#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uc6 s PRO 2 N 0.00 2.99 0.09 1.61 0.02 -1.26 -4.47 135.00 133.97 1uc6 s PRO 2 Ca 0.00 -0.72 0.00 0.00 0.02 0.00 0.00 61.00 60.30 1uc6 s PRO 2 Cb 0.00 -5.20 0.00 0.00 0.02 0.00 0.00 34.50 29.32 1uc6 s PRO 2 CO 0.00 -2.94 0.00 -0.11 -0.33 0.00 0.00 177.00 173.62 1uc6 n LEU 3 N 11.92 0.22 -2.69 -5.54 -0.00 -1.26 -4.95 117.00 114.69 1uc6 n LEU 3 Ca 0.38 0.15 -0.07 0.00 -0.00 0.00 0.00 56.01 56.47 1uc6 n LEU 3 Cb 0.48 0.02 0.06 0.00 -0.00 0.00 0.00 43.42 43.98 1uc6 n LEU 3 CO 0.63 -0.49 0.06 0.61 -0.00 0.00 0.00 177.39 178.21 1uc6 n GLY 4 N 2.39 1.53 0.32 -3.96 0.00 -1.26 -5.11 105.19 99.09 1uc6 n GLY 4 Ca 0.00 -0.96 -0.02 0.00 0.00 0.00 0.00 46.02 45.04 1uc6 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uc6 n SER 5 N -0.31 1.07 -0.07 1.61 3.41 -1.26 -5.07 113.62 113.00 1uc6 n SER 5 Ca 0.05 -1.16 -0.13 0.00 -0.26 0.00 0.00 58.87 57.38 1uc6 n SER 5 Cb 0.83 -0.01 -0.12 0.00 -0.26 0.00 0.00 64.21 64.65 1uc6 n SER 5 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1uc6 h VAL 6 N 0.47 1.64 -4.54 -3.33 2.07 -1.98 -3.50 116.25 107.08 1uc6 h VAL 6 Ca -0.03 -2.20 0.00 0.00 0.82 0.00 0.00 66.70 65.30 1uc6 h VAL 6 Cb 0.11 3.08 -0.02 0.00 -1.52 0.00 0.00 31.29 32.93 1uc6 h VAL 6 CO 0.04 0.55 -0.82 1.17 0.02 0.00 0.00 177.57 178.53 1uc6 n LYS 7 N -4.63 -2.75 -0.81 1.57 0.00 -1.26 -4.98 118.16 105.29 1uc6 n LYS 7 Ca -0.09 2.29 -0.31 0.00 0.00 0.00 0.00 58.31 60.20 1uc6 n LYS 7 Cb 0.43 -4.18 0.15 0.00 0.00 0.00 0.00 35.03 31.44 1uc6 n LYS 7 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 1uc6 s PRO 8 N -1.11 1.25 0.43 1.64 0.04 -1.26 -5.04 135.00 130.96 1uc6 s PRO 8 Ca -0.04 1.46 -0.02 0.00 0.04 0.00 0.00 61.00 62.43 1uc6 s PRO 8 Cb 0.00 -1.76 -0.02 0.00 0.04 0.00 0.00 34.50 32.76 1uc6 s PRO 8 CO 0.58 -2.44 0.68 0.34 0.04 0.00 0.00 177.00 176.20 1uc6 s ASP 9 N -2.83 6.11 0.17 6.66 2.15 -1.26 -4.99 116.67 122.68 1uc6 s ASP 9 Ca 0.66 0.57 -0.33 0.00 0.43 0.00 0.00 52.55 53.88 1uc6 s ASP 9 Cb -0.22 -1.94 -0.14 0.00 -0.30 0.00 0.00 42.92 40.33 1uc6 s ASP 9 CO 0.58 -0.55 1.57 -2.65 -0.17 0.00 0.00 175.17 173.95 1uc6 n PRO 10 N -2.07 2.19 -1.40 4.34 -0.02 -1.26 -4.47 135.00 132.30 1uc6 n PRO 10 Ca -0.01 0.79 -0.43 0.00 -2.02 0.00 0.00 63.50 61.83 1uc6 n PRO 10 Cb 0.56 -2.55 -0.00 0.00 -0.02 0.00 0.00 33.50 31.49 1uc6 n PRO 10 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1uc6 n PRO 11 N 3.32 0.31 -4.18 0.52 -0.04 -1.26 -4.38 135.00 129.29 1uc6 n PRO 11 Ca 0.16 0.11 -0.27 0.00 -0.04 0.00 0.00 63.50 63.46 1uc6 n PRO 11 Cb 0.29 -1.25 -0.08 0.00 -0.04 0.00 0.00 33.50 32.43 1uc6 n PRO 11 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1uc6 s GLU 12 N -1.26 2.47 -1.16 0.54 2.02 -0.66 -4.62 118.70 116.01 1uc6 s GLU 12 Ca 0.62 -1.03 -0.07 0.00 0.02 0.00 0.00 54.97 54.51 1uc6 s GLU 12 Cb -0.68 -2.42 0.01 0.00 0.10 0.00 0.00 34.13 31.14 1uc6 s GLU 12 CO 0.59 0.48 1.01 -1.71 0.02 0.00 0.00 175.26 175.65 1uc6 n ASN 13 N 0.03 -5.26 -4.56 -0.19 5.15 -1.26 0.00 115.26 109.17 1uc6 n ASN 13 Ca -0.10 -0.48 -0.42 0.00 -0.60 0.00 0.00 54.58 52.98 1uc6 n ASN 13 Cb 0.54 -4.47 -0.06 0.00 -0.53 0.00 0.00 39.78 35.26 1uc6 n ASN 13 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1uc6 s VAL 14 N -3.28 4.82 -0.15 3.44 1.01 -1.26 -3.56 120.40 121.42 1uc6 s VAL 14 Ca 0.44 0.53 -0.04 0.00 0.00 0.00 0.00 61.98 62.91 1uc6 s VAL 14 Cb -0.19 -4.15 0.07 0.00 0.00 0.00 0.00 36.38 32.11 1uc6 s VAL 14 CO 0.64 -0.44 0.24 0.68 0.00 0.00 0.00 175.10 176.22 1uc6 s VAL 15 N 2.87 -0.37 -0.23 2.92 -7.23 0.56 -5.00 120.40 113.91 1uc6 s VAL 15 Ca 0.26 0.18 -0.18 0.00 -1.81 0.00 0.00 61.98 60.42 1uc6 s VAL 15 Cb -0.14 -0.49 -0.03 0.00 0.56 0.00 0.00 36.38 36.28 1uc6 s VAL 15 CO 0.17 0.03 0.53 0.00 -0.31 0.00 0.00 175.10 175.52 1uc6 s ALA 16 N 2.38 3.57 -0.12 1.32 0.00 -1.26 -1.33 121.76 126.32 1uc6 s ALA 16 Ca 0.04 -0.49 0.02 0.00 0.00 0.00 0.00 51.96 51.52 1uc6 s ALA 16 Cb -0.13 -2.87 -0.00 0.00 0.00 0.00 0.00 23.12 20.12 1uc6 s ALA 16 CO -0.09 -0.61 -0.20 1.03 0.00 0.00 0.00 175.76 175.89 1uc6 s ARG 17 N 2.02 3.15 0.22 0.00 0.52 -0.05 -4.81 118.95 120.01 1uc6 s ARG 17 Ca 0.23 -0.81 -0.30 0.00 -0.52 0.00 0.00 55.73 54.33 1uc6 s ARG 17 Cb -0.15 -2.46 -0.09 0.00 0.52 0.00 0.00 34.95 32.77 1uc6 s ARG 17 CO 0.09 0.12 1.23 -2.14 0.02 0.00 0.00 175.30 174.63 1uc6 s PRO 18 N 0.52 4.46 -0.33 3.54 0.02 -1.26 0.80 135.00 142.75 1uc6 s PRO 18 Ca -0.12 1.96 -0.11 0.00 0.02 0.00 0.00 61.00 62.74 1uc6 s PRO 18 Cb -0.17 -3.20 -0.01 0.00 0.02 0.00 0.00 34.50 31.15 1uc6 s PRO 18 CO 0.05 -0.11 0.20 0.08 -0.33 0.00 0.00 177.00 176.89 1uc6 s VAL 19 N -0.27 4.95 -0.75 3.83 1.01 -0.37 -4.88 120.40 123.91 1uc6 s VAL 19 Ca 0.52 -0.35 0.15 0.00 0.00 0.00 0.00 61.98 62.31 1uc6 s VAL 19 Cb -0.35 -3.55 0.15 0.00 0.00 0.00 0.00 36.38 32.63 1uc6 s VAL 19 CO 0.40 0.00 1.48 -0.81 0.00 0.00 0.00 175.10 176.17 1uc6 n PRO 20 N 5.05 0.07 0.07 2.72 -0.04 -1.26 -2.03 135.00 139.58 1uc6 n PRO 20 Ca -0.13 0.39 0.12 0.00 -0.04 0.00 0.00 63.50 63.84 1uc6 n PRO 20 Cb 0.49 -1.67 0.20 0.00 -0.04 0.00 0.00 33.50 32.48 1uc6 n PRO 20 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1uc6 h SER 21 N 0.00 0.00 -2.78 3.54 0.02 -1.96 -3.44 113.55 108.93 1uc6 h SER 21 Ca 0.00 -0.18 -0.32 0.00 -0.84 0.00 0.00 61.79 60.45 1uc6 h SER 21 Cb 0.21 0.00 -0.36 0.00 0.14 0.00 0.00 62.40 62.39 1uc6 h SER 21 CO 0.00 0.09 -0.64 0.20 -1.14 0.00 0.00 176.83 175.34 1uc6 s ASN 22 N -4.32 1.23 0.38 3.07 0.01 -0.86 -5.05 114.94 109.41 1uc6 s ASN 22 Ca 0.07 -0.05 0.18 0.00 -0.71 0.00 0.00 52.86 52.35 1uc6 s ASN 22 Cb 0.13 0.30 1.10 0.00 0.41 0.00 0.00 41.25 43.19 1uc6 s ASN 22 CO 0.71 -0.30 1.74 -0.65 -1.51 0.00 0.00 177.10 177.09 1uc6 h PRO 23 N 8.34 0.38 -0.43 -0.60 0.11 -1.76 -1.35 132.00 136.70 1uc6 h PRO 23 Ca -0.15 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.93 1uc6 h PRO 23 Cb 1.14 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1uc6 h PRO 23 CO 0.23 0.25 0.00 0.54 -0.21 0.00 0.00 178.00 178.81 1uc6 n ARG 24 N -4.71 2.94 -3.18 1.05 1.74 -1.26 -1.88 116.66 111.34 1uc6 n ARG 24 Ca 0.27 -2.32 -0.40 0.00 -0.77 0.00 0.00 57.85 54.64 1uc6 n ARG 24 Cb 0.92 -1.44 -0.07 0.00 -1.02 0.00 0.00 32.46 30.85 1uc6 n ARG 24 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1uc6 s ARG 25 N -1.29 4.09 -0.22 5.56 3.52 -0.51 -2.74 118.95 127.37 1uc6 s ARG 25 Ca 0.32 0.42 -0.02 0.00 -0.13 0.00 0.00 55.73 56.32 1uc6 s ARG 25 Cb 0.19 -3.65 0.01 0.00 -1.56 0.00 0.00 34.95 29.94 1uc6 s ARG 25 CO 0.19 -0.37 -0.09 -0.51 -0.81 0.00 0.00 175.30 173.70 1uc6 s LEU 26 N 2.37 2.81 -1.13 -0.88 1.43 0.11 -1.23 118.68 122.15 1uc6 s LEU 26 Ca 0.23 -0.65 -0.19 0.00 -1.03 0.00 0.00 54.13 52.49 1uc6 s LEU 26 Cb -0.16 -1.64 0.10 0.00 0.03 0.00 0.00 46.19 44.52 1uc6 s LEU 26 CO 0.09 -0.06 1.48 -0.70 0.23 0.00 0.00 176.35 177.39 1uc6 s GLU 27 N 1.37 3.83 -0.67 1.70 2.56 0.24 -0.63 118.70 127.09 1uc6 s GLU 27 Ca 0.03 -1.83 -0.26 0.00 0.00 0.00 0.00 54.97 52.92 1uc6 s GLU 27 Cb -0.15 -5.27 0.04 0.00 2.00 0.00 0.00 34.13 30.75 1uc6 s GLU 27 CO -0.06 -2.05 1.14 0.08 -0.56 0.00 0.00 175.26 173.80 1uc6 s VAL 28 N 3.59 4.01 -0.02 3.70 1.01 -1.07 -0.87 120.40 130.76 1uc6 s VAL 28 Ca 0.45 0.27 0.04 0.00 0.00 0.00 0.00 61.98 62.74 1uc6 s VAL 28 Cb -0.00 -4.78 -0.03 0.00 0.00 0.00 0.00 36.38 31.57 1uc6 s VAL 28 CO -0.02 -1.57 -0.11 0.42 0.00 0.00 0.00 175.10 173.81 1uc6 s THR 29 N 4.94 3.30 0.35 3.92 -4.23 -0.44 0.44 115.64 123.92 1uc6 s THR 29 Ca 0.32 -0.77 -0.14 0.00 -1.18 0.00 0.00 61.69 59.92 1uc6 s THR 29 Cb -0.11 -2.37 0.04 0.00 1.34 0.00 0.00 72.50 71.40 1uc6 s THR 29 CO 0.16 0.49 0.70 -1.66 -0.54 0.00 0.00 174.62 173.77 1uc6 s TRP 30 N -0.86 0.26 0.23 3.99 -2.14 -0.31 -0.32 118.94 119.78 1uc6 s TRP 30 Ca 0.14 -0.80 0.00 0.00 2.66 0.00 0.00 56.10 58.11 1uc6 s TRP 30 Cb -0.11 0.60 -0.04 0.00 -3.10 0.00 0.00 33.47 30.82 1uc6 s TRP 30 CO 0.04 -1.39 0.13 -0.65 -2.66 0.00 0.00 176.95 172.41 1uc6 s GLN 31 N -2.84 1.32 0.74 3.25 -1.52 0.10 -4.61 119.66 116.09 1uc6 s GLN 31 Ca 0.18 -1.71 -0.11 0.00 -1.95 0.00 0.00 55.36 51.77 1uc6 s GLN 31 Cb -0.04 0.07 0.04 0.00 -0.22 0.00 0.00 33.01 32.85 1uc6 s GLN 31 CO 0.12 -0.37 1.08 0.95 -0.25 0.00 0.00 175.29 176.83 1uc6 s THR 32 N -3.96 3.49 0.96 -0.19 -4.23 -1.26 -1.66 115.64 108.79 1uc6 s THR 32 Ca 0.38 0.51 -0.11 0.00 -1.18 0.00 0.00 61.69 61.29 1uc6 s THR 32 Cb 0.07 -3.06 0.17 0.00 1.34 0.00 0.00 72.50 71.02 1uc6 s THR 32 CO 0.13 -0.61 1.10 -2.16 -0.54 0.00 0.00 174.62 172.55 1uc6 s PRO 33 N -4.83 0.69 0.51 3.99 0.04 -1.26 -3.79 135.00 130.35 1uc6 s PRO 33 Ca 0.61 1.23 0.33 0.00 0.04 0.00 0.00 61.00 63.21 1uc6 s PRO 33 Cb -0.17 -1.71 1.42 0.00 0.04 0.00 0.00 34.50 34.08 1uc6 s PRO 33 CO 0.54 -2.75 1.97 0.77 0.04 0.00 0.00 177.00 177.57 1uc6 h SER 34 N -1.94 0.00 -0.08 6.66 0.02 -1.93 -1.29 113.55 114.99 1uc6 h SER 34 Ca -0.49 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 1uc6 h SER 34 Cb 1.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.82 1uc6 h SER 34 CO 0.47 0.00 0.00 0.41 -1.14 0.00 0.00 176.83 176.57 1uc6 n THR 35 N -2.91 0.09 -3.84 -2.27 -1.04 -1.26 -4.64 114.28 98.42 1uc6 n THR 35 Ca 0.00 -0.27 -0.35 0.00 -2.04 0.00 0.00 64.05 61.39 1uc6 n THR 35 Cb 0.25 0.35 -0.13 0.00 -1.82 0.00 0.00 70.33 68.99 1uc6 n THR 35 CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 1uc6 s TRP 36 N -1.91 3.51 0.03 -1.42 -0.11 -0.49 -4.89 118.94 113.66 1uc6 s TRP 36 Ca 0.36 -2.29 -0.17 0.00 1.22 0.00 0.00 56.10 55.21 1uc6 s TRP 36 Cb 0.19 -2.86 -0.25 0.00 -1.50 0.00 0.00 33.47 29.05 1uc6 s TRP 36 CO 0.30 -0.92 1.11 -1.35 -4.62 0.00 0.00 176.95 171.47 1uc6 h PRO 37 N 8.00 0.53 -5.28 5.86 0.11 -1.82 -3.43 132.00 135.96 1uc6 h PRO 37 Ca -0.15 -0.61 -0.66 0.00 0.11 0.00 0.00 66.00 64.70 1uc6 h PRO 37 Cb 1.05 0.18 -0.16 0.00 0.11 0.00 0.00 31.00 32.18 1uc6 h PRO 37 CO 0.63 1.23 0.26 -0.51 -0.21 0.00 0.00 178.00 179.41 1uc6 s ASP 38 N -7.05 6.26 0.20 -2.05 1.01 -1.26 -4.92 116.67 108.86 1uc6 s ASP 38 Ca -0.12 -0.76 0.10 0.00 0.71 0.00 0.00 52.55 52.48 1uc6 s ASP 38 Cb 0.05 -2.35 0.03 0.00 1.01 0.00 0.00 42.92 41.65 1uc6 s ASP 38 CO 0.87 -1.06 1.41 1.55 0.21 0.00 0.00 175.17 178.16 1uc6 h PRO 39 N 9.15 0.00 0.00 8.23 0.13 -1.83 -3.28 132.00 144.40 1uc6 h PRO 39 Ca -0.27 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.82 1uc6 h PRO 39 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 1uc6 h PRO 39 CO 1.03 0.78 -1.13 -0.85 -0.23 0.00 0.00 178.00 177.60 1uc6 n GLU 40 N -3.43 0.06 0.26 0.86 -0.00 -1.26 -4.67 120.64 112.46 1uc6 n GLU 40 Ca 0.00 0.01 0.10 0.00 -0.00 0.00 0.00 57.16 57.27 1uc6 n GLU 40 Cb 0.80 -1.00 0.68 0.00 -0.00 0.00 0.00 31.44 31.92 1uc6 n GLU 40 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.13 177.90 1uc6 h SER 41 N -0.01 0.00 -4.18 -1.84 0.02 -1.98 -3.23 113.55 102.34 1uc6 h SER 41 Ca -0.05 0.00 -0.67 0.00 -0.84 0.00 0.00 61.79 60.22 1uc6 h SER 41 Cb 1.08 0.00 -0.38 0.00 0.14 0.00 0.00 62.40 63.24 1uc6 h SER 41 CO -0.01 0.06 -0.49 -0.36 -1.14 0.00 0.00 176.83 174.90 1uc6 s PHE 42 N -4.75 3.35 -1.07 3.45 0.08 -1.24 -5.02 117.98 112.77 1uc6 s PHE 42 Ca -0.04 -2.89 -0.23 0.00 0.12 0.00 0.00 56.93 53.89 1uc6 s PHE 42 Cb 0.16 -3.05 -0.12 0.00 -0.57 0.00 0.00 43.02 39.44 1uc6 s PHE 42 CO 0.64 -0.81 1.93 -0.35 -0.10 0.00 0.00 175.22 176.53 1uc6 n PRO 43 N 3.43 1.45 -1.69 0.24 -0.04 -1.22 -4.65 135.00 132.51 1uc6 n PRO 43 Ca 0.06 -2.27 -0.42 0.00 -0.04 0.00 0.00 63.50 60.83 1uc6 n PRO 43 Cb 0.36 -3.57 -0.03 0.00 -0.04 0.00 0.00 33.50 30.23 1uc6 n PRO 43 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1uc6 s LEU 44 N 9.36 4.22 -0.54 1.53 2.96 -1.26 -3.18 118.68 131.76 1uc6 s LEU 44 Ca 0.67 2.47 -0.28 0.00 -0.22 0.00 0.00 54.13 56.77 1uc6 s LEU 44 Cb 0.02 -3.53 0.02 0.00 0.50 0.00 0.00 46.19 43.21 1uc6 s LEU 44 CO 0.14 -1.23 1.28 -0.54 -1.32 0.00 0.00 176.35 174.68 1uc6 s LYS 45 N 4.81 3.48 -0.55 1.98 1.02 0.19 0.12 119.74 130.79 1uc6 s LYS 45 Ca 0.90 0.42 -0.24 0.00 0.02 0.00 0.00 55.97 57.07 1uc6 s LYS 45 Cb -0.40 -4.04 0.04 0.00 -0.52 0.00 0.00 37.83 32.92 1uc6 s LYS 45 CO 0.39 -1.71 0.92 -0.06 -0.92 0.00 0.00 175.35 173.97 1uc6 s PHE 46 N 5.28 2.81 -1.21 3.18 0.08 0.03 -2.32 117.98 125.81 1uc6 s PHE 46 Ca 0.48 -0.10 -0.16 0.00 0.12 0.00 0.00 56.93 57.27 1uc6 s PHE 46 Cb -0.09 -4.04 0.12 0.00 -0.57 0.00 0.00 43.02 38.44 1uc6 s PHE 46 CO 0.27 -1.35 1.53 -0.06 -0.10 0.00 0.00 175.22 175.51 1uc6 s PHE 47 N 3.85 3.16 -0.38 0.36 0.08 0.13 -0.37 117.98 124.81 1uc6 s PHE 47 Ca 0.28 -1.83 -0.27 0.00 0.12 0.00 0.00 56.93 55.23 1uc6 s PHE 47 Cb -0.13 -4.50 0.02 0.00 -0.57 0.00 0.00 43.02 37.84 1uc6 s PHE 47 CO 0.18 -1.58 0.99 -0.51 -0.10 0.00 0.00 175.22 174.19 1uc6 s LEU 48 N 2.81 3.93 -0.14 -0.37 1.02 0.23 -2.84 118.68 123.32 1uc6 s LEU 48 Ca 0.46 0.64 -0.01 0.00 0.02 0.00 0.00 54.13 55.25 1uc6 s LEU 48 Cb -0.00 -3.36 -0.02 0.00 0.02 0.00 0.00 46.19 42.84 1uc6 s LEU 48 CO 0.02 -0.92 -0.11 0.00 0.02 0.00 0.00 176.35 175.35 1uc6 s ARG 49 N 3.65 3.42 -0.34 1.70 1.70 -0.43 -0.30 118.95 128.36 1uc6 s ARG 49 Ca 0.41 -0.66 0.03 0.00 -0.47 0.00 0.00 55.73 55.04 1uc6 s ARG 49 Cb -0.11 -2.70 0.10 0.00 -0.57 0.00 0.00 34.95 31.67 1uc6 s ARG 49 CO 0.20 0.19 0.07 1.52 -1.08 0.00 0.00 175.30 176.19 1uc6 s TYR 50 N 0.44 3.32 -0.10 5.89 1.13 -0.92 -0.14 117.35 126.97 1uc6 s TYR 50 Ca -0.09 -2.76 -0.17 0.00 -1.41 0.00 0.00 57.07 52.64 1uc6 s TYR 50 Cb -0.16 -2.68 -0.05 0.00 -1.10 0.00 0.00 41.96 37.98 1uc6 s TYR 50 CO 0.04 -0.93 0.44 0.50 -2.51 0.00 0.00 175.55 173.10 1uc6 s ARG 51 N 0.99 4.27 0.24 -3.49 3.52 -0.35 -3.83 118.95 120.30 1uc6 s ARG 51 Ca 0.11 0.40 -0.30 0.00 -0.13 0.00 0.00 55.73 55.81 1uc6 s ARG 51 Cb -0.19 -3.40 -0.10 0.00 -1.56 0.00 0.00 34.95 29.70 1uc6 s ARG 51 CO -0.11 0.25 1.47 -1.25 -0.81 0.00 0.00 175.30 174.85 1uc6 s PRO 52 N 0.34 4.24 0.00 5.12 0.04 -1.25 -1.67 135.00 141.82 1uc6 s PRO 52 Ca 0.24 2.34 0.05 0.00 0.04 0.00 0.00 61.00 63.67 1uc6 s PRO 52 Cb -0.15 -3.11 0.23 0.00 0.04 0.00 0.00 34.50 31.52 1uc6 s PRO 52 CO 0.10 -0.47 1.00 1.28 0.04 0.00 0.00 177.00 178.95 1uc6 n LEU 53 N 2.56 0.00 -0.06 -3.56 4.32 0.20 -1.53 117.00 118.93 1uc6 n LEU 53 Ca 0.08 0.31 0.01 0.00 -0.02 0.00 0.00 56.01 56.39 1uc6 n LEU 53 Cb 0.40 -0.31 0.01 0.00 -1.62 0.00 0.00 43.42 41.90 1uc6 n LEU 53 CO 0.61 -0.26 0.50 2.30 -1.22 0.00 0.00 177.39 179.32 1uc6 n ILE 54 N -1.31 0.95 -3.72 -0.08 -5.35 -1.26 -5.02 119.36 103.57 1uc6 n ILE 54 Ca 0.02 -0.98 -0.12 0.00 -0.27 0.00 0.00 62.75 61.40 1uc6 n ILE 54 Cb 0.04 0.53 -0.10 0.00 -1.74 0.00 0.00 39.64 38.36 1uc6 n ILE 54 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 1uc6 s LEU 55 N -0.96 0.24 -1.44 7.28 2.96 -0.58 -5.06 118.68 121.12 1uc6 s LEU 55 Ca 0.02 0.85 -0.12 0.00 -0.22 0.00 0.00 54.13 54.66 1uc6 s LEU 55 Cb 0.01 1.39 0.05 0.00 0.50 0.00 0.00 46.19 48.14 1uc6 s LEU 55 CO 0.01 -0.16 2.26 -0.67 -1.32 0.00 0.00 176.35 176.47 1uc6 n ASP 56 N 3.35 4.77 -3.77 3.68 -0.08 -1.26 -3.93 116.55 119.31 1uc6 n ASP 56 Ca -0.17 -2.87 -0.29 0.00 -1.51 0.00 0.00 54.79 49.96 1uc6 n ASP 56 Cb 0.56 -1.61 -0.12 0.00 2.34 0.00 0.00 41.12 42.30 1uc6 n ASP 56 CO 0.00 0.00 0.00 -1.10 0.12 0.00 0.00 177.20 176.22 1uc6 s GLN 57 N 2.45 1.83 -0.33 -0.67 -1.52 -1.26 -5.07 119.66 115.09 1uc6 s GLN 57 Ca 0.48 -2.70 -0.29 0.00 -1.95 0.00 0.00 55.36 50.91 1uc6 s GLN 57 Cb 0.14 -2.80 -0.01 0.00 -0.22 0.00 0.00 33.01 30.13 1uc6 s GLN 57 CO -0.07 -1.25 1.54 -1.58 -0.25 0.00 0.00 175.29 173.68 1uc6 s TRP 58 N -0.58 2.23 -1.02 0.91 0.23 -1.26 -4.13 118.94 115.31 1uc6 s TRP 58 Ca 0.23 0.66 -0.10 0.00 -2.03 0.00 0.00 56.10 54.86 1uc6 s TRP 58 Cb -0.11 -4.13 0.26 0.00 0.03 0.00 0.00 33.47 29.52 1uc6 s TRP 58 CO -0.11 -2.41 0.99 -1.14 0.96 0.00 0.00 176.95 175.25 1uc6 s GLN 59 N 4.93 3.97 -0.13 4.98 2.00 -1.25 -4.92 119.66 129.24 1uc6 s GLN 59 Ca 0.67 -3.03 -0.28 0.00 -2.00 0.00 0.00 55.36 50.72 1uc6 s GLN 59 Cb -0.19 -4.47 -0.01 0.00 0.80 0.00 0.00 33.01 29.14 1uc6 s GLN 59 CO 0.31 -1.25 0.93 -3.38 -0.50 0.00 0.00 175.29 171.40 1uc6 s HIS 60 N -0.91 3.48 -0.09 1.67 -3.43 -1.26 -2.18 115.29 112.58 1uc6 s HIS 60 Ca 0.27 1.46 0.02 0.00 -0.80 0.00 0.00 55.06 56.02 1uc6 s HIS 60 Cb -0.10 -3.11 0.01 0.00 -1.43 0.00 0.00 32.58 27.95 1uc6 s HIS 60 CO -0.08 -0.22 -0.14 0.08 -2.00 0.00 0.00 174.74 172.38 1uc6 s VAL 61 N 2.00 1.35 -0.53 -5.38 1.01 0.59 -4.94 120.40 114.50 1uc6 s VAL 61 Ca 0.44 -0.57 -0.21 0.00 0.00 0.00 0.00 61.98 61.64 1uc6 s VAL 61 Cb -0.18 -1.23 0.05 0.00 0.00 0.00 0.00 36.38 35.03 1uc6 s VAL 61 CO 0.16 0.41 0.75 -1.61 0.00 0.00 0.00 175.10 174.81 1uc6 s GLU 62 N 0.84 3.19 -0.66 2.72 2.02 -1.26 -0.60 118.70 124.96 1uc6 s GLU 62 Ca -0.10 -0.69 -0.09 0.00 0.02 0.00 0.00 54.97 54.11 1uc6 s GLU 62 Cb -0.15 -4.10 0.17 0.00 0.10 0.00 0.00 34.13 30.15 1uc6 s GLU 62 CO 0.01 -1.35 0.54 -0.51 0.02 0.00 0.00 175.26 173.97 1uc6 s LEU 63 N 3.16 5.96 -0.34 1.80 1.43 0.51 -4.87 118.68 126.32 1uc6 s LEU 63 Ca 0.21 -2.51 -0.28 0.00 -1.03 0.00 0.00 54.13 50.52 1uc6 s LEU 63 Cb -0.17 -2.04 -0.02 0.00 0.03 0.00 0.00 46.19 43.99 1uc6 s LEU 63 CO 0.14 -0.55 1.85 -0.44 0.23 0.00 0.00 176.35 177.59 1uc6 s SER 64 N 1.87 5.79 -1.58 2.29 0.01 -1.26 -0.79 113.70 120.03 1uc6 s SER 64 Ca 0.14 1.31 0.00 0.00 1.31 0.00 0.00 55.95 58.71 1uc6 s SER 64 Cb -0.19 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.52 1uc6 s SER 64 CO -0.04 -1.79 0.00 -0.46 0.41 0.00 0.00 173.24 171.36 1uc6 n ASN 65 N 10.65 -4.65 -4.73 2.44 0.23 0.12 -4.88 115.26 114.44 1uc6 n ASN 65 Ca 0.24 0.24 -0.30 0.00 -0.53 0.00 0.00 54.58 54.23 1uc6 n ASN 65 Cb 0.47 -4.04 0.12 0.00 -2.08 0.00 0.00 39.78 34.25 1uc6 n ASN 65 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1uc6 s GLY 66 N -2.21 1.65 0.00 4.83 0.00 -1.12 -4.93 107.32 105.54 1uc6 s GLY 66 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 44.72 44.86 1uc6 s GLY 66 CO 0.00 0.56 0.00 -1.30 0.00 0.00 0.00 173.10 172.36 1uc6 n THR 67 N -3.76 0.00 -3.39 0.90 -2.24 -1.26 -4.89 114.28 99.63 1uc6 n THR 67 Ca 0.08 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.65 1uc6 n THR 67 Cb 0.54 0.38 -0.09 0.00 -2.10 0.00 0.00 70.33 69.06 1uc6 n THR 67 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1uc6 s ALA 68 N 0.00 0.10 -1.19 6.98 0.00 -1.26 -1.17 121.76 125.22 1uc6 s ALA 68 Ca 0.00 -1.35 -0.12 0.00 0.00 0.00 0.00 51.96 50.49 1uc6 s ALA 68 Cb 0.00 -1.88 0.20 0.00 0.00 0.00 0.00 23.12 21.43 1uc6 s ALA 68 CO 0.00 -2.13 1.40 1.58 0.00 0.00 0.00 175.76 176.61 1uc6 n HIS 69 N 4.11 4.83 -2.47 0.00 -0.00 0.17 -4.91 115.22 116.95 1uc6 n HIS 69 Ca 0.12 -3.42 -0.43 0.00 0.46 0.00 0.00 57.72 54.45 1uc6 n HIS 69 Cb 0.42 -2.04 -0.02 0.00 -0.12 0.00 0.00 29.99 28.23 1uc6 n HIS 69 CO 0.00 0.00 0.00 0.99 0.46 0.00 0.00 176.34 177.79 1uc6 s THR 70 N 0.73 4.14 -0.07 3.57 2.01 -1.26 -2.59 115.64 122.18 1uc6 s THR 70 Ca 0.40 1.25 0.05 0.00 0.31 0.00 0.00 61.69 63.69 1uc6 s THR 70 Cb -0.03 -4.29 -0.00 0.00 0.01 0.00 0.00 72.50 68.18 1uc6 s THR 70 CO -0.01 -0.65 -0.22 0.27 -0.69 0.00 0.00 174.62 173.31 1uc6 s ILE 71 N 4.55 1.88 -0.40 1.82 -4.36 0.20 -4.93 121.20 119.96 1uc6 s ILE 71 Ca 0.54 -0.95 0.11 0.00 -0.26 0.00 0.00 60.65 60.09 1uc6 s ILE 71 Cb -0.13 -1.61 0.65 0.00 1.25 0.00 0.00 42.46 42.61 1uc6 s ILE 71 CO 0.26 0.52 1.50 0.41 0.24 0.00 0.00 174.94 177.88 1uc6 n THR 72 N 3.24 2.22 0.22 8.37 -1.04 -1.24 0.08 114.28 126.13 1uc6 n THR 72 Ca -0.18 -1.13 0.10 0.00 -2.04 0.00 0.00 64.05 60.80 1uc6 n THR 72 Cb 0.52 -0.33 0.26 0.00 -1.82 0.00 0.00 70.33 68.96 1uc6 n THR 72 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1uc6 n ASP 73 N 0.46 3.09 -4.93 8.00 -0.08 -1.21 -4.66 116.55 117.21 1uc6 n ASP 73 Ca 0.23 -1.98 -0.25 0.00 -1.51 0.00 0.00 54.79 51.28 1uc6 n ASP 73 Cb 1.02 -0.36 0.02 0.00 2.34 0.00 0.00 41.12 44.14 1uc6 n ASP 73 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1uc6 s ALA 74 N -1.29 3.51 -0.35 -1.67 0.00 -1.11 -5.05 121.76 115.82 1uc6 s ALA 74 Ca 0.39 -0.83 -0.20 0.00 0.00 0.00 0.00 51.96 51.32 1uc6 s ALA 74 Cb 0.21 -2.40 0.00 0.00 0.00 0.00 0.00 23.12 20.93 1uc6 s ALA 74 CO 0.27 -0.55 0.63 0.71 0.00 0.00 0.00 175.76 176.82 1uc6 s TYR 75 N -2.76 3.16 0.08 0.00 1.51 -1.26 -4.73 117.35 113.35 1uc6 s TYR 75 Ca 0.50 0.38 -0.25 0.00 -1.01 0.00 0.00 57.07 56.70 1uc6 s TYR 75 Cb -0.10 -3.10 -0.16 0.00 -0.11 0.00 0.00 41.96 38.49 1uc6 s TYR 75 CO 0.42 -0.59 1.70 0.00 -1.11 0.00 0.00 175.55 175.96 1uc6 h ALA 76 N 8.41 -0.18 -0.01 3.71 0.00 -1.85 -3.15 119.26 126.20 1uc6 h ALA 76 Ca -0.26 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1uc6 h ALA 76 Cb 1.11 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1uc6 h ALA 76 CO 0.83 -0.59 -0.42 0.41 0.00 0.00 0.00 179.25 179.47 1uc6 n GLY 77 N -1.11 -0.75 3.19 0.00 0.00 -1.26 -4.09 105.19 101.18 1uc6 n GLY 77 Ca -0.08 -0.44 -0.32 0.00 0.00 0.00 0.00 46.02 45.18 1uc6 n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uc6 s LYS 78 N -2.69 2.97 0.34 1.61 3.01 -1.19 -5.10 119.74 118.69 1uc6 s LYS 78 Ca 0.18 -0.84 -0.28 0.00 -1.01 0.00 0.00 55.97 54.02 1uc6 s LYS 78 Cb 0.18 -2.31 -0.12 0.00 -1.01 0.00 0.00 37.83 34.57 1uc6 s LYS 78 CO 0.61 0.09 1.33 0.39 0.51 0.00 0.00 175.35 178.29 1uc6 n GLU 79 N 3.76 2.22 -4.66 1.68 4.71 -1.26 -4.22 120.64 122.87 1uc6 n GLU 79 Ca -0.19 0.78 -0.33 0.00 -0.01 0.00 0.00 57.16 57.40 1uc6 n GLU 79 Cb 0.52 -2.39 -0.13 0.00 -1.01 0.00 0.00 31.44 28.43 1uc6 n GLU 79 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 1uc6 s TYR 80 N -1.02 2.88 -0.35 -0.32 1.51 0.27 -0.63 117.35 119.68 1uc6 s TYR 80 Ca 0.56 -0.48 -0.10 0.00 -1.01 0.00 0.00 57.07 56.03 1uc6 s TYR 80 Cb -0.56 -1.86 0.02 0.00 -0.11 0.00 0.00 41.96 39.45 1uc6 s TYR 80 CO 0.62 -0.11 0.19 -1.50 -1.11 0.00 0.00 175.55 173.63 1uc6 s ILE 81 N 0.25 4.57 -0.37 2.71 2.07 -0.67 -2.17 121.20 127.59 1uc6 s ILE 81 Ca -0.07 -0.73 -0.07 0.00 -1.41 0.00 0.00 60.65 58.37 1uc6 s ILE 81 Cb -0.15 -3.49 0.06 0.00 0.13 0.00 0.00 42.46 39.01 1uc6 s ILE 81 CO 0.04 -0.15 0.16 -0.63 -1.91 0.00 0.00 174.94 172.46 1uc6 s ILE 82 N 1.57 3.82 -0.04 2.00 1.01 0.31 -1.22 121.20 128.66 1uc6 s ILE 82 Ca 0.03 -1.34 -0.17 0.00 0.00 0.00 0.00 60.65 59.17 1uc6 s ILE 82 Cb -0.19 -3.27 -0.05 0.00 0.01 0.00 0.00 42.46 38.96 1uc6 s ILE 82 CO 0.06 -0.34 0.46 -1.10 0.00 0.00 0.00 174.94 174.03 1uc6 s GLN 83 N 1.37 4.14 -0.37 2.79 -1.52 0.80 0.42 119.66 127.29 1uc6 s GLN 83 Ca 0.01 0.48 -0.01 0.00 -1.95 0.00 0.00 55.36 53.89 1uc6 s GLN 83 Cb -0.21 -3.31 0.10 0.00 -0.22 0.00 0.00 33.01 29.37 1uc6 s GLN 83 CO 0.02 0.47 0.12 0.08 -0.25 0.00 0.00 175.29 175.73 1uc6 s VAL 84 N -0.40 2.93 0.22 1.09 1.01 0.48 -1.31 120.40 124.42 1uc6 s VAL 84 Ca 0.25 -2.02 0.04 0.00 0.00 0.00 0.00 61.98 60.26 1uc6 s VAL 84 Cb -0.16 -2.99 -0.03 0.00 0.00 0.00 0.00 36.38 33.19 1uc6 s VAL 84 CO 0.13 -0.56 0.35 0.00 0.00 0.00 0.00 175.10 175.02 1uc6 s ALA 85 N 1.09 3.94 -0.01 5.51 0.00 -1.13 -2.88 121.76 128.28 1uc6 s ALA 85 Ca 0.06 -1.19 0.02 0.00 0.00 0.00 0.00 51.96 50.86 1uc6 s ALA 85 Cb -0.21 -1.74 -0.00 0.00 0.00 0.00 0.00 23.12 21.16 1uc6 s ALA 85 CO -0.05 0.30 -0.08 0.00 0.00 0.00 0.00 175.76 175.93 1uc6 s ALA 86 N -1.94 0.66 -0.25 0.00 0.00 -1.26 -0.69 121.76 118.28 1uc6 s ALA 86 Ca 0.34 -0.32 -0.19 0.00 0.00 0.00 0.00 51.96 51.79 1uc6 s ALA 86 Cb -0.09 -0.19 0.07 0.00 0.00 0.00 0.00 23.12 22.91 1uc6 s ALA 86 CO 0.29 0.15 0.65 0.21 0.00 0.00 0.00 175.76 177.06 1uc6 s LYS 87 N -0.10 0.72 0.67 0.00 2.20 -0.98 -3.79 119.74 118.45 1uc6 s LYS 87 Ca 0.02 1.02 -0.15 0.00 -0.36 0.00 0.00 55.97 56.50 1uc6 s LYS 87 Cb -0.04 0.26 0.01 0.00 -1.51 0.00 0.00 37.83 36.54 1uc6 s LYS 87 CO -0.00 -0.12 1.12 0.34 -0.36 0.00 0.00 175.35 176.32 1uc6 s ASP 88 N 0.90 4.99 0.21 1.43 2.15 -1.20 0.53 116.67 125.69 1uc6 s ASP 88 Ca -0.04 2.01 -0.02 0.00 0.43 0.00 0.00 52.55 54.93 1uc6 s ASP 88 Cb -0.05 -2.55 0.18 0.00 -0.30 0.00 0.00 42.92 40.20 1uc6 s ASP 88 CO -0.08 -1.71 1.56 -1.13 -0.17 0.00 0.00 175.17 173.64 1uc6 h ASN 89 N -0.08 0.58 0.00 -0.34 -0.73 -1.92 -3.37 115.58 109.72 1uc6 h ASN 89 Ca -0.47 -0.28 -0.24 0.00 1.87 0.00 0.00 56.30 57.19 1uc6 h ASN 89 Cb 1.25 -0.16 -0.04 0.00 0.27 0.00 0.00 38.32 39.63 1uc6 h ASN 89 CO 0.53 0.96 -1.90 -1.84 -0.37 0.00 0.00 177.43 174.81 1uc6 n GLU 90 N -4.00 0.94 -3.06 6.67 0.28 -1.26 -4.77 120.64 115.45 1uc6 n GLU 90 Ca -0.02 0.06 -0.45 0.00 -0.16 0.00 0.00 57.16 56.59 1uc6 n GLU 90 Cb 0.55 -1.32 -0.02 0.00 1.43 0.00 0.00 31.44 32.08 1uc6 n GLU 90 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1uc6 s ILE 91 N -2.32 5.13 -1.09 3.84 1.01 -1.26 -4.96 121.20 121.55 1uc6 s ILE 91 Ca -0.16 -2.24 -0.23 0.00 0.00 0.00 0.00 60.65 58.02 1uc6 s ILE 91 Cb 0.05 -4.73 -0.06 0.00 0.01 0.00 0.00 42.46 37.73 1uc6 s ILE 91 CO 0.42 -1.40 1.90 -0.83 0.00 0.00 0.00 174.94 175.03 1uc6 s GLY 92 N 2.87 0.33 -0.64 6.18 0.00 -1.26 -3.22 107.32 111.58 1uc6 s GLY 92 Ca 0.32 -2.00 -0.12 0.00 0.00 0.00 0.00 44.72 42.92 1uc6 s GLY 92 CO -0.07 3.44 0.55 -1.59 0.00 0.00 0.00 173.10 175.43 1uc6 s THR 93 N 9.96 4.91 -0.89 0.90 2.01 -1.26 -0.47 115.64 130.79 1uc6 s THR 93 Ca 0.67 -2.14 -0.24 0.00 0.31 0.00 0.00 61.69 60.28 1uc6 s THR 93 Cb -0.02 -4.12 -0.00 0.00 0.01 0.00 0.00 72.50 68.36 1uc6 s THR 93 CO 0.07 -0.91 1.70 0.26 -0.69 0.00 0.00 174.62 175.06 1uc6 s TRP 94 N 0.77 2.08 0.71 4.92 0.52 -1.26 -4.40 118.94 122.28 1uc6 s TRP 94 Ca 0.11 0.08 -0.11 0.00 0.02 0.00 0.00 56.10 56.20 1uc6 s TRP 94 Cb -0.20 -4.33 0.02 0.00 -1.15 0.00 0.00 33.47 27.80 1uc6 s TRP 94 CO -0.03 -1.91 1.07 -1.12 0.02 0.00 0.00 176.95 174.97 1uc6 s SER 95 N 6.59 5.27 0.90 2.95 0.01 -1.25 -4.92 113.70 123.25 1uc6 s SER 95 Ca 0.58 1.46 -0.13 0.00 1.31 0.00 0.00 55.95 59.17 1uc6 s SER 95 Cb -0.05 -2.32 0.17 0.00 0.21 0.00 0.00 66.02 64.03 1uc6 s SER 95 CO 0.00 -1.49 1.25 1.51 0.41 0.00 0.00 173.24 174.92 1uc6 s ASP 96 N -3.93 3.54 -0.21 2.44 -4.77 -1.26 -4.78 116.67 107.69 1uc6 s ASP 96 Ca 0.58 0.27 -0.28 0.00 -3.30 0.00 0.00 52.55 49.82 1uc6 s ASP 96 Cb -0.13 -0.45 -0.05 0.00 -1.09 0.00 0.00 42.92 41.20 1uc6 s ASP 96 CO 0.54 -2.46 2.18 0.26 0.70 0.00 0.00 175.17 176.40 1uc6 s TRP 97 N -3.73 1.21 0.00 2.11 0.23 -1.26 -4.72 118.94 112.79 1uc6 s TRP 97 Ca 0.71 0.50 0.00 0.00 -2.03 0.00 0.00 56.10 55.28 1uc6 s TRP 97 Cb -0.05 -3.95 0.00 0.00 0.03 0.00 0.00 33.47 29.49 1uc6 s TRP 97 CO 0.51 -4.08 0.00 -1.13 0.96 0.00 0.00 176.95 173.21 1uc6 n SER 98 N 11.44 0.00 -4.54 2.95 3.41 -1.25 -4.92 113.62 120.71 1uc6 n SER 98 Ca 0.29 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.47 1uc6 n SER 98 Cb 0.45 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.33 1uc6 n SER 98 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1uc6 s VAL 99 N 0.00 4.83 -0.41 -3.33 1.01 -1.14 -4.89 120.40 116.47 1uc6 s VAL 99 Ca 0.00 0.34 -0.20 0.00 0.00 0.00 0.00 61.98 62.12 1uc6 s VAL 99 Cb 0.00 -4.16 0.02 0.00 0.00 0.00 0.00 36.38 32.23 1uc6 s VAL 99 CO 0.00 -0.49 0.62 0.00 0.00 0.00 0.00 175.10 175.23 1uc6 s ALA 100 N 2.82 3.38 0.11 5.51 0.00 -1.26 -0.39 121.76 131.93 1uc6 s ALA 100 Ca 0.24 -1.14 -0.05 0.00 0.00 0.00 0.00 51.96 51.01 1uc6 s ALA 100 Cb -0.14 -3.24 -0.05 0.00 0.00 0.00 0.00 23.12 19.69 1uc6 s ALA 100 CO 0.18 -1.65 0.34 0.00 0.00 0.00 0.00 175.76 174.63 1uc6 s ALA 101 N 2.73 3.82 -0.09 0.00 0.00 0.17 -4.89 121.76 123.49 1uc6 s ALA 101 Ca 0.22 -0.58 0.03 0.00 0.00 0.00 0.00 51.96 51.63 1uc6 s ALA 101 Cb -0.14 -2.10 -0.01 0.00 0.00 0.00 0.00 23.12 20.87 1uc6 s ALA 101 CO 0.17 0.68 -0.18 -1.01 0.00 0.00 0.00 175.76 175.42 1uc6 s HIS 102 N -1.56 2.66 -0.06 0.00 3.76 -1.26 -0.53 115.29 118.31 1uc6 s HIS 102 Ca 0.37 -0.67 -0.30 0.00 -0.15 0.00 0.00 55.06 54.32 1uc6 s HIS 102 Cb -0.13 -1.73 0.09 0.00 1.11 0.00 0.00 32.58 31.92 1uc6 s HIS 102 CO 0.23 -0.19 0.77 0.00 -0.85 0.00 0.00 174.74 174.70 1uc6 s ALA 103 N 0.06 -1.80 -0.18 -1.40 0.00 -0.92 -4.73 121.76 112.79 1uc6 s ALA 103 Ca -0.07 1.30 -0.04 0.00 0.00 0.00 0.00 51.96 53.14 1uc6 s ALA 103 Cb -0.15 -0.09 0.08 0.00 0.00 0.00 0.00 23.12 22.96 1uc6 s ALA 103 CO 0.05 -0.41 0.17 0.99 0.00 0.00 0.00 175.76 176.56 1uc6 s THR 104 N -1.52 -0.24 1.26 0.00 2.01 -1.26 -0.57 115.64 115.32 1uc6 s THR 104 Ca -0.06 -0.06 -0.21 0.00 0.31 0.00 0.00 61.69 61.66 1uc6 s THR 104 Cb -0.00 -0.59 0.32 0.00 0.01 0.00 0.00 72.50 72.24 1uc6 s THR 104 CO 0.04 -0.18 0.91 -0.81 -0.69 0.00 0.00 174.62 173.90 1uc6 n PRO 105 N 5.31 -3.85 -1.43 4.92 -0.04 -1.26 -4.66 135.00 133.99 1uc6 n PRO 105 Ca -0.06 -1.50 -0.52 0.00 -0.04 0.00 0.00 63.50 61.39 1uc6 n PRO 105 Cb 0.49 -1.64 -0.07 0.00 -0.04 0.00 0.00 33.50 32.24 1uc6 n PRO 105 CO 0.00 0.00 0.00 1.87 -0.04 0.00 0.00 175.50 177.33 1uc6 n TRP 106 N -5.17 1.58 -3.05 0.54 -0.00 -0.79 -4.72 117.44 105.82 1uc6 n TRP 106 Ca 0.13 0.32 -0.45 0.00 -0.00 0.00 0.00 57.50 57.51 1uc6 n TRP 106 Cb 0.55 -2.51 -0.03 0.00 -0.00 0.00 0.00 31.31 29.33 1uc6 n TRP 106 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 177.69 178.68 1uc6 s THR 107 N 7.12 4.97 -0.03 5.87 2.01 -1.26 -4.36 115.64 129.96 1uc6 s THR 107 Ca 1.10 -1.76 -0.29 0.00 0.31 0.00 0.00 61.69 61.05 1uc6 s THR 107 Cb -0.91 -4.67 -0.08 0.00 0.01 0.00 0.00 72.50 66.85 1uc6 s THR 107 CO 0.51 -1.35 2.02 -1.61 -0.69 0.00 0.00 174.62 173.50 1uc6 s GLU 108 N 2.02 3.88 0.00 4.92 2.02 -1.26 -5.04 118.70 125.24 1uc6 s GLU 108 Ca 0.27 2.44 0.32 0.00 0.02 0.00 0.00 54.97 58.02 1uc6 s GLU 108 Cb -0.08 -4.21 1.90 0.00 0.10 0.00 0.00 34.13 31.84 1uc6 s GLU 108 CO -0.08 -1.25 2.22 0.39 0.02 0.00 0.00 175.26 176.56