#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ai0 s VAL 2 N 0.00 3.90 -0.00 2.12 1.01 -1.26 -4.20 120.40 121.97 2ai0 s VAL 2 Ca 0.00 1.52 -0.00 0.00 0.00 0.00 0.00 61.98 63.50 2ai0 s VAL 2 Cb 0.00 -3.97 0.00 0.00 0.00 0.00 0.00 36.38 32.41 2ai0 s VAL 2 CO 0.00 0.21 0.00 -0.75 0.00 0.00 0.00 175.10 174.56 2ai0 s LYS 3 N 0.19 -0.00 -0.11 2.72 2.20 0.42 -4.98 119.74 120.17 2ai0 s LYS 3 Ca 0.53 0.02 0.01 0.00 -0.36 0.00 0.00 55.97 56.17 2ai0 s LYS 3 Cb -0.30 -0.02 0.02 0.00 -1.51 0.00 0.00 37.83 36.02 2ai0 s LYS 3 CO 0.33 -0.01 -0.12 -0.51 -0.36 0.00 0.00 175.35 174.67 2ai0 s LEU 4 N 0.09 1.56 -0.32 5.43 1.43 -1.26 -1.28 118.68 124.33 2ai0 s LEU 4 Ca -0.01 -0.39 0.03 0.00 -1.03 0.00 0.00 54.13 52.74 2ai0 s LEU 4 Cb -0.01 -1.00 0.09 0.00 0.03 0.00 0.00 46.19 45.30 2ai0 s LEU 4 CO -0.00 -0.03 0.02 -0.69 0.23 0.00 0.00 176.35 175.88 2ai0 s VAL 5 N 1.23 2.16 0.30 -1.59 1.01 -0.32 -4.05 120.40 119.14 2ai0 s VAL 5 Ca -0.02 -2.14 -0.26 0.00 0.00 0.00 0.00 61.98 59.56 2ai0 s VAL 5 Cb -0.14 -2.53 -0.10 0.00 0.00 0.00 0.00 36.38 33.61 2ai0 s VAL 5 CO -0.04 -0.49 0.92 -1.61 0.00 0.00 0.00 175.10 173.88 2ai0 s GLU 6 N 0.99 4.58 0.20 2.72 8.01 -1.26 -0.81 118.70 133.13 2ai0 s GLU 6 Ca 0.07 1.30 -0.00 0.00 0.01 0.00 0.00 54.97 56.35 2ai0 s GLU 6 Cb -0.19 -2.86 -0.04 0.00 -4.31 0.00 0.00 34.13 26.73 2ai0 s GLU 6 CO -0.08 0.32 0.11 -1.54 0.01 0.00 0.00 175.26 174.07 2ai0 s SER 7 N -1.57 0.43 0.00 -0.19 1.04 -0.28 -4.77 113.70 108.34 2ai0 s SER 7 Ca 0.48 -1.36 0.00 0.00 0.48 0.00 0.00 55.95 55.56 2ai0 s SER 7 Cb -0.19 0.31 0.00 0.00 0.10 0.00 0.00 66.02 66.24 2ai0 s SER 7 CO 0.24 -0.79 0.00 0.61 0.98 0.00 0.00 173.24 174.28 2ai0 n GLY 8 N -0.29 0.75 3.77 7.32 0.00 -1.26 -1.72 105.19 113.76 2ai0 n GLY 8 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2ai0 n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ai0 s GLY 9 N -1.91 2.86 0.00 -0.02 0.00 -1.26 -4.67 107.32 102.31 2ai0 s GLY 9 Ca 0.00 1.08 0.00 0.00 0.00 0.00 0.00 44.72 45.80 2ai0 s GLY 9 CO 0.00 1.59 0.00 0.61 0.00 0.00 0.00 173.10 175.30 2ai0 n GLY 10 N 0.60 1.76 3.70 0.20 0.00 -0.69 -4.82 105.19 105.93 2ai0 n GLY 10 Ca 0.06 -0.76 -0.37 0.00 0.00 0.00 0.00 46.02 44.95 2ai0 n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ai0 s LEU 11 N 0.00 4.18 -0.03 0.99 2.96 -1.26 -1.75 118.68 123.77 2ai0 s LEU 11 Ca 0.00 0.35 0.04 0.00 -0.22 0.00 0.00 54.13 54.29 2ai0 s LEU 11 Cb 0.00 -2.28 -0.00 0.00 0.50 0.00 0.00 46.19 44.41 2ai0 s LEU 11 CO 0.00 0.06 -0.14 0.68 -1.32 0.00 0.00 176.35 175.63 2ai0 s VAL 12 N 0.81 1.17 0.29 1.68 -7.23 -0.13 -5.00 120.40 111.99 2ai0 s VAL 12 Ca 0.13 -0.59 -0.29 0.00 -1.81 0.00 0.00 61.98 59.41 2ai0 s VAL 12 Cb -0.13 -1.01 -0.10 0.00 0.56 0.00 0.00 36.38 35.71 2ai0 s VAL 12 CO 0.04 0.34 1.20 -0.54 -0.31 0.00 0.00 175.10 175.83 2ai0 s LYS 13 N -0.03 4.51 0.24 4.82 1.02 -1.25 -0.39 119.74 128.66 2ai0 s LYS 13 Ca -0.01 1.98 -0.31 0.00 0.02 0.00 0.00 55.97 57.66 2ai0 s LYS 13 Cb -0.09 -3.15 -0.14 0.00 -0.52 0.00 0.00 37.83 33.93 2ai0 s LYS 13 CO 0.01 0.01 1.26 -0.35 -0.92 0.00 0.00 175.35 175.36 2ai0 n PRO 14 N 1.22 1.71 0.00 -1.68 -0.04 -1.26 -0.16 135.00 134.78 2ai0 n PRO 14 Ca 0.00 0.61 0.00 0.00 -0.04 0.00 0.00 63.50 64.07 2ai0 n PRO 14 Cb 0.43 -2.16 0.00 0.00 -0.04 0.00 0.00 33.50 31.73 2ai0 n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ai0 n GLY 15 N 1.78 2.00 3.80 0.55 0.00 0.11 -4.91 105.19 108.52 2ai0 n GLY 15 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 2ai0 n GLY 15 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ai0 s GLY 16 N -2.18 1.68 0.17 -0.02 0.00 0.77 -3.87 107.32 103.87 2ai0 s GLY 16 Ca 0.00 -0.99 0.07 0.00 0.00 0.00 0.00 44.72 43.80 2ai0 s GLY 16 CO 0.00 -0.23 -0.14 -0.56 0.00 0.00 0.00 173.10 172.17 2ai0 s SER 17 N -4.43 2.28 -0.23 1.64 0.01 -1.26 -2.48 113.70 109.23 2ai0 s SER 17 Ca 0.71 -0.95 -0.19 0.00 1.31 0.00 0.00 55.95 56.83 2ai0 s SER 17 Cb -0.08 -0.10 0.06 0.00 0.21 0.00 0.00 66.02 66.12 2ai0 s SER 17 CO 0.54 -0.18 0.60 -0.22 0.41 0.00 0.00 173.24 174.38 2ai0 s LEU 18 N -3.01 -0.39 -0.21 2.44 2.96 0.00 -5.00 118.68 115.48 2ai0 s LEU 18 Ca 0.17 1.23 -0.06 0.00 -0.22 0.00 0.00 54.13 55.25 2ai0 s LEU 18 Cb -0.02 2.04 -0.03 0.00 0.50 0.00 0.00 46.19 48.69 2ai0 s LEU 18 CO 0.05 -0.21 0.04 -0.60 -1.32 0.00 0.00 176.35 174.30 2ai0 s ARG 19 N 0.66 3.71 -0.06 1.98 3.52 -1.26 -0.50 118.95 126.99 2ai0 s ARG 19 Ca -0.03 -0.47 -0.06 0.00 -0.13 0.00 0.00 55.73 55.04 2ai0 s ARG 19 Cb -0.05 -3.20 -0.04 0.00 -1.56 0.00 0.00 34.95 30.10 2ai0 s ARG 19 CO -0.04 -0.00 0.19 -0.51 -0.81 0.00 0.00 175.30 174.12 2ai0 s LEU 20 N 1.09 4.39 0.17 -0.88 1.43 0.12 -4.61 118.68 120.38 2ai0 s LEU 20 Ca 0.03 0.48 0.10 0.00 -1.03 0.00 0.00 54.13 53.71 2ai0 s LEU 20 Cb -0.14 -2.34 -0.04 0.00 0.03 0.00 0.00 46.19 43.69 2ai0 s LEU 20 CO 0.02 0.34 -0.21 -0.44 0.23 0.00 0.00 176.35 176.29 2ai0 s SER 21 N -1.39 3.00 -0.12 2.29 0.01 -0.70 -0.83 113.70 115.96 2ai0 s SER 21 Ca 0.21 -0.83 -0.04 0.00 1.31 0.00 0.00 55.95 56.60 2ai0 s SER 21 Cb -0.13 -0.20 0.05 0.00 0.21 0.00 0.00 66.02 65.96 2ai0 s SER 21 CO 0.10 0.05 0.11 0.00 0.41 0.00 0.00 173.24 173.91 2ai0 s ALA 23 N 2.19 3.54 0.04 0.00 0.00 0.01 -1.32 121.76 126.23 2ai0 s ALA 23 Ca 0.04 -0.30 -0.16 0.00 0.00 0.00 0.00 51.96 51.53 2ai0 s ALA 23 Cb -0.14 -3.38 -0.06 0.00 0.00 0.00 0.00 23.12 19.54 2ai0 s ALA 23 CO -0.07 -1.22 0.48 0.00 0.00 0.00 0.00 175.76 174.95 2ai0 s ALA 24 N 3.08 3.65 -0.07 0.00 0.00 -0.23 -1.18 121.76 127.01 2ai0 s ALA 24 Ca 0.35 -0.11 -0.14 0.00 0.00 0.00 0.00 51.96 52.06 2ai0 s ALA 24 Cb -0.14 -2.49 0.03 0.00 0.00 0.00 0.00 23.12 20.52 2ai0 s ALA 24 CO 0.12 0.45 0.34 0.45 0.00 0.00 0.00 175.76 177.12 2ai0 s SER 25 N -1.16 -0.29 0.00 0.00 0.15 -0.40 -4.91 113.70 107.09 2ai0 s SER 25 Ca 0.27 0.39 0.00 0.00 0.70 0.00 0.00 55.95 57.31 2ai0 s SER 25 Cb -0.18 0.51 0.00 0.00 -1.71 0.00 0.00 66.02 64.64 2ai0 s SER 25 CO 0.16 -0.31 0.00 0.61 1.20 0.00 0.00 173.24 174.90 2ai0 n GLY 26 N 1.98 0.76 3.79 9.45 0.00 -1.26 -0.43 105.19 119.48 2ai0 n GLY 26 Ca -0.18 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.76 2ai0 n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2ai0 s PHE 27 N -2.32 0.12 -0.76 1.61 -0.12 -1.26 -4.37 117.98 110.87 2ai0 s PHE 27 Ca 0.00 -0.72 -0.21 0.00 -0.05 0.00 0.00 56.93 55.96 2ai0 s PHE 27 Cb 0.00 0.74 0.10 0.00 -0.63 0.00 0.00 43.02 43.23 2ai0 s PHE 27 CO 0.00 -1.46 1.01 0.99 -0.05 0.00 0.00 175.22 175.71 2ai0 s THR 28 N -2.73 4.53 0.28 -4.49 2.01 -1.26 -4.91 115.64 109.06 2ai0 s THR 28 Ca 0.16 -0.91 0.01 0.00 0.31 0.00 0.00 61.69 61.26 2ai0 s THR 28 Cb -0.05 -4.71 0.28 0.00 0.01 0.00 0.00 72.50 68.03 2ai0 s THR 28 CO 0.11 -1.45 1.81 0.15 -0.69 0.00 0.00 174.62 174.55 2ai0 h PHE 29 N 9.25 1.07 0.00 4.92 3.57 -1.95 -2.21 116.94 131.58 2ai0 h PHE 29 Ca -0.11 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.43 2ai0 h PHE 29 Cb 1.05 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 39.46 2ai0 h PHE 29 CO 1.04 0.38 0.00 2.89 -2.23 0.00 0.00 178.31 180.38 2ai0 n ARG 30 N -4.68 0.30 0.03 1.11 1.85 -1.26 -2.46 116.66 111.54 2ai0 n ARG 30 Ca 0.19 0.07 0.13 0.00 -1.00 0.00 0.00 57.85 57.23 2ai0 n ARG 30 Cb 0.40 -1.50 0.37 0.00 -1.05 0.00 0.00 32.46 30.67 2ai0 n ARG 30 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2ai0 n ASN 31 N -1.31 0.42 -4.28 2.89 3.02 -0.83 -4.62 115.26 110.55 2ai0 n ASN 31 Ca 0.11 0.16 -0.31 0.00 -0.03 0.00 0.00 54.58 54.51 2ai0 n ASN 31 Cb 0.20 -0.13 -0.16 0.00 -0.61 0.00 0.00 39.78 39.08 2ai0 n ASN 31 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2ai0 s TYR 32 N -3.05 2.34 0.84 3.10 1.51 -1.03 -4.87 117.35 116.19 2ai0 s TYR 32 Ca 0.11 -0.59 -0.11 0.00 -1.01 0.00 0.00 57.07 55.47 2ai0 s TYR 32 Cb 0.16 -1.52 0.10 0.00 -0.11 0.00 0.00 41.96 40.59 2ai0 s TYR 32 CO 0.64 -0.14 1.13 0.20 -1.11 0.00 0.00 175.55 176.27 2ai0 s GLY 33 N -0.35 1.77 0.05 0.71 0.00 -1.25 -3.86 107.32 104.39 2ai0 s GLY 33 Ca 0.02 0.51 -0.03 0.00 0.00 0.00 0.00 44.72 45.22 2ai0 s GLY 33 CO 0.02 0.90 0.03 1.06 0.00 0.00 0.00 173.10 175.10 2ai0 s MET 34 N -4.65 0.58 0.05 2.90 1.00 0.08 -1.84 119.30 117.43 2ai0 s MET 34 Ca 0.66 -0.96 -0.02 0.00 0.00 0.00 0.00 55.69 55.37 2ai0 s MET 34 Cb -0.21 0.21 -0.03 0.00 0.00 0.00 0.00 34.83 34.80 2ai0 s MET 34 CO 0.55 -0.13 -0.00 -1.12 0.00 0.00 0.00 175.02 174.32 2ai0 s SER 35 N -2.45 0.44 -0.11 3.03 0.01 -0.39 -0.80 113.70 113.43 2ai0 s SER 35 Ca -0.00 -0.95 -0.02 0.00 1.31 0.00 0.00 55.95 56.29 2ai0 s SER 35 Cb 0.02 0.22 -0.03 0.00 0.21 0.00 0.00 66.02 66.44 2ai0 s SER 35 CO -0.07 -0.61 -0.03 0.26 0.41 0.00 0.00 173.24 173.20 2ai0 s TRP 36 N -3.86 3.05 -0.06 2.43 0.52 -0.26 -0.99 118.94 119.76 2ai0 s TRP 36 Ca 0.06 -0.04 0.00 0.00 0.02 0.00 0.00 56.10 56.15 2ai0 s TRP 36 Cb 0.07 -1.84 0.02 0.00 -1.15 0.00 0.00 33.47 30.58 2ai0 s TRP 36 CO -0.10 0.24 -0.04 0.08 0.02 0.00 0.00 176.95 177.15 2ai0 s VAL 37 N -0.36 0.58 0.07 4.03 1.01 0.42 -0.86 120.40 125.28 2ai0 s VAL 37 Ca 0.06 -0.08 -0.06 0.00 0.00 0.00 0.00 61.98 61.90 2ai0 s VAL 37 Cb -0.12 -0.65 -0.05 0.00 0.00 0.00 0.00 36.38 35.56 2ai0 s VAL 37 CO 0.02 0.26 0.32 0.00 0.00 0.00 0.00 175.10 175.71 2ai0 s ARG 38 N 1.38 3.62 -0.18 2.72 1.70 -0.11 0.53 118.95 128.61 2ai0 s ARG 38 Ca -0.03 -0.05 -0.01 0.00 -0.47 0.00 0.00 55.73 55.16 2ai0 s ARG 38 Cb -0.13 -2.99 -0.00 0.00 -0.57 0.00 0.00 34.95 31.25 2ai0 s ARG 38 CO -0.03 0.57 -0.12 -1.14 -1.08 0.00 0.00 175.30 173.51 2ai0 s GLN 39 N -2.11 3.26 0.84 3.89 0.74 0.63 -0.44 119.66 126.48 2ai0 s GLN 39 Ca 0.33 -0.71 -0.11 0.00 0.05 0.00 0.00 55.36 54.92 2ai0 s GLN 39 Cb -0.13 -2.77 0.10 0.00 1.10 0.00 0.00 33.01 31.31 2ai0 s GLN 39 CO 0.20 -0.08 1.09 0.95 -0.55 0.00 0.00 175.29 176.90 2ai0 s THR 40 N 1.09 2.93 0.49 -0.34 -4.23 -0.25 -1.12 115.64 114.22 2ai0 s THR 40 Ca 0.00 0.30 0.25 0.00 -1.18 0.00 0.00 61.69 61.06 2ai0 s THR 40 Cb -0.14 -2.87 0.42 0.00 1.34 0.00 0.00 72.50 71.24 2ai0 s THR 40 CO -0.03 -0.40 1.90 -0.65 -0.54 0.00 0.00 174.62 174.91 2ai0 h PRO 41 N -1.32 0.15 -0.48 3.99 0.11 -1.91 0.33 132.00 132.87 2ai0 h PRO 41 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2ai0 h PRO 41 Cb 1.27 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2ai0 h PRO 41 CO 0.56 0.10 0.00 0.39 -0.21 0.00 0.00 178.00 178.84 2ai0 n GLU 42 N -4.38 2.10 -1.14 1.05 -0.58 -1.26 -4.93 120.64 111.50 2ai0 n GLU 42 Ca 0.17 -1.30 -0.05 0.00 -0.42 0.00 0.00 57.16 55.56 2ai0 n GLU 42 Cb 0.78 -1.44 -0.02 0.00 -0.57 0.00 0.00 31.44 30.18 2ai0 n GLU 42 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2ai0 n LYS 43 N 0.44 -0.45 -2.71 3.49 4.01 0.12 -5.01 118.16 118.04 2ai0 n LYS 43 Ca 0.12 0.59 -0.42 0.00 -0.51 0.00 0.00 58.31 58.09 2ai0 n LYS 43 Cb 0.41 -4.27 -0.03 0.00 -0.51 0.00 0.00 35.03 30.63 2ai0 n LYS 43 CO 0.00 0.00 0.00 0.50 -1.11 0.00 0.00 177.40 176.79 2ai0 s ARG 44 N -2.09 4.47 -0.11 1.97 3.52 -1.26 -4.80 118.95 120.65 2ai0 s ARG 44 Ca 0.00 1.38 -0.20 0.00 -0.13 0.00 0.00 55.73 56.78 2ai0 s ARG 44 Cb 0.00 -3.51 -0.04 0.00 -1.56 0.00 0.00 34.95 29.84 2ai0 s ARG 44 CO 0.00 -0.20 0.57 -0.51 -0.81 0.00 0.00 175.30 174.35 2ai0 s LEU 45 N 1.59 4.28 -0.06 -0.88 1.43 -1.26 -1.09 118.68 122.68 2ai0 s LEU 45 Ca 0.49 0.95 -0.00 0.00 -1.03 0.00 0.00 54.13 54.55 2ai0 s LEU 45 Cb -0.19 -2.86 0.02 0.00 0.03 0.00 0.00 46.19 43.20 2ai0 s LEU 45 CO 0.22 -0.07 -0.03 -1.61 0.23 0.00 0.00 176.35 175.09 2ai0 s GLU 46 N 0.82 0.76 0.24 1.70 2.02 0.42 -5.00 118.70 119.65 2ai0 s GLU 46 Ca 0.30 -0.02 -0.30 0.00 0.02 0.00 0.00 54.97 54.98 2ai0 s GLU 46 Cb -0.16 -0.92 -0.09 0.00 0.10 0.00 0.00 34.13 33.05 2ai0 s GLU 46 CO 0.13 -0.18 1.33 -0.46 0.02 0.00 0.00 175.26 176.10 2ai0 s TRP 47 N 1.39 3.18 0.00 1.61 -0.00 -1.26 -0.93 118.94 122.93 2ai0 s TRP 47 Ca -0.04 1.24 0.00 0.00 -0.00 0.00 0.00 56.10 57.30 2ai0 s TRP 47 Cb -0.13 -3.65 0.00 0.00 -0.00 0.00 0.00 33.47 29.69 2ai0 s TRP 47 CO -0.03 -1.98 0.00 1.55 -0.00 0.00 0.00 176.95 176.49 2ai0 n VAL 48 N 2.12 0.00 -3.63 5.86 3.14 -0.04 -4.66 118.33 121.11 2ai0 n VAL 48 Ca 0.05 0.00 -0.08 0.00 -2.96 0.00 0.00 64.34 61.35 2ai0 n VAL 48 Cb 0.42 -0.14 -0.07 0.00 -1.06 0.00 0.00 33.84 32.99 2ai0 n VAL 48 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2ai0 s ALA 49 N -1.87 -2.02 0.05 1.55 0.00 -1.14 -4.16 121.76 114.17 2ai0 s ALA 49 Ca 0.00 1.78 0.05 0.00 0.00 0.00 0.00 51.96 53.80 2ai0 s ALA 49 Cb 0.00 -1.38 -0.02 0.00 0.00 0.00 0.00 23.12 21.72 2ai0 s ALA 49 CO 0.00 -0.22 -0.15 0.00 0.00 0.00 0.00 175.76 175.39 2ai0 s ALA 50 N -0.12 1.26 -0.05 0.00 0.00 -0.87 -1.10 121.76 120.88 2ai0 s ALA 50 Ca 0.03 -0.89 -0.04 0.00 0.00 0.00 0.00 51.96 51.06 2ai0 s ALA 50 Cb -0.04 -0.19 0.02 0.00 0.00 0.00 0.00 23.12 22.91 2ai0 s ALA 50 CO -0.07 0.24 0.13 -1.50 0.00 0.00 0.00 175.76 174.56 2ai0 s ILE 51 N -0.92 -0.02 0.83 0.00 2.07 0.02 -1.66 121.20 121.53 2ai0 s ILE 51 Ca 0.02 0.06 -0.11 0.00 -1.41 0.00 0.00 60.65 59.21 2ai0 s ILE 51 Cb -0.08 -0.19 0.09 0.00 0.13 0.00 0.00 42.46 42.40 2ai0 s ILE 51 CO 0.02 0.03 1.10 -0.94 -1.91 0.00 0.00 174.94 173.23 2ai0 s SER 52 N 0.45 4.18 0.20 4.50 1.04 -0.21 -0.74 113.70 123.12 2ai0 s SER 52 Ca -0.03 1.35 -0.11 0.00 0.48 0.00 0.00 55.95 57.64 2ai0 s SER 52 Cb -0.05 -2.07 0.26 0.00 0.10 0.00 0.00 66.02 64.27 2ai0 s SER 52 CO -0.02 -2.17 1.71 1.23 0.98 0.00 0.00 173.24 174.97 2ai0 h GLY 53 N -1.23 0.73 0.51 7.32 0.00 -1.83 -2.26 103.07 106.32 2ai0 h GLY 53 Ca -0.48 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 46.82 2ai0 h GLY 53 CO 0.58 -0.09 0.00 1.16 0.00 0.00 0.00 176.54 178.19 2ai0 n ASN 54 N -5.11 0.29 0.00 0.19 0.23 -1.26 -4.92 115.26 104.67 2ai0 n ASN 54 Ca 0.08 -1.29 0.00 0.00 -0.53 0.00 0.00 54.58 52.84 2ai0 n ASN 54 Cb 0.30 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 37.99 2ai0 n ASN 54 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 2ai0 n SER 55 N -0.68 -2.53 0.16 0.53 7.64 -0.85 -4.83 113.62 113.06 2ai0 n SER 55 Ca 0.18 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.19 2ai0 n SER 55 Cb 0.13 -2.04 0.29 0.00 -1.01 0.00 0.00 64.21 61.58 2ai0 n SER 55 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2ai0 h LEU 56 N 0.00 0.00 -8.29 -3.43 3.38 -1.91 -3.41 115.31 101.64 2ai0 h LEU 56 Ca 0.00 -0.00 -0.67 0.00 0.09 0.00 0.00 57.88 57.30 2ai0 h LEU 56 Cb 0.33 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 40.77 2ai0 h LEU 56 CO 0.00 0.00 -0.81 -0.47 0.09 0.00 0.00 178.44 177.26 2ai0 s TYR 57 N -3.15 2.81 0.10 1.13 5.04 -1.26 -5.04 117.35 116.97 2ai0 s TYR 57 Ca 0.09 -1.19 0.07 0.00 -2.44 0.00 0.00 57.07 53.60 2ai0 s TYR 57 Cb 0.09 -1.93 -0.03 0.00 0.35 0.00 0.00 41.96 40.43 2ai0 s TYR 57 CO 0.63 -0.58 -0.17 0.95 -1.34 0.00 0.00 175.55 175.04 2ai0 s THR 58 N 1.06 1.44 0.15 4.34 -4.23 -1.26 -1.05 115.64 116.09 2ai0 s THR 58 Ca -0.01 -1.49 -0.12 0.00 -1.18 0.00 0.00 61.69 58.89 2ai0 s THR 58 Cb -0.14 -1.38 0.01 0.00 1.34 0.00 0.00 72.50 72.33 2ai0 s THR 58 CO -0.04 -0.18 0.34 -0.94 -0.54 0.00 0.00 174.62 173.26 2ai0 s SER 59 N -1.94 -0.06 -0.02 3.99 1.04 -0.66 -4.99 113.70 111.05 2ai0 s SER 59 Ca 0.04 -0.66 -0.13 0.00 0.48 0.00 0.00 55.95 55.68 2ai0 s SER 59 Cb -0.09 0.46 0.02 0.00 0.10 0.00 0.00 66.02 66.51 2ai0 s SER 59 CO 0.03 -0.90 0.28 -0.31 0.98 0.00 0.00 173.24 173.33 2ai0 s TYR 60 N -3.90 -0.16 0.66 5.02 1.51 -1.26 -2.06 117.35 117.16 2ai0 s TYR 60 Ca 0.11 0.25 -0.12 0.00 -1.01 0.00 0.00 57.07 56.30 2ai0 s TYR 60 Cb 0.02 0.07 -0.01 0.00 -0.11 0.00 0.00 41.96 41.94 2ai0 s TYR 60 CO -0.04 -0.35 1.05 -1.25 -1.11 0.00 0.00 175.55 173.85 2ai0 s PRO 61 N -1.21 3.10 0.41 -1.71 0.04 -1.26 -4.78 135.00 129.60 2ai0 s PRO 61 Ca -0.13 0.99 0.13 0.00 0.04 0.00 0.00 61.00 62.04 2ai0 s PRO 61 Cb -0.05 -2.01 0.99 0.00 0.04 0.00 0.00 34.50 33.46 2ai0 s PRO 61 CO 0.03 -0.97 1.93 -0.44 0.04 0.00 0.00 177.00 177.60 2ai0 h ASP 62 N -0.39 0.44 -0.08 6.66 3.32 -1.97 -0.91 116.42 123.49 2ai0 h ASP 62 Ca -0.45 0.02 0.02 0.00 0.02 0.00 0.00 57.03 56.65 2ai0 h ASP 62 Cb 1.21 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.69 2ai0 h ASP 62 CO 0.57 0.25 0.10 0.77 -1.72 0.00 0.00 179.24 179.21 2ai0 h SER 63 N 0.48 0.00 0.00 6.45 4.64 -1.99 -3.24 113.55 119.89 2ai0 h SER 63 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 2ai0 h SER 63 Cb 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 2ai0 h SER 63 CO -0.12 0.00 -0.50 1.33 -0.87 0.00 0.00 176.83 176.67 2ai0 n VAL 64 N -3.70 0.00 -1.62 0.95 0.24 -0.55 -5.03 118.33 108.62 2ai0 n VAL 64 Ca -0.01 -0.14 -0.49 0.00 -2.04 0.00 0.00 64.34 61.66 2ai0 n VAL 64 Cb 0.19 0.61 -0.05 0.00 -1.47 0.00 0.00 33.84 33.12 2ai0 n VAL 64 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2ai0 n LYS 65 N -1.03 1.54 0.00 7.34 4.81 -0.46 -1.11 118.16 129.25 2ai0 n LYS 65 Ca 0.00 0.55 0.00 0.00 -0.87 0.00 0.00 58.31 57.99 2ai0 n LYS 65 Cb 0.00 -2.20 0.00 0.00 0.02 0.00 0.00 35.03 32.85 2ai0 n LYS 65 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2ai0 n GLY 66 N 2.61 3.10 0.07 3.14 0.00 -1.26 -4.82 105.19 108.04 2ai0 n GLY 66 Ca 0.16 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.11 2ai0 n GLY 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ai0 n ARG 67 N -0.79 1.49 -4.20 1.61 1.74 -0.27 -4.99 116.66 111.25 2ai0 n ARG 67 Ca 0.00 0.01 -0.35 0.00 -0.77 0.00 0.00 57.85 56.75 2ai0 n ARG 67 Cb 0.00 -1.36 -0.09 0.00 -1.02 0.00 0.00 32.46 29.99 2ai0 n ARG 67 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2ai0 s PHE 68 N -2.34 3.22 -0.21 -1.55 0.40 -0.97 -1.38 117.98 115.16 2ai0 s PHE 68 Ca -0.10 0.13 -0.01 0.00 -0.60 0.00 0.00 56.93 56.35 2ai0 s PHE 68 Cb 0.05 -1.92 0.06 0.00 0.51 0.00 0.00 43.02 41.71 2ai0 s PHE 68 CO 0.54 0.33 -0.02 0.99 0.70 0.00 0.00 175.22 177.76 2ai0 s THR 69 N -0.33 1.11 0.15 0.64 2.01 0.12 -4.88 115.64 114.47 2ai0 s THR 69 Ca 0.08 -0.90 -0.26 0.00 0.31 0.00 0.00 61.69 60.92 2ai0 s THR 69 Cb -0.12 -1.45 -0.08 0.00 0.01 0.00 0.00 72.50 70.87 2ai0 s THR 69 CO 0.02 -0.11 0.81 -0.51 -0.69 0.00 0.00 174.62 174.14 2ai0 s ILE 70 N 1.60 4.39 0.28 1.82 2.07 -1.26 -0.76 121.20 129.33 2ai0 s ILE 70 Ca -0.03 1.77 -0.11 0.00 -1.41 0.00 0.00 60.65 60.87 2ai0 s ILE 70 Cb -0.18 -4.18 0.00 0.00 0.13 0.00 0.00 42.46 38.24 2ai0 s ILE 70 CO -0.07 0.48 0.51 -0.94 -1.91 0.00 0.00 174.94 173.01 2ai0 s SER 71 N -0.89 0.12 0.15 4.50 1.04 -0.91 -5.00 113.70 112.71 2ai0 s SER 71 Ca 0.38 -1.06 -0.13 0.00 0.48 0.00 0.00 55.95 55.62 2ai0 s SER 71 Cb -0.23 0.63 0.01 0.00 0.10 0.00 0.00 66.02 66.53 2ai0 s SER 71 CO 0.27 -1.23 0.37 0.00 0.98 0.00 0.00 173.24 173.62 2ai0 s ARG 72 N -3.65 1.15 -0.31 4.02 1.70 -1.26 -0.53 118.95 120.07 2ai0 s ARG 72 Ca 0.23 -0.93 -0.03 0.00 -0.47 0.00 0.00 55.73 54.53 2ai0 s ARG 72 Cb -0.01 0.44 0.11 0.00 -0.57 0.00 0.00 34.95 34.91 2ai0 s ARG 72 CO 0.12 -0.44 0.15 0.34 -1.08 0.00 0.00 175.30 174.38 2ai0 s ASP 73 N -2.88 3.47 0.28 -2.89 -1.08 -0.27 -5.00 116.67 108.29 2ai0 s ASP 73 Ca 0.09 -1.55 0.04 0.00 -0.52 0.00 0.00 52.55 50.62 2ai0 s ASP 73 Cb 0.02 -0.42 0.42 0.00 -1.46 0.00 0.00 42.92 41.48 2ai0 s ASP 73 CO -0.06 -0.41 1.71 0.78 0.52 0.00 0.00 175.17 177.71 2ai0 h ASN 74 N 8.04 0.39 0.77 -0.34 2.35 -1.95 0.19 115.58 125.04 2ai0 h ASN 74 Ca -0.13 -0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.47 2ai0 h ASN 74 Cb 1.00 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 39.26 2ai0 h ASN 74 CO 0.41 0.70 0.00 0.00 -1.65 0.00 0.00 177.43 176.89 2ai0 h ALA 75 N 1.33 1.00 0.00 -0.83 0.00 -1.96 -2.47 119.26 116.32 2ai0 h ALA 75 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2ai0 h ALA 75 Cb 0.74 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2ai0 h ALA 75 CO 0.06 0.00 -1.12 1.63 0.00 0.00 0.00 179.25 179.82 2ai0 n LYS 76 N -2.71 0.71 -3.54 0.00 5.02 -0.53 -4.99 118.16 112.12 2ai0 n LYS 76 Ca 0.01 -0.04 -0.24 0.00 -2.02 0.00 0.00 58.31 56.01 2ai0 n LYS 76 Cb 0.24 -1.41 0.07 0.00 -0.02 0.00 0.00 35.03 33.91 2ai0 n LYS 76 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2ai0 n ASN 77 N -1.61 -6.18 -4.28 4.39 4.13 -0.06 -4.91 115.26 106.75 2ai0 n ASN 77 Ca 0.02 -0.52 -0.32 0.00 1.68 0.00 0.00 54.58 55.44 2ai0 n ASN 77 Cb 0.34 -4.89 -0.16 0.00 -1.54 0.00 0.00 39.78 33.53 2ai0 n ASN 77 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 2ai0 s ASN 78 N -3.21 3.16 -0.11 6.41 0.01 -0.76 -1.07 114.94 119.36 2ai0 s ASN 78 Ca 0.55 -0.49 -0.05 0.00 -0.71 0.00 0.00 52.86 52.16 2ai0 s ASN 78 Cb -0.25 -0.95 -0.04 0.00 0.41 0.00 0.00 41.25 40.43 2ai0 s ASN 78 CO 0.68 0.24 0.06 -0.22 -1.51 0.00 0.00 177.10 176.35 2ai0 s LEU 79 N -0.10 3.92 0.19 0.60 2.96 -0.43 -1.12 118.68 124.69 2ai0 s LEU 79 Ca -0.05 0.26 0.09 0.00 -0.22 0.00 0.00 54.13 54.21 2ai0 s LEU 79 Cb -0.14 -1.93 -0.04 0.00 0.50 0.00 0.00 46.19 44.57 2ai0 s LEU 79 CO 0.04 0.36 -0.18 -0.31 -1.32 0.00 0.00 176.35 174.94 2ai0 s TYR 80 N -0.75 1.91 -0.20 5.38 2.02 0.31 0.20 117.35 126.22 2ai0 s TYR 80 Ca 0.12 -0.46 -0.04 0.00 -0.37 0.00 0.00 57.07 56.32 2ai0 s TYR 80 Cb -0.12 -0.92 0.08 0.00 -0.40 0.00 0.00 41.96 40.60 2ai0 s TYR 80 CO 0.03 0.41 0.15 -1.17 -1.57 0.00 0.00 175.55 173.39 2ai0 s LEU 81 N -2.93 0.19 -0.04 -1.29 2.96 -0.01 -2.15 118.68 115.42 2ai0 s LEU 81 Ca 0.20 -0.58 -0.27 0.00 -0.22 0.00 0.00 54.13 53.26 2ai0 s LEU 81 Cb -0.05 -0.02 -0.03 0.00 0.50 0.00 0.00 46.19 46.59 2ai0 s LEU 81 CO 0.08 -0.36 0.87 -1.58 -1.32 0.00 0.00 176.35 174.05 2ai0 s GLN 82 N 2.21 4.50 -0.08 1.98 2.00 0.06 0.16 119.66 130.47 2ai0 s GLN 82 Ca 0.05 1.20 0.02 0.00 -2.00 0.00 0.00 55.36 54.63 2ai0 s GLN 82 Cb -0.16 -3.46 0.01 0.00 0.80 0.00 0.00 33.01 30.20 2ai0 s GLN 82 CO -0.15 -0.03 -0.15 -1.64 -0.50 0.00 0.00 175.29 172.82 2ai0 s MET 83 N 1.03 2.05 0.17 1.67 -1.94 0.34 0.15 119.30 122.77 2ai0 s MET 83 Ca 0.46 -0.52 0.02 0.00 -1.71 0.00 0.00 55.69 53.94 2ai0 s MET 83 Cb -0.19 -1.68 -0.05 0.00 2.01 0.00 0.00 34.83 34.92 2ai0 s MET 83 CO 0.23 0.03 -0.02 -1.54 -0.01 0.00 0.00 175.02 173.71 2ai0 s SER 84 N 0.71 1.32 -1.28 3.03 1.04 -0.48 -0.82 113.70 117.23 2ai0 s SER 84 Ca -0.13 -1.14 -0.22 0.00 0.48 0.00 0.00 55.95 54.94 2ai0 s SER 84 Cb -0.16 0.09 0.03 0.00 0.10 0.00 0.00 66.02 66.08 2ai0 s SER 84 CO 0.03 -0.53 0.42 -1.54 0.98 0.00 0.00 173.24 172.61 2ai0 n SER 85 N -0.23 -2.23 -4.78 7.02 3.41 -1.16 -4.77 113.62 110.88 2ai0 n SER 85 Ca -0.07 -1.25 -0.36 0.00 -0.26 0.00 0.00 58.87 56.92 2ai0 n SER 85 Cb 0.63 -1.51 -0.02 0.00 -0.26 0.00 0.00 64.21 63.04 2ai0 n SER 85 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2ai0 s LEU 86 N -7.34 4.03 0.23 1.04 1.43 -1.03 -4.55 118.68 112.48 2ai0 s LEU 86 Ca 0.31 2.16 0.02 0.00 -1.03 0.00 0.00 54.13 55.59 2ai0 s LEU 86 Cb -0.17 -4.27 -0.05 0.00 0.03 0.00 0.00 46.19 41.73 2ai0 s LEU 86 CO 0.94 -0.76 0.05 -0.13 0.23 0.00 0.00 176.35 176.69 2ai0 s ARG 87 N -2.71 1.31 0.57 1.70 1.81 -1.26 0.05 118.95 120.43 2ai0 s ARG 87 Ca 0.62 -1.68 0.31 0.00 -1.72 0.00 0.00 55.73 53.26 2ai0 s ARG 87 Cb -0.25 -0.33 1.44 0.00 -0.45 0.00 0.00 34.95 35.36 2ai0 s ARG 87 CO 0.30 -0.21 1.80 0.66 -0.68 0.00 0.00 175.30 177.17 2ai0 h SER 88 N 2.49 0.00 0.57 0.23 4.64 -1.98 0.56 113.55 120.06 2ai0 h SER 88 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 2ai0 h SER 88 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2ai0 h SER 88 CO 0.62 0.00 0.00 1.05 -0.87 0.00 0.00 176.83 177.63 2ai0 h GLU 89 N 0.00 0.00 0.00 4.77 4.11 -1.96 -2.37 114.58 119.13 2ai0 h GLU 89 Ca 0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.81 2ai0 h GLU 89 Cb 1.79 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.04 2ai0 h GLU 89 CO -0.00 0.00 -0.81 -0.25 0.07 0.00 0.00 179.01 178.02 2ai0 n ASP 90 N -2.80 0.70 -4.66 3.06 8.00 0.20 -4.87 116.55 116.17 2ai0 n ASP 90 Ca -0.00 0.08 -0.48 0.00 0.71 0.00 0.00 54.79 55.09 2ai0 n ASP 90 Cb 0.20 0.39 -0.05 0.00 -0.02 0.00 0.00 41.12 41.63 2ai0 n ASP 90 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2ai0 n THR 91 N -2.19 0.54 -3.62 -3.53 -1.04 -0.89 -4.83 114.28 98.72 2ai0 n THR 91 Ca 0.02 -0.13 -0.02 0.00 -2.04 0.00 0.00 64.05 61.88 2ai0 n THR 91 Cb 0.46 -1.89 -0.01 0.00 -1.82 0.00 0.00 70.33 67.07 2ai0 n THR 91 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2ai0 s ALA 92 N 4.52 -2.08 -0.26 2.41 0.00 0.00 -4.39 121.76 121.96 2ai0 s ALA 92 Ca 0.95 0.91 -0.21 0.00 0.00 0.00 0.00 51.96 53.60 2ai0 s ALA 92 Cb -0.69 0.26 -0.02 0.00 0.00 0.00 0.00 23.12 22.67 2ai0 s ALA 92 CO 0.51 -0.89 0.66 -1.17 0.00 0.00 0.00 175.76 174.87 2ai0 s LEU 93 N -2.70 4.07 -0.28 0.00 2.96 -0.28 -0.84 118.68 121.62 2ai0 s LEU 93 Ca 0.12 0.72 -0.10 0.00 -0.22 0.00 0.00 54.13 54.65 2ai0 s LEU 93 Cb 0.02 -2.91 -0.04 0.00 0.50 0.00 0.00 46.19 43.76 2ai0 s LEU 93 CO -0.04 -0.41 0.17 -0.31 -1.32 0.00 0.00 176.35 174.44 2ai0 s TYR 94 N 2.58 3.19 -0.15 5.38 1.51 0.91 -0.27 117.35 130.51 2ai0 s TYR 94 Ca 0.28 -0.03 -0.08 0.00 -1.01 0.00 0.00 57.07 56.23 2ai0 s TYR 94 Cb -0.15 -2.36 -0.04 0.00 -0.11 0.00 0.00 41.96 39.29 2ai0 s TYR 94 CO 0.09 -0.22 0.13 -0.06 -1.11 0.00 0.00 175.55 174.37 2ai0 s PHE 95 N 1.73 3.49 0.10 2.71 0.08 0.19 -0.82 117.98 125.45 2ai0 s PHE 95 Ca 0.07 0.42 -0.25 0.00 0.12 0.00 0.00 56.93 57.29 2ai0 s PHE 95 Cb -0.16 -2.02 -0.07 0.00 -0.57 0.00 0.00 43.02 40.21 2ai0 s PHE 95 CO 0.09 0.54 0.76 0.00 -0.10 0.00 0.00 175.22 176.51 2ai0 s ALA 97 N -0.56 -0.64 0.04 0.00 0.00 -0.17 -1.01 121.76 119.42 2ai0 s ALA 97 Ca 0.37 0.81 -0.30 0.00 0.00 0.00 0.00 51.96 52.83 2ai0 s ALA 97 Cb -0.21 -0.48 -0.05 0.00 0.00 0.00 0.00 23.12 22.38 2ai0 s ALA 97 CO 0.24 -0.14 1.15 0.50 0.00 0.00 0.00 175.76 177.51 2ai0 s ARG 98 N 0.37 4.45 -0.32 0.00 3.52 -0.65 -1.26 118.95 125.06 2ai0 s ARG 98 Ca -0.02 1.69 0.02 0.00 -0.13 0.00 0.00 55.73 57.29 2ai0 s ARG 98 Cb -0.04 -3.39 0.08 0.00 -1.56 0.00 0.00 34.95 30.05 2ai0 s ARG 98 CO -0.02 -0.22 0.01 -1.58 -0.81 0.00 0.00 175.30 172.68 2ai0 s HIS 99 N 1.13 3.51 0.00 5.12 5.65 -0.77 -1.31 115.29 128.63 2ai0 s HIS 99 Ca 0.57 -2.56 0.00 0.00 0.25 0.00 0.00 55.06 53.32 2ai0 s HIS 99 Cb -0.27 -2.52 0.00 0.00 -1.18 0.00 0.00 32.58 28.61 2ai0 s HIS 99 CO 0.28 -0.91 0.00 -0.40 -0.65 0.00 0.00 174.74 173.06 2ai0 n ASP 100 N 4.40 0.00 -2.14 9.88 5.68 -1.26 -3.77 116.55 129.33 2ai0 n ASP 100 Ca -0.05 0.00 -0.07 0.00 -0.50 0.00 0.00 54.79 54.17 2ai0 n ASP 100 Cb 0.42 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.38 2ai0 n ASP 100 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 2ai0 n ASP 101 N 0.00 1.11 0.00 -1.12 2.03 -1.01 -1.04 116.55 116.52 2ai0 n ASP 101 Ca 0.00 -1.57 0.00 0.00 0.52 0.00 0.00 54.79 53.74 2ai0 n ASP 101 Cb 0.00 0.26 0.00 0.00 -0.72 0.00 0.00 41.12 40.66 2ai0 n ASP 101 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ai0 n TYR 102 N -0.25 0.00 -0.63 -0.67 0.18 -1.26 -3.96 117.16 110.56 2ai0 n TYR 102 Ca -0.02 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.76 2ai0 n TYR 102 Cb 0.16 -0.31 0.00 0.00 -0.38 0.00 0.00 39.34 38.81 2ai0 n TYR 102 CO 0.00 0.00 0.00 0.66 -2.08 0.00 0.00 176.86 175.44 2ai0 n TYR 103 N -2.33 0.00 -2.39 -3.48 4.02 -1.26 -5.08 117.16 106.64 2ai0 n TYR 103 Ca 0.00 -0.05 -0.25 0.00 -0.01 0.00 0.00 57.90 57.59 2ai0 n TYR 103 Cb 0.00 -0.01 0.05 0.00 -0.02 0.00 0.00 39.34 39.36 2ai0 n TYR 103 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 2ai0 s GLY 104 N -0.10 1.68 0.00 2.72 0.00 -1.25 -5.02 107.32 105.34 2ai0 s GLY 104 Ca 0.00 -0.93 0.16 0.00 0.00 0.00 0.00 44.72 43.95 2ai0 s GLY 104 CO 0.00 -0.60 1.08 0.28 0.00 0.00 0.00 173.10 173.86 2ai0 n LYS 105 N -2.65 1.53 -2.30 2.90 4.76 -1.26 -2.40 118.16 118.74 2ai0 n LYS 105 Ca 0.06 -1.62 -0.42 0.00 -2.87 0.00 0.00 58.31 53.47 2ai0 n LYS 105 Cb 0.59 -1.33 -0.03 0.00 -1.84 0.00 0.00 35.03 32.42 2ai0 n LYS 105 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2ai0 s SER 106 N -1.31 6.95 -0.94 4.39 0.01 -1.26 -4.59 113.70 116.94 2ai0 s SER 106 Ca 0.22 2.17 -0.24 0.00 1.31 0.00 0.00 55.95 59.40 2ai0 s SER 106 Cb 0.14 -2.58 -0.02 0.00 0.21 0.00 0.00 66.02 63.77 2ai0 s SER 106 CO 0.21 -0.56 1.80 -2.16 0.41 0.00 0.00 173.24 172.94 2ai0 s PRO 107 N 1.10 2.86 -0.09 12.44 0.04 -1.26 -2.94 135.00 147.15 2ai0 s PRO 107 Ca 0.62 -0.54 0.07 0.00 0.04 0.00 0.00 61.00 61.18 2ai0 s PRO 107 Cb -0.33 -5.15 -0.11 0.00 0.04 0.00 0.00 34.50 28.95 2ai0 s PRO 107 CO 0.30 -3.03 0.01 0.66 0.04 0.00 0.00 177.00 174.97 2ai0 n TYR 108 N 12.46 0.00 -1.49 0.56 0.53 -0.42 -4.83 117.16 123.97 2ai0 n TYR 108 Ca 0.38 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 57.26 2ai0 n TYR 108 Cb 0.48 -0.44 0.00 0.00 -1.03 0.00 0.00 39.34 38.35 2ai0 n TYR 108 CO 0.00 0.00 0.00 1.97 -1.02 0.00 0.00 176.86 177.81 2ai0 n PHE 109 N -2.40 0.00 -2.05 -0.72 1.16 -0.21 -4.94 117.46 108.29 2ai0 n PHE 109 Ca -0.15 0.00 -0.03 0.00 -1.87 0.00 0.00 57.45 55.40 2ai0 n PHE 109 Cb 0.78 0.03 -0.02 0.00 -1.61 0.00 0.00 39.48 38.66 2ai0 n PHE 109 CO 0.00 0.00 0.00 1.19 -1.87 0.00 0.00 176.76 176.08 2ai0 n PHE 110 N 0.00 -2.77 0.54 2.97 3.72 -1.18 -4.91 117.46 115.83 2ai0 n PHE 110 Ca 0.00 1.63 0.06 0.00 -0.05 0.00 0.00 57.45 59.08 2ai0 n PHE 110 Cb 0.16 -3.01 -0.04 0.00 -0.94 0.00 0.00 39.48 35.66 2ai0 n PHE 110 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2ai0 n ASP 111 N 1.05 0.92 -3.75 4.37 5.75 -0.42 -4.95 116.55 119.52 2ai0 n ASP 111 Ca -0.19 -0.96 -0.15 0.00 -0.01 0.00 0.00 54.79 53.49 2ai0 n ASP 111 Cb 0.29 0.75 -0.15 0.00 -1.03 0.00 0.00 41.12 40.97 2ai0 n ASP 111 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2ai0 s VAL 112 N -1.84 -0.06 0.12 2.12 1.01 -1.26 -5.01 120.40 115.48 2ai0 s VAL 112 Ca 0.07 0.22 0.09 0.00 0.00 0.00 0.00 61.98 62.36 2ai0 s VAL 112 Cb 0.09 -0.15 -0.04 0.00 0.00 0.00 0.00 36.38 36.28 2ai0 s VAL 112 CO 0.40 0.09 -0.18 0.26 0.00 0.00 0.00 175.10 175.67 2ai0 s TRP 113 N 1.20 2.54 0.90 5.22 0.52 -1.26 -1.64 118.94 126.41 2ai0 s TRP 113 Ca -0.08 -0.26 -0.13 0.00 0.02 0.00 0.00 56.10 55.64 2ai0 s TRP 113 Cb -0.12 -1.34 0.14 0.00 -1.15 0.00 0.00 33.47 30.99 2ai0 s TRP 113 CO -0.04 0.39 1.20 0.20 0.02 0.00 0.00 176.95 178.72 2ai0 s GLY 114 N -2.15 1.63 0.51 0.98 0.00 -0.18 -4.65 107.32 103.46 2ai0 s GLY 114 Ca 0.18 -0.77 0.29 0.00 0.00 0.00 0.00 44.72 44.42 2ai0 s GLY 114 CO 0.10 -0.17 1.86 0.00 0.00 0.00 0.00 173.10 174.89 2ai0 h ALA 115 N -1.41 1.00 0.00 3.20 0.00 -1.91 -3.45 119.26 116.68 2ai0 h ALA 115 Ca -0.47 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2ai0 h ALA 115 Cb 1.30 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2ai0 h ALA 115 CO 0.56 0.05 0.00 0.41 0.00 0.00 0.00 179.25 180.27 2ai0 n GLY 116 N 0.34 2.02 3.20 0.00 0.00 -1.26 -5.01 105.19 104.47 2ai0 n GLY 116 Ca 0.01 -1.74 -0.26 0.00 0.00 0.00 0.00 46.02 44.04 2ai0 n GLY 116 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2ai0 s THR 117 N -2.15 1.53 -0.08 2.61 -1.32 0.00 -4.84 115.64 111.39 2ai0 s THR 117 Ca 0.00 -0.86 -0.23 0.00 -1.21 0.00 0.00 61.69 59.39 2ai0 s THR 117 Cb 0.00 -1.28 -0.04 0.00 -1.51 0.00 0.00 72.50 69.67 2ai0 s THR 117 CO 0.00 0.40 0.70 -0.89 -2.21 0.00 0.00 174.62 172.62 2ai0 s THR 118 N -0.49 5.04 -0.12 5.08 2.01 -1.26 -0.06 115.64 125.84 2ai0 s THR 118 Ca 0.07 1.42 0.02 0.00 0.31 0.00 0.00 61.69 63.52 2ai0 s THR 118 Cb -0.08 -4.03 -0.00 0.00 0.01 0.00 0.00 72.50 68.40 2ai0 s THR 118 CO -0.00 0.24 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.28 2ai0 s VAL 119 N 0.91 2.47 -0.08 3.82 1.01 -0.02 -1.70 120.40 126.81 2ai0 s VAL 119 Ca 0.37 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.48 2ai0 s VAL 119 Cb -0.17 -1.99 0.02 0.00 0.00 0.00 0.00 36.38 34.23 2ai0 s VAL 119 CO 0.17 0.54 -0.06 0.28 0.00 0.00 0.00 175.10 176.04 2ai0 s THR 120 N 0.42 0.79 -0.38 3.92 -1.32 -0.72 -0.82 115.64 117.54 2ai0 s THR 120 Ca -0.14 -0.18 -0.11 0.00 -1.21 0.00 0.00 61.69 60.04 2ai0 s THR 120 Cb -0.17 -0.83 0.03 0.00 -1.51 0.00 0.00 72.50 70.02 2ai0 s THR 120 CO 0.06 0.31 0.22 0.00 -2.21 0.00 0.00 174.62 173.00 2ai0 s ALA 121 N 1.48 3.30 -0.11 11.08 0.00 -1.26 -0.96 121.76 135.30 2ai0 s ALA 121 Ca -0.01 -1.72 -0.17 0.00 0.00 0.00 0.00 51.96 50.06 2ai0 s ALA 121 Cb -0.13 -2.63 0.04 0.00 0.00 0.00 0.00 23.12 20.40 2ai0 s ALA 121 CO -0.04 -1.39 0.43 0.45 0.00 0.00 0.00 175.76 175.21 2ai0 s SER 122 N 1.57 -0.40 0.00 0.00 0.15 0.48 -3.80 113.70 111.70 2ai0 s SER 122 Ca 0.02 0.63 0.27 0.00 0.70 0.00 0.00 55.95 57.58 2ai0 s SER 122 Cb -0.19 0.69 0.94 0.00 -1.71 0.00 0.00 66.02 65.75 2ai0 s SER 122 CO 0.07 -0.29 1.68 -1.54 1.20 0.00 0.00 173.24 174.36 2ai0 n SER 123 N 2.15 1.67 -4.76 5.45 3.41 -1.26 -3.95 113.62 116.33 2ai0 n SER 123 Ca -0.16 -1.57 -0.37 0.00 -0.26 0.00 0.00 58.87 56.51 2ai0 n SER 123 Cb 0.57 -0.01 0.01 0.00 -0.26 0.00 0.00 64.21 64.51 2ai0 n SER 123 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ai0 s ALA 124 N -1.97 2.85 -0.02 7.33 0.00 -1.26 -5.02 121.76 123.67 2ai0 s ALA 124 Ca 0.37 1.04 -0.02 0.00 0.00 0.00 0.00 51.96 53.35 2ai0 s ALA 124 Cb 0.21 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.85 2ai0 s ALA 124 CO 0.32 -0.92 0.09 0.15 0.00 0.00 0.00 175.76 175.41 2ai0 s LYS 125 N -2.88 3.15 -0.12 0.00 1.02 -1.26 -5.03 119.74 114.62 2ai0 s LYS 125 Ca 0.68 -0.42 -0.36 0.00 0.02 0.00 0.00 55.97 55.89 2ai0 s LYS 125 Cb -0.32 -2.92 -0.13 0.00 -0.52 0.00 0.00 37.83 33.94 2ai0 s LYS 125 CO 0.37 0.67 1.79 2.41 -0.92 0.00 0.00 175.35 179.68 2ai0 n THR 126 N 1.31 0.43 -3.93 2.17 -1.04 -1.26 -4.59 114.28 107.38 2ai0 n THR 126 Ca -0.14 -0.08 -0.16 0.00 -2.04 0.00 0.00 64.05 61.63 2ai0 n THR 126 Cb 0.53 -1.61 -0.16 0.00 -1.82 0.00 0.00 70.33 67.27 2ai0 n THR 126 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2ai0 s THR 127 N 3.51 0.16 0.57 12.58 2.01 0.09 -4.92 115.64 129.65 2ai0 s THR 127 Ca 0.93 0.07 -0.18 0.00 0.31 0.00 0.00 61.69 62.83 2ai0 s THR 127 Cb -0.81 -0.24 -0.04 0.00 0.01 0.00 0.00 72.50 71.41 2ai0 s THR 127 CO 0.54 0.13 1.09 -2.16 -0.69 0.00 0.00 174.62 173.53 2ai0 s PRO 128 N 0.90 3.29 0.60 4.92 0.04 -1.26 -1.60 135.00 141.88 2ai0 s PRO 128 Ca -0.09 1.41 -0.16 0.00 0.04 0.00 0.00 61.00 62.20 2ai0 s PRO 128 Cb -0.12 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.37 2ai0 s PRO 128 CO -0.02 -0.87 1.08 -1.25 0.04 0.00 0.00 177.00 175.99 2ai0 s PRO 129 N -3.67 3.19 -0.17 0.56 0.04 -1.26 -4.37 135.00 129.31 2ai0 s PRO 129 Ca 0.68 1.32 -0.15 0.00 0.04 0.00 0.00 61.00 62.89 2ai0 s PRO 129 Cb -0.20 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.29 2ai0 s PRO 129 CO 0.32 -0.93 0.37 -1.12 0.04 0.00 0.00 177.00 175.68 2ai0 s SER 130 N -2.55 6.47 -0.34 6.66 0.01 0.28 -4.90 113.70 119.33 2ai0 s SER 130 Ca 0.66 0.55 -0.09 0.00 1.31 0.00 0.00 55.95 58.39 2ai0 s SER 130 Cb -0.18 -2.22 0.02 0.00 0.21 0.00 0.00 66.02 63.85 2ai0 s SER 130 CO 0.36 0.00 0.15 -0.69 0.41 0.00 0.00 173.24 173.47 2ai0 s VAL 131 N 0.90 4.27 -0.06 3.43 1.01 -1.26 -0.24 120.40 128.44 2ai0 s VAL 131 Ca 0.19 -0.82 0.02 0.00 0.00 0.00 0.00 61.98 61.37 2ai0 s VAL 131 Cb -0.14 -3.32 -0.03 0.00 0.00 0.00 0.00 36.38 32.89 2ai0 s VAL 131 CO 0.07 -0.11 -0.12 -0.31 0.00 0.00 0.00 175.10 174.63 2ai0 s TYR 132 N 1.52 2.78 0.31 5.22 2.02 0.12 -4.97 117.35 124.35 2ai0 s TYR 132 Ca 0.02 -0.15 -0.26 0.00 -0.37 0.00 0.00 57.07 56.31 2ai0 s TYR 132 Cb -0.18 -1.68 -0.10 0.00 -0.40 0.00 0.00 41.96 39.60 2ai0 s TYR 132 CO 0.05 0.19 0.93 -1.25 -1.57 0.00 0.00 175.55 173.91 2ai0 s PRO 133 N -0.65 4.60 -0.35 -1.71 0.04 -1.26 0.12 135.00 135.78 2ai0 s PRO 133 Ca 0.10 1.32 -0.01 0.00 0.04 0.00 0.00 61.00 62.45 2ai0 s PRO 133 Cb -0.11 -2.85 0.08 0.00 0.04 0.00 0.00 34.50 31.66 2ai0 s PRO 133 CO 0.01 0.31 0.09 -0.51 0.04 0.00 0.00 177.00 176.94 2ai0 s LEU 134 N -1.97 4.56 0.07 -3.56 1.02 0.23 -4.83 118.68 114.19 2ai0 s LEU 134 Ca 0.49 -1.70 0.07 0.00 0.02 0.00 0.00 54.13 53.01 2ai0 s LEU 134 Cb -0.19 -1.75 -0.04 0.00 0.02 0.00 0.00 46.19 44.24 2ai0 s LEU 134 CO 0.24 -0.39 -0.16 0.00 0.02 0.00 0.00 176.35 176.06 2ai0 s ALA 135 N 1.16 2.69 0.54 4.21 0.00 -1.26 -1.86 121.76 127.23 2ai0 s ALA 135 Ca 0.02 -1.24 -0.21 0.00 0.00 0.00 0.00 51.96 50.54 2ai0 s ALA 135 Cb -0.21 -0.75 -0.05 0.00 0.00 0.00 0.00 23.12 22.11 2ai0 s ALA 135 CO -0.03 0.59 1.24 -1.25 0.00 0.00 0.00 175.76 176.30 2ai0 s PRO 136 N -1.74 3.26 0.17 0.00 0.04 -1.26 -4.94 135.00 130.53 2ai0 s PRO 136 Ca 0.17 1.93 -0.28 0.00 0.04 0.00 0.00 61.00 62.85 2ai0 s PRO 136 Cb -0.11 -2.17 -0.17 0.00 0.04 0.00 0.00 34.50 32.10 2ai0 s PRO 136 CO 0.08 -1.00 0.57 0.41 0.04 0.00 0.00 177.00 177.10 2ai0 n GLY 137 N 0.55 -1.49 0.48 0.56 0.00 -1.26 -4.52 105.19 99.52 2ai0 n GLY 137 Ca 0.11 0.38 0.30 0.00 0.00 0.00 0.00 46.02 46.81 2ai0 n GLY 137 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2ai0 h SER 138 N 1.22 0.12 -1.79 1.61 0.02 -1.92 -2.73 113.55 110.07 2ai0 h SER 138 Ca -0.30 0.02 -0.50 0.00 -0.84 0.00 0.00 61.79 60.18 2ai0 h SER 138 Cb 1.38 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 63.51 2ai0 h SER 138 CO 0.56 0.02 -0.99 0.00 -1.14 0.00 0.00 176.83 175.28 2ai0 n ALA 139 N -2.68 3.42 -2.49 3.77 0.00 -1.26 -4.92 120.51 116.34 2ai0 n ALA 139 Ca 0.24 -3.81 -0.25 0.00 0.00 0.00 0.00 53.44 49.62 2ai0 n ALA 139 Cb 1.08 -0.83 -0.14 0.00 0.00 0.00 0.00 19.45 19.56 2ai0 n ALA 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ai0 s ALA 140 N -3.00 1.73 0.29 0.00 0.00 -1.03 -5.12 121.76 114.63 2ai0 s ALA 140 Ca 0.41 -1.06 -0.30 0.00 0.00 0.00 0.00 51.96 51.01 2ai0 s ALA 140 Cb 0.36 -0.33 -0.11 0.00 0.00 0.00 0.00 23.12 23.05 2ai0 s ALA 140 CO -0.08 0.38 1.50 -0.65 0.00 0.00 0.00 175.76 176.91 2ai0 s GLN 141 N -1.23 4.19 0.35 0.00 1.11 -1.26 -4.98 119.66 117.84 2ai0 s GLN 141 Ca 0.07 2.45 0.07 0.00 0.01 0.00 0.00 55.36 57.96 2ai0 s GLN 141 Cb -0.09 -3.05 -0.01 0.00 -1.01 0.00 0.00 33.01 28.85 2ai0 s GLN 141 CO 0.02 -0.51 0.47 0.95 0.01 0.00 0.00 175.29 176.23 2ai0 s THR 142 N -0.23 3.79 0.00 -0.19 -4.23 -1.26 -5.12 115.64 108.40 2ai0 s THR 142 Ca 0.59 -1.03 0.00 0.00 -1.18 0.00 0.00 61.69 60.07 2ai0 s THR 142 Cb -0.45 -3.30 0.00 0.00 1.34 0.00 0.00 72.50 70.09 2ai0 s THR 142 CO 0.48 -0.12 0.00 -0.46 -0.54 0.00 0.00 174.62 173.98 2ai0 n ASN 143 N -1.66 0.00 0.15 3.99 6.94 -1.26 -5.01 115.26 118.41 2ai0 n ASN 143 Ca 0.01 0.00 0.01 0.00 -0.02 0.00 0.00 54.58 54.59 2ai0 n ASN 143 Cb 0.58 0.00 0.23 0.00 -2.36 0.00 0.00 39.78 38.23 2ai0 n ASN 143 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 2ai0 h SER 144 N 0.00 0.00 -4.28 0.53 4.64 -2.01 -3.42 113.55 109.01 2ai0 h SER 144 Ca 0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 2ai0 h SER 144 Cb 0.00 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 61.81 2ai0 h SER 144 CO 0.00 0.53 -0.82 -0.04 -0.87 0.00 0.00 176.83 175.63 2ai0 s MET 145 N -3.62 1.26 -0.08 4.77 -1.94 -1.26 -1.25 119.30 117.17 2ai0 s MET 145 Ca -0.01 -0.65 0.02 0.00 -1.71 0.00 0.00 55.69 53.34 2ai0 s MET 145 Cb 0.12 -1.24 -0.02 0.00 2.01 0.00 0.00 34.83 35.69 2ai0 s MET 145 CO 0.74 0.33 -0.13 0.54 -0.01 0.00 0.00 175.02 176.49 2ai0 s VAL 146 N -0.50 3.14 -0.17 -6.03 0.11 0.94 -4.76 120.40 113.12 2ai0 s VAL 146 Ca 0.06 -0.67 -0.08 0.00 -2.93 0.00 0.00 61.98 58.36 2ai0 s VAL 146 Cb -0.07 -2.27 -0.04 0.00 -1.53 0.00 0.00 36.38 32.47 2ai0 s VAL 146 CO -0.00 0.56 0.09 -0.89 -3.33 0.00 0.00 175.10 171.53 2ai0 s THR 147 N -0.30 5.02 0.43 5.04 2.01 -1.26 -0.69 115.64 125.89 2ai0 s THR 147 Ca 0.03 0.05 0.01 0.00 0.31 0.00 0.00 61.69 62.08 2ai0 s THR 147 Cb -0.13 -3.25 -0.00 0.00 0.01 0.00 0.00 72.50 69.13 2ai0 s THR 147 CO 0.03 0.48 0.02 0.18 -0.69 0.00 0.00 174.62 174.64 2ai0 n LEU 148 N 3.26 0.00 -3.66 4.42 4.77 0.13 -4.64 117.00 121.28 2ai0 n LEU 148 Ca -0.17 -2.77 0.01 0.00 -0.03 0.00 0.00 56.01 53.05 2ai0 n LEU 148 Cb 0.53 0.41 -0.00 0.00 -2.33 0.00 0.00 43.42 42.03 2ai0 n LEU 148 CO 0.35 -0.40 1.01 -0.83 -1.33 0.00 0.00 177.39 176.19 2ai0 s GLY 149 N -3.39 -0.37 -0.04 -0.72 0.00 -0.78 -0.97 107.32 101.06 2ai0 s GLY 149 Ca 0.03 0.56 0.04 0.00 0.00 0.00 0.00 44.72 45.35 2ai0 s GLY 149 CO 0.02 0.40 -0.14 0.00 0.00 0.00 0.00 173.10 173.38 2ai0 s LEU 151 N 0.09 3.97 -0.31 0.00 2.96 0.12 -1.62 118.68 123.89 2ai0 s LEU 151 Ca -0.03 0.05 0.01 0.00 -0.22 0.00 0.00 54.13 53.94 2ai0 s LEU 151 Cb -0.10 -2.06 0.07 0.00 0.50 0.00 0.00 46.19 44.60 2ai0 s LEU 151 CO 0.01 0.06 -0.00 -0.69 -1.32 0.00 0.00 176.35 174.41 2ai0 s VAL 152 N 1.07 2.56 -0.03 1.68 1.01 0.86 0.12 120.40 127.66 2ai0 s VAL 152 Ca 0.07 -1.79 0.05 0.00 0.00 0.00 0.00 61.98 60.31 2ai0 s VAL 152 Cb -0.14 -2.62 -0.01 0.00 0.00 0.00 0.00 36.38 33.62 2ai0 s VAL 152 CO 0.04 -0.27 -0.20 -0.75 0.00 0.00 0.00 175.10 173.93 2ai0 s LYS 153 N 1.10 1.85 -0.15 2.72 2.20 0.66 -0.83 119.74 127.29 2ai0 s LYS 153 Ca -0.01 -0.71 -0.01 0.00 -0.36 0.00 0.00 55.97 54.88 2ai0 s LYS 153 Cb -0.20 -1.67 0.00 0.00 -1.51 0.00 0.00 37.83 34.45 2ai0 s LYS 153 CO -0.05 0.35 0.13 0.41 -0.36 0.00 0.00 175.35 175.83 2ai0 n GLY 154 N 2.87 0.74 3.62 5.54 0.00 0.35 -0.56 105.19 117.74 2ai0 n GLY 154 Ca -0.17 -0.56 -0.28 0.00 0.00 0.00 0.00 46.02 45.02 2ai0 n GLY 154 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2ai0 s TYR 155 N -3.04 2.78 -0.14 1.61 -0.85 -0.99 -4.52 117.35 112.21 2ai0 s TYR 155 Ca 0.06 -0.15 -0.18 0.00 -0.52 0.00 0.00 57.07 56.28 2ai0 s TYR 155 Cb -0.03 -1.40 0.05 0.00 0.38 0.00 0.00 41.96 40.96 2ai0 s TYR 155 CO 0.08 0.48 0.48 0.12 -1.52 0.00 0.00 175.55 175.20 2ai0 s PHE 156 N -1.50 -0.50 0.71 -3.49 5.36 -0.63 -0.47 117.98 117.46 2ai0 s PHE 156 Ca 0.25 1.13 -0.05 0.00 -0.96 0.00 0.00 56.93 57.30 2ai0 s PHE 156 Cb -0.10 0.20 0.15 0.00 -0.34 0.00 0.00 43.02 42.93 2ai0 s PHE 156 CO 0.16 -0.32 0.98 -0.35 -1.46 0.00 0.00 175.22 174.23 2ai0 n PRO 157 N 2.36 -0.42 -1.58 10.12 -0.04 -1.26 -0.73 135.00 143.45 2ai0 n PRO 157 Ca -0.15 -2.17 -0.32 0.00 -0.04 0.00 0.00 63.50 60.81 2ai0 n PRO 157 Cb 0.57 -0.80 0.06 0.00 -0.04 0.00 0.00 33.50 33.29 2ai0 n PRO 157 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2ai0 s GLU 158 N -5.04 2.60 0.45 0.54 2.02 -1.26 -4.71 118.70 113.30 2ai0 s GLU 158 Ca 0.61 1.33 0.04 0.00 0.02 0.00 0.00 54.97 56.96 2ai0 s GLU 158 Cb -0.03 -1.93 0.01 0.00 0.10 0.00 0.00 34.13 32.28 2ai0 s GLU 158 CO 0.41 -1.40 0.63 -1.25 0.02 0.00 0.00 175.26 173.67 2ai0 s PRO 159 N -4.35 2.87 0.18 0.39 0.04 -1.26 -5.01 135.00 127.86 2ai0 s PRO 159 Ca 0.65 -0.86 0.10 0.00 0.04 0.00 0.00 61.00 60.93 2ai0 s PRO 159 Cb -0.20 -2.64 -0.04 0.00 0.04 0.00 0.00 34.50 31.66 2ai0 s PRO 159 CO 0.46 -0.33 -0.14 0.08 0.04 0.00 0.00 177.00 177.11 2ai0 s VAL 160 N -2.49 2.93 -0.09 -0.36 1.01 -1.26 -4.35 120.40 115.79 2ai0 s VAL 160 Ca 0.52 -1.75 0.04 0.00 0.00 0.00 0.00 61.98 60.79 2ai0 s VAL 160 Cb -0.10 -2.43 -0.01 0.00 0.00 0.00 0.00 36.38 33.84 2ai0 s VAL 160 CO 0.35 -0.09 -0.21 -0.89 0.00 0.00 0.00 175.10 174.26 2ai0 s THR 161 N -1.64 2.35 -0.19 3.92 2.01 -0.07 -4.97 115.64 117.05 2ai0 s THR 161 Ca 0.23 -0.93 0.01 0.00 0.31 0.00 0.00 61.69 61.31 2ai0 s THR 161 Cb -0.09 -1.91 0.03 0.00 0.01 0.00 0.00 72.50 70.54 2ai0 s THR 161 CO 0.13 0.56 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.75 2ai0 s VAL 162 N 0.12 2.01 0.42 3.82 1.01 -1.26 -1.25 120.40 125.27 2ai0 s VAL 162 Ca -0.10 -1.00 0.07 0.00 0.00 0.00 0.00 61.98 60.95 2ai0 s VAL 162 Cb -0.16 -1.87 -0.06 0.00 0.00 0.00 0.00 36.38 34.29 2ai0 s VAL 162 CO 0.06 0.45 0.09 0.42 0.00 0.00 0.00 175.10 176.13 2ai0 s THR 163 N 1.29 2.09 -0.03 3.92 -4.23 -0.55 -4.99 115.64 113.14 2ai0 s THR 163 Ca 0.03 -1.86 0.07 0.00 -1.18 0.00 0.00 61.69 58.75 2ai0 s THR 163 Cb -0.14 -2.94 -0.01 0.00 1.34 0.00 0.00 72.50 70.74 2ai0 s THR 163 CO -0.12 0.00 -0.22 0.26 -0.54 0.00 0.00 174.62 174.00 2ai0 s TRP 164 N -2.67 2.05 -1.75 3.99 0.52 -1.26 -0.75 118.94 119.06 2ai0 s TRP 164 Ca 0.36 -0.45 -0.19 0.00 0.02 0.00 0.00 56.10 55.85 2ai0 s TRP 164 Cb 0.07 -1.33 0.17 0.00 -1.15 0.00 0.00 33.47 31.23 2ai0 s TRP 164 CO 0.19 -0.08 0.66 0.09 0.02 0.00 0.00 176.95 177.84 2ai0 n ASN 165 N 2.66 -2.41 -0.92 2.95 3.02 0.82 -0.60 115.26 120.78 2ai0 n ASN 165 Ca -0.16 -1.11 -0.12 0.00 -0.03 0.00 0.00 54.58 53.16 2ai0 n ASN 165 Cb 0.52 -2.28 -0.05 0.00 -0.61 0.00 0.00 39.78 37.36 2ai0 n ASN 165 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2ai0 n SER 166 N -2.61 -4.53 0.00 6.41 7.64 -1.26 -2.59 113.62 116.68 2ai0 n SER 166 Ca 0.05 0.30 0.00 0.00 1.01 0.00 0.00 58.87 60.23 2ai0 n SER 166 Cb 0.50 -3.08 0.00 0.00 -1.01 0.00 0.00 64.21 60.61 2ai0 n SER 166 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ai0 n GLY 167 N -1.40 1.51 0.28 0.23 0.00 0.23 -4.94 105.19 101.12 2ai0 n GLY 167 Ca -0.12 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.06 2ai0 n GLY 167 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2ai0 h SER 168 N 0.00 0.00 -3.49 1.61 0.02 -1.43 -3.36 113.55 106.90 2ai0 h SER 168 Ca 0.00 0.00 -0.70 0.00 -0.84 0.00 0.00 61.79 60.25 2ai0 h SER 168 Cb 0.00 0.00 -0.33 0.00 0.14 0.00 0.00 62.40 62.21 2ai0 h SER 168 CO 0.00 0.06 -0.54 -0.22 -1.14 0.00 0.00 176.83 174.99 2ai0 s LEU 169 N -6.74 5.15 0.00 5.07 0.20 -1.07 -4.89 118.68 116.41 2ai0 s LEU 169 Ca -0.02 -1.90 0.00 0.00 0.69 0.00 0.00 54.13 52.90 2ai0 s LEU 169 Cb 0.12 -1.85 0.00 0.00 -0.43 0.00 0.00 46.19 44.03 2ai0 s LEU 169 CO 0.54 -0.53 0.00 -1.54 -0.29 0.00 0.00 176.35 174.53 2ai0 n SER 170 N 4.66 3.79 -4.77 3.68 3.41 -1.26 -4.10 113.62 119.02 2ai0 n SER 170 Ca -0.05 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.19 2ai0 n SER 170 Cb 0.42 0.01 -0.01 0.00 -0.26 0.00 0.00 64.21 64.37 2ai0 n SER 170 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2ai0 s SER 171 N -3.92 6.13 -1.43 4.04 0.01 -1.26 -3.72 113.70 113.55 2ai0 s SER 171 Ca 0.00 2.35 0.00 0.00 1.31 0.00 0.00 55.95 59.61 2ai0 s SER 171 Cb 0.00 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.62 2ai0 s SER 171 CO 0.00 -0.95 0.00 0.61 0.41 0.00 0.00 173.24 173.31 2ai0 n GLY 172 N 0.48 -0.11 3.76 3.44 0.00 -1.26 -4.74 105.19 106.76 2ai0 n GLY 172 Ca 0.07 -0.20 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 2ai0 n GLY 172 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ai0 s VAL 173 N -2.79 4.57 -0.22 1.61 -7.23 -1.24 -1.72 120.40 113.37 2ai0 s VAL 173 Ca 0.00 -0.50 -0.00 0.00 -1.81 0.00 0.00 61.98 59.67 2ai0 s VAL 173 Cb 0.00 -3.09 0.06 0.00 0.56 0.00 0.00 36.38 33.91 2ai0 s VAL 173 CO 0.00 0.33 -0.03 -1.00 -0.31 0.00 0.00 175.10 174.09 2ai0 s HIS 174 N -1.19 2.03 -0.26 2.82 3.76 -0.60 -5.00 115.29 116.84 2ai0 s HIS 174 Ca 0.23 -1.51 -0.10 0.00 -0.15 0.00 0.00 55.06 53.53 2ai0 s HIS 174 Cb -0.12 -1.43 -0.05 0.00 1.11 0.00 0.00 32.58 32.09 2ai0 s HIS 174 CO 0.14 -0.73 0.17 0.99 -0.85 0.00 0.00 174.74 174.46 2ai0 s THR 175 N 1.52 5.19 0.11 1.30 2.01 -1.26 -1.10 115.64 123.41 2ai0 s THR 175 Ca -0.04 0.13 -0.11 0.00 0.31 0.00 0.00 61.69 61.97 2ai0 s THR 175 Cb -0.18 -3.45 -0.06 0.00 0.01 0.00 0.00 72.50 68.81 2ai0 s THR 175 CO -0.07 0.29 0.46 -0.36 -0.69 0.00 0.00 174.62 174.25 2ai0 s PHE 176 N 1.54 3.58 0.26 4.92 0.08 -0.27 -5.01 117.98 123.08 2ai0 s PHE 176 Ca 0.07 0.87 -0.30 0.00 0.12 0.00 0.00 56.93 57.69 2ai0 s PHE 176 Cb -0.15 -2.23 -0.14 0.00 -0.57 0.00 0.00 43.02 39.93 2ai0 s PHE 176 CO 0.08 0.47 1.23 -2.30 -0.10 0.00 0.00 175.22 174.60 2ai0 n PRO 177 N 0.77 1.68 -1.88 0.24 -0.02 -1.26 -4.40 135.00 130.13 2ai0 n PRO 177 Ca -0.06 0.59 -0.37 0.00 -2.02 0.00 0.00 63.50 61.64 2ai0 n PRO 177 Cb 0.52 -2.13 0.04 0.00 -0.02 0.00 0.00 33.50 31.91 2ai0 n PRO 177 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ai0 s ALA 178 N -0.54 2.68 -0.05 3.55 0.00 -1.26 -4.83 121.76 121.30 2ai0 s ALA 178 Ca 0.64 1.19 0.04 0.00 0.00 0.00 0.00 51.96 53.84 2ai0 s ALA 178 Cb -0.69 -3.52 -0.00 0.00 0.00 0.00 0.00 23.12 18.91 2ai0 s ALA 178 CO 0.55 -1.29 -0.17 0.08 0.00 0.00 0.00 175.76 174.92 2ai0 s VAL 179 N -1.41 1.47 -0.14 0.00 1.01 -0.12 -4.94 120.40 116.26 2ai0 s VAL 179 Ca 0.74 -0.72 -0.24 0.00 0.00 0.00 0.00 61.98 61.76 2ai0 s VAL 179 Cb -0.36 -1.27 -0.02 0.00 0.00 0.00 0.00 36.38 34.73 2ai0 s VAL 179 CO 0.41 0.42 0.78 -0.22 0.00 0.00 0.00 175.10 176.49 2ai0 s LEU 180 N 0.14 4.21 -0.30 3.92 0.20 -1.26 -1.03 118.68 124.56 2ai0 s LEU 180 Ca -0.07 1.15 -0.02 0.00 0.69 0.00 0.00 54.13 55.88 2ai0 s LEU 180 Cb -0.13 -3.17 0.10 0.00 -0.43 0.00 0.00 46.19 42.56 2ai0 s LEU 180 CO 0.03 -0.31 0.11 -1.58 -0.29 0.00 0.00 176.35 174.31 2ai0 s GLN 181 N 1.76 0.51 -0.67 1.98 0.74 0.78 -4.91 119.66 119.86 2ai0 s GLN 181 Ca 0.37 -0.85 -0.14 0.00 0.05 0.00 0.00 55.36 54.80 2ai0 s GLN 181 Cb -0.17 -1.69 0.02 0.00 1.10 0.00 0.00 33.01 32.27 2ai0 s GLN 181 CO 0.14 -0.99 0.63 -1.13 -0.55 0.00 0.00 175.29 173.40 2ai0 n SER 182 N 5.00 -5.58 0.00 6.67 3.41 -1.26 -3.16 113.62 118.70 2ai0 n SER 182 Ca -0.04 -0.51 0.00 0.00 -0.26 0.00 0.00 58.87 58.06 2ai0 n SER 182 Cb 0.42 -2.31 0.00 0.00 -0.26 0.00 0.00 64.21 62.06 2ai0 n SER 182 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2ai0 n ASP 183 N -1.60 -2.97 -3.88 4.04 10.43 -1.26 -4.97 116.55 116.34 2ai0 n ASP 183 Ca -0.18 0.00 -0.11 0.00 2.57 0.00 0.00 54.79 57.07 2ai0 n ASP 183 Cb 0.66 -1.37 -0.11 0.00 1.84 0.00 0.00 41.12 42.13 2ai0 n ASP 183 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 2ai0 s LEU 184 N 0.00 1.68 0.10 0.64 1.43 -1.19 -4.76 118.68 116.58 2ai0 s LEU 184 Ca 0.00 -0.13 -0.05 0.00 -1.03 0.00 0.00 54.13 52.91 2ai0 s LEU 184 Cb 0.00 0.49 -0.05 0.00 0.03 0.00 0.00 46.19 46.65 2ai0 s LEU 184 CO 0.00 -0.26 0.34 -0.31 0.23 0.00 0.00 176.35 176.35 2ai0 s TYR 185 N -0.98 3.51 -0.04 0.29 2.02 0.38 -0.15 117.35 122.38 2ai0 s TYR 185 Ca -0.11 0.57 0.03 0.00 -0.37 0.00 0.00 57.07 57.18 2ai0 s TYR 185 Cb -0.06 -2.00 0.01 0.00 -0.40 0.00 0.00 41.96 39.50 2ai0 s TYR 185 CO 0.01 0.50 -0.10 0.99 -1.57 0.00 0.00 175.55 175.37 2ai0 s THR 186 N -1.54 0.92 0.03 -0.71 2.01 -0.20 -0.50 115.64 115.66 2ai0 s THR 186 Ca 0.37 -0.41 -0.00 0.00 0.31 0.00 0.00 61.69 61.96 2ai0 s THR 186 Cb -0.13 -0.83 -0.03 0.00 0.01 0.00 0.00 72.50 71.53 2ai0 s THR 186 CO 0.22 0.29 -0.03 -0.22 -0.69 0.00 0.00 174.62 174.19 2ai0 s LEU 187 N 0.35 2.32 0.04 4.42 0.20 -0.01 -0.94 118.68 125.07 2ai0 s LEU 187 Ca -0.07 -0.67 0.02 0.00 0.69 0.00 0.00 54.13 54.11 2ai0 s LEU 187 Cb -0.11 0.11 -0.02 0.00 -0.43 0.00 0.00 46.19 45.73 2ai0 s LEU 187 CO 0.01 -0.39 -0.08 -0.94 -0.29 0.00 0.00 176.35 174.66 2ai0 s SER 188 N -1.96 0.93 -0.03 3.68 1.04 -1.26 -0.10 113.70 116.01 2ai0 s SER 188 Ca -0.08 -0.54 0.03 0.00 0.48 0.00 0.00 55.95 55.84 2ai0 s SER 188 Cb -0.04 0.02 0.00 0.00 0.10 0.00 0.00 66.02 66.11 2ai0 s SER 188 CO -0.04 -0.18 -0.10 -0.55 0.98 0.00 0.00 173.24 173.35 2ai0 s SER 189 N -1.55 1.34 0.01 7.02 0.15 -0.64 -1.11 113.70 118.91 2ai0 s SER 189 Ca -0.09 -0.21 0.05 0.00 0.70 0.00 0.00 55.95 56.40 2ai0 s SER 189 Cb -0.10 -0.37 -0.03 0.00 -1.71 0.00 0.00 66.02 63.81 2ai0 s SER 189 CO 0.01 0.07 -0.12 -0.94 1.20 0.00 0.00 173.24 173.46 2ai0 s SER 190 N 0.20 4.21 -0.05 5.45 1.04 -0.26 -1.15 113.70 123.14 2ai0 s SER 190 Ca -0.04 -0.26 0.04 0.00 0.48 0.00 0.00 55.95 56.17 2ai0 s SER 190 Cb -0.09 -0.86 -0.00 0.00 0.10 0.00 0.00 66.02 65.17 2ai0 s SER 190 CO 0.01 0.28 -0.17 0.54 0.98 0.00 0.00 173.24 174.88 2ai0 s VAL 191 N -0.93 1.43 -0.17 5.02 0.11 -0.14 -1.56 120.40 124.15 2ai0 s VAL 191 Ca 0.15 -0.70 -0.02 0.00 -2.93 0.00 0.00 61.98 58.48 2ai0 s VAL 191 Cb -0.11 -1.24 -0.02 0.00 -1.53 0.00 0.00 36.38 33.49 2ai0 s VAL 191 CO 0.06 0.41 -0.08 -0.89 -3.33 0.00 0.00 175.10 171.27 2ai0 s THR 192 N 0.16 3.37 0.10 5.04 2.01 -0.70 0.21 115.64 125.82 2ai0 s THR 192 Ca -0.07 -0.53 0.02 0.00 0.31 0.00 0.00 61.69 61.42 2ai0 s THR 192 Cb -0.13 -2.47 -0.04 0.00 0.01 0.00 0.00 72.50 69.87 2ai0 s THR 192 CO 0.03 0.48 -0.07 0.68 -0.69 0.00 0.00 174.62 175.05 2ai0 s VAL 193 N 0.77 0.70 0.30 3.82 -7.23 0.13 -4.74 120.40 114.16 2ai0 s VAL 193 Ca -0.03 -1.90 -0.30 0.00 -1.81 0.00 0.00 61.98 57.95 2ai0 s VAL 193 Cb -0.15 -1.63 -0.12 0.00 0.56 0.00 0.00 36.38 35.04 2ai0 s VAL 193 CO 0.02 -0.84 1.44 -2.65 -0.31 0.00 0.00 175.10 172.75 2ai0 n PRO 194 N 0.03 2.33 0.18 4.82 -0.02 -1.26 -0.04 135.00 141.03 2ai0 n PRO 194 Ca -0.13 0.82 0.14 0.00 -2.02 0.00 0.00 63.50 62.31 2ai0 n PRO 194 Cb 0.60 -2.50 0.58 0.00 -0.02 0.00 0.00 33.50 32.16 2ai0 n PRO 194 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2ai0 h SER 195 N 3.74 0.00 -0.09 2.55 4.64 -1.43 0.03 113.55 122.99 2ai0 h SER 195 Ca -0.47 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 60.88 2ai0 h SER 195 Cb 1.26 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2ai0 h SER 195 CO 0.71 0.00 0.08 0.28 -0.87 0.00 0.00 176.83 177.04 2ai0 h SER 196 N 0.00 0.00 0.00 4.97 0.02 -1.88 -3.25 113.55 113.40 2ai0 h SER 196 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2ai0 h SER 196 Cb 0.35 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.89 2ai0 h SER 196 CO 0.00 0.00 -1.78 0.35 -1.14 0.00 0.00 176.83 174.26 2ai0 n THR 197 N -4.09 0.00 -5.15 -2.27 -2.24 -0.01 -4.74 114.28 95.78 2ai0 n THR 197 Ca -0.01 -0.39 -0.31 0.00 -2.27 0.00 0.00 64.05 61.07 2ai0 n THR 197 Cb 0.19 0.12 -0.17 0.00 -2.10 0.00 0.00 70.33 68.37 2ai0 n THR 197 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 2ai0 s TRP 198 N -3.21 2.35 -2.48 4.78 -0.00 -1.22 -0.10 118.94 119.06 2ai0 s TRP 198 Ca -0.06 -0.83 0.27 0.00 -0.00 0.00 0.00 56.10 55.48 2ai0 s TRP 198 Cb 0.11 -1.56 0.99 0.00 -0.00 0.00 0.00 33.47 33.01 2ai0 s TRP 198 CO 0.73 -0.30 1.71 -0.35 -0.00 0.00 0.00 176.95 178.74 2ai0 n PRO 199 N 3.27 1.69 0.29 5.86 -0.04 -1.26 -4.82 135.00 139.99 2ai0 n PRO 199 Ca -0.19 -1.00 0.14 0.00 -0.04 0.00 0.00 63.50 62.41 2ai0 n PRO 199 Cb 0.52 -1.47 0.88 0.00 -0.04 0.00 0.00 33.50 33.39 2ai0 n PRO 199 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2ai0 h SER 200 N 2.39 0.00 -3.17 3.54 4.64 -1.85 -3.37 113.55 115.74 2ai0 h SER 200 Ca 0.00 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.65 2ai0 h SER 200 Cb 0.51 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 62.27 2ai0 h SER 200 CO 0.00 0.01 -0.83 -1.61 -0.87 0.00 0.00 176.83 173.53 2ai0 s GLU 201 N -4.64 3.09 0.34 4.77 2.02 0.85 -5.10 118.70 120.03 2ai0 s GLU 201 Ca -0.05 -0.79 -0.29 0.00 0.02 0.00 0.00 54.97 53.87 2ai0 s GLU 201 Cb 0.15 -2.62 -0.12 0.00 0.10 0.00 0.00 34.13 31.64 2ai0 s GLU 201 CO 0.56 -0.14 1.43 0.25 0.02 0.00 0.00 175.26 177.38 2ai0 n THR 202 N 4.47 1.74 -4.44 3.63 -2.24 -1.26 -4.48 114.28 111.71 2ai0 n THR 202 Ca -0.20 -0.44 -0.30 0.00 -2.27 0.00 0.00 64.05 60.84 2ai0 n THR 202 Cb 0.51 -1.80 -0.17 0.00 -2.10 0.00 0.00 70.33 66.78 2ai0 n THR 202 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2ai0 s VAL 203 N -0.83 1.67 -0.05 2.28 1.01 -1.26 -4.98 120.40 118.23 2ai0 s VAL 203 Ca 0.57 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.82 2ai0 s VAL 203 Cb -0.53 -1.51 0.02 0.00 0.00 0.00 0.00 36.38 34.37 2ai0 s VAL 203 CO 0.59 0.47 -0.03 -0.89 0.00 0.00 0.00 175.10 175.25 2ai0 s THR 204 N 1.03 0.47 -0.05 3.92 2.01 -1.26 -0.39 115.64 121.37 2ai0 s THR 204 Ca -0.05 -0.06 -0.14 0.00 0.31 0.00 0.00 61.69 61.75 2ai0 s THR 204 Cb -0.15 -0.53 -0.05 0.00 0.01 0.00 0.00 72.50 71.79 2ai0 s THR 204 CO -0.03 0.22 0.36 0.00 -0.69 0.00 0.00 174.62 174.48 2ai0 s ASN 206 N -0.72 4.48 -0.19 0.00 -0.87 0.07 -1.71 114.94 115.99 2ai0 s ASN 206 Ca 0.22 -0.34 0.00 0.00 -1.57 0.00 0.00 52.86 51.17 2ai0 s ASN 206 Cb -0.15 -1.77 0.02 0.00 -0.02 0.00 0.00 41.25 39.32 2ai0 s ASN 206 CO 0.11 -0.01 -0.17 -0.69 -2.57 0.00 0.00 177.10 173.76 2ai0 s VAL 207 N 1.43 2.25 -0.13 1.60 1.01 0.29 -1.49 120.40 125.38 2ai0 s VAL 207 Ca 0.05 -0.91 -0.03 0.00 0.00 0.00 0.00 61.98 61.09 2ai0 s VAL 207 Cb -0.14 -1.97 -0.03 0.00 0.00 0.00 0.00 36.38 34.23 2ai0 s VAL 207 CO -0.01 0.50 -0.00 0.00 0.00 0.00 0.00 175.10 175.58 2ai0 s ALA 208 N 1.31 3.20 -0.41 5.51 0.00 -0.38 -0.66 121.76 130.33 2ai0 s ALA 208 Ca 0.05 -0.80 0.02 0.00 0.00 0.00 0.00 51.96 51.23 2ai0 s ALA 208 Cb -0.13 -1.58 0.12 0.00 0.00 0.00 0.00 23.12 21.53 2ai0 s ALA 208 CO -0.11 0.38 0.17 -1.58 0.00 0.00 0.00 175.76 174.62 2ai0 s HIS 209 N -0.22 2.63 0.28 0.00 2.46 0.91 -0.89 115.29 120.45 2ai0 s HIS 209 Ca 0.05 -2.60 -0.00 0.00 0.47 0.00 0.00 55.06 52.98 2ai0 s HIS 209 Cb -0.12 -2.32 0.64 0.00 -0.13 0.00 0.00 32.58 30.64 2ai0 s HIS 209 CO 0.02 -0.83 1.66 -1.35 -2.47 0.00 0.00 174.74 171.77 2ai0 h PRO 210 N 7.16 0.22 -0.38 2.88 0.11 -1.81 -2.09 132.00 138.10 2ai0 h PRO 210 Ca -0.06 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.94 2ai0 h PRO 210 Cb 0.96 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.00 2ai0 h PRO 210 CO 0.54 0.15 -0.17 0.00 -0.21 0.00 0.00 178.00 178.31 2ai0 h ALA 211 N 1.74 0.99 -0.18 -0.75 0.00 -1.91 -2.06 119.26 117.09 2ai0 h ALA 211 Ca 0.51 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2ai0 h ALA 211 Cb 0.99 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2ai0 h ALA 211 CO -0.62 0.60 0.00 -1.13 0.00 0.00 0.00 179.25 178.10 2ai0 n SER 212 N -4.14 2.92 -3.36 0.00 3.41 -1.13 -4.97 113.62 106.35 2ai0 n SER 212 Ca 0.01 -1.93 -0.17 0.00 -0.26 0.00 0.00 58.87 56.52 2ai0 n SER 212 Cb 0.39 -0.11 0.08 0.00 -0.26 0.00 0.00 64.21 64.32 2ai0 n SER 212 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2ai0 n SER 213 N 1.21 -2.77 -4.06 4.04 7.64 -0.78 -4.96 113.62 113.94 2ai0 n SER 213 Ca 0.17 -0.58 -0.26 0.00 1.01 0.00 0.00 58.87 59.21 2ai0 n SER 213 Cb 0.56 -4.93 -0.17 0.00 -1.01 0.00 0.00 64.21 58.66 2ai0 n SER 213 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2ai0 s THR 214 N -3.34 1.28 -0.10 0.44 2.01 -0.86 -5.02 115.64 110.05 2ai0 s THR 214 Ca 0.10 -0.57 0.03 0.00 0.31 0.00 0.00 61.69 61.55 2ai0 s THR 214 Cb -0.04 -1.15 0.01 0.00 0.01 0.00 0.00 72.50 71.32 2ai0 s THR 214 CO 0.70 0.39 -0.18 -0.75 -0.69 0.00 0.00 174.62 174.09 2ai0 s LYS 215 N 0.57 2.43 -0.02 4.92 2.36 -1.26 -0.06 119.74 128.67 2ai0 s LYS 215 Ca -0.14 -0.65 0.05 0.00 -2.55 0.00 0.00 55.97 52.68 2ai0 s LYS 215 Cb -0.16 -1.96 -0.01 0.00 -1.05 0.00 0.00 37.83 34.65 2ai0 s LYS 215 CO 0.04 0.03 -0.18 0.08 1.55 0.00 0.00 175.35 176.87 2ai0 s VAL 216 N 0.71 1.47 -0.12 4.02 1.01 0.17 -5.00 120.40 122.65 2ai0 s VAL 216 Ca -0.12 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.10 2ai0 s VAL 216 Cb -0.16 -1.23 0.01 0.00 0.00 0.00 0.00 36.38 35.00 2ai0 s VAL 216 CO 0.03 0.42 -0.19 -1.81 0.00 0.00 0.00 175.10 173.54 2ai0 s ASP 217 N -0.33 2.83 -0.25 3.32 1.01 -1.26 -0.55 116.67 121.44 2ai0 s ASP 217 Ca 0.05 -0.53 -0.00 0.00 0.71 0.00 0.00 52.55 52.78 2ai0 s ASP 217 Cb -0.08 -1.30 0.04 0.00 1.01 0.00 0.00 42.92 42.59 2ai0 s ASP 217 CO -0.00 0.06 -0.08 -0.75 0.21 0.00 0.00 175.17 174.61 2ai0 s LYS 218 N 0.86 2.60 0.04 8.23 2.47 -0.70 -4.99 119.74 128.24 2ai0 s LYS 218 Ca -0.07 -1.13 -0.30 0.00 -1.56 0.00 0.00 55.97 52.90 2ai0 s LYS 218 Cb -0.15 -2.95 -0.06 0.00 -1.46 0.00 0.00 37.83 33.21 2ai0 s LYS 218 CO -0.01 -0.47 1.30 0.21 0.16 0.00 0.00 175.35 176.53 2ai0 s LYS 219 N 1.24 4.35 -0.55 4.03 2.20 -1.26 -1.88 119.74 127.88 2ai0 s LYS 219 Ca -0.03 1.87 -0.26 0.00 -0.36 0.00 0.00 55.97 57.19 2ai0 s LYS 219 Cb -0.18 -3.42 0.03 0.00 -1.51 0.00 0.00 37.83 32.76 2ai0 s LYS 219 CO -0.05 -0.41 1.07 0.42 -0.36 0.00 0.00 175.35 176.02 2ai0 s ILE 220 N 1.61 4.21 0.01 5.43 -1.09 0.48 -4.97 121.20 126.89 2ai0 s ILE 220 Ca 0.61 0.68 0.02 0.00 -2.23 0.00 0.00 60.65 59.73 2ai0 s ILE 220 Cb -0.31 -4.62 -0.04 0.00 -1.58 0.00 0.00 42.46 35.91 2ai0 s ILE 220 CO 0.28 -1.19 0.01 0.68 -1.23 0.00 0.00 174.94 173.49 2ai0 s VAL 221 N 4.44 4.20 0.58 2.92 -7.23 -1.26 -4.56 120.40 119.49 2ai0 s VAL 221 Ca 0.38 -0.62 -0.19 0.00 -1.81 0.00 0.00 61.98 59.74 2ai0 s VAL 221 Cb -0.10 -2.89 -0.05 0.00 0.56 0.00 0.00 36.38 33.90 2ai0 s VAL 221 CO 0.24 0.35 0.97 -0.81 -0.31 0.00 0.00 175.10 175.53 2ai0 n PRO 222 N 1.28 0.96 0.00 4.82 -0.04 -1.26 -4.85 135.00 135.90 2ai0 n PRO 222 Ca -0.14 0.37 0.07 0.00 -0.04 0.00 0.00 63.50 63.76 2ai0 n PRO 222 Cb 0.53 -2.16 0.06 0.00 -0.04 0.00 0.00 33.50 31.88 2ai0 n PRO 222 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35