#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uib s VAL 2 N 0.00 4.50 0.70 3.15 1.01 -1.26 -0.88 120.40 127.62 1uib s VAL 2 Ca 0.00 -0.92 -0.11 0.00 0.00 0.00 0.00 61.98 60.95 1uib s VAL 2 Cb 0.00 -3.53 0.01 0.00 0.00 0.00 0.00 36.38 32.86 1uib s VAL 2 CO 0.00 -0.25 1.07 -0.36 0.00 0.00 0.00 175.10 175.56 1uib s PHE 3 N 1.53 3.25 0.26 5.22 0.40 0.11 -4.99 117.98 123.76 1uib s PHE 3 Ca 0.02 1.25 -0.01 0.00 -0.60 0.00 0.00 56.93 57.58 1uib s PHE 3 Cb -0.19 -2.93 -0.04 0.00 0.51 0.00 0.00 43.02 40.37 1uib s PHE 3 CO 0.06 -1.18 0.46 0.20 0.70 0.00 0.00 175.22 175.47 1uib s GLY 4 N -4.05 1.66 0.10 4.36 0.00 -1.26 -4.86 107.32 103.27 1uib s GLY 4 Ca 0.58 -0.81 -0.35 0.00 0.00 0.00 0.00 44.72 44.13 1uib s GLY 4 CO 0.54 -0.76 1.56 -0.09 0.00 0.00 0.00 173.10 174.36 1uib h ARG 5 N 1.58 -0.84 -0.09 2.90 2.43 -1.98 0.70 114.38 119.09 1uib h ARG 5 Ca -0.49 0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 58.67 1uib h ARG 5 Cb 1.20 0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.93 1uib h ARG 5 CO 0.66 -0.56 -0.26 0.00 -1.51 0.00 0.00 179.97 178.29 1uib h GLU 7 N 0.14 0.56 -0.62 0.00 4.81 -1.88 -2.32 114.58 115.27 1uib h GLU 7 Ca 0.02 -0.12 -0.08 0.00 -0.13 0.00 0.00 59.36 59.06 1uib h GLU 7 Cb 0.55 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 1uib h GLU 7 CO 0.04 0.58 0.09 1.25 -0.73 0.00 0.00 179.01 180.24 1uib h LEU 8 N 0.44 1.00 -0.46 1.64 5.85 -0.48 -1.82 115.31 121.48 1uib h LEU 8 Ca 0.12 -0.27 0.07 0.00 0.84 0.00 0.00 57.88 58.64 1uib h LEU 8 Cb 0.25 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 40.96 1uib h LEU 8 CO -0.00 1.01 0.14 0.00 -0.34 0.00 0.00 178.44 179.25 1uib h ALA 9 N 1.02 0.54 -0.37 1.25 0.00 -1.05 0.40 119.26 121.05 1uib h ALA 9 Ca 0.19 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 1uib h ALA 9 Cb 0.45 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1uib h ALA 9 CO 0.01 -0.26 0.17 0.00 0.00 0.00 0.00 179.25 179.17 1uib h ALA 10 N 1.32 0.48 0.00 0.00 0.00 -1.24 -2.57 119.26 117.25 1uib h ALA 10 Ca 0.22 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1uib h ALA 10 Cb 0.25 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1uib h ALA 10 CO -0.25 0.06 -0.08 0.00 0.00 0.00 0.00 179.25 178.98 1uib h ALA 11 N 1.01 1.82 -0.56 0.00 0.00 -0.49 -2.45 119.26 118.60 1uib h ALA 11 Ca 0.13 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1uib h ALA 11 Cb 0.15 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1uib h ALA 11 CO -0.01 0.10 0.01 -1.33 0.00 0.00 0.00 179.25 178.02 1uib n MET 12 N -4.38 4.69 0.21 0.00 2.81 0.05 -4.60 117.12 115.90 1uib n MET 12 Ca -0.03 -3.01 0.16 0.00 -1.81 0.00 0.00 57.70 53.01 1uib n MET 12 Cb 0.16 -2.24 0.80 0.00 -0.71 0.00 0.00 33.22 31.23 1uib n MET 12 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1uib h LYS 13 N 3.76 0.00 0.00 0.03 1.57 -1.18 -0.06 116.57 120.68 1uib h LYS 13 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1uib h LYS 13 Cb 1.94 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.25 1uib h LYS 13 CO 0.49 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.78 1uib n GLY 16 N -1.44 -0.86 0.20 3.86 0.00 -1.26 -1.83 105.19 103.86 1uib n GLY 16 Ca 0.01 -0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.12 1uib n GLY 16 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1uib n LEU 17 N -1.57 1.37 -4.63 0.99 4.77 -0.04 -4.78 117.00 113.11 1uib n LEU 17 Ca 0.02 -0.56 -0.42 0.00 -0.03 0.00 0.00 56.01 55.02 1uib n LEU 17 Cb 0.12 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.16 1uib n LEU 17 CO 0.10 0.29 1.71 -0.62 -1.33 0.00 0.00 177.39 177.54 1uib s ASP 18 N -2.78 5.98 -0.21 -1.43 2.15 -0.76 -1.01 116.67 118.61 1uib s ASP 18 Ca 0.13 2.29 0.00 0.00 0.43 0.00 0.00 52.55 55.40 1uib s ASP 18 Cb 0.17 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.27 1uib s ASP 18 CO 0.73 -1.48 0.00 0.59 -0.17 0.00 0.00 175.17 174.84 1uib n ASN 19 N 9.50 -4.53 -4.67 -0.34 3.02 0.34 -4.89 115.26 113.68 1uib n ASN 19 Ca 0.24 0.05 -0.42 0.00 -0.03 0.00 0.00 54.58 54.42 1uib n ASN 19 Cb 0.43 -2.20 -0.03 0.00 -0.61 0.00 0.00 39.78 37.37 1uib n ASN 19 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1uib s TYR 20 N -1.64 2.22 -1.72 3.10 5.04 -0.18 -1.45 117.35 122.71 1uib s TYR 20 Ca 0.00 0.30 0.00 0.00 -2.44 0.00 0.00 57.07 54.93 1uib s TYR 20 Cb 0.00 -3.91 0.00 0.00 0.35 0.00 0.00 41.96 38.40 1uib s TYR 20 CO 0.00 -3.71 0.00 0.54 -1.34 0.00 0.00 175.55 171.04 1uib n ARG 21 N 6.41 -1.40 -0.91 4.97 3.00 -1.26 -1.42 116.66 126.04 1uib n ARG 21 Ca 0.16 0.99 0.00 0.00 -0.01 0.00 0.00 57.85 58.99 1uib n ARG 21 Cb 0.42 -5.43 0.00 0.00 0.00 0.00 0.00 32.46 27.46 1uib n ARG 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1uib n GLY 22 N -0.90 0.57 3.45 -0.13 0.00 -0.53 -5.02 105.19 102.62 1uib n GLY 22 Ca -0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 1uib n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1uib s TYR 23 N -2.11 3.24 0.85 1.61 2.02 -0.51 -4.88 117.35 117.57 1uib s TYR 23 Ca 0.00 -0.65 -0.12 0.00 -0.37 0.00 0.00 57.07 55.92 1uib s TYR 23 Cb 0.00 -2.62 0.10 0.00 -0.40 0.00 0.00 41.96 39.05 1uib s TYR 23 CO 0.00 -0.61 1.18 -1.13 -1.57 0.00 0.00 175.55 173.42 1uib n SER 24 N 5.15 0.78 -0.35 2.29 3.41 -1.26 -0.50 113.62 123.13 1uib n SER 24 Ca -0.11 0.53 0.10 0.00 -0.26 0.00 0.00 58.87 59.13 1uib n SER 24 Cb 0.47 -1.50 0.27 0.00 -0.26 0.00 0.00 64.21 63.19 1uib n SER 24 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1uib h LEU 25 N -1.23 0.84 -1.77 1.04 5.85 -1.90 -1.41 115.31 116.72 1uib h LEU 25 Ca -0.45 0.07 0.13 0.00 0.84 0.00 0.00 57.88 58.48 1uib h LEU 25 Cb 1.29 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 42.20 1uib h LEU 25 CO 0.44 0.37 0.42 1.23 -0.34 0.00 0.00 178.44 180.56 1uib h GLY 26 N 0.86 0.37 0.98 3.75 0.00 -1.91 -1.85 103.07 105.27 1uib h GLY 26 Ca 0.53 -0.10 -0.03 0.00 0.00 0.00 0.00 47.33 47.74 1uib h GLY 26 CO -0.33 0.04 0.22 3.43 0.00 0.00 0.00 176.54 179.91 1uib h ASN 27 N 0.24 0.71 -0.32 0.19 2.35 -1.49 -0.94 115.58 116.32 1uib h ASN 27 Ca 0.29 -0.16 -0.16 0.00 -0.55 0.00 0.00 56.30 55.73 1uib h ASN 27 Cb 0.82 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 39.00 1uib h ASN 27 CO -0.06 0.67 -0.40 -0.50 -1.65 0.00 0.00 177.43 175.49 1uib h TRP 28 N 0.70 1.05 -0.40 1.19 4.06 -1.45 -1.47 115.95 119.63 1uib h TRP 28 Ca 0.18 -0.32 -0.11 0.00 2.06 0.00 0.00 58.89 60.70 1uib h TRP 28 Cb 0.17 -0.22 -0.01 0.00 -1.00 0.00 0.00 29.16 28.10 1uib h TRP 28 CO 0.00 1.12 -0.18 0.28 -3.56 0.00 0.00 178.44 176.11 1uib h VAL 29 N 0.71 1.28 -0.23 1.49 2.07 -1.37 -0.97 116.25 119.22 1uib h VAL 29 Ca 0.05 -1.31 -0.01 0.00 0.82 0.00 0.00 66.70 66.26 1uib h VAL 29 Cb 0.98 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 32.01 1uib h VAL 29 CO 0.09 0.44 0.11 0.00 0.02 0.00 0.00 177.57 178.24 1uib h ALA 31 N 0.98 0.24 -0.63 0.00 0.00 -1.17 -2.38 119.26 116.30 1uib h ALA 31 Ca 0.08 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.03 1uib h ALA 31 Cb 0.11 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 1uib h ALA 31 CO -0.01 -0.30 0.37 0.00 0.00 0.00 0.00 179.25 179.31 1uib h ALA 32 N 1.09 0.83 0.17 0.00 0.00 -0.98 0.10 119.26 120.46 1uib h ALA 32 Ca 0.08 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1uib h ALA 32 Cb -0.01 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1uib h ALA 32 CO -0.03 0.09 -0.24 -0.22 0.00 0.00 0.00 179.25 178.84 1uib h LYS 33 N 0.72 -0.46 0.00 0.00 1.63 -1.00 -0.48 116.57 116.98 1uib h LYS 33 Ca 0.26 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 60.10 1uib h LYS 33 Cb 0.08 0.10 0.00 0.00 -0.60 0.00 0.00 32.23 31.81 1uib h LYS 33 CO -0.13 -0.30 0.00 0.74 -3.45 0.00 0.00 179.45 176.30 1uib h PHE 34 N -0.47 0.00 0.10 1.91 0.04 -1.22 0.18 116.94 117.47 1uib h PHE 34 Ca 0.02 0.00 -0.26 0.00 2.80 0.00 0.00 57.97 60.52 1uib h PHE 34 Cb 0.47 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.62 1uib h PHE 34 CO -0.20 0.00 -1.35 0.93 -0.60 0.00 0.00 178.31 177.09 1uib h GLU 35 N 0.00 0.22 0.00 1.51 4.39 -0.59 -3.43 114.58 116.67 1uib h GLU 35 Ca 0.00 -0.37 0.00 0.00 0.34 0.00 0.00 59.36 59.33 1uib h GLU 35 Cb 0.75 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.53 1uib h GLU 35 CO 0.00 1.18 0.00 -1.13 -1.16 0.00 0.00 179.01 177.90 1uib n SER 36 N -3.98 0.38 -2.93 1.42 3.41 -0.23 -4.87 113.62 106.83 1uib n SER 36 Ca -0.25 -0.85 -0.21 0.00 -0.26 0.00 0.00 58.87 57.29 1uib n SER 36 Cb 0.87 0.09 0.04 0.00 -0.26 0.00 0.00 64.21 64.95 1uib n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1uib n ASN 37 N -0.09 -5.92 -0.93 4.04 5.15 0.62 -2.00 115.26 116.13 1uib n ASN 37 Ca 0.00 -0.31 -0.12 0.00 -0.60 0.00 0.00 54.58 53.55 1uib n ASN 37 Cb 0.11 -4.71 -0.05 0.00 -0.53 0.00 0.00 39.78 34.59 1uib n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1uib n PHE 38 N -4.51 0.00 -3.51 1.20 3.72 -1.20 -4.86 117.46 108.29 1uib n PHE 38 Ca -0.09 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.91 1uib n PHE 38 Cb 0.61 -2.41 -0.10 0.00 -0.94 0.00 0.00 39.48 36.63 1uib n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1uib s ASN 39 N -2.68 6.08 0.59 4.37 2.47 -0.84 -0.72 114.94 124.21 1uib s ASN 39 Ca 0.00 -0.40 0.36 0.00 0.42 0.00 0.00 52.86 53.24 1uib s ASN 39 Cb 0.00 -2.15 1.78 0.00 -1.45 0.00 0.00 41.25 39.43 1uib s ASN 39 CO 0.00 -0.26 2.15 0.71 -3.72 0.00 0.00 177.10 175.98 1uib h THR 40 N 5.50 0.15 -0.17 -5.21 1.35 -1.32 -2.88 112.91 110.33 1uib h THR 40 Ca -0.31 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.22 1uib h THR 40 Cb 1.15 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 68.86 1uib h THR 40 CO 0.65 0.03 0.00 0.00 -0.25 0.00 0.00 175.52 175.95 1uib n GLN 41 N -3.23 2.00 -1.90 4.72 6.02 -1.26 -3.85 117.38 119.89 1uib n GLN 41 Ca -0.01 -1.49 -0.41 0.00 -0.01 0.00 0.00 57.00 55.07 1uib n GLN 41 Cb 0.20 -1.45 -0.01 0.00 1.02 0.00 0.00 30.24 30.00 1uib n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1uib s ALA 42 N -1.79 3.59 0.01 -1.58 0.00 -1.09 -4.79 121.76 116.11 1uib s ALA 42 Ca 0.34 1.47 -0.00 0.00 0.00 0.00 0.00 51.96 53.76 1uib s ALA 42 Cb 0.20 -3.58 -0.01 0.00 0.00 0.00 0.00 23.12 19.73 1uib s ALA 42 CO 0.30 -0.90 -0.01 0.95 0.00 0.00 0.00 175.76 176.09 1uib s THR 43 N -0.82 0.08 -0.12 0.00 -4.23 -1.26 -0.84 115.64 108.45 1uib s THR 43 Ca 0.54 -0.69 -0.06 0.00 -1.18 0.00 0.00 61.69 60.31 1uib s THR 43 Cb -0.44 -0.21 0.05 0.00 1.34 0.00 0.00 72.50 73.23 1uib s THR 43 CO 0.56 -0.38 0.27 0.20 -0.54 0.00 0.00 174.62 174.73 1uib s ASN 44 N -1.12 -0.19 0.17 3.99 0.01 -0.71 -4.96 114.94 112.14 1uib s ASN 44 Ca -0.12 0.59 -0.24 0.00 -0.71 0.00 0.00 52.86 52.38 1uib s ASN 44 Cb -0.08 0.52 -0.08 0.00 0.41 0.00 0.00 41.25 42.03 1uib s ASN 44 CO -0.01 -0.18 0.76 -0.60 -1.51 0.00 0.00 177.10 175.56 1uib s ARG 45 N 1.51 4.51 0.28 -0.60 6.06 -1.26 0.04 118.95 129.49 1uib s ARG 45 Ca -0.07 1.10 0.07 0.00 -2.50 0.00 0.00 55.73 54.33 1uib s ARG 45 Cb -0.10 -3.21 -0.03 0.00 0.06 0.00 0.00 34.95 31.67 1uib s ARG 45 CO -0.09 0.55 0.29 -0.80 -2.50 0.00 0.00 175.30 172.75 1uib s ASN 46 N -1.21 5.69 0.35 -2.12 0.01 0.76 -4.96 114.94 113.47 1uib s ASN 46 Ca 0.36 -0.24 0.06 0.00 -0.71 0.00 0.00 52.86 52.33 1uib s ASN 46 Cb -0.22 -1.36 0.73 0.00 0.41 0.00 0.00 41.25 40.81 1uib s ASN 46 CO 0.25 -0.18 1.94 0.74 -1.51 0.00 0.00 177.10 178.34 1uib h THR 47 N 1.28 0.99 0.00 1.60 2.02 -1.98 -1.60 112.91 115.22 1uib h THR 47 Ca -0.48 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 66.44 1uib h THR 47 Cb 1.24 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.80 1uib h THR 47 CO 0.59 0.14 0.00 -0.90 0.37 0.00 0.00 175.52 175.72 1uib n ASP 48 N -4.49 0.00 0.00 4.18 5.75 -1.26 -4.85 116.55 115.88 1uib n ASP 48 Ca 0.12 -0.24 0.00 0.00 -0.01 0.00 0.00 54.79 54.66 1uib n ASP 48 Cb 0.27 -0.17 0.00 0.00 -1.03 0.00 0.00 41.12 40.19 1uib n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1uib n GLY 49 N 0.27 1.68 3.88 6.12 0.00 -0.60 -5.06 105.19 111.48 1uib n GLY 49 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1uib n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uib s SER 50 N -1.54 4.43 0.03 1.61 1.04 -1.26 -4.74 113.70 113.26 1uib s SER 50 Ca 0.00 0.83 0.03 0.00 0.48 0.00 0.00 55.95 57.30 1uib s SER 50 Cb 0.00 -1.36 -0.02 0.00 0.10 0.00 0.00 66.02 64.74 1uib s SER 50 CO 0.00 -1.96 -0.10 -0.89 0.98 0.00 0.00 173.24 171.27 1uib s THR 51 N -3.52 0.75 -0.14 2.02 2.01 -1.26 -0.17 115.64 115.33 1uib s THR 51 Ca 0.62 -0.86 -0.09 0.00 0.31 0.00 0.00 61.69 61.67 1uib s THR 51 Cb -0.12 -0.72 -0.05 0.00 0.01 0.00 0.00 72.50 71.63 1uib s THR 51 CO 0.50 -0.11 0.18 -1.81 -0.69 0.00 0.00 174.62 172.68 1uib s ASP 52 N -1.07 6.37 -0.05 3.53 1.01 0.11 -1.20 116.67 125.38 1uib s ASP 52 Ca -0.02 0.44 0.06 0.00 0.71 0.00 0.00 52.55 53.73 1uib s ASP 52 Cb -0.07 -2.10 -0.01 0.00 1.01 0.00 0.00 42.92 41.74 1uib s ASP 52 CO 0.01 0.30 -0.22 -0.31 0.21 0.00 0.00 175.17 175.15 1uib s TYR 53 N -0.43 2.14 0.00 4.23 1.51 0.07 -1.73 117.35 123.14 1uib s TYR 53 Ca 0.14 -0.59 0.00 0.00 -1.01 0.00 0.00 57.07 55.61 1uib s TYR 53 Cb -0.12 -1.41 0.00 0.00 -0.11 0.00 0.00 41.96 40.32 1uib s TYR 53 CO 0.03 -0.17 0.00 0.41 -1.11 0.00 0.00 175.55 174.71 1uib n GLY 54 N 2.93 -1.62 0.41 0.71 0.00 -0.02 -1.60 105.19 106.00 1uib n GLY 54 Ca -0.17 -1.28 0.23 0.00 0.00 0.00 0.00 46.02 44.79 1uib n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1uib h ILE 55 N 0.00 0.54 -0.36 -0.61 6.09 -1.66 -1.11 117.51 120.40 1uib h ILE 55 Ca 0.00 -0.13 0.00 0.00 -1.37 0.00 0.00 64.86 63.36 1uib h ILE 55 Cb 0.00 0.13 0.00 0.00 0.47 0.00 0.00 36.82 37.42 1uib h ILE 55 CO 0.00 0.07 0.00 0.18 -3.07 0.00 0.00 178.15 175.33 1uib n LEU 56 N -4.59 3.10 -3.94 2.19 4.77 -1.26 -4.20 117.00 113.07 1uib n LEU 56 Ca 0.24 -2.12 -0.33 0.00 -0.03 0.00 0.00 56.01 53.77 1uib n LEU 56 Cb 0.87 -0.28 -0.00 0.00 -2.33 0.00 0.00 43.42 41.68 1uib n LEU 56 CO 0.27 0.73 -0.20 0.00 -1.33 0.00 0.00 177.39 176.86 1uib n GLN 57 N 0.44 -1.60 -2.50 3.23 1.13 -0.42 -4.90 117.38 112.76 1uib n GLN 57 Ca 0.13 0.30 -0.42 0.00 -1.94 0.00 0.00 57.00 55.07 1uib n GLN 57 Cb 0.49 -3.80 -0.03 0.00 0.11 0.00 0.00 30.24 27.02 1uib n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1uib s ILE 58 N -3.76 4.29 0.09 5.09 1.01 -0.63 -4.35 121.20 122.94 1uib s ILE 58 Ca 0.27 1.63 -0.30 0.00 0.00 0.00 0.00 60.65 62.25 1uib s ILE 58 Cb -0.12 -4.05 -0.06 0.00 0.01 0.00 0.00 42.46 38.25 1uib s ILE 58 CO 0.91 0.08 1.08 0.21 0.00 0.00 0.00 174.94 177.22 1uib s ASN 59 N 1.20 7.26 0.41 3.58 3.84 -1.26 -0.75 114.94 129.23 1uib s ASN 59 Ca 0.56 1.92 0.29 0.00 0.21 0.00 0.00 52.86 55.84 1uib s ASN 59 Cb -0.26 -2.59 1.17 0.00 -0.55 0.00 0.00 41.25 39.02 1uib s ASN 59 CO 0.26 -0.29 1.85 0.77 -2.79 0.00 0.00 177.10 176.91 1uib h SER 60 N 6.11 0.00 0.73 -4.21 4.64 -1.40 -1.99 113.55 117.43 1uib h SER 60 Ca -0.42 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.86 1uib h SER 60 Cb 1.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 1uib h SER 60 CO 0.76 0.00 -0.18 -0.09 -0.87 0.00 0.00 176.83 176.44 1uib h ARG 61 N 0.00 0.00 0.00 4.77 2.43 -1.83 -3.39 114.38 116.36 1uib h ARG 61 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1uib h ARG 61 Cb 0.46 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 1uib h ARG 61 CO 0.00 0.18 -0.83 0.91 -1.51 0.00 0.00 179.97 178.72 1uib n TRP 62 N -3.45 0.00 -0.02 2.20 7.02 -1.13 -0.49 117.44 121.57 1uib n TRP 62 Ca -0.01 0.00 -0.00 0.00 -1.02 0.00 0.00 57.50 56.47 1uib n TRP 62 Cb 0.36 0.03 -0.12 0.00 -2.42 0.00 0.00 31.31 29.16 1uib n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 1uib n TRP 63 N -2.56 0.49 -3.99 -5.99 7.02 -0.76 -0.53 117.44 111.12 1uib n TRP 63 Ca 0.00 0.16 -0.09 0.00 -1.02 0.00 0.00 57.50 56.55 1uib n TRP 63 Cb 0.42 -0.94 -0.08 0.00 -2.42 0.00 0.00 31.31 28.29 1uib n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1uib s ASN 65 N -2.97 5.57 0.00 0.00 2.47 -0.41 -4.58 114.94 115.02 1uib s ASN 65 Ca 0.16 -0.01 0.01 0.00 0.42 0.00 0.00 52.86 53.44 1uib s ASN 65 Cb 0.05 -1.98 0.02 0.00 -1.45 0.00 0.00 41.25 37.88 1uib s ASN 65 CO -0.02 0.08 0.80 -0.90 -3.72 0.00 0.00 177.10 173.34 1uib n ASP 66 N 4.19 1.62 -0.24 -4.21 5.68 -1.26 -0.89 116.55 121.44 1uib n ASP 66 Ca -0.16 -1.55 -0.03 0.00 -0.50 0.00 0.00 54.79 52.54 1uib n ASP 66 Cb 0.52 -0.01 -0.01 0.00 -1.14 0.00 0.00 41.12 40.47 1uib n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1uib n GLY 67 N -0.19 0.48 0.48 6.12 0.00 -1.26 -4.79 105.19 106.02 1uib n GLY 67 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1uib n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1uib n ARG 68 N -1.03 0.00 -3.92 1.61 1.85 -1.26 -4.94 116.66 108.98 1uib n ARG 68 Ca -0.03 -0.80 -0.29 0.00 -1.00 0.00 0.00 57.85 55.73 1uib n ARG 68 Cb 0.34 -0.41 -0.13 0.00 -1.05 0.00 0.00 32.46 31.21 1uib n ARG 68 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1uib s THR 69 N 0.00 2.75 0.25 8.89 2.01 -1.26 -4.90 115.64 123.39 1uib s THR 69 Ca 0.00 -3.89 -0.31 0.00 0.31 0.00 0.00 61.69 57.80 1uib s THR 69 Cb 0.00 -2.85 -0.13 0.00 0.01 0.00 0.00 72.50 69.53 1uib s THR 69 CO 0.00 -0.93 1.37 -2.65 -0.69 0.00 0.00 174.62 171.73 1uib n PRO 70 N 2.43 2.00 -1.76 4.92 -0.02 -1.26 -2.54 135.00 138.77 1uib n PRO 70 Ca 0.14 0.71 -0.12 0.00 -2.02 0.00 0.00 63.50 62.21 1uib n PRO 70 Cb 0.34 -2.34 -0.03 0.00 -0.02 0.00 0.00 33.50 31.44 1uib n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1uib n GLY 71 N 1.92 0.64 3.97 -1.23 0.00 -1.26 -5.01 105.19 104.22 1uib n GLY 71 Ca 0.11 -0.42 -0.21 0.00 0.00 0.00 0.00 46.02 45.49 1uib n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uib s SER 72 N -2.68 5.64 0.38 1.61 1.04 -1.05 -5.08 113.70 113.56 1uib s SER 72 Ca 0.00 0.01 0.07 0.00 0.48 0.00 0.00 55.95 56.51 1uib s SER 72 Cb 0.00 -1.13 -0.00 0.00 0.10 0.00 0.00 66.02 64.98 1uib s SER 72 CO 0.00 -0.82 0.49 -0.13 0.98 0.00 0.00 173.24 173.77 1uib s ARG 73 N -4.53 2.88 -0.39 4.02 0.52 0.35 -4.98 118.95 116.83 1uib s ARG 73 Ca 0.52 -1.20 0.11 0.00 -0.52 0.00 0.00 55.73 54.64 1uib s ARG 73 Cb -0.10 -2.72 0.34 0.00 0.52 0.00 0.00 34.95 33.00 1uib s ARG 73 CO 0.36 -0.12 0.73 -1.71 0.02 0.00 0.00 175.30 174.58 1uib n ASN 74 N -1.71 1.05 0.14 0.23 5.15 -1.12 -3.85 115.26 115.14 1uib n ASN 74 Ca 0.04 -3.04 0.17 0.00 -0.60 0.00 0.00 54.58 51.15 1uib n ASN 74 Cb 0.59 -0.62 0.75 0.00 -0.53 0.00 0.00 39.78 39.97 1uib n ASN 74 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1uib h LEU 75 N 3.08 0.00 -1.24 1.20 3.38 -0.86 0.22 115.31 121.08 1uib h LEU 75 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1uib h LEU 75 Cb 0.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1uib h LEU 75 CO 0.52 0.00 -0.01 0.00 0.09 0.00 0.00 178.44 179.04 1uib n ASN 77 N 0.50 -4.17 -3.67 0.00 3.02 0.06 -5.00 115.26 106.00 1uib n ASN 77 Ca 0.17 -1.01 -0.12 0.00 -0.03 0.00 0.00 54.58 53.60 1uib n ASN 77 Cb 0.43 -3.33 -0.06 0.00 -0.61 0.00 0.00 39.78 36.21 1uib n ASN 77 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 1uib s ILE 78 N -3.57 0.07 0.34 2.41 -4.36 -1.26 -5.07 121.20 109.76 1uib s ILE 78 Ca 0.37 -0.55 -0.27 0.00 -0.26 0.00 0.00 60.65 59.94 1uib s ILE 78 Cb -0.13 -1.03 -0.09 0.00 1.25 0.00 0.00 42.46 42.46 1uib s ILE 78 CO 0.87 -0.30 1.06 -2.84 0.24 0.00 0.00 174.94 173.96 1uib s PRO 79 N -2.92 4.40 0.51 0.37 0.02 -1.26 -1.29 135.00 134.83 1uib s PRO 79 Ca -0.02 1.62 0.16 0.00 0.02 0.00 0.00 61.00 62.78 1uib s PRO 79 Cb 0.00 -2.84 1.25 0.00 0.02 0.00 0.00 34.50 32.92 1uib s PRO 79 CO -0.06 0.04 2.13 0.00 -0.33 0.00 0.00 177.00 178.79 1uib h SER 81 N 0.00 0.00 0.33 0.00 4.64 -1.91 -0.75 113.55 115.86 1uib h SER 81 Ca -0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1uib h SER 81 Cb 0.04 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.13 1uib h SER 81 CO 0.00 0.00 -0.07 0.00 -0.87 0.00 0.00 176.83 175.90 1uib h ALA 82 N 1.94 1.22 -0.00 5.18 0.00 -1.68 -1.71 119.26 124.21 1uib h ALA 82 Ca 0.03 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1uib h ALA 82 Cb 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1uib h ALA 82 CO -0.00 0.08 -0.02 1.28 0.00 0.00 0.00 179.25 180.59 1uib n LEU 83 N -3.49 0.15 -0.31 0.00 4.77 -0.29 -3.45 117.00 114.39 1uib n LEU 83 Ca -0.02 0.11 0.11 0.00 -0.03 0.00 0.00 56.01 56.19 1uib n LEU 83 Cb 0.20 -0.17 0.05 0.00 -2.33 0.00 0.00 43.42 41.16 1uib n LEU 83 CO 0.27 0.03 0.29 0.18 -1.33 0.00 0.00 177.39 176.83 1uib n LEU 84 N -1.08 1.53 -4.65 2.23 4.77 -0.64 -4.07 117.00 115.09 1uib n LEU 84 Ca 0.17 -0.57 -0.35 0.00 -0.03 0.00 0.00 56.01 55.24 1uib n LEU 84 Cb 0.21 -0.04 0.10 0.00 -2.33 0.00 0.00 43.42 41.37 1uib n LEU 84 CO 0.21 0.30 0.64 -0.24 -1.33 0.00 0.00 177.39 176.98 1uib n SER 85 N -0.56 0.80 0.22 -1.43 2.88 -1.22 -4.12 113.62 110.18 1uib n SER 85 Ca 0.08 0.65 0.10 0.00 -1.33 0.00 0.00 58.87 58.37 1uib n SER 85 Cb 0.41 -1.45 0.49 0.00 -0.75 0.00 0.00 64.21 62.90 1uib n SER 85 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1uib h SER 86 N -0.41 0.00 -3.46 -3.46 4.64 -1.94 -3.39 113.55 105.54 1uib h SER 86 Ca -0.47 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.24 1uib h SER 86 Cb 1.32 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.30 1uib h SER 86 CO 0.47 0.23 0.31 -0.62 -0.87 0.00 0.00 176.83 176.35 1uib s ASP 87 N -6.24 6.62 0.00 4.97 2.15 -1.26 -4.94 116.67 117.97 1uib s ASP 87 Ca -0.00 0.62 0.16 0.00 0.43 0.00 0.00 52.55 53.76 1uib s ASP 87 Cb 0.11 -2.38 0.77 0.00 -0.30 0.00 0.00 42.92 41.12 1uib s ASP 87 CO 0.64 -0.54 1.53 2.30 -0.17 0.00 0.00 175.17 178.92 1uib n ILE 88 N 5.44 0.12 -0.20 4.11 -5.35 -1.26 -4.38 119.36 117.83 1uib n ILE 88 Ca 0.02 -0.17 -0.00 0.00 -0.27 0.00 0.00 62.75 62.33 1uib n ILE 88 Cb 0.48 0.03 0.07 0.00 -1.74 0.00 0.00 39.64 38.49 1uib n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1uib h THR 89 N 0.99 0.42 -0.76 7.28 2.02 -1.94 0.21 112.91 121.13 1uib h THR 89 Ca 0.00 -0.01 0.05 0.00 0.77 0.00 0.00 66.41 67.22 1uib h THR 89 Cb 0.22 0.38 -0.05 0.00 -1.74 0.00 0.00 68.15 66.96 1uib h THR 89 CO 0.00 0.01 0.46 0.00 0.37 0.00 0.00 175.52 176.35 1uib h ALA 90 N 1.60 1.02 -0.52 6.16 0.00 -1.87 0.18 119.26 125.83 1uib h ALA 90 Ca 0.30 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.11 1uib h ALA 90 Cb 0.48 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1uib h ALA 90 CO -0.60 0.19 -0.07 0.77 0.00 0.00 0.00 179.25 179.54 1uib h SER 91 N 0.85 0.96 -0.19 0.00 0.02 -1.50 -1.51 113.55 112.20 1uib h SER 91 Ca 0.33 -0.34 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 1uib h SER 91 Cb 0.13 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 1uib h SER 91 CO -0.16 1.07 0.04 0.58 -1.14 0.00 0.00 176.83 177.23 1uib h VAL 92 N 0.84 1.21 -0.73 2.27 2.07 -0.37 -0.52 116.25 121.03 1uib h VAL 92 Ca 0.14 -0.68 -0.03 0.00 0.82 0.00 0.00 66.70 66.95 1uib h VAL 92 Cb 0.62 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 1uib h VAL 92 CO 0.04 0.21 0.33 0.78 0.02 0.00 0.00 177.57 178.95 1uib h ASN 93 N 0.11 0.95 -0.10 0.57 -0.26 -0.60 -2.30 115.58 113.95 1uib h ASN 93 Ca 0.06 -0.11 -0.22 0.00 -0.56 0.00 0.00 56.30 55.46 1uib h ASN 93 Cb 0.28 -0.24 0.01 0.00 -1.06 0.00 0.00 38.32 37.31 1uib h ASN 93 CO 0.00 0.82 -0.79 0.00 -1.06 0.00 0.00 177.43 176.40 1uib h ALA 95 N 0.59 1.56 -0.95 0.00 0.00 -0.83 -1.01 119.26 118.60 1uib h ALA 95 Ca -0.06 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.87 1uib h ALA 95 Cb 1.42 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.91 1uib h ALA 95 CO 0.16 0.29 0.63 0.87 0.00 0.00 0.00 179.25 181.20 1uib h LYS 96 N 0.98 1.18 -0.33 0.00 1.57 -1.36 0.39 116.57 119.00 1uib h LYS 96 Ca 0.40 -0.07 -0.16 0.00 -1.87 0.00 0.00 60.65 58.95 1uib h LYS 96 Cb 0.27 -0.27 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1uib h LYS 96 CO -0.16 0.78 -0.41 0.87 -0.57 0.00 0.00 179.45 179.96 1uib h LYS 97 N 1.21 0.86 0.35 3.15 1.57 -1.25 -2.85 116.57 119.61 1uib h LYS 97 Ca 0.37 -0.49 -0.02 0.00 -1.87 0.00 0.00 60.65 58.65 1uib h LYS 97 Cb -0.01 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1uib h LYS 97 CO -0.11 1.13 -0.17 0.82 -0.57 0.00 0.00 179.45 180.55 1uib h ILE 98 N 0.65 0.66 0.00 1.86 2.04 -0.61 -2.29 117.51 119.82 1uib h ILE 98 Ca 0.04 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.84 1uib h ILE 98 Cb 1.01 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 37.78 1uib h ILE 98 CO 0.10 0.01 0.00 1.62 0.00 0.00 0.00 178.15 179.88 1uib h VAL 99 N -0.51 0.00 -0.00 1.67 3.04 -0.99 -0.48 116.25 118.98 1uib h VAL 99 Ca -0.05 -0.15 0.00 0.00 -1.01 0.00 0.00 66.70 65.49 1uib h VAL 99 Cb 0.39 1.10 0.00 0.00 -2.01 0.00 0.00 31.29 30.77 1uib h VAL 99 CO 0.08 0.00 -0.39 -1.20 -1.01 0.00 0.00 177.57 175.05 1uib n SER 100 N -2.99 0.61 0.00 3.17 7.64 -0.93 -3.67 113.62 117.44 1uib n SER 100 Ca -0.02 -0.39 0.09 0.00 1.01 0.00 0.00 58.87 59.56 1uib n SER 100 Cb 0.14 0.16 0.53 0.00 -1.01 0.00 0.00 64.21 64.03 1uib n SER 100 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1uib n ASP 101 N -1.25 0.00 0.00 6.43 2.03 -0.19 -4.88 116.55 118.70 1uib n ASP 101 Ca 0.08 -0.65 0.00 0.00 0.52 0.00 0.00 54.79 54.73 1uib n ASP 101 Cb 0.34 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.74 1uib n ASP 101 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1uib n GLY 102 N 0.20 1.80 1.05 0.27 0.00 -1.26 -4.91 105.19 102.34 1uib n GLY 102 Ca 0.13 -0.59 0.12 0.00 0.00 0.00 0.00 46.02 45.68 1uib n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1uib n ASN 103 N 0.00 3.19 0.00 1.61 3.02 -1.26 -5.06 115.26 116.76 1uib n ASN 103 Ca 0.00 -1.98 0.00 0.00 -0.03 0.00 0.00 54.58 52.57 1uib n ASN 103 Cb 0.00 -0.15 0.00 0.00 -0.61 0.00 0.00 39.78 39.02 1uib n ASN 103 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uib n GLY 104 N 1.43 2.26 0.00 7.41 0.00 -1.24 -2.34 105.19 112.71 1uib n GLY 104 Ca 0.17 -0.44 0.11 0.00 0.00 0.00 0.00 46.02 45.87 1uib n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1uib n MET 105 N 9.32 0.40 0.10 1.61 2.81 -1.26 -3.19 117.12 126.90 1uib n MET 105 Ca 0.00 0.06 0.09 0.00 -1.81 0.00 0.00 57.70 56.03 1uib n MET 105 Cb 0.00 -1.50 0.41 0.00 -0.71 0.00 0.00 33.22 31.42 1uib n MET 105 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1uib n ASN 106 N -1.23 0.40 0.30 7.83 3.02 -0.99 -1.39 115.26 123.21 1uib n ASN 106 Ca 0.12 0.65 0.19 0.00 -0.03 0.00 0.00 54.58 55.51 1uib n ASN 106 Cb 0.16 -0.71 0.91 0.00 -0.61 0.00 0.00 39.78 39.53 1uib n ASN 106 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1uib h ALA 107 N 2.14 1.02 -2.54 5.41 0.00 -1.72 -3.38 119.26 120.20 1uib h ALA 107 Ca 0.00 -0.01 -0.72 0.00 0.00 0.00 0.00 54.91 54.18 1uib h ALA 107 Cb 0.14 -0.00 -0.23 0.00 0.00 0.00 0.00 17.79 17.70 1uib h ALA 107 CO 0.00 0.01 -0.42 -1.58 0.00 0.00 0.00 179.25 177.26 1uib s TRP 108 N -3.91 3.25 0.21 0.00 0.51 -0.48 -4.98 118.94 113.53 1uib s TRP 108 Ca -0.02 -0.82 -0.09 0.00 -2.12 0.00 0.00 56.10 53.05 1uib s TRP 108 Cb 0.11 -2.73 0.23 0.00 -0.81 0.00 0.00 33.47 30.27 1uib s TRP 108 CO 0.49 -0.67 1.81 -0.24 -0.51 0.00 0.00 176.95 177.83 1uib h VAL 109 N 5.75 0.97 -0.42 4.03 3.04 -1.85 -1.13 116.25 126.64 1uib h VAL 109 Ca -0.27 -0.23 -0.04 0.00 -1.01 0.00 0.00 66.70 65.15 1uib h VAL 109 Cb 1.11 0.23 -0.02 0.00 -2.01 0.00 0.00 31.29 30.60 1uib h VAL 109 CO 0.76 0.12 0.10 0.00 -1.01 0.00 0.00 177.57 177.54 1uib h ALA 110 N 1.34 1.38 0.11 3.17 0.00 -1.94 0.10 119.26 123.43 1uib h ALA 110 Ca 0.30 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1uib h ALA 110 Cb 0.18 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1uib h ALA 110 CO -0.18 0.45 -0.06 2.35 0.00 0.00 0.00 179.25 181.81 1uib h TRP 111 N 0.62 -0.14 -0.88 0.00 7.01 -1.69 0.30 115.95 121.16 1uib h TRP 111 Ca 0.14 -0.00 0.11 0.00 2.11 0.00 0.00 58.89 61.25 1uib h TRP 111 Cb 0.24 0.05 -0.08 0.00 -2.10 0.00 0.00 29.16 27.27 1uib h TRP 111 CO 0.01 0.12 0.51 -0.09 -2.79 0.00 0.00 178.44 176.20 1uib h ARG 112 N -0.40 0.79 0.00 2.65 2.43 -0.77 0.14 114.38 119.22 1uib h ARG 112 Ca -0.02 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1uib h ARG 112 Cb 0.33 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1uib h ARG 112 CO 0.03 0.52 -0.94 -0.91 -1.51 0.00 0.00 179.97 177.15 1uib h ASN 113 N 0.81 0.00 0.00 -3.80 2.35 -0.61 -3.38 115.58 110.95 1uib h ASN 113 Ca 0.44 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 56.15 1uib h ASN 113 Cb 0.47 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.84 1uib h ASN 113 CO -0.28 0.02 0.00 0.54 -1.65 0.00 0.00 177.43 176.06 1uib n ARG 114 N -2.57 1.82 0.00 0.81 1.74 0.10 -4.90 116.66 113.66 1uib n ARG 114 Ca 0.01 -0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.01 1uib n ARG 114 Cb 0.53 -0.39 0.00 0.00 -1.02 0.00 0.00 32.46 31.58 1uib n ARG 114 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1uib n LYS 116 N -2.52 1.90 -1.06 0.00 4.81 0.28 -1.75 118.16 119.83 1uib n LYS 116 Ca 0.00 0.69 -0.02 0.00 -0.87 0.00 0.00 58.31 58.11 1uib n LYS 116 Cb 0.48 -2.45 -0.01 0.00 0.02 0.00 0.00 35.03 33.07 1uib n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1uib n GLY 117 N 3.57 0.54 3.79 3.14 0.00 -1.26 -4.97 105.19 110.00 1uib n GLY 117 Ca 0.19 -0.42 -0.26 0.00 0.00 0.00 0.00 46.02 45.53 1uib n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uib s THR 118 N -1.97 2.04 -0.98 2.61 -4.23 -0.72 -5.03 115.64 107.36 1uib s THR 118 Ca 0.00 -1.66 -0.22 0.00 -1.18 0.00 0.00 61.69 58.63 1uib s THR 118 Cb 0.00 -2.70 0.07 0.00 1.34 0.00 0.00 72.50 71.22 1uib s THR 118 CO 0.00 0.00 1.34 -0.62 -0.54 0.00 0.00 174.62 174.80 1uib s ASP 119 N -4.01 6.53 0.23 3.99 2.15 -1.26 -4.79 116.67 119.51 1uib s ASP 119 Ca 0.36 -1.61 0.23 0.00 0.43 0.00 0.00 52.55 51.96 1uib s ASP 119 Cb 0.02 -2.52 0.94 0.00 -0.30 0.00 0.00 42.92 41.06 1uib s ASP 119 CO 0.20 -1.38 1.70 1.33 -0.17 0.00 0.00 175.17 176.85 1uib n VAL 120 N 6.44 0.81 -0.01 1.11 0.24 -1.26 -2.72 118.33 122.93 1uib n VAL 120 Ca 0.29 0.18 0.10 0.00 -2.04 0.00 0.00 64.34 62.87 1uib n VAL 120 Cb 0.50 -1.08 0.51 0.00 -1.47 0.00 0.00 33.84 32.31 1uib n VAL 120 CO 0.00 0.00 0.00 -0.61 -2.14 0.00 0.00 176.83 174.08 1uib h GLN 121 N 0.00 0.35 -0.09 7.34 -0.00 -1.89 -0.91 115.11 119.91 1uib h GLN 121 Ca 0.00 -0.02 0.03 0.00 -0.00 0.00 0.00 58.65 58.66 1uib h GLN 121 Cb 0.39 -0.08 -0.00 0.00 0.00 0.00 0.00 27.48 27.79 1uib h GLN 121 CO 0.00 0.23 0.12 0.00 0.00 0.00 0.00 178.83 179.18 1uib h ALA 122 N 1.75 1.61 0.00 3.38 0.00 -1.92 -2.18 119.26 121.90 1uib h ALA 122 Ca 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1uib h ALA 122 Cb 0.35 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1uib h ALA 122 CO -0.05 -0.17 0.00 0.91 0.00 0.00 0.00 179.25 179.94 1uib n TRP 123 N -3.70 0.77 -0.33 0.00 7.02 -0.35 -2.63 117.44 118.23 1uib n TRP 123 Ca -0.01 0.31 0.04 0.00 -1.02 0.00 0.00 57.50 56.82 1uib n TRP 123 Cb 0.22 -0.99 0.07 0.00 -2.42 0.00 0.00 31.31 28.19 1uib n TRP 123 CO 0.00 0.00 0.00 0.44 -2.02 0.00 0.00 177.69 176.11 1uib n ILE 124 N -2.21 1.28 -1.75 -0.99 -5.35 -0.82 -4.83 119.36 104.70 1uib n ILE 124 Ca 0.02 -1.35 -0.42 0.00 -0.27 0.00 0.00 62.75 60.74 1uib n ILE 124 Cb 0.22 0.28 -0.01 0.00 -1.74 0.00 0.00 39.64 38.40 1uib n ILE 124 CO 0.00 0.00 0.00 -2.11 -1.76 0.00 0.00 176.55 172.68 1uib n ARG 125 N -0.59 2.57 -0.29 6.28 1.85 -1.08 -2.14 116.66 123.26 1uib n ARG 125 Ca 0.06 0.91 0.00 0.00 -1.00 0.00 0.00 57.85 57.82 1uib n ARG 125 Cb 0.40 -2.63 0.00 0.00 -1.05 0.00 0.00 32.46 29.18 1uib n ARG 125 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1uib n GLY 126 N 1.30 2.10 3.76 2.89 0.00 -1.26 -5.01 105.19 108.97 1uib n GLY 126 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 1uib n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uib s ARG 128 N -0.29 3.27 0.00 0.00 6.06 -1.26 -5.11 118.95 121.62 1uib s ARG 128 Ca 0.36 -0.39 0.21 0.00 -2.50 0.00 0.00 55.73 53.40 1uib s ARG 128 Cb -0.20 -4.10 0.16 0.00 0.06 0.00 0.00 34.95 30.87 1uib s ARG 128 CO 0.22 -1.59 1.15 1.28 -2.50 0.00 0.00 175.30 173.86