#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3it9 n GLN 4 N 0.00 3.22 0.17 5.31 1.13 -1.26 -4.69 117.38 121.25 3it9 n GLN 4 Ca 0.00 -0.04 -0.09 0.00 -1.94 0.00 0.00 57.00 54.93 3it9 n GLN 4 Cb 0.00 -1.04 -0.05 0.00 0.11 0.00 0.00 30.24 29.27 3it9 n GLN 4 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 3it9 h THR 5 N 0.07 0.13 -3.42 5.09 2.02 -2.01 -3.44 112.91 111.35 3it9 h THR 5 Ca 0.00 -0.67 -0.61 0.00 0.77 0.00 0.00 66.41 65.90 3it9 h THR 5 Cb 0.27 0.21 -0.13 0.00 -1.74 0.00 0.00 68.15 66.76 3it9 h THR 5 CO 0.00 0.03 -0.50 0.54 0.37 0.00 0.00 175.52 175.96 3it9 s VAL 6 N -3.37 5.35 -0.07 3.16 0.11 -1.26 -5.02 120.40 119.30 3it9 s VAL 6 Ca -0.09 0.17 -0.35 0.00 -2.93 0.00 0.00 61.98 58.78 3it9 s VAL 6 Cb 0.01 -3.47 -0.13 0.00 -1.53 0.00 0.00 36.38 31.26 3it9 s VAL 6 CO 0.28 0.40 1.76 -0.62 -3.33 0.00 0.00 175.10 173.59 3it9 n GLU 7 N 3.89 1.90 -1.59 1.54 -0.58 -1.26 -4.96 120.64 119.58 3it9 n GLU 7 Ca -0.16 0.69 -0.32 0.00 -0.42 0.00 0.00 57.16 56.96 3it9 n GLU 7 Cb 0.52 -2.48 0.06 0.00 -0.57 0.00 0.00 31.44 28.97 3it9 n GLU 7 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3it9 s ALA 8 N 3.17 2.46 0.48 0.62 0.00 -1.26 -5.05 121.76 122.18 3it9 s ALA 8 Ca 0.91 0.35 -0.08 0.00 0.00 0.00 0.00 51.96 53.15 3it9 s ALA 8 Cb -0.78 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.02 3it9 s ALA 8 CO 0.52 -1.38 0.82 -1.25 0.00 0.00 0.00 175.76 174.47 3it9 s PRO 9 N -4.53 3.61 0.33 0.00 0.04 -1.26 -5.05 135.00 128.15 3it9 s PRO 9 Ca 0.63 0.36 -0.28 0.00 0.04 0.00 0.00 61.00 61.75 3it9 s PRO 9 Cb -0.18 -2.33 -0.12 0.00 0.04 0.00 0.00 34.50 31.91 3it9 s PRO 9 CO 0.48 -0.22 1.35 0.43 0.04 0.00 0.00 177.00 179.08 3it9 n SER 10 N -2.09 2.97 -4.06 6.66 7.64 -1.26 -5.03 113.62 118.45 3it9 n SER 10 Ca 0.02 1.20 -0.22 0.00 1.01 0.00 0.00 58.87 60.87 3it9 n SER 10 Cb 0.55 -1.50 -0.16 0.00 -1.01 0.00 0.00 64.21 62.09 3it9 n SER 10 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 3it9 s VAL 11 N -0.91 1.03 -1.04 0.44 -7.23 -1.26 -5.06 120.40 106.37 3it9 s VAL 11 Ca 0.57 -0.51 -0.16 0.00 -1.81 0.00 0.00 61.98 60.07 3it9 s VAL 11 Cb -0.56 -0.90 0.15 0.00 0.56 0.00 0.00 36.38 35.63 3it9 s VAL 11 CO 0.60 0.31 1.24 -0.62 -0.31 0.00 0.00 175.10 176.32 3it9 s ASP 12 N 0.08 6.84 -0.14 4.85 2.15 -1.26 -4.90 116.67 124.29 3it9 s ASP 12 Ca -0.02 -2.50 -0.32 0.00 0.43 0.00 0.00 52.55 50.13 3it9 s ASP 12 Cb -0.09 -2.39 0.13 0.00 -0.30 0.00 0.00 42.92 40.27 3it9 s ASP 12 CO 0.01 -0.89 1.10 0.00 -0.17 0.00 0.00 175.17 175.21 3it9 s ALA 13 N 2.02 -1.98 0.11 3.66 0.00 -1.26 -4.63 121.76 119.68 3it9 s ALA 13 Ca 0.36 1.44 -0.19 0.00 0.00 0.00 0.00 51.96 53.57 3it9 s ALA 13 Cb -0.04 -0.09 -0.06 0.00 0.00 0.00 0.00 23.12 22.93 3it9 s ALA 13 CO -0.06 -0.58 1.69 0.00 0.00 0.00 0.00 175.76 176.82 3it9 h ARG 14 N 2.06 0.36 -3.57 0.00 3.08 -1.20 -3.46 114.38 111.66 3it9 h ARG 14 Ca -0.14 -0.05 -0.15 0.00 0.07 0.00 0.00 59.98 59.72 3it9 h ARG 14 Cb 1.19 -0.07 -0.21 0.00 0.08 0.00 0.00 29.97 30.97 3it9 h ARG 14 CO 0.26 0.35 -0.51 0.00 -1.07 0.00 0.00 179.97 179.00 3it9 s ALA 15 N -5.76 -0.27 0.17 0.04 0.00 -0.91 -4.61 121.76 110.41 3it9 s ALA 15 Ca -0.13 -0.20 -0.20 0.00 0.00 0.00 0.00 51.96 51.43 3it9 s ALA 15 Cb 0.08 0.12 0.05 0.00 0.00 0.00 0.00 23.12 23.37 3it9 s ALA 15 CO 0.71 -0.21 0.55 1.67 0.00 0.00 0.00 175.76 178.48 3it9 s TRP 16 N -1.42 -0.34 -0.12 0.00 -2.14 -0.24 -0.08 118.94 114.60 3it9 s TRP 16 Ca -0.15 0.06 -0.18 0.00 2.66 0.00 0.00 56.10 58.49 3it9 s TRP 16 Cb -0.08 0.47 0.04 0.00 -3.10 0.00 0.00 33.47 30.80 3it9 s TRP 16 CO 0.01 -0.86 0.46 -1.50 -2.66 0.00 0.00 176.95 172.40 3it9 s ILE 17 N -3.80 0.01 -0.14 0.66 2.07 -0.42 -1.45 121.20 118.13 3it9 s ILE 17 Ca 0.04 -0.11 0.02 0.00 -1.41 0.00 0.00 60.65 59.19 3it9 s ILE 17 Cb -0.01 -0.70 0.01 0.00 0.13 0.00 0.00 42.46 41.89 3it9 s ILE 17 CO -0.09 -0.06 -0.21 -0.22 -1.91 0.00 0.00 174.94 172.45 3it9 s LEU 18 N -0.31 2.19 -0.03 8.50 2.96 0.23 -1.09 118.68 131.13 3it9 s LEU 18 Ca -0.05 -0.57 0.02 0.00 -0.22 0.00 0.00 54.13 53.31 3it9 s LEU 18 Cb -0.03 -1.47 0.01 0.00 0.50 0.00 0.00 46.19 45.19 3it9 s LEU 18 CO 0.03 0.08 -0.07 -0.32 -1.32 0.00 0.00 176.35 174.75 3it9 s MET 19 N 0.80 0.85 0.14 1.98 -2.45 0.11 -0.58 119.30 120.13 3it9 s MET 19 Ca -0.07 -0.23 -0.30 0.00 -1.25 0.00 0.00 55.69 53.83 3it9 s MET 19 Cb -0.16 -0.81 -0.07 0.00 1.25 0.00 0.00 34.83 35.05 3it9 s MET 19 CO -0.01 0.06 1.03 0.34 1.05 0.00 0.00 175.02 177.49 3it9 s ASP 20 N 0.33 7.38 0.06 1.11 -1.08 -0.48 -0.36 116.67 123.63 3it9 s ASP 20 Ca -0.05 1.93 -0.16 0.00 -0.52 0.00 0.00 52.55 53.76 3it9 s ASP 20 Cb -0.09 -2.59 -0.19 0.00 -1.46 0.00 0.00 42.92 38.58 3it9 s ASP 20 CO 0.00 -0.15 1.22 0.22 0.52 0.00 0.00 175.17 176.99 3it9 h TYR 21 N 5.44 0.88 0.04 -5.34 3.20 -1.42 0.12 116.97 119.89 3it9 h TYR 21 Ca -0.43 -0.42 -0.27 0.00 3.14 0.00 0.00 58.73 60.74 3it9 h TYR 21 Cb 1.21 -0.12 0.02 0.00 1.54 0.00 0.00 36.73 39.38 3it9 h TYR 21 CO 0.64 1.24 -1.10 0.00 -1.64 0.00 0.00 178.16 177.30 3it9 h ALA 22 N 0.46 0.11 0.00 1.82 0.00 -1.93 -3.35 119.26 116.37 3it9 h ALA 22 Ca -0.07 -0.72 -0.24 0.00 0.00 0.00 0.00 54.91 53.88 3it9 h ALA 22 Cb 1.38 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 19.19 3it9 h ALA 22 CO 0.15 0.70 -1.91 -1.13 0.00 0.00 0.00 179.25 177.05 3it9 n SER 23 N -3.82 0.41 0.00 0.00 3.41 -1.25 -4.73 113.62 107.65 3it9 n SER 23 Ca -0.11 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 3it9 n SER 23 Cb 0.91 0.70 0.00 0.00 -0.26 0.00 0.00 64.21 65.57 3it9 n SER 23 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3it9 n GLY 24 N 1.54 1.47 3.67 5.00 0.00 0.41 -4.91 105.19 112.36 3it9 n GLY 24 Ca -0.19 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.37 3it9 n GLY 24 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3it9 n LYS 25 N -2.00 2.11 -2.89 1.61 3.00 -1.25 -4.69 118.16 114.05 3it9 n LYS 25 Ca 0.00 0.76 -0.42 0.00 -0.00 0.00 0.00 58.31 58.65 3it9 n LYS 25 Cb 0.00 -2.50 -0.04 0.00 0.00 0.00 0.00 35.03 32.48 3it9 n LYS 25 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 3it9 s VAL 26 N 0.68 4.67 -0.11 3.15 1.01 -1.26 -1.38 120.40 127.16 3it9 s VAL 26 Ca 0.76 1.02 0.16 0.00 0.00 0.00 0.00 61.98 63.92 3it9 s VAL 26 Cb -0.68 -4.27 -0.13 0.00 0.00 0.00 0.00 36.38 31.30 3it9 s VAL 26 CO 0.41 -0.48 0.85 -0.07 0.00 0.00 0.00 175.10 175.81 3it9 h LEU 27 N 9.89 0.00 -7.16 3.92 3.38 -1.21 -3.00 115.31 121.13 3it9 h LEU 27 Ca -0.24 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.66 3it9 h LEU 27 Cb 1.09 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.66 3it9 h LEU 27 CO 0.94 0.62 0.06 0.00 0.09 0.00 0.00 178.44 180.15 3it9 s ALA 28 N -2.89 -1.43 -0.06 1.53 0.00 -1.19 -4.55 121.76 113.16 3it9 s ALA 28 Ca -0.03 0.83 -0.31 0.00 0.00 0.00 0.00 51.96 52.46 3it9 s ALA 28 Cb 0.09 0.21 0.07 0.00 0.00 0.00 0.00 23.12 23.49 3it9 s ALA 28 CO 0.81 -0.43 0.70 -1.83 0.00 0.00 0.00 175.76 175.01 3it9 s GLU 29 N -1.86 1.03 -0.05 0.00 -1.05 -1.26 -0.60 118.70 114.91 3it9 s GLU 29 Ca -0.08 0.28 -0.03 0.00 -0.15 0.00 0.00 54.97 54.99 3it9 s GLU 29 Cb -0.01 0.48 0.03 0.00 -0.44 0.00 0.00 34.13 34.19 3it9 s GLU 29 CO 0.03 -0.31 0.11 0.20 0.95 0.00 0.00 175.26 176.24 3it9 s GLY 30 N -1.13 -0.02 -1.66 -3.83 0.00 -0.53 -4.91 107.32 95.24 3it9 s GLY 30 Ca -0.10 0.49 -0.19 0.00 0.00 0.00 0.00 44.72 44.92 3it9 s GLY 30 CO 0.09 0.70 0.70 0.70 0.00 0.00 0.00 173.10 175.29 3it9 n ASN 31 N 3.82 -2.99 0.00 1.64 3.02 -1.26 -1.07 115.26 118.41 3it9 n ASN 31 Ca -0.22 -0.96 0.10 0.00 -0.03 0.00 0.00 54.58 53.47 3it9 n ASN 31 Cb 0.54 -2.48 0.53 0.00 -0.61 0.00 0.00 39.78 37.76 3it9 n ASN 31 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3it9 n ALA 32 N -4.18 2.11 0.03 5.41 0.00 -1.26 -1.94 120.51 120.68 3it9 n ALA 32 Ca 0.08 -0.10 0.02 0.00 0.00 0.00 0.00 53.44 53.43 3it9 n ALA 32 Cb 0.48 -1.32 0.03 0.00 0.00 0.00 0.00 19.45 18.64 3it9 n ALA 32 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3it9 n ASP 33 N -1.19 1.78 -4.69 0.00 8.00 -1.26 -1.40 116.55 117.78 3it9 n ASP 33 Ca 0.11 -1.59 -0.42 0.00 0.71 0.00 0.00 54.79 53.60 3it9 n ASP 33 Cb 0.13 -0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.17 3it9 n ASP 33 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3it9 s GLU 34 N -0.65 4.32 0.03 -1.24 2.12 -0.82 -4.94 118.70 117.52 3it9 s GLU 34 Ca 0.05 1.86 -0.30 0.00 0.36 0.00 0.00 54.97 56.93 3it9 s GLU 34 Cb 0.03 -3.54 -0.06 0.00 0.26 0.00 0.00 34.13 30.82 3it9 s GLU 34 CO 0.04 -0.51 1.41 0.15 -0.54 0.00 0.00 175.26 175.81 3it9 s LYS 35 N 2.21 4.29 0.17 4.30 1.02 -1.26 -4.48 119.74 125.98 3it9 s LYS 35 Ca 0.61 2.01 -0.05 0.00 0.02 0.00 0.00 55.97 58.55 3it9 s LYS 35 Cb -0.29 -3.51 -0.02 0.00 -0.52 0.00 0.00 37.83 33.49 3it9 s LYS 35 CO 0.25 -0.55 0.21 -0.51 -0.92 0.00 0.00 175.35 173.83 3it9 s LEU 36 N 2.12 1.17 -0.21 3.17 1.43 0.04 -4.93 118.68 121.48 3it9 s LEU 36 Ca 0.64 -1.08 -0.29 0.00 -1.03 0.00 0.00 54.13 52.37 3it9 s LEU 36 Cb -0.33 0.82 0.00 0.00 0.03 0.00 0.00 46.19 46.72 3it9 s LEU 36 CO 0.28 -0.86 1.10 -0.62 0.23 0.00 0.00 176.35 176.47 3it9 s ASP 37 N -3.04 7.06 0.40 2.29 3.68 -1.26 -1.23 116.67 124.58 3it9 s ASP 37 Ca 0.24 1.47 0.22 0.00 2.13 0.00 0.00 52.55 56.61 3it9 s ASP 37 Cb 0.05 -2.54 0.53 0.00 -1.45 0.00 0.00 42.92 39.50 3it9 s ASP 37 CO 0.04 -0.69 1.66 1.55 0.13 0.00 0.00 175.17 177.86 3it9 h PRO 38 N 7.64 0.00 0.00 4.34 0.13 -1.89 -3.46 132.00 138.76 3it9 h PRO 38 Ca -0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 3it9 h PRO 38 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 3it9 h PRO 38 CO 0.97 0.22 0.00 0.00 -0.23 0.00 0.00 178.00 178.96 3it9 n ALA 39 N -2.17 0.00 0.44 -0.56 0.00 -1.26 -1.43 120.51 115.54 3it9 n ALA 39 Ca 0.02 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.55 3it9 n ALA 39 Cb 0.54 0.00 0.41 0.00 0.00 0.00 0.00 19.45 20.40 3it9 n ALA 39 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3it9 n SER 40 N 2.07 0.36 -0.09 0.00 7.64 -1.26 -1.80 113.62 120.53 3it9 n SER 40 Ca 0.00 0.59 0.18 0.00 1.01 0.00 0.00 58.87 60.65 3it9 n SER 40 Cb 0.00 -0.67 0.60 0.00 -1.01 0.00 0.00 64.21 63.13 3it9 n SER 40 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 3it9 h LEU 41 N 0.00 0.20 -1.15 -3.43 3.38 -1.36 0.04 115.31 113.00 3it9 h LEU 41 Ca 0.00 0.01 0.39 0.00 0.09 0.00 0.00 57.88 58.37 3it9 h LEU 41 Cb 0.31 -0.03 -0.15 0.00 0.09 0.00 0.00 40.66 40.88 3it9 h LEU 41 CO 0.00 0.10 0.66 0.74 0.09 0.00 0.00 178.44 180.03 3it9 h THR 42 N 0.21 0.16 0.00 0.22 2.02 -1.50 0.60 112.91 114.62 3it9 h THR 42 Ca 0.32 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.45 3it9 h THR 42 Cb 0.96 -0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.37 3it9 h THR 42 CO -0.06 0.03 0.00 0.29 0.37 0.00 0.00 175.52 176.15 3it9 n LYS 43 N -4.98 0.07 -0.28 6.66 5.02 0.00 -1.39 118.16 123.26 3it9 n LYS 43 Ca 0.35 0.34 -0.06 0.00 -2.02 0.00 0.00 58.31 56.92 3it9 n LYS 43 Cb 1.21 -1.63 0.06 0.00 -0.02 0.00 0.00 35.03 34.65 3it9 n LYS 43 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 3it9 h ILE 44 N 0.00 1.25 -0.13 -0.18 2.04 0.06 -0.74 117.51 119.80 3it9 h ILE 44 Ca 0.00 -0.72 -0.22 0.00 1.00 0.00 0.00 64.86 64.92 3it9 h ILE 44 Cb 0.26 0.31 0.01 0.00 -0.74 0.00 0.00 36.82 36.66 3it9 h ILE 44 CO 0.00 0.30 -0.78 -0.03 0.00 0.00 0.00 178.15 177.64 3it9 h MET 45 N 1.08 0.72 -0.41 2.37 4.05 -1.37 -0.57 114.93 120.80 3it9 h MET 45 Ca 0.26 -0.59 0.07 0.00 -0.28 0.00 0.00 59.70 59.15 3it9 h MET 45 Cb 0.15 0.13 -0.06 0.00 -0.80 0.00 0.00 31.60 31.02 3it9 h MET 45 CO -0.03 1.20 0.06 1.15 0.23 0.00 0.00 176.91 179.53 3it9 h THR 46 N 0.49 0.76 -0.19 -0.77 2.02 -1.42 -0.19 112.91 113.62 3it9 h THR 46 Ca -0.05 -0.06 -0.07 0.00 0.77 0.00 0.00 66.41 67.00 3it9 h THR 46 Cb 1.40 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 68.36 3it9 h THR 46 CO 0.16 0.03 -0.18 -1.28 0.37 0.00 0.00 175.52 174.62 3it9 h SER 47 N 0.18 0.32 0.33 4.18 0.87 -0.99 -1.97 113.55 116.47 3it9 h SER 47 Ca 0.20 -0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 60.66 3it9 h SER 47 Cb 0.25 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.13 3it9 h SER 47 CO -0.28 0.52 -0.17 0.22 -0.53 0.00 0.00 176.83 176.59 3it9 h TYR 48 N 0.30 -0.44 0.18 2.24 3.20 0.50 0.32 116.97 123.28 3it9 h TYR 48 Ca 0.05 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.93 3it9 h TYR 48 Cb 0.50 0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.89 3it9 h TYR 48 CO 0.01 -0.27 -0.34 0.28 -1.64 0.00 0.00 178.16 176.20 3it9 h VAL 49 N -0.46 0.29 -0.89 1.81 2.07 -0.98 0.91 116.25 119.01 3it9 h VAL 49 Ca -0.04 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.56 3it9 h VAL 49 Cb 0.36 0.29 -0.07 0.00 -1.52 0.00 0.00 31.29 30.35 3it9 h VAL 49 CO 0.06 0.00 0.54 1.62 0.02 0.00 0.00 177.57 179.81 3it9 h VAL 50 N -0.61 0.97 -0.59 2.57 3.04 -1.34 0.71 116.25 121.00 3it9 h VAL 50 Ca 0.01 -0.32 0.11 0.00 -1.01 0.00 0.00 66.70 65.49 3it9 h VAL 50 Cb 0.61 -0.03 -0.08 0.00 -2.01 0.00 0.00 31.29 29.77 3it9 h VAL 50 CO -0.16 0.17 0.14 1.23 -1.01 0.00 0.00 177.57 177.94 3it9 h GLY 51 N 0.93 0.77 0.94 3.17 0.00 0.11 0.15 103.07 109.14 3it9 h GLY 51 Ca 0.41 -0.04 -0.06 0.00 0.00 0.00 0.00 47.33 47.64 3it9 h GLY 51 CO -0.22 -0.10 0.02 1.46 0.00 0.00 0.00 176.54 177.70 3it9 h GLN 52 N 0.28 0.68 -0.87 4.80 1.08 0.26 -1.46 115.11 119.87 3it9 h GLN 52 Ca 0.31 -0.21 0.14 0.00 -1.45 0.00 0.00 58.65 57.44 3it9 h GLN 52 Cb 0.45 -0.07 -0.09 0.00 -0.05 0.00 0.00 27.48 27.72 3it9 h GLN 52 CO -0.38 0.76 0.47 0.00 -0.95 0.00 0.00 178.83 178.73 3it9 h ALA 53 N 0.89 1.32 0.10 3.87 0.00 -0.11 -0.36 119.26 124.97 3it9 h ALA 53 Ca 0.11 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 3it9 h ALA 53 Cb 0.45 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3it9 h ALA 53 CO 0.02 -0.03 -0.05 -0.07 0.00 0.00 0.00 179.25 179.11 3it9 h LEU 54 N 0.69 -0.11 -0.57 0.00 3.38 -0.36 -2.13 115.31 116.21 3it9 h LEU 54 Ca 0.47 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3it9 h LEU 54 Cb 0.62 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.40 3it9 h LEU 54 CO -0.34 0.23 0.00 0.07 0.09 0.00 0.00 178.44 178.49 3it9 h LYS 55 N -0.47 0.00 -0.00 1.13 2.10 -1.06 -1.95 116.57 116.32 3it9 h LYS 55 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 3it9 h LYS 55 Cb 0.39 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.72 3it9 h LYS 55 CO 0.02 0.00 -0.31 0.00 -2.00 0.00 0.00 179.45 177.17 3it9 n ALA 56 N -1.94 3.11 -0.73 0.07 0.00 -0.16 -4.94 120.51 115.90 3it9 n ALA 56 Ca 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.19 3it9 n ALA 56 Cb 0.37 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.59 3it9 n ALA 56 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3it9 n ASP 57 N -1.36 -2.20 0.09 0.00 -0.08 -0.73 -4.88 116.55 107.38 3it9 n ASP 57 Ca 0.08 0.00 0.13 0.00 -1.51 0.00 0.00 54.79 53.49 3it9 n ASP 57 Cb 0.33 -0.37 0.40 0.00 2.34 0.00 0.00 41.12 43.82 3it9 n ASP 57 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 3it9 n LYS 58 N -2.73 0.23 -4.09 -0.67 4.76 -0.94 -4.77 118.16 109.95 3it9 n LYS 58 Ca 0.00 0.17 -0.07 0.00 -2.87 0.00 0.00 58.31 55.54 3it9 n LYS 58 Cb 0.00 -1.75 -0.10 0.00 -1.84 0.00 0.00 35.03 31.34 3it9 n LYS 58 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 3it9 s ILE 59 N -3.09 0.21 0.22 -0.18 -4.36 -1.21 -5.05 121.20 107.74 3it9 s ILE 59 Ca 0.11 -1.80 0.10 0.00 -0.26 0.00 0.00 60.65 58.80 3it9 s ILE 59 Cb 0.13 -1.56 -0.05 0.00 1.25 0.00 0.00 42.46 42.24 3it9 s ILE 59 CO 0.61 -0.94 -0.18 -0.54 0.24 0.00 0.00 174.94 174.12 3it9 s LYS 60 N -3.93 1.47 0.50 0.37 1.02 -1.26 -4.56 119.74 113.35 3it9 s LYS 60 Ca 0.08 -1.61 0.22 0.00 0.02 0.00 0.00 55.97 54.69 3it9 s LYS 60 Cb 0.08 -1.49 1.32 0.00 -0.52 0.00 0.00 37.83 37.21 3it9 s LYS 60 CO -0.09 0.28 2.07 -0.07 -0.92 0.00 0.00 175.35 176.62 3it9 h LEU 61 N 2.68 0.00 -0.96 3.17 3.38 -1.96 -1.18 115.31 120.45 3it9 h LEU 61 Ca -0.41 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.46 3it9 h LEU 61 Cb 1.23 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.96 3it9 h LEU 61 CO 0.57 0.12 -0.51 0.71 0.09 0.00 0.00 178.44 179.43 3it9 h THR 62 N 0.00 1.32 -2.92 0.22 1.35 -1.97 -2.03 112.91 108.89 3it9 h THR 62 Ca -0.00 -1.77 -0.58 0.00 -0.55 0.00 0.00 66.41 63.51 3it9 h THR 62 Cb 0.26 1.96 0.11 0.00 -1.73 0.00 0.00 68.15 68.75 3it9 h THR 62 CO 0.02 0.50 0.40 0.47 -0.25 0.00 0.00 175.52 176.65 3it9 n ASP 63 N -3.87 2.26 -4.59 5.36 9.92 -0.44 -4.59 116.55 120.60 3it9 n ASP 63 Ca -0.01 1.19 -0.34 0.00 -0.53 0.00 0.00 54.79 55.09 3it9 n ASP 63 Cb 0.53 -1.41 -0.11 0.00 -0.64 0.00 0.00 41.12 39.50 3it9 n ASP 63 CO 0.00 0.00 0.00 -0.32 0.13 0.00 0.00 177.20 177.01 3it9 s MET 64 N -1.52 3.65 -0.05 -1.24 1.75 -1.26 -0.21 119.30 120.41 3it9 s MET 64 Ca 0.59 -0.43 0.06 0.00 -1.25 0.00 0.00 55.69 54.66 3it9 s MET 64 Cb -0.63 -3.00 -0.01 0.00 2.84 0.00 0.00 34.83 34.02 3it9 s MET 64 CO 0.59 0.35 -0.24 0.14 -0.65 0.00 0.00 175.02 175.21 3it9 s VAL 65 N 0.10 2.14 -0.14 10.11 -7.23 -0.11 -4.94 120.40 120.32 3it9 s VAL 65 Ca 0.02 -1.04 -0.29 0.00 -1.81 0.00 0.00 61.98 58.85 3it9 s VAL 65 Cb -0.13 -1.77 -0.01 0.00 0.56 0.00 0.00 36.38 35.03 3it9 s VAL 65 CO 0.02 0.57 1.18 -0.89 -0.31 0.00 0.00 175.10 175.67 3it9 s THR 66 N -0.25 4.40 -0.05 5.32 2.01 -1.26 -2.06 115.64 123.74 3it9 s THR 66 Ca -0.01 1.69 -0.30 0.00 0.31 0.00 0.00 61.69 63.39 3it9 s THR 66 Cb -0.13 -4.09 -0.06 0.00 0.01 0.00 0.00 72.50 68.22 3it9 s THR 66 CO 0.03 -0.09 1.79 -0.69 -0.69 0.00 0.00 174.62 174.97 3it9 s VAL 67 N 2.95 3.36 0.90 3.82 1.01 -0.66 -5.00 120.40 126.79 3it9 s VAL 67 Ca 0.52 0.44 -0.12 0.00 0.00 0.00 0.00 61.98 62.82 3it9 s VAL 67 Cb -0.21 -3.30 0.13 0.00 0.00 0.00 0.00 36.38 33.00 3it9 s VAL 67 CO 0.15 -0.06 1.10 -0.83 0.00 0.00 0.00 175.10 175.46 3it9 s GLY 68 N 4.11 1.60 0.66 4.51 0.00 -1.26 -4.18 107.32 112.76 3it9 s GLY 68 Ca 0.80 -0.20 0.39 0.00 0.00 0.00 0.00 44.72 45.71 3it9 s GLY 68 CO 0.34 0.31 2.22 1.70 0.00 0.00 0.00 173.10 177.67 3it9 h LYS 69 N -1.52 0.00 -0.92 2.90 3.64 -1.95 -2.84 116.57 115.88 3it9 h LYS 69 Ca -0.50 0.00 0.12 0.00 -1.27 0.00 0.00 60.65 59.00 3it9 h LYS 69 Cb 1.30 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 33.04 3it9 h LYS 69 CO 0.57 0.00 0.59 -0.44 -2.27 0.00 0.00 179.45 177.90 3it9 h ASP 70 N 0.00 0.77 -0.48 4.20 5.19 -1.90 -3.08 116.42 121.13 3it9 h ASP 70 Ca 0.01 0.04 -0.04 0.00 -0.62 0.00 0.00 57.03 56.41 3it9 h ASP 70 Cb 0.23 -0.12 -0.02 0.00 0.18 0.00 0.00 39.33 39.60 3it9 h ASP 70 CO -0.00 0.42 0.04 0.00 -3.12 0.00 0.00 179.24 176.57 3it9 n ALA 71 N -2.40 3.69 -2.57 3.45 0.00 -1.07 -4.77 120.51 116.84 3it9 n ALA 71 Ca 0.17 -2.18 -0.36 0.00 0.00 0.00 0.00 53.44 51.07 3it9 n ALA 71 Cb 0.39 -0.98 -0.06 0.00 0.00 0.00 0.00 19.45 18.80 3it9 n ALA 71 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 3it9 s TRP 72 N -2.85 3.64 0.38 0.00 -0.00 -1.16 -4.53 118.94 114.42 3it9 s TRP 72 Ca 0.50 0.84 0.05 0.00 -0.00 0.00 0.00 56.10 57.49 3it9 s TRP 72 Cb 0.39 -2.19 0.75 0.00 -0.00 0.00 0.00 33.47 32.43 3it9 s TRP 72 CO 0.12 0.59 2.03 0.00 -0.00 0.00 0.00 176.95 179.69 3it9 h ALA 73 N 4.20 1.63 0.00 5.86 0.00 -1.83 -3.05 119.26 126.06 3it9 h ALA 73 Ca -0.51 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.33 3it9 h ALA 73 Cb 1.21 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 3it9 h ALA 73 CO 0.64 0.34 -0.26 1.15 0.00 0.00 0.00 179.25 181.12 3it9 h THR 74 N 0.68 0.65 0.00 0.00 2.02 -1.94 -3.35 112.91 110.97 3it9 h THR 74 Ca 0.18 -1.56 0.00 0.00 0.77 0.00 0.00 66.41 65.81 3it9 h THR 74 Cb -0.06 1.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 3it9 h THR 74 CO -0.04 0.22 0.00 0.61 0.37 0.00 0.00 175.52 176.68 3it9 n GLY 75 N 1.66 -0.36 2.94 2.16 0.00 -1.24 -4.10 105.19 106.24 3it9 n GLY 75 Ca -0.08 -0.02 -0.08 0.00 0.00 0.00 0.00 46.02 45.84 3it9 n GLY 75 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3it9 s ASN 76 N -1.73 0.15 0.46 1.61 3.84 -1.15 -4.88 114.94 113.24 3it9 s ASN 76 Ca 0.04 -0.46 0.23 0.00 0.21 0.00 0.00 52.86 52.88 3it9 s ASN 76 Cb 0.02 1.20 1.10 0.00 -0.55 0.00 0.00 41.25 43.02 3it9 s ASN 76 CO 0.03 -0.33 1.93 1.55 -2.79 0.00 0.00 177.10 177.49 3it9 h PRO 77 N 7.98 0.00 -0.01 0.43 0.13 -1.76 -2.30 132.00 136.46 3it9 h PRO 77 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 3it9 h PRO 77 Cb 1.12 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.25 3it9 h PRO 77 CO 0.24 0.22 0.01 0.00 -0.23 0.00 0.00 178.00 178.24 3it9 h ALA 78 N 1.78 1.93 0.00 -0.56 0.00 -1.95 -2.08 119.26 118.38 3it9 h ALA 78 Ca -0.00 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 3it9 h ALA 78 Cb 0.55 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3it9 h ALA 78 CO 0.03 -0.02 -0.40 -0.07 0.00 0.00 0.00 179.25 178.79 3it9 h LEU 79 N 0.00 0.00 -9.52 0.00 3.38 -1.71 -3.43 115.31 104.03 3it9 h LEU 79 Ca 0.01 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.44 3it9 h LEU 79 Cb 0.03 0.00 0.04 0.00 0.09 0.00 0.00 40.66 40.82 3it9 h LEU 79 CO -0.00 0.40 1.07 -1.14 0.09 0.00 0.00 178.44 178.86 3it9 n ARG 80 N -3.35 2.72 0.00 1.13 0.63 -0.79 -0.76 116.66 116.25 3it9 n ARG 80 Ca 0.01 0.99 0.00 0.00 -0.92 0.00 0.00 57.85 57.93 3it9 n ARG 80 Cb 0.60 -2.86 0.00 0.00 0.45 0.00 0.00 32.46 30.64 3it9 n ARG 80 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3it9 n GLY 81 N 4.14 2.63 3.32 5.14 0.00 -1.26 -5.04 105.19 114.12 3it9 n GLY 81 Ca 0.18 -0.66 -0.40 0.00 0.00 0.00 0.00 46.02 45.14 3it9 n GLY 81 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3it9 n SER 82 N 1.50 -2.68 -4.67 1.61 7.64 0.06 -4.89 113.62 112.19 3it9 n SER 82 Ca 0.00 0.74 -0.46 0.00 1.01 0.00 0.00 58.87 60.16 3it9 n SER 82 Cb 0.00 -0.94 -0.04 0.00 -1.01 0.00 0.00 64.21 62.21 3it9 n SER 82 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 3it9 n SER 83 N 1.98 3.12 -4.01 6.43 2.88 -1.26 -4.98 113.62 117.78 3it9 n SER 83 Ca 0.10 1.07 -0.08 0.00 -1.33 0.00 0.00 58.87 58.63 3it9 n SER 83 Cb 0.44 -1.42 -0.09 0.00 -0.75 0.00 0.00 64.21 62.40 3it9 n SER 83 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 3it9 s VAL 84 N 1.27 0.18 -0.94 2.46 -7.23 -1.26 -1.46 120.40 113.41 3it9 s VAL 84 Ca 0.80 -1.58 0.28 0.00 -1.81 0.00 0.00 61.98 59.68 3it9 s VAL 84 Cb -0.68 -1.50 0.23 0.00 0.56 0.00 0.00 36.38 34.98 3it9 s VAL 84 CO 0.39 -0.82 1.85 0.23 -0.31 0.00 0.00 175.10 176.45 3it9 n MET 85 N 0.02 0.06 -2.74 4.82 2.81 -1.26 -4.92 117.12 115.91 3it9 n MET 85 Ca -0.14 0.04 -0.04 0.00 -1.81 0.00 0.00 57.70 55.76 3it9 n MET 85 Cb 0.62 -1.56 0.02 0.00 -0.71 0.00 0.00 33.22 31.58 3it9 n MET 85 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 3it9 n PHE 86 N -1.66 -2.17 -3.59 2.03 3.01 -1.26 -5.03 117.46 108.79 3it9 n PHE 86 Ca 0.07 0.81 -0.27 0.00 1.01 0.00 0.00 57.45 59.06 3it9 n PHE 86 Cb 0.36 -3.58 -0.03 0.00 -0.01 0.00 0.00 39.48 36.22 3it9 n PHE 86 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3it9 s LEU 87 N -3.94 4.17 -0.16 4.37 1.02 -1.26 -5.09 118.68 117.78 3it9 s LEU 87 Ca 0.11 0.48 0.01 0.00 0.02 0.00 0.00 54.13 54.75 3it9 s LEU 87 Cb -0.01 -3.27 0.02 0.00 0.02 0.00 0.00 46.19 42.95 3it9 s LEU 87 CO 0.57 -0.10 -0.20 -0.54 0.02 0.00 0.00 176.35 176.11 3it9 s LYS 88 N -3.45 2.88 0.00 1.70 1.02 -1.26 -4.62 119.74 116.01 3it9 s LYS 88 Ca 0.40 -0.79 0.00 0.00 0.02 0.00 0.00 55.97 55.60 3it9 s LYS 88 Cb -0.11 -2.46 0.00 0.00 -0.52 0.00 0.00 37.83 34.75 3it9 s LYS 88 CO 0.30 -0.16 0.25 -2.30 -0.92 0.00 0.00 175.35 172.52 3it9 n PRO 89 N 4.50 0.00 -0.04 -1.68 -0.02 -1.26 0.24 135.00 136.73 3it9 n PRO 89 Ca -0.20 0.03 -0.12 0.00 -2.02 0.00 0.00 63.50 61.19 3it9 n PRO 89 Cb 0.50 -1.57 -0.14 0.00 -0.02 0.00 0.00 33.50 32.27 3it9 n PRO 89 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3it9 n GLY 90 N -0.75 -0.85 3.77 -1.23 0.00 -1.26 -4.60 105.19 100.26 3it9 n GLY 90 Ca 0.00 -0.17 -0.40 0.00 0.00 0.00 0.00 46.02 45.45 3it9 n GLY 90 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3it9 s ASP 91 N -6.18 6.26 -0.47 1.61 1.11 0.65 -4.56 116.67 115.10 3it9 s ASP 91 Ca -0.12 2.79 -0.23 0.00 0.18 0.00 0.00 52.55 55.18 3it9 s ASP 91 Cb 0.07 -2.65 0.03 0.00 1.07 0.00 0.00 42.92 41.45 3it9 s ASP 91 CO 0.79 -0.90 0.78 -1.10 1.18 0.00 0.00 175.17 175.93 3it9 s GLN 92 N -2.21 3.36 -0.05 8.23 1.11 -1.26 -1.65 119.66 127.19 3it9 s GLN 92 Ca 0.56 -0.22 0.04 0.00 0.01 0.00 0.00 55.36 55.75 3it9 s GLN 92 Cb -0.41 -3.97 -0.02 0.00 -1.01 0.00 0.00 33.01 27.59 3it9 s GLN 92 CO 0.54 -1.18 -0.16 0.08 0.01 0.00 0.00 175.29 174.58 3it9 s VAL 93 N 3.30 2.87 0.91 1.09 1.01 -0.87 -4.90 120.40 123.81 3it9 s VAL 93 Ca 0.28 -0.79 -0.11 0.00 0.00 0.00 0.00 61.98 61.36 3it9 s VAL 93 Cb -0.13 -2.11 0.14 0.00 0.00 0.00 0.00 36.38 34.28 3it9 s VAL 93 CO 0.21 0.59 1.10 -0.94 0.00 0.00 0.00 175.10 176.06 3it9 s SER 94 N -0.67 3.17 0.06 3.32 1.04 -1.26 -0.93 113.70 118.41 3it9 s SER 94 Ca 0.10 1.79 -0.25 0.00 0.48 0.00 0.00 55.95 58.08 3it9 s SER 94 Cb -0.11 -2.40 -0.17 0.00 0.10 0.00 0.00 66.02 63.45 3it9 s SER 94 CO 0.00 -2.88 1.58 0.58 0.98 0.00 0.00 173.24 173.51 3it9 h VAL 95 N -1.71 1.03 -0.94 5.02 2.07 -0.55 -2.80 116.25 118.36 3it9 h VAL 95 Ca -0.48 -0.31 0.27 0.00 0.82 0.00 0.00 66.70 67.00 3it9 h VAL 95 Cb 1.27 1.23 -0.15 0.00 -1.52 0.00 0.00 31.29 32.13 3it9 h VAL 95 CO 0.49 0.08 0.36 0.00 0.02 0.00 0.00 177.57 178.52 3it9 h ALA 96 N 0.69 1.56 0.13 1.67 0.00 -1.64 0.23 119.26 121.90 3it9 h ALA 96 Ca -0.01 0.22 -0.19 0.00 0.00 0.00 0.00 54.91 54.93 3it9 h ALA 96 Cb 0.20 0.27 0.02 0.00 0.00 0.00 0.00 17.79 18.28 3it9 h ALA 96 CO 0.02 -0.52 -0.84 -0.44 0.00 0.00 0.00 179.25 177.46 3it9 h ASP 97 N 0.24 0.44 -0.55 0.00 3.32 -1.84 -2.24 116.42 115.79 3it9 h ASP 97 Ca 0.63 -0.94 0.03 0.00 0.02 0.00 0.00 57.03 56.77 3it9 h ASP 97 Cb 1.36 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 40.73 3it9 h ASP 97 CO -0.65 1.40 0.33 -0.07 -1.72 0.00 0.00 179.24 178.52 3it9 h LEU 98 N -0.40 0.52 -0.48 1.55 4.07 -1.18 0.19 115.31 119.58 3it9 h LEU 98 Ca -0.15 0.01 0.09 0.00 0.08 0.00 0.00 57.88 57.91 3it9 h LEU 98 Cb 1.63 -0.10 -0.08 0.00 1.08 0.00 0.00 40.66 43.18 3it9 h LEU 98 CO 0.14 0.37 -0.00 -1.13 -1.08 0.00 0.00 178.44 176.73 3it9 h ASN 99 N 0.64 -0.22 0.25 -0.43 -1.24 -0.56 -0.60 115.58 113.43 3it9 h ASN 99 Ca 0.22 0.12 -0.10 0.00 0.71 0.00 0.00 56.30 57.25 3it9 h ASN 99 Cb 0.04 0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.28 3it9 h ASN 99 CO -0.11 -0.07 -0.41 0.11 -1.29 0.00 0.00 177.43 175.67 3it9 h LYS 100 N 0.11 0.21 -0.22 6.67 1.57 -1.11 -2.09 116.57 121.70 3it9 h LYS 100 Ca 0.24 -0.10 0.03 0.00 -1.87 0.00 0.00 60.65 58.96 3it9 h LYS 100 Cb 0.36 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.64 3it9 h LYS 100 CO -0.41 0.59 0.01 0.78 -0.57 0.00 0.00 179.45 179.85 3it9 h GLY 101 N 1.22 0.21 1.03 3.86 0.00 0.50 0.24 103.07 110.13 3it9 h GLY 101 Ca 0.02 0.02 -0.10 0.00 0.00 0.00 0.00 47.33 47.27 3it9 h GLY 101 CO 0.06 -0.03 -0.08 -0.39 0.00 0.00 0.00 176.54 176.10 3it9 h VAL 102 N 0.08 1.27 0.00 4.60 -1.51 -1.03 0.28 116.25 119.94 3it9 h VAL 102 Ca 0.10 -1.20 -0.01 0.00 -1.23 0.00 0.00 66.70 64.37 3it9 h VAL 102 Cb 0.12 1.06 -0.00 0.00 -2.13 0.00 0.00 31.29 30.34 3it9 h VAL 102 CO -0.17 0.41 -0.07 0.40 -1.23 0.00 0.00 177.57 176.92 3it9 h ILE 103 N 0.75 1.07 0.02 7.19 2.04 -1.19 -2.09 117.51 125.31 3it9 h ILE 103 Ca 0.13 -1.83 -0.09 0.00 1.00 0.00 0.00 64.86 64.07 3it9 h ILE 103 Cb 0.62 2.05 -0.01 0.00 -0.74 0.00 0.00 36.82 38.74 3it9 h ILE 103 CO 0.04 0.36 -0.49 0.40 0.00 0.00 0.00 178.15 178.47 3it9 h ILE 104 N -1.00 1.50 0.00 -0.67 2.04 -0.70 -3.38 117.51 115.30 3it9 h ILE 104 Ca -0.02 -2.33 -0.16 0.00 1.00 0.00 0.00 64.86 63.36 3it9 h ILE 104 Cb 0.64 3.04 -0.03 0.00 -0.74 0.00 0.00 36.82 39.73 3it9 h ILE 104 CO -0.01 0.55 -0.99 -0.61 0.00 0.00 0.00 178.15 177.09 3it9 h GLN 105 N -0.90 0.00 -5.04 2.37 4.15 -1.39 -3.27 115.11 111.03 3it9 h GLN 105 Ca -0.12 0.00 -0.38 0.00 0.77 0.00 0.00 58.65 58.92 3it9 h GLN 105 Cb 1.19 0.00 0.10 0.00 0.21 0.00 0.00 27.48 28.98 3it9 h GLN 105 CO -0.04 0.54 -0.62 0.43 -1.93 0.00 0.00 178.83 177.22 3it9 n SER 106 N -3.13 -6.08 -4.66 -0.69 7.64 0.46 -4.88 113.62 102.28 3it9 n SER 106 Ca -0.04 -0.41 -0.42 0.00 1.01 0.00 0.00 58.87 59.01 3it9 n SER 106 Cb 0.84 -4.78 -0.03 0.00 -1.01 0.00 0.00 64.21 59.23 3it9 n SER 106 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3it9 s GLY 107 N -3.06 1.58 0.50 0.23 0.00 0.69 -4.75 107.32 102.51 3it9 s GLY 107 Ca 0.45 0.83 0.31 0.00 0.00 0.00 0.00 44.72 46.31 3it9 s GLY 107 CO 0.55 2.88 1.90 3.43 0.00 0.00 0.00 173.10 181.86 3it9 h ASN 108 N 9.10 0.00 0.48 1.64 2.35 -1.59 -2.78 115.58 124.79 3it9 h ASN 108 Ca -0.36 0.00 -0.30 0.00 -0.55 0.00 0.00 56.30 55.09 3it9 h ASN 108 Cb 1.16 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.49 3it9 h ASN 108 CO 0.95 0.00 -1.66 -2.24 -1.65 0.00 0.00 177.43 172.83 3it9 h ASP 109 N 0.00 0.12 -0.75 5.81 2.03 -1.87 -3.14 116.42 118.62 3it9 h ASP 109 Ca 0.00 -0.23 0.09 0.00 -0.73 0.00 0.00 57.03 56.17 3it9 h ASP 109 Cb 0.58 -0.04 -0.05 0.00 -0.83 0.00 0.00 39.33 39.00 3it9 h ASP 109 CO 0.00 1.20 0.49 0.00 -1.03 0.00 0.00 179.24 179.90 3it9 h ALA 110 N 0.78 1.81 0.16 4.15 0.00 -1.86 0.52 119.26 124.81 3it9 h ALA 110 Ca -0.27 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 3it9 h ALA 110 Cb 1.99 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.63 3it9 h ALA 110 CO 0.10 0.04 -0.08 0.00 0.00 0.00 0.00 179.25 179.31 3it9 h ILE 112 N -0.30 0.66 -0.68 0.00 2.04 -1.39 0.25 117.51 118.10 3it9 h ILE 112 Ca -0.02 -0.29 0.13 0.00 1.00 0.00 0.00 64.86 65.68 3it9 h ILE 112 Cb 0.24 0.82 -0.13 0.00 -0.74 0.00 0.00 36.82 37.00 3it9 h ILE 112 CO 0.04 0.06 -0.21 0.00 0.00 0.00 0.00 178.15 178.04 3it9 h ALA 113 N -0.05 0.35 -0.45 1.87 0.00 -0.98 0.20 119.26 120.20 3it9 h ALA 113 Ca -0.05 0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.97 3it9 h ALA 113 Cb 0.46 0.59 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 3it9 h ALA 113 CO 0.08 -0.47 -0.28 1.25 0.00 0.00 0.00 179.25 179.82 3it9 h LEU 114 N -0.04 1.02 0.38 0.00 5.85 -1.11 -1.74 115.31 119.67 3it9 h LEU 114 Ca 0.31 -0.42 -0.02 0.00 0.84 0.00 0.00 57.88 58.60 3it9 h LEU 114 Cb 0.52 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.27 3it9 h LEU 114 CO -0.71 1.22 -0.18 0.00 -0.34 0.00 0.00 178.44 178.43 3it9 h ALA 115 N 0.84 -0.51 -0.80 1.25 0.00 0.49 -0.88 119.26 119.63 3it9 h ALA 115 Ca 0.09 -0.12 0.19 0.00 0.00 0.00 0.00 54.91 55.07 3it9 h ALA 115 Cb 0.87 0.20 -0.14 0.00 0.00 0.00 0.00 17.79 18.72 3it9 h ALA 115 CO 0.08 -0.78 -0.00 -0.44 0.00 0.00 0.00 179.25 178.11 3it9 h ASP 116 N -0.53 -0.39 -0.23 0.00 3.32 -0.53 -2.10 116.42 115.96 3it9 h ASP 116 Ca -0.05 0.21 -0.13 0.00 0.02 0.00 0.00 57.03 57.08 3it9 h ASP 116 Cb 0.40 0.38 -0.00 0.00 0.22 0.00 0.00 39.33 40.33 3it9 h ASP 116 CO 0.09 -0.21 -0.35 0.22 -1.72 0.00 0.00 179.24 177.27 3it9 h TYR 117 N 0.09 0.80 -0.11 4.55 3.20 -0.71 0.32 116.97 125.11 3it9 h TYR 117 Ca 0.44 -0.27 -0.20 0.00 3.14 0.00 0.00 58.73 61.85 3it9 h TYR 117 Cb 0.80 -0.16 0.01 0.00 1.54 0.00 0.00 36.73 38.93 3it9 h TYR 117 CO -0.45 1.02 -0.71 -0.39 -1.64 0.00 0.00 178.16 175.98 3it9 h VAL 118 N 0.35 1.31 0.00 1.81 -1.51 -0.88 -3.39 116.25 113.94 3it9 h VAL 118 Ca 0.02 -1.96 0.00 0.00 -1.23 0.00 0.00 66.70 63.53 3it9 h VAL 118 Cb 0.93 2.13 0.00 0.00 -2.13 0.00 0.00 31.29 32.23 3it9 h VAL 118 CO 0.08 0.61 -0.02 0.00 -1.23 0.00 0.00 177.57 177.01 3it9 n ALA 119 N -2.59 1.58 0.00 5.19 0.00 -0.81 -5.05 120.51 118.83 3it9 n ALA 119 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 3it9 n ALA 119 Cb 0.71 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.16 3it9 n ALA 119 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3it9 n GLY 120 N 0.83 2.90 3.31 0.00 0.00 0.11 -4.70 105.19 107.65 3it9 n GLY 120 Ca 0.00 -0.79 -0.14 0.00 0.00 0.00 0.00 46.02 45.09 3it9 n GLY 120 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3it9 s SER 121 N 0.06 0.59 0.05 1.61 1.04 -1.26 -4.76 113.70 111.04 3it9 s SER 121 Ca 0.00 -1.43 -0.22 0.00 0.48 0.00 0.00 55.95 54.78 3it9 s SER 121 Cb 0.00 0.49 -0.14 0.00 0.10 0.00 0.00 66.02 66.47 3it9 s SER 121 CO 0.00 -1.00 1.49 1.56 0.98 0.00 0.00 173.24 176.27 3it9 h GLN 122 N 2.38 0.20 -0.46 4.02 4.20 -1.92 -2.70 115.11 120.84 3it9 h GLN 122 Ca -0.31 -0.06 0.08 0.00 0.06 0.00 0.00 58.65 58.43 3it9 h GLN 122 Cb 1.24 -0.02 -0.07 0.00 0.30 0.00 0.00 27.48 28.93 3it9 h GLN 122 CO 0.45 0.43 0.04 0.93 -0.67 0.00 0.00 178.83 180.00 3it9 h GLU 123 N -0.06 0.15 -0.04 1.46 3.07 -1.97 -0.44 114.58 116.75 3it9 h GLU 123 Ca 0.03 -0.01 -0.16 0.00 -0.50 0.00 0.00 59.36 58.72 3it9 h GLU 123 Cb 0.34 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.20 3it9 h GLU 123 CO 0.00 0.10 -0.69 0.66 -1.40 0.00 0.00 179.01 177.68 3it9 h SER 124 N 0.15 0.24 -0.98 1.42 4.64 -1.89 -2.30 113.55 114.84 3it9 h SER 124 Ca 0.23 -0.16 0.01 0.00 -0.47 0.00 0.00 61.79 61.40 3it9 h SER 124 Cb 0.33 -0.07 -0.05 0.00 -0.31 0.00 0.00 62.40 62.30 3it9 h SER 124 CO -0.35 0.86 0.64 0.15 -0.87 0.00 0.00 176.83 177.26 3it9 h PHE 125 N 0.14 1.23 -0.66 4.77 3.57 -1.02 -1.73 116.94 123.24 3it9 h PHE 125 Ca -0.02 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.43 3it9 h PHE 125 Cb 1.24 -0.42 -0.03 0.00 2.79 0.00 0.00 35.95 39.53 3it9 h PHE 125 CO 0.02 0.78 0.10 0.82 -2.23 0.00 0.00 178.31 177.80 3it9 h ILE 126 N 1.33 1.26 -0.77 1.41 2.04 -0.69 -1.21 117.51 120.87 3it9 h ILE 126 Ca 0.36 -1.04 0.02 0.00 1.00 0.00 0.00 64.86 65.20 3it9 h ILE 126 Cb -0.15 0.64 -0.04 0.00 -0.74 0.00 0.00 36.82 36.53 3it9 h ILE 126 CO -0.08 0.39 0.51 1.23 0.00 0.00 0.00 178.15 180.21 3it9 h GLY 127 N 1.05 1.09 0.76 5.37 0.00 -1.11 0.45 103.07 110.67 3it9 h GLY 127 Ca 0.20 -0.39 0.04 0.00 0.00 0.00 0.00 47.33 47.18 3it9 h GLY 127 CO 0.01 0.36 0.25 -2.00 0.00 0.00 0.00 176.54 175.16 3it9 h LEU 128 N 0.99 0.37 -0.21 3.11 5.85 -0.37 0.35 115.31 125.39 3it9 h LEU 128 Ca 0.30 0.02 -0.20 0.00 0.84 0.00 0.00 57.88 58.84 3it9 h LEU 128 Cb -0.02 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 3it9 h LEU 128 CO -0.08 0.26 -0.92 0.00 -0.34 0.00 0.00 178.44 177.36 3it9 h MET 129 N 0.49 0.09 0.00 1.25 -0.00 -0.42 -2.12 114.93 114.21 3it9 h MET 129 Ca 0.21 -0.11 -0.10 0.00 -0.00 0.00 0.00 59.70 59.70 3it9 h MET 129 Cb 0.11 0.04 -0.01 0.00 -0.00 0.00 0.00 31.60 31.73 3it9 h MET 129 CO -0.14 0.94 -0.49 -0.91 -0.00 0.00 0.00 176.91 176.31 3it9 h ASN 130 N 0.04 0.00 -0.34 -0.10 2.35 -0.92 -2.17 115.58 114.44 3it9 h ASN 130 Ca -0.03 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.68 3it9 h ASN 130 Cb 1.58 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.94 3it9 h ASN 130 CO 0.13 0.49 0.04 1.23 -1.65 0.00 0.00 177.43 177.67 3it9 h GLY 131 N 2.01 0.62 1.78 2.83 0.00 -0.64 -2.45 103.07 107.21 3it9 h GLY 131 Ca -0.00 -0.42 -0.11 0.00 0.00 0.00 0.00 47.33 46.79 3it9 h GLY 131 CO 0.06 0.39 -0.44 -0.97 0.00 0.00 0.00 176.54 175.58 3it9 h TYR 132 N 0.40 0.29 -0.59 5.60 0.05 -1.37 -2.27 116.97 119.09 3it9 h TYR 132 Ca 0.10 -0.08 0.03 0.00 0.05 0.00 0.00 58.73 58.83 3it9 h TYR 132 Cb 0.37 -0.06 -0.04 0.00 1.01 0.00 0.00 36.73 38.01 3it9 h TYR 132 CO 0.03 0.65 0.35 0.00 -1.05 0.00 0.00 178.16 178.13 3it9 h ALA 133 N 1.34 0.76 0.05 3.88 0.00 -1.28 0.46 119.26 124.47 3it9 h ALA 133 Ca 0.02 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3it9 h ALA 133 Cb 0.86 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3it9 h ALA 133 CO 0.07 0.07 -0.02 0.87 0.00 0.00 0.00 179.25 180.23 3it9 h LYS 134 N 0.68 -0.06 -0.82 0.00 6.56 -1.32 0.13 116.57 121.73 3it9 h LYS 134 Ca 0.24 0.00 0.07 0.00 -1.06 0.00 0.00 60.65 59.91 3it9 h LYS 134 Cb 0.05 0.01 -0.05 0.00 -0.57 0.00 0.00 32.23 31.67 3it9 h LYS 134 CO -0.11 0.08 0.53 -0.22 -2.06 0.00 0.00 179.45 177.67 3it9 h LYS 135 N -0.20 0.83 0.00 3.15 3.64 -1.06 -2.65 116.57 120.29 3it9 h LYS 135 Ca -0.01 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3it9 h LYS 135 Cb 0.18 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 3it9 h LYS 135 CO 0.01 0.55 -0.43 1.28 -2.27 0.00 0.00 179.45 178.60 3it9 n LEU 136 N -4.49 0.50 0.00 5.20 4.77 0.16 -4.92 117.00 118.22 3it9 n LEU 136 Ca 0.13 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.31 3it9 n LEU 136 Cb 0.24 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 3it9 n LEU 136 CO 0.33 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 3it9 n GLY 137 N 1.43 1.23 3.20 -0.72 0.00 -0.76 -4.95 105.19 104.63 3it9 n GLY 137 Ca 0.05 -0.27 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 3it9 n GLY 137 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3it9 n LEU 138 N 0.00 5.84 0.07 0.99 4.77 0.37 -4.80 117.00 124.23 3it9 n LEU 138 Ca 0.00 -4.38 0.12 0.00 -0.03 0.00 0.00 56.01 51.72 3it9 n LEU 138 Cb 0.08 -1.60 0.46 0.00 -2.33 0.00 0.00 43.42 40.03 3it9 n LEU 138 CO 0.00 0.88 0.87 0.35 -1.33 0.00 0.00 177.39 178.16 3it9 n THR 139 N 4.59 0.58 -1.15 -5.08 -2.24 -1.26 -2.76 114.28 106.96 3it9 n THR 139 Ca 0.42 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 62.29 3it9 n THR 139 Cb 0.41 -0.78 0.18 0.00 -2.10 0.00 0.00 70.33 68.03 3it9 n THR 139 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3it9 n ASN 140 N -1.95 2.58 -4.11 3.42 3.02 -1.26 -5.00 115.26 111.97 3it9 n ASN 140 Ca 0.05 -3.23 -0.24 0.00 -0.03 0.00 0.00 54.58 51.13 3it9 n ASN 140 Cb 0.31 -0.48 -0.16 0.00 -0.61 0.00 0.00 39.78 38.85 3it9 n ASN 140 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3it9 s THR 141 N -2.94 1.24 -0.01 3.41 -4.23 -1.11 -4.15 115.64 107.84 3it9 s THR 141 Ca 0.36 -0.63 0.00 0.00 -1.18 0.00 0.00 61.69 60.24 3it9 s THR 141 Cb 0.31 -1.06 0.02 0.00 1.34 0.00 0.00 72.50 73.11 3it9 s THR 141 CO 0.03 0.36 0.01 0.42 -0.54 0.00 0.00 174.62 174.89 3it9 s THR 142 N -0.05 0.05 -0.13 3.99 -4.23 -0.66 -4.97 115.64 109.64 3it9 s THR 142 Ca -0.01 0.09 -0.11 0.00 -1.18 0.00 0.00 61.69 60.48 3it9 s THR 142 Cb -0.09 -0.12 -0.05 0.00 1.34 0.00 0.00 72.50 73.58 3it9 s THR 142 CO 0.01 0.08 0.23 -0.36 -0.54 0.00 0.00 174.62 174.04 3it9 s PHE 143 N 0.64 3.54 -0.27 3.99 0.08 -1.26 -1.97 117.98 122.74 3it9 s PHE 143 Ca -0.06 0.59 0.05 0.00 0.12 0.00 0.00 56.93 57.64 3it9 s PHE 143 Cb -0.08 -2.16 -0.05 0.00 -0.57 0.00 0.00 43.02 40.15 3it9 s PHE 143 CO -0.02 0.49 0.24 1.04 -0.10 0.00 0.00 175.22 176.87 3it9 n GLN 144 N 2.72 5.05 -4.37 0.44 1.13 -1.26 -4.88 117.38 116.21 3it9 n GLN 144 Ca -0.16 -0.03 -0.20 0.00 -1.94 0.00 0.00 57.00 54.67 3it9 n GLN 144 Cb 0.53 -0.76 -0.09 0.00 0.11 0.00 0.00 30.24 30.03 3it9 n GLN 144 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 3it9 s THR 145 N -1.46 0.37 -2.01 5.09 -4.23 -1.26 -5.04 115.64 107.09 3it9 s THR 145 Ca 0.02 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 58.76 3it9 s THR 145 Cb 0.04 -2.49 0.04 0.00 1.34 0.00 0.00 72.50 71.44 3it9 s THR 145 CO 0.21 0.00 1.17 0.52 -0.54 0.00 0.00 174.62 175.99 3it9 n VAL 146 N -0.65 0.00 0.00 2.29 0.31 -1.26 -4.58 118.33 114.44 3it9 n VAL 146 Ca 0.00 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 3it9 n VAL 146 Cb 0.65 1.11 0.00 0.00 -0.91 0.00 0.00 33.84 34.69 3it9 n VAL 146 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3it9 n HIS 147 N -0.10 0.00 -0.59 3.52 -0.00 -1.26 -4.77 115.22 112.02 3it9 n HIS 147 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.82 3it9 n HIS 147 Cb 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.44 3it9 n HIS 147 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3it9 n GLY 148 N 0.08 0.69 3.77 -1.39 0.00 -1.26 -4.46 105.19 102.62 3it9 n GLY 148 Ca 0.00 -0.13 -0.37 0.00 0.00 0.00 0.00 46.02 45.52 3it9 n GLY 148 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3it9 s LEU 149 N 0.00 3.91 0.73 0.99 1.43 -1.26 -4.00 118.68 120.48 3it9 s LEU 149 Ca 0.00 2.33 -0.16 0.00 -1.03 0.00 0.00 54.13 55.27 3it9 s LEU 149 Cb 0.00 -4.35 0.03 0.00 0.03 0.00 0.00 46.19 41.90 3it9 s LEU 149 CO 0.00 -1.11 1.16 -0.67 0.23 0.00 0.00 176.35 175.97 3it9 n ASP 150 N -0.82 1.21 -3.64 2.29 2.03 -1.26 -4.88 116.55 111.48 3it9 n ASP 150 Ca 0.09 0.69 -0.04 0.00 0.52 0.00 0.00 54.79 56.05 3it9 n ASP 150 Cb 0.48 -1.49 -0.06 0.00 -0.72 0.00 0.00 41.12 39.33 3it9 n ASP 150 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3it9 s ALA 151 N -1.79 -2.16 0.35 -1.67 0.00 -1.26 -5.09 121.76 110.13 3it9 s ALA 151 Ca 0.76 1.75 -0.29 0.00 0.00 0.00 0.00 51.96 54.18 3it9 s ALA 151 Cb -0.34 -1.63 -0.11 0.00 0.00 0.00 0.00 23.12 21.04 3it9 s ALA 151 CO 0.47 -0.16 1.50 -1.25 0.00 0.00 0.00 175.76 176.32 3it9 s PRO 152 N -0.27 4.13 -0.71 0.00 0.04 -1.26 -3.13 135.00 133.81 3it9 s PRO 152 Ca 0.07 2.54 0.00 0.00 0.04 0.00 0.00 61.00 63.65 3it9 s PRO 152 Cb -0.04 -2.99 0.00 0.00 0.04 0.00 0.00 34.50 31.51 3it9 s PRO 152 CO -0.12 -0.53 0.00 0.41 0.04 0.00 0.00 177.00 176.80 3it9 n GLY 153 N 0.98 0.67 3.27 0.56 0.00 -1.26 -4.94 105.19 104.46 3it9 n GLY 153 Ca 0.03 -0.69 -0.35 0.00 0.00 0.00 0.00 46.02 45.01 3it9 n GLY 153 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3it9 s GLN 154 N -3.13 3.26 0.17 1.61 0.74 -1.18 -4.71 119.66 116.42 3it9 s GLN 154 Ca 0.00 -0.70 -0.20 0.00 0.05 0.00 0.00 55.36 54.52 3it9 s GLN 154 Cb 0.00 -2.96 0.04 0.00 1.10 0.00 0.00 33.01 31.20 3it9 s GLN 154 CO 0.00 -0.23 0.54 -0.59 -0.55 0.00 0.00 175.29 174.46 3it9 s PHE 155 N 1.44 -0.30 0.05 1.67 -0.12 -0.83 -4.67 117.98 115.21 3it9 s PHE 155 Ca 0.05 0.01 -0.01 0.00 -0.05 0.00 0.00 56.93 56.93 3it9 s PHE 155 Cb -0.14 0.45 0.00 0.00 -0.63 0.00 0.00 43.02 42.70 3it9 s PHE 155 CO -0.05 -0.87 0.08 0.45 -0.05 0.00 0.00 175.22 174.79 3it9 n SER 156 N -0.34 -0.22 -4.26 1.98 2.88 -0.36 -1.65 113.62 111.64 3it9 n SER 156 Ca -0.14 -1.25 -0.14 0.00 -1.33 0.00 0.00 58.87 56.01 3it9 n SER 156 Cb 0.63 0.40 -0.10 0.00 -0.75 0.00 0.00 64.21 64.39 3it9 n SER 156 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3it9 s THR 157 N -2.60 0.57 0.19 2.46 -4.23 -1.26 -0.78 115.64 109.99 3it9 s THR 157 Ca 0.03 -1.98 -0.11 0.00 -1.18 0.00 0.00 61.69 58.45 3it9 s THR 157 Cb -0.00 -2.33 0.11 0.00 1.34 0.00 0.00 72.50 71.62 3it9 s THR 157 CO 0.03 -0.27 1.77 0.00 -0.54 0.00 0.00 174.62 175.60 3it9 h ALA 158 N 2.58 0.72 -0.59 3.99 0.00 -1.78 -2.20 119.26 121.98 3it9 h ALA 158 Ca -0.37 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 3it9 h ALA 158 Cb 1.22 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 3it9 h ALA 158 CO 0.61 -0.13 0.04 -0.09 0.00 0.00 0.00 179.25 179.68 3it9 h ARG 159 N 0.47 1.03 -0.18 0.00 2.43 -1.58 -2.02 114.38 114.52 3it9 h ARG 159 Ca 0.26 -0.31 -0.12 0.00 -0.81 0.00 0.00 59.98 59.00 3it9 h ARG 159 Cb 0.24 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 3it9 h ARG 159 CO -0.22 0.99 -0.42 -0.44 -1.51 0.00 0.00 179.97 178.37 3it9 h ASP 160 N 0.92 0.45 0.70 -3.80 3.32 -1.75 -1.79 116.42 114.46 3it9 h ASP 160 Ca 0.17 -0.20 -0.15 0.00 0.02 0.00 0.00 57.03 56.88 3it9 h ASP 160 Cb 0.51 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 3it9 h ASP 160 CO 0.02 0.82 -0.69 0.24 -1.72 0.00 0.00 179.24 177.91 3it9 h MET 161 N 0.35 0.00 -0.46 3.56 2.86 -1.13 0.31 114.93 120.43 3it9 h MET 161 Ca 0.03 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.63 3it9 h MET 161 Cb 0.89 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.53 3it9 h MET 161 CO 0.07 0.69 0.14 0.00 1.06 0.00 0.00 176.91 178.88 3it9 h ALA 162 N 1.31 0.60 -0.39 6.32 0.00 -1.16 0.17 119.26 126.12 3it9 h ALA 162 Ca -0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 3it9 h ALA 162 Cb 1.23 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 3it9 h ALA 162 CO 0.09 0.26 0.18 -0.07 0.00 0.00 0.00 179.25 179.71 3it9 h LEU 163 N 0.61 0.51 -0.37 0.00 4.07 -0.76 0.11 115.31 119.48 3it9 h LEU 163 Ca 0.15 -0.13 -0.02 0.00 0.08 0.00 0.00 57.88 57.96 3it9 h LEU 163 Cb 0.27 -0.13 -0.02 0.00 1.08 0.00 0.00 40.66 41.87 3it9 h LEU 163 CO -0.00 0.50 0.16 0.25 -1.08 0.00 0.00 178.44 178.27 3it9 h LEU 164 N 0.49 0.50 -0.53 1.67 5.85 -0.34 -0.50 115.31 122.44 3it9 h LEU 164 Ca 0.13 -0.15 0.07 0.00 0.84 0.00 0.00 57.88 58.77 3it9 h LEU 164 Cb 0.13 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 40.98 3it9 h LEU 164 CO -0.02 0.52 0.22 1.23 -0.34 0.00 0.00 178.44 180.05 3it9 h GLY 165 N 0.45 0.73 1.02 3.75 0.00 -0.50 -0.41 103.07 108.11 3it9 h GLY 165 Ca 0.12 -0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.30 3it9 h GLY 165 CO -0.01 0.04 0.44 1.70 0.00 0.00 0.00 176.54 178.71 3it9 h LYS 166 N 0.42 1.14 -0.27 4.80 3.64 -0.35 -2.06 116.57 123.89 3it9 h LYS 166 Ca 0.25 -0.14 -0.13 0.00 -1.27 0.00 0.00 60.65 59.37 3it9 h LYS 166 Cb 0.24 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 3it9 h LYS 166 CO -0.23 0.85 -0.36 0.00 -2.27 0.00 0.00 179.45 177.44 3it9 h ALA 167 N 1.23 0.88 0.47 5.00 0.00 -0.42 -1.27 119.26 125.14 3it9 h ALA 167 Ca 0.29 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 3it9 h ALA 167 Cb 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3it9 h ALA 167 CO -0.05 0.63 -0.22 1.25 0.00 0.00 0.00 179.25 180.86 3it9 h LEU 168 N 0.50 -0.53 -0.77 0.00 7.12 -0.72 0.63 115.31 121.55 3it9 h LEU 168 Ca 0.05 0.02 0.10 0.00 0.13 0.00 0.00 57.88 58.18 3it9 h LEU 168 Cb 0.85 0.14 -0.07 0.00 -0.53 0.00 0.00 40.66 41.04 3it9 h LEU 168 CO 0.07 -0.38 0.41 0.40 -0.13 0.00 0.00 178.44 178.81 3it9 h ILE 169 N -0.62 0.86 0.02 4.05 2.04 -1.28 -2.63 117.51 119.95 3it9 h ILE 169 Ca -0.06 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.56 3it9 h ILE 169 Cb 0.48 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 3it9 h ILE 169 CO 0.10 0.12 -0.01 -0.74 0.00 0.00 0.00 178.15 177.63 3it9 h HIS 170 N 0.68 -0.02 0.15 1.37 2.76 -0.95 -3.31 115.15 115.82 3it9 h HIS 170 Ca 0.38 -0.00 -0.32 0.00 -2.20 0.00 0.00 60.37 58.23 3it9 h HIS 170 Cb 0.39 0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.36 3it9 h HIS 170 CO -0.09 0.72 -1.56 -0.44 -1.30 0.00 0.00 177.93 175.26 3it9 h ASP 171 N -0.93 0.48 -2.12 3.26 3.32 0.25 -3.38 116.42 117.30 3it9 h ASP 171 Ca -0.00 -0.65 -0.58 0.00 0.02 0.00 0.00 57.03 55.82 3it9 h ASP 171 Cb 0.75 -0.16 -0.41 0.00 0.22 0.00 0.00 39.33 39.74 3it9 h ASP 171 CO 0.00 1.54 -0.82 1.33 -1.72 0.00 0.00 179.24 179.58 3it9 n VAL 172 N -3.51 1.22 0.25 -1.35 0.24 -0.99 -4.95 118.33 109.24 3it9 n VAL 172 Ca -0.18 -4.81 0.12 0.00 -2.04 0.00 0.00 64.34 57.44 3it9 n VAL 172 Cb 1.06 -1.84 0.77 0.00 -1.47 0.00 0.00 33.84 32.35 3it9 n VAL 172 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 3it9 h PRO 173 N 3.90 0.00 -0.30 7.34 0.13 -1.66 0.22 132.00 141.64 3it9 h PRO 173 Ca 0.14 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.23 3it9 h PRO 173 Cb 0.74 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.86 3it9 h PRO 173 CO 0.68 0.00 0.01 1.49 -0.23 0.00 0.00 178.00 179.96 3it9 h GLU 174 N 0.00 0.51 -0.46 0.86 4.57 -1.90 -0.26 114.58 117.91 3it9 h GLU 174 Ca 0.02 -0.16 -0.14 0.00 -1.18 0.00 0.00 59.36 57.91 3it9 h GLU 174 Cb 0.10 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.63 3it9 h GLU 174 CO -0.00 0.65 -0.26 1.49 -1.18 0.00 0.00 179.01 179.71 3it9 h GLU 175 N 0.31 0.98 -0.28 1.92 4.57 -1.48 -2.95 114.58 117.66 3it9 h GLU 175 Ca 0.09 -0.45 -0.05 0.00 -1.18 0.00 0.00 59.36 57.77 3it9 h GLU 175 Cb 0.41 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.97 3it9 h GLU 175 CO 0.01 1.12 -0.04 -0.92 -1.18 0.00 0.00 179.01 178.00 3it9 h TYR 176 N 0.83 0.45 0.00 0.92 3.20 -0.86 -2.97 116.97 118.54 3it9 h TYR 176 Ca 0.10 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 3it9 h TYR 176 Cb 0.84 -0.13 -0.00 0.00 1.54 0.00 0.00 36.73 38.98 3it9 h TYR 176 CO 0.06 0.48 -0.07 0.00 -1.64 0.00 0.00 178.16 176.99 3it9 h ALA 177 N 1.55 1.87 0.00 1.82 0.00 -0.86 -0.78 119.26 122.86 3it9 h ALA 177 Ca 0.09 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 3it9 h ALA 177 Cb 0.34 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3it9 h ALA 177 CO 0.01 0.09 -0.22 0.82 0.00 0.00 0.00 179.25 179.95 3it9 h ILE 178 N 0.00 0.84 0.00 0.00 2.04 -1.57 -3.04 117.51 115.78 3it9 h ILE 178 Ca -0.00 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 64.98 3it9 h ILE 178 Cb 0.12 1.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.72 3it9 h ILE 178 CO 0.01 0.22 0.00 1.41 0.00 0.00 0.00 178.15 179.79 3it9 n HIS 179 N -3.81 0.00 0.24 1.37 8.25 -0.30 -1.32 115.22 119.65 3it9 n HIS 179 Ca -0.02 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.56 3it9 n HIS 179 Cb 0.32 -0.44 0.09 0.00 1.12 0.00 0.00 29.99 31.08 3it9 n HIS 179 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 3it9 h LYS 180 N 0.00 0.00 -6.46 -0.41 3.64 -1.59 -3.41 116.57 108.34 3it9 h LYS 180 Ca 0.00 0.00 -0.54 0.00 -1.27 0.00 0.00 60.65 58.84 3it9 h LYS 180 Cb 0.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 3it9 h LYS 180 CO 0.00 0.00 0.60 -1.21 -2.27 0.00 0.00 179.45 176.57 3it9 s GLU 181 N -3.28 4.41 0.17 1.90 2.02 -0.44 -4.88 118.70 118.60 3it9 s GLU 181 Ca 0.03 1.78 0.26 0.00 0.02 0.00 0.00 54.97 57.06 3it9 s GLU 181 Cb 0.09 -3.38 0.91 0.00 0.10 0.00 0.00 34.13 31.86 3it9 s GLU 181 CO 0.74 -0.30 1.79 1.63 0.02 0.00 0.00 175.26 179.14 3it9 n LYS 182 N 4.14 0.20 -3.59 1.61 5.02 -1.26 -4.48 118.16 119.80 3it9 n LYS 182 Ca 0.09 0.20 -0.07 0.00 -2.02 0.00 0.00 58.31 56.51 3it9 n LYS 182 Cb 0.46 -1.74 -0.04 0.00 -0.02 0.00 0.00 35.03 33.68 3it9 n LYS 182 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3it9 s GLU 183 N -3.10 0.42 0.05 1.97 2.12 -1.26 -1.04 118.70 117.86 3it9 s GLU 183 Ca 0.11 0.05 -0.03 0.00 0.36 0.00 0.00 54.97 55.45 3it9 s GLU 183 Cb 0.13 0.20 -0.03 0.00 0.26 0.00 0.00 34.13 34.69 3it9 s GLU 183 CO 0.55 -0.14 0.03 -0.59 -0.54 0.00 0.00 175.26 174.57 3it9 s PHE 184 N -1.36 0.36 -0.19 5.30 -0.71 -0.57 -4.95 117.98 115.85 3it9 s PHE 184 Ca 0.03 -0.80 -0.06 0.00 -1.04 0.00 0.00 56.93 55.07 3it9 s PHE 184 Cb -0.01 -0.26 -0.03 0.00 -1.21 0.00 0.00 43.02 41.51 3it9 s PHE 184 CO -0.03 -0.37 0.01 -0.08 -1.34 0.00 0.00 175.22 173.42 3it9 s THR 185 N -3.26 4.16 -0.03 -4.49 -1.32 -1.26 -0.39 115.64 109.05 3it9 s THR 185 Ca 0.01 -0.25 0.01 0.00 -1.21 0.00 0.00 61.69 60.25 3it9 s THR 185 Cb 0.03 -2.88 0.02 0.00 -1.51 0.00 0.00 72.50 68.16 3it9 s THR 185 CO -0.08 0.44 -0.02 0.12 -2.21 0.00 0.00 174.62 172.87 3it9 s PHE 186 N 0.81 0.49 -1.23 9.09 5.36 0.21 -4.81 117.98 127.90 3it9 s PHE 186 Ca 0.01 -0.09 -0.10 0.00 -0.96 0.00 0.00 56.93 55.79 3it9 s PHE 186 Cb -0.14 -0.49 -0.01 0.00 -0.34 0.00 0.00 43.02 42.04 3it9 s PHE 186 CO 0.02 -0.14 0.70 -1.71 -1.46 0.00 0.00 175.22 172.63 3it9 n ASN 187 N 3.98 -3.36 0.00 6.13 4.05 -1.26 -2.22 115.26 122.58 3it9 n ASN 187 Ca -0.25 -0.95 0.00 0.00 0.45 0.00 0.00 54.58 53.83 3it9 n ASN 187 Cb 0.51 -3.61 0.00 0.00 1.23 0.00 0.00 39.78 37.92 3it9 n ASN 187 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 3it9 n LYS 188 N -4.18 0.00 -3.06 1.20 4.01 -1.26 -4.90 118.16 109.97 3it9 n LYS 188 Ca -0.19 0.00 -0.39 0.00 -0.51 0.00 0.00 58.31 57.22 3it9 n LYS 188 Cb 0.63 -3.57 -0.06 0.00 -0.51 0.00 0.00 35.03 31.52 3it9 n LYS 188 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 3it9 s ILE 189 N -0.28 4.56 -0.11 -0.18 1.01 -0.94 -5.07 121.20 120.19 3it9 s ILE 189 Ca 0.00 1.55 -0.05 0.00 0.00 0.00 0.00 60.65 62.15 3it9 s ILE 189 Cb 0.00 -4.07 -0.04 0.00 0.01 0.00 0.00 42.46 38.37 3it9 s ILE 189 CO 0.00 0.49 0.08 0.00 0.00 0.00 0.00 174.94 175.51 3it9 s ARG 190 N -0.84 3.26 -0.18 2.79 1.70 -1.26 0.65 118.95 125.07 3it9 s ARG 190 Ca 0.34 -0.26 0.01 0.00 -0.47 0.00 0.00 55.73 55.35 3it9 s ARG 190 Cb -0.21 -3.02 0.04 0.00 -0.57 0.00 0.00 34.95 31.18 3it9 s ARG 190 CO 0.23 0.73 -0.11 -0.65 -1.08 0.00 0.00 175.30 174.42 3it9 s GLN 191 N -0.91 2.04 0.27 3.89 -1.52 0.48 -4.98 119.66 118.94 3it9 s GLN 191 Ca 0.14 -0.71 -0.29 0.00 -1.95 0.00 0.00 55.36 52.55 3it9 s GLN 191 Cb -0.12 -2.26 -0.09 0.00 -0.22 0.00 0.00 33.01 30.32 3it9 s GLN 191 CO 0.03 -0.36 1.14 -1.25 -0.25 0.00 0.00 175.29 174.59 3it9 s PRO 192 N 1.46 4.59 0.04 2.91 0.04 -1.26 -1.51 135.00 141.26 3it9 s PRO 192 Ca 0.01 1.86 -0.34 0.00 0.04 0.00 0.00 61.00 62.57 3it9 s PRO 192 Cb -0.15 -3.18 -0.13 0.00 0.04 0.00 0.00 34.50 31.08 3it9 s PRO 192 CO -0.09 0.13 1.69 -1.71 0.04 0.00 0.00 177.00 177.06 3it9 n ASN 193 N 1.30 3.11 0.18 6.66 2.85 -0.20 -4.69 115.26 124.47 3it9 n ASN 193 Ca -0.00 1.04 0.14 0.00 -0.11 0.00 0.00 54.58 55.64 3it9 n ASN 193 Cb 0.44 -1.38 0.59 0.00 1.24 0.00 0.00 39.78 40.67 3it9 n ASN 193 CO 0.00 0.00 0.00 0.03 -2.11 0.00 0.00 177.26 175.18 3it9 h ARG 194 N 7.18 0.00 -6.19 1.20 2.47 -1.90 -3.41 114.38 113.73 3it9 h ARG 194 Ca -0.47 0.00 -0.53 0.00 -1.26 0.00 0.00 59.98 57.72 3it9 h ARG 194 Cb 1.27 0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 29.51 3it9 h ARG 194 CO 0.91 0.00 1.20 1.21 0.56 0.00 0.00 179.97 183.85 3it9 s ASN 195 N -4.58 6.05 0.50 7.04 2.47 -1.26 -4.85 114.94 120.31 3it9 s ASN 195 Ca 0.02 -0.63 0.28 0.00 0.42 0.00 0.00 52.86 52.95 3it9 s ASN 195 Cb 0.09 -2.56 1.20 0.00 -1.45 0.00 0.00 41.25 38.54 3it9 s ASN 195 CO 0.40 -1.89 1.94 0.03 -3.72 0.00 0.00 177.10 173.85 3it9 h ARG 196 N 10.75 0.00 0.00 0.43 3.08 -2.01 -2.62 114.38 124.01 3it9 h ARG 196 Ca -0.12 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.93 3it9 h ARG 196 Cb 1.05 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.10 3it9 h ARG 196 CO 1.31 0.13 -0.02 -0.07 -1.07 0.00 0.00 179.97 180.24 3it9 h LEU 197 N 0.00 0.00 -1.83 3.04 3.38 -1.96 -1.63 115.31 116.31 3it9 h LEU 197 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3it9 h LEU 197 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 3it9 h LEU 197 CO 0.02 0.02 0.09 -0.07 0.09 0.00 0.00 178.44 178.59 3it9 h LEU 198 N 0.00 0.00 -1.20 1.67 4.07 -1.71 -1.09 115.31 117.04 3it9 h LEU 198 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3it9 h LEU 198 Cb 0.14 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.88 3it9 h LEU 198 CO 0.00 0.00 -0.33 0.79 -1.08 0.00 0.00 178.44 177.82 3it9 n TRP 199 N -2.52 0.00 -1.62 1.13 8.01 -0.61 -4.80 117.44 117.02 3it9 n TRP 199 Ca -0.02 0.00 -0.46 0.00 -1.31 0.00 0.00 57.50 55.71 3it9 n TRP 199 Cb 0.13 0.00 -0.03 0.00 -2.01 0.00 0.00 31.31 29.41 3it9 n TRP 199 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.69 177.13 3it9 n SER 200 N 0.29 1.98 0.05 -0.99 2.88 -0.41 -4.89 113.62 112.53 3it9 n SER 200 Ca 0.10 1.15 0.09 0.00 -1.33 0.00 0.00 58.87 58.88 3it9 n SER 200 Cb 0.47 -1.33 -0.08 0.00 -0.75 0.00 0.00 64.21 62.52 3it9 n SER 200 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 3it9 n SER 201 N 1.84 0.52 0.05 -3.46 7.64 -1.26 -4.30 113.62 114.65 3it9 n SER 201 Ca 0.12 0.21 0.13 0.00 1.01 0.00 0.00 58.87 60.34 3it9 n SER 201 Cb 0.29 0.96 0.39 0.00 -1.01 0.00 0.00 64.21 64.84 3it9 n SER 201 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3it9 n ASN 202 N -2.57 0.52 -3.84 6.43 3.02 -1.26 -4.87 115.26 112.69 3it9 n ASN 202 Ca -0.04 0.33 -0.12 0.00 -0.03 0.00 0.00 54.58 54.71 3it9 n ASN 202 Cb 0.62 -0.33 -0.11 0.00 -0.61 0.00 0.00 39.78 39.35 3it9 n ASN 202 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3it9 s LEU 203 N -3.81 1.42 -1.01 3.41 1.43 -1.26 -5.03 118.68 113.82 3it9 s LEU 203 Ca 0.11 0.08 -0.18 0.00 -1.03 0.00 0.00 54.13 53.10 3it9 s LEU 203 Cb 0.15 0.67 0.12 0.00 0.03 0.00 0.00 46.19 47.16 3it9 s LEU 203 CO 0.62 -0.22 1.26 0.21 0.23 0.00 0.00 176.35 178.45 3it9 s ASN 204 N -0.67 6.70 -0.21 2.29 2.47 -1.26 -4.65 114.94 119.61 3it9 s ASN 204 Ca -0.08 -2.16 -0.12 0.00 0.42 0.00 0.00 52.86 50.93 3it9 s ASN 204 Cb -0.04 -2.43 -0.05 0.00 -1.45 0.00 0.00 41.25 37.27 3it9 s ASN 204 CO 0.01 -1.08 0.22 -0.69 -3.72 0.00 0.00 177.10 171.84 3it9 s VAL 205 N 2.90 5.33 -0.03 -5.21 1.01 -1.26 -1.92 120.40 121.22 3it9 s VAL 205 Ca 0.38 0.34 0.04 0.00 0.00 0.00 0.00 61.98 62.74 3it9 s VAL 205 Cb -0.03 -3.56 0.07 0.00 0.00 0.00 0.00 36.38 32.86 3it9 s VAL 205 CO -0.07 0.35 0.96 -0.90 0.00 0.00 0.00 175.10 175.45 3it9 n ASP 206 N 4.05 1.67 -3.71 3.32 3.85 -0.27 -4.59 116.55 120.88 3it9 n ASP 206 Ca -0.13 -2.10 0.02 0.00 -0.71 0.00 0.00 54.79 51.86 3it9 n ASP 206 Cb 0.52 -0.11 0.01 0.00 -1.35 0.00 0.00 41.12 40.19 3it9 n ASP 206 CO 0.00 0.00 0.00 -0.83 -1.01 0.00 0.00 177.20 175.36 3it9 s GLY 207 N -1.28 -0.20 0.18 6.12 0.00 -1.22 -3.60 107.32 107.32 3it9 s GLY 207 Ca 0.07 0.22 0.00 0.00 0.00 0.00 0.00 44.72 45.01 3it9 s GLY 207 CO 0.01 3.38 0.00 -0.13 0.00 0.00 0.00 173.10 176.35 3it9 n MET 208 N -0.74 0.00 -3.64 2.90 1.56 0.56 -1.29 117.12 116.47 3it9 n MET 208 Ca -0.01 0.00 -0.08 0.00 -0.27 0.00 0.00 57.70 57.33 3it9 n MET 208 Cb 0.60 -0.01 -0.07 0.00 2.15 0.00 0.00 33.22 35.89 3it9 n MET 208 CO 0.00 0.00 0.00 0.21 -0.73 0.00 0.00 175.97 175.45 3it9 s LYS 209 N -2.00 0.70 0.50 2.12 2.47 -0.63 -4.96 119.74 117.93 3it9 s LYS 209 Ca 0.00 1.09 0.02 0.00 -1.56 0.00 0.00 55.97 55.53 3it9 s LYS 209 Cb 0.00 0.20 0.02 0.00 -1.46 0.00 0.00 37.83 36.59 3it9 s LYS 209 CO 0.00 -0.13 0.70 0.95 0.16 0.00 0.00 175.35 177.04 3it9 s THR 210 N 1.25 3.13 -0.06 3.43 -4.23 -1.26 -1.06 115.64 116.85 3it9 s THR 210 Ca -0.07 -0.69 -0.30 0.00 -1.18 0.00 0.00 61.69 59.46 3it9 s THR 210 Cb -0.05 -3.15 0.09 0.00 1.34 0.00 0.00 72.50 70.73 3it9 s THR 210 CO -0.14 -0.09 0.77 -0.83 -0.54 0.00 0.00 174.62 173.79 3it9 s GLY 211 N -4.35 -0.49 -0.16 3.99 0.00 -0.41 -3.91 107.32 102.00 3it9 s GLY 211 Ca 0.54 1.42 0.02 0.00 0.00 0.00 0.00 44.72 46.69 3it9 s GLY 211 CO 0.37 0.86 -0.20 -1.08 0.00 0.00 0.00 173.10 173.05 3it9 s THR 212 N -1.55 2.01 0.82 0.90 -1.32 -1.26 0.25 115.64 115.48 3it9 s THR 212 Ca -0.06 -0.92 -0.12 0.00 -1.21 0.00 0.00 61.69 59.38 3it9 s THR 212 Cb -0.00 -1.80 0.08 0.00 -1.51 0.00 0.00 72.50 69.27 3it9 s THR 212 CO 0.04 0.53 1.11 0.42 -2.21 0.00 0.00 174.62 174.52 3it9 s THR 213 N 1.10 2.80 0.30 5.08 -4.23 -0.55 -4.73 115.64 115.41 3it9 s THR 213 Ca -0.00 0.26 -0.00 0.00 -1.18 0.00 0.00 61.69 60.76 3it9 s THR 213 Cb -0.14 -3.04 0.18 0.00 1.34 0.00 0.00 72.50 70.84 3it9 s THR 213 CO -0.08 -0.34 1.87 0.00 -0.54 0.00 0.00 174.62 175.53 3it9 h ALA 214 N -1.14 1.30 0.00 3.99 0.00 -1.95 -3.39 119.26 118.06 3it9 h ALA 214 Ca -0.48 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.27 3it9 h ALA 214 Cb 1.29 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3it9 h ALA 214 CO 0.61 0.51 0.00 0.41 0.00 0.00 0.00 179.25 180.78 3it9 n GLY 215 N -1.00 0.91 2.79 0.00 0.00 -1.26 -4.96 105.19 101.67 3it9 n GLY 215 Ca 0.04 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.05 3it9 n GLY 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3it9 n ALA 216 N 0.00 2.68 0.00 4.61 0.00 -1.26 -5.14 120.51 121.40 3it9 n ALA 216 Ca 0.00 -2.39 0.00 0.00 0.00 0.00 0.00 53.44 51.05 3it9 n ALA 216 Cb 0.46 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 19.03 3it9 n ALA 216 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3it9 n GLY 217 N -0.75 -1.19 3.33 0.00 0.00 -1.26 -4.12 105.19 101.21 3it9 n GLY 217 Ca 0.02 -1.53 -0.30 0.00 0.00 0.00 0.00 46.02 44.21 3it9 n GLY 217 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3it9 s TYR 218 N 0.00 2.28 0.10 1.61 1.51 0.15 -1.48 117.35 121.53 3it9 s TYR 218 Ca 0.00 -0.41 0.08 0.00 -1.01 0.00 0.00 57.07 55.73 3it9 s TYR 218 Cb 0.00 -1.38 -0.04 0.00 -0.11 0.00 0.00 41.96 40.43 3it9 s TYR 218 CO 0.00 0.10 -0.17 -0.80 -1.11 0.00 0.00 175.55 173.57 3it9 s ASN 219 N -1.16 3.94 -0.12 2.29 0.01 0.14 -0.95 114.94 119.09 3it9 s ASN 219 Ca 0.11 -0.51 -0.06 0.00 -0.71 0.00 0.00 52.86 51.69 3it9 s ASN 219 Cb -0.10 -0.60 0.05 0.00 0.41 0.00 0.00 41.25 41.02 3it9 s ASN 219 CO 0.02 0.19 0.27 -0.22 -1.51 0.00 0.00 177.10 175.85 3it9 s LEU 220 N -2.02 0.25 -0.24 0.60 0.20 0.04 -1.28 118.68 116.22 3it9 s LEU 220 Ca 0.18 0.59 -0.07 0.00 0.69 0.00 0.00 54.13 55.51 3it9 s LEU 220 Cb -0.11 0.82 -0.03 0.00 -0.43 0.00 0.00 46.19 46.45 3it9 s LEU 220 CO 0.10 -0.18 0.06 -0.69 -0.29 0.00 0.00 176.35 175.35 3it9 s VAL 221 N 1.43 4.26 0.12 1.68 1.01 -0.22 -0.77 120.40 127.90 3it9 s VAL 221 Ca -0.08 -0.19 0.07 0.00 0.00 0.00 0.00 61.98 61.78 3it9 s VAL 221 Cb -0.10 -2.98 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 3it9 s VAL 221 CO -0.09 0.35 -0.18 0.00 0.00 0.00 0.00 175.10 175.18 3it9 s ALA 222 N 1.52 1.72 0.01 5.51 0.00 -0.18 -0.32 121.76 130.02 3it9 s ALA 222 Ca 0.06 -1.30 0.01 0.00 0.00 0.00 0.00 51.96 50.73 3it9 s ALA 222 Cb -0.15 -0.17 -0.01 0.00 0.00 0.00 0.00 23.12 22.79 3it9 s ALA 222 CO 0.03 0.25 -0.03 0.45 0.00 0.00 0.00 175.76 176.45 3it9 s SER 223 N -2.23 0.35 0.05 0.00 0.15 -0.41 -0.50 113.70 111.10 3it9 s SER 223 Ca 0.09 -0.15 0.01 0.00 0.70 0.00 0.00 55.95 56.60 3it9 s SER 223 Cb -0.08 -0.01 -0.03 0.00 -1.71 0.00 0.00 66.02 64.19 3it9 s SER 223 CO 0.04 -0.03 -0.05 0.00 1.20 0.00 0.00 173.24 174.40 3it9 s ALA 224 N -0.35 0.50 0.09 5.45 0.00 -0.76 -1.12 121.76 125.57 3it9 s ALA 224 Ca -0.02 -0.93 0.09 0.00 0.00 0.00 0.00 51.96 51.10 3it9 s ALA 224 Cb -0.03 0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.21 3it9 s ALA 224 CO -0.00 -0.19 -0.24 0.95 0.00 0.00 0.00 175.76 176.28 3it9 s THR 225 N -2.43 1.99 -0.25 0.00 -4.23 -0.81 -0.84 115.64 109.07 3it9 s THR 225 Ca -0.04 -1.53 -0.02 0.00 -1.18 0.00 0.00 61.69 58.93 3it9 s THR 225 Cb -0.03 -1.76 0.08 0.00 1.34 0.00 0.00 72.50 72.13 3it9 s THR 225 CO -0.03 0.13 0.06 -1.10 -0.54 0.00 0.00 174.62 173.14 3it9 s GLN 226 N -1.69 0.70 7.50 3.99 -0.21 0.43 -4.30 119.66 126.07 3it9 s GLN 226 Ca 0.10 -0.70 0.00 0.00 0.02 0.00 0.00 55.36 54.78 3it9 s GLN 226 Cb -0.10 -2.02 0.00 0.00 1.00 0.00 0.00 33.01 31.89 3it9 s GLN 226 CO 0.04 -0.79 0.00 0.41 -2.12 0.00 0.00 175.29 172.82 3it9 n GLY 227 N 4.97 3.86 0.01 3.09 0.00 -1.26 -1.72 105.19 114.14 3it9 n GLY 227 Ca -0.06 0.02 0.14 0.00 0.00 0.00 0.00 46.02 46.12 3it9 n GLY 227 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3it9 n ASP 228 N 6.39 0.07 -4.65 1.61 10.43 -1.26 -4.80 116.55 124.35 3it9 n ASP 228 Ca 0.00 0.23 -0.40 0.00 2.57 0.00 0.00 54.79 57.19 3it9 n ASP 228 Cb 0.00 -0.36 -0.06 0.00 1.84 0.00 0.00 41.12 42.54 3it9 n ASP 228 CO 0.00 0.00 0.00 -0.32 -1.07 0.00 0.00 177.20 175.81 3it9 s MET 229 N -2.87 4.18 -0.10 -1.24 1.75 -0.70 -4.95 119.30 115.37 3it9 s MET 229 Ca 0.18 0.60 0.04 0.00 -1.25 0.00 0.00 55.69 55.25 3it9 s MET 229 Cb 0.19 -3.60 0.00 0.00 2.84 0.00 0.00 34.83 34.26 3it9 s MET 229 CO 0.53 -0.30 -0.23 0.50 -0.65 0.00 0.00 175.02 174.87 3it9 s ARG 230 N 2.12 2.88 0.05 4.11 3.52 -1.26 -0.43 118.95 129.94 3it9 s ARG 230 Ca 0.28 -0.83 0.04 0.00 -0.13 0.00 0.00 55.73 55.09 3it9 s ARG 230 Cb -0.16 -2.19 -0.04 0.00 -1.56 0.00 0.00 34.95 31.01 3it9 s ARG 230 CO 0.10 0.17 -0.03 -0.51 -0.81 0.00 0.00 175.30 174.21 3it9 s LEU 231 N 0.37 3.35 -0.11 -0.88 1.43 -0.02 -1.02 118.68 121.80 3it9 s LEU 231 Ca -0.18 -0.15 0.03 0.00 -1.03 0.00 0.00 54.13 52.80 3it9 s LEU 231 Cb -0.18 -2.01 0.01 0.00 0.03 0.00 0.00 46.19 44.04 3it9 s LEU 231 CO 0.08 0.23 -0.20 -0.63 0.23 0.00 0.00 176.35 176.06 3it9 s ILE 232 N -1.16 1.82 0.03 -0.59 1.01 0.51 -1.83 121.20 120.99 3it9 s ILE 232 Ca 0.21 -0.86 0.06 0.00 0.00 0.00 0.00 60.65 60.07 3it9 s ILE 232 Cb -0.11 -1.61 -0.03 0.00 0.01 0.00 0.00 42.46 40.72 3it9 s ILE 232 CO 0.13 0.51 -0.17 -0.94 0.00 0.00 0.00 174.94 174.47 3it9 s SER 233 N 0.66 3.87 -0.06 3.58 1.04 0.34 -0.72 113.70 122.41 3it9 s SER 233 Ca -0.12 -0.38 0.02 0.00 0.48 0.00 0.00 55.95 55.94 3it9 s SER 233 Cb -0.16 -0.66 0.01 0.00 0.10 0.00 0.00 66.02 65.31 3it9 s SER 233 CO 0.03 0.27 -0.11 -0.69 0.98 0.00 0.00 173.24 173.71 3it9 s VAL 234 N -0.91 1.06 -0.07 5.02 1.01 -0.25 -1.01 120.40 125.25 3it9 s VAL 234 Ca 0.14 -0.43 0.04 0.00 0.00 0.00 0.00 61.98 61.73 3it9 s VAL 234 Cb -0.11 -0.98 0.00 0.00 0.00 0.00 0.00 36.38 35.30 3it9 s VAL 234 CO 0.05 0.34 -0.20 -0.69 0.00 0.00 0.00 175.10 174.60 3it9 s VAL 235 N 0.72 1.70 -0.06 2.92 1.01 0.05 -1.30 120.40 125.44 3it9 s VAL 235 Ca -0.14 -0.83 0.04 0.00 0.00 0.00 0.00 61.98 61.05 3it9 s VAL 235 Cb -0.16 -1.48 0.00 0.00 0.00 0.00 0.00 36.38 34.75 3it9 s VAL 235 CO 0.03 0.48 -0.18 -0.76 0.00 0.00 0.00 175.10 174.67 3it9 s LEU 236 N 0.28 1.90 -1.12 3.92 1.02 0.88 -0.78 118.68 124.78 3it9 s LEU 236 Ca -0.12 -0.41 -0.05 0.00 0.02 0.00 0.00 54.13 53.57 3it9 s LEU 236 Cb -0.15 -1.08 0.01 0.00 0.02 0.00 0.00 46.19 44.98 3it9 s LEU 236 CO 0.05 0.13 0.96 0.61 0.02 0.00 0.00 176.35 178.13 3it9 n GLY 237 N 3.38 -0.30 3.77 -3.19 0.00 -0.84 -1.81 105.19 106.20 3it9 n GLY 237 Ca -0.19 0.09 -0.39 0.00 0.00 0.00 0.00 46.02 45.52 3it9 n GLY 237 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3it9 s ALA 238 N -3.29 3.30 0.26 4.61 0.00 -0.13 -2.85 121.76 123.67 3it9 s ALA 238 Ca 0.34 1.10 -0.02 0.00 0.00 0.00 0.00 51.96 53.38 3it9 s ALA 238 Cb -0.15 -3.43 0.32 0.00 0.00 0.00 0.00 23.12 19.87 3it9 s ALA 238 CO 0.62 -0.59 1.76 0.87 0.00 0.00 0.00 175.76 178.42 3it9 h LYS 239 N 2.98 0.82 -5.41 0.00 6.56 -1.89 0.44 116.57 120.07 3it9 h LYS 239 Ca -0.49 -0.21 -0.45 0.00 -1.06 0.00 0.00 60.65 58.44 3it9 h LYS 239 Cb 1.23 -0.10 -0.14 0.00 -0.57 0.00 0.00 32.23 32.65 3it9 h LYS 239 CO 0.64 0.81 -0.69 0.95 -2.06 0.00 0.00 179.45 179.10 3it9 s THR 240 N -5.02 1.52 0.23 -0.16 -4.23 -1.26 -4.77 115.64 101.95 3it9 s THR 240 Ca -0.10 -2.13 -0.07 0.00 -1.18 0.00 0.00 61.69 58.22 3it9 s THR 240 Cb 0.15 -2.28 0.21 0.00 1.34 0.00 0.00 72.50 71.92 3it9 s THR 240 CO 0.81 -0.42 1.87 -0.78 -0.54 0.00 0.00 174.62 175.56 3it9 h ASP 241 N 2.43 0.87 -0.27 3.99 3.58 -1.97 -1.24 116.42 123.80 3it9 h ASP 241 Ca -0.39 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 56.89 3it9 h ASP 241 Cb 1.22 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 42.09 3it9 h ASP 241 CO 0.65 0.59 -0.51 -0.09 -2.88 0.00 0.00 179.24 177.00 3it9 h ARG 242 N 1.02 0.82 -0.59 0.28 2.43 -1.99 -2.76 114.38 113.59 3it9 h ARG 242 Ca 0.35 -0.52 -0.01 0.00 -0.81 0.00 0.00 59.98 58.99 3it9 h ARG 242 Cb 0.07 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 3it9 h ARG 242 CO -0.14 1.15 0.35 0.82 -1.51 0.00 0.00 179.97 180.64 3it9 h ILE 243 N 0.59 1.17 -0.68 1.20 2.04 -1.93 0.10 117.51 120.00 3it9 h ILE 243 Ca 0.01 -0.40 0.02 0.00 1.00 0.00 0.00 64.86 65.49 3it9 h ILE 243 Cb 1.12 0.35 -0.04 0.00 -0.74 0.00 0.00 36.82 37.51 3it9 h ILE 243 CO 0.11 0.18 0.44 -0.09 0.00 0.00 0.00 178.15 178.80 3it9 h ARG 244 N 0.82 0.86 -0.03 2.37 1.12 -1.02 -1.06 114.38 117.44 3it9 h ARG 244 Ca 0.21 -0.05 -0.07 0.00 -1.11 0.00 0.00 59.98 58.96 3it9 h ARG 244 Cb -0.01 -0.19 0.00 0.00 -0.01 0.00 0.00 29.97 29.76 3it9 h ARG 244 CO -0.04 0.57 -0.26 0.74 -3.11 0.00 0.00 179.97 177.87 3it9 h PHE 245 N 0.88 0.31 -0.04 2.20 0.04 -1.21 -3.24 116.94 115.88 3it9 h PHE 245 Ca 0.26 -0.15 -0.08 0.00 2.80 0.00 0.00 57.97 60.80 3it9 h PHE 245 Cb -0.06 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.04 3it9 h PHE 245 CO -0.03 0.91 -0.35 -0.91 -0.60 0.00 0.00 178.31 177.32 3it9 h ASN 246 N -0.38 0.07 0.24 2.17 4.21 -0.67 -1.22 115.58 120.01 3it9 h ASN 246 Ca -0.02 -0.02 -0.21 0.00 1.21 0.00 0.00 56.30 57.26 3it9 h ASN 246 Cb 0.96 -0.02 -0.00 0.00 -1.12 0.00 0.00 38.32 38.14 3it9 h ASN 246 CO 0.05 0.42 -0.82 -0.08 -1.29 0.00 0.00 177.43 175.71 3it9 h GLU 247 N 0.06 0.45 -0.41 0.81 4.57 -1.33 -1.90 114.58 116.84 3it9 h GLU 247 Ca 0.01 -0.41 -0.11 0.00 -1.18 0.00 0.00 59.36 57.67 3it9 h GLU 247 Cb 0.65 0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.33 3it9 h GLU 247 CO 0.05 1.06 -0.17 0.77 -1.18 0.00 0.00 179.01 179.54 3it9 h SER 248 N 0.29 0.86 -0.46 1.04 0.02 -1.43 -2.28 113.55 111.59 3it9 h SER 248 Ca -0.05 -0.39 -0.02 0.00 -0.84 0.00 0.00 61.79 60.49 3it9 h SER 248 Cb 1.43 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.71 3it9 h SER 248 CO 0.14 1.06 0.23 -0.08 -1.14 0.00 0.00 176.83 177.04 3it9 h GLU 249 N 0.66 0.66 -0.52 3.45 4.81 -1.19 -1.18 114.58 121.27 3it9 h GLU 249 Ca 0.10 -0.10 0.04 0.00 -0.13 0.00 0.00 59.36 59.27 3it9 h GLU 249 Cb 0.72 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.94 3it9 h GLU 249 CO 0.05 0.56 0.28 -0.22 -0.73 0.00 0.00 179.01 178.95 3it9 h LYS 250 N 0.60 0.53 -0.16 1.92 3.64 -1.23 0.14 116.57 122.01 3it9 h LYS 250 Ca 0.16 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.50 3it9 h LYS 250 Cb 0.11 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 3it9 h LYS 250 CO -0.02 0.35 0.06 -0.07 -2.27 0.00 0.00 179.45 177.49 3it9 h LEU 251 N 0.54 0.23 -0.56 5.20 3.38 -1.10 -0.06 115.31 122.95 3it9 h LEU 251 Ca 0.22 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 3it9 h LEU 251 Cb 0.10 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 3it9 h LEU 251 CO -0.14 0.35 0.07 -0.07 0.09 0.00 0.00 178.44 178.74 3it9 h LEU 252 N 0.09 0.92 -0.00 1.67 3.38 -0.94 -1.78 115.31 118.64 3it9 h LEU 252 Ca 0.05 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.75 3it9 h LEU 252 Cb 0.20 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 3it9 h LEU 252 CO -0.00 0.96 -0.02 0.74 0.09 0.00 0.00 178.44 180.21 3it9 h THR 253 N 0.84 0.96 -0.45 0.22 2.02 -0.62 -2.41 112.91 113.47 3it9 h THR 253 Ca 0.17 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.38 3it9 h THR 253 Cb 0.45 0.96 -0.03 0.00 -1.74 0.00 0.00 68.15 67.78 3it9 h THR 253 CO 0.02 0.00 0.24 -0.25 0.37 0.00 0.00 175.52 175.90 3it9 h TRP 254 N -0.03 0.45 -0.03 3.16 7.01 -0.84 -0.26 115.95 125.41 3it9 h TRP 254 Ca 0.01 0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.06 3it9 h TRP 254 Cb 0.04 -0.14 -0.06 0.00 -2.10 0.00 0.00 29.16 26.90 3it9 h TRP 254 CO -0.10 0.24 -0.44 0.78 -2.79 0.00 0.00 178.44 176.14 3it9 h GLY 255 N 0.48 -0.81 2.00 2.65 0.00 -1.22 -1.91 103.07 104.26 3it9 h GLY 255 Ca 0.19 0.53 -0.02 0.00 0.00 0.00 0.00 47.33 48.03 3it9 h GLY 255 CO -0.11 -0.24 -0.11 0.74 0.00 0.00 0.00 176.54 176.81 3it9 h PHE 256 N -0.57 0.00 -0.18 5.60 0.04 -1.22 -1.88 116.94 118.73 3it9 h PHE 256 Ca 0.05 0.00 -0.16 0.00 2.80 0.00 0.00 57.97 60.66 3it9 h PHE 256 Cb 0.66 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.80 3it9 h PHE 256 CO -0.45 0.11 -0.55 -0.09 -0.60 0.00 0.00 178.31 176.74 3it9 h ARG 257 N 0.00 0.55 0.00 1.51 2.43 -0.46 -3.37 114.38 115.04 3it9 h ARG 257 Ca -0.00 -0.34 0.00 0.00 -0.81 0.00 0.00 59.98 58.82 3it9 h ARG 257 Cb 0.22 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 3it9 h ARG 257 CO 0.01 0.95 -0.58 1.19 -1.51 0.00 0.00 179.97 180.03 3it9 n PHE 258 N -3.96 0.00 -4.31 2.20 3.72 -0.77 -4.94 117.46 109.39 3it9 n PHE 258 Ca -0.03 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.17 3it9 n PHE 258 Cb 0.60 -0.04 -0.11 0.00 -0.94 0.00 0.00 39.48 38.99 3it9 n PHE 258 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 3it9 s PHE 259 N -1.88 1.66 0.07 1.38 0.40 -0.72 -1.12 117.98 117.76 3it9 s PHE 259 Ca 0.01 -0.54 0.03 0.00 -0.60 0.00 0.00 56.93 55.84 3it9 s PHE 259 Cb 0.05 -0.82 -0.03 0.00 0.51 0.00 0.00 43.02 42.74 3it9 s PHE 259 CO 0.30 0.28 -0.09 -1.83 0.70 0.00 0.00 175.22 174.59 3it9 s GLU 260 N -3.07 0.67 -0.22 0.44 -1.05 0.24 -4.68 118.70 111.03 3it9 s GLU 260 Ca 0.16 -0.96 -0.07 0.00 -0.15 0.00 0.00 54.97 53.95 3it9 s GLU 260 Cb -0.04 -0.37 -0.03 0.00 -0.44 0.00 0.00 34.13 33.25 3it9 s GLU 260 CO 0.06 0.05 0.06 0.99 0.95 0.00 0.00 175.26 177.37 3it9 s THR 261 N -2.00 4.49 0.20 1.83 2.01 -1.26 -0.98 115.64 119.94 3it9 s THR 261 Ca -0.02 -0.12 0.09 0.00 0.31 0.00 0.00 61.69 61.94 3it9 s THR 261 Cb -0.06 -3.06 -0.05 0.00 0.01 0.00 0.00 72.50 69.34 3it9 s THR 261 CO -0.01 0.39 -0.17 0.68 -0.69 0.00 0.00 174.62 174.83 3it9 s VAL 262 N 1.07 1.87 -0.63 3.82 -7.23 0.29 -4.96 120.40 114.63 3it9 s VAL 262 Ca 0.04 -2.13 0.05 0.00 -1.81 0.00 0.00 61.98 58.12 3it9 s VAL 262 Cb -0.14 -2.01 0.16 0.00 0.56 0.00 0.00 36.38 34.95 3it9 s VAL 262 CO 0.03 -0.47 0.42 -0.89 -0.31 0.00 0.00 175.10 173.89 3it9 s THR 263 N -2.57 2.59 0.48 5.32 2.01 -1.26 -0.69 115.64 121.52 3it9 s THR 263 Ca 0.21 -3.89 0.20 0.00 0.31 0.00 0.00 61.69 58.52 3it9 s THR 263 Cb -0.03 -2.73 0.25 0.00 0.01 0.00 0.00 72.50 70.01 3it9 s THR 263 CO 0.08 -0.97 2.09 1.55 -0.69 0.00 0.00 174.62 176.67 3it9 h PRO 264 N 5.71 0.00 -4.33 4.92 0.13 -1.96 -3.37 132.00 133.10 3it9 h PRO 264 Ca 0.10 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.61 3it9 h PRO 264 Cb 0.80 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 31.55 3it9 h PRO 264 CO 0.68 0.10 -0.78 0.42 -0.23 0.00 0.00 178.00 178.19 3it9 s ILE 265 N -4.62 1.56 0.71 -3.56 1.01 -1.24 -5.12 121.20 109.94 3it9 s ILE 265 Ca -0.04 -1.36 -0.13 0.00 0.00 0.00 0.00 60.65 59.13 3it9 s ILE 265 Cb 0.15 -1.88 0.03 0.00 0.01 0.00 0.00 42.46 40.76 3it9 s ILE 265 CO 0.64 -0.20 1.09 -0.54 0.00 0.00 0.00 174.94 175.94 3it9 s LYS 266 N 1.36 2.57 0.49 2.79 3.01 -1.26 -4.28 119.74 124.42 3it9 s LYS 266 Ca -0.03 1.24 0.17 0.00 -1.01 0.00 0.00 55.97 56.35 3it9 s LYS 266 Cb -0.19 -1.93 1.20 0.00 -1.01 0.00 0.00 37.83 35.90 3it9 s LYS 266 CO -0.08 -1.41 2.05 -1.35 0.51 0.00 0.00 175.35 175.07 3it9 h PRO 267 N -0.56 0.17 -0.24 -1.68 0.10 -1.95 -1.90 132.00 125.95 3it9 h PRO 267 Ca -0.45 -0.01 0.00 0.00 0.10 0.00 0.00 66.00 65.64 3it9 h PRO 267 Cb 1.23 -0.04 0.00 0.00 0.10 0.00 0.00 31.00 32.30 3it9 h PRO 267 CO 0.53 0.11 0.00 -0.25 0.10 0.00 0.00 178.00 178.49 3it9 n ASP 268 N -4.46 2.61 -4.80 -2.05 9.92 -1.26 -4.11 116.55 112.40 3it9 n ASP 268 Ca 0.05 -1.82 -0.35 0.00 -0.53 0.00 0.00 54.79 52.13 3it9 n ASP 268 Cb 0.32 -0.16 -0.07 0.00 -0.64 0.00 0.00 41.12 40.58 3it9 n ASP 268 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3it9 s ALA 269 N -0.98 3.15 -0.16 2.24 0.00 -0.71 -5.03 121.76 120.26 3it9 s ALA 269 Ca 0.20 0.47 -0.18 0.00 0.00 0.00 0.00 51.96 52.44 3it9 s ALA 269 Cb 0.11 -3.16 -0.04 0.00 0.00 0.00 0.00 23.12 20.04 3it9 s ALA 269 CO 0.15 0.16 0.50 0.95 0.00 0.00 0.00 175.76 177.53 3it9 s THR 270 N -1.83 5.14 -0.06 0.00 -4.23 -1.26 -4.50 115.64 108.89 3it9 s THR 270 Ca 0.55 0.96 -0.04 0.00 -1.18 0.00 0.00 61.69 61.98 3it9 s THR 270 Cb -0.15 -3.83 -0.27 0.00 1.34 0.00 0.00 72.50 69.59 3it9 s THR 270 CO 0.20 0.24 0.59 0.15 -0.54 0.00 0.00 174.62 175.26 3it9 h PHE 271 N 7.15 0.45 -2.78 3.99 3.57 0.29 -3.48 116.94 126.13 3it9 h PHE 271 Ca -0.37 -0.33 -0.08 0.00 3.53 0.00 0.00 57.97 60.72 3it9 h PHE 271 Cb 1.16 -0.02 -0.18 0.00 2.79 0.00 0.00 35.95 39.71 3it9 h PHE 271 CO 0.67 1.55 -0.07 0.54 -2.23 0.00 0.00 178.31 178.76 3it9 s VAL 272 N -2.58 0.04 -0.05 1.41 0.11 -0.76 -5.01 120.40 113.57 3it9 s VAL 272 Ca -0.15 -0.34 -0.02 0.00 -2.93 0.00 0.00 61.98 58.54 3it9 s VAL 272 Cb 0.07 -0.87 -0.04 0.00 -1.53 0.00 0.00 36.38 34.01 3it9 s VAL 272 CO 0.82 -0.19 0.08 0.42 -3.33 0.00 0.00 175.10 172.90 3it9 s THR 273 N -1.89 4.81 0.09 5.04 -4.23 -1.26 0.53 115.64 118.74 3it9 s THR 273 Ca -0.09 -0.23 0.07 0.00 -1.18 0.00 0.00 61.69 60.26 3it9 s THR 273 Cb -0.02 -3.14 -0.03 0.00 1.34 0.00 0.00 72.50 70.65 3it9 s THR 273 CO 0.02 0.47 -0.18 -1.10 -0.54 0.00 0.00 174.62 173.29 3it9 s GLN 274 N -1.39 1.01 0.31 3.99 -1.52 0.03 -4.93 119.66 117.17 3it9 s GLN 274 Ca 0.19 -1.09 -0.29 0.00 -1.95 0.00 0.00 55.36 52.21 3it9 s GLN 274 Cb -0.12 -1.17 -0.12 0.00 -0.22 0.00 0.00 33.01 31.38 3it9 s GLN 274 CO 0.09 0.27 1.48 -2.13 -0.25 0.00 0.00 175.29 174.75 3it9 n ARG 275 N 1.13 2.48 -5.14 2.91 0.63 -1.26 0.44 116.66 117.85 3it9 n ARG 275 Ca -0.20 0.88 -0.29 0.00 -0.92 0.00 0.00 57.85 57.31 3it9 n ARG 275 Cb 0.54 -2.59 -0.16 0.00 0.45 0.00 0.00 32.46 30.70 3it9 n ARG 275 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 3it9 s VAL 276 N -0.46 1.88 -0.02 5.15 0.11 -0.68 -4.28 120.40 122.09 3it9 s VAL 276 Ca 0.61 -1.05 -0.15 0.00 -2.93 0.00 0.00 61.98 58.46 3it9 s VAL 276 Cb -0.53 -1.57 -0.05 0.00 -1.53 0.00 0.00 36.38 32.70 3it9 s VAL 276 CO 0.55 0.50 0.42 0.26 -3.33 0.00 0.00 175.10 173.49 3it9 s TRP 277 N -0.59 3.69 -0.82 1.54 0.52 -0.42 -4.50 118.94 118.37 3it9 s TRP 277 Ca 0.09 0.97 0.00 0.00 0.02 0.00 0.00 56.10 57.18 3it9 s TRP 277 Cb -0.09 -2.33 0.00 0.00 -1.15 0.00 0.00 33.47 29.90 3it9 s TRP 277 CO -0.01 0.56 0.00 1.19 0.02 0.00 0.00 176.95 178.72 3it9 n PHE 278 N 2.13 -0.31 -4.12 -1.98 3.72 -1.26 -1.03 117.46 114.60 3it9 n PHE 278 Ca -0.13 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.00 3it9 n PHE 278 Cb 0.52 -2.15 -0.04 0.00 -0.94 0.00 0.00 39.48 36.87 3it9 n PHE 278 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3it9 s GLY 279 N -2.68 2.50 0.00 1.37 0.00 -1.26 -0.77 107.32 106.49 3it9 s GLY 279 Ca 0.00 -1.29 0.16 0.00 0.00 0.00 0.00 44.72 43.60 3it9 s GLY 279 CO 0.00 -1.98 1.44 2.09 0.00 0.00 0.00 173.10 174.65 3it9 n ASP 280 N -1.52 1.46 -4.15 1.64 5.75 -0.26 -3.91 116.55 115.57 3it9 n ASP 280 Ca -0.05 -1.79 -0.14 0.00 -0.01 0.00 0.00 54.79 52.80 3it9 n ASP 280 Cb 0.65 -0.13 -0.11 0.00 -1.03 0.00 0.00 41.12 40.50 3it9 n ASP 280 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3it9 s LYS 281 N -1.74 0.76 0.00 0.11 1.02 -1.26 -4.99 119.74 113.64 3it9 s LYS 281 Ca 0.27 -1.07 0.19 0.00 0.02 0.00 0.00 55.97 55.38 3it9 s LYS 281 Cb 0.14 -0.44 -0.04 0.00 -0.52 0.00 0.00 37.83 36.97 3it9 s LYS 281 CO 0.21 0.07 0.93 -1.13 -0.92 0.00 0.00 175.35 174.51 3it9 n SER 282 N 0.75 1.64 -4.05 2.83 3.41 -1.26 -4.73 113.62 112.21 3it9 n SER 282 Ca -0.18 -1.32 -0.10 0.00 -0.26 0.00 0.00 58.87 57.02 3it9 n SER 282 Cb 0.57 0.58 -0.11 0.00 -0.26 0.00 0.00 64.21 64.99 3it9 n SER 282 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3it9 s GLU 283 N -2.29 0.50 -0.01 4.33 2.02 -1.26 -1.69 118.70 120.29 3it9 s GLU 283 Ca 0.14 -0.88 0.03 0.00 0.02 0.00 0.00 54.97 54.29 3it9 s GLU 283 Cb 0.15 -0.01 -0.01 0.00 0.10 0.00 0.00 34.13 34.37 3it9 s GLU 283 CO 0.54 -0.04 -0.12 0.54 0.02 0.00 0.00 175.26 176.21 3it9 s VAL 284 N -2.28 0.93 -0.07 2.63 0.11 0.17 -4.80 120.40 117.09 3it9 s VAL 284 Ca -0.06 -0.49 -0.30 0.00 -2.93 0.00 0.00 61.98 58.21 3it9 s VAL 284 Cb -0.04 -0.79 -0.03 0.00 -1.53 0.00 0.00 36.38 33.99 3it9 s VAL 284 CO -0.03 0.27 1.24 0.20 -3.33 0.00 0.00 175.10 173.45 3it9 s ASN 285 N -0.17 7.00 0.16 3.54 0.02 -1.26 -0.79 114.94 123.44 3it9 s ASN 285 Ca 0.03 1.83 0.07 0.00 -1.02 0.00 0.00 52.86 53.77 3it9 s ASN 285 Cb -0.06 -2.55 -0.04 0.00 0.02 0.00 0.00 41.25 38.62 3it9 s ASN 285 CO -0.00 -0.64 -0.03 -0.76 0.02 0.00 0.00 177.10 175.69 3it9 s LEU 286 N 2.49 3.23 0.00 0.60 1.43 0.19 -0.95 118.68 125.67 3it9 s LEU 286 Ca 0.57 -0.42 0.00 0.00 -1.03 0.00 0.00 54.13 53.25 3it9 s LEU 286 Cb -0.25 -1.91 0.00 0.00 0.03 0.00 0.00 46.19 44.06 3it9 s LEU 286 CO 0.21 0.11 0.00 0.61 0.23 0.00 0.00 176.35 177.51 3it9 n GLY 287 N 0.05 1.86 0.00 -3.19 0.00 -0.23 0.10 105.19 103.79 3it9 n GLY 287 Ca -0.10 -0.18 0.07 0.00 0.00 0.00 0.00 46.02 45.81 3it9 n GLY 287 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3it9 n ALA 288 N -3.00 3.00 -0.79 4.61 0.00 -1.26 -0.66 120.51 122.41 3it9 n ALA 288 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.08 3it9 n ALA 288 Cb 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 18.95 3it9 n ALA 288 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3it9 n GLY 289 N 1.56 2.94 0.00 0.00 0.00 -1.26 -2.45 105.19 105.98 3it9 n GLY 289 Ca -0.01 -0.24 0.14 0.00 0.00 0.00 0.00 46.02 45.92 3it9 n GLY 289 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3it9 n GLU 290 N 14.00 0.59 -1.01 1.61 1.02 -1.26 -3.76 120.64 131.83 3it9 n GLU 290 Ca 0.00 0.01 -0.06 0.00 -0.02 0.00 0.00 57.16 57.09 3it9 n GLU 290 Cb 0.00 -1.50 0.30 0.00 -0.02 0.00 0.00 31.44 30.22 3it9 n GLU 290 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3it9 n ALA 291 N -1.18 4.56 0.96 0.62 0.00 -1.03 -4.45 120.51 119.99 3it9 n ALA 291 Ca 0.17 -2.26 0.12 0.00 0.00 0.00 0.00 53.44 51.47 3it9 n ALA 291 Cb 0.18 -1.26 0.11 0.00 0.00 0.00 0.00 19.45 18.48 3it9 n ALA 291 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3it9 n GLY 292 N -0.13 1.04 3.86 0.00 0.00 -1.25 -4.90 105.19 103.81 3it9 n GLY 292 Ca 0.40 -0.69 -0.32 0.00 0.00 0.00 0.00 46.02 45.41 3it9 n GLY 292 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3it9 s SER 293 N -1.97 6.70 0.01 1.61 0.01 -1.26 -3.59 113.70 115.22 3it9 s SER 293 Ca 0.29 1.09 -0.02 0.00 1.31 0.00 0.00 55.95 58.62 3it9 s SER 293 Cb 0.20 -2.30 -0.01 0.00 0.21 0.00 0.00 66.02 64.12 3it9 s SER 293 CO 0.30 -0.14 0.01 -0.69 0.41 0.00 0.00 173.24 173.14 3it9 s VAL 294 N -1.89 0.10 -0.17 3.43 1.01 0.14 -4.57 120.40 118.44 3it9 s VAL 294 Ca 0.51 -0.82 -0.01 0.00 0.00 0.00 0.00 61.98 61.66 3it9 s VAL 294 Cb -0.11 -0.30 -0.00 0.00 0.00 0.00 0.00 36.38 35.97 3it9 s VAL 294 CO 0.19 -0.45 -0.13 -0.89 0.00 0.00 0.00 175.10 173.82 3it9 s THR 295 N -1.39 2.78 0.18 3.92 2.01 -1.26 -0.55 115.64 121.34 3it9 s THR 295 Ca -0.15 -0.72 0.03 0.00 0.31 0.00 0.00 61.69 61.15 3it9 s THR 295 Cb -0.09 -2.19 -0.05 0.00 0.01 0.00 0.00 72.50 70.18 3it9 s THR 295 CO -0.00 0.50 -0.02 0.27 -0.69 0.00 0.00 174.62 174.68 3it9 s ILE 296 N 0.94 0.83 0.52 1.82 -4.36 -0.15 -4.96 121.20 115.83 3it9 s ILE 296 Ca -0.03 -2.00 -0.22 0.00 -0.26 0.00 0.00 60.65 58.14 3it9 s ILE 296 Cb -0.15 -2.11 -0.06 0.00 1.25 0.00 0.00 42.46 41.40 3it9 s ILE 296 CO -0.01 -0.50 1.37 -2.84 0.24 0.00 0.00 174.94 173.19 3it9 s PRO 297 N -3.88 3.26 0.52 0.37 0.02 -1.26 -0.59 135.00 133.44 3it9 s PRO 297 Ca 0.23 2.26 -0.23 0.00 0.02 0.00 0.00 61.00 63.28 3it9 s PRO 297 Cb 0.05 -2.34 -0.06 0.00 0.02 0.00 0.00 34.50 32.17 3it9 s PRO 297 CO 0.04 -1.10 1.39 0.54 -0.33 0.00 0.00 177.00 177.54 3it9 n ARG 298 N -0.85 1.89 -1.95 5.54 1.74 -0.28 -2.60 116.66 120.15 3it9 n ARG 298 Ca 0.09 0.69 -0.15 0.00 -0.77 0.00 0.00 57.85 57.71 3it9 n ARG 298 Cb 0.44 -2.60 -0.03 0.00 -1.02 0.00 0.00 32.46 29.25 3it9 n ARG 298 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3it9 n GLY 299 N 0.69 0.45 0.67 -0.13 0.00 -1.26 -4.87 105.19 100.74 3it9 n GLY 299 Ca 0.09 -0.29 0.06 0.00 0.00 0.00 0.00 46.02 45.88 3it9 n GLY 299 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3it9 n GLN 300 N -2.48 2.18 -0.02 1.61 1.13 -1.07 -4.72 117.38 114.01 3it9 n GLN 300 Ca -0.16 -1.85 -0.09 0.00 -1.94 0.00 0.00 57.00 52.95 3it9 n GLN 300 Cb 0.57 -1.29 -0.03 0.00 0.11 0.00 0.00 30.24 29.61 3it9 n GLN 300 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 3it9 h LEU 301 N 2.41 -0.72 -1.23 1.08 5.85 -1.89 -0.19 115.31 120.61 3it9 h LEU 301 Ca 0.00 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.84 3it9 h LEU 301 Cb 0.69 0.33 0.00 0.00 0.37 0.00 0.00 40.66 42.05 3it9 h LEU 301 CO 0.00 -0.27 0.12 2.29 -0.34 0.00 0.00 178.44 180.23 3it9 n LYS 302 N -5.36 0.12 0.00 1.25 2.85 -1.26 -0.50 118.16 115.26 3it9 n LYS 302 Ca -0.02 0.61 0.10 0.00 -1.05 0.00 0.00 58.31 57.96 3it9 n LYS 302 Cb 0.28 -2.02 0.06 0.00 -0.65 0.00 0.00 35.03 32.71 3it9 n LYS 302 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3it9 n ASN 303 N -2.19 2.54 -4.74 -5.58 5.03 -0.10 -4.92 115.26 105.30 3it9 n ASN 303 Ca -0.01 -1.77 -0.38 0.00 0.87 0.00 0.00 54.58 53.29 3it9 n ASN 303 Cb 0.15 0.12 -0.06 0.00 -1.02 0.00 0.00 39.78 38.97 3it9 n ASN 303 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 3it9 s LEU 304 N -1.91 4.32 0.01 3.41 2.96 0.34 -2.22 118.68 125.60 3it9 s LEU 304 Ca 0.23 0.90 0.02 0.00 -0.22 0.00 0.00 54.13 55.06 3it9 s LEU 304 Cb 0.17 -2.73 -0.01 0.00 0.50 0.00 0.00 46.19 44.13 3it9 s LEU 304 CO 0.33 0.05 -0.07 -1.59 -1.32 0.00 0.00 176.35 173.74 3it9 s LYS 305 N 0.30 0.57 -0.13 1.98 -2.85 -0.36 -4.99 119.74 114.26 3it9 s LYS 305 Ca 0.27 -0.37 -0.06 0.00 -1.00 0.00 0.00 55.97 54.81 3it9 s LYS 305 Cb -0.16 -0.51 -0.04 0.00 -2.06 0.00 0.00 37.83 35.06 3it9 s LYS 305 CO 0.12 0.13 0.08 0.00 0.10 0.00 0.00 175.35 175.79 3it9 s ALA 306 N -0.43 3.60 0.27 0.59 0.00 -1.26 -0.91 121.76 123.63 3it9 s ALA 306 Ca 0.00 -0.71 0.02 0.00 0.00 0.00 0.00 51.96 51.27 3it9 s ALA 306 Cb -0.04 -1.84 -0.04 0.00 0.00 0.00 0.00 23.12 21.20 3it9 s ALA 306 CO -0.00 0.49 0.15 -1.12 0.00 0.00 0.00 175.76 175.27 3it9 s SER 307 N -0.59 1.16 0.05 0.00 0.01 0.14 -4.95 113.70 109.51 3it9 s SER 307 Ca 0.12 -1.49 -0.06 0.00 1.31 0.00 0.00 55.95 55.82 3it9 s SER 307 Cb -0.12 0.34 -0.01 0.00 0.21 0.00 0.00 66.02 66.45 3it9 s SER 307 CO 0.02 -0.85 0.12 -0.72 0.41 0.00 0.00 173.24 172.22 3it9 s TYR 308 N -3.75 0.20 0.09 2.43 1.13 -1.26 0.28 117.35 116.47 3it9 s TYR 308 Ca 0.37 -0.56 0.04 0.00 -1.41 0.00 0.00 57.07 55.52 3it9 s TYR 308 Cb 0.06 -0.13 -0.03 0.00 -1.10 0.00 0.00 41.96 40.76 3it9 s TYR 308 CO 0.16 -0.43 -0.11 0.95 -2.51 0.00 0.00 175.55 173.61 3it9 s THR 309 N -3.11 0.97 0.02 -3.49 -4.23 -0.55 -4.94 115.64 100.30 3it9 s THR 309 Ca -0.01 -1.49 -0.06 0.00 -1.18 0.00 0.00 61.69 58.95 3it9 s THR 309 Cb 0.02 -1.20 -0.05 0.00 1.34 0.00 0.00 72.50 72.61 3it9 s THR 309 CO -0.07 -0.44 0.28 -0.76 -0.54 0.00 0.00 174.62 173.09 3it9 s LEU 310 N -2.15 4.36 -0.00 4.79 1.43 -1.26 -1.57 118.68 124.28 3it9 s LEU 310 Ca 0.02 0.56 -0.15 0.00 -1.03 0.00 0.00 54.13 53.52 3it9 s LEU 310 Cb -0.06 -2.72 -0.09 0.00 0.03 0.00 0.00 46.19 43.35 3it9 s LEU 310 CO 0.01 0.24 0.85 0.71 0.23 0.00 0.00 176.35 178.39 3it9 h THR 311 N 2.96 0.00 -3.18 5.49 1.35 -1.16 -3.44 112.91 114.93 3it9 h THR 311 Ca -0.50 -0.25 -0.67 0.00 -0.55 0.00 0.00 66.41 64.44 3it9 h THR 311 Cb 1.19 0.00 -0.12 0.00 -1.73 0.00 0.00 68.15 67.49 3it9 h THR 311 CO 0.67 0.00 -0.59 -1.83 -0.25 0.00 0.00 175.52 173.51 3it9 s GLU 312 N -3.59 3.03 0.58 4.72 -1.05 -1.26 -5.02 118.70 116.11 3it9 s GLU 312 Ca -0.08 -0.44 0.31 0.00 -0.15 0.00 0.00 54.97 54.61 3it9 s GLU 312 Cb 0.01 -2.84 1.79 0.00 -0.44 0.00 0.00 34.13 32.65 3it9 s GLU 312 CO 0.24 0.68 2.22 -1.35 0.95 0.00 0.00 175.26 178.00 3it9 h PRO 313 N 4.65 0.00 -4.45 -4.83 0.11 -1.97 -3.40 132.00 122.10 3it9 h PRO 313 Ca -0.50 0.00 -0.62 0.00 0.11 0.00 0.00 66.00 64.99 3it9 h PRO 313 Cb 1.19 0.00 -0.38 0.00 0.11 0.00 0.00 31.00 31.92 3it9 h PRO 313 CO 0.58 0.03 -0.79 -0.65 -0.21 0.00 0.00 178.00 176.96 3it9 s GLN 314 N -4.44 1.76 0.23 1.05 -1.52 -1.26 -5.07 119.66 110.41 3it9 s GLN 314 Ca -0.04 -1.01 -0.30 0.00 -1.95 0.00 0.00 55.36 52.06 3it9 s GLN 314 Cb 0.14 -2.60 -0.09 0.00 -0.22 0.00 0.00 33.01 30.25 3it9 s GLN 314 CO 0.54 -0.57 1.17 -0.51 -0.25 0.00 0.00 175.29 175.67 3it9 s LEU 315 N 1.36 4.48 -0.01 2.90 1.02 -1.26 -5.00 118.68 122.17 3it9 s LEU 315 Ca -0.06 2.27 0.06 0.00 0.02 0.00 0.00 54.13 56.42 3it9 s LEU 315 Cb -0.19 -3.62 -0.02 0.00 0.02 0.00 0.00 46.19 42.39 3it9 s LEU 315 CO -0.06 -0.30 -0.18 0.42 0.02 0.00 0.00 176.35 176.25 3it9 s THR 316 N -0.50 1.40 0.99 5.49 -4.23 -1.26 -1.30 115.64 116.23 3it9 s THR 316 Ca 0.50 -0.81 -0.13 0.00 -1.18 0.00 0.00 61.69 60.07 3it9 s THR 316 Cb -0.33 -1.17 0.10 0.00 1.34 0.00 0.00 72.50 72.44 3it9 s THR 316 CO 0.39 0.35 0.57 0.00 -0.54 0.00 0.00 174.62 175.39 3it9 n ALA 317 N 2.53 -2.47 -1.67 3.99 0.00 -0.20 -4.53 120.51 118.16 3it9 n ALA 317 Ca -0.15 -0.76 -0.33 0.00 0.00 0.00 0.00 53.44 52.20 3it9 n ALA 317 Cb 0.54 -1.86 0.01 0.00 0.00 0.00 0.00 19.45 18.13 3it9 n ALA 317 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3it9 s PRO 318 N -3.91 3.32 0.06 0.00 0.04 -1.26 -4.90 135.00 128.35 3it9 s PRO 318 Ca 0.60 1.24 0.08 0.00 0.04 0.00 0.00 61.00 62.96 3it9 s PRO 318 Cb -0.20 -2.03 -0.03 0.00 0.04 0.00 0.00 34.50 32.28 3it9 s PRO 318 CO 0.65 -0.82 -0.21 -0.51 0.04 0.00 0.00 177.00 176.15 3it9 s LEU 319 N -4.42 2.21 0.00 -3.56 1.43 0.75 -4.98 118.68 110.11 3it9 s LEU 319 Ca 0.64 -0.57 0.07 0.00 -1.03 0.00 0.00 54.13 53.24 3it9 s LEU 319 Cb -0.17 -0.95 -0.03 0.00 0.03 0.00 0.00 46.19 45.08 3it9 s LEU 319 CO 0.36 0.13 -0.22 -0.75 0.23 0.00 0.00 176.35 176.09 3it9 s LYS 320 N -1.41 2.11 0.07 1.70 2.47 -1.26 -1.61 119.74 121.81 3it9 s LYS 320 Ca 0.07 -0.94 -0.34 0.00 -1.56 0.00 0.00 55.97 53.21 3it9 s LYS 320 Cb -0.09 -2.12 -0.13 0.00 -1.46 0.00 0.00 37.83 34.03 3it9 s LYS 320 CO 0.03 0.56 1.70 1.17 0.16 0.00 0.00 175.35 178.97 3it9 n LYS 321 N 2.07 2.22 0.00 4.03 4.81 -1.26 -1.60 118.16 128.43 3it9 n LYS 321 Ca -0.16 0.80 0.00 0.00 -0.87 0.00 0.00 58.31 58.08 3it9 n LYS 321 Cb 0.52 -2.61 0.00 0.00 0.02 0.00 0.00 35.03 32.96 3it9 n LYS 321 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3it9 n GLY 322 N 3.82 1.61 3.74 3.14 0.00 0.91 -4.98 105.19 113.43 3it9 n GLY 322 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 3it9 n GLY 322 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3it9 s GLN 323 N -0.88 4.35 0.03 1.61 0.74 -0.63 -4.66 119.66 120.23 3it9 s GLN 323 Ca 0.00 2.13 -0.11 0.00 0.05 0.00 0.00 55.36 57.43 3it9 s GLN 323 Cb 0.00 -3.17 -0.06 0.00 1.10 0.00 0.00 33.01 30.89 3it9 s GLN 323 CO 0.00 -0.30 0.38 0.54 -0.55 0.00 0.00 175.29 175.35 3it9 s VAL 324 N 0.08 5.12 0.00 1.34 0.11 -1.26 -0.65 120.40 125.13 3it9 s VAL 324 Ca 0.57 0.55 0.00 0.00 -2.93 0.00 0.00 61.98 60.17 3it9 s VAL 324 Cb -0.38 -3.64 0.00 0.00 -1.53 0.00 0.00 36.38 30.82 3it9 s VAL 324 CO 0.40 0.42 0.14 0.52 -3.33 0.00 0.00 175.10 173.25 3it9 n VAL 325 N 1.30 0.00 -3.63 2.04 0.31 -0.02 -4.98 118.33 113.36 3it9 n VAL 325 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 3it9 n VAL 325 Cb 0.53 1.57 0.00 0.00 -0.91 0.00 0.00 33.84 35.02 3it9 n VAL 325 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3it9 n GLY 326 N 0.00 -0.61 2.86 2.92 0.00 -1.18 -0.51 105.19 108.67 3it9 n GLY 326 Ca 0.00 -0.94 -0.19 0.00 0.00 0.00 0.00 46.02 44.89 3it9 n GLY 326 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3it9 s THR 327 N -3.00 0.38 -0.07 2.61 -4.23 -0.61 -0.99 115.64 109.72 3it9 s THR 327 Ca 0.00 -0.03 -0.29 0.00 -1.18 0.00 0.00 61.69 60.20 3it9 s THR 327 Cb 0.00 -0.44 -0.02 0.00 1.34 0.00 0.00 72.50 73.38 3it9 s THR 327 CO 0.00 0.19 0.95 -0.63 -0.54 0.00 0.00 174.62 174.59 3it9 s ILE 328 N 0.99 4.85 -0.26 2.99 1.01 0.28 -1.48 121.20 129.58 3it9 s ILE 328 Ca -0.10 1.94 -0.08 0.00 0.00 0.00 0.00 60.65 62.41 3it9 s ILE 328 Cb -0.14 -4.27 -0.03 0.00 0.01 0.00 0.00 42.46 38.03 3it9 s ILE 328 CO -0.01 0.08 0.09 -0.62 0.00 0.00 0.00 174.94 174.49 3it9 s ASP 329 N 1.04 5.31 -0.39 3.58 3.68 0.82 -1.23 116.67 129.49 3it9 s ASP 329 Ca 0.47 -0.17 -0.14 0.00 2.13 0.00 0.00 52.55 54.84 3it9 s ASP 329 Cb -0.19 -1.96 0.01 0.00 -1.45 0.00 0.00 42.92 39.32 3it9 s ASP 329 CO 0.21 -0.04 0.28 -0.36 0.13 0.00 0.00 175.17 175.39 3it9 s PHE 330 N 1.64 3.23 -0.12 -5.34 2.99 -0.52 0.26 117.98 120.13 3it9 s PHE 330 Ca 0.06 -0.44 -0.00 0.00 0.00 0.00 0.00 56.93 56.55 3it9 s PHE 330 Cb -0.15 -2.56 -0.02 0.00 0.00 0.00 0.00 43.02 40.29 3it9 s PHE 330 CO 0.05 -0.51 -0.11 -0.65 -0.00 0.00 0.00 175.22 174.00 3it9 s GLN 331 N 1.71 3.29 -0.35 0.44 -0.21 -0.08 -1.22 119.66 123.25 3it9 s GLN 331 Ca 0.06 -0.64 -0.10 0.00 0.02 0.00 0.00 55.36 54.70 3it9 s GLN 331 Cb -0.18 -2.66 0.02 0.00 1.00 0.00 0.00 33.01 31.18 3it9 s GLN 331 CO 0.10 0.31 0.17 -1.17 -2.12 0.00 0.00 175.29 172.58 3it9 s LEU 332 N 0.12 4.44 -1.41 2.90 2.96 0.59 -1.22 118.68 127.06 3it9 s LEU 332 Ca -0.05 -0.86 -0.03 0.00 -0.22 0.00 0.00 54.13 52.97 3it9 s LEU 332 Cb -0.14 -1.99 0.02 0.00 0.50 0.00 0.00 46.19 44.58 3it9 s LEU 332 CO 0.04 -0.31 0.60 0.59 -1.32 0.00 0.00 176.35 175.95 3it9 n ASN 333 N 4.96 -1.31 0.00 3.68 3.02 -0.94 -2.20 115.26 122.47 3it9 n ASN 333 Ca -0.13 -0.92 0.00 0.00 -0.03 0.00 0.00 54.58 53.50 3it9 n ASN 333 Cb 0.47 -3.45 0.00 0.00 -0.61 0.00 0.00 39.78 36.18 3it9 n ASN 333 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3it9 n GLY 334 N -1.77 1.20 3.17 7.41 0.00 -1.26 -5.02 105.19 108.91 3it9 n GLY 334 Ca -0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.48 3it9 n GLY 334 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3it9 s LYS 335 N -0.57 2.76 0.11 1.61 2.20 -0.93 -5.00 119.74 119.91 3it9 s LYS 335 Ca 0.00 -0.77 -0.31 0.00 -0.36 0.00 0.00 55.97 54.52 3it9 s LYS 335 Cb 0.00 -2.15 -0.08 0.00 -1.51 0.00 0.00 37.83 34.09 3it9 s LYS 335 CO 0.00 0.10 1.44 0.45 -0.36 0.00 0.00 175.35 176.98 3it9 s SER 336 N 0.53 6.77 0.00 1.43 0.15 -1.26 -0.30 113.70 121.02 3it9 s SER 336 Ca -0.15 2.38 0.00 0.00 0.70 0.00 0.00 55.95 58.88 3it9 s SER 336 Cb -0.17 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 3it9 s SER 336 CO 0.05 -0.70 0.31 2.30 1.20 0.00 0.00 173.24 176.40 3it9 n ILE 337 N 4.04 0.00 -3.64 6.45 -5.35 -0.35 -4.89 119.36 115.62 3it9 n ILE 337 Ca 0.12 -0.38 -0.06 0.00 -0.27 0.00 0.00 62.75 62.16 3it9 n ILE 337 Cb 0.42 1.19 -0.07 0.00 -1.74 0.00 0.00 39.64 39.44 3it9 n ILE 337 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 3it9 s GLU 338 N -0.14 0.29 -0.07 6.28 2.12 -1.21 -4.99 118.70 120.97 3it9 s GLU 338 Ca 0.00 0.30 0.01 0.00 0.36 0.00 0.00 54.97 55.64 3it9 s GLU 338 Cb 0.00 0.14 0.02 0.00 0.26 0.00 0.00 34.13 34.55 3it9 s GLU 338 CO 0.00 -0.04 -0.08 -1.14 -0.54 0.00 0.00 175.26 173.45 3it9 s GLN 339 N -0.02 1.37 0.09 4.30 0.74 -1.26 -1.44 119.66 123.44 3it9 s GLN 339 Ca 0.05 -0.27 0.03 0.00 0.05 0.00 0.00 55.36 55.22 3it9 s GLN 339 Cb -0.04 -1.27 -0.04 0.00 1.10 0.00 0.00 33.01 32.76 3it9 s GLN 339 CO -0.10 -0.08 -0.09 1.03 -0.55 0.00 0.00 175.29 175.50 3it9 s ARG 340 N 1.02 0.82 0.18 1.67 1.81 -0.37 -4.99 118.95 119.09 3it9 s ARG 340 Ca -0.08 -1.16 -0.31 0.00 -1.72 0.00 0.00 55.73 52.45 3it9 s ARG 340 Cb -0.15 -0.44 -0.10 0.00 -0.45 0.00 0.00 34.95 33.81 3it9 s ARG 340 CO -0.00 0.06 1.55 -2.14 -0.68 0.00 0.00 175.30 174.09 3it9 s PRO 341 N -2.90 4.22 -0.38 3.54 0.02 -1.26 0.98 135.00 139.22 3it9 s PRO 341 Ca 0.05 2.36 -0.29 0.00 0.02 0.00 0.00 61.00 63.14 3it9 s PRO 341 Cb -0.02 -3.15 0.02 0.00 0.02 0.00 0.00 34.50 31.38 3it9 s PRO 341 CO -0.01 -0.59 1.09 -1.17 -0.33 0.00 0.00 177.00 176.00 3it9 s LEU 342 N 0.96 3.83 0.20 -5.54 2.96 -0.17 -4.60 118.68 116.32 3it9 s LEU 342 Ca 0.69 0.83 0.09 0.00 -0.22 0.00 0.00 54.13 55.53 3it9 s LEU 342 Cb -0.44 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.67 3it9 s LEU 342 CO 0.33 -1.01 -0.11 0.27 -1.32 0.00 0.00 176.35 174.51 3it9 s ILE 343 N 3.93 3.07 0.11 6.68 -4.36 0.17 -0.84 121.20 129.96 3it9 s ILE 343 Ca 0.46 -1.79 -0.31 0.00 -0.26 0.00 0.00 60.65 58.75 3it9 s ILE 343 Cb -0.10 -2.54 -0.08 0.00 1.25 0.00 0.00 42.46 40.99 3it9 s ILE 343 CO 0.21 -0.16 1.44 -0.69 0.24 0.00 0.00 174.94 175.98 3it9 s VAL 344 N -1.83 3.21 -2.18 8.37 1.01 0.18 -1.06 120.40 128.09 3it9 s VAL 344 Ca 0.25 0.84 0.24 0.00 0.00 0.00 0.00 61.98 63.31 3it9 s VAL 344 Cb -0.08 -3.54 0.08 0.00 0.00 0.00 0.00 36.38 32.84 3it9 s VAL 344 CO 0.15 0.05 1.21 0.23 0.00 0.00 0.00 175.10 176.74 3it9 n MET 345 N 4.19 1.36 -3.60 2.72 0.00 -0.12 -0.06 117.12 121.61 3it9 n MET 345 Ca 0.12 -1.09 -0.15 0.00 0.00 0.00 0.00 57.70 56.59 3it9 n MET 345 Cb 0.42 -1.48 -0.06 0.00 0.00 0.00 0.00 33.22 32.10 3it9 n MET 345 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 175.97 174.14 3it9 s GLU 346 N -2.38 0.96 0.24 0.03 -1.05 -1.26 -4.92 118.70 110.33 3it9 s GLU 346 Ca 0.22 -0.12 -0.30 0.00 -0.15 0.00 0.00 54.97 54.62 3it9 s GLU 346 Cb 0.19 0.44 -0.09 0.00 -0.44 0.00 0.00 34.13 34.22 3it9 s GLU 346 CO 0.51 -0.32 1.31 -0.80 0.95 0.00 0.00 175.26 176.91 3it9 s ASN 347 N -1.67 6.86 -0.16 0.83 0.01 -1.26 -4.10 114.94 115.45 3it9 s ASN 347 Ca -0.08 2.50 0.01 0.00 -0.71 0.00 0.00 52.86 54.58 3it9 s ASN 347 Cb -0.01 -2.62 0.02 0.00 0.41 0.00 0.00 41.25 39.04 3it9 s ASN 347 CO 0.02 -0.53 -0.18 0.68 -1.51 0.00 0.00 177.10 175.59 3it9 s VAL 348 N -0.30 1.84 0.71 1.60 -7.23 -0.63 -4.98 120.40 111.40 3it9 s VAL 348 Ca 0.54 -0.81 -0.11 0.00 -1.81 0.00 0.00 61.98 59.79 3it9 s VAL 348 Cb -0.38 -1.68 0.02 0.00 0.56 0.00 0.00 36.38 34.90 3it9 s VAL 348 CO 0.43 0.50 1.07 -1.61 -0.31 0.00 0.00 175.10 175.18 3it9 s GLU 349 N 1.28 2.80 0.22 4.82 8.01 -1.26 -0.18 118.70 134.40 3it9 s GLU 349 Ca 0.03 1.01 -0.31 0.00 0.01 0.00 0.00 54.97 55.70 3it9 s GLU 349 Cb -0.13 -1.97 -0.14 0.00 -4.31 0.00 0.00 34.13 27.57 3it9 s GLU 349 CO -0.10 -1.21 1.29 0.39 0.01 0.00 0.00 175.26 175.64 3it9 n GLU 350 N -3.19 1.68 -1.14 1.61 1.02 -1.26 -1.10 120.64 118.26 3it9 n GLU 350 Ca 0.08 0.60 -0.34 0.00 -0.02 0.00 0.00 57.16 57.48 3it9 n GLU 350 Cb 0.53 -2.18 0.12 0.00 -0.02 0.00 0.00 31.44 29.90 3it9 n GLU 350 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3it9 n GLY 351 N 1.98 -0.32 0.00 0.62 0.00 0.05 -4.25 105.19 103.28 3it9 n GLY 351 Ca 0.12 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.67 3it9 n GLY 351 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93