#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6z n SER 2 N 0.00 -1.32 -4.58 1.61 3.41 -1.26 -5.07 113.62 106.41 2k6z n SER 2 Ca 0.00 -0.02 -0.29 0.00 -0.26 0.00 0.00 58.87 58.30 2k6z n SER 2 Cb 0.00 -1.29 0.21 0.00 -0.26 0.00 0.00 64.21 62.87 2k6z n SER 2 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2k6z s PHE 3 N -2.45 1.64 -0.38 7.33 0.40 -1.26 -5.04 117.98 118.23 2k6z s PHE 3 Ca 0.67 1.28 0.11 0.00 -0.60 0.00 0.00 56.93 58.39 2k6z s PHE 3 Cb -0.24 -3.17 0.41 0.00 0.51 0.00 0.00 43.02 40.52 2k6z s PHE 3 CO 0.64 -3.35 1.32 2.41 0.70 0.00 0.00 175.22 176.95 2k6z n THR 4 N -4.55 0.17 -2.30 0.64 -1.04 -1.26 -4.89 114.28 101.04 2k6z n THR 4 Ca 0.05 -1.68 -0.34 0.00 -2.04 0.00 0.00 64.05 60.04 2k6z n THR 4 Cb 0.54 0.96 -0.04 0.00 -1.82 0.00 0.00 70.33 69.98 2k6z n THR 4 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2k6z s GLU 5 N -0.36 3.04 0.20 -2.82 0.41 -1.26 -4.77 118.70 113.14 2k6z s GLU 5 Ca 0.21 -0.58 -0.18 0.00 -0.41 0.00 0.00 54.97 54.01 2k6z s GLU 5 Cb 0.41 -5.09 0.03 0.00 -1.78 0.00 0.00 34.13 27.70 2k6z s GLU 5 CO -0.08 -2.76 0.53 0.20 -0.49 0.00 0.00 175.26 172.67 2k6z s GLY 6 N 6.46 -0.11 0.08 -1.39 0.00 -1.26 -1.17 107.32 109.92 2k6z s GLY 6 Ca 0.57 -0.20 -0.23 0.00 0.00 0.00 0.00 44.72 44.86 2k6z s GLY 6 CO -0.02 -0.24 0.56 0.66 0.00 0.00 0.00 173.10 174.05 2k6z s TRP 7 N -3.87 -0.47 0.59 1.90 -2.14 -0.69 -4.08 118.94 110.17 2k6z s TRP 7 Ca 0.09 0.46 -0.12 0.00 2.66 0.00 0.00 56.10 59.19 2k6z s TRP 7 Cb -0.01 0.41 -0.05 0.00 -3.10 0.00 0.00 33.47 30.72 2k6z s TRP 7 CO -0.03 -0.71 1.01 0.08 -2.66 0.00 0.00 176.95 174.64 2k6z s VAL 8 N -2.83 4.67 -0.04 -0.66 1.01 -0.61 -1.66 120.40 120.29 2k6z s VAL 8 Ca -0.03 0.94 0.14 0.00 0.00 0.00 0.00 61.98 63.03 2k6z s VAL 8 Cb -0.00 -3.83 0.01 0.00 0.00 0.00 0.00 36.38 32.56 2k6z s VAL 8 CO -0.05 -1.02 1.45 -0.09 0.00 0.00 0.00 175.10 175.40 2k6z h ARG 9 N 0.02 0.00 -2.67 2.72 1.12 -1.22 -3.29 114.38 111.06 2k6z h ARG 9 Ca -0.45 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.42 2k6z h ARG 9 Cb 1.19 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.15 2k6z h ARG 9 CO 0.62 0.60 -0.38 0.34 -3.11 0.00 0.00 179.97 178.04 2k6z n PHE 10 N -3.31 -1.94 -3.61 2.20 7.35 -0.96 -2.25 117.46 114.94 2k6z n PHE 10 Ca 0.01 1.16 -0.12 0.00 -0.76 0.00 0.00 57.45 57.74 2k6z n PHE 10 Cb 0.75 -2.70 -0.07 0.00 0.35 0.00 0.00 39.48 37.81 2k6z n PHE 10 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 2k6z s SER 11 N -0.22 -0.57 0.33 -2.13 0.01 -1.26 -4.83 113.70 105.03 2k6z s SER 11 Ca 0.00 0.96 0.17 0.00 1.31 0.00 0.00 55.95 58.39 2k6z s SER 11 Cb 0.00 0.93 0.43 0.00 0.21 0.00 0.00 66.02 67.59 2k6z s SER 11 CO 0.00 -0.29 1.61 1.55 0.41 0.00 0.00 173.24 176.53 2k6z h PRO 12 N 4.01 0.00 0.00 12.44 0.13 -1.88 -3.20 132.00 143.49 2k6z h PRO 12 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2k6z h PRO 12 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2k6z h PRO 12 CO 0.17 0.44 0.00 0.41 -0.23 0.00 0.00 178.00 178.79 2k6z n GLY 13 N 0.64 1.81 0.00 1.56 0.00 -1.26 -4.16 105.19 103.78 2k6z n GLY 13 Ca 0.01 -1.74 0.09 0.00 0.00 0.00 0.00 46.02 44.38 2k6z n GLY 13 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k6z n PRO 14 N -1.83 0.14 -4.19 1.61 -0.04 -1.26 -4.96 135.00 124.48 2k6z n PRO 14 Ca 0.00 0.15 -0.12 0.00 -0.04 0.00 0.00 63.50 63.49 2k6z n PRO 14 Cb 0.00 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 31.86 2k6z n PRO 14 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2k6z s ASN 15 N -2.77 0.15 0.27 3.54 2.20 -1.26 -1.30 114.94 115.77 2k6z s ASN 15 Ca 0.14 -1.36 0.04 0.00 -0.94 0.00 0.00 52.86 50.73 2k6z s ASN 15 Cb 0.12 0.38 -0.01 0.00 -2.00 0.00 0.00 41.25 39.74 2k6z s ASN 15 CO 0.31 -0.84 0.27 0.00 -2.94 0.00 0.00 177.10 173.90 2k6z n ALA 16 N -0.26 0.31 -2.38 3.54 0.00 -0.22 -4.65 120.51 116.84 2k6z n ALA 16 Ca 0.01 -1.45 -0.19 0.00 0.00 0.00 0.00 53.44 51.81 2k6z n ALA 16 Cb 0.66 1.17 -0.10 0.00 0.00 0.00 0.00 19.45 21.18 2k6z n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k6z s ALA 17 N -2.90 2.04 -0.13 0.00 0.00 -1.26 -0.74 121.76 118.77 2k6z s ALA 17 Ca 0.29 -1.93 -0.21 0.00 0.00 0.00 0.00 51.96 50.11 2k6z s ALA 17 Cb 0.01 0.88 0.05 0.00 0.00 0.00 0.00 23.12 24.06 2k6z s ALA 17 CO 0.20 -0.39 0.52 0.00 0.00 0.00 0.00 175.76 176.09 2k6z s ALA 18 N -3.54 -1.32 0.15 0.00 0.00 0.13 -1.07 121.76 116.11 2k6z s ALA 18 Ca 0.37 1.23 0.10 0.00 0.00 0.00 0.00 51.96 53.66 2k6z s ALA 18 Cb 0.08 -0.49 -0.04 0.00 0.00 0.00 0.00 23.12 22.67 2k6z s ALA 18 CO 0.15 -0.28 -0.22 0.71 0.00 0.00 0.00 175.76 176.12 2k6z s TYR 19 N -0.37 2.01 -0.00 0.00 2.02 -0.67 -1.88 117.35 118.46 2k6z s TYR 19 Ca -0.05 -0.41 -0.28 0.00 -0.37 0.00 0.00 57.07 55.96 2k6z s TYR 19 Cb -0.03 -1.05 0.10 0.00 -0.40 0.00 0.00 41.96 40.58 2k6z s TYR 19 CO 0.03 0.34 0.83 -0.48 -1.57 0.00 0.00 175.55 174.70 2k6z s LEU 20 N -2.34 -0.43 -0.16 -1.29 0.05 -1.26 -1.71 118.68 111.54 2k6z s LEU 20 Ca 0.14 0.13 -0.25 0.00 0.05 0.00 0.00 54.13 54.20 2k6z s LEU 20 Cb -0.08 2.15 -0.02 0.00 -2.05 0.00 0.00 46.19 46.19 2k6z s LEU 20 CO 0.07 -0.64 0.83 -0.89 -0.55 0.00 0.00 176.35 175.17 2k6z s THR 21 N -2.73 4.89 -0.18 5.48 2.01 -0.32 -1.13 115.64 123.67 2k6z s THR 21 Ca 0.02 1.63 -0.10 0.00 0.31 0.00 0.00 61.69 63.55 2k6z s THR 21 Cb -0.01 -4.14 -0.05 0.00 0.01 0.00 0.00 72.50 68.32 2k6z s THR 21 CO -0.06 0.04 0.16 -0.22 -0.69 0.00 0.00 174.62 173.85 2k6z s LEU 22 N 2.05 4.25 0.05 4.42 1.98 0.18 -4.71 118.68 126.89 2k6z s LEU 22 Ca 0.39 0.33 0.08 0.00 -2.89 0.00 0.00 54.13 52.03 2k6z s LEU 22 Cb -0.17 -2.13 -0.03 0.00 0.66 0.00 0.00 46.19 44.52 2k6z s LEU 22 CO 0.13 0.22 -0.22 -1.61 -1.89 0.00 0.00 176.35 172.98 2k6z s GLU 23 N 0.07 1.47 -0.71 1.98 2.02 -1.26 -0.44 118.70 121.83 2k6z s GLU 23 Ca 0.11 -0.99 0.04 0.00 0.02 0.00 0.00 54.97 54.15 2k6z s GLU 23 Cb -0.12 -1.61 0.24 0.00 0.10 0.00 0.00 34.13 32.74 2k6z s GLU 23 CO 0.00 0.41 0.77 -1.71 0.02 0.00 0.00 175.26 174.76 2k6z n ASN 24 N 1.79 3.91 0.30 -0.19 4.05 -0.51 -4.92 115.26 119.69 2k6z n ASN 24 Ca -0.17 -3.38 0.19 0.00 0.45 0.00 0.00 54.58 51.67 2k6z n ASN 24 Cb 0.53 -0.77 0.88 0.00 1.23 0.00 0.00 39.78 41.66 2k6z n ASN 24 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 2k6z h PRO 25 N 4.64 0.00 -7.52 1.20 0.13 -1.91 0.14 132.00 128.68 2k6z h PRO 25 Ca 0.19 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.85 2k6z h PRO 25 Cb 0.68 0.00 0.12 0.00 0.13 0.00 0.00 31.00 31.93 2k6z h PRO 25 CO 0.86 0.00 0.33 0.20 -0.23 0.00 0.00 178.00 179.16 2k6z s GLY 26 N -4.15 1.58 0.00 1.56 0.00 -1.26 -4.72 107.32 100.33 2k6z s GLY 26 Ca -0.01 -0.54 0.24 0.00 0.00 0.00 0.00 44.72 44.41 2k6z s GLY 26 CO 0.49 -0.01 1.31 1.22 0.00 0.00 0.00 173.10 176.11 2k6z n ASP 27 N -3.63 1.69 -4.43 1.64 8.00 -1.26 -3.06 116.55 115.49 2k6z n ASP 27 Ca 0.07 -1.31 -0.22 0.00 0.71 0.00 0.00 54.79 54.03 2k6z n ASP 27 Cb 0.60 0.30 -0.10 0.00 -0.02 0.00 0.00 41.12 41.89 2k6z n ASP 27 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2k6z s LEU 28 N -2.43 2.58 0.28 0.64 1.43 -1.26 -4.82 118.68 115.11 2k6z s LEU 28 Ca 0.22 -1.04 -0.26 0.00 -1.03 0.00 0.00 54.13 52.03 2k6z s LEU 28 Cb 0.19 -0.95 -0.09 0.00 0.03 0.00 0.00 46.19 45.37 2k6z s LEU 28 CO 0.52 -0.05 0.91 -2.16 0.23 0.00 0.00 176.35 175.80 2k6z s PRO 29 N -3.56 4.60 0.23 1.29 0.04 -1.26 -4.38 135.00 131.95 2k6z s PRO 29 Ca 0.28 1.29 -0.04 0.00 0.04 0.00 0.00 61.00 62.57 2k6z s PRO 29 Cb -0.03 -2.93 -0.05 0.00 0.04 0.00 0.00 34.50 31.53 2k6z s PRO 29 CO 0.12 0.36 0.47 -0.51 0.04 0.00 0.00 177.00 177.48 2k6z s LEU 30 N -1.82 4.16 -0.15 -3.56 1.43 -0.67 -4.96 118.68 113.11 2k6z s LEU 30 Ca 0.47 0.60 -0.03 0.00 -1.03 0.00 0.00 54.13 54.13 2k6z s LEU 30 Cb -0.20 -3.38 0.05 0.00 0.03 0.00 0.00 46.19 42.69 2k6z s LEU 30 CO 0.25 -0.09 0.04 -0.60 0.23 0.00 0.00 176.35 176.18 2k6z s ARG 31 N -3.27 0.46 -0.38 1.70 3.52 -1.26 -0.25 118.95 119.47 2k6z s ARG 31 Ca 0.42 -0.16 -0.13 0.00 -0.13 0.00 0.00 55.73 55.72 2k6z s ARG 31 Cb -0.11 -1.66 0.01 0.00 -1.56 0.00 0.00 34.95 31.62 2k6z s ARG 31 CO 0.28 -0.54 0.26 -1.17 -0.81 0.00 0.00 175.30 173.32 2k6z s LEU 32 N 1.97 4.82 -0.16 -0.88 0.20 0.23 -0.77 118.68 124.09 2k6z s LEU 32 Ca 0.02 -0.74 0.16 0.00 0.69 0.00 0.00 54.13 54.25 2k6z s LEU 32 Cb -0.15 -2.13 -0.23 0.00 -0.43 0.00 0.00 46.19 43.26 2k6z s LEU 32 CO -0.07 -0.36 0.09 1.33 -0.29 0.00 0.00 176.35 177.05 2k6z n VAL 33 N 5.11 1.10 -3.39 1.68 0.24 0.41 -0.43 118.33 123.05 2k6z n VAL 33 Ca -0.12 -0.72 -0.04 0.00 -2.04 0.00 0.00 64.34 61.42 2k6z n VAL 33 Cb 0.48 -0.47 0.01 0.00 -1.47 0.00 0.00 33.84 32.39 2k6z n VAL 33 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k6z n GLY 34 N 1.86 1.47 3.02 7.63 0.00 -1.17 -4.51 105.19 113.48 2k6z n GLY 34 Ca -0.26 -1.11 -0.21 0.00 0.00 0.00 0.00 46.02 44.43 2k6z n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k6z n ALA 35 N -1.92 0.57 -2.29 4.61 0.00 -1.26 -0.82 120.51 119.40 2k6z n ALA 35 Ca -0.07 -1.85 -0.20 0.00 0.00 0.00 0.00 53.44 51.32 2k6z n ALA 35 Cb 0.27 1.33 -0.08 0.00 0.00 0.00 0.00 19.45 20.97 2k6z n ALA 35 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2k6z s ARG 36 N -3.36 1.77 0.00 0.00 1.81 0.92 -4.80 118.95 115.29 2k6z s ARG 36 Ca 0.25 -2.03 0.00 0.00 -1.72 0.00 0.00 55.73 52.23 2k6z s ARG 36 Cb 0.01 0.30 0.00 0.00 -0.45 0.00 0.00 34.95 34.81 2k6z s ARG 36 CO 0.17 -0.65 0.00 -2.37 -0.68 0.00 0.00 175.30 171.77 2k6z n THR 37 N -0.64 0.00 1.21 0.02 5.66 -1.26 -0.78 114.28 118.49 2k6z n THR 37 Ca 0.07 0.00 0.14 0.00 -3.05 0.00 0.00 64.05 61.21 2k6z n THR 37 Cb 0.62 0.00 0.68 0.00 -1.55 0.00 0.00 70.33 70.09 2k6z n THR 37 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 2k6z n PRO 38 N -0.17 0.22 -0.88 1.09 -0.04 -1.26 -4.18 135.00 129.78 2k6z n PRO 38 Ca 0.00 0.01 -0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2k6z n PRO 38 Cb 0.00 -1.50 0.17 0.00 -0.04 0.00 0.00 33.50 32.13 2k6z n PRO 38 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2k6z n VAL 39 N -1.39 2.29 -3.67 0.52 0.24 -1.26 -4.70 118.33 110.36 2k6z n VAL 39 Ca 0.11 -3.42 -0.13 0.00 -2.04 0.00 0.00 64.34 58.86 2k6z n VAL 39 Cb 0.28 -0.42 -0.08 0.00 -1.47 0.00 0.00 33.84 32.16 2k6z n VAL 39 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k6z s ALA 40 N -3.31 -1.52 0.24 2.33 0.00 -1.26 -3.01 121.76 115.23 2k6z s ALA 40 Ca 0.41 1.78 -0.06 0.00 0.00 0.00 0.00 51.96 54.09 2k6z s ALA 40 Cb 0.38 -1.04 0.23 0.00 0.00 0.00 0.00 23.12 22.69 2k6z s ALA 40 CO -0.05 -0.30 1.88 1.49 0.00 0.00 0.00 175.76 178.78 2k6z h GLU 41 N 5.50 1.27 -3.44 0.00 4.57 -0.10 -3.45 114.58 118.94 2k6z h GLU 41 Ca -0.29 -0.13 -0.18 0.00 -1.18 0.00 0.00 59.36 57.58 2k6z h GLU 41 Cb 1.18 -0.26 -0.25 0.00 -0.16 0.00 0.00 28.75 29.26 2k6z h GLU 41 CO 0.14 0.91 -0.53 0.50 -1.18 0.00 0.00 179.01 178.84 2k6z s ARG 42 N -5.90 0.27 -0.03 1.92 3.52 -0.73 -5.05 118.95 112.95 2k6z s ARG 42 Ca -0.13 -0.01 -0.02 0.00 -0.13 0.00 0.00 55.73 55.44 2k6z s ARG 42 Cb 0.17 0.12 0.02 0.00 -1.56 0.00 0.00 34.95 33.70 2k6z s ARG 42 CO 0.83 -0.05 0.08 0.54 -0.81 0.00 0.00 175.30 175.89 2k6z s VAL 43 N -0.42 -0.02 -0.06 7.11 0.11 -1.26 -0.45 120.40 125.42 2k6z s VAL 43 Ca -0.05 0.06 -0.05 0.00 -2.93 0.00 0.00 61.98 59.01 2k6z s VAL 43 Cb -0.03 -0.13 0.02 0.00 -1.53 0.00 0.00 36.38 34.70 2k6z s VAL 43 CO 0.01 0.02 0.15 -1.61 -3.33 0.00 0.00 175.10 170.34 2k6z s GLU 44 N 0.37 0.16 0.03 1.54 2.02 -0.61 -4.67 118.70 117.55 2k6z s GLU 44 Ca -0.03 0.24 -0.22 0.00 0.02 0.00 0.00 54.97 54.98 2k6z s GLU 44 Cb -0.04 0.04 -0.06 0.00 0.10 0.00 0.00 34.13 34.17 2k6z s GLU 44 CO -0.01 -0.05 0.67 -0.48 0.02 0.00 0.00 175.26 175.41 2k6z s LEU 45 N 0.27 4.45 0.19 1.80 2.34 -1.26 -0.28 118.68 126.19 2k6z s LEU 45 Ca -0.02 1.31 0.10 0.00 0.06 0.00 0.00 54.13 55.58 2k6z s LEU 45 Cb -0.03 -3.06 -0.04 0.00 -0.56 0.00 0.00 46.19 42.50 2k6z s LEU 45 CO -0.01 0.09 -0.16 -1.00 -1.06 0.00 0.00 176.35 174.22 2k6z s HIS 46 N -0.29 2.49 0.18 3.48 3.76 0.60 -0.77 115.29 124.74 2k6z s HIS 46 Ca 0.34 -0.28 0.04 0.00 -0.15 0.00 0.00 55.06 55.01 2k6z s HIS 46 Cb -0.19 -1.21 -0.04 0.00 1.11 0.00 0.00 32.58 32.25 2k6z s HIS 46 CO 0.20 0.52 0.21 -1.83 -0.85 0.00 0.00 174.74 172.99 2k6z s GLU 47 N -2.81 3.13 -0.06 1.40 4.04 0.43 -0.69 118.70 124.15 2k6z s GLU 47 Ca 0.24 -0.79 0.03 0.00 0.04 0.00 0.00 54.97 54.49 2k6z s GLU 47 Cb -0.08 -2.76 0.01 0.00 0.02 0.00 0.00 34.13 31.31 2k6z s GLU 47 CO 0.13 0.48 -0.14 0.99 -1.84 0.00 0.00 175.26 174.88 2k6z s THR 48 N -1.81 1.24 0.31 1.83 2.01 -0.99 -1.92 115.64 116.31 2k6z s THR 48 Ca 0.33 -0.57 -0.00 0.00 0.31 0.00 0.00 61.69 61.75 2k6z s THR 48 Cb -0.10 -1.10 -0.01 0.00 0.01 0.00 0.00 72.50 71.29 2k6z s THR 48 CO 0.26 0.37 0.36 0.72 -0.69 0.00 0.00 174.62 175.64 2k6z s PHE 49 N 0.38 1.21 -0.01 4.92 -0.71 -0.34 -4.60 117.98 118.82 2k6z s PHE 49 Ca -0.10 -1.36 0.04 0.00 -1.04 0.00 0.00 56.93 54.47 2k6z s PHE 49 Cb -0.14 -0.31 -0.03 0.00 -1.21 0.00 0.00 43.02 41.33 2k6z s PHE 49 CO 0.03 -0.97 -0.12 1.41 -1.34 0.00 0.00 175.22 174.23 2k6z s MET 50 N -3.44 2.43 0.23 1.99 1.75 -1.26 -1.25 119.30 119.75 2k6z s MET 50 Ca 0.34 -0.76 0.06 0.00 -1.25 0.00 0.00 55.69 54.08 2k6z s MET 50 Cb 0.02 -2.39 -0.05 0.00 2.84 0.00 0.00 34.83 35.25 2k6z s MET 50 CO 0.20 0.60 -0.07 1.03 -0.65 0.00 0.00 175.02 176.13 2k6z s ARG 51 N -1.11 1.37 0.07 4.11 0.52 -0.11 -4.94 118.95 118.86 2k6z s ARG 51 Ca 0.14 -1.66 -0.09 0.00 -0.52 0.00 0.00 55.73 53.59 2k6z s ARG 51 Cb -0.11 -0.92 -0.06 0.00 0.52 0.00 0.00 34.95 34.39 2k6z s ARG 51 CO 0.04 0.04 0.38 -2.00 0.02 0.00 0.00 175.30 173.78 2k6z s GLU 52 N -3.75 3.73 -0.20 3.54 2.56 -1.26 -0.56 118.70 122.76 2k6z s GLU 52 Ca 0.26 0.13 -0.09 0.00 0.00 0.00 0.00 54.97 55.27 2k6z s GLU 52 Cb 0.03 -3.00 0.08 0.00 2.00 0.00 0.00 34.13 33.24 2k6z s GLU 52 CO 0.08 0.56 0.45 0.54 -0.56 0.00 0.00 175.26 176.34 2k6z s VAL 53 N -1.40 -0.37 -1.71 3.70 0.11 0.29 -4.90 120.40 116.12 2k6z s VAL 53 Ca 0.33 0.11 0.00 0.00 -2.93 0.00 0.00 61.98 59.49 2k6z s VAL 53 Cb -0.14 -0.69 0.00 0.00 -1.53 0.00 0.00 36.38 34.02 2k6z s VAL 53 CO 0.18 0.05 0.00 -0.62 -3.33 0.00 0.00 175.10 171.38 2k6z n GLU 54 N 4.85 -1.20 -0.94 1.54 1.02 -1.26 -1.40 120.64 123.26 2k6z n GLU 54 Ca -0.16 1.04 0.00 0.00 -0.02 0.00 0.00 57.16 58.02 2k6z n GLU 54 Cb 0.53 -5.29 0.00 0.00 -0.02 0.00 0.00 31.44 26.65 2k6z n GLU 54 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k6z n GLY 55 N -0.94 0.51 3.35 0.62 0.00 -1.26 -5.04 105.19 102.44 2k6z n GLY 55 Ca -0.17 -0.16 -0.36 0.00 0.00 0.00 0.00 46.02 45.33 2k6z n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k6z s LYS 56 N -0.34 3.39 0.16 1.61 1.02 -0.49 -5.09 119.74 119.99 2k6z s LYS 56 Ca 0.00 -0.64 -0.32 0.00 0.02 0.00 0.00 55.97 55.04 2k6z s LYS 56 Cb 0.00 -3.18 -0.11 0.00 -0.52 0.00 0.00 37.83 34.02 2k6z s LYS 56 CO 0.00 -0.25 1.79 1.63 -0.92 0.00 0.00 175.35 177.60 2k6z n LYS 57 N 4.84 2.77 -4.14 1.68 4.01 -1.26 -0.55 118.16 125.52 2k6z n LYS 57 Ca -0.17 1.00 -0.14 0.00 -0.51 0.00 0.00 58.31 58.49 2k6z n LYS 57 Cb 0.50 -2.88 -0.06 0.00 -0.51 0.00 0.00 35.03 32.08 2k6z n LYS 57 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 2k6z s VAL 58 N 2.06 0.00 0.25 -0.18 -7.23 0.27 -4.95 120.40 110.61 2k6z s VAL 58 Ca 0.79 -1.72 0.04 0.00 -1.81 0.00 0.00 61.98 59.27 2k6z s VAL 58 Cb -0.50 -2.53 -0.05 0.00 0.56 0.00 0.00 36.38 33.86 2k6z s VAL 58 CO 0.35 0.00 0.00 -0.04 -0.31 0.00 0.00 175.10 175.11 2k6z s MET 59 N -3.46 1.39 0.38 4.82 -1.94 -1.26 -0.94 119.30 118.30 2k6z s MET 59 Ca 0.33 -1.72 -0.10 0.00 -1.71 0.00 0.00 55.69 52.49 2k6z s MET 59 Cb 0.01 -0.67 0.04 0.00 2.01 0.00 0.00 34.83 36.22 2k6z s MET 59 CO 0.19 -0.11 0.68 0.41 -0.01 0.00 0.00 175.02 176.19 2k6z n GLY 60 N -0.47 1.38 3.39 -0.03 0.00 -0.38 -4.85 105.19 104.23 2k6z n GLY 60 Ca -0.04 -1.39 -0.12 0.00 0.00 0.00 0.00 46.02 44.47 2k6z n GLY 60 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2k6z s MET 61 N -2.35 0.56 0.05 1.61 1.75 -1.26 -1.20 119.30 118.45 2k6z s MET 61 Ca 0.21 0.75 -0.07 0.00 -1.25 0.00 0.00 55.69 55.33 2k6z s MET 61 Cb -0.04 0.22 -0.01 0.00 2.84 0.00 0.00 34.83 37.84 2k6z s MET 61 CO 0.15 -0.09 0.13 1.03 -0.65 0.00 0.00 175.02 175.59 2k6z s ARG 62 N 0.58 0.66 0.61 4.11 1.81 -0.81 -5.01 118.95 120.90 2k6z s ARG 62 Ca -0.03 -0.81 -0.16 0.00 -1.72 0.00 0.00 55.73 53.02 2k6z s ARG 62 Cb -0.05 0.26 -0.03 0.00 -0.45 0.00 0.00 34.95 34.69 2k6z s ARG 62 CO -0.03 -0.18 1.07 -1.25 -0.68 0.00 0.00 175.30 174.23 2k6z s PRO 63 N -2.96 3.18 0.15 3.54 0.04 -1.26 -0.43 135.00 137.26 2k6z s PRO 63 Ca -0.02 1.26 0.06 0.00 0.04 0.00 0.00 61.00 62.34 2k6z s PRO 63 Cb 0.01 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 2k6z s PRO 63 CO -0.06 -0.93 -0.12 0.14 0.04 0.00 0.00 177.00 176.06 2k6z s VAL 64 N -2.41 1.34 -0.43 -0.36 -7.23 0.05 -4.72 120.40 106.64 2k6z s VAL 64 Ca 0.65 -1.99 0.23 0.00 -1.81 0.00 0.00 61.98 59.06 2k6z s VAL 64 Cb -0.17 -1.79 0.19 0.00 0.56 0.00 0.00 36.38 35.16 2k6z s VAL 64 CO 0.38 -0.62 1.41 1.55 -0.31 0.00 0.00 175.10 177.52 2k6z h PRO 65 N 2.95 0.00 -1.19 4.82 0.13 -1.92 -3.42 132.00 133.38 2k6z h PRO 65 Ca -0.38 0.00 0.36 0.00 -0.87 0.00 0.00 66.00 65.11 2k6z h PRO 65 Cb 1.20 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.19 2k6z h PRO 65 CO 0.59 0.00 0.93 -0.59 -0.23 0.00 0.00 178.00 178.70 2k6z s PHE 66 N -3.24 -0.02 0.19 1.56 -0.12 -1.26 -4.71 117.98 110.37 2k6z s PHE 66 Ca 0.05 -0.02 0.09 0.00 -0.05 0.00 0.00 56.93 57.00 2k6z s PHE 66 Cb 0.08 0.52 -0.04 0.00 -0.63 0.00 0.00 43.02 42.95 2k6z s PHE 66 CO 0.71 -0.11 -0.11 -0.51 -0.05 0.00 0.00 175.22 175.14 2k6z s LEU 67 N -2.90 2.90 0.07 -1.99 1.43 0.43 -4.99 118.68 113.62 2k6z s LEU 67 Ca 0.14 -0.64 0.08 0.00 -1.03 0.00 0.00 54.13 52.68 2k6z s LEU 67 Cb 0.06 -1.57 -0.03 0.00 0.03 0.00 0.00 46.19 44.67 2k6z s LEU 67 CO -0.05 0.10 -0.19 -0.70 0.23 0.00 0.00 176.35 175.73 2k6z s GLU 68 N -2.89 1.92 -0.01 1.70 2.56 -1.26 -0.60 118.70 120.12 2k6z s GLU 68 Ca 0.25 -1.07 0.01 0.00 0.00 0.00 0.00 54.97 54.16 2k6z s GLU 68 Cb -0.08 -2.13 0.00 0.00 2.00 0.00 0.00 34.13 33.92 2k6z s GLU 68 CO 0.15 0.52 -0.03 0.08 -0.56 0.00 0.00 175.26 175.41 2k6z s VAL 69 N -0.98 0.26 0.48 3.70 1.01 0.65 -4.99 120.40 120.54 2k6z s VAL 69 Ca 0.15 -0.12 -0.11 0.00 0.00 0.00 0.00 61.98 61.90 2k6z s VAL 69 Cb -0.10 -0.24 -0.06 0.00 0.00 0.00 0.00 36.38 35.97 2k6z s VAL 69 CO 0.06 0.09 0.87 -2.16 0.00 0.00 0.00 175.10 173.96 2k6z s PRO 70 N 0.06 3.76 0.37 2.72 0.04 -1.26 -1.67 135.00 139.02 2k6z s PRO 70 Ca -0.00 0.60 -0.28 0.00 0.04 0.00 0.00 61.00 61.36 2k6z s PRO 70 Cb -0.03 -2.27 -0.10 0.00 0.04 0.00 0.00 34.50 32.13 2k6z s PRO 70 CO -0.00 -0.21 1.42 -1.25 0.04 0.00 0.00 177.00 177.00 2k6z s PRO 71 N -4.24 4.14 0.00 0.56 0.04 -1.26 -2.55 135.00 131.69 2k6z s PRO 71 Ca 0.53 2.44 0.00 0.00 0.04 0.00 0.00 61.00 64.01 2k6z s PRO 71 Cb -0.10 -2.97 0.00 0.00 0.04 0.00 0.00 34.50 31.47 2k6z s PRO 71 CO 0.37 -0.45 0.00 1.63 0.04 0.00 0.00 177.00 178.58 2k6z n LYS 72 N 0.49 0.00 -2.71 4.56 4.76 0.50 -5.00 118.16 120.77 2k6z n LYS 72 Ca 0.01 0.00 -0.34 0.00 -2.87 0.00 0.00 58.31 55.12 2k6z n LYS 72 Cb 0.40 -2.93 -0.06 0.00 -1.84 0.00 0.00 35.03 30.61 2k6z n LYS 72 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2k6z s GLY 73 N -2.00 2.45 -0.14 0.72 0.00 -1.06 -4.82 107.32 102.48 2k6z s GLY 73 Ca 0.00 0.49 -0.03 0.00 0.00 0.00 0.00 44.72 45.18 2k6z s GLY 73 CO 0.00 0.79 -0.03 -1.60 0.00 0.00 0.00 173.10 172.26 2k6z s ARG 74 N -3.17 3.52 -0.08 2.90 3.52 -1.26 -1.42 118.95 122.96 2k6z s ARG 74 Ca 0.64 -0.50 -0.00 0.00 -0.13 0.00 0.00 55.73 55.74 2k6z s ARG 74 Cb -0.12 -2.88 0.02 0.00 -1.56 0.00 0.00 34.95 30.41 2k6z s ARG 74 CO 0.16 0.34 -0.06 0.08 -0.81 0.00 0.00 175.30 175.01 2k6z s VAL 75 N 0.11 0.79 -0.15 7.11 1.01 0.41 -5.01 120.40 124.68 2k6z s VAL 75 Ca -0.00 -0.18 -0.07 0.00 0.00 0.00 0.00 61.98 61.73 2k6z s VAL 75 Cb -0.13 -0.83 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 2k6z s VAL 75 CO 0.03 0.31 0.10 -0.70 0.00 0.00 0.00 175.10 174.84 2k6z s GLU 76 N 1.51 3.65 0.18 2.72 -6.30 -1.26 -0.65 118.70 118.55 2k6z s GLU 76 Ca -0.00 -0.24 -0.14 0.00 -2.50 0.00 0.00 54.97 52.08 2k6z s GLU 76 Cb -0.13 -3.18 0.16 0.00 0.00 0.00 0.00 34.13 30.97 2k6z s GLU 76 CO -0.04 0.55 1.69 -0.07 0.02 0.00 0.00 175.26 177.41 2k6z h LEU 77 N 5.76 -0.15 0.00 2.70 4.07 -1.41 -3.48 115.31 122.79 2k6z h LEU 77 Ca -0.47 0.10 0.00 0.00 0.08 0.00 0.00 57.88 57.59 2k6z h LEU 77 Cb 1.19 0.18 0.00 0.00 1.08 0.00 0.00 40.66 43.11 2k6z h LEU 77 CO 0.64 -0.04 0.00 1.17 -1.08 0.00 0.00 178.44 179.13 2k6z n LYS 78 N -5.20 0.00 0.00 1.13 3.00 -1.24 -2.12 118.16 113.74 2k6z n LYS 78 Ca 0.04 0.00 0.07 0.00 -0.00 0.00 0.00 58.31 58.42 2k6z n LYS 78 Cb 0.24 0.00 0.40 0.00 0.00 0.00 0.00 35.03 35.67 2k6z n LYS 78 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 2k6z n PRO 79 N 2.51 0.39 0.00 1.64 -0.04 -1.26 -1.68 135.00 136.56 2k6z n PRO 79 Ca 0.00 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 2k6z n PRO 79 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 2k6z n PRO 79 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k6z n GLY 80 N -0.14 -0.46 0.00 0.55 0.00 -1.26 -5.04 105.19 98.84 2k6z n GLY 80 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2k6z n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k6z n GLY 81 N -0.11 2.25 3.75 -0.02 0.00 -0.67 -4.72 105.19 105.65 2k6z n GLY 81 Ca 0.00 -0.26 -0.40 0.00 0.00 0.00 0.00 46.02 45.36 2k6z n GLY 81 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k6z s TYR 82 N 1.67 3.76 -0.14 1.61 1.51 -0.90 -2.34 117.35 122.52 2k6z s TYR 82 Ca 0.00 1.77 -0.29 0.00 -1.01 0.00 0.00 57.07 57.54 2k6z s TYR 82 Cb 0.00 -3.14 0.07 0.00 -0.11 0.00 0.00 41.96 38.78 2k6z s TYR 82 CO 0.00 -0.09 0.70 -3.38 -1.11 0.00 0.00 175.55 171.67 2k6z s HIS 83 N -0.77 -0.71 0.18 2.71 -3.43 0.13 -3.59 115.29 109.81 2k6z s HIS 83 Ca 0.45 1.44 -0.30 0.00 -0.80 0.00 0.00 55.06 55.85 2k6z s HIS 83 Cb -0.28 0.36 -0.08 0.00 -1.43 0.00 0.00 32.58 31.15 2k6z s HIS 83 CO 0.35 -0.51 1.05 -0.06 -2.00 0.00 0.00 174.74 173.57 2k6z s PHE 84 N -0.56 3.68 -0.15 0.38 0.08 -0.79 -0.29 117.98 120.33 2k6z s PHE 84 Ca -0.06 1.69 -0.09 0.00 0.12 0.00 0.00 56.93 58.59 2k6z s PHE 84 Cb -0.02 -3.20 -0.04 0.00 -0.57 0.00 0.00 43.02 39.19 2k6z s PHE 84 CO 0.06 -0.32 0.14 -1.64 -0.10 0.00 0.00 175.22 173.37 2k6z s MET 85 N -0.50 3.78 -0.40 0.44 -1.94 0.62 -0.69 119.30 120.61 2k6z s MET 85 Ca 0.47 -0.15 -0.13 0.00 -1.71 0.00 0.00 55.69 54.18 2k6z s MET 85 Cb -0.28 -3.29 0.04 0.00 2.01 0.00 0.00 34.83 33.30 2k6z s MET 85 CO 0.34 0.57 0.26 -0.51 -0.01 0.00 0.00 175.02 175.67 2k6z s LEU 86 N -0.42 4.99 -0.18 -0.03 1.02 0.08 -1.57 118.68 122.56 2k6z s LEU 86 Ca 0.12 -1.05 -0.08 0.00 0.02 0.00 0.00 54.13 53.14 2k6z s LEU 86 Cb -0.12 -2.08 -0.04 0.00 0.02 0.00 0.00 46.19 43.97 2k6z s LEU 86 CO 0.02 -0.45 0.08 -0.76 0.02 0.00 0.00 176.35 175.26 2k6z s LEU 87 N 1.59 3.95 -0.41 1.79 2.01 0.41 -1.05 118.68 126.96 2k6z s LEU 87 Ca 0.03 0.15 -0.01 0.00 0.01 0.00 0.00 54.13 54.31 2k6z s LEU 87 Cb -0.20 -2.00 -0.01 0.00 0.01 0.00 0.00 46.19 43.99 2k6z s LEU 87 CO 0.07 0.20 0.35 0.61 1.01 0.00 0.00 176.35 178.59 2k6z n GLY 88 N 3.39 0.16 3.34 -3.19 0.00 -0.42 -1.77 105.19 106.70 2k6z n GLY 88 Ca -0.17 -0.16 -0.35 0.00 0.00 0.00 0.00 46.02 45.33 2k6z n GLY 88 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k6z n LEU 89 N -2.12 -1.31 -0.03 0.99 4.77 -1.21 -0.74 117.00 117.35 2k6z n LEU 89 Ca -0.08 0.43 -0.00 0.00 -0.03 0.00 0.00 56.01 56.33 2k6z n LEU 89 Cb 0.55 -1.09 -0.07 0.00 -2.33 0.00 0.00 43.42 40.48 2k6z n LEU 89 CO 0.22 -4.03 -0.72 0.29 -1.33 0.00 0.00 177.39 171.82 2k6z n LYS 90 N -0.15 1.56 -4.84 3.23 4.76 -1.17 -4.81 118.16 116.74 2k6z n LYS 90 Ca 0.06 -0.04 -0.26 0.00 -2.87 0.00 0.00 58.31 55.20 2k6z n LYS 90 Cb 0.52 -1.24 -0.15 0.00 -1.84 0.00 0.00 35.03 32.33 2k6z n LYS 90 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2k6z s ARG 91 N -2.42 1.53 0.65 1.97 0.52 -1.26 -5.06 118.95 114.89 2k6z s ARG 91 Ca -0.04 -0.82 -0.14 0.00 -0.52 0.00 0.00 55.73 54.21 2k6z s ARG 91 Cb 0.04 -1.55 -0.01 0.00 0.52 0.00 0.00 34.95 33.96 2k6z s ARG 91 CO 0.39 0.41 1.08 -1.25 0.02 0.00 0.00 175.30 175.95 2k6z s PRO 92 N -0.77 2.96 0.34 3.54 0.04 -1.26 -4.92 135.00 134.94 2k6z s PRO 92 Ca 0.08 1.23 0.02 0.00 0.04 0.00 0.00 61.00 62.37 2k6z s PRO 92 Cb -0.08 -1.98 -0.02 0.00 0.04 0.00 0.00 34.50 32.45 2k6z s PRO 92 CO 0.00 -1.10 0.52 -0.51 0.04 0.00 0.00 177.00 175.95 2k6z s LEU 93 N -4.94 3.99 0.00 -3.56 2.01 -1.21 -5.01 118.68 109.96 2k6z s LEU 93 Ca 0.64 0.23 0.03 0.00 0.01 0.00 0.00 54.13 55.04 2k6z s LEU 93 Cb -0.17 -3.10 -0.01 0.00 0.01 0.00 0.00 46.19 42.92 2k6z s LEU 93 CO 0.43 -0.36 0.12 0.29 1.01 0.00 0.00 176.35 177.85 2k6z n LYS 94 N -1.75 0.60 -4.03 1.70 5.02 -1.26 -4.84 118.16 113.61 2k6z n LYS 94 Ca -0.04 -2.30 -0.30 0.00 -2.02 0.00 0.00 58.31 53.66 2k6z n LYS 94 Cb 0.57 1.39 -0.06 0.00 -0.02 0.00 0.00 35.03 36.91 2k6z n LYS 94 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2k6z s ALA 95 N -2.78 3.64 -0.35 7.82 0.00 -1.26 -4.15 121.76 124.69 2k6z s ALA 95 Ca 0.17 -1.00 -0.01 0.00 0.00 0.00 0.00 51.96 51.11 2k6z s ALA 95 Cb 0.01 -1.50 0.00 0.00 0.00 0.00 0.00 23.12 21.63 2k6z s ALA 95 CO 0.12 0.74 0.19 0.41 0.00 0.00 0.00 175.76 177.21 2k6z n GLY 96 N 0.35 0.47 2.99 0.00 0.00 -0.91 -5.01 105.19 103.08 2k6z n GLY 96 Ca -0.08 -0.53 -0.26 0.00 0.00 0.00 0.00 46.02 45.15 2k6z n GLY 96 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2k6z n GLU 97 N -1.52 0.89 -3.86 1.61 1.02 -1.25 -5.00 120.64 112.53 2k6z n GLU 97 Ca -0.02 -3.05 -0.14 0.00 -0.02 0.00 0.00 57.16 53.93 2k6z n GLU 97 Cb 0.52 1.01 -0.15 0.00 -0.02 0.00 0.00 31.44 32.81 2k6z n GLU 97 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2k6z s GLU 98 N -3.48 0.04 0.00 3.49 2.02 -1.26 0.03 118.70 119.54 2k6z s GLU 98 Ca 0.04 0.06 -0.04 0.00 0.02 0.00 0.00 54.97 55.05 2k6z s GLU 98 Cb 0.00 -0.16 -0.01 0.00 0.10 0.00 0.00 34.13 34.07 2k6z s GLU 98 CO 0.03 -0.07 0.07 0.08 0.02 0.00 0.00 175.26 175.40 2k6z s VAL 99 N 0.46 0.08 0.04 2.63 1.01 0.05 -4.90 120.40 119.78 2k6z s VAL 99 Ca -0.04 -0.70 -0.00 0.00 0.00 0.00 0.00 61.98 61.24 2k6z s VAL 99 Cb -0.06 -0.34 -0.04 0.00 0.00 0.00 0.00 36.38 35.94 2k6z s VAL 99 CO -0.01 -0.38 0.18 -1.83 0.00 0.00 0.00 175.10 173.06 2k6z s GLU 100 N -1.26 3.36 0.19 2.72 -1.05 -1.26 -1.33 118.70 120.06 2k6z s GLU 100 Ca -0.14 -0.44 0.07 0.00 -0.15 0.00 0.00 54.97 54.32 2k6z s GLU 100 Cb -0.08 -3.01 -0.04 0.00 -0.44 0.00 0.00 34.13 30.56 2k6z s GLU 100 CO 0.01 0.63 -0.14 -0.51 0.95 0.00 0.00 175.26 176.19 2k6z s LEU 101 N -2.29 2.53 -0.37 1.83 1.02 -0.57 -4.36 118.68 116.45 2k6z s LEU 101 Ca 0.32 -0.98 0.01 0.00 0.02 0.00 0.00 54.13 53.49 2k6z s LEU 101 Cb -0.13 -0.65 0.12 0.00 0.02 0.00 0.00 46.19 45.56 2k6z s LEU 101 CO 0.24 -0.17 0.17 -1.81 0.02 0.00 0.00 176.35 174.81 2k6z s ASP 102 N -3.14 3.72 0.16 2.29 1.11 0.04 -0.03 116.67 120.82 2k6z s ASP 102 Ca 0.20 -2.13 -0.30 0.00 0.18 0.00 0.00 52.55 50.50 2k6z s ASP 102 Cb -0.01 -0.87 -0.07 0.00 1.07 0.00 0.00 42.92 43.04 2k6z s ASP 102 CO 0.06 -0.34 1.00 -0.76 1.18 0.00 0.00 175.17 176.31 2k6z s LEU 103 N 1.01 4.52 -0.25 1.23 1.02 0.44 -0.06 118.68 126.59 2k6z s LEU 103 Ca 0.14 1.92 -0.07 0.00 0.02 0.00 0.00 54.13 56.14 2k6z s LEU 103 Cb -0.21 -3.60 -0.02 0.00 0.02 0.00 0.00 46.19 42.38 2k6z s LEU 103 CO -0.11 -0.08 0.06 -0.76 0.02 0.00 0.00 176.35 175.48 2k6z s LEU 104 N -0.33 3.43 0.06 1.79 1.43 0.00 -1.48 118.68 123.58 2k6z s LEU 104 Ca 0.47 -0.27 0.09 0.00 -1.03 0.00 0.00 54.13 53.38 2k6z s LEU 104 Cb -0.26 -1.90 -0.03 0.00 0.03 0.00 0.00 46.19 44.03 2k6z s LEU 104 CO 0.32 -0.05 -0.23 -0.36 0.23 0.00 0.00 176.35 176.26 2k6z s PHE 105 N 1.59 2.41 0.13 0.29 0.08 -0.30 -0.44 117.98 121.73 2k6z s PHE 105 Ca 0.06 -0.35 -0.32 0.00 0.12 0.00 0.00 56.93 56.44 2k6z s PHE 105 Cb -0.15 -1.40 -0.11 0.00 -0.57 0.00 0.00 43.02 40.79 2k6z s PHE 105 CO 0.03 0.20 1.79 0.00 -0.10 0.00 0.00 175.22 177.14 2k6z n ALA 106 N 1.57 2.11 -1.59 5.36 0.00 0.05 -2.91 120.51 125.09 2k6z n ALA 106 Ca -0.17 0.34 -0.00 0.00 0.00 0.00 0.00 53.44 53.62 2k6z n ALA 106 Cb 0.52 -2.54 0.00 0.00 0.00 0.00 0.00 19.45 17.43 2k6z n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k6z n GLY 107 N 4.09 -0.18 2.19 0.00 0.00 -1.26 -4.64 105.19 105.40 2k6z n GLY 107 Ca 0.18 -0.17 -0.07 0.00 0.00 0.00 0.00 46.02 45.96 2k6z n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k6z n GLY 108 N -1.11 0.87 3.49 -0.02 0.00 -1.25 -5.02 105.19 102.15 2k6z n GLY 108 Ca -0.00 -0.74 -0.33 0.00 0.00 0.00 0.00 46.02 44.95 2k6z n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k6z s LYS 109 N -2.65 2.70 0.01 1.61 1.02 -1.15 -5.05 119.74 116.24 2k6z s LYS 109 Ca 0.00 -0.65 0.00 0.00 0.02 0.00 0.00 55.97 55.34 2k6z s LYS 109 Cb 0.00 -2.48 -0.01 0.00 -0.52 0.00 0.00 37.83 34.82 2k6z s LYS 109 CO 0.00 0.58 -0.02 0.08 -0.92 0.00 0.00 175.35 175.07 2k6z s VAL 110 N -0.60 0.08 -0.11 3.17 1.01 -1.26 -1.15 120.40 121.53 2k6z s VAL 110 Ca 0.09 -0.54 -0.04 0.00 0.00 0.00 0.00 61.98 61.48 2k6z s VAL 110 Cb -0.11 -0.17 0.06 0.00 0.00 0.00 0.00 36.38 36.15 2k6z s VAL 110 CO 0.01 -0.29 0.23 -0.22 0.00 0.00 0.00 175.10 174.83 2k6z s LEU 111 N -0.86 -0.20 0.20 3.92 2.96 -0.55 -4.98 118.68 119.17 2k6z s LEU 111 Ca -0.09 0.50 -0.30 0.00 -0.22 0.00 0.00 54.13 54.02 2k6z s LEU 111 Cb -0.06 0.56 -0.08 0.00 0.50 0.00 0.00 46.19 47.11 2k6z s LEU 111 CO -0.01 -0.24 0.98 -0.75 -1.32 0.00 0.00 176.35 175.01 2k6z s LYS 112 N 2.33 4.76 0.23 1.98 2.20 -1.26 -0.42 119.74 129.57 2k6z s LYS 112 Ca 0.01 1.53 0.08 0.00 -0.36 0.00 0.00 55.97 57.23 2k6z s LYS 112 Cb -0.12 -3.30 -0.05 0.00 -1.51 0.00 0.00 37.83 32.85 2k6z s LYS 112 CO -0.08 0.35 -0.12 0.14 -0.36 0.00 0.00 175.35 175.29 2k6z s VAL 113 N -0.72 1.73 -0.02 4.02 -7.23 0.96 -4.96 120.40 114.19 2k6z s VAL 113 Ca 0.44 -2.19 0.01 0.00 -1.81 0.00 0.00 61.98 58.43 2k6z s VAL 113 Cb -0.26 -2.19 0.01 0.00 0.56 0.00 0.00 36.38 34.50 2k6z s VAL 113 CO 0.32 -0.49 -0.04 -0.69 -0.31 0.00 0.00 175.10 173.90 2k6z s VAL 114 N -2.97 0.38 -0.01 1.32 1.01 -1.26 -1.52 120.40 117.35 2k6z s VAL 114 Ca 0.25 -0.14 -0.09 0.00 0.00 0.00 0.00 61.98 62.00 2k6z s VAL 114 Cb 0.01 -0.37 0.01 0.00 0.00 0.00 0.00 36.38 36.02 2k6z s VAL 114 CO 0.09 0.14 0.18 -1.48 0.00 0.00 0.00 175.10 174.03 2k6z s LEU 115 N 0.30 1.36 0.62 3.92 2.34 -0.44 -4.94 118.68 121.84 2k6z s LEU 115 Ca -0.03 -0.05 -0.17 0.00 0.06 0.00 0.00 54.13 53.94 2k6z s LEU 115 Cb -0.07 0.80 -0.02 0.00 -0.56 0.00 0.00 46.19 46.34 2k6z s LEU 115 CO -0.00 -0.34 1.17 -2.16 -1.06 0.00 0.00 176.35 173.96 2k6z s PRO 116 N -1.13 2.86 -0.29 1.48 0.04 -1.26 -0.77 135.00 135.94 2k6z s PRO 116 Ca -0.12 1.66 -0.16 0.00 0.04 0.00 0.00 61.00 62.43 2k6z s PRO 116 Cb -0.06 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.52 2k6z s PRO 116 CO 0.02 -1.25 0.40 0.08 0.04 0.00 0.00 177.00 176.29 2k6z s VAL 117 N -1.88 5.15 0.36 -0.36 1.01 0.10 -1.57 120.40 123.21 2k6z s VAL 117 Ca 0.73 0.51 -0.01 0.00 0.00 0.00 0.00 61.98 63.22 2k6z s VAL 117 Cb -0.26 -3.76 0.00 0.00 0.00 0.00 0.00 36.38 32.37 2k6z s VAL 117 CO 0.36 0.08 0.49 -1.61 0.00 0.00 0.00 175.10 174.41 2k6z s GLU 118 N 2.12 1.99 -0.05 2.72 0.41 -1.24 -2.13 118.70 122.52 2k6z s GLU 118 Ca 0.16 -1.84 0.06 0.00 -0.41 0.00 0.00 54.97 52.94 2k6z s GLU 118 Cb -0.16 0.45 -0.01 0.00 -1.78 0.00 0.00 34.13 32.63 2k6z s GLU 118 CO 0.10 -0.83 -0.23 0.00 -0.49 0.00 0.00 175.26 173.81 2k6z s ALA 119 N -2.89 2.02 0.00 5.21 0.00 -1.26 -2.27 121.76 122.57 2k6z s ALA 119 Ca 0.31 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 51.29 2k6z s ALA 119 Cb -0.01 -0.61 0.00 0.00 0.00 0.00 0.00 23.12 22.50 2k6z s ALA 119 CO 0.22 0.41 0.00 2.89 0.00 0.00 0.00 175.76 179.28