#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 0.06 0.68 1.61 0.01 -1.26 -5.16 113.70 109.64 2k6z s SER 2 Ca 0.00 -1.05 -0.14 0.00 1.31 0.00 0.00 55.95 56.07 2k6z s SER 2 Cb 0.00 0.44 0.01 0.00 0.21 0.00 0.00 66.02 66.69 2k6z s SER 2 CO 0.00 -0.92 1.11 -0.36 0.41 0.00 0.00 173.24 173.47 2k6z s PHE 3 N -4.04 2.62 0.00 2.43 0.08 -1.26 -4.97 117.98 112.84 2k6z s PHE 3 Ca 0.24 1.55 0.00 0.00 0.12 0.00 0.00 56.93 58.84 2k6z s PHE 3 Cb 0.04 -3.14 0.00 0.00 -0.57 0.00 0.00 43.02 39.35 2k6z s PHE 3 CO 0.05 -1.70 0.73 0.25 -0.10 0.00 0.00 175.22 174.45 2k6z n THR 4 N -2.66 0.00 -3.55 0.64 -2.24 -1.26 -5.07 114.28 100.14 2k6z n THR 4 Ca 0.10 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.77 2k6z n THR 4 Cb 0.52 0.37 -0.03 0.00 -2.10 0.00 0.00 70.33 69.09 2k6z n THR 4 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2k6z s GLU 5 N 0.00 1.23 0.40 -0.78 2.12 -1.26 -4.97 118.70 115.44 2k6z s GLU 5 Ca 0.00 -0.62 0.08 0.00 0.36 0.00 0.00 54.97 54.79 2k6z s GLU 5 Cb 0.00 0.54 -0.03 0.00 0.26 0.00 0.00 34.13 34.90 2k6z s GLU 5 CO 0.00 -0.52 0.30 0.20 -0.54 0.00 0.00 175.26 174.70 2k6z s GLY 6 N -2.79 2.16 0.23 -1.50 0.00 -1.26 -4.75 107.32 99.41 2k6z s GLY 6 Ca 0.03 -1.94 -0.13 0.00 0.00 0.00 0.00 44.72 42.68 2k6z s GLY 6 CO -0.11 -1.76 0.45 0.66 0.00 0.00 0.00 173.10 172.35 2k6z s TRP 7 N -2.50 0.31 0.05 1.90 -2.14 -0.41 -4.02 118.94 112.14 2k6z s TRP 7 Ca 0.45 -0.67 0.03 0.00 2.66 0.00 0.00 56.10 58.57 2k6z s TRP 7 Cb -0.01 0.18 -0.04 0.00 -3.10 0.00 0.00 33.47 30.49 2k6z s TRP 7 CO 0.26 -0.94 0.02 0.08 -2.66 0.00 0.00 176.95 173.71 2k6z s VAL 8 N -3.99 4.22 0.00 -0.66 1.01 0.50 -0.88 120.40 120.60 2k6z s VAL 8 Ca 0.20 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.40 2k6z s VAL 8 Cb -0.00 -2.97 0.00 0.00 0.00 0.00 0.00 36.38 33.40 2k6z s VAL 8 CO 0.06 0.21 0.00 0.54 0.00 0.00 0.00 175.10 175.92 2k6z n ARG 9 N 0.84 0.99 -3.77 2.72 5.12 -1.14 -1.70 116.66 119.71 2k6z n ARG 9 Ca -0.12 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.68 2k6z n ARG 9 Cb 0.52 0.00 -0.13 0.00 -1.16 0.00 0.00 32.46 31.69 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 -0.23 -0.30 -1.55 5.36 -1.26 -3.46 117.98 116.53 2k6z s PHE 10 Ca 0.00 0.58 -0.18 0.00 -0.96 0.00 0.00 56.93 56.38 2k6z s PHE 10 Cb 0.00 0.03 0.18 0.00 -0.34 0.00 0.00 43.02 42.89 2k6z s PHE 10 CO 0.00 -0.15 1.20 -1.54 -1.46 0.00 0.00 175.22 173.26 2k6z s SER 11 N 0.67 -0.21 0.29 6.13 1.04 -1.26 -4.96 113.70 115.40 2k6z s SER 11 Ca -0.05 0.24 0.13 0.00 0.48 0.00 0.00 55.95 56.76 2k6z s SER 11 Cb -0.06 1.22 0.35 0.00 0.10 0.00 0.00 66.02 67.63 2k6z s SER 11 CO -0.04 -0.04 1.58 1.55 0.98 0.00 0.00 173.24 177.28 2k6z h PRO 12 N 7.41 0.00 0.00 4.02 0.13 -1.86 -1.28 132.00 140.43 2k6z h PRO 12 Ca -0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.00 2k6z h PRO 12 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2k6z h PRO 12 CO -0.00 0.58 0.00 0.41 -0.23 0.00 0.00 178.00 178.75 2k6z n GLY 13 N 0.53 0.80 0.00 1.56 0.00 -1.26 -3.99 105.19 102.83 2k6z n GLY 13 Ca -0.00 -2.16 0.10 0.00 0.00 0.00 0.00 46.02 43.96 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 -0.92 0.13 -4.38 1.61 -0.04 -1.26 -4.98 135.00 125.15 2k6z n PRO 14 Ca 0.00 0.12 -0.19 0.00 -0.04 0.00 0.00 63.50 63.38 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 -2.83 2.33 0.32 3.54 4.22 -1.26 -0.98 114.94 120.28 2k6z s ASN 15 Ca 0.14 -1.20 -0.05 0.00 -2.14 0.00 0.00 52.86 49.62 2k6z s ASN 15 Cb 0.14 -0.09 0.02 0.00 1.28 0.00 0.00 41.25 42.60 2k6z s ASN 15 CO 0.36 -0.42 0.50 0.00 -2.04 0.00 0.00 177.10 175.50 2k6z n ALA 16 N -0.50 -0.62 -3.15 3.54 0.00 -0.37 -4.75 120.51 114.65 2k6z n ALA 16 Ca -0.05 -1.35 -0.13 0.00 0.00 0.00 0.00 53.44 51.91 2k6z n ALA 16 Cb 0.64 1.09 -0.11 0.00 0.00 0.00 0.00 19.45 21.06 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 -2.46 -0.64 0.09 0.00 0.00 -1.26 -0.41 121.76 117.08 2k6z s ALA 17 Ca 0.23 0.63 0.06 0.00 0.00 0.00 0.00 51.96 52.88 2k6z s ALA 17 Cb -0.02 -0.34 -0.03 0.00 0.00 0.00 0.00 23.12 22.73 2k6z s ALA 17 CO 0.16 -0.14 -0.17 0.00 0.00 0.00 0.00 175.76 175.61 2k6z s ALA 18 N -0.13 1.44 -0.46 0.00 0.00 0.10 -2.88 121.76 119.82 2k6z s ALA 18 Ca -0.03 -1.12 0.08 0.00 0.00 0.00 0.00 51.96 50.90 2k6z s ALA 18 Cb -0.03 -0.15 0.28 0.00 0.00 0.00 0.00 23.12 23.23 2k6z s ALA 18 CO 0.01 0.23 0.67 0.66 0.00 0.00 0.00 175.76 177.33 2k6z n TYR 19 N 1.13 1.15 -1.38 0.00 4.02 -0.06 -1.41 117.16 120.61 2k6z n TYR 19 Ca -0.20 -3.80 -0.30 0.00 -0.01 0.00 0.00 57.90 53.59 2k6z n TYR 19 Cb 0.54 -0.43 0.12 0.00 -0.02 0.00 0.00 39.34 39.55 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 -2.03 2.35 0.20 7.72 0.05 -1.26 -1.29 118.68 124.42 2k6z s LEU 20 Ca 0.39 1.35 -0.06 0.00 0.05 0.00 0.00 54.13 55.86 2k6z s LEU 20 Cb 0.22 -3.83 -0.06 0.00 -2.05 0.00 0.00 46.19 40.47 2k6z s LEU 20 CO -0.08 -2.38 0.46 0.28 -0.55 0.00 0.00 176.35 174.08 2k6z s THR 21 N -3.06 5.07 -0.10 5.48 -1.32 -1.26 -0.48 115.64 119.98 2k6z s THR 21 Ca 0.62 0.12 -0.02 0.00 -1.21 0.00 0.00 61.69 61.21 2k6z s THR 21 Cb -0.16 -3.66 0.04 0.00 -1.51 0.00 0.00 72.50 67.21 2k6z s THR 21 CO 0.55 -0.09 0.02 -0.22 -2.21 0.00 0.00 174.62 172.67 2k6z s LEU 22 N -2.96 0.65 -0.09 9.08 2.96 -1.26 -4.92 118.68 122.14 2k6z s LEU 22 Ca 0.43 -0.25 0.02 0.00 -0.22 0.00 0.00 54.13 54.11 2k6z s LEU 22 Cb -0.11 -0.43 -0.02 0.00 0.50 0.00 0.00 46.19 46.12 2k6z s LEU 22 CO 0.25 -0.23 -0.14 -1.61 -1.32 0.00 0.00 176.35 173.30 2k6z s GLU 23 N 1.98 2.93 -0.70 1.98 8.01 -1.26 -0.66 118.70 130.97 2k6z s GLU 23 Ca 0.04 -0.69 0.04 0.00 0.01 0.00 0.00 54.97 54.37 2k6z s GLU 23 Cb -0.13 -2.50 0.28 0.00 -4.31 0.00 0.00 34.13 27.47 2k6z s GLU 23 CO -0.06 0.43 0.95 -1.71 0.01 0.00 0.00 175.26 174.88 2k6z n ASN 24 N 2.89 4.48 0.28 -0.19 4.05 0.04 -4.95 115.26 121.86 2k6z n ASN 24 Ca -0.18 -3.51 0.15 0.00 0.45 0.00 0.00 54.58 51.49 2k6z n ASN 24 Cb 0.52 -0.75 0.79 0.00 1.23 0.00 0.00 39.78 41.57 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 4.06 0.00 0.00 1.20 0.13 -1.90 0.10 132.00 135.58 2k6z h PRO 25 Ca 0.20 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.25 2k6z h PRO 25 Cb 0.60 0.00 0.04 0.00 0.13 0.00 0.00 31.00 31.76 2k6z h PRO 25 CO 0.92 0.08 0.08 0.41 -0.23 0.00 0.00 178.00 179.26 2k6z n GLY 26 N -0.52 -1.26 0.42 1.56 0.00 -1.26 -4.59 105.19 99.53 2k6z n GLY 26 Ca -0.01 -1.67 0.05 0.00 0.00 0.00 0.00 46.02 44.39 2k6z n GLY 26 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2k6z n ASP 27 N -3.18 1.85 -4.43 1.61 9.92 -1.26 -2.43 116.55 118.63 2k6z n ASP 27 Ca 0.03 -1.43 -0.22 0.00 -0.53 0.00 0.00 54.79 52.64 2k6z n ASP 27 Cb 0.11 0.04 -0.10 0.00 -0.64 0.00 0.00 41.12 40.54 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 -0.98 2.58 0.29 0.64 1.43 -1.26 -4.81 118.68 116.57 2k6z s LEU 28 Ca 0.12 -1.04 -0.24 0.00 -1.03 0.00 0.00 54.13 51.95 2k6z s LEU 28 Cb 0.09 -0.95 -0.09 0.00 0.03 0.00 0.00 46.19 45.27 2k6z s LEU 28 CO 0.15 -0.04 0.87 -2.16 0.23 0.00 0.00 176.35 175.39 2k6z s PRO 29 N -3.56 4.48 0.15 1.29 0.04 -1.26 -4.37 135.00 131.76 2k6z s PRO 29 Ca 0.28 1.17 0.03 0.00 0.04 0.00 0.00 61.00 62.52 2k6z s PRO 29 Cb -0.03 -2.84 -0.04 0.00 0.04 0.00 0.00 34.50 31.63 2k6z s PRO 29 CO 0.12 0.33 0.24 -0.51 0.04 0.00 0.00 177.00 177.22 2k6z s LEU 30 N -2.00 4.19 -0.26 -3.56 1.02 -0.91 -4.98 118.68 112.18 2k6z s LEU 30 Ca 0.47 0.10 -0.03 0.00 0.02 0.00 0.00 54.13 54.69 2k6z s LEU 30 Cb -0.18 -2.78 0.09 0.00 0.02 0.00 0.00 46.19 43.34 2k6z s LEU 30 CO 0.23 0.06 0.09 -0.60 0.02 0.00 0.00 176.35 176.16 2k6z s ARG 31 N -3.15 0.41 -0.50 1.70 3.52 -1.26 -0.26 118.95 119.40 2k6z s ARG 31 Ca 0.34 -0.58 -0.24 0.00 -0.13 0.00 0.00 55.73 55.11 2k6z s ARG 31 Cb -0.11 -1.68 0.03 0.00 -1.56 0.00 0.00 34.95 31.63 2k6z s ARG 31 CO 0.27 -0.88 0.91 -1.17 -0.81 0.00 0.00 175.30 173.63 2k6z s LEU 32 N 1.93 4.09 -0.11 -0.88 0.20 0.63 -0.28 118.68 124.26 2k6z s LEU 32 Ca 0.06 -0.13 0.17 0.00 0.69 0.00 0.00 54.13 54.92 2k6z s LEU 32 Cb -0.17 -2.99 -0.25 0.00 -0.43 0.00 0.00 46.19 42.35 2k6z s LEU 32 CO -0.23 -1.11 0.22 1.33 -0.29 0.00 0.00 176.35 176.26 2k6z n VAL 33 N 6.28 0.67 -3.62 1.68 0.24 0.50 -0.61 118.33 123.48 2k6z n VAL 33 Ca 0.04 -0.61 -0.07 0.00 -2.04 0.00 0.00 64.34 61.66 2k6z n VAL 33 Cb 0.48 -0.26 0.01 0.00 -1.47 0.00 0.00 33.84 32.60 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 1.69 1.45 3.42 7.63 0.00 -1.16 -4.59 105.19 113.63 2k6z n GLY 34 Ca -0.17 -1.24 -0.26 0.00 0.00 0.00 0.00 46.02 44.35 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 -1.29 0.59 -3.10 4.61 0.00 -1.26 -0.99 120.51 119.06 2k6z n ALA 35 Ca -0.12 -2.11 -0.11 0.00 0.00 0.00 0.00 53.44 51.11 2k6z n ALA 35 Cb 0.42 1.43 -0.05 0.00 0.00 0.00 0.00 19.45 21.26 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 -3.58 1.68 0.00 0.00 1.81 -0.41 -4.84 118.95 113.60 2k6z s ARG 36 Ca 0.22 -1.42 0.00 0.00 -1.72 0.00 0.00 55.73 52.81 2k6z s ARG 36 Cb 0.01 0.47 0.00 0.00 -0.45 0.00 0.00 34.95 34.98 2k6z s ARG 36 CO 0.15 -0.70 0.00 -2.37 -0.68 0.00 0.00 175.30 171.70 2k6z n THR 37 N -0.44 0.00 0.43 0.02 5.66 -1.26 -0.51 114.28 118.19 2k6z n THR 37 Ca -0.01 0.00 0.13 0.00 -3.05 0.00 0.00 64.05 61.12 2k6z n THR 37 Cb 0.62 0.00 0.48 0.00 -1.55 0.00 0.00 70.33 69.88 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 -0.62 1.09 0.13 -2.03 -3.35 132.00 127.23 2k6z h PRO 38 Ca 0.00 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.99 2k6z h PRO 38 Cb 0.00 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.05 2k6z h PRO 38 CO 0.00 0.00 0.16 1.33 -0.23 0.00 0.00 178.00 179.26 2k6z n VAL 39 N -2.41 2.80 -3.68 1.56 0.24 -1.26 -4.75 118.33 110.82 2k6z n VAL 39 Ca 0.03 -1.70 -0.12 0.00 -2.04 0.00 0.00 64.34 60.51 2k6z n VAL 39 Cb 0.31 -0.33 -0.09 0.00 -1.47 0.00 0.00 33.84 32.27 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 -2.95 -1.37 0.14 2.33 0.00 -1.26 -2.22 121.76 116.44 2k6z s ALA 40 Ca 0.53 1.67 -0.17 0.00 0.00 0.00 0.00 51.96 53.99 2k6z s ALA 40 Cb 0.42 -0.98 -0.01 0.00 0.00 0.00 0.00 23.12 22.55 2k6z s ALA 40 CO 0.13 -0.28 1.79 1.49 0.00 0.00 0.00 175.76 178.89 2k6z h GLU 41 N 5.88 0.45 -5.47 0.00 4.57 0.19 -3.44 114.58 116.76 2k6z h GLU 41 Ca -0.30 -0.03 -0.43 0.00 -1.18 0.00 0.00 59.36 57.42 2k6z h GLU 41 Cb 1.18 -0.10 -0.14 0.00 -0.16 0.00 0.00 28.75 29.53 2k6z h GLU 41 CO 0.19 0.32 -0.73 1.03 -1.18 0.00 0.00 179.01 178.64 2k6z s ARG 42 N -6.10 1.29 0.04 1.92 0.52 -0.48 -5.03 118.95 111.10 2k6z s ARG 42 Ca -0.13 -1.57 0.00 0.00 -0.52 0.00 0.00 55.73 53.51 2k6z s ARG 42 Cb 0.10 -1.02 -0.03 0.00 0.52 0.00 0.00 34.95 34.52 2k6z s ARG 42 CO 0.72 0.16 -0.04 0.54 0.02 0.00 0.00 175.30 176.69 2k6z s VAL 43 N -3.04 0.25 -0.06 3.52 0.11 -1.26 -0.98 120.40 118.94 2k6z s VAL 43 Ca 0.22 -1.22 -0.17 0.00 -2.93 0.00 0.00 61.98 57.88 2k6z s VAL 43 Cb 0.00 -0.71 0.03 0.00 -1.53 0.00 0.00 36.38 34.18 2k6z s VAL 43 CO 0.06 -0.62 0.39 -0.70 -3.33 0.00 0.00 175.10 170.90 2k6z s GLU 44 N -2.20 0.67 -0.33 1.54 -6.30 0.13 -4.87 118.70 107.35 2k6z s GLU 44 Ca -0.08 0.07 -0.05 0.00 -2.50 0.00 0.00 54.97 52.41 2k6z s GLU 44 Cb -0.05 0.31 0.04 0.00 0.00 0.00 0.00 34.13 34.43 2k6z s GLU 44 CO -0.03 -0.17 0.07 -1.17 0.02 0.00 0.00 175.26 173.98 2k6z s LEU 45 N -0.91 4.18 0.18 2.70 2.96 -1.26 -0.29 118.68 126.23 2k6z s LEU 45 Ca -0.10 -1.17 0.10 0.00 -0.22 0.00 0.00 54.13 52.75 2k6z s LEU 45 Cb -0.04 -1.82 -0.04 0.00 0.50 0.00 0.00 46.19 44.79 2k6z s LEU 45 CO 0.04 -0.30 -0.18 -1.00 -1.32 0.00 0.00 176.35 173.58 2k6z s HIS 46 N 1.36 2.44 0.52 5.38 3.76 -0.27 -0.52 115.29 127.97 2k6z s HIS 46 Ca -0.03 -0.30 0.06 0.00 -0.15 0.00 0.00 55.06 54.64 2k6z s HIS 46 Cb -0.19 -1.22 0.03 0.00 1.11 0.00 0.00 32.58 32.31 2k6z s HIS 46 CO 0.02 0.49 0.38 -1.83 -0.85 0.00 0.00 174.74 172.95 2k6z s GLU 47 N -2.65 2.28 -0.28 1.40 -1.05 0.09 -0.89 118.70 117.60 2k6z s GLU 47 Ca 0.22 -1.97 0.01 0.00 -0.15 0.00 0.00 54.97 53.08 2k6z s GLU 47 Cb -0.09 -2.11 0.16 0.00 -0.44 0.00 0.00 34.13 31.65 2k6z s GLU 47 CO 0.12 -0.55 0.43 0.99 0.95 0.00 0.00 175.26 177.19 2k6z s THR 48 N -2.74 -0.67 0.34 1.83 2.01 0.39 -2.65 115.64 114.15 2k6z s THR 48 Ca 0.35 -0.20 0.08 0.00 0.31 0.00 0.00 61.69 62.23 2k6z s THR 48 Cb -0.02 -0.95 -0.03 0.00 0.01 0.00 0.00 72.50 71.51 2k6z s THR 48 CO 0.22 -0.21 0.27 0.72 -0.69 0.00 0.00 174.62 174.93 2k6z s PHE 49 N 2.58 2.86 0.08 4.92 -0.12 -0.13 -4.28 117.98 123.88 2k6z s PHE 49 Ca 0.11 -0.32 0.01 0.00 -0.05 0.00 0.00 56.93 56.68 2k6z s PHE 49 Cb -0.13 -1.78 -0.04 0.00 -0.63 0.00 0.00 43.02 40.44 2k6z s PHE 49 CO -0.26 0.20 0.18 -1.64 -0.05 0.00 0.00 175.22 173.66 2k6z s MET 50 N -3.97 3.28 0.08 1.99 -1.94 -1.26 -1.13 119.30 116.35 2k6z s MET 50 Ca 0.41 -0.53 -0.22 0.00 -1.71 0.00 0.00 55.69 53.63 2k6z s MET 50 Cb -0.05 -2.94 0.06 0.00 2.01 0.00 0.00 34.83 33.90 2k6z s MET 50 CO 0.26 0.59 0.54 0.50 -0.01 0.00 0.00 175.02 176.89 2k6z s ARG 51 N -2.56 1.11 0.02 2.03 3.00 -0.23 -4.90 118.95 117.41 2k6z s ARG 51 Ca 0.33 -0.32 0.03 0.00 -1.00 0.00 0.00 55.73 54.77 2k6z s ARG 51 Cb -0.13 0.51 -0.04 0.00 0.00 0.00 0.00 34.95 35.29 2k6z s ARG 51 CO 0.26 -0.43 -0.02 -2.00 0.00 0.00 0.00 175.30 173.12 2k6z s GLU 52 N -2.88 2.67 -0.18 5.12 2.56 -1.26 -0.23 118.70 124.50 2k6z s GLU 52 Ca -0.03 -0.69 -0.14 0.00 0.00 0.00 0.00 54.97 54.11 2k6z s GLU 52 Cb -0.00 -2.60 0.05 0.00 2.00 0.00 0.00 34.13 33.58 2k6z s GLU 52 CO -0.05 0.60 0.47 0.54 -0.56 0.00 0.00 175.26 176.26 2k6z s VAL 53 N -1.11 -0.01 -0.97 3.70 0.11 -0.13 -4.93 120.40 117.06 2k6z s VAL 53 Ca 0.20 0.03 0.00 0.00 -2.93 0.00 0.00 61.98 59.28 2k6z s VAL 53 Cb -0.11 -0.67 0.00 0.00 -1.53 0.00 0.00 36.38 34.07 2k6z s VAL 53 CO 0.11 0.01 0.00 1.21 -3.33 0.00 0.00 175.10 173.10 2k6z n GLU 54 N 3.32 -1.02 -1.04 1.54 2.13 -1.26 -1.03 120.64 123.28 2k6z n GLU 54 Ca -0.17 0.77 -0.01 0.00 0.66 0.00 0.00 57.16 58.41 2k6z n GLU 54 Cb 0.56 -4.79 -0.01 0.00 0.27 0.00 0.00 31.44 27.48 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 -1.10 0.51 3.17 8.31 0.00 -1.26 -5.04 105.19 109.78 2k6z n GLY 55 Ca -0.09 -0.74 -0.32 0.00 0.00 0.00 0.00 46.02 44.87 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 -1.66 2.90 -0.11 1.61 -0.14 -0.20 -5.10 119.74 117.04 2k6z s LYS 56 Ca 0.00 -0.82 -0.30 0.00 -1.36 0.00 0.00 55.97 53.50 2k6z s LYS 56 Cb 0.00 -2.30 -0.03 0.00 -1.68 0.00 0.00 37.83 33.82 2k6z s LYS 56 CO 0.00 0.04 1.35 0.15 -0.76 0.00 0.00 175.35 176.13 2k6z s LYS 57 N 0.68 4.24 0.41 1.68 -0.14 -1.26 -0.96 119.74 124.40 2k6z s LYS 57 Ca -0.11 1.80 0.05 0.00 -1.36 0.00 0.00 55.97 56.35 2k6z s LYS 57 Cb -0.16 -3.76 -0.02 0.00 -1.68 0.00 0.00 37.83 32.21 2k6z s LYS 57 CO 0.02 -0.69 0.18 0.14 -0.76 0.00 0.00 175.35 174.24 2k6z s VAL 58 N 3.31 0.39 0.31 3.17 -7.23 0.68 -4.98 120.40 116.05 2k6z s VAL 58 Ca 0.59 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.79 2k6z s VAL 58 Cb -0.25 -2.31 -0.06 0.00 0.56 0.00 0.00 36.38 34.31 2k6z s VAL 58 CO 0.20 0.00 0.07 -0.04 -0.31 0.00 0.00 175.10 175.02 2k6z s MET 59 N -3.60 1.58 0.32 4.82 -1.94 -1.26 -1.07 119.30 118.15 2k6z s MET 59 Ca 0.25 -1.87 -0.08 0.00 -1.71 0.00 0.00 55.69 52.28 2k6z s MET 59 Cb 0.01 -0.65 0.03 0.00 2.01 0.00 0.00 34.83 36.23 2k6z s MET 59 CO 0.18 -0.23 0.56 0.41 -0.01 0.00 0.00 175.02 175.93 2k6z n GLY 60 N -0.62 1.59 3.09 -0.03 0.00 -0.29 -4.89 105.19 104.04 2k6z n GLY 60 Ca -0.02 -1.36 -0.11 0.00 0.00 0.00 0.00 46.02 44.54 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 -2.31 0.46 0.03 1.61 1.75 -1.26 -0.96 119.30 118.62 2k6z s MET 61 Ca 0.18 -0.45 -0.27 0.00 -1.25 0.00 0.00 55.69 53.90 2k6z s MET 61 Cb -0.03 0.19 0.07 0.00 2.84 0.00 0.00 34.83 37.90 2k6z s MET 61 CO 0.13 -0.11 0.62 -0.98 -0.65 0.00 0.00 175.02 174.04 2k6z s ARG 62 N -1.46 1.12 0.68 4.11 1.70 -1.08 -4.99 118.95 119.03 2k6z s ARG 62 Ca -0.15 -0.05 -0.11 0.00 -0.47 0.00 0.00 55.73 54.95 2k6z s ARG 62 Cb -0.08 0.52 -0.00 0.00 -0.57 0.00 0.00 34.95 34.82 2k6z s ARG 62 CO 0.01 -0.40 1.06 -1.25 -1.08 0.00 0.00 175.30 173.63 2k6z s PRO 63 N -2.18 3.05 0.02 3.89 0.04 -1.26 -0.73 135.00 137.83 2k6z s PRO 63 Ca -0.06 0.93 -0.12 0.00 0.04 0.00 0.00 61.00 61.79 2k6z s PRO 63 Cb -0.00 -2.00 0.01 0.00 0.04 0.00 0.00 34.50 32.54 2k6z s PRO 63 CO 0.01 -1.01 0.24 0.14 0.04 0.00 0.00 177.00 176.42 2k6z s VAL 64 N -3.05 0.08 -0.09 -0.36 -7.23 0.32 -4.79 120.40 105.30 2k6z s VAL 64 Ca 0.58 -0.69 0.14 0.00 -1.81 0.00 0.00 61.98 60.19 2k6z s VAL 64 Cb -0.14 -0.76 -0.07 0.00 0.56 0.00 0.00 36.38 35.98 2k6z s VAL 64 CO 0.54 -0.38 1.19 1.55 -0.31 0.00 0.00 175.10 177.69 2k6z h PRO 65 N 3.65 0.00 -1.24 4.82 0.13 -1.93 -3.42 132.00 134.01 2k6z h PRO 65 Ca -0.31 0.00 0.34 0.00 -0.87 0.00 0.00 66.00 65.16 2k6z h PRO 65 Cb 1.19 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.16 2k6z h PRO 65 CO 0.44 0.54 0.91 -0.59 -0.23 0.00 0.00 178.00 179.07 2k6z s PHE 66 N -2.88 -0.04 0.15 1.56 -0.12 -1.26 -4.74 117.98 110.65 2k6z s PHE 66 Ca 0.01 -0.01 0.06 0.00 -0.05 0.00 0.00 56.93 56.95 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 0.78 -0.13 0.01 -0.51 -0.05 0.00 0.00 175.22 175.32 2k6z s LEU 67 N -2.66 3.39 0.09 -1.99 1.43 0.22 -4.99 118.68 114.17 2k6z s LEU 67 Ca 0.13 -0.31 0.09 0.00 -1.03 0.00 0.00 54.13 53.01 2k6z s LEU 67 Cb 0.04 -2.07 -0.04 0.00 0.03 0.00 0.00 46.19 44.15 2k6z s LEU 67 CO -0.05 0.11 -0.22 -0.70 0.23 0.00 0.00 176.35 175.72 2k6z s GLU 68 N -2.78 1.76 -0.01 1.70 2.56 -1.26 -0.27 118.70 120.41 2k6z s GLU 68 Ca 0.27 -1.16 -0.00 0.00 0.00 0.00 0.00 54.97 54.08 2k6z s GLU 68 Cb -0.10 -2.05 0.00 0.00 2.00 0.00 0.00 34.13 33.98 2k6z s GLU 68 CO 0.19 0.49 0.02 0.08 -0.56 0.00 0.00 175.26 175.48 2k6z s VAL 69 N -0.99 -0.01 0.51 3.70 1.01 0.64 -4.97 120.40 120.30 2k6z s VAL 69 Ca 0.15 0.02 -0.11 0.00 0.00 0.00 0.00 61.98 62.03 2k6z s VAL 69 Cb -0.10 -0.04 -0.06 0.00 0.00 0.00 0.00 36.38 36.18 2k6z s VAL 69 CO 0.06 0.01 0.91 -2.16 0.00 0.00 0.00 175.10 173.92 2k6z s PRO 70 N 0.11 3.73 0.55 2.72 0.04 -1.26 -2.15 135.00 138.74 2k6z s PRO 70 Ca -0.01 0.65 -0.21 0.00 0.04 0.00 0.00 61.00 61.46 2k6z s PRO 70 Cb -0.01 -2.22 -0.05 0.00 0.04 0.00 0.00 34.50 32.26 2k6z s PRO 70 CO -0.00 -0.29 1.34 -1.25 0.04 0.00 0.00 177.00 176.83 2k6z s PRO 71 N -4.46 3.13 0.00 0.56 0.04 -1.26 -2.87 135.00 130.15 2k6z s PRO 71 Ca 0.54 2.18 0.00 0.00 0.04 0.00 0.00 61.00 63.76 2k6z s PRO 71 Cb -0.10 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.21 2k6z s PRO 71 CO 0.40 -1.18 0.00 1.63 0.04 0.00 0.00 177.00 177.89 2k6z n LYS 72 N -1.07 0.00 -1.81 4.56 4.76 0.02 -5.00 118.16 119.62 2k6z n LYS 72 Ca 0.11 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.25 2k6z n LYS 72 Cb 0.46 -3.03 0.08 0.00 -1.84 0.00 0.00 35.03 30.69 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 -0.12 0.72 0.00 -1.14 -4.88 107.32 101.52 2k6z s GLY 73 Ca 0.00 -0.45 -0.08 0.00 0.00 0.00 0.00 44.72 44.18 2k6z s GLY 73 CO 0.00 -0.01 0.30 -1.60 0.00 0.00 0.00 173.10 171.78 2k6z s ARG 74 N -5.40 0.31 -0.33 2.90 3.52 -1.26 -0.78 118.95 117.90 2k6z s ARG 74 Ca 0.60 0.51 0.03 0.00 -0.13 0.00 0.00 55.73 56.75 2k6z s ARG 74 Cb -0.12 0.04 0.16 0.00 -1.56 0.00 0.00 34.95 33.48 2k6z s ARG 74 CO 0.51 -0.10 0.45 0.08 -0.81 0.00 0.00 175.30 175.43 2k6z s VAL 75 N 0.71 -0.64 0.72 7.11 1.01 0.17 -5.00 120.40 124.47 2k6z s VAL 75 Ca -0.05 -0.40 -0.11 0.00 0.00 0.00 0.00 61.98 61.43 2k6z s VAL 75 Cb -0.06 -0.77 0.02 0.00 0.00 0.00 0.00 36.38 35.58 2k6z s VAL 75 CO -0.05 -0.30 1.07 -1.61 0.00 0.00 0.00 175.10 174.22 2k6z s GLU 76 N 2.19 2.74 -0.87 2.72 8.01 -1.26 -4.01 118.70 128.22 2k6z s GLU 76 Ca 0.12 0.97 -0.25 0.00 0.01 0.00 0.00 54.97 55.82 2k6z s GLU 76 Cb -0.12 -1.97 -0.07 0.00 -4.31 0.00 0.00 34.13 27.67 2k6z s GLU 76 CO -0.20 -1.24 2.06 -0.51 0.01 0.00 0.00 175.26 175.38 2k6z s LEU 77 N -5.63 3.09 0.13 1.80 1.02 0.37 -4.92 118.68 114.53 2k6z s LEU 77 Ca 0.59 -0.48 -0.33 0.00 0.02 0.00 0.00 54.13 53.93 2k6z s LEU 77 Cb -0.15 -2.56 -0.18 0.00 0.02 0.00 0.00 46.19 43.33 2k6z s LEU 77 CO 0.55 -3.03 0.87 2.29 0.02 0.00 0.00 176.35 177.05 2k6z n LYS 78 N 8.85 0.31 0.14 1.70 0.00 -1.26 -4.60 118.16 123.30 2k6z n LYS 78 Ca 0.42 0.11 0.05 0.00 -0.00 0.00 0.00 58.31 58.89 2k6z n LYS 78 Cb 0.46 -1.40 0.51 0.00 -0.00 0.00 0.00 35.03 34.60 2k6z n LYS 78 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.40 176.40 2k6z h PRO 79 N 2.25 0.23 -4.15 -1.58 0.13 -1.91 -3.25 132.00 123.72 2k6z h PRO 79 Ca -0.40 -0.02 -0.76 0.00 -0.87 0.00 0.00 66.00 63.96 2k6z h PRO 79 Cb 1.41 -0.05 -0.24 0.00 0.13 0.00 0.00 31.00 32.26 2k6z h PRO 79 CO 0.63 0.20 -0.01 0.20 -0.23 0.00 0.00 178.00 178.78 2k6z s GLY 80 N -3.94 2.21 0.00 1.56 0.00 -1.26 -4.77 107.32 101.13 2k6z s GLY 80 Ca -0.06 -2.75 0.00 0.00 0.00 0.00 0.00 44.72 41.91 2k6z s GLY 80 CO 0.70 1.32 0.00 0.61 0.00 0.00 0.00 173.10 175.73 2k6z n GLY 81 N 4.86 1.20 2.97 0.20 0.00 -1.23 -5.04 105.19 108.15 2k6z n GLY 81 Ca -0.03 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.74 0.12 -0.09 1.61 1.51 -1.24 -0.46 117.35 118.06 2k6z s TYR 82 Ca 0.00 -0.25 -0.30 0.00 -1.01 0.00 0.00 57.07 55.51 2k6z s TYR 82 Cb 0.00 -0.10 0.07 0.00 -0.11 0.00 0.00 41.96 41.83 2k6z s TYR 82 CO 0.00 -0.14 0.71 -3.38 -1.11 0.00 0.00 175.55 171.63 2k6z s HIS 83 N -0.90 -0.66 -0.20 2.71 -3.43 -0.07 -4.45 115.29 108.28 2k6z s HIS 83 Ca -0.10 1.23 -0.29 0.00 -0.80 0.00 0.00 55.06 55.10 2k6z s HIS 83 Cb -0.06 0.39 0.00 0.00 -1.43 0.00 0.00 32.58 31.48 2k6z s HIS 83 CO -0.00 -0.55 1.06 -0.06 -2.00 0.00 0.00 174.74 173.18 2k6z s PHE 84 N -0.92 3.32 -0.04 0.38 0.08 -0.50 -1.11 117.98 119.19 2k6z s PHE 84 Ca -0.09 1.45 -0.30 0.00 0.12 0.00 0.00 56.93 58.11 2k6z s PHE 84 Cb -0.01 -3.28 -0.03 0.00 -0.57 0.00 0.00 43.02 39.14 2k6z s PHE 84 CO 0.08 -0.56 1.04 1.41 -0.10 0.00 0.00 175.22 177.09 2k6z s MET 85 N 3.03 4.47 -0.09 0.44 -2.45 0.60 -0.73 119.30 124.57 2k6z s MET 85 Ca 0.46 1.47 0.01 0.00 -1.25 0.00 0.00 55.69 56.39 2k6z s MET 85 Cb -0.16 -3.49 -0.02 0.00 1.25 0.00 0.00 34.83 32.40 2k6z s MET 85 CO 0.09 -0.22 -0.13 -0.51 1.05 0.00 0.00 175.02 175.29 2k6z s LEU 86 N 1.56 2.75 -0.04 4.11 1.43 0.45 -0.69 118.68 128.25 2k6z s LEU 86 Ca 0.52 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 53.37 2k6z s LEU 86 Cb -0.21 -1.59 0.02 0.00 0.03 0.00 0.00 46.19 44.44 2k6z s LEU 86 CO 0.23 0.25 -0.04 -0.76 0.23 0.00 0.00 176.35 176.27 2k6z s LEU 87 N -0.15 1.38 0.00 1.79 1.02 -0.15 -1.23 118.68 121.34 2k6z s LEU 87 Ca -0.01 -0.10 0.00 0.00 0.02 0.00 0.00 54.13 54.04 2k6z s LEU 87 Cb -0.13 -0.38 0.00 0.00 0.02 0.00 0.00 46.19 45.70 2k6z s LEU 87 CO 0.03 -0.05 0.00 0.61 0.02 0.00 0.00 176.35 176.97 2k6z n GLY 88 N 3.92 0.49 3.48 -3.19 0.00 -0.16 -1.29 105.19 108.43 2k6z n GLY 88 Ca -0.25 -0.40 -0.35 0.00 0.00 0.00 0.00 46.02 45.02 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 -0.79 0.99 -0.00 0.99 4.77 -1.12 -1.24 117.00 120.60 2k6z n LEU 89 Ca 0.00 0.51 0.05 0.00 -0.03 0.00 0.00 56.01 56.55 2k6z n LEU 89 Cb 0.41 -1.25 -0.07 0.00 -2.33 0.00 0.00 43.42 40.18 2k6z n LEU 89 CO 0.00 -3.08 -0.22 0.29 -1.33 0.00 0.00 177.39 173.05 2k6z n LYS 90 N -1.32 2.50 -3.85 3.23 4.76 -0.94 -4.87 118.16 117.68 2k6z n LYS 90 Ca 0.09 -0.03 -0.13 0.00 -2.87 0.00 0.00 58.31 55.38 2k6z n LYS 90 Cb 0.51 -1.08 -0.14 0.00 -1.84 0.00 0.00 35.03 32.48 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 -2.24 0.01 0.22 1.97 1.81 -1.26 -5.07 118.95 114.39 2k6z s ARG 91 Ca 0.01 0.05 -0.30 0.00 -1.72 0.00 0.00 55.73 53.78 2k6z s ARG 91 Cb 0.08 -0.04 -0.08 0.00 -0.45 0.00 0.00 34.95 34.45 2k6z s ARG 91 CO 0.44 -0.03 1.05 -1.25 -0.68 0.00 0.00 175.30 174.83 2k6z s PRO 92 N 0.21 4.67 0.10 3.54 0.04 -1.26 -4.86 135.00 137.45 2k6z s PRO 92 Ca -0.02 1.67 -0.14 0.00 0.04 0.00 0.00 61.00 62.56 2k6z s PRO 92 Cb -0.03 -3.26 -0.06 0.00 0.04 0.00 0.00 34.50 31.19 2k6z s PRO 92 CO -0.01 0.23 0.49 -0.51 0.04 0.00 0.00 177.00 177.24 2k6z s LEU 93 N -0.84 4.38 0.00 -3.56 2.01 -0.48 -4.95 118.68 115.25 2k6z s LEU 93 Ca 0.46 1.01 0.00 0.00 0.01 0.00 0.00 54.13 55.60 2k6z s LEU 93 Cb -0.29 -3.04 0.00 0.00 0.01 0.00 0.00 46.19 42.87 2k6z s LEU 93 CO 0.36 0.18 0.00 0.29 1.01 0.00 0.00 176.35 178.18 2k6z n LYS 94 N 1.09 1.70 -4.36 1.70 4.76 -1.26 -4.38 118.16 117.42 2k6z n LYS 94 Ca -0.08 0.00 -0.33 0.00 -2.87 0.00 0.00 58.31 55.03 2k6z n LYS 94 Cb 0.52 0.00 -0.09 0.00 -1.84 0.00 0.00 35.03 33.62 2k6z n LYS 94 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2k6z s ALA 95 N -2.83 3.23 0.00 7.82 0.00 -1.26 -4.68 121.76 124.04 2k6z s ALA 95 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 51.96 51.05 2k6z s ALA 95 Cb 0.00 -1.35 0.00 0.00 0.00 0.00 0.00 23.12 21.77 2k6z s ALA 95 CO 0.00 0.62 0.00 0.41 0.00 0.00 0.00 175.76 176.79 2k6z n GLY 96 N 1.68 0.95 2.48 0.00 0.00 -0.30 -4.99 105.19 105.01 2k6z n GLY 96 Ca -0.16 -0.53 -0.18 0.00 0.00 0.00 0.00 46.02 45.14 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 -0.74 1.02 -3.76 1.61 1.02 -1.22 -4.96 120.64 113.60 2k6z n GLU 97 Ca 0.00 -2.31 -0.13 0.00 -0.02 0.00 0.00 57.16 54.70 2k6z n GLU 97 Cb 0.33 0.36 -0.12 0.00 -0.02 0.00 0.00 31.44 31.98 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 -3.41 0.24 -0.02 3.49 2.02 -1.26 0.00 118.70 119.76 2k6z s GLU 98 Ca 0.15 0.43 -0.05 0.00 0.02 0.00 0.00 54.97 55.51 2k6z s GLU 98 Cb -0.01 0.01 0.01 0.00 0.10 0.00 0.00 34.13 34.23 2k6z s GLU 98 CO 0.09 -0.10 0.12 0.08 0.02 0.00 0.00 175.26 175.48 2k6z s VAL 99 N 0.69 0.04 -0.00 2.63 1.01 -0.21 -4.93 120.40 119.64 2k6z s VAL 99 Ca -0.05 -0.33 -0.02 0.00 0.00 0.00 0.00 61.98 61.58 2k6z s VAL 99 Cb -0.06 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.99 2k6z s VAL 99 CO -0.04 -0.18 0.14 -1.83 0.00 0.00 0.00 175.10 173.19 2k6z s GLU 100 N -0.60 3.28 -0.02 2.72 1.03 -1.26 -1.23 118.70 122.63 2k6z s GLU 100 Ca -0.07 -0.40 0.07 0.00 0.03 0.00 0.00 54.97 54.60 2k6z s GLU 100 Cb -0.04 -2.99 -0.02 0.00 -0.80 0.00 0.00 34.13 30.28 2k6z s GLU 100 CO 0.01 0.66 -0.22 -0.51 -1.33 0.00 0.00 175.26 173.86 2k6z s LEU 101 N -1.91 2.05 0.13 1.83 1.02 -0.24 -4.50 118.68 117.05 2k6z s LEU 101 Ca 0.26 -0.41 -0.30 0.00 0.02 0.00 0.00 54.13 53.70 2k6z s LEU 101 Cb -0.12 -1.15 -0.06 0.00 0.02 0.00 0.00 46.19 44.87 2k6z s LEU 101 CO 0.18 0.27 0.97 -1.81 0.02 0.00 0.00 176.35 175.97 2k6z s ASP 102 N -0.54 7.50 -0.24 2.29 1.01 0.34 -0.67 116.67 126.36 2k6z s ASP 102 Ca 0.09 1.82 -0.09 0.00 0.71 0.00 0.00 52.55 55.08 2k6z s ASP 102 Cb -0.09 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.21 2k6z s ASP 102 CO -0.01 -0.05 0.12 -0.76 0.21 0.00 0.00 175.17 174.68 2k6z s LEU 103 N -0.13 3.86 -0.50 1.23 1.02 0.43 -1.29 118.68 123.30 2k6z s LEU 103 Ca 0.47 -0.00 -0.18 0.00 0.02 0.00 0.00 54.13 54.44 2k6z s LEU 103 Cb -0.24 -2.03 0.07 0.00 0.02 0.00 0.00 46.19 44.01 2k6z s LEU 103 CO 0.30 0.04 0.54 -0.76 0.02 0.00 0.00 176.35 176.49 2k6z s LEU 104 N 1.21 5.30 -0.17 1.79 1.43 -0.16 -2.48 118.68 125.60 2k6z s LEU 104 Ca 0.06 -1.15 -0.14 0.00 -1.03 0.00 0.00 54.13 51.87 2k6z s LEU 104 Cb -0.14 -2.33 -0.05 0.00 0.03 0.00 0.00 46.19 43.71 2k6z s LEU 104 CO 0.05 -0.82 0.30 -0.36 0.23 0.00 0.00 176.35 175.75 2k6z s PHE 105 N 2.22 3.43 -1.74 0.29 0.08 0.05 -0.37 117.98 121.95 2k6z s PHE 105 Ca 0.10 0.57 -0.19 0.00 0.12 0.00 0.00 56.93 57.53 2k6z s PHE 105 Cb -0.22 -2.37 0.17 0.00 -0.57 0.00 0.00 43.02 40.03 2k6z s PHE 105 CO 0.09 0.18 0.72 0.00 -0.10 0.00 0.00 175.22 176.11 2k6z n ALA 106 N 3.79 -1.29 0.00 5.36 0.00 0.62 -1.78 120.51 127.21 2k6z n ALA 106 Ca -0.11 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2k6z n ALA 106 Cb 0.52 -3.16 0.00 0.00 0.00 0.00 0.00 19.45 16.80 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 -1.36 1.38 0.20 0.00 0.00 -1.26 -4.65 105.19 99.49 2k6z n GLY 107 Ca 0.07 -0.42 0.12 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.70 3.57 -0.02 0.00 -1.20 -4.81 105.19 102.03 2k6z n GLY 108 Ca 0.00 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.14 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 3.43 -0.16 1.61 1.02 -0.74 -4.92 119.74 117.30 2k6z s LYS 109 Ca 0.18 0.09 -0.08 0.00 0.02 0.00 0.00 55.97 56.17 2k6z s LYS 109 Cb 0.18 -4.05 -0.04 0.00 -0.52 0.00 0.00 37.83 33.39 2k6z s LYS 109 CO 0.61 -1.75 0.13 0.08 -0.92 0.00 0.00 175.35 173.51 2k6z s VAL 110 N 4.99 5.46 -0.22 3.17 1.01 -1.26 -0.77 120.40 132.78 2k6z s VAL 110 Ca 0.40 0.20 -0.12 0.00 0.00 0.00 0.00 61.98 62.46 2k6z s VAL 110 Cb -0.08 -3.43 0.07 0.00 0.00 0.00 0.00 36.38 32.93 2k6z s VAL 110 CO 0.23 0.53 0.53 -0.22 0.00 0.00 0.00 175.10 176.17 2k6z s LEU 111 N -0.35 -0.47 0.12 3.92 0.20 -1.03 -5.00 118.68 116.08 2k6z s LEU 111 Ca 0.12 1.16 0.03 0.00 0.69 0.00 0.00 54.13 56.13 2k6z s LEU 111 Cb -0.12 1.80 -0.04 0.00 -0.43 0.00 0.00 46.19 47.40 2k6z s LEU 111 CO 0.01 -0.21 0.19 -1.59 -0.29 0.00 0.00 176.35 174.46 2k6z s LYS 112 N 1.51 3.18 0.18 1.98 -2.85 -1.26 -0.42 119.74 122.06 2k6z s LYS 112 Ca -0.10 -0.67 0.05 0.00 -1.00 0.00 0.00 55.97 54.26 2k6z s LYS 112 Cb -0.07 -2.84 -0.05 0.00 -2.06 0.00 0.00 37.83 32.81 2k6z s LYS 112 CO -0.16 0.53 -0.09 0.08 0.10 0.00 0.00 175.35 175.82 2k6z s VAL 113 N -1.64 1.29 0.05 1.79 1.01 0.16 -4.96 120.40 118.10 2k6z s VAL 113 Ca 0.33 -2.09 0.04 0.00 0.00 0.00 0.00 61.98 60.25 2k6z s VAL 113 Cb -0.11 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 2k6z s VAL 113 CO 0.26 -0.61 -0.04 -0.69 0.00 0.00 0.00 175.10 174.02 2k6z s VAL 114 N -3.25 3.84 -0.16 2.92 1.01 -1.26 -1.08 120.40 122.41 2k6z s VAL 114 Ca 0.21 -0.88 -0.14 0.00 0.00 0.00 0.00 61.98 61.17 2k6z s VAL 114 Cb 0.03 -2.75 0.04 0.00 0.00 0.00 0.00 36.38 33.70 2k6z s VAL 114 CO 0.04 0.26 0.42 -1.48 0.00 0.00 0.00 175.10 174.34 2k6z s LEU 115 N -1.85 0.31 0.76 3.92 2.34 -0.36 -4.83 118.68 118.96 2k6z s LEU 115 Ca 0.21 0.85 -0.11 0.00 0.06 0.00 0.00 54.13 55.15 2k6z s LEU 115 Cb -0.11 1.42 0.05 0.00 -0.56 0.00 0.00 46.19 46.98 2k6z s LEU 115 CO 0.13 -0.15 1.08 -2.16 -1.06 0.00 0.00 176.35 174.18 2k6z s PRO 116 N 0.44 2.41 -0.18 1.48 0.04 -1.26 -1.04 135.00 136.89 2k6z s PRO 116 Ca -0.02 1.01 -0.06 0.00 0.04 0.00 0.00 61.00 61.98 2k6z s PRO 116 Cb -0.04 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.54 2k6z s PRO 116 CO -0.02 -1.49 0.02 0.08 0.04 0.00 0.00 177.00 175.63 2k6z s VAL 117 N -2.98 4.29 -0.05 -0.36 1.01 0.10 -0.37 120.40 122.04 2k6z s VAL 117 Ca 0.60 -0.21 -0.19 0.00 0.00 0.00 0.00 61.98 62.18 2k6z s VAL 117 Cb -0.16 -2.92 0.04 0.00 0.00 0.00 0.00 36.38 33.34 2k6z s VAL 117 CO 0.56 0.46 0.42 -0.70 0.00 0.00 0.00 175.10 175.84 2k6z s GLU 118 N 0.56 0.74 -0.92 2.72 2.12 -0.69 -1.15 118.70 122.08 2k6z s GLU 118 Ca 0.00 0.05 -0.24 0.00 0.36 0.00 0.00 54.97 55.14 2k6z s GLU 118 Cb -0.14 0.34 0.01 0.00 0.26 0.00 0.00 34.13 34.61 2k6z s GLU 118 CO 0.02 -0.20 1.60 0.00 -0.54 0.00 0.00 175.26 176.14 2k6z s ALA 119 N -1.05 2.38 0.00 6.30 0.00 -1.26 -4.29 121.76 123.83 2k6z s ALA 119 Ca -0.11 -1.82 0.00 0.00 0.00 0.00 0.00 51.96 50.03 2k6z s ALA 119 Cb -0.04 -4.49 0.00 0.00 0.00 0.00 0.00 23.12 18.60 2k6z s ALA 119 CO 0.05 -3.94 0.45 0.54 0.00 0.00 0.00 175.76 172.87