#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2uxd s ARG 3 N 0.00 3.68 -0.05 0.00 3.52 -1.26 -3.42 118.95 121.41 2uxd s ARG 3 Ca 0.00 -1.52 -0.07 0.00 -0.13 0.00 0.00 55.73 54.01 2uxd s ARG 3 Cb 0.00 -5.23 -0.04 0.00 -1.56 0.00 0.00 34.95 28.12 2uxd s ARG 3 CO 0.00 -2.06 0.32 0.82 -0.81 0.00 0.00 175.30 173.58 2uxd h ILE 4 N 6.21 0.00 -0.07 4.11 2.04 -1.92 -3.47 117.51 124.41 2uxd h ILE 4 Ca 0.23 -0.63 0.00 0.00 1.00 0.00 0.00 64.86 65.46 2uxd h ILE 4 Cb 0.99 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.07 2uxd h ILE 4 CO 1.33 0.00 0.00 0.00 0.00 0.00 0.00 178.15 179.48 2uxd n ALA 5 N -2.61 0.00 -1.00 1.87 0.00 -1.26 -4.52 120.51 112.99 2uxd n ALA 5 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2uxd n ALA 5 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.55 2uxd n ALA 5 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2uxd n GLY 6 N 5.00 -1.99 2.58 0.00 0.00 -1.26 -4.45 105.19 105.07 2uxd n GLY 6 Ca 0.00 -1.12 -0.01 0.00 0.00 0.00 0.00 46.02 44.89 2uxd n GLY 6 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2uxd n VAL 7 N 0.00 0.26 -4.33 1.61 0.24 -1.26 -4.66 118.33 110.19 2uxd n VAL 7 Ca 0.00 -0.14 -0.19 0.00 -2.04 0.00 0.00 64.34 61.98 2uxd n VAL 7 Cb 0.00 -1.55 -0.13 0.00 -1.47 0.00 0.00 33.84 30.69 2uxd n VAL 7 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2uxd s GLU 8 N 3.31 0.83 -0.12 7.34 0.41 -1.26 -5.14 118.70 124.07 2uxd s GLU 8 Ca 0.05 -0.63 -0.03 0.00 -0.41 0.00 0.00 54.97 53.95 2uxd s GLU 8 Cb 0.02 -0.80 0.05 0.00 -1.78 0.00 0.00 34.13 31.62 2uxd s GLU 8 CO -0.00 0.20 0.06 0.42 -0.49 0.00 0.00 175.26 175.45 2uxd s ILE 9 N -0.73 0.08 1.23 -1.63 1.09 -1.26 -3.40 121.20 116.58 2uxd s ILE 9 Ca 0.01 0.01 -0.17 0.00 -1.10 0.00 0.00 60.65 59.39 2uxd s ILE 9 Cb -0.07 -0.50 0.30 0.00 -1.06 0.00 0.00 42.46 41.13 2uxd s ILE 9 CO 0.01 -0.03 1.02 -2.16 -0.10 0.00 0.00 174.94 173.68 2uxd s PRO 10 N 2.08 -1.47 -0.28 2.79 0.04 -1.22 -4.99 135.00 131.96 2uxd s PRO 10 Ca 0.03 0.34 0.01 0.00 0.04 0.00 0.00 61.00 61.42 2uxd s PRO 10 Cb -0.14 -1.53 0.16 0.00 0.04 0.00 0.00 34.50 33.03 2uxd s PRO 10 CO -0.06 -3.96 0.45 0.50 0.04 0.00 0.00 177.00 173.96 2uxd s ARG 11 N -4.95 0.43 0.00 4.56 6.06 -1.26 -4.59 118.95 119.20 2uxd s ARG 11 Ca 0.69 0.44 0.00 0.00 -2.50 0.00 0.00 55.73 54.35 2uxd s ARG 11 Cb -0.17 -0.17 0.00 0.00 0.06 0.00 0.00 34.95 34.67 2uxd s ARG 11 CO 0.59 -0.85 0.00 -1.71 -2.50 0.00 0.00 175.30 170.83 2uxd n ASN 12 N 5.38 -3.77 -4.78 -2.12 2.85 -1.26 -4.96 115.26 106.59 2uxd n ASN 12 Ca -0.00 0.00 -0.22 0.00 -0.11 0.00 0.00 54.58 54.24 2uxd n ASN 12 Cb 0.50 -2.91 -0.05 0.00 1.24 0.00 0.00 39.78 38.56 2uxd n ASN 12 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 2uxd s LYS 13 N -1.51 2.49 0.69 1.20 1.02 -1.26 -4.69 119.74 117.67 2uxd s LYS 13 Ca 0.00 -1.48 -0.17 0.00 0.02 0.00 0.00 55.97 54.34 2uxd s LYS 13 Cb 0.00 -2.27 -0.08 0.00 -0.52 0.00 0.00 37.83 34.95 2uxd s LYS 13 CO 0.00 0.08 0.21 0.54 -0.92 0.00 0.00 175.35 175.26 2uxd n ARG 14 N -1.24 0.21 0.02 1.68 1.74 -1.26 -3.19 116.66 114.62 2uxd n ARG 14 Ca -0.02 0.09 -0.13 0.00 -0.77 0.00 0.00 57.85 57.02 2uxd n ARG 14 Cb 0.61 -1.51 -0.02 0.00 -1.02 0.00 0.00 32.46 30.51 2uxd n ARG 14 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2uxd h VAL 15 N -0.31 1.34 0.00 1.55 2.07 -1.40 0.74 116.25 120.25 2uxd h VAL 15 Ca -0.44 -2.11 0.00 0.00 0.82 0.00 0.00 66.70 64.96 2uxd h VAL 15 Cb 1.37 2.11 0.00 0.00 -1.52 0.00 0.00 31.29 33.25 2uxd h VAL 15 CO 0.40 0.65 0.16 -2.24 0.02 0.00 0.00 177.57 176.56 2uxd h ASP 16 N 0.38 0.00 0.00 0.57 3.04 -1.86 -0.71 116.42 117.83 2uxd h ASP 16 Ca -0.05 0.00 -0.21 0.00 -3.24 0.00 0.00 57.03 53.53 2uxd h ASP 16 Cb 1.39 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 39.65 2uxd h ASP 16 CO 0.15 0.00 -1.62 0.52 -2.04 0.00 0.00 179.24 176.24 2uxd n VAL 17 N -2.53 0.98 -0.34 4.15 0.31 -1.07 -4.61 118.33 115.22 2uxd n VAL 17 Ca -0.02 -0.13 0.26 0.00 -0.01 0.00 0.00 64.34 64.45 2uxd n VAL 17 Cb 0.20 -1.78 0.56 0.00 -0.91 0.00 0.00 33.84 31.91 2uxd n VAL 17 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2uxd h ALA 18 N -0.57 2.40 0.00 3.52 0.00 0.84 0.15 119.26 125.60 2uxd h ALA 18 Ca -0.32 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 2uxd h ALA 18 Cb 1.20 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 2uxd h ALA 18 CO -0.20 -0.84 -0.17 -0.07 0.00 0.00 0.00 179.25 177.98 2uxd h LEU 19 N 0.30 0.00 -2.88 0.00 3.38 -1.36 -2.83 115.31 111.92 2uxd h LEU 19 Ca 0.63 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.60 2uxd h LEU 19 Cb 1.75 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.50 2uxd h LEU 19 CO -0.29 0.17 -0.00 0.74 0.09 0.00 0.00 178.44 179.15 2uxd h THR 20 N 0.00 0.05 0.00 0.22 2.02 -0.94 -1.47 112.91 112.79 2uxd h THR 20 Ca -0.00 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.15 2uxd h THR 20 Cb 0.55 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.98 2uxd h THR 20 CO 0.02 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.69 2uxd n TYR 21 N -3.15 0.12 -2.84 3.16 4.02 -1.07 -4.65 117.16 112.75 2uxd n TYR 21 Ca -0.03 0.05 -0.34 0.00 -0.01 0.00 0.00 57.90 57.57 2uxd n TYR 21 Cb 0.08 -0.58 -0.07 0.00 -0.02 0.00 0.00 39.34 38.75 2uxd n TYR 21 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 2uxd s ILE 22 N -3.06 4.37 0.00 -0.72 1.01 -0.55 -4.96 121.20 117.29 2uxd s ILE 22 Ca 0.05 1.54 0.00 0.00 0.00 0.00 0.00 60.65 62.24 2uxd s ILE 22 Cb 0.08 -3.73 0.00 0.00 0.01 0.00 0.00 42.46 38.81 2uxd s ILE 22 CO 0.23 -0.15 0.00 0.00 0.00 0.00 0.00 174.94 175.01 2uxd n TYR 23 N -0.21 0.00 0.26 3.97 9.36 -1.26 -3.07 117.16 126.21 2uxd n TYR 23 Ca 0.05 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.27 2uxd n TYR 23 Cb 0.53 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.24 2uxd n TYR 23 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2uxd n GLY 24 N 0.00 -0.40 3.78 2.98 0.00 -1.26 -4.59 105.19 105.70 2uxd n GLY 24 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 2uxd n GLY 24 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2uxd s ILE 25 N -3.48 4.81 0.32 -0.61 1.01 -1.18 -4.99 121.20 117.09 2uxd s ILE 25 Ca 0.00 1.26 0.04 0.00 0.00 0.00 0.00 60.65 61.95 2uxd s ILE 25 Cb 0.00 -3.93 -0.03 0.00 0.01 0.00 0.00 42.46 38.51 2uxd s ILE 25 CO 0.00 0.48 0.19 -0.83 0.00 0.00 0.00 174.94 174.78 2uxd s GLY 26 N -0.62 2.18 0.40 6.18 0.00 -1.26 -4.58 107.32 109.62 2uxd s GLY 26 Ca 0.30 -1.78 0.24 0.00 0.00 0.00 0.00 44.72 43.48 2uxd s GLY 26 CO 0.18 -1.56 1.65 0.50 0.00 0.00 0.00 173.10 173.87 2uxd h LYS 27 N 2.16 0.18 0.51 2.90 1.79 -1.95 -0.39 116.57 121.76 2uxd h LYS 27 Ca -0.31 -0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.12 2uxd h LYS 27 Cb 1.25 -0.04 0.01 0.00 -1.58 0.00 0.00 32.23 31.86 2uxd h LYS 27 CO 0.47 0.12 -0.25 0.00 -1.08 0.00 0.00 179.45 178.71 2uxd h ALA 28 N 1.70 -1.06 0.00 3.86 0.00 -1.97 -2.70 119.26 119.09 2uxd h ALA 28 Ca 0.77 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.53 2uxd h ALA 28 Cb 2.17 0.27 0.00 0.00 0.00 0.00 0.00 17.79 20.22 2uxd h ALA 28 CO -0.47 -1.01 0.00 0.54 0.00 0.00 0.00 179.25 178.31 2uxd n ARG 29 N -4.05 0.06 0.00 0.00 1.74 -0.82 -2.65 116.66 110.94 2uxd n ARG 29 Ca -0.09 0.27 0.00 0.00 -0.77 0.00 0.00 57.85 57.27 2uxd n ARG 29 Cb 0.27 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.21 2uxd n ARG 29 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2uxd n ALA 30 N -1.33 0.00 0.51 7.54 0.00 -0.22 -2.32 120.51 124.69 2uxd n ALA 30 Ca 0.02 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.51 2uxd n ALA 30 Cb 0.05 0.00 0.26 0.00 0.00 0.00 0.00 19.45 19.76 2uxd n ALA 30 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2uxd n LYS 31 N -0.32 0.20 -0.50 0.00 4.81 -1.24 -1.22 118.16 119.89 2uxd n LYS 31 Ca 0.00 0.13 0.07 0.00 -0.87 0.00 0.00 58.31 57.64 2uxd n LYS 31 Cb 0.00 -1.50 0.27 0.00 0.02 0.00 0.00 35.03 33.82 2uxd n LYS 31 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 2uxd n GLU 32 N -1.19 3.21 0.00 1.64 2.13 -1.09 -2.79 120.64 122.55 2uxd n GLU 32 Ca 0.06 -2.15 0.00 0.00 0.66 0.00 0.00 57.16 55.72 2uxd n GLU 32 Cb 0.06 -1.80 0.00 0.00 0.27 0.00 0.00 31.44 29.97 2uxd n GLU 32 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2uxd n ALA 33 N 0.71 0.80 1.38 4.31 0.00 -0.36 -4.58 120.51 122.78 2uxd n ALA 33 Ca 0.19 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.77 2uxd n ALA 33 Cb 0.75 0.01 0.56 0.00 0.00 0.00 0.00 19.45 20.77 2uxd n ALA 33 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2uxd n LEU 34 N -0.45 0.63 -0.08 0.00 4.77 -1.00 -2.12 117.00 118.76 2uxd n LEU 34 Ca 0.00 -0.07 -0.07 0.00 -0.03 0.00 0.00 56.01 55.84 2uxd n LEU 34 Cb 0.02 -0.16 -0.03 0.00 -2.33 0.00 0.00 43.42 40.92 2uxd n LEU 34 CO 0.00 0.12 -0.37 -0.08 -1.33 0.00 0.00 177.39 175.73 2uxd h GLU 35 N 0.77 0.00 -0.44 3.23 4.81 -1.78 -2.26 114.58 118.91 2uxd h GLU 35 Ca 0.00 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.29 2uxd h GLU 35 Cb 0.39 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.72 2uxd h GLU 35 CO 0.00 0.16 0.15 0.87 -0.73 0.00 0.00 179.01 179.45 2uxd h LYS 36 N -1.00 0.30 0.75 1.92 1.79 -1.81 -2.71 116.57 115.82 2uxd h LYS 36 Ca -0.06 -0.02 -0.04 0.00 -2.18 0.00 0.00 60.65 58.36 2uxd h LYS 36 Cb 0.62 -0.07 0.01 0.00 -1.58 0.00 0.00 32.23 31.21 2uxd h LYS 36 CO -0.03 0.20 -0.36 1.15 -1.08 0.00 0.00 179.45 179.32 2uxd h THR 37 N 0.31 0.20 0.00 -0.16 2.02 -1.61 -3.48 112.91 110.18 2uxd h THR 37 Ca 0.21 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.27 2uxd h THR 37 Cb 0.21 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 66.84 2uxd h THR 37 CO -0.22 0.01 0.00 0.61 0.37 0.00 0.00 175.52 176.29 2uxd n GLY 38 N -1.25 1.11 3.76 2.16 0.00 -0.87 -5.07 105.19 105.03 2uxd n GLY 38 Ca -0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 2uxd n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2uxd s ILE 39 N -2.00 2.98 -0.02 -0.61 1.01 -1.09 -4.91 121.20 116.55 2uxd s ILE 39 Ca 0.00 0.92 -0.34 0.00 0.00 0.00 0.00 60.65 61.23 2uxd s ILE 39 Cb 0.00 -3.59 -0.12 0.00 0.01 0.00 0.00 42.46 38.76 2uxd s ILE 39 CO 0.00 0.19 1.82 -3.20 0.00 0.00 0.00 174.94 173.76 2uxd n ASN 40 N 1.43 3.43 0.10 3.58 4.05 -1.26 -4.70 115.26 121.90 2uxd n ASN 40 Ca 0.02 0.99 -0.12 0.00 0.45 0.00 0.00 54.58 55.92 2uxd n ASN 40 Cb 0.42 -1.40 -0.05 0.00 1.23 0.00 0.00 39.78 39.98 2uxd n ASN 40 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 177.26 173.56 2uxd h PRO 41 N 8.58 -0.44 -4.01 1.20 0.11 -1.91 -3.32 132.00 132.21 2uxd h PRO 41 Ca -0.48 0.03 -0.67 0.00 0.11 0.00 0.00 66.00 65.00 2uxd h PRO 41 Cb 1.26 0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.47 2uxd h PRO 41 CO 0.94 -0.29 2.92 0.00 -0.21 0.00 0.00 178.00 181.35 2uxd n ALA 42 N -2.62 5.00 -3.38 -0.75 0.00 -1.26 -3.10 120.51 114.40 2uxd n ALA 42 Ca -0.06 -3.54 -0.13 0.00 0.00 0.00 0.00 53.44 49.70 2uxd n ALA 42 Cb 0.29 -3.52 -0.14 0.00 0.00 0.00 0.00 19.45 16.08 2uxd n ALA 42 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2uxd s THR 43 N 3.67 -0.03 0.33 0.00 -4.23 -1.25 -4.97 115.64 109.16 2uxd s THR 43 Ca 0.52 0.10 -0.28 0.00 -1.18 0.00 0.00 61.69 60.85 2uxd s THR 43 Cb 0.14 -0.17 -0.12 0.00 1.34 0.00 0.00 72.50 73.69 2uxd s THR 43 CO -0.02 0.04 1.33 -1.14 -0.54 0.00 0.00 174.62 174.30 2uxd n ARG 44 N 3.65 2.18 0.05 3.99 3.00 -1.26 -2.26 116.66 126.02 2uxd n ARG 44 Ca -0.20 0.77 -0.03 0.00 -0.00 0.00 0.00 57.85 58.38 2uxd n ARG 44 Cb 0.55 -2.38 0.20 0.00 0.00 0.00 0.00 32.46 30.83 2uxd n ARG 44 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2uxd h VAL 45 N 2.68 1.29 -0.46 5.15 2.07 -1.82 -1.51 116.25 123.64 2uxd h VAL 45 Ca -0.46 -1.43 0.13 0.00 0.82 0.00 0.00 66.70 65.76 2uxd h VAL 45 Cb 1.28 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 32.57 2uxd h VAL 45 CO 0.65 0.44 0.52 0.07 0.02 0.00 0.00 177.57 179.27 2uxd h LYS 46 N 0.32 0.00 -0.51 1.57 2.10 -1.89 1.03 116.57 119.19 2uxd h LYS 46 Ca 0.04 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.69 2uxd h LYS 46 Cb 0.78 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.11 2uxd h LYS 46 CO 0.06 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.26 2uxd n ASP 47 N -3.63 4.13 -4.76 7.07 8.00 -0.58 -4.98 116.55 121.79 2uxd n ASP 47 Ca 0.09 -2.41 -0.40 0.00 0.71 0.00 0.00 54.79 52.78 2uxd n ASP 47 Cb 0.71 -0.48 -0.04 0.00 -0.02 0.00 0.00 41.12 41.29 2uxd n ASP 47 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2uxd s LEU 48 N -1.76 4.44 0.20 0.64 1.43 0.36 -4.95 118.68 119.03 2uxd s LEU 48 Ca 0.43 2.30 -0.30 0.00 -1.03 0.00 0.00 54.13 55.53 2uxd s LEU 48 Cb 0.28 -3.76 -0.08 0.00 0.03 0.00 0.00 46.19 42.66 2uxd s LEU 48 CO 0.20 -0.31 1.01 -0.89 0.23 0.00 0.00 176.35 176.59 2uxd s THR 49 N -1.26 4.04 0.55 5.49 2.01 -1.26 -4.86 115.64 120.34 2uxd s THR 49 Ca 0.48 1.88 0.25 0.00 0.31 0.00 0.00 61.69 64.61 2uxd s THR 49 Cb -0.31 -4.20 0.36 0.00 0.01 0.00 0.00 72.50 68.36 2uxd s THR 49 CO 0.40 0.38 2.05 -0.08 -0.69 0.00 0.00 174.62 176.69 2uxd h GLU 50 N 4.68 0.00 -0.04 4.92 4.57 -1.97 0.96 114.58 127.69 2uxd h GLU 50 Ca -0.45 0.00 -0.23 0.00 -1.18 0.00 0.00 59.36 57.50 2uxd h GLU 50 Cb 1.21 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.80 2uxd h GLU 50 CO 0.70 0.00 -0.91 0.00 -1.18 0.00 0.00 179.01 177.62 2uxd h ALA 51 N 1.78 0.33 0.05 2.92 0.00 -1.99 -2.57 119.26 119.78 2uxd h ALA 51 Ca 0.15 -0.67 -0.20 0.00 0.00 0.00 0.00 54.91 54.19 2uxd h ALA 51 Cb 0.67 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.48 2uxd h ALA 51 CO -0.00 0.75 -0.82 0.93 0.00 0.00 0.00 179.25 180.10 2uxd h GLU 52 N 0.34 0.46 -0.44 0.00 5.08 -1.25 -2.90 114.58 115.87 2uxd h GLU 52 Ca -0.08 -0.57 0.05 0.00 -1.00 0.00 0.00 59.36 57.76 2uxd h GLU 52 Cb 1.53 0.18 -0.02 0.00 0.50 0.00 0.00 28.75 30.94 2uxd h GLU 52 CO 0.17 1.21 0.30 0.28 -1.00 0.00 0.00 179.01 179.97 2uxd h VAL 53 N -0.03 0.98 -0.07 3.13 2.07 0.76 0.18 116.25 123.27 2uxd h VAL 53 Ca -0.12 -0.13 -0.14 0.00 0.82 0.00 0.00 66.70 67.13 2uxd h VAL 53 Cb 1.55 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.86 2uxd h VAL 53 CO 0.16 0.07 -0.57 0.58 0.02 0.00 0.00 177.57 177.83 2uxd h VAL 54 N 0.39 1.38 -0.07 2.57 2.07 -1.42 -2.88 116.25 118.29 2uxd h VAL 54 Ca 0.19 -1.91 -0.02 0.00 0.82 0.00 0.00 66.70 65.78 2uxd h VAL 54 Cb 0.26 1.96 -0.00 0.00 -1.52 0.00 0.00 31.29 31.99 2uxd h VAL 54 CO -0.05 0.56 -0.02 0.03 0.02 0.00 0.00 177.57 178.11 2uxd h ARG 55 N 0.17 0.14 0.01 1.57 3.08 -0.48 -1.33 114.38 117.54 2uxd h ARG 55 Ca -0.00 -0.06 0.03 0.00 0.07 0.00 0.00 59.98 60.02 2uxd h ARG 55 Cb 1.06 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 31.06 2uxd h ARG 55 CO 0.09 0.49 -0.26 -0.07 -1.07 0.00 0.00 179.97 179.15 2uxd h LEU 56 N -0.22 -0.76 -0.85 3.04 3.38 -1.32 0.11 115.31 118.68 2uxd h LEU 56 Ca 0.02 0.10 0.10 0.00 0.09 0.00 0.00 57.88 58.19 2uxd h LEU 56 Cb 0.45 0.31 -0.12 0.00 0.09 0.00 0.00 40.66 41.38 2uxd h LEU 56 CO 0.01 -0.33 -0.52 -0.09 0.09 0.00 0.00 178.44 177.60 2uxd h ARG 57 N -0.40 -0.09 0.21 1.13 2.43 -1.43 0.14 114.38 116.37 2uxd h ARG 57 Ca 0.06 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.25 2uxd h ARG 57 Cb 0.48 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.02 2uxd h ARG 57 CO -0.22 -0.06 -0.38 0.93 -1.51 0.00 0.00 179.97 178.73 2uxd h GLU 58 N -0.09 -0.64 0.00 0.20 4.39 -0.22 -2.76 114.58 115.45 2uxd h GLU 58 Ca 0.19 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.93 2uxd h GLU 58 Cb 0.50 0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.30 2uxd h GLU 58 CO -0.86 -0.43 0.00 0.98 -1.16 0.00 0.00 179.01 177.54 2uxd n TYR 59 N -5.46 0.00 -0.26 4.33 9.36 0.27 -1.84 117.16 123.56 2uxd n TYR 59 Ca -0.08 0.00 0.25 0.00 3.32 0.00 0.00 57.90 61.39 2uxd n TYR 59 Cb 0.37 -0.23 0.44 0.00 -0.63 0.00 0.00 39.34 39.28 2uxd n TYR 59 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 2uxd n VAL 60 N -1.20 -0.26 0.11 2.97 0.31 0.38 -0.06 118.33 120.58 2uxd n VAL 60 Ca 0.00 1.40 -0.23 0.00 -0.01 0.00 0.00 64.34 65.49 2uxd n VAL 60 Cb 0.00 -2.28 -0.15 0.00 -0.91 0.00 0.00 33.84 30.51 2uxd n VAL 60 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2uxd h GLU 61 N 0.00 0.51 -0.01 5.55 5.08 -1.52 -3.19 114.58 121.00 2uxd h GLU 61 Ca 0.61 -0.81 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 2uxd h GLU 61 Cb 1.74 0.29 0.00 0.00 0.50 0.00 0.00 28.75 31.28 2uxd h GLU 61 CO -0.48 1.38 -0.03 0.09 -1.00 0.00 0.00 179.01 178.97 2uxd n ASN 62 N -3.84 0.99 -0.00 1.42 5.03 0.92 -4.00 115.26 115.77 2uxd n ASN 62 Ca -0.15 -1.23 0.03 0.00 0.87 0.00 0.00 54.58 54.10 2uxd n ASN 62 Cb 1.01 0.00 -0.04 0.00 -1.02 0.00 0.00 39.78 39.73 2uxd n ASN 62 CO 0.00 0.00 0.00 1.07 -1.83 0.00 0.00 177.26 176.50 2uxd n THR 63 N -0.30 0.00 -3.86 3.41 5.66 -0.09 -5.03 114.28 114.07 2uxd n THR 63 Ca 0.19 -0.26 -0.12 0.00 -3.05 0.00 0.00 64.05 60.81 2uxd n THR 63 Cb 0.29 0.70 -0.14 0.00 -1.55 0.00 0.00 70.33 69.63 2uxd n THR 63 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 175.07 172.28 2uxd s TRP 64 N -1.96 -0.04 -1.39 1.09 0.51 -1.20 -5.06 118.94 110.88 2uxd s TRP 64 Ca 0.00 0.09 -0.12 0.00 -2.12 0.00 0.00 56.10 53.96 2uxd s TRP 64 Cb 0.04 0.01 0.09 0.00 -0.81 0.00 0.00 33.47 32.80 2uxd s TRP 64 CO 0.25 -0.02 2.13 1.17 -0.51 0.00 0.00 176.95 179.97 2uxd n LYS 65 N 3.04 3.24 -2.94 4.98 4.81 -1.26 -4.74 118.16 125.29 2uxd n LYS 65 Ca -0.12 -2.97 -0.19 0.00 -0.87 0.00 0.00 58.31 54.16 2uxd n LYS 65 Cb 0.60 -3.11 0.04 0.00 0.02 0.00 0.00 35.03 32.58 2uxd n LYS 65 CO 0.00 0.00 0.00 -0.48 1.17 0.00 0.00 177.40 178.09 2uxd s LEU 66 N 1.06 3.34 0.00 3.14 0.05 -1.26 -3.98 118.68 121.03 2uxd s LEU 66 Ca 0.45 -0.53 0.00 0.00 0.05 0.00 0.00 54.13 54.10 2uxd s LEU 66 Cb 0.13 -2.23 0.00 0.00 -2.05 0.00 0.00 46.19 42.03 2uxd s LEU 66 CO -0.05 -1.12 0.00 -0.62 -0.55 0.00 0.00 176.35 174.00 2uxd n GLU 67 N -2.14 0.00 0.00 1.48 -0.58 -1.26 -4.03 120.64 114.11 2uxd n GLU 67 Ca 0.12 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.86 2uxd n GLU 67 Cb 0.60 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.47 2uxd n GLU 67 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2uxd n GLY 68 N 0.00 -2.28 0.49 0.62 0.00 -1.26 0.19 105.19 102.95 2uxd n GLY 68 Ca 0.00 0.48 0.28 0.00 0.00 0.00 0.00 46.02 46.78 2uxd n GLY 68 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2uxd h GLU 69 N 0.00 0.00 0.11 1.61 4.11 -1.91 -0.48 114.58 118.01 2uxd h GLU 69 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 2uxd h GLU 69 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2uxd h GLU 69 CO 0.00 0.00 -0.05 1.25 0.07 0.00 0.00 179.01 180.28 2uxd h LEU 70 N 0.00 -0.12 0.46 3.06 6.46 -0.38 -1.88 115.31 122.90 2uxd h LEU 70 Ca 0.42 -0.45 -0.01 0.00 -0.12 0.00 0.00 57.88 57.72 2uxd h LEU 70 Cb 2.32 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 42.26 2uxd h LEU 70 CO -0.00 0.47 -0.45 0.03 -0.62 0.00 0.00 178.44 177.86 2uxd h ARG 71 N -0.80 -0.89 -0.08 1.25 3.08 -0.30 0.64 114.38 117.28 2uxd h ARG 71 Ca -0.01 0.06 0.02 0.00 0.07 0.00 0.00 59.98 60.12 2uxd h ARG 71 Cb 0.57 0.20 -0.00 0.00 0.08 0.00 0.00 29.97 30.82 2uxd h ARG 71 CO 0.02 -0.59 0.17 0.00 -1.07 0.00 0.00 179.97 178.50 2uxd h ALA 72 N -0.66 1.45 0.15 0.04 0.00 -1.58 1.63 119.26 120.28 2uxd h ALA 72 Ca -0.05 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2uxd h ALA 72 Cb 0.81 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2uxd h ALA 72 CO -0.06 -0.21 -0.07 1.49 0.00 0.00 0.00 179.25 180.40 2uxd h GLU 73 N 0.00 -0.19 -0.39 0.00 4.81 -0.28 -2.30 114.58 116.23 2uxd h GLU 73 Ca 0.04 0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.17 2uxd h GLU 73 Cb 0.38 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 2uxd h GLU 73 CO -0.00 0.21 -0.19 0.28 -0.73 0.00 0.00 179.01 178.57 2uxd h VAL 74 N -0.94 1.28 -0.30 0.32 2.07 0.09 0.32 116.25 119.10 2uxd h VAL 74 Ca -0.02 -1.33 0.06 0.00 0.82 0.00 0.00 66.70 66.23 2uxd h VAL 74 Cb 0.48 1.30 -0.06 0.00 -1.52 0.00 0.00 31.29 31.49 2uxd h VAL 74 CO 0.03 0.44 -0.11 0.00 0.02 0.00 0.00 177.57 177.95 2uxd h ALA 75 N 0.81 0.14 0.00 1.67 0.00 0.22 0.76 119.26 122.86 2uxd h ALA 75 Ca 0.09 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2uxd h ALA 75 Cb 0.75 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2uxd h ALA 75 CO 0.06 -0.50 -0.06 0.00 0.00 0.00 0.00 179.25 178.74 2uxd n ALA 76 N -2.63 2.38 0.28 0.00 0.00 -0.86 -3.01 120.51 116.67 2uxd n ALA 76 Ca 0.00 -0.07 0.16 0.00 0.00 0.00 0.00 53.44 53.54 2uxd n ALA 76 Cb 0.21 -1.44 0.62 0.00 0.00 0.00 0.00 19.45 18.84 2uxd n ALA 76 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2uxd h ASN 77 N 0.00 0.00 0.01 0.00 -0.73 0.20 -2.42 115.58 112.65 2uxd h ASN 77 Ca 0.00 0.00 -0.36 0.00 1.87 0.00 0.00 56.30 57.81 2uxd h ASN 77 Cb 0.68 0.00 -0.05 0.00 0.27 0.00 0.00 38.32 39.21 2uxd h ASN 77 CO 0.00 0.00 -2.02 -0.38 -0.37 0.00 0.00 177.43 174.66 2uxd n ILE 78 N -3.02 1.55 0.30 2.57 5.41 -0.75 -3.90 119.36 121.52 2uxd n ILE 78 Ca 0.01 -0.28 0.10 0.00 1.00 0.00 0.00 62.75 63.58 2uxd n ILE 78 Cb 0.32 -1.90 0.56 0.00 -0.71 0.00 0.00 39.64 37.92 2uxd n ILE 78 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 2uxd h LYS 79 N -0.84 0.00 0.01 0.38 3.11 -1.51 0.42 116.57 118.13 2uxd h LYS 79 Ca -0.54 0.00 -0.00 0.00 -2.81 0.00 0.00 60.65 57.30 2uxd h LYS 79 Cb 1.55 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.78 2uxd h LYS 79 CO -0.28 0.00 -0.01 -0.09 -2.81 0.00 0.00 179.45 176.26 2uxd h ARG 80 N 0.00 -0.02 -0.73 1.90 2.43 -1.55 -2.96 114.38 113.45 2uxd h ARG 80 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2uxd h ARG 80 Cb 0.94 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.49 2uxd h ARG 80 CO 0.00 -0.01 0.00 1.47 -1.51 0.00 0.00 179.97 179.92 2uxd n LEU 81 N -2.05 0.79 -0.07 3.80 -0.00 0.07 -2.19 117.00 117.35 2uxd n LEU 81 Ca -0.00 -0.40 -0.05 0.00 -0.00 0.00 0.00 56.01 55.56 2uxd n LEU 81 Cb 0.01 -0.34 -0.15 0.00 -0.00 0.00 0.00 43.42 42.94 2uxd n LEU 81 CO 0.00 0.18 -0.97 0.23 -0.00 0.00 0.00 177.39 176.84 2uxd n MET 82 N 0.21 0.67 0.00 1.47 2.81 -0.76 -4.25 117.12 117.26 2uxd n MET 82 Ca 0.00 0.00 0.07 0.00 -1.81 0.00 0.00 57.70 55.96 2uxd n MET 82 Cb 0.18 -1.57 0.01 0.00 -0.71 0.00 0.00 33.22 31.14 2uxd n MET 82 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2uxd n ASP 83 N -2.70 1.63 -1.02 7.83 8.00 -0.93 -4.40 116.55 124.96 2uxd n ASP 83 Ca -0.25 -1.32 0.06 0.00 0.71 0.00 0.00 54.79 54.00 2uxd n ASP 83 Cb 1.02 0.36 0.22 0.00 -0.02 0.00 0.00 41.12 42.70 2uxd n ASP 83 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 2uxd n ILE 84 N 0.05 0.99 -3.56 0.53 -5.35 -1.22 -4.96 119.36 105.84 2uxd n ILE 84 Ca 0.06 -0.69 -0.20 0.00 -0.27 0.00 0.00 62.75 61.66 2uxd n ILE 84 Cb 0.30 0.06 0.01 0.00 -1.74 0.00 0.00 39.64 38.27 2uxd n ILE 84 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2uxd n GLY 85 N 0.91 -1.20 3.27 3.28 0.00 -1.26 -5.00 105.19 105.18 2uxd n GLY 85 Ca 0.16 0.52 -0.25 0.00 0.00 0.00 0.00 46.02 46.44 2uxd n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2uxd h TYR 87 N 4.56 -0.80 0.00 0.00 3.20 -1.94 0.17 116.97 122.16 2uxd h TYR 87 Ca -0.44 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.44 2uxd h TYR 87 Cb 1.17 0.32 0.00 0.00 1.54 0.00 0.00 36.73 39.76 2uxd h TYR 87 CO 0.54 -0.35 0.00 -2.13 -1.64 0.00 0.00 178.16 174.58 2uxd n ARG 88 N -4.07 0.00 -0.01 1.82 0.63 -1.26 0.11 116.66 113.88 2uxd n ARG 88 Ca -0.06 0.00 0.03 0.00 -0.92 0.00 0.00 57.85 56.90 2uxd n ARG 88 Cb 0.24 -1.39 -0.07 0.00 0.45 0.00 0.00 32.46 31.69 2uxd n ARG 88 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2uxd n GLY 89 N -0.77 -0.40 0.24 5.14 0.00 0.42 -4.50 105.19 105.32 2uxd n GLY 89 Ca 0.00 -0.20 -0.11 0.00 0.00 0.00 0.00 46.02 45.71 2uxd n GLY 89 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2uxd h LEU 90 N 0.00 0.82 -0.86 0.99 3.38 0.26 -3.03 115.31 116.87 2uxd h LEU 90 Ca -0.03 -0.39 0.15 0.00 0.09 0.00 0.00 57.88 57.69 2uxd h LEU 90 Cb 0.55 -0.23 -0.09 0.00 0.09 0.00 0.00 40.66 40.97 2uxd h LEU 90 CO 0.00 1.14 0.46 0.03 0.09 0.00 0.00 178.44 180.16 2uxd h ARG 91 N 0.61 0.63 0.00 1.13 2.47 -1.77 0.88 114.38 118.33 2uxd h ARG 91 Ca 0.04 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2uxd h ARG 91 Cb 1.01 -0.14 0.00 0.00 -1.65 0.00 0.00 29.97 29.18 2uxd h ARG 91 CO 0.10 0.42 0.00 0.45 0.56 0.00 0.00 179.97 181.50 2uxd h HIS 92 N 0.65 0.00 0.05 3.04 3.86 -1.75 0.50 115.15 121.49 2uxd h HIS 92 Ca 0.47 0.00 -0.32 0.00 -1.16 0.00 0.00 60.37 59.36 2uxd h HIS 92 Cb 0.65 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.08 2uxd h HIS 92 CO -0.08 0.00 -1.84 0.54 0.86 0.00 0.00 177.93 177.41 2uxd n ARG 93 N -2.53 0.68 0.07 2.45 1.74 0.28 -4.28 116.66 115.07 2uxd n ARG 93 Ca 0.01 0.28 0.09 0.00 -0.77 0.00 0.00 57.85 57.45 2uxd n ARG 93 Cb 0.21 -1.75 -0.04 0.00 -1.02 0.00 0.00 32.46 29.86 2uxd n ARG 93 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2uxd n ARG 94 N -3.20 0.62 -1.32 5.56 1.74 0.32 -4.98 116.66 115.39 2uxd n ARG 94 Ca -0.23 0.10 0.00 0.00 -0.77 0.00 0.00 57.85 56.95 2uxd n ARG 94 Cb 1.05 -1.78 0.00 0.00 -1.02 0.00 0.00 32.46 30.71 2uxd n ARG 94 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2uxd n GLY 95 N 1.24 0.99 3.62 -0.13 0.00 0.16 -5.04 105.19 106.03 2uxd n GLY 95 Ca -0.03 -0.52 -0.26 0.00 0.00 0.00 0.00 46.02 45.21 2uxd n GLY 95 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2uxd s LEU 96 N -0.16 3.16 0.99 0.99 1.43 -0.56 -3.30 118.68 121.22 2uxd s LEU 96 Ca 0.00 -0.52 -0.14 0.00 -1.03 0.00 0.00 54.13 52.45 2uxd s LEU 96 Cb 0.00 -1.79 0.07 0.00 0.03 0.00 0.00 46.19 44.50 2uxd s LEU 96 CO 0.00 0.08 0.43 -0.81 0.23 0.00 0.00 176.35 176.28 2uxd n PRO 97 N -0.22 -0.69 0.00 1.29 -0.04 -1.26 -4.46 135.00 129.62 2uxd n PRO 97 Ca -0.09 -0.16 0.00 0.00 -0.04 0.00 0.00 63.50 63.20 2uxd n PRO 97 Cb 0.56 -1.89 0.00 0.00 -0.04 0.00 0.00 33.50 32.13 2uxd n PRO 97 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2uxd n VAL 98 N -3.91 0.00 -1.66 0.52 0.31 -1.26 -4.82 118.33 107.51 2uxd n VAL 98 Ca 0.06 -0.33 -0.28 0.00 -0.01 0.00 0.00 64.34 63.77 2uxd n VAL 98 Cb 0.55 1.16 0.06 0.00 -0.91 0.00 0.00 33.84 34.70 2uxd n VAL 98 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2uxd n ARG 99 N -0.35 3.08 -3.15 5.55 1.74 -1.26 -4.95 116.66 117.32 2uxd n ARG 99 Ca 0.00 -3.69 -0.14 0.00 -0.77 0.00 0.00 57.85 53.25 2uxd n ARG 99 Cb 0.04 -2.26 0.07 0.00 -1.02 0.00 0.00 32.46 29.29 2uxd n ARG 99 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2uxd n GLY 100 N -0.83 -0.55 3.66 -0.13 0.00 -1.26 -5.05 105.19 101.03 2uxd n GLY 100 Ca 0.53 0.23 -0.26 0.00 0.00 0.00 0.00 46.02 46.51 2uxd n GLY 100 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2uxd s GLN 101 N -4.76 2.38 0.34 1.61 1.11 -1.26 -5.09 119.66 113.99 2uxd s GLN 101 Ca 0.18 -1.12 -0.28 0.00 0.01 0.00 0.00 55.36 54.14 2uxd s GLN 101 Cb -0.02 -2.34 -0.10 0.00 -1.01 0.00 0.00 33.01 29.53 2uxd s GLN 101 CO 0.64 0.45 1.30 -0.98 0.01 0.00 0.00 175.29 176.71 2uxd s ARG 102 N -2.95 4.33 -0.06 2.91 1.70 -1.26 -4.93 118.95 118.68 2uxd s ARG 102 Ca 0.27 2.19 0.11 0.00 -0.47 0.00 0.00 55.73 57.83 2uxd s ARG 102 Cb -0.09 -3.04 0.27 0.00 -0.57 0.00 0.00 34.95 31.51 2uxd s ARG 102 CO 0.18 -0.20 1.20 2.41 -1.08 0.00 0.00 175.30 177.82 2uxd n THR 103 N 0.75 1.45 0.07 4.99 -1.04 -1.26 -4.44 114.28 114.79 2uxd n THR 103 Ca 0.00 -1.42 -0.18 0.00 -2.04 0.00 0.00 64.05 60.41 2uxd n THR 103 Cb 0.42 0.20 -0.14 0.00 -1.82 0.00 0.00 70.33 68.99 2uxd n THR 103 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 2uxd h ARG 104 N 1.05 0.28 0.00 -2.82 2.43 -2.00 -3.46 114.38 109.86 2uxd h ARG 104 Ca 0.00 -0.47 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 2uxd h ARG 104 Cb 0.87 0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.60 2uxd h ARG 104 CO 0.05 1.15 0.00 2.41 -1.51 0.00 0.00 179.97 182.07 2uxd n THR 105 N -3.48 0.00 0.00 0.20 -1.04 -1.26 -5.08 114.28 103.62 2uxd n THR 105 Ca -0.16 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.85 2uxd n THR 105 Cb 1.05 -0.17 0.00 0.00 -1.82 0.00 0.00 70.33 69.38 2uxd n THR 105 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2uxd n ASN 106 N 0.00 0.00 -3.71 8.00 3.02 -1.26 -4.79 115.26 116.52 2uxd n ASN 106 Ca 0.00 0.00 -0.24 0.00 -0.03 0.00 0.00 54.58 54.31 2uxd n ASN 106 Cb 0.00 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.22 2uxd n ASN 106 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2uxd n ALA 107 N -3.00 -1.71 -0.07 5.41 0.00 -1.26 -4.91 120.51 114.97 2uxd n ALA 107 Ca 0.00 0.03 -0.10 0.00 0.00 0.00 0.00 53.44 53.38 2uxd n ALA 107 Cb 0.00 -3.25 -0.07 0.00 0.00 0.00 0.00 19.45 16.13 2uxd n ALA 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2uxd h ARG 108 N -2.06 0.00 -0.98 0.00 2.47 -1.90 -3.23 114.38 108.69 2uxd h ARG 108 Ca -0.59 0.00 0.33 0.00 -1.26 0.00 0.00 59.98 58.46 2uxd h ARG 108 Cb 1.36 0.00 -0.16 0.00 -1.65 0.00 0.00 29.97 29.52 2uxd h ARG 108 CO 0.58 0.54 0.44 1.15 0.56 0.00 0.00 179.97 183.24 2uxd h THR 109 N -1.00 0.18 0.29 2.04 2.02 -1.91 0.26 112.91 114.80 2uxd h THR 109 Ca -0.07 -0.06 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 2uxd h THR 109 Cb 0.68 -0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.09 2uxd h THR 109 CO -0.04 0.03 -0.14 -0.09 0.37 0.00 0.00 175.52 175.65 2uxd h ARG 110 N 0.17 -0.38 0.16 6.66 9.65 -1.88 -3.38 114.38 125.38 2uxd h ARG 110 Ca 0.72 0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 59.62 2uxd h ARG 110 Cb 1.69 0.09 0.00 0.00 -1.39 0.00 0.00 29.97 30.36 2uxd h ARG 110 CO -0.70 -0.09 -0.09 0.87 2.80 0.00 0.00 179.97 182.76 2uxd h LYS 111 N -1.00 -0.22 0.00 0.20 1.57 -1.33 -3.44 116.57 112.34 2uxd h LYS 111 Ca -0.04 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2uxd h LYS 111 Cb 0.47 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.83 2uxd h LYS 111 CO 0.07 -0.15 0.00 0.41 -0.57 0.00 0.00 179.45 179.21 2uxd n GLY 112 N -1.12 0.77 3.27 3.86 0.00 0.00 -5.04 105.19 106.94 2uxd n GLY 112 Ca -0.03 -1.86 -0.34 0.00 0.00 0.00 0.00 46.02 43.79 2uxd n GLY 112 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2uxd n PRO 113 N -0.34 -0.13 -2.29 1.61 -0.02 -1.26 -4.80 135.00 127.76 2uxd n PRO 113 Ca 0.00 -0.01 -0.43 0.00 -2.02 0.00 0.00 63.50 61.04 2uxd n PRO 113 Cb 0.00 -1.53 -0.02 0.00 -0.02 0.00 0.00 33.50 31.93 2uxd n PRO 113 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2uxd s ARG 114 N -2.92 3.93 -0.53 -0.52 0.52 -1.26 -4.98 118.95 113.19 2uxd s ARG 114 Ca 0.52 1.50 -0.07 0.00 -0.52 0.00 0.00 55.73 57.15 2uxd s ARG 114 Cb -0.22 -3.92 0.14 0.00 0.52 0.00 0.00 34.95 31.47 2uxd s ARG 114 CO 0.72 -1.11 0.39 0.15 0.02 0.00 0.00 175.30 175.47 2uxd s LYS 115 N 4.24 2.55 -0.20 3.54 3.01 -1.26 -5.06 119.74 126.56 2uxd s LYS 115 Ca 0.62 -2.01 -0.23 0.00 -1.01 0.00 0.00 55.97 53.35 2uxd s LYS 115 Cb -0.21 -3.89 -0.02 0.00 -1.01 0.00 0.00 37.83 32.70 2uxd s LYS 115 CO 0.24 -1.18 0.72 0.99 0.51 0.00 0.00 175.35 176.63 2uxd s THR 116 N 0.90 4.95 0.00 2.17 2.01 -1.26 -5.02 115.64 119.39 2uxd s THR 116 Ca 0.10 1.37 0.00 0.00 0.31 0.00 0.00 61.69 63.47 2uxd s THR 116 Cb -0.23 -4.03 0.00 0.00 0.01 0.00 0.00 72.50 68.26 2uxd s THR 116 CO -0.03 0.05 0.00 1.33 -0.69 0.00 0.00 174.62 175.29 2uxd n VAL 117 N 4.82 0.00 0.00 3.82 0.24 -1.26 -5.11 118.33 120.85 2uxd n VAL 117 Ca 0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.31 2uxd n VAL 117 Cb 0.49 -0.04 0.00 0.00 -1.47 0.00 0.00 33.84 32.82 2uxd n VAL 117 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2uxd n ALA 118 N -1.98 0.00 0.00 2.33 0.00 -1.26 -5.14 120.51 114.45 2uxd n ALA 118 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2uxd n ALA 118 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2uxd n ALA 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2uxd n GLY 119 N -0.08 0.06 0.00 0.00 0.00 -1.26 -5.12 105.19 98.79 2uxd n GLY 119 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2uxd n GLY 119 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2uxd n LYS 120 N 0.00 0.00 0.00 1.61 4.81 -1.26 -5.08 118.16 118.24 2uxd n LYS 120 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2uxd n LYS 120 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2uxd n LYS 120 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2uxd n LYS 121 N 0.00 0.04 -3.84 1.64 4.01 -1.26 -5.11 118.16 113.64 2uxd n LYS 121 Ca 0.00 0.00 -0.23 0.00 -0.51 0.00 0.00 58.31 57.57 2uxd n LYS 121 Cb 0.00 -0.73 -0.02 0.00 -0.51 0.00 0.00 35.03 33.77 2uxd n LYS 121 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 2uxd s LYS 122 N -1.45 3.45 0.11 1.97 2.47 -1.26 -4.99 119.74 120.04 2uxd s LYS 122 Ca 0.00 -0.63 0.00 0.00 -1.56 0.00 0.00 55.97 53.78 2uxd s LYS 122 Cb 0.00 -2.86 0.00 0.00 -1.46 0.00 0.00 37.83 33.51 2uxd s LYS 122 CO 0.00 0.39 0.00 0.00 0.16 0.00 0.00 175.35 175.90 2uxd n ALA 123 N -1.29 -2.64 -2.18 3.13 0.00 -1.26 -4.92 120.51 111.34 2uxd n ALA 123 Ca -0.08 0.18 -0.42 0.00 0.00 0.00 0.00 53.44 53.12 2uxd n ALA 123 Cb 0.56 -0.86 -0.03 0.00 0.00 0.00 0.00 19.45 19.13 2uxd n ALA 123 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2uxd s PRO 124 N -2.66 4.25 0.00 0.00 0.02 -1.26 -4.90 135.00 130.45 2uxd s PRO 124 Ca 0.00 2.00 0.00 0.00 0.02 0.00 0.00 61.00 63.02 2uxd s PRO 124 Cb 0.00 -3.68 0.00 0.00 0.02 0.00 0.00 34.50 30.84 2uxd s PRO 124 CO 0.00 -0.66 1.26 2.89 -0.33 0.00 0.00 177.00 180.17 2uxd n ARG 125 N 5.90 0.85 0.00 5.54 -4.01 -1.26 -5.27 116.66 118.41 2uxd n ARG 125 Ca 0.14 0.00 0.13 0.00 -1.04 0.00 0.00 57.85 57.08 2uxd n ARG 125 Cb 0.43 -1.07 0.32 0.00 -3.04 0.00 0.00 32.46 29.10 2uxd n ARG 125 CO 0.00 0.00 0.00 1.63 -3.04 0.00 0.00 177.63 176.22