#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oul n TYR 3 N 0.00 -2.41 -3.25 -1.84 4.02 -1.26 -4.97 117.16 107.46 1oul n TYR 3 Ca 0.00 0.97 -0.43 0.00 -0.01 0.00 0.00 57.90 58.44 1oul n TYR 3 Cb 0.00 -3.28 -0.01 0.00 -0.02 0.00 0.00 39.34 36.03 1oul n TYR 3 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1oul n LYS 4 N -0.34 3.76 -2.75 -0.72 4.01 -1.26 -5.04 118.16 115.83 1oul n LYS 4 Ca 0.08 -4.51 -0.34 0.00 -0.51 0.00 0.00 58.31 53.03 1oul n LYS 4 Cb 0.30 -2.51 -0.06 0.00 -0.51 0.00 0.00 35.03 32.25 1oul n LYS 4 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 1oul s SER 5 N -0.12 6.91 0.99 4.39 1.04 -1.26 -5.05 113.70 120.60 1oul s SER 5 Ca 0.31 1.78 -0.12 0.00 0.48 0.00 0.00 55.95 58.39 1oul s SER 5 Cb -0.03 -2.55 0.18 0.00 0.10 0.00 0.00 66.02 63.72 1oul s SER 5 CO -0.01 -0.38 1.09 -0.94 0.98 0.00 0.00 173.24 173.97 1oul s SER 6 N -2.01 2.64 0.57 7.02 1.04 -1.26 -5.00 113.70 116.70 1oul s SER 6 Ca 0.60 1.32 -0.17 0.00 0.48 0.00 0.00 55.95 58.18 1oul s SER 6 Cb -0.13 -2.00 -0.05 0.00 0.10 0.00 0.00 66.02 63.95 1oul s SER 6 CO 0.17 -3.14 1.08 -2.84 0.98 0.00 0.00 173.24 169.49 1oul s PRO 7 N -4.89 3.34 0.14 4.02 0.02 -1.26 -4.97 135.00 131.39 1oul s PRO 7 Ca 0.65 1.36 0.21 0.00 0.02 0.00 0.00 61.00 63.24 1oul s PRO 7 Cb -0.19 -2.03 -0.07 0.00 0.02 0.00 0.00 34.50 32.24 1oul s PRO 7 CO 0.58 -0.81 0.93 1.63 -0.33 0.00 0.00 177.00 179.00 1oul n LYS 8 N -1.70 0.61 -0.35 5.54 5.02 -1.26 -4.58 118.16 121.44 1oul n LYS 8 Ca 0.10 0.14 0.06 0.00 -2.02 0.00 0.00 58.31 56.58 1oul n LYS 8 Cb 0.52 -1.80 0.13 0.00 -0.02 0.00 0.00 35.03 33.86 1oul n LYS 8 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1oul n ARG 9 N -2.72 -0.09 -0.35 1.97 0.63 -1.26 -1.12 116.66 113.71 1oul n ARG 9 Ca -0.04 1.51 0.04 0.00 -0.92 0.00 0.00 57.85 58.44 1oul n ARG 9 Cb 0.65 -2.26 0.19 0.00 0.45 0.00 0.00 32.46 31.49 1oul n ARG 9 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 1oul h PRO 10 N 0.00 1.02 -0.29 -0.14 0.11 -1.84 0.39 132.00 131.25 1oul h PRO 10 Ca 0.46 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.42 1oul h PRO 10 Cb 0.71 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.58 1oul h PRO 10 CO -1.00 0.67 -0.18 1.88 -0.21 0.00 0.00 178.00 179.17 1oul h TYR 11 N 1.05 0.73 -0.38 0.65 -1.99 -1.44 -1.34 116.97 114.25 1oul h TYR 11 Ca 0.44 -0.19 -0.06 0.00 2.00 0.00 0.00 58.73 60.91 1oul h TYR 11 Cb 0.28 -0.16 -0.01 0.00 2.00 0.00 0.00 36.73 38.83 1oul h TYR 11 CO -0.01 0.88 -0.02 -0.07 -0.00 0.00 0.00 178.16 178.94 1oul h LEU 12 N 0.37 0.67 0.17 3.88 3.38 -0.85 -1.19 115.31 121.73 1oul h LEU 12 Ca 0.06 -0.32 0.01 0.00 0.09 0.00 0.00 57.88 57.72 1oul h LEU 12 Cb 0.71 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 1oul h LEU 12 CO 0.05 0.82 -0.20 0.25 0.09 0.00 0.00 178.44 179.45 1oul h LEU 13 N 0.49 -0.54 -0.43 1.67 6.46 -0.21 -0.91 115.31 121.84 1oul h LEU 13 Ca 0.10 0.05 0.06 0.00 -0.12 0.00 0.00 57.88 57.98 1oul h LEU 13 Cb 0.49 0.19 -0.05 0.00 -0.73 0.00 0.00 40.66 40.56 1oul h LEU 13 CO 0.02 -0.29 0.13 -0.09 -0.62 0.00 0.00 178.44 177.59 1oul h ARG 14 N -0.42 0.28 -0.05 1.25 2.43 -1.19 0.18 114.38 116.87 1oul h ARG 14 Ca 0.01 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1oul h ARG 14 Cb 0.40 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1oul h ARG 14 CO -0.07 0.19 0.02 0.00 -1.51 0.00 0.00 179.97 178.59 1oul h ALA 15 N 1.30 0.06 -0.65 2.80 0.00 -1.00 -0.66 119.26 121.10 1oul h ALA 15 Ca 0.21 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1oul h ALA 15 Cb 0.22 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1oul h ALA 15 CO -0.23 -0.33 0.30 -0.92 0.00 0.00 0.00 179.25 178.08 1oul h TYR 16 N -0.11 0.92 -0.29 0.00 3.20 -0.95 -0.18 116.97 119.55 1oul h TYR 16 Ca 0.02 -0.04 0.02 0.00 3.14 0.00 0.00 58.73 61.87 1oul h TYR 16 Cb 0.21 -0.29 -0.03 0.00 1.54 0.00 0.00 36.73 38.16 1oul h TYR 16 CO -0.01 0.68 0.13 -0.92 -1.64 0.00 0.00 178.16 176.40 1oul h TYR 17 N 0.92 0.23 -0.43 -3.82 3.20 -0.32 -0.79 116.97 115.97 1oul h TYR 17 Ca 0.23 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.05 1oul h TYR 17 Cb 0.11 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.29 1oul h TYR 17 CO 0.01 0.12 0.03 -0.44 -1.64 0.00 0.00 178.16 176.25 1oul h ASP 18 N 0.27 0.63 -0.44 -2.11 3.32 -0.36 -2.26 116.42 115.47 1oul h ASP 18 Ca 0.12 -0.13 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 1oul h ASP 18 Cb 0.06 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 1oul h ASP 18 CO -0.10 0.68 0.13 -0.25 -1.72 0.00 0.00 179.24 177.98 1oul h TRP 19 N 0.64 0.72 0.10 4.55 7.01 -0.41 -0.68 115.95 127.87 1oul h TRP 19 Ca 0.14 -0.08 -0.00 0.00 2.11 0.00 0.00 58.89 61.05 1oul h TRP 19 Cb 0.35 -0.21 0.00 0.00 -2.10 0.00 0.00 29.16 27.21 1oul h TRP 19 CO 0.02 0.66 -0.05 -0.07 -2.79 0.00 0.00 178.44 176.21 1oul h LEU 20 N 0.58 -0.11 -0.30 0.65 3.38 -0.94 -2.33 115.31 116.23 1oul h LEU 20 Ca 0.14 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1oul h LEU 20 Cb 0.28 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1oul h LEU 20 CO -0.00 -0.02 0.16 0.58 0.09 0.00 0.00 178.44 179.25 1oul h VAL 21 N -0.19 1.13 0.00 1.22 2.07 -1.38 0.18 116.25 119.27 1oul h VAL 21 Ca -0.01 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1oul h VAL 21 Cb 0.16 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 1oul h VAL 21 CO 0.02 0.13 0.00 0.44 0.02 0.00 0.00 177.57 178.19 1oul h ASP 22 N 0.36 0.00 -0.50 0.57 3.32 -1.08 -1.64 116.42 117.44 1oul h ASP 22 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1oul h ASP 22 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 1oul h ASP 22 CO -0.02 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.09 1oul n ASN 23 N -2.45 3.66 -1.91 6.45 3.02 -0.68 -4.97 115.26 118.37 1oul n ASN 23 Ca -0.01 -2.19 -0.14 0.00 -0.03 0.00 0.00 54.58 52.22 1oul n ASN 23 Cb 0.12 -0.40 0.02 0.00 -0.61 0.00 0.00 39.78 38.91 1oul n ASN 23 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1oul n SER 24 N 0.84 -4.36 -4.76 6.41 7.64 -0.62 -5.03 113.62 113.75 1oul n SER 24 Ca 0.19 -0.16 -0.24 0.00 1.01 0.00 0.00 58.87 59.66 1oul n SER 24 Cb 0.62 -3.26 -0.06 0.00 -1.01 0.00 0.00 64.21 60.50 1oul n SER 24 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1oul s PHE 25 N -2.91 3.01 -0.46 1.43 2.99 -0.04 -5.03 117.98 116.98 1oul s PHE 25 Ca 0.17 -0.10 -0.16 0.00 0.00 0.00 0.00 56.93 56.85 1oul s PHE 25 Cb -0.08 -1.40 0.06 0.00 0.00 0.00 0.00 43.02 41.61 1oul s PHE 25 CO 0.21 0.53 0.39 0.99 -0.00 0.00 0.00 175.22 177.35 1oul s THR 26 N -1.96 5.23 -0.01 0.64 2.01 -1.26 -4.18 115.64 116.11 1oul s THR 26 Ca 0.31 -0.99 -0.30 0.00 0.31 0.00 0.00 61.69 61.02 1oul s THR 26 Cb -0.09 -4.10 -0.08 0.00 0.01 0.00 0.00 72.50 68.24 1oul s THR 26 CO 0.22 -0.55 1.94 -2.84 -0.69 0.00 0.00 174.62 172.71 1oul s PRO 27 N 1.67 4.03 -0.08 4.92 0.02 -1.26 -2.32 135.00 141.98 1oul s PRO 27 Ca 0.04 2.47 0.03 0.00 0.02 0.00 0.00 61.00 63.56 1oul s PRO 27 Cb -0.23 -4.16 -0.02 0.00 0.02 0.00 0.00 34.50 30.11 1oul s PRO 27 CO 0.07 -1.08 -0.16 0.71 -0.33 0.00 0.00 177.00 176.22 1oul s TYR 28 N 4.84 2.69 -0.13 6.54 1.51 -0.22 -0.00 117.35 132.57 1oul s TYR 28 Ca 0.87 -0.44 -0.01 0.00 -1.01 0.00 0.00 57.07 56.49 1oul s TYR 28 Cb -0.40 -1.70 -0.02 0.00 -0.11 0.00 0.00 41.96 39.73 1oul s TYR 28 CO 0.39 -0.03 -0.12 -1.17 -1.11 0.00 0.00 175.55 173.51 1oul s LEU 29 N -0.23 2.80 -0.26 -1.29 2.96 0.12 -1.37 118.68 121.41 1oul s LEU 29 Ca 0.00 -0.29 -0.11 0.00 -0.22 0.00 0.00 54.13 53.51 1oul s LEU 29 Cb -0.13 -1.64 -0.05 0.00 0.50 0.00 0.00 46.19 44.87 1oul s LEU 29 CO 0.03 0.17 0.19 -0.69 -1.32 0.00 0.00 176.35 174.73 1oul s VAL 30 N 0.31 5.32 0.04 1.68 1.01 0.35 -1.03 120.40 128.08 1oul s VAL 30 Ca -0.09 0.21 0.09 0.00 0.00 0.00 0.00 61.98 62.18 1oul s VAL 30 Cb -0.15 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 1oul s VAL 30 CO 0.05 0.29 -0.25 -0.69 0.00 0.00 0.00 175.10 174.51 1oul s VAL 31 N 1.43 2.28 -0.59 2.92 1.01 -0.53 -0.32 120.40 126.60 1oul s VAL 31 Ca 0.08 -1.33 -0.21 0.00 0.00 0.00 0.00 61.98 60.52 1oul s VAL 31 Cb -0.15 -1.90 0.07 0.00 0.00 0.00 0.00 36.38 34.41 1oul s VAL 31 CO 0.08 0.38 0.81 -0.62 0.00 0.00 0.00 175.10 175.75 1oul s ASP 32 N -1.24 6.21 0.00 3.32 3.68 -0.29 -2.09 116.67 126.26 1oul s ASP 32 Ca 0.12 -1.03 0.12 0.00 2.13 0.00 0.00 52.55 53.89 1oul s ASP 32 Cb -0.10 -2.36 0.51 0.00 -1.45 0.00 0.00 42.92 39.52 1oul s ASP 32 CO 0.02 -1.21 1.37 0.00 0.13 0.00 0.00 175.17 175.49 1oul n ALA 33 N 6.95 1.56 -0.03 3.66 0.00 -1.19 -2.66 120.51 128.80 1oul n ALA 33 Ca -0.05 -0.04 -0.15 0.00 0.00 0.00 0.00 53.44 53.20 1oul n ALA 33 Cb 0.45 -1.19 -0.11 0.00 0.00 0.00 0.00 19.45 18.60 1oul n ALA 33 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1oul h THR 34 N 0.00 1.51 -0.69 0.00 2.02 -1.90 -3.45 112.91 110.40 1oul h THR 34 Ca 0.00 -1.82 -0.56 0.00 0.77 0.00 0.00 66.41 64.80 1oul h THR 34 Cb 0.19 2.62 0.03 0.00 -1.74 0.00 0.00 68.15 69.25 1oul h THR 34 CO 0.00 0.50 0.16 0.00 0.37 0.00 0.00 175.52 176.55 1oul n TYR 35 N -4.53 0.65 -1.64 3.16 9.36 -1.09 -4.78 117.16 118.30 1oul n TYR 35 Ca -0.09 0.75 -0.50 0.00 3.32 0.00 0.00 57.90 61.38 1oul n TYR 35 Cb 0.47 -1.46 -0.05 0.00 -0.63 0.00 0.00 39.34 37.67 1oul n TYR 35 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 1oul n LEU 36 N 1.50 2.41 0.00 2.98 4.77 -1.26 -2.13 117.00 125.27 1oul n LEU 36 Ca 0.16 1.09 0.00 0.00 -0.03 0.00 0.00 56.01 57.23 1oul n LEU 36 Cb 0.03 -1.30 0.00 0.00 -2.33 0.00 0.00 43.42 39.82 1oul n LEU 36 CO 0.47 -0.63 0.00 0.61 -1.33 0.00 0.00 177.39 176.52 1oul n GLY 37 N 3.12 0.53 3.73 -0.72 0.00 -1.26 -4.81 105.19 105.79 1oul n GLY 37 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1oul n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oul s VAL 38 N -2.15 3.25 -0.33 1.61 1.01 -0.91 -4.64 120.40 118.24 1oul s VAL 38 Ca 0.00 0.99 0.02 0.00 0.00 0.00 0.00 61.98 62.99 1oul s VAL 38 Cb 0.00 -3.63 0.10 0.00 0.00 0.00 0.00 36.38 32.85 1oul s VAL 38 CO 0.00 0.13 0.08 0.21 0.00 0.00 0.00 175.10 175.52 1oul s ASN 39 N 0.54 4.40 0.09 3.32 3.04 -0.11 -5.01 114.94 121.20 1oul s ASN 39 Ca 0.59 -1.96 -0.03 0.00 0.04 0.00 0.00 52.86 51.49 1oul s ASN 39 Cb -0.36 -1.27 -0.03 0.00 -1.54 0.00 0.00 41.25 38.04 1oul s ASN 39 CO 0.36 -0.39 0.06 0.68 -3.04 0.00 0.00 177.10 174.78 1oul s VAL 40 N 1.17 0.16 -0.51 -5.21 -7.23 -1.26 -2.13 120.40 105.39 1oul s VAL 40 Ca 0.11 -1.68 -0.27 0.00 -1.81 0.00 0.00 61.98 58.33 1oul s VAL 40 Cb -0.19 -1.65 -0.08 0.00 0.56 0.00 0.00 36.38 35.02 1oul s VAL 40 CO -0.15 -0.73 2.43 -2.65 -0.31 0.00 0.00 175.10 173.68 1oul n PRO 41 N -0.00 1.01 0.19 4.82 -0.02 -1.26 -4.80 135.00 134.94 1oul n PRO 41 Ca -0.11 0.04 0.17 0.00 -2.02 0.00 0.00 63.50 61.58 1oul n PRO 41 Cb 0.62 -3.25 0.70 0.00 -0.02 0.00 0.00 33.50 31.55 1oul n PRO 41 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1oul h VAL 42 N 7.68 0.17 -0.11 -1.45 2.07 -1.98 0.05 116.25 122.68 1oul h VAL 42 Ca -0.24 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.28 1oul h VAL 42 Cb 1.27 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1oul h VAL 42 CO 1.16 0.00 0.00 -1.84 0.02 0.00 0.00 177.57 176.91 1oul n GLU 43 N -3.26 1.66 -0.13 1.57 0.00 -1.26 -3.41 120.64 115.81 1oul n GLU 43 Ca 0.04 -0.98 0.04 0.00 0.00 0.00 0.00 57.16 56.26 1oul n GLU 43 Cb 0.61 -1.42 0.11 0.00 0.00 0.00 0.00 31.44 30.74 1oul n GLU 43 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1oul n TYR 44 N 0.20 0.33 -3.39 -1.84 4.02 0.00 -4.98 117.16 111.51 1oul n TYR 44 Ca 0.17 -0.53 -0.38 0.00 -0.01 0.00 0.00 57.90 57.15 1oul n TYR 44 Cb 0.32 -0.05 -0.06 0.00 -0.02 0.00 0.00 39.34 39.53 1oul n TYR 44 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1oul s VAL 45 N -1.14 4.97 -0.08 -0.72 1.01 -1.22 -4.79 120.40 118.44 1oul s VAL 45 Ca 0.17 0.99 0.00 0.00 0.00 0.00 0.00 61.98 63.14 1oul s VAL 45 Cb 0.10 -3.80 0.02 0.00 0.00 0.00 0.00 36.38 32.70 1oul s VAL 45 CO 0.10 0.51 -0.06 -0.54 0.00 0.00 0.00 175.10 175.11 1oul s LYS 46 N -0.70 1.21 -1.46 2.72 1.02 0.19 -4.78 119.74 117.95 1oul s LYS 46 Ca 0.26 -0.18 -0.09 0.00 0.02 0.00 0.00 55.97 55.98 1oul s LYS 46 Cb -0.17 -1.24 0.04 0.00 -0.52 0.00 0.00 37.83 35.94 1oul s LYS 46 CO 0.14 -0.16 0.89 -0.25 -0.92 0.00 0.00 175.35 175.05 1oul n ASP 47 N 4.50 -5.58 -3.54 2.83 10.43 -1.26 -1.90 116.55 122.04 1oul n ASP 47 Ca -0.17 -0.52 -0.19 0.00 2.57 0.00 0.00 54.79 56.48 1oul n ASP 47 Cb 0.51 -4.46 0.06 0.00 1.84 0.00 0.00 41.12 39.07 1oul n ASP 47 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1oul n GLY 48 N -1.69 -0.45 3.57 0.44 0.00 -1.26 -4.99 105.19 100.81 1oul n GLY 48 Ca -0.02 0.18 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 1oul n GLY 48 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1oul s GLN 49 N -5.55 0.74 -0.08 1.61 0.74 -0.80 -3.18 119.66 113.15 1oul s GLN 49 Ca 0.08 0.30 -0.07 0.00 0.05 0.00 0.00 55.36 55.72 1oul s GLN 49 Cb -0.02 0.35 0.02 0.00 1.10 0.00 0.00 33.01 34.47 1oul s GLN 49 CO 0.77 -0.20 0.20 -1.50 -0.55 0.00 0.00 175.29 174.01 1oul s ILE 50 N -0.84 -0.00 -0.15 -2.34 2.07 -0.89 -0.64 121.20 118.41 1oul s ILE 50 Ca -0.04 0.01 -0.06 0.00 -1.41 0.00 0.00 60.65 59.16 1oul s ILE 50 Cb -0.01 -0.29 -0.04 0.00 0.13 0.00 0.00 42.46 42.25 1oul s ILE 50 CO 0.03 0.01 0.06 -0.69 -1.91 0.00 0.00 174.94 172.43 1oul s VAL 51 N 0.21 4.77 0.10 4.00 1.01 -1.26 -1.45 120.40 127.78 1oul s VAL 51 Ca -0.01 -0.05 0.08 0.00 0.00 0.00 0.00 61.98 62.00 1oul s VAL 51 Cb -0.02 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.22 1oul s VAL 51 CO -0.00 0.52 -0.21 -0.76 0.00 0.00 0.00 175.10 174.65 1oul s LEU 52 N -0.15 2.29 -0.27 3.92 1.43 -0.20 -4.95 118.68 120.76 1oul s LEU 52 Ca 0.07 -0.68 -0.16 0.00 -1.03 0.00 0.00 54.13 52.34 1oul s LEU 52 Cb -0.12 -0.91 -0.03 0.00 0.03 0.00 0.00 46.19 45.16 1oul s LEU 52 CO 0.01 0.07 0.41 0.21 0.23 0.00 0.00 176.35 177.29 1oul s ASN 53 N -1.86 6.30 0.00 2.29 3.84 -1.26 -0.70 114.94 123.55 1oul s ASN 53 Ca 0.07 0.34 0.14 0.00 0.21 0.00 0.00 52.86 53.62 1oul s ASN 53 Cb -0.10 -2.23 0.38 0.00 -0.55 0.00 0.00 41.25 38.76 1oul s ASN 53 CO 0.04 -0.21 1.31 0.18 -2.79 0.00 0.00 177.10 175.63 1oul n LEU 54 N 5.39 3.16 -4.40 3.21 4.77 0.99 -4.64 117.00 125.48 1oul n LEU 54 Ca -0.07 -1.96 -0.29 0.00 -0.03 0.00 0.00 56.01 53.66 1oul n LEU 54 Cb 0.50 -0.29 0.24 0.00 -2.33 0.00 0.00 43.42 41.55 1oul n LEU 54 CO 0.38 0.78 0.18 -1.54 -1.33 0.00 0.00 177.39 175.87 1oul n SER 55 N 0.82 -2.06 -0.19 -1.43 3.41 -1.24 -4.75 113.62 108.17 1oul n SER 55 Ca 0.15 -0.20 -0.08 0.00 -0.26 0.00 0.00 58.87 58.49 1oul n SER 55 Cb 0.47 -1.16 0.02 0.00 -0.26 0.00 0.00 64.21 63.29 1oul n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1oul h ALA 56 N -2.58 0.71 0.00 7.33 0.00 -1.95 -2.73 119.26 120.04 1oul h ALA 56 Ca -0.61 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.15 1oul h ALA 56 Cb 1.35 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1oul h ALA 56 CO 0.46 0.32 0.00 0.66 0.00 0.00 0.00 179.25 180.69 1oul h SER 57 N 0.75 0.00 -0.03 0.00 4.64 -1.99 -2.98 113.55 113.94 1oul h SER 57 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1oul h SER 57 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1oul h SER 57 CO -0.02 0.00 -0.00 0.00 -0.87 0.00 0.00 176.83 175.94 1oul n ALA 58 N -1.86 2.47 -2.19 5.18 0.00 -1.05 -4.98 120.51 118.08 1oul n ALA 58 Ca 0.03 -0.69 -0.11 0.00 0.00 0.00 0.00 53.44 52.66 1oul n ALA 58 Cb 0.30 -0.80 -0.10 0.00 0.00 0.00 0.00 19.45 18.84 1oul n ALA 58 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1oul s THR 59 N -1.99 0.81 -0.06 0.00 -4.23 -1.09 -4.64 115.64 104.44 1oul s THR 59 Ca 0.28 -1.97 -0.00 0.00 -1.18 0.00 0.00 61.69 58.82 1oul s THR 59 Cb 0.20 -1.73 0.02 0.00 1.34 0.00 0.00 72.50 72.33 1oul s THR 59 CO 0.30 -0.84 -0.02 -0.83 -0.54 0.00 0.00 174.62 172.69 1oul s GLY 60 N -3.08 0.46 -1.32 3.99 0.00 -0.36 -4.85 107.32 102.17 1oul s GLY 60 Ca 0.13 -0.09 -0.05 0.00 0.00 0.00 0.00 44.72 44.71 1oul s GLY 60 CO -0.03 0.76 1.01 0.70 0.00 0.00 0.00 173.10 175.53 1oul n ASN 61 N 4.55 -3.73 -4.73 1.64 3.02 -1.26 -1.19 115.26 113.56 1oul n ASN 61 Ca -0.17 -0.65 -0.42 0.00 -0.03 0.00 0.00 54.58 53.31 1oul n ASN 61 Cb 0.50 -4.73 -0.03 0.00 -0.61 0.00 0.00 39.78 34.92 1oul n ASN 61 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1oul s LEU 62 N -6.87 4.37 -0.22 3.41 2.96 -1.26 -4.38 118.68 116.69 1oul s LEU 62 Ca 0.29 2.68 0.00 0.00 -0.22 0.00 0.00 54.13 56.89 1oul s LEU 62 Cb -0.14 -3.60 0.05 0.00 0.50 0.00 0.00 46.19 43.01 1oul s LEU 62 CO 0.76 -0.83 -0.06 -1.10 -1.32 0.00 0.00 176.35 173.80 1oul s GLN 63 N 0.74 1.65 -0.93 1.98 -0.21 0.22 -4.98 119.66 118.13 1oul s GLN 63 Ca 0.68 -0.87 -0.08 0.00 0.02 0.00 0.00 55.36 55.11 1oul s GLN 63 Cb -0.44 -2.45 0.24 0.00 1.00 0.00 0.00 33.01 31.35 1oul s GLN 63 CO 0.35 -0.54 0.86 -0.51 -2.12 0.00 0.00 175.29 173.33 1oul s LEU 64 N 1.45 6.17 0.39 2.90 1.43 -1.26 -1.23 118.68 128.53 1oul s LEU 64 Ca -0.04 -3.28 -0.02 0.00 -1.03 0.00 0.00 54.13 49.76 1oul s LEU 64 Cb -0.18 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.90 1oul s LEU 64 CO -0.07 -0.36 0.64 -0.89 0.23 0.00 0.00 176.35 175.90 1oul s THR 65 N -0.74 5.03 0.41 5.49 2.01 0.41 -4.99 115.64 123.26 1oul s THR 65 Ca 0.25 -0.19 0.08 0.00 0.31 0.00 0.00 61.69 62.13 1oul s THR 65 Cb -0.11 -3.86 0.27 0.00 0.01 0.00 0.00 72.50 68.82 1oul s THR 65 CO -0.09 -0.65 2.06 0.78 -0.69 0.00 0.00 174.62 176.03 1oul h ASN 66 N 0.61 0.45 0.24 3.53 4.21 -1.96 -3.09 115.58 119.57 1oul h ASN 66 Ca -0.49 -0.01 -0.26 0.00 1.21 0.00 0.00 56.30 56.76 1oul h ASN 66 Cb 1.21 -0.11 -0.05 0.00 -1.12 0.00 0.00 38.32 38.25 1oul h ASN 66 CO 0.62 0.32 -2.00 0.47 -1.29 0.00 0.00 177.43 175.55 1oul n ASP 67 N -4.48 0.34 -3.61 5.81 8.00 -1.26 -4.69 116.55 116.66 1oul n ASP 67 Ca 0.03 0.16 -0.09 0.00 0.71 0.00 0.00 54.79 55.60 1oul n ASP 67 Cb 0.08 0.77 -0.02 0.00 -0.02 0.00 0.00 41.12 41.93 1oul n ASP 67 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1oul s PHE 68 N -2.76 0.18 -0.01 1.24 -0.12 -1.17 -4.57 117.98 110.78 1oul s PHE 68 Ca -0.07 -0.64 0.06 0.00 -0.05 0.00 0.00 56.93 56.23 1oul s PHE 68 Cb 0.08 0.51 -0.02 0.00 -0.63 0.00 0.00 43.02 42.96 1oul s PHE 68 CO 0.84 -1.24 -0.20 0.42 -0.05 0.00 0.00 175.22 174.98 1oul s ILE 69 N -3.47 1.60 -0.11 -4.49 1.01 0.79 -0.45 121.20 116.10 1oul s ILE 69 Ca 0.17 -0.91 -0.17 0.00 0.00 0.00 0.00 60.65 59.75 1oul s ILE 69 Cb -0.04 -1.34 0.04 0.00 0.01 0.00 0.00 42.46 41.13 1oul s ILE 69 CO 0.10 0.42 0.42 -1.58 0.00 0.00 0.00 174.94 174.30 1oul s GLN 70 N -0.57 0.62 0.01 2.79 0.74 -0.37 -0.05 119.66 122.83 1oul s GLN 70 Ca 0.08 0.33 -0.28 0.00 0.05 0.00 0.00 55.36 55.53 1oul s GLN 70 Cb -0.08 0.29 0.10 0.00 1.10 0.00 0.00 33.01 34.42 1oul s GLN 70 CO -0.00 -0.13 1.24 -0.59 -0.55 0.00 0.00 175.29 175.26 1oul s PHE 71 N -0.39 -0.00 -0.09 1.67 -0.12 -1.01 0.73 117.98 118.77 1oul s PHE 71 Ca -0.05 -0.15 0.01 0.00 -0.05 0.00 0.00 56.93 56.69 1oul s PHE 71 Cb -0.03 0.57 -0.02 0.00 -0.63 0.00 0.00 43.02 42.91 1oul s PHE 71 CO 0.03 -0.37 -0.12 -0.80 -0.05 0.00 0.00 175.22 173.90 1oul s ASN 72 N -3.37 4.14 0.02 1.98 -0.87 -0.34 -0.61 114.94 115.89 1oul s ASN 72 Ca 0.21 -0.22 -0.07 0.00 -1.57 0.00 0.00 52.86 51.21 1oul s ASN 72 Cb 0.02 -1.22 -0.00 0.00 -0.02 0.00 0.00 41.25 40.02 1oul s ASN 72 CO -0.01 0.27 0.14 0.00 -2.57 0.00 0.00 177.10 174.93 1oul s ALA 73 N -0.28 -0.26 -0.19 0.60 0.00 0.14 -1.22 121.76 120.54 1oul s ALA 73 Ca 0.02 -0.27 -0.07 0.00 0.00 0.00 0.00 51.96 51.65 1oul s ALA 73 Cb -0.13 0.18 -0.03 0.00 0.00 0.00 0.00 23.12 23.14 1oul s ALA 73 CO 0.03 -0.26 0.04 1.03 0.00 0.00 0.00 175.76 176.59 1oul s ARG 74 N -1.92 3.82 -0.37 0.00 0.52 -1.26 0.16 118.95 119.90 1oul s ARG 74 Ca -0.11 -0.42 -0.02 0.00 -0.52 0.00 0.00 55.73 54.66 1oul s ARG 74 Cb -0.05 -3.17 0.09 0.00 0.52 0.00 0.00 34.95 32.34 1oul s ARG 74 CO -0.01 0.14 0.14 -0.06 0.02 0.00 0.00 175.30 175.53 1oul s PHE 75 N 0.71 3.50 -1.21 -0.53 0.40 -0.78 -4.68 117.98 115.39 1oul s PHE 75 Ca 0.02 -2.26 -0.02 0.00 -0.60 0.00 0.00 56.93 54.07 1oul s PHE 75 Cb -0.14 -2.87 -0.01 0.00 0.51 0.00 0.00 43.02 40.51 1oul s PHE 75 CO 0.02 -0.92 0.88 1.63 0.70 0.00 0.00 175.22 177.53 1oul n LYS 76 N 4.59 -5.13 0.00 0.44 5.02 -1.26 -2.49 118.16 119.33 1oul n LYS 76 Ca -0.05 0.76 0.00 0.00 -2.02 0.00 0.00 58.31 56.99 1oul n LYS 76 Cb 0.42 -5.54 0.00 0.00 -0.02 0.00 0.00 35.03 29.89 1oul n LYS 76 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1oul n GLY 77 N -1.32 1.49 3.55 0.72 0.00 -1.26 -4.94 105.19 103.44 1oul n GLY 77 Ca -0.25 -0.12 -0.35 0.00 0.00 0.00 0.00 46.02 45.30 1oul n GLY 77 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oul s VAL 78 N -0.08 3.16 0.02 1.61 1.01 -1.04 -4.93 120.40 120.16 1oul s VAL 78 Ca 0.00 0.06 -0.30 0.00 0.00 0.00 0.00 61.98 61.74 1oul s VAL 78 Cb 0.00 -3.43 -0.06 0.00 0.00 0.00 0.00 36.38 32.89 1oul s VAL 78 CO 0.00 -0.41 1.46 -0.55 0.00 0.00 0.00 175.10 175.60 1oul s SER 79 N 10.33 6.79 0.14 3.32 0.15 -1.26 -1.86 113.70 131.30 1oul s SER 79 Ca 0.84 2.21 0.04 0.00 0.70 0.00 0.00 55.95 59.74 1oul s SER 79 Cb -0.15 -2.56 -0.04 0.00 -1.71 0.00 0.00 66.02 61.56 1oul s SER 79 CO 0.22 -0.76 -0.09 -0.13 1.20 0.00 0.00 173.24 173.68 1oul s ARG 80 N 2.40 1.01 -0.06 5.44 0.52 0.12 -4.97 118.95 123.42 1oul s ARG 80 Ca 0.66 -1.43 0.04 0.00 -0.52 0.00 0.00 55.73 54.49 1oul s ARG 80 Cb -0.34 -0.50 -0.02 0.00 0.52 0.00 0.00 34.95 34.61 1oul s ARG 80 CO 0.28 0.04 -0.19 -2.00 0.02 0.00 0.00 175.30 173.45 1oul s GLU 81 N -3.78 2.60 0.07 3.54 2.12 -1.26 0.28 118.70 122.27 1oul s GLU 81 Ca 0.16 -0.79 0.07 0.00 0.36 0.00 0.00 54.97 54.77 1oul s GLU 81 Cb 0.03 -2.31 -0.04 0.00 0.26 0.00 0.00 34.13 32.08 1oul s GLU 81 CO -0.01 0.48 -0.12 -0.51 -0.54 0.00 0.00 175.26 174.56 1oul s LEU 82 N -0.38 2.92 -0.11 2.70 1.43 0.22 -4.85 118.68 120.60 1oul s LEU 82 Ca 0.04 -0.37 0.01 0.00 -1.03 0.00 0.00 54.13 52.77 1oul s LEU 82 Cb -0.12 -1.72 0.02 0.00 0.03 0.00 0.00 46.19 44.39 1oul s LEU 82 CO 0.02 0.21 -0.12 -0.47 0.23 0.00 0.00 176.35 176.22 1oul s TYR 83 N -1.10 1.79 -0.17 0.29 5.04 -0.90 -2.41 117.35 119.88 1oul s TYR 83 Ca 0.19 -0.89 -0.01 0.00 -2.44 0.00 0.00 57.07 53.92 1oul s TYR 83 Cb -0.11 -1.36 0.05 0.00 0.35 0.00 0.00 41.96 40.89 1oul s TYR 83 CO 0.10 -0.51 -0.03 0.42 -1.34 0.00 0.00 175.55 174.19 1oul s ILE 84 N 1.31 0.97 0.00 3.14 1.01 0.92 -0.94 121.20 127.61 1oul s ILE 84 Ca -0.01 -0.63 0.00 0.00 0.00 0.00 0.00 60.65 60.01 1oul s ILE 84 Cb -0.14 -1.24 0.00 0.00 0.01 0.00 0.00 42.46 41.10 1oul s ILE 84 CO -0.05 0.03 0.00 -2.65 0.00 0.00 0.00 174.94 172.26 1oul n PRO 85 N 4.91 2.80 0.00 2.79 -0.02 -1.26 -0.14 135.00 144.07 1oul n PRO 85 Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.37 1oul n PRO 85 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.95 1oul n PRO 85 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1oul n GLY 87 N 0.49 0.00 0.13 -1.23 0.00 -1.26 -3.44 105.19 99.88 1oul n GLY 87 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1oul n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oul h ALA 88 N 0.00 0.60 -1.86 4.61 0.00 -1.91 -3.44 119.26 117.25 1oul h ALA 88 Ca 0.00 -0.04 -0.57 0.00 0.00 0.00 0.00 54.91 54.30 1oul h ALA 88 Cb 0.00 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1oul h ALA 88 CO 0.00 0.05 1.01 0.00 0.00 0.00 0.00 179.25 180.31 1oul s ALA 89 N -3.31 3.21 -0.07 0.00 0.00 -1.22 -1.14 121.76 119.22 1oul s ALA 89 Ca 0.01 -0.07 0.14 0.00 0.00 0.00 0.00 51.96 52.03 1oul s ALA 89 Cb 0.09 -3.86 -0.23 0.00 0.00 0.00 0.00 23.12 19.12 1oul s ALA 89 CO 0.77 -2.09 0.57 1.28 0.00 0.00 0.00 175.76 176.29 1oul n LEU 90 N 8.16 0.73 -3.54 0.00 4.77 0.57 -4.86 117.00 122.82 1oul n LEU 90 Ca 0.15 0.35 -0.07 0.00 -0.03 0.00 0.00 56.01 56.41 1oul n LEU 90 Cb 0.47 0.22 -0.02 0.00 -2.33 0.00 0.00 43.42 41.77 1oul n LEU 90 CO 0.67 0.40 0.75 0.00 -1.33 0.00 0.00 177.39 177.88 1oul s ALA 91 N -2.59 -1.85 -0.01 -1.18 0.00 -1.11 -1.75 121.76 113.26 1oul s ALA 91 Ca -0.05 1.00 -0.00 0.00 0.00 0.00 0.00 51.96 52.90 1oul s ALA 91 Cb 0.08 0.36 0.02 0.00 0.00 0.00 0.00 23.12 23.58 1oul s ALA 91 CO 0.83 -0.72 0.03 -1.50 0.00 0.00 0.00 175.76 174.39 1oul s ILE 92 N -3.02 -0.04 0.29 0.00 2.07 -0.97 -0.50 121.20 119.04 1oul s ILE 92 Ca 0.07 0.13 -0.08 0.00 -1.41 0.00 0.00 60.65 59.36 1oul s ILE 92 Cb -0.01 -0.06 0.00 0.00 0.13 0.00 0.00 42.46 42.52 1oul s ILE 92 CO -0.07 0.05 0.48 -0.72 -1.91 0.00 0.00 174.94 172.77 1oul s TYR 93 N 0.66 0.67 -0.21 3.50 -0.85 -0.48 -1.28 117.35 119.37 1oul s TYR 93 Ca -0.05 -1.00 -0.16 0.00 -0.52 0.00 0.00 57.07 55.34 1oul s TYR 93 Cb -0.08 0.08 -0.04 0.00 0.38 0.00 0.00 41.96 42.31 1oul s TYR 93 CO -0.02 -1.07 0.41 0.00 -1.52 0.00 0.00 175.55 173.34 1oul s ALA 94 N -3.50 3.56 0.26 9.51 0.00 -0.72 -1.06 121.76 129.81 1oul s ALA 94 Ca 0.26 -0.57 -0.04 0.00 0.00 0.00 0.00 51.96 51.62 1oul s ALA 94 Cb -0.00 -2.66 0.34 0.00 0.00 0.00 0.00 23.12 20.79 1oul s ALA 94 CO 0.14 -0.38 1.90 -0.09 0.00 0.00 0.00 175.76 177.33 1oul h ARG 95 N 7.52 1.21 -0.04 0.00 2.43 -1.81 0.59 114.38 124.29 1oul h ARG 95 Ca -0.35 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 58.75 1oul h ARG 95 Cb 1.16 -0.27 0.00 0.00 -0.42 0.00 0.00 29.97 30.44 1oul h ARG 95 CO 0.71 0.80 0.00 0.39 -1.51 0.00 0.00 179.97 180.36 1oul n GLU 96 N -4.46 0.34 0.00 0.20 4.71 -1.26 -3.79 120.64 116.38 1oul n GLU 96 Ca 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.29 1oul n GLU 96 Cb 0.11 -1.02 0.00 0.00 -1.01 0.00 0.00 31.44 29.52 1oul n GLU 96 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 1oul n ASN 97 N -0.41 0.00 -1.37 1.62 2.04 -1.01 -5.00 115.26 111.14 1oul n ASN 97 Ca 0.00 -0.25 -0.16 0.00 -0.44 0.00 0.00 54.58 53.73 1oul n ASN 97 Cb 0.01 0.00 -0.06 0.00 -2.53 0.00 0.00 39.78 37.20 1oul n ASN 97 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1oul n GLY 98 N 0.00 1.25 3.42 4.83 0.00 0.17 -4.98 105.19 109.87 1oul n GLY 98 Ca 0.00 -0.24 -0.35 0.00 0.00 0.00 0.00 46.02 45.43 1oul n GLY 98 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1oul s ASP 99 N -2.72 4.72 0.00 1.61 -0.00 -1.24 -4.87 116.67 114.17 1oul s ASP 99 Ca 0.00 -0.24 0.00 0.00 -0.00 0.00 0.00 52.55 52.31 1oul s ASP 99 Cb 0.00 -1.81 0.00 0.00 -0.00 0.00 0.00 42.92 41.11 1oul s ASP 99 CO 0.00 0.05 0.00 0.61 -0.00 0.00 0.00 175.17 175.83 1oul n GLY 100 N 4.36 2.95 0.00 0.21 0.00 -1.26 -1.75 105.19 109.71 1oul n GLY 100 Ca -0.17 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1oul n GLY 100 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1oul n VAL 101 N 0.00 0.00 -4.51 1.61 0.24 -0.40 -4.98 118.33 110.29 1oul n VAL 101 Ca 0.00 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 62.07 1oul n VAL 101 Cb 0.00 0.00 -0.14 0.00 -1.47 0.00 0.00 33.84 32.23 1oul n VAL 101 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1oul s PHE 103 N 0.36 1.47 0.47 6.34 2.99 -0.72 -2.30 117.98 126.60 1oul s PHE 103 Ca 0.00 -0.35 -0.21 0.00 0.00 0.00 0.00 56.93 56.37 1oul s PHE 103 Cb 0.00 -0.88 -0.08 0.00 0.00 0.00 0.00 43.02 42.05 1oul s PHE 103 CO 0.00 0.05 1.05 -2.00 -0.00 0.00 0.00 175.22 174.32 1oul s GLU 104 N -1.05 3.84 0.45 0.44 2.56 -1.26 -4.99 118.70 118.69 1oul s GLU 104 Ca 0.04 1.42 -0.23 0.00 0.00 0.00 0.00 54.97 56.20 1oul s GLU 104 Cb -0.08 -2.18 -0.08 0.00 2.00 0.00 0.00 34.13 33.80 1oul s GLU 104 CO 0.01 -0.41 1.16 -2.14 -0.56 0.00 0.00 175.26 173.32 1oul s PRO 105 N -3.09 3.79 -0.09 4.30 0.02 -1.26 -5.02 135.00 133.66 1oul s PRO 105 Ca 0.66 1.76 0.01 0.00 0.02 0.00 0.00 61.00 63.45 1oul s PRO 105 Cb -0.18 -2.42 0.02 0.00 0.02 0.00 0.00 34.50 31.93 1oul s PRO 105 CO 0.22 -0.52 -0.12 -1.21 -0.33 0.00 0.00 177.00 175.04 1oul s GLU 106 N -2.67 1.82 0.26 5.54 2.02 -1.26 -5.05 118.70 119.35 1oul s GLU 106 Ca 0.63 -0.42 -0.05 0.00 0.02 0.00 0.00 54.97 55.16 1oul s GLU 106 Cb -0.28 -1.62 0.48 0.00 0.10 0.00 0.00 34.13 32.81 1oul s GLU 106 CO 0.34 -0.09 1.38 0.39 0.02 0.00 0.00 175.26 177.31 1oul n GLU 107 N 4.27 -0.08 0.20 1.61 1.02 -1.26 -0.92 120.64 125.48 1oul n GLU 107 Ca -0.19 1.37 0.05 0.00 -0.02 0.00 0.00 57.16 58.37 1oul n GLU 107 Cb 0.51 -2.07 0.43 0.00 -0.02 0.00 0.00 31.44 30.28 1oul n GLU 107 CO 0.00 0.00 0.00 -0.84 1.18 0.00 0.00 177.13 177.47 1oul h ILE 108 N 0.00 1.09 -0.56 -3.67 -0.00 -1.98 -2.27 117.51 110.11 1oul h ILE 108 Ca 0.46 -1.14 -0.07 0.00 -0.00 0.00 0.00 64.86 64.11 1oul h ILE 108 Cb 0.77 1.64 -0.02 0.00 -0.00 0.00 0.00 36.82 39.21 1oul h ILE 108 CO -0.89 0.31 0.08 1.88 -0.00 0.00 0.00 178.15 179.54 1oul h TYR 109 N 0.00 0.95 -0.41 0.16 0.99 -1.44 -0.27 116.97 116.95 1oul h TYR 109 Ca -0.00 -0.11 -0.05 0.00 2.00 0.00 0.00 58.73 60.57 1oul h TYR 109 Cb 0.61 -0.27 -0.02 0.00 1.00 0.00 0.00 36.73 38.06 1oul h TYR 109 CO 0.00 0.82 0.07 -0.44 -0.00 0.00 0.00 178.16 178.61 1oul h ASP 110 N 0.85 0.64 -0.74 3.88 5.19 -1.40 -2.92 116.42 121.92 1oul h ASP 110 Ca 0.18 -0.25 0.01 0.00 -0.62 0.00 0.00 57.03 56.34 1oul h ASP 110 Cb 0.39 -0.17 -0.04 0.00 0.18 0.00 0.00 39.33 39.69 1oul h ASP 110 CO 0.01 0.73 0.48 -0.33 -3.12 0.00 0.00 179.24 177.01 1oul h GLU 111 N 0.52 0.98 0.00 3.56 5.08 -0.85 -1.11 114.58 122.76 1oul h GLU 111 Ca 0.12 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1oul h GLU 111 Cb 0.36 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1oul h GLU 111 CO 0.01 0.66 0.00 1.28 -1.00 0.00 0.00 179.01 179.95 1oul n LEU 112 N -4.56 0.00 -0.09 1.33 4.77 -0.17 -2.40 117.00 115.88 1oul n LEU 112 Ca 0.07 0.02 0.02 0.00 -0.03 0.00 0.00 56.01 56.09 1oul n LEU 112 Cb 0.02 -0.02 0.03 0.00 -2.33 0.00 0.00 43.42 41.12 1oul n LEU 112 CO 0.36 -0.01 0.52 -3.20 -1.33 0.00 0.00 177.39 173.74 1oul n ASN 113 N -1.02 2.17 -4.69 -1.43 5.15 -0.44 -4.78 115.26 110.22 1oul n ASN 113 Ca 0.13 -2.12 -0.42 0.00 -0.60 0.00 0.00 54.58 51.57 1oul n ASN 113 Cb 0.07 -0.08 -0.03 0.00 -0.53 0.00 0.00 39.78 39.22 1oul n ASN 113 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1oul s ILE 114 N -1.21 4.39 0.14 -1.44 1.01 -1.01 -4.88 121.20 118.20 1oul s ILE 114 Ca 0.06 1.70 -0.02 0.00 0.00 0.00 0.00 60.65 62.39 1oul s ILE 114 Cb 0.05 -4.09 -0.05 0.00 0.01 0.00 0.00 42.46 38.38 1oul s ILE 114 CO 0.02 0.00 0.33 -1.61 0.00 0.00 0.00 174.94 173.68 1oul s GLU 115 N 2.13 3.52 0.56 2.79 2.02 -1.26 -5.09 118.70 123.37 1oul s GLU 115 Ca 0.54 -0.31 -0.18 0.00 0.02 0.00 0.00 54.97 55.05 1oul s GLU 115 Cb -0.23 -2.91 -0.05 0.00 0.10 0.00 0.00 34.13 31.04 1oul s GLU 115 CO 0.21 0.49 1.07 -2.14 0.02 0.00 0.00 175.26 174.91 1oul s PRO 116 N -2.89 3.41 0.21 0.39 0.02 -1.26 -4.94 135.00 129.94 1oul s PRO 116 Ca 0.38 1.34 0.11 0.00 0.02 0.00 0.00 61.00 62.85 1oul s PRO 116 Cb -0.12 -2.04 0.04 0.00 0.02 0.00 0.00 34.50 32.41 1oul s PRO 116 CO 0.27 -0.75 1.42 -0.44 -0.33 0.00 0.00 177.00 177.17 1oul h ASP 117 N 0.85 0.00 -4.53 2.53 3.32 -2.06 -3.46 116.42 113.07 1oul h ASP 117 Ca -0.48 0.00 -0.31 0.00 0.02 0.00 0.00 57.03 56.26 1oul h ASP 117 Cb 1.23 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.63 1oul h ASP 117 CO 0.57 0.74 -0.65 0.42 -1.72 0.00 0.00 179.24 178.61 1oul s THR 118 N -3.00 0.63 0.79 0.35 -4.23 -1.26 -5.16 115.64 103.75 1oul s THR 118 Ca 0.01 -1.99 -0.11 0.00 -1.18 0.00 0.00 61.69 58.43 1oul s THR 118 Cb 0.10 -2.29 0.08 0.00 1.34 0.00 0.00 72.50 71.73 1oul s THR 118 CO 0.78 -0.31 1.14 -1.61 -0.54 0.00 0.00 174.62 174.07 1oul s GLU 119 N -3.96 1.96 0.70 3.99 2.02 -1.26 -5.07 118.70 117.08 1oul s GLU 119 Ca 0.29 -0.02 -0.09 0.00 0.02 0.00 0.00 54.97 55.16 1oul s GLU 119 Cb 0.07 -2.01 0.03 0.00 0.10 0.00 0.00 34.13 32.32 1oul s GLU 119 CO 0.07 -1.54 1.05 -0.65 0.02 0.00 0.00 175.26 174.22 1oul s GLN 120 N -5.50 2.59 0.16 1.61 -1.52 -1.26 -5.00 119.66 110.73 1oul s GLN 120 Ca 0.62 0.16 -0.31 0.00 -1.95 0.00 0.00 55.36 53.89 1oul s GLN 120 Cb -0.11 -2.09 -0.09 0.00 -0.22 0.00 0.00 33.01 30.51 1oul s GLN 120 CO 0.48 -1.10 1.39 -2.14 -0.25 0.00 0.00 175.29 173.66 1oul s PRO 121 N -5.30 4.33 0.00 2.91 0.02 -1.26 -5.30 135.00 130.40 1oul s PRO 121 Ca 0.58 2.11 0.00 0.00 0.02 0.00 0.00 61.00 63.71 1oul s PRO 121 Cb -0.11 -3.21 0.00 0.00 0.02 0.00 0.00 34.50 31.20 1oul s PRO 121 CO 0.48 -0.40 0.00 0.25 -0.33 0.00 0.00 177.00 177.01