#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 -1.82 1.61 7.64 -1.26 -4.70 113.62 115.09 2k6z n SER 2 Ca 0.00 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.82 2k6z n SER 2 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 2k6z n SER 2 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25 2k6z n PHE 3 N 14.00 -0.85 -1.33 1.43 -1.74 -1.26 -5.05 117.46 122.65 2k6z n PHE 3 Ca 0.00 -0.97 -0.38 0.00 -0.56 0.00 0.00 57.45 55.54 2k6z n PHE 3 Cb 0.00 0.23 -0.02 0.00 1.52 0.00 0.00 39.48 41.21 2k6z n PHE 3 CO 0.00 0.00 0.00 0.25 -0.56 0.00 0.00 176.76 176.45 2k6z n THR 4 N -0.24 3.75 -1.27 1.97 -2.24 -1.26 -4.73 114.28 110.26 2k6z n THR 4 Ca 0.00 -2.50 -0.37 0.00 -2.27 0.00 0.00 64.05 58.91 2k6z n THR 4 Cb 0.24 -2.54 -0.03 0.00 -2.10 0.00 0.00 70.33 65.90 2k6z n THR 4 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2k6z n GLU 5 N 4.45 3.48 -4.26 -0.78 0.28 -1.26 -4.81 120.64 117.73 2k6z n GLU 5 Ca 0.67 -2.14 -0.19 0.00 -0.16 0.00 0.00 57.16 55.34 2k6z n GLU 5 Cb 0.27 -2.79 -0.07 0.00 1.43 0.00 0.00 31.44 30.27 2k6z n GLU 5 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 2k6z s GLY 6 N 2.37 2.26 0.26 -1.84 0.00 -1.26 -4.48 107.32 104.63 2k6z s GLY 6 Ca 0.65 -2.02 -0.17 0.00 0.00 0.00 0.00 44.72 43.19 2k6z s GLY 6 CO -0.06 -1.41 0.58 0.66 0.00 0.00 0.00 173.10 172.87 2k6z s TRP 7 N -3.34 0.10 -0.08 1.90 -2.14 -0.59 -4.23 118.94 110.55 2k6z s TRP 7 Ca 0.39 -0.50 -0.03 0.00 2.66 0.00 0.00 56.10 58.63 2k6z s TRP 7 Cb 0.02 0.42 -0.03 0.00 -3.10 0.00 0.00 33.47 30.77 2k6z s TRP 7 CO 0.27 -1.09 0.03 0.08 -2.66 0.00 0.00 176.95 173.59 2k6z s VAL 8 N -3.97 4.58 -0.24 -0.66 1.01 -0.70 -1.37 120.40 119.05 2k6z s VAL 8 Ca 0.17 -0.18 0.28 0.00 0.00 0.00 0.00 61.98 62.25 2k6z s VAL 8 Cb -0.03 -2.95 0.33 0.00 0.00 0.00 0.00 36.38 33.73 2k6z s VAL 8 CO 0.07 0.58 1.83 -0.09 0.00 0.00 0.00 175.10 177.50 2k6z h ARG 9 N 5.02 0.00 -0.07 2.72 1.12 -1.47 -1.41 114.38 120.28 2k6z h ARG 9 Ca -0.51 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.36 2k6z h ARG 9 Cb 1.20 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.16 2k6z h ARG 9 CO 0.56 0.00 -0.01 0.34 -3.11 0.00 0.00 179.97 177.75 2k6z n PHE 10 N -2.74 -0.03 -3.64 2.20 7.35 -1.03 -4.15 117.46 115.42 2k6z n PHE 10 Ca 0.02 0.02 -0.05 0.00 -0.76 0.00 0.00 57.45 56.68 2k6z n PHE 10 Cb 0.33 -1.54 -0.06 0.00 0.35 0.00 0.00 39.48 38.56 2k6z n PHE 10 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2k6z s SER 11 N -0.96 -0.15 0.21 -2.13 0.15 -1.26 -4.90 113.70 104.65 2k6z s SER 11 Ca 0.00 0.26 0.11 0.00 0.70 0.00 0.00 55.95 57.03 2k6z s SER 11 Cb 0.00 0.25 -0.00 0.00 -1.71 0.00 0.00 66.02 64.56 2k6z s SER 11 CO 0.00 -0.07 1.40 1.55 1.20 0.00 0.00 173.24 177.31 2k6z h PRO 12 N 3.08 0.00 0.00 5.44 0.13 -1.85 -2.71 132.00 136.09 2k6z h PRO 12 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 2k6z h PRO 12 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2k6z h PRO 12 CO 0.19 0.72 0.00 0.41 -0.23 0.00 0.00 178.00 179.09 2k6z n GLY 13 N 1.16 1.42 0.00 1.56 0.00 -1.26 -4.16 105.19 103.92 2k6z n GLY 13 Ca 0.01 -1.60 0.09 0.00 0.00 0.00 0.00 46.02 44.51 2k6z n GLY 13 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k6z n PRO 14 N -1.60 0.25 -3.87 1.61 -0.04 -1.26 -4.97 135.00 125.12 2k6z n PRO 14 Ca 0.00 0.12 -0.09 0.00 -0.04 0.00 0.00 63.50 63.49 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 -2.56 0.10 0.24 3.54 4.22 -1.26 -1.59 114.94 117.62 2k6z s ASN 15 Ca 0.17 -0.68 0.05 0.00 -2.14 0.00 0.00 52.86 50.26 2k6z s ASN 15 Cb 0.12 0.36 -0.02 0.00 1.28 0.00 0.00 41.25 42.99 2k6z s ASN 15 CO 0.27 -0.76 0.21 0.00 -2.04 0.00 0.00 177.10 174.77 2k6z n ALA 16 N -0.09 0.49 -3.13 3.54 0.00 -0.15 -4.73 120.51 116.42 2k6z n ALA 16 Ca -0.14 -1.38 -0.13 0.00 0.00 0.00 0.00 53.44 51.80 2k6z n ALA 16 Cb 0.63 1.12 -0.08 0.00 0.00 0.00 0.00 19.45 21.11 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 -2.95 -0.76 0.00 0.00 0.00 -1.26 -0.85 121.76 115.94 2k6z s ALA 17 Ca 0.28 0.20 0.01 0.00 0.00 0.00 0.00 51.96 52.45 2k6z s ALA 17 Cb 0.01 0.20 -0.01 0.00 0.00 0.00 0.00 23.12 23.32 2k6z s ALA 17 CO 0.20 -0.34 -0.03 0.00 0.00 0.00 0.00 175.76 175.59 2k6z s ALA 18 N -1.92 0.23 -0.97 0.00 0.00 0.18 -1.73 121.76 117.55 2k6z s ALA 18 Ca -0.09 -0.21 -0.03 0.00 0.00 0.00 0.00 51.96 51.63 2k6z s ALA 18 Cb -0.03 -0.02 0.27 0.00 0.00 0.00 0.00 23.12 23.34 2k6z s ALA 18 CO 0.01 0.02 1.13 0.66 0.00 0.00 0.00 175.76 177.58 2k6z n TYR 19 N 2.74 3.53 -1.75 0.00 4.01 -0.47 -1.43 117.16 123.79 2k6z n TYR 19 Ca -0.14 -3.47 -0.31 0.00 -0.16 0.00 0.00 57.90 53.82 2k6z n TYR 19 Cb 0.58 -1.20 0.03 0.00 -0.31 0.00 0.00 39.34 38.45 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 -2.13 3.23 0.01 7.72 0.05 -1.26 -1.54 118.68 124.76 2k6z s LEU 20 Ca 0.32 1.59 -0.00 0.00 0.05 0.00 0.00 54.13 56.08 2k6z s LEU 20 Cb 0.01 -4.49 -0.01 0.00 -2.05 0.00 0.00 46.19 39.64 2k6z s LEU 20 CO -0.00 -1.22 -0.01 -0.89 -0.55 0.00 0.00 176.35 173.68 2k6z s THR 21 N -2.98 0.08 0.29 5.48 2.01 -1.26 -0.98 115.64 118.27 2k6z s THR 21 Ca 0.58 -0.65 0.02 0.00 0.31 0.00 0.00 61.69 61.95 2k6z s THR 21 Cb -0.13 -0.20 -0.01 0.00 0.01 0.00 0.00 72.50 72.17 2k6z s THR 21 CO 0.51 -0.36 0.33 -0.11 -0.69 0.00 0.00 174.62 174.31 2k6z n LEU 22 N 2.00 0.00 -3.71 4.42 -0.00 -0.09 -4.37 117.00 115.26 2k6z n LEU 22 Ca -0.21 -2.51 -0.18 0.00 -0.00 0.00 0.00 56.01 53.12 2k6z n LEU 22 Cb 0.56 1.82 -0.17 0.00 -0.00 0.00 0.00 43.42 45.63 2k6z n LEU 22 CO 0.22 -0.50 -0.33 -0.70 -0.00 0.00 0.00 177.39 176.07 2k6z s GLU 23 N -2.87 -0.05 -0.21 1.96 2.12 -1.26 0.10 118.70 118.48 2k6z s GLU 23 Ca 0.28 0.33 -0.29 0.00 0.36 0.00 0.00 54.97 55.65 2k6z s GLU 23 Cb 0.00 -0.39 -0.00 0.00 0.26 0.00 0.00 34.13 34.00 2k6z s GLU 23 CO 0.20 -0.27 1.20 1.21 -0.54 0.00 0.00 175.26 177.06 2k6z s ASN 24 N 1.76 6.94 0.44 -1.70 2.47 0.14 -4.24 114.94 120.75 2k6z s ASN 24 Ca -0.01 1.49 0.30 0.00 0.42 0.00 0.00 52.86 55.06 2k6z s ASN 24 Cb -0.12 -2.54 1.20 0.00 -1.45 0.00 0.00 41.25 38.34 2k6z s ASN 24 CO -0.03 -0.79 1.88 1.55 -3.72 0.00 0.00 177.10 175.98 2k6z h PRO 25 N 8.16 0.00 -0.39 0.43 0.13 -1.88 -2.44 132.00 136.01 2k6z h PRO 25 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 2k6z h PRO 25 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2k6z h PRO 25 CO 0.99 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 179.17 2k6z n GLY 26 N 0.06 -3.35 0.11 1.56 0.00 -1.26 -4.10 105.19 98.21 2k6z n GLY 26 Ca 0.01 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.13 2k6z n GLY 26 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2k6z n ASP 27 N -0.30 0.00 -1.26 1.61 -0.08 -1.26 -4.91 116.55 110.35 2k6z n ASP 27 Ca 0.00 0.00 -0.01 0.00 -1.51 0.00 0.00 54.79 53.27 2k6z n ASP 27 Cb 0.00 0.03 0.00 0.00 2.34 0.00 0.00 41.12 43.49 2k6z n ASP 27 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2k6z n LEU 28 N -1.72 0.00 -4.71 -2.67 -0.00 -1.26 -5.12 117.00 101.52 2k6z n LEU 28 Ca 0.00 -0.24 -0.42 0.00 -0.00 0.00 0.00 56.01 55.35 2k6z n LEU 28 Cb 0.00 0.40 -0.03 0.00 -0.00 0.00 0.00 43.42 43.79 2k6z n LEU 28 CO 0.00 -0.08 0.70 -2.16 -0.00 0.00 0.00 177.39 175.85 2k6z s PRO 29 N -2.01 4.55 0.33 1.47 0.04 -1.26 -4.01 135.00 134.11 2k6z s PRO 29 Ca 0.02 1.47 -0.04 0.00 0.04 0.00 0.00 61.00 62.49 2k6z s PRO 29 Cb -0.00 -3.44 -0.05 0.00 0.04 0.00 0.00 34.50 31.05 2k6z s PRO 29 CO 0.01 -0.06 0.59 -0.51 0.04 0.00 0.00 177.00 177.08 2k6z s LEU 30 N 0.94 3.99 -0.27 -3.56 2.01 0.14 -4.96 118.68 116.97 2k6z s LEU 30 Ca 0.52 0.70 -0.01 0.00 0.01 0.00 0.00 54.13 55.35 2k6z s LEU 30 Cb -0.22 -3.55 0.15 0.00 0.01 0.00 0.00 46.19 42.59 2k6z s LEU 30 CO 0.28 -0.27 0.44 -0.60 1.01 0.00 0.00 176.35 177.21 2k6z s ARG 31 N -3.88 0.41 -0.46 1.70 3.52 -1.26 -0.30 118.95 118.67 2k6z s ARG 31 Ca 0.44 0.52 -0.20 0.00 -0.13 0.00 0.00 55.73 56.36 2k6z s ARG 31 Cb -0.10 -0.22 0.03 0.00 -1.56 0.00 0.00 34.95 33.10 2k6z s ARG 31 CO 0.33 -0.76 0.64 -1.17 -0.81 0.00 0.00 175.30 173.53 2k6z s LEU 32 N 2.62 4.65 -0.02 -0.88 2.96 0.30 -0.77 118.68 127.53 2k6z s LEU 32 Ca 0.13 -0.54 0.15 0.00 -0.22 0.00 0.00 54.13 53.65 2k6z s LEU 32 Cb -0.14 -2.62 -0.22 0.00 0.50 0.00 0.00 46.19 43.70 2k6z s LEU 32 CO -0.21 -0.82 0.31 1.33 -1.32 0.00 0.00 176.35 175.64 2k6z n VAL 33 N 5.77 0.03 -3.65 1.68 0.24 -0.07 -0.72 118.33 121.62 2k6z n VAL 33 Ca -0.03 -0.34 -0.07 0.00 -2.04 0.00 0.00 64.34 61.85 2k6z n VAL 33 Cb 0.47 0.14 0.02 0.00 -1.47 0.00 0.00 33.84 33.00 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 1.23 3.32 7.63 0.00 -1.15 -4.68 105.19 113.22 2k6z n GLY 34 Ca -0.03 -1.22 -0.24 0.00 0.00 0.00 0.00 46.02 44.52 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 -1.05 0.59 -2.84 4.61 0.00 -1.26 -1.09 120.51 119.47 2k6z n ALA 35 Ca -0.13 -2.05 -0.10 0.00 0.00 0.00 0.00 53.44 51.16 2k6z n ALA 35 Cb 0.48 1.42 -0.07 0.00 0.00 0.00 0.00 19.45 21.27 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 -3.52 1.40 0.00 0.00 0.52 -0.15 -4.80 118.95 112.39 2k6z s ARG 36 Ca 0.23 -1.35 0.00 0.00 -0.52 0.00 0.00 55.73 54.09 2k6z s ARG 36 Cb 0.01 0.40 0.00 0.00 0.52 0.00 0.00 34.95 35.88 2k6z s ARG 36 CO 0.16 -0.54 0.00 -2.37 0.02 0.00 0.00 175.30 172.57 2k6z n THR 37 N -0.33 0.00 1.15 0.02 5.66 -1.26 -0.40 114.28 119.13 2k6z n THR 37 Ca -0.01 0.00 0.13 0.00 -3.05 0.00 0.00 64.05 61.11 2k6z n THR 37 Cb 0.63 0.00 0.35 0.00 -1.55 0.00 0.00 70.33 69.76 2k6z n THR 37 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 2k6z n PRO 38 N -0.08 0.47 -0.58 1.09 -0.04 -1.26 -4.38 135.00 130.22 2k6z n PRO 38 Ca 0.00 -0.26 0.03 0.00 -0.04 0.00 0.00 63.50 63.22 2k6z n PRO 38 Cb 0.00 -1.49 0.22 0.00 -0.04 0.00 0.00 33.50 32.18 2k6z n PRO 38 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2k6z n VAL 39 N -1.04 2.37 -3.82 0.52 0.24 -1.26 -4.61 118.33 110.73 2k6z n VAL 39 Ca 0.10 -2.39 -0.10 0.00 -2.04 0.00 0.00 64.34 59.91 2k6z n VAL 39 Cb 0.34 -0.29 -0.05 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 -3.05 -0.50 -0.15 2.33 0.00 -1.26 -2.81 121.76 116.31 2k6z s ALA 40 Ca 0.42 -0.50 0.15 0.00 0.00 0.00 0.00 51.96 52.03 2k6z s ALA 40 Cb 0.37 0.80 -0.24 0.00 0.00 0.00 0.00 23.12 24.05 2k6z s ALA 40 CO 0.03 -0.69 0.25 -1.91 0.00 0.00 0.00 175.76 173.44 2k6z n GLU 41 N -0.25 0.67 -4.11 0.00 2.13 0.25 -4.86 120.64 114.48 2k6z n GLU 41 Ca -0.10 0.11 -0.09 0.00 0.66 0.00 0.00 57.16 57.73 2k6z n GLU 41 Cb 0.63 -1.61 -0.10 0.00 0.27 0.00 0.00 31.44 30.62 2k6z n GLU 41 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2k6z s ARG 42 N -2.53 0.66 -0.20 5.31 0.52 -0.72 -5.03 118.95 116.97 2k6z s ARG 42 Ca -0.10 -1.16 -0.12 0.00 -0.52 0.00 0.00 55.73 53.83 2k6z s ARG 42 Cb 0.07 -0.02 0.06 0.00 0.52 0.00 0.00 34.95 35.58 2k6z s ARG 42 CO 0.81 -0.05 0.49 0.54 0.02 0.00 0.00 175.30 177.11 2k6z s VAL 43 N -3.29 -0.02 -0.02 3.52 0.11 -1.26 -1.14 120.40 118.31 2k6z s VAL 43 Ca 0.05 0.06 -0.00 0.00 -2.93 0.00 0.00 61.98 59.16 2k6z s VAL 43 Cb 0.03 -0.72 0.02 0.00 -1.53 0.00 0.00 36.38 34.19 2k6z s VAL 43 CO -0.06 0.02 0.03 -1.61 -3.33 0.00 0.00 175.10 170.15 2k6z s GLU 44 N 1.34 -0.02 -0.30 1.54 2.02 -0.43 -4.69 118.70 118.16 2k6z s GLU 44 Ca -0.09 0.14 -0.25 0.00 0.02 0.00 0.00 54.97 54.80 2k6z s GLU 44 Cb -0.07 -0.17 0.00 0.00 0.10 0.00 0.00 34.13 33.99 2k6z s GLU 44 CO -0.13 -0.12 0.84 -1.17 0.02 0.00 0.00 175.26 174.71 2k6z s LEU 45 N 0.74 4.06 0.31 1.80 2.96 -1.26 -0.26 118.68 127.03 2k6z s LEU 45 Ca -0.06 0.79 0.10 0.00 -0.22 0.00 0.00 54.13 54.74 2k6z s LEU 45 Cb -0.09 -3.17 -0.05 0.00 0.50 0.00 0.00 46.19 43.38 2k6z s LEU 45 CO -0.02 -0.64 -0.07 -1.00 -1.32 0.00 0.00 176.35 173.29 2k6z s HIS 46 N 3.05 2.47 0.48 5.38 3.76 -0.24 -0.62 115.29 129.58 2k6z s HIS 46 Ca 0.35 -0.38 0.03 0.00 -0.15 0.00 0.00 55.06 54.91 2k6z s HIS 46 Cb -0.14 -1.26 0.03 0.00 1.11 0.00 0.00 32.58 32.32 2k6z s HIS 46 CO 0.12 0.60 0.25 -0.85 -0.85 0.00 0.00 174.74 174.01 2k6z n GLU 47 N -0.81 0.80 -3.74 1.40 -0.00 -0.05 -1.10 120.64 117.13 2k6z n GLU 47 Ca -0.05 -3.17 -0.12 0.00 -0.00 0.00 0.00 57.16 53.81 2k6z n GLU 47 Cb 0.61 0.51 -0.11 0.00 -0.00 0.00 0.00 31.44 32.45 2k6z n GLU 47 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 2k6z s THR 48 N -2.52 -0.01 0.27 3.84 2.01 -0.90 -3.30 115.64 115.03 2k6z s THR 48 Ca 0.19 0.05 0.03 0.00 0.31 0.00 0.00 61.69 62.27 2k6z s THR 48 Cb -0.02 -0.46 -0.06 0.00 0.01 0.00 0.00 72.50 71.98 2k6z s THR 48 CO 0.12 0.02 0.06 0.72 -0.69 0.00 0.00 174.62 174.85 2k6z s PHE 49 N 0.67 1.68 -0.07 4.92 -0.12 0.03 -4.55 117.98 120.54 2k6z s PHE 49 Ca -0.04 -1.05 0.00 0.00 -0.05 0.00 0.00 56.93 55.79 2k6z s PHE 49 Cb -0.05 -1.02 -0.03 0.00 -0.63 0.00 0.00 43.02 41.28 2k6z s PHE 49 CO -0.04 -0.16 -0.06 -1.64 -0.05 0.00 0.00 175.22 173.26 2k6z s MET 50 N -3.95 2.83 0.01 1.99 -1.94 -1.26 -1.61 119.30 115.36 2k6z s MET 50 Ca 0.35 -0.54 0.05 0.00 -1.71 0.00 0.00 55.69 53.85 2k6z s MET 50 Cb 0.08 -2.63 -0.01 0.00 2.01 0.00 0.00 34.83 34.28 2k6z s MET 50 CO 0.13 0.64 -0.15 1.03 -0.01 0.00 0.00 175.02 176.67 2k6z s ARG 51 N -0.74 1.11 0.04 2.03 0.52 -0.19 -4.95 118.95 116.76 2k6z s ARG 51 Ca 0.11 -0.61 -0.19 0.00 -0.52 0.00 0.00 55.73 54.52 2k6z s ARG 51 Cb -0.11 -1.09 -0.06 0.00 0.52 0.00 0.00 34.95 34.20 2k6z s ARG 51 CO 0.02 0.29 0.55 -2.00 0.02 0.00 0.00 175.30 174.18 2k6z s GLU 52 N -0.62 4.19 -0.13 3.54 2.56 -1.26 -0.49 118.70 126.49 2k6z s GLU 52 Ca 0.04 0.68 -0.02 0.00 0.00 0.00 0.00 54.97 55.68 2k6z s GLU 52 Cb -0.06 -3.26 0.04 0.00 2.00 0.00 0.00 34.13 32.84 2k6z s GLU 52 CO 0.00 0.58 -0.00 0.08 -0.56 0.00 0.00 175.26 175.36 2k6z s VAL 53 N -0.86 0.57 -1.40 3.70 1.01 0.18 -4.87 120.40 118.73 2k6z s VAL 53 Ca 0.29 -0.23 -0.01 0.00 0.00 0.00 0.00 61.98 62.03 2k6z s VAL 53 Cb -0.19 -0.83 0.00 0.00 0.00 0.00 0.00 36.38 35.36 2k6z s VAL 53 CO 0.18 0.10 0.14 1.21 0.00 0.00 0.00 175.10 176.72 2k6z n GLU 54 N 5.07 -2.07 -0.98 2.72 2.13 -1.26 -1.40 120.64 124.84 2k6z n GLU 54 Ca -0.09 0.80 0.00 0.00 0.66 0.00 0.00 57.16 58.53 2k6z n GLU 54 Cb 0.49 -5.26 0.00 0.00 0.27 0.00 0.00 31.44 26.94 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 -1.12 0.51 2.99 8.31 0.00 -1.26 -5.03 105.19 109.59 2k6z n GLY 55 Ca -0.17 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.54 2k6z n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k6z s LYS 56 N -0.05 2.07 0.10 1.61 1.02 -0.49 -5.11 119.74 118.90 2k6z s LYS 56 Ca 0.00 -0.49 -0.29 0.00 0.02 0.00 0.00 55.97 55.22 2k6z s LYS 56 Cb 0.00 -1.98 -0.06 0.00 -0.52 0.00 0.00 37.83 35.27 2k6z s LYS 56 CO 0.00 -0.26 0.90 -1.59 -0.92 0.00 0.00 175.35 173.49 2k6z s LYS 57 N 1.54 4.65 -0.14 1.68 0.00 -1.26 -0.64 119.74 125.57 2k6z s LYS 57 Ca 0.05 1.34 -0.09 0.00 0.00 0.00 0.00 55.97 57.27 2k6z s LYS 57 Cb -0.13 -3.36 0.05 0.00 0.00 0.00 0.00 37.83 34.39 2k6z s LYS 57 CO -0.10 0.27 0.35 0.54 0.00 0.00 0.00 175.35 176.41 2k6z s VAL 58 N -0.14 -0.02 0.65 1.79 0.11 0.35 -4.96 120.40 118.18 2k6z s VAL 58 Ca 0.44 0.08 -0.08 0.00 -2.93 0.00 0.00 61.98 59.48 2k6z s VAL 58 Cb -0.23 -0.52 0.02 0.00 -1.53 0.00 0.00 36.38 34.12 2k6z s VAL 58 CO 0.28 0.03 0.99 -0.04 -3.33 0.00 0.00 175.10 173.03 2k6z s MET 59 N 0.98 2.79 0.35 1.54 -1.94 -1.26 -1.03 119.30 120.73 2k6z s MET 59 Ca -0.06 0.13 -0.05 0.00 -1.71 0.00 0.00 55.69 54.00 2k6z s MET 59 Cb -0.07 -2.16 0.01 0.00 2.01 0.00 0.00 34.83 34.62 2k6z s MET 59 CO -0.08 -0.91 0.54 0.20 -0.01 0.00 0.00 175.02 174.77 2k6z s GLY 60 N -4.36 1.26 -0.07 -0.03 0.00 -0.63 -4.88 107.32 98.61 2k6z s GLY 60 Ca 0.56 -1.36 -0.10 0.00 0.00 0.00 0.00 44.72 43.83 2k6z s GLY 60 CO 0.47 -0.85 0.24 -0.29 0.00 0.00 0.00 173.10 172.67 2k6z s MET 61 N -2.88 0.38 0.08 2.90 1.75 -1.26 -0.79 119.30 119.48 2k6z s MET 61 Ca 0.27 0.15 -0.15 0.00 -1.25 0.00 0.00 55.69 54.71 2k6z s MET 61 Cb -0.01 0.18 0.03 0.00 2.84 0.00 0.00 34.83 37.86 2k6z s MET 61 CO 0.19 -0.07 0.35 -0.98 -0.65 0.00 0.00 175.02 173.86 2k6z s ARG 62 N -0.34 0.94 0.65 4.11 1.70 -1.21 -5.00 118.95 119.80 2k6z s ARG 62 Ca -0.04 -0.60 -0.11 0.00 -0.47 0.00 0.00 55.73 54.50 2k6z s ARG 62 Cb -0.03 0.41 -0.02 0.00 -0.57 0.00 0.00 34.95 34.74 2k6z s ARG 62 CO 0.01 -0.33 1.04 -1.25 -1.08 0.00 0.00 175.30 173.69 2k6z s PRO 63 N -3.17 3.26 0.04 3.89 0.04 -1.26 -0.87 135.00 136.93 2k6z s PRO 63 Ca -0.01 0.90 -0.04 0.00 0.04 0.00 0.00 61.00 61.89 2k6z s PRO 63 Cb 0.01 -2.03 -0.02 0.00 0.04 0.00 0.00 34.50 32.50 2k6z s PRO 63 CO -0.07 -0.84 0.05 0.14 0.04 0.00 0.00 177.00 176.31 2k6z s VAL 64 N -3.03 0.16 -0.16 -0.36 -7.23 0.21 -4.79 120.40 105.19 2k6z s VAL 64 Ca 0.57 -1.28 0.16 0.00 -1.81 0.00 0.00 61.98 59.63 2k6z s VAL 64 Cb -0.13 -1.02 -0.01 0.00 0.56 0.00 0.00 36.38 35.78 2k6z s VAL 64 CO 0.52 -0.71 1.18 1.55 -0.31 0.00 0.00 175.10 177.33 2k6z h PRO 65 N 3.59 0.00 -1.37 4.82 0.13 -1.95 -3.41 132.00 133.82 2k6z h PRO 65 Ca -0.33 0.00 0.34 0.00 -0.87 0.00 0.00 66.00 65.14 2k6z h PRO 65 Cb 1.18 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.18 2k6z h PRO 65 CO 0.54 0.37 0.86 -0.59 -0.23 0.00 0.00 178.00 178.95 2k6z s PHE 66 N -2.98 -0.04 0.18 1.56 -0.12 -1.26 -4.75 117.98 110.57 2k6z s PHE 66 Ca 0.01 -0.05 0.08 0.00 -0.05 0.00 0.00 56.93 56.92 2k6z s PHE 66 Cb 0.08 0.54 -0.04 0.00 -0.63 0.00 0.00 43.02 42.97 2k6z s PHE 66 CO 0.77 -0.23 -0.06 -0.51 -0.05 0.00 0.00 175.22 175.15 2k6z s LEU 67 N -2.97 3.11 -0.02 -1.99 1.43 0.11 -4.98 118.68 113.35 2k6z s LEU 67 Ca 0.14 -0.50 0.04 0.00 -1.03 0.00 0.00 54.13 52.78 2k6z s LEU 67 Cb 0.05 -1.78 -0.03 0.00 0.03 0.00 0.00 46.19 44.46 2k6z s LEU 67 CO -0.04 0.10 -0.12 -0.70 0.23 0.00 0.00 176.35 175.82 2k6z s GLU 68 N -2.85 2.46 -0.07 1.70 2.56 -1.26 -0.53 118.70 120.70 2k6z s GLU 68 Ca 0.26 -0.74 -0.03 0.00 0.00 0.00 0.00 54.97 54.46 2k6z s GLU 68 Cb -0.09 -2.40 0.04 0.00 2.00 0.00 0.00 34.13 33.68 2k6z s GLU 68 CO 0.16 0.61 0.15 0.08 -0.56 0.00 0.00 175.26 175.70 2k6z s VAL 69 N -0.85 -0.07 0.96 3.70 1.01 0.58 -4.97 120.40 120.76 2k6z s VAL 69 Ca 0.14 0.20 -0.12 0.00 0.00 0.00 0.00 61.98 62.20 2k6z s VAL 69 Cb -0.11 -0.25 0.16 0.00 0.00 0.00 0.00 36.38 36.18 2k6z s VAL 69 CO 0.03 0.08 1.09 -2.16 0.00 0.00 0.00 175.10 174.15 2k6z s PRO 70 N 1.31 0.75 0.45 2.72 0.04 -1.26 -0.68 135.00 138.33 2k6z s PRO 70 Ca -0.08 0.68 -0.22 0.00 0.04 0.00 0.00 61.00 61.42 2k6z s PRO 70 Cb -0.12 -1.76 -0.11 0.00 0.04 0.00 0.00 34.50 32.55 2k6z s PRO 70 CO -0.06 -2.55 0.72 -2.30 0.04 0.00 0.00 177.00 172.85 2k6z n PRO 71 N -4.08 0.82 0.00 0.56 -0.02 -1.26 -2.73 135.00 128.31 2k6z n PRO 71 Ca 0.06 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 2k6z n PRO 71 Cb 0.56 -1.74 0.00 0.00 -0.02 0.00 0.00 33.50 32.30 2k6z n PRO 71 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2k6z n LYS 72 N 0.25 0.00 -1.90 -0.52 4.76 -0.92 -4.83 118.16 115.00 2k6z n LYS 72 Ca 0.11 0.00 -0.31 0.00 -2.87 0.00 0.00 58.31 55.24 2k6z n LYS 72 Cb 0.41 -2.10 0.01 0.00 -1.84 0.00 0.00 35.03 31.52 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 -1.56 1.75 0.19 0.72 0.00 -1.10 -4.66 107.32 102.66 2k6z s GLY 73 Ca 0.00 0.02 -0.30 0.00 0.00 0.00 0.00 44.72 44.44 2k6z s GLY 73 CO 0.00 0.30 1.05 0.50 0.00 0.00 0.00 173.10 174.95 2k6z s ARG 74 N -4.91 4.66 -0.83 2.90 1.81 -1.26 -0.69 118.95 120.64 2k6z s ARG 74 Ca 0.57 1.65 0.02 0.00 -1.72 0.00 0.00 55.73 56.24 2k6z s ARG 74 Cb -0.12 -3.28 0.31 0.00 -0.45 0.00 0.00 34.95 31.41 2k6z s ARG 74 CO 0.50 0.19 1.31 0.28 -0.68 0.00 0.00 175.30 176.90 2k6z n VAL 75 N 2.12 4.41 -3.77 3.52 0.31 0.12 -4.90 118.33 120.13 2k6z n VAL 75 Ca 0.01 -5.73 -0.36 0.00 -0.01 0.00 0.00 64.34 58.25 2k6z n VAL 75 Cb 0.47 -1.68 -0.07 0.00 -0.91 0.00 0.00 33.84 31.64 2k6z n VAL 75 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2k6z s GLU 76 N -3.49 3.85 -0.85 5.55 4.04 -1.26 -0.91 118.70 125.63 2k6z s GLU 76 Ca 0.41 -0.13 -0.22 0.00 0.04 0.00 0.00 54.97 55.07 2k6z s GLU 76 Cb 0.19 -3.31 0.08 0.00 0.02 0.00 0.00 34.13 31.11 2k6z s GLU 76 CO -0.07 0.52 1.19 -0.51 -1.84 0.00 0.00 175.26 174.55 2k6z s LEU 77 N -0.30 4.20 -0.37 1.83 1.02 -0.16 -4.99 118.68 119.92 2k6z s LEU 77 Ca 0.12 -1.38 -0.41 0.00 0.02 0.00 0.00 54.13 52.49 2k6z s LEU 77 Cb -0.12 -2.47 -0.16 0.00 0.02 0.00 0.00 46.19 43.46 2k6z s LEU 77 CO 0.02 -1.39 1.90 1.17 0.02 0.00 0.00 176.35 178.07 2k6z n LYS 78 N 7.87 0.77 -1.73 1.70 3.00 -1.23 -4.47 118.16 124.07 2k6z n LYS 78 Ca 0.16 0.26 -0.42 0.00 -0.00 0.00 0.00 58.31 58.31 2k6z n LYS 78 Cb 0.49 -1.99 0.00 0.00 0.00 0.00 0.00 35.03 33.52 2k6z n LYS 78 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 2k6z n PRO 79 N 6.26 2.27 0.00 1.64 -0.04 -1.26 -1.07 135.00 142.80 2k6z n PRO 79 Ca 0.36 0.80 0.00 0.00 -0.04 0.00 0.00 63.50 64.62 2k6z n PRO 79 Cb 0.09 -2.46 0.00 0.00 -0.04 0.00 0.00 33.50 31.09 2k6z n PRO 79 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k6z n GLY 80 N 0.66 3.06 0.00 0.55 0.00 -1.26 -4.85 105.19 103.36 2k6z n GLY 80 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 0.97 3.75 -0.02 0.00 -0.24 -4.69 105.19 102.96 2k6z n GLY 81 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 0.87 3.60 -0.11 1.61 1.51 -0.71 -2.12 117.35 122.00 2k6z s TYR 82 Ca 0.00 1.65 -0.29 0.00 -1.01 0.00 0.00 57.07 57.42 2k6z s TYR 82 Cb 0.00 -3.27 0.07 0.00 -0.11 0.00 0.00 41.96 38.65 2k6z s TYR 82 CO 0.00 -0.54 0.70 -3.38 -1.11 0.00 0.00 175.55 171.22 2k6z s HIS 83 N -0.69 -0.68 -0.08 2.71 -3.43 -0.26 -3.48 115.29 109.37 2k6z s HIS 83 Ca 0.47 1.33 -0.27 0.00 -0.80 0.00 0.00 55.06 55.78 2k6z s HIS 83 Cb -0.30 0.37 -0.02 0.00 -1.43 0.00 0.00 32.58 31.20 2k6z s HIS 83 CO 0.37 -0.54 0.89 -0.06 -2.00 0.00 0.00 174.74 173.41 2k6z s PHE 84 N -0.75 3.55 0.33 0.38 0.08 -0.51 -1.07 117.98 119.98 2k6z s PHE 84 Ca -0.08 1.47 -0.27 0.00 0.12 0.00 0.00 56.93 58.18 2k6z s PHE 84 Cb -0.01 -3.05 -0.09 0.00 -0.57 0.00 0.00 43.02 39.29 2k6z s PHE 84 CO 0.07 -0.10 1.01 1.41 -0.10 0.00 0.00 175.22 177.51 2k6z s MET 85 N 1.51 4.48 -0.20 0.44 1.75 0.64 -0.64 119.30 127.28 2k6z s MET 85 Ca 0.45 1.52 -0.00 0.00 -1.25 0.00 0.00 55.69 56.40 2k6z s MET 85 Cb -0.19 -2.85 0.05 0.00 2.84 0.00 0.00 34.83 34.68 2k6z s MET 85 CO 0.19 0.15 -0.04 -0.51 -0.65 0.00 0.00 175.02 174.16 2k6z s LEU 86 N -2.02 1.98 -0.11 4.11 1.43 -0.03 -1.32 118.68 122.72 2k6z s LEU 86 Ca 0.50 -0.92 0.01 0.00 -1.03 0.00 0.00 54.13 52.70 2k6z s LEU 86 Cb -0.24 -0.99 -0.02 0.00 0.03 0.00 0.00 46.19 44.98 2k6z s LEU 86 CO 0.30 -0.22 -0.14 -0.76 0.23 0.00 0.00 176.35 175.75 2k6z s LEU 87 N 1.56 2.68 -0.05 1.79 2.01 -0.29 -0.98 118.68 125.40 2k6z s LEU 87 Ca -0.02 -0.31 -0.00 0.00 0.01 0.00 0.00 54.13 53.80 2k6z s LEU 87 Cb -0.17 -1.58 0.00 0.00 0.01 0.00 0.00 46.19 44.44 2k6z s LEU 87 CO -0.07 0.21 0.04 0.61 1.01 0.00 0.00 176.35 178.14 2k6z n GLY 88 N 3.25 0.55 3.43 -3.19 0.00 -0.62 -0.58 105.19 108.04 2k6z n GLY 88 Ca -0.18 -0.51 -0.36 0.00 0.00 0.00 0.00 46.02 44.96 2k6z n GLY 88 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k6z n LEU 89 N -0.99 0.26 -0.01 0.99 4.77 -1.17 -2.79 117.00 118.05 2k6z n LEU 89 Ca -0.01 0.59 -0.02 0.00 -0.03 0.00 0.00 56.01 56.54 2k6z n LEU 89 Cb 0.51 -1.17 -0.02 0.00 -2.33 0.00 0.00 43.42 40.41 2k6z n LEU 89 CO 0.02 -3.34 -0.60 0.29 -1.33 0.00 0.00 177.39 172.44 2k6z n LYS 90 N -0.41 2.39 -4.17 3.23 4.76 -1.12 -4.86 118.16 117.98 2k6z n LYS 90 Ca 0.09 0.01 -0.35 0.00 -2.87 0.00 0.00 58.31 55.19 2k6z n LYS 90 Cb 0.50 -1.07 -0.10 0.00 -1.84 0.00 0.00 35.03 32.52 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 -2.07 3.61 0.21 1.97 0.52 -1.26 -5.02 118.95 116.91 2k6z s ARG 91 Ca -0.02 -0.38 -0.30 0.00 -0.52 0.00 0.00 55.73 54.51 2k6z s ARG 91 Cb 0.01 -3.04 -0.09 0.00 0.52 0.00 0.00 34.95 32.35 2k6z s ARG 91 CO 0.10 0.42 1.28 -1.25 0.02 0.00 0.00 175.30 175.88 2k6z s PRO 92 N -0.08 4.41 0.22 3.54 0.04 -1.26 -4.95 135.00 136.92 2k6z s PRO 92 Ca 0.05 2.02 0.03 0.00 0.04 0.00 0.00 61.00 63.15 2k6z s PRO 92 Cb -0.12 -3.20 -0.03 0.00 0.04 0.00 0.00 34.50 31.19 2k6z s PRO 92 CO 0.02 -0.21 0.36 -0.51 0.04 0.00 0.00 177.00 176.70 2k6z s LEU 93 N -0.28 4.29 0.19 -3.56 2.01 -1.02 -4.96 118.68 115.34 2k6z s LEU 93 Ca 0.55 0.16 -0.21 0.00 0.01 0.00 0.00 54.13 54.64 2k6z s LEU 93 Cb -0.36 -2.94 0.05 0.00 0.01 0.00 0.00 46.19 42.95 2k6z s LEU 93 CO 0.39 -0.05 0.60 -1.59 1.01 0.00 0.00 176.35 176.71 2k6z s LYS 94 N -3.73 1.38 0.38 1.70 0.00 -1.26 -4.07 119.74 114.14 2k6z s LYS 94 Ca 0.35 -0.65 -0.28 0.00 0.00 0.00 0.00 55.97 55.39 2k6z s LYS 94 Cb -0.10 0.57 -0.10 0.00 0.00 0.00 0.00 37.83 38.20 2k6z s LYS 94 CO 0.29 -0.60 1.44 0.00 0.00 0.00 0.00 175.35 176.48 2k6z s ALA 95 N -3.81 3.51 -0.50 0.59 0.00 -1.26 -2.96 121.76 117.32 2k6z s ALA 95 Ca 0.04 1.50 -0.01 0.00 0.00 0.00 0.00 51.96 53.49 2k6z s ALA 95 Cb -0.02 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.52 2k6z s ALA 95 CO -0.07 -1.00 0.42 0.41 0.00 0.00 0.00 175.76 175.52 2k6z n GLY 96 N 0.54 0.15 3.58 0.00 0.00 -1.18 -5.04 105.19 103.23 2k6z n GLY 96 Ca 0.01 -0.25 -0.27 0.00 0.00 0.00 0.00 46.02 45.51 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 -4.71 1.97 0.11 1.61 0.41 -1.16 -5.02 118.70 111.91 2k6z s GLU 97 Ca 0.04 -2.20 0.01 0.00 -0.41 0.00 0.00 54.97 52.40 2k6z s GLU 97 Cb -0.02 -0.97 -0.04 0.00 -1.78 0.00 0.00 34.13 31.32 2k6z s GLU 97 CO 0.30 -0.38 -0.02 -1.83 -0.49 0.00 0.00 175.26 172.84 2k6z s GLU 98 N -3.78 0.87 0.03 1.61 1.03 -1.26 -0.15 118.70 117.04 2k6z s GLU 98 Ca 0.21 -1.38 -0.19 0.00 0.03 0.00 0.00 54.97 53.64 2k6z s GLU 98 Cb 0.04 -0.03 0.04 0.00 -0.80 0.00 0.00 34.13 33.37 2k6z s GLU 98 CO 0.12 -0.11 0.44 0.08 -1.33 0.00 0.00 175.26 174.45 2k6z s VAL 99 N -3.78 0.05 0.18 1.83 1.01 -0.47 -4.93 120.40 114.29 2k6z s VAL 99 Ca 0.16 -0.39 -0.26 0.00 0.00 0.00 0.00 61.98 61.48 2k6z s VAL 99 Cb 0.07 -0.93 -0.08 0.00 0.00 0.00 0.00 36.38 35.43 2k6z s VAL 99 CO -0.03 -0.22 0.81 -1.83 0.00 0.00 0.00 175.10 173.84 2k6z s GLU 100 N -2.31 4.63 0.38 2.72 1.03 -1.26 -1.46 118.70 122.43 2k6z s GLU 100 Ca -0.06 1.23 0.08 0.00 0.03 0.00 0.00 54.97 56.24 2k6z s GLU 100 Cb -0.01 -3.26 -0.04 0.00 -0.80 0.00 0.00 34.13 30.03 2k6z s GLU 100 CO -0.01 0.56 0.25 -0.51 -1.33 0.00 0.00 175.26 174.21 2k6z s LEU 101 N -1.18 3.31 -0.00 1.83 1.02 -1.24 -4.28 118.68 118.14 2k6z s LEU 101 Ca 0.37 -0.81 0.04 0.00 0.02 0.00 0.00 54.13 53.75 2k6z s LEU 101 Cb -0.24 -1.82 -0.01 0.00 0.02 0.00 0.00 46.19 44.14 2k6z s LEU 101 CO 0.27 -0.48 -0.13 -1.81 0.02 0.00 0.00 176.35 174.22 2k6z s ASP 102 N -3.97 1.51 -0.20 2.29 1.01 0.47 0.19 116.67 117.96 2k6z s ASP 102 Ca 0.42 -0.26 -0.08 0.00 0.71 0.00 0.00 52.55 53.34 2k6z s ASP 102 Cb -0.01 -0.16 -0.04 0.00 1.01 0.00 0.00 42.92 43.72 2k6z s ASP 102 CO 0.25 0.14 0.08 -0.76 0.21 0.00 0.00 175.17 175.09 2k6z s LEU 103 N -0.41 3.82 -0.45 1.23 1.02 0.17 -0.98 118.68 123.09 2k6z s LEU 103 Ca 0.04 0.04 -0.15 0.00 0.02 0.00 0.00 54.13 54.09 2k6z s LEU 103 Cb -0.05 -1.99 0.06 0.00 0.02 0.00 0.00 46.19 44.22 2k6z s LEU 103 CO -0.00 0.12 0.36 -0.76 0.02 0.00 0.00 176.35 176.09 2k6z s LEU 104 N 0.71 5.44 -0.22 1.79 1.43 -0.25 -1.79 118.68 125.78 2k6z s LEU 104 Ca 0.04 -1.20 -0.13 0.00 -1.03 0.00 0.00 54.13 51.82 2k6z s LEU 104 Cb -0.13 -2.17 -0.05 0.00 0.03 0.00 0.00 46.19 43.88 2k6z s LEU 104 CO 0.02 -0.58 0.25 -0.36 0.23 0.00 0.00 176.35 175.91 2k6z s PHE 105 N 1.64 3.34 -0.71 0.29 0.08 0.07 -0.89 117.98 121.80 2k6z s PHE 105 Ca 0.04 0.38 0.00 0.00 0.12 0.00 0.00 56.93 57.47 2k6z s PHE 105 Cb -0.23 -2.36 0.00 0.00 -0.57 0.00 0.00 43.02 39.86 2k6z s PHE 105 CO 0.08 0.04 0.00 0.00 -0.10 0.00 0.00 175.22 175.24 2k6z n ALA 106 N 4.34 -0.10 -0.11 5.36 0.00 0.05 -1.62 120.51 128.43 2k6z n ALA 106 Ca -0.12 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2k6z n ALA 106 Cb 0.52 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.80 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 0.19 1.12 0.00 0.00 0.00 -1.26 -4.86 105.19 100.38 2k6z n GLY 107 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.00 0.00 3.54 -0.02 0.00 -0.78 -5.02 105.19 100.91 2k6z n GLY 108 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.27 3.42 -0.17 1.61 1.02 -0.64 -4.94 119.74 118.77 2k6z s LYS 109 Ca 0.00 -0.06 -0.09 0.00 0.02 0.00 0.00 55.97 55.84 2k6z s LYS 109 Cb 0.00 -3.99 -0.05 0.00 -0.52 0.00 0.00 37.83 33.27 2k6z s LYS 109 CO 0.00 -1.37 0.14 0.08 -0.92 0.00 0.00 175.35 173.28 2k6z s VAL 110 N 3.89 5.43 -0.05 3.17 1.01 -1.26 -0.75 120.40 131.83 2k6z s VAL 110 Ca 0.34 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.54 2k6z s VAL 110 Cb -0.11 -3.46 0.02 0.00 0.00 0.00 0.00 36.38 32.83 2k6z s VAL 110 CO 0.23 0.49 -0.03 -0.76 0.00 0.00 0.00 175.10 175.03 2k6z s LEU 111 N -0.03 1.14 0.27 3.92 1.02 -0.74 -4.99 118.68 119.27 2k6z s LEU 111 Ca 0.11 -0.11 -0.28 0.00 0.02 0.00 0.00 54.13 53.86 2k6z s LEU 111 Cb -0.11 -0.42 -0.09 0.00 0.02 0.00 0.00 46.19 45.58 2k6z s LEU 111 CO 0.00 -0.09 0.94 -0.75 0.02 0.00 0.00 176.35 176.47 2k6z s LYS 112 N 1.18 4.75 0.32 1.70 2.20 -1.26 -0.65 119.74 127.98 2k6z s LYS 112 Ca -0.07 1.44 0.08 0.00 -0.36 0.00 0.00 55.97 57.05 2k6z s LYS 112 Cb -0.14 -3.09 -0.03 0.00 -1.51 0.00 0.00 37.83 33.06 2k6z s LYS 112 CO -0.01 0.42 0.23 0.08 -0.36 0.00 0.00 175.35 175.71 2k6z s VAL 113 N -1.35 3.54 -0.03 4.02 1.01 0.13 -4.96 120.40 122.76 2k6z s VAL 113 Ca 0.45 -1.47 0.01 0.00 0.00 0.00 0.00 61.98 60.97 2k6z s VAL 113 Cb -0.23 -3.15 0.02 0.00 0.00 0.00 0.00 36.38 33.01 2k6z s VAL 113 CO 0.29 -0.21 -0.04 -0.69 0.00 0.00 0.00 175.10 174.45 2k6z s VAL 114 N -2.31 0.46 -0.06 2.92 1.01 -1.26 -3.61 120.40 117.56 2k6z s VAL 114 Ca 0.39 -0.13 -0.13 0.00 0.00 0.00 0.00 61.98 62.11 2k6z s VAL 114 Cb -0.05 -0.47 0.02 0.00 0.00 0.00 0.00 36.38 35.88 2k6z s VAL 114 CO 0.25 0.19 0.30 -1.48 0.00 0.00 0.00 175.10 174.36 2k6z s LEU 115 N 0.62 0.89 0.74 3.92 2.34 -0.53 -4.82 118.68 121.83 2k6z s LEU 115 Ca -0.08 0.29 -0.11 0.00 0.06 0.00 0.00 54.13 54.29 2k6z s LEU 115 Cb -0.11 1.14 0.03 0.00 -0.56 0.00 0.00 46.19 46.69 2k6z s LEU 115 CO -0.00 -0.30 1.07 -2.16 -1.06 0.00 0.00 176.35 173.90 2k6z s PRO 116 N -0.71 2.58 -0.17 1.48 0.04 -1.26 -1.37 135.00 135.59 2k6z s PRO 116 Ca -0.08 0.86 -0.15 0.00 0.04 0.00 0.00 61.00 61.67 2k6z s PRO 116 Cb -0.04 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 2k6z s PRO 116 CO 0.02 -1.33 0.33 0.08 0.04 0.00 0.00 177.00 176.15 2k6z s VAL 117 N -3.07 5.28 0.32 -0.36 1.01 0.78 -1.73 120.40 122.62 2k6z s VAL 117 Ca 0.59 0.61 0.04 0.00 0.00 0.00 0.00 61.98 63.22 2k6z s VAL 117 Cb -0.14 -3.66 -0.02 0.00 0.00 0.00 0.00 36.38 32.56 2k6z s VAL 117 CO 0.55 0.35 0.33 -0.62 0.00 0.00 0.00 175.10 175.71 2k6z n GLU 118 N 3.80 0.47 -3.92 2.72 -0.58 -0.53 -3.13 120.64 119.46 2k6z n GLU 118 Ca -0.11 -2.95 -0.30 0.00 -0.42 0.00 0.00 57.16 53.38 2k6z n GLU 118 Cb 0.52 2.54 -0.16 0.00 -0.57 0.00 0.00 31.44 33.77 2k6z n GLU 118 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2k6z s ALA 119 N -3.08 1.91 0.00 0.62 0.00 -1.26 -2.47 121.76 117.48 2k6z s ALA 119 Ca 0.34 -1.35 0.00 0.00 0.00 0.00 0.00 51.96 50.95 2k6z s ALA 119 Cb 0.01 -1.43 0.00 0.00 0.00 0.00 0.00 23.12 21.70 2k6z s ALA 119 CO 0.24 -1.21 0.00 2.89 0.00 0.00 0.00 175.76 177.68