#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k0p s ASN 3 N 0.00 5.80 0.68 4.52 0.01 -1.26 -4.99 114.94 119.69 3k0p s ASN 3 Ca 0.00 2.53 -0.13 0.00 -0.71 0.00 0.00 52.86 54.56 3k0p s ASN 3 Cb 0.00 -2.62 0.00 0.00 0.41 0.00 0.00 41.25 39.04 3k0p s ASN 3 CO 0.00 -1.19 1.07 -2.16 -1.51 0.00 0.00 177.10 173.31 3k0p s PRO 4 N -2.75 2.90 -0.04 -0.60 0.04 -1.26 -4.82 135.00 128.48 3k0p s PRO 4 Ca 0.66 1.12 0.06 0.00 0.04 0.00 0.00 61.00 62.88 3k0p s PRO 4 Cb -0.34 -1.98 -0.01 0.00 0.04 0.00 0.00 34.50 32.20 3k0p s PRO 4 CO 0.42 -1.14 -0.22 0.99 0.04 0.00 0.00 177.00 177.09 3k0p s THR 5 N -2.77 1.75 0.28 1.26 2.01 -1.26 -1.35 115.64 115.56 3k0p s THR 5 Ca 0.61 -0.92 0.04 0.00 0.31 0.00 0.00 61.69 61.74 3k0p s THR 5 Cb -0.16 -1.48 -0.06 0.00 0.01 0.00 0.00 72.50 70.82 3k0p s THR 5 CO 0.48 0.49 0.00 0.68 -0.69 0.00 0.00 174.62 175.59 3k0p s VAL 6 N -0.24 1.25 0.07 3.82 -7.23 -0.57 -4.57 120.40 112.92 3k0p s VAL 6 Ca 0.01 -2.05 0.01 0.00 -1.81 0.00 0.00 61.98 58.14 3k0p s VAL 6 Cb -0.11 -2.53 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 3k0p s VAL 6 CO 0.01 -0.21 -0.06 0.72 -0.31 0.00 0.00 175.10 175.26 3k0p s PHE 7 N -3.27 0.68 -0.09 2.82 -0.71 0.09 -0.60 117.98 116.91 3k0p s PHE 7 Ca 0.32 -0.81 0.04 0.00 -1.04 0.00 0.00 56.93 55.43 3k0p s PHE 7 Cb 0.06 -0.42 -0.00 0.00 -1.21 0.00 0.00 43.02 41.44 3k0p s PHE 7 CO 0.12 -0.19 -0.24 -0.06 -1.34 0.00 0.00 175.22 173.51 3k0p s PHE 8 N -2.94 2.55 -0.23 3.49 0.08 0.09 -2.23 117.98 118.80 3k0p s PHE 8 Ca 0.03 -0.95 -0.23 0.00 0.12 0.00 0.00 56.93 55.89 3k0p s PHE 8 Cb 0.01 -1.69 -0.01 0.00 -0.57 0.00 0.00 43.02 40.75 3k0p s PHE 8 CO -0.04 -0.36 0.75 -0.51 -0.10 0.00 0.00 175.22 174.95 3k0p s ASP 9 N 0.23 6.77 -0.11 1.36 1.01 -0.09 -0.88 116.67 124.95 3k0p s ASP 9 Ca -0.15 0.95 -0.08 0.00 0.71 0.00 0.00 52.55 53.98 3k0p s ASP 9 Cb -0.17 -2.40 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 3k0p s ASP 9 CO 0.08 -0.42 0.16 -0.63 0.21 0.00 0.00 175.17 174.56 3k0p s ILE 10 N 2.49 5.48 0.15 0.77 -1.09 -0.23 -0.49 121.20 128.28 3k0p s ILE 10 Ca 0.32 0.25 0.06 0.00 -2.23 0.00 0.00 60.65 59.06 3k0p s ILE 10 Cb -0.16 -3.42 -0.04 0.00 -1.58 0.00 0.00 42.46 37.26 3k0p s ILE 10 CO 0.09 0.61 -0.14 0.00 -1.23 0.00 0.00 174.94 174.28 3k0p s ALA 11 N -1.01 1.65 -0.19 9.38 0.00 -0.01 -0.87 121.76 130.72 3k0p s ALA 11 Ca 0.15 -1.44 0.00 0.00 0.00 0.00 0.00 51.96 50.68 3k0p s ALA 11 Cb -0.12 -0.06 0.05 0.00 0.00 0.00 0.00 23.12 22.98 3k0p s ALA 11 CO 0.05 0.06 -0.07 0.08 0.00 0.00 0.00 175.76 175.88 3k0p s VAL 12 N -2.57 1.31 -1.70 0.00 1.01 0.22 -1.05 120.40 117.61 3k0p s VAL 12 Ca 0.14 -0.83 -0.18 0.00 0.00 0.00 0.00 61.98 61.12 3k0p s VAL 12 Cb -0.02 -1.48 0.16 0.00 0.00 0.00 0.00 36.38 35.03 3k0p s VAL 12 CO 0.04 0.10 0.73 0.47 0.00 0.00 0.00 175.10 176.44 3k0p n ASP 13 N 4.79 -2.91 0.00 3.32 8.00 0.07 -1.20 116.55 128.62 3k0p n ASP 13 Ca -0.13 -1.04 0.00 0.00 0.71 0.00 0.00 54.79 54.33 3k0p n ASP 13 Cb 0.47 -2.64 0.00 0.00 -0.02 0.00 0.00 41.12 38.93 3k0p n ASP 13 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3k0p n GLY 14 N -1.42 1.16 3.73 0.44 0.00 -1.26 -5.02 105.19 102.82 3k0p n GLY 14 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 3k0p n GLY 14 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k0p s GLU 15 N -0.23 4.14 0.24 1.61 0.41 -0.34 -5.00 118.70 119.53 3k0p s GLU 15 Ca 0.00 -0.22 -0.30 0.00 -0.41 0.00 0.00 54.97 54.04 3k0p s GLU 15 Cb 0.00 -3.40 -0.10 0.00 -1.78 0.00 0.00 34.13 28.85 3k0p s GLU 15 CO 0.00 0.32 1.49 -1.25 -0.49 0.00 0.00 175.26 175.34 3k0p s PRO 16 N 0.29 4.23 -0.09 0.39 0.04 -1.26 -0.61 135.00 137.98 3k0p s PRO 16 Ca 0.08 2.37 0.17 0.00 0.04 0.00 0.00 61.00 63.65 3k0p s PRO 16 Cb -0.11 -3.10 -0.24 0.00 0.04 0.00 0.00 34.50 31.08 3k0p s PRO 16 CO -0.02 -0.50 0.24 -0.11 0.04 0.00 0.00 177.00 176.66 3k0p n LEU 17 N 2.61 0.00 0.00 -3.56 7.94 -0.05 -4.89 117.00 119.05 3k0p n LEU 17 Ca 0.08 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.98 3k0p n LEU 17 Cb 0.39 0.19 0.00 0.00 0.53 0.00 0.00 43.42 44.53 3k0p n LEU 17 CO 0.61 0.19 0.00 0.61 -1.11 0.00 0.00 177.39 177.69 3k0p n GLY 18 N 1.71 1.02 3.53 -3.96 0.00 -1.22 -4.97 105.19 101.30 3k0p n GLY 18 Ca -0.14 -2.07 -0.34 0.00 0.00 0.00 0.00 46.02 43.47 3k0p n GLY 18 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3k0p s ARG 19 N -1.02 3.75 -0.16 1.61 3.52 -1.26 -1.07 118.95 124.32 3k0p s ARG 19 Ca 0.00 -0.47 -0.05 0.00 -0.13 0.00 0.00 55.73 55.07 3k0p s ARG 19 Cb 0.00 -3.00 -0.03 0.00 -1.56 0.00 0.00 34.95 30.35 3k0p s ARG 19 CO 0.00 0.23 0.02 0.08 -0.81 0.00 0.00 175.30 174.82 3k0p s VAL 20 N 0.41 4.39 0.20 7.11 1.01 -0.06 -4.36 120.40 129.10 3k0p s VAL 20 Ca -0.02 -0.18 0.10 0.00 0.00 0.00 0.00 61.98 61.88 3k0p s VAL 20 Cb -0.14 -2.94 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 3k0p s VAL 20 CO 0.02 0.50 -0.13 -0.94 0.00 0.00 0.00 175.10 174.55 3k0p s SER 21 N 0.17 4.01 0.01 3.32 1.04 -0.17 -0.73 113.70 121.35 3k0p s SER 21 Ca 0.02 -0.70 0.02 0.00 0.48 0.00 0.00 55.95 55.76 3k0p s SER 21 Cb -0.13 -0.58 -0.01 0.00 0.10 0.00 0.00 66.02 65.41 3k0p s SER 21 CO 0.02 0.09 -0.05 -0.36 0.98 0.00 0.00 173.24 173.92 3k0p s PHE 22 N -1.83 0.45 -0.04 5.02 0.08 0.23 -0.15 117.98 121.74 3k0p s PHE 22 Ca 0.25 -0.16 -0.20 0.00 0.12 0.00 0.00 56.93 56.93 3k0p s PHE 22 Cb -0.08 -0.29 -0.05 0.00 -0.57 0.00 0.00 43.02 42.03 3k0p s PHE 22 CO 0.14 -0.03 0.59 -2.00 -0.10 0.00 0.00 175.22 173.83 3k0p s GLU 23 N -0.40 4.34 -0.16 0.44 2.12 -0.17 -1.51 118.70 123.35 3k0p s GLU 23 Ca -0.01 0.70 -0.05 0.00 0.36 0.00 0.00 54.97 55.97 3k0p s GLU 23 Cb -0.03 -3.38 -0.03 0.00 0.26 0.00 0.00 34.13 30.94 3k0p s GLU 23 CO -0.00 0.27 0.02 -0.51 -0.54 0.00 0.00 175.26 174.49 3k0p s LEU 24 N 0.17 3.59 -1.39 2.70 1.43 -0.46 -1.13 118.68 123.60 3k0p s LEU 24 Ca 0.31 0.02 -0.09 0.00 -1.03 0.00 0.00 54.13 53.35 3k0p s LEU 24 Cb -0.17 -1.88 0.08 0.00 0.03 0.00 0.00 46.19 44.25 3k0p s LEU 24 CO 0.16 0.21 2.33 0.49 0.23 0.00 0.00 176.35 179.77 3k0p n PHE 25 N 3.29 2.78 0.30 0.29 3.72 0.56 -3.98 117.46 124.42 3k0p n PHE 25 Ca -0.17 -2.89 0.18 0.00 -0.05 0.00 0.00 57.45 54.52 3k0p n PHE 25 Cb 0.53 -2.09 0.97 0.00 -0.94 0.00 0.00 39.48 37.95 3k0p n PHE 25 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3k0p h ALA 26 N 5.19 1.18 0.00 4.37 0.00 -1.84 -0.86 119.26 127.31 3k0p h ALA 26 Ca 0.63 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.51 3k0p h ALA 26 Cb 0.44 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3k0p h ALA 26 CO 1.64 0.03 0.00 -0.40 0.00 0.00 0.00 179.25 180.52 3k0p n ASP 27 N -3.38 0.21 0.00 0.00 5.75 -1.26 -3.20 116.55 114.67 3k0p n ASP 27 Ca -0.02 0.54 0.00 0.00 -0.01 0.00 0.00 54.79 55.29 3k0p n ASP 27 Cb 0.14 -0.59 0.00 0.00 -1.03 0.00 0.00 41.12 39.65 3k0p n ASP 27 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3k0p n LYS 28 N -1.71 2.48 -3.24 0.11 5.02 -0.51 -4.89 118.16 115.41 3k0p n LYS 28 Ca 0.05 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.09 3k0p n LYS 28 Cb 0.26 -0.87 -0.07 0.00 -0.02 0.00 0.00 35.03 34.33 3k0p n LYS 28 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 3k0p n VAL 29 N -1.71 0.17 -0.32 -0.18 0.24 -0.45 -4.93 118.33 111.16 3k0p n VAL 29 Ca 0.00 -4.38 -0.03 0.00 -2.04 0.00 0.00 64.34 57.89 3k0p n VAL 29 Cb 0.37 -1.86 0.13 0.00 -1.47 0.00 0.00 33.84 31.00 3k0p n VAL 29 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 3k0p h PRO 30 N 3.95 1.21 -0.35 7.34 0.13 -1.74 0.37 132.00 142.90 3k0p h PRO 30 Ca 0.10 -0.12 -0.11 0.00 -0.87 0.00 0.00 66.00 65.01 3k0p h PRO 30 Cb 0.82 -0.25 -0.01 0.00 0.13 0.00 0.00 31.00 31.69 3k0p h PRO 30 CO 0.56 0.86 -0.19 -0.22 -0.23 0.00 0.00 178.00 178.77 3k0p h LYS 31 N 1.23 0.75 -0.30 0.86 3.64 -1.94 -0.39 116.57 120.42 3k0p h LYS 31 Ca 0.32 -0.34 -0.14 0.00 -1.27 0.00 0.00 60.65 59.22 3k0p h LYS 31 Cb -0.04 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.76 3k0p h LYS 31 CO -0.06 0.96 -0.34 1.15 -2.27 0.00 0.00 179.45 178.89 3k0p h THR 32 N 0.54 1.29 -0.67 1.00 2.02 -1.92 -2.04 112.91 113.14 3k0p h THR 32 Ca 0.08 -1.52 0.01 0.00 0.77 0.00 0.00 66.41 65.75 3k0p h THR 32 Cb 0.74 1.57 -0.03 0.00 -1.74 0.00 0.00 68.15 68.69 3k0p h THR 32 CO 0.06 0.49 0.44 0.00 0.37 0.00 0.00 175.52 176.88 3k0p h ALA 33 N 0.71 0.85 -0.62 6.16 0.00 -0.90 -2.72 119.26 122.74 3k0p h ALA 33 Ca 0.04 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3k0p h ALA 33 Cb 0.92 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 3k0p h ALA 33 CO 0.08 0.26 0.19 1.49 0.00 0.00 0.00 179.25 181.27 3k0p h GLU 34 N 0.89 0.97 -0.03 0.00 4.57 -0.88 0.24 114.58 120.34 3k0p h GLU 34 Ca 0.25 -0.21 0.03 0.00 -1.18 0.00 0.00 59.36 58.25 3k0p h GLU 34 Cb -0.09 -0.14 -0.04 0.00 -0.16 0.00 0.00 28.75 28.32 3k0p h GLU 34 CO -0.06 0.86 -0.21 -0.97 -1.18 0.00 0.00 179.01 177.45 3k0p h ASN 35 N 0.89 -0.64 -0.56 1.04 -1.24 -1.23 0.47 115.58 114.32 3k0p h ASN 35 Ca 0.20 0.09 -0.07 0.00 0.71 0.00 0.00 56.30 57.23 3k0p h ASN 35 Cb 0.30 0.27 -0.02 0.00 0.73 0.00 0.00 38.32 39.60 3k0p h ASN 35 CO -0.00 -0.28 0.07 0.15 -1.29 0.00 0.00 177.43 176.08 3k0p h PHE 36 N -0.32 1.01 -0.09 0.67 3.57 -1.25 -1.36 116.94 119.17 3k0p h PHE 36 Ca 0.07 -0.15 0.02 0.00 3.53 0.00 0.00 57.97 61.44 3k0p h PHE 36 Cb 0.42 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 38.86 3k0p h PHE 36 CO -0.27 0.89 -0.06 -0.09 -2.23 0.00 0.00 178.31 176.55 3k0p h ARG 37 N 0.83 -0.06 -0.36 1.11 2.43 -0.71 -0.46 114.38 117.15 3k0p h ARG 37 Ca 0.17 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.22 3k0p h ARG 37 Cb 0.44 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 3k0p h ARG 37 CO 0.01 -0.04 -0.27 0.00 -1.51 0.00 0.00 179.97 178.16 3k0p h ALA 38 N 1.01 0.85 0.00 2.80 0.00 -0.79 -1.07 119.26 122.06 3k0p h ALA 38 Ca 0.06 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 3k0p h ALA 38 Cb 0.15 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3k0p h ALA 38 CO -0.13 0.64 -0.19 -0.07 0.00 0.00 0.00 179.25 179.49 3k0p h LEU 39 N 0.64 0.00 0.05 0.00 3.38 -1.01 -1.34 115.31 117.03 3k0p h LEU 39 Ca 0.08 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.78 3k0p h LEU 39 Cb 0.79 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.55 3k0p h LEU 39 CO 0.06 0.19 -1.18 0.28 0.09 0.00 0.00 178.44 177.89 3k0p h SER 40 N 0.00 0.54 0.37 -0.43 0.02 -0.22 -0.67 113.55 113.16 3k0p h SER 40 Ca -0.00 -0.52 -0.22 0.00 -0.84 0.00 0.00 61.79 60.20 3k0p h SER 40 Cb 0.42 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.79 3k0p h SER 40 CO 0.03 1.38 -0.95 0.71 -1.14 0.00 0.00 176.83 176.85 3k0p h THR 41 N 0.14 1.41 0.00 -2.27 1.35 -1.07 -2.87 112.91 109.60 3k0p h THR 41 Ca -0.14 -2.48 0.00 0.00 -0.55 0.00 0.00 66.41 63.24 3k0p h THR 41 Cb 1.87 2.44 0.00 0.00 -1.73 0.00 0.00 68.15 70.74 3k0p h THR 41 CO 0.20 0.74 0.00 0.61 -0.25 0.00 0.00 175.52 176.82 3k0p n GLY 42 N 0.96 0.75 0.30 5.82 0.00 -0.52 -4.85 105.19 107.65 3k0p n GLY 42 Ca -0.06 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.14 3k0p n GLY 42 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3k0p h GLU 43 N 2.66 0.00 -0.01 1.61 4.11 -1.81 -0.03 114.58 121.12 3k0p h GLU 43 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3k0p h GLU 43 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3k0p h GLU 43 CO 0.00 0.03 -0.09 1.63 0.07 0.00 0.00 179.01 180.65 3k0p n LYS 44 N -3.24 1.18 0.00 1.06 4.76 -1.26 -4.92 118.16 115.73 3k0p n LYS 44 Ca -0.02 -0.58 0.00 0.00 -2.87 0.00 0.00 58.31 54.84 3k0p n LYS 44 Cb 0.18 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.88 3k0p n LYS 44 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3k0p n GLY 45 N 1.22 0.52 3.55 0.72 0.00 -0.02 -5.05 105.19 106.12 3k0p n GLY 45 Ca 0.17 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 3k0p n GLY 45 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3k0p s PHE 46 N -2.00 0.21 -5.00 1.61 -0.71 -1.25 -5.11 117.98 105.73 3k0p s PHE 46 Ca 0.00 -0.57 0.00 0.00 -1.04 0.00 0.00 56.93 55.32 3k0p s PHE 46 Cb 0.00 0.23 0.00 0.00 -1.21 0.00 0.00 43.02 42.04 3k0p s PHE 46 CO 0.00 -0.94 0.00 0.41 -1.34 0.00 0.00 175.22 173.35 3k0p n GLY 47 N -0.35 0.03 0.20 1.99 0.00 -1.26 -4.43 105.19 101.37 3k0p n GLY 47 Ca -0.05 -1.23 0.10 0.00 0.00 0.00 0.00 46.02 44.84 3k0p n GLY 47 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3k0p h TYR 48 N 0.00 0.00 -2.37 1.61 0.05 -1.44 -3.45 116.97 111.38 3k0p h TYR 48 Ca 0.00 0.00 -0.57 0.00 0.05 0.00 0.00 58.73 58.21 3k0p h TYR 48 Cb 0.00 0.00 0.06 0.00 1.01 0.00 0.00 36.73 37.80 3k0p h TYR 48 CO 0.00 0.13 0.86 1.17 -1.05 0.00 0.00 178.16 179.27 3k0p n LYS 49 N -3.13 2.32 0.00 4.88 4.81 -1.26 -1.11 118.16 124.67 3k0p n LYS 49 Ca 0.03 0.84 0.00 0.00 -0.87 0.00 0.00 58.31 58.31 3k0p n LYS 49 Cb 0.58 -2.63 0.00 0.00 0.02 0.00 0.00 35.03 33.00 3k0p n LYS 49 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3k0p n GLY 50 N 3.58 1.86 3.93 3.14 0.00 0.82 -5.05 105.19 113.47 3k0p n GLY 50 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 3k0p n GLY 50 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k0p s SER 51 N -2.71 3.47 0.26 1.61 1.04 -0.27 -4.73 113.70 112.38 3k0p s SER 51 Ca 0.00 0.35 0.04 0.00 0.48 0.00 0.00 55.95 56.82 3k0p s SER 51 Cb 0.00 -0.51 -0.06 0.00 0.10 0.00 0.00 66.02 65.56 3k0p s SER 51 CO 0.00 -2.51 0.01 0.00 0.98 0.00 0.00 173.24 171.71 3k0p s PHE 53 N -3.35 3.03 -0.97 0.00 0.40 0.17 -4.08 117.98 113.18 3k0p s PHE 53 Ca 0.31 -0.69 0.25 0.00 -0.60 0.00 0.00 56.93 56.20 3k0p s PHE 53 Cb 0.06 -3.70 0.47 0.00 0.51 0.00 0.00 43.02 40.36 3k0p s PHE 53 CO 0.11 -1.12 1.39 -2.39 0.70 0.00 0.00 175.22 173.91 3k0p n HIS 54 N 6.21 0.03 -3.70 0.36 1.44 -0.92 -4.61 115.22 114.04 3k0p n HIS 54 Ca -0.08 0.01 -0.17 0.00 -2.01 0.00 0.00 57.72 55.47 3k0p n HIS 54 Cb 0.44 -0.27 -0.17 0.00 0.12 0.00 0.00 29.99 30.12 3k0p n HIS 54 CO 0.00 0.00 0.00 0.50 -2.81 0.00 0.00 176.34 174.03 3k0p s ARG 55 N -3.01 -0.02 -0.15 -1.40 3.52 -1.23 -4.61 118.95 112.05 3k0p s ARG 55 Ca 0.10 0.39 -0.01 0.00 -0.13 0.00 0.00 55.73 56.08 3k0p s ARG 55 Cb 0.17 -0.36 0.04 0.00 -1.56 0.00 0.00 34.95 33.25 3k0p s ARG 55 CO 0.71 -0.27 -0.01 0.42 -0.81 0.00 0.00 175.30 175.33 3k0p s ILE 56 N 1.88 0.75 -0.29 4.11 1.01 -0.12 -0.23 121.20 128.30 3k0p s ILE 56 Ca 0.00 -0.41 -0.00 0.00 0.00 0.00 0.00 60.65 60.24 3k0p s ILE 56 Cb -0.12 -1.02 0.05 0.00 0.01 0.00 0.00 42.46 41.39 3k0p s ILE 56 CO -0.04 0.07 -0.04 -0.63 0.00 0.00 0.00 174.94 174.30 3k0p s ILE 57 N 1.79 2.73 0.35 2.92 1.01 -0.09 -2.39 121.20 127.52 3k0p s ILE 57 Ca 0.01 -1.47 -0.28 0.00 0.00 0.00 0.00 60.65 58.91 3k0p s ILE 57 Cb -0.15 -2.58 -0.12 0.00 0.01 0.00 0.00 42.46 39.62 3k0p s ILE 57 CO -0.07 -0.08 1.40 -2.65 0.00 0.00 0.00 174.94 173.54 3k0p n PRO 58 N 4.56 2.42 -0.61 2.79 -0.02 -1.26 -1.16 135.00 141.72 3k0p n PRO 58 Ca -0.13 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 3k0p n PRO 58 Cb 0.43 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 3k0p n PRO 58 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3k0p n GLY 59 N 0.71 1.23 1.10 -1.23 0.00 -1.26 -4.81 105.19 100.92 3k0p n GLY 59 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3k0p n GLY 59 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3k0p n PHE 60 N -2.00 0.00 -3.67 1.61 7.35 -0.31 -4.57 117.46 115.87 3k0p n PHE 60 Ca 0.00 0.00 -0.06 0.00 -0.76 0.00 0.00 57.45 56.63 3k0p n PHE 60 Cb 0.00 0.23 -0.02 0.00 0.35 0.00 0.00 39.48 40.04 3k0p n PHE 60 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3k0p s MET 61 N -0.64 1.21 -0.18 -4.13 0.23 -0.68 -1.33 119.30 113.79 3k0p s MET 61 Ca 0.00 -0.60 -0.04 0.00 -1.03 0.00 0.00 55.69 54.02 3k0p s MET 61 Cb 0.00 0.46 -0.03 0.00 -1.53 0.00 0.00 34.83 33.73 3k0p s MET 61 CO 0.00 -0.55 -0.02 0.00 -2.03 0.00 0.00 175.02 172.42 3k0p s GLN 63 N 0.65 3.59 0.00 0.00 0.74 0.68 -0.43 119.66 124.88 3k0p s GLN 63 Ca -0.01 -0.55 0.00 0.00 0.05 0.00 0.00 55.36 54.85 3k0p s GLN 63 Cb -0.14 -2.85 0.00 0.00 1.10 0.00 0.00 33.01 31.11 3k0p s GLN 63 CO 0.02 0.26 0.00 0.41 -0.55 0.00 0.00 175.29 175.43 3k0p n GLY 64 N 3.46 4.04 0.00 2.59 0.00 -0.60 -2.16 105.19 112.52 3k0p n GLY 64 Ca -0.18 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.23 3k0p n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k0p n GLY 65 N 0.00 0.29 3.52 -0.02 0.00 -1.26 -1.56 105.19 106.16 3k0p n GLY 65 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3k0p n GLY 65 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3k0p s ASP 66 N -2.54 6.91 0.00 1.61 -1.08 -1.26 -4.17 116.67 116.14 3k0p s ASP 66 Ca 0.00 -2.61 0.16 0.00 -0.52 0.00 0.00 52.55 49.59 3k0p s ASP 66 Cb 0.00 -2.49 0.61 0.00 -1.46 0.00 0.00 42.92 39.59 3k0p s ASP 66 CO 0.00 -0.99 1.45 2.22 0.52 0.00 0.00 175.17 178.36 3k0p n PHE 67 N 7.06 0.26 -0.08 -5.34 1.16 -1.26 -1.76 117.46 117.50 3k0p n PHE 67 Ca 0.41 -0.13 -0.10 0.00 -1.87 0.00 0.00 57.45 55.76 3k0p n PHE 67 Cb 0.45 0.00 -0.08 0.00 -1.61 0.00 0.00 39.48 38.24 3k0p n PHE 67 CO 0.00 0.00 0.00 0.25 -1.87 0.00 0.00 176.76 175.14 3k0p n THR 68 N 0.24 0.92 0.00 1.97 -2.24 -1.26 -4.79 114.28 109.12 3k0p n THR 68 Ca 0.14 -0.41 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 3k0p n THR 68 Cb 0.28 -0.96 0.00 0.00 -2.10 0.00 0.00 70.33 67.54 3k0p n THR 68 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3k0p n ARG 69 N -2.84 5.81 -1.82 -0.78 1.74 -1.25 -4.95 116.66 112.57 3k0p n ARG 69 Ca -0.27 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 56.63 3k0p n ARG 69 Cb 0.84 -0.44 -0.06 0.00 -1.02 0.00 0.00 32.46 31.78 3k0p n ARG 69 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3k0p n HIS 70 N -0.86 -0.30 -1.45 -1.55 8.25 -0.72 -4.74 115.22 113.84 3k0p n HIS 70 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3k0p n HIS 70 Cb 0.00 -3.34 0.00 0.00 1.12 0.00 0.00 29.99 27.77 3k0p n HIS 70 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3k0p n ASN 71 N -1.21 0.00 0.00 0.41 0.23 -1.26 -4.82 115.26 108.61 3k0p n ASN 71 Ca -0.20 -1.00 0.00 0.00 -0.53 0.00 0.00 54.58 52.85 3k0p n ASN 71 Cb 0.63 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.33 3k0p n ASN 71 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3k0p n GLY 72 N 0.00 2.64 0.00 4.83 0.00 -1.26 -4.92 105.19 106.47 3k0p n GLY 72 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 3k0p n GLY 72 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k0p n THR 73 N -1.50 0.00 -0.76 2.61 -2.24 -1.26 -4.93 114.28 106.19 3k0p n THR 73 Ca 0.00 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3k0p n THR 73 Cb 0.00 -0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 3k0p n THR 73 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k0p n GLY 74 N 1.50 3.98 0.00 3.38 0.00 -1.26 -5.00 105.19 107.79 3k0p n GLY 74 Ca 0.06 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.34 3k0p n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k0p n GLY 75 N 5.00 0.63 3.38 -0.02 0.00 -1.26 -4.86 105.19 108.06 3k0p n GLY 75 Ca 0.00 -1.58 -0.15 0.00 0.00 0.00 0.00 46.02 44.30 3k0p n GLY 75 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k0p s LYS 76 N -4.23 0.77 0.96 1.61 -2.85 -1.26 -4.74 119.74 110.00 3k0p s LYS 76 Ca 0.00 0.21 -0.16 0.00 -1.00 0.00 0.00 55.97 55.02 3k0p s LYS 76 Cb 0.00 0.36 0.20 0.00 -2.06 0.00 0.00 37.83 36.32 3k0p s LYS 76 CO 0.00 -0.20 1.32 -1.54 0.10 0.00 0.00 175.35 175.03 3k0p s SER 77 N -0.82 3.15 0.00 0.03 1.04 -1.23 -4.16 113.70 111.72 3k0p s SER 77 Ca -0.09 0.28 0.30 0.00 0.48 0.00 0.00 55.95 56.93 3k0p s SER 77 Cb -0.03 -0.34 1.49 0.00 0.10 0.00 0.00 66.02 67.24 3k0p s SER 77 CO 0.05 -2.71 2.00 2.30 0.98 0.00 0.00 173.24 175.85 3k0p n ILE 78 N -3.76 0.00 1.05 -1.02 -5.35 -1.26 -4.02 119.36 105.00 3k0p n ILE 78 Ca 0.15 -0.11 0.12 0.00 -0.27 0.00 0.00 62.75 62.64 3k0p n ILE 78 Cb 0.59 -0.05 0.12 0.00 -1.74 0.00 0.00 39.64 38.57 3k0p n ILE 78 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 3k0p n TYR 79 N -0.50 0.00 -0.63 4.28 4.01 -1.26 -4.96 117.16 118.10 3k0p n TYR 79 Ca 0.21 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.95 3k0p n TYR 79 Cb 0.23 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.25 3k0p n TYR 79 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3k0p n GLY 80 N 1.35 0.82 3.47 2.72 0.00 -1.26 -4.98 105.19 107.32 3k0p n GLY 80 Ca 0.13 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.05 3k0p n GLY 80 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k0p s GLU 81 N -0.37 0.99 0.43 1.61 2.02 -1.26 -5.06 118.70 117.07 3k0p s GLU 81 Ca 0.00 -0.34 -0.25 0.00 0.02 0.00 0.00 54.97 54.40 3k0p s GLU 81 Cb 0.00 0.46 -0.08 0.00 0.10 0.00 0.00 34.13 34.61 3k0p s GLU 81 CO 0.00 -0.43 1.28 0.15 0.02 0.00 0.00 175.26 176.29 3k0p s LYS 82 N -3.25 3.83 0.32 1.61 1.02 -1.26 -4.56 119.74 117.44 3k0p s LYS 82 Ca 0.03 2.10 0.09 0.00 0.02 0.00 0.00 55.97 58.21 3k0p s LYS 82 Cb -0.01 -2.64 -0.05 0.00 -0.52 0.00 0.00 37.83 34.61 3k0p s LYS 82 CO -0.10 -0.59 -0.01 -0.59 -0.92 0.00 0.00 175.35 173.14 3k0p s PHE 83 N -1.32 2.55 0.71 3.18 -0.71 -0.02 -4.82 117.98 117.56 3k0p s PHE 83 Ca 0.60 -0.38 -0.14 0.00 -1.04 0.00 0.00 56.93 55.97 3k0p s PHE 83 Cb -0.37 -1.37 0.03 0.00 -1.21 0.00 0.00 43.02 40.11 3k0p s PHE 83 CO 0.46 0.53 1.13 -1.83 -1.34 0.00 0.00 175.22 174.18 3k0p s GLU 84 N -3.68 2.44 -0.04 1.99 1.03 -1.26 -2.16 118.70 117.01 3k0p s GLU 84 Ca 0.34 1.45 -0.30 0.00 0.03 0.00 0.00 54.97 56.49 3k0p s GLU 84 Cb -0.02 -1.90 -0.07 0.00 -0.80 0.00 0.00 34.13 31.34 3k0p s GLU 84 CO 0.19 -1.54 1.91 -0.51 -1.33 0.00 0.00 175.26 173.97 3k0p s ASP 85 N -2.59 6.34 -0.02 0.83 1.01 -1.26 -4.85 116.67 116.14 3k0p s ASP 85 Ca 0.68 2.38 -0.24 0.00 0.71 0.00 0.00 52.55 56.07 3k0p s ASP 85 Cb -0.22 -2.53 -0.19 0.00 1.01 0.00 0.00 42.92 40.99 3k0p s ASP 85 CO 0.46 -1.18 1.22 -0.08 0.21 0.00 0.00 175.17 175.80 3k0p h GLU 86 N 11.03 0.14 -2.07 8.23 4.81 -1.99 -3.48 114.58 131.25 3k0p h GLU 86 Ca -0.45 -0.09 0.25 0.00 -0.13 0.00 0.00 59.36 58.94 3k0p h GLU 86 Cb 1.22 0.01 -0.08 0.00 0.63 0.00 0.00 28.75 30.53 3k0p h GLU 86 CO 0.95 0.68 0.70 0.54 -0.73 0.00 0.00 179.01 181.16 3k0p s ASN 87 N -5.98 -0.05 -0.27 1.04 2.20 -1.26 -5.04 114.94 105.58 3k0p s ASN 87 Ca -0.16 -0.36 0.08 0.00 -0.94 0.00 0.00 52.86 51.49 3k0p s ASN 87 Cb 0.02 0.32 0.45 0.00 -2.00 0.00 0.00 41.25 40.05 3k0p s ASN 87 CO 0.71 -0.62 1.20 0.49 -2.94 0.00 0.00 177.10 175.94 3k0p n PHE 88 N -0.63 2.08 -0.13 1.54 3.72 -1.26 -4.66 117.46 118.11 3k0p n PHE 88 Ca -0.04 -2.04 -0.09 0.00 -0.05 0.00 0.00 57.45 55.23 3k0p n PHE 88 Cb 0.61 -0.32 -0.00 0.00 -0.94 0.00 0.00 39.48 38.83 3k0p n PHE 88 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 3k0p h ILE 89 N 1.97 1.17 -3.05 4.37 2.04 -1.94 -3.42 117.51 118.65 3k0p h ILE 89 Ca 0.27 -0.47 -0.60 0.00 1.00 0.00 0.00 64.86 65.06 3k0p h ILE 89 Cb 1.41 0.74 -0.05 0.00 -0.74 0.00 0.00 36.82 38.18 3k0p h ILE 89 CO 0.57 0.18 -0.25 -0.76 0.00 0.00 0.00 178.15 177.89 3k0p s LEU 90 N -9.91 4.39 0.46 1.44 1.43 -1.26 -5.09 118.68 110.13 3k0p s LEU 90 Ca -0.13 0.81 0.07 0.00 -1.03 0.00 0.00 54.13 53.85 3k0p s LEU 90 Cb 0.10 -2.81 -0.00 0.00 0.03 0.00 0.00 46.19 43.50 3k0p s LEU 90 CO 0.74 0.23 0.38 -0.54 0.23 0.00 0.00 176.35 177.39 3k0p s LYS 91 N -1.63 2.41 -0.84 1.70 -0.14 -1.26 -4.46 119.74 115.52 3k0p s LYS 91 Ca 0.29 -1.70 -0.20 0.00 -1.36 0.00 0.00 55.97 53.00 3k0p s LYS 91 Cb -0.15 -2.27 0.11 0.00 -1.68 0.00 0.00 37.83 33.85 3k0p s LYS 91 CO 0.16 -0.32 1.06 -1.01 -0.76 0.00 0.00 175.35 174.47 3k0p s HIS 92 N -2.57 3.00 -1.00 3.18 3.76 -1.26 -4.83 115.29 115.57 3k0p s HIS 92 Ca 0.44 -1.16 0.22 0.00 -0.15 0.00 0.00 55.06 54.42 3k0p s HIS 92 Cb -0.02 -4.27 -0.02 0.00 1.11 0.00 0.00 32.58 29.39 3k0p s HIS 92 CO 0.26 -1.51 1.05 0.25 -0.85 0.00 0.00 174.74 173.94 3k0p n THR 93 N 5.60 0.00 -2.27 1.30 -2.24 -1.26 -3.93 114.28 111.48 3k0p n THR 93 Ca 0.15 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.93 3k0p n THR 93 Cb 0.48 0.78 0.00 0.00 -2.10 0.00 0.00 70.33 69.49 3k0p n THR 93 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k0p n GLY 94 N 1.50 -1.61 3.75 3.38 0.00 -1.26 -4.77 105.19 106.18 3k0p n GLY 94 Ca 0.04 -1.09 -0.38 0.00 0.00 0.00 0.00 46.02 44.59 3k0p n GLY 94 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3k0p s PRO 95 N -1.43 3.21 0.00 1.61 0.02 -1.21 -3.24 135.00 133.96 3k0p s PRO 95 Ca 0.00 2.07 0.00 0.00 0.02 0.00 0.00 61.00 63.09 3k0p s PRO 95 Cb 0.00 -2.22 0.00 0.00 0.02 0.00 0.00 34.50 32.30 3k0p s PRO 95 CO 0.00 -1.08 0.00 0.41 -0.33 0.00 0.00 177.00 176.00 3k0p n GLY 96 N 0.65 0.59 3.75 0.52 0.00 0.33 -4.93 105.19 106.11 3k0p n GLY 96 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 3k0p n GLY 96 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k0p s ILE 97 N -2.17 2.70 -0.23 -0.61 -1.09 -1.20 -0.31 121.20 118.29 3k0p s ILE 97 Ca 0.00 0.61 -0.10 0.00 -2.23 0.00 0.00 60.65 58.93 3k0p s ILE 97 Cb 0.00 -3.39 -0.05 0.00 -1.58 0.00 0.00 42.46 37.44 3k0p s ILE 97 CO 0.00 0.11 0.14 -0.22 -1.23 0.00 0.00 174.94 173.74 3k0p s LEU 98 N -0.68 4.05 0.02 2.97 2.96 -0.20 -0.48 118.68 127.32 3k0p s LEU 98 Ca 0.57 0.10 -0.02 0.00 -0.22 0.00 0.00 54.13 54.56 3k0p s LEU 98 Cb -0.41 -2.08 -0.02 0.00 0.50 0.00 0.00 46.19 44.18 3k0p s LEU 98 CO 0.45 0.08 0.00 0.28 -1.32 0.00 0.00 176.35 175.85 3k0p s THR 99 N 0.93 0.12 0.27 3.68 -1.32 -0.76 -1.36 115.64 117.20 3k0p s THR 99 Ca 0.07 -1.02 -0.29 0.00 -1.21 0.00 0.00 61.69 59.24 3k0p s THR 99 Cb -0.13 -0.51 -0.09 0.00 -1.51 0.00 0.00 72.50 70.26 3k0p s THR 99 CO 0.03 -0.56 1.13 -0.04 -2.21 0.00 0.00 174.62 172.97 3k0p s MET 100 N -1.88 4.60 0.42 7.08 -1.94 -0.34 -0.64 119.30 126.61 3k0p s MET 100 Ca -0.12 1.84 -0.13 0.00 -1.71 0.00 0.00 55.69 55.57 3k0p s MET 100 Cb -0.07 -3.19 -0.07 0.00 2.01 0.00 0.00 34.83 33.51 3k0p s MET 100 CO -0.02 0.14 0.83 0.00 -0.01 0.00 0.00 175.02 175.96 3k0p s ALA 101 N -1.01 3.25 0.31 3.03 0.00 -0.03 -4.39 121.76 122.92 3k0p s ALA 101 Ca 0.46 -0.04 -0.16 0.00 0.00 0.00 0.00 51.96 52.22 3k0p s ALA 101 Cb -0.33 -2.85 0.03 0.00 0.00 0.00 0.00 23.12 19.97 3k0p s ALA 101 CO 0.41 -0.02 0.68 0.54 0.00 0.00 0.00 175.76 177.37 3k0p s ASN 102 N -2.97 -0.04 -0.39 0.00 2.20 -1.26 -4.58 114.94 107.90 3k0p s ASN 102 Ca 0.54 -0.92 0.06 0.00 -0.94 0.00 0.00 52.86 51.60 3k0p s ASN 102 Cb -0.10 0.74 0.54 0.00 -2.00 0.00 0.00 41.25 40.43 3k0p s ASN 102 CO 0.29 -1.42 1.65 0.00 -2.94 0.00 0.00 177.10 174.68 3k0p n ALA 103 N -0.48 5.05 0.00 3.54 0.00 -1.26 -5.05 120.51 122.32 3k0p n ALA 103 Ca -0.05 -3.20 0.00 0.00 0.00 0.00 0.00 53.44 50.19 3k0p n ALA 103 Cb 0.60 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 19.01 3k0p n ALA 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k0p n GLY 104 N -1.06 -0.89 3.72 0.00 0.00 -1.26 -4.94 105.19 100.75 3k0p n GLY 104 Ca 0.46 -2.25 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 3k0p n GLY 104 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3k0p n PRO 105 N -0.52 2.43 -3.36 1.61 -0.02 -1.26 -2.95 135.00 130.93 3k0p n PRO 105 Ca 0.00 0.86 -0.19 0.00 -2.02 0.00 0.00 63.50 62.16 3k0p n PRO 105 Cb 0.00 -2.58 0.07 0.00 -0.02 0.00 0.00 33.50 30.97 3k0p n PRO 105 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3k0p n ASN 106 N 1.82 -4.88 -2.20 2.55 3.02 -1.26 -4.93 115.26 109.38 3k0p n ASN 106 Ca 0.08 -0.46 -0.05 0.00 -0.03 0.00 0.00 54.58 54.12 3k0p n ASN 106 Cb 0.35 -4.29 0.05 0.00 -0.61 0.00 0.00 39.78 35.29 3k0p n ASN 106 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3k0p n THR 107 N -4.38 1.43 -2.37 3.41 -2.24 -1.15 -4.54 114.28 104.43 3k0p n THR 107 Ca -0.05 -2.91 -0.42 0.00 -2.27 0.00 0.00 64.05 58.40 3k0p n THR 107 Cb 0.57 0.53 -0.03 0.00 -2.10 0.00 0.00 70.33 69.29 3k0p n THR 107 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3k0p s ASN 108 N -3.38 7.05 0.00 3.42 0.01 -0.92 -4.13 114.94 116.99 3k0p s ASN 108 Ca 0.35 2.13 0.00 0.00 -0.71 0.00 0.00 52.86 54.63 3k0p s ASN 108 Cb 0.36 -2.59 0.00 0.00 0.41 0.00 0.00 41.25 39.43 3k0p s ASN 108 CO -0.05 -0.45 0.00 0.61 -1.51 0.00 0.00 177.10 175.70 3k0p n GLY 109 N 2.88 0.92 0.00 0.66 0.00 -1.26 -0.84 105.19 107.55 3k0p n GLY 109 Ca 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.09 3k0p n GLY 109 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k0p n SER 110 N 0.00 0.18 -4.85 1.61 3.41 -1.26 -3.53 113.62 109.19 3k0p n SER 110 Ca 0.00 -0.84 -0.33 0.00 -0.26 0.00 0.00 58.87 57.43 3k0p n SER 110 Cb 0.00 0.04 -0.06 0.00 -0.26 0.00 0.00 64.21 63.93 3k0p n SER 110 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3k0p s GLN 111 N -0.04 3.98 0.13 4.33 -0.21 -1.26 -4.47 119.66 122.12 3k0p s GLN 111 Ca 0.00 0.55 -0.09 0.00 0.02 0.00 0.00 55.36 55.84 3k0p s GLN 111 Cb 0.00 -2.65 -0.00 0.00 1.00 0.00 0.00 33.01 31.35 3k0p s GLN 111 CO 0.00 0.30 0.24 -0.59 -2.12 0.00 0.00 175.29 173.12 3k0p s PHE 112 N -1.77 0.26 -0.09 0.91 -0.12 -0.60 -0.85 117.98 115.73 3k0p s PHE 112 Ca 0.47 -0.66 0.00 0.00 -0.05 0.00 0.00 56.93 56.70 3k0p s PHE 112 Cb -0.12 -0.05 -0.03 0.00 -0.63 0.00 0.00 43.02 42.18 3k0p s PHE 112 CO 0.19 -0.63 -0.07 -0.06 -0.05 0.00 0.00 175.22 174.60 3k0p s PHE 113 N -3.91 2.92 -0.37 3.49 0.08 0.19 -1.55 117.98 118.83 3k0p s PHE 113 Ca 0.11 -0.11 -0.17 0.00 0.12 0.00 0.00 56.93 56.89 3k0p s PHE 113 Cb 0.04 -1.76 0.00 0.00 -0.57 0.00 0.00 43.02 40.73 3k0p s PHE 113 CO -0.06 0.21 0.43 0.42 -0.10 0.00 0.00 175.22 176.12 3k0p s ILE 114 N -0.50 5.10 0.35 0.64 1.01 0.43 -1.83 121.20 126.40 3k0p s ILE 114 Ca 0.07 0.02 -0.28 0.00 0.00 0.00 0.00 60.65 60.47 3k0p s ILE 114 Cb -0.12 -3.93 -0.09 0.00 0.01 0.00 0.00 42.46 38.33 3k0p s ILE 114 CO 0.02 -0.23 1.22 0.00 0.00 0.00 0.00 174.94 175.95 3k0p n THR 116 N 0.61 0.79 -3.89 0.00 -2.24 -0.44 -0.51 114.28 108.61 3k0p n THR 116 Ca 0.01 -0.90 -0.09 0.00 -2.27 0.00 0.00 64.05 60.80 3k0p n THR 116 Cb 0.44 0.64 -0.01 0.00 -2.10 0.00 0.00 70.33 69.30 3k0p n THR 116 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k0p s ALA 117 N -0.96 -0.61 -0.36 6.98 0.00 -1.26 -4.69 121.76 120.88 3k0p s ALA 117 Ca 0.18 -0.74 -0.29 0.00 0.00 0.00 0.00 51.96 51.11 3k0p s ALA 117 Cb 0.10 0.85 -0.00 0.00 0.00 0.00 0.00 23.12 24.06 3k0p s ALA 117 CO 0.13 -0.96 1.48 0.21 0.00 0.00 0.00 175.76 176.62 3k0p s LYS 118 N -3.12 3.63 -0.91 0.00 2.20 -1.26 -3.29 119.74 116.98 3k0p s LYS 118 Ca 0.17 1.16 0.00 0.00 -0.36 0.00 0.00 55.97 56.94 3k0p s LYS 118 Cb -0.04 -4.03 0.32 0.00 -1.51 0.00 0.00 37.83 32.57 3k0p s LYS 118 CO 0.11 -1.50 1.48 0.25 -0.36 0.00 0.00 175.35 175.34 3k0p n THR 119 N 6.89 5.02 0.30 3.43 -2.24 -1.25 -4.81 114.28 121.62 3k0p n THR 119 Ca 0.17 -5.83 0.17 0.00 -2.27 0.00 0.00 64.05 56.29 3k0p n THR 119 Cb 0.47 -1.67 0.77 0.00 -2.10 0.00 0.00 70.33 67.80 3k0p n THR 119 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 3k0p h GLU 120 N 4.20 0.00 0.00 -0.78 9.09 -1.92 -1.28 114.58 123.89 3k0p h GLU 120 Ca 0.36 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.77 3k0p h GLU 120 Cb 0.45 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.55 3k0p h GLU 120 CO 1.11 0.00 0.00 -2.67 0.05 0.00 0.00 179.01 177.50 3k0p n TRP 121 N -2.80 0.00 1.04 2.06 2.14 -1.26 -1.64 117.44 116.97 3k0p n TRP 121 Ca -0.00 0.00 0.11 0.00 2.07 0.00 0.00 57.50 59.68 3k0p n TRP 121 Cb 0.19 -0.50 0.12 0.00 -0.81 0.00 0.00 31.31 30.31 3k0p n TRP 121 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 3k0p n LEU 122 N -1.50 0.91 -4.69 5.67 4.77 -0.48 -4.93 117.00 116.76 3k0p n LEU 122 Ca 0.02 -0.29 -0.44 0.00 -0.03 0.00 0.00 56.01 55.27 3k0p n LEU 122 Cb 0.10 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.04 3k0p n LEU 122 CO 0.08 0.20 1.15 0.47 -1.33 0.00 0.00 177.39 177.96 3k0p n ASP 123 N -1.21 3.16 0.00 -1.43 8.00 -0.65 -1.37 116.55 123.04 3k0p n ASP 123 Ca 0.06 1.11 0.00 0.00 0.71 0.00 0.00 54.79 56.68 3k0p n ASP 123 Cb 0.35 -1.47 0.00 0.00 -0.02 0.00 0.00 41.12 39.98 3k0p n ASP 123 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3k0p n GLY 124 N 2.77 1.48 0.00 0.44 0.00 -1.26 -4.77 105.19 103.84 3k0p n GLY 124 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3k0p n GLY 124 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3k0p n LYS 125 N -2.00 0.93 -4.71 1.61 5.02 -0.47 -5.03 118.16 113.51 3k0p n LYS 125 Ca 0.00 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.04 3k0p n LYS 125 Cb 0.00 -0.97 -0.16 0.00 -0.02 0.00 0.00 35.03 33.88 3k0p n LYS 125 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3k0p s HIS 126 N -1.87 1.53 -0.39 2.13 3.76 -0.89 -4.88 115.29 114.67 3k0p s HIS 126 Ca 0.00 -0.46 -0.27 0.00 -0.15 0.00 0.00 55.06 54.18 3k0p s HIS 126 Cb 0.00 -1.05 0.02 0.00 1.11 0.00 0.00 32.58 32.66 3k0p s HIS 126 CO 0.00 -0.18 0.99 0.08 -0.85 0.00 0.00 174.74 174.79 3k0p s VAL 127 N 0.18 4.48 0.07 -0.90 1.01 -1.26 -4.83 120.40 119.15 3k0p s VAL 127 Ca -0.06 1.23 -0.31 0.00 0.00 0.00 0.00 61.98 62.85 3k0p s VAL 127 Cb -0.12 -4.42 -0.06 0.00 0.00 0.00 0.00 36.38 31.79 3k0p s VAL 127 CO 0.02 -0.66 1.23 -0.69 0.00 0.00 0.00 175.10 175.00 3k0p s VAL 128 N 3.74 3.91 0.00 2.92 1.01 -1.26 -1.20 120.40 129.52 3k0p s VAL 128 Ca 0.41 1.37 0.00 0.00 0.00 0.00 0.00 61.98 63.76 3k0p s VAL 128 Cb -0.11 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.39 3k0p s VAL 128 CO 0.22 0.10 0.31 2.22 0.00 0.00 0.00 175.10 177.95 3k0p n PHE 129 N 3.99 0.00 -3.92 5.22 -1.74 -0.47 -4.76 117.46 115.77 3k0p n PHE 129 Ca 0.09 -0.01 0.01 0.00 -0.56 0.00 0.00 57.45 56.98 3k0p n PHE 129 Cb 0.46 -0.00 0.01 0.00 1.52 0.00 0.00 39.48 41.46 3k0p n PHE 129 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 3k0p n GLY 130 N -0.01 0.43 3.38 4.97 0.00 -1.10 -0.32 105.19 112.53 3k0p n GLY 130 Ca 0.00 -0.99 -0.14 0.00 0.00 0.00 0.00 46.02 44.90 3k0p n GLY 130 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k0p s LYS 131 N -2.01 1.02 0.21 1.61 -2.85 -0.28 -1.03 119.74 116.39 3k0p s LYS 131 Ca 0.19 -0.26 -0.32 0.00 -1.00 0.00 0.00 55.97 54.58 3k0p s LYS 131 Cb -0.01 0.46 -0.11 0.00 -2.06 0.00 0.00 37.83 36.11 3k0p s LYS 131 CO 0.00 -0.36 1.65 0.08 0.10 0.00 0.00 175.35 176.82 3k0p s VAL 132 N -2.47 2.23 -0.18 1.79 1.01 0.58 -1.00 120.40 122.35 3k0p s VAL 132 Ca -0.05 0.17 -0.15 0.00 0.00 0.00 0.00 61.98 61.95 3k0p s VAL 132 Cb -0.01 -3.11 -0.07 0.00 0.00 0.00 0.00 36.38 33.20 3k0p s VAL 132 CO -0.02 0.02 -0.25 1.17 0.00 0.00 0.00 175.10 176.01 3k0p n LYS 133 N 3.72 0.52 -4.48 2.72 4.81 0.79 -4.81 118.16 121.43 3k0p n LYS 133 Ca 0.14 0.34 -0.25 0.00 -0.87 0.00 0.00 58.31 57.67 3k0p n LYS 133 Cb 0.37 -1.55 -0.13 0.00 0.02 0.00 0.00 35.03 33.74 3k0p n LYS 133 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 3k0p s GLU 134 N -2.61 1.30 0.00 1.64 2.02 -1.17 -4.85 118.70 115.03 3k0p s GLU 134 Ca -0.26 -1.09 0.00 0.00 0.02 0.00 0.00 54.97 53.64 3k0p s GLU 134 Cb 0.05 -1.52 0.00 0.00 0.10 0.00 0.00 34.13 32.76 3k0p s GLU 134 CO 0.38 0.37 0.00 0.41 0.02 0.00 0.00 175.26 176.44 3k0p n GLY 135 N 1.41 1.13 0.25 -1.39 0.00 -1.26 -1.00 105.19 104.33 3k0p n GLY 135 Ca -0.18 -0.24 0.07 0.00 0.00 0.00 0.00 46.02 45.67 3k0p n GLY 135 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 3k0p h MET 136 N 0.00 0.00 -0.06 1.61 4.05 -1.92 -0.86 114.93 117.75 3k0p h MET 136 Ca 0.00 0.00 -0.05 0.00 -0.28 0.00 0.00 59.70 59.37 3k0p h MET 136 Cb 0.09 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 30.88 3k0p h MET 136 CO 0.00 0.07 -0.18 -0.91 0.23 0.00 0.00 176.91 176.12 3k0p h ASN 137 N 0.00 0.09 -0.52 1.39 4.21 -1.99 -0.91 115.58 117.85 3k0p h ASN 137 Ca -0.00 -0.02 -0.10 0.00 1.21 0.00 0.00 56.30 57.39 3k0p h ASN 137 Cb 0.12 -0.02 -0.02 0.00 -1.12 0.00 0.00 38.32 37.28 3k0p h ASN 137 CO 0.01 0.28 -0.06 0.40 -1.29 0.00 0.00 177.43 176.77 3k0p h ILE 138 N 0.09 1.27 -0.70 2.81 2.04 -1.54 -0.77 117.51 120.71 3k0p h ILE 138 Ca 0.02 -1.18 -0.04 0.00 1.00 0.00 0.00 64.86 64.66 3k0p h ILE 138 Cb 0.37 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.40 3k0p h ILE 138 CO 0.03 0.42 0.29 0.58 0.00 0.00 0.00 178.15 179.46 3k0p h VAL 139 N 0.83 1.24 -0.48 1.67 2.07 -1.11 0.74 116.25 121.20 3k0p h VAL 139 Ca 0.14 -0.72 -0.05 0.00 0.82 0.00 0.00 66.70 66.88 3k0p h VAL 139 Cb 0.60 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 3k0p h VAL 139 CO 0.04 0.29 0.07 -0.33 0.02 0.00 0.00 177.57 177.67 3k0p h GLU 140 N 1.00 0.74 -0.52 1.57 5.08 -0.94 -1.17 114.58 120.35 3k0p h GLU 140 Ca 0.24 -0.16 -0.11 0.00 -1.00 0.00 0.00 59.36 58.33 3k0p h GLU 140 Cb 0.17 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 3k0p h GLU 140 CO -0.02 0.71 -0.10 0.00 -1.00 0.00 0.00 179.01 178.59 3k0p h ALA 141 N 1.37 0.84 -0.74 3.43 0.00 -0.22 -2.90 119.26 121.03 3k0p h ALA 141 Ca 0.15 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 3k0p h ALA 141 Cb 0.33 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3k0p h ALA 141 CO 0.00 0.65 0.34 0.52 0.00 0.00 0.00 179.25 180.77 3k0p h MET 142 N 0.86 1.08 -0.55 0.00 2.86 -0.42 -2.58 114.93 116.18 3k0p h MET 142 Ca 0.14 -0.17 0.07 0.00 -2.06 0.00 0.00 59.70 57.68 3k0p h MET 142 Cb 0.65 -0.19 -0.03 0.00 0.06 0.00 0.00 31.60 32.09 3k0p h MET 142 CO 0.04 0.85 0.37 1.49 1.06 0.00 0.00 176.91 180.72 3k0p h GLU 143 N 1.05 0.46 0.00 1.72 4.81 -1.03 -0.65 114.58 120.94 3k0p h GLU 143 Ca 0.25 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 3k0p h GLU 143 Cb 0.14 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.42 3k0p h GLU 143 CO -0.03 0.30 0.00 0.00 -0.73 0.00 0.00 179.01 178.55 3k0p h ARG 144 N 0.47 0.00 -0.04 1.92 3.08 -1.33 -0.79 114.38 117.69 3k0p h ARG 144 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.29 3k0p h ARG 144 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.39 3k0p h ARG 144 CO -0.07 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 180.02 3k0p n PHE 145 N -2.87 0.05 -2.69 3.04 3.72 -0.25 -4.90 117.46 113.55 3k0p n PHE 145 Ca -0.00 -0.02 -0.23 0.00 -0.05 0.00 0.00 57.45 57.15 3k0p n PHE 145 Cb 0.20 0.00 0.10 0.00 -0.94 0.00 0.00 39.48 38.84 3k0p n PHE 145 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3k0p s GLY 146 N -1.83 1.75 0.22 1.37 0.00 -0.30 -0.89 107.32 107.65 3k0p s GLY 146 Ca 0.38 -1.84 -0.08 0.00 0.00 0.00 0.00 44.72 43.18 3k0p s GLY 146 CO 0.31 -1.29 0.43 -1.14 0.00 0.00 0.00 173.10 171.41 3k0p n SER 147 N -2.72 -1.25 -0.02 1.64 3.41 -1.00 -4.83 113.62 108.85 3k0p n SER 147 Ca 0.15 -1.93 -0.01 0.00 -0.26 0.00 0.00 58.87 56.82 3k0p n SER 147 Cb 0.61 2.10 -0.01 0.00 -0.26 0.00 0.00 64.21 66.65 3k0p n SER 147 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3k0p n ARG 148 N -0.31 -0.02 -0.40 4.33 1.74 -1.26 -0.96 116.66 119.77 3k0p n ARG 148 Ca -0.04 0.61 0.11 0.00 -0.77 0.00 0.00 57.85 57.75 3k0p n ARG 148 Cb 0.34 -0.91 0.32 0.00 -1.02 0.00 0.00 32.46 31.19 3k0p n ARG 148 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3k0p n ASN 149 N -2.78 4.04 0.00 0.55 4.13 -1.26 -4.89 115.26 115.05 3k0p n ASN 149 Ca 0.00 -2.09 0.00 0.00 1.68 0.00 0.00 54.58 54.17 3k0p n ASN 149 Cb 0.01 -0.49 0.00 0.00 -1.54 0.00 0.00 39.78 37.76 3k0p n ASN 149 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3k0p n GLY 150 N 1.47 0.58 3.73 7.41 0.00 -0.13 -4.85 105.19 113.39 3k0p n GLY 150 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 3k0p n GLY 150 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3k0p s LYS 151 N -0.80 4.14 0.02 1.61 2.20 -1.26 -0.95 119.74 124.70 3k0p s LYS 151 Ca 0.00 2.55 -0.09 0.00 -0.36 0.00 0.00 55.97 58.07 3k0p s LYS 151 Cb 0.00 -3.06 -0.05 0.00 -1.51 0.00 0.00 37.83 33.20 3k0p s LYS 151 CO 0.00 -0.67 0.33 0.95 -0.36 0.00 0.00 175.35 175.60 3k0p s THR 152 N 0.61 5.20 -0.91 3.43 -4.23 -1.26 -2.99 115.64 115.48 3k0p s THR 152 Ca 0.69 0.39 0.25 0.00 -1.18 0.00 0.00 61.69 61.84 3k0p s THR 152 Cb -0.48 -3.60 0.05 0.00 1.34 0.00 0.00 72.50 69.81 3k0p s THR 152 CO 0.39 0.40 1.47 -1.54 -0.54 0.00 0.00 174.62 174.80 3k0p n SER 153 N 1.26 0.48 -4.02 3.99 3.41 -0.06 -4.86 113.62 113.82 3k0p n SER 153 Ca -0.11 -0.05 -0.08 0.00 -0.26 0.00 0.00 58.87 58.36 3k0p n SER 153 Cb 0.53 0.12 -0.09 0.00 -0.26 0.00 0.00 64.21 64.51 3k0p n SER 153 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3k0p s LYS 154 N -3.04 0.76 -0.25 4.33 1.02 -1.26 -5.12 119.74 116.17 3k0p s LYS 154 Ca 0.10 -1.17 -0.26 0.00 0.02 0.00 0.00 55.97 54.66 3k0p s LYS 154 Cb 0.17 0.27 0.00 0.00 -0.52 0.00 0.00 37.83 37.74 3k0p s LYS 154 CO 0.68 -0.20 0.91 0.21 -0.92 0.00 0.00 175.35 176.03 3k0p s LYS 155 N -3.92 4.17 -0.30 1.68 2.47 -1.26 -4.90 119.74 117.68 3k0p s LYS 155 Ca 0.10 1.04 -0.06 0.00 -1.56 0.00 0.00 55.97 55.49 3k0p s LYS 155 Cb 0.07 -3.66 0.02 0.00 -1.46 0.00 0.00 37.83 32.79 3k0p s LYS 155 CO -0.08 -0.60 0.07 0.42 0.16 0.00 0.00 175.35 175.32 3k0p s ILE 156 N 3.03 3.83 0.26 5.43 -1.09 -1.26 -0.75 121.20 130.65 3k0p s ILE 156 Ca 0.38 -0.82 0.11 0.00 -2.23 0.00 0.00 60.65 58.10 3k0p s ILE 156 Cb -0.15 -3.02 -0.05 0.00 -1.58 0.00 0.00 42.46 37.67 3k0p s ILE 156 CO 0.08 0.03 -0.19 0.42 -1.23 0.00 0.00 174.94 174.05 3k0p s THR 157 N 1.46 2.35 -0.74 2.92 -4.23 -0.22 -0.66 115.64 116.53 3k0p s THR 157 Ca 0.01 -2.35 -0.20 0.00 -1.18 0.00 0.00 61.69 57.98 3k0p s THR 157 Cb -0.18 -2.25 0.11 0.00 1.34 0.00 0.00 72.50 71.53 3k0p s THR 157 CO 0.02 -0.41 0.93 -0.63 -0.54 0.00 0.00 174.62 173.99 3k0p s ILE 158 N -2.52 4.69 0.30 2.99 1.01 0.29 -0.83 121.20 127.11 3k0p s ILE 158 Ca 0.28 -1.09 0.04 0.00 0.00 0.00 0.00 60.65 59.88 3k0p s ILE 158 Cb -0.05 -4.65 0.08 0.00 0.01 0.00 0.00 42.46 37.86 3k0p s ILE 158 CO 0.13 -1.35 1.75 0.00 0.00 0.00 0.00 174.94 175.47 3k0p h ALA 159 N 9.10 1.16 -2.90 9.38 0.00 -1.08 0.23 119.26 135.15 3k0p h ALA 159 Ca -0.12 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 3k0p h ALA 159 Cb 1.06 -0.12 -0.10 0.00 0.00 0.00 0.00 17.79 18.63 3k0p h ALA 159 CO 1.11 0.53 0.08 0.34 0.00 0.00 0.00 179.25 181.31 3k0p s ASP 160 N -6.82 -0.32 0.09 0.00 -1.08 -1.23 -4.54 116.67 102.76 3k0p s ASP 160 Ca -0.06 -0.37 -0.26 0.00 -0.52 0.00 0.00 52.55 51.33 3k0p s ASP 160 Cb 0.14 0.59 0.08 0.00 -1.46 0.00 0.00 42.92 42.27 3k0p s ASP 160 CO 0.78 -1.05 0.82 0.00 0.52 0.00 0.00 175.17 176.25 3k0p n GLY 162 N -0.34 -1.62 0.73 0.00 0.00 -0.95 -4.68 105.19 98.33 3k0p n GLY 162 Ca -0.10 -1.08 0.09 0.00 0.00 0.00 0.00 46.02 44.94 3k0p n GLY 162 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14