#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cyz s GLU 9 N 0.00 4.12 -1.26 1.09 2.12 -1.26 -2.25 118.70 121.25 2cyz s GLU 9 Ca 0.00 2.59 0.00 0.00 0.36 0.00 0.00 54.97 57.92 2cyz s GLU 9 Cb 0.00 -3.02 0.00 0.00 0.26 0.00 0.00 34.13 31.37 2cyz s GLU 9 CO 0.00 -0.65 0.00 0.09 -0.54 0.00 0.00 175.26 174.16 2cyz n ASN 10 N 2.24 -5.02 -4.85 -1.70 3.02 -1.26 -4.97 115.26 102.72 2cyz n ASN 10 Ca 0.09 0.29 -0.32 0.00 -0.03 0.00 0.00 54.58 54.61 2cyz n ASN 10 Cb 0.37 -3.57 -0.02 0.00 -0.61 0.00 0.00 39.78 35.95 2cyz n ASN 10 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2cyz s ALA 11 N -2.25 3.06 0.51 5.41 0.00 -0.95 -5.02 121.76 122.52 2cyz s ALA 11 Ca 0.00 0.09 -0.20 0.00 0.00 0.00 0.00 51.96 51.85 2cyz s ALA 11 Cb 0.00 -3.11 -0.07 0.00 0.00 0.00 0.00 23.12 19.94 2cyz s ALA 11 CO 0.00 -0.44 1.11 0.00 0.00 0.00 0.00 175.76 176.43 2cyz s ALA 12 N -2.83 2.79 0.58 0.00 0.00 -1.26 -4.98 121.76 116.06 2cyz s ALA 12 Ca 0.58 0.79 -0.17 0.00 0.00 0.00 0.00 51.96 53.15 2cyz s ALA 12 Cb -0.11 -3.34 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 2cyz s ALA 12 CO 0.40 -0.63 1.10 -1.25 0.00 0.00 0.00 175.76 175.38 2cyz s PRO 13 N -3.16 3.24 0.32 0.00 0.04 -1.26 -4.98 135.00 129.20 2cyz s PRO 13 Ca 0.70 1.42 -0.29 0.00 0.04 0.00 0.00 61.00 62.87 2cyz s PRO 13 Cb -0.23 -2.01 -0.11 0.00 0.04 0.00 0.00 34.50 32.20 2cyz s PRO 13 CO 0.26 -0.90 1.52 0.00 0.04 0.00 0.00 177.00 177.92 2cyz s ALA 14 N -2.12 3.65 -0.09 8.56 0.00 -1.26 -5.02 121.76 125.49 2cyz s ALA 14 Ca 0.68 1.52 -0.11 0.00 0.00 0.00 0.00 51.96 54.06 2cyz s ALA 14 Cb -0.20 -3.61 0.03 0.00 0.00 0.00 0.00 23.12 19.33 2cyz s ALA 14 CO 0.32 -0.96 0.29 -0.65 0.00 0.00 0.00 175.76 174.77 2cyz s GLN 15 N -1.14 0.40 0.89 0.00 -0.21 -1.26 -5.16 119.66 113.18 2cyz s GLN 15 Ca 0.58 0.29 -0.10 0.00 0.02 0.00 0.00 55.36 56.15 2cyz s GLN 15 Cb -0.46 0.19 0.13 0.00 1.00 0.00 0.00 33.01 33.87 2cyz s GLN 15 CO 0.53 -0.06 1.15 0.00 -2.12 0.00 0.00 175.29 174.78 2cyz s ALA 16 N -0.12 1.58 0.35 6.09 0.00 -1.26 -4.91 121.76 123.48 2cyz s ALA 16 Ca -0.03 0.58 -0.27 0.00 0.00 0.00 0.00 51.96 52.24 2cyz s ALA 16 Cb -0.03 -3.44 -0.12 0.00 0.00 0.00 0.00 23.12 19.53 2cyz s ALA 16 CO 0.01 -2.63 1.11 -2.30 0.00 0.00 0.00 175.76 171.94 2cyz n PRO 17 N -4.10 1.62 -0.16 0.00 -0.02 -1.26 -4.77 135.00 126.31 2cyz n PRO 17 Ca 0.12 0.57 0.01 0.00 -2.02 0.00 0.00 63.50 62.18 2cyz n PRO 17 Cb 0.52 -2.07 0.28 0.00 -0.02 0.00 0.00 33.50 32.21 2cyz n PRO 17 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 2cyz h VAL 18 N 2.05 1.18 -0.97 -1.45 3.04 -1.99 -0.49 116.25 117.61 2cyz h VAL 18 Ca -0.43 -0.36 0.04 0.00 -1.01 0.00 0.00 66.70 64.93 2cyz h VAL 18 Cb 1.32 0.25 -0.06 0.00 -2.01 0.00 0.00 31.29 30.79 2cyz h VAL 18 CO 0.60 0.18 0.63 -1.28 -1.01 0.00 0.00 177.57 176.69 2cyz h SER 19 N 0.89 1.05 -0.14 3.17 0.87 -1.99 0.91 113.55 118.31 2cyz h SER 19 Ca 0.24 -0.01 -0.13 0.00 -1.23 0.00 0.00 61.79 60.66 2cyz h SER 19 Cb -0.06 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.65 2cyz h SER 19 CO -0.05 0.72 -0.34 0.44 -0.53 0.00 0.00 176.83 177.07 2cyz h ASP 20 N 1.22 0.67 -0.24 6.23 3.45 -1.47 -0.64 116.42 125.64 2cyz h ASP 20 Ca 0.39 -0.27 -0.05 0.00 0.43 0.00 0.00 57.03 57.52 2cyz h ASP 20 Cb 0.01 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 38.59 2cyz h ASP 20 CO -0.13 0.95 -0.04 0.03 -1.57 0.00 0.00 179.24 178.48 2cyz h ARG 21 N 0.54 0.45 -0.31 3.56 3.08 -0.79 -0.87 114.38 120.04 2cyz h ARG 21 Ca 0.06 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 2cyz h ARG 21 Cb 0.84 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.85 2cyz h ARG 21 CO 0.07 0.67 0.15 0.00 -1.07 0.00 0.00 179.97 179.79 2cyz h ALA 22 N 0.77 0.40 0.00 0.04 0.00 -0.66 -1.06 119.26 118.75 2cyz h ALA 22 Ca 0.06 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 2cyz h ALA 22 Cb 0.50 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2cyz h ALA 22 CO 0.02 -0.04 -0.40 -1.49 0.00 0.00 0.00 179.25 177.35 2cyz h TRP 23 N 0.37 0.00 -0.63 0.00 4.06 -1.16 -2.12 115.95 116.47 2cyz h TRP 23 Ca 0.11 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 60.99 2cyz h TRP 23 Cb 0.12 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.25 2cyz h TRP 23 CO -0.02 0.40 0.13 0.00 -3.56 0.00 0.00 178.44 175.39 2cyz h ALA 24 N 1.60 0.84 -0.31 1.49 0.00 -0.64 0.12 119.26 122.37 2cyz h ALA 24 Ca -0.00 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.68 2cyz h ALA 24 Cb 0.78 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 2cyz h ALA 24 CO 0.05 0.57 0.13 1.25 0.00 0.00 0.00 179.25 181.26 2cyz h LEU 25 N 0.94 0.18 -0.04 0.00 5.85 -0.94 0.88 115.31 122.19 2cyz h LEU 25 Ca 0.20 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.97 2cyz h LEU 25 Cb 0.39 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.37 2cyz h LEU 25 CO 0.01 0.14 -0.20 0.15 -0.34 0.00 0.00 178.44 178.20 2cyz h PHE 26 N 0.29 -0.52 -0.41 1.25 3.57 -1.05 -2.65 116.94 117.42 2cyz h PHE 26 Ca 0.13 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.57 2cyz h PHE 26 Cb 0.07 0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 2cyz h PHE 26 CO -0.11 -0.28 -0.06 0.00 -2.23 0.00 0.00 178.31 175.63 2cyz h ARG 27 N -0.30 0.69 -0.45 1.11 3.08 -0.40 0.25 114.38 118.36 2cyz h ARG 27 Ca 0.07 -0.20 0.01 0.00 0.07 0.00 0.00 59.98 59.93 2cyz h ARG 27 Cb 0.40 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 2cyz h ARG 27 CO -0.21 0.75 0.29 0.00 -1.07 0.00 0.00 179.97 179.73 2cyz h ALA 28 N 1.29 0.57 -0.05 0.04 0.00 -0.73 0.12 119.26 120.50 2cyz h ALA 28 Ca 0.12 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.85 2cyz h ALA 28 Cb 0.49 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.12 2cyz h ALA 28 CO 0.03 0.01 -0.58 -0.07 0.00 0.00 0.00 179.25 178.63 2cyz h LEU 29 N 0.60 0.60 -1.02 0.00 3.38 -1.16 -3.26 115.31 114.44 2cyz h LEU 29 Ca 0.17 -0.70 -0.08 0.00 0.09 0.00 0.00 57.88 57.36 2cyz h LEU 29 Cb -0.06 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2cyz h LEU 29 CO -0.04 1.21 -0.15 -0.78 0.09 0.00 0.00 178.44 178.77 2cyz h ASP 30 N 0.04 0.52 0.36 -0.43 1.82 -0.40 -1.68 116.42 116.64 2cyz h ASP 30 Ca -0.06 -0.15 0.00 0.00 -0.39 0.00 0.00 57.03 56.44 2cyz h ASP 30 Cb 1.26 -0.14 0.00 0.00 0.68 0.00 0.00 39.33 41.13 2cyz h ASP 30 CO 0.12 0.69 0.00 1.23 -1.61 0.00 0.00 179.24 179.67 2cyz h GLY 31 N 0.95 0.00 -2.18 -0.78 0.00 -0.82 -1.39 103.07 98.86 2cyz h GLY 31 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.42 2cyz h GLY 31 CO 0.03 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.85 2cyz n LYS 32 N -2.45 2.86 -1.12 4.80 5.02 -0.68 -4.94 118.16 121.65 2cyz n LYS 32 Ca -0.00 -2.46 -0.04 0.00 -2.02 0.00 0.00 58.31 53.79 2cyz n LYS 32 Cb 0.14 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.64 2cyz n LYS 32 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2cyz n GLY 33 N 1.15 0.69 0.23 0.72 0.00 -0.52 -4.92 105.19 102.54 2cyz n GLY 33 Ca 0.20 -0.57 0.13 0.00 0.00 0.00 0.00 46.02 45.77 2cyz n GLY 33 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2cyz n LEU 34 N -0.47 1.01 -4.15 0.99 4.77 -0.93 -4.74 117.00 113.48 2cyz n LEU 34 Ca -0.04 -0.25 -0.34 0.00 -0.03 0.00 0.00 56.01 55.34 2cyz n LEU 34 Cb 0.17 -0.13 -0.14 0.00 -2.33 0.00 0.00 43.42 40.99 2cyz n LEU 34 CO 0.06 0.19 -0.39 -0.69 -1.33 0.00 0.00 177.39 175.23 2cyz s VAL 35 N -2.55 2.75 0.81 4.08 1.01 -1.26 -4.97 120.40 120.28 2cyz s VAL 35 Ca 0.23 -1.37 -0.14 0.00 0.00 0.00 0.00 61.98 60.70 2cyz s VAL 35 Cb 0.19 -2.55 0.05 0.00 0.00 0.00 0.00 36.38 34.07 2cyz s VAL 35 CO 0.54 -0.02 0.91 -2.65 0.00 0.00 0.00 175.10 173.88 2cyz n PRO 36 N 4.58 0.14 -1.67 2.72 -0.02 -1.26 -4.87 135.00 134.62 2cyz n PRO 36 Ca -0.14 0.11 -0.44 0.00 -2.02 0.00 0.00 63.50 61.01 2cyz n PRO 36 Cb 0.44 -2.20 -0.02 0.00 -0.02 0.00 0.00 33.50 31.70 2cyz n PRO 36 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2cyz n ASP 37 N -2.23 2.73 -0.05 2.55 10.43 -1.26 -1.44 116.55 127.28 2cyz n ASP 37 Ca 0.12 1.15 -0.01 0.00 2.57 0.00 0.00 54.79 58.62 2cyz n ASP 37 Cb 0.51 -1.44 -0.00 0.00 1.84 0.00 0.00 41.12 42.03 2cyz n ASP 37 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2cyz n GLY 38 N 1.89 0.10 0.28 0.44 0.00 -1.26 -4.91 105.19 101.73 2cyz n GLY 38 Ca 0.10 -0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.96 2cyz n GLY 38 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2cyz h TYR 39 N 0.00 -0.60 0.00 1.61 3.20 -1.58 -1.01 116.97 118.59 2cyz h TYR 39 Ca -0.01 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.75 2cyz h TYR 39 Cb 0.93 0.20 -0.01 0.00 1.54 0.00 0.00 36.73 39.39 2cyz h TYR 39 CO 0.58 -0.33 -0.45 -0.39 -1.64 0.00 0.00 178.16 175.93 2cyz h VAL 40 N -0.74 1.15 -0.37 1.81 -1.51 -1.91 -2.32 116.25 112.37 2cyz h VAL 40 Ca -0.07 -1.62 -0.08 0.00 -1.23 0.00 0.00 66.70 63.70 2cyz h VAL 40 Cb 0.54 1.92 -0.02 0.00 -2.13 0.00 0.00 31.29 31.60 2cyz h VAL 40 CO 0.11 0.44 -0.10 -0.33 -1.23 0.00 0.00 177.57 176.46 2cyz h GLU 41 N 0.00 0.63 0.09 5.19 3.07 -1.94 -0.61 114.58 121.01 2cyz h GLU 41 Ca -0.00 -0.19 -0.00 0.00 -0.50 0.00 0.00 59.36 58.66 2cyz h GLU 41 Cb 0.88 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 28.73 2cyz h GLU 41 CO 0.06 0.72 -0.05 0.78 -1.40 0.00 0.00 179.01 179.12 2cyz h GLY 42 N 0.95 -0.13 1.01 -3.84 0.00 -0.88 -1.56 103.07 98.62 2cyz h GLY 42 Ca 0.11 0.05 -0.06 0.00 0.00 0.00 0.00 47.33 47.43 2cyz h GLY 42 CO 0.03 -0.05 0.15 1.49 0.00 0.00 0.00 176.54 178.16 2cyz h TRP 43 N -0.13 0.98 -0.89 5.60 4.06 -1.20 -1.83 115.95 122.53 2cyz h TRP 43 Ca -0.01 -0.11 0.07 0.00 2.06 0.00 0.00 58.89 60.89 2cyz h TRP 43 Cb 0.10 -0.28 -0.06 0.00 -1.00 0.00 0.00 29.16 27.92 2cyz h TRP 43 CO -0.08 0.83 0.56 -0.22 -3.56 0.00 0.00 178.44 175.97 2cyz h LYS 44 N 0.84 0.97 -0.41 0.49 3.64 -0.83 0.14 116.57 121.42 2cyz h LYS 44 Ca 0.18 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.44 2cyz h LYS 44 Cb 0.34 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 2cyz h LYS 44 CO 0.00 0.64 -0.00 -0.22 -2.27 0.00 0.00 179.45 177.61 2cyz h LYS 45 N 1.00 0.73 -0.20 1.90 3.64 -1.02 -0.73 116.57 121.89 2cyz h LYS 45 Ca 0.39 -0.23 0.03 0.00 -1.27 0.00 0.00 60.65 59.58 2cyz h LYS 45 Cb 0.20 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.92 2cyz h LYS 45 CO -0.18 0.81 -0.01 1.15 -2.27 0.00 0.00 179.45 178.95 2cyz h THR 46 N 0.56 0.85 -0.52 1.00 2.02 -0.82 0.26 112.91 116.27 2cyz h THR 46 Ca 0.12 -0.02 -0.03 0.00 0.77 0.00 0.00 66.41 67.25 2cyz h THR 46 Cb 0.48 0.79 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 2cyz h THR 46 CO 0.02 0.01 0.20 -0.26 0.37 0.00 0.00 175.52 175.86 2cyz h PHE 47 N 0.06 0.75 0.13 3.16 0.04 -0.61 -1.31 116.94 119.15 2cyz h PHE 47 Ca 0.09 -0.04 -0.31 0.00 2.80 0.00 0.00 57.97 60.52 2cyz h PHE 47 Cb 0.12 -0.23 -0.00 0.00 2.20 0.00 0.00 35.95 38.04 2cyz h PHE 47 CO -0.18 0.59 -1.53 0.93 -0.60 0.00 0.00 178.31 177.52 2cyz h GLU 48 N 0.74 0.27 0.00 1.51 5.08 -0.82 -3.40 114.58 117.96 2cyz h GLU 48 Ca 0.18 -0.46 -0.10 0.00 -1.00 0.00 0.00 59.36 57.97 2cyz h GLU 48 Cb 0.16 0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 2cyz h GLU 48 CO -0.02 1.15 -1.39 0.39 -1.00 0.00 0.00 179.01 178.15 2cyz n GLU 49 N -3.48 2.79 -0.11 2.33 1.02 0.90 -4.81 120.64 119.29 2cyz n GLU 49 Ca -0.16 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 56.76 2cyz n GLU 49 Cb 1.05 -1.14 -0.10 0.00 -0.02 0.00 0.00 31.44 31.23 2cyz n GLU 49 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2cyz n ASP 50 N -2.26 1.89 -4.67 1.62 8.00 -0.73 -4.82 116.55 115.58 2cyz n ASP 50 Ca -0.09 0.41 -0.42 0.00 0.71 0.00 0.00 54.79 55.40 2cyz n ASP 50 Cb 0.68 -0.90 -0.03 0.00 -0.02 0.00 0.00 41.12 40.85 2cyz n ASP 50 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2cyz s PHE 51 N -2.42 2.32 -0.24 1.24 0.08 -0.57 -4.95 117.98 113.43 2cyz s PHE 51 Ca -0.30 0.46 -0.23 0.00 0.12 0.00 0.00 56.93 56.98 2cyz s PHE 51 Cb 0.08 -3.80 0.06 0.00 -0.57 0.00 0.00 43.02 38.80 2cyz s PHE 51 CO 0.51 -3.20 0.65 0.45 -0.10 0.00 0.00 175.22 173.53 2cyz s SER 52 N 2.76 -0.68 0.26 1.36 0.15 -1.10 -4.49 113.70 111.97 2cyz s SER 52 Ca 0.68 1.30 0.22 0.00 0.70 0.00 0.00 55.95 58.85 2cyz s SER 52 Cb -0.31 1.32 0.99 0.00 -1.71 0.00 0.00 66.02 66.30 2cyz s SER 52 CO 0.26 -0.23 1.65 -0.81 1.20 0.00 0.00 173.24 175.31 2cyz n PRO 53 N 2.69 0.16 0.24 5.44 -0.04 -1.20 -1.98 135.00 140.31 2cyz n PRO 53 Ca -0.14 0.49 0.08 0.00 -0.04 0.00 0.00 63.50 63.89 2cyz n PRO 53 Cb 0.55 -1.87 0.60 0.00 -0.04 0.00 0.00 33.50 32.74 2cyz n PRO 53 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2cyz h ARG 54 N 0.00 0.00 0.03 0.54 2.47 -1.91 -1.17 114.38 114.34 2cyz h ARG 54 Ca 0.00 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2cyz h ARG 54 Cb 0.22 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.55 2cyz h ARG 54 CO 0.00 0.12 -0.01 0.00 0.56 0.00 0.00 179.97 180.63 2cyz h ARG 55 N 0.00 -0.04 -0.43 0.04 3.08 -1.60 -1.95 114.38 113.48 2cyz h ARG 55 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2cyz h ARG 55 Cb 0.22 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 2cyz h ARG 55 CO 0.02 0.27 0.28 0.78 -1.07 0.00 0.00 179.97 180.24 2cyz h GLY 56 N -0.35 0.60 1.01 0.04 0.00 -0.84 -1.39 103.07 102.14 2cyz h GLY 56 Ca -0.00 -0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.10 2cyz h GLY 56 CO 0.01 0.22 0.47 0.00 0.00 0.00 0.00 176.54 177.23 2cyz h ALA 57 N 1.73 0.99 -0.59 3.60 0.00 -1.12 -0.39 119.26 123.47 2cyz h ALA 57 Ca 0.16 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2cyz h ALA 57 Cb -0.06 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.39 2cyz h ALA 57 CO -0.03 0.45 0.31 1.49 0.00 0.00 0.00 179.25 181.47 2cyz h GLU 58 N 1.06 0.84 -0.66 0.00 4.81 -0.63 -0.23 114.58 119.77 2cyz h GLU 58 Ca 0.28 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.39 2cyz h GLU 58 Cb -0.04 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.15 2cyz h GLU 58 CO -0.05 0.66 0.38 -0.07 -0.73 0.00 0.00 179.01 179.20 2cyz h LEU 59 N 0.81 0.80 -0.29 1.64 3.38 -0.85 -1.29 115.31 119.52 2cyz h LEU 59 Ca 0.21 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 2cyz h LEU 59 Cb 0.08 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2cyz h LEU 59 CO -0.03 0.64 0.04 0.58 0.09 0.00 0.00 178.44 179.77 2cyz h VAL 60 N 0.90 1.23 -0.50 1.22 2.07 -0.65 -1.23 116.25 119.29 2cyz h VAL 60 Ca 0.23 -0.81 -0.03 0.00 0.82 0.00 0.00 66.70 66.92 2cyz h VAL 60 Cb 0.00 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 2cyz h VAL 60 CO -0.04 0.26 0.20 0.00 0.02 0.00 0.00 177.57 178.01 2cyz h ALA 61 N 0.87 1.42 -0.13 1.67 0.00 -0.92 0.68 119.26 122.85 2cyz h ALA 61 Ca 0.09 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2cyz h ALA 61 Cb 0.35 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2cyz h ALA 61 CO 0.01 0.44 -0.03 -0.09 0.00 0.00 0.00 179.25 179.58 2cyz h ARG 62 N 0.71 0.25 -0.96 0.00 9.65 -0.99 -2.67 114.38 120.37 2cyz h ARG 62 Ca 0.17 -0.09 0.07 0.00 -1.10 0.00 0.00 59.98 59.03 2cyz h ARG 62 Cb 0.14 -0.02 -0.07 0.00 -1.39 0.00 0.00 29.97 28.64 2cyz h ARG 62 CO -0.02 0.53 0.61 0.00 2.80 0.00 0.00 179.97 183.90 2cyz h ALA 63 N 0.71 1.33 0.00 2.80 0.00 -0.64 0.02 119.26 123.48 2cyz h ALA 63 Ca 0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2cyz h ALA 63 Cb 0.44 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2cyz h ALA 63 CO 0.01 0.37 -0.11 -1.49 0.00 0.00 0.00 179.25 178.04 2cyz h TRP 64 N 1.10 0.00 -0.09 0.00 6.55 -0.68 -3.10 115.95 119.73 2cyz h TRP 64 Ca 0.42 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.26 2cyz h TRP 64 Cb 0.19 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.49 2cyz h TRP 64 CO -0.01 0.11 0.00 0.25 -1.05 0.00 0.00 178.44 177.73 2cyz n THR 65 N -3.57 0.56 -3.43 1.49 -2.24 -0.57 -4.90 114.28 101.62 2cyz n THR 65 Ca -0.02 -0.78 -0.22 0.00 -2.27 0.00 0.00 64.05 60.77 2cyz n THR 65 Cb 0.23 0.77 -0.10 0.00 -2.10 0.00 0.00 70.33 69.13 2cyz n THR 65 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2cyz s ASP 66 N -0.74 2.13 0.48 3.42 3.68 -0.11 -5.01 116.67 120.52 2cyz s ASP 66 Ca 0.08 -1.44 0.18 0.00 2.13 0.00 0.00 52.55 53.50 2cyz s ASP 66 Cb 0.05 0.17 1.19 0.00 -1.45 0.00 0.00 42.92 42.88 2cyz s ASP 66 CO 0.07 -0.34 2.02 -0.65 0.13 0.00 0.00 175.17 176.40 2cyz h PRO 67 N 7.62 0.19 -0.35 4.34 0.11 -1.86 -0.78 132.00 141.27 2cyz h PRO 67 Ca -0.04 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 65.93 2cyz h PRO 67 Cb 1.03 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 2cyz h PRO 67 CO 0.29 0.13 -0.27 1.49 -0.21 0.00 0.00 178.00 179.43 2cyz h GLU 68 N 0.20 0.80 -0.47 1.05 4.81 -1.95 -1.15 114.58 117.88 2cyz h GLU 68 Ca 0.21 -0.40 -0.09 0.00 -0.13 0.00 0.00 59.36 58.95 2cyz h GLU 68 Cb 0.56 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.93 2cyz h GLU 68 CO -0.03 1.03 -0.07 0.35 -0.73 0.00 0.00 179.01 179.55 2cyz h PHE 69 N 0.59 0.98 -0.58 0.92 3.57 -1.70 -2.17 116.94 118.55 2cyz h PHE 69 Ca 0.07 -0.20 0.08 0.00 3.53 0.00 0.00 57.97 61.45 2cyz h PHE 69 Cb 0.85 -0.25 -0.06 0.00 2.79 0.00 0.00 35.95 39.28 2cyz h PHE 69 CO 0.06 0.95 0.24 -0.09 -2.23 0.00 0.00 178.31 177.24 2cyz h ARG 70 N 0.73 0.42 -0.75 1.11 2.43 -0.95 0.10 114.38 117.47 2cyz h ARG 70 Ca 0.12 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.22 2cyz h ARG 70 Cb 0.61 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 30.03 2cyz h ARG 70 CO 0.04 0.28 0.27 0.37 -1.51 0.00 0.00 179.97 179.42 2cyz h GLN 71 N 0.44 1.14 -0.04 0.20 5.75 -1.06 -1.71 115.11 119.83 2cyz h GLN 71 Ca 0.28 -0.22 -0.00 0.00 -0.15 0.00 0.00 58.65 58.56 2cyz h GLN 71 Cb 0.31 -0.18 -0.00 0.00 1.07 0.00 0.00 27.48 28.68 2cyz h GLN 71 CO -0.26 0.94 0.02 1.25 -2.65 0.00 0.00 178.83 178.12 2cyz h LEU 72 N 1.10 0.06 -1.00 -2.39 5.85 -0.67 -2.34 115.31 115.92 2cyz h LEU 72 Ca 0.25 -0.18 0.12 0.00 0.84 0.00 0.00 57.88 58.91 2cyz h LEU 72 Cb 0.25 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.18 2cyz h LEU 72 CO -0.02 0.22 0.63 0.25 -0.34 0.00 0.00 178.44 179.18 2cyz h LEU 73 N -0.11 0.92 0.00 2.25 5.85 -0.70 0.43 115.31 123.95 2cyz h LEU 73 Ca 0.01 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2cyz h LEU 73 Cb 0.18 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.08 2cyz h LEU 73 CO -0.00 0.49 -0.06 0.18 -0.34 0.00 0.00 178.44 178.71 2cyz n LEU 74 N -4.63 0.63 -0.02 2.25 4.77 -0.65 -3.19 117.00 116.15 2cyz n LEU 74 Ca 0.19 0.52 -0.01 0.00 -0.03 0.00 0.00 56.01 56.68 2cyz n LEU 74 Cb 0.35 -0.35 -0.06 0.00 -2.33 0.00 0.00 43.42 41.04 2cyz n LEU 74 CO 0.27 -0.13 -0.69 0.35 -1.33 0.00 0.00 177.39 175.86 2cyz n THR 75 N -2.08 0.33 -3.05 -5.08 -2.24 -0.75 -4.84 114.28 96.56 2cyz n THR 75 Ca 0.06 -0.27 -0.16 0.00 -2.27 0.00 0.00 64.05 61.41 2cyz n THR 75 Cb 0.41 -0.38 -0.04 0.00 -2.10 0.00 0.00 70.33 68.22 2cyz n THR 75 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2cyz n ASP 76 N -2.09 -1.85 -0.18 3.42 -0.08 0.14 -5.00 116.55 110.91 2cyz n ASP 76 Ca -0.08 -2.72 -0.04 0.00 -1.51 0.00 0.00 54.79 50.43 2cyz n ASP 76 Cb 0.55 0.61 0.14 0.00 2.34 0.00 0.00 41.12 44.75 2cyz n ASP 76 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 2cyz h GLY 77 N 5.03 1.02 0.34 0.27 0.00 -1.53 -2.03 103.07 106.17 2cyz h GLY 77 Ca 0.12 -0.61 0.05 0.00 0.00 0.00 0.00 47.33 46.90 2cyz h GLY 77 CO 0.23 0.57 -0.17 -0.84 0.00 0.00 0.00 176.54 176.33 2cyz h THR 78 N 0.91 0.53 -0.86 4.70 2.02 -1.84 0.63 112.91 119.01 2cyz h THR 78 Ca 0.20 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.36 2cyz h THR 78 Cb 0.32 0.53 -0.04 0.00 -1.74 0.00 0.00 68.15 67.22 2cyz h THR 78 CO -0.00 0.00 0.47 0.00 0.37 0.00 0.00 175.52 176.36 2cyz h ALA 79 N 0.92 1.20 -0.17 6.16 0.00 -1.74 -0.29 119.26 125.34 2cyz h ALA 79 Ca 0.12 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2cyz h ALA 79 Cb 0.36 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2cyz h ALA 79 CO -0.31 0.64 0.06 0.00 0.00 0.00 0.00 179.25 179.65 2cyz h ALA 80 N 1.31 0.23 -0.61 0.00 0.00 -0.88 -2.46 119.26 116.84 2cyz h ALA 80 Ca 0.30 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 2cyz h ALA 80 Cb 0.03 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2cyz h ALA 80 CO -0.05 -0.16 0.25 0.28 0.00 0.00 0.00 179.25 179.57 2cyz h VAL 81 N 0.11 1.22 -0.11 0.00 2.07 -0.59 -2.35 116.25 116.59 2cyz h VAL 81 Ca 0.06 -0.66 -0.03 0.00 0.82 0.00 0.00 66.70 66.89 2cyz h VAL 81 Cb 0.21 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 2cyz h VAL 81 CO -0.00 0.27 -0.04 0.00 0.02 0.00 0.00 177.57 177.81 2cyz h ALA 82 N 1.40 1.72 -0.08 1.67 0.00 -0.80 -1.77 119.26 121.41 2cyz h ALA 82 Ca 0.21 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2cyz h ALA 82 Cb 0.16 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2cyz h ALA 82 CO -0.02 0.21 0.01 1.96 0.00 0.00 0.00 179.25 181.42 2cyz h GLN 83 N 0.16 0.10 -0.00 0.00 4.20 -0.95 -0.64 115.11 117.98 2cyz h GLN 83 Ca 0.04 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.74 2cyz h GLN 83 Cb 0.19 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.95 2cyz h GLN 83 CO 0.01 0.10 -0.26 0.66 -0.67 0.00 0.00 178.83 178.67 2cyz n TYR 84 N -4.49 0.00 -1.85 2.96 4.02 -0.70 -4.95 117.16 112.15 2cyz n TYR 84 Ca -0.02 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.84 2cyz n TYR 84 Cb 0.11 -0.26 -0.00 0.00 -0.02 0.00 0.00 39.34 39.17 2cyz n TYR 84 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2cyz n GLY 85 N 1.41 0.32 1.25 2.72 0.00 -0.25 -4.97 105.19 105.68 2cyz n GLY 85 Ca 0.09 -0.80 0.09 0.00 0.00 0.00 0.00 46.02 45.41 2cyz n GLY 85 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2cyz n TYR 86 N -3.76 1.06 -1.97 1.61 4.01 -0.96 -4.95 117.16 112.19 2cyz n TYR 86 Ca -0.04 -0.57 -0.35 0.00 -0.16 0.00 0.00 57.90 56.78 2cyz n TYR 86 Cb 0.43 -0.12 0.03 0.00 -0.31 0.00 0.00 39.34 39.38 2cyz n TYR 86 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2cyz s LEU 87 N -1.46 3.60 0.00 7.72 1.43 -1.26 -4.63 118.68 124.08 2cyz s LEU 87 Ca 0.44 2.24 -0.05 0.00 -1.03 0.00 0.00 54.13 55.73 2cyz s LEU 87 Cb 0.26 -4.58 0.02 0.00 0.03 0.00 0.00 46.19 41.92 2cyz s LEU 87 CO 0.24 -1.56 0.25 0.61 0.23 0.00 0.00 176.35 176.12 2cyz n GLY 88 N 0.19 0.56 3.64 -3.19 0.00 -1.03 -5.02 105.19 100.34 2cyz n GLY 88 Ca 0.12 -0.88 -0.47 0.00 0.00 0.00 0.00 46.02 44.80 2cyz n GLY 88 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2cyz n PRO 89 N -0.18 1.77 -2.72 1.61 -0.02 -1.26 -0.66 135.00 133.54 2cyz n PRO 89 Ca 0.01 0.63 -0.21 0.00 -2.02 0.00 0.00 63.50 61.91 2cyz n PRO 89 Cb 0.11 -2.28 0.01 0.00 -0.02 0.00 0.00 33.50 31.32 2cyz n PRO 89 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2cyz n GLN 90 N 2.35 -3.21 -2.68 -0.52 1.13 -1.26 -4.23 117.38 108.96 2cyz n GLN 90 Ca 0.14 0.92 -0.06 0.00 -1.94 0.00 0.00 57.00 56.06 2cyz n GLN 90 Cb 0.28 -5.67 0.07 0.00 0.11 0.00 0.00 30.24 25.03 2cyz n GLN 90 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2cyz n GLY 91 N -1.23 0.57 0.04 1.08 0.00 0.17 -2.61 105.19 103.20 2cyz n GLY 91 Ca -0.17 -0.08 0.02 0.00 0.00 0.00 0.00 46.02 45.79 2cyz n GLY 91 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2cyz n GLU 92 N -0.58 0.80 -3.84 1.61 -0.58 -1.17 -2.47 120.64 114.40 2cyz n GLU 92 Ca -0.12 -0.11 -0.30 0.00 -0.42 0.00 0.00 57.16 56.21 2cyz n GLU 92 Cb 0.77 -1.45 -0.15 0.00 -0.57 0.00 0.00 31.44 30.05 2cyz n GLU 92 CO 0.00 0.00 0.00 -0.47 -0.48 0.00 0.00 177.13 176.18 2cyz s TYR 93 N -2.96 2.23 -0.13 -0.32 6.14 -1.26 -4.92 117.35 116.14 2cyz s TYR 93 Ca -0.08 -1.91 -0.03 0.00 0.64 0.00 0.00 57.07 55.69 2cyz s TYR 93 Cb 0.09 -1.86 -0.03 0.00 0.42 0.00 0.00 41.96 40.59 2cyz s TYR 93 CO 0.75 -0.84 -0.01 0.42 0.64 0.00 0.00 175.55 176.52 2cyz s ILE 94 N 1.44 4.21 -0.11 3.14 -1.09 -1.26 -1.13 121.20 126.40 2cyz s ILE 94 Ca 0.05 -0.26 0.01 0.00 -2.23 0.00 0.00 60.65 58.22 2cyz s ILE 94 Cb -0.18 -2.82 0.02 0.00 -1.58 0.00 0.00 42.46 37.90 2cyz s ILE 94 CO -0.15 0.54 -0.12 -0.69 -1.23 0.00 0.00 174.94 173.29 2cyz s VAL 95 N -0.22 1.31 -0.09 2.92 1.01 -0.63 -2.71 120.40 121.99 2cyz s VAL 95 Ca 0.05 -0.51 -0.12 0.00 0.00 0.00 0.00 61.98 61.40 2cyz s VAL 95 Cb -0.12 -1.24 -0.05 0.00 0.00 0.00 0.00 36.38 34.97 2cyz s VAL 95 CO 0.02 0.41 0.29 0.00 0.00 0.00 0.00 175.10 175.82 2cyz s ALA 96 N 1.21 3.71 -0.10 5.51 0.00 -1.26 -2.10 121.76 128.73 2cyz s ALA 96 Ca -0.03 -0.42 0.03 0.00 0.00 0.00 0.00 51.96 51.54 2cyz s ALA 96 Cb -0.14 -2.28 -0.01 0.00 0.00 0.00 0.00 23.12 20.69 2cyz s ALA 96 CO -0.04 0.37 -0.20 0.14 0.00 0.00 0.00 175.76 176.04 2cyz s VAL 97 N -0.49 2.50 -0.21 0.00 -7.23 -0.32 -4.72 120.40 109.92 2cyz s VAL 97 Ca 0.19 -0.88 -0.10 0.00 -1.81 0.00 0.00 61.98 59.38 2cyz s VAL 97 Cb -0.14 -1.98 -0.05 0.00 0.56 0.00 0.00 36.38 34.77 2cyz s VAL 97 CO 0.07 0.55 0.13 -1.83 -0.31 0.00 0.00 175.10 173.72 2cyz s GLU 98 N 0.13 4.13 0.50 4.82 -1.05 -1.26 -0.84 118.70 125.13 2cyz s GLU 98 Ca -0.10 -0.25 -0.21 0.00 -0.15 0.00 0.00 54.97 54.26 2cyz s GLU 98 Cb -0.16 -3.43 -0.07 0.00 -0.44 0.00 0.00 34.13 30.03 2cyz s GLU 98 CO 0.06 0.23 1.13 -0.51 0.95 0.00 0.00 175.26 177.12 2cyz s ASP 99 N 0.57 5.99 0.27 0.83 1.01 -0.72 -4.87 116.67 119.75 2cyz s ASP 99 Ca 0.07 2.20 0.02 0.00 0.71 0.00 0.00 52.55 55.55 2cyz s ASP 99 Cb -0.12 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.18 2cyz s ASP 99 CO 0.00 -1.03 0.14 0.42 0.21 0.00 0.00 175.17 174.91 2cyz s THR 100 N -1.70 0.28 -0.35 -1.27 -4.23 -0.55 -4.54 115.64 103.28 2cyz s THR 100 Ca 0.68 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 59.36 2cyz s THR 100 Cb -0.25 -2.54 0.17 0.00 1.34 0.00 0.00 72.50 71.22 2cyz s THR 100 CO 0.29 0.00 1.52 -2.65 -0.54 0.00 0.00 174.62 173.24 2cyz n PRO 101 N -0.47 0.11 -0.04 3.99 -0.02 -1.26 -2.08 135.00 135.23 2cyz n PRO 101 Ca 0.01 0.61 0.04 0.00 -2.02 0.00 0.00 63.50 62.14 2cyz n PRO 101 Cb 0.65 -1.87 0.05 0.00 -0.02 0.00 0.00 33.50 32.31 2cyz n PRO 101 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2cyz n THR 102 N -2.10 1.21 -3.72 3.45 -2.24 -1.26 -4.81 114.28 104.81 2cyz n THR 102 Ca -0.01 -1.34 -0.13 0.00 -2.27 0.00 0.00 64.05 60.29 2cyz n THR 102 Cb 0.03 0.27 -0.14 0.00 -2.10 0.00 0.00 70.33 68.40 2cyz n THR 102 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2cyz s LEU 103 N -1.55 0.37 -0.16 3.22 2.96 -0.88 -1.07 118.68 121.57 2cyz s LEU 103 Ca 0.11 0.43 0.01 0.00 -0.22 0.00 0.00 54.13 54.47 2cyz s LEU 103 Cb 0.10 0.55 0.01 0.00 0.50 0.00 0.00 46.19 47.35 2cyz s LEU 103 CO 0.01 -0.18 -0.18 -0.75 -1.32 0.00 0.00 176.35 173.93 2cyz s LYS 104 N 1.49 3.09 -0.01 1.98 2.47 0.28 -1.49 119.74 127.55 2cyz s LYS 104 Ca -0.07 -0.80 -0.08 0.00 -1.56 0.00 0.00 55.97 53.46 2cyz s LYS 104 Cb -0.11 -2.56 -0.05 0.00 -1.46 0.00 0.00 37.83 33.65 2cyz s LYS 104 CO -0.07 -0.06 0.27 -0.80 0.16 0.00 0.00 175.35 174.84 2cyz s ASN 105 N 0.96 6.52 -0.02 1.43 -0.87 -1.26 -0.86 114.94 120.84 2cyz s ASN 105 Ca -0.03 0.60 -0.02 0.00 -1.57 0.00 0.00 52.86 51.83 2cyz s ASN 105 Cb -0.15 -2.11 0.00 0.00 -0.02 0.00 0.00 41.25 38.98 2cyz s ASN 105 CO -0.04 0.28 0.06 -0.69 -2.57 0.00 0.00 177.10 174.14 2cyz s VAL 106 N -1.24 0.02 0.03 1.60 1.01 -0.22 -4.47 120.40 117.14 2cyz s VAL 106 Ca 0.25 -0.14 0.05 0.00 0.00 0.00 0.00 61.98 62.14 2cyz s VAL 106 Cb -0.13 -0.13 -0.03 0.00 0.00 0.00 0.00 36.38 36.08 2cyz s VAL 106 CO 0.14 -0.08 -0.11 -0.63 0.00 0.00 0.00 175.10 174.42 2cyz s ILE 107 N -0.22 3.33 0.18 2.22 1.01 -0.36 -0.19 121.20 127.18 2cyz s ILE 107 Ca -0.03 -0.99 -0.11 0.00 0.00 0.00 0.00 60.65 59.53 2cyz s ILE 107 Cb -0.02 -2.46 -0.00 0.00 0.01 0.00 0.00 42.46 39.99 2cyz s ILE 107 CO 0.00 0.33 0.35 0.54 0.00 0.00 0.00 174.94 176.16 2cyz s VAL 108 N -1.01 0.05 -0.40 2.92 0.11 -0.51 -4.92 120.40 116.63 2cyz s VAL 108 Ca 0.17 -1.29 0.04 0.00 -2.93 0.00 0.00 61.98 57.96 2cyz s VAL 108 Cb -0.11 -1.86 0.11 0.00 -1.53 0.00 0.00 36.38 33.00 2cyz s VAL 108 CO 0.08 -0.22 0.13 0.00 -3.33 0.00 0.00 175.10 171.76 2cyz h SER 110 N 7.22 0.00 0.80 0.00 4.64 -1.87 -3.35 113.55 120.99 2cyz h SER 110 Ca -0.06 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.08 2cyz h SER 110 Cb 0.97 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.03 2cyz h SER 110 CO 0.57 0.17 -1.30 -0.07 -0.87 0.00 0.00 176.83 175.33 2cyz h LEU 111 N 0.00 0.00 -8.71 5.97 3.38 -1.91 -3.46 115.31 110.58 2cyz h LEU 111 Ca -0.00 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.34 2cyz h LEU 111 Cb 0.46 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 40.97 2cyz h LEU 111 CO 0.02 0.65 -0.86 -0.94 0.09 0.00 0.00 178.44 177.40 2cyz s SER 113 N -5.97 2.87 0.00 -0.43 1.04 -1.26 -5.22 113.70 104.73 2cyz s SER 113 Ca -0.02 -0.63 0.00 0.00 0.48 0.00 0.00 55.95 55.78 2cyz s SER 113 Cb 0.08 -0.22 0.00 0.00 0.10 0.00 0.00 66.02 65.99 2cyz s SER 113 CO 0.80 0.17 0.00 0.41 0.98 0.00 0.00 173.24 175.60 2cyz n THR 115 N 1.45 0.00 -2.06 2.02 -1.04 -1.26 -4.81 114.28 108.58 2cyz n THR 115 Ca -0.18 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.45 2cyz n THR 115 Cb 0.53 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 69.01 2cyz n THR 115 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2cyz n ALA 116 N -1.44 3.22 -0.21 2.41 0.00 -1.26 -4.76 120.51 118.47 2cyz n ALA 116 Ca 0.00 -3.49 -0.01 0.00 0.00 0.00 0.00 53.44 49.94 2cyz n ALA 116 Cb 0.00 -3.56 0.06 0.00 0.00 0.00 0.00 19.45 15.95 2cyz n ALA 116 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 2cyz h TRP 117 N 8.11 -0.36 0.00 0.00 6.55 -1.72 -0.97 115.95 127.56 2cyz h TRP 117 Ca 0.39 0.06 -0.03 0.00 0.95 0.00 0.00 58.89 60.26 2cyz h TRP 117 Cb 0.83 0.26 -0.00 0.00 -0.86 0.00 0.00 29.16 29.38 2cyz h TRP 117 CO 1.33 -0.28 -0.13 -1.35 -1.05 0.00 0.00 178.44 176.96 2cyz h PRO 118 N -0.01 0.00 0.00 0.49 0.11 -1.80 0.83 132.00 131.62 2cyz h PRO 118 Ca 0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.41 2cyz h PRO 118 Cb 0.47 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.58 2cyz h PRO 118 CO -0.66 0.13 -0.57 0.44 -0.21 0.00 0.00 178.00 177.14 2cyz n ILE 119 N -3.65 0.00 0.18 4.15 -5.35 -0.98 -2.70 119.36 111.02 2cyz n ILE 119 Ca -0.02 -0.30 0.06 0.00 -0.27 0.00 0.00 62.75 62.23 2cyz n ILE 119 Cb 0.26 0.84 -0.09 0.00 -1.74 0.00 0.00 39.64 38.91 2cyz n ILE 119 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 2cyz n LEU 120 N -1.30 0.19 0.00 7.28 4.32 -0.41 -1.14 117.00 125.94 2cyz n LEU 120 Ca 0.01 -0.16 0.00 0.00 -0.02 0.00 0.00 56.01 55.83 2cyz n LEU 120 Cb 0.13 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.93 2cyz n LEU 120 CO 0.14 0.05 0.00 0.61 -1.22 0.00 0.00 177.39 176.97 2cyz n GLY 121 N 1.62 -1.68 3.59 -0.72 0.00 0.28 -3.26 105.19 105.03 2cyz n GLY 121 Ca -0.01 -1.54 -0.39 0.00 0.00 0.00 0.00 46.02 44.08 2cyz n GLY 121 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2cyz n LEU 122 N -1.64 2.81 -4.75 0.99 4.77 -1.26 -4.46 117.00 113.46 2cyz n LEU 122 Ca 0.00 0.91 -0.36 0.00 -0.03 0.00 0.00 56.01 56.53 2cyz n LEU 122 Cb 0.00 -1.35 0.04 0.00 -2.33 0.00 0.00 43.42 39.79 2cyz n LEU 122 CO 0.00 -1.83 0.85 -2.16 -1.33 0.00 0.00 177.39 172.92 2cyz s PRO 123 N -2.32 2.86 0.64 3.23 0.04 -1.26 -4.99 135.00 133.20 2cyz s PRO 123 Ca 0.69 1.85 -0.11 0.00 0.04 0.00 0.00 61.00 63.47 2cyz s PRO 123 Cb -0.48 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.11 2cyz s PRO 123 CO 0.53 -1.30 1.04 -1.25 0.04 0.00 0.00 177.00 176.05 2cyz s PRO 124 N -3.38 3.46 0.29 0.56 0.04 -1.26 -4.94 135.00 129.77 2cyz s PRO 124 Ca 0.78 0.79 0.04 0.00 0.04 0.00 0.00 61.00 62.65 2cyz s PRO 124 Cb -0.31 -2.06 0.68 0.00 0.04 0.00 0.00 34.50 32.85 2cyz s PRO 124 CO 0.35 -0.68 1.76 1.15 0.04 0.00 0.00 177.00 179.62 2cyz h THR 125 N -0.40 0.69 -0.24 1.26 2.02 -1.99 -1.35 112.91 112.90 2cyz h THR 125 Ca -0.44 -0.24 -0.08 0.00 0.77 0.00 0.00 66.41 66.43 2cyz h THR 125 Cb 1.19 -0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 2cyz h THR 125 CO 0.61 0.13 -0.18 4.11 0.37 0.00 0.00 175.52 180.56 2cyz h TRP 126 N 0.69 0.46 0.00 3.16 5.08 -1.98 -2.11 115.95 121.25 2cyz h TRP 126 Ca 0.55 -0.08 -0.08 0.00 1.08 0.00 0.00 58.89 60.36 2cyz h TRP 126 Cb 0.85 -0.12 -0.01 0.00 -3.00 0.00 0.00 29.16 26.88 2cyz h TRP 126 CO -0.04 0.58 -0.36 -0.92 -1.28 0.00 0.00 178.44 176.42 2cyz h TYR 127 N 0.39 0.00 -0.01 0.12 5.03 -1.62 -2.41 116.97 118.46 2cyz h TYR 127 Ca 0.07 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.38 2cyz h TYR 127 Cb 0.53 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.81 2cyz h TYR 127 CO 0.01 0.36 -0.07 1.63 -1.32 0.00 0.00 178.16 178.78 2cyz n LYS 128 N -4.08 1.22 -2.11 1.82 5.02 -0.85 -4.54 118.16 114.66 2cyz n LYS 128 Ca -0.02 -0.58 -0.34 0.00 -2.02 0.00 0.00 58.31 55.35 2cyz n LYS 128 Cb 0.40 -1.49 0.01 0.00 -0.02 0.00 0.00 35.03 33.94 2cyz n LYS 128 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2cyz s SER 129 N -2.18 5.57 0.38 4.39 1.04 -0.90 -4.88 113.70 117.13 2cyz s SER 129 Ca 0.35 2.08 0.08 0.00 0.48 0.00 0.00 55.95 58.94 2cyz s SER 129 Cb 0.21 -2.57 0.78 0.00 0.10 0.00 0.00 66.02 64.54 2cyz s SER 129 CO 0.40 -1.31 1.95 -0.26 0.98 0.00 0.00 173.24 174.99 2cyz h PHE 130 N 0.80 0.37 -0.13 5.02 0.04 -1.92 -1.74 116.94 119.38 2cyz h PHE 130 Ca -0.49 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.26 2cyz h PHE 130 Cb 1.25 -0.11 -0.01 0.00 2.20 0.00 0.00 35.95 39.28 2cyz h PHE 130 CO 0.53 0.39 0.07 0.93 -0.60 0.00 0.00 178.31 179.63 2cyz h GLU 131 N 0.36 0.14 -0.23 1.51 3.07 -1.91 0.63 114.58 118.15 2cyz h GLU 131 Ca 0.08 -0.01 -0.06 0.00 -0.50 0.00 0.00 59.36 58.87 2cyz h GLU 131 Cb 0.25 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.12 2cyz h GLU 131 CO 0.01 0.10 -0.09 -0.92 -1.40 0.00 0.00 179.01 176.71 2cyz h TYR 132 N 0.15 0.53 -0.67 4.33 3.20 -1.72 -1.29 116.97 121.50 2cyz h TYR 132 Ca 0.05 -0.12 0.04 0.00 3.14 0.00 0.00 58.73 61.83 2cyz h TYR 132 Cb -0.00 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.10 2cyz h TYR 132 CO -0.08 0.72 0.44 0.00 -1.64 0.00 0.00 178.16 177.60 2cyz h ARG 133 N 0.19 0.76 0.21 1.82 3.08 -1.22 -1.55 114.38 117.66 2cyz h ARG 133 Ca 0.05 -0.05 -0.33 0.00 0.07 0.00 0.00 59.98 59.73 2cyz h ARG 133 Cb 0.57 -0.17 0.02 0.00 0.08 0.00 0.00 29.97 30.47 2cyz h ARG 133 CO 0.03 0.50 -1.50 0.00 -1.07 0.00 0.00 179.97 177.93 2cyz h ALA 134 N 1.61 -0.01 0.03 0.04 0.00 -0.82 -3.42 119.26 116.70 2cyz h ALA 134 Ca 0.27 -0.95 -0.36 0.00 0.00 0.00 0.00 54.91 53.87 2cyz h ALA 134 Cb 0.11 0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 2cyz h ALA 134 CO -0.08 0.86 -2.19 0.54 0.00 0.00 0.00 179.25 178.38 2cyz n ARG 135 N -3.63 0.69 0.25 0.00 1.74 -0.49 -4.38 116.66 110.83 2cyz n ARG 135 Ca -0.17 0.17 0.12 0.00 -0.77 0.00 0.00 57.85 57.20 2cyz n ARG 135 Cb 1.08 -1.62 0.60 0.00 -1.02 0.00 0.00 32.46 31.50 2cyz n ARG 135 CO 0.00 0.00 0.00 -0.24 -1.52 0.00 0.00 177.63 175.87 2cyz h VAL 136 N 0.02 0.48 -0.08 1.55 3.04 -1.48 0.36 116.25 120.13 2cyz h VAL 136 Ca -0.48 -0.83 -0.11 0.00 -1.01 0.00 0.00 66.70 64.27 2cyz h VAL 136 Cb 2.04 1.57 -0.01 0.00 -2.01 0.00 0.00 31.29 32.88 2cyz h VAL 136 CO 0.02 0.16 -0.45 0.58 -1.01 0.00 0.00 177.57 176.86 2cyz h VAL 137 N 0.00 1.33 0.01 1.51 2.07 -1.80 -2.89 116.25 116.48 2cyz h VAL 137 Ca -0.00 -1.61 -0.37 0.00 0.82 0.00 0.00 66.70 65.54 2cyz h VAL 137 Cb 0.56 1.77 -0.06 0.00 -1.52 0.00 0.00 31.29 32.04 2cyz h VAL 137 CO 0.02 0.48 -2.28 -1.14 0.02 0.00 0.00 177.57 174.66 2cyz n ARG 138 N -3.99 0.68 -3.17 1.57 0.63 -0.84 -4.69 116.66 106.84 2cyz n ARG 138 Ca -0.02 0.11 -0.21 0.00 -0.92 0.00 0.00 57.85 56.82 2cyz n ARG 138 Cb 0.50 -1.58 -0.04 0.00 0.45 0.00 0.00 32.46 31.79 2cyz n ARG 138 CO 0.00 0.00 0.00 -0.85 -2.51 0.00 0.00 177.63 174.27 2cyz n GLU 139 N -3.04 1.17 0.23 -0.14 0.28 0.06 -4.93 120.64 114.27 2cyz n GLU 139 Ca -0.35 -3.53 0.06 0.00 -0.16 0.00 0.00 57.16 53.19 2cyz n GLU 139 Cb 1.08 -1.66 0.52 0.00 1.43 0.00 0.00 31.44 32.81 2cyz n GLU 139 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 177.13 175.97 2cyz h PRO 140 N 3.27 0.00 -0.39 3.44 0.13 -1.66 -1.27 132.00 135.52 2cyz h PRO 140 Ca 0.10 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.15 2cyz h PRO 140 Cb 0.89 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.01 2cyz h PRO 140 CO 0.53 0.18 -0.08 -0.09 -0.23 0.00 0.00 178.00 178.32 2cyz h ARG 141 N 0.00 0.75 -0.46 0.86 2.43 -1.91 -0.49 114.38 115.55 2cyz h ARG 141 Ca -0.00 -0.28 -0.13 0.00 -0.81 0.00 0.00 59.98 58.76 2cyz h ARG 141 Cb 0.33 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 2cyz h ARG 141 CO 0.02 0.88 -0.22 -0.22 -1.51 0.00 0.00 179.97 178.93 2cyz h LYS 142 N 0.56 0.94 -0.08 0.20 3.64 -1.91 -0.49 116.57 119.44 2cyz h LYS 142 Ca 0.10 -0.40 -0.00 0.00 -1.27 0.00 0.00 60.65 59.08 2cyz h LYS 142 Cb 0.59 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.37 2cyz h LYS 142 CO 0.04 1.06 0.04 0.28 -2.27 0.00 0.00 179.45 178.59 2cyz h VAL 143 N 0.82 1.12 -0.82 2.00 2.07 -1.10 -0.86 116.25 119.47 2cyz h VAL 143 Ca 0.11 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.27 2cyz h VAL 143 Cb 0.78 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.71 2cyz h VAL 143 CO 0.06 0.10 0.45 -0.07 0.02 0.00 0.00 177.57 178.14 2cyz h LEU 144 N -0.00 1.03 -0.36 2.57 4.07 -1.00 -0.85 115.31 120.77 2cyz h LEU 144 Ca 0.03 -0.10 0.04 0.00 0.08 0.00 0.00 57.88 57.93 2cyz h LEU 144 Cb 0.13 -0.26 -0.04 0.00 1.08 0.00 0.00 40.66 41.57 2cyz h LEU 144 CO -0.00 0.83 0.13 -1.28 -1.08 0.00 0.00 178.44 177.04 2cyz h SER 145 N 1.15 0.15 -0.26 -0.43 0.87 -0.72 0.78 113.55 115.09 2cyz h SER 145 Ca 0.29 0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 60.88 2cyz h SER 145 Cb 0.03 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.00 2cyz h SER 145 CO -0.05 0.12 0.15 -0.33 -0.53 0.00 0.00 176.83 176.20 2cyz h GLU 146 N 0.29 0.38 0.00 2.24 5.08 -0.74 -0.82 114.58 121.01 2cyz h GLU 146 Ca 0.16 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2cyz h GLU 146 Cb 0.13 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2cyz h GLU 146 CO -0.16 0.28 0.00 -1.33 -1.00 0.00 0.00 179.01 176.80 2cyz n MET 147 N -4.46 0.04 0.00 2.33 2.81 -0.36 -4.90 117.12 112.58 2cyz n MET 147 Ca 0.01 0.09 0.00 0.00 -1.81 0.00 0.00 57.70 55.99 2cyz n MET 147 Cb 0.10 -1.56 0.00 0.00 -0.71 0.00 0.00 33.22 31.05 2cyz n MET 147 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2cyz n GLY 148 N 1.16 1.16 3.05 3.03 0.00 -0.31 -5.07 105.19 108.20 2cyz n GLY 148 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 2cyz n GLY 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2cyz s THR 149 N -2.00 2.06 -0.18 2.61 2.01 0.13 -4.99 115.64 115.29 2cyz s THR 149 Ca 0.00 -1.57 -0.22 0.00 0.31 0.00 0.00 61.69 60.21 2cyz s THR 149 Cb 0.00 -2.20 -0.02 0.00 0.01 0.00 0.00 72.50 70.29 2cyz s THR 149 CO 0.00 -0.04 0.70 -1.61 -0.69 0.00 0.00 174.62 172.98 2cyz s GLU 150 N 1.15 4.25 -0.25 4.92 0.41 -1.26 -2.41 118.70 125.51 2cyz s GLU 150 Ca -0.08 0.76 -0.03 0.00 -0.41 0.00 0.00 54.97 55.21 2cyz s GLU 150 Cb -0.20 -3.57 0.02 0.00 -1.78 0.00 0.00 34.13 28.60 2cyz s GLU 150 CO -0.05 -0.24 -0.03 0.42 -0.49 0.00 0.00 175.26 174.86 2cyz s ILE 151 N 1.90 3.15 0.64 -1.63 -1.09 -1.26 -5.06 121.20 117.84 2cyz s ILE 151 Ca 0.32 -0.89 -0.17 0.00 -2.23 0.00 0.00 60.65 57.68 2cyz s ILE 151 Cb -0.16 -2.58 -0.05 0.00 -1.58 0.00 0.00 42.46 38.09 2cyz s ILE 151 CO 0.11 0.21 0.70 0.00 -1.23 0.00 0.00 174.94 174.73 2cyz n ALA 152 N 4.72 -0.76 -0.09 9.38 0.00 -1.26 -4.88 120.51 127.61 2cyz n ALA 152 Ca -0.16 -0.09 0.25 0.00 0.00 0.00 0.00 53.44 53.44 2cyz n ALA 152 Cb 0.48 -1.95 0.71 0.00 0.00 0.00 0.00 19.45 18.69 2cyz n ALA 152 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2cyz h SER 153 N 0.09 0.00 -0.03 0.00 0.02 -2.04 -2.10 113.55 109.49 2cyz h SER 153 Ca -0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 2cyz h SER 153 Cb 1.37 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.91 2cyz h SER 153 CO 0.47 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.63 2cyz n ASP 154 N -4.30 0.99 -4.60 3.07 10.43 -1.26 -4.74 116.55 116.14 2cyz n ASP 154 Ca 0.14 -1.37 -0.36 0.00 2.57 0.00 0.00 54.79 55.78 2cyz n ASP 154 Cb 0.80 -0.01 -0.10 0.00 1.84 0.00 0.00 41.12 43.65 2cyz n ASP 154 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 2cyz s ILE 155 N -1.98 4.94 0.19 0.53 1.01 -0.79 -4.85 121.20 120.24 2cyz s ILE 155 Ca 0.40 0.03 -0.30 0.00 0.00 0.00 0.00 60.65 60.78 2cyz s ILE 155 Cb 0.20 -3.29 -0.09 0.00 0.01 0.00 0.00 42.46 39.30 2cyz s ILE 155 CO 0.33 0.37 1.36 -0.70 0.00 0.00 0.00 174.94 176.30 2cyz s GLU 156 N 1.04 4.34 -0.15 2.79 2.12 -0.24 -4.85 118.70 123.76 2cyz s GLU 156 Ca 0.06 2.12 -0.08 0.00 0.36 0.00 0.00 54.97 57.43 2cyz s GLU 156 Cb -0.14 -3.18 -0.04 0.00 0.26 0.00 0.00 34.13 31.02 2cyz s GLU 156 CO 0.04 -0.33 0.11 0.42 -0.54 0.00 0.00 175.26 174.96 2cyz s ILE 157 N 0.30 5.26 -0.16 -3.70 1.01 -1.26 -0.56 121.20 122.09 2cyz s ILE 157 Ca 0.59 0.13 0.00 0.00 0.00 0.00 0.00 60.65 61.37 2cyz s ILE 157 Cb -0.38 -3.34 0.02 0.00 0.01 0.00 0.00 42.46 38.78 2cyz s ILE 157 CO 0.38 0.53 -0.14 -0.60 0.00 0.00 0.00 174.94 175.11 2cyz s ARG 158 N -0.33 2.31 -0.24 2.79 3.52 -0.04 -4.95 118.95 122.01 2cyz s ARG 158 Ca 0.11 -0.60 -0.09 0.00 -0.13 0.00 0.00 55.73 55.01 2cyz s ARG 158 Cb -0.12 -2.16 -0.04 0.00 -1.56 0.00 0.00 34.95 31.07 2cyz s ARG 158 CO 0.01 -0.25 0.13 0.08 -0.81 0.00 0.00 175.30 174.45 2cyz s VAL 159 N 1.47 5.02 -0.34 7.11 1.01 -1.26 -1.05 120.40 132.36 2cyz s VAL 159 Ca 0.04 0.06 -0.16 0.00 0.00 0.00 0.00 61.98 61.93 2cyz s VAL 159 Cb -0.13 -3.34 -0.01 0.00 0.00 0.00 0.00 36.38 32.90 2cyz s VAL 159 CO -0.11 0.35 0.41 -0.31 0.00 0.00 0.00 175.10 175.44 2cyz s TYR 160 N 1.17 3.20 -0.29 5.22 1.51 0.73 -4.96 117.35 123.93 2cyz s TYR 160 Ca 0.06 0.09 -0.17 0.00 -1.01 0.00 0.00 57.07 56.05 2cyz s TYR 160 Cb -0.14 -2.74 -0.03 0.00 -0.11 0.00 0.00 41.96 38.94 2cyz s TYR 160 CO 0.05 -0.44 0.45 0.34 -1.11 0.00 0.00 175.55 174.83 2cyz s ASP 161 N 1.73 6.32 -1.26 2.29 -1.08 -1.26 -1.43 116.67 121.98 2cyz s ASP 161 Ca 0.14 0.26 -0.18 0.00 -0.52 0.00 0.00 52.55 52.25 2cyz s ASP 161 Cb -0.16 -2.24 0.08 0.00 -1.46 0.00 0.00 42.92 39.14 2cyz s ASP 161 CO 0.12 -0.29 1.66 -0.89 0.52 0.00 0.00 175.17 176.29 2cyz s THR 162 N 2.21 4.24 -1.71 1.71 2.01 0.89 -4.72 115.64 120.28 2cyz s THR 162 Ca 0.17 -1.92 0.22 0.00 0.31 0.00 0.00 61.69 60.48 2cyz s THR 162 Cb -0.16 -5.14 -0.07 0.00 0.01 0.00 0.00 72.50 67.14 2cyz s THR 162 CO 0.11 -1.96 1.05 0.35 -0.69 0.00 0.00 174.62 173.48 2cyz n THR 163 N 6.18 0.00 0.00 -0.82 -2.24 -1.26 -4.77 114.28 111.37 2cyz n THR 163 Ca 0.46 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 62.06 2cyz n THR 163 Cb 0.46 1.14 0.00 0.00 -2.10 0.00 0.00 70.33 69.83 2cyz n THR 163 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2cyz n ALA 164 N -0.50 0.00 0.69 6.98 0.00 -1.26 -5.07 120.51 121.35 2cyz n ALA 164 Ca 0.08 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.60 2cyz n ALA 164 Cb 0.42 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.76 2cyz n ALA 164 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2cyz n GLU 165 N 0.00 1.01 -1.70 0.00 -0.58 -1.26 -4.92 120.64 113.19 2cyz n GLU 165 Ca 0.00 -0.03 -0.43 0.00 -0.42 0.00 0.00 57.16 56.27 2cyz n GLU 165 Cb 0.00 -1.36 -0.03 0.00 -0.57 0.00 0.00 31.44 29.49 2cyz n GLU 165 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 2cyz n THR 166 N -1.55 0.66 -4.95 2.62 -1.04 -1.26 -4.53 114.28 104.23 2cyz n THR 166 Ca 0.02 -0.16 -0.32 0.00 -2.04 0.00 0.00 64.05 61.55 2cyz n THR 166 Cb 0.31 -1.73 -0.17 0.00 -1.82 0.00 0.00 70.33 66.92 2cyz n THR 166 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2cyz s ARG 167 N 0.04 2.98 0.20 -2.82 1.81 -0.28 -4.84 118.95 116.03 2cyz s ARG 167 Ca 0.70 -0.85 0.07 0.00 -1.72 0.00 0.00 55.73 53.92 2cyz s ARG 167 Cb -0.58 -2.32 -0.04 0.00 -0.45 0.00 0.00 34.95 31.56 2cyz s ARG 167 CO 0.44 0.09 0.09 0.71 -0.68 0.00 0.00 175.30 175.95 2cyz s TYR 168 N 0.57 3.00 0.01 -0.53 2.02 -1.26 -1.61 117.35 119.54 2cyz s TYR 168 Ca -0.13 -0.09 0.00 0.00 -0.37 0.00 0.00 57.07 56.47 2cyz s TYR 168 Cb -0.17 -1.42 -0.01 0.00 -0.40 0.00 0.00 41.96 39.97 2cyz s TYR 168 CO 0.04 0.53 -0.01 0.00 -1.57 0.00 0.00 175.55 174.54 2cyz s MET 169 N -3.26 0.13 0.00 -0.62 0.23 -0.89 -4.41 119.30 110.47 2cyz s MET 169 Ca 0.30 -0.18 -0.23 0.00 -1.03 0.00 0.00 55.69 54.56 2cyz s MET 169 Cb -0.09 -0.02 -0.05 0.00 -1.53 0.00 0.00 34.83 33.14 2cyz s MET 169 CO 0.22 0.00 0.68 0.08 -2.03 0.00 0.00 175.02 173.97 2cyz s VAL 170 N -0.38 4.87 -0.65 5.16 1.01 -0.24 -1.18 120.40 128.99 2cyz s VAL 170 Ca -0.04 1.43 -0.18 0.00 0.00 0.00 0.00 61.98 63.19 2cyz s VAL 170 Cb -0.03 -4.02 0.13 0.00 0.00 0.00 0.00 36.38 32.46 2cyz s VAL 170 CO -0.00 0.36 0.73 -0.22 0.00 0.00 0.00 175.10 175.97 2cyz s LEU 171 N 0.06 5.66 0.85 3.92 2.96 -0.02 -4.57 118.68 127.53 2cyz s LEU 171 Ca 0.35 -1.72 -0.11 0.00 -0.22 0.00 0.00 54.13 52.43 2cyz s LEU 171 Cb -0.19 -2.29 0.10 0.00 0.50 0.00 0.00 46.19 44.31 2cyz s LEU 171 CO 0.19 -1.00 1.09 -2.84 -1.32 0.00 0.00 176.35 172.48 2cyz s PRO 172 N 2.19 1.68 0.48 0.98 0.02 -1.26 -1.75 135.00 137.33 2cyz s PRO 172 Ca 0.13 0.81 -0.22 0.00 0.02 0.00 0.00 61.00 61.74 2cyz s PRO 172 Cb -0.21 -1.86 -0.07 0.00 0.02 0.00 0.00 34.50 32.38 2cyz s PRO 172 CO 0.02 -1.95 1.18 -0.65 -0.33 0.00 0.00 177.00 175.27 2cyz s GLN 173 N -5.00 3.63 -0.12 5.54 -0.21 -1.26 -4.82 119.66 117.42 2cyz s GLN 173 Ca 0.62 1.80 -0.30 0.00 0.02 0.00 0.00 55.36 57.51 2cyz s GLN 173 Cb -0.17 -2.33 -0.02 0.00 1.00 0.00 0.00 33.01 31.49 2cyz s GLN 173 CO 0.56 -0.66 1.17 0.50 -2.12 0.00 0.00 175.29 174.73 2cyz s ARG 174 N -2.80 4.31 0.50 2.91 3.52 -1.26 -4.79 118.95 121.34 2cyz s ARG 174 Ca 0.66 1.59 -0.19 0.00 -0.13 0.00 0.00 55.73 57.65 2cyz s ARG 174 Cb -0.29 -3.63 -0.08 0.00 -1.56 0.00 0.00 34.95 29.39 2cyz s ARG 174 CO 0.35 -0.53 1.02 -1.25 -0.81 0.00 0.00 175.30 174.08 2cyz s PRO 175 N 2.71 3.81 0.74 5.12 0.04 -1.26 -5.01 135.00 141.15 2cyz s PRO 175 Ca 0.53 1.25 -0.15 0.00 0.04 0.00 0.00 61.00 62.66 2cyz s PRO 175 Cb -0.21 -2.10 0.04 0.00 0.04 0.00 0.00 34.50 32.27 2cyz s PRO 175 CO 0.17 -0.41 1.23 0.00 0.04 0.00 0.00 177.00 178.02 2cyz s ALA 176 N -2.17 2.07 0.00 8.56 0.00 -1.26 -3.32 121.76 125.64 2cyz s ALA 176 Ca 0.65 0.94 0.00 0.00 0.00 0.00 0.00 51.96 53.55 2cyz s ALA 176 Cb -0.14 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.48 2cyz s ALA 176 CO 0.23 -1.97 0.00 0.41 0.00 0.00 0.00 175.76 174.43 2cyz n GLY 177 N 0.54 0.75 0.80 0.00 0.00 -1.26 -4.91 105.19 101.11 2cyz n GLY 177 Ca 0.14 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.24 2cyz n GLY 177 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2cyz n THR 178 N -2.12 1.87 -1.80 2.61 -2.24 -1.21 -5.00 114.28 106.38 2cyz n THR 178 Ca 0.00 -1.60 -0.42 0.00 -2.27 0.00 0.00 64.05 59.76 2cyz n THR 178 Cb 0.00 -0.01 -0.03 0.00 -2.10 0.00 0.00 70.33 68.19 2cyz n THR 178 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2cyz s GLU 179 N -2.23 4.16 0.00 -0.78 8.01 -1.26 -1.44 118.70 125.16 2cyz s GLU 179 Ca 0.36 2.52 0.00 0.00 0.01 0.00 0.00 54.97 57.85 2cyz s GLU 179 Cb 0.27 -3.18 0.00 0.00 -4.31 0.00 0.00 34.13 26.91 2cyz s GLU 179 CO 0.11 -0.72 0.00 0.41 0.01 0.00 0.00 175.26 175.07 2cyz n GLY 180 N 3.94 1.58 3.71 -1.39 0.00 -1.26 -5.02 105.19 106.75 2cyz n GLY 180 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 2cyz n GLY 180 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2cyz s TRP 181 N -2.74 1.93 0.76 1.61 0.52 -0.52 -5.00 118.94 115.51 2cyz s TRP 181 Ca 0.00 1.59 -0.12 0.00 0.02 0.00 0.00 56.10 57.59 2cyz s TRP 181 Cb 0.00 -3.57 0.05 0.00 -1.15 0.00 0.00 33.47 28.80 2cyz s TRP 181 CO 0.00 -2.87 1.12 -1.54 0.02 0.00 0.00 176.95 173.69 2cyz s SER 182 N -1.83 4.91 0.29 2.95 1.04 -1.26 -4.85 113.70 114.96 2cyz s SER 182 Ca 0.77 1.05 -0.01 0.00 0.48 0.00 0.00 55.95 58.24 2cyz s SER 182 Cb -0.32 -1.74 0.46 0.00 0.10 0.00 0.00 66.02 64.52 2cyz s SER 182 CO 0.46 -1.67 1.94 1.56 0.98 0.00 0.00 173.24 176.50 2cyz h GLN 183 N -0.89 1.07 -0.77 4.02 4.20 -1.94 -1.11 115.11 119.70 2cyz h GLN 183 Ca -0.46 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.13 2cyz h GLN 183 Cb 1.28 -0.24 -0.03 0.00 0.30 0.00 0.00 27.48 28.79 2cyz h GLN 183 CO 0.64 0.71 0.27 0.93 -0.67 0.00 0.00 178.83 180.71 2cyz h GLU 184 N 1.11 1.17 -0.68 1.46 5.08 -1.98 0.10 114.58 120.84 2cyz h GLU 184 Ca 0.35 -0.23 -0.05 0.00 -1.00 0.00 0.00 59.36 58.44 2cyz h GLU 184 Cb 0.03 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.07 2cyz h GLU 184 CO -0.11 0.97 0.25 1.96 -1.00 0.00 0.00 179.01 181.08 2cyz h GLN 185 N 1.13 1.03 -0.36 2.33 4.20 -1.77 -2.65 115.11 119.02 2cyz h GLN 185 Ca 0.25 -0.20 -0.16 0.00 0.06 0.00 0.00 58.65 58.60 2cyz h GLN 185 Cb 0.27 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 2cyz h GLN 185 CO -0.01 0.87 -0.40 -0.07 -0.67 0.00 0.00 178.83 178.55 2cyz h LEU 186 N 0.98 0.96 -1.26 1.46 3.38 -0.81 -2.97 115.31 117.04 2cyz h LEU 186 Ca 0.22 -0.44 0.04 0.00 0.09 0.00 0.00 57.88 57.79 2cyz h LEU 186 Cb 0.25 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 2cyz h LEU 186 CO -0.01 1.23 0.52 1.56 0.09 0.00 0.00 178.44 181.83 2cyz h GLN 187 N 0.73 0.92 0.00 1.13 4.20 -0.65 -2.28 115.11 119.15 2cyz h GLN 187 Ca 0.06 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2cyz h GLN 187 Cb 0.99 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 28.56 2cyz h GLN 187 CO 0.10 0.61 -0.05 1.49 -0.67 0.00 0.00 178.83 180.30 2cyz h GLU 188 N 0.95 0.00 -0.03 1.46 4.81 -1.30 -2.23 114.58 118.23 2cyz h GLU 188 Ca 0.32 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.55 2cyz h GLU 188 Cb 0.08 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.46 2cyz h GLU 188 CO -0.10 0.05 -0.06 0.44 -0.73 0.00 0.00 179.01 178.61 2cyz n ILE 189 N -4.04 0.00 -3.05 2.32 -5.35 -0.86 -4.73 119.36 103.65 2cyz n ILE 189 Ca -0.03 -0.43 -0.44 0.00 -0.27 0.00 0.00 62.75 61.58 2cyz n ILE 189 Cb 0.14 1.33 -0.05 0.00 -1.74 0.00 0.00 39.64 39.31 2cyz n ILE 189 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2cyz s VAL 190 N -2.07 4.70 0.48 7.28 1.01 -0.84 -4.20 120.40 126.76 2cyz s VAL 190 Ca 0.28 -0.44 0.07 0.00 0.00 0.00 0.00 61.98 61.89 2cyz s VAL 190 Cb 0.20 -4.43 0.03 0.00 0.00 0.00 0.00 36.38 32.18 2cyz s VAL 190 CO 0.34 -1.01 0.66 0.42 0.00 0.00 0.00 175.10 175.51 2cyz s THR 191 N 3.07 2.76 0.23 3.92 -4.23 -1.26 -4.65 115.64 115.48 2cyz s THR 191 Ca 0.18 -0.93 -0.08 0.00 -1.18 0.00 0.00 61.69 59.68 2cyz s THR 191 Cb -0.19 -2.83 0.20 0.00 1.34 0.00 0.00 72.50 71.02 2cyz s THR 191 CO 0.12 0.00 1.69 0.50 -0.54 0.00 0.00 174.62 176.39 2cyz h LYS 192 N 0.42 0.24 0.00 3.99 3.64 -1.92 -0.61 116.57 122.33 2cyz h LYS 192 Ca -0.38 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 58.94 2cyz h LYS 192 Cb 1.28 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.04 2cyz h LYS 192 CO 0.45 0.16 -0.18 -0.44 -2.27 0.00 0.00 179.45 177.17 2cyz h ASP 193 N 0.25 0.00 -0.47 4.20 3.45 -1.94 -0.84 116.42 121.07 2cyz h ASP 193 Ca 0.36 0.00 -0.12 0.00 0.43 0.00 0.00 57.03 57.70 2cyz h ASP 193 Cb 0.57 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.33 2cyz h ASP 193 CO -0.46 0.18 -0.18 0.00 -1.57 0.00 0.00 179.24 177.21 2cyz h LEU 195 N 0.80 0.19 -0.52 0.00 3.38 -0.66 -2.79 115.31 115.72 2cyz h LEU 195 Ca 0.11 -0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.83 2cyz h LEU 195 Cb 0.75 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 2cyz h LEU 195 CO 0.06 0.69 -0.71 0.40 0.09 0.00 0.00 178.44 178.98 2cyz h ILE 196 N 0.14 1.45 0.00 1.22 2.04 -1.13 -0.61 117.51 120.62 2cyz h ILE 196 Ca 0.00 -2.46 0.00 0.00 1.00 0.00 0.00 64.86 63.40 2cyz h ILE 196 Cb 0.99 2.35 0.00 0.00 -0.74 0.00 0.00 36.82 39.42 2cyz h ILE 196 CO 0.08 0.69 0.00 0.61 0.00 0.00 0.00 178.15 179.53 2cyz n GLY 197 N 0.61 0.82 0.07 5.37 0.00 -0.33 -1.23 105.19 110.50 2cyz n GLY 197 Ca -0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.14 2cyz n GLY 197 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2cyz n VAL 198 N -1.02 0.00 -4.26 1.61 0.24 -0.47 -4.63 118.33 109.80 2cyz n VAL 198 Ca 0.00 -0.03 -0.19 0.00 -2.04 0.00 0.00 64.34 62.07 2cyz n VAL 198 Cb 0.00 0.20 -0.11 0.00 -1.47 0.00 0.00 33.84 32.46 2cyz n VAL 198 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2cyz s ALA 199 N -2.85 1.62 -0.10 2.33 0.00 -1.02 -4.63 121.76 117.12 2cyz s ALA 199 Ca 0.16 -1.32 -0.01 0.00 0.00 0.00 0.00 51.96 50.78 2cyz s ALA 199 Cb 0.18 -0.12 -0.03 0.00 0.00 0.00 0.00 23.12 23.16 2cyz s ALA 199 CO 0.63 0.16 -0.04 0.42 0.00 0.00 0.00 175.76 176.92 2cyz s ILE 200 N -1.99 3.91 0.28 0.00 1.01 -1.26 -4.12 121.20 119.04 2cyz s ILE 200 Ca 0.10 -0.38 -0.30 0.00 0.00 0.00 0.00 60.65 60.07 2cyz s ILE 200 Cb -0.06 -2.65 -0.13 0.00 0.01 0.00 0.00 42.46 39.63 2cyz s ILE 200 CO 0.04 0.56 1.38 -2.65 0.00 0.00 0.00 174.94 174.27 2cyz n PRO 201 N 2.66 2.13 -4.24 2.79 -0.02 -1.26 -4.97 135.00 132.09 2cyz n PRO 201 Ca -0.18 0.75 -0.34 0.00 -2.02 0.00 0.00 63.50 61.71 2cyz n PRO 201 Cb 0.53 -2.39 -0.10 0.00 -0.02 0.00 0.00 33.50 31.52 2cyz n PRO 201 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2cyz s GLN 202 N -0.99 3.62 -0.17 -0.52 -1.52 -1.26 -4.83 119.66 113.99 2cyz s GLN 202 Ca 0.63 -0.42 -0.08 0.00 -1.95 0.00 0.00 55.36 53.54 2cyz s GLN 202 Cb -0.60 -3.00 -0.04 0.00 -0.22 0.00 0.00 33.01 29.14 2cyz s GLN 202 CO 0.54 0.38 0.10 0.08 -0.25 0.00 0.00 175.29 176.15 2cyz s VAL 203 N 0.03 5.17 -1.01 1.09 1.01 -1.26 -4.87 120.40 120.56 2cyz s VAL 203 Ca 0.03 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.11 2cyz s VAL 203 Cb -0.13 -3.31 0.00 0.00 0.00 0.00 0.00 36.38 32.94 2cyz s VAL 203 CO 0.02 0.50 0.25 -2.65 0.00 0.00 0.00 175.10 173.22