#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6z s SER 2 N 0.00 5.16 0.14 1.61 0.01 -1.26 -3.88 113.70 115.48 2k6z s SER 2 Ca 0.00 0.93 0.00 0.00 1.31 0.00 0.00 55.95 58.19 2k6z s SER 2 Cb 0.00 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.71 2k6z s SER 2 CO 0.00 -2.35 0.00 0.49 0.41 0.00 0.00 173.24 171.79 2k6z n PHE 3 N 13.09 -2.46 -0.00 2.43 3.01 -1.26 -5.06 117.46 127.21 2k6z n PHE 3 Ca 0.27 1.41 -0.00 0.00 1.01 0.00 0.00 57.45 60.13 2k6z n PHE 3 Cb 0.51 -2.75 -0.00 0.00 -0.01 0.00 0.00 39.48 37.23 2k6z n PHE 3 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 2k6z n THR 4 N 0.58 0.02 -2.80 4.37 -1.04 -1.25 -5.04 114.28 109.12 2k6z n THR 4 Ca 0.00 -0.01 -0.21 0.00 -2.04 0.00 0.00 64.05 61.79 2k6z n THR 4 Cb 0.00 -0.98 0.06 0.00 -1.82 0.00 0.00 70.33 67.59 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 -2.01 2.25 0.10 -2.82 2.02 -1.26 -4.56 118.70 112.43 2k6z s GLU 5 Ca -0.00 -1.21 0.00 0.00 0.02 0.00 0.00 54.97 53.78 2k6z s GLU 5 Cb 0.00 -2.53 -0.00 0.00 0.10 0.00 0.00 34.13 31.70 2k6z s GLU 5 CO 0.01 -0.91 0.01 0.41 0.02 0.00 0.00 175.26 174.81 2k6z n GLY 6 N -2.38 4.02 3.72 -1.39 0.00 -1.26 -4.49 105.19 103.40 2k6z n GLY 6 Ca 0.12 -2.14 -0.32 0.00 0.00 0.00 0.00 46.02 43.69 2k6z n GLY 6 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2k6z s TRP 7 N -1.56 1.86 0.01 1.61 -2.14 -1.15 -4.16 118.94 113.41 2k6z s TRP 7 Ca 0.02 -1.01 0.09 0.00 2.66 0.00 0.00 56.10 57.85 2k6z s TRP 7 Cb 0.00 -1.53 -0.02 0.00 -3.10 0.00 0.00 33.47 28.81 2k6z s TRP 7 CO 0.01 0.14 -0.26 0.08 -2.66 0.00 0.00 176.95 174.26 2k6z s VAL 8 N -2.93 2.09 0.00 -0.66 1.01 -0.01 -1.59 120.40 118.30 2k6z s VAL 8 Ca 0.09 -1.24 0.00 0.00 0.00 0.00 0.00 61.98 60.83 2k6z s VAL 8 Cb 0.02 -1.76 0.00 0.00 0.00 0.00 0.00 36.38 34.64 2k6z s VAL 8 CO 0.05 0.48 0.00 0.54 0.00 0.00 0.00 175.10 176.17 2k6z n ARG 9 N 2.12 0.00 -3.53 2.72 5.12 -1.23 -1.69 116.66 120.17 2k6z n ARG 9 Ca -0.16 0.00 -0.16 0.00 -1.93 0.00 0.00 57.85 55.59 2k6z n ARG 9 Cb 0.51 -0.01 -0.06 0.00 -1.16 0.00 0.00 32.46 31.75 2k6z n ARG 9 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 2k6z s PHE 10 N 0.00 -0.60 -0.11 -1.55 5.36 -1.26 -3.40 117.98 116.41 2k6z s PHE 10 Ca 0.00 1.00 0.03 0.00 -0.96 0.00 0.00 56.93 57.00 2k6z s PHE 10 Cb 0.00 0.42 0.01 0.00 -0.34 0.00 0.00 43.02 43.11 2k6z s PHE 10 CO 0.00 -0.57 -0.20 -1.12 -1.46 0.00 0.00 175.22 171.86 2k6z s SER 11 N -1.26 2.80 -0.02 6.13 0.01 -0.82 -4.57 113.70 115.96 2k6z s SER 11 Ca -0.09 -0.51 -0.25 0.00 1.31 0.00 0.00 55.95 56.41 2k6z s SER 11 Cb -0.00 -1.28 -0.20 0.00 0.21 0.00 0.00 66.02 64.75 2k6z s SER 11 CO 0.07 0.09 1.24 1.55 0.41 0.00 0.00 173.24 176.61 2k6z h PRO 12 N 7.05 0.04 0.00 12.44 0.13 -1.88 -3.44 132.00 146.35 2k6z h PRO 12 Ca -0.27 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2k6z h PRO 12 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2k6z h PRO 12 CO 0.50 0.56 0.00 0.41 -0.23 0.00 0.00 178.00 179.23 2k6z n GLY 13 N 0.32 2.76 0.73 1.56 0.00 -1.26 -4.92 105.19 104.38 2k6z n GLY 13 Ca -0.08 -1.58 0.03 0.00 0.00 0.00 0.00 46.02 44.39 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 1.04 1.98 -4.14 1.61 -0.04 -1.26 -5.05 135.00 129.14 2k6z n PRO 14 Ca 0.00 -1.01 -0.12 0.00 -0.04 0.00 0.00 63.50 62.33 2k6z n PRO 14 Cb 0.00 -1.48 -0.08 0.00 -0.04 0.00 0.00 33.50 31.90 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 -0.64 0.27 0.27 3.54 4.22 -1.26 -0.76 114.94 120.58 2k6z s ASN 15 Ca 0.18 -1.29 -0.07 0.00 -2.14 0.00 0.00 52.86 49.53 2k6z s ASN 15 Cb 0.12 0.48 0.03 0.00 1.28 0.00 0.00 41.25 43.16 2k6z s ASN 15 CO 0.09 -0.99 0.49 0.00 -2.04 0.00 0.00 177.10 174.65 2k6z n ALA 16 N -0.36 -0.91 -3.29 3.54 0.00 -0.01 -4.10 120.51 115.38 2k6z n ALA 16 Ca 0.01 -1.00 -0.13 0.00 0.00 0.00 0.00 53.44 52.32 2k6z n ALA 16 Cb 0.64 0.80 -0.10 0.00 0.00 0.00 0.00 19.45 20.79 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 -2.01 -0.97 0.18 0.00 0.00 -1.26 -0.79 121.76 116.91 2k6z s ALA 17 Ca 0.15 1.02 0.11 0.00 0.00 0.00 0.00 51.96 53.24 2k6z s ALA 17 Cb -0.03 -0.54 -0.04 0.00 0.00 0.00 0.00 23.12 22.51 2k6z s ALA 17 CO 0.11 -0.20 -0.24 0.00 0.00 0.00 0.00 175.76 175.43 2k6z s ALA 18 N -0.01 2.49 -0.37 0.00 0.00 -0.09 -3.56 121.76 120.21 2k6z s ALA 18 Ca -0.02 -1.61 0.12 0.00 0.00 0.00 0.00 51.96 50.45 2k6z s ALA 18 Cb -0.03 -0.33 0.36 0.00 0.00 0.00 0.00 23.12 23.12 2k6z s ALA 18 CO 0.01 0.44 0.75 0.66 0.00 0.00 0.00 175.76 177.62 2k6z n TYR 19 N 0.37 0.39 -1.19 0.00 4.02 -0.62 -1.59 117.16 118.53 2k6z n TYR 19 Ca -0.13 -3.76 -0.29 0.00 -0.01 0.00 0.00 57.90 53.71 2k6z n TYR 19 Cb 0.56 -0.42 0.16 0.00 -0.02 0.00 0.00 39.34 39.61 2k6z n TYR 19 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 176.86 175.37 2k6z s LEU 20 N -2.52 1.92 0.00 7.72 0.05 -1.26 -2.94 118.68 121.65 2k6z s LEU 20 Ca 0.39 1.33 -0.02 0.00 0.05 0.00 0.00 54.13 55.89 2k6z s LEU 20 Cb 0.36 -3.63 -0.04 0.00 -2.05 0.00 0.00 46.19 40.83 2k6z s LEU 20 CO -0.07 -2.89 0.15 -0.89 -0.55 0.00 0.00 176.35 172.09 2k6z s THR 21 N -2.95 5.20 -0.21 5.48 2.01 -1.26 -1.57 115.64 122.33 2k6z s THR 21 Ca 0.64 -0.27 -0.00 0.00 0.31 0.00 0.00 61.69 62.37 2k6z s THR 21 Cb -0.18 -3.43 0.02 0.00 0.01 0.00 0.00 72.50 68.92 2k6z s THR 21 CO 0.57 0.31 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.93 2k6z s LEU 22 N -1.95 2.70 -0.10 4.42 2.01 -0.52 -4.83 118.68 120.40 2k6z s LEU 22 Ca 0.27 -0.74 0.03 0.00 0.01 0.00 0.00 54.13 53.70 2k6z s LEU 22 Cb -0.12 -1.59 0.01 0.00 0.01 0.00 0.00 46.19 44.50 2k6z s LEU 22 CO 0.18 -0.06 -0.19 -1.61 1.01 0.00 0.00 176.35 175.69 2k6z s GLU 23 N 1.31 2.54 -0.47 1.70 2.02 -1.26 -0.22 118.70 124.32 2k6z s GLU 23 Ca 0.02 -0.70 -0.17 0.00 0.02 0.00 0.00 54.97 54.15 2k6z s GLU 23 Cb -0.15 -2.01 0.06 0.00 0.10 0.00 0.00 34.13 32.13 2k6z s GLU 23 CO -0.08 0.07 0.48 1.21 0.02 0.00 0.00 175.26 176.96 2k6z s ASN 24 N 0.62 6.18 0.06 -0.19 3.84 -0.45 -4.95 114.94 120.04 2k6z s ASN 24 Ca -0.14 -1.06 0.26 0.00 0.21 0.00 0.00 52.86 52.14 2k6z s ASN 24 Cb -0.16 -2.23 0.78 0.00 -0.55 0.00 0.00 41.25 39.09 2k6z s ASN 24 CO 0.04 -0.72 1.64 -0.81 -2.79 0.00 0.00 177.10 174.46 2k6z n PRO 25 N 5.61 0.10 -2.50 0.43 -0.04 -1.26 -1.38 135.00 135.96 2k6z n PRO 25 Ca -0.09 0.05 -0.25 0.00 -0.04 0.00 0.00 63.50 63.17 2k6z n PRO 25 Cb 0.45 -1.58 0.04 0.00 -0.04 0.00 0.00 33.50 32.36 2k6z n PRO 25 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2k6z s GLY 26 N -3.22 1.65 0.00 0.55 0.00 -1.26 -4.77 107.32 100.28 2k6z s GLY 26 Ca 0.11 -0.92 0.23 0.00 0.00 0.00 0.00 44.72 44.14 2k6z s GLY 26 CO 0.63 -0.63 1.64 1.22 0.00 0.00 0.00 173.10 175.95 2k6z n ASP 27 N -2.52 1.49 -4.61 1.64 8.00 -1.26 -2.99 116.55 116.29 2k6z n ASP 27 Ca 0.05 -1.61 -0.26 0.00 0.71 0.00 0.00 54.79 53.68 2k6z n ASP 27 Cb 0.59 -0.06 -0.08 0.00 -0.02 0.00 0.00 41.12 41.54 2k6z n ASP 27 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 2k6z s LEU 28 N -1.71 3.11 0.29 0.64 0.05 -1.26 -4.81 118.68 114.99 2k6z s LEU 28 Ca 0.34 -0.54 -0.28 0.00 0.05 0.00 0.00 54.13 53.71 2k6z s LEU 28 Cb 0.18 -1.75 -0.09 0.00 -2.05 0.00 0.00 46.19 42.48 2k6z s LEU 28 CO 0.29 0.08 0.96 -2.16 -0.55 0.00 0.00 176.35 174.96 2k6z s PRO 29 N -3.02 4.68 -0.05 1.48 0.04 -1.26 -4.06 135.00 132.80 2k6z s PRO 29 Ca 0.27 1.43 -0.06 0.00 0.04 0.00 0.00 61.00 62.67 2k6z s PRO 29 Cb -0.08 -3.00 -0.04 0.00 0.04 0.00 0.00 34.50 31.41 2k6z s PRO 29 CO 0.17 0.35 0.20 -0.51 0.04 0.00 0.00 177.00 177.25 2k6z s LEU 30 N -1.70 4.39 -0.22 -3.56 1.02 -0.44 -4.99 118.68 113.18 2k6z s LEU 30 Ca 0.47 0.50 -0.04 0.00 0.02 0.00 0.00 54.13 55.07 2k6z s LEU 30 Cb -0.22 -2.39 0.08 0.00 0.02 0.00 0.00 46.19 43.67 2k6z s LEU 30 CO 0.28 0.33 0.09 -0.60 0.02 0.00 0.00 176.35 176.47 2k6z s ARG 31 N -1.43 0.29 -0.49 1.70 3.52 -1.26 -0.53 118.95 120.75 2k6z s ARG 31 Ca 0.22 -0.38 -0.18 0.00 -0.13 0.00 0.00 55.73 55.25 2k6z s ARG 31 Cb -0.13 -1.71 0.05 0.00 -1.56 0.00 0.00 34.95 31.60 2k6z s ARG 31 CO 0.11 -0.80 0.56 -1.17 -0.81 0.00 0.00 175.30 173.20 2k6z s LEU 32 N 2.02 5.06 -0.04 -0.88 0.20 0.10 -0.88 118.68 124.25 2k6z s LEU 32 Ca 0.04 -0.94 0.17 0.00 0.69 0.00 0.00 54.13 54.09 2k6z s LEU 32 Cb -0.16 -2.40 -0.26 0.00 -0.43 0.00 0.00 46.19 42.94 2k6z s LEU 32 CO -0.18 -0.81 0.33 1.33 -0.29 0.00 0.00 176.35 176.73 2k6z n VAL 33 N 5.53 0.17 -3.45 1.68 0.24 0.40 -0.65 118.33 122.24 2k6z n VAL 33 Ca -0.07 -0.44 -0.05 0.00 -2.04 0.00 0.00 64.34 61.74 2k6z n VAL 33 Cb 0.45 0.00 0.01 0.00 -1.47 0.00 0.00 33.84 32.84 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 1.61 1.65 3.38 7.63 0.00 -1.21 -4.67 105.19 113.58 2k6z n GLY 34 Ca -0.07 -1.18 -0.22 0.00 0.00 0.00 0.00 46.02 44.55 2k6z n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k6z s ALA 35 N -1.62 2.33 0.07 4.61 0.00 -1.26 -1.31 121.76 124.57 2k6z s ALA 35 Ca 0.09 -1.73 -0.06 0.00 0.00 0.00 0.00 51.96 50.25 2k6z s ALA 35 Cb -0.02 1.22 -0.01 0.00 0.00 0.00 0.00 23.12 24.30 2k6z s ALA 35 CO 0.07 -0.55 0.12 0.50 0.00 0.00 0.00 175.76 175.90 2k6z s ARG 36 N -3.50 0.73 -0.19 0.00 3.52 -0.67 -4.88 118.95 113.96 2k6z s ARG 36 Ca 0.34 -0.95 -0.28 0.00 -0.13 0.00 0.00 55.73 54.71 2k6z s ARG 36 Cb 0.02 0.29 0.10 0.00 -1.56 0.00 0.00 34.95 33.80 2k6z s ARG 36 CO 0.23 -0.20 0.87 -0.08 -0.81 0.00 0.00 175.30 175.31 2k6z s THR 37 N -3.52 0.00 -1.72 4.11 -1.32 -1.26 -0.38 115.64 111.55 2k6z s THR 37 Ca 0.03 0.00 0.22 0.00 -1.21 0.00 0.00 61.69 60.73 2k6z s THR 37 Cb 0.04 -1.00 0.51 0.00 -1.51 0.00 0.00 72.50 70.54 2k6z s THR 37 CO -0.09 0.00 1.71 -0.81 -2.21 0.00 0.00 174.62 173.22 2k6z n PRO 38 N 1.58 0.51 -0.32 7.08 -0.04 -1.26 -3.59 135.00 138.96 2k6z n PRO 38 Ca -0.14 0.04 0.08 0.00 -0.04 0.00 0.00 63.50 63.44 2k6z n PRO 38 Cb 0.56 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 32.76 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 -1.14 1.29 -4.05 0.52 0.24 -1.26 -4.82 118.33 109.12 2k6z n VAL 39 Ca 0.14 -1.14 -0.08 0.00 -2.04 0.00 0.00 64.34 61.22 2k6z n VAL 39 Cb 0.12 0.35 -0.10 0.00 -1.47 0.00 0.00 33.84 32.74 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 -1.36 0.37 0.01 2.33 0.00 -1.24 -1.11 121.76 120.76 2k6z s ALA 40 Ca 0.35 -0.98 0.08 0.00 0.00 0.00 0.00 51.96 51.41 2k6z s ALA 40 Cb 0.21 0.23 -0.23 0.00 0.00 0.00 0.00 23.12 23.33 2k6z s ALA 40 CO 0.20 -0.30 0.86 1.49 0.00 0.00 0.00 175.76 178.02 2k6z h GLU 41 N 3.68 0.04 -3.86 0.00 4.57 -1.61 -3.47 114.58 113.94 2k6z h GLU 41 Ca -0.33 -0.07 -0.18 0.00 -1.18 0.00 0.00 59.36 57.60 2k6z h GLU 41 Cb 1.17 0.03 -0.23 0.00 -0.16 0.00 0.00 28.75 29.55 2k6z h GLU 41 CO 0.57 0.75 -0.68 1.03 -1.18 0.00 0.00 179.01 179.50 2k6z s ARG 42 N -2.63 0.25 0.00 1.92 0.52 -1.12 -5.03 118.95 112.86 2k6z s ARG 42 Ca -0.04 -0.42 0.07 0.00 -0.52 0.00 0.00 55.73 54.82 2k6z s ARG 42 Cb 0.08 0.09 -0.03 0.00 0.52 0.00 0.00 34.95 35.62 2k6z s ARG 42 CO 0.82 -0.04 -0.23 0.54 0.02 0.00 0.00 175.30 176.41 2k6z s VAL 43 N -1.07 2.37 -0.01 3.52 0.11 -1.26 -1.19 120.40 122.86 2k6z s VAL 43 Ca -0.12 -1.13 -0.00 0.00 -2.93 0.00 0.00 61.98 57.80 2k6z s VAL 43 Cb -0.07 -1.90 0.01 0.00 -1.53 0.00 0.00 36.38 32.89 2k6z s VAL 43 CO -0.00 0.49 0.02 -0.70 -3.33 0.00 0.00 175.10 171.57 2k6z s GLU 44 N -0.93 0.01 -0.39 1.54 2.12 -0.18 -4.86 118.70 116.01 2k6z s GLU 44 Ca 0.11 0.06 -0.15 0.00 0.36 0.00 0.00 54.97 55.36 2k6z s GLU 44 Cb -0.10 -0.05 0.01 0.00 0.26 0.00 0.00 34.13 34.24 2k6z s GLU 44 CO 0.01 -0.04 0.30 -1.17 -0.54 0.00 0.00 175.26 173.82 2k6z s LEU 45 N 0.26 4.86 0.21 2.70 2.96 -1.26 -0.37 118.68 128.05 2k6z s LEU 45 Ca -0.02 -0.69 0.11 0.00 -0.22 0.00 0.00 54.13 53.31 2k6z s LEU 45 Cb -0.03 -2.19 -0.05 0.00 0.50 0.00 0.00 46.19 44.43 2k6z s LEU 45 CO -0.01 -0.39 -0.20 -1.00 -1.32 0.00 0.00 176.35 173.43 2k6z s HIS 46 N 1.76 2.36 0.54 5.38 3.76 -0.60 -0.83 115.29 127.65 2k6z s HIS 46 Ca 0.06 -0.33 0.09 0.00 -0.15 0.00 0.00 55.06 54.74 2k6z s HIS 46 Cb -0.18 -1.13 0.07 0.00 1.11 0.00 0.00 32.58 32.44 2k6z s HIS 46 CO 0.11 0.55 0.73 -1.83 -0.85 0.00 0.00 174.74 173.45 2k6z s GLU 47 N -2.90 2.43 -0.06 1.40 -1.05 0.23 -0.68 118.70 118.07 2k6z s GLU 47 Ca 0.24 -1.56 -0.04 0.00 -0.15 0.00 0.00 54.97 53.46 2k6z s GLU 47 Cb -0.07 -2.66 0.02 0.00 -0.44 0.00 0.00 34.13 30.98 2k6z s GLU 47 CO 0.12 -0.71 0.14 0.99 0.95 0.00 0.00 175.26 176.74 2k6z s THR 48 N -2.59 -0.02 0.13 1.83 2.01 -0.81 -2.87 115.64 113.32 2k6z s THR 48 Ca 0.60 0.07 -0.00 0.00 0.31 0.00 0.00 61.69 62.66 2k6z s THR 48 Cb -0.07 -0.21 -0.04 0.00 0.01 0.00 0.00 72.50 72.19 2k6z s THR 48 CO 0.37 0.03 0.04 0.72 -0.69 0.00 0.00 174.62 175.08 2k6z s PHE 49 N 0.48 0.91 -0.06 4.92 -0.12 0.10 -4.49 117.98 119.72 2k6z s PHE 49 Ca -0.03 -1.17 -0.06 0.00 -0.05 0.00 0.00 56.93 55.62 2k6z s PHE 49 Cb -0.05 -0.52 -0.04 0.00 -0.63 0.00 0.00 43.02 41.78 2k6z s PHE 49 CO -0.02 -0.43 0.18 1.41 -0.05 0.00 0.00 175.22 176.31 2k6z s MET 50 N -4.01 3.48 -0.01 1.99 -2.45 -1.26 -1.07 119.30 115.97 2k6z s MET 50 Ca 0.23 -0.17 -0.04 0.00 -1.25 0.00 0.00 55.69 54.46 2k6z s MET 50 Cb 0.07 -3.15 0.00 0.00 1.25 0.00 0.00 34.83 33.01 2k6z s MET 50 CO 0.01 0.72 0.08 -0.98 1.05 0.00 0.00 175.02 175.91 2k6z s ARG 51 N -1.43 0.27 0.25 4.11 1.70 -0.07 -4.92 118.95 118.86 2k6z s ARG 51 Ca 0.21 -0.19 -0.28 0.00 -0.47 0.00 0.00 55.73 55.01 2k6z s ARG 51 Cb -0.13 0.11 -0.09 0.00 -0.57 0.00 0.00 34.95 34.28 2k6z s ARG 51 CO 0.11 -0.05 0.90 -2.00 -1.08 0.00 0.00 175.30 173.18 2k6z s GLU 52 N -0.71 4.71 -0.05 3.89 2.56 -1.26 -0.69 118.70 127.15 2k6z s GLU 52 Ca -0.08 1.36 -0.02 0.00 0.00 0.00 0.00 54.97 56.24 2k6z s GLU 52 Cb -0.05 -3.13 0.03 0.00 2.00 0.00 0.00 34.13 32.98 2k6z s GLU 52 CO 0.00 0.46 0.04 0.08 -0.56 0.00 0.00 175.26 175.28 2k6z s VAL 53 N -1.31 0.07 -1.17 3.70 1.01 0.59 -4.81 120.40 118.47 2k6z s VAL 53 Ca 0.43 0.30 0.00 0.00 0.00 0.00 0.00 61.98 62.71 2k6z s VAL 53 Cb -0.23 -0.28 0.00 0.00 0.00 0.00 0.00 36.38 35.87 2k6z s VAL 53 CO 0.28 0.20 0.00 -0.62 0.00 0.00 0.00 175.10 174.96 2k6z n GLU 54 N 5.12 -1.48 -0.77 2.72 1.02 -1.26 -1.13 120.64 124.86 2k6z n GLU 54 Ca -0.07 0.87 0.00 0.00 -0.02 0.00 0.00 57.16 57.93 2k6z n GLU 54 Cb 0.50 -5.16 0.00 0.00 -0.02 0.00 0.00 31.44 26.76 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 -0.21 0.56 3.10 0.62 0.00 -1.26 -5.06 105.19 102.93 2k6z n GLY 55 Ca -0.11 -0.54 -0.32 0.00 0.00 0.00 0.00 46.02 45.05 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 -1.06 2.79 0.29 1.61 1.02 -0.28 -5.08 119.74 119.02 2k6z s LYS 56 Ca 0.00 -0.75 -0.29 0.00 0.02 0.00 0.00 55.97 54.94 2k6z s LYS 56 Cb 0.00 -2.40 -0.10 0.00 -0.52 0.00 0.00 37.83 34.81 2k6z s LYS 56 CO 0.00 -0.18 1.17 -1.59 -0.92 0.00 0.00 175.35 173.84 2k6z s LYS 57 N 1.24 4.54 0.26 1.68 -2.85 -1.26 -0.30 119.74 123.05 2k6z s LYS 57 Ca 0.02 1.94 -0.16 0.00 -1.00 0.00 0.00 55.97 56.77 2k6z s LYS 57 Cb -0.13 -3.16 0.01 0.00 -2.06 0.00 0.00 37.83 32.49 2k6z s LYS 57 CO -0.10 0.07 0.58 0.54 0.10 0.00 0.00 175.35 176.53 2k6z s VAL 58 N -1.08 0.00 0.46 1.79 0.11 0.13 -4.94 120.40 116.88 2k6z s VAL 58 Ca 0.46 -1.21 0.08 0.00 -2.93 0.00 0.00 61.98 58.39 2k6z s VAL 58 Cb -0.34 -2.09 0.03 0.00 -1.53 0.00 0.00 36.38 32.44 2k6z s VAL 58 CO 0.44 -0.01 0.62 -0.04 -3.33 0.00 0.00 175.10 172.78 2k6z s MET 59 N -3.97 2.69 0.30 1.54 -1.94 -1.26 -0.89 119.30 115.77 2k6z s MET 59 Ca 0.17 -1.35 -0.11 0.00 -1.71 0.00 0.00 55.69 52.69 2k6z s MET 59 Cb -0.03 -2.72 0.01 0.00 2.01 0.00 0.00 34.83 34.10 2k6z s MET 59 CO 0.08 -0.41 0.54 0.20 -0.01 0.00 0.00 175.02 175.42 2k6z s GLY 60 N -4.42 0.76 0.06 -0.03 0.00 -0.23 -4.82 107.32 98.64 2k6z s GLY 60 Ca 0.56 -1.02 0.02 0.00 0.00 0.00 0.00 44.72 44.28 2k6z s GLY 60 CO 0.34 -0.66 -0.07 -0.29 0.00 0.00 0.00 173.10 172.43 2k6z s MET 61 N -3.43 0.61 0.08 2.90 1.75 -1.26 -0.72 119.30 119.23 2k6z s MET 61 Ca 0.23 -0.96 -0.25 0.00 -1.25 0.00 0.00 55.69 53.46 2k6z s MET 61 Cb -0.02 -0.21 0.07 0.00 2.84 0.00 0.00 34.83 37.51 2k6z s MET 61 CO 0.13 0.01 0.60 -0.98 -0.65 0.00 0.00 175.02 174.13 2k6z s ARG 62 N -2.42 1.16 0.63 4.11 1.70 -1.14 -5.00 118.95 118.00 2k6z s ARG 62 Ca -0.03 -0.22 -0.15 0.00 -0.47 0.00 0.00 55.73 54.87 2k6z s ARG 62 Cb -0.04 0.54 -0.02 0.00 -0.57 0.00 0.00 34.95 34.86 2k6z s ARG 62 CO -0.02 -0.45 1.07 -1.25 -1.08 0.00 0.00 175.30 173.57 2k6z s PRO 63 N -2.75 3.10 0.05 3.89 0.04 -1.26 -0.60 135.00 137.47 2k6z s PRO 63 Ca -0.04 1.23 -0.02 0.00 0.04 0.00 0.00 61.00 62.21 2k6z s PRO 63 Cb -0.01 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.50 2k6z s PRO 63 CO -0.04 -0.99 0.00 0.14 0.04 0.00 0.00 177.00 176.16 2k6z s VAL 64 N -2.50 0.20 -0.05 -0.36 -7.23 -0.01 -4.78 120.40 105.67 2k6z s VAL 64 Ca 0.64 -1.67 0.12 0.00 -1.81 0.00 0.00 61.98 59.26 2k6z s VAL 64 Cb -0.17 -1.43 -0.08 0.00 0.56 0.00 0.00 36.38 35.26 2k6z s VAL 64 CO 0.41 -0.92 1.25 1.55 -0.31 0.00 0.00 175.10 177.07 2k6z h PRO 65 N 3.16 0.00 -1.24 4.82 0.13 -1.94 -3.44 132.00 133.49 2k6z h PRO 65 Ca -0.34 0.00 0.33 0.00 -0.87 0.00 0.00 66.00 65.12 2k6z h PRO 65 Cb 1.15 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.12 2k6z h PRO 65 CO 0.63 0.63 0.91 -0.59 -0.23 0.00 0.00 178.00 179.35 2k6z s PHE 66 N -2.85 -0.04 0.26 1.56 -0.12 -1.26 -4.72 117.98 110.81 2k6z s PHE 66 Ca 0.01 0.00 0.08 0.00 -0.05 0.00 0.00 56.93 56.98 2k6z s PHE 66 Cb 0.09 0.52 -0.04 0.00 -0.63 0.00 0.00 43.02 42.95 2k6z s PHE 66 CO 0.79 -0.12 0.14 -0.51 -0.05 0.00 0.00 175.22 175.46 2k6z s LEU 67 N -2.52 3.63 -0.02 -1.99 1.43 0.17 -4.97 118.68 114.41 2k6z s LEU 67 Ca 0.13 -0.38 -0.08 0.00 -1.03 0.00 0.00 54.13 52.77 2k6z s LEU 67 Cb 0.03 -2.16 0.01 0.00 0.03 0.00 0.00 46.19 44.10 2k6z s LEU 67 CO -0.04 -0.04 0.16 -0.70 0.23 0.00 0.00 176.35 175.96 2k6z s GLU 68 N -3.80 0.43 -0.06 1.70 2.12 -1.26 0.01 118.70 117.84 2k6z s GLU 68 Ca 0.33 -0.23 -0.03 0.00 0.36 0.00 0.00 54.97 55.40 2k6z s GLU 68 Cb -0.07 0.19 0.04 0.00 0.26 0.00 0.00 34.13 34.54 2k6z s GLU 68 CO 0.24 -0.10 0.14 0.08 -0.54 0.00 0.00 175.26 175.07 2k6z s VAL 69 N -1.03 -0.05 0.78 3.70 1.01 0.31 -4.99 120.40 120.13 2k6z s VAL 69 Ca -0.11 0.17 -0.11 0.00 0.00 0.00 0.00 61.98 61.92 2k6z s VAL 69 Cb -0.06 -0.22 0.06 0.00 0.00 0.00 0.00 36.38 36.16 2k6z s VAL 69 CO 0.01 0.07 1.08 -2.16 0.00 0.00 0.00 175.10 174.11 2k6z s PRO 70 N 1.06 2.20 0.30 2.72 0.04 -1.26 -1.32 135.00 138.73 2k6z s PRO 70 Ca -0.08 0.92 -0.30 0.00 0.04 0.00 0.00 61.00 61.57 2k6z s PRO 70 Cb -0.11 -1.91 -0.12 0.00 0.04 0.00 0.00 34.50 32.41 2k6z s PRO 70 CO -0.05 -1.61 1.58 -0.35 0.04 0.00 0.00 177.00 176.61 2k6z n PRO 71 N -3.47 2.68 -0.31 0.56 -0.04 -1.26 -2.48 135.00 130.69 2k6z n PRO 71 Ca 0.08 0.95 0.00 0.00 -0.04 0.00 0.00 63.50 64.49 2k6z n PRO 71 Cb 0.54 -2.73 0.00 0.00 -0.04 0.00 0.00 33.50 31.28 2k6z n PRO 71 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2k6z n LYS 72 N 2.02 0.00 -1.88 0.54 4.01 -0.48 -4.98 118.16 117.39 2k6z n LYS 72 Ca 0.08 0.00 -0.29 0.00 -0.51 0.00 0.00 58.31 57.59 2k6z n LYS 72 Cb 0.37 -3.49 0.07 0.00 -0.51 0.00 0.00 35.03 31.47 2k6z n LYS 72 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 2k6z s GLY 73 N -2.00 1.60 0.02 0.72 0.00 -1.03 -4.82 107.32 101.81 2k6z s GLY 73 Ca 0.00 -0.53 -0.06 0.00 0.00 0.00 0.00 44.72 44.13 2k6z s GLY 73 CO 0.00 -0.08 0.10 1.09 0.00 0.00 0.00 173.10 174.21 2k6z s ARG 74 N -5.49 0.50 0.32 2.90 1.04 -1.26 -1.34 118.95 115.62 2k6z s ARG 74 Ca 0.61 -0.55 0.00 0.00 -1.04 0.00 0.00 55.73 54.74 2k6z s ARG 74 Cb -0.11 0.20 0.00 0.00 -2.04 0.00 0.00 34.95 33.00 2k6z s ARG 74 CO 0.50 -0.12 0.41 0.28 -0.04 0.00 0.00 175.30 176.33 2k6z n VAL 75 N 1.21 0.00 -3.84 4.99 0.31 0.69 -5.00 118.33 116.69 2k6z n VAL 75 Ca -0.22 -1.75 -0.11 0.00 -0.01 0.00 0.00 64.34 62.26 2k6z n VAL 75 Cb 0.56 1.03 -0.08 0.00 -0.91 0.00 0.00 33.84 34.44 2k6z n VAL 75 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2k6z s GLU 76 N -2.83 0.69 0.33 5.55 4.04 -1.26 -1.45 118.70 123.77 2k6z s GLU 76 Ca 0.29 -0.61 0.09 0.00 0.04 0.00 0.00 54.97 54.78 2k6z s GLU 76 Cb -0.00 0.29 0.82 0.00 0.02 0.00 0.00 34.13 35.26 2k6z s GLU 76 CO 0.20 -0.20 1.79 -0.07 -1.84 0.00 0.00 175.26 175.14 2k6z h LEU 77 N 3.49 0.70 0.00 1.83 4.07 -1.57 -3.48 115.31 120.35 2k6z h LEU 77 Ca -0.32 0.09 0.00 0.00 0.08 0.00 0.00 57.88 57.73 2k6z h LEU 77 Cb 1.19 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 42.89 2k6z h LEU 77 CO 0.48 0.25 0.00 1.17 -1.08 0.00 0.00 178.44 179.25 2k6z n LYS 78 N -4.71 0.00 0.20 1.13 4.81 -1.25 -0.84 118.16 117.50 2k6z n LYS 78 Ca 0.23 0.00 0.14 0.00 -0.87 0.00 0.00 58.31 57.81 2k6z n LYS 78 Cb 0.62 0.00 0.69 0.00 0.02 0.00 0.00 35.03 36.35 2k6z n LYS 78 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 2k6z h PRO 79 N 0.00 0.00 -0.13 1.64 0.13 -1.92 0.52 132.00 132.24 2k6z h PRO 79 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2k6z h PRO 79 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2k6z h PRO 79 CO 0.00 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.18 2k6z n GLY 80 N -0.71 1.81 0.00 1.56 0.00 -1.26 -5.02 105.19 101.57 2k6z n GLY 80 Ca -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 0.10 1.73 3.78 -0.02 0.00 0.17 -4.64 105.19 106.32 2k6z n GLY 81 Ca 0.05 -0.08 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 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 2.01 3.00 -0.21 1.61 1.51 -0.02 -1.93 117.35 123.33 2k6z s TYR 82 Ca 0.00 1.58 -0.26 0.00 -1.01 0.00 0.00 57.07 57.38 2k6z s TYR 82 Cb 0.00 -3.19 0.07 0.00 -0.11 0.00 0.00 41.96 38.73 2k6z s TYR 82 CO 0.00 -1.03 0.70 -3.38 -1.11 0.00 0.00 175.55 170.73 2k6z s HIS 83 N -1.75 -0.75 -0.45 2.71 -3.43 0.14 -3.78 115.29 107.99 2k6z s HIS 83 Ca 0.64 1.71 -0.29 0.00 -0.80 0.00 0.00 55.06 56.32 2k6z s HIS 83 Cb -0.22 0.30 0.03 0.00 -1.43 0.00 0.00 32.58 31.26 2k6z s HIS 83 CO 0.27 -0.43 1.13 -0.06 -2.00 0.00 0.00 174.74 173.65 2k6z s PHE 84 N -0.00 2.87 -0.17 0.38 0.08 -0.62 -1.56 117.98 118.95 2k6z s PHE 84 Ca -0.03 0.80 -0.29 0.00 0.12 0.00 0.00 56.93 57.53 2k6z s PHE 84 Cb -0.04 -4.30 -0.01 0.00 -0.57 0.00 0.00 43.02 38.10 2k6z s PHE 84 CO 0.03 -1.20 1.17 1.41 -0.10 0.00 0.00 175.22 176.53 2k6z s MET 85 N 4.32 4.26 -0.21 0.44 -2.45 0.50 -0.91 119.30 125.26 2k6z s MET 85 Ca 0.48 1.55 -0.05 0.00 -1.25 0.00 0.00 55.69 56.42 2k6z s MET 85 Cb -0.08 -3.69 -0.02 0.00 1.25 0.00 0.00 34.83 32.29 2k6z s MET 85 CO 0.29 -0.63 -0.01 -0.51 1.05 0.00 0.00 175.02 175.21 2k6z s LEU 86 N 3.18 3.12 0.03 4.11 1.43 0.03 -1.01 118.68 129.57 2k6z s LEU 86 Ca 0.51 -0.28 0.08 0.00 -1.03 0.00 0.00 54.13 53.40 2k6z s LEU 86 Cb -0.20 -1.80 -0.03 0.00 0.03 0.00 0.00 46.19 44.20 2k6z s LEU 86 CO 0.13 0.02 -0.22 -0.76 0.23 0.00 0.00 176.35 175.75 2k6z s LEU 87 N 1.27 2.38 0.00 1.79 2.01 -0.34 -0.83 118.68 124.96 2k6z s LEU 87 Ca 0.04 -0.48 0.00 0.00 0.01 0.00 0.00 54.13 53.70 2k6z s LEU 87 Cb -0.15 -1.41 0.00 0.00 0.01 0.00 0.00 46.19 44.65 2k6z s LEU 87 CO 0.00 0.27 0.00 0.61 1.01 0.00 0.00 176.35 178.24 2k6z n GLY 88 N 1.81 1.29 1.32 -3.19 0.00 0.06 -1.84 105.19 104.64 2k6z n GLY 88 Ca -0.17 -0.06 0.16 0.00 0.00 0.00 0.00 46.02 45.96 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 0.00 -0.78 0.00 0.99 4.77 -1.25 -4.83 117.00 115.90 2k6z n LEU 89 Ca 0.00 1.79 0.00 0.00 -0.03 0.00 0.00 56.01 57.77 2k6z n LEU 89 Cb 0.00 -4.04 0.00 0.00 -2.33 0.00 0.00 43.42 37.05 2k6z n LEU 89 CO 0.00 -2.47 -0.40 0.29 -1.33 0.00 0.00 177.39 173.47 2k6z n LYS 90 N -4.01 2.94 -4.75 3.23 4.76 -0.26 -4.56 118.16 115.50 2k6z n LYS 90 Ca -0.04 0.00 -0.24 0.00 -2.87 0.00 0.00 58.31 55.16 2k6z n LYS 90 Cb 0.65 -0.90 -0.15 0.00 -1.84 0.00 0.00 35.03 32.79 2k6z n LYS 90 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2k6z s ARG 91 N -1.80 1.30 -1.21 1.97 1.70 -1.26 -5.07 118.95 114.57 2k6z s ARG 91 Ca 0.00 -0.58 -0.05 0.00 -0.47 0.00 0.00 55.73 54.63 2k6z s ARG 91 Cb 0.00 -1.26 0.15 0.00 -0.57 0.00 0.00 34.95 33.27 2k6z s ARG 91 CO 0.00 0.34 2.33 -0.35 -1.08 0.00 0.00 175.30 176.54 2k6z n PRO 92 N 2.65 4.56 -0.92 3.89 -0.04 -1.26 -4.96 135.00 138.92 2k6z n PRO 92 Ca -0.15 -3.56 -0.36 0.00 -0.04 0.00 0.00 63.50 59.39 2k6z n PRO 92 Cb 0.54 -2.57 -0.09 0.00 -0.04 0.00 0.00 33.50 31.35 2k6z n PRO 92 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2k6z n LEU 93 N 1.37 0.39 -4.99 1.53 7.99 -1.26 -4.74 117.00 117.30 2k6z n LEU 93 Ca 0.59 0.34 -0.18 0.00 -0.01 0.00 0.00 56.01 56.75 2k6z n LEU 93 Cb 0.27 -0.62 0.00 0.00 -0.11 0.00 0.00 43.42 42.96 2k6z n LEU 93 CO 0.63 -0.52 0.10 -0.54 -1.51 0.00 0.00 177.39 175.56 2k6z s LYS 94 N 4.90 2.87 0.21 3.23 -0.14 -1.26 -1.95 119.74 127.60 2k6z s LYS 94 Ca 0.87 -1.22 -0.30 0.00 -1.36 0.00 0.00 55.97 53.96 2k6z s LYS 94 Cb -0.97 -2.72 -0.09 0.00 -1.68 0.00 0.00 37.83 32.37 2k6z s LYS 94 CO 0.41 -0.17 1.38 0.00 -0.76 0.00 0.00 175.35 176.21 2k6z s ALA 95 N -2.32 3.58 0.00 5.17 0.00 -1.26 -2.89 121.76 124.04 2k6z s ALA 95 Ca 0.51 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.68 2k6z s ALA 95 Cb -0.09 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.51 2k6z s ALA 95 CO 0.32 -0.63 0.00 0.41 0.00 0.00 0.00 175.76 175.86 2k6z n GLY 96 N 2.42 0.34 2.02 0.00 0.00 -0.24 -5.00 105.19 104.73 2k6z n GLY 96 Ca 0.07 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.73 -0.49 -3.74 1.61 1.02 -1.14 -4.88 120.64 111.29 2k6z n GLU 97 Ca 0.00 -1.15 -0.13 0.00 -0.02 0.00 0.00 57.16 55.86 2k6z n GLU 97 Cb 0.00 -0.64 -0.10 0.00 -0.02 0.00 0.00 31.44 30.68 2k6z n GLU 97 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2k6z s GLU 98 N -4.37 0.50 -0.07 3.49 1.03 -1.26 -0.17 118.70 117.85 2k6z s GLU 98 Ca 0.38 0.40 -0.03 0.00 0.03 0.00 0.00 54.97 55.75 2k6z s GLU 98 Cb -0.01 0.24 0.04 0.00 -0.80 0.00 0.00 34.13 33.60 2k6z s GLU 98 CO 0.27 -0.08 0.13 0.08 -1.33 0.00 0.00 175.26 174.33 2k6z s VAL 99 N -0.10 -0.15 -0.19 1.83 1.01 0.91 -4.92 120.40 118.79 2k6z s VAL 99 Ca -0.03 0.29 -0.11 0.00 0.00 0.00 0.00 61.98 62.13 2k6z s VAL 99 Cb -0.03 -0.24 -0.05 0.00 0.00 0.00 0.00 36.38 36.06 2k6z s VAL 99 CO 0.01 0.12 0.19 -1.83 0.00 0.00 0.00 175.10 173.60 2k6z s GLU 100 N 1.78 4.20 -0.04 2.72 -1.05 -1.26 -0.35 118.70 124.70 2k6z s GLU 100 Ca -0.02 -0.11 0.07 0.00 -0.15 0.00 0.00 54.97 54.75 2k6z s GLU 100 Cb -0.12 -3.43 -0.02 0.00 -0.44 0.00 0.00 34.13 30.12 2k6z s GLU 100 CO -0.05 0.25 -0.24 -0.51 0.95 0.00 0.00 175.26 175.66 2k6z s LEU 101 N 0.47 2.16 -0.23 1.83 2.01 -0.02 -4.28 118.68 120.62 2k6z s LEU 101 Ca 0.11 -0.45 -0.13 0.00 0.01 0.00 0.00 54.13 53.68 2k6z s LEU 101 Cb -0.12 -1.39 -0.05 0.00 0.01 0.00 0.00 46.19 44.65 2k6z s LEU 101 CO 0.01 0.29 0.25 -1.81 1.01 0.00 0.00 176.35 176.10 2k6z s ASP 102 N -0.42 6.22 -0.34 2.29 1.01 0.49 -0.36 116.67 125.54 2k6z s ASP 102 Ca 0.04 0.24 -0.17 0.00 0.71 0.00 0.00 52.55 53.37 2k6z s ASP 102 Cb -0.12 -2.15 -0.01 0.00 1.01 0.00 0.00 42.92 41.65 2k6z s ASP 102 CO 0.01 -0.01 0.49 -0.76 0.21 0.00 0.00 175.17 175.11 2k6z s LEU 103 N 1.29 4.32 -0.63 1.23 1.02 0.20 -1.67 118.68 124.44 2k6z s LEU 103 Ca 0.12 0.01 -0.23 0.00 0.02 0.00 0.00 54.13 54.04 2k6z s LEU 103 Cb -0.14 -2.55 0.06 0.00 0.02 0.00 0.00 46.19 43.58 2k6z s LEU 103 CO 0.07 -0.43 0.95 -0.76 0.02 0.00 0.00 176.35 176.19 2k6z s LEU 104 N 2.32 4.33 -0.06 1.79 1.43 -0.43 -3.09 118.68 124.98 2k6z s LEU 104 Ca 0.18 -0.84 -0.14 0.00 -1.03 0.00 0.00 54.13 52.29 2k6z s LEU 104 Cb -0.16 -2.51 -0.05 0.00 0.03 0.00 0.00 46.19 43.50 2k6z s LEU 104 CO 0.13 -1.38 0.37 -0.36 0.23 0.00 0.00 176.35 175.34 2k6z s PHE 105 N 4.00 3.64 -0.03 0.29 0.08 -0.31 -0.45 117.98 125.19 2k6z s PHE 105 Ca 0.24 0.86 -0.37 0.00 0.12 0.00 0.00 56.93 57.78 2k6z s PHE 105 Cb -0.16 -2.30 -0.15 0.00 -0.57 0.00 0.00 43.02 39.84 2k6z s PHE 105 CO 0.12 0.52 1.56 0.00 -0.10 0.00 0.00 175.22 177.32 2k6z n ALA 106 N 2.39 -0.18 -1.76 5.36 0.00 -0.06 -3.01 120.51 123.26 2k6z n ALA 106 Ca -0.13 0.44 -0.00 0.00 0.00 0.00 0.00 53.44 53.75 2k6z n ALA 106 Cb 0.52 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.76 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 3.37 -0.47 2.87 0.00 0.00 -1.26 -4.51 105.19 105.19 2k6z n GLY 107 Ca 0.21 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 -1.09 0.38 3.69 -0.02 0.00 -1.25 -4.98 105.19 101.91 2k6z n GLY 108 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.74 4.15 0.00 1.61 1.02 -1.16 -5.05 119.74 119.56 2k6z s LYS 109 Ca 0.00 -0.13 -0.00 0.00 0.02 0.00 0.00 55.97 55.86 2k6z s LYS 109 Cb 0.00 -3.49 -0.00 0.00 -0.52 0.00 0.00 37.83 33.81 2k6z s LYS 109 CO 0.00 0.13 -0.00 0.08 -0.92 0.00 0.00 175.35 174.64 2k6z s VAL 110 N 0.83 0.03 -0.17 3.17 1.01 -1.26 -1.16 120.40 122.85 2k6z s VAL 110 Ca 0.11 -0.26 -0.13 0.00 0.00 0.00 0.00 61.98 61.69 2k6z s VAL 110 Cb -0.13 -0.09 0.05 0.00 0.00 0.00 0.00 36.38 36.21 2k6z s VAL 110 CO 0.03 -0.14 0.45 -0.22 0.00 0.00 0.00 175.10 175.22 2k6z s LEU 111 N -0.42 0.09 -0.10 3.92 0.20 -1.18 -5.00 118.68 116.19 2k6z s LEU 111 Ca -0.05 0.93 -0.05 0.00 0.69 0.00 0.00 54.13 55.65 2k6z s LEU 111 Cb -0.03 1.51 -0.04 0.00 -0.43 0.00 0.00 46.19 47.21 2k6z s LEU 111 CO -0.00 -0.17 0.10 -0.75 -0.29 0.00 0.00 176.35 175.23 2k6z s LYS 112 N 0.72 3.30 0.23 1.98 2.20 -1.26 -0.63 119.74 126.27 2k6z s LYS 112 Ca -0.04 -0.23 0.06 0.00 -0.36 0.00 0.00 55.97 55.40 2k6z s LYS 112 Cb -0.05 -3.06 -0.05 0.00 -1.51 0.00 0.00 37.83 33.16 2k6z s LYS 112 CO -0.05 0.75 -0.08 0.08 -0.36 0.00 0.00 175.35 175.69 2k6z s VAL 113 N -1.01 1.49 0.00 4.02 1.01 0.51 -4.99 120.40 121.43 2k6z s VAL 113 Ca 0.15 -2.13 0.05 0.00 0.00 0.00 0.00 61.98 60.05 2k6z s VAL 113 Cb -0.12 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.03 2k6z s VAL 113 CO 0.04 -0.46 -0.15 -0.69 0.00 0.00 0.00 175.10 173.84 2k6z s VAL 114 N -3.12 1.22 -0.05 2.92 1.01 -1.26 -0.84 120.40 120.28 2k6z s VAL 114 Ca 0.25 -0.74 -0.00 0.00 0.00 0.00 0.00 61.98 61.49 2k6z s VAL 114 Cb 0.02 -1.03 0.03 0.00 0.00 0.00 0.00 36.38 35.40 2k6z s VAL 114 CO 0.08 0.28 -0.00 -0.76 0.00 0.00 0.00 175.10 174.70 2k6z s LEU 115 N -0.54 0.85 0.50 3.92 1.43 0.52 -4.49 118.68 120.87 2k6z s LEU 115 Ca 0.05 -0.06 -0.20 0.00 -1.03 0.00 0.00 54.13 52.89 2k6z s LEU 115 Cb -0.06 -0.34 -0.07 0.00 0.03 0.00 0.00 46.19 45.74 2k6z s LEU 115 CO -0.00 -0.15 1.08 -2.16 0.23 0.00 0.00 176.35 175.35 2k6z s PRO 116 N 1.52 3.67 -0.31 1.29 0.04 -1.26 -0.06 135.00 139.89 2k6z s PRO 116 Ca -0.02 1.50 -0.20 0.00 0.04 0.00 0.00 61.00 62.32 2k6z s PRO 116 Cb -0.13 -2.13 -0.01 0.00 0.04 0.00 0.00 34.50 32.27 2k6z s PRO 116 CO -0.03 -0.57 0.60 0.08 0.04 0.00 0.00 177.00 177.13 2k6z s VAL 117 N -1.84 4.96 -0.05 -0.36 1.01 0.76 -0.83 120.40 124.05 2k6z s VAL 117 Ca 0.68 0.80 -0.01 0.00 0.00 0.00 0.00 61.98 63.45 2k6z s VAL 117 Cb -0.21 -3.98 0.03 0.00 0.00 0.00 0.00 36.38 32.23 2k6z s VAL 117 CO 0.24 -0.13 0.02 -1.61 0.00 0.00 0.00 175.10 173.63 2k6z s GLU 118 N 2.55 0.27 -1.29 2.72 2.02 -0.68 -1.08 118.70 123.22 2k6z s GLU 118 Ca 0.24 0.18 -0.09 0.00 0.02 0.00 0.00 54.97 55.32 2k6z s GLU 118 Cb -0.15 -0.64 -0.12 0.00 0.10 0.00 0.00 34.13 33.32 2k6z s GLU 118 CO 0.12 -0.25 3.00 0.00 0.02 0.00 0.00 175.26 178.15 2k6z n ALA 119 N 4.81 7.11 -1.80 5.21 0.00 -1.22 -4.29 120.51 130.35 2k6z n ALA 119 Ca -0.13 -3.10 0.00 0.00 0.00 0.00 0.00 53.44 50.21 2k6z n ALA 119 Cb 0.50 -3.16 0.00 0.00 0.00 0.00 0.00 19.45 16.79 2k6z n ALA 119 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39