 0.03 -0.49 -0.27 0.00 0.02 0.00 0.00 54.97 54.26 3i50 s GLU 46 Cb -0.17 -3.32 -0.09 0.00 0.10 0.00 0.00 34.13 30.65 3i50 s GLU 46 CO -0.16 -0.20 1.10 -0.46 0.02 0.00 0.00 175.26 175.56 3i50 s TRP 47 N 1.61 3.41 -0.05 1.61 -0.00 -1.26 -0.50 118.94 123.76 3i50 s TRP 47 Ca 0.06 1.66 -0.09 0.00 -0.00 0.00 0.00 56.10 57.74 3i50 s TRP 47 Cb -0.15 -3.26 -0.03 0.00 -0.00 0.00 0.00 33.47 30.02 3i50 s TRP 47 CO 0.03 -0.70 -0.17 1.28 -0.00 0.00 0.00 176.95 177.39 3i50 n LEU 48 N 0.68 1.46 -3.59 5.86 4.77 -0.49 -4.72 117.00 120.97 3i50 n LEU 48 Ca 0.01 0.23 -0.05 0.00 -0.03 0.00 0.00 56.01 56.17 3i50 n LEU 48 Cb 0.46 -0.52 -0.03 0.00 -2.33 0.00 0.00 43.42 41.00 3i50 n LEU 48 CO 0.51 -0.42 0.96 -0.83 -1.33 0.00 0.00 177.39 176.28 3i50 s GLY 49 N -4.55 -0.27 0.32 -0.72 0.00 -1.21 -0.34 107.32 100.55 3i50 s GLY 49 Ca -0.15 1.72 0.07 0.00 0.00 0.00 0.00 44.72 46.37 3i50 s GLY 49 CO 0.22 0.63 -0.05 -0.11 0.00 0.00 0.00 173.10 173.79 3i50 s PHE 50 N -2.19 2.14 -0.05 1.90 -0.12 -1.05 -1.03 117.98 117.58 3i50 s PHE 50 Ca 0.08 -0.67 -0.02 0.00 -0.05 0.00 0.00 56.93 56.27 3i50 s PHE 50 Cb -0.01 -1.28 0.03 0.00 -0.63 0.00 0.00 43.02 41.13 3i50 s PHE 50 CO -0.05 0.35 0.04 -1.50 -0.05 0.00 0.00 175.22 174.01 3i50 s ILE 51 N -2.90 0.03 0.73 -4.49 2.07 0.49 -2.58 121.20 114.55 3i50 s ILE 51 Ca 0.32 0.33 -0.11 0.00 -1.41 0.00 0.00 60.65 59.77 3i50 s ILE 51 Cb 0.05 -0.25 0.17 0.00 0.13 0.00 0.00 42.46 42.57 3i50 s ILE 51 CO 0.14 0.19 0.39 0.61 -1.91 0.00 0.00 174.94 174.37 3i50 n GLY 52 N 5.14 -3.12 4.03 1.50 0.00 0.41 -2.32 105.19 110.83 3i50 n GLY 52 Ca -0.07 -1.02 -0.19 0.00 0.00 0.00 0.00 46.02 44.74 3i50 n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i50 s ASN 52 N -2.30 5.12 0.17 1.61 4.22 -1.26 -4.53 114.94 117.97 3i50 s ASN 52 Ca 0.30 -0.83 -0.24 0.00 -2.14 0.00 0.00 52.86 49.96 3i50 s ASN 52 Cb -0.05 0.26 0.06 0.00 1.28 0.00 0.00 41.25 42.80 3i50 s ASN 52 CO 0.26 -1.32 1.59 0.50 -2.04 0.00 0.00 177.10 176.08 3i50 h LYS 52 N 0.20 -0.24 0.00 3.55 3.64 -1.94 0.27 116.57 122.05 3i50 h LYS 52 Ca -0.30 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.09 3i50 h LYS 52 Cb 1.29 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.16 3i50 h LYS 52 CO 0.41 -0.16 0.00 0.00 -2.27 0.00 0.00 179.45 177.43 3i50 n ALA 52 N -3.07 1.44 -1.45 5.00 0.00 -1.26 -0.68 120.51 120.49 3i50 n ALA 52 Ca 0.02 -0.03 0.01 0.00 0.00 0.00 0.00 53.44 53.44 3i50 n ALA 52 Cb 0.35 -1.10 0.20 0.00 0.00 0.00 0.00 19.45 18.90 3i50 n ALA 52 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3i50 n ASN 53 N -1.32 2.29 -2.68 0.00 3.02 0.02 -4.95 115.26 111.64 3i50 n ASN 53 Ca 0.03 -3.74 -0.17 0.00 -0.03 0.00 0.00 54.58 50.67 3i50 n ASN 53 Cb 0.05 -0.58 -0.00 0.00 -0.61 0.00 0.00 39.78 38.64 3i50 n ASN 53 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3i50 n ASP 54 N -1.11 -4.56 -3.54 6.41 8.00 0.15 -1.21 116.55 120.68 3i50 n ASP 54 Ca 0.27 -0.02 -0.25 0.00 0.71 0.00 0.00 54.79 55.50 3i50 n ASP 54 Cb 0.89 -3.81 -0.01 0.00 -0.02 0.00 0.00 41.12 38.17 3i50 n ASP 54 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3i50 n TYR 55 N -3.76 -1.74 -1.60 1.24 4.01 -0.84 -4.82 117.16 109.64 3i50 n TYR 55 Ca -0.14 0.50 -0.45 0.00 -0.16 0.00 0.00 57.90 57.66 3i50 n TYR 55 Cb 0.61 -2.69 -0.02 0.00 -0.31 0.00 0.00 39.34 36.94 3i50 n TYR 55 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03 3i50 n THR 56 N -3.90 1.90 -4.22 -0.72 5.66 -0.35 -4.21 114.28 108.44 3i50 n THR 56 Ca 0.01 -0.48 -0.17 0.00 -3.05 0.00 0.00 64.05 60.37 3i50 n THR 56 Cb 0.52 -1.07 -0.11 0.00 -1.55 0.00 0.00 70.33 68.12 3i50 n THR 56 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 3i50 s THR 57 N -0.98 1.20 -0.07 1.09 2.01 -1.26 0.15 115.64 117.79 3i50 s THR 57 Ca 0.59 -1.71 -0.06 0.00 0.31 0.00 0.00 61.69 60.82 3i50 s THR 57 Cb -0.69 -1.50 0.02 0.00 0.01 0.00 0.00 72.50 70.34 3i50 s THR 57 CO 0.59 -0.48 0.18 -0.70 -0.69 0.00 0.00 174.62 173.52 3i50 s GLU 58 N -2.77 0.20 0.21 4.92 2.56 -1.06 -5.01 118.70 117.74 3i50 s GLU 58 Ca 0.08 0.28 0.11 0.00 0.00 0.00 0.00 54.97 55.44 3i50 s GLU 58 Cb -0.04 0.06 -0.05 0.00 2.00 0.00 0.00 34.13 36.11 3i50 s GLU 58 CO 0.02 -0.05 -0.21 0.71 -0.56 0.00 0.00 175.26 175.17 3i50 s TYR 59 N 0.28 2.18 0.57 5.30 1.51 -1.26 -2.53 117.35 123.39 3i50 s TYR 59 Ca -0.01 -0.38 -0.10 0.00 -1.01 0.00 0.00 57.07 55.56 3i50 s TYR 59 Cb -0.03 -1.04 -0.04 0.00 -0.11 0.00 0.00 41.96 40.74 3i50 s TYR 59 CO -0.01 0.52 0.95 -1.54 -1.11 0.00 0.00 175.55 174.37 3i50 s SER 60 N -2.94 6.29 0.47 2.29 1.04 0.53 -4.91 113.70 116.48 3i50 s SER 60 Ca 0.22 1.30 0.25 0.00 0.48 0.00 0.00 55.95 58.21 3i50 s SER 60 Cb -0.06 -2.41 1.29 0.00 0.10 0.00 0.00 66.02 64.94 3i50 s SER 60 CO 0.11 -0.75 1.84 0.00 0.98 0.00 0.00 173.24 175.42 3i50 h ALA 61 N 0.01 2.56 0.00 5.32 0.00 -1.94 0.23 119.26 125.44 3i50 h ALA 61 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3i50 h ALA 61 Cb 1.19 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.02 3i50 h ALA 61 CO 0.62 -0.87 0.00 0.43 0.00 0.00 0.00 179.25 179.43 3i50 n SER 62 N -4.41 0.59 -0.03 0.00 7.64 -1.26 -3.47 113.62 112.68 3i50 n SER 62 Ca 0.21 0.62 0.01 0.00 1.01 0.00 0.00 58.87 60.71 3i50 n SER 62 Cb 0.91 -0.75 0.00 0.00 -1.01 0.00 0.00 64.21 63.35 3i50 n SER 62 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3i50 n VAL 63 N -2.12 0.00 -1.66 0.44 0.31 0.05 -4.89 118.33 110.47 3i50 n VAL 63 Ca 0.03 -0.49 -0.60 0.00 -0.01 0.00 0.00 64.34 63.28 3i50 n VAL 63 Cb 0.27 1.02 -0.08 0.00 -0.91 0.00 0.00 33.84 34.14 3i50 n VAL 63 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3i50 n LYS 64 N -0.40 0.64 0.00 5.55 4.01 -1.11 -2.15 118.16 124.69 3i50 n LYS 64 Ca 0.01 0.23 0.00 0.00 -0.51 0.00 0.00 58.31 58.04 3i50 n LYS 64 Cb 0.03 -1.83 0.00 0.00 -0.51 0.00 0.00 35.03 32.72 3i50 n LYS 64 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3i50 n GLY 65 N 3.37 1.66 0.20 0.72 0.00 -1.26 -4.73 105.19 105.14 3i50 n GLY 65 Ca 0.25 -0.09 -0.08 0.00 0.00 0.00 0.00 46.02 46.10 3i50 n GLY 65 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3i50 h ARG 66 N 0.00 -0.15 -5.76 1.61 3.08 -1.73 -3.44 114.38 107.99 3i50 h ARG 66 Ca 0.00 0.01 -0.53 0.00 0.07 0.00 0.00 59.98 59.53 3i50 h ARG 66 Cb 0.00 0.03 -0.14 0.00 0.08 0.00 0.00 29.97 29.94 3i50 h ARG 66 CO 0.00 -0.10 -0.71 -0.06 -1.07 0.00 0.00 179.97 178.03 3i50 s PHE 67 N -6.15 2.03 -0.07 3.04 0.08 -1.12 -1.94 117.98 113.85 3i50 s PHE 67 Ca -0.14 -0.54 -0.07 0.00 0.12 0.00 0.00 56.93 56.30 3i50 s PHE 67 Cb 0.11 -1.02 0.02 0.00 -0.57 0.00 0.00 43.02 41.56 3i50 s PHE 67 CO 0.68 0.46 0.20 0.95 -0.10 0.00 0.00 175.22 177.41 3i50 s THR 68 N -2.82 0.01 -0.08 0.64 -4.23 -0.94 -4.84 115.64 103.38 3i50 s THR 68 Ca 0.28 -0.07 -0.02 0.00 -1.18 0.00 0.00 61.69 60.70 3i50 s THR 68 Cb 0.00 -0.30 -0.03 0.00 1.34 0.00 0.00 72.50 73.50 3i50 s THR 68 CO 0.12 -0.04 0.03 -0.51 -0.54 0.00 0.00 174.62 173.68 3i50 s ILE 69 N -0.04 4.53 0.07 2.99 2.07 -1.26 -1.50 121.20 128.06 3i50 s ILE 69 Ca -0.01 -0.21 0.03 0.00 -1.41 0.00 0.00 60.65 59.04 3i50 s ILE 69 Cb -0.02 -2.94 -0.03 0.00 0.13 0.00 0.00 42.46 39.60 3i50 s ILE 69 CO 0.00 0.57 -0.09 -0.94 -1.91 0.00 0.00 174.94 172.58 3i50 s SER 70 N -1.02 1.16 -0.17 4.50 1.04 -0.84 -5.00 113.70 113.37 3i50 s SER 70 Ca 0.15 -0.73 0.01 0.00 0.48 0.00 0.00 55.95 55.85 3i50 s SER 70 Cb -0.11 0.03 0.02 0.00 0.10 0.00 0.00 66.02 66.06 3i50 s SER 70 CO 0.04 -0.27 -0.19 -0.13 0.98 0.00 0.00 173.24 173.67 3i50 s ARG 71 N -2.45 2.82 -1.25 4.02 0.52 -1.26 -1.14 118.95 120.21 3i50 s ARG 71 Ca 0.00 -0.77 -0.08 0.00 -0.52 0.00 0.00 55.73 54.36 3i50 s ARG 71 Cb -0.04 -2.44 0.19 0.00 0.52 0.00 0.00 34.95 33.17 3i50 s ARG 71 CO -0.01 -0.19 1.87 -3.47 0.02 0.00 0.00 175.30 173.52 3i50 n ASP 72 N 4.58 5.60 0.21 0.23 -0.08 0.45 -4.83 116.55 122.72 3i50 n ASP 72 Ca -0.20 -3.17 0.17 0.00 -1.51 0.00 0.00 54.79 50.08 3i50 n ASP 72 Cb 0.50 -1.43 0.75 0.00 2.34 0.00 0.00 41.12 43.28 3i50 n ASP 72 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 3i50 h ASP 73 N 5.56 0.00 1.13 1.67 5.19 -1.96 -0.37 116.42 127.63 3i50 h ASP 73 Ca 0.40 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.76 3i50 h ASP 73 Cb 0.59 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.09 3i50 h ASP 73 CO 1.57 0.00 -0.25 -1.28 -3.12 0.00 0.00 179.24 176.16 3i50 h SER 74 N 0.00 0.00 0.00 6.45 0.87 -1.94 -3.27 113.55 115.65 3i50 h SER 74 Ca 0.10 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 3i50 h SER 74 Cb 0.95 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.91 3i50 h SER 74 CO -0.00 0.25 -0.08 0.00 -0.53 0.00 0.00 176.83 176.47 3i50 n GLN 75 N -3.32 1.29 -3.42 2.24 6.02 -0.20 -5.02 117.38 114.96 3i50 n GLN 75 Ca 0.01 -1.30 -0.21 0.00 -0.01 0.00 0.00 57.00 55.48 3i50 n GLN 75 Cb 0.49 -0.85 0.06 0.00 1.02 0.00 0.00 30.24 30.95 3i50 n GLN 75 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 3i50 n SER 76 N -0.43 -5.91 -4.09 1.08 7.64 -0.85 -4.75 113.62 106.31 3i50 n SER 76 Ca 0.03 -0.82 -0.19 0.00 1.01 0.00 0.00 58.87 58.89 3i50 n SER 76 Cb 0.47 -4.51 -0.14 0.00 -1.01 0.00 0.00 64.21 59.02 3i50 n SER 76 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3i50 s ILE 77 N -3.42 0.91 0.04 0.44 1.01 -1.08 -1.81 121.20 117.28 3i50 s ILE 77 Ca 0.44 -0.72 0.08 0.00 0.00 0.00 0.00 60.65 60.46 3i50 s ILE 77 Cb -0.10 -0.81 -0.03 0.00 0.01 0.00 0.00 42.46 41.54 3i50 s ILE 77 CO 0.79 0.09 -0.23 -0.22 0.00 0.00 0.00 174.94 175.36 3i50 s LEU 78 N -0.71 2.34 0.08 2.97 2.96 -1.04 -0.41 118.68 124.87 3i50 s LEU 78 Ca 0.02 -0.52 0.05 0.00 -0.22 0.00 0.00 54.13 53.46 3i50 s LEU 78 Cb -0.06 -1.38 -0.03 0.00 0.50 0.00 0.00 46.19 45.22 3i50 s LEU 78 CO 0.00 0.26 -0.14 -0.31 -1.32 0.00 0.00 176.35 174.84 3i50 s TYR 79 N -0.84 1.24 -0.42 5.38 2.02 -0.29 -0.49 117.35 123.95 3i50 s TYR 79 Ca 0.13 -0.48 0.02 0.00 -0.37 0.00 0.00 57.07 56.36 3i50 s TYR 79 Cb -0.10 -0.69 0.14 0.00 -0.40 0.00 0.00 41.96 40.90 3i50 s TYR 79 CO 0.03 0.07 0.23 -1.17 -1.57 0.00 0.00 175.55 173.14 3i50 s LEU 80 N -1.89 2.28 0.19 -1.29 2.96 -0.27 -1.98 118.68 118.70 3i50 s LEU 80 Ca 0.00 -2.51 -0.31 0.00 -0.22 0.00 0.00 54.13 51.09 3i50 s LEU 80 Cb -0.09 -0.88 -0.10 0.00 0.50 0.00 0.00 46.19 45.62 3i50 s LEU 80 CO 0.02 -0.28 1.47 -1.58 -1.32 0.00 0.00 176.35 174.66 3i50 s GLN 81 N 0.53 4.26 -0.02 1.98 2.00 -0.56 -2.43 119.66 125.42 3i50 s GLN 81 Ca 0.18 2.27 0.05 0.00 -2.00 0.00 0.00 55.36 55.86 3i50 s GLN 81 Cb -0.24 -3.15 -0.01 0.00 0.80 0.00 0.00 33.01 30.40 3i50 s GLN 81 CO 0.01 -0.48 -0.18 -1.64 -0.50 0.00 0.00 175.29 172.50 3i50 s MET 82 N 0.44 1.58 0.02 1.67 -1.94 0.21 -2.20 119.30 119.07 3i50 s MET 82 Ca 0.64 -0.63 0.00 0.00 -1.71 0.00 0.00 55.69 53.99 3i50 s MET 82 Cb -0.41 -1.46 -0.02 0.00 2.01 0.00 0.00 34.83 34.94 3i50 s MET 82 CO 0.36 0.34 -0.03 -1.54 -0.01 0.00 0.00 175.02 174.14 3i50 s SER 82 N -0.27 0.26 -1.41 3.03 1.04 -0.82 -0.69 113.70 114.85 3i50 s SER 82 Ca 0.03 -0.46 -0.04 0.00 0.48 0.00 0.00 55.95 55.96 3i50 s SER 82 Cb -0.09 0.09 0.03 0.00 0.10 0.00 0.00 66.02 66.15 3i50 s SER 82 CO 0.00 -0.27 0.67 0.35 0.98 0.00 0.00 173.24 174.97 3i50 n THR 82 N 1.72 -3.33 -0.71 2.02 -2.24 -0.33 -4.74 114.28 106.67 3i50 n THR 82 Ca -0.23 -0.37 -0.32 0.00 -2.27 0.00 0.00 64.05 60.86 3i50 n THR 82 Cb 0.55 -3.10 0.15 0.00 -2.10 0.00 0.00 70.33 65.84 3i50 n THR 82 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3i50 n LEU 82 N -4.40 0.71 0.00 3.22 4.77 -1.01 -4.59 117.00 115.70 3i50 n LEU 82 Ca -0.22 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 3i50 n LEU 82 Cb 0.64 -1.28 0.00 0.00 -2.33 0.00 0.00 43.42 40.45 3i50 n LEU 82 CO 0.73 -3.05 0.00 -2.11 -1.33 0.00 0.00 177.39 171.63 3i50 n ARG 83 N -2.89 0.00 -0.31 3.23 1.85 -1.26 -1.16 116.66 116.13 3i50 n ARG 83 Ca 0.08 0.00 -0.02 0.00 -1.00 0.00 0.00 57.85 56.91 3i50 n ARG 83 Cb 0.54 0.00 0.15 0.00 -1.05 0.00 0.00 32.46 32.09 3i50 n ARG 83 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3i50 h ALA 84 N 1.56 1.29 0.00 2.89 0.00 -1.97 -2.95 119.26 120.08 3i50 h ALA 84 Ca 0.00 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 3i50 h ALA 84 Cb 0.00 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 3i50 h ALA 84 CO 0.00 0.62 -0.61 1.05 0.00 0.00 0.00 179.25 180.31 3i50 h GLU 85 N 1.22 0.00 0.00 0.00 4.11 -1.97 -3.10 114.58 114.84 3i50 h GLU 85 Ca 0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.75 3i50 h GLU 85 Cb -0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.18 3i50 h GLU 85 CO -0.06 0.61 0.00 -0.25 0.07 0.00 0.00 179.01 179.38 3i50 n ASP 86 N -3.65 0.00 -4.64 3.06 8.00 -1.11 -4.70 116.55 113.51 3i50 n ASP 86 Ca -0.01 0.39 -0.42 0.00 0.71 0.00 0.00 54.79 55.46 3i50 n ASP 86 Cb 0.64 -0.45 -0.03 0.00 -0.02 0.00 0.00 41.12 41.26 3i50 n ASP 86 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 3i50 s ARG 87 N -2.90 3.78 0.00 -1.24 3.52 -1.17 -4.87 118.95 116.06 3i50 s ARG 87 Ca 0.11 2.28 0.00 0.00 -0.13 0.00 0.00 55.73 57.98 3i50 s ARG 87 Cb 0.12 -4.20 0.00 0.00 -1.56 0.00 0.00 34.95 29.31 3i50 s ARG 87 CO 0.31 -1.36 0.00 0.00 -0.81 0.00 0.00 175.30 173.45 3i50 n ALA 88 N 8.94 0.00 -4.00 6.12 0.00 0.17 -4.41 120.51 127.33 3i50 n ALA 88 Ca 0.23 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.33 3i50 n ALA 88 Cb 0.43 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.72 3i50 n ALA 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3i50 s THR 89 N -2.30 2.31 -0.24 0.00 2.01 0.14 0.20 115.64 117.76 3i50 s THR 89 Ca 0.00 -0.98 -0.11 0.00 0.31 0.00 0.00 61.69 60.91 3i50 s THR 89 Cb 0.00 -2.05 -0.05 0.00 0.01 0.00 0.00 72.50 70.41 3i50 s THR 89 CO 0.00 0.43 0.19 -0.31 -0.69 0.00 0.00 174.62 174.24 3i50 s TYR 90 N 1.29 3.31 0.02 4.92 1.51 0.20 0.13 117.35 128.73 3i50 s TYR 90 Ca 0.03 0.25 0.01 0.00 -1.01 0.00 0.00 57.07 56.35 3i50 s TYR 90 Cb -0.14 -2.32 -0.04 0.00 -0.11 0.00 0.00 41.96 39.35 3i50 s TYR 90 CO -0.10 0.02 0.08 0.71 -1.11 0.00 0.00 175.55 175.15 3i50 s TYR 91 N 1.21 3.24 -0.25 2.71 2.02 0.77 -0.67 117.35 126.38 3i50 s TYR 91 Ca 0.09 0.16 0.02 0.00 -0.37 0.00 0.00 57.07 56.97 3i50 s TYR 91 Cb -0.14 -1.70 0.05 0.00 -0.40 0.00 0.00 41.96 39.78 3i50 s TYR 91 CO 0.06 0.54 -0.12 0.00 -1.57 0.00 0.00 175.55 174.46 3i50 s ALA 93 N 1.15 2.10 0.66 0.00 0.00 -0.74 -2.94 121.76 121.99 3i50 s ALA 93 Ca -0.06 -1.31 -0.11 0.00 0.00 0.00 0.00 51.96 50.47 3i50 s ALA 93 Cb -0.19 -0.35 -0.01 0.00 0.00 0.00 0.00 23.12 22.57 3i50 s ALA 93 CO -0.06 0.46 1.05 0.95 0.00 0.00 0.00 175.76 178.16 3i50 s THR 94 N -1.01 4.28 0.16 0.00 -4.23 -1.08 -0.41 115.64 113.34 3i50 s THR 94 Ca 0.10 0.76 0.07 0.00 -1.18 0.00 0.00 61.69 61.44 3i50 s THR 94 Cb -0.10 -3.57 -0.04 0.00 1.34 0.00 0.00 72.50 70.13 3i50 s THR 94 CO 0.04 -0.95 -0.02 -0.69 -0.54 0.00 0.00 174.62 172.46 3i50 s VAL 95 N -3.07 3.68 0.20 2.29 1.01 -1.23 -3.06 120.40 120.23 3i50 s VAL 95 Ca 0.57 -1.37 -0.23 0.00 0.00 0.00 0.00 61.98 60.95 3i50 s VAL 95 Cb -0.13 -2.82 0.05 0.00 0.00 0.00 0.00 36.38 33.48 3i50 s VAL 95 CO 0.54 -0.06 0.89 -0.47 0.00 0.00 0.00 175.10 176.00 3i50 s TYR 96 N -1.61 -0.13 0.00 5.22 5.04 -0.79 -4.54 117.35 120.54 3i50 s TYR 96 Ca 0.26 -0.24 0.00 0.00 -2.44 0.00 0.00 57.07 54.65 3i50 s TYR 96 Cb -0.10 0.67 0.00 0.00 0.35 0.00 0.00 41.96 42.88 3i50 s TYR 96 CO 0.18 -0.98 0.00 0.41 -1.34 0.00 0.00 175.55 173.82 3i50 n GLY 97 N -0.48 -1.53 0.27 8.97 0.00 -1.26 -0.89 105.19 110.26 3i50 n GLY 97 Ca -0.05 -1.44 0.05 0.00 0.00 0.00 0.00 46.02 44.57 3i50 n GLY 97 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3i50 h ASN 98 N 0.00 0.13 -3.55 1.61 2.35 -2.01 -3.25 115.58 110.85 3i50 h ASN 98 Ca 0.00 0.13 -0.70 0.00 -0.55 0.00 0.00 56.30 55.18 3i50 h ASN 98 Cb 0.00 0.14 -0.31 0.00 0.05 0.00 0.00 38.32 38.21 3i50 h ASN 98 CO 0.00 0.03 -0.55 -0.31 -1.65 0.00 0.00 177.43 174.94 3i50 s TYR 99 N -6.04 3.38 0.28 1.19 2.02 -1.26 -5.06 117.35 111.86 3i50 s TYR 99 Ca -0.13 -1.82 -0.28 0.00 -0.37 0.00 0.00 57.07 54.48 3i50 s TYR 99 Cb 0.21 -2.78 -0.15 0.00 -0.40 0.00 0.00 41.96 38.84 3i50 s TYR 99 CO 0.76 -0.86 0.88 -2.30 -1.57 0.00 0.00 175.55 172.46 3i50 n PRO 100 N 4.76 1.00 -3.77 -1.71 -0.02 -1.23 -4.97 135.00 129.07 3i50 n PRO 100 Ca -0.09 0.35 -0.13 0.00 -2.02 0.00 0.00 63.50 61.62 3i50 n PRO 100 Cb 0.43 -1.63 -0.08 0.00 -0.02 0.00 0.00 33.50 32.19 3i50 n PRO 100 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 3i50 s TYR 100 N -1.07 -0.14 -0.68 6.00 -0.85 -0.07 -4.92 117.35 115.62 3i50 s TYR 100 Ca 0.60 0.16 -0.26 0.00 -0.52 0.00 0.00 57.07 57.06 3i50 s TYR 100 Cb -0.75 0.08 0.04 0.00 0.38 0.00 0.00 41.96 41.72 3i50 s TYR 100 CO 0.59 -0.41 1.16 -0.06 -1.52 0.00 0.00 175.55 175.31 3i50 s PHE 100 N -1.63 2.46 0.00 -3.49 0.40 -1.26 -1.89 117.98 112.57 3i50 s PHE 100 Ca -0.12 -0.12 0.00 0.00 -0.60 0.00 0.00 56.93 56.10 3i50 s PHE 100 Cb -0.04 -4.48 0.00 0.00 0.51 0.00 0.00 43.02 39.00 3i50 s PHE 100 CO 0.02 -1.85 0.00 -0.40 0.70 0.00 0.00 175.22 173.69 3i50 n ASP 101 N 8.68 0.00 -4.56 1.36 5.75 -1.17 -4.81 116.55 121.80 3i50 n ASP 101 Ca 0.02 0.00 -0.41 0.00 -0.01 0.00 0.00 54.79 54.38 3i50 n ASP 101 Cb 0.48 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.54 3i50 n ASP 101 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3i50 s VAL 102 N 0.00 3.81 0.00 2.12 1.01 -1.26 -4.92 120.40 121.16 3i50 s VAL 102 Ca 0.00 0.57 0.00 0.00 0.00 0.00 0.00 61.98 62.55 3i50 s VAL 102 Cb 0.00 -4.83 0.00 0.00 0.00 0.00 0.00 36.38 31.55 3i50 s VAL 102 CO 0.00 -1.66 0.00 0.79 0.00 0.00 0.00 175.10 174.23 3i50 n TRP 103 N 9.14 -2.86 -4.24 5.22 7.02 -1.26 -2.62 117.44 127.85 3i50 n TRP 103 Ca 0.05 0.00 -0.13 0.00 -1.02 0.00 0.00 57.50 56.40 3i50 n TRP 103 Cb 0.49 0.00 -0.10 0.00 -2.42 0.00 0.00 31.31 29.28 3i50 n TRP 103 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 3i50 s GLY 104 N -2.36 1.48 0.27 6.99 0.00 -1.15 -4.55 107.32 108.00 3i50 s GLY 104 Ca 0.00 -1.73 -0.03 0.00 0.00 0.00 0.00 44.72 42.96 3i50 s GLY 104 CO 0.00 -1.47 1.43 -0.62 0.00 0.00 0.00 173.10 172.44 3i50 n VAL 105 N -0.32 -0.39 0.00 1.40 0.31 -1.16 -4.76 118.33 113.42 3i50 n VAL 105 Ca -0.00 2.06 0.00 0.00 -0.01 0.00 0.00 64.34 66.39 3i50 n VAL 105 Cb 0.66 -2.92 0.00 0.00 -0.91 0.00 0.00 33.84 30.66 3i50 n VAL 105 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3i50 n GLY 106 N -1.52 1.85 3.15 2.92 0.00 -1.26 -5.02 105.19 105.30 3i50 n GLY 106 Ca 0.18 -1.97 -0.13 0.00 0.00 0.00 0.00 46.02 44.10 3i50 n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3i50 s THR 107 N -2.42 0.02 -0.18 2.61 -1.32 0.16 -4.62 115.64 109.88 3i50 s THR 107 Ca 0.00 -0.14 -0.17 0.00 -1.21 0.00 0.00 61.69 60.17 3i50 s THR 107 Cb 0.00 -0.40 -0.04 0.00 -1.51 0.00 0.00 72.50 70.55 3i50 s THR 107 CO 0.00 -0.08 0.45 -0.89 -2.21 0.00 0.00 174.62 171.89 3i50 s THR 108 N -0.23 5.17 -0.25 5.08 2.01 -1.26 0.60 115.64 126.76 3i50 s THR 108 Ca -0.03 0.83 0.02 0.00 0.31 0.00 0.00 61.69 62.81 3i50 s THR 108 Cb -0.03 -3.78 0.05 0.00 0.01 0.00 0.00 72.50 68.75 3i50 s THR 108 CO 0.01 0.25 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.38 3i50 s VAL 109 N 1.26 2.31 -0.11 3.82 1.01 0.13 -2.54 120.40 126.27 3i50 s VAL 109 Ca 0.22 -1.40 -0.01 0.00 0.00 0.00 0.00 61.98 60.78 3i50 s VAL 109 Cb -0.15 -2.26 -0.03 0.00 0.00 0.00 0.00 36.38 33.95 3i50 s VAL 109 CO 0.09 0.10 -0.06 0.00 0.00 0.00 0.00 175.10 175.23 3i50 s ALA 110 N 1.18 2.96 -0.26 5.51 0.00 -0.85 -0.66 121.76 129.64 3i50 s ALA 110 Ca -0.05 -0.86 0.03 0.00 0.00 0.00 0.00 51.96 51.08 3i50 s ALA 110 Cb -0.18 -1.37 0.06 0.00 0.00 0.00 0.00 23.12 21.64 3i50 s ALA 110 CO -0.06 0.39 -0.09 0.08 0.00 0.00 0.00 175.76 176.08 3i50 s VAL 111 N -0.21 2.04 -0.07 0.00 1.01 -1.26 -1.51 120.40 120.39 3i50 s VAL 111 Ca 0.03 -1.59 -0.31 0.00 0.00 0.00 0.00 61.98 60.10 3i50 s VAL 111 Cb -0.13 -2.20 0.12 0.00 0.00 0.00 0.00 36.38 34.17 3i50 s VAL 111 CO 0.03 -0.08 1.07 -0.94 0.00 0.00 0.00 175.10 175.17 3i50 s SER 112 N 1.15 -0.22 0.00 3.32 1.04 -0.62 -4.81 113.70 113.56 3i50 s SER 112 Ca -0.07 -0.05 0.25 0.00 0.48 0.00 0.00 55.95 56.56 3i50 s SER 112 Cb -0.20 0.27 0.40 0.00 0.10 0.00 0.00 66.02 66.59 3i50 s SER 112 CO -0.06 -0.45 1.35 -1.54 0.98 0.00 0.00 173.24 173.53 3i50 n SER 113 N -0.22 1.76 -3.93 7.02 3.41 -1.26 -4.00 113.62 116.41 3i50 n SER 113 Ca -0.05 -1.37 -0.29 0.00 -0.26 0.00 0.00 58.87 56.90 3i50 n SER 113 Cb 0.60 0.24 0.27 0.00 -0.26 0.00 0.00 64.21 65.07 3i50 n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i50 s ALA 114 N -2.36 -0.57 0.06 7.33 0.00 -1.26 -5.02 121.76 119.93 3i50 s ALA 114 Ca 0.24 -0.54 0.04 0.00 0.00 0.00 0.00 51.96 51.70 3i50 s ALA 114 Cb 0.19 -3.07 -0.04 0.00 0.00 0.00 0.00 23.12 20.21 3i50 s ALA 114 CO 0.49 -4.22 -0.03 0.95 0.00 0.00 0.00 175.76 172.95 3i50 s THR 115 N -2.41 3.84 0.66 0.00 -4.23 -1.26 -5.04 115.64 107.20 3i50 s THR 115 Ca 0.69 -0.92 -0.17 0.00 -1.18 0.00 0.00 61.69 60.11 3i50 s THR 115 Cb -0.18 -2.77 0.00 0.00 1.34 0.00 0.00 72.50 70.89 3i50 s THR 115 CO 0.61 0.23 1.20 -0.89 -0.54 0.00 0.00 174.62 175.23 3i50 s THR 116 N -1.18 2.53 -0.23 3.99 2.01 -1.26 -4.64 115.64 116.86 3i50 s THR 116 Ca 0.22 0.29 -0.12 0.00 0.31 0.00 0.00 61.69 62.39 3i50 s THR 116 Cb -0.11 -2.96 0.08 0.00 0.01 0.00 0.00 72.50 69.51 3i50 s THR 116 CO 0.14 -0.11 0.54 -0.89 -0.69 0.00 0.00 174.62 173.61 3i50 s THR 117 N -1.83 -0.18 -0.14 -0.82 2.01 0.71 -4.90 115.64 110.49 3i50 s THR 117 Ca 0.75 0.06 -0.29 0.00 0.31 0.00 0.00 61.69 62.51 3i50 s THR 117 Cb -0.29 -0.81 -0.01 0.00 0.01 0.00 0.00 72.50 71.40 3i50 s THR 117 CO 0.39 0.02 1.07 0.00 -0.69 0.00 0.00 174.62 175.42 3i50 s ALA 118 N 1.78 3.52 1.22 7.40 0.00 -1.26 -3.40 121.76 131.02 3i50 s ALA 118 Ca -0.08 0.36 -0.16 0.00 0.00 0.00 0.00 51.96 52.08 3i50 s ALA 118 Cb -0.08 -3.50 0.26 0.00 0.00 0.00 0.00 23.12 19.80 3i50 s ALA 118 CO -0.16 -0.81 0.69 -2.30 0.00 0.00 0.00 175.76 173.18 3i50 n PRO 119 N 5.56 -2.72 -3.89 0.00 -0.02 -1.24 -4.83 135.00 127.86 3i50 n PRO 119 Ca 0.10 -0.78 -0.28 0.00 -2.02 0.00 0.00 63.50 60.53 3i50 n PRO 119 Cb 0.47 -1.96 -0.12 0.00 -0.02 0.00 0.00 33.50 31.87 3i50 n PRO 119 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3i50 s SER 120 N -2.31 4.79 0.07 2.55 0.01 0.01 -4.98 113.70 113.84 3i50 s SER 120 Ca 0.64 -3.86 -0.31 0.00 1.31 0.00 0.00 55.95 53.73 3i50 s SER 120 Cb -0.19 -1.62 -0.06 0.00 0.21 0.00 0.00 66.02 64.35 3i50 s SER 120 CO 0.63 -0.08 1.24 -0.69 0.41 0.00 0.00 173.24 174.75 3i50 s VAL 121 N -1.45 3.88 0.21 3.43 1.01 -1.26 -3.73 120.40 122.49 3i50 s VAL 121 Ca 0.25 1.35 0.08 0.00 0.00 0.00 0.00 61.98 63.66 3i50 s VAL 121 Cb -0.04 -3.86 -0.05 0.00 0.00 0.00 0.00 36.38 32.43 3i50 s VAL 121 CO -0.17 0.10 -0.15 -0.31 0.00 0.00 0.00 175.10 174.57 3i50 s TYR 122 N 1.09 1.79 -0.71 5.22 2.02 -0.88 -5.00 117.35 120.87 3i50 s TYR 122 Ca 0.60 -0.54 -0.24 0.00 -0.37 0.00 0.00 57.07 56.52 3i50 s TYR 122 Cb -0.31 -0.82 0.06 0.00 -0.40 0.00 0.00 41.96 40.48 3i50 s TYR 122 CO 0.29 0.40 1.10 -1.25 -1.57 0.00 0.00 175.55 174.53 3i50 s PRO 123 N -3.59 3.16 -1.23 -1.71 0.04 -1.26 -2.95 135.00 127.46 3i50 s PRO 123 Ca 0.23 -0.63 -0.20 0.00 0.04 0.00 0.00 61.00 60.45 3i50 s PRO 123 Cb -0.01 -4.25 -0.01 0.00 0.04 0.00 0.00 34.50 30.26 3i50 s PRO 123 CO 0.08 -1.96 1.88 1.28 0.04 0.00 0.00 177.00 178.32 3i50 n LEU 124 N 8.37 4.45 -4.77 -3.56 4.77 -1.11 -4.95 117.00 120.20 3i50 n LEU 124 Ca 0.00 -3.59 -0.40 0.00 -0.03 0.00 0.00 56.01 52.00 3i50 n LEU 124 Cb 0.47 -1.67 -0.06 0.00 -2.33 0.00 0.00 43.42 39.83 3i50 n LEU 124 CO 0.67 -0.46 0.50 -0.69 -1.33 0.00 0.00 177.39 176.08 3i50 s VAL 125 N 6.49 4.38 -0.29 4.08 1.01 -1.26 -3.56 120.40 131.26 3i50 s VAL 125 Ca 0.58 1.74 -0.34 0.00 0.00 0.00 0.00 61.98 63.97 3i50 s VAL 125 Cb 0.05 -4.16 -0.10 0.00 0.00 0.00 0.00 36.38 32.17 3i50 s VAL 125 CO 0.08 0.50 2.16 -2.65 0.00 0.00 0.00 175.10 175.19 3i50 n PRO 126 N 1.75 1.40 0.32 2.72 -0.02 -1.26 -5.08 135.00 134.83 3i50 n PRO 126 Ca -0.05 0.40 0.19 0.00 -2.02 0.00 0.00 63.50 62.03 3i50 n PRO 126 Cb 0.49 -2.66 1.07 0.00 -0.02 0.00 0.00 33.50 32.38 3i50 n PRO 126 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3i50 h GLY 127 N 12.59 0.00 0.00 -1.23 0.00 -1.93 -3.53 103.07 108.97 3i50 h GLY 127 Ca -0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.00 3i50 h GLY 127 CO 1.00 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.98 3i50 n SER 135 N -3.37 0.00 -3.69 0.19 7.64 -1.26 -5.27 113.62 107.86 3i50 n SER 135 Ca -0.03 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.73 3i50 n SER 135 Cb 0.10 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.20 3i50 n SER 135 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 3i50 s VAL 136 N 0.00 -0.01 -0.08 0.44 -7.23 -1.26 -4.88 120.40 107.38 3i50 s VAL 136 Ca 0.00 0.02 0.02 0.00 -1.81 0.00 0.00 61.98 60.22 3i50 s VAL 136 Cb 0.00 -0.71 0.01 0.00 0.56 0.00 0.00 36.38 36.25 3i50 s VAL 136 CO 0.00 0.01 -0.14 -0.89 -0.31 0.00 0.00 175.10 173.77 3i50 s THR 137 N 0.69 1.35 0.00 5.32 2.01 -1.26 -4.16 115.64 119.59 3i50 s THR 137 Ca -0.03 -0.58 0.00 0.00 0.31 0.00 0.00 61.69 61.38 3i50 s THR 137 Cb -0.05 -1.23 0.00 0.00 0.01 0.00 0.00 72.50 71.23 3i50 s THR 137 CO -0.05 0.41 0.00 0.18 -0.69 0.00 0.00 174.62 174.47 3i50 n LEU 138 N 3.95 0.00 0.00 4.42 4.32 -1.04 -4.59 117.00 124.07 3i50 n LEU 138 Ca -0.21 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.78 3i50 n LEU 138 Cb 0.52 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.32 3i50 n LEU 138 CO 0.25 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 177.03 3i50 n GLY 139 N 5.00 1.13 2.89 -0.72 0.00 -1.23 -3.73 105.19 108.52 3i50 n GLY 139 Ca 0.00 -1.76 -0.23 0.00 0.00 0.00 0.00 46.02 44.04 3i50 n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i50 s LEU 141 N 1.25 4.48 -0.24 0.00 2.96 -1.15 -3.05 118.68 122.93 3i50 s LEU 141 Ca -0.05 1.68 -0.03 0.00 -0.22 0.00 0.00 54.13 55.51 3i50 s LEU 141 Cb -0.14 -3.58 0.08 0.00 0.50 0.00 0.00 46.19 43.05 3i50 s LEU 141 CO -0.02 0.10 0.07 -0.69 -1.32 0.00 0.00 176.35 174.49 3i50 s VAL 142 N -1.35 0.47 0.48 1.68 1.01 -0.76 -2.08 120.40 119.85 3i50 s VAL 142 Ca 0.42 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 61.62 3i50 s VAL 142 Cb -0.21 -1.16 -0.01 0.00 0.00 0.00 0.00 36.38 35.00 3i50 s VAL 142 CO 0.25 -0.43 0.06 -0.54 0.00 0.00 0.00 175.10 174.44 3i50 s LYS 143 N 1.86 2.12 -0.66 2.72 1.02 -1.24 -1.73 119.74 123.82 3i50 s LYS 143 Ca 0.04 -2.35 -0.12 0.00 0.02 0.00 0.00 55.97 53.56 3i50 s LYS 143 Cb -0.17 -1.11 0.02 0.00 -0.52 0.00 0.00 37.83 36.05 3i50 s LYS 143 CO -0.18 -0.46 0.64 0.41 -0.92 0.00 0.00 175.35 174.85 3i50 n GLY 144 N -1.15 -0.93 3.30 -3.33 0.00 -1.24 -0.81 105.19 101.03 3i50 n GLY 144 Ca -0.15 0.81 -0.10 0.00 0.00 0.00 0.00 46.02 46.58 3i50 n GLY 144 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3i50 s TYR 145 N -2.56 -0.15 -0.29 1.61 -0.85 -1.25 -3.66 117.35 110.20 3i50 s TYR 145 Ca 0.13 -0.15 -0.22 0.00 -0.52 0.00 0.00 57.07 56.31 3i50 s TYR 145 Cb -0.02 0.20 0.17 0.00 0.38 0.00 0.00 41.96 42.69 3i50 s TYR 145 CO 0.84 -0.66 1.22 0.12 -1.52 0.00 0.00 175.55 175.55 3i50 s PHE 146 N -3.66 -0.26 0.63 -3.49 2.19 -1.22 -2.19 117.98 109.98 3i50 s PHE 146 Ca 0.02 0.59 0.03 0.00 0.33 0.00 0.00 56.93 57.90 3i50 s PHE 146 Cb 0.02 0.35 0.09 0.00 -1.31 0.00 0.00 43.02 42.17 3i50 s PHE 146 CO -0.11 -0.13 0.87 -1.25 1.83 0.00 0.00 175.22 176.44 3i50 s PRO 147 N 0.46 2.09 0.94 10.12 0.04 -1.26 -0.21 135.00 147.18 3i50 s PRO 147 Ca 0.01 -1.16 -0.11 0.00 0.04 0.00 0.00 61.00 59.78 3i50 s PRO 147 Cb -0.04 -2.47 0.16 0.00 0.04 0.00 0.00 34.50 32.19 3i50 s PRO 147 CO -0.12 -1.07 1.10 -2.00 0.04 0.00 0.00 177.00 174.95 3i50 s GLU 148 N -4.90 0.88 0.16 4.56 2.12 -1.26 -4.69 118.70 115.57 3i50 s GLU 148 Ca 0.62 1.15 0.05 0.00 0.36 0.00 0.00 54.97 57.15 3i50 s GLU 148 Cb -0.07 -1.74 -0.04 0.00 0.26 0.00 0.00 34.13 32.54 3i50 s GLU 148 CO 0.41 -2.59 0.16 -1.25 -0.54 0.00 0.00 175.26 171.45 3i50 s PRO 149 N -4.73 3.00 0.34 4.30 0.04 -1.26 -4.94 135.00 131.75 3i50 s PRO 149 Ca 0.65 -0.82 0.07 0.00 0.04 0.00 0.00 61.00 60.94 3i50 s PRO 149 Cb -0.21 -2.71 -0.01 0.00 0.04 0.00 0.00 34.50 31.62 3i50 s PRO 149 CO 0.59 0.49 0.46 0.14 0.04 0.00 0.00 177.00 178.72 3i50 s VAL 150 N -1.75 3.92 -0.07 -0.36 -7.23 -1.26 -4.34 120.40 109.32 3i50 s VAL 150 Ca 0.32 -1.03 -0.01 0.00 -1.81 0.00 0.00 61.98 59.45 3i50 s VAL 150 Cb -0.10 -3.35 0.03 0.00 0.56 0.00 0.00 36.38 33.51 3i50 s VAL 150 CO 0.24 -0.14 -0.02 0.42 -0.31 0.00 0.00 175.10 175.29 3i50 s THR 151 N -2.20 0.48 0.07 5.32 -4.23 -0.51 -4.99 115.64 109.59 3i50 s THR 151 Ca 0.46 0.01 0.07 0.00 -1.18 0.00 0.00 61.69 61.04 3i50 s THR 151 Cb -0.09 -0.59 -0.04 0.00 1.34 0.00 0.00 72.50 73.12 3i50 s THR 151 CO 0.31 0.26 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.83 3i50 s VAL 152 N 1.62 3.17 0.24 2.29 1.01 -1.25 0.11 120.40 127.59 3i50 s VAL 152 Ca 0.00 -1.21 -0.06 0.00 0.00 0.00 0.00 61.98 60.70 3i50 s VAL 152 Cb -0.13 -2.43 -0.02 0.00 0.00 0.00 0.00 36.38 33.81 3i50 s VAL 152 CO -0.04 0.21 0.33 -0.54 0.00 0.00 0.00 175.10 175.06 3i50 s LYS 153 N -1.88 1.44 -0.04 2.72 1.02 0.11 -4.94 119.74 118.18 3i50 s LYS 153 Ca 0.18 -1.48 0.02 0.00 0.02 0.00 0.00 55.97 54.71 3i50 s LYS 153 Cb -0.11 0.38 0.01 0.00 -0.52 0.00 0.00 37.83 37.60 3i50 s LYS 153 CO 0.10 -0.55 -0.07 -1.58 -0.92 0.00 0.00 175.35 172.32 3i50 s TRP 154 N -3.97 0.93 -1.45 3.18 0.52 -1.26 0.28 118.94 117.17 3i50 s TRP 154 Ca 0.31 -0.27 -0.10 0.00 0.02 0.00 0.00 56.10 56.06 3i50 s TRP 154 Cb 0.03 -0.73 0.04 0.00 -1.15 0.00 0.00 33.47 31.66 3i50 s TRP 154 CO 0.12 -0.17 0.95 0.09 0.02 0.00 0.00 176.95 177.96 3i50 n ASN 155 N 3.71 -5.64 -3.43 2.95 4.13 -1.00 -2.68 115.26 113.31 3i50 n ASN 155 Ca -0.22 -0.55 -0.22 0.00 1.68 0.00 0.00 54.58 55.27 3i50 n ASN 155 Cb 0.52 -4.49 0.08 0.00 -1.54 0.00 0.00 39.78 34.35 3i50 n ASN 155 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 3i50 n TYR 156 N -4.72 -2.65 -0.43 3.10 4.02 -1.26 -1.93 117.16 113.28 3i50 n TYR 156 Ca -0.01 0.96 0.00 0.00 -0.01 0.00 0.00 57.90 58.84 3i50 n TYR 156 Cb 0.56 -4.87 0.00 0.00 -0.02 0.00 0.00 39.34 35.01 3i50 n TYR 156 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3i50 n GLY 157 N -1.81 1.59 0.00 2.72 0.00 -1.11 -4.93 105.19 101.65 3i50 n GLY 157 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3i50 n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i50 n ALA 158 N 0.02 -0.13 -1.55 4.61 0.00 -0.81 -4.63 120.51 118.02 3i50 n ALA 158 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 3i50 n ALA 158 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 3i50 n ALA 158 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3i50 n LEU 159 N -1.42 2.32 -1.68 0.00 -0.00 -1.09 -4.79 117.00 110.34 3i50 n LEU 159 Ca 0.00 -0.20 -0.00 0.00 -0.00 0.00 0.00 56.01 55.81 3i50 n LEU 159 Cb 0.00 -1.49 0.07 0.00 -0.00 0.00 0.00 43.42 42.01 3i50 n LEU 159 CO 0.00 -1.22 0.13 -1.54 -0.00 0.00 0.00 177.39 174.76 3i50 n SER 160 N 13.91 1.87 -3.73 1.96 3.41 -1.26 -4.42 113.62 125.35 3i50 n SER 160 Ca 0.39 -2.71 -0.16 0.00 -0.26 0.00 0.00 58.87 56.13 3i50 n SER 160 Cb 0.45 -0.40 -0.16 0.00 -0.26 0.00 0.00 64.21 63.83 3i50 n SER 160 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3i50 s SER 161 N -2.95 0.33 0.00 4.04 0.01 -1.26 -4.74 113.70 109.13 3i50 s SER 161 Ca 0.36 0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.77 3i50 s SER 161 Cb 0.37 0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.63 3i50 s SER 161 CO -0.09 -0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.00 3i50 n GLY 162 N 4.57 0.64 3.71 3.44 0.00 -1.26 -4.63 105.19 111.66 3i50 n GLY 162 Ca -0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 3i50 n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i50 s VAL 163 N -2.45 4.25 -0.48 1.61 1.01 -1.26 -3.19 120.40 119.89 3i50 s VAL 163 Ca 0.00 1.62 0.05 0.00 0.00 0.00 0.00 61.98 63.65 3i50 s VAL 163 Cb 0.00 -4.04 0.19 0.00 0.00 0.00 0.00 36.38 32.54 3i50 s VAL 163 CO 0.00 0.12 0.44 0.54 0.00 0.00 0.00 175.10 176.20 3i50 n ARG 164 N 3.98 0.79 -2.89 2.72 5.12 0.76 -4.96 116.66 122.18 3i50 n ARG 164 Ca 0.08 -3.56 -0.43 0.00 -1.93 0.00 0.00 57.85 52.02 3i50 n ARG 164 Cb 0.47 -1.75 -0.05 0.00 -1.16 0.00 0.00 32.46 29.98 3i50 n ARG 164 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 3i50 s THR 165 N -0.68 4.50 1.20 0.55 2.01 -1.26 -1.25 115.64 120.70 3i50 s THR 165 Ca 0.32 0.33 -0.19 0.00 0.31 0.00 0.00 61.69 62.47 3i50 s THR 165 Cb 0.06 -4.45 0.28 0.00 0.01 0.00 0.00 72.50 68.40 3i50 s THR 165 CO -0.16 -0.95 1.10 0.68 -0.69 0.00 0.00 174.62 174.60 3i50 s VAL 166 N 3.66 1.62 1.06 3.82 -7.23 -0.65 -4.95 120.40 117.74 3i50 s VAL 166 Ca 0.30 0.00 -0.18 0.00 -1.81 0.00 0.00 61.98 60.29 3i50 s VAL 166 Cb -0.13 -2.48 0.24 0.00 0.56 0.00 0.00 36.38 34.58 3i50 s VAL 166 CO 0.21 0.00 1.27 -0.55 -0.31 0.00 0.00 175.10 175.71 3i50 s SER 167 N -3.85 2.20 -0.01 4.85 0.15 -1.26 -4.43 113.70 111.36 3i50 s SER 167 Ca 0.71 0.32 0.04 0.00 0.70 0.00 0.00 55.95 57.72 3i50 s SER 167 Cb -0.10 -0.37 -0.01 0.00 -1.71 0.00 0.00 66.02 63.82 3i50 s SER 167 CO 0.56 -3.31 -0.14 -0.94 1.20 0.00 0.00 173.24 170.61 3i50 s SER 168 N -4.61 1.68 0.09 5.45 1.04 -1.26 -4.06 113.70 112.03 3i50 s SER 168 Ca 0.74 -0.27 0.10 0.00 0.48 0.00 0.00 55.95 57.00 3i50 s SER 168 Cb -0.05 -0.18 -0.04 0.00 0.10 0.00 0.00 66.02 65.86 3i50 s SER 168 CO 0.54 0.17 -0.25 -0.69 0.98 0.00 0.00 173.24 173.99 3i50 s VAL 169 N -0.37 2.35 0.20 5.02 1.01 -1.05 -4.81 120.40 122.76 3i50 s VAL 169 Ca 0.05 -1.53 -0.30 0.00 0.00 0.00 0.00 61.98 60.20 3i50 s VAL 169 Cb -0.06 -2.00 -0.08 0.00 0.00 0.00 0.00 36.38 34.24 3i50 s VAL 169 CO -0.00 0.22 0.99 -0.22 0.00 0.00 0.00 175.10 176.08 3i50 s LEU 170 N -1.71 4.57 -0.29 3.92 2.96 -1.26 -2.94 118.68 123.94 3i50 s LEU 170 Ca 0.14 1.97 -0.23 0.00 -0.22 0.00 0.00 54.13 55.79 3i50 s LEU 170 Cb -0.10 -3.61 0.15 0.00 0.50 0.00 0.00 46.19 43.13 3i50 s LEU 170 CO 0.05 0.01 1.14 -1.58 -1.32 0.00 0.00 176.35 174.65 3i50 s GLN 171 N -0.79 0.34 -1.56 1.98 0.74 0.65 -4.91 119.66 116.12 3i50 s GLN 171 Ca 0.44 0.45 -0.02 0.00 0.05 0.00 0.00 55.36 56.28 3i50 s GLN 171 Cb -0.27 0.15 0.00 0.00 1.10 0.00 0.00 33.01 33.99 3i50 s GLN 171 CO 0.33 -0.05 0.25 0.43 -0.55 0.00 0.00 175.29 175.70 3i50 n SER 172 N 2.36 -5.66 -2.42 6.67 7.64 -1.26 -0.07 113.62 120.88 3i50 n SER 172 Ca -0.13 -0.13 -0.20 0.00 1.01 0.00 0.00 58.87 59.42 3i50 n SER 172 Cb 0.56 -4.60 -0.01 0.00 -1.01 0.00 0.00 64.21 59.15 3i50 n SER 172 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3i50 n GLY 173 N -1.22 -0.50 3.08 0.23 0.00 -1.26 -4.97 105.19 100.54 3i50 n GLY 173 Ca -0.17 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.66 3i50 n GLY 173 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3i50 s PHE 174 N -3.02 0.97 0.22 1.61 2.99 0.90 -4.86 117.98 116.78 3i50 s PHE 174 Ca 0.01 -0.27 -0.12 0.00 0.00 0.00 0.00 56.93 56.54 3i50 s PHE 174 Cb -0.00 -0.59 -0.07 0.00 0.00 0.00 0.00 43.02 42.35 3i50 s PHE 174 CO 0.01 -0.00 0.59 0.71 -0.00 0.00 0.00 175.22 176.52 3i50 s TYR 175 N -0.60 3.48 -0.13 0.36 1.51 -0.93 -0.25 117.35 120.79 3i50 s TYR 175 Ca 0.01 1.01 -0.04 0.00 -1.01 0.00 0.00 57.07 57.05 3i50 s TYR 175 Cb -0.06 -2.36 0.06 0.00 -0.11 0.00 0.00 41.96 39.49 3i50 s TYR 175 CO 0.00 0.29 0.14 -1.12 -1.11 0.00 0.00 175.55 173.75 3i50 s SER 176 N -2.12 1.45 0.13 2.29 0.01 -1.15 -3.63 113.70 110.68 3i50 s SER 176 Ca 0.45 -0.13 0.11 0.00 1.31 0.00 0.00 55.95 57.69 3i50 s SER 176 Cb -0.12 0.08 -0.04 0.00 0.21 0.00 0.00 66.02 66.15 3i50 s SER 176 CO 0.20 -0.30 -0.27 -1.48 0.41 0.00 0.00 173.24 171.81 3i50 s LEU 177 N 2.24 2.34 0.50 2.44 0.05 -0.71 -2.52 118.68 123.02 3i50 s LEU 177 Ca 0.04 -0.74 0.04 0.00 0.05 0.00 0.00 54.13 53.52 3i50 s LEU 177 Cb -0.14 -1.23 0.00 0.00 -2.05 0.00 0.00 46.19 42.77 3i50 s LEU 177 CO -0.08 0.18 0.20 -0.44 -0.55 0.00 0.00 176.35 175.66 3i50 s SER 178 N -2.08 4.39 -0.27 1.48 0.01 -1.26 -1.82 113.70 114.15 3i50 s SER 178 Ca 0.14 -1.37 -0.25 0.00 1.31 0.00 0.00 55.95 55.78 3i50 s SER 178 Cb -0.10 0.28 0.10 0.00 0.21 0.00 0.00 66.02 66.51 3i50 s SER 178 CO 0.06 -0.90 0.90 -0.55 0.41 0.00 0.00 173.24 173.16 3i50 s SER 179 N -4.05 -0.58 -0.04 2.44 0.15 -1.17 -1.63 113.70 108.82 3i50 s SER 179 Ca 0.25 1.11 -0.06 0.00 0.70 0.00 0.00 55.95 57.94 3i50 s SER 179 Cb 0.01 1.12 0.01 0.00 -1.71 0.00 0.00 66.02 65.45 3i50 s SER 179 CO 0.14 -0.20 0.15 -0.76 1.20 0.00 0.00 173.24 173.77 3i50 s LEU 180 N 0.26 1.47 0.13 3.45 1.02 -0.38 -1.80 118.68 122.84 3i50 s LEU 180 Ca 0.02 0.11 -0.06 0.00 0.02 0.00 0.00 54.13 54.21 3i50 s LEU 180 Cb -0.05 0.58 -0.02 0.00 0.02 0.00 0.00 46.19 46.72 3i50 s LEU 180 CO -0.03 -0.17 0.18 0.54 0.02 0.00 0.00 176.35 176.89 3i50 s VAL 181 N -0.48 0.10 -0.06 -1.59 0.11 -1.24 0.27 120.40 117.51 3i50 s VAL 181 Ca -0.06 -1.50 -0.05 0.00 -2.93 0.00 0.00 61.98 57.44 3i50 s VAL 181 Cb -0.04 -1.75 0.02 0.00 -1.53 0.00 0.00 36.38 33.08 3i50 s VAL 181 CO 0.01 -0.48 0.16 -0.89 -3.33 0.00 0.00 175.10 170.57 3i50 s THR 182 N -3.96 -0.01 0.13 5.04 2.01 -1.19 -2.50 115.64 115.15 3i50 s THR 182 Ca 0.15 0.04 0.02 0.00 0.31 0.00 0.00 61.69 62.21 3i50 s THR 182 Cb 0.05 -0.23 -0.04 0.00 0.01 0.00 0.00 72.50 72.29 3i50 s THR 182 CO -0.03 0.02 -0.04 0.68 -0.69 0.00 0.00 174.62 174.56 3i50 s VAL 183 N 0.32 0.68 0.15 3.82 -7.23 -1.26 -4.72 120.40 112.16 3i50 s VAL 183 Ca -0.02 -1.96 -0.33 0.00 -1.81 0.00 0.00 61.98 57.86 3i50 s VAL 183 Cb -0.03 -1.85 -0.16 0.00 0.56 0.00 0.00 36.38 34.89 3i50 s VAL 183 CO -0.01 -0.72 1.06 -2.65 -0.31 0.00 0.00 175.10 172.47 3i50 n PRO 184 N -0.12 0.83 0.00 4.82 -0.02 -1.26 -4.46 135.00 134.78 3i50 n PRO 184 Ca -0.10 0.29 0.04 0.00 -2.02 0.00 0.00 63.50 61.72 3i50 n PRO 184 Cb 0.62 -1.72 0.24 0.00 -0.02 0.00 0.00 33.50 32.62 3i50 n PRO 184 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3i50 n SER 185 N 1.91 0.00 -0.00 2.55 3.41 -1.26 -1.26 113.62 118.96 3i50 n SER 185 Ca 0.16 -0.28 -0.08 0.00 -0.26 0.00 0.00 58.87 58.41 3i50 n SER 185 Cb 0.22 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.04 3i50 n SER 185 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3i50 h SER 186 N 0.00 0.00 -0.84 4.04 4.64 -2.00 -3.36 113.55 116.03 3i50 h SER 186 Ca 0.00 -0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 3i50 h SER 186 Cb 0.00 -0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 61.84 3i50 h SER 186 CO 0.00 1.00 0.66 0.35 -0.87 0.00 0.00 176.83 177.97 3i50 n THR 187 N -3.11 3.17 -3.69 2.95 -2.24 -0.39 -4.72 114.28 106.24 3i50 n THR 187 Ca -0.13 -2.16 -0.13 0.00 -2.27 0.00 0.00 64.05 59.36 3i50 n THR 187 Cb 1.03 -0.94 -0.09 0.00 -2.10 0.00 0.00 70.33 68.23 3i50 n THR 187 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 3i50 s TRP 188 N -3.04 -0.62 -0.32 4.78 -0.00 -1.26 -3.41 118.94 115.08 3i50 s TRP 188 Ca 0.52 1.45 -0.05 0.00 -0.00 0.00 0.00 56.10 58.02 3i50 s TRP 188 Cb 0.42 0.24 -0.11 0.00 -0.00 0.00 0.00 33.47 34.02 3i50 s TRP 188 CO 0.03 -0.31 3.20 -2.30 -0.00 0.00 0.00 176.95 177.58 3i50 n PRO 189 N 3.10 2.35 -0.27 5.86 -0.02 -1.26 -4.98 135.00 139.78 3i50 n PRO 189 Ca -0.15 -1.71 0.07 0.00 -2.02 0.00 0.00 63.50 59.69 3i50 n PRO 189 Cb 0.56 -2.12 0.21 0.00 -0.02 0.00 0.00 33.50 32.13 3i50 n PRO 189 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3i50 n SER 190 N 1.86 2.63 -3.96 2.55 3.41 -1.23 -4.90 113.62 113.97 3i50 n SER 190 Ca 0.48 -2.08 -0.10 0.00 -0.26 0.00 0.00 58.87 56.92 3i50 n SER 190 Cb 0.71 -0.35 -0.06 0.00 -0.26 0.00 0.00 64.21 64.25 3i50 n SER 190 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3i50 s GLN 191 N -1.48 1.28 -0.36 4.33 -0.21 -1.22 -5.02 119.66 116.98 3i50 s GLN 191 Ca 0.31 -1.19 -0.28 0.00 0.02 0.00 0.00 55.36 54.21 3i50 s GLN 191 Cb 0.17 0.41 -0.02 0.00 1.00 0.00 0.00 33.01 34.57 3i50 s GLN 191 CO 0.19 -0.49 1.81 0.99 -2.12 0.00 0.00 175.29 175.67 3i50 s THR 192 N -3.99 3.46 -0.62 -0.19 2.01 -1.26 -4.95 115.64 110.10 3i50 s THR 192 Ca 0.19 0.45 -0.13 0.00 0.31 0.00 0.00 61.69 62.51 3i50 s THR 192 Cb 0.02 -3.66 0.16 0.00 0.01 0.00 0.00 72.50 69.03 3i50 s THR 192 CO 0.03 -0.45 0.54 -0.69 -0.69 0.00 0.00 174.62 173.36 3i50 s VAL 193 N 7.17 4.98 -0.01 3.82 1.01 -1.26 -4.80 120.40 131.30 3i50 s VAL 193 Ca 0.79 -1.99 0.03 0.00 0.00 0.00 0.00 61.98 60.81 3i50 s VAL 193 Cb -0.22 -4.17 -0.00 0.00 0.00 0.00 0.00 36.38 31.99 3i50 s VAL 193 CO 0.32 -0.90 -0.10 0.27 0.00 0.00 0.00 175.10 174.69 3i50 s ILE 194 N 0.96 0.83 -0.31 2.22 -4.36 -1.26 -1.44 121.20 117.84 3i50 s ILE 194 Ca 0.09 -0.43 -0.01 0.00 -0.26 0.00 0.00 60.65 60.05 3i50 s ILE 194 Cb -0.22 -0.71 0.06 0.00 1.25 0.00 0.00 42.46 42.84 3i50 s ILE 194 CO -0.02 0.24 0.01 0.00 0.24 0.00 0.00 174.94 175.41 3i50 s ASN 196 N 1.27 6.91 -0.25 0.00 0.01 0.14 -3.40 114.94 119.63 3i50 s ASN 196 Ca -0.03 2.40 -0.04 0.00 -0.71 0.00 0.00 52.86 54.48 3i50 s ASN 196 Cb -0.20 -2.61 0.09 0.00 0.41 0.00 0.00 41.25 38.94 3i50 s ASN 196 CO -0.03 -0.51 0.15 -0.69 -1.51 0.00 0.00 177.10 174.51 3i50 s VAL 197 N 0.03 -0.14 -0.01 1.60 1.01 -1.24 0.09 120.40 121.74 3i50 s VAL 197 Ca 0.56 -0.49 -0.01 0.00 0.00 0.00 0.00 61.98 62.04 3i50 s VAL 197 Cb -0.36 -0.83 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 3i50 s VAL 197 CO 0.39 -0.52 0.11 0.00 0.00 0.00 0.00 175.10 175.08 3i50 s ALA 198 N 2.16 3.69 -0.47 5.51 0.00 0.12 -2.09 121.76 130.68 3i50 s ALA 198 Ca 0.07 -0.83 0.03 0.00 0.00 0.00 0.00 51.96 51.22 3i50 s ALA 198 Cb -0.16 -1.67 0.14 0.00 0.00 0.00 0.00 23.12 21.43 3i50 s ALA 198 CO -0.26 0.70 0.27 -1.58 0.00 0.00 0.00 175.76 174.89 3i50 s HIS 199 N -1.22 2.14 0.58 0.00 2.46 -0.26 -1.42 115.29 117.57 3i50 s HIS 199 Ca 0.23 -2.55 0.29 0.00 0.47 0.00 0.00 55.06 53.50 3i50 s HIS 199 Cb -0.12 -1.95 1.48 0.00 -0.13 0.00 0.00 32.58 31.86 3i50 s HIS 199 CO 0.15 -0.76 1.92 -1.35 -2.47 0.00 0.00 174.74 172.22 3i50 h PRO 200 N 6.50 0.00 0.62 2.88 0.11 -1.83 0.18 132.00 140.45 3i50 h PRO 200 Ca 0.02 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.10 3i50 h PRO 200 Cb 0.91 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.02 3i50 h PRO 200 CO 0.51 0.00 -0.30 0.00 -0.21 0.00 0.00 178.00 178.00 3i50 h ALA 201 N 1.51 -0.83 -0.59 -0.75 0.00 -1.85 -2.97 119.26 113.79 3i50 h ALA 201 Ca 0.23 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3i50 h ALA 201 Cb 1.17 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.28 3i50 h ALA 201 CO -0.00 -0.92 0.00 -1.13 0.00 0.00 0.00 179.25 177.20 3i50 n SER 202 N -5.41 5.40 -4.05 0.00 3.41 -0.91 -4.94 113.62 107.11 3i50 n SER 202 Ca -0.13 -2.79 -0.44 0.00 -0.26 0.00 0.00 58.87 55.26 3i50 n SER 202 Cb 0.35 -0.66 0.02 0.00 -0.26 0.00 0.00 64.21 63.66 3i50 n SER 202 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3i50 n LYS 203 N 0.75 -0.40 -4.33 4.33 5.02 0.57 -4.97 118.16 119.13 3i50 n LYS 203 Ca 0.27 0.15 -0.18 0.00 -2.02 0.00 0.00 58.31 56.53 3i50 n LYS 203 Cb 1.10 -2.37 -0.09 0.00 -0.02 0.00 0.00 35.03 33.65 3i50 n LYS 203 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3i50 s VAL 204 N -3.45 0.34 0.13 -0.18 -7.23 -1.03 -4.99 120.40 103.99 3i50 s VAL 204 Ca 0.42 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.48 3i50 s VAL 204 Cb -0.23 -2.52 0.00 0.00 0.56 0.00 0.00 36.38 34.19 3i50 s VAL 204 CO 0.96 0.00 0.28 -0.62 -0.31 0.00 0.00 175.10 175.41 3i50 s ASP 205 N -3.37 0.01 -0.35 4.85 3.68 -1.26 -1.10 116.67 119.13 3i50 s ASP 205 Ca 0.36 -0.66 0.01 0.00 2.13 0.00 0.00 52.55 54.38 3i50 s ASP 205 Cb 0.05 0.41 0.14 0.00 -1.45 0.00 0.00 42.92 42.08 3i50 s ASP 205 CO 0.17 -0.83 0.29 -0.22 0.13 0.00 0.00 175.17 174.71 3i50 s LEU 206 N -2.89 0.30 -1.21 -1.34 1.98 -0.89 -5.00 118.68 109.63 3i50 s LEU 206 Ca 0.09 -1.63 -0.22 0.00 -2.89 0.00 0.00 54.13 49.48 3i50 s LEU 206 Cb 0.03 0.16 -0.05 0.00 0.66 0.00 0.00 46.19 47.00 3i50 s LEU 206 CO -0.07 -0.31 1.89 -0.63 -1.89 0.00 0.00 176.35 175.34 3i50 s ILE 207 N 1.51 3.68 0.45 6.68 1.01 -1.26 -3.72 121.20 129.55 3i50 s ILE 207 Ca 0.15 -1.14 -0.07 0.00 0.00 0.00 0.00 60.65 59.59 3i50 s ILE 207 Cb -0.18 -4.71 0.10 0.00 0.01 0.00 0.00 42.46 37.68 3i50 s ILE 207 CO -0.09 -1.24 0.62 1.17 0.00 0.00 0.00 174.94 175.40 3i50 n LYS 208 N 8.32 -0.52 -3.23 2.79 4.81 -1.22 -4.95 118.16 124.16 3i50 n LYS 208 Ca 0.46 -1.02 0.04 0.00 -0.87 0.00 0.00 58.31 56.91 3i50 n LYS 208 Cb 0.46 -0.62 -0.02 0.00 0.02 0.00 0.00 35.03 34.88 3i50 n LYS 208 CO 0.00 0.00 0.00 -1.83 1.17 0.00 0.00 177.40 176.74 3i50 s GLU 209 N -4.31 0.43 -0.94 1.64 -1.05 -1.26 -3.50 118.70 109.71 3i50 s GLU 209 Ca 0.36 0.83 -0.23 0.00 -0.15 0.00 0.00 54.97 55.78 3i50 s GLU 209 Cb -0.01 0.47 0.07 0.00 -0.44 0.00 0.00 34.13 34.22 3i50 s GLU 209 CO 0.25 -0.40 1.33 0.42 0.95 0.00 0.00 175.26 177.81 3i50 s ILE 210 N 2.85 4.09 -2.00 1.83 -1.09 -0.52 -4.98 121.20 121.38 3i50 s ILE 210 Ca 0.09 -0.75 0.29 0.00 -2.23 0.00 0.00 60.65 58.05 3i50 s ILE 210 Cb -0.12 -4.96 0.83 0.00 -1.58 0.00 0.00 42.46 36.62 3i50 s ILE 210 CO -0.17 -1.81 2.07 -1.20 -1.23 0.00 0.00 174.94 172.60