#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q82 n GLN 2 N 0.00 -1.55 -2.14 -0.52 1.13 -1.26 -4.97 117.38 108.07 1q82 n GLN 2 Ca 0.00 1.50 -0.38 0.00 -1.94 0.00 0.00 57.00 56.19 1q82 n GLN 2 Cb 0.00 -2.54 0.00 0.00 0.11 0.00 0.00 30.24 27.81 1q82 n GLN 2 CO 0.00 0.00 0.00 -2.14 -1.44 0.00 0.00 177.06 173.48 1q82 s PRO 3 N -0.78 3.67 1.32 -1.09 0.02 -1.26 -5.01 135.00 131.87 1q82 s PRO 3 Ca -0.07 1.92 -0.18 0.00 0.02 0.00 0.00 61.00 62.69 1q82 s PRO 3 Cb 0.00 -2.43 0.34 0.00 0.02 0.00 0.00 34.50 32.43 1q82 s PRO 3 CO 0.29 -0.66 0.97 -1.12 -0.33 0.00 0.00 177.00 176.14 1q82 s SER 4 N -1.19 -0.27 0.00 2.53 0.01 -1.26 -5.07 113.70 108.45 1q82 s SER 4 Ca 0.64 1.16 0.00 0.00 1.31 0.00 0.00 55.95 59.07 1q82 s SER 4 Cb -0.32 -1.75 0.00 0.00 0.21 0.00 0.00 66.02 64.16 1q82 s SER 4 CO 0.39 -4.92 0.00 -1.14 0.41 0.00 0.00 173.24 167.98 1q82 n ARG 5 N -5.37 0.00 -1.11 12.44 0.63 -1.26 -5.15 116.66 116.84 1q82 n ARG 5 Ca 0.08 0.00 -0.34 0.00 -0.92 0.00 0.00 57.85 56.67 1q82 n ARG 5 Cb 0.57 0.00 0.12 0.00 0.45 0.00 0.00 32.46 33.60 1q82 n ARG 5 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 1q82 n PRO 6 N -0.11 0.18 -1.23 -0.14 -0.02 -1.26 -4.96 135.00 127.45 1q82 n PRO 6 Ca 0.00 0.13 -0.31 0.00 -2.02 0.00 0.00 63.50 61.31 1q82 n PRO 6 Cb 0.00 -2.34 0.11 0.00 -0.02 0.00 0.00 33.50 31.25 1q82 n PRO 6 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1q82 s ARG 7 N -3.92 1.89 -0.55 -0.52 1.04 -1.26 -4.95 118.95 110.68 1q82 s ARG 7 Ca 0.72 1.05 -0.25 0.00 -1.04 0.00 0.00 55.73 56.21 1q82 s ARG 7 Cb -0.29 -1.86 0.04 0.00 -2.04 0.00 0.00 34.95 30.79 1q82 s ARG 7 CO 0.52 -1.87 0.99 0.15 -0.04 0.00 0.00 175.30 175.05 1q82 s LYS 8 N -4.91 3.38 0.00 3.89 -0.14 -1.26 -4.89 119.74 115.80 1q82 s LYS 8 Ca 0.62 -0.14 0.00 0.00 -1.36 0.00 0.00 55.97 55.09 1q82 s LYS 8 Cb -0.17 -4.04 0.00 0.00 -1.68 0.00 0.00 37.83 31.94 1q82 s LYS 8 CO 0.56 -1.50 0.00 0.41 -0.76 0.00 0.00 175.35 174.06 1q82 n GLY 9 N 5.10 0.08 3.78 -3.33 0.00 -1.22 -4.85 105.19 104.75 1q82 n GLY 9 Ca 0.03 -1.57 -0.38 0.00 0.00 0.00 0.00 46.02 44.10 1q82 n GLY 9 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1q82 s SER 10 N -1.31 7.32 0.00 1.61 0.15 -1.26 -4.93 113.70 115.28 1q82 s SER 10 Ca 0.00 1.65 0.21 0.00 0.70 0.00 0.00 55.95 58.51 1q82 s SER 10 Cb 0.00 -2.50 0.57 0.00 -1.71 0.00 0.00 66.02 62.38 1q82 s SER 10 CO 0.00 0.12 1.46 0.18 1.20 0.00 0.00 173.24 176.20 1q82 n LEU 11 N 1.21 2.50 -0.57 3.45 4.32 -1.26 -4.21 117.00 122.43 1q82 n LEU 11 Ca -0.03 -1.09 0.13 0.00 -0.02 0.00 0.00 56.01 55.00 1q82 n LEU 11 Cb 0.49 -0.19 0.43 0.00 -1.62 0.00 0.00 43.42 42.53 1q82 n LEU 11 CO 0.45 0.54 0.81 0.61 -1.22 0.00 0.00 177.39 178.59 1q82 n GLY 12 N 1.30 0.25 1.39 -0.72 0.00 -1.26 -4.09 105.19 102.06 1q82 n GLY 12 Ca 0.17 -0.47 -0.07 0.00 0.00 0.00 0.00 46.02 45.65 1q82 n GLY 12 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1q82 n PHE 13 N 0.38 1.22 -4.12 1.61 3.01 -1.26 -5.06 117.46 113.24 1q82 n PHE 13 Ca 0.18 -1.77 -0.24 0.00 1.01 0.00 0.00 57.45 56.63 1q82 n PHE 13 Cb 0.38 -0.28 -0.07 0.00 -0.01 0.00 0.00 39.48 39.50 1q82 n PHE 13 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1q82 s GLY 14 N -3.34 2.15 0.33 1.37 0.00 -1.26 -3.99 107.32 102.59 1q82 s GLY 14 Ca 0.42 -1.98 -0.28 0.00 0.00 0.00 0.00 44.72 42.88 1q82 s GLY 14 CO -0.03 -1.85 1.20 2.56 0.00 0.00 0.00 173.10 174.98 1q82 s PRO 15 N -3.87 4.37 -0.84 2.90 0.04 -1.26 -5.03 135.00 131.31 1q82 s PRO 15 Ca 0.39 1.97 -0.07 0.00 0.04 0.00 0.00 61.00 63.33 1q82 s PRO 15 Cb 0.01 -3.00 -0.06 0.00 0.04 0.00 0.00 34.50 31.49 1q82 s PRO 15 CO 0.22 -0.09 2.01 0.54 0.04 0.00 0.00 177.00 179.73 1q82 n ARG 16 N 0.72 1.88 -3.24 4.56 3.00 -1.26 -4.88 116.66 117.44 1q82 n ARG 16 Ca 0.01 -1.42 -0.20 0.00 -0.01 0.00 0.00 57.85 56.23 1q82 n ARG 16 Cb 0.44 -2.46 0.02 0.00 0.00 0.00 0.00 32.46 30.47 1q82 n ARG 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 1q82 s LYS 17 N 3.66 2.49 0.48 5.56 -2.85 -1.26 -4.27 119.74 123.55 1q82 s LYS 17 Ca 0.38 -1.56 -0.22 0.00 -1.00 0.00 0.00 55.97 53.57 1q82 s LYS 17 Cb 0.10 -2.55 -0.07 0.00 -2.06 0.00 0.00 37.83 33.24 1q82 s LYS 17 CO -0.02 -0.54 1.17 1.03 0.10 0.00 0.00 175.35 177.09 1q82 s ARG 18 N -4.42 3.64 0.13 1.78 0.52 -1.26 -4.72 118.95 114.62 1q82 s ARG 18 Ca 0.53 1.77 -0.30 0.00 -0.52 0.00 0.00 55.73 57.21 1q82 s ARG 18 Cb -0.06 -2.32 -0.07 0.00 0.52 0.00 0.00 34.95 33.03 1q82 s ARG 18 CO 0.33 -0.65 1.14 0.45 0.02 0.00 0.00 175.30 176.59 1q82 s SER 19 N -1.42 7.18 0.28 0.23 0.15 -0.72 -4.97 113.70 114.42 1q82 s SER 19 Ca 0.66 2.07 -0.04 0.00 0.70 0.00 0.00 55.95 59.34 1q82 s SER 19 Cb -0.28 -2.59 0.36 0.00 -1.71 0.00 0.00 66.02 61.79 1q82 s SER 19 CO 0.34 -0.33 1.95 0.74 1.20 0.00 0.00 173.24 177.14 1q82 h THR 20 N 4.03 1.23 -3.87 6.45 2.02 -1.93 -3.42 112.91 117.43 1q82 h THR 20 Ca -0.43 -0.42 -0.58 0.00 0.77 0.00 0.00 66.41 65.75 1q82 h THR 20 Cb 1.21 -0.11 -0.31 0.00 -1.74 0.00 0.00 68.15 67.20 1q82 h THR 20 CO 0.76 0.23 -0.84 -0.44 0.37 0.00 0.00 175.52 175.59 1q82 s SER 21 N -6.21 2.26 0.33 4.18 0.01 -1.26 -4.99 113.70 108.01 1q82 s SER 21 Ca -0.12 -0.37 0.26 0.00 1.31 0.00 0.00 55.95 57.03 1q82 s SER 21 Cb 0.18 -0.66 0.82 0.00 0.21 0.00 0.00 66.02 66.57 1q82 s SER 21 CO 0.81 0.16 1.75 -0.08 0.41 0.00 0.00 173.24 176.29 1q82 h GLU 22 N 6.29 0.00 -5.39 12.44 4.81 -2.01 -3.41 114.58 127.31 1q82 h GLU 22 Ca -0.32 0.00 -0.61 0.00 -0.13 0.00 0.00 59.36 58.30 1q82 h GLU 22 Cb 1.18 0.00 -0.12 0.00 0.63 0.00 0.00 28.75 30.44 1q82 h GLU 22 CO 0.48 0.00 -0.15 0.99 -0.73 0.00 0.00 179.01 179.60 1q82 s THR 23 N -3.26 5.16 0.54 0.32 2.01 -1.26 -4.44 115.64 114.71 1q82 s THR 23 Ca 0.07 0.76 -0.21 0.00 0.31 0.00 0.00 61.69 62.62 1q82 s THR 23 Cb 0.09 -3.76 -0.05 0.00 0.01 0.00 0.00 72.50 68.79 1q82 s THR 23 CO 0.56 0.20 1.22 -2.84 -0.69 0.00 0.00 174.62 173.07 1q82 s PRO 24 N 1.63 3.25 -0.24 4.92 0.02 -1.26 -5.04 135.00 138.27 1q82 s PRO 24 Ca 0.20 1.88 0.00 0.00 0.02 0.00 0.00 61.00 63.10 1q82 s PRO 24 Cb -0.15 -2.14 0.07 0.00 0.02 0.00 0.00 34.50 32.30 1q82 s PRO 24 CO 0.09 -1.00 -0.02 1.03 -0.33 0.00 0.00 177.00 176.77 1q82 s ARG 25 N -3.06 1.42 0.49 5.54 1.81 -1.26 -5.01 118.95 118.89 1q82 s ARG 25 Ca 0.72 -1.00 -0.23 0.00 -1.72 0.00 0.00 55.73 53.50 1q82 s ARG 25 Cb -0.32 -2.52 -0.06 0.00 -0.45 0.00 0.00 34.95 31.60 1q82 s ARG 25 CO 0.36 -0.66 1.33 -0.06 -0.68 0.00 0.00 175.30 175.59 1q82 s PHE 26 N 1.43 2.49 -0.71 -0.53 0.40 -1.26 -4.91 117.98 114.90 1q82 s PHE 26 Ca -0.03 1.39 0.07 0.00 -0.60 0.00 0.00 56.93 57.77 1q82 s PHE 26 Cb -0.19 -3.73 0.18 0.00 0.51 0.00 0.00 43.02 39.80 1q82 s PHE 26 CO -0.08 -2.54 1.09 0.27 0.70 0.00 0.00 175.22 174.65 1q82 n ASN 27 N -0.63 2.44 -3.86 1.36 2.04 -1.26 -4.99 115.26 110.36 1q82 n ASN 27 Ca 0.08 -1.86 -0.11 0.00 -0.44 0.00 0.00 54.58 52.25 1q82 n ASN 27 Cb 0.45 -0.13 -0.09 0.00 -2.53 0.00 0.00 39.78 37.48 1q82 n ASN 27 CO 0.00 0.00 0.00 -0.44 -0.44 0.00 0.00 177.26 176.38 1q82 s SER 28 N -0.93 0.04 0.07 0.53 0.01 -1.26 -5.18 113.70 106.98 1q82 s SER 28 Ca 0.15 -0.34 0.01 0.00 1.31 0.00 0.00 55.95 57.08 1q82 s SER 28 Cb 0.08 0.27 -0.04 0.00 0.21 0.00 0.00 66.02 66.54 1q82 s SER 28 CO 0.11 -0.51 -0.06 0.26 0.41 0.00 0.00 173.24 173.45 1q82 s TRP 29 N -2.30 0.71 0.99 2.43 0.52 -1.26 -5.10 118.94 114.93 1q82 s TRP 29 Ca -0.07 -0.82 -0.11 0.00 0.02 0.00 0.00 56.10 55.11 1q82 s TRP 29 Cb -0.02 -0.44 0.18 0.00 -1.15 0.00 0.00 33.47 32.04 1q82 s TRP 29 CO -0.03 -0.19 1.09 -2.14 0.02 0.00 0.00 176.95 175.71 1q82 s PRO 30 N -3.14 0.49 0.57 4.98 0.02 -1.26 -5.00 135.00 131.66 1q82 s PRO 30 Ca 0.04 1.12 -0.11 0.00 0.02 0.00 0.00 61.00 62.06 1q82 s PRO 30 Cb 0.01 -1.70 -0.05 0.00 0.02 0.00 0.00 34.50 32.79 1q82 s PRO 30 CO -0.04 -2.85 0.97 -1.54 -0.33 0.00 0.00 177.00 173.20 1q82 s SER 31 N -2.84 6.31 -1.21 2.53 1.04 -1.26 -4.96 113.70 113.30 1q82 s SER 31 Ca 0.66 1.35 -0.19 0.00 0.48 0.00 0.00 55.95 58.25 1q82 s SER 31 Cb -0.22 -2.43 0.07 0.00 0.10 0.00 0.00 66.02 63.54 1q82 s SER 31 CO 0.60 -0.76 1.63 -1.81 0.98 0.00 0.00 173.24 173.88 1q82 s ASP 32 N -3.95 6.76 0.00 7.02 1.01 -1.26 -4.76 116.67 121.49 1q82 s ASP 32 Ca 0.54 -2.21 0.00 0.00 0.71 0.00 0.00 52.55 51.59 1q82 s ASP 32 Cb -0.11 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.26 1q82 s ASP 32 CO 0.48 -1.23 0.00 -0.67 0.21 0.00 0.00 175.17 173.96 1q82 n ASP 33 N 8.32 0.00 -2.93 0.27 -0.08 -1.26 -4.90 116.55 115.97 1q82 n ASP 33 Ca 0.43 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.71 1q82 n ASP 33 Cb 0.47 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.93 1q82 n ASP 33 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1q82 n GLY 34 N 3.47 -2.17 3.68 0.27 0.00 -1.26 -4.54 105.19 104.64 1q82 n GLY 34 Ca 0.00 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 44.99 1q82 n GLY 34 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1q82 s GLN 35 N 0.00 0.94 0.28 1.61 -0.21 -1.26 -3.03 119.66 117.98 1q82 s GLN 35 Ca 0.00 0.89 -0.30 0.00 0.02 0.00 0.00 55.36 55.97 1q82 s GLN 35 Cb 0.00 -1.77 -0.11 0.00 1.00 0.00 0.00 33.01 32.13 1q82 s GLN 35 CO 0.00 -2.48 1.55 -2.14 -2.12 0.00 0.00 175.29 170.10 1q82 s PRO 36 N -4.85 4.16 -0.10 2.91 0.02 -1.26 -4.40 135.00 131.49 1q82 s PRO 36 Ca 0.64 2.50 -0.32 0.00 0.02 0.00 0.00 61.00 63.84 1q82 s PRO 36 Cb -0.19 -3.05 0.12 0.00 0.02 0.00 0.00 34.50 31.40 1q82 s PRO 36 CO 0.58 -0.57 1.05 0.20 -0.33 0.00 0.00 177.00 177.93 1q82 s GLY 37 N 0.45 -0.37 0.15 0.52 0.00 -0.20 -4.91 107.32 102.96 1q82 s GLY 37 Ca 0.62 1.34 -0.30 0.00 0.00 0.00 0.00 44.72 46.38 1q82 s GLY 37 CO 0.47 0.46 1.13 0.14 0.00 0.00 0.00 173.10 175.30 1q82 s VAL 38 N -2.71 3.88 -0.40 1.40 1.01 -1.26 -2.11 120.40 120.21 1q82 s VAL 38 Ca 0.07 1.54 -0.01 0.00 0.00 0.00 0.00 61.98 63.58 1q82 s VAL 38 Cb -0.01 -3.99 0.26 0.00 0.00 0.00 0.00 36.38 32.65 1q82 s VAL 38 CO -0.07 0.23 2.04 0.00 0.00 0.00 0.00 175.10 177.30 1q82 n GLN 39 N 2.73 2.01 0.00 2.72 6.02 0.18 -4.89 117.38 126.15 1q82 n GLN 39 Ca 0.04 -1.96 0.00 0.00 -0.01 0.00 0.00 57.00 55.07 1q82 n GLN 39 Cb 0.46 -1.77 0.00 0.00 1.02 0.00 0.00 30.24 29.95 1q82 n GLN 39 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1q82 n GLY 40 N 0.07 1.01 3.84 1.08 0.00 -1.26 -4.36 105.19 105.58 1q82 n GLY 40 Ca 0.38 -1.01 -0.07 0.00 0.00 0.00 0.00 46.02 45.32 1q82 n GLY 40 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1q82 s PHE 41 N -2.00 -0.19 0.16 1.61 5.36 -0.61 -4.97 117.98 117.33 1q82 s PHE 41 Ca 0.00 -0.25 0.01 0.00 -0.96 0.00 0.00 56.93 55.73 1q82 s PHE 41 Cb 0.00 0.70 -0.04 0.00 -0.34 0.00 0.00 43.02 43.33 1q82 s PHE 41 CO 0.00 -1.19 0.01 0.00 -1.46 0.00 0.00 175.22 172.58 1q82 s ALA 42 N -3.85 1.21 0.00 11.12 0.00 -1.26 0.55 121.76 129.54 1q82 s ALA 42 Ca 0.11 -1.55 -0.00 0.00 0.00 0.00 0.00 51.96 50.52 1q82 s ALA 42 Cb -0.05 0.59 0.00 0.00 0.00 0.00 0.00 23.12 23.66 1q82 s ALA 42 CO 0.06 -0.35 0.01 0.41 0.00 0.00 0.00 175.76 175.89 1q82 n GLY 43 N -0.19 1.62 3.01 0.00 0.00 -0.86 -4.69 105.19 104.08 1q82 n GLY 43 Ca -0.07 -0.97 -0.26 0.00 0.00 0.00 0.00 46.02 44.72 1q82 n GLY 43 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1q82 s TYR 44 N -7.36 1.66 0.31 1.61 1.51 0.05 -1.83 117.35 113.29 1q82 s TYR 44 Ca 0.00 -0.72 -0.29 0.00 -1.01 0.00 0.00 57.07 55.05 1q82 s TYR 44 Cb -0.00 -1.24 -0.12 0.00 -0.11 0.00 0.00 41.96 40.49 1q82 s TYR 44 CO 0.00 -0.40 1.46 1.17 -1.11 0.00 0.00 175.55 176.67 1q82 n LYS 45 N 4.17 2.42 -0.02 -0.62 4.81 -0.90 -1.21 118.16 126.81 1q82 n LYS 45 Ca -0.19 0.86 -0.05 0.00 -0.87 0.00 0.00 58.31 58.06 1q82 n LYS 45 Cb 0.51 -2.55 -0.02 0.00 0.02 0.00 0.00 35.03 32.99 1q82 n LYS 45 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1q82 n ALA 46 N 1.29 2.52 0.00 3.14 0.00 0.28 -0.60 120.51 127.14 1q82 n ALA 46 Ca 0.07 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1q82 n ALA 46 Cb 0.36 0.43 0.00 0.00 0.00 0.00 0.00 19.45 20.24 1q82 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q82 n GLY 47 N 2.85 -0.69 3.21 0.00 0.00 -1.10 -4.76 105.19 104.69 1q82 n GLY 47 Ca -0.09 -1.04 -0.14 0.00 0.00 0.00 0.00 46.02 44.76 1q82 n GLY 47 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1q82 s MET 48 N -1.57 0.94 0.31 1.61 -1.94 -1.26 0.86 119.30 118.25 1q82 s MET 48 Ca 0.00 -1.31 -0.18 0.00 -1.71 0.00 0.00 55.69 52.49 1q82 s MET 48 Cb 0.00 -0.53 0.06 0.00 2.01 0.00 0.00 34.83 36.37 1q82 s MET 48 CO 0.00 0.07 0.89 0.95 -0.01 0.00 0.00 175.02 176.91 1q82 s THR 49 N -2.97 0.00 0.34 2.05 -4.23 -0.79 -4.95 115.64 105.09 1q82 s THR 49 Ca 0.11 -0.84 0.09 0.00 -1.18 0.00 0.00 61.69 59.87 1q82 s THR 49 Cb 0.01 -2.90 -0.06 0.00 1.34 0.00 0.00 72.50 70.88 1q82 s THR 49 CO -0.00 0.00 -0.09 -1.38 -0.54 0.00 0.00 174.62 172.61 1q82 s HIS 50 N -2.23 2.35 0.02 3.99 -3.43 -1.26 0.02 115.29 114.76 1q82 s HIS 50 Ca 0.18 -0.53 -0.04 0.00 -0.80 0.00 0.00 55.06 53.87 1q82 s HIS 50 Cb -0.04 -1.37 -0.01 0.00 -1.43 0.00 0.00 32.58 29.73 1q82 s HIS 50 CO 0.09 0.54 0.05 0.54 -2.00 0.00 0.00 174.74 173.97 1q82 s VAL 51 N -2.67 0.11 -0.18 -5.38 0.11 -0.50 -1.54 120.40 110.37 1q82 s VAL 51 Ca 0.32 -0.95 -0.08 0.00 -2.93 0.00 0.00 61.98 58.34 1q82 s VAL 51 Cb 0.03 -0.56 -0.04 0.00 -1.53 0.00 0.00 36.38 34.28 1q82 s VAL 51 CO 0.16 -0.52 0.11 -0.69 -3.33 0.00 0.00 175.10 170.82 1q82 s VAL 52 N -1.89 5.19 0.32 2.04 1.01 0.13 -0.47 120.40 126.73 1q82 s VAL 52 Ca -0.11 0.11 0.06 0.00 0.00 0.00 0.00 61.98 62.04 1q82 s VAL 52 Cb -0.06 -3.34 -0.06 0.00 0.00 0.00 0.00 36.38 32.92 1q82 s VAL 52 CO -0.02 0.48 -0.02 -0.76 0.00 0.00 0.00 175.10 174.78 1q82 s LEU 53 N 0.09 2.52 -0.26 3.92 1.02 0.11 -2.04 118.68 124.03 1q82 s LEU 53 Ca 0.08 -1.27 -0.13 0.00 0.02 0.00 0.00 54.13 52.84 1q82 s LEU 53 Cb -0.12 -0.67 -0.05 0.00 0.02 0.00 0.00 46.19 45.38 1q82 s LEU 53 CO -0.00 -0.40 0.26 -0.69 0.02 0.00 0.00 176.35 175.53 1q82 s VAL 54 N -2.97 5.27 -0.42 -1.59 1.01 -1.05 -0.99 120.40 119.66 1q82 s VAL 54 Ca 0.32 0.34 -0.40 0.00 0.00 0.00 0.00 61.98 62.25 1q82 s VAL 54 Cb 0.06 -3.59 -0.16 0.00 0.00 0.00 0.00 36.38 32.69 1q82 s VAL 54 CO 0.14 0.24 2.10 -3.20 0.00 0.00 0.00 175.10 174.38 1q82 n ASN 55 N 4.93 1.49 0.04 3.32 2.85 0.13 -4.68 115.26 123.35 1q82 n ASN 55 Ca -0.12 0.63 0.01 0.00 -0.11 0.00 0.00 54.58 54.99 1q82 n ASN 55 Cb 0.52 -1.07 -0.07 0.00 1.24 0.00 0.00 39.78 40.39 1q82 n ASN 55 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1q82 n ASP 56 N 8.11 0.87 -4.63 1.20 -0.08 -1.26 -0.54 116.55 120.22 1q82 n ASP 56 Ca 0.46 0.38 -0.43 0.00 -1.51 0.00 0.00 54.79 53.69 1q82 n ASP 56 Cb 0.09 0.18 -0.03 0.00 2.34 0.00 0.00 41.12 43.70 1q82 n ASP 56 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 1q82 s GLU 57 N -2.98 3.70 0.60 -0.67 2.12 -1.26 -4.88 118.70 115.34 1q82 s GLU 57 Ca -0.03 2.21 0.38 0.00 0.36 0.00 0.00 54.97 57.89 1q82 s GLU 57 Cb 0.09 -4.21 1.86 0.00 0.26 0.00 0.00 34.13 32.13 1q82 s GLU 57 CO 0.81 -1.44 2.17 -1.00 -0.54 0.00 0.00 175.26 175.26 1q82 h PRO 58 N 12.24 0.00 -0.02 4.30 0.13 -1.99 -2.48 132.00 144.17 1q82 h PRO 58 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1q82 h PRO 58 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1q82 h PRO 58 CO 0.96 0.02 -0.09 0.09 -0.23 0.00 0.00 178.00 178.74 1q82 n ASN 59 N -3.16 2.37 -4.73 1.44 3.02 -1.26 -4.93 115.26 108.01 1q82 n ASN 59 Ca -0.01 -1.73 -0.39 0.00 -0.03 0.00 0.00 54.58 52.41 1q82 n ASN 59 Cb 0.19 0.08 -0.05 0.00 -0.61 0.00 0.00 39.78 39.40 1q82 n ASN 59 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1q82 s SER 60 N -2.11 7.03 0.00 6.41 0.15 -0.93 -4.90 113.70 119.35 1q82 s SER 60 Ca 0.29 1.23 0.05 0.00 0.70 0.00 0.00 55.95 58.21 1q82 s SER 60 Cb 0.20 -2.41 0.24 0.00 -1.71 0.00 0.00 66.02 62.34 1q82 s SER 60 CO 0.37 -0.04 0.94 -2.65 1.20 0.00 0.00 173.24 173.05 1q82 n PRO 61 N 3.35 0.08 -0.06 5.44 -0.02 -1.26 -0.44 135.00 142.09 1q82 n PRO 61 Ca -0.03 0.20 0.05 0.00 -2.02 0.00 0.00 63.50 61.70 1q82 n PRO 61 Cb 0.51 -1.50 0.08 0.00 -0.02 0.00 0.00 33.50 32.57 1q82 n PRO 61 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1q82 n ARG 62 N -1.23 1.37 -1.67 -0.52 1.74 -1.26 -5.02 116.66 110.06 1q82 n ARG 62 Ca 0.02 -1.45 -0.57 0.00 -0.77 0.00 0.00 57.85 55.08 1q82 n ARG 62 Cb 0.03 -1.21 -0.07 0.00 -1.02 0.00 0.00 32.46 30.19 1q82 n ARG 62 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 1q82 n GLU 63 N 0.52 1.01 0.00 5.56 0.28 0.42 -0.70 120.64 127.73 1q82 n GLU 63 Ca 0.08 0.37 0.00 0.00 -0.16 0.00 0.00 57.16 57.45 1q82 n GLU 63 Cb 0.31 -2.02 0.00 0.00 1.43 0.00 0.00 31.44 31.17 1q82 n GLU 63 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1q82 n GLY 64 N 3.61 1.50 3.94 -1.84 0.00 0.30 -4.92 105.19 107.79 1q82 n GLY 64 Ca 0.24 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.02 1q82 n GLY 64 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1q82 s MET 65 N -0.78 3.04 1.00 1.61 -1.94 0.12 -4.53 119.30 117.82 1q82 s MET 65 Ca 0.00 -0.36 -0.11 0.00 -1.71 0.00 0.00 55.69 53.51 1q82 s MET 65 Cb 0.00 -2.48 0.19 0.00 2.01 0.00 0.00 34.83 34.55 1q82 s MET 65 CO 0.00 -0.38 1.10 -1.21 -0.01 0.00 0.00 175.02 174.52 1q82 s GLU 66 N -4.67 0.34 -0.30 2.03 0.41 -1.26 0.22 118.70 115.47 1q82 s GLU 66 Ca 0.50 1.27 -0.16 0.00 -0.41 0.00 0.00 54.97 56.17 1q82 s GLU 66 Cb -0.10 -1.67 0.17 0.00 -1.78 0.00 0.00 34.13 30.75 1q82 s GLU 66 CO 0.40 -3.01 1.09 -2.00 -0.49 0.00 0.00 175.26 171.25 1q82 s GLU 67 N -4.59 0.23 -0.16 1.61 2.12 -0.16 -4.65 118.70 113.10 1q82 s GLU 67 Ca 0.67 0.47 -0.20 0.00 0.36 0.00 0.00 54.97 56.27 1q82 s GLU 67 Cb -0.23 0.17 -0.03 0.00 0.26 0.00 0.00 34.13 34.30 1q82 s GLU 67 CO 0.60 -0.06 0.58 0.99 -0.54 0.00 0.00 175.26 176.83 1q82 s THR 68 N 1.73 5.08 -0.05 -1.70 2.01 -1.26 0.05 115.64 121.50 1q82 s THR 68 Ca -0.05 1.13 0.04 0.00 0.31 0.00 0.00 61.69 63.11 1q82 s THR 68 Cb -0.04 -3.91 0.00 0.00 0.01 0.00 0.00 72.50 68.57 1q82 s THR 68 CO -0.15 0.20 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.13 1q82 s VAL 69 N 1.35 1.39 0.52 3.82 1.01 0.39 -4.98 120.40 123.90 1q82 s VAL 69 Ca 0.29 -0.67 -0.19 0.00 0.00 0.00 0.00 61.98 61.40 1q82 s VAL 69 Cb -0.16 -1.22 -0.07 0.00 0.00 0.00 0.00 36.38 34.94 1q82 s VAL 69 CO 0.11 0.41 1.08 -2.84 0.00 0.00 0.00 175.10 173.86 1q82 s PRO 70 N 0.23 3.55 -0.12 2.72 0.02 -1.26 -1.41 135.00 138.74 1q82 s PRO 70 Ca -0.08 1.46 -0.09 0.00 0.02 0.00 0.00 61.00 62.31 1q82 s PRO 70 Cb -0.13 -2.05 0.04 0.00 0.02 0.00 0.00 34.50 32.38 1q82 s PRO 70 CO 0.03 -0.66 0.30 0.08 -0.33 0.00 0.00 177.00 176.43 1q82 s VAL 71 N -1.93 -0.01 -0.19 3.83 1.01 0.10 -1.83 120.40 121.38 1q82 s VAL 71 Ca 0.69 0.05 -0.14 0.00 0.00 0.00 0.00 61.98 62.58 1q82 s VAL 71 Cb -0.20 -0.44 -0.04 0.00 0.00 0.00 0.00 36.38 35.70 1q82 s VAL 71 CO 0.24 0.02 0.33 -0.89 0.00 0.00 0.00 175.10 174.81 1q82 s THR 72 N 0.61 5.26 -0.23 3.92 2.01 0.15 -1.88 115.64 125.48 1q82 s THR 72 Ca -0.04 0.59 -0.24 0.00 0.31 0.00 0.00 61.69 62.32 1q82 s THR 72 Cb -0.05 -3.67 -0.01 0.00 0.01 0.00 0.00 72.50 68.78 1q82 s THR 72 CO -0.04 0.32 0.77 -0.69 -0.69 0.00 0.00 174.62 174.29 1q82 s VAL 73 N 0.94 4.89 -0.12 3.82 1.01 0.25 -1.22 120.40 129.97 1q82 s VAL 73 Ca 0.17 1.46 0.02 0.00 0.00 0.00 0.00 61.98 63.63 1q82 s VAL 73 Cb -0.14 -4.07 0.01 0.00 0.00 0.00 0.00 36.38 32.18 1q82 s VAL 73 CO 0.06 -0.02 -0.19 -0.63 0.00 0.00 0.00 175.10 174.33 1q82 s ILE 74 N 2.55 1.76 -0.33 2.22 1.01 -0.61 -0.55 121.20 127.25 1q82 s ILE 74 Ca 0.33 -0.81 -0.29 0.00 0.00 0.00 0.00 60.65 59.89 1q82 s ILE 74 Cb -0.16 -1.58 0.01 0.00 0.01 0.00 0.00 42.46 40.75 1q82 s ILE 74 CO 0.09 0.49 1.14 -1.61 0.00 0.00 0.00 174.94 175.05 1q82 s GLU 75 N 0.84 4.00 -0.62 2.79 2.02 -0.35 -0.43 118.70 126.95 1q82 s GLU 75 Ca -0.08 1.08 0.05 0.00 0.02 0.00 0.00 54.97 56.04 1q82 s GLU 75 Cb -0.15 -3.79 0.29 0.00 0.10 0.00 0.00 34.13 30.58 1q82 s GLU 75 CO -0.00 -1.00 0.86 0.25 0.02 0.00 0.00 175.26 175.39 1q82 n THR 76 N 6.04 2.77 -0.60 3.63 -2.24 0.17 -0.77 114.28 123.28 1q82 n THR 76 Ca 0.13 -5.41 -0.29 0.00 -2.27 0.00 0.00 64.05 56.21 1q82 n THR 76 Cb 0.47 -1.77 0.26 0.00 -2.10 0.00 0.00 70.33 67.19 1q82 n THR 76 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 1q82 s PRO 77 N -2.97 -1.38 0.63 -0.78 0.02 -1.25 -4.56 135.00 124.70 1q82 s PRO 77 Ca 0.44 0.55 -0.17 0.00 0.02 0.00 0.00 61.00 61.84 1q82 s PRO 77 Cb 0.21 -1.52 -0.02 0.00 0.02 0.00 0.00 34.50 33.19 1q82 s PRO 77 CO -0.07 -3.96 1.15 -2.14 -0.33 0.00 0.00 177.00 171.65 1q82 s PRO 78 N -4.71 2.87 0.51 5.54 0.02 -1.26 -4.77 135.00 133.20 1q82 s PRO 78 Ca 0.68 1.58 0.03 0.00 0.02 0.00 0.00 61.00 63.31 1q82 s PRO 78 Cb -0.21 -1.94 -0.00 0.00 0.02 0.00 0.00 34.50 32.37 1q82 s PRO 78 CO 0.62 -1.23 0.13 -1.64 -0.33 0.00 0.00 177.00 174.56 1q82 s MET 79 N -3.72 2.21 -0.11 5.54 -1.94 -0.25 -4.36 119.30 116.67 1q82 s MET 79 Ca 0.71 -2.25 -0.03 0.00 -1.71 0.00 0.00 55.69 52.41 1q82 s MET 79 Cb -0.24 -1.73 0.04 0.00 2.01 0.00 0.00 34.83 34.91 1q82 s MET 79 CO 0.37 -0.42 0.07 1.03 -0.01 0.00 0.00 175.02 176.06 1q82 s ARG 80 N -4.00 0.05 -0.49 2.03 0.52 -0.90 -1.42 118.95 114.74 1q82 s ARG 80 Ca 0.17 0.13 -0.28 0.00 -0.52 0.00 0.00 55.73 55.23 1q82 s ARG 80 Cb 0.01 -1.18 0.02 0.00 0.52 0.00 0.00 34.95 34.31 1q82 s ARG 80 CO 0.10 -0.49 1.34 0.00 0.02 0.00 0.00 175.30 176.27 1q82 s ALA 81 N 2.13 2.99 -2.67 2.13 0.00 0.12 -2.92 121.76 123.54 1q82 s ALA 81 Ca 0.03 -0.43 0.26 0.00 0.00 0.00 0.00 51.96 51.82 1q82 s ALA 81 Cb -0.14 -3.99 0.55 0.00 0.00 0.00 0.00 23.12 19.54 1q82 s ALA 81 CO -0.06 -2.56 1.46 0.28 0.00 0.00 0.00 175.76 174.88 1q82 n VAL 82 N 6.94 0.00 -3.60 0.00 0.31 -0.58 -3.37 118.33 118.03 1q82 n VAL 82 Ca 0.14 -0.36 -0.05 0.00 -0.01 0.00 0.00 64.34 64.05 1q82 n VAL 82 Cb 0.49 1.02 -0.03 0.00 -0.91 0.00 0.00 33.84 34.41 1q82 n VAL 82 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1q82 s ALA 83 N -2.06 -2.05 -0.26 3.52 0.00 -1.21 -3.33 121.76 116.36 1q82 s ALA 83 Ca 0.31 1.63 -0.02 0.00 0.00 0.00 0.00 51.96 53.88 1q82 s ALA 83 Cb 0.20 -0.44 0.03 0.00 0.00 0.00 0.00 23.12 22.92 1q82 s ALA 83 CO 0.34 -0.49 -0.04 -1.17 0.00 0.00 0.00 175.76 174.40 1q82 s LEU 84 N -1.83 3.41 -0.12 0.00 1.98 0.27 -0.67 118.68 121.71 1q82 s LEU 84 Ca 0.08 -0.98 -0.11 0.00 -2.89 0.00 0.00 54.13 50.23 1q82 s LEU 84 Cb -0.01 -1.68 -0.05 0.00 0.66 0.00 0.00 46.19 45.11 1q82 s LEU 84 CO -0.05 -0.17 0.23 -0.60 -1.89 0.00 0.00 176.35 173.88 1q82 s ARG 85 N 1.31 3.88 -0.11 1.98 3.52 0.15 -1.03 118.95 128.66 1q82 s ARG 85 Ca -0.01 0.01 0.02 0.00 -0.13 0.00 0.00 55.73 55.62 1q82 s ARG 85 Cb -0.18 -3.30 -0.01 0.00 -1.56 0.00 0.00 34.95 29.90 1q82 s ARG 85 CO -0.03 0.53 -0.16 0.00 -0.81 0.00 0.00 175.30 174.83 1q82 s ALA 86 N -0.39 2.52 0.03 6.12 0.00 -0.55 -2.05 121.76 127.44 1q82 s ALA 86 Ca 0.16 -0.93 0.03 0.00 0.00 0.00 0.00 51.96 51.22 1q82 s ALA 86 Cb -0.13 -1.07 -0.04 0.00 0.00 0.00 0.00 23.12 21.89 1q82 s ALA 86 CO 0.05 0.32 -0.01 0.71 0.00 0.00 0.00 175.76 176.83 1q82 s TYR 87 N 0.13 3.02 0.03 0.00 1.51 -1.19 0.26 117.35 121.11 1q82 s TYR 87 Ca -0.08 0.03 0.07 0.00 -1.01 0.00 0.00 57.07 56.08 1q82 s TYR 87 Cb -0.15 -1.61 -0.03 0.00 -0.11 0.00 0.00 41.96 40.05 1q82 s TYR 87 CO 0.05 0.46 -0.18 -1.83 -1.11 0.00 0.00 175.55 172.94 1q82 s GLU 88 N -1.82 2.11 0.13 -0.62 -1.05 0.15 0.26 118.70 117.86 1q82 s GLU 88 Ca 0.22 -0.96 -0.30 0.00 -0.15 0.00 0.00 54.97 53.78 1q82 s GLU 88 Cb -0.12 -2.20 -0.06 0.00 -0.44 0.00 0.00 34.13 31.31 1q82 s GLU 88 CO 0.13 0.55 0.95 -0.51 0.95 0.00 0.00 175.26 177.33 1q82 s ASP 89 N -1.35 7.52 0.20 0.83 1.01 0.14 -2.54 116.67 122.48 1q82 s ASP 89 Ca 0.14 1.81 -0.03 0.00 0.71 0.00 0.00 52.55 55.18 1q82 s ASP 89 Cb -0.10 -2.59 -0.03 0.00 1.01 0.00 0.00 42.92 41.20 1q82 s ASP 89 CO 0.05 -0.03 0.18 0.42 0.21 0.00 0.00 175.17 175.99 1q82 s THR 90 N -0.20 0.01 -1.02 -1.27 -4.23 -0.71 -4.94 115.64 103.28 1q82 s THR 90 Ca 0.46 -1.89 0.01 0.00 -1.18 0.00 0.00 61.69 59.09 1q82 s THR 90 Cb -0.24 -2.40 0.01 0.00 1.34 0.00 0.00 72.50 71.21 1q82 s THR 90 CO 0.30 -0.05 1.03 -2.65 -0.54 0.00 0.00 174.62 172.71 1q82 n PRO 91 N -0.27 0.00 -1.26 3.99 -0.02 -1.26 -2.08 135.00 134.10 1q82 n PRO 91 Ca 0.01 0.47 -0.06 0.00 -2.02 0.00 0.00 63.50 61.89 1q82 n PRO 91 Cb 0.65 -1.50 0.12 0.00 -0.02 0.00 0.00 33.50 32.75 1q82 n PRO 91 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1q82 n TYR 92 N -1.49 1.14 -1.55 6.00 4.02 -1.26 -5.10 117.16 118.92 1q82 n TYR 92 Ca 0.00 -1.77 0.00 0.00 -0.01 0.00 0.00 57.90 56.12 1q82 n TYR 92 Cb 0.01 -0.28 0.00 0.00 -0.02 0.00 0.00 39.34 39.05 1q82 n TYR 92 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1q82 n GLY 93 N -0.88 -1.78 3.87 2.72 0.00 -0.88 -4.93 105.19 103.31 1q82 n GLY 93 Ca 0.28 -1.76 -0.32 0.00 0.00 0.00 0.00 46.02 44.22 1q82 n GLY 93 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1q82 s GLN 94 N 0.00 3.82 -0.01 1.61 -0.21 -1.26 -1.74 119.66 121.87 1q82 s GLN 94 Ca 0.00 0.30 -0.05 0.00 0.02 0.00 0.00 55.36 55.63 1q82 s GLN 94 Cb 0.00 -2.67 0.00 0.00 1.00 0.00 0.00 33.01 31.34 1q82 s GLN 94 CO 0.00 0.33 0.11 1.03 -2.12 0.00 0.00 175.29 174.64 1q82 s ARG 95 N -2.72 0.34 0.10 2.91 0.52 -1.05 -4.95 118.95 114.09 1q82 s ARG 95 Ca 0.46 -0.24 -0.31 0.00 -0.52 0.00 0.00 55.73 55.13 1q82 s ARG 95 Cb -0.12 0.14 -0.09 0.00 0.52 0.00 0.00 34.95 35.41 1q82 s ARG 95 CO 0.21 -0.07 1.65 -2.14 0.02 0.00 0.00 175.30 174.97 1q82 s PRO 96 N -0.89 4.19 -0.01 3.54 0.02 -1.26 -0.68 135.00 139.91 1q82 s PRO 96 Ca -0.10 2.37 -0.01 0.00 0.02 0.00 0.00 61.00 63.29 1q82 s PRO 96 Cb -0.06 -3.48 -0.00 0.00 0.02 0.00 0.00 34.50 30.98 1q82 s PRO 96 CO 0.01 -0.72 -0.01 1.25 -0.33 0.00 0.00 177.00 177.20 1q82 h LEU 97 N 8.11 0.00 0.00 -5.54 6.46 0.33 -3.46 115.31 121.22 1q82 h LEU 97 Ca -0.43 0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.29 1q82 h LEU 97 Cb 1.20 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.13 1q82 h LEU 97 CO 0.93 0.08 -0.00 0.41 -0.62 0.00 0.00 178.44 179.23 1q82 n THR 98 N -2.46 0.00 -3.76 1.05 -1.04 -1.18 -5.00 114.28 101.89 1q82 n THR 98 Ca -0.01 -0.29 -0.13 0.00 -2.04 0.00 0.00 64.05 61.59 1q82 n THR 98 Cb 0.02 0.20 -0.10 0.00 -1.82 0.00 0.00 70.33 68.63 1q82 n THR 98 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1q82 s GLU 99 N -2.11 0.48 -0.24 -2.82 2.02 -1.26 -1.49 118.70 113.29 1q82 s GLU 99 Ca 0.05 0.25 -0.04 0.00 0.02 0.00 0.00 54.97 55.24 1q82 s GLU 99 Cb -0.00 0.22 0.00 0.00 0.10 0.00 0.00 34.13 34.45 1q82 s GLU 99 CO 0.03 -0.09 -0.02 0.08 0.02 0.00 0.00 175.26 175.28 1q82 s VAL 100 N -0.32 3.37 0.45 2.63 1.01 -0.20 -4.81 120.40 122.53 1q82 s VAL 100 Ca -0.05 -0.65 0.05 0.00 0.00 0.00 0.00 61.98 61.34 1q82 s VAL 100 Cb -0.03 -2.61 0.05 0.00 0.00 0.00 0.00 36.38 33.79 1q82 s VAL 100 CO 0.02 0.31 0.44 0.79 0.00 0.00 0.00 175.10 176.66 1q82 n TRP 101 N 4.78 -1.36 -3.42 5.22 7.02 -1.26 -0.57 117.44 127.86 1q82 n TRP 101 Ca -0.17 -1.81 0.00 0.00 -1.02 0.00 0.00 57.50 54.50 1q82 n TRP 101 Cb 0.49 -0.39 0.00 0.00 -2.42 0.00 0.00 31.31 28.99 1q82 n TRP 101 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 1q82 n THR 102 N -1.71 0.00 0.00 -0.99 -2.24 -1.21 -4.86 114.28 103.27 1q82 n THR 102 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1q82 n THR 102 Cb 0.50 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 1q82 n THR 102 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1q82 n ASP 103 N -0.48 4.09 -4.54 3.42 8.00 -1.26 -4.96 116.55 120.82 1q82 n ASP 103 Ca 0.00 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.08 1q82 n ASP 103 Cb 0.00 0.55 -0.03 0.00 -0.02 0.00 0.00 41.12 41.62 1q82 n ASP 103 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1q82 s GLU 104 N -1.75 3.34 0.08 -1.24 2.02 -1.26 -5.01 118.70 114.88 1q82 s GLU 104 Ca 0.00 -0.14 0.07 0.00 0.02 0.00 0.00 54.97 54.92 1q82 s GLU 104 Cb 0.00 -4.09 -0.04 0.00 0.10 0.00 0.00 34.13 30.11 1q82 s GLU 104 CO 0.00 -1.73 -0.11 -0.06 0.02 0.00 0.00 175.26 173.38 1q82 s PHE 105 N 4.69 2.72 0.27 1.61 0.40 -1.26 -4.93 117.98 121.48 1q82 s PHE 105 Ca 0.35 -0.16 -0.29 0.00 -0.60 0.00 0.00 56.93 56.22 1q82 s PHE 105 Cb -0.10 -1.45 -0.10 0.00 0.51 0.00 0.00 43.02 41.88 1q82 s PHE 105 CO 0.20 0.39 1.33 -1.58 0.70 0.00 0.00 175.22 176.26 1q82 s HIS 106 N -1.14 3.12 0.46 0.36 5.65 -1.26 -4.85 115.29 117.63 1q82 s HIS 106 Ca 0.20 1.27 0.41 0.00 0.25 0.00 0.00 55.06 57.19 1q82 s HIS 106 Cb -0.11 -3.68 1.47 0.00 -1.18 0.00 0.00 32.58 29.08 1q82 s HIS 106 CO 0.11 -2.02 1.35 -1.13 -0.65 0.00 0.00 174.74 172.40 1q82 n SER 107 N 1.72 0.03 -1.77 9.88 3.41 -1.26 -1.43 113.62 124.21 1q82 n SER 107 Ca 0.03 0.92 -0.11 0.00 -0.26 0.00 0.00 58.87 59.45 1q82 n SER 107 Cb 0.42 -0.46 0.07 0.00 -0.26 0.00 0.00 64.21 63.98 1q82 n SER 107 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1q82 n GLU 108 N -3.79 2.59 0.21 4.33 1.02 -1.26 -4.66 120.64 119.08 1q82 n GLU 108 Ca 0.38 -3.71 0.11 0.00 -0.02 0.00 0.00 57.16 53.92 1q82 n GLU 108 Cb 1.69 -1.86 0.21 0.00 -0.02 0.00 0.00 31.44 31.45 1q82 n GLU 108 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1q82 h LEU 109 N 1.88 0.00 0.00 -4.62 5.85 -1.61 -3.16 115.31 113.64 1q82 h LEU 109 Ca 0.16 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.88 1q82 h LEU 109 Cb 1.39 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.42 1q82 h LEU 109 CO 0.44 0.09 0.00 -0.90 -0.34 0.00 0.00 178.44 177.73 1q82 n ASP 110 N -3.13 0.00 -0.05 1.25 5.75 -1.26 -1.73 116.55 117.39 1q82 n ASP 110 Ca 0.03 -1.43 0.12 0.00 -0.01 0.00 0.00 54.79 53.50 1q82 n ASP 110 Cb 0.54 0.00 0.27 0.00 -1.03 0.00 0.00 41.12 40.90 1q82 n ASP 110 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1q82 n ARG 111 N -0.57 0.16 0.00 0.11 1.74 -1.20 -4.45 116.66 112.45 1q82 n ARG 111 Ca 0.03 -0.09 0.00 0.00 -0.77 0.00 0.00 57.85 57.01 1q82 n ARG 111 Cb 0.01 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 29.95 1q82 n ARG 111 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1q82 n THR 112 N -1.34 0.00 -4.20 0.55 -1.04 -0.87 -4.94 114.28 102.44 1q82 n THR 112 Ca 0.07 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.85 1q82 n THR 112 Cb 0.34 -0.67 -0.06 0.00 -1.82 0.00 0.00 70.33 68.12 1q82 n THR 112 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1q82 s LEU 113 N -4.83 3.31 -1.03 -4.42 1.43 -0.70 -5.03 118.68 107.40 1q82 s LEU 113 Ca 0.00 -0.64 -0.15 0.00 -1.03 0.00 0.00 54.13 52.31 1q82 s LEU 113 Cb 0.00 -1.81 0.17 0.00 0.03 0.00 0.00 46.19 44.58 1q82 s LEU 113 CO 0.00 -0.12 1.18 -1.81 0.23 0.00 0.00 176.35 175.83 1q82 s ASP 114 N -3.76 6.88 0.20 2.29 1.01 -1.26 -4.20 116.67 117.83 1q82 s ASP 114 Ca 0.34 -2.65 -0.32 0.00 0.71 0.00 0.00 52.55 50.63 1q82 s ASP 114 Cb -0.05 -2.35 -0.14 0.00 1.01 0.00 0.00 42.92 41.38 1q82 s ASP 114 CO 0.22 -0.79 1.32 0.52 0.21 0.00 0.00 175.17 176.64 1q82 n VAL 115 N 4.64 0.83 -1.73 -1.27 0.31 -1.26 -4.89 118.33 114.95 1q82 n VAL 115 Ca 0.27 -0.21 -0.42 0.00 -0.01 0.00 0.00 64.34 63.97 1q82 n VAL 115 Cb 0.45 -1.20 -0.02 0.00 -0.91 0.00 0.00 33.84 32.17 1q82 n VAL 115 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1q82 n PRO 116 N 2.02 2.69 -0.00 5.55 -0.02 -1.26 -4.91 135.00 139.07 1q82 n PRO 116 Ca 0.14 0.96 0.04 0.00 -2.02 0.00 0.00 63.50 62.62 1q82 n PRO 116 Cb 0.28 -2.76 -0.06 0.00 -0.02 0.00 0.00 33.50 30.94 1q82 n PRO 116 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1q82 n GLU 117 N 2.65 0.28 -3.41 -0.52 1.02 -1.26 -4.93 120.64 114.47 1q82 n GLU 117 Ca 0.11 -0.07 -0.16 0.00 -0.02 0.00 0.00 57.16 57.02 1q82 n GLU 117 Cb 0.36 -1.19 -0.10 0.00 -0.02 0.00 0.00 31.44 30.49 1q82 n GLU 117 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1q82 s ASP 118 N -2.93 1.28 0.02 1.62 1.01 -1.26 -5.14 116.67 111.27 1q82 s ASP 118 Ca -0.03 -0.41 0.01 0.00 0.71 0.00 0.00 52.55 52.83 1q82 s ASP 118 Cb 0.05 0.61 -0.02 0.00 1.01 0.00 0.00 42.92 44.57 1q82 s ASP 118 CO 0.34 -0.35 -0.05 -2.28 0.21 0.00 0.00 175.17 173.03 1q82 s HIS 119 N 2.39 0.47 -0.71 4.23 5.65 -1.26 -5.11 115.29 120.96 1q82 s HIS 119 Ca 0.09 -0.35 -0.07 0.00 0.25 0.00 0.00 55.06 54.99 1q82 s HIS 119 Cb -0.15 -0.29 0.18 0.00 -1.18 0.00 0.00 32.58 31.15 1q82 s HIS 119 CO -0.24 -0.08 0.57 0.34 -0.65 0.00 0.00 174.74 174.69 1q82 s ASP 120 N -1.03 5.80 0.16 9.88 -1.08 -1.26 -4.95 116.67 124.19 1q82 s ASP 120 Ca -0.07 -2.84 -0.16 0.00 -0.52 0.00 0.00 52.55 48.96 1q82 s ASP 120 Cb -0.07 -1.98 0.08 0.00 -1.46 0.00 0.00 42.92 39.49 1q82 s ASP 120 CO -0.00 -0.43 1.74 -0.65 0.52 0.00 0.00 175.17 176.35 1q82 h PRO 121 N 7.24 0.24 0.09 4.34 0.11 -1.92 -2.97 132.00 139.14 1q82 h PRO 121 Ca 0.04 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.14 1q82 h PRO 121 Cb 0.98 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.02 1q82 h PRO 121 CO 0.73 0.16 -0.11 -0.44 -0.21 0.00 0.00 178.00 178.13 1q82 h ASP 122 N 0.25 -0.30 -0.64 -2.05 5.19 -1.98 -0.08 116.42 116.81 1q82 h ASP 122 Ca 0.17 0.03 0.11 0.00 -0.62 0.00 0.00 57.03 56.73 1q82 h ASP 122 Cb 0.17 0.11 -0.08 0.00 0.18 0.00 0.00 39.33 39.71 1q82 h ASP 122 CO -0.20 -0.17 0.21 0.00 -3.12 0.00 0.00 179.24 175.96 1q82 h ALA 123 N 0.66 0.83 0.49 3.45 0.00 -1.98 1.08 119.26 123.79 1q82 h ALA 123 Ca 0.01 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1q82 h ALA 123 Cb 0.24 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1q82 h ALA 123 CO -0.05 -0.23 -0.25 0.00 0.00 0.00 0.00 179.25 178.72 1q82 h ALA 124 N 1.47 -0.68 -0.70 0.00 0.00 -1.34 0.16 119.26 118.17 1q82 h ALA 124 Ca 0.34 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 55.25 1q82 h ALA 124 Cb 0.47 0.28 -0.10 0.00 0.00 0.00 0.00 17.79 18.43 1q82 h ALA 124 CO -0.36 -0.89 0.15 1.49 0.00 0.00 0.00 179.25 179.65 1q82 h GLU 125 N -0.68 0.25 0.48 0.00 4.81 0.80 0.03 114.58 120.27 1q82 h GLU 125 Ca -0.06 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 1q82 h GLU 125 Cb 0.53 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.84 1q82 h GLU 125 CO 0.10 0.17 -0.37 1.49 -0.73 0.00 0.00 179.01 179.66 1q82 h GLU 126 N 0.26 -0.81 -1.01 1.92 4.81 0.18 -0.86 114.58 119.06 1q82 h GLU 126 Ca 0.39 0.06 0.26 0.00 -0.13 0.00 0.00 59.36 59.93 1q82 h GLU 126 Cb 0.65 0.18 -0.12 0.00 0.63 0.00 0.00 28.75 30.09 1q82 h GLU 126 CO -0.49 -0.54 0.61 0.37 -0.73 0.00 0.00 179.01 178.23 1q82 h GLN 127 N -0.84 0.52 -0.12 1.92 4.15 0.56 0.83 115.11 122.12 1q82 h GLN 127 Ca -0.05 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.31 1q82 h GLN 127 Cb 0.72 -0.12 -0.00 0.00 0.21 0.00 0.00 27.48 28.29 1q82 h GLN 127 CO -0.00 0.34 -0.04 0.82 -1.93 0.00 0.00 178.83 178.02 1q82 h ILE 128 N 0.53 1.30 -0.10 2.39 2.04 -0.39 -2.10 117.51 121.19 1q82 h ILE 128 Ca 0.65 -1.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.44 1q82 h ILE 128 Cb 1.32 1.72 -0.01 0.00 -0.74 0.00 0.00 36.82 39.11 1q82 h ILE 128 CO -0.45 0.29 -0.25 0.03 0.00 0.00 0.00 178.15 177.76 1q82 h ARG 129 N -0.09 0.17 -0.21 2.37 3.08 0.23 -0.23 114.38 119.69 1q82 h ARG 129 Ca 0.03 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 1q82 h ARG 129 Cb 0.46 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 1q82 h ARG 129 CO 0.01 0.42 -0.06 -0.44 -1.07 0.00 0.00 179.97 178.83 1q82 h ASP 130 N 0.15 0.42 -0.79 7.04 3.32 -0.85 0.29 116.42 126.00 1q82 h ASP 130 Ca 0.02 -0.38 0.06 0.00 0.02 0.00 0.00 57.03 56.76 1q82 h ASP 130 Cb 0.53 -0.12 -0.06 0.00 0.22 0.00 0.00 39.33 39.91 1q82 h ASP 130 CO 0.04 0.70 0.47 0.00 -1.72 0.00 0.00 179.24 178.73 1q82 h ALA 131 N 0.73 1.08 -0.39 3.45 0.00 -0.92 0.25 119.26 123.47 1q82 h ALA 131 Ca 0.05 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1q82 h ALA 131 Cb 0.53 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1q82 h ALA 131 CO 0.02 0.18 -0.09 1.25 0.00 0.00 0.00 179.25 180.61 1q82 h HIS 132 N 0.85 0.72 -0.63 0.00 -0.00 -0.76 0.02 115.15 115.35 1q82 h HIS 132 Ca 0.35 -0.12 -0.01 0.00 -0.00 0.00 0.00 60.37 60.59 1q82 h HIS 132 Cb 0.20 -0.19 -0.03 0.00 -0.00 0.00 0.00 27.41 27.39 1q82 h HIS 132 CO -0.05 0.74 0.35 0.93 -0.00 0.00 0.00 177.93 179.90 1q82 h GLU 133 N 0.62 0.88 0.00 5.26 5.08 0.84 -1.52 114.58 125.73 1q82 h GLU 133 Ca 0.11 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1q82 h GLU 133 Cb 0.52 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1q82 h GLU 133 CO 0.03 0.66 0.00 0.00 -1.00 0.00 0.00 179.01 178.70 1q82 n ALA 134 N -2.32 1.97 -2.91 3.43 0.00 -0.10 -4.93 120.51 115.64 1q82 n ALA 134 Ca 0.05 -0.01 -0.09 0.00 0.00 0.00 0.00 53.44 53.38 1q82 n ALA 134 Cb 0.09 -1.39 0.03 0.00 0.00 0.00 0.00 19.45 18.17 1q82 n ALA 134 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q82 n GLY 135 N 0.67 0.33 0.04 0.00 0.00 -0.08 -4.93 105.19 101.22 1q82 n GLY 135 Ca 0.04 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1q82 n GLY 135 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1q82 n ASP 136 N -0.47 1.33 -4.63 1.61 8.00 -0.77 -4.99 116.55 116.63 1q82 n ASP 136 Ca -0.01 -1.28 -0.43 0.00 0.71 0.00 0.00 54.79 53.79 1q82 n ASP 136 Cb 0.53 -0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.60 1q82 n ASP 136 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1q82 s LEU 137 N -0.31 3.93 0.60 0.64 2.96 -1.24 0.24 118.68 125.51 1q82 s LEU 137 Ca 0.01 1.58 -0.01 0.00 -0.22 0.00 0.00 54.13 55.49 1q82 s LEU 137 Cb 0.01 -3.53 0.05 0.00 0.50 0.00 0.00 46.19 43.21 1q82 s LEU 137 CO 0.01 -1.18 0.85 -0.83 -1.32 0.00 0.00 176.35 173.88 1q82 s GLY 138 N 3.80 1.79 0.61 7.98 0.00 0.73 -4.78 107.32 117.46 1q82 s GLY 138 Ca 0.68 -1.25 -0.16 0.00 0.00 0.00 0.00 44.72 43.99 1q82 s GLY 138 CO 0.27 -0.92 -0.90 2.09 0.00 0.00 0.00 173.10 173.65 1q82 n ASP 139 N -2.53 -2.09 -4.07 1.64 5.75 -1.26 -4.02 116.55 109.97 1q82 n ASP 139 Ca 0.08 0.01 -0.25 0.00 -0.01 0.00 0.00 54.79 54.63 1q82 n ASP 139 Cb 0.60 -0.33 -0.16 0.00 -1.03 0.00 0.00 41.12 40.20 1q82 n ASP 139 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1q82 s LEU 140 N 4.91 1.78 0.07 -2.12 1.43 -1.26 -3.19 118.68 120.29 1q82 s LEU 140 Ca 0.22 -0.32 0.02 0.00 -1.03 0.00 0.00 54.13 53.02 1q82 s LEU 140 Cb 0.04 -0.89 -0.03 0.00 0.03 0.00 0.00 46.19 45.35 1q82 s LEU 140 CO 0.42 0.08 -0.08 -0.13 0.23 0.00 0.00 176.35 176.88 1q82 s ARG 141 N 0.39 0.70 -0.16 1.70 0.52 -0.87 -0.06 118.95 121.16 1q82 s ARG 141 Ca -0.10 -1.05 -0.04 0.00 -0.52 0.00 0.00 55.73 54.02 1q82 s ARG 141 Cb -0.14 -0.28 -0.03 0.00 0.52 0.00 0.00 34.95 35.02 1q82 s ARG 141 CO 0.03 0.03 -0.04 -0.51 0.02 0.00 0.00 175.30 174.83 1q82 s LEU 142 N -2.31 3.23 -0.12 2.53 1.43 0.16 0.34 118.68 123.94 1q82 s LEU 142 Ca 0.01 -0.15 -0.29 0.00 -1.03 0.00 0.00 54.13 52.67 1q82 s LEU 142 Cb -0.03 -1.78 -0.03 0.00 0.03 0.00 0.00 46.19 44.38 1q82 s LEU 142 CO -0.02 0.15 1.39 -0.63 0.23 0.00 0.00 176.35 177.48 1q82 s ILE 143 N 0.45 4.04 0.21 -0.59 -1.09 0.15 -1.48 121.20 122.90 1q82 s ILE 143 Ca -0.04 1.26 0.09 0.00 -2.23 0.00 0.00 60.65 59.74 1q82 s ILE 143 Cb -0.14 -3.82 -0.05 0.00 -1.58 0.00 0.00 42.46 36.88 1q82 s ILE 143 CO 0.03 -0.11 -0.17 -0.89 -1.23 0.00 0.00 174.94 172.57 1q82 s THR 144 N 3.64 1.95 0.11 2.92 2.01 -0.12 -1.53 115.64 124.62 1q82 s THR 144 Ca 0.61 -2.17 -0.10 0.00 0.31 0.00 0.00 61.69 60.34 1q82 s THR 144 Cb -0.26 -2.05 0.00 0.00 0.01 0.00 0.00 72.50 70.21 1q82 s THR 144 CO 0.20 -0.46 0.25 -1.38 -0.69 0.00 0.00 174.62 172.54 1q82 s HIS 145 N -2.56 0.16 0.59 4.92 -3.43 -1.15 0.20 115.29 114.02 1q82 s HIS 145 Ca 0.22 -0.56 0.10 0.00 -0.80 0.00 0.00 55.06 54.02 1q82 s HIS 145 Cb -0.03 -0.01 0.10 0.00 -1.43 0.00 0.00 32.58 31.20 1q82 s HIS 145 CO 0.09 -0.62 0.82 0.95 -2.00 0.00 0.00 174.74 173.98 1q82 s THR 146 N -3.88 2.05 -0.54 -5.38 -4.23 -0.86 -2.13 115.64 100.68 1q82 s THR 146 Ca 0.08 -1.00 0.06 0.00 -1.18 0.00 0.00 61.69 59.65 1q82 s THR 146 Cb 0.04 -2.05 0.21 0.00 1.34 0.00 0.00 72.50 72.04 1q82 s THR 146 CO -0.08 0.00 0.53 0.52 -0.54 0.00 0.00 174.62 175.04 1q82 n VAL 147 N -2.29 0.52 -0.07 2.29 0.31 -1.26 -4.46 118.33 113.36 1q82 n VAL 147 Ca 0.17 -4.38 0.24 0.00 -0.01 0.00 0.00 64.34 60.35 1q82 n VAL 147 Cb 0.62 -1.97 0.70 0.00 -0.91 0.00 0.00 33.84 32.28 1q82 n VAL 147 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1q82 h PRO 148 N 4.79 0.00 -0.02 5.55 0.11 -1.81 0.34 132.00 140.97 1q82 h PRO 148 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1q82 h PRO 148 Cb 0.80 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.91 1q82 h PRO 148 CO 0.60 0.00 0.02 0.22 -0.21 0.00 0.00 178.00 178.62 1q82 h ASP 149 N 0.00 0.00 0.79 -2.05 3.58 -1.80 0.36 116.42 117.29 1q82 h ASP 149 Ca 0.32 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.77 1q82 h ASP 149 Cb 1.30 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.35 1q82 h ASP 149 CO -0.00 0.00 0.00 0.00 -2.88 0.00 0.00 179.24 176.36 1q82 n ALA 150 N -2.37 2.01 -4.01 -0.78 0.00 0.12 -4.39 120.51 111.10 1q82 n ALA 150 Ca -0.03 -0.07 -0.31 0.00 0.00 0.00 0.00 53.44 53.03 1q82 n ALA 150 Cb 0.10 -1.36 -0.15 0.00 0.00 0.00 0.00 19.45 18.04 1q82 n ALA 150 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1q82 s VAL 151 N -3.02 2.12 0.13 0.00 1.01 0.13 -5.00 120.40 115.77 1q82 s VAL 151 Ca 0.10 -2.05 -0.19 0.00 0.00 0.00 0.00 61.98 59.85 1q82 s VAL 151 Cb 0.14 -2.47 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 1q82 s VAL 151 CO 0.41 -0.43 1.74 -0.65 0.00 0.00 0.00 175.10 176.17 1q82 h PRO 152 N 7.70 0.16 -0.02 2.72 0.11 -1.76 -2.47 132.00 138.44 1q82 h PRO 152 Ca -0.09 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.02 1q82 h PRO 152 Cb 1.03 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.10 1q82 h PRO 152 CO 0.50 0.11 0.12 0.77 -0.21 0.00 0.00 178.00 179.28 1q82 h SER 153 N 0.17 0.00 -3.48 -2.05 0.02 -1.85 -3.37 113.55 102.99 1q82 h SER 153 Ca 0.10 0.00 -0.71 0.00 -0.84 0.00 0.00 61.79 60.34 1q82 h SER 153 Cb 0.09 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 62.42 1q82 h SER 153 CO -0.12 0.00 -0.31 -0.69 -1.14 0.00 0.00 176.83 174.56 1q82 s VAL 154 N -4.23 5.18 0.27 2.27 1.01 -0.93 -4.85 120.40 119.11 1q82 s VAL 154 Ca -0.05 -0.59 -0.03 0.00 0.00 0.00 0.00 61.98 61.31 1q82 s VAL 154 Cb 0.12 -4.01 0.32 0.00 0.00 0.00 0.00 36.38 32.81 1q82 s VAL 154 CO 0.40 -0.41 1.62 -0.65 0.00 0.00 0.00 175.10 176.06 1q82 h PRO 155 N 8.70 0.10 -7.01 2.72 0.11 -1.82 -3.44 132.00 131.35 1q82 h PRO 155 Ca -0.27 -0.01 -0.54 0.00 0.11 0.00 0.00 66.00 65.30 1q82 h PRO 155 Cb 1.11 -0.02 0.11 0.00 0.11 0.00 0.00 31.00 32.31 1q82 h PRO 155 CO 0.78 0.07 0.60 -1.59 -0.21 0.00 0.00 178.00 177.65 1q82 s LYS 156 N -6.06 3.48 -0.03 1.05 -2.85 -1.26 -4.93 119.74 109.15 1q82 s LYS 156 Ca -0.13 2.16 0.03 0.00 -1.00 0.00 0.00 55.97 57.02 1q82 s LYS 156 Cb 0.25 -2.43 -0.04 0.00 -2.06 0.00 0.00 37.83 33.55 1q82 s LYS 156 CO 0.76 -0.89 0.01 1.63 0.10 0.00 0.00 175.35 176.96 1q82 n LYS 157 N -0.60 3.28 -1.58 1.78 5.02 -1.26 -3.97 118.16 120.83 1q82 n LYS 157 Ca 0.08 -0.00 -0.46 0.00 -2.02 0.00 0.00 58.31 55.91 1q82 n LYS 157 Cb 0.45 -1.08 -0.04 0.00 -0.02 0.00 0.00 35.03 34.33 1q82 n LYS 157 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1q82 n LYS 158 N -2.15 1.87 -1.95 1.97 4.81 -1.26 -4.55 118.16 116.90 1q82 n LYS 158 Ca -0.05 0.58 -0.34 0.00 -0.87 0.00 0.00 58.31 57.62 1q82 n LYS 158 Cb 0.60 -2.91 0.03 0.00 0.02 0.00 0.00 35.03 32.77 1q82 n LYS 158 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 1q82 s PRO 159 N 5.70 2.99 -0.23 1.64 0.02 -1.26 -4.85 135.00 139.02 1q82 s PRO 159 Ca 1.00 1.54 -0.10 0.00 0.02 0.00 0.00 61.00 63.46 1q82 s PRO 159 Cb -0.55 -1.96 -0.05 0.00 0.02 0.00 0.00 34.50 31.96 1q82 s PRO 159 CO 0.43 -1.13 0.15 -0.51 -0.33 0.00 0.00 177.00 175.61 1q82 s ASP 160 N -2.15 6.12 -0.15 2.53 1.01 -1.26 -4.88 116.67 117.89 1q82 s ASP 160 Ca 0.71 0.14 -0.05 0.00 0.71 0.00 0.00 52.55 54.06 1q82 s ASP 160 Cb -0.23 -2.10 -0.03 0.00 1.01 0.00 0.00 42.92 41.57 1q82 s ASP 160 CO 0.35 0.10 0.02 -0.69 0.21 0.00 0.00 175.17 175.16 1q82 s VAL 161 N 0.85 4.44 -0.09 -1.27 1.01 -1.26 -2.03 120.40 122.05 1q82 s VAL 161 Ca 0.08 -0.17 -0.13 0.00 0.00 0.00 0.00 61.98 61.75 1q82 s VAL 161 Cb -0.13 -2.95 0.03 0.00 0.00 0.00 0.00 36.38 33.33 1q82 s VAL 161 CO 0.03 0.51 0.34 0.00 0.00 0.00 0.00 175.10 175.98 1q82 s MET 162 N -0.01 0.51 -0.04 2.72 0.23 0.13 -4.98 119.30 117.86 1q82 s MET 162 Ca 0.04 0.26 -0.23 0.00 -1.03 0.00 0.00 55.69 54.73 1q82 s MET 162 Cb -0.13 0.24 -0.04 0.00 -1.53 0.00 0.00 34.83 33.37 1q82 s MET 162 CO 0.02 -0.10 0.70 -2.00 -2.03 0.00 0.00 175.02 171.61 1q82 s GLU 163 N -0.34 4.43 -0.02 3.16 2.12 -1.26 -0.94 118.70 125.85 1q82 s GLU 163 Ca -0.05 0.90 0.06 0.00 0.36 0.00 0.00 54.97 56.24 1q82 s GLU 163 Cb -0.03 -3.42 -0.01 0.00 0.26 0.00 0.00 34.13 30.92 1q82 s GLU 163 CO 0.02 0.14 -0.20 0.99 -0.54 0.00 0.00 175.26 175.67 1q82 s THR 164 N 0.53 1.59 0.57 -1.70 2.01 -0.55 -4.95 115.64 113.16 1q82 s THR 164 Ca 0.37 -0.85 -0.16 0.00 0.31 0.00 0.00 61.69 61.37 1q82 s THR 164 Cb -0.18 -1.34 -0.05 0.00 0.01 0.00 0.00 72.50 70.94 1q82 s THR 164 CO 0.19 0.45 1.03 -0.60 -0.69 0.00 0.00 174.62 175.01 1q82 s ARG 165 N -0.35 3.51 -0.26 4.92 3.52 -1.26 0.37 118.95 129.40 1q82 s ARG 165 Ca 0.05 1.10 0.02 0.00 -0.13 0.00 0.00 55.73 56.77 1q82 s ARG 165 Cb -0.09 -2.06 0.06 0.00 -1.56 0.00 0.00 34.95 31.30 1q82 s ARG 165 CO 0.00 -0.65 -0.08 0.08 -0.81 0.00 0.00 175.30 173.85 1q82 s VAL 166 N -2.56 1.93 -0.12 7.11 1.01 0.91 -0.65 120.40 128.03 1q82 s VAL 166 Ca 0.61 -1.53 -0.04 0.00 0.00 0.00 0.00 61.98 61.02 1q82 s VAL 166 Cb -0.14 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 1q82 s VAL 166 CO 0.37 -0.10 0.03 -0.83 0.00 0.00 0.00 175.10 174.57 1q82 s GLY 167 N 1.20 1.88 0.04 4.51 0.00 -0.90 -4.46 107.32 109.60 1q82 s GLY 167 Ca -0.06 -0.77 -0.01 0.00 0.00 0.00 0.00 44.72 43.87 1q82 s GLY 167 CO -0.06 -0.31 0.08 0.61 0.00 0.00 0.00 173.10 173.42 1q82 n GLY 168 N 2.68 2.34 0.00 0.20 0.00 -1.26 -1.03 105.19 108.13 1q82 n GLY 168 Ca -0.18 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1q82 n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q82 n GLY 169 N -0.06 -1.30 3.94 -0.02 0.00 -1.17 -4.66 105.19 101.91 1q82 n GLY 169 Ca -0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 1q82 n GLY 169 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1q82 s SER 170 N -2.39 5.76 0.15 1.61 1.04 -1.26 -4.93 113.70 113.68 1q82 s SER 170 Ca 0.00 0.46 -0.12 0.00 0.48 0.00 0.00 55.95 56.77 1q82 s SER 170 Cb 0.00 -1.62 0.03 0.00 0.10 0.00 0.00 66.02 64.53 1q82 s SER 170 CO 0.00 -0.83 1.63 -0.37 0.98 0.00 0.00 173.24 174.65 1q82 h VAL 171 N 0.19 1.26 0.08 5.02 -1.51 -1.99 -1.20 116.25 118.09 1q82 h VAL 171 Ca -0.46 -0.99 -0.00 0.00 -1.23 0.00 0.00 66.70 64.01 1q82 h VAL 171 Cb 1.25 0.90 0.00 0.00 -2.13 0.00 0.00 31.29 31.32 1q82 h VAL 171 CO 0.59 0.35 -0.04 0.28 -1.23 0.00 0.00 177.57 177.52 1q82 h SER 172 N 0.74 -0.09 0.06 4.19 0.02 -1.99 0.11 113.55 116.60 1q82 h SER 172 Ca 0.15 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1q82 h SER 172 Cb 0.44 0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.00 1q82 h SER 172 CO 0.02 -0.03 -0.05 0.44 -1.14 0.00 0.00 176.83 176.07 1q82 h ASP 173 N -0.13 -0.12 0.84 3.07 3.32 -1.92 -2.25 116.42 119.24 1q82 h ASP 173 Ca -0.01 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 1q82 h ASP 173 Cb 0.11 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1q82 h ASP 173 CO 0.02 -0.07 -0.23 0.08 -1.72 0.00 0.00 179.24 177.31 1q82 h ARG 174 N -0.11 0.00 0.41 3.56 0.11 -1.15 -1.08 114.38 116.11 1q82 h ARG 174 Ca -0.00 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.06 1q82 h ARG 174 Cb 0.10 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.18 1q82 h ARG 174 CO -0.00 0.23 -0.20 1.25 0.10 0.00 0.00 179.97 181.35 1q82 h LEU 175 N 0.00 -0.46 -0.15 0.08 6.46 -0.43 0.15 115.31 120.96 1q82 h LEU 175 Ca -0.00 -0.00 0.04 0.00 -0.12 0.00 0.00 57.88 57.80 1q82 h LEU 175 Cb 0.71 0.12 -0.05 0.00 -0.73 0.00 0.00 40.66 40.71 1q82 h LEU 175 CO 0.03 -0.30 -0.15 0.44 -0.62 0.00 0.00 178.44 177.84 1q82 h ASP 176 N -0.58 -0.46 -0.92 1.25 3.32 -1.16 -0.91 116.42 116.96 1q82 h ASP 176 Ca -0.06 0.09 0.21 0.00 0.02 0.00 0.00 57.03 57.29 1q82 h ASP 176 Cb 0.44 0.22 -0.12 0.00 0.22 0.00 0.00 39.33 40.10 1q82 h ASP 176 CO 0.09 -0.19 0.46 -0.74 -1.72 0.00 0.00 179.24 177.14 1q82 h HIS 177 N -0.17 0.78 0.73 4.55 2.76 -0.81 0.10 115.15 123.09 1q82 h HIS 177 Ca 0.10 0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.27 1q82 h HIS 177 Cb 0.32 -0.20 0.01 0.00 1.55 0.00 0.00 27.41 29.08 1q82 h HIS 177 CO -0.27 0.04 -0.35 0.00 -1.30 0.00 0.00 177.93 176.05 1q82 h ALA 178 N 1.68 -0.97 -0.77 5.26 0.00 0.54 -2.36 119.26 122.63 1q82 h ALA 178 Ca 0.56 -0.22 0.15 0.00 0.00 0.00 0.00 54.91 55.39 1q82 h ALA 178 Cb 1.01 0.38 -0.10 0.00 0.00 0.00 0.00 17.79 19.08 1q82 h ALA 178 CO -0.47 -1.00 0.32 -0.07 0.00 0.00 0.00 179.25 178.02 1q82 h LEU 179 N -1.07 0.30 0.17 0.00 3.38 0.03 -1.62 115.31 116.50 1q82 h LEU 179 Ca -0.10 0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1q82 h LEU 179 Cb 0.77 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 1q82 h LEU 179 CO 0.16 0.11 -0.15 0.44 0.09 0.00 0.00 178.44 179.09 1q82 h ASP 180 N 0.45 -0.40 0.05 -0.43 3.32 -0.73 0.70 116.42 119.39 1q82 h ASP 180 Ca 0.43 0.04 0.03 0.00 0.02 0.00 0.00 57.03 57.54 1q82 h ASP 180 Cb 0.66 0.14 -0.05 0.00 0.22 0.00 0.00 39.33 40.30 1q82 h ASP 180 CO -0.41 -0.24 -0.39 0.40 -1.72 0.00 0.00 179.24 176.89 1q82 h ILE 181 N -0.35 0.20 0.22 0.35 2.04 -0.81 -2.89 117.51 116.28 1q82 h ILE 181 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1q82 h ILE 181 Cb 0.32 0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 36.57 1q82 h ILE 181 CO -0.03 0.00 -0.40 0.58 0.00 0.00 0.00 178.15 178.30 1q82 h VAL 182 N -0.57 0.00 -0.86 1.67 2.07 -1.12 -2.42 116.25 115.01 1q82 h VAL 182 Ca 0.04 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.70 1q82 h VAL 182 Cb 0.63 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.26 1q82 h VAL 182 CO -0.27 0.00 -0.31 -0.62 0.02 0.00 0.00 177.57 176.39 1q82 n GLU 183 N -4.79 -0.17 0.00 1.57 -0.58 0.22 -2.31 120.64 114.58 1q82 n GLU 183 Ca -0.08 1.33 0.00 0.00 -0.42 0.00 0.00 57.16 58.00 1q82 n GLU 183 Cb 0.34 -1.98 0.00 0.00 -0.57 0.00 0.00 31.44 29.23 1q82 n GLU 183 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1q82 n ASP 184 N -5.30 0.00 0.00 1.62 8.00 -1.10 -4.75 116.55 115.02 1q82 n ASP 184 Ca 0.10 0.63 0.00 0.00 0.71 0.00 0.00 54.79 56.23 1q82 n ASP 184 Cb 0.37 -0.13 0.00 0.00 -0.02 0.00 0.00 41.12 41.34 1q82 n ASP 184 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1q82 n GLY 185 N -0.90 0.46 3.56 0.44 0.00 -0.98 -4.91 105.19 102.87 1q82 n GLY 185 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1q82 n GLY 185 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q82 n GLY 186 N 0.00 0.96 3.67 -0.02 0.00 -0.92 -4.50 105.19 104.37 1q82 n GLY 186 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1q82 n GLY 186 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1q82 s GLU 187 N -0.28 4.16 0.10 1.61 2.12 -1.26 0.10 118.70 125.26 1q82 s GLU 187 Ca 0.00 2.43 -0.04 0.00 0.36 0.00 0.00 54.97 57.72 1q82 s GLU 187 Cb 0.00 -3.99 -0.03 0.00 0.26 0.00 0.00 34.13 30.38 1q82 s GLU 187 CO 0.00 -0.88 0.10 -3.38 -0.54 0.00 0.00 175.26 170.56 1q82 s HIS 188 N 3.95 0.53 0.22 5.30 -3.43 -0.51 -4.96 115.29 116.39 1q82 s HIS 188 Ca 0.81 -0.97 0.03 0.00 -0.80 0.00 0.00 55.06 54.13 1q82 s HIS 188 Cb -0.39 -0.29 -0.05 0.00 -1.43 0.00 0.00 32.58 30.42 1q82 s HIS 188 CO 0.36 -0.52 0.01 0.00 -2.00 0.00 0.00 174.74 172.59 1q82 s ALA 189 N -3.96 1.69 0.34 -1.38 0.00 -1.26 -1.09 121.76 116.10 1q82 s ALA 189 Ca 0.14 -1.74 0.12 0.00 0.00 0.00 0.00 51.96 50.48 1q82 s ALA 189 Cb 0.06 0.58 0.96 0.00 0.00 0.00 0.00 23.12 24.72 1q82 s ALA 189 CO -0.05 -0.30 1.73 1.98 0.00 0.00 0.00 175.76 179.13 1q82 h MET 190 N 2.51 0.50 -0.63 0.00 4.05 -1.86 0.12 114.93 119.63 1q82 h MET 190 Ca -0.38 -0.03 0.05 0.00 -0.28 0.00 0.00 59.70 59.06 1q82 h MET 190 Cb 1.22 -0.11 -0.05 0.00 -0.80 0.00 0.00 31.60 31.86 1q82 h MET 190 CO 0.64 0.33 0.36 -0.91 0.23 0.00 0.00 176.91 177.56 1q82 h ASN 191 N 0.52 0.56 0.18 1.39 2.35 -1.96 0.22 115.58 118.84 1q82 h ASN 191 Ca 0.64 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 56.41 1q82 h ASN 191 Cb 1.34 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.61 1q82 h ASN 191 CO -0.44 0.37 0.00 0.47 -1.65 0.00 0.00 177.43 176.18 1q82 n ASP 192 N -4.77 0.32 0.00 5.81 8.00 0.43 -3.72 116.55 122.61 1q82 n ASP 192 Ca 0.07 0.63 0.00 0.00 0.71 0.00 0.00 54.79 56.20 1q82 n ASP 192 Cb 0.14 -0.68 0.00 0.00 -0.02 0.00 0.00 41.12 40.56 1q82 n ASP 192 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1q82 n ILE 193 N -1.90 0.00 -4.14 0.53 5.41 -0.91 -4.90 119.36 113.45 1q82 n ILE 193 Ca 0.00 0.00 -0.28 0.00 1.00 0.00 0.00 62.75 63.48 1q82 n ILE 193 Cb 0.07 -1.39 -0.07 0.00 -0.71 0.00 0.00 39.64 37.54 1q82 n ILE 193 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 1q82 s PHE 194 N -2.00 2.99 -0.03 1.39 0.40 0.71 -5.07 117.98 116.39 1q82 s PHE 194 Ca 0.00 -0.06 0.05 0.00 -0.60 0.00 0.00 56.93 56.32 1q82 s PHE 194 Cb 0.00 -1.48 -0.01 0.00 0.51 0.00 0.00 43.02 42.04 1q82 s PHE 194 CO 0.00 0.51 -0.18 0.50 0.70 0.00 0.00 175.22 176.75 1q82 s ARG 195 N -2.78 1.60 0.13 0.44 6.06 -1.26 -4.26 118.95 118.88 1q82 s ARG 195 Ca 0.28 -0.63 -0.34 0.00 -2.50 0.00 0.00 55.73 52.55 1q82 s ARG 195 Cb -0.10 -1.48 -0.13 0.00 0.06 0.00 0.00 34.95 33.30 1q82 s ARG 195 CO 0.20 0.33 1.65 0.00 -2.50 0.00 0.00 175.30 174.97 1q82 n ALA 196 N 2.86 1.47 0.00 6.12 0.00 -1.26 -1.84 120.51 127.85 1q82 n ALA 196 Ca -0.16 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.69 1q82 n ALA 196 Cb 0.53 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.58 1q82 n ALA 196 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q82 n GLY 197 N 3.64 2.38 3.86 0.00 0.00 0.27 0.25 105.19 115.59 1q82 n GLY 197 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 1q82 n GLY 197 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1q82 s GLU 198 N -0.31 3.78 -0.13 1.61 2.02 -0.77 -3.77 118.70 121.12 1q82 s GLU 198 Ca 0.00 0.71 -0.13 0.00 0.02 0.00 0.00 54.97 55.58 1q82 s GLU 198 Cb 0.00 -2.20 -0.05 0.00 0.10 0.00 0.00 34.13 31.98 1q82 s GLU 198 CO 0.00 -0.29 0.28 0.71 0.02 0.00 0.00 175.26 175.98 1q82 s TYR 199 N -2.73 3.52 0.17 1.61 1.51 -1.26 -0.86 117.35 119.31 1q82 s TYR 199 Ca 0.55 0.63 0.06 0.00 -1.01 0.00 0.00 57.07 57.30 1q82 s TYR 199 Cb -0.10 -2.27 -0.04 0.00 -0.11 0.00 0.00 41.96 39.44 1q82 s TYR 199 CO 0.39 0.38 -0.13 0.00 -1.11 0.00 0.00 175.55 175.08 1q82 s ALA 200 N 0.00 1.70 -0.24 3.71 0.00 0.12 -1.37 121.76 125.68 1q82 s ALA 200 Ca 0.17 -1.53 -0.10 0.00 0.00 0.00 0.00 51.96 50.50 1q82 s ALA 200 Cb -0.13 -0.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.91 1q82 s ALA 200 CO 0.05 0.01 0.13 -0.51 0.00 0.00 0.00 175.76 175.44 1q82 s ASP 201 N -3.11 5.83 -0.28 0.00 1.01 0.44 0.38 116.67 120.93 1q82 s ASP 201 Ca 0.18 0.02 -0.07 0.00 0.71 0.00 0.00 52.55 53.39 1q82 s ASP 201 Cb -0.00 -2.05 -0.00 0.00 1.01 0.00 0.00 42.92 41.87 1q82 s ASP 201 CO 0.04 0.04 0.08 -0.69 0.21 0.00 0.00 175.17 174.84 1q82 s VAL 202 N 1.21 4.10 0.31 -1.27 1.01 -0.72 -1.87 120.40 123.17 1q82 s VAL 202 Ca 0.06 -0.51 0.06 0.00 0.00 0.00 0.00 61.98 61.59 1q82 s VAL 202 Cb -0.14 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.18 1q82 s VAL 202 CO 0.05 0.17 0.44 0.00 0.00 0.00 0.00 175.10 175.76 1q82 s ALA 203 N 1.54 4.13 0.00 5.51 0.00 -0.70 -0.94 121.76 131.29 1q82 s ALA 203 Ca 0.04 -1.37 0.00 0.00 0.00 0.00 0.00 51.96 50.63 1q82 s ALA 203 Cb -0.16 -1.71 0.00 0.00 0.00 0.00 0.00 23.12 21.24 1q82 s ALA 203 CO 0.03 0.04 0.00 0.41 0.00 0.00 0.00 175.76 176.24 1q82 n GLY 204 N -1.59 2.11 3.55 0.00 0.00 -0.57 -2.11 105.19 106.59 1q82 n GLY 204 Ca -0.03 -0.59 -0.43 0.00 0.00 0.00 0.00 46.02 44.97 1q82 n GLY 204 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1q82 s VAL 205 N -2.00 4.66 1.07 1.61 1.01 -1.26 -1.26 120.40 124.23 1q82 s VAL 205 Ca 0.00 0.53 -0.18 0.00 0.00 0.00 0.00 61.98 62.33 1q82 s VAL 205 Cb 0.00 -4.30 0.06 0.00 0.00 0.00 0.00 36.38 32.14 1q82 s VAL 205 CO 0.00 -0.67 -0.05 0.35 0.00 0.00 0.00 175.10 174.73 1q82 n THR 206 N 6.09 0.00 -2.16 3.92 -2.24 0.70 -3.87 114.28 116.72 1q82 n THR 206 Ca 0.03 -0.26 -0.41 0.00 -2.27 0.00 0.00 64.05 61.13 1q82 n THR 206 Cb 0.48 -0.55 -0.03 0.00 -2.10 0.00 0.00 70.33 68.14 1q82 n THR 206 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1q82 s LYS 207 N -3.34 4.35 0.34 -0.78 1.02 -1.26 -2.32 119.74 117.75 1q82 s LYS 207 Ca 0.54 2.12 -0.25 0.00 0.02 0.00 0.00 55.97 58.41 1q82 s LYS 207 Cb -0.12 -3.17 -0.10 0.00 -0.52 0.00 0.00 37.83 33.92 1q82 s LYS 207 CO 0.67 -0.30 0.93 0.20 -0.92 0.00 0.00 175.35 175.93 1q82 s GLY 208 N 0.35 2.71 -0.00 -3.33 0.00 -1.26 -2.80 107.32 102.98 1q82 s GLY 208 Ca 0.57 0.47 0.00 0.00 0.00 0.00 0.00 44.72 45.77 1q82 s GLY 208 CO 0.40 0.88 0.69 0.28 0.00 0.00 0.00 173.10 175.34 1q82 n LYS 209 N 0.34 0.90 0.00 2.90 5.02 -0.63 -4.85 118.16 121.84 1q82 n LYS 209 Ca 0.03 -0.87 0.00 0.00 -2.02 0.00 0.00 58.31 55.45 1q82 n LYS 209 Cb 0.51 -0.67 0.00 0.00 -0.02 0.00 0.00 35.03 34.85 1q82 n LYS 209 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1q82 n GLY 210 N -0.18 1.32 3.78 0.72 0.00 -1.15 -4.66 105.19 105.01 1q82 n GLY 210 Ca 0.00 -0.65 -0.39 0.00 0.00 0.00 0.00 46.02 44.98 1q82 n GLY 210 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1q82 s THR 211 N 0.00 4.50 0.09 2.61 -4.23 -1.25 -0.22 115.64 117.14 1q82 s THR 211 Ca 0.00 1.57 -0.00 0.00 -1.18 0.00 0.00 61.69 62.08 1q82 s THR 211 Cb 0.00 -4.07 -0.04 0.00 1.34 0.00 0.00 72.50 69.73 1q82 s THR 211 CO 0.00 0.52 -0.01 -1.10 -0.54 0.00 0.00 174.62 173.49 1q82 s GLN 212 N -1.03 0.79 0.86 3.99 -1.52 0.14 -4.91 119.66 117.99 1q82 s GLN 212 Ca 0.34 -1.33 -0.13 0.00 -1.95 0.00 0.00 55.36 52.29 1q82 s GLN 212 Cb -0.22 0.10 0.12 0.00 -0.22 0.00 0.00 33.01 32.79 1q82 s GLN 212 CO 0.24 -0.14 1.20 0.20 -0.25 0.00 0.00 175.29 176.54 1q82 s GLY 213 N -3.00 1.62 0.19 3.09 0.00 -1.26 -2.51 107.32 105.45 1q82 s GLY 213 Ca 0.14 -0.74 -0.11 0.00 0.00 0.00 0.00 44.72 44.01 1q82 s GLY 213 CO -0.04 -0.18 1.76 -2.55 0.00 0.00 0.00 173.10 172.09 1q82 h PRO 214 N -1.27 0.44 0.16 2.90 0.11 -1.82 0.26 132.00 132.78 1q82 h PRO 214 Ca -0.46 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 65.64 1q82 h PRO 214 Cb 1.31 -0.10 -0.04 0.00 0.11 0.00 0.00 31.00 32.28 1q82 h PRO 214 CO 0.60 0.29 -0.35 0.28 -0.21 0.00 0.00 178.00 178.61 1q82 h VAL 215 N 0.45 0.27 -0.06 3.15 2.07 -1.84 0.95 116.25 121.24 1q82 h VAL 215 Ca 0.26 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.68 1q82 h VAL 215 Cb 0.25 0.27 0.01 0.00 -1.52 0.00 0.00 31.29 30.30 1q82 h VAL 215 CO -0.23 0.00 -0.36 0.50 0.02 0.00 0.00 177.57 177.50 1q82 h LYS 216 N -0.60 0.35 -0.67 1.57 3.64 -1.83 0.19 116.57 119.22 1q82 h LYS 216 Ca 0.02 -0.29 -0.08 0.00 -1.27 0.00 0.00 60.65 59.03 1q82 h LYS 216 Cb 0.62 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.48 1q82 h LYS 216 CO -0.18 0.94 0.11 -0.09 -2.27 0.00 0.00 179.45 177.96 1q82 h ARG 217 N -0.16 1.09 -0.00 1.90 2.43 -0.38 -3.33 114.38 115.93 1q82 h ARG 217 Ca -0.03 -0.29 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 1q82 h ARG 217 Cb 1.02 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.44 1q82 h ARG 217 CO 0.07 1.00 -0.03 0.91 -1.51 0.00 0.00 179.97 180.41 1q82 n TRP 218 N -4.21 0.00 -1.97 2.20 7.02 0.32 -5.02 117.44 115.77 1q82 n TRP 218 Ca 0.04 0.00 -0.03 0.00 -1.02 0.00 0.00 57.50 56.49 1q82 n TRP 218 Cb 0.29 0.00 -0.00 0.00 -2.42 0.00 0.00 31.31 29.18 1q82 n TRP 218 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1q82 n GLY 219 N 0.89 0.27 3.81 6.99 0.00 0.67 -3.41 105.19 114.41 1q82 n GLY 219 Ca 0.00 -0.76 -0.31 0.00 0.00 0.00 0.00 46.02 44.95 1q82 n GLY 219 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1q82 s VAL 220 N -2.17 3.70 1.10 1.61 -7.23 -1.21 -4.94 120.40 111.25 1q82 s VAL 220 Ca 0.00 0.55 -0.15 0.00 -1.81 0.00 0.00 61.98 60.57 1q82 s VAL 220 Cb 0.00 -3.27 0.24 0.00 0.56 0.00 0.00 36.38 33.91 1q82 s VAL 220 CO 0.00 -0.72 1.10 -1.10 -0.31 0.00 0.00 175.10 174.07 1q82 s GLN 221 N -5.06 -0.37 0.25 4.82 -0.21 -1.26 -4.39 119.66 113.44 1q82 s GLN 221 Ca 0.59 0.26 0.06 0.00 0.02 0.00 0.00 55.36 56.29 1q82 s GLN 221 Cb -0.14 -1.67 -0.03 0.00 1.00 0.00 0.00 33.01 32.17 1q82 s GLN 221 CO 0.55 -3.21 0.33 0.15 -2.12 0.00 0.00 175.29 170.98 1q82 s LYS 222 N -5.13 3.30 0.54 2.91 1.02 -1.26 -4.80 119.74 116.31 1q82 s LYS 222 Ca 0.68 -0.85 -0.21 0.00 0.02 0.00 0.00 55.97 55.61 1q82 s LYS 222 Cb -0.15 -2.81 -0.06 0.00 -0.52 0.00 0.00 37.83 34.29 1q82 s LYS 222 CO 0.57 0.40 1.21 0.54 -0.92 0.00 0.00 175.35 177.15 1q82 n ARG 223 N -1.37 1.45 -4.19 1.68 5.12 -0.67 -4.97 116.66 113.72 1q82 n ARG 223 Ca -0.08 0.54 -0.23 0.00 -1.93 0.00 0.00 57.85 56.15 1q82 n ARG 223 Cb 0.57 -2.40 -0.06 0.00 -1.16 0.00 0.00 32.46 29.41 1q82 n ARG 223 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1q82 s LYS 224 N -2.71 2.41 0.70 5.56 -0.14 -1.26 -4.49 119.74 119.80 1q82 s LYS 224 Ca 0.71 -1.43 0.00 0.00 -1.36 0.00 0.00 55.97 53.89 1q82 s LYS 224 Cb -0.44 -2.22 0.00 0.00 -1.68 0.00 0.00 37.83 33.49 1q82 s LYS 224 CO 0.50 0.26 0.00 0.41 -0.76 0.00 0.00 175.35 175.76 1q82 n GLY 225 N -1.04 1.94 0.38 -3.33 0.00 -1.26 -1.36 105.19 100.52 1q82 n GLY 225 Ca -0.05 -0.17 0.16 0.00 0.00 0.00 0.00 46.02 45.96 1q82 n GLY 225 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1q82 h LYS 226 N 0.00 0.50 -0.32 1.61 3.64 -2.02 0.52 116.57 120.50 1q82 h LYS 226 Ca 0.00 -0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.44 1q82 h LYS 226 Cb 0.00 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 1q82 h LYS 226 CO 0.00 0.33 0.28 0.45 -2.27 0.00 0.00 179.45 178.24 1q82 h HIS 227 N 0.51 0.00 0.00 1.91 3.86 -1.59 -0.39 115.15 119.46 1q82 h HIS 227 Ca 0.44 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.65 1q82 h HIS 227 Cb 0.93 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.40 1q82 h HIS 227 CO -0.00 0.00 0.00 0.00 0.86 0.00 0.00 177.93 178.79 1q82 n ALA 228 N -2.47 1.97 0.71 2.45 0.00 0.17 -3.33 120.51 120.02 1q82 n ALA 228 Ca 0.05 -0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.57 1q82 n ALA 228 Cb 0.44 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.49 1q82 n ALA 228 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1q82 n ARG 229 N -2.01 1.65 0.18 0.00 1.74 -0.16 -4.61 116.66 113.44 1q82 n ARG 229 Ca 0.04 -0.86 0.06 0.00 -0.77 0.00 0.00 57.85 56.32 1q82 n ARG 229 Cb 0.30 -1.28 0.22 0.00 -1.02 0.00 0.00 32.46 30.68 1q82 n ARG 229 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1q82 h GLN 230 N 1.91 0.00 0.00 5.56 1.08 -1.56 -3.46 115.11 118.64 1q82 h GLN 230 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1q82 h GLN 230 Cb 0.56 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.99 1q82 h GLN 230 CO 0.00 0.38 0.00 0.41 -0.95 0.00 0.00 178.83 178.67 1q82 n GLY 231 N 0.70 -0.12 3.07 3.46 0.00 -1.26 -5.11 105.19 105.94 1q82 n GLY 231 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1q82 n GLY 231 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1q82 s TRP 232 N 0.00 2.22 0.00 1.61 0.51 -1.26 -4.97 118.94 117.05 1q82 s TRP 232 Ca 0.00 -1.14 0.00 0.00 -2.12 0.00 0.00 56.10 52.84 1q82 s TRP 232 Cb 0.00 -1.58 0.00 0.00 -0.81 0.00 0.00 33.47 31.08 1q82 s TRP 232 CO 0.00 -0.58 0.00 0.54 -0.51 0.00 0.00 176.95 176.40 1q82 n ARG 233 N 4.36 0.00 -2.56 4.98 1.74 -1.26 -4.17 116.66 119.74 1q82 n ARG 233 Ca -0.19 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.74 1q82 n ARG 233 Cb 0.51 -0.85 0.02 0.00 -1.02 0.00 0.00 32.46 31.12 1q82 n ARG 233 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1q82 n ARG 234 N -2.35 2.21 -4.31 5.56 1.74 -1.26 -1.67 116.66 116.59 1q82 n ARG 234 Ca 0.00 -3.80 -0.18 0.00 -0.77 0.00 0.00 57.85 53.11 1q82 n ARG 234 Cb 0.40 -1.72 -0.14 0.00 -1.02 0.00 0.00 32.46 29.97 1q82 n ARG 234 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1q82 s ARG 235 N -3.38 0.66 1.04 5.56 0.52 -1.26 -4.62 118.95 117.46 1q82 s ARG 235 Ca 0.36 -0.32 -0.12 0.00 -0.52 0.00 0.00 55.73 55.13 1q82 s ARG 235 Cb 0.42 -0.63 0.21 0.00 0.52 0.00 0.00 34.95 35.47 1q82 s ARG 235 CO -0.05 0.17 1.07 0.96 0.02 0.00 0.00 175.30 177.47 1q82 s ILE 236 N -0.25 2.13 0.13 1.52 -4.36 -1.26 -4.79 121.20 114.32 1q82 s ILE 236 Ca 0.03 0.04 -0.17 0.00 -0.26 0.00 0.00 60.65 60.29 1q82 s ILE 236 Cb -0.04 -2.37 -0.02 0.00 1.25 0.00 0.00 42.46 41.28 1q82 s ILE 236 CO -0.00 -0.06 1.70 1.23 0.24 0.00 0.00 174.94 178.05 1q82 h GLY 237 N -2.10 0.53 -3.01 6.27 0.00 -2.00 -3.46 103.07 99.30 1q82 h GLY 237 Ca -0.56 -0.27 0.05 0.00 0.00 0.00 0.00 47.33 46.55 1q82 h GLY 237 CO 0.54 0.25 0.33 0.54 0.00 0.00 0.00 176.54 178.21 1q82 s ASN 238 N -5.71 -0.44 0.00 0.19 4.22 -1.26 -5.01 114.94 106.92 1q82 s ASN 238 Ca -0.13 -0.07 0.20 0.00 -2.14 0.00 0.00 52.86 50.71 1q82 s ASN 238 Cb 0.09 0.52 0.89 0.00 1.28 0.00 0.00 41.25 44.04 1q82 s ASN 238 CO 0.73 -0.87 1.61 0.18 -2.04 0.00 0.00 177.10 176.72 1q82 n LEU 239 N -0.34 1.03 0.00 3.54 4.77 -1.26 -5.01 117.00 119.73 1q82 n LEU 239 Ca -0.12 -0.43 0.00 0.00 -0.03 0.00 0.00 56.01 55.43 1q82 n LEU 239 Cb 0.63 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 1q82 n LEU 239 CO 0.12 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 1q82 n GLY 240 N 1.00 1.02 3.91 -0.72 0.00 -1.26 -4.43 105.19 104.70 1q82 n GLY 240 Ca 0.15 -1.87 -0.30 0.00 0.00 0.00 0.00 46.02 44.01 1q82 n GLY 240 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1q82 s PRO 241 N -1.18 0.49 0.05 1.61 0.04 -1.26 -4.98 135.00 129.76 1q82 s PRO 241 Ca 0.00 -0.40 -0.29 0.00 0.04 0.00 0.00 61.00 60.36 1q82 s PRO 241 Cb 0.00 -1.83 -0.17 0.00 0.04 0.00 0.00 34.50 32.54 1q82 s PRO 241 CO 0.00 -2.52 1.47 2.35 0.04 0.00 0.00 177.00 178.34 1q82 h TRP 242 N -1.72 -0.61 -3.96 0.56 2.91 -2.00 -3.43 115.95 107.70 1q82 h TRP 242 Ca -0.44 -0.01 -0.69 0.00 1.13 0.00 0.00 58.89 58.87 1q82 h TRP 242 Cb 1.24 0.20 -0.30 0.00 -0.51 0.00 0.00 29.16 29.79 1q82 h TRP 242 CO -1.25 -0.32 -0.86 -0.80 -1.03 0.00 0.00 178.44 174.18 1q82 s ASN 243 N -4.70 3.23 0.13 2.65 0.01 -1.26 -2.36 114.94 112.65 1q82 s ASN 243 Ca -0.16 -0.47 -0.31 0.00 -0.71 0.00 0.00 52.86 51.21 1q82 s ASN 243 Cb 0.03 -0.91 -0.09 0.00 0.41 0.00 0.00 41.25 40.70 1q82 s ASN 243 CO 0.58 0.25 1.48 -2.16 -1.51 0.00 0.00 177.10 175.74 1q82 s PRO 244 N -0.17 4.27 -1.05 -0.60 0.04 -1.26 -5.06 135.00 131.16 1q82 s PRO 244 Ca -0.03 2.21 -0.13 0.00 0.04 0.00 0.00 61.00 63.09 1q82 s PRO 244 Cb -0.14 -3.22 -0.08 0.00 0.04 0.00 0.00 34.50 31.10 1q82 s PRO 244 CO 0.04 -0.52 2.18 -1.13 0.04 0.00 0.00 177.00 177.60 1q82 n SER 245 N 4.03 4.46 -3.55 6.66 3.41 -1.00 -4.72 113.62 122.92 1q82 n SER 245 Ca 0.13 -2.56 -0.09 0.00 -0.26 0.00 0.00 58.87 56.08 1q82 n SER 245 Cb 0.41 -1.26 -0.02 0.00 -0.26 0.00 0.00 64.21 63.08 1q82 n SER 245 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1q82 s ARG 246 N 3.75 1.25 -0.28 4.33 1.70 -1.26 -5.14 118.95 123.29 1q82 s ARG 246 Ca 0.51 -0.54 -0.11 0.00 -0.47 0.00 0.00 55.73 55.12 1q82 s ARG 246 Cb 0.13 0.52 -0.05 0.00 -0.57 0.00 0.00 34.95 34.99 1q82 s ARG 246 CO 0.01 -0.56 0.21 0.08 -1.08 0.00 0.00 175.30 173.96 1q82 s VAL 247 N -3.58 5.30 0.42 4.99 1.01 -1.26 -4.87 120.40 122.41 1q82 s VAL 247 Ca 0.05 0.16 -0.24 0.00 0.00 0.00 0.00 61.98 61.95 1q82 s VAL 247 Cb -0.02 -3.56 -0.08 0.00 0.00 0.00 0.00 36.38 32.72 1q82 s VAL 247 CO -0.07 0.22 1.17 -0.13 0.00 0.00 0.00 175.10 176.29 1q82 s ARG 248 N 1.78 3.95 0.00 2.72 0.52 -1.26 -4.91 118.95 121.74 1q82 s ARG 248 Ca 0.07 1.81 0.18 0.00 -0.52 0.00 0.00 55.73 57.27 1q82 s ARG 248 Cb -0.16 -2.57 0.84 0.00 0.52 0.00 0.00 34.95 33.57 1q82 s ARG 248 CO 0.11 -0.40 1.55 -1.13 0.02 0.00 0.00 175.30 175.45 1q82 n SER 249 N -0.14 0.00 -0.13 0.23 3.41 -1.26 -2.47 113.62 113.26 1q82 n SER 249 Ca 0.05 0.24 0.15 0.00 -0.26 0.00 0.00 58.87 59.06 1q82 n SER 249 Cb 0.47 -0.38 0.74 0.00 -0.26 0.00 0.00 64.21 64.78 1q82 n SER 249 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1q82 n THR 250 N -1.38 0.00 -3.34 6.66 -2.24 -1.26 -4.77 114.28 107.95 1q82 n THR 250 Ca 0.07 -0.07 -0.38 0.00 -2.27 0.00 0.00 64.05 61.40 1q82 n THR 250 Cb 0.17 -0.18 -0.06 0.00 -2.10 0.00 0.00 70.33 68.16 1q82 n THR 250 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1q82 s VAL 251 N -2.21 5.20 -0.18 2.28 0.11 -1.03 -5.00 120.40 119.57 1q82 s VAL 251 Ca 0.38 0.90 -0.30 0.00 -2.93 0.00 0.00 61.98 60.02 1q82 s VAL 251 Cb 0.21 -3.79 -0.07 0.00 -1.53 0.00 0.00 36.38 31.19 1q82 s VAL 251 CO 0.41 0.32 2.14 -0.81 -3.33 0.00 0.00 175.10 173.82 1q82 n PRO 252 N 3.80 2.03 -4.39 1.54 -0.04 -1.26 -4.98 135.00 131.69 1q82 n PRO 252 Ca -0.07 0.63 -0.19 0.00 -0.04 0.00 0.00 63.50 63.82 1q82 n PRO 252 Cb 0.51 -3.02 -0.10 0.00 -0.04 0.00 0.00 33.50 30.85 1q82 n PRO 252 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1q82 s GLN 253 N 5.74 1.56 0.79 0.54 -0.21 -1.26 -4.87 119.66 121.96 1q82 s GLN 253 Ca 0.99 -1.86 -0.13 0.00 0.02 0.00 0.00 55.36 54.38 1q82 s GLN 253 Cb -0.47 -0.57 0.07 0.00 1.00 0.00 0.00 33.01 33.05 1q82 s GLN 253 CO 0.40 -0.26 1.16 -1.14 -2.12 0.00 0.00 175.29 173.34 1q82 s GLN 254 N -3.94 1.84 0.00 2.91 -0.44 -1.26 -4.63 119.66 114.13 1q82 s GLN 254 Ca 0.36 1.57 0.00 0.00 -2.50 0.00 0.00 55.36 54.80 1q82 s GLN 254 Cb 0.08 -1.82 0.00 0.00 -1.64 0.00 0.00 33.01 29.63 1q82 s GLN 254 CO 0.15 -2.02 0.00 0.41 0.50 0.00 0.00 175.29 174.32 1q82 n GLY 255 N 0.01 -0.89 3.69 2.59 0.00 -1.05 -4.98 105.19 104.57 1q82 n GLY 255 Ca 0.12 -1.02 -0.42 0.00 0.00 0.00 0.00 46.02 44.69 1q82 n GLY 255 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1q82 s GLN 256 N -1.40 4.33 -0.06 1.61 -0.44 -1.26 -0.68 119.66 121.77 1q82 s GLN 256 Ca 0.00 1.85 0.01 0.00 -2.50 0.00 0.00 55.36 54.72 1q82 s GLN 256 Cb 0.00 -3.50 0.02 0.00 -1.64 0.00 0.00 33.01 27.89 1q82 s GLN 256 CO 0.00 -0.47 -0.08 0.95 0.50 0.00 0.00 175.29 176.19 1q82 s THR 257 N 2.00 0.84 0.00 -0.34 -4.23 0.70 -4.65 115.64 109.96 1q82 s THR 257 Ca 0.60 -0.29 0.00 0.00 -1.18 0.00 0.00 61.69 60.82 1q82 s THR 257 Cb -0.29 -0.81 0.00 0.00 1.34 0.00 0.00 72.50 72.73 1q82 s THR 257 CO 0.26 0.30 0.00 0.61 -0.54 0.00 0.00 174.62 175.24 1q82 n GLY 258 N 4.03 2.12 2.76 3.99 0.00 -1.26 -1.60 105.19 115.23 1q82 n GLY 258 Ca -0.23 -1.91 -0.13 0.00 0.00 0.00 0.00 46.02 43.75 1q82 n GLY 258 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1q82 n TYR 259 N 1.99 -1.67 -4.40 1.61 9.36 -0.98 -4.60 117.16 118.46 1q82 n TYR 259 Ca 0.00 0.66 -0.27 0.00 3.32 0.00 0.00 57.90 61.61 1q82 n TYR 259 Cb 0.00 -4.01 -0.13 0.00 -0.63 0.00 0.00 39.34 34.57 1q82 n TYR 259 CO 0.00 0.00 0.00 -1.01 0.22 0.00 0.00 176.86 176.07 1q82 s HIS 260 N -3.24 2.11 0.38 2.98 3.76 -1.26 -1.76 115.29 118.26 1q82 s HIS 260 Ca 0.14 -0.39 -0.24 0.00 -0.15 0.00 0.00 55.06 54.41 1q82 s HIS 260 Cb -0.06 -1.16 -0.10 0.00 1.11 0.00 0.00 32.58 32.37 1q82 s HIS 260 CO 0.50 0.27 0.99 -1.14 -0.85 0.00 0.00 174.74 174.51 1q82 s GLN 261 N -1.91 4.31 -0.12 1.40 0.74 -1.26 -0.21 119.66 122.61 1q82 s GLN 261 Ca 0.11 1.35 -0.07 0.00 0.05 0.00 0.00 55.36 56.80 1q82 s GLN 261 Cb -0.10 -2.54 0.04 0.00 1.10 0.00 0.00 33.01 31.52 1q82 s GLN 261 CO 0.05 0.02 0.28 1.03 -0.55 0.00 0.00 175.29 176.12 1q82 s ARG 262 N -2.52 0.27 -0.53 1.67 1.81 -0.39 -4.91 118.95 114.35 1q82 s ARG 262 Ca 0.56 0.54 -0.06 0.00 -1.72 0.00 0.00 55.73 55.05 1q82 s ARG 262 Cb -0.18 -0.03 0.14 0.00 -0.45 0.00 0.00 34.95 34.43 1q82 s ARG 262 CO 0.23 -0.13 0.38 0.99 -0.68 0.00 0.00 175.30 176.09 1q82 s THR 263 N 0.99 3.98 -0.24 0.02 2.01 -1.26 -1.51 115.64 119.63 1q82 s THR 263 Ca -0.07 -2.25 -0.29 0.00 0.31 0.00 0.00 61.69 59.39 1q82 s THR 263 Cb -0.08 -3.62 0.01 0.00 0.01 0.00 0.00 72.50 68.82 1q82 s THR 263 CO -0.07 -0.81 1.08 -0.70 -0.69 0.00 0.00 174.62 173.44 1q82 s GLU 264 N 0.79 4.21 0.44 4.92 2.12 -0.12 -4.90 118.70 126.15 1q82 s GLU 264 Ca 0.11 1.34 -0.19 0.00 0.36 0.00 0.00 54.97 56.58 1q82 s GLU 264 Cb -0.22 -3.68 -0.10 0.00 0.26 0.00 0.00 34.13 30.39 1q82 s GLU 264 CO -0.03 -0.71 0.93 -0.51 -0.54 0.00 0.00 175.26 174.40 1q82 s LEU 265 N 3.37 3.88 -0.98 2.70 1.02 -1.26 -1.75 118.68 125.66 1q82 s LEU 265 Ca 0.46 1.60 -0.12 0.00 0.02 0.00 0.00 54.13 56.09 1q82 s LEU 265 Cb -0.15 -4.46 -0.01 0.00 0.02 0.00 0.00 46.19 41.59 1q82 s LEU 265 CO 0.10 -0.40 0.73 0.59 0.02 0.00 0.00 176.35 177.39 1q82 n ASN 266 N -0.84 -5.78 -4.64 2.29 3.02 -1.25 -4.97 115.26 103.10 1q82 n ASN 266 Ca 0.06 -0.80 -0.38 0.00 -0.03 0.00 0.00 54.58 53.44 1q82 n ASN 266 Cb 0.54 -3.40 -0.09 0.00 -0.61 0.00 0.00 39.78 36.21 1q82 n ASN 266 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1q82 s LYS 267 N -5.08 4.06 0.03 3.52 -0.14 0.16 -4.85 119.74 117.43 1q82 s LYS 267 Ca 0.26 -0.10 -0.30 0.00 -1.36 0.00 0.00 55.97 54.47 1q82 s LYS 267 Cb -0.09 -3.59 -0.04 0.00 -1.68 0.00 0.00 37.83 32.43 1q82 s LYS 267 CO 0.85 -0.09 1.01 0.50 -0.76 0.00 0.00 175.35 176.86 1q82 s ARG 268 N 1.50 4.56 -0.68 1.68 3.52 -1.26 0.13 118.95 128.39 1q82 s ARG 268 Ca 0.12 1.48 -0.22 0.00 -0.13 0.00 0.00 55.73 56.98 1q82 s ARG 268 Cb -0.15 -3.43 0.08 0.00 -1.56 0.00 0.00 34.95 29.89 1q82 s ARG 268 CO 0.08 -0.04 0.96 -0.51 -0.81 0.00 0.00 175.30 174.98 1q82 s LEU 269 N 0.86 4.52 0.34 -0.88 1.43 -0.04 -1.45 118.68 123.47 1q82 s LEU 269 Ca 0.52 -1.13 0.05 0.00 -1.03 0.00 0.00 54.13 52.55 1q82 s LEU 269 Cb -0.23 -2.41 0.62 0.00 0.03 0.00 0.00 46.19 44.20 1q82 s LEU 269 CO 0.29 -1.38 1.86 0.40 0.23 0.00 0.00 176.35 177.74 1q82 h ILE 270 N 5.96 1.20 -1.26 -0.59 1.08 -1.49 0.78 117.51 123.20 1q82 h ILE 270 Ca -0.24 -0.87 0.15 0.00 -0.39 0.00 0.00 64.86 63.50 1q82 h ILE 270 Cb 1.07 1.09 -0.31 0.00 -3.07 0.00 0.00 36.82 35.60 1q82 h ILE 270 CO 1.17 0.29 0.73 -0.62 -0.69 0.00 0.00 178.15 179.03 1q82 s ASP 271 N -6.79 -0.19 -0.28 1.72 2.15 -1.20 -4.60 116.67 107.48 1q82 s ASP 271 Ca -0.07 0.37 0.01 0.00 0.43 0.00 0.00 52.55 53.30 1q82 s ASP 271 Cb 0.15 0.40 0.06 0.00 -0.30 0.00 0.00 42.92 43.22 1q82 s ASP 271 CO 0.76 -0.06 -0.06 -0.63 -0.17 0.00 0.00 175.17 175.00 1q82 s ILE 272 N 0.12 2.48 0.00 4.11 1.01 -1.26 0.47 121.20 128.14 1q82 s ILE 272 Ca 0.06 -1.56 0.00 0.00 0.00 0.00 0.00 60.65 59.14 1q82 s ILE 272 Cb -0.05 -2.46 0.00 0.00 0.01 0.00 0.00 42.46 39.97 1q82 s ILE 272 CO -0.12 -0.07 0.00 0.61 0.00 0.00 0.00 174.94 175.35 1q82 n GLY 273 N 4.50 5.83 3.61 6.18 0.00 -0.48 -4.98 105.19 119.85 1q82 n GLY 273 Ca -0.13 -1.56 -0.14 0.00 0.00 0.00 0.00 46.02 44.19 1q82 n GLY 273 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1q82 s GLU 274 N 1.07 0.81 0.00 1.61 2.12 -1.26 -0.23 118.70 122.83 1q82 s GLU 274 Ca 0.00 0.98 0.00 0.00 0.36 0.00 0.00 54.97 56.31 1q82 s GLU 274 Cb 0.00 0.39 0.00 0.00 0.26 0.00 0.00 34.13 34.78 1q82 s GLU 274 CO 0.00 -0.10 0.00 0.41 -0.54 0.00 0.00 175.26 175.03 1q82 n GLY 275 N 2.74 0.58 0.23 -1.50 0.00 -0.33 -4.82 105.19 102.10 1q82 n GLY 275 Ca -0.14 -2.02 0.08 0.00 0.00 0.00 0.00 46.02 43.94 1q82 n GLY 275 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1q82 n ASP 276 N 0.00 2.59 0.24 1.61 5.75 -1.26 -0.99 116.55 124.49 1q82 n ASP 276 Ca 0.00 -2.86 0.15 0.00 -0.01 0.00 0.00 54.79 52.07 1q82 n ASP 276 Cb 0.00 -0.37 0.84 0.00 -1.03 0.00 0.00 41.12 40.56 1q82 n ASP 276 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1q82 h GLU 277 N 0.40 0.00 0.00 0.11 5.08 -1.87 -2.42 114.58 115.88 1q82 h GLU 277 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1q82 h GLU 277 Cb 0.99 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.24 1q82 h GLU 277 CO 0.04 0.00 -1.24 -0.35 -1.00 0.00 0.00 179.01 176.46 1q82 n PRO 278 N -3.92 0.48 -1.66 2.33 -0.04 -1.26 -4.91 135.00 126.01 1q82 n PRO 278 Ca -0.01 -0.01 -0.41 0.00 -0.04 0.00 0.00 63.50 63.04 1q82 n PRO 278 Cb 0.21 -1.65 0.01 0.00 -0.04 0.00 0.00 33.50 32.03 1q82 n PRO 278 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1q82 n THR 279 N -2.26 2.59 -3.03 0.52 -1.04 -0.91 -4.83 114.28 105.31 1q82 n THR 279 Ca -0.00 -0.50 -0.24 0.00 -2.04 0.00 0.00 64.05 61.26 1q82 n THR 279 Cb 0.50 -1.37 0.00 0.00 -1.82 0.00 0.00 70.33 67.64 1q82 n THR 279 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1q82 s VAL 280 N -1.24 4.64 0.07 12.58 1.01 -1.26 -4.62 120.40 131.58 1q82 s VAL 280 Ca 0.63 -0.30 -0.30 0.00 0.00 0.00 0.00 61.98 62.01 1q82 s VAL 280 Cb -0.53 -3.72 -0.06 0.00 0.00 0.00 0.00 36.38 32.08 1q82 s VAL 280 CO 0.57 -0.55 1.14 -1.81 0.00 0.00 0.00 175.10 174.45 1q82 s ASP 281 N -4.12 7.17 0.00 3.32 1.01 0.08 -2.58 116.67 121.54 1q82 s ASP 281 Ca 0.45 1.97 0.00 0.00 0.71 0.00 0.00 52.55 55.68 1q82 s ASP 281 Cb -0.10 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.25 1q82 s ASP 281 CO 0.39 -0.38 0.00 0.61 0.21 0.00 0.00 175.17 176.00 1q82 n GLY 282 N 2.91 3.27 0.00 0.21 0.00 -1.26 -3.99 105.19 106.34 1q82 n GLY 282 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1q82 n GLY 282 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q82 n GLY 283 N -1.67 2.38 3.64 -0.02 0.00 -1.07 -4.90 105.19 103.54 1q82 n GLY 283 Ca 0.00 -1.80 -0.43 0.00 0.00 0.00 0.00 46.02 43.79 1q82 n GLY 283 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1q82 s PHE 284 N -2.34 2.20 -0.03 1.61 0.40 0.13 -4.71 117.98 115.24 1q82 s PHE 284 Ca 0.00 0.56 -0.39 0.00 -0.60 0.00 0.00 56.93 56.50 1q82 s PHE 284 Cb 0.00 -3.92 -0.18 0.00 0.51 0.00 0.00 43.02 39.42 1q82 s PHE 284 CO 0.00 -2.85 1.27 0.28 0.70 0.00 0.00 175.22 174.61 1q82 n VAL 285 N 6.17 0.02 -1.34 -0.44 0.31 -1.26 0.21 118.33 122.00 1q82 n VAL 285 Ca 0.18 -0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.39 1q82 n VAL 285 Cb 0.45 -0.44 -0.05 0.00 -0.91 0.00 0.00 33.84 32.89 1q82 n VAL 285 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1q82 n ASN 286 N 2.38 -5.54 0.00 4.52 3.02 -1.26 -4.74 115.26 113.64 1q82 n ASN 286 Ca 0.21 0.29 0.00 0.00 -0.03 0.00 0.00 54.58 55.05 1q82 n ASN 286 Cb 0.11 -4.08 0.00 0.00 -0.61 0.00 0.00 39.78 35.20 1q82 n ASN 286 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1q82 n TYR 287 N -2.28 0.00 -0.62 3.10 9.36 0.13 -4.93 117.16 121.92 1q82 n TYR 287 Ca -0.12 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.10 1q82 n TYR 287 Cb 0.57 0.09 0.00 0.00 -0.63 0.00 0.00 39.34 39.38 1q82 n TYR 287 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1q82 n GLY 288 N 2.63 0.19 3.54 2.98 0.00 -0.30 -4.69 105.19 109.53 1q82 n GLY 288 Ca 0.00 -1.30 -0.34 0.00 0.00 0.00 0.00 46.02 44.38 1q82 n GLY 288 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1q82 s GLU 289 N -2.00 3.66 -0.09 1.61 2.02 -1.26 0.22 118.70 122.86 1q82 s GLU 289 Ca 0.00 -0.47 -0.15 0.00 0.02 0.00 0.00 54.97 54.36 1q82 s GLU 289 Cb 0.00 -2.96 -0.05 0.00 0.10 0.00 0.00 34.13 31.22 1q82 s GLU 289 CO 0.00 0.30 0.39 0.08 0.02 0.00 0.00 175.26 176.05 1q82 s VAL 290 N 0.23 5.18 -0.45 2.63 1.01 -1.26 -4.76 120.40 122.99 1q82 s VAL 290 Ca -0.01 0.78 0.02 0.00 0.00 0.00 0.00 61.98 62.77 1q82 s VAL 290 Cb -0.13 -3.72 0.19 0.00 0.00 0.00 0.00 36.38 32.72 1q82 s VAL 290 CO 0.02 0.43 0.84 -0.62 0.00 0.00 0.00 175.10 175.77 1q82 s ASP 291 N -0.01 -1.08 0.00 3.32 2.15 -1.21 -4.16 116.67 115.68 1q82 s ASP 291 Ca 0.22 -1.14 0.00 0.00 0.43 0.00 0.00 52.55 52.06 1q82 s ASP 291 Cb -0.15 1.41 0.00 0.00 -0.30 0.00 0.00 42.92 43.88 1q82 s ASP 291 CO 0.09 -0.05 0.00 0.61 -0.17 0.00 0.00 175.17 175.65 1q82 n GLY 292 N 3.09 -0.62 3.68 2.66 0.00 -0.16 -4.72 105.19 109.11 1q82 n GLY 292 Ca 0.15 -0.95 -0.45 0.00 0.00 0.00 0.00 46.02 44.77 1q82 n GLY 292 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1q82 n PRO 293 N 0.00 2.53 -4.08 1.61 -0.02 -1.26 -1.18 135.00 132.60 1q82 n PRO 293 Ca 0.00 0.92 -0.09 0.00 -2.02 0.00 0.00 63.50 62.32 1q82 n PRO 293 Cb 0.00 -2.80 -0.09 0.00 -0.02 0.00 0.00 33.50 30.58 1q82 n PRO 293 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1q82 s TYR 294 N 3.36 0.63 0.02 6.00 -0.85 0.68 -0.65 117.35 126.53 1q82 s TYR 294 Ca 0.87 -1.06 0.04 0.00 -0.52 0.00 0.00 57.07 56.40 1q82 s TYR 294 Cb -0.56 -0.36 -0.02 0.00 0.38 0.00 0.00 41.96 41.40 1q82 s TYR 294 CO 0.43 -0.50 -0.12 0.99 -1.52 0.00 0.00 175.55 174.83 1q82 s THR 295 N -3.98 0.96 -0.31 -3.49 2.01 0.43 -1.38 115.64 109.88 1q82 s THR 295 Ca 0.16 -0.78 -0.03 0.00 0.31 0.00 0.00 61.69 61.35 1q82 s THR 295 Cb 0.07 -0.85 0.04 0.00 0.01 0.00 0.00 72.50 71.77 1q82 s THR 295 CO -0.04 0.08 0.03 -0.76 -0.69 0.00 0.00 174.62 173.24 1q82 s LEU 296 N -0.80 4.00 -0.23 4.42 1.43 0.18 -1.58 118.68 126.11 1q82 s LEU 296 Ca 0.02 -1.19 -0.13 0.00 -1.03 0.00 0.00 54.13 51.80 1q82 s LEU 296 Cb -0.06 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 1q82 s LEU 296 CO 0.00 -0.27 0.27 -0.69 0.23 0.00 0.00 176.35 175.89 1q82 s VAL 297 N 1.31 5.29 0.23 -1.59 1.01 -0.36 -1.24 120.40 125.05 1q82 s VAL 297 Ca -0.04 0.41 -0.32 0.00 0.00 0.00 0.00 61.98 62.04 1q82 s VAL 297 Cb -0.19 -3.60 -0.12 0.00 0.00 0.00 0.00 36.38 32.46 1q82 s VAL 297 CO 0.00 0.30 1.62 1.17 0.00 0.00 0.00 175.10 178.20 1q82 n LYS 298 N 4.40 2.57 0.00 2.72 4.81 -0.53 0.30 118.16 132.43 1q82 n LYS 298 Ca -0.12 0.92 0.00 0.00 -0.87 0.00 0.00 58.31 58.24 1q82 n LYS 298 Cb 0.52 -2.71 0.00 0.00 0.02 0.00 0.00 35.03 32.85 1q82 n LYS 298 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1q82 n GLY 299 N 3.11 -0.12 3.87 3.14 0.00 -0.76 -4.62 105.19 109.80 1q82 n GLY 299 Ca 0.13 -1.03 -0.22 0.00 0.00 0.00 0.00 46.02 44.91 1q82 n GLY 299 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1q82 s SER 300 N -4.00 5.74 -0.05 1.61 1.04 -1.26 -3.01 113.70 113.77 1q82 s SER 300 Ca 0.00 -0.18 0.02 0.00 0.48 0.00 0.00 55.95 56.28 1q82 s SER 300 Cb 0.00 -1.50 0.01 0.00 0.10 0.00 0.00 66.02 64.63 1q82 s SER 300 CO 0.00 -0.08 -0.11 -0.69 0.98 0.00 0.00 173.24 173.34 1q82 s VAL 301 N -2.10 1.00 1.02 5.02 1.01 -1.26 -5.03 120.40 120.06 1q82 s VAL 301 Ca 0.34 -0.43 -0.15 0.00 0.00 0.00 0.00 61.98 61.74 1q82 s VAL 301 Cb -0.08 -0.91 0.07 0.00 0.00 0.00 0.00 36.38 35.46 1q82 s VAL 301 CO 0.26 0.32 0.29 -0.81 0.00 0.00 0.00 175.10 175.16 1q82 n PRO 302 N 3.65 -0.88 0.00 2.72 -0.04 -1.26 -4.85 135.00 134.33 1q82 n PRO 302 Ca -0.22 -0.23 0.00 0.00 -0.04 0.00 0.00 63.50 63.02 1q82 n PRO 302 Cb 0.52 -1.82 0.00 0.00 -0.04 0.00 0.00 33.50 32.16 1q82 n PRO 302 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1q82 n GLY 303 N 1.66 -1.21 3.97 0.55 0.00 -1.25 -4.83 105.19 104.06 1q82 n GLY 303 Ca 0.04 -1.59 -0.22 0.00 0.00 0.00 0.00 46.02 44.25 1q82 n GLY 303 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1q82 s PRO 304 N -2.72 2.93 0.35 1.61 0.04 -1.26 -4.67 135.00 131.28 1q82 s PRO 304 Ca 0.00 -0.66 -0.28 0.00 0.04 0.00 0.00 61.00 60.10 1q82 s PRO 304 Cb 0.00 -2.58 -0.12 0.00 0.04 0.00 0.00 34.50 31.84 1q82 s PRO 304 CO 0.00 -0.34 1.31 -0.25 0.04 0.00 0.00 177.00 177.76 1q82 n ASP 305 N -2.08 2.88 0.00 6.66 8.00 -1.26 -1.59 116.55 129.16 1q82 n ASP 305 Ca 0.03 1.21 0.00 0.00 0.71 0.00 0.00 54.79 56.74 1q82 n ASP 305 Cb 0.58 -1.50 0.00 0.00 -0.02 0.00 0.00 41.12 40.18 1q82 n ASP 305 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1q82 n LYS 306 N 0.51 0.00 -2.61 -1.24 5.02 0.23 -4.98 118.16 115.09 1q82 n LYS 306 Ca 0.04 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.99 1q82 n LYS 306 Cb 0.37 -0.74 -0.04 0.00 -0.02 0.00 0.00 35.03 34.59 1q82 n LYS 306 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1q82 s ARG 307 N -0.46 3.99 0.09 1.97 3.52 -0.62 -4.66 118.95 122.79 1q82 s ARG 307 Ca 0.00 1.34 -0.30 0.00 -0.13 0.00 0.00 55.73 56.64 1q82 s ARG 307 Cb 0.00 -2.23 -0.06 0.00 -1.56 0.00 0.00 34.95 31.10 1q82 s ARG 307 CO 0.00 -0.27 1.14 -1.17 -0.81 0.00 0.00 175.30 174.20 1q82 s LEU 308 N -3.20 4.41 0.02 -0.88 2.96 -1.26 -2.11 118.68 118.62 1q82 s LEU 308 Ca 0.64 2.00 0.07 0.00 -0.22 0.00 0.00 54.13 56.61 1q82 s LEU 308 Cb -0.16 -3.59 -0.02 0.00 0.50 0.00 0.00 46.19 42.92 1q82 s LEU 308 CO 0.20 -0.37 -0.20 0.68 -1.32 0.00 0.00 176.35 175.35 1q82 s VAL 309 N 0.63 1.57 0.09 1.68 -7.23 -0.76 -4.61 120.40 111.77 1q82 s VAL 309 Ca 0.55 -1.06 0.06 0.00 -1.81 0.00 0.00 61.98 59.72 1q82 s VAL 309 Cb -0.29 -1.35 -0.04 0.00 0.56 0.00 0.00 36.38 35.26 1q82 s VAL 309 CO 0.31 0.26 -0.07 -0.13 -0.31 0.00 0.00 175.10 175.17 1q82 s ARG 310 N -0.93 2.29 0.11 4.82 0.52 -0.89 -2.03 118.95 122.84 1q82 s ARG 310 Ca 0.07 -0.94 0.09 0.00 -0.52 0.00 0.00 55.73 54.42 1q82 s ARG 310 Cb -0.08 -2.39 -0.04 0.00 0.52 0.00 0.00 34.95 32.96 1q82 s ARG 310 CO 0.01 0.53 -0.17 -0.06 0.02 0.00 0.00 175.30 175.63 1q82 s PHE 311 N -1.22 2.57 -0.19 -0.53 0.40 0.19 -1.73 117.98 117.47 1q82 s PHE 311 Ca 0.22 -0.24 -0.18 0.00 -0.60 0.00 0.00 56.93 56.13 1q82 s PHE 311 Cb -0.11 -1.37 0.05 0.00 0.51 0.00 0.00 43.02 42.10 1q82 s PHE 311 CO 0.14 0.39 0.52 0.50 0.70 0.00 0.00 175.22 177.47 1q82 s ARG 312 N -2.13 0.61 0.25 0.44 3.52 -0.78 -1.58 118.95 119.28 1q82 s ARG 312 Ca 0.18 0.70 -0.31 0.00 -0.13 0.00 0.00 55.73 56.18 1q82 s ARG 312 Cb -0.11 0.30 -0.11 0.00 -1.56 0.00 0.00 34.95 33.47 1q82 s ARG 312 CO 0.11 -0.07 1.62 -2.14 -0.81 0.00 0.00 175.30 174.00 1q82 s PRO 313 N 0.25 4.14 0.15 5.12 0.02 -1.26 0.17 135.00 143.58 1q82 s PRO 313 Ca -0.00 2.54 -0.33 0.00 0.02 0.00 0.00 61.00 63.23 1q82 s PRO 313 Cb -0.04 -3.06 -0.17 0.00 0.02 0.00 0.00 34.50 31.26 1q82 s PRO 313 CO 0.01 -0.65 0.99 0.00 -0.33 0.00 0.00 177.00 177.01 1q82 n ALA 314 N 2.99 -1.81 0.05 -1.55 0.00 -0.47 -4.56 120.51 115.16 1q82 n ALA 314 Ca 0.11 0.48 0.02 0.00 0.00 0.00 0.00 53.44 54.05 1q82 n ALA 314 Cb 0.37 -1.88 -0.07 0.00 0.00 0.00 0.00 19.45 17.87 1q82 n ALA 314 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1q82 h VAL 315 N 2.31 0.44 -2.08 0.00 -1.51 -1.91 -3.41 116.25 110.08 1q82 h VAL 315 Ca -0.41 -1.86 -0.56 0.00 -1.23 0.00 0.00 66.70 62.64 1q82 h VAL 315 Cb 1.38 1.97 -0.38 0.00 -2.13 0.00 0.00 31.29 32.14 1q82 h VAL 315 CO 0.65 0.25 -1.03 -2.11 -1.23 0.00 0.00 177.57 174.10 1q82 n ARG 316 N -2.87 0.49 -2.80 5.19 1.85 -1.26 -4.95 116.66 112.31 1q82 n ARG 316 Ca -0.08 -3.14 -0.33 0.00 -1.00 0.00 0.00 57.85 53.30 1q82 n ARG 316 Cb 0.80 -1.41 -0.07 0.00 -1.05 0.00 0.00 32.46 30.73 1q82 n ARG 316 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 1q82 s PRO 317 N -0.58 4.20 -0.19 2.89 0.02 -1.26 -4.84 135.00 135.24 1q82 s PRO 317 Ca 0.34 1.09 0.18 0.00 0.02 0.00 0.00 61.00 62.63 1q82 s PRO 317 Cb 0.11 -2.19 -0.24 0.00 0.02 0.00 0.00 34.50 32.20 1q82 s PRO 317 CO -0.15 -0.04 0.08 0.09 -0.33 0.00 0.00 177.00 176.65 1q82 n ASN 318 N -0.70 0.15 -4.71 2.53 3.02 -1.26 -5.00 115.26 109.29 1q82 n ASN 318 Ca 0.07 0.00 -0.23 0.00 -0.03 0.00 0.00 54.58 54.39 1q82 n ASN 318 Cb 0.54 1.01 -0.07 0.00 -0.61 0.00 0.00 39.78 40.65 1q82 n ASN 318 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1q82 s ASP 319 N -5.39 4.66 0.43 6.41 1.01 -1.26 -5.12 116.67 117.41 1q82 s ASP 319 Ca -0.10 -0.73 -0.15 0.00 0.71 0.00 0.00 52.55 52.28 1q82 s ASP 319 Cb 0.06 -0.78 -0.08 0.00 1.01 0.00 0.00 42.92 43.13 1q82 s ASP 319 CO 0.81 -0.21 0.87 -1.58 0.21 0.00 0.00 175.17 175.26 1q82 s GLN 320 N -3.80 3.97 0.36 8.23 2.00 -1.26 -5.02 119.66 124.14 1q82 s GLN 320 Ca 0.36 0.80 -0.28 0.00 -2.00 0.00 0.00 55.36 54.24 1q82 s GLN 320 Cb -0.03 -2.27 -0.10 0.00 0.80 0.00 0.00 33.01 31.40 1q82 s GLN 320 CO 0.22 -0.07 1.30 -2.14 -0.50 0.00 0.00 175.29 174.10 1q82 s PRO 321 N -3.61 4.21 -0.58 1.67 0.02 -1.26 -4.97 135.00 130.48 1q82 s PRO 321 Ca 0.56 2.18 0.05 0.00 0.02 0.00 0.00 61.00 63.81 1q82 s PRO 321 Cb -0.10 -2.95 0.17 0.00 0.02 0.00 0.00 34.50 31.65 1q82 s PRO 321 CO 0.25 -0.29 0.45 0.54 -0.33 0.00 0.00 177.00 177.61 1q82 n ARG 322 N 0.54 1.19 -0.90 5.54 1.74 -1.25 -5.07 116.66 118.46 1q82 n ARG 322 Ca 0.01 -3.96 -0.34 0.00 -0.77 0.00 0.00 57.85 52.80 1q82 n ARG 322 Cb 0.43 -2.02 0.09 0.00 -1.02 0.00 0.00 32.46 29.94 1q82 n ARG 322 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1q82 n LEU 323 N 2.25 -1.58 -1.79 0.55 4.77 -1.26 -4.32 117.00 115.62 1q82 n LEU 323 Ca 0.24 0.33 -0.09 0.00 -0.03 0.00 0.00 56.01 56.46 1q82 n LEU 323 Cb 0.41 -1.09 0.01 0.00 -2.33 0.00 0.00 43.42 40.41 1q82 n LEU 323 CO 0.20 -4.19 -0.07 0.47 -1.33 0.00 0.00 177.39 172.48 1q82 n ASP 324 N 0.03 -1.27 -4.77 -1.43 9.92 0.14 -4.87 116.55 114.29 1q82 n ASP 324 Ca 0.05 -0.07 -0.39 0.00 -0.53 0.00 0.00 54.79 53.85 1q82 n ASP 324 Cb 0.54 -0.38 -0.01 0.00 -0.64 0.00 0.00 41.12 40.63 1q82 n ASP 324 CO 0.00 0.00 0.00 -2.84 0.13 0.00 0.00 177.20 174.49 1q82 s PRO 325 N -0.92 4.03 -0.19 -0.24 0.02 -1.26 -4.94 135.00 131.50 1q82 s PRO 325 Ca 0.08 2.10 -0.29 0.00 0.02 0.00 0.00 61.00 62.90 1q82 s PRO 325 Cb -0.01 -2.78 -0.01 0.00 0.02 0.00 0.00 34.50 31.72 1q82 s PRO 325 CO 0.21 -0.42 1.30 -2.00 -0.33 0.00 0.00 177.00 175.76 1q82 s GLU 326 N -2.19 4.16 -0.46 5.54 2.12 -1.26 -4.98 118.70 121.62 1q82 s GLU 326 Ca 0.56 1.61 -0.14 0.00 0.36 0.00 0.00 54.97 57.35 1q82 s GLU 326 Cb -0.37 -3.80 0.07 0.00 0.26 0.00 0.00 34.13 30.29 1q82 s GLU 326 CO 0.47 -0.81 0.37 0.08 -0.54 0.00 0.00 175.26 174.83 1q82 s VAL 327 N 3.74 5.05 0.01 3.70 1.01 -1.26 -2.53 120.40 130.13 1q82 s VAL 327 Ca 0.56 -1.11 0.11 0.00 0.00 0.00 0.00 61.98 61.54 1q82 s VAL 327 Cb -0.21 -4.02 -0.16 0.00 0.00 0.00 0.00 36.38 31.99 1q82 s VAL 327 CO 0.17 -0.55 1.13 0.03 0.00 0.00 0.00 175.10 175.88 1q82 h ARG 328 N 8.69 0.00 -2.57 2.72 3.08 -1.77 -3.47 114.38 121.05 1q82 h ARG 328 Ca -0.27 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.67 1q82 h ARG 328 Cb 1.11 0.00 -0.24 0.00 0.08 0.00 0.00 29.97 30.92 1q82 h ARG 328 CO 0.85 0.74 -0.17 -0.47 -1.07 0.00 0.00 179.97 179.85 1q82 s TYR 329 N -2.75 -0.55 -0.18 3.04 5.04 -1.19 -4.96 117.35 115.82 1q82 s TYR 329 Ca -0.00 1.30 0.01 0.00 -2.44 0.00 0.00 57.07 55.94 1q82 s TYR 329 Cb 0.09 0.20 0.03 0.00 0.35 0.00 0.00 41.96 42.63 1q82 s TYR 329 CO 0.81 -0.27 -0.11 0.08 -1.34 0.00 0.00 175.55 174.72 1q82 s VAL 330 N 0.40 1.56 0.13 3.14 1.01 -1.26 0.17 120.40 125.55 1q82 s VAL 330 Ca -0.01 -0.82 -0.31 0.00 0.00 0.00 0.00 61.98 60.84 1q82 s VAL 330 Cb -0.04 -1.57 -0.08 0.00 0.00 0.00 0.00 36.38 34.69 1q82 s VAL 330 CO -0.01 0.28 1.36 -0.55 0.00 0.00 0.00 175.10 176.17 1q82 s SER 331 N 1.46 6.86 0.00 3.32 0.15 -0.59 -4.89 113.70 120.01 1q82 s SER 331 Ca 0.01 2.33 0.01 0.00 0.70 0.00 0.00 55.95 59.01 1q82 s SER 331 Cb -0.15 -2.59 0.04 0.00 -1.71 0.00 0.00 66.02 61.61 1q82 s SER 331 CO -0.09 -0.61 1.03 0.59 1.20 0.00 0.00 173.24 175.35 1q82 n ASN 332 N 3.59 2.11 -4.77 5.45 3.02 -1.26 -4.67 115.26 118.72 1q82 n ASN 332 Ca 0.10 -1.98 -0.41 0.00 -0.03 0.00 0.00 54.58 52.26 1q82 n ASN 332 Cb 0.43 -0.03 -0.01 0.00 -0.61 0.00 0.00 39.78 39.56 1q82 n ASN 332 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1q82 s GLU 333 N -0.98 4.19 0.28 3.52 2.12 -1.26 -0.74 118.70 125.83 1q82 s GLU 333 Ca 0.03 2.45 -0.30 0.00 0.36 0.00 0.00 54.97 57.51 1q82 s GLU 333 Cb 0.02 -3.01 -0.13 0.00 0.26 0.00 0.00 34.13 31.27 1q82 s GLU 333 CO 0.02 -0.42 1.40 0.45 -0.54 0.00 0.00 175.26 176.18 1q82 n SER 334 N 0.66 2.96 0.00 -1.70 2.88 -1.26 -4.25 113.62 112.92 1q82 n SER 334 Ca 0.01 1.16 0.11 0.00 -1.33 0.00 0.00 58.87 58.82 1q82 n SER 334 Cb 0.40 -1.48 0.63 0.00 -0.75 0.00 0.00 64.21 63.01 1q82 n SER 334 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1q82 n ASN 335 N 1.70 0.00 -4.41 -3.46 3.02 -1.26 -4.60 115.26 106.25 1q82 n ASN 335 Ca 0.09 -1.12 -0.37 0.00 -0.03 0.00 0.00 54.58 53.15 1q82 n ASN 335 Cb 0.34 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.38 1q82 n ASN 335 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1q82 s GLN 336 N -2.00 3.49 0.00 3.52 -0.21 -1.26 -4.99 119.66 118.21 1q82 s GLN 336 Ca 0.32 -0.59 0.00 0.00 0.02 0.00 0.00 55.36 55.11 1q82 s GLN 336 Cb 0.15 -3.32 0.00 0.00 1.00 0.00 0.00 33.01 30.83 1q82 s GLN 336 CO 0.24 -0.26 0.00 0.41 -2.12 0.00 0.00 175.29 173.57