#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cui n SER 2 N 0.00 3.39 -3.45 1.61 2.88 -1.26 -5.07 113.62 111.73 2cui n SER 2 Ca 0.00 -3.04 -0.12 0.00 -1.33 0.00 0.00 58.87 54.38 2cui n SER 2 Cb 0.00 -0.42 -0.04 0.00 -0.75 0.00 0.00 64.21 63.00 2cui n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2cui s SER 3 N -3.62 0.50 0.00 -3.46 0.01 -1.26 -5.12 113.70 100.74 2cui s SER 3 Ca 0.40 -1.29 0.00 0.00 1.31 0.00 0.00 55.95 56.37 2cui s SER 3 Cb 0.38 0.66 0.00 0.00 0.21 0.00 0.00 66.02 67.27 2cui s SER 3 CO -0.01 -1.29 0.00 0.61 0.41 0.00 0.00 173.24 172.96 2cui n GLY 4 N -0.50 -1.77 3.59 3.44 0.00 -1.26 -5.11 105.19 103.57 2cui n GLY 4 Ca -0.01 0.77 -0.42 0.00 0.00 0.00 0.00 46.02 46.36 2cui n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cui s SER 5 N 0.00 6.25 1.13 1.61 0.15 -1.26 -5.01 113.70 116.58 2cui s SER 5 Ca 0.00 0.45 -0.18 0.00 0.70 0.00 0.00 55.95 56.92 2cui s SER 5 Cb 0.00 -2.54 0.26 0.00 -1.71 0.00 0.00 66.02 62.02 2cui s SER 5 CO 0.00 -1.57 1.17 -0.44 1.20 0.00 0.00 173.24 173.59 2cui s SER 6 N 4.02 1.59 0.00 5.45 0.01 -1.26 -4.66 113.70 118.85 2cui s SER 6 Ca 0.54 0.55 0.00 0.00 1.31 0.00 0.00 55.95 58.35 2cui s SER 6 Cb -0.11 -0.75 0.00 0.00 0.21 0.00 0.00 66.02 65.37 2cui s SER 6 CO 0.28 -3.70 0.00 0.61 0.41 0.00 0.00 173.24 170.84 2cui n GLY 7 N -1.74 3.19 3.55 3.44 0.00 -1.26 -5.05 105.19 107.32 2cui n GLY 7 Ca 0.13 -0.77 -0.38 0.00 0.00 0.00 0.00 46.02 45.01 2cui n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cui s SER 8 N 0.00 4.97 0.02 1.61 0.01 -1.26 -4.85 113.70 114.20 2cui s SER 8 Ca 0.00 0.67 -0.29 0.00 1.31 0.00 0.00 55.95 57.64 2cui s SER 8 Cb 0.00 -2.52 -0.16 0.00 0.21 0.00 0.00 66.02 63.55 2cui s SER 8 CO 0.00 -2.54 1.21 0.03 0.41 0.00 0.00 173.24 172.35 2cui h ARG 9 N 16.66 -1.01 -6.87 12.44 3.08 -1.96 -3.44 114.38 133.28 2cui h ARG 9 Ca -0.26 0.07 -0.51 0.00 0.07 0.00 0.00 59.98 59.35 2cui h ARG 9 Cb 1.20 0.23 0.05 0.00 0.08 0.00 0.00 29.97 31.53 2cui h ARG 9 CO 1.19 -0.67 0.56 -1.25 -1.07 0.00 0.00 179.97 178.73 2cui s PRO 10 N -4.97 4.37 0.44 0.04 0.04 -1.26 -5.05 135.00 128.61 2cui s PRO 10 Ca -0.15 2.02 0.03 0.00 0.04 0.00 0.00 61.00 62.93 2cui s PRO 10 Cb 0.02 -3.02 -0.02 0.00 0.04 0.00 0.00 34.50 31.52 2cui s PRO 10 CO 0.46 -0.10 0.11 1.03 0.04 0.00 0.00 177.00 178.54 2cui s ARG 11 N -1.80 2.02 0.30 4.56 3.00 -1.26 -4.76 118.95 121.00 2cui s ARG 11 Ca 0.49 -2.26 0.04 0.00 0.00 0.00 0.00 55.73 54.01 2cui s ARG 11 Cb -0.36 -0.78 -0.02 0.00 0.00 0.00 0.00 34.95 33.79 2cui s ARG 11 CO 0.46 -0.49 0.45 -0.51 0.00 0.00 0.00 175.30 175.21 2cui s LEU 12 N -3.68 4.12 0.69 2.53 1.43 -1.26 -4.64 118.68 117.86 2cui s LEU 12 Ca 0.18 0.07 0.03 0.00 -1.03 0.00 0.00 54.13 53.38 2cui s LEU 12 Cb 0.02 -2.92 0.13 0.00 0.03 0.00 0.00 46.19 43.44 2cui s LEU 12 CO 0.12 -0.26 0.95 -0.55 0.23 0.00 0.00 176.35 176.84 2cui s SER 13 N -4.07 4.51 -0.24 2.29 0.15 -0.57 -4.98 113.70 110.78 2cui s SER 13 Ca 0.39 -0.61 -0.29 0.00 0.70 0.00 0.00 55.95 56.14 2cui s SER 13 Cb -0.09 0.24 -0.06 0.00 -1.71 0.00 0.00 66.02 64.39 2cui s SER 13 CO 0.31 -1.77 2.22 0.00 1.20 0.00 0.00 173.24 175.20 2cui n GLN 14 N -2.68 1.81 -2.64 5.44 10.64 -1.26 -4.65 117.38 124.05 2cui n GLN 14 Ca 0.16 0.49 -0.42 0.00 -1.83 0.00 0.00 57.00 55.41 2cui n GLN 14 Cb 0.61 -3.10 -0.03 0.00 -0.86 0.00 0.00 30.24 26.86 2cui n GLN 14 CO 0.00 0.00 0.00 -1.17 -1.83 0.00 0.00 177.06 174.06 2cui s LEU 15 N 8.11 3.55 0.33 2.61 2.96 -1.26 -4.68 118.68 130.30 2cui s LEU 15 Ca 1.02 -0.16 0.08 0.00 -0.22 0.00 0.00 54.13 54.85 2cui s LEU 15 Cb -0.43 -2.93 -0.03 0.00 0.50 0.00 0.00 46.19 43.30 2cui s LEU 15 CO 0.38 -1.51 0.27 -0.44 -1.32 0.00 0.00 176.35 173.72 2cui s SER 16 N 3.15 5.23 -0.10 3.68 0.01 -1.16 -4.64 113.70 119.88 2cui s SER 16 Ca 0.38 -0.51 0.02 0.00 1.31 0.00 0.00 55.95 57.15 2cui s SER 16 Cb -0.09 -0.98 -0.02 0.00 0.21 0.00 0.00 66.02 65.14 2cui s SER 16 CO 0.21 -0.32 -0.14 -0.69 0.41 0.00 0.00 173.24 172.71 2cui s VAL 17 N -2.30 2.99 0.16 3.43 1.01 -1.26 -2.14 120.40 122.29 2cui s VAL 17 Ca 0.40 -0.71 0.07 0.00 0.00 0.00 0.00 61.98 61.74 2cui s VAL 17 Cb -0.06 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 2cui s VAL 17 CO 0.26 0.55 -0.15 0.42 0.00 0.00 0.00 175.10 176.18 2cui s THR 18 N -0.08 1.58 -1.46 3.92 -4.23 0.94 -4.78 115.64 111.53 2cui s THR 18 Ca -0.03 -1.95 -0.07 0.00 -1.18 0.00 0.00 61.69 58.47 2cui s THR 18 Cb -0.14 -1.79 0.01 0.00 1.34 0.00 0.00 72.50 71.92 2cui s THR 18 CO 0.04 -0.47 0.91 0.47 -0.54 0.00 0.00 174.62 175.03 2cui n ASP 19 N 0.14 -6.22 -4.49 3.99 9.92 -1.26 -1.36 116.55 117.27 2cui n ASP 19 Ca -0.12 -0.43 -0.43 0.00 -0.53 0.00 0.00 54.79 53.28 2cui n ASP 19 Cb 0.58 -4.95 -0.09 0.00 -0.64 0.00 0.00 41.12 36.02 2cui n ASP 19 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2cui n VAL 20 N -4.77 0.02 -2.47 2.53 0.31 -1.26 -4.41 118.33 108.28 2cui n VAL 20 Ca -0.05 -0.34 -0.28 0.00 -0.01 0.00 0.00 64.34 63.67 2cui n VAL 20 Cb 0.59 -1.57 0.01 0.00 -0.91 0.00 0.00 33.84 31.96 2cui n VAL 20 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2cui s THR 21 N 9.52 4.49 0.24 2.52 2.01 0.56 -4.58 115.64 130.39 2cui s THR 21 Ca 1.16 0.22 -0.05 0.00 0.31 0.00 0.00 61.69 63.32 2cui s THR 21 Cb -0.80 -3.74 0.21 0.00 0.01 0.00 0.00 72.50 68.18 2cui s THR 21 CO 0.42 -0.76 1.73 0.71 -0.69 0.00 0.00 174.62 176.03 2cui h THR 22 N 0.03 0.68 0.00 -0.82 1.35 -1.91 -2.78 112.91 109.46 2cui h THR 22 Ca -0.46 -0.15 -0.00 0.00 -0.55 0.00 0.00 66.41 65.25 2cui h THR 22 Cb 1.22 0.19 -0.00 0.00 -1.73 0.00 0.00 68.15 67.83 2cui h THR 22 CO 0.61 0.08 -0.21 -1.20 -0.25 0.00 0.00 175.52 174.56 2cui n SER 23 N -5.00 1.38 -3.19 5.36 7.64 -1.26 -3.40 113.62 115.16 2cui n SER 23 Ca 0.13 -2.64 -0.11 0.00 1.01 0.00 0.00 58.87 57.26 2cui n SER 23 Cb 0.39 -0.34 -0.01 0.00 -1.01 0.00 0.00 64.21 63.25 2cui n SER 23 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2cui s SER 24 N -2.11 0.31 0.01 6.43 0.01 -1.12 -0.74 113.70 116.49 2cui s SER 24 Ca 0.19 -1.22 -0.28 0.00 1.31 0.00 0.00 55.95 55.95 2cui s SER 24 Cb 0.17 0.76 0.10 0.00 0.21 0.00 0.00 66.02 67.26 2cui s SER 24 CO 0.02 -1.49 1.25 -1.48 0.41 0.00 0.00 173.24 171.95 2cui s LEU 25 N -3.12 -0.03 0.05 2.44 0.05 -1.15 0.21 118.68 117.13 2cui s LEU 25 Ca 0.21 -0.23 0.05 0.00 0.05 0.00 0.00 54.13 54.21 2cui s LEU 25 Cb -0.03 1.46 -0.02 0.00 -2.05 0.00 0.00 46.19 45.54 2cui s LEU 25 CO 0.14 -0.39 -0.14 -0.60 -0.55 0.00 0.00 176.35 174.81 2cui s ARG 26 N -2.26 0.89 0.30 1.48 3.52 -0.46 -2.75 118.95 119.67 2cui s ARG 26 Ca 0.21 -0.81 0.09 0.00 -0.13 0.00 0.00 55.73 55.10 2cui s ARG 26 Cb 0.02 -0.90 -0.05 0.00 -1.56 0.00 0.00 34.95 32.46 2cui s ARG 26 CO -0.01 0.22 0.02 -0.51 -0.81 0.00 0.00 175.30 174.20 2cui s LEU 27 N -1.30 3.10 -0.24 -0.88 1.43 0.46 -0.04 118.68 121.20 2cui s LEU 27 Ca 0.00 -0.79 -0.07 0.00 -1.03 0.00 0.00 54.13 52.24 2cui s LEU 27 Cb -0.08 -1.57 0.12 0.00 0.03 0.00 0.00 46.19 44.68 2cui s LEU 27 CO 0.01 -0.12 0.50 0.20 0.23 0.00 0.00 176.35 177.17 2cui s ASN 28 N -3.71 -0.57 0.02 2.29 0.01 -0.91 -3.64 114.94 108.44 2cui s ASN 28 Ca 0.33 1.05 0.03 0.00 -0.71 0.00 0.00 52.86 53.57 2cui s ASN 28 Cb -0.04 1.69 -0.02 0.00 0.41 0.00 0.00 41.25 43.29 2cui s ASN 28 CO 0.20 -0.24 -0.10 -1.66 -1.51 0.00 0.00 177.10 173.79 2cui s TRP 29 N 2.71 0.91 -0.15 2.20 -2.14 -1.21 -3.01 118.94 118.25 2cui s TRP 29 Ca 0.01 -0.30 -0.08 0.00 2.66 0.00 0.00 56.10 58.39 2cui s TRP 29 Cb -0.13 -0.55 -0.04 0.00 -3.10 0.00 0.00 33.47 29.64 2cui s TRP 29 CO -0.16 -0.01 0.14 -2.00 -2.66 0.00 0.00 176.95 172.26 2cui s GLU 30 N -0.86 3.76 -0.04 3.25 2.12 -1.26 -4.67 118.70 120.99 2cui s GLU 30 Ca -0.00 -0.17 -0.09 0.00 0.36 0.00 0.00 54.97 55.07 2cui s GLU 30 Cb -0.06 -3.29 0.01 0.00 0.26 0.00 0.00 34.13 31.05 2cui s GLU 30 CO 0.00 0.57 0.21 0.00 -0.54 0.00 0.00 175.26 175.50 2cui s ALA 31 N -0.43 -0.51 0.72 6.30 0.00 -1.26 -1.52 121.76 125.07 2cui s ALA 31 Ca 0.12 0.31 -0.12 0.00 0.00 0.00 0.00 51.96 52.27 2cui s ALA 31 Cb -0.12 -0.13 0.03 0.00 0.00 0.00 0.00 23.12 22.91 2cui s ALA 31 CO 0.01 -0.17 1.10 -1.25 0.00 0.00 0.00 175.76 175.46 2cui s PRO 32 N -0.63 2.49 0.08 0.00 0.04 -1.26 -4.98 135.00 130.74 2cui s PRO 32 Ca -0.07 1.26 -0.31 0.00 0.04 0.00 0.00 61.00 61.92 2cui s PRO 32 Cb -0.04 -1.92 -0.07 0.00 0.04 0.00 0.00 34.50 32.51 2cui s PRO 32 CO 0.01 -1.47 1.38 -1.25 0.04 0.00 0.00 177.00 175.71 2cui s PRO 33 N -4.55 4.32 -0.26 0.56 0.04 -1.26 -3.08 135.00 130.76 2cui s PRO 33 Ca 0.64 2.03 -0.00 0.00 0.04 0.00 0.00 61.00 63.70 2cui s PRO 33 Cb -0.19 -3.34 0.00 0.00 0.04 0.00 0.00 34.50 31.01 2cui s PRO 33 CO 0.50 -0.46 0.06 0.41 0.04 0.00 0.00 177.00 177.54 2cui n GLY 34 N 3.52 0.38 0.13 0.56 0.00 -1.26 -4.97 105.19 103.56 2cui n GLY 34 Ca 0.12 -0.69 -0.22 0.00 0.00 0.00 0.00 46.02 45.23 2cui n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cui n ALA 35 N -1.68 1.21 -3.08 4.61 0.00 -1.18 -5.01 120.51 115.39 2cui n ALA 35 Ca -0.03 -0.95 -0.11 0.00 0.00 0.00 0.00 53.44 52.35 2cui n ALA 35 Cb 0.52 -0.20 -0.11 0.00 0.00 0.00 0.00 19.45 19.67 2cui n ALA 35 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2cui s PHE 36 N -2.51 0.02 0.13 0.00 0.08 -1.26 -4.75 117.98 109.70 2cui s PHE 36 Ca -0.33 -0.06 -0.02 0.00 0.12 0.00 0.00 56.93 56.64 2cui s PHE 36 Cb 0.10 -0.04 -0.09 0.00 -0.57 0.00 0.00 43.02 42.42 2cui s PHE 36 CO 0.61 -0.23 1.31 0.22 -0.10 0.00 0.00 175.22 177.02 2cui h ASP 37 N 4.65 0.43 -5.32 1.36 3.58 -0.25 -3.33 116.42 117.53 2cui h ASP 37 Ca -0.30 -0.35 -0.19 0.00 0.42 0.00 0.00 57.03 56.61 2cui h ASP 37 Cb 1.20 -0.13 -0.04 0.00 1.72 0.00 0.00 39.33 42.08 2cui h ASP 37 CO 0.41 1.17 0.01 -0.94 -2.88 0.00 0.00 179.24 177.01 2cui s SER 38 N -7.04 0.64 -0.10 2.28 1.04 -0.53 -2.76 113.70 107.24 2cui s SER 38 Ca -0.05 -1.41 -0.02 0.00 0.48 0.00 0.00 55.95 54.95 2cui s SER 38 Cb 0.09 0.76 0.04 0.00 0.10 0.00 0.00 66.02 67.01 2cui s SER 38 CO 0.86 -1.50 0.02 -0.36 0.98 0.00 0.00 173.24 173.24 2cui s PHE 39 N -2.57 0.62 -0.47 5.02 0.08 0.56 -1.25 117.98 119.97 2cui s PHE 39 Ca 0.25 -0.27 -0.13 0.00 0.12 0.00 0.00 56.93 56.90 2cui s PHE 39 Cb -0.03 -0.80 0.09 0.00 -0.57 0.00 0.00 43.02 41.72 2cui s PHE 39 CO 0.18 -0.39 0.37 -1.17 -0.10 0.00 0.00 175.22 174.11 2cui s LEU 40 N 1.99 5.62 -0.16 -0.37 2.96 -0.59 -2.27 118.68 125.86 2cui s LEU 40 Ca 0.03 -1.54 -0.18 0.00 -0.22 0.00 0.00 54.13 52.23 2cui s LEU 40 Cb -0.14 -2.11 -0.04 0.00 0.50 0.00 0.00 46.19 44.40 2cui s LEU 40 CO -0.06 -0.67 0.47 -0.22 -1.32 0.00 0.00 176.35 174.56 2cui s LEU 41 N 1.54 4.21 -0.28 -0.68 2.96 -1.02 -1.46 118.68 123.94 2cui s LEU 41 Ca 0.04 0.71 -0.03 0.00 -0.22 0.00 0.00 54.13 54.62 2cui s LEU 41 Cb -0.25 -2.66 0.03 0.00 0.50 0.00 0.00 46.19 43.81 2cui s LEU 41 CO 0.04 -0.07 -0.01 -0.13 -1.32 0.00 0.00 176.35 174.86 2cui s ARG 42 N 1.08 2.76 -0.26 1.98 0.52 -0.04 -1.55 118.95 123.43 2cui s ARG 42 Ca 0.24 -1.04 -0.02 0.00 -0.52 0.00 0.00 55.73 54.39 2cui s ARG 42 Cb -0.15 -3.15 0.03 0.00 0.52 0.00 0.00 34.95 32.21 2cui s ARG 42 CO 0.09 -0.48 -0.05 -0.59 0.02 0.00 0.00 175.30 174.29 2cui s PHE 43 N 1.35 3.12 0.22 -0.53 -0.71 -1.20 -2.50 117.98 117.73 2cui s PHE 43 Ca -0.01 -1.65 0.05 0.00 -1.04 0.00 0.00 56.93 54.29 2cui s PHE 43 Cb -0.18 -2.07 -0.05 0.00 -1.21 0.00 0.00 43.02 39.51 2cui s PHE 43 CO -0.02 -0.75 -0.07 0.20 -1.34 0.00 0.00 175.22 173.25 2cui s GLY 44 N 1.30 1.48 -0.45 1.99 0.00 -1.19 -4.28 107.32 106.18 2cui s GLY 44 Ca -0.01 -1.71 -0.28 0.00 0.00 0.00 0.00 44.72 42.71 2cui s GLY 44 CO -0.04 -1.71 1.06 0.14 0.00 0.00 0.00 173.10 172.56 2cui s VAL 45 N -3.21 4.33 -0.31 1.40 1.01 -1.26 -3.21 120.40 119.15 2cui s VAL 45 Ca 0.25 1.15 -0.29 0.00 0.00 0.00 0.00 61.98 63.09 2cui s VAL 45 Cb 0.03 -4.52 -0.01 0.00 0.00 0.00 0.00 36.38 31.88 2cui s VAL 45 CO 0.07 -0.88 1.68 -2.16 0.00 0.00 0.00 175.10 173.81 2cui s PRO 46 N 4.12 3.51 -0.11 2.72 0.04 -1.26 -5.00 135.00 139.02 2cui s PRO 46 Ca 0.44 1.40 -0.05 0.00 0.04 0.00 0.00 61.00 62.83 2cui s PRO 46 Cb -0.09 -4.12 -0.04 0.00 0.04 0.00 0.00 34.50 30.29 2cui s PRO 46 CO 0.28 -1.65 0.09 -1.54 0.04 0.00 0.00 177.00 174.22 2cui s SER 47 N 5.18 5.94 0.32 6.66 1.04 -1.26 -5.08 113.70 126.50 2cui s SER 47 Ca 0.74 0.34 -0.28 0.00 0.48 0.00 0.00 55.95 57.23 2cui s SER 47 Cb -0.21 -1.84 -0.10 0.00 0.10 0.00 0.00 66.02 63.97 2cui s SER 47 CO 0.32 0.40 1.22 -2.16 0.98 0.00 0.00 173.24 174.00 2cui s PRO 48 N -0.96 4.41 0.30 4.02 0.04 -1.26 -4.94 135.00 136.60 2cui s PRO 48 Ca 0.14 2.04 0.17 0.00 0.04 0.00 0.00 61.00 63.39 2cui s PRO 48 Cb -0.12 -3.06 0.11 0.00 0.04 0.00 0.00 34.50 31.47 2cui s PRO 48 CO 0.03 -0.07 1.44 0.66 0.04 0.00 0.00 177.00 179.09 2cui h SER 49 N 3.43 0.00 0.60 6.66 4.64 -2.00 -3.22 113.55 123.66 2cui h SER 49 Ca -0.48 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.79 2cui h SER 49 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.31 2cui h SER 49 CO 0.65 0.39 -0.24 0.00 -0.87 0.00 0.00 176.83 176.76 2cui h THR 50 N 0.00 0.75 -3.65 2.95 1.03 -2.06 -3.44 112.91 108.49 2cui h THR 50 Ca -0.01 -1.01 -0.48 0.00 -0.01 0.00 0.00 66.41 64.89 2cui h THR 50 Cb 1.30 1.63 0.05 0.00 -1.07 0.00 0.00 68.15 70.06 2cui h THR 50 CO 0.05 0.24 0.16 -0.22 -0.01 0.00 0.00 175.52 175.74 2cui s LEU 51 N -7.27 3.36 0.25 0.00 2.96 -1.22 -5.06 118.68 111.70 2cui s LEU 51 Ca -0.01 0.80 -0.24 0.00 -0.22 0.00 0.00 54.13 54.46 2cui s LEU 51 Cb 0.12 -3.68 -0.09 0.00 0.50 0.00 0.00 46.19 43.04 2cui s LEU 51 CO 0.64 -0.90 0.83 -1.61 -1.32 0.00 0.00 176.35 173.99 2cui s GLU 52 N -4.92 4.47 0.61 1.98 0.41 -1.26 -4.98 118.70 115.02 2cui s GLU 52 Ca 0.52 1.13 -0.17 0.00 -0.41 0.00 0.00 54.97 56.04 2cui s GLU 52 Cb -0.10 -2.95 -0.02 0.00 -1.78 0.00 0.00 34.13 29.27 2cui s GLU 52 CO 0.45 0.40 1.12 -1.25 -0.49 0.00 0.00 175.26 175.49 2cui s PRO 53 N -1.78 3.02 0.06 0.39 0.04 -1.26 -5.06 135.00 130.40 2cui s PRO 53 Ca 0.44 1.48 0.09 0.00 0.04 0.00 0.00 61.00 63.05 2cui s PRO 53 Cb -0.19 -1.97 -0.03 0.00 0.04 0.00 0.00 34.50 32.34 2cui s PRO 53 CO 0.24 -1.09 -0.24 -1.01 0.04 0.00 0.00 177.00 174.94 2cui s HIS 54 N -2.11 2.39 -2.00 0.56 3.76 -1.26 -5.00 115.29 111.63 2cui s HIS 54 Ca 0.69 -0.36 0.12 0.00 -0.15 0.00 0.00 55.06 55.36 2cui s HIS 54 Cb -0.22 -1.39 0.71 0.00 1.11 0.00 0.00 32.58 32.79 2cui s HIS 54 CO 0.36 0.20 1.14 -0.35 -0.85 0.00 0.00 174.74 175.24 2cui n PRO 55 N 1.55 0.49 -2.50 8.40 -0.04 -1.26 -4.73 135.00 136.91 2cui n PRO 55 Ca -0.17 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.86 2cui n PRO 55 Cb 0.52 -1.38 -0.02 0.00 -0.04 0.00 0.00 33.50 32.58 2cui n PRO 55 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 2cui s ARG 56 N -2.00 4.23 0.11 0.54 3.52 -1.26 -4.99 118.95 119.09 2cui s ARG 56 Ca 0.18 1.54 -0.31 0.00 -0.13 0.00 0.00 55.73 57.01 2cui s ARG 56 Cb 0.08 -3.73 -0.08 0.00 -1.56 0.00 0.00 34.95 29.67 2cui s ARG 56 CO 0.14 -0.70 1.36 -1.25 -0.81 0.00 0.00 175.30 174.04 2cui s PRO 57 N 3.43 4.34 -0.32 5.12 0.04 -1.26 -5.01 135.00 141.33 2cui s PRO 57 Ca 0.51 2.03 -0.00 0.00 0.04 0.00 0.00 61.00 63.58 2cui s PRO 57 Cb -0.19 -3.26 0.07 0.00 0.04 0.00 0.00 34.50 31.16 2cui s PRO 57 CO 0.12 -0.41 0.02 -0.48 0.04 0.00 0.00 177.00 176.29 2cui s LEU 58 N 1.06 4.18 0.21 -3.56 2.34 -1.26 -5.10 118.68 116.55 2cui s LEU 58 Ca 0.64 -1.56 -0.28 0.00 0.06 0.00 0.00 54.13 52.98 2cui s LEU 58 Cb -0.36 -1.69 -0.08 0.00 -0.56 0.00 0.00 46.19 43.50 2cui s LEU 58 CO 0.30 -0.31 0.88 -1.48 -1.06 0.00 0.00 176.35 174.68 2cui s LEU 59 N 1.15 4.62 0.18 1.48 2.34 -1.26 -5.07 118.68 122.13 2cui s LEU 59 Ca -0.01 1.83 0.08 0.00 0.06 0.00 0.00 54.13 56.09 2cui s LEU 59 Cb -0.20 -3.50 -0.04 0.00 -0.56 0.00 0.00 46.19 41.89 2cui s LEU 59 CO -0.03 0.16 -0.01 -1.10 -1.06 0.00 0.00 176.35 174.31 2cui s GLN 60 N -1.10 2.37 0.07 1.48 1.11 -1.26 -5.00 119.66 117.34 2cui s GLN 60 Ca 0.39 -1.14 0.01 0.00 0.01 0.00 0.00 55.36 54.63 2cui s GLN 60 Cb -0.25 -2.33 -0.04 0.00 -1.01 0.00 0.00 33.01 29.38 2cui s GLN 60 CO 0.30 0.45 -0.05 0.50 0.01 0.00 0.00 175.29 176.49 2cui s ARG 61 N -3.00 0.71 0.04 2.91 3.52 -1.26 -5.11 118.95 116.77 2cui s ARG 61 Ca 0.28 -1.24 -0.01 0.00 -0.13 0.00 0.00 55.73 54.63 2cui s ARG 61 Cb -0.09 -0.03 -0.03 0.00 -1.56 0.00 0.00 34.95 33.24 2cui s ARG 61 CO 0.18 -0.05 -0.03 -1.83 -0.81 0.00 0.00 175.30 172.76 2cui s GLU 62 N -3.69 0.50 0.11 5.12 1.03 -1.26 -3.23 118.70 117.28 2cui s GLU 62 Ca 0.08 -0.99 0.03 0.00 0.03 0.00 0.00 54.97 54.12 2cui s GLU 62 Cb 0.05 0.18 -0.04 0.00 -0.80 0.00 0.00 34.13 33.52 2cui s GLU 62 CO -0.07 -0.09 0.15 -1.17 -1.33 0.00 0.00 175.26 172.76 2cui s LEU 63 N -2.38 4.01 -0.23 1.83 2.96 -0.60 -4.92 118.68 119.35 2cui s LEU 63 Ca -0.02 0.05 0.02 0.00 -0.22 0.00 0.00 54.13 53.96 2cui s LEU 63 Cb 0.01 -2.64 0.05 0.00 0.50 0.00 0.00 46.19 44.11 2cui s LEU 63 CO -0.07 0.13 -0.13 -0.32 -1.32 0.00 0.00 176.35 174.64 2cui s MET 64 N -2.72 2.37 -0.01 1.98 -2.45 -1.26 -2.45 119.30 114.75 2cui s MET 64 Ca 0.32 -1.12 0.01 0.00 -1.25 0.00 0.00 55.69 53.64 2cui s MET 64 Cb -0.12 -2.72 0.01 0.00 1.25 0.00 0.00 34.83 33.25 2cui s MET 64 CO 0.25 -0.46 -0.04 0.08 1.05 0.00 0.00 175.02 175.90 2cui s VAL 65 N 1.21 0.34 0.60 10.11 1.01 -0.96 -4.96 120.40 127.75 2cui s VAL 65 Ca -0.04 -0.12 -0.17 0.00 0.00 0.00 0.00 61.98 61.64 2cui s VAL 65 Cb -0.18 -0.33 -0.03 0.00 0.00 0.00 0.00 36.38 35.84 2cui s VAL 65 CO -0.08 0.13 1.12 -2.16 0.00 0.00 0.00 175.10 174.11 2cui s PRO 66 N 0.27 3.08 0.26 2.72 0.04 -1.26 0.21 135.00 140.31 2cui s PRO 66 Ca -0.03 1.50 -0.04 0.00 0.04 0.00 0.00 61.00 62.47 2cui s PRO 66 Cb -0.06 -1.98 0.51 0.00 0.04 0.00 0.00 34.50 33.01 2cui s PRO 66 CO -0.00 -1.05 1.65 0.78 0.04 0.00 0.00 177.00 178.42 2cui h GLY 67 N 0.61 1.03 0.94 0.56 0.00 -1.63 0.60 103.07 105.18 2cui h GLY 67 Ca -0.48 0.03 0.11 0.00 0.00 0.00 0.00 47.33 46.99 2cui h GLY 67 CO 0.55 -0.28 0.42 0.00 0.00 0.00 0.00 176.54 177.24 2cui h THR 68 N 0.18 0.38 -3.34 4.70 1.03 -1.88 -3.37 112.91 110.60 2cui h THR 68 Ca 0.45 0.00 -0.66 0.00 -0.01 0.00 0.00 66.41 66.19 2cui h THR 68 Cb 0.82 0.66 -0.28 0.00 -1.07 0.00 0.00 68.15 68.28 2cui h THR 68 CO -0.62 0.00 -0.74 -0.13 -0.01 0.00 0.00 175.52 174.02 2cui s ARG 69 N -4.61 3.37 -0.67 0.00 0.52 0.21 -5.04 118.95 112.74 2cui s ARG 69 Ca -0.04 -0.65 0.05 0.00 -0.52 0.00 0.00 55.73 54.57 2cui s ARG 69 Cb 0.15 -2.87 0.28 0.00 0.52 0.00 0.00 34.95 33.03 2cui s ARG 69 CO 0.54 -0.06 0.88 0.72 0.02 0.00 0.00 175.30 177.41 2cui n HIS 70 N 4.35 3.64 -3.98 -0.53 8.25 -1.26 -4.28 115.22 121.41 2cui n HIS 70 Ca -0.18 -3.97 -0.09 0.00 -0.26 0.00 0.00 57.72 53.22 2cui n HIS 70 Cb 0.51 -0.61 -0.10 0.00 1.12 0.00 0.00 29.99 30.92 2cui n HIS 70 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2cui s SER 71 N -2.65 0.26 -0.26 0.41 1.04 -1.26 -3.32 113.70 107.92 2cui s SER 71 Ca 0.42 -0.64 -0.10 0.00 0.48 0.00 0.00 55.95 56.11 2cui s SER 71 Cb 0.18 0.19 0.11 0.00 0.10 0.00 0.00 66.02 66.59 2cui s SER 71 CO -0.04 -0.49 0.58 0.00 0.98 0.00 0.00 173.24 174.28 2cui s ALA 72 N -2.67 -1.72 -0.22 5.32 0.00 -1.24 -4.88 121.76 116.35 2cui s ALA 72 Ca -0.05 2.10 0.02 0.00 0.00 0.00 0.00 51.96 54.03 2cui s ALA 72 Cb -0.01 -1.54 0.04 0.00 0.00 0.00 0.00 23.12 21.62 2cui s ALA 72 CO -0.05 -0.73 -0.12 0.08 0.00 0.00 0.00 175.76 174.94 2cui s VAL 73 N 2.46 1.91 -0.06 0.00 1.01 -1.26 -0.41 120.40 124.06 2cui s VAL 73 Ca -0.06 -1.21 -0.13 0.00 0.00 0.00 0.00 61.98 60.58 2cui s VAL 73 Cb -0.10 -1.94 -0.05 0.00 0.00 0.00 0.00 36.38 34.29 2cui s VAL 73 CO -0.17 0.18 0.34 -0.76 0.00 0.00 0.00 175.10 174.68 2cui s LEU 74 N 1.27 4.41 0.29 3.92 2.01 -1.11 -4.95 118.68 124.52 2cui s LEU 74 Ca -0.03 0.78 0.06 0.00 0.01 0.00 0.00 54.13 54.96 2cui s LEU 74 Cb -0.17 -2.45 -0.06 0.00 0.01 0.00 0.00 46.19 43.52 2cui s LEU 74 CO -0.08 0.29 -0.04 -0.13 1.01 0.00 0.00 176.35 177.40 2cui s ARG 75 N -0.73 1.58 -0.89 1.70 0.52 -1.26 -2.95 118.95 116.92 2cui s ARG 75 Ca 0.21 -1.81 -0.04 0.00 -0.52 0.00 0.00 55.73 53.57 2cui s ARG 75 Cb -0.15 -1.13 0.00 0.00 0.52 0.00 0.00 34.95 34.19 2cui s ARG 75 CO 0.10 0.00 0.48 -3.47 0.02 0.00 0.00 175.30 172.43 2cui n ASP 76 N -0.61 -4.40 -4.17 0.23 2.03 -1.18 -4.99 116.55 103.46 2cui n ASP 76 Ca -0.05 -0.22 -0.20 0.00 0.52 0.00 0.00 54.79 54.84 2cui n ASP 76 Cb 0.64 -3.17 0.11 0.00 -0.72 0.00 0.00 41.12 37.97 2cui n ASP 76 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2cui n LEU 77 N -2.74 0.00 -4.99 -2.67 4.77 0.08 -5.07 117.00 106.38 2cui n LEU 77 Ca -0.04 -1.79 -0.22 0.00 -0.03 0.00 0.00 56.01 53.92 2cui n LEU 77 Cb 0.56 -0.57 0.08 0.00 -2.33 0.00 0.00 43.42 41.15 2cui n LEU 77 CO 0.32 -0.94 0.45 -0.60 -1.33 0.00 0.00 177.39 175.29 2cui s ARG 78 N -4.77 2.08 -0.04 3.23 3.52 -1.26 -4.69 118.95 117.03 2cui s ARG 78 Ca 0.57 -1.07 -0.14 0.00 -0.13 0.00 0.00 55.73 54.97 2cui s ARG 78 Cb -0.03 -2.44 -0.05 0.00 -1.56 0.00 0.00 34.95 30.87 2cui s ARG 78 CO 0.38 -1.09 0.37 -1.54 -0.81 0.00 0.00 175.30 172.61 2cui s SER 79 N -4.61 6.72 -1.12 -2.12 1.04 -1.26 -4.29 113.70 108.06 2cui s SER 79 Ca 0.62 0.85 -0.24 0.00 0.48 0.00 0.00 55.95 57.66 2cui s SER 79 Cb -0.07 -2.22 0.03 0.00 0.10 0.00 0.00 66.02 63.86 2cui s SER 79 CO 0.41 0.30 0.46 0.61 0.98 0.00 0.00 173.24 176.00 2cui n GLY 80 N 2.05 -0.58 3.25 7.32 0.00 -0.89 -4.86 105.19 111.49 2cui n GLY 80 Ca -0.14 0.26 -0.18 0.00 0.00 0.00 0.00 46.02 45.95 2cui n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2cui s THR 81 N -3.83 1.39 -0.24 2.61 2.01 -1.26 -4.90 115.64 111.41 2cui s THR 81 Ca 0.33 -1.76 -0.14 0.00 0.31 0.00 0.00 61.69 60.43 2cui s THR 81 Cb -0.19 -1.58 -0.04 0.00 0.01 0.00 0.00 72.50 70.70 2cui s THR 81 CO 0.85 -0.42 0.34 -0.22 -0.69 0.00 0.00 174.62 174.49 2cui s LEU 82 N -2.51 4.09 0.12 4.42 1.98 -1.26 -1.63 118.68 123.88 2cui s LEU 82 Ca 0.10 0.33 0.06 0.00 -2.89 0.00 0.00 54.13 51.74 2cui s LEU 82 Cb -0.05 -2.40 -0.04 0.00 0.66 0.00 0.00 46.19 44.37 2cui s LEU 82 CO 0.03 -0.10 -0.05 -0.31 -1.89 0.00 0.00 176.35 174.03 2cui s TYR 83 N 1.64 2.84 -0.42 5.38 1.51 -0.74 -4.56 117.35 123.01 2cui s TYR 83 Ca 0.15 -0.11 -0.09 0.00 -1.01 0.00 0.00 57.07 56.00 2cui s TYR 83 Cb -0.15 -1.45 0.07 0.00 -0.11 0.00 0.00 41.96 40.32 2cui s TYR 83 CO 0.08 0.46 0.26 0.45 -1.11 0.00 0.00 175.55 175.69 2cui s SER 84 N -2.41 5.65 0.06 2.29 0.15 -1.20 -3.38 113.70 114.86 2cui s SER 84 Ca 0.24 -1.46 -0.06 0.00 0.70 0.00 0.00 55.95 55.37 2cui s SER 84 Cb -0.11 -1.99 -0.05 0.00 -1.71 0.00 0.00 66.02 62.16 2cui s SER 84 CO 0.16 -0.53 0.31 -0.76 1.20 0.00 0.00 173.24 173.63 2cui s LEU 85 N 1.44 4.34 -0.24 3.45 1.43 -0.59 -3.16 118.68 125.34 2cui s LEU 85 Ca 0.03 0.58 -0.03 0.00 -1.03 0.00 0.00 54.13 53.68 2cui s LEU 85 Cb -0.23 -2.90 0.13 0.00 0.03 0.00 0.00 46.19 43.23 2cui s LEU 85 CO 0.02 0.18 0.43 -0.89 0.23 0.00 0.00 176.35 176.33 2cui s THR 86 N -1.42 -0.68 0.27 5.49 2.01 -1.04 -1.24 115.64 119.03 2cui s THR 86 Ca 0.32 -0.01 -0.11 0.00 0.31 0.00 0.00 61.69 62.19 2cui s THR 86 Cb -0.13 -0.82 -0.08 0.00 0.01 0.00 0.00 72.50 71.48 2cui s THR 86 CO 0.19 -0.06 0.63 -0.22 -0.69 0.00 0.00 174.62 174.47 2cui s LEU 87 N 2.61 4.11 -0.19 4.42 2.96 -0.87 -0.86 118.68 130.86 2cui s LEU 87 Ca 0.11 1.06 -0.01 0.00 -0.22 0.00 0.00 54.13 55.06 2cui s LEU 87 Cb -0.15 -3.84 0.06 0.00 0.50 0.00 0.00 46.19 42.76 2cui s LEU 87 CO -0.16 -0.14 -0.01 -0.31 -1.32 0.00 0.00 176.35 174.41 2cui s TYR 88 N -1.92 1.50 -1.09 5.38 2.02 -0.54 -1.20 117.35 121.50 2cui s TYR 88 Ca 0.50 -1.11 -0.23 0.00 -0.37 0.00 0.00 57.07 55.86 2cui s TYR 88 Cb -0.11 -1.22 -0.04 0.00 -0.40 0.00 0.00 41.96 40.19 2cui s TYR 88 CO 0.21 -0.64 1.87 0.20 -1.57 0.00 0.00 175.55 175.61 2cui s GLY 89 N 1.70 0.45 -0.32 0.71 0.00 0.21 -1.55 107.32 108.52 2cui s GLY 89 Ca -0.02 -2.04 -0.28 0.00 0.00 0.00 0.00 44.72 42.37 2cui s GLY 89 CO -0.07 3.36 1.81 1.08 0.00 0.00 0.00 173.10 179.28 2cui s LEU 90 N 9.34 3.51 -0.38 0.66 2.01 -0.38 -0.39 118.68 133.05 2cui s LEU 90 Ca 0.65 1.34 0.07 0.00 0.01 0.00 0.00 54.13 56.20 2cui s LEU 90 Cb -0.02 -3.52 0.69 0.00 0.01 0.00 0.00 46.19 43.35 2cui s LEU 90 CO 0.06 -1.71 1.84 -1.14 1.01 0.00 0.00 176.35 176.41 2cui n ARG 91 N 8.43 2.98 0.00 1.70 0.63 -1.16 0.49 116.66 129.72 2cui n ARG 91 Ca 0.23 -2.96 0.00 0.00 -0.92 0.00 0.00 57.85 54.20 2cui n ARG 91 Cb 0.47 -2.17 0.00 0.00 0.45 0.00 0.00 32.46 31.20 2cui n ARG 91 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2cui n GLY 92 N -0.59 0.58 0.21 5.14 0.00 -1.26 -4.73 105.19 104.53 2cui n GLY 92 Ca 0.49 -0.88 -0.05 0.00 0.00 0.00 0.00 46.02 45.58 2cui n GLY 92 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cui h PRO 93 N 0.00 0.40 -5.72 1.61 0.13 -2.02 -3.45 132.00 122.95 2cui h PRO 93 Ca 0.00 -0.21 -0.48 0.00 -0.87 0.00 0.00 66.00 64.44 2cui h PRO 93 Cb 0.00 0.01 -0.16 0.00 0.13 0.00 0.00 31.00 30.98 2cui h PRO 93 CO 0.00 0.77 -0.75 -1.01 -0.23 0.00 0.00 178.00 176.78 2cui s HIS 94 N -4.13 1.78 0.37 1.56 3.76 -1.26 -5.13 115.29 112.24 2cui s HIS 94 Ca -0.06 -0.52 -0.26 0.00 -0.15 0.00 0.00 55.06 54.07 2cui s HIS 94 Cb 0.13 -0.84 -0.09 0.00 1.11 0.00 0.00 32.58 32.89 2cui s HIS 94 CO 0.80 0.37 1.15 0.15 -0.85 0.00 0.00 174.74 176.36 2cui s LYS 95 N -3.34 4.21 -0.21 1.40 1.02 -1.26 -3.01 119.74 118.54 2cui s LYS 95 Ca 0.20 1.81 -0.17 0.00 0.02 0.00 0.00 55.97 57.84 2cui s LYS 95 Cb -0.03 -2.78 -0.08 0.00 -0.52 0.00 0.00 37.83 34.42 2cui s LYS 95 CO 0.07 -0.18 -0.35 0.00 -0.92 0.00 0.00 175.35 173.97 2cui n ALA 96 N 0.32 0.98 -2.57 5.17 0.00 0.48 -4.83 120.51 120.06 2cui n ALA 96 Ca 0.03 -0.91 -0.26 0.00 0.00 0.00 0.00 53.44 52.30 2cui n ALA 96 Cb 0.46 0.06 -0.11 0.00 0.00 0.00 0.00 19.45 19.87 2cui n ALA 96 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2cui s ASP 97 N -6.42 3.39 -0.26 0.00 2.15 -1.18 -4.71 116.67 109.66 2cui s ASP 97 Ca -0.32 -1.39 -0.25 0.00 0.43 0.00 0.00 52.55 51.02 2cui s ASP 97 Cb 0.07 -0.25 0.07 0.00 -0.30 0.00 0.00 42.92 42.51 2cui s ASP 97 CO 0.45 -0.52 0.70 -0.94 -0.17 0.00 0.00 175.17 174.69 2cui s SER 98 N -3.64 -0.73 0.33 -0.34 1.04 -1.26 0.65 113.70 109.75 2cui s SER 98 Ca 0.34 1.39 0.06 0.00 0.48 0.00 0.00 55.95 58.22 2cui s SER 98 Cb 0.09 1.41 -0.07 0.00 0.10 0.00 0.00 66.02 67.55 2cui s SER 98 CO 0.17 -0.26 0.01 -0.51 0.98 0.00 0.00 173.24 173.62 2cui s ILE 99 N 0.32 1.55 -0.16 -1.02 2.07 -0.35 -4.93 121.20 118.68 2cui s ILE 99 Ca -0.00 -2.05 -0.01 0.00 -1.41 0.00 0.00 60.65 57.18 2cui s ILE 99 Cb -0.05 -2.73 0.04 0.00 0.13 0.00 0.00 42.46 39.86 2cui s ILE 99 CO 0.01 -0.10 -0.03 -1.10 -1.91 0.00 0.00 174.94 171.81 2cui s GLN 100 N -3.79 1.24 -0.15 3.50 -0.21 -1.26 -2.04 119.66 116.95 2cui s GLN 100 Ca 0.34 -0.44 0.01 0.00 0.02 0.00 0.00 55.36 55.29 2cui s GLN 100 Cb 0.07 -1.92 0.02 0.00 1.00 0.00 0.00 33.01 32.18 2cui s GLN 100 CO 0.15 -0.45 -0.18 0.20 -2.12 0.00 0.00 175.29 172.89 2cui s GLY 101 N 1.70 1.26 -0.00 3.09 0.00 -0.38 -4.86 107.32 108.13 2cui s GLY 101 Ca 0.01 -1.02 -0.01 0.00 0.00 0.00 0.00 44.72 43.70 2cui s GLY 101 CO -0.07 0.22 0.12 -0.51 0.00 0.00 0.00 173.10 172.86 2cui s THR 102 N 1.12 4.98 -0.04 0.90 -4.23 -1.26 -1.54 115.64 115.55 2cui s THR 102 Ca -0.01 -0.34 -0.27 0.00 -1.18 0.00 0.00 61.69 59.89 2cui s THR 102 Cb -0.14 -3.30 0.06 0.00 1.34 0.00 0.00 72.50 70.46 2cui s THR 102 CO -0.07 0.33 0.60 0.00 -0.54 0.00 0.00 174.62 174.94 2cui s ALA 103 N -1.25 -1.54 -0.20 3.99 0.00 -1.22 -4.83 121.76 116.71 2cui s ALA 103 Ca 0.25 1.10 0.01 0.00 0.00 0.00 0.00 51.96 53.32 2cui s ALA 103 Cb -0.12 0.00 0.02 0.00 0.00 0.00 0.00 23.12 23.02 2cui s ALA 103 CO 0.16 -0.34 -0.17 0.50 0.00 0.00 0.00 175.76 175.91 2cui s ARG 104 N -1.20 2.91 1.36 0.00 3.52 -1.26 -1.78 118.95 122.50 2cui s ARG 104 Ca -0.11 -0.89 -0.20 0.00 -0.13 0.00 0.00 55.73 54.39 2cui s ARG 104 Cb -0.01 -2.68 0.34 0.00 -1.56 0.00 0.00 34.95 31.04 2cui s ARG 104 CO 0.09 -0.27 0.89 0.25 -0.81 0.00 0.00 175.30 175.44 2cui n THR 105 N 4.61 0.00 -4.01 4.11 -2.24 -0.64 -4.85 114.28 111.26 2cui n THR 105 Ca -0.20 -0.20 -0.25 0.00 -2.27 0.00 0.00 64.05 61.14 2cui n THR 105 Cb 0.49 -0.97 -0.04 0.00 -2.10 0.00 0.00 70.33 67.71 2cui n THR 105 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2cui s LEU 106 N -7.34 4.10 0.00 3.22 1.43 -1.06 -3.73 118.68 115.30 2cui s LEU 106 Ca 0.67 0.01 -0.12 0.00 -1.03 0.00 0.00 54.13 53.66 2cui s LEU 106 Cb -0.17 -2.67 -0.33 0.00 0.03 0.00 0.00 46.19 43.05 2cui s LEU 106 CO 0.60 0.03 0.87 0.77 0.23 0.00 0.00 176.35 178.85 2cui h SER 107 N 2.04 0.69 0.00 2.29 4.64 -1.89 -2.38 113.55 118.94 2cui h SER 107 Ca -0.49 -0.85 0.00 0.00 -0.47 0.00 0.00 61.79 59.99 2cui h SER 107 Cb 1.21 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 2cui h SER 107 CO 0.65 1.69 0.00 0.61 -0.87 0.00 0.00 176.83 178.91 2cui n GLY 108 N 1.75 0.64 3.67 -0.77 0.00 -1.26 -4.80 105.19 104.42 2cui n GLY 108 Ca -0.19 -2.14 -0.29 0.00 0.00 0.00 0.00 46.02 43.40 2cui n GLY 108 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cui s PRO 109 N -0.58 0.27 0.10 1.61 0.04 -1.26 -5.02 135.00 130.16 2cui s PRO 109 Ca 0.00 0.47 -0.23 0.00 0.04 0.00 0.00 61.00 61.27 2cui s PRO 109 Cb 0.00 -1.72 -0.07 0.00 0.04 0.00 0.00 34.50 32.75 2cui s PRO 109 CO 0.00 -2.83 0.70 -1.12 0.04 0.00 0.00 177.00 173.79 2cui s SER 110 N -3.47 7.22 -0.09 6.66 0.01 -1.26 -4.98 113.70 117.79 2cui s SER 110 Ca 0.66 1.45 -0.38 0.00 1.31 0.00 0.00 55.95 58.99 2cui s SER 110 Cb -0.18 -2.44 -0.15 0.00 0.21 0.00 0.00 66.02 63.45 2cui s SER 110 CO 0.58 0.17 1.61 -0.24 0.41 0.00 0.00 173.24 175.77 2cui n SER 111 N 2.03 2.34 0.00 2.44 2.88 -1.26 -5.32 113.62 116.72 2cui n SER 111 Ca -0.06 1.08 0.00 0.00 -1.33 0.00 0.00 58.87 58.55 2cui n SER 111 Cb 0.50 -1.21 0.00 0.00 -0.75 0.00 0.00 64.21 62.74 2cui n SER 111 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42