#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1suz h LEU 3 N 0.00 0.23 -0.20 1.04 5.85 -1.99 -0.93 115.31 119.31 1suz h LEU 3 Ca 0.00 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 1suz h LEU 3 Cb 0.00 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1suz h LEU 3 CO 0.00 0.17 0.11 -0.09 -0.34 0.00 0.00 178.44 178.29 1suz h ARG 4 N 0.38 0.28 -0.33 1.25 2.43 -1.99 0.16 114.38 116.55 1suz h ARG 4 Ca 0.21 -0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 59.23 1suz h ARG 4 Cb 0.17 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 1suz h ARG 4 CO -0.19 0.26 -0.25 0.66 -1.51 0.00 0.00 179.97 178.95 1suz h SER 5 N 0.22 0.68 -0.61 -3.80 4.64 -1.98 -2.04 113.55 110.66 1suz h SER 5 Ca 0.07 -0.24 -0.09 0.00 -0.47 0.00 0.00 61.79 61.06 1suz h SER 5 Cb 0.07 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 61.95 1suz h SER 5 CO -0.01 0.90 0.05 0.44 -0.87 0.00 0.00 176.83 177.34 1suz h ASP 6 N 0.58 1.03 0.04 4.97 3.32 -0.95 -1.42 116.42 124.00 1suz h ASP 6 Ca 0.08 -0.27 -0.00 0.00 0.02 0.00 0.00 57.03 56.86 1suz h ASP 6 Cb 0.73 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.01 1suz h ASP 6 CO 0.06 1.05 -0.02 0.25 -1.72 0.00 0.00 179.24 178.86 1suz h LEU 7 N 0.98 -0.05 -0.98 1.55 5.85 -0.41 -1.34 115.31 120.92 1suz h LEU 7 Ca 0.18 -0.22 -0.08 0.00 0.84 0.00 0.00 57.88 58.61 1suz h LEU 7 Cb 0.50 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.52 1suz h LEU 7 CO 0.02 0.19 -0.15 -0.29 -0.34 0.00 0.00 178.44 177.88 1suz h ILE 8 N -0.29 1.25 -0.90 4.05 6.09 -1.33 -0.53 117.51 125.85 1suz h ILE 8 Ca -0.01 -1.12 -0.01 0.00 -1.37 0.00 0.00 64.86 62.36 1suz h ILE 8 Cb 0.26 1.16 -0.04 0.00 0.47 0.00 0.00 36.82 38.67 1suz h ILE 8 CO 0.01 0.37 0.53 0.78 -3.07 0.00 0.00 178.15 176.77 1suz h ASN 9 N 0.52 1.09 -0.35 2.19 2.35 -1.20 0.77 115.58 120.96 1suz h ASN 9 Ca 0.09 -0.07 -0.15 0.00 -0.55 0.00 0.00 56.30 55.62 1suz h ASN 9 Cb 0.56 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 1suz h ASN 9 CO 0.04 0.84 -0.33 0.00 -1.65 0.00 0.00 177.43 176.32 1suz h ALA 10 N 1.29 0.67 -0.40 -0.83 0.00 -0.49 -0.51 119.26 118.99 1suz h ALA 10 Ca 0.32 -0.43 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 1suz h ALA 10 Cb -0.04 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1suz h ALA 10 CO -0.06 0.67 -0.12 -0.07 0.00 0.00 0.00 179.25 179.67 1suz h LEU 11 N 0.74 0.79 -0.22 0.00 3.38 -0.84 -0.34 115.31 118.82 1suz h LEU 11 Ca 0.07 -0.37 -0.01 0.00 0.09 0.00 0.00 57.88 57.66 1suz h LEU 11 Cb 0.90 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1suz h LEU 11 CO 0.08 0.99 0.11 0.22 0.09 0.00 0.00 178.44 179.93 1suz h TYR 12 N 0.59 0.32 -0.30 1.13 3.20 -0.75 -0.69 116.97 120.47 1suz h TYR 12 Ca 0.10 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.93 1suz h TYR 12 Cb 0.65 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.81 1suz h TYR 12 CO 0.05 0.31 0.08 0.22 -1.64 0.00 0.00 178.16 177.19 1suz h ASP 13 N 0.23 0.45 -0.71 -2.11 3.58 -1.01 -2.01 116.42 114.83 1suz h ASP 13 Ca 0.08 -0.22 -0.02 0.00 0.42 0.00 0.00 57.03 57.29 1suz h ASP 13 Cb 0.11 -0.12 -0.03 0.00 1.72 0.00 0.00 39.33 41.01 1suz h ASP 13 CO -0.01 0.55 0.38 -0.08 -2.88 0.00 0.00 179.24 177.20 1suz h GLU 14 N 0.33 1.00 -0.78 0.28 4.57 -0.95 -0.70 114.58 118.33 1suz h GLU 14 Ca 0.10 -0.12 -0.00 0.00 -1.18 0.00 0.00 59.36 58.15 1suz h GLU 14 Cb 0.27 -0.19 -0.04 0.00 -0.16 0.00 0.00 28.75 28.63 1suz h GLU 14 CO -0.00 0.75 0.48 -0.97 -1.18 0.00 0.00 179.01 178.10 1suz h ASN 15 N 0.99 0.93 0.51 1.04 -1.24 -0.98 -0.95 115.58 115.87 1suz h ASN 15 Ca 0.25 -0.04 -0.16 0.00 0.71 0.00 0.00 56.30 57.05 1suz h ASN 15 Cb 0.05 -0.23 -0.01 0.00 0.73 0.00 0.00 38.32 38.85 1suz h ASN 15 CO -0.04 0.70 -0.72 1.56 -1.29 0.00 0.00 177.43 177.64 1suz h GLN 16 N 1.07 0.17 0.00 6.67 7.50 -0.59 -3.34 115.11 126.60 1suz h GLN 16 Ca 0.28 -0.15 -0.12 0.00 0.50 0.00 0.00 58.65 59.17 1suz h GLN 16 Cb -0.06 0.03 -0.02 0.00 0.05 0.00 0.00 27.48 27.48 1suz h GLN 16 CO -0.06 0.82 -1.09 0.87 -1.50 0.00 0.00 178.83 177.87 1suz h LYS 17 N 0.11 0.00 -5.51 1.46 6.56 -0.66 -3.47 116.57 115.07 1suz h LYS 17 Ca -0.02 0.00 -0.51 0.00 -1.06 0.00 0.00 60.65 59.06 1suz h LYS 17 Cb 1.28 0.00 -0.28 0.00 -0.57 0.00 0.00 32.23 32.66 1suz h LYS 17 CO 0.11 0.28 -0.82 0.71 -2.06 0.00 0.00 179.45 177.67 1suz s TYR 18 N -3.02 1.42 -0.28 -1.35 2.02 -0.41 -5.09 117.35 110.64 1suz s TYR 18 Ca -0.01 -0.30 0.03 0.00 -0.37 0.00 0.00 57.07 56.43 1suz s TYR 18 Cb 0.08 -0.89 0.07 0.00 -0.40 0.00 0.00 41.96 40.83 1suz s TYR 18 CO 0.79 0.00 -0.04 -0.51 -1.57 0.00 0.00 175.55 174.22 1suz s ASP 19 N -0.63 4.43 0.30 2.29 -0.00 -1.26 -4.70 116.67 117.10 1suz s ASP 19 Ca 0.05 -1.60 -0.29 0.00 -0.00 0.00 0.00 52.55 50.71 1suz s ASP 19 Cb -0.07 -1.48 -0.10 0.00 -0.00 0.00 0.00 42.92 41.27 1suz s ASP 19 CO 0.00 -0.26 1.44 -0.69 -0.00 0.00 0.00 175.17 175.66 1suz s VAL 20 N 1.11 2.46 0.00 -1.27 1.01 -1.26 -4.91 120.40 117.54 1suz s VAL 20 Ca -0.02 0.42 0.00 0.00 0.00 0.00 0.00 61.98 62.38 1suz s VAL 20 Cb -0.19 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 32.92 1suz s VAL 20 CO -0.07 0.08 0.08 0.00 0.00 0.00 0.00 175.10 175.20 1suz n GLY 22 N 0.05 -0.60 3.68 0.00 0.00 -1.26 -3.93 105.19 103.12 1suz n GLY 22 Ca 0.00 -1.03 -0.35 0.00 0.00 0.00 0.00 46.02 44.64 1suz n GLY 22 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1suz s ILE 23 N -2.00 4.30 0.10 -0.61 -4.36 0.20 -4.92 121.20 113.91 1suz s ILE 23 Ca 0.00 -0.25 0.08 0.00 -0.26 0.00 0.00 60.65 60.22 1suz s ILE 23 Cb 0.00 -2.81 -0.04 0.00 1.25 0.00 0.00 42.46 40.86 1suz s ILE 23 CO 0.00 0.60 -0.17 -0.51 0.24 0.00 0.00 174.94 175.10 1suz s ILE 24 N -0.85 2.91 0.30 8.37 2.07 -1.26 -1.33 121.20 131.40 1suz s ILE 24 Ca 0.13 -1.40 0.07 0.00 -1.41 0.00 0.00 60.65 58.03 1suz s ILE 24 Cb -0.11 -2.31 -0.02 0.00 0.13 0.00 0.00 42.46 40.14 1suz s ILE 24 CO 0.02 0.15 0.34 -0.94 -1.91 0.00 0.00 174.94 172.61 1suz s SER 25 N -2.00 5.76 0.51 4.50 1.04 -0.12 -4.97 113.70 118.42 1suz s SER 25 Ca 0.18 -0.23 0.18 0.00 0.48 0.00 0.00 55.95 56.56 1suz s SER 25 Cb -0.11 -1.32 1.31 0.00 0.10 0.00 0.00 66.02 66.00 1suz s SER 25 CO 0.10 -0.26 2.13 0.00 0.98 0.00 0.00 173.24 176.18 1suz h ALA 26 N 1.17 1.82 0.00 5.32 0.00 -2.00 0.12 119.26 125.68 1suz h ALA 26 Ca -0.47 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1suz h ALA 26 Cb 1.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1suz h ALA 26 CO 0.58 0.06 0.00 0.39 0.00 0.00 0.00 179.25 180.28 1suz n GLU 27 N -4.33 0.85 -0.40 0.00 4.71 -1.26 -4.90 120.64 115.31 1suz n GLU 27 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.12 1suz n GLU 27 Cb 0.13 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.06 1suz n GLU 27 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1suz n GLY 28 N 0.97 0.73 3.79 0.62 0.00 0.40 -5.07 105.19 106.64 1suz n GLY 28 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 1suz n GLY 28 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1suz s LYS 29 N -0.60 4.41 -0.06 1.61 2.20 -1.26 -3.92 119.74 122.12 1suz s LYS 29 Ca 0.00 1.00 0.05 0.00 -0.36 0.00 0.00 55.97 56.66 1suz s LYS 29 Cb 0.00 -3.15 -0.01 0.00 -1.51 0.00 0.00 37.83 33.16 1suz s LYS 29 CO 0.00 0.53 -0.22 0.42 -0.36 0.00 0.00 175.35 175.72 1suz s ILE 30 N -1.25 2.34 -0.17 5.43 1.01 0.08 -0.95 121.20 127.69 1suz s ILE 30 Ca 0.37 -0.97 -0.01 0.00 0.00 0.00 0.00 60.65 60.04 1suz s ILE 30 Cb -0.21 -1.87 -0.00 0.00 0.01 0.00 0.00 42.46 40.39 1suz s ILE 30 CO 0.23 0.57 -0.12 -0.31 0.00 0.00 0.00 174.94 175.31 1suz s TYR 31 N -0.25 2.84 0.96 3.97 1.51 -0.44 -0.32 117.35 125.62 1suz s TYR 31 Ca -0.00 -1.05 -0.11 0.00 -1.01 0.00 0.00 57.07 54.90 1suz s TYR 31 Cb -0.13 -1.95 0.17 0.00 -0.11 0.00 0.00 41.96 39.94 1suz s TYR 31 CO 0.03 -0.51 1.12 -2.14 -1.11 0.00 0.00 175.55 172.94 1suz s PRO 32 N 1.02 0.66 0.27 -1.71 0.02 -1.26 -0.63 135.00 133.37 1suz s PRO 32 Ca -0.01 1.40 -0.11 0.00 0.02 0.00 0.00 61.00 62.30 1suz s PRO 32 Cb -0.15 -1.70 -0.08 0.00 0.02 0.00 0.00 34.50 32.60 1suz s PRO 32 CO -0.02 -2.83 0.62 -0.51 -0.33 0.00 0.00 177.00 173.92 1suz s LEU 33 N -6.71 4.11 0.42 -5.54 1.43 -1.25 -4.75 118.68 106.39 1suz s LEU 33 Ca 0.67 1.03 0.03 0.00 -1.03 0.00 0.00 54.13 54.82 1suz s LEU 33 Cb -0.23 -3.81 -0.00 0.00 0.03 0.00 0.00 46.19 42.18 1suz s LEU 33 CO 0.59 -0.14 0.62 -0.83 0.23 0.00 0.00 176.35 176.82 1suz s GLY 34 N -2.43 1.61 0.00 -3.19 0.00 -1.26 -4.64 107.32 97.42 1suz s GLY 34 Ca 0.49 -1.23 0.25 0.00 0.00 0.00 0.00 44.72 44.24 1suz s GLY 34 CO 0.21 -1.07 1.42 -1.14 0.00 0.00 0.00 173.10 172.52 1suz n SER 35 N -1.96 0.85 -4.76 1.64 3.41 -1.26 -4.64 113.62 106.90 1suz n SER 35 Ca 0.02 -0.65 -0.37 0.00 -0.26 0.00 0.00 58.87 57.61 1suz n SER 35 Cb 0.58 0.28 0.02 0.00 -0.26 0.00 0.00 64.21 64.82 1suz n SER 35 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1suz s ASP 36 N -2.76 5.62 0.42 4.04 -4.77 -1.26 -4.83 116.67 113.12 1suz s ASP 36 Ca 0.17 2.42 0.13 0.00 -3.30 0.00 0.00 52.55 51.96 1suz s ASP 36 Cb 0.18 -2.61 0.99 0.00 -1.09 0.00 0.00 42.92 40.39 1suz s ASP 36 CO 0.63 -1.30 1.96 0.74 0.70 0.00 0.00 175.17 177.90 1suz h THR 37 N 1.40 0.89 -0.76 2.11 2.02 -1.99 -1.49 112.91 115.08 1suz h THR 37 Ca -0.50 -0.16 -0.02 0.00 0.77 0.00 0.00 66.41 66.50 1suz h THR 37 Cb 1.28 0.37 -0.04 0.00 -1.74 0.00 0.00 68.15 68.02 1suz h THR 37 CO 0.58 0.09 0.41 0.11 0.37 0.00 0.00 175.52 177.07 1suz h LYS 38 N 0.47 1.05 0.18 6.66 6.56 -1.98 0.57 116.57 130.08 1suz h LYS 38 Ca 0.31 -0.12 -0.01 0.00 -1.06 0.00 0.00 60.65 59.77 1suz h LYS 38 Cb 0.58 -0.21 0.00 0.00 -0.57 0.00 0.00 32.23 32.04 1suz h LYS 38 CO -0.10 0.78 -0.08 0.28 -2.06 0.00 0.00 179.45 178.27 1suz h VAL 39 N 1.06 0.94 -0.43 0.50 2.07 -1.63 -2.76 116.25 116.00 1suz h VAL 39 Ca 0.27 -0.82 -0.08 0.00 0.82 0.00 0.00 66.70 66.89 1suz h VAL 39 Cb 0.03 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1suz h VAL 39 CO -0.04 0.18 -0.07 -0.07 0.02 0.00 0.00 177.57 177.59 1suz h LEU 40 N -0.66 0.71 -0.36 2.57 4.07 -1.25 -1.69 115.31 118.71 1suz h LEU 40 Ca -0.02 -0.19 0.03 0.00 0.08 0.00 0.00 57.88 57.77 1suz h LEU 40 Cb 0.48 -0.19 -0.03 0.00 1.08 0.00 0.00 40.66 41.99 1suz h LEU 40 CO 0.04 0.83 0.17 -1.28 -1.08 0.00 0.00 178.44 177.11 1suz h SER 41 N 0.68 0.23 -0.08 -0.43 0.87 -0.92 -0.51 113.55 113.39 1suz h SER 41 Ca 0.12 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 1suz h SER 41 Cb 0.52 -0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 62.45 1suz h SER 41 CO 0.03 0.18 0.05 0.74 -0.53 0.00 0.00 176.83 177.30 1suz h THR 42 N 0.34 1.04 -0.38 2.23 2.02 -1.16 -1.89 112.91 115.11 1suz h THR 42 Ca 0.15 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.24 1suz h THR 42 Cb 0.08 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 1suz h THR 42 CO -0.12 0.03 0.25 0.40 0.37 0.00 0.00 175.52 176.46 1suz h ILE 43 N 0.09 1.10 0.00 3.11 5.03 -0.88 -0.30 117.51 125.66 1suz h ILE 43 Ca 0.03 -0.19 -0.06 0.00 -0.12 0.00 0.00 64.86 64.51 1suz h ILE 43 Cb 0.01 0.55 -0.01 0.00 -3.03 0.00 0.00 36.82 34.34 1suz h ILE 43 CO -0.01 0.10 -0.29 -0.26 -0.68 0.00 0.00 178.15 177.01 1suz h PHE 44 N 0.52 0.00 -0.29 1.37 0.04 -0.98 0.34 116.94 117.93 1suz h PHE 44 Ca 0.14 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.78 1suz h PHE 44 Cb -0.05 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.09 1suz h PHE 44 CO -0.05 0.29 -0.32 0.93 -0.60 0.00 0.00 178.31 178.56 1suz h GLU 45 N 0.00 0.74 -0.48 1.51 5.08 -0.86 -1.59 114.58 118.98 1suz h GLU 45 Ca -0.00 -0.40 -0.10 0.00 -1.00 0.00 0.00 59.36 57.86 1suz h GLU 45 Cb 0.53 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 1suz h GLU 45 CO 0.04 1.02 -0.11 -0.07 -1.00 0.00 0.00 179.01 178.89 1suz h LEU 46 N 0.49 0.87 -0.94 1.33 3.38 -0.23 -2.63 115.31 117.58 1suz h LEU 46 Ca 0.04 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1suz h LEU 46 Cb 0.90 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.37 1suz h LEU 46 CO 0.08 1.00 0.56 0.15 0.09 0.00 0.00 178.44 180.31 1suz h PHE 47 N 0.79 1.24 -0.09 1.13 3.57 -0.28 -3.06 116.94 120.25 1suz h PHE 47 Ca 0.13 -0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.48 1suz h PHE 47 Cb 0.62 -0.41 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 1suz h PHE 47 CO 0.04 0.83 -0.57 0.77 -2.23 0.00 0.00 178.31 177.14 1suz h SER 48 N 1.29 0.29 -0.29 0.41 0.02 -1.02 -3.39 113.55 110.87 1suz h SER 48 Ca 0.34 -0.16 0.07 0.00 -0.84 0.00 0.00 61.79 61.19 1suz h SER 48 Cb -0.05 -0.08 -0.08 0.00 0.14 0.00 0.00 62.40 62.33 1suz h SER 48 CO -0.06 0.80 -0.30 0.03 -1.14 0.00 0.00 176.83 176.15 1suz h ARG 49 N 0.20 -0.28 -0.52 3.45 3.08 -1.36 -0.35 114.38 118.59 1suz h ARG 49 Ca -0.00 0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 1suz h ARG 49 Cb 1.06 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 31.14 1suz h ARG 49 CO 0.09 -0.19 0.21 -1.35 -1.07 0.00 0.00 179.97 177.66 1suz h PRO 50 N -0.29 0.75 -0.09 0.04 0.11 -1.76 -1.59 132.00 129.17 1suz h PRO 50 Ca 0.14 -0.11 -0.02 0.00 0.11 0.00 0.00 66.00 66.12 1suz h PRO 50 Cb 0.52 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.49 1suz h PRO 50 CO -0.45 0.62 -0.03 0.82 -0.21 0.00 0.00 178.00 178.75 1suz h ILE 51 N 0.74 1.30 -0.98 4.15 2.04 -1.64 -1.07 117.51 122.05 1suz h ILE 51 Ca 0.18 -0.96 0.04 0.00 1.00 0.00 0.00 64.86 65.12 1suz h ILE 51 Cb 0.15 1.75 -0.06 0.00 -0.74 0.00 0.00 36.82 37.92 1suz h ILE 51 CO -0.02 0.27 0.64 0.40 0.00 0.00 0.00 178.15 179.44 1suz h ILE 52 N -0.15 1.14 -0.33 -0.67 2.04 -0.88 -2.25 117.51 116.42 1suz h ILE 52 Ca 0.02 -0.41 -0.07 0.00 1.00 0.00 0.00 64.86 65.40 1suz h ILE 52 Cb 0.44 -0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 36.34 1suz h ILE 52 CO 0.01 0.22 -0.08 -1.13 0.00 0.00 0.00 178.15 177.17 1suz h ASN 53 N 1.20 0.64 -0.18 1.72 -1.24 -1.07 -1.61 115.58 115.05 1suz h ASN 53 Ca 0.40 -0.36 0.00 0.00 0.71 0.00 0.00 56.30 57.05 1suz h ASN 53 Cb 0.05 -0.18 -0.01 0.00 0.73 0.00 0.00 38.32 38.92 1suz h ASN 53 CO -0.13 0.86 0.11 0.50 -1.29 0.00 0.00 177.43 177.48 1suz h LYS 54 N 0.42 0.23 -0.38 6.67 3.64 -1.01 -1.48 116.57 124.66 1suz h LYS 54 Ca 0.08 -0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.34 1suz h LYS 54 Cb 0.58 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 1suz h LYS 54 CO 0.03 0.18 -0.18 0.82 -2.27 0.00 0.00 179.45 178.03 1suz h ILE 55 N 0.22 1.28 -0.22 2.00 1.08 -1.39 -1.52 117.51 118.97 1suz h ILE 55 Ca 0.06 -1.30 0.02 0.00 -0.39 0.00 0.00 64.86 63.25 1suz h ILE 55 Cb -0.00 1.31 -0.02 0.00 -3.07 0.00 0.00 36.82 35.04 1suz h ILE 55 CO -0.01 0.43 0.07 0.00 -0.69 0.00 0.00 178.15 177.95 1suz h ALA 56 N 0.80 0.24 -0.99 1.87 0.00 -1.22 -2.22 119.26 117.75 1suz h ALA 56 Ca 0.09 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1suz h ALA 56 Cb 0.72 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.48 1suz h ALA 56 CO 0.05 -0.35 0.65 1.49 0.00 0.00 0.00 179.25 181.09 1suz h GLU 57 N 0.17 1.31 0.00 0.00 4.81 -1.20 0.12 114.58 119.78 1suz h GLU 57 Ca 0.10 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1suz h GLU 57 Cb 0.07 -0.29 -0.00 0.00 0.63 0.00 0.00 28.75 29.16 1suz h GLU 57 CO -0.11 0.87 -0.05 0.87 -0.73 0.00 0.00 179.01 179.86 1suz h LYS 58 N 1.35 0.00 -0.37 1.92 1.57 -0.67 -2.11 116.57 118.26 1suz h LYS 58 Ca 0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 1suz h LYS 58 Cb -0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.17 1suz h LYS 58 CO -0.08 0.05 0.00 0.72 -0.57 0.00 0.00 179.45 179.58 1suz n HIS 59 N -3.89 0.48 -0.97 -1.35 8.25 -0.64 -4.97 115.22 112.13 1suz n HIS 59 Ca -0.03 -0.27 0.00 0.00 -0.26 0.00 0.00 57.72 57.16 1suz n HIS 59 Cb 0.15 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.25 1suz n HIS 59 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1suz n GLY 60 N 1.31 0.46 3.86 -1.41 0.00 -0.79 -5.03 105.19 103.59 1suz n GLY 60 Ca 0.18 -0.50 -0.36 0.00 0.00 0.00 0.00 46.02 45.34 1suz n GLY 60 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1suz s TYR 61 N -2.00 3.64 0.26 1.61 1.51 0.31 -4.51 117.35 118.18 1suz s TYR 61 Ca 0.00 0.85 -0.21 0.00 -1.01 0.00 0.00 57.07 56.71 1suz s TYR 61 Cb 0.00 -2.20 -0.09 0.00 -0.11 0.00 0.00 41.96 39.57 1suz s TYR 61 CO 0.00 0.58 0.78 0.96 -1.11 0.00 0.00 175.55 176.76 1suz s ILE 62 N -1.25 4.49 -0.14 2.71 -0.00 0.17 -3.81 121.20 123.38 1suz s ILE 62 Ca 0.28 1.38 0.02 0.00 -0.00 0.00 0.00 60.65 62.33 1suz s ILE 62 Cb -0.15 -3.85 0.00 0.00 -0.00 0.00 0.00 42.46 38.46 1suz s ILE 62 CO 0.15 0.13 -0.19 -0.69 -0.00 0.00 0.00 174.94 174.34 1suz s VAL 63 N -1.62 2.39 -0.04 8.37 1.01 -1.26 -1.91 120.40 127.33 1suz s VAL 63 Ca 0.47 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.60 1suz s VAL 63 Cb -0.16 -1.97 0.00 0.00 0.00 0.00 0.00 36.38 34.25 1suz s VAL 63 CO 0.21 0.54 -0.13 -0.70 0.00 0.00 0.00 175.10 175.02 1suz s GLU 64 N 0.67 1.43 0.25 2.72 2.12 -0.15 -4.97 118.70 120.76 1suz s GLU 64 Ca -0.09 -0.44 0.08 0.00 0.36 0.00 0.00 54.97 54.87 1suz s GLU 64 Cb -0.16 -1.26 -0.04 0.00 0.26 0.00 0.00 34.13 32.94 1suz s GLU 64 CO 0.02 0.14 0.12 -1.21 -0.54 0.00 0.00 175.26 173.79 1suz s GLU 65 N 0.24 2.71 0.46 4.30 2.02 -1.26 -0.98 118.70 126.19 1suz s GLU 65 Ca -0.06 -1.15 -0.25 0.00 0.02 0.00 0.00 54.97 53.53 1suz s GLU 65 Cb -0.11 -2.44 -0.08 0.00 0.10 0.00 0.00 34.13 31.60 1suz s GLU 65 CO 0.02 0.40 1.43 -2.14 0.02 0.00 0.00 175.26 174.98 1suz s PRO 66 N -3.69 3.63 0.16 0.39 0.02 -1.26 -4.89 135.00 129.37 1suz s PRO 66 Ca 0.32 2.42 0.23 0.00 0.02 0.00 0.00 61.00 63.99 1suz s PRO 66 Cb -0.08 -2.62 0.21 0.00 0.02 0.00 0.00 34.50 32.04 1suz s PRO 66 CO 0.23 -0.86 1.23 1.57 -0.33 0.00 0.00 177.00 178.84 1suz h LYS 67 N 2.24 0.00 -6.55 5.54 -0.00 -1.98 -3.45 116.57 112.38 1suz h LYS 67 Ca -0.51 0.00 -0.66 0.00 -0.00 0.00 0.00 60.65 59.48 1suz h LYS 67 Cb 1.27 0.00 -0.26 0.00 -0.00 0.00 0.00 32.23 33.24 1suz h LYS 67 CO 0.61 0.00 -0.87 1.14 -0.00 0.00 0.00 179.45 180.33 1suz s GLN 68 N -3.24 1.64 0.68 0.07 0.00 -1.26 -5.10 119.66 112.45 1suz s GLN 68 Ca 0.04 -1.08 -0.16 0.00 -0.00 0.00 0.00 55.36 54.16 1suz s GLN 68 Cb 0.12 -1.82 0.01 0.00 0.00 0.00 0.00 33.01 31.31 1suz s GLN 68 CO 0.74 0.47 1.17 -0.65 0.00 0.00 0.00 175.29 177.02 1suz s GLN 69 N -1.28 2.52 0.00 9.60 -1.52 -1.26 -2.96 119.66 124.76 1suz s GLN 69 Ca 0.11 1.64 0.00 0.00 -1.95 0.00 0.00 55.36 55.16 1suz s GLN 69 Cb -0.10 -1.89 0.00 0.00 -0.22 0.00 0.00 33.01 30.80 1suz s GLN 69 CO 0.02 -1.51 0.00 0.09 -0.25 0.00 0.00 175.29 173.64 1suz n ASN 70 N -2.40 -1.75 -4.58 5.90 3.02 -1.26 -5.02 115.26 109.17 1suz n ASN 70 Ca 0.12 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.33 1suz n ASN 70 Cb 0.51 -0.75 -0.11 0.00 -0.61 0.00 0.00 39.78 38.82 1suz n ASN 70 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1suz s HIS 71 N -2.65 3.18 0.30 3.10 3.76 -1.16 -4.81 115.29 117.02 1suz s HIS 71 Ca 0.00 -0.07 -0.17 0.00 -0.15 0.00 0.00 55.06 54.68 1suz s HIS 71 Cb 0.00 -2.08 -0.09 0.00 1.11 0.00 0.00 32.58 31.53 1suz s HIS 71 CO 0.00 0.05 0.75 -0.47 -0.85 0.00 0.00 174.74 174.22 1suz s TYR 72 N 0.53 3.45 0.43 1.40 6.14 -0.00 -4.62 117.35 124.68 1suz s TYR 72 Ca 0.02 1.30 0.08 0.00 0.64 0.00 0.00 57.07 59.11 1suz s TYR 72 Cb -0.13 -2.59 -0.00 0.00 0.42 0.00 0.00 41.96 39.66 1suz s TYR 72 CO 0.01 0.14 0.47 -1.25 0.64 0.00 0.00 175.55 175.56 1suz s PRO 73 N -2.72 2.61 0.33 4.97 0.04 -1.26 -0.78 135.00 138.20 1suz s PRO 73 Ca 0.52 -1.46 0.03 0.00 0.04 0.00 0.00 61.00 60.12 1suz s PRO 73 Cb -0.12 -2.51 0.62 0.00 0.04 0.00 0.00 34.50 32.53 1suz s PRO 73 CO 0.18 -0.27 1.95 -0.44 0.04 0.00 0.00 177.00 178.46 1suz h ASP 74 N 0.84 0.79 -3.42 6.66 5.19 -1.78 -3.38 116.42 121.33 1suz h ASP 74 Ca -0.40 -0.00 -0.31 0.00 -0.62 0.00 0.00 57.03 55.70 1suz h ASP 74 Cb 1.27 -0.17 -0.35 0.00 0.18 0.00 0.00 39.33 40.26 1suz h ASP 74 CO 0.52 0.53 -0.71 -0.36 -3.12 0.00 0.00 179.24 176.10 1suz s PHE 75 N -5.79 -0.01 -0.21 4.55 0.08 -0.91 -4.29 117.98 111.40 1suz s PHE 75 Ca -0.11 0.26 -0.05 0.00 0.12 0.00 0.00 56.93 57.15 1suz s PHE 75 Cb 0.19 -0.28 -0.02 0.00 -0.57 0.00 0.00 43.02 42.34 1suz s PHE 75 CO 0.78 -0.14 -0.01 0.99 -0.10 0.00 0.00 175.22 176.74 1suz s THR 76 N 1.49 3.72 -0.06 0.64 2.01 -0.15 -0.06 115.64 123.23 1suz s THR 76 Ca -0.04 -0.38 0.03 0.00 0.31 0.00 0.00 61.69 61.60 1suz s THR 76 Cb -0.12 -2.69 -0.02 0.00 0.01 0.00 0.00 72.50 69.67 1suz s THR 76 CO -0.04 0.42 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.41 1suz s LEU 77 N 1.27 2.72 -0.11 4.42 1.02 0.91 -0.98 118.68 127.93 1suz s LEU 77 Ca 0.04 -0.22 -0.30 0.00 0.02 0.00 0.00 54.13 53.67 1suz s LEU 77 Cb -0.15 -1.56 0.10 0.00 0.02 0.00 0.00 46.19 44.60 1suz s LEU 77 CO 0.00 0.32 0.83 -0.72 0.02 0.00 0.00 176.35 176.80 1suz s TYR 78 N -0.58 -0.53 0.12 0.29 1.13 -0.80 -0.28 117.35 116.69 1suz s TYR 78 Ca 0.08 0.94 -0.23 0.00 -1.41 0.00 0.00 57.07 56.45 1suz s TYR 78 Cb -0.11 0.42 -0.07 0.00 -1.10 0.00 0.00 41.96 41.10 1suz s TYR 78 CO 0.01 -0.47 0.69 0.15 -2.51 0.00 0.00 175.55 173.42 1suz s LYS 79 N -1.05 4.42 0.39 -3.49 1.02 -1.26 0.45 119.74 120.22 1suz s LYS 79 Ca -0.06 0.99 0.16 0.00 0.02 0.00 0.00 55.97 57.08 1suz s LYS 79 Cb -0.01 -3.26 1.04 0.00 -0.52 0.00 0.00 37.83 35.08 1suz s LYS 79 CO 0.06 0.58 1.81 -1.35 -0.92 0.00 0.00 175.35 175.52 1suz h PRO 80 N 4.51 0.45 0.00 -1.68 0.11 -1.99 -1.26 132.00 132.14 1suz h PRO 80 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1suz h PRO 80 Cb 1.21 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1suz h PRO 80 CO 0.65 0.29 0.00 -1.13 -0.21 0.00 0.00 178.00 177.61 1suz n SER 81 N -4.59 0.00 -3.12 -2.05 3.41 -1.26 -4.02 113.62 101.99 1suz n SER 81 Ca 0.22 -0.20 -0.19 0.00 -0.26 0.00 0.00 58.87 58.44 1suz n SER 81 Cb 0.75 -0.24 -0.03 0.00 -0.26 0.00 0.00 64.21 64.43 1suz n SER 81 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1suz n GLU 82 N -1.24 1.34 0.13 4.33 1.02 -0.48 -4.95 120.64 120.79 1suz n GLU 82 Ca 0.14 -3.60 0.09 0.00 -0.02 0.00 0.00 57.16 53.76 1suz n GLU 82 Cb 0.19 -1.77 0.48 0.00 -0.02 0.00 0.00 31.44 30.32 1suz n GLU 82 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1suz n PRO 83 N 0.18 0.12 -0.50 3.49 -0.04 -1.25 -1.29 135.00 135.71 1suz n PRO 83 Ca 0.25 0.58 0.09 0.00 -0.04 0.00 0.00 63.50 64.38 1suz n PRO 83 Cb 0.63 -1.86 0.32 0.00 -0.04 0.00 0.00 33.50 32.54 1suz n PRO 83 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1suz n ASN 84 N -2.12 4.33 -2.50 3.54 3.02 -1.26 -4.26 115.26 116.00 1suz n ASN 84 Ca -0.01 -2.35 -0.19 0.00 -0.03 0.00 0.00 54.58 52.00 1suz n ASN 84 Cb 0.06 -0.52 0.01 0.00 -0.61 0.00 0.00 39.78 38.73 1suz n ASN 84 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1suz n LYS 85 N 1.02 2.65 -2.05 3.52 5.02 -0.41 -4.48 118.16 123.43 1suz n LYS 85 Ca 0.23 -4.02 -0.33 0.00 -2.02 0.00 0.00 58.31 52.17 1suz n LYS 85 Cb 0.78 -1.91 0.02 0.00 -0.02 0.00 0.00 35.03 33.90 1suz n LYS 85 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1suz s LYS 86 N -3.44 3.20 -0.14 1.97 1.02 -0.07 -4.61 119.74 117.67 1suz s LYS 86 Ca 0.41 1.38 0.01 0.00 0.02 0.00 0.00 55.97 57.79 1suz s LYS 86 Cb 0.41 -2.00 -0.00 0.00 -0.52 0.00 0.00 37.83 35.71 1suz s LYS 86 CO -0.08 -0.93 -0.17 0.42 -0.92 0.00 0.00 175.35 173.67 1suz s ILE 87 N -2.20 2.62 -0.09 2.17 1.01 0.61 -0.75 121.20 124.57 1suz s ILE 87 Ca 0.67 -0.80 -0.05 0.00 0.00 0.00 0.00 60.65 60.47 1suz s ILE 87 Cb -0.19 -2.08 -0.04 0.00 0.01 0.00 0.00 42.46 40.15 1suz s ILE 87 CO 0.34 0.53 0.11 0.00 0.00 0.00 0.00 174.94 175.92 1suz s ALA 88 N 0.61 3.75 -0.08 9.38 0.00 -0.55 -0.06 121.76 134.81 1suz s ALA 88 Ca -0.09 -0.70 -0.00 0.00 0.00 0.00 0.00 51.96 51.16 1suz s ALA 88 Cb -0.16 -1.83 0.02 0.00 0.00 0.00 0.00 23.12 21.15 1suz s ALA 88 CO 0.03 0.64 -0.05 0.42 0.00 0.00 0.00 175.76 176.80 1suz s ILE 89 N -1.05 0.71 0.18 0.00 1.01 0.92 -0.78 121.20 122.19 1suz s ILE 89 Ca 0.17 -0.12 0.09 0.00 0.00 0.00 0.00 60.65 60.78 1suz s ILE 89 Cb -0.12 -0.78 -0.04 0.00 0.01 0.00 0.00 42.46 41.53 1suz s ILE 89 CO 0.06 0.30 -0.09 -0.62 0.00 0.00 0.00 174.94 174.60 1suz s ASP 90 N 1.60 4.30 -0.15 3.58 -1.08 -0.36 -2.13 116.67 122.43 1suz s ASP 90 Ca 0.01 -0.55 -0.01 0.00 -0.52 0.00 0.00 52.55 51.47 1suz s ASP 90 Cb -0.13 -0.75 -0.02 0.00 -1.46 0.00 0.00 42.92 40.56 1suz s ASP 90 CO -0.05 0.11 -0.10 -0.63 0.52 0.00 0.00 175.17 175.02 1suz s ILE 91 N -1.68 3.27 -0.02 4.11 -1.09 -1.26 -0.77 121.20 123.77 1suz s ILE 91 Ca 0.25 -0.57 0.04 0.00 -2.23 0.00 0.00 60.65 58.14 1suz s ILE 91 Cb -0.09 -2.40 -0.01 0.00 -1.58 0.00 0.00 42.46 38.38 1suz s ILE 91 CO 0.15 0.51 -0.15 0.00 -1.23 0.00 0.00 174.94 174.22 1suz s ALA 92 N 0.49 1.30 0.06 9.38 0.00 0.36 -4.95 121.76 128.41 1suz s ALA 92 Ca -0.07 -0.64 0.03 0.00 0.00 0.00 0.00 51.96 51.28 1suz s ALA 92 Cb -0.15 -0.37 -0.03 0.00 0.00 0.00 0.00 23.12 22.57 1suz s ALA 92 CO 0.04 0.29 -0.10 0.99 0.00 0.00 0.00 175.76 176.98 1suz s THR 93 N -0.21 0.75 0.23 0.00 2.01 -1.26 -0.16 115.64 117.00 1suz s THR 93 Ca 0.03 -1.30 -0.19 0.00 0.31 0.00 0.00 61.69 60.54 1suz s THR 93 Cb -0.08 -0.93 0.02 0.00 0.01 0.00 0.00 72.50 71.52 1suz s THR 93 CO 0.00 -0.42 0.60 0.28 -0.69 0.00 0.00 174.62 174.39 1suz s THR 94 N -1.73 0.01 0.38 -0.82 -1.32 -0.79 -4.84 115.64 106.53 1suz s THR 94 Ca -0.04 -0.91 0.06 0.00 -1.21 0.00 0.00 61.69 59.60 1suz s THR 94 Cb -0.07 -1.80 -0.07 0.00 -1.51 0.00 0.00 72.50 69.04 1suz s THR 94 CO 0.00 -0.04 0.01 -0.72 -2.21 0.00 0.00 174.62 171.66 1suz s TYR 95 N -3.91 2.36 0.04 9.09 1.13 -1.26 -2.68 117.35 122.13 1suz s TYR 95 Ca 0.12 -0.72 0.03 0.00 -1.41 0.00 0.00 57.07 55.09 1suz s TYR 95 Cb -0.03 -1.61 -0.02 0.00 -1.10 0.00 0.00 41.96 39.20 1suz s TYR 95 CO 0.02 0.36 -0.09 -0.08 -2.51 0.00 0.00 175.55 173.25 1suz s THR 96 N -2.84 0.68 0.01 -3.49 -1.32 0.68 -4.88 115.64 104.48 1suz s THR 96 Ca 0.35 -1.04 0.11 0.00 -1.21 0.00 0.00 61.69 59.90 1suz s THR 96 Cb 0.09 -0.70 -0.22 0.00 -1.51 0.00 0.00 72.50 70.15 1suz s THR 96 CO 0.17 -0.28 0.87 0.78 -2.21 0.00 0.00 174.62 173.95 1suz h ASN 97 N 4.63 0.00 -4.04 8.08 -0.26 -1.92 -1.53 115.58 120.54 1suz h ASN 97 Ca -0.36 0.00 -0.42 0.00 -0.56 0.00 0.00 56.30 54.96 1suz h ASN 97 Cb 1.20 0.00 -0.29 0.00 -1.06 0.00 0.00 38.32 38.17 1suz h ASN 97 CO 0.42 0.99 -0.79 -0.75 -1.06 0.00 0.00 177.43 176.24 1suz s LYS 98 N -2.64 0.84 0.40 0.81 2.36 -1.26 -4.76 119.74 115.48 1suz s LYS 98 Ca -0.03 -0.36 -0.27 0.00 -2.55 0.00 0.00 55.97 52.76 1suz s LYS 98 Cb 0.09 -0.81 -0.10 0.00 -1.05 0.00 0.00 37.83 35.95 1suz s LYS 98 CO 0.82 0.21 1.47 -0.85 1.55 0.00 0.00 175.35 178.55 1suz n GLU 99 N 2.88 2.55 -1.30 4.03 -0.00 -1.26 -3.04 120.64 124.51 1suz n GLU 99 Ca -0.14 0.90 -0.10 0.00 -0.00 0.00 0.00 57.16 57.81 1suz n GLU 99 Cb 0.56 -2.65 -0.04 0.00 -0.00 0.00 0.00 31.44 29.31 1suz n GLU 99 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.13 177.40 1suz n ASN 100 N 0.30 -4.53 -4.85 -1.84 6.94 -1.26 -5.03 115.26 104.98 1suz n ASN 100 Ca 0.02 0.26 -0.29 0.00 -0.02 0.00 0.00 54.58 54.55 1suz n ASN 100 Cb 0.39 -2.94 0.09 0.00 -2.36 0.00 0.00 39.78 34.96 1suz n ASN 100 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1suz s GLU 101 N -2.74 1.99 0.61 -3.83 2.02 -1.17 -4.92 118.70 110.67 1suz s GLU 101 Ca 0.00 0.32 -0.18 0.00 0.02 0.00 0.00 54.97 55.13 1suz s GLU 101 Cb 0.00 -1.93 -0.03 0.00 0.10 0.00 0.00 34.13 32.27 1suz s GLU 101 CO 0.00 -1.62 1.21 0.15 0.02 0.00 0.00 175.26 175.02 1suz s LYS 102 N -5.39 2.86 0.11 1.61 1.02 -1.26 -4.64 119.74 114.06 1suz s LYS 102 Ca 0.61 1.81 -0.00 0.00 0.02 0.00 0.00 55.97 58.40 1suz s LYS 102 Cb -0.12 -1.92 -0.04 0.00 -0.52 0.00 0.00 37.83 35.23 1suz s LYS 102 CO 0.52 -1.28 0.02 0.96 -0.92 0.00 0.00 175.35 174.64 1suz s ILE 103 N -1.67 0.25 -0.05 2.17 -4.36 0.56 -4.87 121.20 113.23 1suz s ILE 103 Ca 0.77 -1.90 -0.09 0.00 -0.26 0.00 0.00 60.65 59.17 1suz s ILE 103 Cb -0.30 -1.90 0.02 0.00 1.25 0.00 0.00 42.46 41.53 1suz s ILE 103 CO 0.35 -0.63 0.23 -0.54 0.24 0.00 0.00 174.94 174.59 1suz s LYS 104 N -3.98 0.40 0.32 0.37 3.01 -1.26 -1.47 119.74 117.12 1suz s LYS 104 Ca 0.19 0.06 0.10 0.00 -1.01 0.00 0.00 55.97 55.31 1suz s LYS 104 Cb 0.07 0.18 -0.06 0.00 -1.01 0.00 0.00 37.83 37.02 1suz s LYS 104 CO -0.01 -0.08 -0.08 -0.06 0.51 0.00 0.00 175.35 175.63 1suz s PHE 105 N -0.50 2.45 -0.17 3.18 0.40 -1.26 -4.84 117.98 117.25 1suz s PHE 105 Ca -0.06 -0.41 -0.11 0.00 -0.60 0.00 0.00 56.93 55.76 1suz s PHE 105 Cb -0.04 -1.29 -0.05 0.00 0.51 0.00 0.00 43.02 42.15 1suz s PHE 105 CO 0.01 0.59 0.19 0.95 0.70 0.00 0.00 175.22 177.66 1suz s THR 106 N -2.52 5.38 -0.23 0.64 -4.23 -1.26 -1.16 115.64 112.25 1suz s THR 106 Ca 0.32 0.32 0.12 0.00 -1.18 0.00 0.00 61.69 61.27 1suz s THR 106 Cb -0.01 -3.51 0.45 0.00 1.34 0.00 0.00 72.50 70.77 1suz s THR 106 CO 0.17 0.46 1.34 0.18 -0.54 0.00 0.00 174.62 176.24 1suz n LEU 107 N 3.19 3.41 0.00 4.79 4.77 0.90 -4.90 117.00 129.16 1suz n LEU 107 Ca -0.15 -3.63 0.00 0.00 -0.03 0.00 0.00 56.01 52.19 1suz n LEU 107 Cb 0.52 -0.56 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 1suz n LEU 107 CO 0.37 1.16 0.00 0.61 -1.33 0.00 0.00 177.39 178.20 1suz n GLY 108 N -1.10 1.66 3.76 -0.72 0.00 -1.26 -4.68 105.19 102.86 1suz n GLY 108 Ca 0.25 -1.95 -0.37 0.00 0.00 0.00 0.00 46.02 43.96 1suz n GLY 108 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1suz s GLY 109 N -0.09 2.76 0.00 -0.02 0.00 -1.26 0.57 107.32 109.28 1suz s GLY 109 Ca 0.00 1.01 0.16 0.00 0.00 0.00 0.00 44.72 45.88 1suz s GLY 109 CO 0.00 1.43 1.05 1.58 0.00 0.00 0.00 173.10 177.16 1suz n TYR 110 N -1.09 0.09 -0.25 1.90 0.18 -0.78 -4.56 117.16 112.66 1suz n TYR 110 Ca 0.11 -0.07 0.04 0.00 1.88 0.00 0.00 57.90 59.86 1suz n TYR 110 Cb 0.49 -0.00 0.10 0.00 -0.38 0.00 0.00 39.34 39.54 1suz n TYR 110 CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 1suz n THR 111 N 0.89 1.18 0.00 -3.48 -2.24 -1.26 -4.58 114.28 104.79 1suz n THR 111 Ca 0.10 -1.18 0.00 0.00 -2.27 0.00 0.00 64.05 60.70 1suz n THR 111 Cb 0.41 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 69.01 1suz n THR 111 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1suz n SER 112 N -0.15 0.00 0.23 3.42 3.41 -1.26 -4.76 113.62 114.51 1suz n SER 112 Ca 0.08 0.00 0.18 0.00 -0.26 0.00 0.00 58.87 58.87 1suz n SER 112 Cb 0.41 0.00 0.86 0.00 -0.26 0.00 0.00 64.21 65.22 1suz n SER 112 CO 0.00 0.00 0.00 2.19 -0.16 0.00 0.00 175.04 177.07 1suz h PHE 113 N 0.00 0.00 0.00 7.33 -5.15 -1.47 0.41 116.94 118.06 1suz h PHE 113 Ca 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 1suz h PHE 113 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.17 1suz h PHE 113 CO 0.00 0.00 0.00 -0.84 -2.00 0.00 0.00 178.31 175.47 1suz h ILE 114 N 0.00 0.00 0.00 0.88 3.07 -1.86 -3.04 117.51 116.56 1suz h ILE 114 Ca 0.08 -0.46 -0.21 0.00 1.55 0.00 0.00 64.86 65.81 1suz h ILE 114 Cb 0.58 1.38 -0.04 0.00 -0.27 0.00 0.00 36.82 38.46 1suz h ILE 114 CO -0.00 0.00 -1.85 0.54 -1.05 0.00 0.00 178.15 175.79 1suz n ARG 115 N -2.78 1.81 -3.84 0.16 1.74 0.38 -4.79 116.66 109.35 1suz n ARG 115 Ca 0.02 -0.02 -0.30 0.00 -0.77 0.00 0.00 57.85 56.78 1suz n ARG 115 Cb 0.31 -1.33 -0.13 0.00 -1.02 0.00 0.00 32.46 30.29 1suz n ARG 115 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1suz s ASN 116 N -4.49 4.01 0.20 0.55 3.84 0.12 -5.01 114.94 114.16 1suz s ASN 116 Ca -0.06 -2.86 0.00 0.00 0.21 0.00 0.00 52.86 50.15 1suz s ASN 116 Cb 0.04 -1.36 0.00 0.00 -0.55 0.00 0.00 41.25 39.38 1suz s ASN 116 CO 0.52 -0.24 0.33 -3.20 -2.79 0.00 0.00 177.10 171.72 1suz n ASN 117 N 3.28 0.00 0.00 -4.21 5.15 -1.15 -1.42 115.26 116.91 1suz n ASN 117 Ca 0.07 0.15 0.00 0.00 -0.60 0.00 0.00 54.58 54.20 1suz n ASN 117 Cb 0.33 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.58 1suz n ASN 117 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1suz n THR 118 N -1.09 0.00 -2.41 -0.44 -2.24 -1.26 -0.22 114.28 106.62 1suz n THR 118 Ca 0.00 -0.23 -0.42 0.00 -2.27 0.00 0.00 64.05 61.12 1suz n THR 118 Cb 0.33 1.40 -0.03 0.00 -2.10 0.00 0.00 70.33 69.93 1suz n THR 118 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1suz s LYS 119 N -0.12 4.31 -1.52 -0.78 2.20 -0.51 -3.86 119.74 119.45 1suz s LYS 119 Ca 0.00 1.72 -0.10 0.00 -0.36 0.00 0.00 55.97 57.23 1suz s LYS 119 Cb 0.00 -3.62 0.08 0.00 -1.51 0.00 0.00 37.83 32.77 1suz s LYS 119 CO 0.00 -0.54 0.77 0.09 -0.36 0.00 0.00 175.35 175.31 1suz n ASN 120 N 5.62 -2.89 -4.02 1.43 4.13 -1.26 -2.40 115.26 115.88 1suz n ASN 120 Ca 0.12 -0.90 -0.15 0.00 1.68 0.00 0.00 54.58 55.33 1suz n ASN 120 Cb 0.45 -3.40 -0.13 0.00 -1.54 0.00 0.00 39.78 35.16 1suz n ASN 120 CO 0.00 0.00 0.00 -0.51 0.28 0.00 0.00 177.26 177.03 1suz s ILE 121 N -3.49 0.54 0.15 2.41 2.07 -1.25 -0.82 121.20 120.80 1suz s ILE 121 Ca 0.45 -0.61 -0.14 0.00 -1.41 0.00 0.00 60.65 58.94 1suz s ILE 121 Cb -0.23 -0.51 0.03 0.00 0.13 0.00 0.00 42.46 41.87 1suz s ILE 121 CO 0.87 -0.07 1.68 0.58 -1.91 0.00 0.00 174.94 176.09 1suz h VAL 122 N 4.78 1.23 -3.33 4.00 2.07 -1.28 -3.44 116.25 120.28 1suz h VAL 122 Ca -0.32 -0.75 -0.50 0.00 0.82 0.00 0.00 66.70 65.95 1suz h VAL 122 Cb 1.19 0.78 -0.18 0.00 -1.52 0.00 0.00 31.29 31.57 1suz h VAL 122 CO 0.46 0.28 -0.77 -0.31 0.02 0.00 0.00 177.57 177.24 1suz s TYR 123 N -5.42 1.74 0.33 1.57 2.02 -1.26 -5.11 117.35 111.22 1suz s TYR 123 Ca -0.13 -0.49 -0.28 0.00 -0.37 0.00 0.00 57.07 55.80 1suz s TYR 123 Cb 0.11 -0.87 -0.12 0.00 -0.40 0.00 0.00 41.96 40.68 1suz s TYR 123 CO 0.78 0.30 1.33 -2.30 -1.57 0.00 0.00 175.55 174.09 1suz n PRO 124 N 0.30 2.18 -0.32 -1.71 -0.02 -1.26 -4.85 135.00 129.32 1suz n PRO 124 Ca -0.13 0.77 0.13 0.00 -2.02 0.00 0.00 63.50 62.24 1suz n PRO 124 Cb 0.57 -2.38 0.31 0.00 -0.02 0.00 0.00 33.50 31.98 1suz n PRO 124 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1suz h PHE 125 N 2.85 0.84 0.00 6.00 3.57 -0.93 -0.66 116.94 128.61 1suz h PHE 125 Ca -0.46 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.07 1suz h PHE 125 Cb 1.28 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.79 1suz h PHE 125 CO 0.52 0.09 0.00 -0.40 -2.23 0.00 0.00 178.31 176.29 1suz n ASP 126 N -4.91 0.00 -0.24 0.41 5.68 -1.26 -1.74 116.55 114.48 1suz n ASP 126 Ca 0.22 0.18 0.14 0.00 -0.50 0.00 0.00 54.79 54.82 1suz n ASP 126 Cb 0.60 -0.32 0.48 0.00 -1.14 0.00 0.00 41.12 40.74 1suz n ASP 126 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1suz n GLN 127 N -1.32 0.94 -3.92 0.11 6.02 -0.26 -4.85 117.38 114.10 1suz n GLN 127 Ca 0.05 -0.49 -0.36 0.00 -0.01 0.00 0.00 57.00 56.19 1suz n GLN 127 Cb 0.10 -1.49 -0.07 0.00 1.02 0.00 0.00 30.24 29.80 1suz n GLN 127 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1suz s TYR 128 N -2.40 3.46 -0.77 1.08 1.51 -0.71 -0.90 117.35 118.62 1suz s TYR 128 Ca 0.28 0.38 0.16 0.00 -1.01 0.00 0.00 57.07 56.89 1suz s TYR 128 Cb 0.20 -1.99 -0.18 0.00 -0.11 0.00 0.00 41.96 39.88 1suz s TYR 128 CO 0.47 0.53 0.70 0.44 -1.11 0.00 0.00 175.55 176.58 1suz n ILE 129 N 2.56 0.00 -3.71 2.71 -5.35 0.07 -4.84 119.36 110.79 1suz n ILE 129 Ca -0.18 -0.11 -0.14 0.00 -0.27 0.00 0.00 62.75 62.04 1suz n ILE 129 Cb 0.54 1.00 -0.08 0.00 -1.74 0.00 0.00 39.64 39.35 1suz n ILE 129 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1suz s ALA 130 N -2.55 -0.94 -0.21 -1.28 0.00 -1.21 -5.06 121.76 110.51 1suz s ALA 130 Ca 0.06 0.42 -0.04 0.00 0.00 0.00 0.00 51.96 52.41 1suz s ALA 130 Cb 0.12 0.13 0.07 0.00 0.00 0.00 0.00 23.12 23.44 1suz s ALA 130 CO 0.67 -0.32 0.08 -1.01 0.00 0.00 0.00 175.76 175.19 1suz s HIS 131 N -1.59 0.66 0.01 0.00 3.76 -1.26 -1.48 115.29 115.38 1suz s HIS 131 Ca -0.11 -0.74 0.01 0.00 -0.15 0.00 0.00 55.06 54.06 1suz s HIS 131 Cb -0.03 -0.94 -0.04 0.00 1.11 0.00 0.00 32.58 32.67 1suz s HIS 131 CO 0.03 -0.64 0.04 -1.58 -0.85 0.00 0.00 174.74 171.75 1suz s TRP 132 N 1.98 3.17 -0.15 1.40 0.51 0.04 -0.34 118.94 125.57 1suz s TRP 132 Ca 0.03 0.13 -0.02 0.00 -2.12 0.00 0.00 56.10 54.12 1suz s TRP 132 Cb -0.17 -1.69 -0.02 0.00 -0.81 0.00 0.00 33.47 30.79 1suz s TRP 132 CO -0.15 0.51 -0.09 0.42 -0.51 0.00 0.00 176.95 177.13 1suz s ILE 133 N -1.17 3.41 -0.33 2.03 -1.09 0.15 -1.23 121.20 122.97 1suz s ILE 133 Ca 0.22 -0.53 -0.12 0.00 -2.23 0.00 0.00 60.65 57.99 1suz s ILE 133 Cb -0.12 -2.47 -0.02 0.00 -1.58 0.00 0.00 42.46 38.28 1suz s ILE 133 CO 0.13 0.51 0.22 -0.63 -1.23 0.00 0.00 174.94 173.94 1suz s ILE 134 N 0.43 5.19 -0.14 2.92 1.01 0.05 -1.32 121.20 129.34 1suz s ILE 134 Ca -0.07 -0.19 -0.06 0.00 0.00 0.00 0.00 60.65 60.33 1suz s ILE 134 Cb -0.15 -3.64 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 1suz s ILE 134 CO 0.04 0.04 0.06 -0.83 0.00 0.00 0.00 174.94 174.25 1suz s GLY 135 N 1.71 1.94 -0.05 6.18 0.00 -0.23 -0.49 107.32 116.39 1suz s GLY 135 Ca 0.06 -0.74 0.06 0.00 0.00 0.00 0.00 44.72 44.10 1suz s GLY 135 CO 0.10 -0.21 -0.23 -0.19 0.00 0.00 0.00 173.10 172.57 1suz s TYR 136 N -0.27 2.47 -0.01 1.90 1.51 0.77 -0.94 117.35 122.78 1suz s TYR 136 Ca 0.08 -0.56 0.03 0.00 -1.01 0.00 0.00 57.07 55.62 1suz s TYR 136 Cb -0.12 -1.59 -0.01 0.00 -0.11 0.00 0.00 41.96 40.13 1suz s TYR 136 CO 0.02 -0.11 -0.11 0.08 -1.11 0.00 0.00 175.55 174.31 1suz s VAL 137 N -0.34 0.89 0.11 0.71 1.01 -0.56 -1.88 120.40 120.34 1suz s VAL 137 Ca 0.02 -0.51 -0.08 0.00 0.00 0.00 0.00 61.98 61.41 1suz s VAL 137 Cb -0.12 -0.75 -0.01 0.00 0.00 0.00 0.00 36.38 35.50 1suz s VAL 137 CO 0.02 0.23 0.19 -0.72 0.00 0.00 0.00 175.10 174.82 1suz s TYR 138 N -0.30 0.28 -0.20 5.22 1.13 -1.09 -0.24 117.35 122.15 1suz s TYR 138 Ca 0.04 -0.70 -0.11 0.00 -1.41 0.00 0.00 57.07 54.89 1suz s TYR 138 Cb -0.05 -0.11 -0.05 0.00 -1.10 0.00 0.00 41.96 40.66 1suz s TYR 138 CO -0.00 -0.57 0.18 0.99 -2.51 0.00 0.00 175.55 173.63 1suz s THR 139 N -3.90 5.37 0.49 -3.49 2.01 -1.26 -0.23 115.64 114.63 1suz s THR 139 Ca 0.09 0.28 -0.21 0.00 0.31 0.00 0.00 61.69 62.16 1suz s THR 139 Cb 0.05 -3.52 -0.07 0.00 0.01 0.00 0.00 72.50 68.97 1suz s THR 139 CO -0.08 0.40 1.10 0.00 -0.69 0.00 0.00 174.62 175.36 1suz s ARG 140 N 0.55 3.67 -0.08 4.92 3.03 -0.57 -2.05 118.95 128.41 1suz s ARG 140 Ca 0.10 1.55 0.00 0.00 2.03 0.00 0.00 55.73 59.42 1suz s ARG 140 Cb -0.12 -2.17 0.02 0.00 -1.03 0.00 0.00 34.95 31.65 1suz s ARG 140 CO 0.01 -0.58 -0.06 0.08 -1.13 0.00 0.00 175.30 173.61 1suz s VAL 141 N -1.78 0.81 0.27 4.99 1.01 -0.84 -4.84 120.40 120.02 1suz s VAL 141 Ca 0.68 -0.22 -0.30 0.00 0.00 0.00 0.00 61.98 62.14 1suz s VAL 141 Cb -0.22 -0.83 -0.13 0.00 0.00 0.00 0.00 36.38 35.19 1suz s VAL 141 CO 0.26 0.31 1.37 0.00 0.00 0.00 0.00 175.10 177.04 1suz n ALA 142 N 4.50 1.15 -1.00 5.51 0.00 -1.26 -4.51 120.51 124.90 1suz n ALA 142 Ca -0.17 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1suz n ALA 142 Cb 0.51 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.69 1suz n ALA 142 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1suz n THR 143 N 1.46 0.00 0.00 0.00 -1.04 -1.26 -4.96 114.28 108.48 1suz n THR 143 Ca 0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 1suz n THR 143 Cb 0.33 -0.04 0.00 0.00 -1.82 0.00 0.00 70.33 68.80 1suz n THR 143 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 1suz n LYS 145 N 0.00 0.00 0.25 -2.82 2.85 -1.26 -4.98 118.16 112.20 1suz n LYS 145 Ca 0.00 0.00 0.15 0.00 -1.05 0.00 0.00 58.31 57.41 1suz n LYS 145 Cb 0.00 0.00 0.83 0.00 -0.65 0.00 0.00 35.03 35.21 1suz n LYS 145 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1suz h SER 146 N 0.00 0.00 0.22 -5.58 4.64 -2.01 -0.06 113.55 110.76 1suz h SER 146 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1suz h SER 146 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1suz h SER 146 CO 0.00 0.00 -0.07 -1.54 -0.87 0.00 0.00 176.83 174.35 1suz n SER 147 N -2.63 0.59 -1.45 4.97 3.41 -1.26 -3.88 113.62 113.38 1suz n SER 147 Ca -0.02 -0.84 0.09 0.00 -0.26 0.00 0.00 58.87 57.83 1suz n SER 147 Cb 0.14 -0.04 0.32 0.00 -0.26 0.00 0.00 64.21 64.37 1suz n SER 147 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1suz n LEU 148 N -0.74 4.28 -4.47 1.04 4.77 -0.03 -4.52 117.00 117.32 1suz n LEU 148 Ca 0.17 -2.16 -0.22 0.00 -0.03 0.00 0.00 56.01 53.77 1suz n LEU 148 Cb 0.26 -0.54 -0.11 0.00 -2.33 0.00 0.00 43.42 40.70 1suz n LEU 148 CO 0.21 0.75 -0.29 -1.59 -1.33 0.00 0.00 177.39 175.14 1suz s LYS 149 N -1.76 1.68 0.54 3.23 0.00 -1.25 -5.01 119.74 117.17 1suz s LYS 149 Ca 0.46 -1.92 -0.02 0.00 0.00 0.00 0.00 55.97 54.49 1suz s LYS 149 Cb 0.29 -1.03 0.02 0.00 0.00 0.00 0.00 37.83 37.11 1suz s LYS 149 CO 0.23 -0.13 0.79 0.95 0.00 0.00 0.00 175.35 177.19 1suz s THR 150 N -3.16 3.33 0.19 3.79 -4.23 -1.26 -4.38 115.64 109.91 1suz s THR 150 Ca 0.35 -0.41 0.00 0.00 -1.18 0.00 0.00 61.69 60.45 1suz s THR 150 Cb 0.08 -3.28 -0.04 0.00 1.34 0.00 0.00 72.50 70.60 1suz s THR 150 CO 0.15 -0.23 0.06 -0.31 -0.54 0.00 0.00 174.62 173.76 1suz s TYR 151 N -2.79 1.20 0.30 3.99 1.51 0.56 -4.96 117.35 117.15 1suz s TYR 151 Ca 0.54 -1.18 0.08 0.00 -1.01 0.00 0.00 57.07 55.50 1suz s TYR 151 Cb -0.10 -0.67 -0.04 0.00 -0.11 0.00 0.00 41.96 41.04 1suz s TYR 151 CO 0.40 -0.40 0.13 -0.80 -1.11 0.00 0.00 175.55 173.78 1suz s ASN 152 N -3.17 4.90 0.46 2.29 0.01 -1.26 -0.75 114.94 117.42 1suz s ASN 152 Ca 0.30 -0.59 0.22 0.00 -0.71 0.00 0.00 52.86 52.07 1suz s ASN 152 Cb 0.07 -0.93 1.21 0.00 0.41 0.00 0.00 41.25 42.02 1suz s ASN 152 CO 0.07 -0.17 1.89 0.40 -1.51 0.00 0.00 177.10 177.78 1suz h ILE 153 N 1.59 0.67 0.00 0.60 2.04 -1.98 0.50 117.51 120.93 1suz h ILE 153 Ca -0.45 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.32 1suz h ILE 153 Cb 1.25 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 37.72 1suz h ILE 153 CO 0.61 0.05 0.00 -0.46 0.00 0.00 0.00 178.15 178.35 1suz n ASN 154 N -4.43 0.00 -0.48 1.72 0.23 -1.26 -2.70 115.26 108.33 1suz n ASN 154 Ca 0.17 -0.47 0.07 0.00 -0.53 0.00 0.00 54.58 53.82 1suz n ASN 154 Cb 0.73 -0.09 0.16 0.00 -2.08 0.00 0.00 39.78 38.50 1suz n ASN 154 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1suz n GLU 155 N -1.09 2.52 -0.22 -3.83 1.02 0.17 -4.80 120.64 114.40 1suz n GLU 155 Ca 0.14 -2.37 0.01 0.00 -0.02 0.00 0.00 57.16 54.93 1suz n GLU 155 Cb 0.11 -1.49 0.09 0.00 -0.02 0.00 0.00 31.44 30.13 1suz n GLU 155 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1suz h LEU 156 N 1.11 -0.48 -0.29 -4.62 3.38 -1.58 -0.18 115.31 112.64 1suz h LEU 156 Ca 0.00 0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1suz h LEU 156 Cb 1.01 0.36 0.00 0.00 0.09 0.00 0.00 40.66 42.13 1suz h LEU 156 CO 0.08 -0.19 0.00 0.59 0.09 0.00 0.00 178.44 179.01 1suz n ASN 157 N -5.39 0.21 0.01 -0.43 5.03 -1.26 -2.79 115.26 110.64 1suz n ASN 157 Ca 0.09 0.56 0.11 0.00 0.87 0.00 0.00 54.58 56.21 1suz n ASN 157 Cb 0.37 -0.60 -0.06 0.00 -1.02 0.00 0.00 39.78 38.47 1suz n ASN 157 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1suz n GLU 158 N -1.74 0.26 -2.12 3.52 1.02 -0.09 -4.94 120.64 116.55 1suz n GLU 158 Ca 0.02 -0.04 -0.42 0.00 -0.02 0.00 0.00 57.16 56.70 1suz n GLU 158 Cb 0.14 -1.54 -0.03 0.00 -0.02 0.00 0.00 31.44 29.99 1suz n GLU 158 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1suz s ILE 159 N -3.19 3.33 0.20 -3.67 1.01 -1.12 -4.96 121.20 112.80 1suz s ILE 159 Ca 0.03 0.87 -0.30 0.00 0.00 0.00 0.00 60.65 61.25 1suz s ILE 159 Cb 0.15 -3.56 -0.08 0.00 0.01 0.00 0.00 42.46 38.98 1suz s ILE 159 CO 0.84 0.03 1.21 -2.16 0.00 0.00 0.00 174.94 174.86 1suz s PRO 160 N 1.79 4.48 -0.15 2.79 0.04 -1.26 -5.02 135.00 137.68 1suz s PRO 160 Ca 0.66 1.90 -0.13 0.00 0.04 0.00 0.00 61.00 63.48 1suz s PRO 160 Cb -0.36 -3.23 -0.05 0.00 0.04 0.00 0.00 34.50 30.90 1suz s PRO 160 CO 0.29 -0.09 0.26 0.15 0.04 0.00 0.00 177.00 177.65 1suz s LYS 161 N -0.34 4.12 -0.11 4.56 1.02 -1.26 -4.68 119.74 123.05 1suz s LYS 161 Ca 0.53 0.06 0.02 0.00 0.02 0.00 0.00 55.97 56.59 1suz s LYS 161 Cb -0.33 -3.38 0.19 0.00 -0.52 0.00 0.00 37.83 33.79 1suz s LYS 161 CO 0.38 0.36 1.15 -0.35 -0.92 0.00 0.00 175.35 175.96 1suz n PRO 162 N 3.21 1.49 -3.86 -1.68 -0.04 -1.26 -4.83 135.00 128.02 1suz n PRO 162 Ca -0.14 -0.80 -0.09 0.00 -0.04 0.00 0.00 63.50 62.43 1suz n PRO 162 Cb 0.52 -1.40 -0.05 0.00 -0.04 0.00 0.00 33.50 32.53 1suz n PRO 162 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1suz s TYR 163 N -1.00 0.12 0.00 0.54 -0.85 -1.26 -1.99 117.35 112.91 1suz s TYR 163 Ca 0.15 -0.48 0.00 0.00 -0.52 0.00 0.00 57.07 56.22 1suz s TYR 163 Cb 0.12 0.24 0.00 0.00 0.38 0.00 0.00 41.96 42.70 1suz s TYR 163 CO 0.03 -0.90 0.00 0.36 -1.52 0.00 0.00 175.55 173.53 1suz n LYS 164 N -0.32 1.23 -3.21 -3.49 2.85 -0.87 -4.84 118.16 109.51 1suz n LYS 164 Ca -0.07 0.00 -0.24 0.00 -1.05 0.00 0.00 58.31 56.95 1suz n LYS 164 Cb 0.62 -0.53 -0.07 0.00 -0.65 0.00 0.00 35.03 34.40 1suz n LYS 164 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1suz n GLY 165 N 0.57 2.93 3.73 2.58 0.00 -1.26 -4.98 105.19 108.77 1suz n GLY 165 Ca 0.00 -1.62 -0.42 0.00 0.00 0.00 0.00 46.02 43.98 1suz n GLY 165 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1suz s VAL 166 N -1.20 3.27 0.07 1.61 1.01 -1.26 -4.25 120.40 119.65 1suz s VAL 166 Ca 0.35 0.99 0.07 0.00 0.00 0.00 0.00 61.98 63.40 1suz s VAL 166 Cb 0.16 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.88 1suz s VAL 166 CO -0.11 0.12 -0.20 -0.54 0.00 0.00 0.00 175.10 174.38 1suz s LYS 167 N 0.32 1.19 0.06 2.72 1.02 0.67 -4.98 119.74 120.73 1suz s LYS 167 Ca 0.59 -1.01 0.05 0.00 0.02 0.00 0.00 55.97 55.62 1suz s LYS 167 Cb -0.36 -1.35 -0.03 0.00 -0.52 0.00 0.00 37.83 35.57 1suz s LYS 167 CO 0.35 0.33 -0.15 0.54 -0.92 0.00 0.00 175.35 175.51 1suz s VAL 168 N -0.98 1.14 0.09 3.17 0.11 -1.26 -1.50 120.40 121.18 1suz s VAL 168 Ca 0.06 -1.17 -0.03 0.00 -2.93 0.00 0.00 61.98 57.91 1suz s VAL 168 Cb -0.09 -1.07 -0.03 0.00 -1.53 0.00 0.00 36.38 33.66 1suz s VAL 168 CO 0.03 -0.11 0.06 0.72 -3.33 0.00 0.00 175.10 172.47 1suz s PHE 169 N -1.07 0.55 -0.12 1.54 -0.12 -0.12 -4.94 117.98 113.70 1suz s PHE 169 Ca 0.00 -1.01 -0.01 0.00 -0.05 0.00 0.00 56.93 55.86 1suz s PHE 169 Cb -0.09 -0.33 0.03 0.00 -0.63 0.00 0.00 43.02 42.00 1suz s PHE 169 CO 0.02 -0.48 -0.04 -1.17 -0.05 0.00 0.00 175.22 173.50 1suz s LEU 170 N -2.95 1.15 0.05 -1.99 1.98 -1.26 -1.07 118.68 114.60 1suz s LEU 170 Ca 0.13 -0.39 -0.11 0.00 -2.89 0.00 0.00 54.13 50.86 1suz s LEU 170 Cb 0.07 -0.74 0.01 0.00 0.66 0.00 0.00 46.19 46.19 1suz s LEU 170 CO -0.06 -0.17 0.25 -1.58 -1.89 0.00 0.00 176.35 172.89 1suz s GLN 171 N 1.77 0.78 0.27 1.98 2.00 -0.44 -4.96 119.66 121.06 1suz s GLN 171 Ca 0.03 -0.65 -0.29 0.00 -2.00 0.00 0.00 55.36 52.45 1suz s GLN 171 Cb -0.14 0.33 -0.10 0.00 0.80 0.00 0.00 33.01 33.91 1suz s GLN 171 CO -0.07 -0.25 1.31 -0.51 -0.50 0.00 0.00 175.29 175.27 1suz s ASP 172 N -2.26 6.85 0.18 6.67 1.01 -1.26 0.31 116.67 128.17 1suz s ASP 172 Ca -0.03 2.54 -0.14 0.00 0.71 0.00 0.00 52.55 55.64 1suz s ASP 172 Cb 0.00 -2.63 0.17 0.00 1.01 0.00 0.00 42.92 41.47 1suz s ASP 172 CO -0.05 -0.52 1.72 0.50 0.21 0.00 0.00 175.17 177.03 1suz h LYS 173 N 4.38 0.23 -0.01 8.23 3.64 -1.00 -2.49 116.57 129.56 1suz h LYS 173 Ca -0.47 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 58.87 1suz h LYS 173 Cb 1.22 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.98 1suz h LYS 173 CO 0.72 0.15 -0.15 0.11 -2.27 0.00 0.00 179.45 178.01 1suz h TRP 174 N 0.23 0.01 -0.46 1.91 5.08 -1.92 -1.87 115.95 118.94 1suz h TRP 174 Ca 0.23 -0.00 -0.11 0.00 1.08 0.00 0.00 58.89 60.09 1suz h TRP 174 Cb 0.30 -0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.44 1suz h TRP 174 CO -0.22 0.16 -0.13 0.28 -1.28 0.00 0.00 178.44 177.26 1suz h VAL 175 N 0.01 1.27 -0.27 0.12 2.07 -1.83 -3.12 116.25 114.51 1suz h VAL 175 Ca 0.00 -1.26 0.00 0.00 0.82 0.00 0.00 66.70 66.26 1suz h VAL 175 Cb 0.27 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 1suz h VAL 175 CO 0.02 0.43 0.00 2.30 0.02 0.00 0.00 177.57 180.34 1suz n ILE 176 N -4.23 0.33 -2.33 4.57 -5.35 -1.05 -3.49 119.36 107.80 1suz n ILE 176 Ca -0.00 -0.61 -0.38 0.00 -0.27 0.00 0.00 62.75 61.49 1suz n ILE 176 Cb 0.40 0.94 -0.02 0.00 -1.74 0.00 0.00 39.64 39.22 1suz n ILE 176 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1suz s ALA 177 N -1.67 3.13 0.00 -1.28 0.00 -0.73 -1.08 121.76 120.13 1suz s ALA 177 Ca 0.36 0.92 0.00 0.00 0.00 0.00 0.00 51.96 53.23 1suz s ALA 177 Cb 0.21 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.97 1suz s ALA 177 CO 0.30 -0.48 0.00 0.41 0.00 0.00 0.00 175.76 175.99 1suz n GLY 178 N 0.58 3.55 0.33 0.00 0.00 0.09 -4.09 105.19 105.65 1suz n GLY 178 Ca 0.05 -2.10 0.03 0.00 0.00 0.00 0.00 46.02 43.99 1suz n GLY 178 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1suz n ASP 179 N -1.15 2.39 -4.19 1.61 5.68 -1.26 -4.76 116.55 114.87 1suz n ASP 179 Ca 0.00 -1.92 -0.29 0.00 -0.50 0.00 0.00 54.79 52.08 1suz n ASP 179 Cb 0.00 -0.11 -0.16 0.00 -1.14 0.00 0.00 41.12 39.70 1suz n ASP 179 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 1suz s LEU 180 N -0.94 1.98 0.47 -2.12 1.98 -1.26 -4.56 118.68 114.22 1suz s LEU 180 Ca 0.12 -0.45 -0.22 0.00 -2.89 0.00 0.00 54.13 50.68 1suz s LEU 180 Cb 0.06 -1.20 -0.09 0.00 0.66 0.00 0.00 46.19 45.62 1suz s LEU 180 CO 0.08 0.17 0.91 0.00 -1.89 0.00 0.00 176.35 175.62 1suz n ALA 181 N 3.25 -0.12 0.90 5.97 0.00 -1.26 -2.61 120.51 126.64 1suz n ALA 181 Ca -0.19 0.15 0.11 0.00 0.00 0.00 0.00 53.44 53.52 1suz n ALA 181 Cb 0.52 -2.03 0.11 0.00 0.00 0.00 0.00 19.45 18.05 1suz n ALA 181 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1suz n GLY 182 N 1.32 -1.19 3.43 0.00 0.00 0.36 -4.53 105.19 104.58 1suz n GLY 182 Ca 0.11 -0.42 -0.11 0.00 0.00 0.00 0.00 46.02 45.60 1suz n GLY 182 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1suz s SER 183 N -3.23 -0.41 0.00 1.61 1.04 -1.24 -4.85 113.70 106.62 1suz s SER 183 Ca 0.09 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.32 1suz s SER 183 Cb 0.16 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.85 1suz s SER 183 CO 0.76 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 174.63 1suz n GLY 184 N -0.33 0.06 0.28 7.32 0.00 -1.26 -3.32 105.19 107.94 1suz n GLY 184 Ca -0.15 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.06 1suz n GLY 184 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 1suz h ASN 185 N 0.00 0.00 -0.38 1.61 7.08 -2.01 -0.25 115.58 121.64 1suz h ASN 185 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1suz h ASN 185 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.24 1suz h ASN 185 CO 0.00 0.00 0.00 0.35 -2.08 0.00 0.00 177.43 175.70 1suz n THR 186 N -2.87 1.54 -3.80 6.14 -2.24 -1.26 -5.02 114.28 106.76 1suz n THR 186 Ca -0.02 -1.31 -0.29 0.00 -2.27 0.00 0.00 64.05 60.17 1suz n THR 186 Cb 0.13 0.20 0.01 0.00 -2.10 0.00 0.00 70.33 68.57 1suz n THR 186 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1suz n THR 187 N 0.31 -2.01 -3.67 4.28 -2.24 -0.11 -4.73 114.28 106.11 1suz n THR 187 Ca 0.17 -0.28 -0.33 0.00 -2.27 0.00 0.00 64.05 61.35 1suz n THR 187 Cb 0.65 -1.74 -0.05 0.00 -2.10 0.00 0.00 70.33 67.09 1suz n THR 187 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1suz s ASN 188 N -3.52 6.53 0.29 3.42 0.02 -1.21 -1.86 114.94 118.61 1suz s ASN 188 Ca 0.23 0.63 -0.29 0.00 -1.02 0.00 0.00 52.86 52.41 1suz s ASN 188 Cb -0.13 -2.11 -0.10 0.00 0.02 0.00 0.00 41.25 38.93 1suz s ASN 188 CO 0.68 0.13 1.32 -0.63 0.02 0.00 0.00 177.10 178.61 1suz s ILE 189 N -1.51 2.86 0.07 0.60 1.01 0.19 -0.49 121.20 123.93 1suz s ILE 189 Ca 0.36 0.80 0.02 0.00 0.00 0.00 0.00 60.65 61.83 1suz s ILE 189 Cb -0.13 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 38.79 1suz s ILE 189 CO 0.21 0.17 0.13 -0.83 0.00 0.00 0.00 174.94 174.61 1suz s GLY 190 N -0.20 2.08 0.57 6.18 0.00 -1.07 -0.07 107.32 114.81 1suz s GLY 190 Ca 0.52 -0.94 -0.05 0.00 0.00 0.00 0.00 44.72 44.25 1suz s GLY 190 CO 0.47 -0.91 0.78 -1.14 0.00 0.00 0.00 173.10 172.30 1suz n SER 191 N 0.46 0.50 -4.73 1.64 3.41 -0.31 -0.73 113.62 113.86 1suz n SER 191 Ca -0.08 -1.55 -0.31 0.00 -0.26 0.00 0.00 58.87 56.67 1suz n SER 191 Cb 0.51 -0.55 0.12 0.00 -0.26 0.00 0.00 64.21 64.04 1suz n SER 191 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1suz s ILE 192 N -2.46 2.79 -0.39 -1.33 -4.36 -0.24 -3.77 121.20 111.44 1suz s ILE 192 Ca 0.47 0.26 -0.06 0.00 -0.26 0.00 0.00 60.65 61.06 1suz s ILE 192 Cb -0.02 -2.55 0.08 0.00 1.25 0.00 0.00 42.46 41.22 1suz s ILE 192 CO 0.32 -0.33 0.19 -2.28 0.24 0.00 0.00 174.94 173.08 1suz s HIS 193 N -2.80 3.39 0.33 1.37 5.65 -1.26 -4.40 115.29 117.57 1suz s HIS 193 Ca 0.64 -1.81 -0.18 0.00 0.25 0.00 0.00 55.06 53.96 1suz s HIS 193 Cb -0.19 -2.85 0.05 0.00 -1.18 0.00 0.00 32.58 28.41 1suz s HIS 193 CO 0.57 -0.87 0.82 0.00 -0.65 0.00 0.00 174.74 174.61 1suz s ALA 194 N 1.32 -0.96 0.57 1.58 0.00 -0.54 -4.86 121.76 118.86 1suz s ALA 194 Ca 0.03 -0.60 -0.15 0.00 0.00 0.00 0.00 51.96 51.24 1suz s ALA 194 Cb -0.22 0.71 -0.05 0.00 0.00 0.00 0.00 23.12 23.56 1suz s ALA 194 CO -0.00 -1.01 1.02 -1.01 0.00 0.00 0.00 175.76 174.76 1suz s HIS 195 N -2.56 3.33 0.32 0.00 3.76 -1.26 -0.32 115.29 118.56 1suz s HIS 195 Ca 0.16 1.44 0.10 0.00 -0.15 0.00 0.00 55.06 56.61 1suz s HIS 195 Cb -0.05 -2.85 0.89 0.00 1.11 0.00 0.00 32.58 31.69 1suz s HIS 195 CO 0.10 -0.71 1.73 -0.92 -0.85 0.00 0.00 174.74 174.09 1suz h TYR 196 N 0.42 1.01 -0.32 1.40 3.20 -1.91 -0.45 116.97 120.32 1suz h TYR 196 Ca -0.46 0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.45 1suz h TYR 196 Cb 1.20 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 39.16 1suz h TYR 196 CO 0.63 0.06 0.21 1.57 -1.64 0.00 0.00 178.16 178.99 1suz h LYS 197 N 0.58 0.41 0.00 1.82 2.10 -1.99 -1.16 116.57 118.33 1suz h LYS 197 Ca 0.65 -0.02 -0.05 0.00 -2.00 0.00 0.00 60.65 59.22 1suz h LYS 197 Cb 1.23 -0.09 -0.01 0.00 -0.90 0.00 0.00 32.23 32.46 1suz h LYS 197 CO -0.47 0.27 -0.26 -0.44 -2.00 0.00 0.00 179.45 176.55 1suz h ASP 198 N 0.43 0.00 -0.05 7.07 3.32 -1.44 0.28 116.42 126.03 1suz h ASP 198 Ca 0.12 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.07 1suz h ASP 198 Cb -0.04 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.52 1suz h ASP 198 CO -0.03 0.26 -0.37 -0.26 -1.72 0.00 0.00 179.24 177.12 1suz h PHE 199 N 0.00 0.47 -0.82 4.55 -1.00 -1.26 0.75 116.94 119.63 1suz h PHE 199 Ca -0.00 -0.22 0.01 0.00 2.81 0.00 0.00 57.97 60.57 1suz h PHE 199 Cb 0.53 -0.07 -0.04 0.00 3.61 0.00 0.00 35.95 39.98 1suz h PHE 199 CO 0.00 0.99 0.54 0.28 -1.61 0.00 0.00 178.31 178.51 1suz h VAL 200 N -0.19 1.20 0.00 -0.55 2.07 -1.23 -2.61 116.25 114.94 1suz h VAL 200 Ca -0.03 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.11 1suz h VAL 200 Cb 1.05 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1suz h VAL 200 CO 0.08 0.20 0.00 -0.33 0.02 0.00 0.00 177.57 177.54 1suz h GLU 201 N 1.10 0.00 -0.23 1.57 5.08 -0.92 -3.47 114.58 117.71 1suz h GLU 201 Ca 0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 1suz h GLU 201 Cb -0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.14 1suz h GLU 201 CO -0.07 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.35 1suz n GLY 202 N 1.12 0.51 2.77 -3.84 0.00 -0.25 -4.95 105.19 100.54 1suz n GLY 202 Ca 0.05 -0.84 -0.42 0.00 0.00 0.00 0.00 46.02 44.81 1suz n GLY 202 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1suz n LYS 203 N -0.88 3.07 -0.20 1.61 5.02 0.10 -4.92 118.16 121.95 1suz n LYS 203 Ca 0.00 -2.86 0.00 0.00 -2.02 0.00 0.00 58.31 53.43 1suz n LYS 203 Cb 0.50 -3.19 0.00 0.00 -0.02 0.00 0.00 35.03 32.32 1suz n LYS 203 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1suz n GLY 204 N 3.74 1.29 0.03 0.72 0.00 -1.23 -4.90 105.19 104.83 1suz n GLY 204 Ca 0.49 -1.97 -0.00 0.00 0.00 0.00 0.00 46.02 44.54 1suz n GLY 204 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1suz n ILE 205 N -0.32 0.34 -2.79 -0.61 -5.35 -1.26 -5.02 119.36 104.36 1suz n ILE 205 Ca 0.00 -0.31 -0.36 0.00 -0.27 0.00 0.00 62.75 61.81 1suz n ILE 205 Cb 0.00 -0.28 -0.07 0.00 -1.74 0.00 0.00 39.64 37.56 1suz n ILE 205 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1suz s PHE 206 N -2.44 3.56 -0.30 4.28 0.08 -1.26 -4.96 117.98 116.94 1suz s PHE 206 Ca -0.04 1.72 0.22 0.00 0.12 0.00 0.00 56.93 58.95 1suz s PHE 206 Cb 0.04 -2.91 0.12 0.00 -0.57 0.00 0.00 43.02 39.71 1suz s PHE 206 CO 0.39 0.08 1.27 -0.44 -0.10 0.00 0.00 175.22 176.42 1suz h ASP 207 N 2.75 0.00 -5.10 1.36 3.32 -1.95 -3.48 116.42 113.32 1suz h ASP 207 Ca -0.48 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.54 1suz h ASP 207 Cb 1.19 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.63 1suz h ASP 207 CO 0.64 0.05 -0.02 -0.94 -1.72 0.00 0.00 179.24 177.25 1suz s SER 208 N -5.76 -0.24 0.32 6.45 1.04 -1.26 -5.02 113.70 109.23 1suz s SER 208 Ca 0.02 -0.45 0.07 0.00 0.48 0.00 0.00 55.95 56.07 1suz s SER 208 Cb 0.08 0.54 0.53 0.00 0.10 0.00 0.00 66.02 67.27 1suz s SER 208 CO 0.74 -0.98 1.75 -0.08 0.98 0.00 0.00 173.24 175.66 1suz h GLU 209 N 2.27 0.24 -0.42 4.02 4.81 -1.92 -2.10 114.58 121.48 1suz h GLU 209 Ca -0.31 -0.10 -0.10 0.00 -0.13 0.00 0.00 59.36 58.72 1suz h GLU 209 Cb 1.26 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.61 1suz h GLU 209 CO 0.41 0.56 -0.16 -0.44 -0.73 0.00 0.00 179.01 178.64 1suz h ASP 210 N 0.21 0.78 -0.41 1.04 3.32 -1.99 -1.04 116.42 118.34 1suz h ASP 210 Ca 0.03 -0.26 -0.07 0.00 0.02 0.00 0.00 57.03 56.75 1suz h ASP 210 Cb 0.71 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 1suz h ASP 210 CO 0.05 0.95 -0.03 -0.08 -1.72 0.00 0.00 179.24 178.41 1suz h GLU 211 N 0.70 0.74 -0.19 3.56 4.81 -1.89 0.10 114.58 122.41 1suz h GLU 211 Ca 0.11 -0.25 0.04 0.00 -0.13 0.00 0.00 59.36 59.12 1suz h GLU 211 Cb 0.66 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.95 1suz h GLU 211 CO 0.05 0.84 -0.04 0.35 -0.73 0.00 0.00 179.01 179.48 1suz h PHE 212 N 0.57 -0.09 -0.42 0.92 3.57 -1.20 0.18 116.94 120.48 1suz h PHE 212 Ca 0.11 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 1suz h PHE 212 Cb 0.53 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 1suz h PHE 212 CO 0.04 -0.07 0.22 -0.07 -2.23 0.00 0.00 178.31 176.20 1suz h LEU 213 N 0.01 0.54 -0.71 0.59 3.38 -0.93 -0.94 115.31 117.25 1suz h LEU 213 Ca 0.09 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1suz h LEU 213 Cb 0.14 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1suz h LEU 213 CO -0.19 0.49 0.14 -0.78 0.09 0.00 0.00 178.44 178.19 1suz h ASP 214 N 0.55 1.07 0.34 -0.43 3.58 -0.45 0.19 116.42 121.27 1suz h ASP 214 Ca 0.15 -0.24 -0.02 0.00 0.42 0.00 0.00 57.03 57.34 1suz h ASP 214 Cb 0.08 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 40.85 1suz h ASP 214 CO -0.02 1.04 -0.17 0.22 -2.88 0.00 0.00 179.24 177.44 1suz h TYR 215 N 1.05 -0.43 0.00 0.28 5.03 -0.32 -2.55 116.97 120.03 1suz h TYR 215 Ca 0.21 -0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.48 1suz h TYR 215 Cb 0.41 0.14 -0.01 0.00 1.55 0.00 0.00 36.73 38.83 1suz h TYR 215 CO 0.03 -0.25 -0.18 -1.49 -1.32 0.00 0.00 178.16 174.96 1suz h TRP 216 N -0.49 0.00 0.00 -3.82 4.06 -1.02 -2.28 115.95 112.40 1suz h TRP 216 Ca -0.05 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.90 1suz h TRP 216 Cb 0.37 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.53 1suz h TRP 216 CO -0.05 0.18 0.00 0.00 -3.56 0.00 0.00 178.44 175.01 1suz h ARG 217 N 0.00 0.00 0.00 0.49 3.08 -0.38 -3.25 114.38 114.32 1suz h ARG 217 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1suz h ARG 217 Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.84 1suz h ARG 217 CO 0.02 0.00 -0.02 0.09 -1.07 0.00 0.00 179.97 178.99 1suz n ASN 218 N -2.90 1.80 -4.69 7.04 3.02 -0.97 -5.00 115.26 113.55 1suz n ASN 218 Ca 0.01 -2.18 -0.42 0.00 -0.03 0.00 0.00 54.58 51.96 1suz n ASN 218 Cb 0.31 -0.12 -0.03 0.00 -0.61 0.00 0.00 39.78 39.33 1suz n ASN 218 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1suz s TYR 219 N -1.33 3.42 0.60 3.10 5.04 -0.90 -4.94 117.35 122.33 1suz s TYR 219 Ca 0.08 1.48 -0.15 0.00 -2.44 0.00 0.00 57.07 56.04 1suz s TYR 219 Cb 0.07 -3.26 -0.03 0.00 0.35 0.00 0.00 41.96 39.09 1suz s TYR 219 CO 0.01 -0.54 1.05 -1.21 -1.34 0.00 0.00 175.55 173.52 1suz s GLU 220 N 2.11 3.30 0.46 4.97 0.41 -1.26 -4.96 118.70 123.73 1suz s GLU 220 Ca 0.50 1.17 0.28 0.00 -0.41 0.00 0.00 54.97 56.51 1suz s GLU 220 Cb -0.20 -2.03 0.88 0.00 -1.78 0.00 0.00 34.13 31.00 1suz s GLU 220 CO 0.19 -0.82 1.80 0.00 -0.49 0.00 0.00 175.26 175.93 1suz h ARG 221 N 0.34 0.00 -5.17 1.61 3.08 -1.98 -3.45 114.38 108.81 1suz h ARG 221 Ca -0.46 0.00 -0.36 0.00 0.07 0.00 0.00 59.98 59.22 1suz h ARG 221 Cb 1.22 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 31.08 1suz h ARG 221 CO 0.57 0.00 -0.75 0.95 -1.07 0.00 0.00 179.97 179.68 1suz s THR 222 N -3.42 1.11 0.35 2.04 -4.23 -1.26 -5.02 115.64 105.21 1suz s THR 222 Ca 0.04 -1.64 0.08 0.00 -1.18 0.00 0.00 61.69 58.99 1suz s THR 222 Cb 0.08 -1.40 0.31 0.00 1.34 0.00 0.00 72.50 72.83 1suz s THR 222 CO 0.59 -0.47 1.88 0.28 -0.54 0.00 0.00 174.62 176.35 1suz h SER 223 N 3.61 0.68 0.05 3.99 0.02 -1.98 -0.62 113.55 119.29 1suz h SER 223 Ca -0.39 0.03 0.02 0.00 -0.84 0.00 0.00 61.79 60.62 1suz h SER 223 Cb 1.19 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 63.59 1suz h SER 223 CO 0.51 0.37 -0.24 0.06 -1.14 0.00 0.00 176.83 176.39 1suz h GLN 224 N 0.73 -0.38 -0.17 3.45 -0.00 -1.99 -0.32 115.11 116.43 1suz h GLN 224 Ca 0.43 0.03 -0.08 0.00 -0.00 0.00 0.00 58.65 59.02 1suz h GLN 224 Cb 0.62 0.09 -0.00 0.00 -0.00 0.00 0.00 27.48 28.18 1suz h GLN 224 CO -0.19 -0.25 -0.22 -0.07 -0.00 0.00 0.00 178.83 178.09 1suz h LEU 225 N -0.39 0.49 -2.66 0.06 3.38 -1.82 -3.13 115.31 111.23 1suz h LEU 225 Ca 0.05 -0.51 -0.00 0.00 0.09 0.00 0.00 57.88 57.51 1suz h LEU 225 Cb 0.45 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 1suz h LEU 225 CO -0.18 0.90 -0.01 0.03 0.09 0.00 0.00 178.44 179.27 1suz h ARG 226 N 0.09 0.00 -0.11 1.13 3.08 -0.87 -0.79 114.38 116.91 1suz h ARG 226 Ca 0.02 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.01 1suz h ARG 226 Cb 0.79 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.82 1suz h ARG 226 CO 0.05 0.01 -0.19 -0.91 -1.07 0.00 0.00 179.97 177.86 1suz h ASN 227 N 0.00 0.17 0.50 7.04 -0.26 -1.00 -2.47 115.58 119.55 1suz h ASN 227 Ca -0.00 -0.04 0.00 0.00 -0.56 0.00 0.00 56.30 55.70 1suz h ASN 227 Cb 0.08 -0.04 0.00 0.00 -1.06 0.00 0.00 38.32 37.30 1suz h ASN 227 CO 0.00 0.37 -0.63 -0.90 -1.06 0.00 0.00 177.43 175.21 1suz n ASP 228 N -4.24 0.58 0.00 5.81 3.85 -0.31 -4.79 116.55 117.45 1suz n ASP 228 Ca -0.01 -0.26 0.00 0.00 -0.71 0.00 0.00 54.79 53.81 1suz n ASP 228 Cb 0.30 0.38 0.00 0.00 -1.35 0.00 0.00 41.12 40.45 1suz n ASP 228 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.20 177.36 1suz n LYS 229 N -1.64 0.00 -3.66 0.11 4.81 -1.07 -5.13 118.16 111.58 1suz n LYS 229 Ca 0.05 0.00 -0.15 0.00 -0.87 0.00 0.00 58.31 57.34 1suz n LYS 229 Cb 0.36 0.00 -0.08 0.00 0.02 0.00 0.00 35.03 35.33 1suz n LYS 229 CO 0.00 0.00 0.00 1.52 1.17 0.00 0.00 177.40 180.09 1suz s TYR 230 N 0.00 -0.45 0.00 5.64 -0.85 -0.95 -4.84 117.35 115.89 1suz s TYR 230 Ca 0.00 0.86 0.00 0.00 -0.52 0.00 0.00 57.07 57.41 1suz s TYR 230 Cb 0.00 0.23 0.00 0.00 0.38 0.00 0.00 41.96 42.57 1suz s TYR 230 CO 0.00 -0.44 0.22 0.09 -1.52 0.00 0.00 175.55 173.90 1suz n ASN 231 N 1.51 0.44 -3.27 -0.18 3.02 -1.23 -4.65 115.26 110.89 1suz n ASN 231 Ca -0.19 -0.72 -0.10 0.00 -0.03 0.00 0.00 54.58 53.54 1suz n ASN 231 Cb 0.56 0.44 -0.01 0.00 -0.61 0.00 0.00 39.78 40.17 1suz n ASN 231 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1suz s ASN 232 N -0.44 0.23 0.23 6.41 2.20 -1.26 -4.81 114.94 117.50 1suz s ASN 232 Ca 0.00 -1.15 -0.05 0.00 -0.94 0.00 0.00 52.86 50.72 1suz s ASN 232 Cb 0.00 0.75 0.23 0.00 -2.00 0.00 0.00 41.25 40.23 1suz s ASN 232 CO 0.00 -1.46 1.74 -0.29 -2.94 0.00 0.00 177.10 174.15 1suz h ILE 233 N 2.07 1.25 -0.57 0.54 6.09 -1.98 -1.09 117.51 123.81 1suz h ILE 233 Ca -0.29 -0.98 -0.04 0.00 -1.37 0.00 0.00 64.86 62.19 1suz h ILE 233 Cb 1.25 0.69 -0.03 0.00 0.47 0.00 0.00 36.82 39.20 1suz h ILE 233 CO 0.37 0.36 0.22 0.28 -3.07 0.00 0.00 178.15 176.32 1suz h SER 234 N 0.92 0.80 -0.07 2.19 0.02 -1.99 -0.99 113.55 114.42 1suz h SER 234 Ca 0.19 -0.18 -0.10 0.00 -0.84 0.00 0.00 61.79 60.86 1suz h SER 234 Cb 0.41 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 1suz h SER 234 CO 0.01 0.76 -0.24 -0.33 -1.14 0.00 0.00 176.83 175.88 1suz h GLU 235 N 0.79 0.50 -0.02 3.45 5.08 -1.90 -2.03 114.58 120.45 1suz h GLU 235 Ca 0.19 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1suz h GLU 235 Cb 0.21 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 1suz h GLU 235 CO -0.01 0.71 0.01 -0.92 -1.00 0.00 0.00 179.01 177.80 1suz h TYR 236 N 0.44 0.03 -0.40 4.33 3.20 -0.76 -0.02 116.97 123.79 1suz h TYR 236 Ca 0.07 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.94 1suz h TYR 236 Cb 0.67 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.91 1suz h TYR 236 CO 0.02 0.12 0.25 0.00 -1.64 0.00 0.00 178.16 176.92 1suz h ARG 237 N -0.07 0.54 -0.38 1.82 3.08 -1.04 0.05 114.38 118.37 1suz h ARG 237 Ca 0.01 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 59.95 1suz h ARG 237 Cb 0.10 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 1suz h ARG 237 CO -0.00 0.37 -0.05 -0.97 -1.07 0.00 0.00 179.97 178.24 1suz h ASN 238 N 0.55 0.70 -0.72 7.04 -1.24 -0.99 -0.52 115.58 120.39 1suz h ASN 238 Ca 0.15 -0.34 -0.02 0.00 0.71 0.00 0.00 56.30 56.79 1suz h ASN 238 Cb -0.04 -0.19 -0.03 0.00 0.73 0.00 0.00 38.32 38.78 1suz h ASN 238 CO -0.03 0.88 0.36 -0.25 -1.29 0.00 0.00 177.43 177.10 1suz h TRP 239 N 0.51 1.04 -0.25 0.67 7.01 0.06 -1.48 115.95 123.52 1suz h TRP 239 Ca 0.10 -0.04 -0.04 0.00 2.11 0.00 0.00 58.89 61.02 1suz h TRP 239 Cb 0.55 -0.33 -0.01 0.00 -2.10 0.00 0.00 29.16 27.27 1suz h TRP 239 CO 0.05 0.75 -0.02 0.82 -2.79 0.00 0.00 178.44 177.25 1suz h ILE 240 N 1.05 1.26 -0.93 2.65 1.08 -0.90 0.38 117.51 122.10 1suz h ILE 240 Ca 0.26 -0.95 0.09 0.00 -0.39 0.00 0.00 64.86 63.86 1suz h ILE 240 Cb 0.09 1.40 -0.07 0.00 -3.07 0.00 0.00 36.82 35.17 1suz h ILE 240 CO -0.03 0.30 0.58 0.22 -0.69 0.00 0.00 178.15 178.52 1suz h TYR 241 N 0.21 1.06 0.00 1.37 3.20 -0.24 -1.92 116.97 120.65 1suz h TYR 241 Ca 0.07 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.97 1suz h TYR 241 Cb 0.44 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 38.38 1suz h TYR 241 CO 0.04 0.49 0.00 0.00 -1.64 0.00 0.00 178.16 177.05 1suz h ARG 242 N 0.99 0.00 0.00 1.82 3.08 -1.25 -3.47 114.38 115.56 1suz h ARG 242 Ca 0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.48 1suz h ARG 242 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1suz h ARG 242 CO -0.21 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.10 1suz n GLY 243 N 0.21 1.79 3.45 0.04 0.00 -0.72 -4.64 105.19 105.32 1suz n GLY 243 Ca 0.02 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.86 1suz n GLY 243 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1suz n ARG 244 N -0.49 -5.56 0.00 1.61 1.74 0.13 -5.01 116.66 109.09 1suz n ARG 244 Ca 0.00 0.81 0.00 0.00 -0.77 0.00 0.00 57.85 57.89 1suz n ARG 244 Cb 0.00 -5.72 0.00 0.00 -1.02 0.00 0.00 32.46 25.72 1suz n ARG 244 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47