#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 0.00 1.61 7.64 -1.26 -5.18 113.62 116.43 2k6z n SER 2 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2k6z n SER 2 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2k6z n SER 2 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 2k6z n PHE 3 N -0.89 0.00 -3.75 1.43 7.35 -1.26 -5.12 117.46 115.22 2k6z n PHE 3 Ca 0.00 0.00 -0.32 0.00 -0.76 0.00 0.00 57.45 56.37 2k6z n PHE 3 Cb 0.00 0.00 -0.05 0.00 0.35 0.00 0.00 39.48 39.78 2k6z n PHE 3 CO 0.00 0.00 0.00 -0.08 -0.76 0.00 0.00 176.76 175.92 2k6z s THR 4 N -3.65 5.25 -0.41 -2.13 -1.32 -1.26 -4.19 115.64 107.93 2k6z s THR 4 Ca 0.00 0.00 0.10 0.00 -1.21 0.00 0.00 61.69 60.58 2k6z s THR 4 Cb 0.00 -3.61 0.35 0.00 -1.51 0.00 0.00 72.50 67.74 2k6z s THR 4 CO 0.00 0.17 1.00 -1.84 -2.21 0.00 0.00 174.62 171.75 2k6z n GLU 5 N 0.48 1.04 -3.57 7.08 0.28 -0.97 -5.04 120.64 119.94 2k6z n GLU 5 Ca -0.06 -2.54 -0.10 0.00 -0.16 0.00 0.00 57.16 54.30 2k6z n GLU 5 Cb 0.52 -1.15 0.01 0.00 1.43 0.00 0.00 31.44 32.25 2k6z n GLU 5 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2k6z n GLY 6 N 0.16 1.50 3.25 -1.84 0.00 -1.26 -4.33 105.19 102.68 2k6z n GLY 6 Ca 0.11 -1.36 -0.14 0.00 0.00 0.00 0.00 46.02 44.63 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 -3.01 1.27 0.15 1.61 -2.14 -0.89 -4.26 118.94 111.67 2k6z s TRP 7 Ca 0.19 -0.78 -0.14 0.00 2.66 0.00 0.00 56.10 58.03 2k6z s TRP 7 Cb -0.03 -0.65 -0.07 0.00 -3.10 0.00 0.00 33.47 29.62 2k6z s TRP 7 CO 0.14 0.06 0.55 0.08 -2.66 0.00 0.00 176.95 175.12 2k6z s VAL 8 N -3.35 4.85 0.18 -0.66 1.01 0.09 -1.46 120.40 121.08 2k6z s VAL 8 Ca 0.17 0.82 -0.07 0.00 0.00 0.00 0.00 61.98 62.90 2k6z s VAL 8 Cb 0.03 -3.73 -0.06 0.00 0.00 0.00 0.00 36.38 32.62 2k6z s VAL 8 CO 0.01 0.22 0.46 -0.60 0.00 0.00 0.00 175.10 175.19 2k6z s ARG 9 N -2.01 3.70 0.30 2.72 3.00 0.38 -1.22 118.95 125.82 2k6z s ARG 9 Ca 0.39 0.08 -0.29 0.00 -1.00 0.00 0.00 55.73 54.90 2k6z s ARG 9 Cb -0.15 -2.75 -0.10 0.00 0.00 0.00 0.00 34.95 31.95 2k6z s ARG 9 CO 0.19 0.39 1.21 0.12 0.00 0.00 0.00 175.30 177.21 2k6z s PHE 10 N -1.74 3.31 -0.30 5.12 5.36 -0.77 -4.29 117.98 124.67 2k6z s PHE 10 Ca 0.44 1.54 -0.26 0.00 -0.96 0.00 0.00 56.93 57.69 2k6z s PHE 10 Cb -0.12 -3.49 0.20 0.00 -0.34 0.00 0.00 43.02 39.28 2k6z s PHE 10 CO 0.23 -1.23 1.48 0.45 -1.46 0.00 0.00 175.22 174.69 2k6z s SER 11 N -0.63 -0.00 0.49 6.13 0.15 -1.00 -4.83 113.70 114.00 2k6z s SER 11 Ca 0.47 0.00 0.28 0.00 0.70 0.00 0.00 55.95 57.40 2k6z s SER 11 Cb -0.36 0.00 0.91 0.00 -1.71 0.00 0.00 66.02 64.86 2k6z s SER 11 CO 0.47 -0.00 1.81 1.55 1.20 0.00 0.00 173.24 178.27 2k6z h PRO 12 N 2.76 0.00 0.00 5.44 0.13 -1.89 0.54 132.00 138.99 2k6z h PRO 12 Ca -0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 2k6z h PRO 12 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2k6z h PRO 12 CO 0.19 0.06 0.00 0.41 -0.23 0.00 0.00 178.00 178.44 2k6z n GLY 13 N 0.45 1.90 0.13 1.56 0.00 -1.26 -4.23 105.19 103.73 2k6z n GLY 13 Ca 0.02 -1.94 0.13 0.00 0.00 0.00 0.00 46.02 44.22 2k6z n GLY 13 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k6z h PRO 14 N 0.00 0.00 -5.38 1.61 0.13 -1.96 -3.48 132.00 122.91 2k6z h PRO 14 Ca 0.00 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.73 2k6z h PRO 14 Cb 0.00 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 30.99 2k6z h PRO 14 CO 0.00 0.00 -0.73 0.54 -0.23 0.00 0.00 178.00 177.58 2k6z s ASN 15 N -4.76 2.28 0.37 1.44 2.20 -1.26 -1.04 114.94 114.16 2k6z s ASN 15 Ca 0.09 -1.01 0.04 0.00 -0.94 0.00 0.00 52.86 51.04 2k6z s ASN 15 Cb 0.11 -0.09 -0.01 0.00 -2.00 0.00 0.00 41.25 39.26 2k6z s ASN 15 CO 0.59 -0.23 0.14 0.00 -2.94 0.00 0.00 177.10 174.66 2k6z n ALA 16 N -0.30 0.53 -2.46 3.54 0.00 -0.17 -4.73 120.51 116.94 2k6z n ALA 16 Ca -0.09 -1.88 -0.22 0.00 0.00 0.00 0.00 53.44 51.25 2k6z n ALA 16 Cb 0.60 1.29 -0.10 0.00 0.00 0.00 0.00 19.45 21.24 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 -3.02 2.44 -0.11 0.00 0.00 -1.26 -0.76 121.76 119.05 2k6z s ALA 17 Ca 0.20 -1.85 -0.01 0.00 0.00 0.00 0.00 51.96 50.30 2k6z s ALA 17 Cb 0.01 0.71 0.03 0.00 0.00 0.00 0.00 23.12 23.87 2k6z s ALA 17 CO 0.14 -0.33 -0.03 0.00 0.00 0.00 0.00 175.76 175.54 2k6z s ALA 18 N -3.32 1.06 -0.99 0.00 0.00 0.17 -0.47 121.76 118.22 2k6z s ALA 18 Ca 0.34 -0.41 -0.01 0.00 0.00 0.00 0.00 51.96 51.87 2k6z s ALA 18 Cb 0.07 -0.89 0.32 0.00 0.00 0.00 0.00 23.12 22.62 2k6z s ALA 18 CO 0.15 -0.53 1.63 0.66 0.00 0.00 0.00 175.76 177.67 2k6z n TYR 19 N 5.03 2.76 -2.89 0.00 4.01 -0.53 -2.66 117.16 122.88 2k6z n TYR 19 Ca -0.10 -2.73 -0.26 0.00 -0.16 0.00 0.00 57.90 54.65 2k6z n TYR 19 Cb 0.50 -1.13 -0.00 0.00 -0.31 0.00 0.00 39.34 38.39 2k6z n TYR 19 CO 0.00 0.00 0.00 -0.48 -0.46 0.00 0.00 176.86 175.92 2k6z s LEU 20 N -3.80 3.76 -0.07 7.72 0.05 -1.20 -2.09 118.68 123.05 2k6z s LEU 20 Ca 0.38 0.77 0.01 0.00 0.05 0.00 0.00 54.13 55.34 2k6z s LEU 20 Cb 0.16 -3.69 0.02 0.00 -2.05 0.00 0.00 46.19 40.63 2k6z s LEU 20 CO -0.06 -0.48 -0.09 -0.89 -0.55 0.00 0.00 176.35 174.27 2k6z s THR 21 N -2.60 0.98 0.53 5.48 2.01 -1.26 -0.59 115.64 120.19 2k6z s THR 21 Ca 0.45 -0.36 0.00 0.00 0.31 0.00 0.00 61.69 62.10 2k6z s THR 21 Cb -0.10 -0.93 -0.00 0.00 0.01 0.00 0.00 72.50 71.48 2k6z s THR 21 CO 0.42 0.33 0.01 -0.76 -0.69 0.00 0.00 174.62 173.93 2k6z s LEU 22 N 0.95 2.21 0.26 4.42 2.01 -0.27 -2.30 118.68 125.95 2k6z s LEU 22 Ca -0.10 -1.69 0.06 0.00 0.01 0.00 0.00 54.13 52.41 2k6z s LEU 22 Cb -0.15 -0.72 -0.05 0.00 0.01 0.00 0.00 46.19 45.28 2k6z s LEU 22 CO 0.00 -0.92 -0.06 -1.61 1.01 0.00 0.00 176.35 174.77 2k6z s GLU 23 N -3.91 1.46 -1.02 1.70 2.02 -1.26 0.02 118.70 117.72 2k6z s GLU 23 Ca 0.02 -1.73 -0.07 0.00 0.02 0.00 0.00 54.97 53.21 2k6z s GLU 23 Cb 0.00 -1.03 0.25 0.00 0.10 0.00 0.00 34.13 33.46 2k6z s GLU 23 CO 0.01 0.03 0.97 1.21 0.02 0.00 0.00 175.26 177.51 2k6z s ASN 24 N -3.39 6.87 0.41 -0.19 3.04 -0.09 -4.76 114.94 116.82 2k6z s ASN 24 Ca 0.28 -3.53 0.29 0.00 0.04 0.00 0.00 52.86 49.94 2k6z s ASN 24 Cb 0.03 -2.12 1.16 0.00 -1.54 0.00 0.00 41.25 38.79 2k6z s ASN 24 CO 0.10 -0.29 1.85 1.55 -3.04 0.00 0.00 177.10 177.27 2k6z h PRO 25 N 6.60 0.00 -7.28 0.43 0.13 -1.93 0.15 132.00 130.10 2k6z h PRO 25 Ca 0.16 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.79 2k6z h PRO 25 Cb 0.88 0.00 0.08 0.00 0.13 0.00 0.00 31.00 32.09 2k6z h PRO 25 CO 0.94 0.00 0.37 0.20 -0.23 0.00 0.00 178.00 179.28 2k6z s GLY 26 N -3.88 1.84 0.00 1.56 0.00 -1.26 -4.79 107.32 100.79 2k6z s GLY 26 Ca 0.03 0.20 0.20 0.00 0.00 0.00 0.00 44.72 45.15 2k6z s GLY 26 CO 0.48 0.51 1.61 1.22 0.00 0.00 0.00 173.10 176.92 2k6z n ASP 27 N -2.71 0.99 -4.40 1.64 8.00 -1.26 -3.38 116.55 115.43 2k6z n ASP 27 Ca 0.08 -1.59 -0.22 0.00 0.71 0.00 0.00 54.79 53.76 2k6z n ASP 27 Cb 0.53 -0.06 -0.11 0.00 -0.02 0.00 0.00 41.12 41.47 2k6z n ASP 27 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2k6z s LEU 28 N -1.57 2.52 0.22 0.64 1.02 -1.26 -4.80 118.68 115.44 2k6z s LEU 28 Ca 0.30 -0.96 -0.25 0.00 0.02 0.00 0.00 54.13 53.24 2k6z s LEU 28 Cb 0.15 -0.94 -0.09 0.00 0.02 0.00 0.00 46.19 45.34 2k6z s LEU 28 CO 0.24 -0.02 0.82 -2.16 0.02 0.00 0.00 176.35 175.26 2k6z s PRO 29 N -3.25 4.56 0.25 1.29 0.04 -1.26 -4.31 135.00 132.32 2k6z s PRO 29 Ca 0.23 1.19 -0.11 0.00 0.04 0.00 0.00 61.00 62.35 2k6z s PRO 29 Cb -0.05 -3.11 -0.08 0.00 0.04 0.00 0.00 34.50 31.31 2k6z s PRO 29 CO 0.10 0.48 0.59 -0.51 0.04 0.00 0.00 177.00 177.70 2k6z s LEU 30 N -1.47 4.14 -0.34 -3.56 1.43 -0.62 -4.94 118.68 113.32 2k6z s LEU 30 Ca 0.40 1.00 0.00 0.00 -1.03 0.00 0.00 54.13 54.50 2k6z s LEU 30 Cb -0.22 -3.77 0.11 0.00 0.03 0.00 0.00 46.19 42.34 2k6z s LEU 30 CO 0.26 -0.10 0.13 -0.60 0.23 0.00 0.00 176.35 176.26 2k6z s ARG 31 N -2.86 0.88 -0.45 1.70 3.52 -1.26 -0.31 118.95 120.17 2k6z s ARG 31 Ca 0.49 -1.33 -0.29 0.00 -0.13 0.00 0.00 55.73 54.47 2k6z s ARG 31 Cb -0.11 -2.13 0.02 0.00 -1.56 0.00 0.00 34.95 31.18 2k6z s ARG 31 CO 0.20 -1.03 1.20 -1.17 -0.81 0.00 0.00 175.30 173.70 2k6z s LEU 32 N 1.29 3.65 -0.16 -0.88 0.20 0.15 -0.18 118.68 122.76 2k6z s LEU 32 Ca 0.12 0.61 0.19 0.00 0.69 0.00 0.00 54.13 55.73 2k6z s LEU 32 Cb -0.19 -3.55 -0.27 0.00 -0.43 0.00 0.00 46.19 41.75 2k6z s LEU 32 CO -0.18 -1.26 0.17 1.33 -0.29 0.00 0.00 176.35 176.11 2k6z n VAL 33 N 6.81 1.05 -3.32 1.68 0.24 0.25 -0.18 118.33 124.86 2k6z n VAL 33 Ca 0.13 -0.77 -0.03 0.00 -2.04 0.00 0.00 64.34 61.63 2k6z n VAL 33 Cb 0.49 -0.35 0.01 0.00 -1.47 0.00 0.00 33.84 32.51 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 1.64 1.57 3.36 7.63 0.00 -1.15 -4.60 105.19 113.65 2k6z n GLY 34 Ca -0.26 -1.10 -0.17 0.00 0.00 0.00 0.00 46.02 44.50 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 -1.41 1.35 0.20 4.61 0.00 -1.26 -0.84 121.76 124.40 2k6z s ALA 35 Ca 0.06 -1.81 -0.04 0.00 0.00 0.00 0.00 51.96 50.17 2k6z s ALA 35 Cb -0.02 1.34 -0.03 0.00 0.00 0.00 0.00 23.12 24.41 2k6z s ALA 35 CO 0.04 -0.71 0.21 1.03 0.00 0.00 0.00 175.76 176.34 2k6z s ARG 36 N -3.37 1.25 -0.16 0.00 0.52 -0.69 -4.83 118.95 111.68 2k6z s ARG 36 Ca 0.36 -1.49 -0.30 0.00 -0.52 0.00 0.00 55.73 53.78 2k6z s ARG 36 Cb 0.02 0.32 0.13 0.00 0.52 0.00 0.00 34.95 35.93 2k6z s ARG 36 CO 0.23 -0.44 1.00 -0.08 0.02 0.00 0.00 175.30 176.03 2k6z s THR 37 N -4.10 0.00 -0.74 0.02 -1.32 -1.26 -0.76 115.64 107.47 2k6z s THR 37 Ca 0.32 0.00 0.26 0.00 -1.21 0.00 0.00 61.69 61.06 2k6z s THR 37 Cb 0.05 -1.00 0.28 0.00 -1.51 0.00 0.00 72.50 70.32 2k6z s THR 37 CO 0.09 0.00 1.78 -0.81 -2.21 0.00 0.00 174.62 173.48 2k6z n PRO 38 N 0.69 0.25 -1.01 7.08 -0.04 -1.26 -3.80 135.00 136.91 2k6z n PRO 38 Ca -0.10 0.20 -0.06 0.00 -0.04 0.00 0.00 63.50 63.51 2k6z n PRO 38 Cb 0.58 -1.79 0.30 0.00 -0.04 0.00 0.00 33.50 32.55 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 -2.23 2.92 -3.90 0.52 0.24 -1.26 -4.64 118.33 109.98 2k6z n VAL 39 Ca 0.06 -1.70 -0.09 0.00 -2.04 0.00 0.00 64.34 60.56 2k6z n VAL 39 Cb 0.43 -0.36 -0.07 0.00 -1.47 0.00 0.00 33.84 32.37 2k6z n VAL 39 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k6z s ALA 40 N -3.01 -0.12 -0.19 2.33 0.00 -1.25 -2.37 121.76 117.15 2k6z s ALA 40 Ca 0.55 -0.73 -0.10 0.00 0.00 0.00 0.00 51.96 51.68 2k6z s ALA 40 Cb 0.44 0.61 -0.20 0.00 0.00 0.00 0.00 23.12 23.97 2k6z s ALA 40 CO 0.13 -0.55 0.10 -1.91 0.00 0.00 0.00 175.76 173.53 2k6z n GLU 41 N -0.11 0.66 -4.24 0.00 2.13 0.43 -4.82 120.64 114.69 2k6z n GLU 41 Ca -0.12 0.32 -0.14 0.00 0.66 0.00 0.00 57.16 57.88 2k6z n GLU 41 Cb 0.63 -1.65 -0.10 0.00 0.27 0.00 0.00 31.44 30.59 2k6z n GLU 41 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 2k6z s ARG 42 N -2.49 1.03 0.03 5.31 1.70 -1.10 -5.05 118.95 118.39 2k6z s ARG 42 Ca -0.29 -1.42 0.09 0.00 -0.47 0.00 0.00 55.73 53.64 2k6z s ARG 42 Cb 0.08 -0.60 -0.03 0.00 -0.57 0.00 0.00 34.95 33.83 2k6z s ARG 42 CO 0.65 0.07 -0.26 0.54 -1.08 0.00 0.00 175.30 175.22 2k6z s VAL 43 N -3.25 2.15 0.11 4.99 0.11 -1.26 -1.13 120.40 122.12 2k6z s VAL 43 Ca 0.16 -1.33 0.09 0.00 -2.93 0.00 0.00 61.98 57.97 2k6z s VAL 43 Cb 0.02 -1.82 -0.04 0.00 -1.53 0.00 0.00 36.38 33.01 2k6z s VAL 43 CO 0.00 0.40 -0.21 -1.61 -3.33 0.00 0.00 175.10 170.36 2k6z s GLU 44 N -1.14 1.70 -0.27 1.54 2.02 0.00 -4.91 118.70 117.65 2k6z s GLU 44 Ca 0.12 -1.20 -0.10 0.00 0.02 0.00 0.00 54.97 53.80 2k6z s GLU 44 Cb -0.10 -2.05 -0.05 0.00 0.10 0.00 0.00 34.13 32.03 2k6z s GLU 44 CO 0.02 0.48 0.17 -1.17 0.02 0.00 0.00 175.26 174.77 2k6z s LEU 45 N -2.01 3.95 0.22 1.80 2.96 -1.26 -0.53 118.68 123.81 2k6z s LEU 45 Ca 0.16 -0.02 0.10 0.00 -0.22 0.00 0.00 54.13 54.15 2k6z s LEU 45 Cb -0.10 -2.09 -0.05 0.00 0.50 0.00 0.00 46.19 44.45 2k6z s LEU 45 CO 0.08 -0.03 -0.19 -1.00 -1.32 0.00 0.00 176.35 173.89 2k6z s HIS 46 N 1.63 2.05 0.58 5.38 3.76 0.11 -0.59 115.29 128.22 2k6z s HIS 46 Ca 0.07 -0.42 0.07 0.00 -0.15 0.00 0.00 55.06 54.63 2k6z s HIS 46 Cb -0.16 -0.95 0.08 0.00 1.11 0.00 0.00 32.58 32.66 2k6z s HIS 46 CO 0.09 0.51 0.80 -1.83 -0.85 0.00 0.00 174.74 173.46 2k6z s GLU 47 N -3.24 2.27 -0.06 1.40 -1.05 0.22 -0.77 118.70 117.47 2k6z s GLU 47 Ca 0.23 -1.45 -0.17 0.00 -0.15 0.00 0.00 54.97 53.43 2k6z s GLU 47 Cb -0.05 -2.60 0.04 0.00 -0.44 0.00 0.00 34.13 31.08 2k6z s GLU 47 CO 0.10 -0.88 0.40 0.99 0.95 0.00 0.00 175.26 176.82 2k6z s THR 48 N -2.72 0.03 0.35 1.83 2.01 -0.97 -3.46 115.64 112.71 2k6z s THR 48 Ca 0.62 -0.28 -0.16 0.00 0.31 0.00 0.00 61.69 62.18 2k6z s THR 48 Cb -0.06 -0.67 0.06 0.00 0.01 0.00 0.00 72.50 71.84 2k6z s THR 48 CO 0.39 -0.15 0.83 2.22 -0.69 0.00 0.00 174.62 177.22 2k6z n PHE 49 N 1.63 -2.15 -4.30 4.92 1.16 -0.48 -4.27 117.46 113.98 2k6z n PHE 49 Ca -0.19 -1.71 -0.31 0.00 -1.87 0.00 0.00 57.45 53.36 2k6z n PHE 49 Cb 0.56 0.85 -0.09 0.00 -1.61 0.00 0.00 39.48 39.19 2k6z n PHE 49 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2k6z s MET 50 N -2.08 2.52 0.05 3.97 0.23 -1.26 -1.14 119.30 121.60 2k6z s MET 50 Ca 0.17 -0.79 0.04 0.00 -1.03 0.00 0.00 55.69 54.09 2k6z s MET 50 Cb -0.04 -2.51 -0.02 0.00 -1.53 0.00 0.00 34.83 30.72 2k6z s MET 50 CO 0.10 0.57 -0.12 1.03 -2.03 0.00 0.00 175.02 174.57 2k6z s ARG 51 N -1.83 0.76 0.00 3.16 1.81 0.48 -4.88 118.95 118.45 2k6z s ARG 51 Ca 0.21 -0.82 -0.01 0.00 -1.72 0.00 0.00 55.73 53.39 2k6z s ARG 51 Cb -0.11 -0.71 -0.00 0.00 -0.45 0.00 0.00 34.95 33.67 2k6z s ARG 51 CO 0.12 0.16 0.01 -2.00 -0.68 0.00 0.00 175.30 172.91 2k6z s GLU 52 N -1.47 0.11 0.00 3.54 -6.30 -1.26 -1.00 118.70 112.31 2k6z s GLU 52 Ca -0.03 -0.16 0.00 0.00 -2.50 0.00 0.00 54.97 52.28 2k6z s GLU 52 Cb -0.09 0.04 0.00 0.00 0.00 0.00 0.00 34.13 34.08 2k6z s GLU 52 CO 0.01 -0.02 0.20 1.33 0.02 0.00 0.00 175.26 176.80 2k6z n VAL 53 N 2.64 0.00 -1.13 3.70 0.24 -1.26 -4.99 118.33 117.53 2k6z n VAL 53 Ca -0.15 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.15 2k6z n VAL 53 Cb 0.58 1.05 0.00 0.00 -1.47 0.00 0.00 33.84 34.00 2k6z n VAL 53 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 2k6z n GLU 54 N 0.00 0.00 -0.37 7.34 2.13 -1.26 -4.95 120.64 123.53 2k6z n GLU 54 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2k6z n GLU 54 Cb 0.39 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.10 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 0.00 1.65 2.96 8.31 0.00 -1.26 -4.94 105.19 111.91 2k6z n GLY 55 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2k6z n GLY 55 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k6z n LYS 56 N -2.00 4.29 -1.68 1.61 5.02 -1.26 -5.00 118.16 119.14 2k6z n LYS 56 Ca 0.00 -4.30 -0.48 0.00 -2.02 0.00 0.00 58.31 51.50 2k6z n LYS 56 Cb 0.00 -2.61 -0.05 0.00 -0.02 0.00 0.00 35.03 32.35 2k6z n LYS 56 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2k6z n LYS 57 N 1.91 2.21 -3.83 1.97 5.02 -1.26 -4.55 118.16 119.64 2k6z n LYS 57 Ca 0.30 0.81 -0.12 0.00 -2.02 0.00 0.00 58.31 57.28 2k6z n LYS 57 Cb 0.34 -2.66 -0.11 0.00 -0.02 0.00 0.00 35.03 32.57 2k6z n LYS 57 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2k6z s VAL 58 N 4.11 0.04 0.75 -0.18 0.11 -0.17 -5.01 120.40 120.04 2k6z s VAL 58 Ca 0.93 -0.30 -0.10 0.00 -2.93 0.00 0.00 61.98 59.58 2k6z s VAL 58 Cb -0.68 -0.36 0.06 0.00 -1.53 0.00 0.00 36.38 33.87 2k6z s VAL 58 CO 0.51 -0.17 1.10 -0.04 -3.33 0.00 0.00 175.10 173.17 2k6z s MET 59 N -0.58 2.19 0.35 1.54 -1.94 -1.26 -0.39 119.30 119.21 2k6z s MET 59 Ca -0.07 0.01 -0.12 0.00 -1.71 0.00 0.00 55.69 53.81 2k6z s MET 59 Cb -0.04 -2.05 0.03 0.00 2.01 0.00 0.00 34.83 34.77 2k6z s MET 59 CO 0.01 -1.36 0.65 0.20 -0.01 0.00 0.00 175.02 174.50 2k6z s GLY 60 N -4.52 0.71 -0.05 -0.03 0.00 -0.29 -4.76 107.32 98.38 2k6z s GLY 60 Ca 0.60 -0.97 -0.25 0.00 0.00 0.00 0.00 44.72 44.11 2k6z s GLY 60 CO 0.48 -0.55 0.55 -0.29 0.00 0.00 0.00 173.10 173.29 2k6z s MET 61 N -2.90 0.90 0.05 2.90 1.75 -1.26 -1.39 119.30 119.35 2k6z s MET 61 Ca 0.21 0.16 -0.15 0.00 -1.25 0.00 0.00 55.69 54.66 2k6z s MET 61 Cb -0.03 0.42 0.02 0.00 2.84 0.00 0.00 34.83 38.08 2k6z s MET 61 CO 0.14 -0.26 0.33 1.03 -0.65 0.00 0.00 175.02 175.61 2k6z s ARG 62 N -1.11 0.86 0.63 4.11 0.52 -1.23 -5.01 118.95 117.72 2k6z s ARG 62 Ca -0.11 -0.50 -0.15 0.00 -0.52 0.00 0.00 55.73 54.45 2k6z s ARG 62 Cb -0.02 0.37 -0.02 0.00 0.52 0.00 0.00 34.95 35.81 2k6z s ARG 62 CO 0.07 -0.29 1.07 -1.25 0.02 0.00 0.00 175.30 174.92 2k6z s PRO 63 N -2.68 3.13 0.03 3.54 0.04 -1.26 -0.61 135.00 137.19 2k6z s PRO 63 Ca -0.04 1.19 -0.02 0.00 0.04 0.00 0.00 61.00 62.16 2k6z s PRO 63 Cb -0.00 -2.01 -0.02 0.00 0.04 0.00 0.00 34.50 32.51 2k6z s PRO 63 CO -0.04 -0.96 0.02 0.14 0.04 0.00 0.00 177.00 176.19 2k6z s VAL 64 N -2.56 0.14 -0.24 -0.36 -7.23 0.24 -4.76 120.40 105.64 2k6z s VAL 64 Ca 0.63 -1.17 0.18 0.00 -1.81 0.00 0.00 61.98 59.81 2k6z s VAL 64 Cb -0.16 -0.77 0.12 0.00 0.56 0.00 0.00 36.38 36.13 2k6z s VAL 64 CO 0.42 -0.64 1.42 1.55 -0.31 0.00 0.00 175.10 177.53 2k6z h PRO 65 N 3.96 0.00 -1.35 4.82 0.13 -1.93 -3.42 132.00 134.22 2k6z h PRO 65 Ca -0.33 0.00 0.28 0.00 -0.87 0.00 0.00 66.00 65.09 2k6z h PRO 65 Cb 1.18 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.12 2k6z h PRO 65 CO 0.50 0.32 0.86 -0.59 -0.23 0.00 0.00 178.00 178.86 2k6z s PHE 66 N -3.05 -0.09 0.24 1.56 -0.71 -1.26 -4.75 117.98 109.92 2k6z s PHE 66 Ca 0.04 0.05 0.07 0.00 -1.04 0.00 0.00 56.93 56.05 2k6z s PHE 66 Cb 0.07 0.51 -0.04 0.00 -1.21 0.00 0.00 43.02 42.35 2k6z s PHE 66 CO 0.73 -0.15 0.17 -0.51 -1.34 0.00 0.00 175.22 174.12 2k6z s LEU 67 N -2.17 3.77 0.06 -1.99 1.43 0.75 -4.99 118.68 115.53 2k6z s LEU 67 Ca 0.10 -0.25 0.04 0.00 -1.03 0.00 0.00 54.13 52.99 2k6z s LEU 67 Cb -0.01 -2.32 -0.03 0.00 0.03 0.00 0.00 46.19 43.87 2k6z s LEU 67 CO -0.04 -0.02 -0.11 -0.70 0.23 0.00 0.00 176.35 175.71 2k6z s GLU 68 N -3.69 0.69 -0.05 1.70 2.12 -1.26 -0.67 118.70 117.54 2k6z s GLU 68 Ca 0.32 -0.87 -0.04 0.00 0.36 0.00 0.00 54.97 54.74 2k6z s GLU 68 Cb -0.08 -0.60 0.02 0.00 0.26 0.00 0.00 34.13 33.73 2k6z s GLU 68 CO 0.24 0.13 0.13 0.08 -0.54 0.00 0.00 175.26 175.30 2k6z s VAL 69 N -1.32 -0.01 0.60 3.70 1.01 0.58 -4.98 120.40 119.98 2k6z s VAL 69 Ca -0.05 0.02 -0.14 0.00 0.00 0.00 0.00 61.98 61.81 2k6z s VAL 69 Cb -0.10 -0.20 -0.04 0.00 0.00 0.00 0.00 36.38 36.04 2k6z s VAL 69 CO 0.01 0.01 1.04 -2.16 0.00 0.00 0.00 175.10 174.00 2k6z s PRO 70 N 0.22 3.43 0.39 2.72 0.04 -1.26 -1.59 135.00 138.94 2k6z s PRO 70 Ca -0.01 1.02 -0.28 0.00 0.04 0.00 0.00 61.00 61.78 2k6z s PRO 70 Cb -0.02 -2.05 -0.11 0.00 0.04 0.00 0.00 34.50 32.36 2k6z s PRO 70 CO -0.01 -0.71 1.48 -1.25 0.04 0.00 0.00 177.00 176.56 2k6z s PRO 71 N -4.44 4.04 0.00 0.56 0.04 -1.26 -2.11 135.00 131.83 2k6z s PRO 71 Ca 0.60 2.56 0.00 0.00 0.04 0.00 0.00 61.00 64.20 2k6z s PRO 71 Cb -0.13 -2.92 0.00 0.00 0.04 0.00 0.00 34.50 31.49 2k6z s PRO 71 CO 0.42 -0.58 0.00 1.63 0.04 0.00 0.00 177.00 178.50 2k6z n LYS 72 N 0.35 -0.43 -1.81 4.56 4.01 0.52 -4.98 118.16 120.37 2k6z n LYS 72 Ca 0.02 0.11 -0.30 0.00 -0.51 0.00 0.00 58.31 57.62 2k6z n LYS 72 Cb 0.40 -4.19 0.21 0.00 -0.51 0.00 0.00 35.03 30.93 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 1.79 -0.21 0.72 0.00 -0.90 -4.74 107.32 101.98 2k6z s GLY 73 Ca 0.00 -1.29 -0.07 0.00 0.00 0.00 0.00 44.72 43.37 2k6z s GLY 73 CO 0.00 -0.44 0.05 0.50 0.00 0.00 0.00 173.10 173.21 2k6z s ARG 74 N -5.89 3.75 -1.18 2.90 1.81 -1.26 -0.92 118.95 118.16 2k6z s ARG 74 Ca 0.76 -0.45 -0.08 0.00 -1.72 0.00 0.00 55.73 54.24 2k6z s ARG 74 Cb -0.03 -3.21 0.23 0.00 -0.45 0.00 0.00 34.95 31.49 2k6z s ARG 74 CO 0.54 0.02 1.57 0.28 -0.68 0.00 0.00 175.30 177.03 2k6z n VAL 75 N 4.27 4.72 -4.03 3.52 0.31 0.10 -4.95 118.33 122.28 2k6z n VAL 75 Ca -0.16 -5.13 -0.33 0.00 -0.01 0.00 0.00 64.34 58.70 2k6z n VAL 75 Cb 0.52 -2.31 -0.15 0.00 -0.91 0.00 0.00 33.84 30.99 2k6z n VAL 75 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 2k6z s GLU 76 N -0.81 2.74 -1.28 5.55 2.12 -1.26 -1.11 118.70 124.65 2k6z s GLU 76 Ca 0.36 -1.02 -0.12 0.00 0.36 0.00 0.00 54.97 54.54 2k6z s GLU 76 Cb 0.03 -2.86 0.14 0.00 0.26 0.00 0.00 34.13 31.71 2k6z s GLU 76 CO 0.03 -0.39 1.75 1.28 -0.54 0.00 0.00 175.26 177.40 2k6z n LEU 77 N 4.60 5.99 -4.76 2.70 4.32 0.25 -4.87 117.00 125.22 2k6z n LEU 77 Ca -0.17 -4.43 -0.37 0.00 -0.02 0.00 0.00 56.01 51.01 2k6z n LEU 77 Cb 0.47 -1.58 0.01 0.00 -1.62 0.00 0.00 43.42 40.70 2k6z n LEU 77 CO 0.25 0.98 0.88 -1.59 -1.22 0.00 0.00 177.39 176.69 2k6z s LYS 78 N 1.60 3.44 0.56 3.23 0.00 -1.14 -3.47 119.74 123.96 2k6z s LYS 78 Ca 0.43 1.93 -0.21 0.00 0.00 0.00 0.00 55.97 58.12 2k6z s LYS 78 Cb 0.05 -2.28 -0.04 0.00 0.00 0.00 0.00 37.83 35.56 2k6z s LYS 78 CO 0.00 -0.86 1.34 -1.25 0.00 0.00 0.00 175.35 174.58 2k6z s PRO 79 N -2.86 3.05 0.00 1.78 0.04 -1.26 -2.30 135.00 133.45 2k6z s PRO 79 Ca 0.68 2.18 0.00 0.00 0.04 0.00 0.00 61.00 63.90 2k6z s PRO 79 Cb -0.33 -2.18 0.00 0.00 0.04 0.00 0.00 34.50 32.04 2k6z s PRO 79 CO 0.39 -1.24 0.00 0.41 0.04 0.00 0.00 177.00 176.59 2k6z n GLY 80 N 0.74 1.85 0.00 0.56 0.00 -1.26 -4.91 105.19 102.17 2k6z n GLY 80 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -2.00 3.67 3.75 -0.02 0.00 -0.97 -4.23 105.19 105.39 2k6z n GLY 81 Ca 0.00 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.33 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 2.67 3.53 0.01 1.61 2.02 -1.22 -2.30 117.35 123.67 2k6z s TYR 82 Ca 0.00 1.62 -0.29 0.00 -0.37 0.00 0.00 57.07 58.04 2k6z s TYR 82 Cb 0.00 -3.32 0.07 0.00 -0.40 0.00 0.00 41.96 38.31 2k6z s TYR 82 CO 0.00 -0.72 0.66 -3.38 -1.57 0.00 0.00 175.55 170.54 2k6z s HIS 83 N -0.82 -0.62 0.22 2.71 -3.43 0.05 -2.88 115.29 110.53 2k6z s HIS 83 Ca 0.47 0.87 -0.30 0.00 -0.80 0.00 0.00 55.06 55.30 2k6z s HIS 83 Cb -0.32 0.46 -0.09 0.00 -1.43 0.00 0.00 32.58 31.20 2k6z s HIS 83 CO 0.40 -0.68 0.93 -0.06 -2.00 0.00 0.00 174.74 173.33 2k6z s PHE 84 N -1.97 3.97 -0.27 0.38 0.08 -1.09 -0.71 117.98 118.36 2k6z s PHE 84 Ca -0.07 1.89 -0.11 0.00 0.12 0.00 0.00 56.93 58.76 2k6z s PHE 84 Cb -0.00 -2.97 -0.05 0.00 -0.57 0.00 0.00 43.02 39.43 2k6z s PHE 84 CO 0.03 0.44 0.17 1.41 -0.10 0.00 0.00 175.22 177.17 2k6z s MET 85 N -1.06 3.93 -0.29 0.44 1.75 0.31 -0.65 119.30 123.72 2k6z s MET 85 Ca 0.41 -0.33 -0.09 0.00 -1.25 0.00 0.00 55.69 54.42 2k6z s MET 85 Cb -0.26 -3.61 -0.02 0.00 2.84 0.00 0.00 34.83 33.79 2k6z s MET 85 CO 0.31 -0.16 0.14 -0.51 -0.65 0.00 0.00 175.02 174.16 2k6z s LEU 86 N 1.68 3.96 0.09 4.11 1.02 0.06 -0.82 118.68 128.78 2k6z s LEU 86 Ca 0.07 -0.37 0.09 0.00 0.02 0.00 0.00 54.13 53.94 2k6z s LEU 86 Cb -0.16 -2.01 -0.04 0.00 0.02 0.00 0.00 46.19 44.01 2k6z s LEU 86 CO 0.10 -0.14 -0.20 -0.76 0.02 0.00 0.00 176.35 175.37 2k6z s LEU 87 N 1.64 2.60 -0.25 1.79 1.02 -0.28 -1.00 118.68 124.19 2k6z s LEU 87 Ca 0.05 -0.54 -0.01 0.00 0.02 0.00 0.00 54.13 53.65 2k6z s LEU 87 Cb -0.16 -1.48 0.00 0.00 0.02 0.00 0.00 46.19 44.56 2k6z s LEU 87 CO 0.07 0.21 0.14 0.61 0.02 0.00 0.00 176.35 177.39 2k6z n GLY 88 N 1.10 0.55 3.36 -3.19 0.00 -0.20 -0.43 105.19 106.38 2k6z n GLY 88 Ca -0.16 -0.59 -0.38 0.00 0.00 0.00 0.00 46.02 44.89 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 -1.02 -1.21 -0.03 0.99 4.77 -1.21 -3.39 117.00 115.90 2k6z n LEU 89 Ca -0.01 0.62 -0.03 0.00 -0.03 0.00 0.00 56.01 56.56 2k6z n LEU 89 Cb 0.52 -1.05 -0.04 0.00 -2.33 0.00 0.00 43.42 40.52 2k6z n LEU 89 CO 0.09 -3.88 -0.70 0.29 -1.33 0.00 0.00 177.39 171.86 2k6z n LYS 90 N 0.47 2.66 -3.69 3.23 4.76 -1.00 -4.82 118.16 119.78 2k6z n LYS 90 Ca 0.09 0.00 -0.36 0.00 -2.87 0.00 0.00 58.31 55.17 2k6z n LYS 90 Cb 0.49 -1.15 -0.10 0.00 -1.84 0.00 0.00 35.03 32.43 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 -2.14 4.06 -0.22 1.97 1.81 -1.26 -5.03 118.95 118.14 2k6z s ARG 91 Ca -0.04 -0.28 -0.29 0.00 -1.72 0.00 0.00 55.73 53.41 2k6z s ARG 91 Cb 0.02 -3.50 -0.04 0.00 -0.45 0.00 0.00 34.95 30.98 2k6z s ARG 91 CO 0.23 0.08 1.91 -1.25 -0.68 0.00 0.00 175.30 175.59 2k6z s PRO 92 N 0.98 3.48 -0.07 3.54 0.04 -1.26 -4.89 135.00 136.82 2k6z s PRO 92 Ca 0.07 1.82 0.03 0.00 0.04 0.00 0.00 61.00 62.96 2k6z s PRO 92 Cb -0.13 -4.21 -0.02 0.00 0.04 0.00 0.00 34.50 30.17 2k6z s PRO 92 CO 0.04 -1.69 -0.14 -0.48 0.04 0.00 0.00 177.00 174.77 2k6z s LEU 93 N 6.65 2.75 0.20 -3.56 0.05 0.18 -4.89 118.68 120.05 2k6z s LEU 93 Ca 0.85 -0.22 0.03 0.00 0.05 0.00 0.00 54.13 54.84 2k6z s LEU 93 Cb -0.29 -1.57 -0.05 0.00 -2.05 0.00 0.00 46.19 42.23 2k6z s LEU 93 CO 0.34 0.31 -0.00 -0.54 -0.55 0.00 0.00 176.35 175.90 2k6z s LYS 94 N -0.51 1.22 -0.23 1.48 1.02 -1.26 -2.39 119.74 119.07 2k6z s LYS 94 Ca 0.07 -1.60 -0.29 0.00 0.02 0.00 0.00 55.97 54.17 2k6z s LYS 94 Cb -0.12 -0.44 -0.01 0.00 -0.52 0.00 0.00 37.83 36.74 2k6z s LYS 94 CO 0.02 -0.11 1.34 0.00 -0.92 0.00 0.00 175.35 175.68 2k6z s ALA 95 N -3.53 3.47 0.00 5.17 0.00 -1.26 -2.02 121.76 123.58 2k6z s ALA 95 Ca 0.26 0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.52 2k6z s ALA 95 Cb 0.06 -3.73 0.00 0.00 0.00 0.00 0.00 23.12 19.45 2k6z s ALA 95 CO 0.06 -1.57 0.00 0.41 0.00 0.00 0.00 175.76 174.66 2k6z n GLY 96 N 4.10 0.95 4.02 0.00 0.00 -1.13 -5.05 105.19 108.09 2k6z n GLY 96 Ca 0.15 -0.05 -0.21 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.54 2.08 0.04 1.61 2.02 -0.86 -4.98 118.70 118.08 2k6z s GLU 97 Ca 0.00 -1.52 0.01 0.00 0.02 0.00 0.00 54.97 53.49 2k6z s GLU 97 Cb 0.00 -2.55 -0.02 0.00 0.10 0.00 0.00 34.13 31.65 2k6z s GLU 97 CO 0.00 -1.07 -0.06 -1.21 0.02 0.00 0.00 175.26 172.94 2k6z s GLU 98 N -4.82 0.48 -0.03 1.61 2.02 -1.26 -0.33 118.70 116.37 2k6z s GLU 98 Ca 0.64 -0.76 -0.07 0.00 0.02 0.00 0.00 54.97 54.80 2k6z s GLU 98 Cb -0.05 -0.15 0.01 0.00 0.10 0.00 0.00 34.13 34.04 2k6z s GLU 98 CO 0.41 0.01 0.17 0.08 0.02 0.00 0.00 175.26 175.95 2k6z s VAL 99 N -1.60 0.04 -0.07 2.63 1.01 0.42 -4.87 120.40 117.96 2k6z s VAL 99 Ca -0.10 -0.33 -0.16 0.00 0.00 0.00 0.00 61.98 61.39 2k6z s VAL 99 Cb -0.09 -0.35 -0.05 0.00 0.00 0.00 0.00 36.38 35.89 2k6z s VAL 99 CO -0.01 -0.18 0.43 -0.70 0.00 0.00 0.00 175.10 174.64 2k6z s GLU 100 N -0.62 4.16 0.05 2.72 2.12 -1.26 -1.02 118.70 124.84 2k6z s GLU 100 Ca -0.07 0.40 0.06 0.00 0.36 0.00 0.00 54.97 55.72 2k6z s GLU 100 Cb -0.04 -3.34 -0.03 0.00 0.26 0.00 0.00 34.13 30.97 2k6z s GLU 100 CO 0.01 0.39 -0.14 -0.51 -0.54 0.00 0.00 175.26 174.48 2k6z s LEU 101 N -0.12 2.83 -0.11 2.70 2.01 -0.34 -4.08 118.68 121.56 2k6z s LEU 101 Ca 0.24 -0.36 -0.06 0.00 0.01 0.00 0.00 54.13 53.96 2k6z s LEU 101 Cb -0.16 -1.65 -0.04 0.00 0.01 0.00 0.00 46.19 44.36 2k6z s LEU 101 CO 0.11 0.24 0.11 -1.81 1.01 0.00 0.00 176.35 176.02 2k6z s ASP 102 N -1.61 6.16 -0.24 2.29 1.01 0.06 -0.49 116.67 123.86 2k6z s ASP 102 Ca 0.17 0.40 -0.08 0.00 0.71 0.00 0.00 52.55 53.75 2k6z s ASP 102 Cb -0.11 -1.95 -0.03 0.00 1.01 0.00 0.00 42.92 41.83 2k6z s ASP 102 CO 0.08 0.40 0.08 -0.76 0.21 0.00 0.00 175.17 175.18 2k6z s LEU 103 N -0.98 3.60 -0.36 1.23 1.02 0.12 -1.70 118.68 121.62 2k6z s LEU 103 Ca 0.15 -0.11 -0.17 0.00 0.02 0.00 0.00 54.13 54.01 2k6z s LEU 103 Cb -0.12 -1.96 -0.00 0.00 0.02 0.00 0.00 46.19 44.13 2k6z s LEU 103 CO 0.04 0.02 0.47 -0.76 0.02 0.00 0.00 176.35 176.14 2k6z s LEU 104 N 1.31 4.42 -0.30 1.79 1.43 -0.02 -2.06 118.68 125.25 2k6z s LEU 104 Ca 0.05 -0.15 -0.06 0.00 -1.03 0.00 0.00 54.13 52.94 2k6z s LEU 104 Cb -0.15 -2.51 0.02 0.00 0.03 0.00 0.00 46.19 43.59 2k6z s LEU 104 CO 0.04 -0.47 0.07 -0.36 0.23 0.00 0.00 176.35 175.86 2k6z s PHE 105 N 2.29 3.18 -1.04 0.29 0.08 0.17 -0.58 117.98 122.37 2k6z s PHE 105 Ca 0.16 -1.25 0.00 0.00 0.12 0.00 0.00 56.93 55.96 2k6z s PHE 105 Cb -0.16 -2.23 0.00 0.00 -0.57 0.00 0.00 43.02 40.06 2k6z s PHE 105 CO 0.13 -0.66 0.00 0.00 -0.10 0.00 0.00 175.22 174.59 2k6z n ALA 106 N 4.81 -0.77 -0.03 5.36 0.00 0.74 -1.98 120.51 128.64 2k6z n ALA 106 Ca -0.14 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2k6z n ALA 106 Cb 0.46 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.43 2k6z n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k6z n GLY 107 N -0.79 1.59 0.17 0.00 0.00 -1.26 -4.64 105.19 100.26 2k6z n GLY 107 Ca -0.14 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.13 3.08 -0.02 0.00 -1.20 -4.67 105.19 102.25 2k6z n GLY 108 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.66 0.80 0.02 1.61 1.02 -0.84 -5.05 119.74 115.65 2k6z s LYS 109 Ca 0.00 -0.57 0.03 0.00 0.02 0.00 0.00 55.97 55.45 2k6z s LYS 109 Cb 0.00 -0.76 -0.01 0.00 -0.52 0.00 0.00 37.83 36.53 2k6z s LYS 109 CO 0.00 0.19 -0.08 0.08 -0.92 0.00 0.00 175.35 174.62 2k6z s VAL 110 N -0.64 0.62 -0.06 3.17 1.01 -1.26 -0.66 120.40 122.58 2k6z s VAL 110 Ca 0.01 -0.70 -0.01 0.00 0.00 0.00 0.00 61.98 61.28 2k6z s VAL 110 Cb -0.06 -0.59 0.03 0.00 0.00 0.00 0.00 36.38 35.75 2k6z s VAL 110 CO 0.00 -0.08 0.00 -0.22 0.00 0.00 0.00 175.10 174.80 2k6z s LEU 111 N -0.86 0.77 -0.11 3.92 2.96 -0.87 -4.99 118.68 119.49 2k6z s LEU 111 Ca -0.02 -0.06 -0.06 0.00 -0.22 0.00 0.00 54.13 53.76 2k6z s LEU 111 Cb -0.06 -0.37 -0.04 0.00 0.50 0.00 0.00 46.19 46.22 2k6z s LEU 111 CO 0.00 -0.16 0.15 -1.59 -1.32 0.00 0.00 176.35 173.43 2k6z s LYS 112 N 1.65 3.44 -0.13 1.98 -2.85 -1.26 -0.70 119.74 121.87 2k6z s LYS 112 Ca -0.00 -0.15 -0.11 0.00 -1.00 0.00 0.00 55.97 54.70 2k6z s LYS 112 Cb -0.13 -3.18 0.04 0.00 -2.06 0.00 0.00 37.83 32.50 2k6z s LYS 112 CO -0.03 0.77 0.33 0.14 0.10 0.00 0.00 175.35 176.65 2k6z s VAL 113 N -1.07 -0.00 0.11 1.79 -7.23 0.35 -4.99 120.40 109.36 2k6z s VAL 113 Ca 0.17 0.02 -0.27 0.00 -1.81 0.00 0.00 61.98 60.09 2k6z s VAL 113 Cb -0.12 -0.47 -0.07 0.00 0.56 0.00 0.00 36.38 36.28 2k6z s VAL 113 CO 0.06 0.01 0.83 0.54 -0.31 0.00 0.00 175.10 176.22 2k6z s VAL 114 N 0.35 4.52 0.01 1.32 0.11 -1.26 -1.20 120.40 124.24 2k6z s VAL 114 Ca -0.01 1.79 0.02 0.00 -2.93 0.00 0.00 61.98 60.85 2k6z s VAL 114 Cb -0.03 -4.19 -0.01 0.00 -1.53 0.00 0.00 36.38 30.62 2k6z s VAL 114 CO -0.01 0.41 -0.07 -0.76 -3.33 0.00 0.00 175.10 171.34 2k6z s LEU 115 N -0.44 2.07 0.65 2.54 1.43 -0.19 -4.96 118.68 119.78 2k6z s LEU 115 Ca 0.40 -0.22 -0.15 0.00 -1.03 0.00 0.00 54.13 53.12 2k6z s LEU 115 Cb -0.22 -0.31 -0.00 0.00 0.03 0.00 0.00 46.19 45.68 2k6z s LEU 115 CO 0.26 0.02 1.11 -2.16 0.23 0.00 0.00 176.35 175.81 2k6z s PRO 116 N -0.50 2.83 -0.16 1.29 0.04 -1.26 -0.43 135.00 136.81 2k6z s PRO 116 Ca -0.00 1.39 -0.19 0.00 0.04 0.00 0.00 61.00 62.24 2k6z s PRO 116 Cb -0.04 -1.95 -0.03 0.00 0.04 0.00 0.00 34.50 32.51 2k6z s PRO 116 CO -0.00 -1.22 0.53 0.08 0.04 0.00 0.00 177.00 176.43 2k6z s VAL 117 N -2.33 5.12 0.07 -0.36 1.01 0.55 -0.73 120.40 123.73 2k6z s VAL 117 Ca 0.67 1.01 0.09 0.00 0.00 0.00 0.00 61.98 63.75 2k6z s VAL 117 Cb -0.20 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.28 2k6z s VAL 117 CO 0.41 0.22 -0.22 -1.61 0.00 0.00 0.00 175.10 173.91 2k6z s GLU 118 N 1.28 1.83 -1.35 2.72 2.02 -0.36 -2.83 118.70 122.01 2k6z s GLU 118 Ca 0.26 -1.12 -0.07 0.00 0.02 0.00 0.00 54.97 54.06 2k6z s GLU 118 Cb -0.15 -2.07 0.11 0.00 0.10 0.00 0.00 34.13 32.11 2k6z s GLU 118 CO 0.10 0.50 2.30 0.00 0.02 0.00 0.00 175.26 178.19 2k6z n ALA 119 N 1.32 6.44 0.69 5.21 0.00 -1.26 -1.85 120.51 131.07 2k6z n ALA 119 Ca -0.17 -4.09 0.08 0.00 0.00 0.00 0.00 53.44 49.27 2k6z n ALA 119 Cb 0.52 -2.92 0.07 0.00 0.00 0.00 0.00 19.45 17.12 2k6z n ALA 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04