#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ugp n ASN 2 N 0.00 7.10 -4.84 3.17 5.03 -1.26 -4.96 115.26 119.50 1ugp n ASN 2 Ca 0.00 -2.72 -0.32 0.00 0.87 0.00 0.00 54.58 52.41 1ugp n ASN 2 Cb 0.00 -1.43 0.00 0.00 -1.02 0.00 0.00 39.78 37.33 1ugp n ASN 2 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1ugp s GLY 3 N 1.56 1.87 0.51 7.41 0.00 -1.26 -4.95 107.32 112.47 1ugp s GLY 3 Ca 0.65 0.11 0.23 0.00 0.00 0.00 0.00 44.72 45.70 1ugp s GLY 3 CO -0.07 0.39 2.09 -2.08 0.00 0.00 0.00 173.10 173.43 1ugp h VAL 4 N 0.16 0.77 -0.57 1.40 2.07 -1.93 -2.59 116.25 115.57 1ugp h VAL 4 Ca -0.45 -0.42 0.17 0.00 0.82 0.00 0.00 66.70 66.81 1ugp h VAL 4 Cb 1.20 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 32.19 1ugp h VAL 4 CO 0.60 0.11 0.44 0.10 0.02 0.00 0.00 177.57 178.84 1ugp h TYR 5 N 0.00 0.00 -0.35 1.57 -0.00 -1.92 -3.23 116.97 113.05 1ugp h TYR 5 Ca -0.00 0.00 -0.62 0.00 0.00 0.00 0.00 58.73 58.11 1ugp h TYR 5 Cb 0.24 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 36.94 1ugp h TYR 5 CO 0.00 0.00 2.33 -3.47 -0.00 0.00 0.00 178.16 177.02 1ugp n ASP 6 N -4.19 3.79 -0.00 0.10 2.03 -0.98 -4.75 116.55 112.55 1ugp n ASP 6 Ca 0.11 -2.81 0.13 0.00 0.52 0.00 0.00 54.79 52.74 1ugp n ASP 6 Cb 0.68 -1.59 0.50 0.00 -0.72 0.00 0.00 41.12 39.98 1ugp n ASP 6 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 1ugp n VAL 7 N 6.15 0.00 -1.61 5.18 0.24 -1.22 -4.85 118.33 122.22 1ugp n VAL 7 Ca 0.49 -0.00 -0.50 0.00 -2.04 0.00 0.00 64.34 62.30 1ugp n VAL 7 Cb 0.43 -0.26 -0.05 0.00 -1.47 0.00 0.00 33.84 32.49 1ugp n VAL 7 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ugp n GLY 8 N 1.50 1.08 0.55 7.63 0.00 -1.26 -0.71 105.19 113.98 1ugp n GLY 8 Ca 0.07 0.88 0.00 0.00 0.00 0.00 0.00 46.02 46.97 1ugp n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ugp n GLY 9 N 5.11 0.67 3.74 -0.02 0.00 -1.26 -4.57 105.19 108.86 1ugp n GLY 9 Ca 0.29 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.90 1ugp n GLY 9 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ugp s THR 10 N -2.20 3.09 0.22 2.61 2.01 0.11 -5.03 115.64 116.46 1ugp s THR 10 Ca 0.00 0.89 0.04 0.00 0.31 0.00 0.00 61.69 62.94 1ugp s THR 10 Cb 0.00 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 68.91 1ugp s THR 10 CO 0.00 0.13 0.35 -1.81 -0.69 0.00 0.00 174.62 172.60 1ugp s ASP 11 N 0.38 6.32 0.00 3.53 1.01 -1.26 -4.66 116.67 122.00 1ugp s ASP 11 Ca 0.58 0.10 0.00 0.00 0.71 0.00 0.00 52.55 53.94 1ugp s ASP 11 Cb -0.38 -1.88 0.00 0.00 1.01 0.00 0.00 42.92 41.68 1ugp s ASP 11 CO 0.39 -0.05 0.00 0.61 0.21 0.00 0.00 175.17 176.33 1ugp n GLY 12 N -1.22 0.49 0.00 0.21 0.00 -1.26 -4.94 105.19 98.48 1ugp n GLY 12 Ca -0.08 -0.18 0.13 0.00 0.00 0.00 0.00 46.02 45.89 1ugp n GLY 12 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ugp n LEU 13 N 0.00 0.00 0.00 0.99 4.32 -1.26 -5.02 117.00 116.02 1ugp n LEU 13 Ca 0.00 0.41 0.00 0.00 -0.02 0.00 0.00 56.01 56.40 1ugp n LEU 13 Cb 0.00 -0.41 0.00 0.00 -1.62 0.00 0.00 43.42 41.39 1ugp n LEU 13 CO 0.00 -0.04 0.00 0.61 -1.22 0.00 0.00 177.39 176.74 1ugp n GLY 14 N 1.11 0.13 3.78 -0.72 0.00 -1.26 -5.00 105.19 103.23 1ugp n GLY 14 Ca 0.09 -1.89 -0.33 0.00 0.00 0.00 0.00 46.02 43.89 1ugp n GLY 14 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ugp s PRO 15 N -1.55 3.00 0.14 1.61 0.04 -1.26 -4.99 135.00 131.99 1ugp s PRO 15 Ca 0.00 1.32 -0.31 0.00 0.04 0.00 0.00 61.00 62.06 1ugp s PRO 15 Cb 0.00 -1.98 -0.08 0.00 0.04 0.00 0.00 34.50 32.48 1ugp s PRO 15 CO 0.00 -1.08 1.29 0.42 0.04 0.00 0.00 177.00 177.67 1ugp s ILE 16 N -2.37 3.50 -0.46 0.56 1.01 -1.26 -4.98 121.20 117.19 1ugp s ILE 16 Ca 0.66 1.15 -0.18 0.00 0.00 0.00 0.00 60.65 62.28 1ugp s ILE 16 Cb -0.19 -3.73 0.04 0.00 0.01 0.00 0.00 42.46 38.59 1ugp s ILE 16 CO 0.40 0.13 0.52 0.21 0.00 0.00 0.00 174.94 176.19 1ugp s ASN 17 N 0.72 6.21 -0.29 3.58 2.47 -1.26 -5.02 114.94 121.35 1ugp s ASN 17 Ca 0.59 -0.85 -0.03 0.00 0.42 0.00 0.00 52.86 52.99 1ugp s ASN 17 Cb -0.34 -2.25 0.10 0.00 -1.45 0.00 0.00 41.25 37.31 1ugp s ASN 17 CO 0.33 -0.72 0.11 -0.60 -3.72 0.00 0.00 177.10 172.50 1ugp s ARG 18 N 2.29 0.45 0.80 0.43 3.52 -1.26 -5.13 118.95 120.03 1ugp s ARG 18 Ca 0.13 -0.75 -0.11 0.00 -0.13 0.00 0.00 55.73 54.86 1ugp s ARG 18 Cb -0.19 -1.61 0.07 0.00 -1.56 0.00 0.00 34.95 31.67 1ugp s ARG 18 CO 0.12 -0.97 1.12 -2.14 -0.81 0.00 0.00 175.30 172.63 1ugp s PRO 19 N 1.87 1.93 0.45 5.12 0.02 -1.26 -4.91 135.00 138.23 1ugp s PRO 19 Ca 0.08 1.38 0.11 0.00 0.02 0.00 0.00 61.00 62.60 1ugp s PRO 19 Cb -0.17 -1.84 1.01 0.00 0.02 0.00 0.00 34.50 33.52 1ugp s PRO 19 CO -0.29 -1.92 2.08 0.00 -0.33 0.00 0.00 177.00 176.54 1ugp h ALA 20 N -1.11 1.80 -2.96 -1.55 0.00 -2.06 -3.44 119.26 109.95 1ugp h ALA 20 Ca -0.44 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.45 1ugp h ALA 20 Cb 1.25 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.87 1ugp h ALA 20 CO 0.48 0.17 0.15 0.34 0.00 0.00 0.00 179.25 180.40 1ugp s ASP 21 N -6.86 -0.32 -0.04 0.00 2.15 -1.26 -5.19 116.67 105.15 1ugp s ASP 21 Ca -0.07 -0.45 -0.29 0.00 0.43 0.00 0.00 52.55 52.17 1ugp s ASP 21 Cb 0.17 0.65 0.10 0.00 -0.30 0.00 0.00 42.92 43.54 1ugp s ASP 21 CO 0.71 -1.17 0.83 -1.83 -0.17 0.00 0.00 175.17 173.53 1ugp s GLU 22 N -3.87 0.88 0.66 4.34 -1.05 -1.26 -5.17 118.70 113.23 1ugp s GLU 22 Ca 0.09 -0.07 -0.11 0.00 -0.15 0.00 0.00 54.97 54.73 1ugp s GLU 22 Cb -0.03 0.41 -0.02 0.00 -0.44 0.00 0.00 34.13 34.05 1ugp s GLU 22 CO -0.00 -0.33 1.05 -1.25 0.95 0.00 0.00 175.26 175.68 1ugp s PRO 23 N -2.18 3.26 0.16 -4.83 0.04 -1.26 -4.96 135.00 125.23 1ugp s PRO 23 Ca -0.01 0.69 -0.13 0.00 0.04 0.00 0.00 61.00 61.59 1ugp s PRO 23 Cb -0.01 -2.05 0.05 0.00 0.04 0.00 0.00 34.50 32.54 1ugp s PRO 23 CO -0.02 -0.80 1.72 0.28 0.04 0.00 0.00 177.00 178.22 1ugp h VAL 24 N -0.49 1.21 -3.10 -0.36 2.07 -2.03 -3.40 116.25 110.16 1ugp h VAL 24 Ca -0.44 -0.64 -0.66 0.00 0.82 0.00 0.00 66.70 65.78 1ugp h VAL 24 Cb 1.21 0.64 -0.35 0.00 -1.52 0.00 0.00 31.29 31.28 1ugp h VAL 24 CO 0.62 0.25 -0.86 -0.36 0.02 0.00 0.00 177.57 177.23 1ugp s PHE 25 N -5.60 2.68 -0.74 1.57 0.40 -1.26 -5.01 117.98 110.02 1ugp s PHE 25 Ca -0.13 -1.53 0.26 0.00 -0.60 0.00 0.00 56.93 54.93 1ugp s PHE 25 Cb 0.12 -1.86 0.78 0.00 0.51 0.00 0.00 43.02 42.57 1ugp s PHE 25 CO 0.78 -0.75 1.73 0.54 0.70 0.00 0.00 175.22 178.22 1ugp n ARG 26 N 4.51 0.25 -3.45 0.44 1.74 -1.26 -4.91 116.66 113.99 1ugp n ARG 26 Ca -0.20 0.19 -0.11 0.00 -0.77 0.00 0.00 57.85 56.95 1ugp n ARG 26 Cb 0.50 -1.77 -0.02 0.00 -1.02 0.00 0.00 32.46 30.15 1ugp n ARG 26 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ugp s ALA 27 N -3.10 -1.67 0.41 7.54 0.00 -1.26 -5.05 121.76 118.62 1ugp s ALA 27 Ca 0.10 0.67 0.07 0.00 0.00 0.00 0.00 51.96 52.81 1ugp s ALA 27 Cb 0.13 0.72 0.86 0.00 0.00 0.00 0.00 23.12 24.83 1ugp s ALA 27 CO 0.61 -0.74 2.04 0.93 0.00 0.00 0.00 175.76 178.61 1ugp h GLU 28 N 2.02 0.56 0.00 0.00 4.39 -2.02 -1.74 114.58 117.79 1ugp h GLU 28 Ca -0.30 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.34 1ugp h GLU 28 Cb 1.29 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 29.81 1ugp h GLU 28 CO 0.36 0.37 -0.11 0.11 -1.16 0.00 0.00 179.01 178.57 1ugp h TRP 29 N 0.57 0.00 -0.36 4.33 5.08 -2.00 -2.01 115.95 121.57 1ugp h TRP 29 Ca 0.18 0.00 -0.12 0.00 1.08 0.00 0.00 58.89 60.02 1ugp h TRP 29 Cb 0.01 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.16 1ugp h TRP 29 CO -0.00 0.11 -0.28 0.93 -1.28 0.00 0.00 178.44 177.92 1ugp h GLU 30 N 0.00 0.75 -0.68 0.12 5.08 -1.73 -0.39 114.58 117.74 1ugp h GLU 30 Ca -0.00 -0.33 -0.06 0.00 -1.00 0.00 0.00 59.36 57.97 1ugp h GLU 30 Cb 0.23 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1ugp h GLU 30 CO 0.01 0.95 0.19 0.87 -1.00 0.00 0.00 179.01 180.03 1ugp h LYS 31 N 0.64 1.07 -0.09 2.33 1.57 -1.40 -0.19 116.57 120.50 1ugp h LYS 31 Ca 0.08 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.61 1ugp h LYS 31 Cb 0.80 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.96 1ugp h LYS 31 CO 0.07 0.94 0.02 0.28 -0.57 0.00 0.00 179.45 180.19 1ugp h VAL 32 N 1.00 1.19 -0.61 0.50 2.07 -1.25 -0.85 116.25 118.31 1ugp h VAL 32 Ca 0.22 -0.59 0.05 0.00 0.82 0.00 0.00 66.70 67.20 1ugp h VAL 32 Cb 0.33 1.42 -0.05 0.00 -1.52 0.00 0.00 31.29 31.47 1ugp h VAL 32 CO -0.00 0.17 0.33 0.00 0.02 0.00 0.00 177.57 178.08 1ugp h ALA 33 N 0.81 0.80 -0.07 1.67 0.00 -0.84 -1.40 119.26 120.23 1ugp h ALA 33 Ca 0.03 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1ugp h ALA 33 Cb 0.25 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1ugp h ALA 33 CO 0.00 -0.00 0.04 0.35 0.00 0.00 0.00 179.25 179.64 1ugp h PHE 34 N 0.62 0.09 0.00 0.00 3.57 -0.88 -2.78 116.94 117.55 1ugp h PHE 34 Ca 0.27 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.75 1ugp h PHE 34 Cb 0.16 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 38.87 1ugp h PHE 34 CO -0.09 0.13 -0.10 0.00 -2.23 0.00 0.00 178.31 176.02 1ugp h ALA 35 N 0.96 1.25 0.00 2.41 0.00 -0.79 -2.07 119.26 121.01 1ugp h ALA 35 Ca 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ugp h ALA 35 Cb 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1ugp h ALA 35 CO -0.00 0.12 0.00 0.52 0.00 0.00 0.00 179.25 179.89 1ugp h MET 36 N 0.00 0.00 0.81 0.00 2.86 -0.97 -3.10 114.93 114.53 1ugp h MET 36 Ca -0.00 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 1ugp h MET 36 Cb 0.32 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.98 1ugp h MET 36 CO 0.01 0.00 -0.39 0.35 1.06 0.00 0.00 176.91 177.94 1ugp h PHE 37 N 0.00 -1.01 0.00 -0.22 -0.00 -1.44 -0.03 116.94 114.24 1ugp h PHE 37 Ca 0.00 -0.02 -0.07 0.00 -0.00 0.00 0.00 57.97 57.88 1ugp h PHE 37 Cb 0.34 0.33 -0.01 0.00 -0.00 0.00 0.00 35.95 36.61 1ugp h PHE 37 CO 0.00 -0.63 -0.33 -1.00 -0.00 0.00 0.00 178.31 176.36 1ugp h PRO 38 N -1.12 0.00 0.11 6.41 0.13 -1.76 -2.04 132.00 133.74 1ugp h PRO 38 Ca -0.11 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.01 1ugp h PRO 38 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1ugp h PRO 38 CO 0.18 0.33 -0.05 0.00 -0.23 0.00 0.00 178.00 178.23 1ugp h ALA 39 N 1.67 -0.15 0.00 -0.56 0.00 -1.45 -0.68 119.26 118.10 1ugp h ALA 39 Ca -0.00 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 1ugp h ALA 39 Cb 0.59 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1ugp h ALA 39 CO 0.04 -0.52 -0.53 1.79 0.00 0.00 0.00 179.25 180.03 1ugp h THR 40 N -0.27 1.25 -0.11 0.00 1.35 -0.94 -2.22 112.91 111.97 1ugp h THR 40 Ca -0.02 -1.92 -0.02 0.00 -0.55 0.00 0.00 66.41 63.91 1ugp h THR 40 Cb 0.22 2.07 -0.00 0.00 -1.73 0.00 0.00 68.15 68.71 1ugp h THR 40 CO 0.02 0.52 -0.01 0.15 -0.25 0.00 0.00 175.52 175.96 1ugp h PHE 41 N 0.00 0.22 -0.55 4.73 3.57 -1.25 -0.64 116.94 123.02 1ugp h PHE 41 Ca -0.01 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.42 1ugp h PHE 41 Cb 1.03 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.69 1ugp h PHE 41 CO 0.00 0.47 0.20 -0.09 -2.23 0.00 0.00 178.31 176.66 1ugp h ARG 42 N -0.09 0.80 0.00 1.11 2.43 -1.05 -2.31 114.38 115.27 1ugp h ARG 42 Ca 0.03 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1ugp h ARG 42 Cb 0.39 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1ugp h ARG 42 CO 0.01 0.67 0.00 0.00 -1.51 0.00 0.00 179.97 179.14 1ugp n ALA 43 N -2.46 2.36 -1.04 2.80 0.00 -0.84 -4.90 120.51 116.43 1ugp n ALA 43 Ca 0.04 -0.14 -0.00 0.00 0.00 0.00 0.00 53.44 53.34 1ugp n ALA 43 Cb 0.18 -1.42 -0.00 0.00 0.00 0.00 0.00 19.45 18.21 1ugp n ALA 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ugp n GLY 44 N 0.74 0.39 0.28 0.00 0.00 -0.87 -4.94 105.19 100.80 1ugp n GLY 44 Ca 0.16 -1.09 -0.08 0.00 0.00 0.00 0.00 46.02 45.01 1ugp n GLY 44 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1ugp h PHE 45 N 0.00 0.98 -1.45 1.61 -1.00 -1.34 -3.48 116.94 112.26 1ugp h PHE 45 Ca -0.00 -0.19 0.31 0.00 2.81 0.00 0.00 57.97 60.90 1ugp h PHE 45 Cb 0.05 -0.25 -0.14 0.00 3.61 0.00 0.00 35.95 39.22 1ugp h PHE 45 CO 0.00 0.94 0.83 0.00 -1.61 0.00 0.00 178.31 178.47 1ugp s MET 46 N -4.81 0.37 0.43 1.51 0.23 -1.26 -4.82 119.30 110.96 1ugp s MET 46 Ca -0.10 -0.19 0.07 0.00 -1.03 0.00 0.00 55.69 54.43 1ugp s MET 46 Cb 0.13 0.14 0.07 0.00 -1.53 0.00 0.00 34.83 33.64 1ugp s MET 46 CO 0.84 -0.17 0.55 0.41 -2.03 0.00 0.00 175.02 174.62 1ugp n GLY 47 N -0.39 2.10 0.16 3.16 0.00 -1.26 -4.47 105.19 104.49 1ugp n GLY 47 Ca -0.06 -2.21 -0.09 0.00 0.00 0.00 0.00 46.02 43.66 1ugp n GLY 47 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ugp h LEU 48 N 0.00 0.43 -0.70 0.99 5.85 -1.99 -0.66 115.31 119.22 1ugp h LEU 48 Ca -0.21 -0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.43 1ugp h LEU 48 Cb 0.94 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 1ugp h LEU 48 CO 0.31 0.33 0.26 0.44 -0.34 0.00 0.00 178.44 179.45 1ugp h ASP 49 N 0.48 0.99 -0.46 1.25 5.19 -1.95 -2.01 116.42 119.91 1ugp h ASP 49 Ca 0.13 -0.18 -0.09 0.00 -0.62 0.00 0.00 57.03 56.27 1ugp h ASP 49 Cb -0.03 -0.26 -0.02 0.00 0.18 0.00 0.00 39.33 39.21 1ugp h ASP 49 CO -0.03 0.90 -0.03 -0.33 -3.12 0.00 0.00 179.24 176.64 1ugp h GLU 50 N 1.01 0.89 -0.40 3.56 5.08 -1.69 -2.06 114.58 120.97 1ugp h GLU 50 Ca 0.23 -0.27 0.06 0.00 -1.00 0.00 0.00 59.36 58.38 1ugp h GLU 50 Cb 0.24 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.35 1ugp h GLU 50 CO -0.02 0.90 0.10 0.35 -1.00 0.00 0.00 179.01 179.35 1ugp h PHE 51 N 0.82 0.16 -0.49 4.33 3.04 -0.64 -1.25 116.94 122.91 1ugp h PHE 51 Ca 0.15 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 62.10 1ugp h PHE 51 Cb 0.53 -0.01 -0.02 0.00 2.56 0.00 0.00 35.95 39.00 1ugp h PHE 51 CO 0.03 0.03 0.23 0.00 -2.02 0.00 0.00 178.31 176.58 1ugp h ARG 52 N 0.23 0.71 -0.74 1.11 3.08 -1.04 -2.84 114.38 114.89 1ugp h ARG 52 Ca 0.19 -0.11 0.01 0.00 0.07 0.00 0.00 59.98 60.15 1ugp h ARG 52 Cb 0.22 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.10 1ugp h ARG 52 CO -0.24 0.60 0.49 0.35 -1.07 0.00 0.00 179.97 180.11 1ugp h PHE 53 N 0.65 0.92 -0.75 3.04 3.57 -0.77 -1.48 116.94 122.12 1ugp h PHE 53 Ca 0.17 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.67 1ugp h PHE 53 Cb 0.13 -0.31 -0.04 0.00 2.79 0.00 0.00 35.95 38.53 1ugp h PHE 53 CO -0.00 0.57 0.40 0.78 -2.23 0.00 0.00 178.31 177.82 1ugp h GLY 54 N 0.99 1.13 1.27 2.40 0.00 -1.00 -2.25 103.07 105.60 1ugp h GLY 54 Ca 0.28 -0.51 -0.16 0.00 0.00 0.00 0.00 47.33 46.93 1ugp h GLY 54 CO -0.07 0.49 -0.47 -2.22 0.00 0.00 0.00 176.54 174.28 1ugp h ILE 55 N 1.06 1.29 0.00 2.60 2.04 -1.28 -3.00 117.51 120.22 1ugp h ILE 55 Ca 0.26 -1.66 -0.01 0.00 1.00 0.00 0.00 64.86 64.45 1ugp h ILE 55 Cb 0.05 1.56 -0.00 0.00 -0.74 0.00 0.00 36.82 37.69 1ugp h ILE 55 CO -0.04 0.54 -0.06 -0.33 0.00 0.00 0.00 178.15 178.26 1ugp h GLU 56 N 0.62 0.00 -0.09 2.37 5.08 -0.75 -1.96 114.58 119.84 1ugp h GLU 56 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1ugp h GLU 56 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 1ugp h GLU 56 CO 0.10 0.06 0.00 1.04 -1.00 0.00 0.00 179.01 179.21 1ugp n GLN 57 N -3.54 1.59 -0.95 2.33 6.02 -0.90 -4.85 117.38 117.08 1ugp n GLN 57 Ca -0.02 -0.88 -0.31 0.00 -0.01 0.00 0.00 57.00 55.78 1ugp n GLN 57 Cb 0.18 -1.42 0.14 0.00 1.02 0.00 0.00 30.24 30.16 1ugp n GLN 57 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 1ugp s MET 58 N -1.89 1.31 0.02 -1.09 -1.94 -0.74 -4.92 119.30 110.04 1ugp s MET 58 Ca 0.35 1.25 -0.30 0.00 -1.71 0.00 0.00 55.69 55.28 1ugp s MET 58 Cb 0.18 -1.78 -0.07 0.00 2.01 0.00 0.00 34.83 35.17 1ugp s MET 58 CO 0.29 -2.33 1.67 1.21 -0.01 0.00 0.00 175.02 175.84 1ugp s ASN 59 N -3.02 6.63 0.24 3.03 3.04 -1.26 -4.89 114.94 118.71 1ugp s ASN 59 Ca 0.64 2.39 -0.06 0.00 0.04 0.00 0.00 52.86 55.88 1ugp s ASN 59 Cb -0.20 -2.55 0.42 0.00 -1.54 0.00 0.00 41.25 37.38 1ugp s ASN 59 CO 0.58 -0.91 1.72 -0.65 -3.04 0.00 0.00 177.10 174.80 1ugp h PRO 60 N 8.94 0.36 -0.79 0.43 0.11 -1.94 0.29 132.00 139.41 1ugp h PRO 60 Ca -0.42 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.63 1ugp h PRO 60 Cb 1.19 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.19 1ugp h PRO 60 CO 0.94 0.24 0.35 0.00 -0.21 0.00 0.00 178.00 179.32 1ugp h ALA 61 N 1.54 1.13 -0.30 -0.75 0.00 -2.00 -0.57 119.26 118.31 1ugp h ALA 61 Ca 0.39 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 1ugp h ALA 61 Cb 0.61 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1ugp h ALA 61 CO -0.42 0.64 -0.18 1.49 0.00 0.00 0.00 179.25 180.78 1ugp h GLU 62 N 1.13 0.66 -0.04 0.00 4.81 -1.69 -3.17 114.58 116.28 1ugp h GLU 62 Ca 0.27 -0.30 0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1ugp h GLU 62 Cb 0.16 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 1ugp h GLU 62 CO -0.03 0.90 -0.04 -0.92 -0.73 0.00 0.00 179.01 178.19 1ugp h TYR 63 N 0.41 -0.08 -0.11 0.92 5.03 -0.60 -1.02 116.97 121.51 1ugp h TYR 63 Ca 0.06 0.01 0.03 0.00 2.58 0.00 0.00 58.73 61.41 1ugp h TYR 63 Cb 0.72 0.04 -0.00 0.00 1.55 0.00 0.00 36.73 39.04 1ugp h TYR 63 CO 0.06 -0.06 0.08 -0.07 -1.32 0.00 0.00 178.16 176.86 1ugp h LEU 64 N -0.04 0.00 -1.53 2.82 3.38 -1.14 -3.27 115.31 115.53 1ugp h LEU 64 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1ugp h LEU 64 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1ugp h LEU 64 CO -0.07 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.84 1ugp n GLU 65 N -4.47 0.38 -3.20 1.13 1.02 -1.16 -5.06 120.64 109.28 1ugp n GLU 65 Ca -0.00 -0.76 -0.30 0.00 -0.02 0.00 0.00 57.16 56.07 1ugp n GLU 65 Cb 0.20 -0.93 -0.04 0.00 -0.02 0.00 0.00 31.44 30.65 1ugp n GLU 65 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1ugp s SER 66 N -0.31 6.55 0.33 1.62 1.04 -0.40 -5.02 113.70 117.51 1ugp s SER 66 Ca 0.00 0.95 -0.28 0.00 0.48 0.00 0.00 55.95 57.10 1ugp s SER 66 Cb 0.00 -2.24 -0.12 0.00 0.10 0.00 0.00 66.02 63.76 1ugp s SER 66 CO 0.00 -0.22 1.32 -2.65 0.98 0.00 0.00 173.24 172.67 1ugp n PRO 67 N -0.76 2.15 -0.32 4.02 -0.02 -1.26 -4.89 135.00 133.93 1ugp n PRO 67 Ca 0.01 0.76 -0.04 0.00 -2.02 0.00 0.00 63.50 62.20 1ugp n PRO 67 Cb 0.53 -2.36 0.01 0.00 -0.02 0.00 0.00 33.50 31.66 1ugp n PRO 67 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 1ugp h TYR 68 N 2.82 -1.17 0.00 6.00 3.20 -1.95 -0.39 116.97 125.48 1ugp h TYR 68 Ca -0.46 0.10 0.00 0.00 3.14 0.00 0.00 58.73 61.51 1ugp h TYR 68 Cb 1.28 0.63 0.00 0.00 1.54 0.00 0.00 36.73 40.18 1ugp h TYR 68 CO 0.52 -0.40 0.00 1.88 -1.64 0.00 0.00 178.16 178.52 1ugp h TYR 69 N -0.08 0.00 -0.09 -3.82 0.05 -1.96 -0.72 116.97 110.35 1ugp h TYR 69 Ca 0.27 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.98 1ugp h TYR 69 Cb 0.56 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.29 1ugp h TYR 69 CO -0.81 0.00 -0.30 2.35 -1.05 0.00 0.00 178.16 178.36 1ugp h TRP 70 N 0.00 0.19 -0.93 4.88 2.91 -1.41 -2.09 115.95 119.51 1ugp h TRP 70 Ca 0.00 -0.04 0.00 0.00 1.13 0.00 0.00 58.89 59.98 1ugp h TRP 70 Cb 0.09 -0.05 -0.05 0.00 -0.51 0.00 0.00 29.16 28.65 1ugp h TRP 70 CO 0.00 0.46 0.59 0.45 -1.03 0.00 0.00 178.44 178.90 1ugp h HIS 71 N 0.15 1.19 -0.49 2.65 -0.00 -1.21 -1.17 115.15 116.28 1ugp h HIS 71 Ca 0.02 0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 60.37 1ugp h HIS 71 Cb 0.61 -0.40 -0.02 0.00 -0.00 0.00 0.00 27.41 27.60 1ugp h HIS 71 CO 0.01 0.77 0.17 -1.49 -0.00 0.00 0.00 177.93 177.39 1ugp h TRP 72 N 1.27 0.78 -0.74 2.45 4.06 -1.49 -2.21 115.95 120.07 1ugp h TRP 72 Ca 0.34 -0.07 0.03 0.00 2.06 0.00 0.00 58.89 61.24 1ugp h TRP 72 Cb -0.10 -0.23 -0.04 0.00 -1.00 0.00 0.00 29.16 27.79 1ugp h TRP 72 CO -0.00 0.67 0.47 0.82 -3.56 0.00 0.00 178.44 176.84 1ugp h ILE 73 N 0.66 1.12 -0.94 1.49 1.08 -0.92 -1.68 117.51 118.31 1ugp h ILE 73 Ca 0.16 -0.32 0.01 0.00 -0.39 0.00 0.00 64.86 64.32 1ugp h ILE 73 Cb 0.24 0.11 -0.05 0.00 -3.07 0.00 0.00 36.82 34.06 1ugp h ILE 73 CO -0.01 0.17 0.61 0.03 -0.69 0.00 0.00 178.15 178.26 1ugp h ARG 74 N 0.92 1.25 -0.02 2.37 2.47 -0.89 -1.90 114.38 118.57 1ugp h ARG 74 Ca 0.29 -0.08 -0.13 0.00 -1.26 0.00 0.00 59.98 58.80 1ugp h ARG 74 Cb -0.00 -0.28 -0.02 0.00 -1.65 0.00 0.00 29.97 28.03 1ugp h ARG 74 CO -0.10 0.84 -0.57 0.00 0.56 0.00 0.00 179.97 180.69 1ugp h THR 75 N 1.28 1.40 -0.33 2.04 1.03 -0.78 -0.86 112.91 116.70 1ugp h THR 75 Ca 0.34 -1.94 -0.06 0.00 -0.01 0.00 0.00 66.41 64.75 1ugp h THR 75 Cb -0.13 2.02 -0.01 0.00 -1.07 0.00 0.00 68.15 68.96 1ugp h THR 75 CO -0.07 0.56 -0.02 1.88 -0.01 0.00 0.00 175.52 177.86 1ugp h TYR 76 N 0.06 0.64 -0.35 0.00 0.99 -0.77 -1.61 116.97 115.93 1ugp h TYR 76 Ca -0.00 -0.12 -0.05 0.00 2.00 0.00 0.00 58.73 60.56 1ugp h TYR 76 Cb 1.02 -0.17 -0.01 0.00 1.00 0.00 0.00 36.73 38.58 1ugp h TYR 76 CO 0.01 0.72 0.04 0.82 -0.00 0.00 0.00 178.16 179.75 1ugp h ILE 77 N 0.38 1.24 -0.14 -2.88 2.04 -1.26 0.15 117.51 117.05 1ugp h ILE 77 Ca 0.09 -0.88 0.04 0.00 1.00 0.00 0.00 64.86 65.12 1ugp h ILE 77 Cb 0.48 1.14 -0.05 0.00 -0.74 0.00 0.00 36.82 37.64 1ugp h ILE 77 CO 0.02 0.29 -0.18 -0.74 0.00 0.00 0.00 178.15 177.55 1ugp h HIS 78 N 0.42 -0.46 0.00 1.37 2.76 -1.03 0.27 115.15 118.48 1ugp h HIS 78 Ca 0.10 0.03 -0.12 0.00 -2.20 0.00 0.00 60.37 58.18 1ugp h HIS 78 Cb 0.39 0.23 -0.02 0.00 1.55 0.00 0.00 27.41 29.55 1ugp h HIS 78 CO 0.03 -0.25 -0.56 0.45 -1.30 0.00 0.00 177.93 176.30 1ugp h HIS 79 N -0.22 0.00 -0.54 5.26 3.86 -1.25 -0.88 115.15 121.38 1ugp h HIS 79 Ca 0.10 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.26 1ugp h HIS 79 Cb 0.37 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.82 1ugp h HIS 79 CO -0.29 0.56 0.14 0.78 0.86 0.00 0.00 177.93 179.97 1ugp h GLY 80 N 2.46 0.92 0.94 2.45 0.00 -0.06 -0.75 103.07 109.03 1ugp h GLY 80 Ca -0.01 -0.57 -0.13 0.00 0.00 0.00 0.00 47.33 46.62 1ugp h GLY 80 CO 0.07 0.53 -0.40 -2.08 0.00 0.00 0.00 176.54 174.66 1ugp h VAL 81 N 0.75 1.32 -0.52 4.60 2.07 -0.86 0.20 116.25 123.83 1ugp h VAL 81 Ca 0.17 -1.63 0.06 0.00 0.82 0.00 0.00 66.70 66.13 1ugp h VAL 81 Cb 0.33 1.85 -0.05 0.00 -1.52 0.00 0.00 31.29 31.89 1ugp h VAL 81 CO 0.00 0.51 0.22 -0.09 0.02 0.00 0.00 177.57 178.22 1ugp h ARG 82 N 0.31 0.41 -0.00 1.57 2.43 -0.97 -1.94 114.38 116.19 1ugp h ARG 82 Ca 0.01 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1ugp h ARG 82 Cb 1.00 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.46 1ugp h ARG 82 CO 0.09 0.27 -0.16 0.25 -1.51 0.00 0.00 179.97 178.91 1ugp n THR 83 N -4.96 0.00 -1.07 0.20 -2.24 -0.30 -4.93 114.28 100.98 1ugp n THR 83 Ca 0.05 -0.06 -0.02 0.00 -2.27 0.00 0.00 64.05 61.75 1ugp n THR 83 Cb 0.19 -0.02 -0.01 0.00 -2.10 0.00 0.00 70.33 68.38 1ugp n THR 83 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ugp n GLY 84 N 1.33 0.58 0.11 3.38 0.00 -0.73 -4.91 105.19 104.95 1ugp n GLY 84 Ca 0.13 -0.56 0.12 0.00 0.00 0.00 0.00 46.02 45.70 1ugp n GLY 84 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ugp h LYS 85 N 0.30 0.00 -4.68 1.61 1.57 -0.92 -3.45 116.57 111.00 1ugp h LYS 85 Ca -0.05 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.15 1ugp h LYS 85 Cb 0.23 0.00 -0.35 0.00 0.08 0.00 0.00 32.23 32.19 1ugp h LYS 85 CO 0.07 0.00 -0.83 0.42 -0.57 0.00 0.00 179.45 178.54 1ugp s ILE 86 N -3.24 1.48 -0.35 1.86 -1.09 -0.39 -4.98 121.20 114.49 1ugp s ILE 86 Ca 0.04 -0.61 -0.21 0.00 -2.23 0.00 0.00 60.65 57.64 1ugp s ILE 86 Cb 0.10 -1.37 0.00 0.00 -1.58 0.00 0.00 42.46 39.62 1ugp s ILE 86 CO 0.73 0.44 0.67 -0.62 -1.23 0.00 0.00 174.94 174.93 1ugp s ASP 87 N 1.15 6.48 0.26 3.58 -1.08 -1.26 -4.13 116.67 121.66 1ugp s ASP 87 Ca -0.03 0.27 -0.03 0.00 -0.52 0.00 0.00 52.55 52.23 1ugp s ASP 87 Cb -0.14 -2.35 0.38 0.00 -1.46 0.00 0.00 42.92 39.36 1ugp s ASP 87 CO -0.04 -0.60 1.88 0.25 0.52 0.00 0.00 175.17 177.18 1ugp h LEU 88 N 9.41 1.01 -0.73 -1.34 6.46 -1.98 -1.52 115.31 126.62 1ugp h LEU 88 Ca -0.26 0.01 -0.07 0.00 -0.12 0.00 0.00 57.88 57.44 1ugp h LEU 88 Cb 1.11 -0.21 -0.03 0.00 -0.73 0.00 0.00 40.66 40.80 1ugp h LEU 88 CO 0.85 0.65 0.20 -0.33 -0.62 0.00 0.00 178.44 179.19 1ugp h GLU 89 N 1.15 1.15 -0.44 1.25 3.07 -1.99 -0.41 114.58 118.36 1ugp h GLU 89 Ca 0.42 -0.26 -0.14 0.00 -0.50 0.00 0.00 59.36 58.88 1ugp h GLU 89 Cb 0.15 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 27.89 1ugp h GLU 89 CO -0.17 1.00 -0.26 1.49 -1.40 0.00 0.00 179.01 179.67 1ugp h GLU 90 N 1.10 0.93 -0.68 2.33 4.57 -1.88 -1.86 114.58 119.08 1ugp h GLU 90 Ca 0.23 -0.42 -0.03 0.00 -1.18 0.00 0.00 59.36 57.97 1ugp h GLU 90 Cb 0.35 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.88 1ugp h GLU 90 CO -0.00 1.08 0.31 1.25 -1.18 0.00 0.00 179.01 180.46 1ugp h LEU 91 N 0.80 0.91 -0.68 1.64 5.85 -0.93 -0.64 115.31 122.25 1ugp h LEU 91 Ca 0.10 -0.15 -0.07 0.00 0.84 0.00 0.00 57.88 58.59 1ugp h LEU 91 Cb 0.83 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 1ugp h LEU 91 CO 0.07 0.81 0.14 -0.33 -0.34 0.00 0.00 178.44 178.79 1ugp h GLU 92 N 0.95 1.11 -0.35 1.25 5.08 -0.91 -0.57 114.58 121.15 1ugp h GLU 92 Ca 0.23 -0.28 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1ugp h GLU 92 Cb 0.15 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1ugp h GLU 92 CO -0.03 1.00 0.10 -0.09 -1.00 0.00 0.00 179.01 179.00 1ugp h ARG 93 N 1.04 0.55 -0.09 2.33 2.43 -0.96 -2.34 114.38 117.34 1ugp h ARG 93 Ca 0.21 -0.12 -0.07 0.00 -0.81 0.00 0.00 59.98 59.19 1ugp h ARG 93 Cb 0.41 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.87 1ugp h ARG 93 CO 0.01 0.58 -0.26 0.00 -1.51 0.00 0.00 179.97 178.78 1ugp h ARG 94 N 0.41 0.16 -0.20 0.20 3.08 -0.92 -1.46 114.38 115.65 1ugp h ARG 94 Ca 0.11 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.09 1ugp h ARG 94 Cb 0.26 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 1ugp h ARG 94 CO -0.00 0.42 0.05 1.15 -1.07 0.00 0.00 179.97 180.51 1ugp h THR 95 N 0.15 1.21 -0.71 2.04 2.02 -0.78 -0.91 112.91 115.92 1ugp h THR 95 Ca 0.02 -0.67 -0.04 0.00 0.77 0.00 0.00 66.41 66.49 1ugp h THR 95 Cb 0.55 1.27 -0.03 0.00 -1.74 0.00 0.00 68.15 68.20 1ugp h THR 95 CO 0.04 0.21 0.27 -0.61 0.37 0.00 0.00 175.52 175.80 1ugp h GLN 96 N 0.14 1.05 -0.29 6.66 5.75 -1.16 -0.12 115.11 127.13 1ugp h GLN 96 Ca 0.06 -0.19 0.01 0.00 -0.15 0.00 0.00 58.65 58.38 1ugp h GLN 96 Cb 0.28 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 28.64 1ugp h GLN 96 CO 0.00 0.86 0.19 -0.92 -2.65 0.00 0.00 178.83 176.31 1ugp h TYR 97 N 1.02 0.35 0.00 3.99 3.20 -1.00 -1.18 116.97 123.35 1ugp h TYR 97 Ca 0.24 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.12 1ugp h TYR 97 Cb 0.21 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.37 1ugp h TYR 97 CO 0.02 0.21 0.00 1.88 -1.64 0.00 0.00 178.16 178.63 1ugp h TYR 98 N 0.38 0.00 -0.07 -3.82 0.99 -0.77 0.17 116.97 113.85 1ugp h TYR 98 Ca 0.11 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.77 1ugp h TYR 98 Cb -0.03 0.00 0.00 0.00 1.00 0.00 0.00 36.73 37.71 1ugp h TYR 98 CO -0.07 0.00 -0.22 0.00 -0.00 0.00 0.00 178.16 177.87 1ugp h ARG 99 N 0.00 0.27 0.00 4.88 3.08 -0.25 -2.43 114.38 119.93 1ugp h ARG 99 Ca 0.00 -0.20 -0.14 0.00 0.07 0.00 0.00 59.98 59.71 1ugp h ARG 99 Cb 0.62 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.68 1ugp h ARG 99 CO 0.00 0.83 -0.66 0.93 -1.07 0.00 0.00 179.97 179.99 1ugp h GLU 100 N -0.23 0.00 -2.10 0.04 5.08 -1.04 -3.37 114.58 112.97 1ugp h GLU 100 Ca -0.01 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.77 1ugp h GLU 100 Cb 0.85 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.70 1ugp h GLU 100 CO 0.05 0.66 -0.90 0.09 -1.00 0.00 0.00 179.01 177.92 1ugp n ASN 101 N -3.50 1.60 0.15 1.42 3.02 0.57 -4.96 115.26 113.55 1ugp n ASN 101 Ca -0.00 -2.98 0.15 0.00 -0.03 0.00 0.00 54.58 51.71 1ugp n ASN 101 Cb 0.71 -0.65 0.70 0.00 -0.61 0.00 0.00 39.78 39.93 1ugp n ASN 101 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1ugp h PRO 102 N 4.14 0.00 -0.52 3.52 0.13 -1.60 -1.80 132.00 135.87 1ugp h PRO 102 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1ugp h PRO 102 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1ugp h PRO 102 CO 0.61 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.13 1ugp n ASP 103 N -4.33 3.19 -4.75 1.44 8.00 -1.26 -4.95 116.55 113.88 1ugp n ASP 103 Ca 0.03 -1.97 -0.38 0.00 0.71 0.00 0.00 54.79 53.18 1ugp n ASP 103 Cb 0.33 -0.34 0.03 0.00 -0.02 0.00 0.00 41.12 41.12 1ugp n ASP 103 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ugp s ALA 104 N -1.31 2.84 0.76 2.24 0.00 -0.68 -4.97 121.76 120.64 1ugp s ALA 104 Ca 0.40 1.22 -0.11 0.00 0.00 0.00 0.00 51.96 53.47 1ugp s ALA 104 Cb 0.21 -3.52 0.05 0.00 0.00 0.00 0.00 23.12 19.87 1ugp s ALA 104 CO 0.29 -1.19 1.09 -1.25 0.00 0.00 0.00 175.76 174.70 1ugp s PRO 105 N -2.87 2.34 0.60 0.00 0.04 -1.26 -5.05 135.00 128.80 1ugp s PRO 105 Ca 0.70 1.18 -0.09 0.00 0.04 0.00 0.00 61.00 62.83 1ugp s PRO 105 Cb -0.37 -1.91 -0.01 0.00 0.04 0.00 0.00 34.50 32.25 1ugp s PRO 105 CO 0.44 -1.58 0.96 -0.51 0.04 0.00 0.00 177.00 176.35 1ugp s LEU 106 N -5.81 3.23 0.54 -3.56 1.43 -1.26 -5.02 118.68 108.24 1ugp s LEU 106 Ca 0.61 1.06 -0.22 0.00 -1.03 0.00 0.00 54.13 54.56 1ugp s LEU 106 Cb -0.17 -3.97 -0.05 0.00 0.03 0.00 0.00 46.19 42.03 1ugp s LEU 106 CO 0.55 -0.98 1.34 -2.84 0.23 0.00 0.00 176.35 174.65 1ugp s PRO 107 N -5.08 3.16 0.32 1.29 0.02 -1.26 -4.94 135.00 128.50 1ugp s PRO 107 Ca 0.54 2.20 -0.29 0.00 0.02 0.00 0.00 61.00 63.47 1ugp s PRO 107 Cb -0.11 -2.25 -0.10 0.00 0.02 0.00 0.00 34.50 32.06 1ugp s PRO 107 CO 0.49 -1.17 1.37 -1.21 -0.33 0.00 0.00 177.00 176.16 1ugp s GLU 108 N -2.91 4.29 0.09 5.54 0.41 -1.26 -5.00 118.70 119.85 1ugp s GLU 108 Ca 0.71 2.30 -0.24 0.00 -0.41 0.00 0.00 54.97 57.34 1ugp s GLU 108 Cb -0.40 -3.06 0.06 0.00 -1.78 0.00 0.00 34.13 28.96 1ugp s GLU 108 CO 0.47 -0.30 0.59 -3.38 -0.49 0.00 0.00 175.26 172.14 1ugp s HIS 109 N -0.90 -0.52 0.11 1.61 -3.43 -1.26 -5.16 115.29 105.74 1ugp s HIS 109 Ca 0.52 0.49 -0.12 0.00 -0.80 0.00 0.00 55.06 55.15 1ugp s HIS 109 Cb -0.42 0.46 -0.06 0.00 -1.43 0.00 0.00 32.58 31.14 1ugp s HIS 109 CO 0.53 -0.75 0.47 -1.83 -2.00 0.00 0.00 174.74 171.16 1ugp s GLU 110 N -2.97 3.86 0.46 -0.38 -1.05 -1.26 -5.07 118.70 112.29 1ugp s GLU 110 Ca -0.03 0.32 -0.20 0.00 -0.15 0.00 0.00 54.97 54.91 1ugp s GLU 110 Cb -0.01 -2.96 -0.10 0.00 -0.44 0.00 0.00 34.13 30.63 1ugp s GLU 110 CO -0.06 0.52 0.98 -0.65 0.95 0.00 0.00 175.26 176.99 1ugp s GLN 111 N -1.97 4.06 -0.19 -4.83 -1.52 -1.26 -5.05 119.66 108.90 1ugp s GLN 111 Ca 0.36 1.14 0.00 0.00 -1.95 0.00 0.00 55.36 54.90 1ugp s GLN 111 Cb -0.14 -2.15 0.05 0.00 -0.22 0.00 0.00 33.01 30.54 1ugp s GLN 111 CO 0.19 -0.18 -0.07 0.15 -0.25 0.00 0.00 175.29 175.12 1ugp s LYS 112 N -3.40 1.69 0.38 2.91 1.02 -1.26 -5.01 119.74 116.07 1ugp s LYS 112 Ca 0.62 -0.73 0.09 0.00 0.02 0.00 0.00 55.97 55.98 1ugp s LYS 112 Cb -0.11 -2.28 0.84 0.00 -0.52 0.00 0.00 37.83 35.77 1ugp s LYS 112 CO 0.19 -0.46 1.93 -1.35 -0.92 0.00 0.00 175.35 174.73 1ugp h PRO 113 N 8.03 0.63 -0.14 -1.68 0.11 -2.01 -1.87 132.00 135.07 1ugp h PRO 113 Ca -0.24 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.82 1ugp h PRO 113 Cb 1.10 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 1ugp h PRO 113 CO 0.43 0.41 0.05 1.05 -0.21 0.00 0.00 178.00 179.74 1ugp h GLU 114 N 0.65 0.19 -0.06 1.05 9.09 -1.99 -1.09 114.58 122.42 1ugp h GLU 114 Ca 0.36 -0.02 -0.15 0.00 0.05 0.00 0.00 59.36 59.60 1ugp h GLU 114 Cb 0.53 -0.04 -0.01 0.00 -1.65 0.00 0.00 28.75 27.58 1ugp h GLU 114 CO -0.14 0.17 -0.64 -0.07 0.05 0.00 0.00 179.01 178.39 1ugp h LEU 115 N 0.20 0.25 -0.21 3.06 3.38 -1.77 -0.65 115.31 119.57 1ugp h LEU 115 Ca 0.05 -0.15 -0.21 0.00 0.09 0.00 0.00 57.88 57.66 1ugp h LEU 115 Cb 0.06 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 40.74 1ugp h LEU 115 CO -0.00 0.82 -0.72 0.40 0.09 0.00 0.00 178.44 179.03 1ugp h ILE 116 N 0.16 1.28 -0.67 1.22 1.08 -1.36 -2.05 117.51 117.17 1ugp h ILE 116 Ca -0.01 -1.91 -0.01 0.00 -0.39 0.00 0.00 64.86 62.53 1ugp h ILE 116 Cb 1.15 1.89 -0.03 0.00 -3.07 0.00 0.00 36.82 36.76 1ugp h ILE 116 CO 0.10 0.61 0.36 -0.33 -0.69 0.00 0.00 178.15 178.20 1ugp h GLU 117 N 0.57 0.94 -0.40 2.37 5.08 -1.09 -1.10 114.58 120.96 1ugp h GLU 117 Ca -0.03 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 1ugp h GLU 117 Cb 1.34 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 30.39 1ugp h GLU 117 CO 0.15 0.71 0.23 0.35 -1.00 0.00 0.00 179.01 179.44 1ugp h PHE 118 N 0.92 0.54 0.07 4.33 3.57 -1.03 -0.71 116.94 124.63 1ugp h PHE 118 Ca 0.23 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.73 1ugp h PHE 118 Cb 0.05 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 1ugp h PHE 118 CO -0.00 0.41 -0.09 0.28 -2.23 0.00 0.00 178.31 176.68 1ugp h VAL 119 N 0.52 0.80 -0.67 1.41 2.07 -0.97 0.53 116.25 119.93 1ugp h VAL 119 Ca 0.14 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.65 1ugp h VAL 119 Cb 0.04 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.57 1ugp h VAL 119 CO -0.02 0.00 0.38 0.78 0.02 0.00 0.00 177.57 178.73 1ugp h ASN 120 N -0.18 0.83 -0.48 0.57 2.35 -1.05 -0.45 115.58 117.16 1ugp h ASN 120 Ca 0.01 -0.08 -0.06 0.00 -0.55 0.00 0.00 56.30 55.62 1ugp h ASN 120 Cb 0.19 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 1ugp h ASN 120 CO -0.04 0.67 0.05 1.56 -1.65 0.00 0.00 177.43 178.02 1ugp h GLN 121 N 0.92 0.81 -0.25 0.81 4.20 -0.96 -1.41 115.11 119.23 1ugp h GLN 121 Ca 0.24 -0.23 -0.05 0.00 0.06 0.00 0.00 58.65 58.67 1ugp h GLN 121 Cb 0.01 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 1ugp h GLN 121 CO -0.04 0.84 -0.02 0.00 -0.67 0.00 0.00 178.83 178.93 1ugp h ALA 122 N 0.94 0.34 0.07 3.87 0.00 -0.67 0.24 119.26 124.05 1ugp h ALA 122 Ca 0.14 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1ugp h ALA 122 Cb 0.44 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1ugp h ALA 122 CO 0.02 0.10 -0.03 0.28 0.00 0.00 0.00 179.25 179.61 1ugp h VAL 123 N 0.22 1.04 0.00 0.00 2.07 -1.04 0.11 116.25 118.65 1ugp h VAL 123 Ca 0.07 -0.38 -0.06 0.00 0.82 0.00 0.00 66.70 67.15 1ugp h VAL 123 Cb 0.45 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 1ugp h VAL 123 CO 0.02 0.09 -1.14 1.88 0.02 0.00 0.00 177.57 178.44 1ugp h TYR 124 N -0.26 0.00 0.00 1.57 0.05 -1.33 -3.36 116.97 113.64 1ugp h TYR 124 Ca -0.01 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 58.59 1ugp h TYR 124 Cb 0.23 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.93 1ugp h TYR 124 CO -0.02 0.22 -2.02 0.41 -1.05 0.00 0.00 178.16 175.70 1ugp n GLY 125 N 1.26 -1.05 0.08 3.88 0.00 0.82 -5.07 105.19 105.12 1ugp n GLY 125 Ca -0.04 -0.37 0.01 0.00 0.00 0.00 0.00 46.02 45.63 1ugp n GLY 125 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ugp n GLY 126 N 1.48 -1.54 2.36 -0.02 0.00 0.37 -4.74 105.19 103.09 1ugp n GLY 126 Ca -0.16 -1.50 -0.26 0.00 0.00 0.00 0.00 46.02 44.09 1ugp n GLY 126 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ugp n LEU 127 N -1.68 2.19 -4.66 0.99 4.77 -1.26 -4.71 117.00 112.64 1ugp n LEU 127 Ca -0.00 -5.10 -0.46 0.00 -0.03 0.00 0.00 56.01 50.41 1ugp n LEU 127 Cb 0.04 -0.12 -0.04 0.00 -2.33 0.00 0.00 43.42 40.97 1ugp n LEU 127 CO 0.00 2.04 1.07 -0.81 -1.33 0.00 0.00 177.39 178.36 1ugp n PRO 128 N 1.19 1.94 0.00 3.23 -0.04 -1.26 -4.91 135.00 135.15 1ugp n PRO 128 Ca 0.26 0.70 0.11 0.00 -0.04 0.00 0.00 63.50 64.53 1ugp n PRO 128 Cb 0.46 -2.39 0.03 0.00 -0.04 0.00 0.00 33.50 31.55 1ugp n PRO 128 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ugp n ALA 129 N 2.63 3.34 -1.77 0.55 0.00 -1.26 -4.97 120.51 119.04 1ugp n ALA 129 Ca 0.15 -0.65 -0.40 0.00 0.00 0.00 0.00 53.44 52.54 1ugp n ALA 129 Cb 0.28 -0.80 -0.02 0.00 0.00 0.00 0.00 19.45 18.91 1ugp n ALA 129 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ugp s SER 130 N -2.39 6.71 0.06 0.00 1.04 -1.26 -1.88 113.70 115.99 1ugp s SER 130 Ca 0.20 2.53 -0.03 0.00 0.48 0.00 0.00 55.95 59.13 1ugp s SER 130 Cb 0.18 -2.63 -0.03 0.00 0.10 0.00 0.00 66.02 63.64 1ugp s SER 130 CO 0.52 -0.56 0.04 -0.13 0.98 0.00 0.00 173.24 174.09 1ugp s ARG 131 N -1.94 0.69 -0.12 4.02 1.81 -0.12 -4.92 118.95 118.37 1ugp s ARG 131 Ca 0.52 -1.15 -0.09 0.00 -1.72 0.00 0.00 55.73 53.29 1ugp s ARG 131 Cb -0.36 0.25 -0.04 0.00 -0.45 0.00 0.00 34.95 34.35 1ugp s ARG 131 CO 0.47 -0.16 0.19 -1.21 -0.68 0.00 0.00 175.30 173.90 1ugp s GLU 132 N -3.91 3.65 0.20 3.54 0.41 -1.26 -3.91 118.70 117.43 1ugp s GLU 132 Ca 0.07 -0.05 0.08 0.00 -0.41 0.00 0.00 54.97 54.65 1ugp s GLU 132 Cb 0.07 -3.24 -0.05 0.00 -1.78 0.00 0.00 34.13 29.14 1ugp s GLU 132 CO -0.10 0.67 -0.15 0.14 -0.49 0.00 0.00 175.26 175.34 1ugp s VAL 133 N -0.77 1.73 -0.11 2.63 -7.23 -1.26 -5.03 120.40 110.36 1ugp s VAL 133 Ca 0.15 -2.19 0.14 0.00 -1.81 0.00 0.00 61.98 58.27 1ugp s VAL 133 Cb -0.13 -2.02 0.01 0.00 0.56 0.00 0.00 36.38 34.80 1ugp s VAL 133 CO 0.05 -0.58 1.40 0.44 -0.31 0.00 0.00 175.10 176.10 1ugp h ASP 134 N 2.61 0.00 -3.54 4.85 5.19 -1.99 -3.46 116.42 120.09 1ugp h ASP 134 Ca -0.38 0.00 -0.52 0.00 -0.62 0.00 0.00 57.03 55.50 1ugp h ASP 134 Cb 1.22 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.70 1ugp h ASP 134 CO 0.61 0.59 0.11 0.00 -3.12 0.00 0.00 179.24 177.43 1ugp s ARG 135 N -2.92 4.29 0.68 3.56 1.70 -1.26 -5.08 118.95 119.93 1ugp s ARG 135 Ca 0.03 0.90 -0.10 0.00 -0.47 0.00 0.00 55.73 56.09 1ugp s ARG 135 Cb 0.08 -2.96 0.01 0.00 -0.57 0.00 0.00 34.95 31.51 1ugp s ARG 135 CO 0.76 0.44 1.06 -1.25 -1.08 0.00 0.00 175.30 175.23 1ugp s PRO 136 N -1.79 2.88 0.28 3.89 0.04 -1.26 -5.00 135.00 134.04 1ugp s PRO 136 Ca 0.41 0.37 -0.29 0.00 0.04 0.00 0.00 61.00 61.52 1ugp s PRO 136 Cb -0.18 -2.07 -0.10 0.00 0.04 0.00 0.00 34.50 32.19 1ugp s PRO 136 CO 0.22 -0.96 1.40 -1.25 0.04 0.00 0.00 177.00 176.44 1ugp s PRO 137 N -5.28 4.29 0.20 0.56 0.04 -1.26 -4.92 135.00 128.63 1ugp s PRO 137 Ca 0.57 2.28 0.10 0.00 0.04 0.00 0.00 61.00 64.00 1ugp s PRO 137 Cb -0.11 -3.09 0.04 0.00 0.04 0.00 0.00 34.50 31.38 1ugp s PRO 137 CO 0.50 -0.35 1.42 -0.22 0.04 0.00 0.00 177.00 178.39 1ugp h LYS 138 N 4.43 0.00 -5.87 4.56 3.64 -1.99 -3.46 116.57 117.87 1ugp h LYS 138 Ca -0.47 0.00 -0.61 0.00 -1.27 0.00 0.00 60.65 58.30 1ugp h LYS 138 Cb 1.22 0.00 -0.12 0.00 -0.41 0.00 0.00 32.23 32.92 1ugp h LYS 138 CO 0.73 0.78 -0.63 -0.06 -2.27 0.00 0.00 179.45 178.01 1ugp s PHE 139 N -3.04 2.49 0.18 1.91 0.40 -1.26 -5.10 117.98 113.55 1ugp s PHE 139 Ca 0.01 -0.54 -0.09 0.00 -0.60 0.00 0.00 56.93 55.71 1ugp s PHE 139 Cb 0.10 -1.57 -0.01 0.00 0.51 0.00 0.00 43.02 42.05 1ugp s PHE 139 CO 0.78 0.48 0.31 -1.59 0.70 0.00 0.00 175.22 175.91 1ugp s LYS 140 N -3.69 1.22 0.20 0.44 -2.85 -1.26 -4.97 119.74 108.82 1ugp s LYS 140 Ca 0.35 -1.21 -0.32 0.00 -1.00 0.00 0.00 55.97 53.78 1ugp s LYS 140 Cb 0.04 0.39 -0.14 0.00 -2.06 0.00 0.00 37.83 36.05 1ugp s LYS 140 CO 0.18 -0.46 1.33 0.39 0.10 0.00 0.00 175.35 176.90 1ugp n GLU 141 N -0.25 1.67 0.00 1.78 1.02 -1.26 -1.84 120.64 121.76 1ugp n GLU 141 Ca -0.06 0.60 0.00 0.00 -0.02 0.00 0.00 57.16 57.68 1ugp n GLU 141 Cb 0.63 -2.21 0.00 0.00 -0.02 0.00 0.00 31.44 29.84 1ugp n GLU 141 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ugp n GLY 142 N 2.27 3.41 3.75 0.62 0.00 -0.35 -4.99 105.19 109.89 1ugp n GLY 142 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1ugp n GLY 142 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ugp s ASP 143 N -0.87 6.64 -0.25 1.61 1.01 -0.77 -4.72 116.67 119.31 1ugp s ASP 143 Ca 0.00 2.69 -0.15 0.00 0.71 0.00 0.00 52.55 55.80 1ugp s ASP 143 Cb 0.00 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.27 1ugp s ASP 143 CO 0.00 -0.71 0.40 -0.69 0.21 0.00 0.00 175.17 174.38 1ugp s VAL 144 N -0.07 5.17 0.23 -1.27 1.01 -1.26 -0.71 120.40 123.50 1ugp s VAL 144 Ca 0.59 0.64 0.06 0.00 0.00 0.00 0.00 61.98 63.27 1ugp s VAL 144 Cb -0.42 -3.72 -0.05 0.00 0.00 0.00 0.00 36.38 32.19 1ugp s VAL 144 CO 0.44 0.17 -0.08 0.68 0.00 0.00 0.00 175.10 176.31 1ugp s VAL 145 N 1.94 1.52 -0.09 2.92 -7.23 0.18 0.35 120.40 120.00 1ugp s VAL 145 Ca 0.17 -2.13 0.03 0.00 -1.81 0.00 0.00 61.98 58.24 1ugp s VAL 145 Cb -0.15 -2.25 -0.01 0.00 0.56 0.00 0.00 36.38 34.53 1ugp s VAL 145 CO 0.09 -0.44 -0.20 -0.60 -0.31 0.00 0.00 175.10 173.64 1ugp s ARG 146 N -3.73 2.94 0.20 4.82 3.52 -0.29 -0.58 118.95 125.83 1ugp s ARG 146 Ca 0.26 -0.81 -0.30 0.00 -0.13 0.00 0.00 55.73 54.75 1ugp s ARG 146 Cb 0.03 -2.36 -0.08 0.00 -1.56 0.00 0.00 34.95 30.97 1ugp s ARG 146 CO 0.09 0.30 0.98 0.12 -0.81 0.00 0.00 175.30 175.97 1ugp s PHE 147 N 0.07 3.87 0.55 5.12 5.36 -0.20 -1.99 117.98 130.76 1ugp s PHE 147 Ca -0.09 1.84 -0.21 0.00 -0.96 0.00 0.00 56.93 57.51 1ugp s PHE 147 Cb -0.15 -3.06 -0.06 0.00 -0.34 0.00 0.00 43.02 39.41 1ugp s PHE 147 CO 0.06 0.20 1.12 0.45 -1.46 0.00 0.00 175.22 175.58 1ugp n SER 148 N 1.89 1.56 -1.35 6.13 2.88 0.12 -0.60 113.62 124.25 1ugp n SER 148 Ca -0.00 0.91 0.11 0.00 -1.33 0.00 0.00 58.87 58.55 1ugp n SER 148 Cb 0.47 -1.45 0.32 0.00 -0.75 0.00 0.00 64.21 62.80 1ugp n SER 148 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1ugp n THR 149 N -1.24 1.26 -1.83 2.46 -2.24 -1.26 -3.34 114.28 108.09 1ugp n THR 149 Ca 0.12 -1.07 -0.36 0.00 -2.27 0.00 0.00 64.05 60.46 1ugp n THR 149 Cb 0.45 0.38 0.06 0.00 -2.10 0.00 0.00 70.33 69.11 1ugp n THR 149 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ugp s ALA 150 N -1.27 2.43 -0.44 6.98 0.00 -1.26 -4.99 121.76 123.20 1ugp s ALA 150 Ca 0.47 1.10 0.08 0.00 0.00 0.00 0.00 51.96 53.61 1ugp s ALA 150 Cb 0.27 -3.50 0.25 0.00 0.00 0.00 0.00 23.12 20.14 1ugp s ALA 150 CO 0.29 -1.44 0.58 -1.13 0.00 0.00 0.00 175.76 174.06 1ugp n SER 151 N -1.84 1.01 -4.69 0.00 3.41 -1.26 -5.08 113.62 105.17 1ugp n SER 151 Ca 0.15 -2.88 -0.42 0.00 -0.26 0.00 0.00 58.87 55.47 1ugp n SER 151 Cb 0.49 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 1ugp n SER 151 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1ugp n PRO 152 N 1.23 1.91 0.14 4.33 -0.04 -1.26 -4.90 135.00 136.40 1ugp n PRO 152 Ca 0.23 0.68 0.12 0.00 -0.04 0.00 0.00 63.50 64.49 1ugp n PRO 152 Cb 0.51 -2.31 0.24 0.00 -0.04 0.00 0.00 33.50 31.90 1ugp n PRO 152 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1ugp h LYS 153 N 2.17 0.00 0.00 0.54 1.57 -1.99 -2.64 116.57 116.21 1ugp h LYS 153 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1ugp h LYS 153 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 1ugp h LYS 153 CO 0.60 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.89 1ugp n GLY 154 N 1.22 1.19 3.77 3.86 0.00 -1.26 -4.33 105.19 109.64 1ugp n GLY 154 Ca 0.04 -1.98 -0.39 0.00 0.00 0.00 0.00 46.02 43.69 1ugp n GLY 154 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ugp s HIS 155 N 0.96 2.95 0.04 1.61 2.46 -1.26 -0.03 115.29 122.03 1ugp s HIS 155 Ca 0.00 1.48 -0.28 0.00 0.47 0.00 0.00 55.06 56.73 1ugp s HIS 155 Cb 0.00 -3.55 0.09 0.00 -0.13 0.00 0.00 32.58 28.99 1ugp s HIS 155 CO 0.00 -1.72 0.91 0.00 -2.47 0.00 0.00 174.74 171.47 1ugp s ALA 156 N -1.31 -1.78 -0.64 1.58 0.00 -1.26 -4.15 121.76 114.20 1ugp s ALA 156 Ca 0.56 0.74 0.03 0.00 0.00 0.00 0.00 51.96 53.29 1ugp s ALA 156 Cb -0.35 0.49 0.36 0.00 0.00 0.00 0.00 23.12 23.61 1ugp s ALA 156 CO 0.45 -0.80 1.22 0.54 0.00 0.00 0.00 175.76 177.16 1ugp n ARG 157 N -0.32 3.62 -3.67 0.00 5.12 -1.26 -4.68 116.66 115.48 1ugp n ARG 157 Ca -0.08 -4.65 -0.31 0.00 -1.93 0.00 0.00 57.85 50.88 1ugp n ARG 157 Cb 0.61 -2.28 -0.09 0.00 -1.16 0.00 0.00 32.46 29.54 1ugp n ARG 157 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1ugp n ARG 158 N -0.29 2.38 -1.65 5.56 1.74 -1.26 -4.99 116.66 118.14 1ugp n ARG 158 Ca 0.37 -4.54 -0.47 0.00 -0.77 0.00 0.00 57.85 52.45 1ugp n ARG 158 Cb 0.42 -2.33 -0.04 0.00 -1.02 0.00 0.00 32.46 29.49 1ugp n ARG 158 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ugp n ALA 159 N 1.77 0.87 -0.21 7.54 0.00 -1.26 -4.84 120.51 124.38 1ugp n ALA 159 Ca 0.23 0.45 0.19 0.00 0.00 0.00 0.00 53.44 54.32 1ugp n ALA 159 Cb 0.37 -2.28 0.54 0.00 0.00 0.00 0.00 19.45 18.07 1ugp n ALA 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ugp h ARG 160 N 5.40 0.34 0.00 0.00 3.08 -1.91 -1.87 114.38 119.41 1ugp h ARG 160 Ca -0.45 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.58 1ugp h ARG 160 Cb 1.27 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.25 1ugp h ARG 160 CO 0.85 0.22 0.00 0.10 -1.07 0.00 0.00 179.97 180.07 1ugp h TYR 161 N 0.35 0.00 0.00 3.04 -0.00 -1.88 -2.89 116.97 115.59 1ugp h TYR 161 Ca 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 59.17 1ugp h TYR 161 Cb 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.89 1ugp h TYR 161 CO -0.00 0.00 -0.86 1.33 -0.00 0.00 0.00 178.16 178.63 1ugp n VAL 162 N -2.56 0.00 -1.76 -0.90 0.24 -0.71 -4.88 118.33 107.76 1ugp n VAL 162 Ca 0.00 -0.17 -0.42 0.00 -2.04 0.00 0.00 64.34 61.72 1ugp n VAL 162 Cb 0.18 0.89 -0.02 0.00 -1.47 0.00 0.00 33.84 33.41 1ugp n VAL 162 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1ugp s ARG 163 N -2.54 4.13 0.00 7.34 0.52 -1.09 -1.78 118.95 125.52 1ugp s ARG 163 Ca 0.04 2.59 0.00 0.00 -0.52 0.00 0.00 55.73 57.84 1ugp s ARG 163 Cb 0.11 -3.05 0.00 0.00 0.52 0.00 0.00 34.95 32.53 1ugp s ARG 163 CO 0.63 -0.69 0.00 0.41 0.02 0.00 0.00 175.30 175.67 1ugp n GLY 164 N 3.10 0.66 3.86 -3.53 0.00 0.23 -4.93 105.19 104.58 1ugp n GLY 164 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 1ugp n GLY 164 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ugp s LYS 165 N -0.33 3.90 -0.14 1.61 -0.14 -0.73 -4.72 119.74 119.18 1ugp s LYS 165 Ca 0.00 0.43 -0.10 0.00 -1.36 0.00 0.00 55.97 54.93 1ugp s LYS 165 Cb 0.00 -2.66 -0.05 0.00 -1.68 0.00 0.00 37.83 33.44 1ugp s LYS 165 CO 0.00 0.31 0.20 0.99 -0.76 0.00 0.00 175.35 176.09 1ugp s THR 166 N -1.78 5.39 0.30 2.17 2.01 -1.26 -1.04 115.64 121.43 1ugp s THR 166 Ca 0.47 0.34 0.02 0.00 0.31 0.00 0.00 61.69 62.83 1ugp s THR 166 Cb -0.12 -3.50 -0.01 0.00 0.01 0.00 0.00 72.50 68.88 1ugp s THR 166 CO 0.20 0.51 0.35 0.61 -0.69 0.00 0.00 174.62 175.60 1ugp n GLY 167 N 2.73 2.58 3.25 4.40 0.00 0.25 -4.69 105.19 113.72 1ugp n GLY 167 Ca -0.16 -1.70 -0.32 0.00 0.00 0.00 0.00 46.02 43.83 1ugp n GLY 167 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ugp s THR 168 N -2.94 2.09 0.02 2.61 2.01 -0.35 -0.64 115.64 118.44 1ugp s THR 168 Ca 0.29 -1.03 -0.30 0.00 0.31 0.00 0.00 61.69 60.96 1ugp s THR 168 Cb 0.00 -1.77 -0.07 0.00 0.01 0.00 0.00 72.50 70.67 1ugp s THR 168 CO 0.21 0.57 1.63 -0.69 -0.69 0.00 0.00 174.62 175.64 1ugp s VAL 169 N 0.04 3.31 -0.18 3.82 1.01 0.12 -0.41 120.40 128.10 1ugp s VAL 169 Ca -0.10 0.63 0.02 0.00 0.00 0.00 0.00 61.98 62.53 1ugp s VAL 169 Cb -0.15 -3.40 -0.22 0.00 0.00 0.00 0.00 36.38 32.61 1ugp s VAL 169 CO 0.06 -0.02 0.10 0.52 0.00 0.00 0.00 175.10 175.76 1ugp n VAL 170 N 4.99 1.59 -3.59 2.92 0.31 0.89 -1.21 118.33 124.22 1ugp n VAL 170 Ca 0.16 -0.66 -0.13 0.00 -0.01 0.00 0.00 64.34 63.70 1ugp n VAL 170 Cb 0.42 -1.36 -0.06 0.00 -0.91 0.00 0.00 33.84 31.93 1ugp n VAL 170 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1ugp s LYS 171 N -2.54 0.74 -0.23 5.55 2.20 -1.17 -4.82 119.74 119.47 1ugp s LYS 171 Ca -0.24 0.51 -0.09 0.00 -0.36 0.00 0.00 55.97 55.79 1ugp s LYS 171 Cb 0.08 0.36 -0.04 0.00 -1.51 0.00 0.00 37.83 36.71 1ugp s LYS 171 CO 0.71 -0.16 0.12 -1.58 -0.36 0.00 0.00 175.35 174.08 1ugp s HIS 172 N -0.38 3.24 -2.22 4.03 5.65 -1.26 -1.21 115.29 123.14 1ugp s HIS 172 Ca -0.02 0.04 0.22 0.00 0.25 0.00 0.00 55.06 55.55 1ugp s HIS 172 Cb -0.03 -2.23 0.04 0.00 -1.18 0.00 0.00 32.58 29.18 1ugp s HIS 172 CO 0.01 -0.03 1.11 0.72 -0.65 0.00 0.00 174.74 175.91 1ugp n HIS 173 N 4.31 0.00 0.00 3.88 -0.00 -0.08 -5.01 115.22 118.32 1ugp n HIS 173 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.56 1ugp n HIS 173 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.51 1ugp n HIS 173 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1ugp n GLY 174 N 1.38 -2.62 3.88 -1.41 0.00 -1.26 -4.93 105.19 100.23 1ugp n GLY 174 Ca 0.10 -2.10 -0.32 0.00 0.00 0.00 0.00 46.02 43.69 1ugp n GLY 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ugp s ALA 175 N -1.57 3.68 0.16 4.61 0.00 -1.25 -0.64 121.76 126.76 1ugp s ALA 175 Ca 0.00 -0.39 -0.04 0.00 0.00 0.00 0.00 51.96 51.53 1ugp s ALA 175 Cb 0.00 -2.29 -0.03 0.00 0.00 0.00 0.00 23.12 20.80 1ugp s ALA 175 CO 0.00 0.58 0.15 0.71 0.00 0.00 0.00 175.76 177.20 1ugp s TYR 176 N -1.66 0.78 0.21 0.00 1.51 -0.32 -0.95 117.35 116.93 1ugp s TYR 176 Ca 0.42 -1.12 -0.32 0.00 -1.01 0.00 0.00 57.07 55.04 1ugp s TYR 176 Cb -0.12 -0.35 -0.14 0.00 -0.11 0.00 0.00 41.96 41.23 1ugp s TYR 176 CO 0.22 -0.63 1.31 -0.89 -1.11 0.00 0.00 175.55 174.45 1ugp n ILE 177 N -0.18 0.91 -3.15 2.71 5.41 -0.79 -1.32 119.36 122.95 1ugp n ILE 177 Ca -0.04 -0.23 -0.41 0.00 1.00 0.00 0.00 62.75 63.07 1ugp n ILE 177 Cb 0.64 -1.22 -0.07 0.00 -0.71 0.00 0.00 39.64 38.28 1ugp n ILE 177 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 176.55 176.08 1ugp s TYR 178 N -0.09 3.18 0.26 1.39 5.04 0.08 -4.78 117.35 122.43 1ugp s TYR 178 Ca 0.70 0.39 -0.03 0.00 -2.44 0.00 0.00 57.07 55.70 1ugp s TYR 178 Cb -0.73 -3.02 0.41 0.00 0.35 0.00 0.00 41.96 38.96 1ugp s TYR 178 CO 0.50 -0.54 1.86 -1.35 -1.34 0.00 0.00 175.55 174.68 1ugp h PRO 179 N 8.36 1.03 -0.02 4.97 0.11 -1.91 -0.50 132.00 144.03 1ugp h PRO 179 Ca -0.27 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 65.78 1ugp h PRO 179 Cb 1.12 -0.23 -0.00 0.00 0.11 0.00 0.00 31.00 32.00 1ugp h PRO 179 CO 0.80 0.68 0.04 -0.44 -0.21 0.00 0.00 178.00 178.88 1ugp h ASP 180 N 1.06 0.00 0.00 -2.05 3.45 -1.94 0.58 116.42 117.51 1ugp h ASP 180 Ca 0.43 0.00 -0.31 0.00 0.43 0.00 0.00 57.03 57.57 1ugp h ASP 180 Cb 0.24 0.00 -0.05 0.00 -0.56 0.00 0.00 39.33 38.96 1ugp h ASP 180 CO -0.20 0.00 -2.01 0.35 -1.57 0.00 0.00 179.24 175.81 1ugp n THR 181 N -3.39 1.27 -0.12 0.35 -2.24 -1.01 -4.51 114.28 104.64 1ugp n THR 181 Ca -0.02 -0.23 -0.05 0.00 -2.27 0.00 0.00 64.05 61.47 1ugp n THR 181 Cb 0.12 -1.87 0.03 0.00 -2.10 0.00 0.00 70.33 66.50 1ugp n THR 181 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ugp h ALA 182 N -0.81 0.43 0.00 6.98 0.00 0.60 0.14 119.26 126.60 1ugp h ALA 182 Ca -0.47 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1ugp h ALA 182 Cb 1.38 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.24 1ugp h ALA 182 CO -0.29 -0.30 0.00 0.41 0.00 0.00 0.00 179.25 179.07 1ugp n GLY 183 N -1.24 -1.14 0.93 0.00 0.00 0.18 -2.20 105.19 101.73 1ugp n GLY 183 Ca 0.02 0.09 0.08 0.00 0.00 0.00 0.00 46.02 46.21 1ugp n GLY 183 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ugp n ASN 184 N -2.13 3.81 -1.08 1.61 3.02 -0.69 -4.29 115.26 115.52 1ugp n ASN 184 Ca 0.02 -2.72 -0.11 0.00 -0.03 0.00 0.00 54.58 51.73 1ugp n ASN 184 Cb 0.18 -0.48 -0.03 0.00 -0.61 0.00 0.00 39.78 38.85 1ugp n ASN 184 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ugp n GLY 185 N -0.08 0.54 1.04 7.41 0.00 -0.93 -4.91 105.19 108.25 1ugp n GLY 185 Ca 0.20 -0.46 0.08 0.00 0.00 0.00 0.00 46.02 45.83 1ugp n GLY 185 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ugp n LEU 186 N -1.45 3.65 0.00 0.99 4.77 0.39 -5.01 117.00 120.35 1ugp n LEU 186 Ca -0.12 -2.19 0.00 0.00 -0.03 0.00 0.00 56.01 53.67 1ugp n LEU 186 Cb 0.49 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 1ugp n LEU 186 CO 0.16 0.81 0.00 0.61 -1.33 0.00 0.00 177.39 177.64 1ugp n GLY 187 N 0.82 0.24 0.16 -0.72 0.00 -1.24 -4.74 105.19 99.71 1ugp n GLY 187 Ca 0.19 -1.88 -0.11 0.00 0.00 0.00 0.00 46.02 44.22 1ugp n GLY 187 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1ugp h GLU 188 N 0.00 0.45 -7.16 1.61 5.08 -1.90 -0.49 114.58 112.17 1ugp h GLU 188 Ca 0.00 -0.12 -0.35 0.00 -1.00 0.00 0.00 59.36 57.89 1ugp h GLU 188 Cb 0.00 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1ugp h GLU 188 CO 0.00 0.56 -0.59 0.00 -1.00 0.00 0.00 179.01 177.98 1ugp n PRO 190 N -3.30 0.97 -4.05 0.00 -0.02 -1.26 -4.09 135.00 123.25 1ugp n PRO 190 Ca -0.07 0.34 -0.12 0.00 -2.02 0.00 0.00 63.50 61.63 1ugp n PRO 190 Cb 0.32 -1.64 -0.12 0.00 -0.02 0.00 0.00 33.50 32.05 1ugp n PRO 190 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1ugp s GLU 191 N -1.48 0.48 0.47 -0.52 0.41 -0.43 -4.87 118.70 112.75 1ugp s GLU 191 Ca 0.61 -0.70 -0.24 0.00 -0.41 0.00 0.00 54.97 54.23 1ugp s GLU 191 Cb -0.72 -0.23 -0.07 0.00 -1.78 0.00 0.00 34.13 31.33 1ugp s GLU 191 CO 0.59 0.04 1.37 -1.01 -0.49 0.00 0.00 175.26 175.76 1ugp s HIS 192 N -1.32 2.50 -0.03 1.61 3.76 -1.26 -1.17 115.29 119.38 1ugp s HIS 192 Ca -0.10 1.33 0.05 0.00 -0.15 0.00 0.00 55.06 56.19 1ugp s HIS 192 Cb -0.09 -3.82 -0.03 0.00 1.11 0.00 0.00 32.58 29.75 1ugp s HIS 192 CO 0.00 -2.70 -0.18 -1.17 -0.85 0.00 0.00 174.74 169.83 1ugp s LEU 193 N -2.89 2.52 0.01 0.89 2.96 0.19 -0.43 118.68 121.94 1ugp s LEU 193 Ca 0.63 -0.31 0.00 0.00 -0.22 0.00 0.00 54.13 54.24 1ugp s LEU 193 Cb -0.41 -1.49 -0.01 0.00 0.50 0.00 0.00 46.19 44.78 1ugp s LEU 193 CO 0.52 0.33 -0.02 -0.31 -1.32 0.00 0.00 176.35 175.54 1ugp s TYR 194 N -0.72 0.21 -0.15 5.38 1.51 -0.38 -0.90 117.35 122.30 1ugp s TYR 194 Ca 0.11 -0.28 -0.14 0.00 -1.01 0.00 0.00 57.07 55.75 1ugp s TYR 194 Cb -0.10 -0.14 -0.05 0.00 -0.11 0.00 0.00 41.96 41.56 1ugp s TYR 194 CO 0.01 -0.09 0.31 0.99 -1.11 0.00 0.00 175.55 175.65 1ugp s THR 195 N -0.77 5.30 -0.04 -0.71 2.01 -0.35 0.38 115.64 121.45 1ugp s THR 195 Ca -0.08 0.58 0.06 0.00 0.31 0.00 0.00 61.69 62.57 1ugp s THR 195 Cb -0.05 -3.64 -0.01 0.00 0.01 0.00 0.00 72.50 68.80 1ugp s THR 195 CO -0.00 0.39 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.38 1ugp s VAL 196 N 0.44 1.96 -0.21 3.82 1.01 -0.03 -0.08 120.40 127.31 1ugp s VAL 196 Ca 0.17 -1.03 -0.13 0.00 0.00 0.00 0.00 61.98 60.99 1ugp s VAL 196 Cb -0.13 -1.65 -0.05 0.00 0.00 0.00 0.00 36.38 34.55 1ugp s VAL 196 CO 0.04 0.55 0.26 -0.60 0.00 0.00 0.00 175.10 175.36 1ugp s ARG 197 N -0.27 4.14 -0.10 2.72 3.52 0.45 -1.12 118.95 128.30 1ugp s ARG 197 Ca 0.00 -0.05 0.04 0.00 -0.13 0.00 0.00 55.73 55.59 1ugp s ARG 197 Cb -0.12 -3.52 0.00 0.00 -1.56 0.00 0.00 34.95 29.75 1ugp s ARG 197 CO 0.02 0.06 -0.24 -0.06 -0.81 0.00 0.00 175.30 174.27 1ugp s PHE 198 N 1.04 2.54 0.63 5.12 0.40 0.12 -1.21 117.98 126.63 1ugp s PHE 198 Ca 0.13 -1.05 -0.15 0.00 -0.60 0.00 0.00 56.93 55.26 1ugp s PHE 198 Cb -0.14 -1.70 -0.02 0.00 0.51 0.00 0.00 43.02 41.68 1ugp s PHE 198 CO 0.05 -0.42 1.08 0.95 0.70 0.00 0.00 175.22 177.58 1ugp s THR 199 N 0.36 3.61 0.36 0.64 -4.23 -1.26 -0.06 115.64 115.06 1ugp s THR 199 Ca -0.19 0.73 0.06 0.00 -1.18 0.00 0.00 61.69 61.11 1ugp s THR 199 Cb -0.18 -3.27 0.18 0.00 1.34 0.00 0.00 72.50 70.57 1ugp s THR 199 CO 0.09 -0.49 1.92 0.00 -0.54 0.00 0.00 174.62 175.59 1ugp h ALA 200 N 0.14 1.46 -0.38 3.99 0.00 -1.36 -2.05 119.26 121.05 1ugp h ALA 200 Ca -0.46 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.19 1ugp h ALA 200 Cb 1.23 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 1ugp h ALA 200 CO 0.56 0.39 -0.13 1.96 0.00 0.00 0.00 179.25 182.02 1ugp h GLN 201 N 0.46 0.68 -0.46 0.00 1.08 -1.77 0.11 115.11 115.21 1ugp h GLN 201 Ca 0.10 -0.22 -0.09 0.00 -1.45 0.00 0.00 58.65 56.99 1ugp h GLN 201 Cb 0.27 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.62 1ugp h GLN 201 CO 0.00 0.79 -0.06 1.49 -0.95 0.00 0.00 178.83 180.10 1ugp h GLU 202 N 0.62 0.85 0.03 1.46 4.57 -1.69 0.22 114.58 120.64 1ugp h GLU 202 Ca 0.10 -0.30 -0.17 0.00 -1.18 0.00 0.00 59.36 57.81 1ugp h GLU 202 Cb 0.58 -0.06 0.02 0.00 -0.16 0.00 0.00 28.75 29.13 1ugp h GLU 202 CO 0.04 0.94 -0.68 -0.07 -1.18 0.00 0.00 179.01 178.05 1ugp h LEU 203 N 0.70 0.54 -1.21 1.64 3.38 -1.16 -3.39 115.31 115.81 1ugp h LEU 203 Ca 0.12 -0.80 0.00 0.00 0.09 0.00 0.00 57.88 57.29 1ugp h LEU 203 Cb 0.59 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1ugp h LEU 203 CO 0.04 1.28 -0.04 0.79 0.09 0.00 0.00 178.44 180.59 1ugp n TRP 204 N -4.17 0.00 -4.29 1.13 7.02 0.36 -5.03 117.44 112.46 1ugp n TRP 204 Ca -0.11 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.37 1ugp n TRP 204 Cb 0.72 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.61 1ugp n TRP 204 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1ugp n GLY 205 N 0.60 0.14 0.30 6.99 0.00 0.06 -3.60 105.19 109.68 1ugp n GLY 205 Ca 0.05 -0.95 0.12 0.00 0.00 0.00 0.00 46.02 45.25 1ugp n GLY 205 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ugp h PRO 206 N 0.00 0.00 0.00 1.61 0.11 -1.93 -1.99 132.00 129.80 1ugp h PRO 206 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1ugp h PRO 206 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1ugp h PRO 206 CO 0.00 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.18 1ugp n GLU 207 N -4.41 0.02 -2.13 1.05 4.71 -1.24 -4.84 120.64 113.80 1ugp n GLU 207 Ca 0.01 0.16 -0.33 0.00 -0.01 0.00 0.00 57.16 56.99 1ugp n GLU 207 Cb 0.25 -1.53 0.00 0.00 -1.01 0.00 0.00 31.44 29.16 1ugp n GLU 207 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 1ugp s GLY 208 N -3.04 2.18 0.11 0.62 0.00 -0.75 -4.97 107.32 101.47 1ugp s GLY 208 Ca 0.10 0.42 -0.31 0.00 0.00 0.00 0.00 44.72 44.92 1ugp s GLY 208 CO 0.38 0.73 1.68 -0.35 0.00 0.00 0.00 173.10 175.54 1ugp s ASP 209 N -2.68 6.54 0.23 1.64 -1.08 -1.26 -4.77 116.67 115.29 1ugp s ASP 209 Ca 0.64 2.60 0.19 0.00 -0.52 0.00 0.00 52.55 55.46 1ugp s ASP 209 Cb -0.16 -2.57 0.90 0.00 -1.46 0.00 0.00 42.92 39.62 1ugp s ASP 209 CO 0.34 -0.91 1.57 -0.81 0.52 0.00 0.00 175.17 175.88 1ugp n PRO 210 N 5.13 0.13 -2.94 4.34 -0.04 -1.26 -3.27 135.00 137.08 1ugp n PRO 210 Ca 0.16 0.51 -0.19 0.00 -0.04 0.00 0.00 63.50 63.95 1ugp n PRO 210 Cb 0.39 -1.83 -0.02 0.00 -0.04 0.00 0.00 33.50 32.01 1ugp n PRO 210 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1ugp n ASN 211 N -2.08 2.11 -3.79 3.54 5.15 -1.26 -5.00 115.26 113.92 1ugp n ASN 211 Ca 0.00 -3.15 -0.11 0.00 -0.60 0.00 0.00 54.58 50.72 1ugp n ASN 211 Cb 0.11 -0.57 -0.08 0.00 -0.53 0.00 0.00 39.78 38.70 1ugp n ASN 211 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1ugp s SER 212 N -2.92 -0.07 -0.01 1.20 0.15 -1.20 -5.09 113.70 105.76 1ugp s SER 212 Ca 0.40 -0.22 -0.12 0.00 0.70 0.00 0.00 55.95 56.70 1ugp s SER 212 Cb 0.37 0.32 0.01 0.00 -1.71 0.00 0.00 66.02 65.01 1ugp s SER 212 CO -0.08 -0.56 0.24 -0.94 1.20 0.00 0.00 173.24 173.11 1ugp s SER 213 N -1.96 -0.11 -0.11 5.45 1.04 -1.26 -1.15 113.70 115.60 1ugp s SER 213 Ca -0.06 -0.03 0.01 0.00 0.48 0.00 0.00 55.95 56.35 1ugp s SER 213 Cb -0.02 0.27 -0.02 0.00 0.10 0.00 0.00 66.02 66.36 1ugp s SER 213 CO -0.02 -0.42 -0.14 -0.69 0.98 0.00 0.00 173.24 172.94 1ugp s VAL 214 N -1.35 2.95 -0.23 5.02 1.01 0.91 -4.91 120.40 123.79 1ugp s VAL 214 Ca -0.14 -0.71 -0.10 0.00 0.00 0.00 0.00 61.98 61.03 1ugp s VAL 214 Cb -0.06 -2.21 -0.05 0.00 0.00 0.00 0.00 36.38 34.06 1ugp s VAL 214 CO 0.03 0.54 0.14 -0.31 0.00 0.00 0.00 175.10 175.50 1ugp s TYR 215 N 0.14 3.28 -0.02 5.22 1.51 -1.26 -0.70 117.35 125.51 1ugp s TYR 215 Ca -0.07 0.13 0.02 0.00 -1.01 0.00 0.00 57.07 56.14 1ugp s TYR 215 Cb -0.15 -2.24 0.00 0.00 -0.11 0.00 0.00 41.96 39.46 1ugp s TYR 215 CO 0.05 0.03 -0.08 -0.47 -1.11 0.00 0.00 175.55 173.97 1ugp s TYR 216 N 1.02 0.84 -0.04 2.71 5.04 -0.27 -4.94 117.35 121.70 1ugp s TYR 216 Ca 0.07 -0.19 -0.26 0.00 -2.44 0.00 0.00 57.07 54.24 1ugp s TYR 216 Cb -0.14 -0.60 -0.03 0.00 0.35 0.00 0.00 41.96 41.55 1ugp s TYR 216 CO 0.04 -0.08 0.82 -0.51 -1.34 0.00 0.00 175.55 174.48 1ugp s ASP 217 N 0.15 7.14 -0.09 4.32 -0.00 -1.26 -0.85 116.67 126.08 1ugp s ASP 217 Ca -0.02 1.38 0.02 0.00 -0.00 0.00 0.00 52.55 53.93 1ugp s ASP 217 Cb -0.07 -2.48 0.01 0.00 -0.00 0.00 0.00 42.92 40.38 1ugp s ASP 217 CO 0.00 -0.18 -0.16 0.00 -0.00 0.00 0.00 175.17 174.83 1ugp s TRP 219 N 0.78 3.15 0.28 0.00 0.51 -1.26 -1.24 118.94 121.16 1ugp s TRP 219 Ca -0.11 1.53 -0.04 0.00 -2.12 0.00 0.00 56.10 55.36 1ugp s TRP 219 Cb -0.16 -2.95 0.56 0.00 -0.81 0.00 0.00 33.47 30.12 1ugp s TRP 219 CO 0.02 -0.71 1.59 1.49 -0.51 0.00 0.00 176.95 178.83 1ugp h GLU 220 N 1.07 0.03 0.00 4.98 4.81 -1.05 0.30 114.58 124.73 1ugp h GLU 220 Ca -0.48 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 1ugp h GLU 220 Cb 1.21 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.58 1ugp h GLU 220 CO 0.59 0.02 0.00 -1.35 -0.73 0.00 0.00 179.01 177.54 1ugp h PRO 221 N 0.03 0.00 0.00 0.92 0.11 -1.92 -2.77 132.00 128.37 1ugp h PRO 221 Ca 0.50 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.58 1ugp h PRO 221 Cb 0.92 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.03 1ugp h PRO 221 CO -0.87 0.00 -0.16 1.88 -0.21 0.00 0.00 178.00 178.64 1ugp h TYR 222 N 0.00 0.00 -3.81 0.65 -1.99 -1.29 -3.46 116.97 107.07 1ugp h TYR 222 Ca 0.00 0.00 -0.50 0.00 2.00 0.00 0.00 58.73 60.23 1ugp h TYR 222 Cb 0.21 0.00 -0.21 0.00 2.00 0.00 0.00 36.73 38.73 1ugp h TYR 222 CO 0.00 0.16 -0.80 0.96 -0.00 0.00 0.00 178.16 178.48 1ugp s ILE 223 N -3.63 1.55 0.05 -2.88 -4.36 -1.05 0.10 121.20 110.99 1ugp s ILE 223 Ca 0.01 -1.56 0.04 0.00 -0.26 0.00 0.00 60.65 58.88 1ugp s ILE 223 Cb 0.10 -1.48 -0.02 0.00 1.25 0.00 0.00 42.46 42.30 1ugp s ILE 223 CO 0.62 -0.17 -0.12 -1.61 0.24 0.00 0.00 174.94 173.90 1ugp s GLU 224 N -2.07 0.75 0.35 0.37 0.41 -0.84 -4.95 118.70 112.71 1ugp s GLU 224 Ca 0.06 -0.80 -0.28 0.00 -0.41 0.00 0.00 54.97 53.53 1ugp s GLU 224 Cb -0.09 -0.69 -0.11 0.00 -1.78 0.00 0.00 34.13 31.47 1ugp s GLU 224 CO 0.04 0.16 1.39 -1.17 -0.49 0.00 0.00 175.26 175.19 1ugp s LEU 225 N -1.44 4.38 0.00 1.80 2.96 -1.26 -1.13 118.68 123.98 1ugp s LEU 225 Ca -0.03 2.86 0.02 0.00 -0.22 0.00 0.00 54.13 56.76 1ugp s LEU 225 Cb -0.09 -3.66 0.02 0.00 0.50 0.00 0.00 46.19 42.96 1ugp s LEU 225 CO 0.01 -0.70 0.57 0.52 -1.32 0.00 0.00 176.35 175.43