#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 0.00 0.03 1.61 3.41 -1.26 -4.77 113.62 112.64 2k6z n SER 2 Ca 0.00 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.74 2k6z n SER 2 Cb 0.00 0.00 0.54 0.00 -0.26 0.00 0.00 64.21 64.49 2k6z n SER 2 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 2k6z n PHE 3 N 0.00 0.28 -2.30 7.33 1.16 -1.26 -4.93 117.46 117.74 2k6z n PHE 3 Ca 0.00 0.09 -0.43 0.00 -1.87 0.00 0.00 57.45 55.24 2k6z n PHE 3 Cb 0.00 -0.64 -0.02 0.00 -1.61 0.00 0.00 39.48 37.21 2k6z n PHE 3 CO 0.00 0.00 0.00 0.95 -1.87 0.00 0.00 176.76 175.84 2k6z s THR 4 N -3.04 3.88 -1.42 1.97 -4.23 -1.26 -4.89 115.64 106.65 2k6z s THR 4 Ca 0.12 0.92 -0.13 0.00 -1.18 0.00 0.00 61.69 61.43 2k6z s THR 4 Cb 0.16 -4.09 -0.03 0.00 1.34 0.00 0.00 72.50 69.88 2k6z s THR 4 CO 0.53 -0.63 2.46 -0.62 -0.54 0.00 0.00 174.62 175.82 2k6z n GLU 5 N 7.95 2.98 -4.24 3.99 1.02 -1.26 -4.86 120.64 126.21 2k6z n GLU 5 Ca 0.17 -2.30 -0.15 0.00 -0.02 0.00 0.00 57.16 54.86 2k6z n GLU 5 Cb 0.47 -3.02 -0.10 0.00 -0.02 0.00 0.00 31.44 28.78 2k6z n GLU 5 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2k6z s GLY 6 N 3.01 1.71 0.36 0.62 0.00 -1.26 -2.90 107.32 108.86 2k6z s GLY 6 Ca 0.56 -1.79 -0.08 0.00 0.00 0.00 0.00 44.72 43.40 2k6z s GLY 6 CO -0.06 -1.45 0.61 -2.67 0.00 0.00 0.00 173.10 169.53 2k6z n TRP 7 N -0.39 -1.86 -4.81 1.90 2.14 0.04 -4.13 117.44 110.33 2k6z n TRP 7 Ca 0.03 -2.03 -0.29 0.00 2.07 0.00 0.00 57.50 57.28 2k6z n TRP 7 Cb 0.65 0.71 -0.14 0.00 -0.81 0.00 0.00 31.31 31.71 2k6z n TRP 7 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 2k6z s VAL 8 N -2.48 2.02 0.21 -1.67 1.01 -0.66 -2.08 120.40 116.75 2k6z s VAL 8 Ca 0.22 -1.36 0.19 0.00 0.00 0.00 0.00 61.98 61.02 2k6z s VAL 8 Cb -0.03 -1.74 0.15 0.00 0.00 0.00 0.00 36.38 34.76 2k6z s VAL 8 CO 0.16 0.31 1.77 -0.09 0.00 0.00 0.00 175.10 177.25 2k6z h ARG 9 N 4.75 0.00 0.00 2.72 9.65 -1.64 -0.26 114.38 129.60 2k6z h ARG 9 Ca -0.46 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.42 2k6z h ARG 9 Cb 1.15 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.73 2k6z h ARG 9 CO 0.43 0.35 0.00 0.34 2.80 0.00 0.00 179.97 183.89 2k6z n PHE 10 N -3.58 0.00 -3.64 2.20 7.35 -1.08 -1.96 117.46 116.75 2k6z n PHE 10 Ca -0.00 0.00 -0.04 0.00 -0.76 0.00 0.00 57.45 56.65 2k6z n PHE 10 Cb 0.48 -0.30 -0.06 0.00 0.35 0.00 0.00 39.48 39.94 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 -1.26 -0.11 0.08 -2.13 0.01 -1.26 -4.67 113.70 104.35 2k6z s SER 11 Ca 0.00 0.18 -0.07 0.00 1.31 0.00 0.00 55.95 57.37 2k6z s SER 11 Cb 0.00 0.17 -0.24 0.00 0.21 0.00 0.00 66.02 66.16 2k6z s SER 11 CO 0.00 -0.07 1.17 1.55 0.41 0.00 0.00 173.24 176.30 2k6z h PRO 12 N 2.77 0.38 0.00 12.44 0.13 -1.91 -3.36 132.00 142.45 2k6z h PRO 12 Ca -0.19 -0.55 0.00 0.00 -0.87 0.00 0.00 66.00 64.39 2k6z h PRO 12 Cb 1.19 0.19 0.00 0.00 0.13 0.00 0.00 31.00 32.51 2k6z h PRO 12 CO 0.20 1.23 0.00 0.41 -0.23 0.00 0.00 178.00 179.61 2k6z n GLY 13 N 1.36 1.80 0.00 1.56 0.00 -1.26 -4.00 105.19 104.66 2k6z n GLY 13 Ca -0.09 -1.06 0.11 0.00 0.00 0.00 0.00 46.02 44.98 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 -0.85 0.41 -3.70 1.61 -0.04 -1.26 -4.98 135.00 126.20 2k6z n PRO 14 Ca 0.00 0.06 -0.13 0.00 -0.04 0.00 0.00 63.50 63.39 2k6z n PRO 14 Cb 0.00 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 31.89 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 -2.44 -0.25 0.47 3.54 6.03 -1.26 -1.32 114.94 119.71 2k6z s ASN 15 Ca 0.24 0.00 0.00 0.00 -1.03 0.00 0.00 52.86 52.08 2k6z s ASN 15 Cb 0.15 0.39 -0.00 0.00 -3.03 0.00 0.00 41.25 38.77 2k6z s ASN 15 CO 0.32 -0.61 0.01 0.00 -2.03 0.00 0.00 177.10 174.79 2k6z n ALA 16 N 0.67 0.42 -2.66 3.54 0.00 -0.38 -4.75 120.51 117.35 2k6z n ALA 16 Ca -0.19 -2.12 -0.19 0.00 0.00 0.00 0.00 53.44 50.93 2k6z n ALA 16 Cb 0.59 1.18 -0.15 0.00 0.00 0.00 0.00 19.45 21.07 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 -2.84 0.85 0.02 0.00 0.00 -1.26 -0.87 121.76 117.66 2k6z s ALA 17 Ca 0.02 -0.47 0.08 0.00 0.00 0.00 0.00 51.96 51.58 2k6z s ALA 17 Cb 0.00 -0.20 -0.03 0.00 0.00 0.00 0.00 23.12 22.89 2k6z s ALA 17 CO 0.01 0.20 -0.22 0.00 0.00 0.00 0.00 175.76 175.75 2k6z s ALA 18 N -0.32 2.38 -0.25 0.00 0.00 0.30 -2.42 121.76 121.45 2k6z s ALA 18 Ca 0.03 -1.18 -0.01 0.00 0.00 0.00 0.00 51.96 50.80 2k6z s ALA 18 Cb -0.04 -0.63 0.08 0.00 0.00 0.00 0.00 23.12 22.52 2k6z s ALA 18 CO -0.00 0.55 0.04 0.71 0.00 0.00 0.00 175.76 177.06 2k6z s TYR 19 N -0.79 1.69 0.11 0.00 1.51 -0.88 -1.64 117.35 117.34 2k6z s TYR 19 Ca 0.12 -1.48 -0.06 0.00 -1.01 0.00 0.00 57.07 54.65 2k6z s TYR 19 Cb -0.10 -1.48 -0.02 0.00 -0.11 0.00 0.00 41.96 40.25 2k6z s TYR 19 CO 0.02 -0.77 0.15 -0.48 -1.11 0.00 0.00 175.55 173.36 2k6z s LEU 20 N 1.63 1.57 0.54 -1.29 2.34 -1.25 -0.78 118.68 121.43 2k6z s LEU 20 Ca 0.03 -0.87 -0.15 0.00 0.06 0.00 0.00 54.13 53.19 2k6z s LEU 20 Cb -0.18 0.79 -0.07 0.00 -0.56 0.00 0.00 46.19 46.17 2k6z s LEU 20 CO -0.15 -0.75 1.00 -0.89 -1.06 0.00 0.00 176.35 174.50 2k6z s THR 21 N -3.93 4.55 -0.14 5.48 2.01 -1.14 -0.57 115.64 121.89 2k6z s THR 21 Ca 0.12 1.14 -0.01 0.00 0.31 0.00 0.00 61.69 63.25 2k6z s THR 21 Cb 0.05 -3.74 0.04 0.00 0.01 0.00 0.00 72.50 68.86 2k6z s THR 21 CO -0.06 -0.78 -0.05 -0.22 -0.69 0.00 0.00 174.62 172.82 2k6z s LEU 22 N -4.31 1.35 -0.16 4.42 1.98 0.08 -4.85 118.68 117.20 2k6z s LEU 22 Ca 0.58 -0.51 -0.08 0.00 -2.89 0.00 0.00 54.13 51.23 2k6z s LEU 22 Cb -0.10 -0.82 -0.04 0.00 0.66 0.00 0.00 46.19 45.88 2k6z s LEU 22 CO 0.36 -0.17 0.11 -1.61 -1.89 0.00 0.00 176.35 173.15 2k6z s GLU 23 N 1.70 3.82 -0.89 1.98 8.01 -1.26 -0.90 118.70 131.16 2k6z s GLU 23 Ca 0.02 -0.23 -0.01 0.00 0.01 0.00 0.00 54.97 54.76 2k6z s GLU 23 Cb -0.14 -3.26 0.24 0.00 -4.31 0.00 0.00 34.13 26.66 2k6z s GLU 23 CO -0.08 0.47 0.90 -1.71 0.01 0.00 0.00 175.26 174.86 2k6z n ASN 24 N 2.94 4.53 0.27 -0.19 4.05 -0.49 -4.92 115.26 121.45 2k6z n ASN 24 Ca -0.18 -3.23 0.17 0.00 0.45 0.00 0.00 54.58 51.80 2k6z n ASN 24 Cb 0.53 -1.03 0.74 0.00 1.23 0.00 0.00 39.78 41.25 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 5.59 0.00 -7.73 1.20 0.13 -1.92 0.61 132.00 129.88 2k6z h PRO 25 Ca 0.18 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.86 2k6z h PRO 25 Cb 0.75 0.00 0.16 0.00 0.13 0.00 0.00 31.00 32.04 2k6z h PRO 25 CO 0.94 0.00 0.38 0.20 -0.23 0.00 0.00 178.00 179.29 2k6z s GLY 26 N -4.09 1.72 0.00 1.56 0.00 -1.26 -4.72 107.32 100.53 2k6z s GLY 26 Ca 0.01 -1.07 0.22 0.00 0.00 0.00 0.00 44.72 43.88 2k6z s GLY 26 CO 0.50 -0.33 1.12 1.22 0.00 0.00 0.00 173.10 175.61 2k6z n ASP 27 N -3.84 2.28 -4.36 1.64 9.92 -1.26 -2.96 116.55 117.97 2k6z n ASP 27 Ca 0.14 -1.64 -0.19 0.00 -0.53 0.00 0.00 54.79 52.56 2k6z n ASP 27 Cb 0.60 0.34 -0.10 0.00 -0.64 0.00 0.00 41.12 41.31 2k6z n ASP 27 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2k6z s LEU 28 N -2.29 2.55 0.20 0.64 1.02 -1.26 -4.81 118.68 114.73 2k6z s LEU 28 Ca 0.21 -1.03 -0.28 0.00 0.02 0.00 0.00 54.13 53.04 2k6z s LEU 28 Cb 0.18 -0.70 -0.08 0.00 0.02 0.00 0.00 46.19 45.61 2k6z s LEU 28 CO 0.48 -0.17 0.88 -2.16 0.02 0.00 0.00 176.35 175.40 2k6z s PRO 29 N -3.64 4.74 0.18 1.29 0.04 -1.26 -4.42 135.00 131.93 2k6z s PRO 29 Ca 0.24 1.36 -0.13 0.00 0.04 0.00 0.00 61.00 62.51 2k6z s PRO 29 Cb -0.01 -3.28 -0.07 0.00 0.04 0.00 0.00 34.50 31.18 2k6z s PRO 29 CO 0.08 0.51 0.56 -0.51 0.04 0.00 0.00 177.00 177.68 2k6z s LEU 30 N -1.06 4.27 -0.27 -3.56 1.02 -1.02 -4.97 118.68 113.08 2k6z s LEU 30 Ca 0.39 1.04 -0.02 0.00 0.02 0.00 0.00 54.13 55.56 2k6z s LEU 30 Cb -0.25 -3.45 0.09 0.00 0.02 0.00 0.00 46.19 42.60 2k6z s LEU 30 CO 0.30 0.03 0.09 -0.60 0.02 0.00 0.00 176.35 176.18 2k6z s ARG 31 N -2.30 0.57 -0.61 1.70 3.52 -1.26 -0.47 118.95 120.10 2k6z s ARG 31 Ca 0.42 -0.77 -0.25 0.00 -0.13 0.00 0.00 55.73 55.00 2k6z s ARG 31 Cb -0.13 -1.83 0.04 0.00 -1.56 0.00 0.00 34.95 31.47 2k6z s ARG 31 CO 0.20 -0.90 1.06 -1.17 -0.81 0.00 0.00 175.30 173.68 2k6z s LEU 32 N 1.80 3.83 -0.05 -0.88 2.96 0.70 -0.20 118.68 126.84 2k6z s LEU 32 Ca 0.07 -0.37 0.20 0.00 -0.22 0.00 0.00 54.13 53.80 2k6z s LEU 32 Cb -0.17 -2.79 -0.25 0.00 0.50 0.00 0.00 46.19 43.48 2k6z s LEU 32 CO -0.23 -1.43 0.45 1.33 -1.32 0.00 0.00 176.35 175.15 2k6z n VAL 33 N 6.29 0.74 -3.37 1.68 0.24 0.27 -0.73 118.33 123.45 2k6z n VAL 33 Ca 0.03 -0.66 -0.04 0.00 -2.04 0.00 0.00 64.34 61.62 2k6z n VAL 33 Cb 0.48 -0.32 0.01 0.00 -1.47 0.00 0.00 33.84 32.53 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 1.44 1.58 2.26 7.63 0.00 -1.14 -4.66 105.19 112.30 2k6z n GLY 34 Ca -0.14 -1.13 -0.12 0.00 0.00 0.00 0.00 46.02 44.62 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 -1.91 0.27 -3.38 4.61 0.00 -1.26 -1.07 120.51 117.77 2k6z n ALA 35 Ca -0.07 -1.28 -0.09 0.00 0.00 0.00 0.00 53.44 51.99 2k6z n ALA 35 Cb 0.27 1.04 -0.04 0.00 0.00 0.00 0.00 19.45 20.72 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 -2.82 1.47 0.00 0.00 0.52 0.50 -4.83 118.95 113.80 2k6z s ARG 36 Ca 0.25 -0.94 0.00 0.00 -0.52 0.00 0.00 55.73 54.52 2k6z s ARG 36 Cb 0.01 0.53 0.00 0.00 0.52 0.00 0.00 34.95 36.01 2k6z s ARG 36 CO 0.18 -0.63 0.00 -2.37 0.02 0.00 0.00 175.30 172.50 2k6z n THR 37 N -0.37 0.00 0.14 0.02 5.66 -1.26 -0.56 114.28 117.91 2k6z n THR 37 Ca -0.08 0.00 0.01 0.00 -3.05 0.00 0.00 64.05 60.93 2k6z n THR 37 Cb 0.62 0.00 0.16 0.00 -1.55 0.00 0.00 70.33 69.56 2k6z n THR 37 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 2k6z h PRO 38 N 0.00 0.00 -0.78 1.09 0.13 -2.01 -3.35 132.00 127.08 2k6z h PRO 38 Ca 0.00 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.04 2k6z h PRO 38 Cb 0.00 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.08 2k6z h PRO 38 CO 0.00 0.57 0.11 1.33 -0.23 0.00 0.00 178.00 179.78 2k6z n VAL 39 N -3.53 2.06 -4.15 1.56 0.24 -1.26 -4.76 118.33 108.49 2k6z n VAL 39 Ca -0.00 -1.05 -0.10 0.00 -2.04 0.00 0.00 64.34 61.15 2k6z n VAL 39 Cb 0.65 -0.42 -0.10 0.00 -1.47 0.00 0.00 33.84 32.50 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 -2.23 0.85 -0.09 2.33 0.00 -1.26 -1.80 121.76 119.56 2k6z s ALA 40 Ca 0.38 -1.38 -0.14 0.00 0.00 0.00 0.00 51.96 50.82 2k6z s ALA 40 Cb 0.30 0.45 -0.12 0.00 0.00 0.00 0.00 23.12 23.75 2k6z s ALA 40 CO 0.10 -0.36 0.49 1.49 0.00 0.00 0.00 175.76 177.48 2k6z h GLU 41 N 2.96 -0.11 -4.97 0.00 4.22 -0.07 -3.46 114.58 113.15 2k6z h GLU 41 Ca -0.35 0.01 -0.51 0.00 0.08 0.00 0.00 59.36 58.59 2k6z h GLU 41 Cb 1.17 0.02 -0.13 0.00 0.50 0.00 0.00 28.75 30.31 2k6z h GLU 41 CO 0.63 0.28 -0.52 -0.98 -2.18 0.00 0.00 179.01 176.24 2k6z s ARG 42 N -2.39 1.82 -0.07 1.92 1.70 -1.03 -5.02 118.95 115.88 2k6z s ARG 42 Ca -0.09 -2.08 -0.20 0.00 -0.47 0.00 0.00 55.73 52.89 2k6z s ARG 42 Cb -0.01 -0.26 0.04 0.00 -0.57 0.00 0.00 34.95 34.15 2k6z s ARG 42 CO 0.32 -0.52 0.45 0.54 -1.08 0.00 0.00 175.30 175.02 2k6z s VAL 43 N -3.35 0.03 0.04 4.99 0.11 -1.26 -1.12 120.40 119.84 2k6z s VAL 43 Ca 0.30 -0.22 0.04 0.00 -2.93 0.00 0.00 61.98 59.17 2k6z s VAL 43 Cb 0.03 -0.73 -0.02 0.00 -1.53 0.00 0.00 36.38 34.13 2k6z s VAL 43 CO 0.19 -0.12 -0.11 -1.61 -3.33 0.00 0.00 175.10 170.12 2k6z s GLU 44 N -0.84 0.69 -0.26 1.54 2.02 -0.01 -4.85 118.70 116.99 2k6z s GLU 44 Ca -0.09 -0.74 -0.14 0.00 0.02 0.00 0.00 54.97 54.02 2k6z s GLU 44 Cb -0.03 -0.60 -0.04 0.00 0.10 0.00 0.00 34.13 33.55 2k6z s GLU 44 CO 0.05 0.14 0.32 -1.17 0.02 0.00 0.00 175.26 174.62 2k6z s LEU 45 N -1.34 4.05 0.22 1.80 2.96 -1.26 -0.43 118.68 124.69 2k6z s LEU 45 Ca -0.04 0.24 0.10 0.00 -0.22 0.00 0.00 54.13 54.22 2k6z s LEU 45 Cb -0.09 -2.35 -0.05 0.00 0.50 0.00 0.00 46.19 44.21 2k6z s LEU 45 CO 0.01 -0.12 -0.19 -1.00 -1.32 0.00 0.00 176.35 173.73 2k6z s HIS 46 N 1.83 2.04 0.16 5.38 3.76 -0.14 -0.77 115.29 127.56 2k6z s HIS 46 Ca 0.13 -0.43 0.06 0.00 -0.15 0.00 0.00 55.06 54.67 2k6z s HIS 46 Cb -0.15 -0.95 -0.04 0.00 1.11 0.00 0.00 32.58 32.55 2k6z s HIS 46 CO 0.09 0.51 0.09 -1.83 -0.85 0.00 0.00 174.74 172.75 2k6z s GLU 47 N -3.24 2.74 -0.08 1.40 -1.05 0.06 -1.25 118.70 117.28 2k6z s GLU 47 Ca 0.23 -0.93 0.03 0.00 -0.15 0.00 0.00 54.97 54.15 2k6z s GLU 47 Cb -0.05 -2.56 -0.02 0.00 -0.44 0.00 0.00 34.13 31.06 2k6z s GLU 47 CO 0.10 0.48 -0.15 0.99 0.95 0.00 0.00 175.26 177.63 2k6z s THR 48 N -1.71 2.95 0.28 1.83 2.01 -0.53 -1.47 115.64 119.01 2k6z s THR 48 Ca 0.30 -0.74 0.06 0.00 0.31 0.00 0.00 61.69 61.62 2k6z s THR 48 Cb -0.10 -2.18 -0.06 0.00 0.01 0.00 0.00 72.50 70.18 2k6z s THR 48 CO 0.22 0.56 -0.04 0.72 -0.69 0.00 0.00 174.62 175.39 2k6z s PHE 49 N -0.28 1.94 -0.01 4.92 -0.12 -0.43 -4.50 117.98 119.50 2k6z s PHE 49 Ca 0.02 -0.74 -0.00 0.00 -0.05 0.00 0.00 56.93 56.16 2k6z s PHE 49 Cb -0.13 -1.13 -0.04 0.00 -0.63 0.00 0.00 43.02 41.09 2k6z s PHE 49 CO 0.03 0.24 0.06 1.41 -0.05 0.00 0.00 175.22 176.91 2k6z s MET 50 N -3.75 3.02 -0.01 1.99 -2.45 -1.26 -1.05 119.30 115.78 2k6z s MET 50 Ca 0.30 -0.50 -0.17 0.00 -1.25 0.00 0.00 55.69 54.07 2k6z s MET 50 Cb 0.04 -2.83 0.03 0.00 1.25 0.00 0.00 34.83 33.33 2k6z s MET 50 CO 0.12 0.65 0.37 0.50 1.05 0.00 0.00 175.02 177.71 2k6z s ARG 51 N -1.64 0.74 0.01 4.11 3.00 0.04 -4.94 118.95 120.28 2k6z s ARG 51 Ca 0.21 -0.15 -0.10 0.00 -1.00 0.00 0.00 55.73 54.69 2k6z s ARG 51 Cb -0.12 0.33 -0.05 0.00 0.00 0.00 0.00 34.95 35.11 2k6z s ARG 51 CO 0.12 -0.22 0.34 -2.00 0.00 0.00 0.00 175.30 173.55 2k6z s GLU 52 N -1.43 3.72 0.00 5.12 2.56 -1.26 -0.32 118.70 127.09 2k6z s GLU 52 Ca -0.12 0.15 0.00 0.00 0.00 0.00 0.00 54.97 55.00 2k6z s GLU 52 Cb -0.04 -3.11 0.00 0.00 2.00 0.00 0.00 34.13 32.98 2k6z s GLU 52 CO 0.04 0.65 0.00 0.28 -0.56 0.00 0.00 175.26 175.67 2k6z n VAL 53 N 1.36 0.00 -0.32 3.70 0.31 0.68 -4.93 118.33 119.13 2k6z n VAL 53 Ca -0.12 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.18 2k6z n VAL 53 Cb 0.53 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 33.42 2k6z n VAL 53 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2k6z n GLU 54 N 0.00 0.64 -1.36 5.55 2.13 -1.26 -4.35 120.64 121.99 2k6z n GLU 54 Ca 0.00 -0.21 -0.13 0.00 0.66 0.00 0.00 57.16 57.48 2k6z n GLU 54 Cb 0.00 -1.50 -0.05 0.00 0.27 0.00 0.00 31.44 30.16 2k6z n GLU 54 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2k6z n GLY 55 N 2.28 1.28 2.97 8.31 0.00 -1.26 -4.97 105.19 113.80 2k6z n GLY 55 Ca 0.09 -0.18 -0.20 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.96 0.87 -0.08 1.61 1.02 -1.26 -5.12 119.74 113.82 2k6z s LYS 56 Ca 0.00 -0.24 -0.18 0.00 0.02 0.00 0.00 55.97 55.57 2k6z s LYS 56 Cb 0.00 -0.83 -0.05 0.00 -0.52 0.00 0.00 37.83 36.44 2k6z s LYS 56 CO 0.00 0.07 0.49 0.15 -0.92 0.00 0.00 175.35 175.13 2k6z s LYS 57 N 0.33 4.27 -0.03 1.68 1.02 -1.26 -0.23 119.74 125.53 2k6z s LYS 57 Ca -0.05 0.49 -0.05 0.00 0.02 0.00 0.00 55.97 56.39 2k6z s LYS 57 Cb -0.09 -3.39 0.01 0.00 -0.52 0.00 0.00 37.83 33.84 2k6z s LYS 57 CO 0.00 0.28 0.11 0.08 -0.92 0.00 0.00 175.35 174.90 2k6z s VAL 58 N 0.22 0.04 0.56 3.17 1.01 0.56 -4.97 120.40 120.98 2k6z s VAL 58 Ca 0.26 -0.30 -0.04 0.00 0.00 0.00 0.00 61.98 61.91 2k6z s VAL 58 Cb -0.16 -0.26 0.01 0.00 0.00 0.00 0.00 36.38 35.97 2k6z s VAL 58 CO 0.12 -0.16 0.84 -0.04 0.00 0.00 0.00 175.10 175.86 2k6z s MET 59 N -0.52 2.88 0.35 2.72 -1.94 -1.26 -0.78 119.30 120.74 2k6z s MET 59 Ca -0.06 -0.20 -0.01 0.00 -1.71 0.00 0.00 55.69 53.71 2k6z s MET 59 Cb -0.04 -2.35 0.00 0.00 2.01 0.00 0.00 34.83 34.45 2k6z s MET 59 CO 0.00 -0.63 0.46 0.41 -0.01 0.00 0.00 175.02 175.26 2k6z n GLY 60 N -2.46 2.19 3.18 -0.03 0.00 -0.21 -4.91 105.19 102.95 2k6z n GLY 60 Ca 0.04 -1.64 -0.13 0.00 0.00 0.00 0.00 46.02 44.30 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 -2.84 0.52 0.03 1.61 1.75 -1.26 -1.31 119.30 117.80 2k6z s MET 61 Ca 0.30 -0.09 -0.22 0.00 -1.25 0.00 0.00 55.69 54.43 2k6z s MET 61 Cb -0.01 0.23 0.05 0.00 2.84 0.00 0.00 34.83 37.94 2k6z s MET 61 CO 0.21 -0.12 0.51 -0.98 -0.65 0.00 0.00 175.02 173.99 2k6z s ARG 62 N -0.93 1.00 0.64 4.11 1.70 -0.54 -5.00 118.95 119.93 2k6z s ARG 62 Ca -0.10 -0.21 -0.14 0.00 -0.47 0.00 0.00 55.73 54.81 2k6z s ARG 62 Cb -0.05 0.46 -0.02 0.00 -0.57 0.00 0.00 34.95 34.77 2k6z s ARG 62 CO 0.02 -0.35 1.07 -1.25 -1.08 0.00 0.00 175.30 173.71 2k6z s PRO 63 N -2.28 3.09 0.06 3.89 0.04 -1.26 -0.77 135.00 137.77 2k6z s PRO 63 Ca -0.06 1.18 0.01 0.00 0.04 0.00 0.00 61.00 62.17 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 -0.00 -1.00 -0.06 0.14 0.04 0.00 0.00 177.00 176.12 2k6z s VAL 64 N -2.59 0.49 -0.21 -0.36 -7.23 0.05 -4.77 120.40 105.78 2k6z s VAL 64 Ca 0.63 -1.47 0.17 0.00 -1.81 0.00 0.00 61.98 59.50 2k6z s VAL 64 Cb -0.16 -1.07 0.08 0.00 0.56 0.00 0.00 36.38 35.78 2k6z s VAL 64 CO 0.43 -0.66 1.34 1.55 -0.31 0.00 0.00 175.10 177.45 2k6z h PRO 65 N 3.78 0.00 -1.16 4.82 0.13 -1.94 -3.42 132.00 134.21 2k6z h PRO 65 Ca -0.35 0.00 0.35 0.00 -0.87 0.00 0.00 66.00 65.13 2k6z h PRO 65 Cb 1.18 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.15 2k6z h PRO 65 CO 0.53 0.33 0.94 -0.59 -0.23 0.00 0.00 178.00 178.98 2k6z s PHE 66 N -3.03 -0.03 0.25 1.56 -0.12 -1.26 -4.74 117.98 110.60 2k6z s PHE 66 Ca 0.03 -0.00 0.08 0.00 -0.05 0.00 0.00 56.93 56.99 2k6z s PHE 66 Cb 0.07 0.51 -0.04 0.00 -0.63 0.00 0.00 43.02 42.94 2k6z s PHE 66 CO 0.75 -0.09 0.07 -0.51 -0.05 0.00 0.00 175.22 175.38 2k6z s LEU 67 N -2.62 3.43 0.12 -1.99 1.43 0.09 -4.99 118.68 114.16 2k6z s LEU 67 Ca 0.13 -0.47 0.07 0.00 -1.03 0.00 0.00 54.13 52.84 2k6z s LEU 67 Cb 0.04 -1.98 -0.04 0.00 0.03 0.00 0.00 46.19 44.24 2k6z s LEU 67 CO -0.05 0.00 -0.17 -0.70 0.23 0.00 0.00 176.35 175.66 2k6z s GLU 68 N -3.61 1.09 0.00 1.70 2.12 -1.26 -0.21 118.70 118.53 2k6z s GLU 68 Ca 0.31 -1.22 0.01 0.00 0.36 0.00 0.00 54.97 54.44 2k6z s GLU 68 Cb -0.07 -1.16 -0.01 0.00 0.26 0.00 0.00 34.13 33.15 2k6z s GLU 68 CO 0.21 0.25 -0.05 0.08 -0.54 0.00 0.00 175.26 175.21 2k6z s VAL 69 N -1.68 0.36 0.48 3.70 1.01 0.38 -4.97 120.40 119.68 2k6z s VAL 69 Ca 0.08 -0.33 -0.12 0.00 0.00 0.00 0.00 61.98 61.62 2k6z s VAL 69 Cb -0.07 -0.33 -0.06 0.00 0.00 0.00 0.00 36.38 35.91 2k6z s VAL 69 CO 0.04 0.01 0.88 -2.16 0.00 0.00 0.00 175.10 173.87 2k6z s PRO 70 N -0.34 3.79 0.37 2.72 0.04 -1.26 -2.44 135.00 137.87 2k6z s PRO 70 Ca -0.00 0.64 -0.28 0.00 0.04 0.00 0.00 61.00 61.40 2k6z s PRO 70 Cb -0.03 -2.26 -0.11 0.00 0.04 0.00 0.00 34.50 32.14 2k6z s PRO 70 CO -0.00 -0.20 1.45 -1.25 0.04 0.00 0.00 177.00 177.04 2k6z s PRO 71 N -4.19 4.14 0.00 0.56 0.04 -1.26 -2.39 135.00 131.89 2k6z s PRO 71 Ca 0.54 2.51 0.00 0.00 0.04 0.00 0.00 61.00 64.09 2k6z s PRO 71 Cb -0.10 -2.98 0.00 0.00 0.04 0.00 0.00 34.50 31.46 2k6z s PRO 71 CO 0.36 -0.48 0.00 1.63 0.04 0.00 0.00 177.00 178.55 2k6z n LYS 72 N 0.50 0.00 -1.77 4.56 4.76 0.20 -4.99 118.16 121.43 2k6z n LYS 72 Ca 0.01 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.15 2k6z n LYS 72 Cb 0.40 -2.96 0.08 0.00 -1.84 0.00 0.00 35.03 30.70 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 1.61 -0.02 0.72 0.00 -1.01 -4.83 107.32 101.80 2k6z s GLY 73 Ca 0.00 -0.42 0.01 0.00 0.00 0.00 0.00 44.72 44.31 2k6z s GLY 73 CO 0.00 0.02 -0.04 -1.60 0.00 0.00 0.00 173.10 171.48 2k6z s ARG 74 N -5.36 0.44 -0.13 2.90 3.52 -1.26 -1.39 118.95 117.67 2k6z s ARG 74 Ca 0.61 -0.11 -0.12 0.00 -0.13 0.00 0.00 55.73 55.98 2k6z s ARG 74 Cb -0.12 -0.47 0.04 0.00 -1.56 0.00 0.00 34.95 32.83 2k6z s ARG 74 CO 0.52 0.03 0.35 0.08 -0.81 0.00 0.00 175.30 175.46 2k6z s VAL 75 N 0.28 -0.00 0.06 7.11 1.01 -0.08 -5.01 120.40 123.76 2k6z s VAL 75 Ca -0.03 0.01 0.01 0.00 0.00 0.00 0.00 61.98 61.97 2k6z s VAL 75 Cb -0.06 -0.49 -0.04 0.00 0.00 0.00 0.00 36.38 35.79 2k6z s VAL 75 CO -0.00 0.00 0.13 -1.83 0.00 0.00 0.00 175.10 173.40 2k6z s GLU 76 N 0.27 3.11 -0.28 2.72 4.04 -1.26 -0.74 118.70 126.56 2k6z s GLU 76 Ca -0.01 -0.57 -0.28 0.00 0.04 0.00 0.00 54.97 54.15 2k6z s GLU 76 Cb -0.03 -2.86 -0.06 0.00 0.02 0.00 0.00 34.13 31.21 2k6z s GLU 76 CO -0.00 0.59 2.27 1.28 -1.84 0.00 0.00 175.26 177.56 2k6z n LEU 77 N 0.48 3.05 -4.78 1.83 4.32 0.26 -4.89 117.00 117.27 2k6z n LEU 77 Ca -0.08 0.06 -0.41 0.00 -0.02 0.00 0.00 56.01 55.56 2k6z n LEU 77 Cb 0.51 -1.56 -0.00 0.00 -1.62 0.00 0.00 43.42 40.75 2k6z n LEU 77 CO 0.46 -0.87 1.16 -0.54 -1.22 0.00 0.00 177.39 176.38 2k6z s LYS 78 N 6.77 4.09 0.55 3.23 -0.14 -0.99 -3.90 119.74 129.35 2k6z s LYS 78 Ca 1.01 2.60 0.33 0.00 -1.36 0.00 0.00 55.97 58.55 2k6z s LYS 78 Cb -0.31 -2.97 1.48 0.00 -1.68 0.00 0.00 37.83 34.36 2k6z s LYS 78 CO 0.34 -0.57 1.83 -1.00 -0.76 0.00 0.00 175.35 175.18 2k6z h PRO 79 N 3.21 0.00 -0.01 -1.68 0.13 -1.90 -0.66 132.00 131.09 2k6z h PRO 79 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2k6z h PRO 79 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2k6z h PRO 79 CO 0.66 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.84 2k6z n GLY 80 N -1.70 0.37 0.00 1.56 0.00 -1.26 -5.03 105.19 99.14 2k6z n GLY 80 Ca 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 -0.17 1.08 3.76 -0.02 0.00 -0.26 -4.72 105.19 104.86 2k6z n GLY 81 Ca 0.00 -0.04 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 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 0.86 3.35 0.00 1.61 1.51 -1.24 -1.45 117.35 121.99 2k6z s TYR 82 Ca 0.00 1.60 -0.28 0.00 -1.01 0.00 0.00 57.07 57.38 2k6z s TYR 82 Cb 0.00 -3.40 0.08 0.00 -0.11 0.00 0.00 41.96 38.53 2k6z s TYR 82 CO 0.00 -1.01 0.71 -3.38 -1.11 0.00 0.00 175.55 170.76 2k6z s HIS 83 N -1.22 -0.57 -0.08 2.71 -3.43 -0.38 -2.34 115.29 109.99 2k6z s HIS 83 Ca 0.48 0.77 -0.22 0.00 -0.80 0.00 0.00 55.06 55.29 2k6z s HIS 83 Cb -0.33 0.47 -0.04 0.00 -1.43 0.00 0.00 32.58 31.25 2k6z s HIS 83 CO 0.43 -0.64 0.64 -0.06 -2.00 0.00 0.00 174.74 173.11 2k6z s PHE 84 N -2.08 3.55 -0.25 0.38 0.08 -0.65 -0.97 117.98 118.05 2k6z s PHE 84 Ca -0.05 1.15 -0.26 0.00 0.12 0.00 0.00 56.93 57.88 2k6z s PHE 84 Cb -0.00 -2.74 0.00 0.00 -0.57 0.00 0.00 43.02 39.71 2k6z s PHE 84 CO 0.01 0.10 0.92 1.41 -0.10 0.00 0.00 175.22 177.56 2k6z s MET 85 N 0.79 4.19 -0.38 0.44 1.75 0.43 -0.54 119.30 125.97 2k6z s MET 85 Ca 0.34 1.08 -0.13 0.00 -1.25 0.00 0.00 55.69 55.74 2k6z s MET 85 Cb -0.17 -3.66 0.02 0.00 2.84 0.00 0.00 34.83 33.86 2k6z s MET 85 CO 0.16 -0.60 0.25 -0.51 -0.65 0.00 0.00 175.02 173.67 2k6z s LEU 86 N 3.05 4.84 -0.10 4.11 1.02 -0.05 -0.83 118.68 130.72 2k6z s LEU 86 Ca 0.39 -0.87 -0.04 0.00 0.02 0.00 0.00 54.13 53.63 2k6z s LEU 86 Cb -0.15 -2.09 -0.04 0.00 0.02 0.00 0.00 46.19 43.93 2k6z s LEU 86 CO 0.08 -0.39 0.06 -0.76 0.02 0.00 0.00 176.35 175.35 2k6z s LEU 87 N 1.63 3.89 -0.55 1.79 2.01 -0.27 -1.25 118.68 125.93 2k6z s LEU 87 Ca 0.04 0.27 -0.02 0.00 0.01 0.00 0.00 54.13 54.43 2k6z s LEU 87 Cb -0.19 -1.92 0.00 0.00 0.01 0.00 0.00 46.19 44.10 2k6z s LEU 87 CO 0.08 0.39 0.46 0.61 1.01 0.00 0.00 176.35 178.91 2k6z n GLY 88 N 2.10 0.19 3.35 -3.19 0.00 -0.44 -0.68 105.19 106.51 2k6z n GLY 88 Ca -0.19 -0.25 -0.36 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.39 -1.17 -0.02 0.99 4.77 -0.92 -1.78 117.00 116.49 2k6z n LEU 89 Ca -0.07 0.49 -0.02 0.00 -0.03 0.00 0.00 56.01 56.38 2k6z n LEU 89 Cb 0.55 -1.08 -0.03 0.00 -2.33 0.00 0.00 43.42 40.53 2k6z n LEU 89 CO 0.27 -3.94 -0.63 0.29 -1.33 0.00 0.00 177.39 172.05 2k6z n LYS 90 N 0.01 3.25 -4.17 3.23 4.76 -0.75 -4.86 118.16 119.63 2k6z n LYS 90 Ca 0.07 -0.00 -0.35 0.00 -2.87 0.00 0.00 58.31 55.16 2k6z n LYS 90 Cb 0.51 -1.10 -0.09 0.00 -1.84 0.00 0.00 35.03 32.50 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 -2.10 3.53 -1.13 1.97 1.81 -1.26 -5.02 118.95 116.74 2k6z s ARG 91 Ca -0.02 -0.36 -0.20 0.00 -1.72 0.00 0.00 55.73 53.43 2k6z s ARG 91 Cb 0.01 -3.03 -0.05 0.00 -0.45 0.00 0.00 34.95 31.43 2k6z s ARG 91 CO 0.16 0.48 1.95 -0.35 -0.68 0.00 0.00 175.30 176.87 2k6z n PRO 92 N 2.85 2.15 -1.88 3.54 -0.04 -1.26 -4.90 135.00 135.46 2k6z n PRO 92 Ca -0.18 -2.47 -0.42 0.00 -0.04 0.00 0.00 63.50 60.39 2k6z n PRO 92 Cb 0.53 -3.34 -0.03 0.00 -0.04 0.00 0.00 33.50 30.62 2k6z n PRO 92 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2k6z s LEU 93 N 4.74 4.37 0.13 1.53 2.34 -1.26 -4.92 118.68 125.61 2k6z s LEU 93 Ca 0.58 2.61 -0.24 0.00 0.06 0.00 0.00 54.13 57.13 2k6z s LEU 93 Cb 0.08 -3.58 -0.07 0.00 -0.56 0.00 0.00 46.19 42.06 2k6z s LEU 93 CO 0.07 -0.89 0.74 -0.54 -1.06 0.00 0.00 176.35 174.68 2k6z s LYS 94 N 1.98 4.50 -0.05 1.48 -0.14 -1.26 -4.73 119.74 121.52 2k6z s LYS 94 Ca 0.74 1.08 -0.32 0.00 -1.36 0.00 0.00 55.97 56.11 2k6z s LYS 94 Cb -0.43 -3.28 -0.10 0.00 -1.68 0.00 0.00 37.83 32.34 2k6z s LYS 94 CO 0.32 0.52 1.97 0.00 -0.76 0.00 0.00 175.35 177.40 2k6z n ALA 95 N 1.88 1.29 0.00 5.17 0.00 -1.26 -0.88 120.51 126.71 2k6z n ALA 95 Ca -0.06 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.58 2k6z n ALA 95 Cb 0.49 -2.62 0.00 0.00 0.00 0.00 0.00 19.45 17.32 2k6z n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k6z n GLY 96 N 4.66 0.54 3.88 0.00 0.00 -1.06 -5.02 105.19 108.17 2k6z n GLY 96 Ca 0.23 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.95 2k6z n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k6z s GLU 97 N -0.64 1.18 0.01 1.61 2.02 -0.05 -4.92 118.70 117.91 2k6z s GLU 97 Ca 0.00 -0.05 0.01 0.00 0.02 0.00 0.00 54.97 54.94 2k6z s GLU 97 Cb 0.00 -1.87 -0.01 0.00 0.10 0.00 0.00 34.13 32.35 2k6z s GLU 97 CO 0.00 -2.11 -0.03 -1.83 0.02 0.00 0.00 175.26 171.31 2k6z s GLU 98 N -5.63 0.26 -0.01 1.61 -1.05 -1.26 -0.42 118.70 112.20 2k6z s GLU 98 Ca 0.67 -0.32 -0.08 0.00 -0.15 0.00 0.00 54.97 55.10 2k6z s GLU 98 Cb -0.09 -0.11 0.00 0.00 -0.44 0.00 0.00 34.13 33.49 2k6z s GLU 98 CO 0.52 0.02 0.15 0.08 0.95 0.00 0.00 175.26 176.98 2k6z s VAL 99 N -0.61 0.07 0.13 1.83 1.01 -0.21 -4.94 120.40 117.67 2k6z s VAL 99 Ca -0.05 -0.59 -0.05 0.00 0.00 0.00 0.00 61.98 61.29 2k6z s VAL 99 Cb -0.05 -0.42 -0.05 0.00 0.00 0.00 0.00 36.38 35.86 2k6z s VAL 99 CO -0.00 -0.33 0.36 -1.83 0.00 0.00 0.00 175.10 173.30 2k6z s GLU 100 N -1.20 3.61 0.15 2.72 4.04 -1.26 -2.18 118.70 124.59 2k6z s GLU 100 Ca -0.13 -0.10 0.11 0.00 0.04 0.00 0.00 54.97 54.89 2k6z s GLU 100 Cb -0.07 -2.88 -0.04 0.00 0.02 0.00 0.00 34.13 31.16 2k6z s GLU 100 CO 0.02 0.49 -0.25 -0.51 -1.84 0.00 0.00 175.26 173.17 2k6z s LEU 101 N -2.56 2.36 -0.33 1.83 1.02 -0.76 -4.14 118.68 116.10 2k6z s LEU 101 Ca 0.39 -0.79 0.02 0.00 0.02 0.00 0.00 54.13 53.77 2k6z s LEU 101 Cb -0.12 -1.16 0.09 0.00 0.02 0.00 0.00 46.19 45.01 2k6z s LEU 101 CO 0.24 0.14 0.04 -1.81 0.02 0.00 0.00 176.35 174.98 2k6z s ASP 102 N -2.30 4.81 0.07 2.29 1.01 0.28 -0.36 116.67 122.47 2k6z s ASP 102 Ca 0.16 -1.85 -0.26 0.00 0.71 0.00 0.00 52.55 51.31 2k6z s ASP 102 Cb -0.09 -1.66 -0.06 0.00 1.01 0.00 0.00 42.92 42.12 2k6z s ASP 102 CO 0.07 -0.35 0.81 -0.76 0.21 0.00 0.00 175.17 175.15 2k6z s LEU 103 N 1.04 4.47 -0.37 1.23 1.02 0.24 -0.37 118.68 125.94 2k6z s LEU 103 Ca 0.04 1.54 -0.10 0.00 0.02 0.00 0.00 54.13 55.63 2k6z s LEU 103 Cb -0.20 -3.32 0.03 0.00 0.02 0.00 0.00 46.19 42.72 2k6z s LEU 103 CO -0.06 0.01 0.19 -0.76 0.02 0.00 0.00 176.35 175.76 2k6z s LEU 104 N -0.12 4.63 -0.23 1.79 1.43 -0.23 -1.43 118.68 124.52 2k6z s LEU 104 Ca 0.40 -0.98 -0.08 0.00 -1.03 0.00 0.00 54.13 52.44 2k6z s LEU 104 Cb -0.21 -2.01 -0.04 0.00 0.03 0.00 0.00 46.19 43.96 2k6z s LEU 104 CO 0.25 -0.37 0.10 -0.36 0.23 0.00 0.00 176.35 176.20 2k6z s PHE 105 N 1.54 3.18 -1.25 0.29 0.08 -0.03 -0.57 117.98 121.23 2k6z s PHE 105 Ca 0.02 -0.11 -0.11 0.00 0.12 0.00 0.00 56.93 56.85 2k6z s PHE 105 Cb -0.19 -2.21 0.10 0.00 -0.57 0.00 0.00 43.02 40.14 2k6z s PHE 105 CO 0.06 -0.12 0.46 0.00 -0.10 0.00 0.00 175.22 175.52 2k6z n ALA 106 N 4.43 -1.09 0.00 5.36 0.00 0.72 -2.15 120.51 127.79 2k6z n ALA 106 Ca -0.16 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2k6z n ALA 106 Cb 0.52 -2.49 0.00 0.00 0.00 0.00 0.00 19.45 17.48 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 -1.08 1.05 0.08 0.00 0.00 -1.26 -4.75 105.19 99.23 2k6z n GLY 107 Ca 0.01 -0.73 0.14 0.00 0.00 0.00 0.00 46.02 45.44 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 0.00 -1.08 3.55 -0.02 0.00 -1.23 -4.74 105.19 101.67 2k6z n GLY 108 Ca 0.00 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.68 3.31 0.16 1.61 1.02 -0.91 -4.91 119.74 117.33 2k6z s LYS 109 Ca 0.22 -0.11 -0.20 0.00 0.02 0.00 0.00 55.97 55.90 2k6z s LYS 109 Cb 0.19 -4.12 -0.08 0.00 -0.52 0.00 0.00 37.83 33.31 2k6z s LYS 109 CO 0.53 -1.92 0.66 0.54 -0.92 0.00 0.00 175.35 174.25 2k6z s VAL 110 N 5.24 4.62 -0.03 3.17 0.11 -1.26 -0.85 120.40 131.40 2k6z s VAL 110 Ca 0.37 1.29 -0.01 0.00 -2.93 0.00 0.00 61.98 60.69 2k6z s VAL 110 Cb -0.09 -3.91 0.03 0.00 -1.53 0.00 0.00 36.38 30.88 2k6z s VAL 110 CO 0.19 0.38 0.05 -0.22 -3.33 0.00 0.00 175.10 172.16 2k6z s LEU 111 N -1.55 0.65 -0.30 2.54 1.98 -0.52 -4.93 118.68 116.55 2k6z s LEU 111 Ca 0.37 0.07 -0.28 0.00 -2.89 0.00 0.00 54.13 51.40 2k6z s LEU 111 Cb -0.19 -0.08 0.01 0.00 0.66 0.00 0.00 46.19 46.59 2k6z s LEU 111 CO 0.21 -0.18 1.01 -0.75 -1.89 0.00 0.00 176.35 174.75 2k6z s LYS 112 N 1.57 4.08 0.37 1.98 2.47 -1.26 -0.59 119.74 128.35 2k6z s LYS 112 Ca -0.03 1.02 0.08 0.00 -1.56 0.00 0.00 55.97 55.49 2k6z s LYS 112 Cb -0.13 -3.72 -0.04 0.00 -1.46 0.00 0.00 37.83 32.48 2k6z s LYS 112 CO -0.03 -0.80 0.16 0.14 0.16 0.00 0.00 175.35 174.98 2k6z s VAL 113 N 3.42 2.78 -0.12 4.02 -7.23 0.52 -5.00 120.40 118.78 2k6z s VAL 113 Ca 0.42 -1.69 -0.04 0.00 -1.81 0.00 0.00 61.98 58.87 2k6z s VAL 113 Cb -0.13 -2.97 0.06 0.00 0.56 0.00 0.00 36.38 33.90 2k6z s VAL 113 CO 0.13 -0.12 0.20 -0.69 -0.31 0.00 0.00 175.10 174.31 2k6z s VAL 114 N -2.48 -0.31 0.01 1.32 1.01 -1.26 -1.82 120.40 116.86 2k6z s VAL 114 Ca 0.39 0.23 0.07 0.00 0.00 0.00 0.00 61.98 62.67 2k6z s VAL 114 Cb -0.01 -0.42 -0.02 0.00 0.00 0.00 0.00 36.38 35.93 2k6z s VAL 114 CO 0.23 0.06 -0.21 -0.76 0.00 0.00 0.00 175.10 174.42 2k6z s LEU 115 N 2.33 2.10 0.57 3.92 2.01 -0.93 -4.29 118.68 124.40 2k6z s LEU 115 Ca 0.03 -0.45 -0.18 0.00 0.01 0.00 0.00 54.13 53.55 2k6z s LEU 115 Cb -0.13 -1.04 -0.04 0.00 0.01 0.00 0.00 46.19 44.98 2k6z s LEU 115 CO -0.08 0.22 1.12 -2.16 1.01 0.00 0.00 176.35 176.46 2k6z s PRO 116 N -0.80 3.23 -0.07 1.29 0.04 -1.26 -1.04 135.00 136.39 2k6z s PRO 116 Ca 0.08 1.54 -0.25 0.00 0.04 0.00 0.00 61.00 62.40 2k6z s PRO 116 Cb -0.08 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.43 2k6z s PRO 116 CO 0.00 -0.93 0.79 0.08 0.04 0.00 0.00 177.00 176.99 2k6z s VAL 117 N -1.93 4.98 0.40 -0.36 1.01 0.44 -1.65 120.40 123.28 2k6z s VAL 117 Ca 0.71 1.63 0.07 0.00 0.00 0.00 0.00 61.98 64.39 2k6z s VAL 117 Cb -0.23 -4.13 -0.07 0.00 0.00 0.00 0.00 36.38 31.96 2k6z s VAL 117 CO 0.30 0.19 0.05 -1.61 0.00 0.00 0.00 175.10 174.03 2k6z s GLU 118 N 1.07 2.02 -0.59 2.72 0.41 -0.11 -2.58 118.70 121.65 2k6z s GLU 118 Ca 0.41 -2.01 0.03 0.00 -0.41 0.00 0.00 54.97 52.99 2k6z s GLU 118 Cb -0.18 -1.75 0.38 0.00 -1.78 0.00 0.00 34.13 30.80 2k6z s GLU 118 CO 0.20 -0.04 1.27 0.00 -0.49 0.00 0.00 175.26 176.19 2k6z n ALA 119 N -1.03 5.28 -0.85 5.21 0.00 -1.26 -2.63 120.51 125.23 2k6z n ALA 119 Ca -0.04 -4.43 0.00 0.00 0.00 0.00 0.00 53.44 48.97 2k6z n ALA 119 Cb 0.66 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 19.15 2k6z n ALA 119 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37