#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iss s ASP 2 N 0.00 5.95 0.09 7.83 1.11 -1.26 -4.05 116.67 126.33 3iss s ASP 2 Ca 0.00 2.50 0.02 0.00 0.18 0.00 0.00 52.55 55.25 3iss s ASP 2 Cb 0.00 -2.62 -0.04 0.00 1.07 0.00 0.00 42.92 41.33 3iss s ASP 2 CO 0.00 -1.08 -0.08 -0.54 1.18 0.00 0.00 175.17 174.65 3iss s LYS 3 N -2.66 0.78 -0.18 8.23 1.02 -0.86 -3.29 119.74 122.78 3iss s LYS 3 Ca 0.64 -1.18 -0.07 0.00 0.02 0.00 0.00 55.97 55.38 3iss s LYS 3 Cb -0.34 -0.31 -0.04 0.00 -0.52 0.00 0.00 37.83 36.63 3iss s LYS 3 CO 0.41 0.02 0.05 -0.06 -0.92 0.00 0.00 175.35 174.85 3iss s PHE 4 N -2.91 3.22 -0.21 3.18 0.08 -0.74 -1.49 117.98 119.12 3iss s PHE 4 Ca 0.06 0.03 -0.09 0.00 0.12 0.00 0.00 56.93 57.05 3iss s PHE 4 Cb 0.00 -2.07 -0.05 0.00 -0.57 0.00 0.00 43.02 40.34 3iss s PHE 4 CO -0.02 0.13 0.11 0.50 -0.10 0.00 0.00 175.22 175.84 3iss s ARG 5 N 0.38 4.06 -0.01 0.44 3.52 0.17 -0.40 118.95 127.10 3iss s ARG 5 Ca 0.02 -0.29 0.05 0.00 -0.13 0.00 0.00 55.73 55.38 3iss s ARG 5 Cb -0.13 -3.38 -0.01 0.00 -1.56 0.00 0.00 34.95 29.87 3iss s ARG 5 CO 0.00 0.20 -0.16 0.08 -0.81 0.00 0.00 175.30 174.61 3iss s VAL 6 N 0.62 1.29 -0.15 7.11 1.01 0.52 -0.95 120.40 129.85 3iss s VAL 6 Ca 0.06 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.36 3iss s VAL 6 Cb -0.12 -1.07 0.01 0.00 0.00 0.00 0.00 36.38 35.19 3iss s VAL 6 CO 0.01 0.37 -0.21 -1.10 0.00 0.00 0.00 175.10 174.16 3iss s GLN 7 N -0.38 3.03 0.34 2.72 -1.52 -0.03 -0.82 119.66 123.00 3iss s GLN 7 Ca 0.06 -0.84 0.07 0.00 -1.95 0.00 0.00 55.36 52.70 3iss s GLN 7 Cb -0.06 -2.48 -0.03 0.00 -0.22 0.00 0.00 33.01 30.22 3iss s GLN 7 CO -0.01 -0.06 0.30 0.41 -0.25 0.00 0.00 175.29 175.68 3iss n GLY 8 N 4.20 2.85 3.84 3.09 0.00 -0.06 -4.16 105.19 114.95 3iss n GLY 8 Ca -0.20 -1.89 -0.32 0.00 0.00 0.00 0.00 46.02 43.62 3iss n GLY 8 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3iss s PRO 9 N -3.35 3.57 -0.15 1.61 0.04 -0.79 -1.18 135.00 134.75 3iss s PRO 9 Ca 0.40 0.94 -0.11 0.00 0.04 0.00 0.00 61.00 62.27 3iss s PRO 9 Cb 0.02 -2.08 0.04 0.00 0.04 0.00 0.00 34.50 32.53 3iss s PRO 9 CO 0.28 -0.59 0.38 -0.08 0.04 0.00 0.00 177.00 177.04 3iss s THR 10 N -2.82 -0.01 -0.31 1.26 -1.32 -0.50 -4.99 115.64 106.94 3iss s THR 10 Ca 0.58 0.04 -0.15 0.00 -1.21 0.00 0.00 61.69 60.95 3iss s THR 10 Cb -0.12 -0.55 -0.02 0.00 -1.51 0.00 0.00 72.50 70.30 3iss s THR 10 CO 0.43 0.02 0.39 -0.75 -2.21 0.00 0.00 174.62 172.50 3iss s LYS 11 N 0.68 3.78 -0.29 7.08 2.20 -1.26 -4.57 119.74 127.36 3iss s LYS 11 Ca -0.04 -0.17 -0.24 0.00 -0.36 0.00 0.00 55.97 55.17 3iss s LYS 11 Cb -0.05 -3.74 -0.00 0.00 -1.51 0.00 0.00 37.83 32.53 3iss s LYS 11 CO -0.05 -0.43 0.80 -0.51 -0.36 0.00 0.00 175.35 174.80 3iss s LEU 12 N 2.10 4.08 0.08 5.43 1.43 -1.26 -4.72 118.68 125.81 3iss s LEU 12 Ca 0.14 0.76 -0.17 0.00 -1.03 0.00 0.00 54.13 53.84 3iss s LEU 12 Cb -0.16 -3.11 0.03 0.00 0.03 0.00 0.00 46.19 42.99 3iss s LEU 12 CO 0.11 -0.59 0.40 0.00 0.23 0.00 0.00 176.35 176.51 3iss s GLN 13 N 2.93 0.98 0.00 1.70 -2.07 -0.51 -3.54 119.66 119.15 3iss s GLN 13 Ca 0.33 -0.51 0.00 0.00 -1.82 0.00 0.00 55.36 53.36 3iss s GLN 13 Cb -0.14 0.43 0.00 0.00 -1.09 0.00 0.00 33.01 32.21 3iss s GLN 13 CO 0.11 -0.36 0.00 0.41 -1.32 0.00 0.00 175.29 174.14 3iss n GLY 14 N 0.20 0.25 3.20 2.60 0.00 -0.63 -4.46 105.19 106.36 3iss n GLY 14 Ca -0.17 -1.65 -0.12 0.00 0.00 0.00 0.00 46.02 44.07 3iss n GLY 14 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3iss s GLU 15 N -0.86 1.07 -0.05 1.61 -1.05 -1.26 -1.67 118.70 116.48 3iss s GLU 15 Ca 0.00 -1.53 -0.09 0.00 -0.15 0.00 0.00 54.97 53.21 3iss s GLU 15 Cb 0.00 0.02 0.02 0.00 -0.44 0.00 0.00 34.13 33.73 3iss s GLU 15 CO 0.00 -0.24 0.22 0.54 0.95 0.00 0.00 175.26 176.73 3iss s VAL 16 N -3.90 0.03 -0.24 1.83 0.11 -0.48 -4.81 120.40 112.93 3iss s VAL 16 Ca 0.27 -0.25 -0.12 0.00 -2.93 0.00 0.00 61.98 58.96 3iss s VAL 16 Cb 0.07 -0.39 -0.05 0.00 -1.53 0.00 0.00 36.38 34.48 3iss s VAL 16 CO 0.05 -0.14 0.21 -0.89 -3.33 0.00 0.00 175.10 171.00 3iss s THR 17 N -0.48 5.32 0.02 5.04 2.01 -1.26 -0.35 115.64 125.95 3iss s THR 17 Ca -0.06 0.27 -0.30 0.00 0.31 0.00 0.00 61.69 61.91 3iss s THR 17 Cb -0.04 -3.55 -0.05 0.00 0.01 0.00 0.00 72.50 68.88 3iss s THR 17 CO 0.01 0.31 1.23 -0.63 -0.69 0.00 0.00 174.62 174.85 3iss s ILE 18 N 1.27 4.03 0.89 1.82 -1.09 0.17 -4.93 121.20 123.35 3iss s ILE 18 Ca 0.09 1.43 -0.12 0.00 -2.23 0.00 0.00 60.65 59.82 3iss s ILE 18 Cb -0.14 -3.92 0.12 0.00 -1.58 0.00 0.00 42.46 36.95 3iss s ILE 18 CO 0.06 0.06 1.15 -0.44 -1.23 0.00 0.00 174.94 174.55 3iss s SER 19 N 1.29 3.76 0.59 3.58 0.01 -1.26 -4.83 113.70 116.83 3iss s SER 19 Ca 0.59 0.90 -0.19 0.00 1.31 0.00 0.00 55.95 58.56 3iss s SER 19 Cb -0.29 -1.44 -0.04 0.00 0.21 0.00 0.00 66.02 64.46 3iss s SER 19 CO 0.27 -2.39 1.23 -0.83 0.41 0.00 0.00 173.24 171.93 3iss s GLY 20 N -4.19 2.78 -0.08 3.44 0.00 -1.23 -1.81 107.32 106.23 3iss s GLY 20 Ca 0.63 1.07 -0.29 0.00 0.00 0.00 0.00 44.72 46.13 3iss s GLY 20 CO 0.52 1.48 1.90 0.00 0.00 0.00 0.00 173.10 177.01 3iss s ALA 21 N -1.53 3.34 0.24 3.20 0.00 0.18 -4.31 121.76 122.89 3iss s ALA 21 Ca 0.77 0.98 -0.04 0.00 0.00 0.00 0.00 51.96 53.66 3iss s ALA 21 Cb -0.32 -3.88 0.42 0.00 0.00 0.00 0.00 23.12 19.33 3iss s ALA 21 CO 0.35 -1.88 1.78 -0.22 0.00 0.00 0.00 175.76 175.79 3iss h LYS 22 N 11.41 0.63 -0.11 0.00 3.64 -1.91 -0.58 116.57 129.66 3iss h LYS 22 Ca -0.43 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 3iss h LYS 22 Cb 1.21 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 3iss h LYS 22 CO 0.96 0.42 0.00 0.09 -2.27 0.00 0.00 179.45 178.65 3iss n ASN 23 N -4.84 0.97 -0.12 4.20 3.02 -1.26 -1.77 115.26 115.45 3iss n ASN 23 Ca 0.14 -1.66 -0.21 0.00 -0.03 0.00 0.00 54.58 52.81 3iss n ASN 23 Cb 0.33 -0.07 -0.11 0.00 -0.61 0.00 0.00 39.78 39.32 3iss n ASN 23 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3iss n ALA 24 N -0.11 1.42 -0.15 5.41 0.00 -0.68 -4.41 120.51 121.98 3iss n ALA 24 Ca 0.14 -1.04 -0.03 0.00 0.00 0.00 0.00 53.44 52.51 3iss n ALA 24 Cb 0.21 0.02 0.06 0.00 0.00 0.00 0.00 19.45 19.73 3iss n ALA 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iss h ALA 25 N -0.34 0.48 0.19 0.00 0.00 -1.00 -2.26 119.26 116.33 3iss h ALA 25 Ca -0.59 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 3iss h ALA 25 Cb 1.75 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.74 3iss h ALA 25 CO -0.20 -0.36 -0.09 -0.07 0.00 0.00 0.00 179.25 178.52 3iss h LEU 26 N 0.15 -0.23 -1.06 0.00 4.07 -1.58 0.14 115.31 116.80 3iss h LEU 26 Ca 0.24 0.01 -0.08 0.00 0.08 0.00 0.00 57.88 58.13 3iss h LEU 26 Cb 0.35 0.06 -0.02 0.00 1.08 0.00 0.00 40.66 42.14 3iss h LEU 26 CO -0.37 -0.16 -0.16 -0.65 -1.08 0.00 0.00 178.44 176.02 3iss h PRO 27 N -0.26 0.48 -0.23 1.13 0.11 -1.75 -2.84 132.00 128.64 3iss h PRO 27 Ca -0.02 -0.15 -0.04 0.00 0.11 0.00 0.00 66.00 65.89 3iss h PRO 27 Cb 0.20 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.26 3iss h PRO 27 CO 0.04 0.63 -0.03 0.82 -0.21 0.00 0.00 178.00 179.25 3iss h ILE 28 N 0.44 1.27 -0.91 4.15 2.04 -1.09 -0.11 117.51 123.30 3iss h ILE 28 Ca 0.08 -0.98 0.18 0.00 1.00 0.00 0.00 64.86 65.13 3iss h ILE 28 Cb 0.54 1.45 -0.07 0.00 -0.74 0.00 0.00 36.82 38.00 3iss h ILE 28 CO 0.03 0.30 0.59 -0.07 0.00 0.00 0.00 178.15 179.01 3iss h LEU 29 N 0.18 0.58 0.00 1.44 4.07 -0.86 -1.40 115.31 119.32 3iss h LEU 29 Ca 0.06 0.05 -0.19 0.00 0.08 0.00 0.00 57.88 57.88 3iss h LEU 29 Cb 0.47 -0.06 -0.03 0.00 1.08 0.00 0.00 40.66 42.12 3iss h LEU 29 CO 0.02 0.25 -0.93 -0.26 -1.08 0.00 0.00 178.44 176.44 3iss h PHE 30 N 0.59 0.00 0.00 1.13 0.04 -1.24 -3.09 116.94 114.37 3iss h PHE 30 Ca 0.48 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 61.25 3iss h PHE 30 Cb 0.93 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.08 3iss h PHE 30 CO -0.00 0.88 -0.00 0.00 -0.60 0.00 0.00 178.31 178.58 3iss h ALA 31 N 1.12 1.00 0.00 2.45 0.00 -0.02 -2.73 119.26 121.09 3iss h ALA 31 Ca -0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3iss h ALA 31 Cb 1.69 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.48 3iss h ALA 31 CO 0.11 0.00 -0.06 0.00 0.00 0.00 0.00 179.25 179.30 3iss h ALA 32 N 2.00 1.11 -0.04 0.00 0.00 -1.21 -1.55 119.26 119.57 3iss h ALA 32 Ca -0.00 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.87 3iss h ALA 32 Cb 0.54 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3iss h ALA 32 CO 0.00 0.08 0.14 -0.07 0.00 0.00 0.00 179.25 179.40 3iss h LEU 33 N 0.00 0.00 -0.43 0.00 3.38 -1.64 -0.40 115.31 116.22 3iss h LEU 33 Ca -0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 3iss h LEU 33 Cb 0.33 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 3iss h LEU 33 CO 0.01 0.00 -0.41 -0.07 0.09 0.00 0.00 178.44 178.06 3iss h LEU 34 N 0.00 0.00 -9.73 1.67 3.38 -1.50 -3.47 115.31 105.66 3iss h LEU 34 Ca 0.02 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.48 3iss h LEU 34 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3iss h LEU 34 CO -0.00 0.41 0.45 0.00 0.09 0.00 0.00 178.44 179.39 3iss s ALA 35 N -3.24 3.37 -1.60 1.53 0.00 -0.16 -4.42 121.76 117.23 3iss s ALA 35 Ca 0.02 0.80 0.17 0.00 0.00 0.00 0.00 51.96 52.95 3iss s ALA 35 Cb 0.09 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.90 3iss s ALA 35 CO 0.71 -0.10 0.90 0.39 0.00 0.00 0.00 175.76 177.66 3iss n GLU 36 N 1.78 1.60 -4.45 0.00 1.02 -0.26 -4.39 120.64 115.95 3iss n GLU 36 Ca 0.00 -0.89 -0.24 0.00 -0.02 0.00 0.00 57.16 56.02 3iss n GLU 36 Cb 0.46 -1.31 -0.10 0.00 -0.02 0.00 0.00 31.44 30.47 3iss n GLU 36 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3iss s GLU 37 N -1.94 1.63 0.72 3.49 0.41 -1.23 -4.72 118.70 117.04 3iss s GLU 37 Ca 0.15 -1.72 -0.16 0.00 -0.41 0.00 0.00 54.97 52.83 3iss s GLU 37 Cb 0.14 -1.72 0.01 0.00 -1.78 0.00 0.00 34.13 30.78 3iss s GLU 37 CO 0.41 0.33 1.05 -2.30 -0.49 0.00 0.00 175.26 174.26 3iss n PRO 38 N -0.47 0.58 -4.03 0.39 -0.02 -1.26 -4.02 135.00 126.17 3iss n PRO 38 Ca -0.06 0.26 -0.10 0.00 -2.02 0.00 0.00 63.50 61.57 3iss n PRO 38 Cb 0.59 -2.30 -0.11 0.00 -0.02 0.00 0.00 33.50 31.67 3iss n PRO 38 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3iss s VAL 39 N -1.77 0.31 -0.11 -1.45 0.11 -0.10 -2.31 120.40 115.08 3iss s VAL 39 Ca 0.75 -1.07 0.00 0.00 -2.93 0.00 0.00 61.98 58.73 3iss s VAL 39 Cb -0.35 -0.53 0.02 0.00 -1.53 0.00 0.00 36.38 33.99 3iss s VAL 39 CO 0.49 -0.50 -0.09 -0.70 -3.33 0.00 0.00 175.10 170.96 3iss s GLU 40 N -1.76 1.66 -0.25 1.54 2.12 -0.34 -1.16 118.70 120.51 3iss s GLU 40 Ca -0.11 -0.32 -0.08 0.00 0.36 0.00 0.00 54.97 54.81 3iss s GLU 40 Cb -0.08 -1.61 -0.04 0.00 0.26 0.00 0.00 34.13 32.66 3iss s GLU 40 CO -0.01 -0.20 0.10 0.42 -0.54 0.00 0.00 175.26 175.03 3iss s ILE 41 N 1.46 4.64 0.19 -3.70 1.09 -0.22 -1.79 121.20 122.87 3iss s ILE 41 Ca 0.01 -0.06 0.04 0.00 -1.10 0.00 0.00 60.65 59.53 3iss s ILE 41 Cb -0.13 -3.17 -0.03 0.00 -1.06 0.00 0.00 42.46 38.06 3iss s ILE 41 CO -0.06 0.33 0.32 -1.10 -0.10 0.00 0.00 174.94 174.33 3iss s GLN 42 N 1.46 3.44 -1.05 2.79 -0.21 0.12 -0.96 119.66 125.26 3iss s GLN 42 Ca 0.06 -0.67 -0.06 0.00 0.02 0.00 0.00 55.36 54.71 3iss s GLN 42 Cb -0.15 -2.93 0.01 0.00 1.00 0.00 0.00 33.01 30.94 3iss s GLN 42 CO 0.05 0.48 0.91 -1.71 -2.12 0.00 0.00 175.29 172.90 3iss n ASN 43 N -0.92 -4.82 -4.71 5.90 5.15 -1.20 -1.98 115.26 112.67 3iss n ASN 43 Ca -0.08 -0.44 -0.38 0.00 -0.60 0.00 0.00 54.58 53.09 3iss n ASN 43 Cb 0.55 -4.08 -0.06 0.00 -0.53 0.00 0.00 39.78 35.66 3iss n ASN 43 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3iss s VAL 44 N -3.26 5.18 0.51 3.44 1.01 -1.08 -3.52 120.40 122.68 3iss s VAL 44 Ca 0.38 0.94 -0.22 0.00 0.00 0.00 0.00 61.98 63.08 3iss s VAL 44 Cb -0.17 -3.82 -0.06 0.00 0.00 0.00 0.00 36.38 32.34 3iss s VAL 44 CO 0.57 0.31 1.24 -2.16 0.00 0.00 0.00 175.10 175.06 3iss s PRO 45 N 0.75 3.45 -0.90 2.72 0.04 -1.26 -4.83 135.00 134.98 3iss s PRO 45 Ca 0.26 1.93 -0.19 0.00 0.04 0.00 0.00 61.00 63.04 3iss s PRO 45 Cb -0.15 -2.29 0.12 0.00 0.04 0.00 0.00 34.50 32.22 3iss s PRO 45 CO 0.10 -0.85 1.10 0.15 0.04 0.00 0.00 177.00 177.55 3iss s LYS 46 N -2.85 3.54 0.13 4.56 1.02 -1.26 -4.85 119.74 120.04 3iss s LYS 46 Ca 0.68 -1.66 0.06 0.00 0.02 0.00 0.00 55.97 55.07 3iss s LYS 46 Cb -0.33 -4.84 -0.04 0.00 -0.52 0.00 0.00 37.83 32.10 3iss s LYS 46 CO 0.39 -1.77 -0.14 -0.51 -0.92 0.00 0.00 175.35 172.40 3iss s LEU 47 N 2.83 2.43 0.36 3.17 1.43 -1.26 -4.48 118.68 123.15 3iss s LEU 47 Ca 0.31 -0.85 0.05 0.00 -1.03 0.00 0.00 54.13 52.61 3iss s LEU 47 Cb -0.06 -0.54 0.67 0.00 0.03 0.00 0.00 46.19 46.29 3iss s LEU 47 CO -0.07 -0.17 1.93 0.50 0.23 0.00 0.00 176.35 178.77 3iss h LYS 48 N 3.35 0.56 -0.31 1.70 3.64 -1.63 -2.13 116.57 121.76 3iss h LYS 48 Ca -0.39 -0.09 -0.05 0.00 -1.27 0.00 0.00 60.65 58.85 3iss h LYS 48 Cb 1.20 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.90 3iss h LYS 48 CO 0.53 0.50 -0.03 -0.44 -2.27 0.00 0.00 179.45 177.74 3iss h ASP 49 N 0.55 0.45 -0.31 4.20 5.19 -1.82 -1.78 116.42 122.91 3iss h ASP 49 Ca 0.13 -0.09 -0.12 0.00 -0.62 0.00 0.00 57.03 56.34 3iss h ASP 49 Cb 0.19 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 39.57 3iss h ASP 49 CO -0.01 0.54 -0.27 0.58 -3.12 0.00 0.00 179.24 176.97 3iss h VAL 50 N 0.46 1.30 -0.15 -1.35 2.07 -1.72 -2.42 116.25 114.44 3iss h VAL 50 Ca 0.10 -1.43 0.05 0.00 0.82 0.00 0.00 66.70 66.24 3iss h VAL 50 Cb 0.35 1.53 -0.05 0.00 -1.52 0.00 0.00 31.29 31.60 3iss h VAL 50 CO 0.01 0.46 -0.16 0.44 0.02 0.00 0.00 177.57 178.34 3iss h ASP 51 N 0.48 -0.50 -0.87 0.57 3.32 -1.12 -0.65 116.42 117.64 3iss h ASP 51 Ca 0.05 0.10 0.04 0.00 0.02 0.00 0.00 57.03 57.24 3iss h ASP 51 Cb 0.83 0.24 -0.05 0.00 0.22 0.00 0.00 39.33 40.57 3iss h ASP 51 CO 0.07 -0.20 0.57 0.74 -1.72 0.00 0.00 179.24 178.70 3iss h THR 52 N -0.19 1.14 -0.21 0.35 2.02 -1.34 0.62 112.91 115.31 3iss h THR 52 Ca 0.10 -0.37 -0.02 0.00 0.77 0.00 0.00 66.41 66.90 3iss h THR 52 Cb 0.34 -0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.70 3iss h THR 52 CO -0.27 0.20 0.06 0.28 0.37 0.00 0.00 175.52 176.17 3iss h SER 53 N 1.08 0.31 -0.34 4.18 0.02 -0.90 -1.70 113.55 116.20 3iss h SER 53 Ca 0.35 -0.21 0.01 0.00 -0.84 0.00 0.00 61.79 61.10 3iss h SER 53 Cb 0.04 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 3iss h SER 53 CO -0.11 0.44 0.21 0.24 -1.14 0.00 0.00 176.83 176.47 3iss h MET 54 N 0.17 0.42 -0.96 3.45 2.07 -0.40 0.36 114.93 120.05 3iss h MET 54 Ca 0.07 -0.03 0.14 0.00 -2.07 0.00 0.00 59.70 57.82 3iss h MET 54 Cb 0.24 -0.09 -0.09 0.00 -1.87 0.00 0.00 31.60 29.78 3iss h MET 54 CO -0.00 0.28 0.57 -0.22 1.07 0.00 0.00 176.91 178.61 3iss h LYS 55 N 0.43 0.82 -0.03 1.72 1.63 -0.78 0.14 116.57 120.50 3iss h LYS 55 Ca 0.13 -0.05 -0.03 0.00 -0.85 0.00 0.00 60.65 59.85 3iss h LYS 55 Cb -0.02 -0.18 0.00 0.00 -0.60 0.00 0.00 32.23 31.42 3iss h LYS 55 CO -0.05 0.54 -0.08 1.25 -3.45 0.00 0.00 179.45 177.66 3iss h LEU 56 N 0.84 0.13 -0.31 5.20 5.85 -0.45 -2.23 115.31 124.34 3iss h LEU 56 Ca 0.50 -0.61 0.07 0.00 0.84 0.00 0.00 57.88 58.68 3iss h LEU 56 Cb 0.62 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.54 3iss h LEU 56 CO -0.32 0.71 -0.27 -0.07 -0.34 0.00 0.00 178.44 178.16 3iss h LEU 57 N -0.46 -0.89 -0.59 2.25 4.07 -0.53 -1.24 115.31 117.93 3iss h LEU 57 Ca -0.00 0.16 0.09 0.00 0.08 0.00 0.00 57.88 58.20 3iss h LEU 57 Cb 0.70 0.42 -0.07 0.00 1.08 0.00 0.00 40.66 42.79 3iss h LEU 57 CO 0.02 -0.30 0.23 -1.28 -1.08 0.00 0.00 178.44 176.04 3iss h SER 58 N -0.25 0.25 -0.17 -0.43 0.87 -1.03 -1.34 113.55 111.46 3iss h SER 58 Ca 0.15 0.07 0.01 0.00 -1.23 0.00 0.00 61.79 60.80 3iss h SER 58 Cb 0.49 0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.49 3iss h SER 58 CO -0.45 0.16 0.11 -0.61 -0.53 0.00 0.00 176.83 175.51 3iss h GLN 59 N 0.42 0.18 0.00 2.24 4.15 -0.69 0.21 115.11 121.63 3iss h GLN 59 Ca 0.29 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.70 3iss h GLN 59 Cb 0.34 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 27.99 3iss h GLN 59 CO -0.28 0.12 0.00 1.28 -1.93 0.00 0.00 178.83 178.02 3iss n LEU 60 N -4.51 0.35 0.00 -2.39 4.77 -0.55 -4.81 117.00 109.87 3iss n LEU 60 Ca -0.00 0.55 0.00 0.00 -0.03 0.00 0.00 56.01 56.53 3iss n LEU 60 Cb 0.11 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 3iss n LEU 60 CO 0.34 -0.20 0.00 0.61 -1.33 0.00 0.00 177.39 176.82 3iss n GLY 61 N 0.90 1.05 3.84 -0.72 0.00 0.06 -2.16 105.19 108.16 3iss n GLY 61 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 3iss n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iss s ALA 62 N -2.00 3.07 -0.31 4.61 0.00 -0.91 -3.84 121.76 122.37 3iss s ALA 62 Ca 0.00 0.21 -0.17 0.00 0.00 0.00 0.00 51.96 52.00 3iss s ALA 62 Cb 0.00 -3.12 -0.02 0.00 0.00 0.00 0.00 23.12 19.99 3iss s ALA 62 CO 0.00 -0.17 0.47 0.15 0.00 0.00 0.00 175.76 176.21 3iss s LYS 63 N -3.93 3.80 -0.02 0.00 3.01 0.67 -4.15 119.74 119.13 3iss s LYS 63 Ca 0.59 -0.03 0.04 0.00 -1.01 0.00 0.00 55.97 55.56 3iss s LYS 63 Cb -0.10 -3.74 -0.01 0.00 -1.01 0.00 0.00 37.83 32.98 3iss s LYS 63 CO 0.28 -0.49 -0.12 0.08 0.51 0.00 0.00 175.35 175.61 3iss s VAL 64 N 2.28 0.97 0.11 3.17 1.01 -1.26 -0.15 120.40 126.53 3iss s VAL 64 Ca 0.18 -0.51 -0.17 0.00 0.00 0.00 0.00 61.98 61.48 3iss s VAL 64 Cb -0.16 -0.82 0.04 0.00 0.00 0.00 0.00 36.38 35.44 3iss s VAL 64 CO 0.12 0.28 0.43 -1.83 0.00 0.00 0.00 175.10 174.10 3iss s GLU 65 N -0.17 1.07 -0.19 2.72 -1.05 -0.73 -5.00 118.70 115.36 3iss s GLU 65 Ca 0.03 -0.61 -0.14 0.00 -0.15 0.00 0.00 54.97 54.10 3iss s GLU 65 Cb -0.06 0.48 0.06 0.00 -0.44 0.00 0.00 34.13 34.16 3iss s GLU 65 CO -0.00 -0.42 0.48 -0.98 0.95 0.00 0.00 175.26 175.29 3iss s ARG 66 N -3.55 0.52 0.00 -4.83 1.70 -1.26 -0.26 118.95 111.27 3iss s ARG 66 Ca 0.01 0.78 0.00 0.00 -0.47 0.00 0.00 55.73 56.05 3iss s ARG 66 Cb 0.01 0.15 0.00 0.00 -0.57 0.00 0.00 34.95 34.54 3iss s ARG 66 CO -0.10 -0.11 0.00 -3.47 -1.08 0.00 0.00 175.30 170.54 3iss n ASP 67 N 3.53 0.00 0.03 -2.89 -0.08 -1.26 -5.00 116.55 110.88 3iss n ASP 67 Ca -0.18 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 52.97 3iss n ASP 67 Cb 0.56 0.00 -0.14 0.00 2.34 0.00 0.00 41.12 43.89 3iss n ASP 67 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 3iss h GLY 68 N 0.00 0.14 -1.30 0.27 0.00 -1.96 -3.51 103.07 96.71 3iss h GLY 68 Ca 0.00 -0.35 -0.64 0.00 0.00 0.00 0.00 47.33 46.34 3iss h GLY 68 CO 0.00 0.31 -0.56 -0.56 0.00 0.00 0.00 176.54 175.73 3iss s SER 69 N -6.63 4.02 -0.07 0.19 0.01 -1.26 -2.64 113.70 107.33 3iss s SER 69 Ca -0.07 -1.42 0.04 0.00 1.31 0.00 0.00 55.95 55.81 3iss s SER 69 Cb 0.08 -0.12 -0.00 0.00 0.21 0.00 0.00 66.02 66.18 3iss s SER 69 CO 0.83 -0.59 -0.21 -0.69 0.41 0.00 0.00 173.24 172.99 3iss s VAL 70 N -2.75 1.76 -0.21 3.43 1.01 -0.13 -4.39 120.40 119.12 3iss s VAL 70 Ca 0.27 -0.88 -0.06 0.00 0.00 0.00 0.00 61.98 61.32 3iss s VAL 70 Cb 0.07 -1.52 -0.03 0.00 0.00 0.00 0.00 36.38 34.90 3iss s VAL 70 CO 0.14 0.50 0.02 -1.00 0.00 0.00 0.00 175.10 174.75 3iss s HIS 71 N 0.15 3.06 -0.11 5.22 3.76 0.64 -1.06 115.29 126.95 3iss s HIS 71 Ca -0.10 -0.43 0.02 0.00 -0.15 0.00 0.00 55.06 54.41 3iss s HIS 71 Cb -0.15 -2.12 0.01 0.00 1.11 0.00 0.00 32.58 31.44 3iss s HIS 71 CO 0.05 -0.25 -0.18 0.42 -0.85 0.00 0.00 174.74 173.94 3iss s ILE 72 N 1.10 1.65 -0.32 0.60 1.01 -0.31 -1.77 121.20 123.15 3iss s ILE 72 Ca 0.03 -0.75 0.01 0.00 0.00 0.00 0.00 60.65 59.94 3iss s ILE 72 Cb -0.14 -1.48 0.08 0.00 0.01 0.00 0.00 42.46 40.93 3iss s ILE 72 CO 0.02 0.47 0.03 -0.62 0.00 0.00 0.00 174.94 174.84 3iss s ASP 73 N 0.81 4.81 -0.25 3.58 -1.08 0.78 -0.93 116.67 124.40 3iss s ASP 73 Ca -0.10 -1.76 0.13 0.00 -0.52 0.00 0.00 52.55 50.31 3iss s ASP 73 Cb -0.16 -1.66 0.67 0.00 -1.46 0.00 0.00 42.92 40.31 3iss s ASP 73 CO 0.01 -0.34 1.63 0.00 0.52 0.00 0.00 175.17 176.98 3iss n ALA 74 N 4.44 3.80 -0.12 3.66 0.00 -1.26 -0.24 120.51 130.78 3iss n ALA 74 Ca -0.05 -2.29 -0.13 0.00 0.00 0.00 0.00 53.44 50.97 3iss n ALA 74 Cb 0.42 -0.98 -0.02 0.00 0.00 0.00 0.00 19.45 18.87 3iss n ALA 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iss h ARG 75 N 2.57 0.86 -0.86 0.00 3.08 -1.85 -3.26 114.38 114.93 3iss h ARG 75 Ca 0.09 -0.42 -0.25 0.00 0.07 0.00 0.00 59.98 59.47 3iss h ARG 75 Cb 1.86 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 31.76 3iss h ARG 75 CO 0.46 1.07 0.32 -0.25 -1.07 0.00 0.00 179.97 180.49 3iss n ASP 76 N -4.16 4.16 -4.70 7.04 8.00 -1.26 -4.93 116.55 120.68 3iss n ASP 76 Ca -0.02 -3.10 -0.42 0.00 0.71 0.00 0.00 54.79 51.96 3iss n ASP 76 Cb 0.49 -0.73 -0.03 0.00 -0.02 0.00 0.00 41.12 40.83 3iss n ASP 76 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3iss s VAL 77 N -2.61 2.70 0.00 2.53 1.01 -1.23 -4.68 120.40 118.11 3iss s VAL 77 Ca 0.46 0.34 0.00 0.00 0.00 0.00 0.00 61.98 62.78 3iss s VAL 77 Cb 0.37 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 33.54 3iss s VAL 77 CO 0.11 0.01 0.00 -0.46 0.00 0.00 0.00 175.10 174.76 3iss n ASN 78 N 4.92 0.00 -4.34 3.32 6.94 -0.92 -5.00 115.26 120.17 3iss n ASN 78 Ca 0.16 -0.78 -0.29 0.00 -0.02 0.00 0.00 54.58 53.65 3iss n ASN 78 Cb 0.39 0.00 -0.14 0.00 -2.36 0.00 0.00 39.78 37.67 3iss n ASN 78 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 3iss s VAL 79 N 0.00 2.08 -0.12 3.53 0.11 -1.00 -5.06 120.40 119.95 3iss s VAL 79 Ca 0.00 -1.50 0.17 0.00 -2.93 0.00 0.00 61.98 57.72 3iss s VAL 79 Cb 0.00 -1.81 0.41 0.00 -1.53 0.00 0.00 36.38 33.45 3iss s VAL 79 CO 0.00 0.21 1.19 0.49 -3.33 0.00 0.00 175.10 173.67 3iss n PHE 80 N 1.43 0.00 -4.63 1.54 3.72 -1.26 -4.69 117.46 113.56 3iss n PHE 80 Ca -0.18 -1.05 -0.25 0.00 -0.05 0.00 0.00 57.45 55.93 3iss n PHE 80 Cb 0.53 -0.20 -0.16 0.00 -0.94 0.00 0.00 39.48 38.70 3iss n PHE 80 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3iss s ALA 82 N 0.56 3.53 0.65 0.00 0.00 0.40 -4.89 121.76 122.01 3iss s ALA 82 Ca -0.13 -2.05 -0.14 0.00 0.00 0.00 0.00 51.96 49.64 3iss s ALA 82 Cb -0.15 -3.13 -0.01 0.00 0.00 0.00 0.00 23.12 19.82 3iss s ALA 82 CO 0.04 -1.79 1.07 -1.25 0.00 0.00 0.00 175.76 173.82 3iss s PRO 83 N 1.84 3.04 0.17 0.00 0.04 -1.26 -2.35 135.00 136.47 3iss s PRO 83 Ca 0.06 1.18 -0.21 0.00 0.04 0.00 0.00 61.00 62.07 3iss s PRO 83 Cb -0.23 -2.00 0.07 0.00 0.04 0.00 0.00 34.50 32.39 3iss s PRO 83 CO 0.08 -1.03 1.62 -0.92 0.04 0.00 0.00 177.00 176.78 3iss h TYR 84 N -0.04 -0.69 0.00 0.56 3.20 -1.97 -0.16 116.97 117.87 3iss h TYR 84 Ca -0.46 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.46 3iss h TYR 84 Cb 1.22 0.36 0.00 0.00 1.54 0.00 0.00 36.73 39.85 3iss h TYR 84 CO 0.59 -0.33 0.26 -0.44 -1.64 0.00 0.00 178.16 176.59 3iss h ASP 85 N -0.20 0.00 0.00 -2.11 5.19 -2.01 -2.02 116.42 115.26 3iss h ASP 85 Ca 0.18 0.00 -0.24 0.00 -0.62 0.00 0.00 57.03 56.35 3iss h ASP 85 Cb 0.49 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.95 3iss h ASP 85 CO -0.49 0.00 -1.91 -0.11 -3.12 0.00 0.00 179.24 173.61 3iss n LEU 86 N -2.21 1.19 0.24 1.55 0.00 -0.14 -4.45 117.00 113.18 3iss n LEU 86 Ca -0.01 -0.04 0.13 0.00 0.00 0.00 0.00 56.01 56.09 3iss n LEU 86 Cb 0.28 -0.04 0.48 0.00 0.00 0.00 0.00 43.42 44.14 3iss n LEU 86 CO 0.08 0.50 0.86 0.58 0.00 0.00 0.00 177.39 179.40 3iss h VAL 87 N 0.00 0.29 0.00 1.96 2.07 -0.68 -3.05 116.25 116.84 3iss h VAL 87 Ca -0.36 -0.94 -0.09 0.00 0.82 0.00 0.00 66.70 66.14 3iss h VAL 87 Cb 1.71 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 33.20 3iss h VAL 87 CO -0.01 0.12 -0.42 0.07 0.02 0.00 0.00 177.57 177.35 3iss h LYS 88 N 0.00 0.00 0.00 1.57 2.10 -1.64 -2.88 116.57 115.71 3iss h LYS 88 Ca -0.00 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.64 3iss h LYS 88 Cb 0.73 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.06 3iss h LYS 88 CO 0.02 0.42 -0.23 1.79 -2.00 0.00 0.00 179.45 179.44 3iss h THR 89 N 0.00 0.04 -1.06 0.07 1.35 -1.76 -3.44 112.91 108.12 3iss h THR 89 Ca -0.00 -1.06 -0.01 0.00 -0.55 0.00 0.00 66.41 64.79 3iss h THR 89 Cb 1.14 1.92 -0.21 0.00 -1.73 0.00 0.00 68.15 69.27 3iss h THR 89 CO 0.05 0.02 -0.41 -0.32 -0.25 0.00 0.00 175.52 174.62 3iss s MET 90 N -3.23 0.60 0.00 4.72 -2.45 -1.09 -5.03 119.30 112.82 3iss s MET 90 Ca 0.05 0.33 0.06 0.00 -1.25 0.00 0.00 55.69 54.88 3iss s MET 90 Cb 0.06 0.17 0.25 0.00 1.25 0.00 0.00 34.83 36.55 3iss s MET 90 CO 0.70 -1.08 1.17 2.89 1.05 0.00 0.00 175.02 179.75 3iss n ARG 91 N 5.19 0.00 0.23 4.11 1.85 -1.21 -1.45 116.66 125.39 3iss n ARG 91 Ca 0.06 0.39 0.16 0.00 -1.00 0.00 0.00 57.85 57.46 3iss n ARG 91 Cb 0.54 -1.50 0.65 0.00 -1.05 0.00 0.00 32.46 31.11 3iss n ARG 91 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3iss h ALA 92 N 2.20 1.00 -1.10 2.89 0.00 -1.96 -2.84 119.26 119.45 3iss h ALA 92 Ca 0.00 0.00 0.32 0.00 0.00 0.00 0.00 54.91 55.23 3iss h ALA 92 Cb 0.10 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 3iss h ALA 92 CO 0.00 0.00 0.93 0.77 0.00 0.00 0.00 179.25 180.95 3iss h SER 93 N 0.00 0.00 -0.09 0.00 0.02 -1.59 0.72 113.55 112.61 3iss h SER 93 Ca 0.00 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.98 3iss h SER 93 Cb 0.41 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.95 3iss h SER 93 CO 0.00 0.00 0.26 -0.29 -1.14 0.00 0.00 176.83 175.66 3iss h ILE 94 N 0.00 0.15 0.00 3.27 6.09 -1.76 0.97 117.51 126.23 3iss h ILE 94 Ca 0.52 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 64.01 3iss h ILE 94 Cb 2.38 0.76 0.00 0.00 0.47 0.00 0.00 36.82 40.44 3iss h ILE 94 CO -0.01 0.00 0.00 0.79 -3.07 0.00 0.00 178.15 175.86 3iss n TRP 95 N -3.22 0.25 0.04 2.19 8.01 0.24 -2.05 117.44 122.90 3iss n TRP 95 Ca -0.00 0.11 -0.05 0.00 -1.31 0.00 0.00 57.50 56.24 3iss n TRP 95 Cb 0.34 -0.68 0.14 0.00 -2.01 0.00 0.00 31.31 29.10 3iss n TRP 95 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 3iss h ALA 96 N 2.24 0.92 -0.23 6.99 0.00 -1.03 -3.34 119.26 124.82 3iss h ALA 96 Ca 0.00 -0.45 0.05 0.00 0.00 0.00 0.00 54.91 54.51 3iss h ALA 96 Cb 0.16 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.78 3iss h ALA 96 CO 0.00 0.64 -0.42 1.25 0.00 0.00 0.00 179.25 180.72 3iss h LEU 97 N 0.35 -1.34 -0.00 0.00 5.85 -1.63 -2.54 115.31 116.00 3iss h LEU 97 Ca 0.03 0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.95 3iss h LEU 97 Cb 0.91 0.56 -0.05 0.00 0.37 0.00 0.00 40.66 42.46 3iss h LEU 97 CO 0.08 -0.40 -0.46 1.23 -0.34 0.00 0.00 178.44 178.55 3iss h GLY 98 N -0.43 -1.17 0.92 3.75 0.00 -1.78 -1.94 103.07 102.41 3iss h GLY 98 Ca 0.10 0.66 0.02 0.00 0.00 0.00 0.00 47.33 48.11 3iss h GLY 98 CO -0.46 -0.28 0.51 -2.55 0.00 0.00 0.00 176.54 173.76 3iss h PRO 99 N -0.57 0.97 -0.33 4.80 0.11 -1.73 -1.34 132.00 133.91 3iss h PRO 99 Ca 0.01 -0.06 0.05 0.00 0.11 0.00 0.00 66.00 66.11 3iss h PRO 99 Cb 0.61 -0.22 -0.05 0.00 0.11 0.00 0.00 31.00 31.46 3iss h PRO 99 CO -0.30 0.64 0.04 -0.07 -0.21 0.00 0.00 178.00 178.10 3iss h LEU 100 N 1.00 -0.05 -0.63 2.35 3.38 -1.17 -1.10 115.31 119.09 3iss h LEU 100 Ca 0.31 0.06 -0.13 0.00 0.09 0.00 0.00 57.88 58.21 3iss h LEU 100 Cb -0.03 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 3iss h LEU 100 CO -0.10 0.01 -0.33 0.58 0.09 0.00 0.00 178.44 178.69 3iss h VAL 101 N 0.15 1.28 -0.72 1.22 2.07 -1.00 -0.41 116.25 118.84 3iss h VAL 101 Ca 0.16 -1.48 -0.06 0.00 0.82 0.00 0.00 66.70 66.15 3iss h VAL 101 Cb 0.19 1.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 3iss h VAL 101 CO -0.23 0.48 0.23 0.00 0.02 0.00 0.00 177.57 178.07 3iss h ALA 102 N 1.03 0.94 0.06 1.67 0.00 -0.88 -2.07 119.26 120.01 3iss h ALA 102 Ca 0.06 -0.22 -0.37 0.00 0.00 0.00 0.00 54.91 54.38 3iss h ALA 102 Cb 0.85 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 3iss h ALA 102 CO 0.07 0.62 -2.15 -2.13 0.00 0.00 0.00 179.25 175.66 3iss n ARG 103 N -4.29 0.69 -0.03 0.00 0.63 -0.45 -4.56 116.66 108.65 3iss n ARG 103 Ca 0.06 0.25 0.07 0.00 -0.92 0.00 0.00 57.85 57.30 3iss n ARG 103 Cb 0.22 -1.63 0.08 0.00 0.45 0.00 0.00 32.46 31.58 3iss n ARG 103 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 3iss n PHE 104 N -3.52 0.09 -0.80 -0.14 3.72 -0.17 -4.99 117.46 111.64 3iss n PHE 104 Ca -0.39 -0.08 0.00 0.00 -0.05 0.00 0.00 57.45 56.93 3iss n PHE 104 Cb 0.99 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.52 3iss n PHE 104 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3iss n GLY 105 N 0.76 0.71 3.21 1.37 0.00 -0.78 -4.97 105.19 105.49 3iss n GLY 105 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.02 3iss n GLY 105 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3iss s GLN 106 N -0.32 0.85 -0.29 1.61 -2.07 -1.25 -1.07 119.66 117.11 3iss s GLN 106 Ca 0.00 -1.00 -0.20 0.00 -1.82 0.00 0.00 55.36 52.34 3iss s GLN 106 Cb 0.00 0.33 0.18 0.00 -1.09 0.00 0.00 33.01 32.43 3iss s GLN 106 CO 0.00 -0.27 1.24 0.20 -1.32 0.00 0.00 175.29 175.14 3iss s GLY 107 N -2.88 0.33 -0.20 2.60 0.00 -0.73 -3.16 107.32 103.28 3iss s GLY 107 Ca 0.06 3.46 0.01 0.00 0.00 0.00 0.00 44.72 48.25 3iss s GLY 107 CO -0.10 2.34 -0.09 1.20 0.00 0.00 0.00 173.10 176.45 3iss s GLN 108 N 0.65 1.94 -0.05 2.90 1.11 -0.13 -0.32 119.66 125.75 3iss s GLN 108 Ca -0.02 -0.85 0.06 0.00 0.01 0.00 0.00 55.36 54.56 3iss s GLN 108 Cb -0.04 -2.42 -0.01 0.00 -1.01 0.00 0.00 33.01 29.53 3iss s GLN 108 CO -0.12 -0.45 -0.22 0.08 0.01 0.00 0.00 175.29 174.58 3iss s VAL 109 N 1.40 1.81 0.27 1.09 1.01 -0.75 -0.45 120.40 124.79 3iss s VAL 109 Ca -0.02 -0.94 -0.30 0.00 0.00 0.00 0.00 61.98 60.72 3iss s VAL 109 Cb -0.17 -1.54 -0.11 0.00 0.00 0.00 0.00 36.38 34.57 3iss s VAL 109 CO -0.08 0.51 1.50 -0.55 0.00 0.00 0.00 175.10 176.48 3iss s SER 110 N -0.14 6.54 -0.13 3.32 0.15 -0.99 -0.52 113.70 121.93 3iss s SER 110 Ca -0.02 2.79 -0.29 0.00 0.70 0.00 0.00 55.95 59.12 3iss s SER 110 Cb -0.12 -2.63 -0.03 0.00 -1.71 0.00 0.00 66.02 61.53 3iss s SER 110 CO 0.03 -0.79 1.38 -0.22 1.20 0.00 0.00 173.24 174.84 3iss s LEU 111 N -0.47 4.22 0.29 3.45 1.98 0.01 -4.80 118.68 123.36 3iss s LEU 111 Ca 0.61 1.86 -0.30 0.00 -2.89 0.00 0.00 54.13 53.41 3iss s LEU 111 Cb -0.44 -3.54 -0.11 0.00 0.66 0.00 0.00 46.19 42.76 3iss s LEU 111 CO 0.46 -0.81 1.55 -2.84 -1.89 0.00 0.00 176.35 172.82 3iss s PRO 112 N 3.65 4.16 0.00 0.98 0.02 -1.26 -5.01 135.00 137.54 3iss s PRO 112 Ca 0.60 2.51 0.00 0.00 0.02 0.00 0.00 61.00 64.14 3iss s PRO 112 Cb -0.25 -3.04 0.00 0.00 0.02 0.00 0.00 34.50 31.23 3iss s PRO 112 CO 0.19 -0.57 0.00 0.41 -0.33 0.00 0.00 177.00 176.70 3iss n GLY 113 N 2.05 0.99 3.84 0.52 0.00 -1.26 -5.02 105.19 106.31 3iss n GLY 113 Ca 0.07 -1.26 -0.33 0.00 0.00 0.00 0.00 46.02 44.51 3iss n GLY 113 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3iss s GLY 114 N 0.00 2.36 0.05 -0.02 0.00 -1.26 -4.90 107.32 103.55 3iss s GLY 114 Ca 0.00 0.21 0.04 0.00 0.00 0.00 0.00 44.72 44.97 3iss s GLY 114 CO 0.00 0.45 -0.12 0.00 0.00 0.00 0.00 173.10 173.42 3iss h THR 116 N 4.44 0.93 -0.00 0.00 1.35 -1.97 -3.18 112.91 114.47 3iss h THR 116 Ca -0.38 -1.27 0.00 0.00 -0.55 0.00 0.00 66.41 64.21 3iss h THR 116 Cb 1.19 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 69.36 3iss h THR 116 CO 0.42 0.32 -0.16 2.30 -0.25 0.00 0.00 175.52 178.15 3iss n ILE 117 N -3.70 0.00 -0.28 6.82 -5.35 -1.26 -4.91 119.36 110.68 3iss n ILE 117 Ca -0.01 -0.03 0.00 0.00 -0.27 0.00 0.00 62.75 62.45 3iss n ILE 117 Cb 0.43 -0.16 0.00 0.00 -1.74 0.00 0.00 39.64 38.17 3iss n ILE 117 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3iss n GLY 118 N 1.40 0.83 3.70 3.28 0.00 -1.20 -3.54 105.19 109.65 3iss n GLY 118 Ca 0.10 -1.86 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 3iss n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iss s ALA 119 N -1.00 3.63 -0.41 4.61 0.00 -1.26 -4.39 121.76 122.94 3iss s ALA 119 Ca 0.00 1.10 0.11 0.00 0.00 0.00 0.00 51.96 53.17 3iss s ALA 119 Cb 0.00 -3.60 0.36 0.00 0.00 0.00 0.00 23.12 19.88 3iss s ALA 119 CO 0.00 -0.84 0.80 0.54 0.00 0.00 0.00 175.76 176.25 3iss n ARG 120 N 4.79 1.46 -1.40 0.00 1.74 -1.26 -5.05 116.66 116.93 3iss n ARG 120 Ca 0.13 -3.67 -0.32 0.00 -0.77 0.00 0.00 57.85 53.22 3iss n ARG 120 Cb 0.42 -1.78 0.08 0.00 -1.02 0.00 0.00 32.46 30.16 3iss n ARG 120 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3iss s PRO 121 N -2.70 2.29 -0.19 5.56 0.04 -1.26 -4.98 135.00 133.75 3iss s PRO 121 Ca 0.41 1.39 0.13 0.00 0.04 0.00 0.00 61.00 62.97 3iss s PRO 121 Cb 0.35 -1.89 0.39 0.00 0.04 0.00 0.00 34.50 33.39 3iss s PRO 121 CO -0.08 -1.65 1.20 1.33 0.04 0.00 0.00 177.00 177.84 3iss n VAL 122 N -3.07 2.10 -0.29 -0.36 0.24 -1.26 -4.79 118.33 110.90 3iss n VAL 122 Ca 0.11 -3.00 0.10 0.00 -2.04 0.00 0.00 64.34 59.51 3iss n VAL 122 Cb 0.52 -0.22 0.34 0.00 -1.47 0.00 0.00 33.84 33.01 3iss n VAL 122 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 3iss h ASP 123 N 0.79 0.73 -0.04 -1.34 2.03 -2.00 -1.39 116.42 115.20 3iss h ASP 123 Ca -0.00 0.04 -0.07 0.00 -0.73 0.00 0.00 57.03 56.27 3iss h ASP 123 Cb 1.02 -0.10 -0.01 0.00 -0.83 0.00 0.00 39.33 39.40 3iss h ASP 123 CO 0.00 0.38 -0.16 -0.07 -1.03 0.00 0.00 179.24 178.36 3iss h LEU 124 N 0.78 0.37 0.27 0.15 3.38 -1.99 0.64 115.31 118.92 3iss h LEU 124 Ca 0.46 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.32 3iss h LEU 124 Cb 0.64 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.29 3iss h LEU 124 CO -0.22 0.56 -0.13 0.45 0.09 0.00 0.00 178.44 179.19 3iss h HIS 125 N 0.36 -0.34 -0.01 1.13 3.86 -1.61 -1.49 115.15 117.05 3iss h HIS 125 Ca 0.07 -0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.28 3iss h HIS 125 Cb 0.49 0.11 -0.02 0.00 1.06 0.00 0.00 27.41 29.06 3iss h HIS 125 CO 0.01 -0.05 -0.08 0.82 0.86 0.00 0.00 177.93 179.49 3iss h ILE 126 N -0.62 0.79 -0.81 2.45 2.04 -1.35 -2.36 117.51 117.65 3iss h ILE 126 Ca -0.04 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.85 3iss h ILE 126 Cb 0.44 0.79 -0.05 0.00 -0.74 0.00 0.00 36.82 37.26 3iss h ILE 126 CO 0.06 0.00 0.52 -1.28 0.00 0.00 0.00 178.15 177.45 3iss h SER 127 N -0.14 0.86 -0.86 1.72 0.87 -0.91 -1.26 113.55 113.83 3iss h SER 127 Ca 0.04 -0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.60 3iss h SER 127 Cb 0.18 -0.19 -0.04 0.00 -0.44 0.00 0.00 62.40 61.91 3iss h SER 127 CO -0.09 0.59 0.57 1.23 -0.53 0.00 0.00 176.83 178.60 3iss h GLY 128 N 1.01 1.21 1.16 5.77 0.00 -0.99 -0.77 103.07 110.47 3iss h GLY 128 Ca 0.32 -0.44 -0.15 0.00 0.00 0.00 0.00 47.33 47.06 3iss h GLY 128 CO -0.11 0.43 -0.35 1.41 0.00 0.00 0.00 176.54 177.91 3iss h LEU 129 N 1.15 0.98 -0.98 3.11 3.38 -0.89 -2.47 115.31 119.58 3iss h LEU 129 Ca 0.32 -0.43 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 3iss h LEU 129 Cb -0.11 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.33 3iss h LEU 129 CO -0.08 1.22 0.38 -0.33 0.09 0.00 0.00 178.44 179.72 3iss h GLU 130 N 0.76 1.10 0.00 1.13 5.08 -0.94 -1.50 114.58 120.21 3iss h GLU 130 Ca 0.07 -0.15 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 3iss h GLU 130 Cb 0.94 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.98 3iss h GLU 130 CO 0.09 0.84 -0.11 0.37 -1.00 0.00 0.00 179.01 179.20 3iss h GLN 131 N 1.10 0.00 -0.39 2.33 4.15 -0.93 -0.46 115.11 120.91 3iss h GLN 131 Ca 0.27 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.69 3iss h GLN 131 Cb 0.10 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.79 3iss h GLN 131 CO -0.04 0.11 0.00 1.28 -1.93 0.00 0.00 178.83 178.26 3iss n LEU 132 N -3.33 2.12 0.00 -2.39 4.77 -0.66 -4.77 117.00 112.74 3iss n LEU 132 Ca -0.00 -1.05 0.00 0.00 -0.03 0.00 0.00 56.01 54.92 3iss n LEU 132 Cb 0.32 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 3iss n LEU 132 CO 0.30 0.53 0.00 0.61 -1.33 0.00 0.00 177.39 177.49 3iss n GLY 133 N 1.13 0.50 3.79 -0.72 0.00 -0.18 -1.73 105.19 107.99 3iss n GLY 133 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 3iss n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iss s ALA 134 N -2.00 2.87 -0.20 4.61 0.00 -0.66 -4.85 121.76 121.52 3iss s ALA 134 Ca 0.00 0.64 -0.08 0.00 0.00 0.00 0.00 51.96 52.52 3iss s ALA 134 Cb 0.00 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.81 3iss s ALA 134 CO 0.00 -0.36 0.08 0.99 0.00 0.00 0.00 175.76 176.48 3iss s THR 135 N -1.94 4.86 -0.08 0.00 2.01 0.17 -4.27 115.64 116.39 3iss s THR 135 Ca 0.67 -0.00 0.02 0.00 0.31 0.00 0.00 61.69 62.69 3iss s THR 135 Cb -0.17 -3.21 0.01 0.00 0.01 0.00 0.00 72.50 69.13 3iss s THR 135 CO 0.21 0.43 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.79 3iss s ILE 136 N 0.61 1.40 0.11 1.82 1.01 -1.26 -1.57 121.20 123.32 3iss s ILE 136 Ca 0.04 -0.62 0.03 0.00 0.00 0.00 0.00 60.65 60.10 3iss s ILE 136 Cb -0.13 -1.26 -0.04 0.00 0.01 0.00 0.00 42.46 41.04 3iss s ILE 136 CO 0.01 0.42 -0.08 -1.59 0.00 0.00 0.00 174.94 173.70 3iss s LYS 137 N 0.72 0.87 -0.29 2.79 -2.85 -0.54 -4.97 119.74 115.47 3iss s LYS 137 Ca -0.13 -1.29 -0.02 0.00 -1.00 0.00 0.00 55.97 53.53 3iss s LYS 137 Cb -0.16 -0.39 0.04 0.00 -2.06 0.00 0.00 37.83 35.27 3iss s LYS 137 CO 0.03 0.03 -0.01 -1.17 0.10 0.00 0.00 175.35 174.34 3iss s LEU 138 N -2.85 3.76 -0.01 2.77 2.96 -1.26 0.04 118.68 124.08 3iss s LEU 138 Ca 0.10 -1.16 0.02 0.00 -0.22 0.00 0.00 54.13 52.87 3iss s LEU 138 Cb 0.02 -1.72 0.00 0.00 0.50 0.00 0.00 46.19 44.99 3iss s LEU 138 CO -0.02 -0.23 -0.05 -1.83 -1.32 0.00 0.00 176.35 172.89 3iss s GLU 139 N 1.29 0.54 -1.69 1.98 -1.05 -0.65 -4.82 118.70 114.29 3iss s GLU 139 Ca -0.04 -0.18 0.00 0.00 -0.15 0.00 0.00 54.97 54.60 3iss s GLU 139 Cb -0.19 -0.53 0.00 0.00 -0.44 0.00 0.00 34.13 32.97 3iss s GLU 139 CO -0.01 0.08 0.00 0.39 0.95 0.00 0.00 175.26 176.67 3iss n GLU 140 N 3.17 -1.75 -0.90 -4.83 1.02 -1.26 -1.45 120.64 114.65 3iss n GLU 140 Ca -0.16 0.95 0.00 0.00 -0.02 0.00 0.00 57.16 57.93 3iss n GLU 140 Cb 0.56 -5.57 0.00 0.00 -0.02 0.00 0.00 31.44 26.42 3iss n GLU 140 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3iss n GLY 141 N -0.89 0.80 3.67 0.62 0.00 -1.26 -5.03 105.19 103.10 3iss n GLY 141 Ca -0.22 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.45 3iss n GLY 141 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3iss s TYR 142 N -3.12 3.29 -0.40 1.61 2.02 -0.53 -0.81 117.35 119.42 3iss s TYR 142 Ca 0.00 0.15 -0.27 0.00 -0.37 0.00 0.00 57.07 56.58 3iss s TYR 142 Cb 0.00 -2.03 0.02 0.00 -0.40 0.00 0.00 41.96 39.55 3iss s TYR 142 CO 0.00 0.27 1.01 0.54 -1.57 0.00 0.00 175.55 175.80 3iss s VAL 143 N 0.05 4.45 -0.25 0.71 0.11 0.32 -1.64 120.40 124.16 3iss s VAL 143 Ca 0.06 1.24 -0.06 0.00 -2.93 0.00 0.00 61.98 60.28 3iss s VAL 143 Cb -0.12 -4.44 -0.02 0.00 -1.53 0.00 0.00 36.38 30.27 3iss s VAL 143 CO 0.01 -0.70 0.04 -0.54 -3.33 0.00 0.00 175.10 170.58 3iss s LYS 144 N 3.82 3.51 0.10 1.54 1.02 0.11 -1.80 119.74 128.03 3iss s LYS 144 Ca 0.42 -0.56 0.09 0.00 0.02 0.00 0.00 55.97 55.94 3iss s LYS 144 Cb -0.10 -3.25 -0.04 0.00 -0.52 0.00 0.00 37.83 33.92 3iss s LYS 144 CO 0.23 -0.22 -0.19 0.00 -0.92 0.00 0.00 175.35 174.24 3iss s ALA 145 N 1.57 2.61 -0.05 5.17 0.00 0.56 -1.46 121.76 130.15 3iss s ALA 145 Ca 0.06 -1.32 -0.28 0.00 0.00 0.00 0.00 51.96 50.41 3iss s ALA 145 Cb -0.15 -0.64 0.06 0.00 0.00 0.00 0.00 23.12 22.39 3iss s ALA 145 CO 0.02 0.58 0.63 -1.54 0.00 0.00 0.00 175.76 175.44 3iss s SER 146 N -1.91 -0.59 -0.11 0.00 1.04 -0.61 -1.78 113.70 109.74 3iss s SER 146 Ca 0.16 0.65 -0.07 0.00 0.48 0.00 0.00 55.95 57.18 3iss s SER 146 Cb -0.10 0.53 0.04 0.00 0.10 0.00 0.00 66.02 66.59 3iss s SER 146 CO 0.08 -0.58 0.27 0.54 0.98 0.00 0.00 173.24 174.53 3iss s VAL 147 N -1.16 -0.03 -0.61 5.02 0.11 -0.23 -0.66 120.40 122.84 3iss s VAL 147 Ca -0.11 0.10 -0.28 0.00 -2.93 0.00 0.00 61.98 58.77 3iss s VAL 147 Cb -0.01 -0.40 0.02 0.00 -1.53 0.00 0.00 36.38 34.46 3iss s VAL 147 CO 0.09 0.04 1.41 -0.62 -3.33 0.00 0.00 175.10 172.69 3iss s ASP 148 N 0.98 6.08 0.29 3.54 2.15 -1.26 -4.71 116.67 123.74 3iss s ASP 148 Ca -0.07 0.11 0.00 0.00 0.43 0.00 0.00 52.55 53.02 3iss s ASP 148 Cb -0.08 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 39.99 3iss s ASP 148 CO -0.07 -1.79 0.00 0.61 -0.17 0.00 0.00 175.17 173.76 3iss n GLY 149 N 5.31 0.68 3.61 2.66 0.00 -1.26 -4.94 105.19 111.25 3iss n GLY 149 Ca 0.11 -1.15 -0.25 0.00 0.00 0.00 0.00 46.02 44.73 3iss n GLY 149 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3iss s ARG 150 N 0.00 1.99 0.84 1.61 1.70 -1.26 -4.67 118.95 119.16 3iss s ARG 150 Ca 0.00 -1.84 -0.11 0.00 -0.47 0.00 0.00 55.73 53.31 3iss s ARG 150 Cb 0.00 -1.83 0.10 0.00 -0.57 0.00 0.00 34.95 32.64 3iss s ARG 150 CO 0.00 0.11 1.09 -0.51 -1.08 0.00 0.00 175.30 174.92 3iss s LEU 151 N -3.69 2.65 -0.11 -1.89 1.43 -1.26 -4.81 118.68 110.99 3iss s LEU 151 Ca 0.34 1.69 0.03 0.00 -1.03 0.00 0.00 54.13 55.17 3iss s LEU 151 Cb 0.02 -4.24 0.00 0.00 0.03 0.00 0.00 46.19 42.00 3iss s LEU 151 CO 0.18 -2.40 -0.23 -0.54 0.23 0.00 0.00 176.35 173.60 3iss s LYS 152 N -4.89 2.95 0.36 1.70 1.02 -0.70 -0.01 119.74 120.17 3iss s LYS 152 Ca 0.63 -0.84 -0.24 0.00 0.02 0.00 0.00 55.97 55.53 3iss s LYS 152 Cb -0.18 -2.29 -0.14 0.00 -0.52 0.00 0.00 37.83 34.71 3iss s LYS 152 CO 0.57 0.11 0.61 0.41 -0.92 0.00 0.00 175.35 176.12 3iss n GLY 153 N 3.72 -1.35 3.35 -3.33 0.00 -0.21 -4.58 105.19 102.80 3iss n GLY 153 Ca -0.19 0.14 -0.10 0.00 0.00 0.00 0.00 46.02 45.87 3iss n GLY 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iss s ALA 154 N -1.33 -0.58 -0.48 4.61 0.00 -1.13 -4.78 121.76 118.07 3iss s ALA 154 Ca 0.62 -0.39 -0.20 0.00 0.00 0.00 0.00 51.96 51.99 3iss s ALA 154 Cb -0.67 0.74 0.04 0.00 0.00 0.00 0.00 23.12 23.23 3iss s ALA 154 CO 0.58 -0.66 0.64 -1.58 0.00 0.00 0.00 175.76 174.74 3iss s HIS 155 N -3.87 3.04 -0.22 0.00 2.46 -1.26 -0.86 115.29 114.58 3iss s HIS 155 Ca 0.08 -0.33 -0.03 0.00 0.47 0.00 0.00 55.06 55.26 3iss s HIS 155 Cb 0.02 -3.47 0.00 0.00 -0.13 0.00 0.00 32.58 29.01 3iss s HIS 155 CO -0.07 -0.98 -0.07 0.42 -2.47 0.00 0.00 174.74 171.57 3iss s ILE 156 N 2.76 3.07 -0.29 0.89 1.01 0.12 -4.96 121.20 123.80 3iss s ILE 156 Ca 0.18 -0.67 -0.09 0.00 0.00 0.00 0.00 60.65 60.07 3iss s ILE 156 Cb -0.17 -2.42 -0.02 0.00 0.01 0.00 0.00 42.46 39.86 3iss s ILE 156 CO 0.15 0.39 0.14 -0.69 0.00 0.00 0.00 174.94 174.93 3iss s VAL 157 N 1.42 4.70 -0.07 2.92 1.01 -1.26 -0.31 120.40 128.81 3iss s VAL 157 Ca 0.05 -0.20 -0.28 0.00 0.00 0.00 0.00 61.98 61.54 3iss s VAL 157 Cb -0.15 -3.30 -0.02 0.00 0.00 0.00 0.00 36.38 32.91 3iss s VAL 157 CO -0.05 0.19 0.90 -0.04 0.00 0.00 0.00 175.10 176.10 3iss s MET 158 N 1.65 4.46 0.17 2.72 1.00 -0.46 -4.94 119.30 123.90 3iss s MET 158 Ca 0.06 1.24 -0.15 0.00 0.00 0.00 0.00 55.69 56.84 3iss s MET 158 Cb -0.16 -3.49 0.07 0.00 0.00 0.00 0.00 34.83 31.25 3iss s MET 158 CO 0.07 -0.13 1.80 0.22 0.00 0.00 0.00 175.02 176.97 3iss h ASP 159 N 6.94 0.40 -5.18 3.03 1.82 -1.93 -3.44 116.42 118.06 3iss h ASP 159 Ca -0.37 0.01 -0.28 0.00 -0.39 0.00 0.00 57.03 56.01 3iss h ASP 159 Cb 1.18 -0.07 -0.15 0.00 0.68 0.00 0.00 39.33 40.97 3iss h ASP 159 CO 0.79 0.29 -0.62 -1.59 -1.61 0.00 0.00 179.24 176.50 3iss s LYS 160 N -6.15 1.26 -0.11 0.28 -2.85 -1.26 -5.12 119.74 105.79 3iss s LYS 160 Ca -0.13 -1.66 -0.30 0.00 -1.00 0.00 0.00 55.97 52.88 3iss s LYS 160 Cb 0.12 0.07 -0.02 0.00 -2.06 0.00 0.00 37.83 35.95 3iss s LYS 160 CO 0.73 -0.34 1.09 0.08 0.10 0.00 0.00 175.35 177.01 3iss s VAL 161 N -4.00 4.56 -0.06 1.79 1.01 -1.26 -5.00 120.40 117.44 3iss s VAL 161 Ca 0.37 1.86 -0.02 0.00 0.00 0.00 0.00 61.98 64.19 3iss s VAL 161 Cb 0.07 -4.19 0.04 0.00 0.00 0.00 0.00 36.38 32.30 3iss s VAL 161 CO 0.12 -0.03 0.11 -0.55 0.00 0.00 0.00 175.10 174.75 3iss s SER 162 N 1.29 0.52 0.10 3.32 0.15 -1.26 -5.01 113.70 112.81 3iss s SER 162 Ca 0.51 0.22 -0.19 0.00 0.70 0.00 0.00 55.95 57.19 3iss s SER 162 Cb -0.20 0.11 -0.07 0.00 -1.71 0.00 0.00 66.02 64.14 3iss s SER 162 CO 0.18 -0.20 1.65 0.58 1.20 0.00 0.00 173.24 176.64 3iss h VAL 163 N 6.30 1.16 0.15 4.45 2.07 -1.95 -2.67 116.25 125.76 3iss h VAL 163 Ca -0.25 -0.49 -0.01 0.00 0.82 0.00 0.00 66.70 66.77 3iss h VAL 163 Cb 1.12 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.96 3iss h VAL 163 CO 0.27 0.16 -0.07 1.23 0.02 0.00 0.00 177.57 179.17 3iss h GLY 164 N 0.22 -0.21 1.22 2.17 0.00 -2.00 -2.14 103.07 102.33 3iss h GLY 164 Ca 0.08 0.08 -0.12 0.00 0.00 0.00 0.00 47.33 47.36 3iss h GLY 164 CO -0.01 -0.08 -0.20 0.00 0.00 0.00 0.00 176.54 176.26 3iss h ALA 165 N 0.57 0.79 -0.66 3.60 0.00 -1.93 -0.55 119.26 121.09 3iss h ALA 165 Ca -0.02 -0.38 0.09 0.00 0.00 0.00 0.00 54.91 54.60 3iss h ALA 165 Cb 0.21 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 17.77 3iss h ALA 165 CO 0.03 0.65 0.30 1.15 0.00 0.00 0.00 179.25 181.39 3iss h THR 166 N 0.78 0.83 -0.18 0.00 2.02 -1.40 0.05 112.91 115.01 3iss h THR 166 Ca 0.11 -0.18 -0.04 0.00 0.77 0.00 0.00 66.41 67.07 3iss h THR 166 Cb 0.75 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.41 3iss h THR 166 CO 0.06 0.10 -0.05 0.58 0.37 0.00 0.00 175.52 176.58 3iss h VAL 167 N 0.53 1.29 -0.19 3.16 2.07 -0.93 -1.32 116.25 120.85 3iss h VAL 167 Ca 0.32 -1.03 0.05 0.00 0.82 0.00 0.00 66.70 66.87 3iss h VAL 167 Cb 0.35 1.61 -0.06 0.00 -1.52 0.00 0.00 31.29 31.67 3iss h VAL 167 CO -0.27 0.31 -0.18 0.74 0.02 0.00 0.00 177.57 178.19 3iss h THR 168 N 0.05 0.53 -0.12 2.57 2.02 -0.58 -1.36 112.91 116.01 3iss h THR 168 Ca 0.04 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.21 3iss h THR 168 Cb 0.49 0.53 -0.00 0.00 -1.74 0.00 0.00 68.15 67.42 3iss h THR 168 CO 0.02 0.00 0.01 0.40 0.37 0.00 0.00 175.52 176.32 3iss h ILE 169 N -0.19 1.23 -0.60 3.11 2.04 -1.02 -2.45 117.51 119.63 3iss h ILE 169 Ca 0.12 -0.73 0.08 0.00 1.00 0.00 0.00 64.86 65.34 3iss h ILE 169 Cb 0.37 1.47 -0.07 0.00 -0.74 0.00 0.00 36.82 37.85 3iss h ILE 169 CO -0.30 0.21 0.24 -0.03 0.00 0.00 0.00 178.15 178.27 3iss h MET 170 N -0.03 0.43 -0.29 2.37 4.05 -1.03 -0.29 114.93 120.13 3iss h MET 170 Ca 0.04 -0.03 -0.07 0.00 -0.28 0.00 0.00 59.70 59.36 3iss h MET 170 Cb 0.31 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 31.01 3iss h MET 170 CO 0.00 0.28 -0.11 0.00 0.23 0.00 0.00 176.91 177.32 3iss h ALA 172 N 0.77 1.31 0.00 0.00 0.00 -0.96 -2.81 119.26 117.57 3iss h ALA 172 Ca 0.07 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 3iss h ALA 172 Cb 0.61 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3iss h ALA 172 CO 0.04 0.49 -0.20 0.00 0.00 0.00 0.00 179.25 179.58 3iss h ALA 173 N 1.43 1.34 0.00 0.00 0.00 -0.97 -3.08 119.26 117.98 3iss h ALA 173 Ca 0.16 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3iss h ALA 173 Cb 0.25 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3iss h ALA 173 CO -0.00 0.25 0.00 1.79 0.00 0.00 0.00 179.25 181.29 3iss h THR 174 N 0.00 0.00 -0.07 0.00 1.35 -1.47 -0.91 112.91 111.81 3iss h THR 174 Ca -0.00 -0.02 -0.02 0.00 -0.55 0.00 0.00 66.41 65.82 3iss h THR 174 Cb 0.45 0.76 -0.01 0.00 -1.73 0.00 0.00 68.15 67.62 3iss h THR 174 CO 0.03 0.00 -0.15 0.18 -0.25 0.00 0.00 175.52 175.33 3iss n LEU 175 N -2.65 2.83 -4.98 3.87 4.77 -1.16 -2.08 117.00 117.60 3iss n LEU 175 Ca -0.02 -3.38 -0.20 0.00 -0.03 0.00 0.00 56.01 52.39 3iss n LEU 175 Cb 0.06 -0.49 0.02 0.00 -2.33 0.00 0.00 43.42 40.68 3iss n LEU 175 CO 0.15 0.95 0.26 0.00 -1.33 0.00 0.00 177.39 177.43 3iss s ALA 176 N -3.01 4.12 -0.44 -1.18 0.00 -0.34 -4.52 121.76 116.39 3iss s ALA 176 Ca 0.36 -1.43 -0.27 0.00 0.00 0.00 0.00 51.96 50.63 3iss s ALA 176 Cb 0.33 -1.90 0.02 0.00 0.00 0.00 0.00 23.12 21.57 3iss s ALA 176 CO 0.01 -0.50 0.99 -1.21 0.00 0.00 0.00 175.76 175.05 3iss s GLU 177 N -4.56 3.68 0.71 0.00 2.02 0.99 -4.09 118.70 117.45 3iss s GLU 177 Ca 0.55 0.41 0.00 0.00 0.02 0.00 0.00 54.97 55.95 3iss s GLU 177 Cb -0.10 -3.89 0.00 0.00 0.10 0.00 0.00 34.13 30.24 3iss s GLU 177 CO 0.36 -1.20 0.00 0.41 0.02 0.00 0.00 175.26 174.85 3iss n GLY 178 N 4.74 -1.02 3.53 -1.39 0.00 -1.26 -1.04 105.19 108.75 3iss n GLY 178 Ca 0.08 -1.72 -0.34 0.00 0.00 0.00 0.00 46.02 44.04 3iss n GLY 178 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3iss s THR 179 N 0.00 4.20 -0.11 2.61 2.01 -1.26 -0.81 115.64 122.28 3iss s THR 179 Ca 0.00 -0.24 -0.04 0.00 0.31 0.00 0.00 61.69 61.72 3iss s THR 179 Cb 0.00 -2.87 -0.04 0.00 0.01 0.00 0.00 72.50 69.60 3iss s THR 179 CO 0.00 0.47 0.06 -0.89 -0.69 0.00 0.00 174.62 173.57 3iss s THR 180 N 0.52 4.81 -0.14 -0.82 2.01 0.26 -2.82 115.64 119.46 3iss s THR 180 Ca -0.01 -0.05 0.00 0.00 0.31 0.00 0.00 61.69 61.94 3iss s THR 180 Cb -0.14 -3.06 0.02 0.00 0.01 0.00 0.00 72.50 69.33 3iss s THR 180 CO 0.02 0.60 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.79 3iss s ILE 181 N -0.86 1.52 -0.35 1.82 1.01 -0.04 -1.10 121.20 123.20 3iss s ILE 181 Ca 0.13 -0.60 -0.13 0.00 0.00 0.00 0.00 60.65 60.06 3iss s ILE 181 Cb -0.12 -1.43 -0.01 0.00 0.01 0.00 0.00 42.46 40.91 3iss s ILE 181 CO 0.03 0.45 0.24 -0.63 0.00 0.00 0.00 174.94 175.03 3iss s ILE 182 N 1.49 5.21 -0.07 2.92 1.01 -0.21 0.13 121.20 131.69 3iss s ILE 182 Ca 0.05 -0.29 -0.06 0.00 0.00 0.00 0.00 60.65 60.34 3iss s ILE 182 Cb -0.13 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 3iss s ILE 182 CO -0.10 -0.04 0.19 -1.61 0.00 0.00 0.00 174.94 173.38 3iss s GLU 183 N 1.71 3.49 -1.00 2.79 0.41 0.57 -1.88 118.70 124.80 3iss s GLU 183 Ca 0.06 -0.13 -0.03 0.00 -0.41 0.00 0.00 54.97 54.46 3iss s GLU 183 Cb -0.18 -3.15 0.00 0.00 -1.78 0.00 0.00 34.13 29.03 3iss s GLU 183 CO 0.10 0.73 0.38 -1.71 -0.49 0.00 0.00 175.26 174.27 3iss n ASN 184 N 1.59 -4.46 -4.77 -0.19 4.05 -0.39 -1.35 115.26 109.74 3iss n ASN 184 Ca -0.16 -0.18 -0.33 0.00 0.45 0.00 0.00 54.58 54.36 3iss n ASN 184 Cb 0.54 -3.34 0.06 0.00 1.23 0.00 0.00 39.78 38.27 3iss n ASN 184 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3iss s ALA 185 N -2.93 2.41 0.31 5.20 0.00 -0.09 -4.59 121.76 122.06 3iss s ALA 185 Ca 0.19 0.54 -0.29 0.00 0.00 0.00 0.00 51.96 52.40 3iss s ALA 185 Cb -0.08 -3.33 -0.10 0.00 0.00 0.00 0.00 23.12 19.61 3iss s ALA 185 CO 0.23 -1.40 1.17 0.00 0.00 0.00 0.00 175.76 175.77 3iss s ALA 186 N -2.38 3.42 -1.71 0.00 0.00 -1.26 -4.48 121.76 115.35 3iss s ALA 186 Ca 0.67 1.01 0.19 0.00 0.00 0.00 0.00 51.96 53.84 3iss s ALA 186 Cb -0.21 -3.38 0.53 0.00 0.00 0.00 0.00 23.12 20.07 3iss s ALA 186 CO 0.44 -0.34 1.44 0.54 0.00 0.00 0.00 175.76 177.84 3iss n ARG 187 N 0.98 2.72 -1.59 0.00 3.00 -1.26 -4.66 116.66 115.85 3iss n ARG 187 Ca -0.00 -2.45 -0.46 0.00 -0.01 0.00 0.00 57.85 54.93 3iss n ARG 187 Cb 0.44 -1.48 -0.02 0.00 0.00 0.00 0.00 32.46 31.40 3iss n ARG 187 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 3iss n GLU 188 N 1.32 1.32 -0.28 5.56 4.71 -1.26 -4.59 120.64 127.42 3iss n GLU 188 Ca 0.20 0.47 0.18 0.00 -0.01 0.00 0.00 57.16 58.00 3iss n GLU 188 Cb 0.56 -1.89 0.46 0.00 -1.01 0.00 0.00 31.44 29.57 3iss n GLU 188 CO 0.00 0.00 0.00 -1.35 0.09 0.00 0.00 177.13 175.87 3iss h PRO 189 N 2.53 0.48 0.00 3.49 0.11 -1.96 0.22 132.00 136.87 3iss h PRO 189 Ca -0.41 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.65 3iss h PRO 189 Cb 1.34 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 3iss h PRO 189 CO 0.64 0.32 -0.13 0.93 -0.21 0.00 0.00 178.00 179.55 3iss h GLU 190 N 0.50 0.00 -0.03 1.05 3.07 -1.89 -1.17 114.58 116.11 3iss h GLU 190 Ca 0.50 0.00 -0.20 0.00 -0.50 0.00 0.00 59.36 59.16 3iss h GLU 190 Cb 1.12 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.03 3iss h GLU 190 CO -0.23 0.13 -0.84 0.82 -1.40 0.00 0.00 179.01 177.50 3iss h ILE 191 N 0.00 1.41 -0.07 3.13 2.04 -0.90 -2.18 117.51 120.94 3iss h ILE 191 Ca -0.00 -2.35 -0.01 0.00 1.00 0.00 0.00 64.86 63.50 3iss h ILE 191 Cb 0.36 2.30 -0.00 0.00 -0.74 0.00 0.00 36.82 38.74 3iss h ILE 191 CO 0.02 0.70 0.02 0.58 0.00 0.00 0.00 178.15 179.47 3iss h VAL 192 N 0.22 1.18 -0.79 1.67 2.07 -1.15 -1.11 116.25 118.34 3iss h VAL 192 Ca -0.05 -0.54 0.03 0.00 0.82 0.00 0.00 66.70 66.96 3iss h VAL 192 Cb 1.44 1.42 -0.05 0.00 -1.52 0.00 0.00 31.29 32.58 3iss h VAL 192 CO 0.14 0.15 0.51 -0.78 0.02 0.00 0.00 177.57 177.61 3iss h ASP 193 N -0.09 0.84 -0.68 0.57 3.58 -1.26 0.13 116.42 119.50 3iss h ASP 193 Ca 0.02 -0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.42 3iss h ASP 193 Cb 0.23 -0.19 -0.03 0.00 1.72 0.00 0.00 39.33 41.06 3iss h ASP 193 CO -0.00 0.58 0.24 0.74 -2.88 0.00 0.00 179.24 177.91 3iss h THR 194 N 0.99 1.25 -0.53 2.25 2.02 -1.26 -1.05 112.91 116.57 3iss h THR 194 Ca 0.32 -0.83 -0.05 0.00 0.77 0.00 0.00 66.41 66.61 3iss h THR 194 Cb 0.01 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 3iss h THR 194 CO -0.11 0.33 0.12 0.00 0.37 0.00 0.00 175.52 176.23 3iss h ALA 195 N 1.10 0.70 -0.11 6.16 0.00 -0.54 -1.80 119.26 124.77 3iss h ALA 195 Ca 0.22 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 3iss h ALA 195 Cb 0.27 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3iss h ALA 195 CO -0.01 0.40 -0.23 -0.91 0.00 0.00 0.00 179.25 178.50 3iss h ASN 196 N 0.74 0.19 -0.27 0.00 2.35 -0.69 -0.57 115.58 117.34 3iss h ASN 196 Ca 0.17 -0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 55.82 3iss h ASN 196 Cb 0.35 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 3iss h ASN 196 CO 0.00 0.43 -0.00 0.15 -1.65 0.00 0.00 177.43 176.37 3iss h PHE 197 N 0.18 0.52 -0.48 1.19 3.57 -1.05 -2.55 116.94 118.32 3iss h PHE 197 Ca 0.03 -0.09 0.03 0.00 3.53 0.00 0.00 57.97 61.47 3iss h PHE 197 Cb 0.51 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.08 3iss h PHE 197 CO 0.01 0.63 0.27 -0.07 -2.23 0.00 0.00 178.31 176.92 3iss h LEU 198 N 0.26 0.41 -1.13 0.59 3.38 -0.81 -2.06 115.31 115.96 3iss h LEU 198 Ca 0.08 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.07 3iss h LEU 198 Cb 0.43 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 3iss h LEU 198 CO 0.01 0.29 0.59 0.40 0.09 0.00 0.00 178.44 179.82 3iss h ILE 199 N 0.53 1.23 -0.19 1.22 2.04 -1.13 -0.48 117.51 120.73 3iss h ILE 199 Ca 0.20 -0.41 0.03 0.00 1.00 0.00 0.00 64.86 65.67 3iss h ILE 199 Cb 0.06 -0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.05 3iss h ILE 199 CO -0.11 0.22 0.13 0.74 0.00 0.00 0.00 178.15 179.13 3iss h THR 200 N 1.20 0.98 -0.00 -0.27 2.02 -0.94 0.51 112.91 116.40 3iss h THR 200 Ca 0.32 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.46 3iss h THR 200 Cb -0.14 0.83 0.00 0.00 -1.74 0.00 0.00 68.15 67.10 3iss h THR 200 CO -0.07 0.03 -0.09 0.18 0.37 0.00 0.00 175.52 175.93 3iss n LEU 201 N -4.50 0.29 0.00 2.58 4.77 -0.27 -4.87 117.00 114.99 3iss n LEU 201 Ca 0.01 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 3iss n LEU 201 Cb 0.17 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 3iss n LEU 201 CO 0.35 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 3iss n GLY 202 N 1.32 1.32 3.87 -0.72 0.00 0.17 -1.36 105.19 109.78 3iss n GLY 202 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 3iss n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iss s ALA 203 N -2.00 2.99 -0.37 4.61 0.00 -0.71 -4.93 121.76 121.35 3iss s ALA 203 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 51.96 51.82 3iss s ALA 203 Cb 0.00 -3.07 0.10 0.00 0.00 0.00 0.00 23.12 20.15 3iss s ALA 203 CO 0.00 -0.88 0.12 0.15 0.00 0.00 0.00 175.76 175.15 3iss s LYS 204 N -5.22 1.80 -0.02 0.00 1.02 -1.26 -4.34 119.74 111.72 3iss s LYS 204 Ca 0.56 -1.81 0.04 0.00 0.02 0.00 0.00 55.97 54.78 3iss s LYS 204 Cb -0.11 -3.38 -0.01 0.00 -0.52 0.00 0.00 37.83 33.81 3iss s LYS 204 CO 0.53 -0.98 -0.13 0.42 -0.92 0.00 0.00 175.35 174.27 3iss s ILE 205 N 1.04 1.06 0.01 2.17 1.01 -1.26 -1.05 121.20 124.19 3iss s ILE 205 Ca 0.08 -0.55 -0.01 0.00 0.00 0.00 0.00 60.65 60.17 3iss s ILE 205 Cb -0.21 -0.90 -0.01 0.00 0.01 0.00 0.00 42.46 41.35 3iss s ILE 205 CO -0.06 0.31 -0.00 -0.94 0.00 0.00 0.00 174.94 174.25 3iss s SER 206 N -0.15 0.18 0.00 3.58 1.04 -0.10 -4.91 113.70 113.34 3iss s SER 206 Ca 0.02 -0.40 0.00 0.00 0.48 0.00 0.00 55.95 56.05 3iss s SER 206 Cb -0.07 0.11 0.00 0.00 0.10 0.00 0.00 66.02 66.16 3iss s SER 206 CO 0.00 -0.28 0.00 0.61 0.98 0.00 0.00 173.24 174.55 3iss n GLY 207 N 1.75 0.55 3.70 7.32 0.00 -1.26 -0.03 105.19 117.21 3iss n GLY 207 Ca -0.22 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.36 3iss n GLY 207 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iss n GLN 208 N -2.00 2.37 -0.02 1.61 0.00 -1.26 -0.86 117.38 117.22 3iss n GLN 208 Ca 0.00 0.85 0.00 0.00 0.00 0.00 0.00 57.00 57.85 3iss n GLN 208 Cb 0.00 -2.59 0.00 0.00 0.00 0.00 0.00 30.24 27.65 3iss n GLN 208 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3iss n GLY 209 N 2.60 0.60 3.78 2.61 0.00 -1.26 -4.93 105.19 108.59 3iss n GLY 209 Ca 0.12 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.87 3iss n GLY 209 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3iss s THR 210 N -2.22 1.94 -1.01 2.61 -4.23 -0.04 -4.78 115.64 107.91 3iss s THR 210 Ca 0.00 -1.71 0.17 0.00 -1.18 0.00 0.00 61.69 58.97 3iss s THR 210 Cb 0.00 -2.65 0.14 0.00 1.34 0.00 0.00 72.50 71.33 3iss s THR 210 CO 0.00 0.00 1.53 -0.90 -0.54 0.00 0.00 174.62 174.71 3iss n ASP 211 N -1.36 0.00 -3.96 3.99 5.68 -1.26 -4.60 116.55 115.03 3iss n ASP 211 Ca -0.04 0.49 -0.30 0.00 -0.50 0.00 0.00 54.79 54.43 3iss n ASP 211 Cb 0.65 -0.49 -0.16 0.00 -1.14 0.00 0.00 41.12 39.98 3iss n ASP 211 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 3iss s ARG 212 N -2.99 1.80 -0.18 0.11 3.52 -1.26 -0.91 118.95 119.04 3iss s ARG 212 Ca 0.08 -0.88 -0.05 0.00 -0.13 0.00 0.00 55.73 54.75 3iss s ARG 212 Cb 0.11 -2.45 -0.03 0.00 -1.56 0.00 0.00 34.95 31.02 3iss s ARG 212 CO 0.30 -0.50 0.01 0.42 -0.81 0.00 0.00 175.30 174.72 3iss s ILE 213 N 1.42 4.23 -0.20 4.11 1.01 -0.79 -4.33 121.20 126.65 3iss s ILE 213 Ca -0.03 -0.23 -0.03 0.00 0.00 0.00 0.00 60.65 60.36 3iss s ILE 213 Cb -0.17 -2.89 -0.01 0.00 0.01 0.00 0.00 42.46 39.39 3iss s ILE 213 CO -0.07 0.46 -0.06 -0.69 0.00 0.00 0.00 174.94 174.58 3iss s VAL 214 N 0.56 3.40 -0.16 2.92 1.01 0.95 -1.05 120.40 128.03 3iss s VAL 214 Ca -0.00 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.48 3iss s VAL 214 Cb -0.14 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.72 3iss s VAL 214 CO 0.02 0.45 -0.16 -0.63 0.00 0.00 0.00 175.10 174.78 3iss s ILE 215 N 1.13 2.57 -0.40 2.22 1.09 -0.26 -0.92 121.20 126.62 3iss s ILE 215 Ca 0.01 -0.80 -0.14 0.00 -1.10 0.00 0.00 60.65 58.63 3iss s ILE 215 Cb -0.15 -2.09 0.02 0.00 -1.06 0.00 0.00 42.46 39.19 3iss s ILE 215 CO -0.01 0.51 0.28 -0.70 -0.10 0.00 0.00 174.94 174.93 3iss s GLU 216 N 0.95 3.00 0.34 2.79 2.56 -0.21 -0.57 118.70 127.55 3iss s GLU 216 Ca -0.03 -0.99 -0.28 0.00 0.00 0.00 0.00 54.97 53.67 3iss s GLU 216 Cb -0.15 -3.92 -0.12 0.00 2.00 0.00 0.00 34.13 31.94 3iss s GLU 216 CO -0.03 -0.71 1.37 0.41 -0.56 0.00 0.00 175.26 175.74 3iss n GLY 217 N 5.13 0.80 3.58 -1.50 0.00 0.01 -4.00 105.19 109.21 3iss n GLY 217 Ca -0.11 0.33 -0.26 0.00 0.00 0.00 0.00 46.02 45.98 3iss n GLY 217 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3iss s VAL 218 N -0.98 1.87 -0.22 1.61 -7.23 -0.88 -4.69 120.40 109.88 3iss s VAL 218 Ca 0.56 -2.02 0.22 0.00 -1.81 0.00 0.00 61.98 58.93 3iss s VAL 218 Cb -0.55 -2.91 -0.03 0.00 0.56 0.00 0.00 36.38 33.45 3iss s VAL 218 CO 0.61 -0.03 1.00 -1.84 -0.31 0.00 0.00 175.10 174.53 3iss n GLU 219 N -0.89 0.61 -3.51 4.82 0.28 -1.26 -4.32 120.64 116.37 3iss n GLU 219 Ca -0.05 0.13 -0.15 0.00 -0.16 0.00 0.00 57.16 56.93 3iss n GLU 219 Cb 0.66 -1.82 -0.05 0.00 1.43 0.00 0.00 31.44 31.67 3iss n GLU 219 CO 0.00 0.00 0.00 -0.98 -0.16 0.00 0.00 177.13 175.99 3iss s ARG 220 N -3.31 1.02 0.03 3.44 1.70 -1.26 -5.05 118.95 115.51 3iss s ARG 220 Ca -0.01 0.07 0.06 0.00 -0.47 0.00 0.00 55.73 55.37 3iss s ARG 220 Cb 0.10 0.48 -0.03 0.00 -0.57 0.00 0.00 34.95 34.92 3iss s ARG 220 CO 0.80 -0.36 -0.14 -0.51 -1.08 0.00 0.00 175.30 174.01 3iss s LEU 221 N -1.56 2.79 0.00 -1.89 1.43 -1.26 -4.94 118.68 113.25 3iss s LEU 221 Ca -0.06 -0.33 0.00 0.00 -1.03 0.00 0.00 54.13 52.71 3iss s LEU 221 Cb -0.00 -1.62 0.00 0.00 0.03 0.00 0.00 46.19 44.59 3iss s LEU 221 CO 0.03 0.26 0.00 0.61 0.23 0.00 0.00 176.35 177.48 3iss n GLY 222 N 1.55 1.74 0.00 -3.19 0.00 -0.47 -1.10 105.19 103.73 3iss n GLY 222 Ca -0.16 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.17 3iss n GLY 222 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iss n GLY 223 N 5.00 5.94 0.00 -0.02 0.00 -1.26 -3.32 105.19 111.53 3iss n GLY 223 Ca 0.00 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 44.05 3iss n GLY 223 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iss n GLY 224 N 3.81 -0.21 3.04 -0.02 0.00 -0.98 -4.59 105.19 106.24 3iss n GLY 224 Ca 0.00 -1.54 -0.23 0.00 0.00 0.00 0.00 46.02 44.25 3iss n GLY 224 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iss s VAL 225 N -2.57 1.04 -0.06 1.61 1.01 -1.26 -1.20 120.40 118.97 3iss s VAL 225 Ca 0.00 -0.48 -0.04 0.00 0.00 0.00 0.00 61.98 61.46 3iss s VAL 225 Cb 0.00 -0.93 0.02 0.00 0.00 0.00 0.00 36.38 35.47 3iss s VAL 225 CO 0.00 0.32 0.14 -0.47 0.00 0.00 0.00 175.10 175.09 3iss s TYR 226 N 0.32 -0.16 -0.21 5.22 5.04 -0.74 -5.00 117.35 121.82 3iss s TYR 226 Ca -0.07 0.41 -0.07 0.00 -2.44 0.00 0.00 57.07 54.90 3iss s TYR 226 Cb -0.12 0.02 -0.03 0.00 0.35 0.00 0.00 41.96 42.18 3iss s TYR 226 CO 0.02 -0.10 0.06 0.50 -1.34 0.00 0.00 175.55 174.68 3iss s ARG 227 N 0.39 3.80 0.27 4.97 3.52 -1.26 0.16 118.95 130.80 3iss s ARG 227 Ca -0.03 -0.42 -0.29 0.00 -0.13 0.00 0.00 55.73 54.86 3iss s ARG 227 Cb -0.04 -3.23 -0.09 0.00 -1.56 0.00 0.00 34.95 30.03 3iss s ARG 227 CO -0.02 0.07 1.12 0.08 -0.81 0.00 0.00 175.30 175.74 3iss s VAL 228 N 0.92 3.44 0.99 7.11 1.01 -0.84 -4.95 120.40 128.09 3iss s VAL 228 Ca 0.03 1.42 -0.12 0.00 0.00 0.00 0.00 61.98 63.31 3iss s VAL 228 Cb -0.14 -3.90 0.18 0.00 0.00 0.00 0.00 36.38 32.52 3iss s VAL 228 CO 0.03 0.33 1.08 -1.48 0.00 0.00 0.00 175.10 175.06 3iss s LEU 229 N -1.33 1.76 0.59 3.92 2.34 -1.26 -4.71 118.68 119.99 3iss s LEU 229 Ca 0.46 1.40 -0.18 0.00 0.06 0.00 0.00 54.13 55.86 3iss s LEU 229 Cb -0.33 -3.63 -0.04 0.00 -0.56 0.00 0.00 46.19 41.64 3iss s LEU 229 CO 0.41 -3.14 1.13 -2.84 -1.06 0.00 0.00 176.35 170.86 3iss s PRO 230 N -4.86 3.14 -0.51 1.48 0.02 -1.26 -0.64 135.00 132.37 3iss s PRO 230 Ca 0.65 1.55 -0.28 0.00 0.02 0.00 0.00 61.00 62.94 3iss s PRO 230 Cb -0.20 -1.98 0.03 0.00 0.02 0.00 0.00 34.50 32.37 3iss s PRO 230 CO 0.59 -1.01 1.12 0.34 -0.33 0.00 0.00 177.00 177.71 3iss s ASP 231 N -2.03 6.56 0.40 2.53 -1.08 -0.75 -4.29 116.67 118.00 3iss s ASP 231 Ca 0.71 0.29 0.16 0.00 -0.52 0.00 0.00 52.55 53.20 3iss s ASP 231 Cb -0.23 -2.53 0.87 0.00 -1.46 0.00 0.00 42.92 39.56 3iss s ASP 231 CO 0.32 -1.29 1.87 0.08 0.52 0.00 0.00 175.17 176.67 3iss h ARG 232 N 9.30 0.00 -0.10 4.34 0.11 -1.93 -1.99 114.38 124.12 3iss h ARG 232 Ca -0.24 0.00 -0.18 0.00 0.10 0.00 0.00 59.98 59.66 3iss h ARG 232 Cb 1.06 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.15 3iss h ARG 232 CO 1.13 0.31 -0.64 0.82 0.10 0.00 0.00 179.97 181.69 3iss h ILE 233 N 0.00 1.34 -0.58 0.08 1.08 -1.96 0.13 117.51 117.60 3iss h ILE 233 Ca -0.00 -1.94 -0.01 0.00 -0.39 0.00 0.00 64.86 62.53 3iss h ILE 233 Cb 0.61 2.20 -0.03 0.00 -3.07 0.00 0.00 36.82 36.53 3iss h ILE 233 CO 0.04 0.59 0.34 -0.08 -0.69 0.00 0.00 178.15 178.35 3iss h GLU 234 N 0.24 0.80 -0.32 2.37 4.81 -1.93 -1.37 114.58 119.17 3iss h GLU 234 Ca -0.05 -0.08 0.04 0.00 -0.13 0.00 0.00 59.36 59.14 3iss h GLU 234 Cb 1.29 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 30.47 3iss h GLU 234 CO 0.13 0.59 0.07 1.15 -0.73 0.00 0.00 179.01 180.22 3iss h THR 235 N 0.78 0.86 -0.65 0.32 2.02 -1.22 -2.08 112.91 112.95 3iss h THR 235 Ca 0.21 -0.07 -0.03 0.00 0.77 0.00 0.00 66.41 67.30 3iss h THR 235 Cb 0.00 0.65 -0.03 0.00 -1.74 0.00 0.00 68.15 67.03 3iss h THR 235 CO -0.04 0.04 0.30 1.23 0.37 0.00 0.00 175.52 177.42 3iss h GLY 236 N 0.19 0.99 1.26 2.16 0.00 -0.76 -1.85 103.07 105.06 3iss h GLY 236 Ca 0.15 -0.48 -0.08 0.00 0.00 0.00 0.00 47.33 46.93 3iss h GLY 236 CO -0.19 0.45 0.04 -0.84 0.00 0.00 0.00 176.54 176.00 3iss h THR 237 N 0.92 1.25 0.17 4.70 2.02 -0.59 -0.79 112.91 120.58 3iss h THR 237 Ca 0.22 -1.01 -0.31 0.00 0.77 0.00 0.00 66.41 66.08 3iss h THR 237 Cb 0.11 0.79 0.01 0.00 -1.74 0.00 0.00 68.15 67.33 3iss h THR 237 CO -0.03 0.37 -1.45 -0.26 0.37 0.00 0.00 175.52 174.52 3iss h PHE 238 N 0.84 0.66 -0.89 3.16 0.04 -1.20 -1.34 116.94 118.20 3iss h PHE 238 Ca 0.16 -0.48 0.08 0.00 2.80 0.00 0.00 57.97 60.54 3iss h PHE 238 Cb 0.45 -0.03 -0.07 0.00 2.20 0.00 0.00 35.95 38.50 3iss h PHE 238 CO 0.03 1.44 0.55 -0.07 -0.60 0.00 0.00 178.31 179.65 3iss h LEU 239 N 0.10 0.83 -0.66 1.54 3.38 -1.18 -1.69 115.31 117.62 3iss h LEU 239 Ca -0.22 0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.65 3iss h LEU 239 Cb 2.06 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 42.66 3iss h LEU 239 CO 0.21 0.49 -0.35 0.58 0.09 0.00 0.00 178.44 179.46 3iss h VAL 240 N 0.94 1.29 -0.78 1.22 2.07 -1.07 -1.58 116.25 118.34 3iss h VAL 240 Ca 0.41 -1.50 0.09 0.00 0.82 0.00 0.00 66.70 66.52 3iss h VAL 240 Cb 0.30 1.44 -0.07 0.00 -1.52 0.00 0.00 31.29 31.44 3iss h VAL 240 CO -0.22 0.48 0.43 0.00 0.02 0.00 0.00 177.57 178.29 3iss h ALA 241 N 1.06 1.09 -0.03 1.67 0.00 -0.39 -1.40 119.26 121.27 3iss h ALA 241 Ca 0.06 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3iss h ALA 241 Cb 0.86 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 3iss h ALA 241 CO 0.07 0.07 -0.02 0.00 0.00 0.00 0.00 179.25 179.37 3iss h ALA 242 N 1.43 0.04 -0.26 0.00 0.00 -1.11 -3.11 119.26 116.25 3iss h ALA 242 Ca 0.37 -0.24 0.07 0.00 0.00 0.00 0.00 54.91 55.11 3iss h ALA 242 Cb 0.32 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3iss h ALA 242 CO -0.24 -0.21 0.19 0.00 0.00 0.00 0.00 179.25 179.00 3iss h ALA 243 N 0.56 2.19 0.00 0.00 0.00 -0.78 -1.17 119.26 120.06 3iss h ALA 243 Ca 0.01 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3iss h ALA 243 Cb 0.49 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3iss h ALA 243 CO 0.01 -0.33 -1.16 0.44 0.00 0.00 0.00 179.25 178.21 3iss n ILE 244 N -4.36 0.72 -0.05 0.00 -5.35 -0.57 -3.82 119.36 105.92 3iss n ILE 244 Ca 0.03 -0.58 0.11 0.00 -0.27 0.00 0.00 62.75 62.04 3iss n ILE 244 Cb 0.35 -0.41 0.29 0.00 -1.74 0.00 0.00 39.64 38.13 3iss n ILE 244 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3iss n SER 245 N -2.70 3.55 -3.34 7.28 3.41 -0.93 -4.93 113.62 115.96 3iss n SER 245 Ca -0.03 -1.99 -0.24 0.00 -0.26 0.00 0.00 58.87 56.36 3iss n SER 245 Cb 0.62 -0.41 0.05 0.00 -0.26 0.00 0.00 64.21 64.21 3iss n SER 245 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3iss n ARG 246 N 1.46 -6.26 0.00 4.33 1.74 -1.00 -4.48 116.66 112.45 3iss n ARG 246 Ca 0.22 0.84 0.00 0.00 -0.77 0.00 0.00 57.85 58.14 3iss n ARG 246 Cb 0.57 -5.79 0.00 0.00 -1.02 0.00 0.00 32.46 26.22 3iss n ARG 246 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3iss n GLY 247 N -1.74 3.52 3.36 -0.13 0.00 -0.49 -4.12 105.19 105.59 3iss n GLY 247 Ca -0.05 -1.98 -0.14 0.00 0.00 0.00 0.00 46.02 43.85 3iss n GLY 247 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3iss s LYS 248 N 2.68 0.61 -0.03 1.61 -2.85 -1.23 -2.20 119.74 118.34 3iss s LYS 248 Ca 0.00 0.49 -0.14 0.00 -1.00 0.00 0.00 55.97 55.32 3iss s LYS 248 Cb 0.00 0.29 0.02 0.00 -2.06 0.00 0.00 37.83 36.09 3iss s LYS 248 CO 0.00 -0.11 0.30 -1.50 0.10 0.00 0.00 175.35 174.15 3iss s ILE 249 N -0.12 0.05 -0.09 3.79 2.07 -0.43 -1.60 121.20 124.87 3iss s ILE 249 Ca -0.03 -0.42 0.03 0.00 -1.41 0.00 0.00 60.65 58.83 3iss s ILE 249 Cb -0.03 -0.58 -0.01 0.00 0.13 0.00 0.00 42.46 41.97 3iss s ILE 249 CO 0.02 -0.23 -0.21 -0.63 -1.91 0.00 0.00 174.94 171.99 3iss s ILE 250 N -1.11 2.41 -0.23 2.00 -1.09 -0.67 -1.46 121.20 121.05 3iss s ILE 250 Ca -0.12 -0.91 -0.08 0.00 -2.23 0.00 0.00 60.65 57.32 3iss s ILE 250 Cb -0.05 -1.94 -0.04 0.00 -1.58 0.00 0.00 42.46 38.86 3iss s ILE 250 CO 0.04 0.56 0.08 0.00 -1.23 0.00 0.00 174.94 174.38 3iss s ARG 252 N 1.16 3.13 -1.05 0.00 1.81 0.53 -2.03 118.95 122.50 3iss s ARG 252 Ca 0.05 -0.59 -0.01 0.00 -1.72 0.00 0.00 55.73 53.45 3iss s ARG 252 Cb -0.14 -2.86 0.00 0.00 -0.45 0.00 0.00 34.95 31.50 3iss s ARG 252 CO 0.04 0.58 0.89 0.09 -0.68 0.00 0.00 175.30 176.21 3iss n ASN 253 N 0.33 -2.74 -4.86 0.23 3.02 -0.71 -0.65 115.26 109.88 3iss n ASN 253 Ca -0.07 -0.52 -0.21 0.00 -0.03 0.00 0.00 54.58 53.75 3iss n ASN 253 Cb 0.51 -4.45 -0.04 0.00 -0.61 0.00 0.00 39.78 35.20 3iss n ASN 253 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3iss s ALA 254 N -3.30 3.92 -0.45 5.41 0.00 -0.21 -4.44 121.76 122.69 3iss s ALA 254 Ca 0.10 -1.77 0.02 0.00 0.00 0.00 0.00 51.96 50.31 3iss s ALA 254 Cb -0.04 -1.08 0.15 0.00 0.00 0.00 0.00 23.12 22.15 3iss s ALA 254 CO 0.63 -0.09 0.28 -1.14 0.00 0.00 0.00 175.76 175.44 3iss s GLN 255 N -4.05 1.24 0.41 0.00 0.74 -1.26 -4.27 119.66 112.48 3iss s GLN 255 Ca 0.44 -2.08 0.15 0.00 0.05 0.00 0.00 55.36 53.91 3iss s GLN 255 Cb -0.04 -2.13 1.01 0.00 1.10 0.00 0.00 33.01 32.94 3iss s GLN 255 CO 0.27 -1.23 1.90 -1.35 -0.55 0.00 0.00 175.29 174.33 3iss h PRO 256 N 6.41 0.46 0.00 1.67 0.11 -1.87 -1.87 132.00 136.91 3iss h PRO 256 Ca 0.07 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.15 3iss h PRO 256 Cb 0.91 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.92 3iss h PRO 256 CO 0.46 0.31 0.00 -0.40 -0.21 0.00 0.00 178.00 178.15 3iss n ASP 257 N -4.50 0.00 -0.02 -2.05 5.68 -1.26 -1.08 116.55 113.31 3iss n ASP 257 Ca 0.16 0.17 0.11 0.00 -0.50 0.00 0.00 54.79 54.74 3iss n ASP 257 Cb 0.55 -0.26 0.15 0.00 -1.14 0.00 0.00 41.12 40.42 3iss n ASP 257 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.20 176.28 3iss n THR 258 N -1.26 0.00 -1.80 2.12 -1.04 -0.70 -4.40 114.28 107.20 3iss n THR 258 Ca 0.03 -0.01 0.05 0.00 -2.04 0.00 0.00 64.05 62.08 3iss n THR 258 Cb 0.04 0.48 0.12 0.00 -1.82 0.00 0.00 70.33 69.15 3iss n THR 258 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3iss n LEU 259 N -1.43 1.85 0.03 -4.42 4.77 -0.24 -4.90 117.00 112.65 3iss n LEU 259 Ca 0.05 -2.88 -0.12 0.00 -0.03 0.00 0.00 56.01 53.03 3iss n LEU 259 Cb 0.34 -0.30 -0.06 0.00 -2.33 0.00 0.00 43.42 41.07 3iss n LEU 259 CO 0.37 0.89 0.61 0.44 -1.33 0.00 0.00 177.39 178.37 3iss h ASP 260 N 0.70 -1.17 -0.53 -1.43 3.32 -1.77 -1.00 116.42 114.54 3iss h ASP 260 Ca -0.06 0.15 0.03 0.00 0.02 0.00 0.00 57.03 57.17 3iss h ASP 260 Cb 1.30 0.47 -0.04 0.00 0.22 0.00 0.00 39.33 41.28 3iss h ASP 260 CO 0.03 -0.41 0.31 0.00 -1.72 0.00 0.00 179.24 177.45 3iss h ALA 261 N 0.18 0.69 -0.45 3.45 0.00 -1.90 -1.69 119.26 119.54 3iss h ALA 261 Ca 0.07 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 3iss h ALA 261 Cb 0.60 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 3iss h ALA 261 CO -0.34 0.01 0.27 0.28 0.00 0.00 0.00 179.25 179.47 3iss h VAL 262 N 0.62 1.14 -0.66 0.00 2.07 -1.78 -1.62 116.25 116.02 3iss h VAL 262 Ca 0.22 -0.31 -0.08 0.00 0.82 0.00 0.00 66.70 67.35 3iss h VAL 262 Cb 0.04 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 3iss h VAL 262 CO -0.11 0.14 0.08 -0.07 0.02 0.00 0.00 177.57 177.64 3iss h LEU 263 N 0.59 1.07 -0.83 2.57 3.38 -0.93 -1.36 115.31 119.81 3iss h LEU 263 Ca 0.16 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 3iss h LEU 263 Cb -0.01 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.42 3iss h LEU 263 CO -0.03 1.07 0.45 0.00 0.09 0.00 0.00 178.44 180.02 3iss h ALA 264 N 1.05 1.06 -0.31 1.53 0.00 -1.14 -1.40 119.26 120.04 3iss h ALA 264 Ca 0.20 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 3iss h ALA 264 Cb 0.47 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3iss h ALA 264 CO 0.02 0.57 -0.38 -0.22 0.00 0.00 0.00 179.25 179.23 3iss h LYS 265 N 1.15 0.73 -0.57 0.00 1.63 -0.95 -2.24 116.57 116.31 3iss h LYS 265 Ca 0.29 -0.37 -0.02 0.00 -0.85 0.00 0.00 60.65 59.70 3iss h LYS 265 Cb 0.03 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 31.64 3iss h LYS 265 CO -0.05 0.98 0.28 -0.07 -3.45 0.00 0.00 179.45 177.14 3iss h LEU 266 N 0.60 0.74 -0.59 5.20 3.38 -0.89 -1.63 115.31 122.12 3iss h LEU 266 Ca 0.05 -0.13 0.05 0.00 0.09 0.00 0.00 57.88 57.95 3iss h LEU 266 Cb 0.92 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.43 3iss h LEU 266 CO 0.08 0.66 0.31 0.03 0.09 0.00 0.00 178.44 179.61 3iss h ARG 267 N 0.77 0.57 -0.03 1.13 3.08 -1.10 -0.71 114.38 118.08 3iss h ARG 267 Ca 0.20 -0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.22 3iss h ARG 267 Cb 0.11 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 3iss h ARG 267 CO -0.03 0.38 0.03 -0.44 -1.07 0.00 0.00 179.97 178.84 3iss h ASP 268 N 0.59 0.00 0.64 7.04 3.32 -0.86 0.51 116.42 127.65 3iss h ASP 268 Ca 0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.32 3iss h ASP 268 Cb 0.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.72 3iss h ASP 268 CO -0.18 0.00 -0.04 0.00 -1.72 0.00 0.00 179.24 177.30 3iss n ALA 269 N -2.42 2.53 0.00 3.45 0.00 -0.34 -4.72 120.51 119.01 3iss n ALA 269 Ca -0.02 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.26 3iss n ALA 269 Cb 0.12 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.12 3iss n ALA 269 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3iss n GLY 270 N 1.34 1.21 3.88 0.00 0.00 0.18 -0.09 105.19 111.71 3iss n GLY 270 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 3iss n GLY 270 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iss s ALA 271 N -2.00 3.35 -0.38 4.61 0.00 -0.82 -4.89 121.76 121.63 3iss s ALA 271 Ca 0.00 -0.22 -0.10 0.00 0.00 0.00 0.00 51.96 51.64 3iss s ALA 271 Cb 0.00 -2.70 0.04 0.00 0.00 0.00 0.00 23.12 20.46 3iss s ALA 271 CO 0.00 -0.03 0.20 0.34 0.00 0.00 0.00 175.76 176.28 3iss s ASP 272 N -3.21 5.67 -0.06 0.00 2.15 -0.44 -4.46 116.67 116.33 3iss s ASP 272 Ca 0.51 -1.11 0.06 0.00 0.43 0.00 0.00 52.55 52.44 3iss s ASP 272 Cb -0.10 -2.00 -0.01 0.00 -0.30 0.00 0.00 42.92 40.51 3iss s ASP 272 CO 0.32 -0.41 -0.24 -0.63 -0.17 0.00 0.00 175.17 174.04 3iss s ILE 273 N 1.51 1.98 0.05 4.11 1.01 -1.26 -0.75 121.20 127.86 3iss s ILE 273 Ca 0.02 -1.02 0.05 0.00 0.00 0.00 0.00 60.65 59.70 3iss s ILE 273 Cb -0.20 -1.68 -0.03 0.00 0.01 0.00 0.00 42.46 40.57 3iss s ILE 273 CO 0.05 0.55 -0.14 -1.61 0.00 0.00 0.00 174.94 173.79 3iss s GLU 274 N -0.08 0.88 0.02 2.79 2.02 -0.74 -4.99 118.70 118.59 3iss s GLU 274 Ca -0.05 -0.85 0.07 0.00 0.02 0.00 0.00 54.97 54.16 3iss s GLU 274 Cb -0.14 -0.89 -0.02 0.00 0.10 0.00 0.00 34.13 33.18 3iss s GLU 274 CO 0.04 0.21 -0.20 0.14 0.02 0.00 0.00 175.26 175.47 3iss s VAL 275 N -1.04 1.63 0.00 2.63 -7.23 -1.26 -0.36 120.40 114.77 3iss s VAL 275 Ca -0.00 -1.04 0.00 0.00 -1.81 0.00 0.00 61.98 59.13 3iss s VAL 275 Cb -0.09 -1.39 0.00 0.00 0.56 0.00 0.00 36.38 35.47 3iss s VAL 275 CO 0.02 0.32 0.00 0.61 -0.31 0.00 0.00 175.10 175.74 3iss n GLY 276 N 2.20 3.42 0.15 2.32 0.00 -0.05 -5.00 105.19 108.23 3iss n GLY 276 Ca -0.16 -1.98 0.11 0.00 0.00 0.00 0.00 46.02 43.99 3iss n GLY 276 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3iss h GLU 277 N 0.00 0.00 0.00 1.61 4.81 -2.01 -3.39 114.58 115.61 3iss h GLU 277 Ca 0.00 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 3iss h GLU 277 Cb 0.00 0.00 -0.23 0.00 0.63 0.00 0.00 28.75 29.15 3iss h GLU 277 CO 0.00 0.03 -0.64 -0.40 -0.73 0.00 0.00 179.01 177.27 3iss n ASP 278 N -2.87 0.11 -3.83 1.04 5.75 -1.26 -4.72 116.55 110.77 3iss n ASP 278 Ca 0.01 -1.93 -0.11 0.00 -0.01 0.00 0.00 54.79 52.76 3iss n ASP 278 Cb 0.56 -0.05 -0.08 0.00 -1.03 0.00 0.00 41.12 40.51 3iss n ASP 278 CO 0.00 0.00 0.00 -1.66 -0.11 0.00 0.00 177.20 175.43 3iss s TRP 279 N 0.00 0.01 -0.00 2.11 1.48 -1.26 -1.04 118.94 120.24 3iss s TRP 279 Ca 0.16 -0.18 0.04 0.00 -1.06 0.00 0.00 56.10 55.06 3iss s TRP 279 Cb 0.18 -0.00 -0.01 0.00 -1.16 0.00 0.00 33.47 32.48 3iss s TRP 279 CO -0.08 -0.42 -0.12 0.42 -4.06 0.00 0.00 176.95 172.69 3iss s ILE 280 N -2.32 0.93 0.09 0.66 1.01 -0.86 -0.87 121.20 119.84 3iss s ILE 280 Ca -0.07 -0.55 0.09 0.00 0.00 0.00 0.00 60.65 60.12 3iss s ILE 280 Cb -0.02 -0.79 -0.03 0.00 0.01 0.00 0.00 42.46 41.63 3iss s ILE 280 CO -0.02 0.23 -0.24 -0.94 0.00 0.00 0.00 174.94 173.96 3iss s SER 281 N -0.38 2.93 -0.05 3.58 1.04 0.52 -0.30 113.70 121.05 3iss s SER 281 Ca 0.04 -0.65 -0.02 0.00 0.48 0.00 0.00 55.95 55.80 3iss s SER 281 Cb -0.05 -0.21 0.03 0.00 0.10 0.00 0.00 66.02 65.89 3iss s SER 281 CO -0.00 0.17 0.10 -0.22 0.98 0.00 0.00 173.24 174.26 3iss s LEU 282 N -1.65 0.87 -0.07 2.42 0.20 -0.54 -1.80 118.68 118.11 3iss s LEU 282 Ca 0.10 0.20 0.01 0.00 0.69 0.00 0.00 54.13 55.13 3iss s LEU 282 Cb -0.10 0.19 0.02 0.00 -0.43 0.00 0.00 46.19 45.87 3iss s LEU 282 CO 0.04 -0.14 -0.09 -0.62 -0.29 0.00 0.00 176.35 175.25 3iss s ASP 283 N 1.13 1.62 0.03 3.68 -1.08 0.08 -1.31 116.67 120.81 3iss s ASP 283 Ca -0.09 -0.25 0.24 0.00 -0.52 0.00 0.00 52.55 51.93 3iss s ASP 283 Cb -0.12 -0.71 0.29 0.00 -1.46 0.00 0.00 42.92 40.92 3iss s ASP 283 CO -0.05 -0.03 1.25 0.23 0.52 0.00 0.00 175.17 177.10 3iss n MET 284 N 4.12 0.12 -3.94 4.34 2.81 -0.93 -1.33 117.12 122.32 3iss n MET 284 Ca -0.21 0.01 -0.28 0.00 -1.81 0.00 0.00 57.70 55.42 3iss n MET 284 Cb 0.51 -1.56 0.00 0.00 -0.71 0.00 0.00 33.22 31.47 3iss n MET 284 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 3iss n HIS 285 N -1.72 -1.89 -0.79 2.03 8.25 -1.26 -1.22 115.22 118.61 3iss n HIS 285 Ca 0.04 0.82 0.00 0.00 -0.26 0.00 0.00 57.72 58.32 3iss n HIS 285 Cb 0.38 -3.81 0.00 0.00 1.12 0.00 0.00 29.99 27.68 3iss n HIS 285 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3iss n GLY 286 N -1.71 0.63 3.82 -1.41 0.00 -1.26 -4.97 105.19 100.29 3iss n GLY 286 Ca -0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 3iss n GLY 286 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3iss s LYS 287 N -0.38 4.22 0.22 1.61 -0.14 -0.36 -4.97 119.74 119.94 3iss s LYS 287 Ca 0.00 0.98 -0.30 0.00 -1.36 0.00 0.00 55.97 55.29 3iss s LYS 287 Cb 0.00 -2.46 -0.08 0.00 -1.68 0.00 0.00 37.83 33.61 3iss s LYS 287 CO 0.00 0.14 0.95 0.50 -0.76 0.00 0.00 175.35 176.18 3iss s ARG 288 N -2.76 4.82 0.67 1.68 3.52 -1.26 -4.51 118.95 121.10 3iss s ARG 288 Ca 0.55 1.50 -0.16 0.00 -0.13 0.00 0.00 55.73 57.49 3iss s ARG 288 Cb -0.12 -3.29 0.00 0.00 -1.56 0.00 0.00 34.95 29.98 3iss s ARG 288 CO 0.17 0.45 1.19 -1.25 -0.81 0.00 0.00 175.30 175.05 3iss s PRO 289 N -0.97 2.58 -0.06 5.12 0.04 -1.26 -4.82 135.00 135.62 3iss s PRO 289 Ca 0.42 1.71 -0.10 0.00 0.04 0.00 0.00 61.00 63.08 3iss s PRO 289 Cb -0.26 -1.89 -0.05 0.00 0.04 0.00 0.00 34.50 32.34 3iss s PRO 289 CO 0.32 -1.49 0.26 0.15 0.04 0.00 0.00 177.00 176.28 3iss s LYS 290 N -3.73 3.63 0.42 4.56 -0.14 0.87 -0.95 119.74 124.40 3iss s LYS 290 Ca 0.74 0.08 -0.25 0.00 -1.36 0.00 0.00 55.97 55.18 3iss s LYS 290 Cb -0.28 -3.19 -0.10 0.00 -1.68 0.00 0.00 37.83 32.58 3iss s LYS 290 CO 0.40 0.73 1.15 0.00 -0.76 0.00 0.00 175.35 176.87 3iss n ALA 291 N 1.80 0.78 -2.32 5.17 0.00 -0.60 -4.32 120.51 121.03 3iss n ALA 291 Ca -0.17 0.25 -0.17 0.00 0.00 0.00 0.00 53.44 53.36 3iss n ALA 291 Cb 0.54 -2.18 -0.10 0.00 0.00 0.00 0.00 19.45 17.70 3iss n ALA 291 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3iss s VAL 292 N -1.23 1.26 -0.12 0.00 -7.23 -1.26 -4.85 120.40 106.97 3iss s VAL 292 Ca 0.62 -2.08 -0.02 0.00 -1.81 0.00 0.00 61.98 58.69 3iss s VAL 292 Cb -0.53 -2.14 -0.03 0.00 0.56 0.00 0.00 36.38 34.24 3iss s VAL 292 CO 0.57 -0.51 -0.05 0.20 -0.31 0.00 0.00 175.10 175.01 3iss s ASN 293 N -3.28 4.75 0.01 4.85 0.02 -1.26 -3.38 114.94 116.65 3iss s ASN 293 Ca 0.24 -0.08 0.04 0.00 -1.02 0.00 0.00 52.86 52.03 3iss s ASN 293 Cb 0.03 -1.56 -0.01 0.00 0.02 0.00 0.00 41.25 39.73 3iss s ASN 293 CO 0.06 0.25 -0.11 -0.69 0.02 0.00 0.00 177.10 176.63 3iss s VAL 294 N -0.11 0.87 -0.17 1.60 1.01 -0.39 -4.99 120.40 118.22 3iss s VAL 294 Ca 0.02 -0.64 -0.00 0.00 0.00 0.00 0.00 61.98 61.35 3iss s VAL 294 Cb -0.13 -0.76 0.04 0.00 0.00 0.00 0.00 36.38 35.53 3iss s VAL 294 CO 0.03 0.12 -0.05 -0.60 0.00 0.00 0.00 175.10 174.59 3iss s ARG 295 N -0.59 1.46 0.50 2.72 3.52 -1.26 -0.19 118.95 125.10 3iss s ARG 295 Ca 0.02 -0.57 -0.21 0.00 -0.13 0.00 0.00 55.73 54.84 3iss s ARG 295 Cb -0.05 -2.08 -0.07 0.00 -1.56 0.00 0.00 34.95 31.18 3iss s ARG 295 CO 0.00 -0.45 1.11 0.95 -0.81 0.00 0.00 175.30 176.10 3iss s THR 296 N 1.61 3.33 0.08 4.11 -4.23 -0.26 -4.36 115.64 115.92 3iss s THR 296 Ca 0.00 0.88 -0.27 0.00 -1.18 0.00 0.00 61.69 61.12 3iss s THR 296 Cb -0.16 -3.39 0.09 0.00 1.34 0.00 0.00 72.50 70.39 3iss s THR 296 CO -0.08 -0.13 1.12 0.00 -0.54 0.00 0.00 174.62 175.00 3iss s ALA 297 N -1.75 -1.93 0.67 3.99 0.00 -0.52 -3.62 121.76 118.59 3iss s ALA 297 Ca 0.68 0.34 -0.18 0.00 0.00 0.00 0.00 51.96 52.80 3iss s ALA 297 Cb -0.23 0.53 -0.00 0.00 0.00 0.00 0.00 23.12 23.42 3iss s ALA 297 CO 0.27 -1.05 1.28 -2.30 0.00 0.00 0.00 175.76 173.96 3iss n PRO 298 N -0.51 1.01 -1.51 0.00 -0.02 -1.26 -4.37 135.00 128.34 3iss n PRO 298 Ca -0.07 0.41 -0.45 0.00 -2.02 0.00 0.00 63.50 61.37 3iss n PRO 298 Cb 0.61 -2.52 -0.01 0.00 -0.02 0.00 0.00 33.50 31.56 3iss n PRO 298 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 3iss n HIS 299 N -2.06 0.37 -0.51 6.00 -0.00 -1.26 -1.95 115.22 115.80 3iss n HIS 299 Ca 0.16 0.75 -0.01 0.00 0.46 0.00 0.00 57.72 59.07 3iss n HIS 299 Cb 0.48 -2.11 0.26 0.00 -0.12 0.00 0.00 29.99 28.50 3iss n HIS 299 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 3iss n PRO 300 N 0.75 3.42 -1.16 1.57 -0.04 -1.26 -4.51 135.00 133.77 3iss n PRO 300 Ca 0.12 -2.37 -0.30 0.00 -0.04 0.00 0.00 63.50 60.91 3iss n PRO 300 Cb 0.32 -2.04 0.23 0.00 -0.04 0.00 0.00 33.50 31.98 3iss n PRO 300 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3iss s ALA 301 N -2.39 0.78 0.16 0.55 0.00 -0.82 -4.37 121.76 115.66 3iss s ALA 301 Ca 0.42 -0.93 -0.31 0.00 0.00 0.00 0.00 51.96 51.14 3iss s ALA 301 Cb 0.33 -2.89 -0.10 0.00 0.00 0.00 0.00 23.12 20.45 3iss s ALA 301 CO 0.11 -3.43 1.65 0.12 0.00 0.00 0.00 175.76 174.21 3iss s PHE 302 N -3.08 2.82 0.17 0.00 2.19 -1.26 -4.78 117.98 114.04 3iss s PHE 302 Ca 0.71 0.43 -0.29 0.00 0.33 0.00 0.00 56.93 58.11 3iss s PHE 302 Cb -0.10 -4.02 -0.08 0.00 -1.31 0.00 0.00 43.02 37.51 3iss s PHE 302 CO 0.56 -3.91 0.90 -1.25 1.83 0.00 0.00 175.22 173.35 3iss s PRO 303 N 1.55 4.72 0.47 10.12 0.05 -1.26 -1.44 135.00 149.22 3iss s PRO 303 Ca 0.73 1.37 0.13 0.00 0.05 0.00 0.00 61.00 63.28 3iss s PRO 303 Cb -0.45 -3.31 1.10 0.00 0.05 0.00 0.00 34.50 31.89 3iss s PRO 303 CO 0.32 0.43 2.10 0.00 0.05 0.00 0.00 177.00 179.90 3iss h THR 304 N 3.51 1.03 0.00 1.26 1.03 -1.93 -1.61 112.91 116.19 3iss h THR 304 Ca -0.45 -0.08 0.00 0.00 -0.01 0.00 0.00 66.41 65.87 3iss h THR 304 Cb 1.20 0.77 0.00 0.00 -1.07 0.00 0.00 68.15 69.06 3iss h THR 304 CO 0.69 0.04 0.00 0.47 -0.01 0.00 0.00 175.52 176.71 3iss n ASP 305 N -4.51 0.00 -0.33 0.00 8.00 -1.26 -1.45 116.55 117.00 3iss n ASP 305 Ca 0.00 0.29 0.04 0.00 0.71 0.00 0.00 54.79 55.84 3iss n ASP 305 Cb 0.11 -0.36 0.03 0.00 -0.02 0.00 0.00 41.12 40.88 3iss n ASP 305 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3iss n MET 306 N -1.36 0.52 -0.23 -1.24 2.81 -0.61 -4.75 117.12 112.26 3iss n MET 306 Ca 0.03 -0.96 -0.07 0.00 -1.81 0.00 0.00 57.70 54.89 3iss n MET 306 Cb 0.07 -1.15 0.04 0.00 -0.71 0.00 0.00 33.22 31.46 3iss n MET 306 CO 0.00 0.00 0.00 0.37 1.51 0.00 0.00 175.97 177.85 3iss h GLN 307 N 1.63 0.98 -0.15 0.03 -0.00 -1.25 -2.22 115.11 114.12 3iss h GLN 307 Ca 0.00 -0.19 -0.18 0.00 -0.00 0.00 0.00 58.65 58.28 3iss h GLN 307 Cb 0.36 -0.15 -0.00 0.00 0.00 0.00 0.00 27.48 27.69 3iss h GLN 307 CO 0.00 0.84 -0.65 0.00 0.00 0.00 0.00 178.83 179.02 3iss h ALA 308 N 1.09 0.58 -0.68 3.38 0.00 -1.86 -1.55 119.26 120.22 3iss h ALA 308 Ca 0.21 -0.56 -0.02 0.00 0.00 0.00 0.00 54.91 54.54 3iss h ALA 308 Cb 0.24 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 3iss h ALA 308 CO -0.01 0.71 0.35 1.96 0.00 0.00 0.00 179.25 182.26 3iss h GLN 309 N 0.41 0.97 0.00 0.00 7.50 -1.81 -1.71 115.11 120.47 3iss h GLN 309 Ca -0.02 -0.13 -0.02 0.00 0.50 0.00 0.00 58.65 58.98 3iss h GLN 309 Cb 1.22 -0.18 -0.00 0.00 0.05 0.00 0.00 27.48 28.57 3iss h GLN 309 CO 0.12 0.75 -0.11 0.74 -1.50 0.00 0.00 178.83 178.83 3iss h PHE 310 N 0.94 0.00 -0.42 2.96 -1.00 -1.24 -1.99 116.94 116.19 3iss h PHE 310 Ca 0.24 0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.91 3iss h PHE 310 Cb 0.08 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.63 3iss h PHE 310 CO 0.00 0.11 -0.15 1.15 -1.61 0.00 0.00 178.31 177.81 3iss h THR 311 N 0.00 1.28 -0.23 -1.55 2.02 -0.69 -1.75 112.91 111.98 3iss h THR 311 Ca -0.00 -1.28 -0.01 0.00 0.77 0.00 0.00 66.41 65.89 3iss h THR 311 Cb 0.77 1.22 -0.01 0.00 -1.74 0.00 0.00 68.15 68.39 3iss h THR 311 CO 0.01 0.43 0.11 0.25 0.37 0.00 0.00 175.52 176.69 3iss h LEU 312 N 0.66 0.30 -0.20 2.58 5.85 -0.99 -1.60 115.31 121.92 3iss h LEU 312 Ca 0.10 -0.12 0.05 0.00 0.84 0.00 0.00 57.88 58.75 3iss h LEU 312 Cb 0.70 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.58 3iss h LEU 312 CO 0.05 0.34 -0.37 0.25 -0.34 0.00 0.00 178.44 178.37 3iss h LEU 313 N 0.24 -1.17 -1.71 2.25 6.46 -1.25 0.68 115.31 120.81 3iss h LEU 313 Ca 0.08 0.17 0.15 0.00 -0.12 0.00 0.00 57.88 58.16 3iss h LEU 313 Cb 0.12 0.50 -0.04 0.00 -0.73 0.00 0.00 40.66 40.51 3iss h LEU 313 CO -0.01 -0.38 0.47 0.78 -0.62 0.00 0.00 178.44 178.68 3iss h ASN 314 N -0.40 0.27 1.13 1.25 2.35 -1.11 -1.91 115.58 117.14 3iss h ASN 314 Ca 0.10 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 3iss h ASN 314 Cb 0.58 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.91 3iss h ASN 314 CO -0.42 0.14 0.00 0.18 -1.65 0.00 0.00 177.43 175.68 3iss n LEU 315 N -4.44 0.61 -0.10 1.61 4.77 0.20 -2.26 117.00 117.39 3iss n LEU 315 Ca 0.13 0.59 0.08 0.00 -0.03 0.00 0.00 56.01 56.77 3iss n LEU 315 Cb 0.56 -0.43 0.11 0.00 -2.33 0.00 0.00 43.42 41.32 3iss n LEU 315 CO 0.34 -0.28 0.52 1.33 -1.33 0.00 0.00 177.39 177.98 3iss n VAL 316 N -2.11 1.56 -2.90 4.08 0.24 -0.77 -1.19 118.33 117.25 3iss n VAL 316 Ca 0.05 -1.85 -0.20 0.00 -2.04 0.00 0.00 64.34 60.30 3iss n VAL 316 Cb 0.34 -0.05 0.06 0.00 -1.47 0.00 0.00 33.84 32.72 3iss n VAL 316 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3iss s ALA 317 N -2.31 4.38 -0.37 2.33 0.00 -0.89 -4.71 121.76 120.19 3iss s ALA 317 Ca 0.24 -1.87 -0.23 0.00 0.00 0.00 0.00 51.96 50.11 3iss s ALA 317 Cb 0.21 -1.67 0.01 0.00 0.00 0.00 0.00 23.12 21.67 3iss s ALA 317 CO 0.02 -0.84 0.75 -2.00 0.00 0.00 0.00 175.76 173.69 3iss s GLU 318 N -4.70 3.71 0.00 0.00 2.12 -0.12 -4.07 118.70 115.64 3iss s GLU 318 Ca 0.61 0.22 0.00 0.00 0.36 0.00 0.00 54.97 56.16 3iss s GLU 318 Cb -0.07 -3.82 0.00 0.00 0.26 0.00 0.00 34.13 30.50 3iss s GLU 318 CO 0.39 -0.84 0.00 0.41 -0.54 0.00 0.00 175.26 174.67 3iss n GLY 319 N 4.59 -1.24 3.36 -1.50 0.00 -1.26 -1.56 105.19 107.58 3iss n GLY 319 Ca 0.02 -2.09 -0.32 0.00 0.00 0.00 0.00 46.02 43.63 3iss n GLY 319 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3iss s THR 320 N 0.00 2.72 0.05 2.61 2.01 -1.26 -1.78 115.64 119.99 3iss s THR 320 Ca 0.00 -0.81 0.02 0.00 0.31 0.00 0.00 61.69 61.21 3iss s THR 320 Cb 0.00 -2.08 -0.03 0.00 0.01 0.00 0.00 72.50 70.40 3iss s THR 320 CO 0.00 0.56 -0.07 -0.83 -0.69 0.00 0.00 174.62 173.59 3iss s GLY 321 N -0.05 0.51 0.20 4.40 0.00 -0.83 -4.72 107.32 106.84 3iss s GLY 321 Ca -0.04 -0.86 0.11 0.00 0.00 0.00 0.00 44.72 43.93 3iss s GLY 321 CO 0.04 -0.93 -0.22 -0.11 0.00 0.00 0.00 173.10 171.89 3iss s PHE 322 N -1.89 2.34 -0.11 1.90 -0.71 -1.22 -0.54 117.98 117.75 3iss s PHE 322 Ca -0.06 -0.34 -0.00 0.00 -1.04 0.00 0.00 56.93 55.48 3iss s PHE 322 Cb -0.07 -1.14 0.02 0.00 -1.21 0.00 0.00 43.02 40.63 3iss s PHE 322 CO -0.01 0.53 -0.07 0.42 -1.34 0.00 0.00 175.22 174.75 3iss s ILE 323 N -1.78 0.98 -0.14 -4.49 1.01 -0.56 -1.26 121.20 114.95 3iss s ILE 323 Ca 0.22 -0.26 -0.03 0.00 0.00 0.00 0.00 60.65 60.58 3iss s ILE 323 Cb -0.08 -1.01 -0.03 0.00 0.01 0.00 0.00 42.46 41.36 3iss s ILE 323 CO 0.11 0.36 -0.03 -0.89 0.00 0.00 0.00 174.94 174.49 3iss s THR 324 N 1.71 3.97 -0.25 2.92 2.01 0.73 -0.97 115.64 125.76 3iss s THR 324 Ca 0.05 -0.34 -0.07 0.00 0.31 0.00 0.00 61.69 61.64 3iss s THR 324 Cb -0.13 -2.73 -0.02 0.00 0.01 0.00 0.00 72.50 69.64 3iss s THR 324 CO -0.08 0.51 0.06 -0.70 -0.69 0.00 0.00 174.62 173.72 3iss s GLU 325 N 0.13 3.57 0.00 4.92 2.56 -0.57 -1.10 118.70 128.21 3iss s GLU 325 Ca -0.01 -0.53 0.09 0.00 0.00 0.00 0.00 54.97 54.52 3iss s GLU 325 Cb -0.13 -3.30 0.06 0.00 2.00 0.00 0.00 34.13 32.76 3iss s GLU 325 CO 0.03 -0.22 0.76 0.25 -0.56 0.00 0.00 175.26 175.52 3iss n THR 326 N 4.91 0.00 -0.13 -1.70 -2.24 -1.24 -4.58 114.28 109.30 3iss n THR 326 Ca -0.16 -0.49 -0.27 0.00 -2.27 0.00 0.00 64.05 60.85 3iss n THR 326 Cb 0.51 1.18 -0.09 0.00 -2.10 0.00 0.00 70.33 69.83 3iss n THR 326 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3iss n VAL 327 N 0.42 1.48 -3.86 2.28 0.31 -1.26 -4.84 118.33 112.85 3iss n VAL 327 Ca 0.05 -0.33 -0.30 0.00 -0.01 0.00 0.00 64.34 63.75 3iss n VAL 327 Cb 0.22 -1.91 -0.14 0.00 -0.91 0.00 0.00 33.84 31.10 3iss n VAL 327 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 3iss s PHE 328 N -2.53 2.72 -0.74 3.52 0.08 -1.26 -5.01 117.98 114.77 3iss s PHE 328 Ca -0.37 -2.68 0.18 0.00 0.12 0.00 0.00 56.93 54.17 3iss s PHE 328 Cb 0.14 -2.39 0.76 0.00 -0.57 0.00 0.00 43.02 40.95 3iss s PHE 328 CO 0.47 -0.82 1.55 0.39 -0.10 0.00 0.00 175.22 176.70 3iss n GLU 329 N 3.79 0.09 -0.63 0.44 1.02 -1.26 -2.01 120.64 122.08 3iss n GLU 329 Ca 0.05 0.36 0.01 0.00 -0.02 0.00 0.00 57.16 57.56 3iss n GLU 329 Cb 0.37 -1.68 0.21 0.00 -0.02 0.00 0.00 31.44 30.32 3iss n GLU 329 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3iss n ASN 330 N -1.85 2.86 -3.90 1.62 3.02 -1.23 -4.68 115.26 111.10 3iss n ASN 330 Ca 0.02 -3.50 -0.43 0.00 -0.03 0.00 0.00 54.58 50.65 3iss n ASN 330 Cb 0.17 -0.59 0.01 0.00 -0.61 0.00 0.00 39.78 38.76 3iss n ASN 330 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 3iss n ARG 331 N -0.97 3.90 -0.17 3.52 0.63 -0.85 -4.55 116.66 118.17 3iss n ARG 331 Ca 0.28 -3.84 0.01 0.00 -0.92 0.00 0.00 57.85 53.37 3iss n ARG 331 Cb 0.95 -2.79 0.01 0.00 0.45 0.00 0.00 32.46 31.07 3iss n ARG 331 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 3iss n PHE 332 N 3.04 0.00 0.16 -0.14 3.72 -1.26 -4.86 117.46 118.12 3iss n PHE 332 Ca 0.36 -0.10 0.16 0.00 -0.05 0.00 0.00 57.45 57.81 3iss n PHE 332 Cb 0.35 -0.03 0.74 0.00 -0.94 0.00 0.00 39.48 39.60 3iss n PHE 332 CO 0.00 0.00 0.00 0.52 -0.05 0.00 0.00 176.76 177.23 3iss h MET 333 N 0.00 0.00 -0.04 -1.08 2.86 -1.97 -1.05 114.93 113.64 3iss h MET 333 Ca 0.00 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 3iss h MET 333 Cb 1.09 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.75 3iss h MET 333 CO 0.00 0.00 -0.05 1.12 1.06 0.00 0.00 176.91 179.04 3iss h HIS 334 N 0.00 0.06 0.51 -0.22 -0.00 -1.94 -3.25 115.15 110.31 3iss h HIS 334 Ca 0.11 -0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.46 3iss h HIS 334 Cb 0.50 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 27.88 3iss h HIS 334 CO 0.00 0.11 -0.38 0.28 -0.00 0.00 0.00 177.93 177.95 3iss h VAL 335 N 0.06 0.23 -0.71 6.12 2.07 -1.58 -0.85 116.25 121.58 3iss h VAL 335 Ca 0.01 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.58 3iss h VAL 335 Cb 0.14 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 30.09 3iss h VAL 335 CO 0.01 0.00 0.47 -0.65 0.02 0.00 0.00 177.57 177.42 3iss h PRO 336 N -0.87 0.79 -0.24 1.57 0.11 -1.72 -0.91 132.00 130.73 3iss h PRO 336 Ca -0.06 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.00 3iss h PRO 336 Cb 0.73 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 3iss h PRO 336 CO 0.01 0.52 0.13 0.93 -0.21 0.00 0.00 178.00 179.39 3iss h GLU 337 N 0.81 0.33 0.00 1.05 4.39 -1.54 -2.01 114.58 117.61 3iss h GLU 337 Ca 0.29 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.93 3iss h GLU 337 Cb 0.14 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 28.72 3iss h GLU 337 CO -0.09 0.30 -0.10 -0.07 -1.16 0.00 0.00 179.01 177.89 3iss h LEU 338 N 0.27 0.00 -1.16 1.33 3.38 -0.34 -0.02 115.31 118.77 3iss h LEU 338 Ca 0.08 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 3iss h LEU 338 Cb 0.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 3iss h LEU 338 CO -0.01 0.10 -0.38 0.28 0.09 0.00 0.00 178.44 178.52 3iss h SER 339 N 0.00 0.08 0.33 -0.43 0.02 -0.48 -1.43 113.55 111.63 3iss h SER 339 Ca -0.00 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 3iss h SER 339 Cb 0.25 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 62.77 3iss h SER 339 CO 0.01 0.45 -0.09 0.03 -1.14 0.00 0.00 176.83 176.09 3iss h ARG 340 N 0.06 0.00 -0.62 3.45 3.08 -0.53 -1.95 114.38 117.87 3iss h ARG 340 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3iss h ARG 340 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.75 3iss h ARG 340 CO 0.05 0.09 0.00 -1.33 -1.07 0.00 0.00 179.97 177.72 3iss n MET 341 N -3.63 2.53 -0.36 0.04 2.81 -0.60 -4.83 117.12 113.09 3iss n MET 341 Ca -0.02 -2.25 0.00 0.00 -1.81 0.00 0.00 57.70 53.62 3iss n MET 341 Cb 0.21 -1.52 0.00 0.00 -0.71 0.00 0.00 33.22 31.21 3iss n MET 341 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3iss n GLY 342 N 1.44 0.82 3.78 3.03 0.00 -0.73 -0.63 105.19 112.89 3iss n GLY 342 Ca 0.21 -0.04 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 3iss n GLY 342 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iss s ALA 343 N -2.00 2.61 -0.38 4.61 0.00 -0.82 -4.96 121.76 120.81 3iss s ALA 343 Ca 0.00 0.63 -0.02 0.00 0.00 0.00 0.00 51.96 52.58 3iss s ALA 343 Cb 0.00 -3.32 0.10 0.00 0.00 0.00 0.00 23.12 19.90 3iss s ALA 343 CO 0.00 -0.98 0.14 -1.01 0.00 0.00 0.00 175.76 173.91 3iss s HIS 344 N -2.13 3.56 0.00 0.00 0.09 -1.26 -4.53 115.29 111.03 3iss s HIS 344 Ca 0.69 -2.41 -0.05 0.00 -0.00 0.00 0.00 55.06 53.28 3iss s HIS 344 Cb -0.21 -2.98 -0.00 0.00 -0.00 0.00 0.00 32.58 29.39 3iss s HIS 344 CO 0.34 -0.94 0.09 0.00 -0.00 0.00 0.00 174.74 174.23 3iss s ALA 345 N 1.12 -0.19 0.08 -1.40 0.00 -1.26 -1.34 121.76 118.77 3iss s ALA 345 Ca 0.06 -0.22 0.07 0.00 0.00 0.00 0.00 51.96 51.87 3iss s ALA 345 Cb -0.22 0.09 -0.03 0.00 0.00 0.00 0.00 23.12 22.96 3iss s ALA 345 CO -0.04 -0.18 -0.18 -1.83 0.00 0.00 0.00 175.76 173.53 3iss s GLU 346 N -1.25 1.04 -0.28 0.00 1.03 -0.57 -4.98 118.70 113.69 3iss s GLU 346 Ca -0.14 -1.03 -0.07 0.00 0.03 0.00 0.00 54.97 53.76 3iss s GLU 346 Cb -0.08 -1.19 -0.00 0.00 -0.80 0.00 0.00 34.13 32.06 3iss s GLU 346 CO 0.01 0.28 0.07 0.42 -1.33 0.00 0.00 175.26 174.71 3iss s ILE 347 N -1.12 4.05 -0.36 1.83 1.01 -1.26 0.52 121.20 125.86 3iss s ILE 347 Ca 0.04 -0.54 -0.05 0.00 0.00 0.00 0.00 60.65 60.09 3iss s ILE 347 Cb -0.10 -3.02 0.06 0.00 0.01 0.00 0.00 42.46 39.41 3iss s ILE 347 CO 0.03 0.16 0.13 -1.61 0.00 0.00 0.00 174.94 173.65 3iss s GLU 348 N 1.53 2.45 6.59 2.79 0.41 0.10 -4.98 118.70 127.59 3iss s GLU 348 Ca 0.04 -1.38 0.00 0.00 -0.41 0.00 0.00 54.97 53.22 3iss s GLU 348 Cb -0.16 -3.48 0.00 0.00 -1.78 0.00 0.00 34.13 28.70 3iss s GLU 348 CO 0.03 -0.79 0.00 0.45 -0.49 0.00 0.00 175.26 174.45 3iss n SER 349 N 4.75 0.00 -1.33 -0.19 2.88 -1.26 -1.35 113.62 117.12 3iss n SER 349 Ca -0.10 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.40 3iss n SER 349 Cb 0.43 0.00 0.22 0.00 -0.75 0.00 0.00 64.21 64.12 3iss n SER 349 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 3iss n ASN 350 N 9.24 3.26 -4.15 -3.46 0.23 -1.26 -4.92 115.26 114.20 3iss n ASN 350 Ca 0.00 -3.50 -0.28 0.00 -0.53 0.00 0.00 54.58 50.27 3iss n ASN 350 Cb 0.00 -0.65 -0.16 0.00 -2.08 0.00 0.00 39.78 36.88 3iss n ASN 350 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 3iss s THR 351 N -3.12 1.63 -0.23 5.53 2.01 -0.46 -1.51 115.64 119.49 3iss s THR 351 Ca 0.47 -0.80 -0.12 0.00 0.31 0.00 0.00 61.69 61.55 3iss s THR 351 Cb 0.40 -1.41 -0.05 0.00 0.01 0.00 0.00 72.50 71.46 3iss s THR 351 CO 0.05 0.46 0.24 0.54 -0.69 0.00 0.00 174.62 175.22 3iss s VAL 352 N 0.23 5.31 -0.33 3.82 0.11 -0.15 -0.72 120.40 128.67 3iss s VAL 352 Ca -0.10 0.36 -0.15 0.00 -2.93 0.00 0.00 61.98 59.16 3iss s VAL 352 Cb -0.15 -3.58 -0.02 0.00 -1.53 0.00 0.00 36.38 31.11 3iss s VAL 352 CO 0.05 0.32 0.35 -0.63 -3.33 0.00 0.00 175.10 171.85 3iss s ILE 353 N 1.11 5.18 -0.13 7.04 1.01 0.18 -1.50 121.20 134.10 3iss s ILE 353 Ca 0.11 0.09 -0.04 0.00 0.00 0.00 0.00 60.65 60.82 3iss s ILE 353 Cb -0.14 -3.79 -0.03 0.00 0.01 0.00 0.00 42.46 38.51 3iss s ILE 353 CO 0.05 -0.04 0.01 0.00 0.00 0.00 0.00 174.94 174.96 3iss s HIS 355 N -0.28 3.48 0.19 0.00 3.76 -0.45 -1.96 115.29 120.03 3iss s HIS 355 Ca 0.07 -2.55 -0.32 0.00 -0.15 0.00 0.00 55.06 52.11 3iss s HIS 355 Cb -0.12 -2.41 -0.12 0.00 1.11 0.00 0.00 32.58 31.04 3iss s HIS 355 CO 0.02 -0.90 1.73 0.41 -0.85 0.00 0.00 174.74 175.15 3iss n GLY 356 N 4.39 1.53 3.89 -2.22 0.00 -0.73 -4.19 105.19 107.85 3iss n GLY 356 Ca -0.06 0.64 -0.21 0.00 0.00 0.00 0.00 46.02 46.39 3iss n GLY 356 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3iss s VAL 357 N 1.43 3.67 0.02 1.61 -7.23 -0.33 -4.69 120.40 114.87 3iss s VAL 357 Ca 0.77 -1.27 -0.18 0.00 -1.81 0.00 0.00 61.98 59.49 3iss s VAL 357 Cb -0.52 -3.25 -0.23 0.00 0.56 0.00 0.00 36.38 32.94 3iss s VAL 357 CO 0.34 -0.17 1.12 -0.08 -0.31 0.00 0.00 175.10 176.00 3iss h GLU 358 N 1.15 0.48 -2.45 4.82 4.22 -1.86 -3.38 114.58 117.55 3iss h GLU 358 Ca -0.45 -0.51 -0.09 0.00 0.08 0.00 0.00 59.36 58.39 3iss h GLU 358 Cb 1.25 0.15 -0.21 0.00 0.50 0.00 0.00 28.75 30.44 3iss h GLU 358 CO 0.57 1.16 -0.04 -1.59 -2.18 0.00 0.00 179.01 176.92 3iss s LYS 359 N -3.23 0.79 0.45 1.92 -2.85 -1.26 -5.02 119.74 110.53 3iss s LYS 359 Ca -0.12 0.32 0.01 0.00 -1.00 0.00 0.00 55.97 55.17 3iss s LYS 359 Cb 0.04 0.37 -0.00 0.00 -2.06 0.00 0.00 37.83 36.18 3iss s LYS 359 CO 0.84 -0.19 0.66 -0.51 0.10 0.00 0.00 175.35 176.25 3iss s LEU 360 N -0.68 3.65 -0.06 2.77 1.43 -1.26 -4.96 118.68 119.57 3iss s LEU 360 Ca -0.08 0.25 0.04 0.00 -1.03 0.00 0.00 54.13 53.32 3iss s LEU 360 Cb -0.03 -3.13 -0.02 0.00 0.03 0.00 0.00 46.19 43.04 3iss s LEU 360 CO 0.05 -0.70 -0.19 -0.44 0.23 0.00 0.00 176.35 175.30 3iss s SER 361 N -4.22 3.56 0.50 2.29 0.01 0.20 0.23 113.70 116.27 3iss s SER 361 Ca 0.48 -0.37 -0.23 0.00 1.31 0.00 0.00 55.95 57.15 3iss s SER 361 Cb -0.10 -0.93 -0.07 0.00 0.21 0.00 0.00 66.02 65.13 3iss s SER 361 CO 0.38 0.27 1.28 0.61 0.41 0.00 0.00 173.24 176.19 3iss n GLY 362 N 2.78 0.56 3.74 3.44 0.00 -0.46 -4.39 105.19 110.86 3iss n GLY 362 Ca -0.17 0.08 -0.04 0.00 0.00 0.00 0.00 46.02 45.88 3iss n GLY 362 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iss s ALA 363 N -1.28 -1.62 -0.14 4.61 0.00 -1.12 -4.80 121.76 117.41 3iss s ALA 363 Ca 0.68 0.15 -0.29 0.00 0.00 0.00 0.00 51.96 52.50 3iss s ALA 363 Cb -0.45 0.65 -0.01 0.00 0.00 0.00 0.00 23.12 23.31 3iss s ALA 363 CO 0.53 -1.01 1.06 -0.65 0.00 0.00 0.00 175.76 175.69 3iss s GLN 364 N -3.35 4.35 0.16 0.00 -0.21 -1.26 -2.39 119.66 116.97 3iss s GLN 364 Ca 0.11 1.44 0.04 0.00 0.02 0.00 0.00 55.36 56.97 3iss s GLN 364 Cb -0.02 -3.59 -0.05 0.00 1.00 0.00 0.00 33.01 30.35 3iss s GLN 364 CO 0.02 -0.46 -0.07 0.14 -2.12 0.00 0.00 175.29 172.79 3iss s VAL 365 N 2.52 1.11 -0.16 1.09 -7.23 0.20 -4.95 120.40 112.97 3iss s VAL 365 Ca 0.48 -2.05 0.01 0.00 -1.81 0.00 0.00 61.98 58.62 3iss s VAL 365 Cb -0.18 -1.96 0.02 0.00 0.56 0.00 0.00 36.38 34.81 3iss s VAL 365 CO 0.15 -0.65 -0.18 -0.32 -0.31 0.00 0.00 175.10 173.79 3iss s MET 366 N -3.78 2.72 0.39 4.82 1.75 -1.26 -0.45 119.30 123.49 3iss s MET 366 Ca 0.19 -0.73 -0.25 0.00 -1.25 0.00 0.00 55.69 53.66 3iss s MET 366 Cb 0.03 -2.36 -0.09 0.00 2.84 0.00 0.00 34.83 35.26 3iss s MET 366 CO 0.02 -0.18 1.07 0.00 -0.65 0.00 0.00 175.02 175.29 3iss s ALA 367 N 1.26 3.13 0.00 4.11 0.00 -0.82 -4.94 121.76 124.49 3iss s ALA 367 Ca 0.02 0.76 0.00 0.00 0.00 0.00 0.00 51.96 52.74 3iss s ALA 367 Cb -0.13 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.69 3iss s ALA 367 CO -0.10 -0.25 0.00 0.25 0.00 0.00 0.00 175.76 175.66 3iss n THR 368 N 0.10 0.00 -3.95 0.00 -2.24 -1.26 -4.83 114.28 102.09 3iss n THR 368 Ca 0.04 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.53 3iss n THR 368 Cb 0.49 0.53 -0.16 0.00 -2.10 0.00 0.00 70.33 69.08 3iss n THR 368 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3iss s ASP 369 N 0.00 2.94 0.28 3.42 -1.08 -1.26 -5.03 116.67 115.95 3iss s ASP 369 Ca 0.00 -0.67 0.19 0.00 -0.52 0.00 0.00 52.55 51.54 3iss s ASP 369 Cb 0.00 -1.07 0.99 0.00 -1.46 0.00 0.00 42.92 41.37 3iss s ASP 369 CO 0.00 -0.14 1.09 -0.11 0.52 0.00 0.00 175.17 176.53 3iss n LEU 370 N 4.79 0.19 -0.05 -1.34 7.94 -1.26 -1.75 117.00 125.52 3iss n LEU 370 Ca -0.14 1.05 -0.09 0.00 -1.11 0.00 0.00 56.01 55.71 3iss n LEU 370 Cb 0.48 -0.51 -0.04 0.00 0.53 0.00 0.00 43.42 43.88 3iss n LEU 370 CO 0.19 -1.16 -0.85 0.54 -1.11 0.00 0.00 177.39 175.00 3iss n ARG 371 N -4.30 0.24 -0.24 1.96 5.12 -1.26 -4.11 116.66 114.06 3iss n ARG 371 Ca 0.27 0.08 0.04 0.00 -1.93 0.00 0.00 57.85 56.31 3iss n ARG 371 Cb 1.00 -1.02 0.28 0.00 -1.16 0.00 0.00 32.46 31.55 3iss n ARG 371 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3iss h ALA 372 N -0.21 1.56 0.00 7.54 0.00 -1.81 -2.57 119.26 123.77 3iss h ALA 372 Ca -0.25 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3iss h ALA 372 Cb 1.29 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.82 3iss h ALA 372 CO -0.10 0.34 0.00 0.43 0.00 0.00 0.00 179.25 179.91 3iss n SER 373 N -4.47 0.28 0.19 0.00 7.64 -0.72 -1.85 113.62 114.70 3iss n SER 373 Ca 0.11 0.57 0.17 0.00 1.01 0.00 0.00 58.87 60.74 3iss n SER 373 Cb 0.16 -0.63 0.81 0.00 -1.01 0.00 0.00 64.21 63.55 3iss n SER 373 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3iss h ALA 374 N 2.36 1.86 0.00 -0.43 0.00 -1.69 0.21 119.26 121.58 3iss h ALA 374 Ca 0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 3iss h ALA 374 Cb 0.27 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3iss h ALA 374 CO 0.00 -0.31 -0.26 0.66 0.00 0.00 0.00 179.25 179.34 3iss h SER 375 N 0.00 0.00 -0.35 0.00 4.64 -1.58 -1.56 113.55 114.70 3iss h SER 375 Ca 0.09 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.27 3iss h SER 375 Cb 0.51 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 3iss h SER 375 CO -0.00 0.26 -0.31 -0.07 -0.87 0.00 0.00 176.83 175.84 3iss h LEU 376 N 0.00 0.92 -0.15 5.97 3.38 -1.16 0.11 115.31 124.39 3iss h LEU 376 Ca -0.00 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 3iss h LEU 376 Cb 0.60 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3iss h LEU 376 CO 0.03 1.15 0.03 0.58 0.09 0.00 0.00 178.44 180.33 3iss h VAL 377 N 0.74 1.21 -0.74 1.22 2.07 -1.42 -1.64 116.25 117.68 3iss h VAL 377 Ca 0.08 -0.67 0.09 0.00 0.82 0.00 0.00 66.70 67.02 3iss h VAL 377 Cb 0.88 1.37 -0.07 0.00 -1.52 0.00 0.00 31.29 31.94 3iss h VAL 377 CO 0.08 0.20 0.40 -0.07 0.02 0.00 0.00 177.57 178.20 3iss h LEU 378 N 0.04 0.55 -0.67 2.57 4.07 -1.25 -2.08 115.31 118.54 3iss h LEU 378 Ca 0.05 0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.06 3iss h LEU 378 Cb 0.28 -0.05 -0.03 0.00 1.08 0.00 0.00 40.66 41.93 3iss h LEU 378 CO 0.00 0.32 0.42 0.00 -1.08 0.00 0.00 178.44 178.11 3iss h ALA 379 N 1.42 0.85 -0.86 1.53 0.00 -0.73 -2.20 119.26 119.28 3iss h ALA 379 Ca 0.36 -0.07 0.14 0.00 0.00 0.00 0.00 54.91 55.34 3iss h ALA 379 Cb 0.33 -0.27 -0.09 0.00 0.00 0.00 0.00 17.79 17.76 3iss h ALA 379 CO -0.24 0.31 0.46 0.78 0.00 0.00 0.00 179.25 180.55 3iss h GLY 380 N 0.91 1.41 1.80 0.00 0.00 -0.63 -0.68 103.07 105.88 3iss h GLY 380 Ca 0.24 -0.27 -0.03 0.00 0.00 0.00 0.00 47.33 47.28 3iss h GLY 380 CO -0.05 -0.02 -0.01 0.00 0.00 0.00 0.00 176.54 176.46 3iss n ILE 382 N -4.38 0.00 -1.58 0.00 -5.35 -0.90 -1.41 119.36 105.74 3iss n ILE 382 Ca -0.00 -0.16 -0.31 0.00 -0.27 0.00 0.00 62.75 62.01 3iss n ILE 382 Cb 0.18 1.03 0.05 0.00 -1.74 0.00 0.00 39.64 39.17 3iss n ILE 382 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3iss s ALA 383 N -2.41 2.67 -0.28 -1.28 0.00 -0.31 -4.49 121.76 115.66 3iss s ALA 383 Ca 0.07 0.05 -0.23 0.00 0.00 0.00 0.00 51.96 51.86 3iss s ALA 383 Cb 0.12 -3.17 -0.01 0.00 0.00 0.00 0.00 23.12 20.07 3iss s ALA 383 CO 0.61 -1.24 0.75 -2.00 0.00 0.00 0.00 175.76 173.88 3iss s GLU 384 N -5.06 4.03 0.00 0.00 2.56 0.13 -1.89 118.70 118.48 3iss s GLU 384 Ca 0.58 0.63 0.00 0.00 0.00 0.00 0.00 54.97 56.18 3iss s GLU 384 Cb -0.14 -3.69 0.00 0.00 2.00 0.00 0.00 34.13 32.30 3iss s GLU 384 CO 0.55 -0.58 0.00 0.41 -0.56 0.00 0.00 175.26 175.08 3iss n GLY 385 N 4.12 0.97 3.39 -1.50 0.00 -0.32 -1.36 105.19 110.49 3iss n GLY 385 Ca 0.03 -1.65 -0.34 0.00 0.00 0.00 0.00 46.02 44.06 3iss n GLY 385 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3iss s THR 386 N 0.00 3.54 -0.10 2.61 2.01 -1.26 -0.88 115.64 121.55 3iss s THR 386 Ca 0.00 -0.46 0.01 0.00 0.31 0.00 0.00 61.69 61.54 3iss s THR 386 Cb 0.00 -2.57 -0.02 0.00 0.01 0.00 0.00 72.50 69.92 3iss s THR 386 CO 0.00 0.46 -0.12 -0.89 -0.69 0.00 0.00 174.62 173.38 3iss s THR 387 N 0.89 3.20 -0.26 -0.82 2.01 0.00 -2.80 115.64 117.87 3iss s THR 387 Ca -0.01 -0.63 -0.04 0.00 0.31 0.00 0.00 61.69 61.32 3iss s THR 387 Cb -0.15 -2.32 0.01 0.00 0.01 0.00 0.00 72.50 70.05 3iss s THR 387 CO 0.01 0.55 -0.00 -0.69 -0.69 0.00 0.00 174.62 173.80 3iss s VAL 388 N -0.10 3.44 -0.48 3.82 1.01 -1.00 -0.36 120.40 126.73 3iss s VAL 388 Ca -0.01 -0.73 -0.17 0.00 0.00 0.00 0.00 61.98 61.08 3iss s VAL 388 Cb -0.14 -2.70 0.06 0.00 0.00 0.00 0.00 36.38 33.61 3iss s VAL 388 CO 0.03 0.23 0.46 -0.69 0.00 0.00 0.00 175.10 175.13 3iss s VAL 389 N 1.44 5.12 0.47 2.92 1.01 0.46 -0.63 120.40 131.20 3iss s VAL 389 Ca 0.03 -0.84 -0.20 0.00 0.00 0.00 0.00 61.98 60.98 3iss s VAL 389 Cb -0.16 -4.16 -0.09 0.00 0.00 0.00 0.00 36.38 31.97 3iss s VAL 389 CO -0.02 -0.62 0.98 -0.62 0.00 0.00 0.00 175.10 174.83 3iss s ASP 390 N 2.53 6.67 -0.67 3.32 2.15 0.40 -1.79 116.67 129.28 3iss s ASP 390 Ca 0.08 1.74 -0.04 0.00 0.43 0.00 0.00 52.55 54.75 3iss s ASP 390 Cb -0.22 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 39.86 3iss s ASP 390 CO 0.09 -0.55 0.58 -1.14 -0.17 0.00 0.00 175.17 173.98 3iss n ARG 391 N -0.97 -3.93 0.00 4.34 0.63 -1.22 -1.94 116.66 113.58 3iss n ARG 391 Ca 0.08 0.41 0.12 0.00 -0.92 0.00 0.00 57.85 57.54 3iss n ARG 391 Cb 0.54 -4.18 0.65 0.00 0.45 0.00 0.00 32.46 29.92 3iss n ARG 391 CO 0.00 0.00 0.00 0.44 -2.51 0.00 0.00 177.63 175.56 3iss n ILE 392 N -3.67 0.16 -0.03 5.15 -5.35 -1.21 -3.38 119.36 111.03 3iss n ILE 392 Ca -0.01 0.04 0.22 0.00 -0.27 0.00 0.00 62.75 62.73 3iss n ILE 392 Cb 0.53 -0.64 0.70 0.00 -1.74 0.00 0.00 39.64 38.49 3iss n ILE 392 CO 0.00 0.00 0.00 0.10 -1.76 0.00 0.00 176.55 174.89 3iss h TYR 393 N 0.00 0.00 -0.07 4.28 -0.00 -1.90 0.34 116.97 119.61 3iss h TYR 393 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 58.73 58.75 3iss h TYR 393 Cb 0.15 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 36.86 3iss h TYR 393 CO 0.00 0.00 -0.07 0.45 -0.00 0.00 0.00 178.16 178.54 3iss h HIS 394 N 0.00 -0.18 -0.29 0.10 3.86 -1.93 -2.73 115.15 113.99 3iss h HIS 394 Ca 0.28 0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.48 3iss h HIS 394 Cb 1.16 0.09 -0.02 0.00 1.06 0.00 0.00 27.41 29.70 3iss h HIS 394 CO 0.00 -0.11 0.07 0.82 0.86 0.00 0.00 177.93 179.57 3iss h ILE 395 N -0.09 1.14 0.00 2.45 2.04 -0.63 -2.04 117.51 120.37 3iss h ILE 395 Ca 0.05 -0.49 -0.02 0.00 1.00 0.00 0.00 64.86 65.40 3iss h ILE 395 Cb 0.17 0.85 -0.00 0.00 -0.74 0.00 0.00 36.82 37.10 3iss h ILE 395 CO -0.13 0.18 -0.09 0.44 0.00 0.00 0.00 178.15 178.55 3iss h ASP 396 N 0.41 0.00 0.82 1.72 3.32 -0.92 -0.30 116.42 121.48 3iss h ASP 396 Ca 0.10 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.10 3iss h ASP 396 Cb 0.16 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 3iss h ASP 396 CO -0.00 0.09 -0.24 0.03 -1.72 0.00 0.00 179.24 177.40 3iss h ARG 397 N 0.00 0.00 0.00 3.56 3.08 -1.18 -2.62 114.38 117.22 3iss h ARG 397 Ca -0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 3iss h ARG 397 Cb 0.27 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 3iss h ARG 397 CO 0.01 0.24 -1.47 0.41 -1.07 0.00 0.00 179.97 178.09 3iss n GLY 398 N 0.04 -0.38 3.10 0.04 0.00 -0.24 -3.65 105.19 104.09 3iss n GLY 398 Ca -0.00 -0.16 -0.23 0.00 0.00 0.00 0.00 46.02 45.63 3iss n GLY 398 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3iss s TYR 399 N -2.35 1.36 -0.58 1.61 2.02 -0.49 -4.94 117.35 113.98 3iss s TYR 399 Ca -0.04 -0.31 -0.28 0.00 -0.37 0.00 0.00 57.07 56.07 3iss s TYR 399 Cb 0.04 -0.91 0.02 0.00 -0.40 0.00 0.00 41.96 40.71 3iss s TYR 399 CO 0.33 -0.08 1.33 -2.00 -1.57 0.00 0.00 175.55 173.56 3iss s GLU 400 N -0.13 3.38 -1.08 -0.62 2.12 -1.26 -4.43 118.70 116.67 3iss s GLU 400 Ca 0.01 0.34 -0.17 0.00 0.36 0.00 0.00 54.97 55.52 3iss s GLU 400 Cb -0.08 -4.09 -0.01 0.00 0.26 0.00 0.00 34.13 30.21 3iss s GLU 400 CO 0.00 -1.85 0.78 0.54 -0.54 0.00 0.00 175.26 174.20 3iss n ARG 401 N 8.62 -1.31 0.18 4.30 1.74 -1.26 -4.87 116.66 124.07 3iss n ARG 401 Ca 0.10 0.59 0.03 0.00 -0.77 0.00 0.00 57.85 57.81 3iss n ARG 401 Cb 0.49 -4.23 0.41 0.00 -1.02 0.00 0.00 32.46 28.10 3iss n ARG 401 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 3iss h ILE 402 N -1.53 1.21 -0.04 0.55 2.10 -1.96 -2.60 117.51 115.23 3iss h ILE 402 Ca -0.61 -0.98 -0.09 0.00 1.08 0.00 0.00 64.86 64.26 3iss h ILE 402 Cb 1.33 1.49 -0.01 0.00 -1.09 0.00 0.00 36.82 38.54 3iss h ILE 402 CO 0.45 0.28 -0.40 1.05 -1.08 0.00 0.00 178.15 178.46 3iss h GLU 403 N 0.05 0.08 -0.20 2.19 9.09 -1.97 -1.29 114.58 122.53 3iss h GLU 403 Ca 0.01 -0.04 -0.07 0.00 0.05 0.00 0.00 59.36 59.31 3iss h GLU 403 Cb 0.50 -0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.60 3iss h GLU 403 CO 0.04 0.48 -0.15 -0.44 0.05 0.00 0.00 179.01 178.99 3iss h ASP 404 N 0.07 0.47 -0.48 3.06 3.32 -1.83 -1.19 116.42 119.84 3iss h ASP 404 Ca 0.01 -0.45 -0.11 0.00 0.02 0.00 0.00 57.03 56.50 3iss h ASP 404 Cb 0.75 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 3iss h ASP 404 CO 0.06 0.82 -0.12 0.11 -1.72 0.00 0.00 179.24 178.39 3iss h LYS 405 N 0.12 0.96 -0.59 3.56 1.57 -1.49 -2.02 116.57 118.68 3iss h LYS 405 Ca 0.04 -0.35 -0.10 0.00 -1.87 0.00 0.00 60.65 58.36 3iss h LYS 405 Cb 0.67 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.89 3iss h LYS 405 CO 0.04 1.02 -0.03 -0.07 -0.57 0.00 0.00 179.45 179.83 3iss h LEU 406 N 0.85 1.05 -0.99 2.94 3.38 -1.22 -2.85 115.31 118.48 3iss h LEU 406 Ca 0.13 -0.31 -0.07 0.00 0.09 0.00 0.00 57.88 57.72 3iss h LEU 406 Cb 0.66 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 3iss h LEU 406 CO 0.05 1.11 -0.02 -0.09 0.09 0.00 0.00 178.44 179.58 3iss h ARG 407 N 0.96 0.71 0.00 1.13 2.43 -1.05 0.16 114.38 118.72 3iss h ARG 407 Ca 0.16 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3iss h ARG 407 Cb 0.60 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.06 3iss h ARG 407 CO 0.04 0.74 0.00 0.00 -1.51 0.00 0.00 179.97 179.23 3iss n ALA 408 N -2.48 2.01 0.64 2.80 0.00 -0.77 -1.07 120.51 121.65 3iss n ALA 408 Ca 0.02 -0.09 0.08 0.00 0.00 0.00 0.00 53.44 53.45 3iss n ALA 408 Cb 0.30 -1.28 0.05 0.00 0.00 0.00 0.00 19.45 18.52 3iss n ALA 408 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3iss n LEU 409 N -1.17 2.16 0.00 0.00 4.77 -0.03 -4.67 117.00 118.06 3iss n LEU 409 Ca 0.10 -0.96 0.00 0.00 -0.03 0.00 0.00 56.01 55.12 3iss n LEU 409 Cb 0.10 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 3iss n LEU 409 CO 0.12 0.39 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 3iss n GLY 410 N 0.91 0.94 3.77 -0.72 0.00 -0.23 -1.42 105.19 108.43 3iss n GLY 410 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 3iss n GLY 410 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iss s ALA 411 N -2.00 3.29 -0.70 4.61 0.00 -0.75 -4.78 121.76 121.42 3iss s ALA 411 Ca 0.00 1.04 -0.16 0.00 0.00 0.00 0.00 51.96 52.84 3iss s ALA 411 Cb 0.00 -3.40 0.16 0.00 0.00 0.00 0.00 23.12 19.88 3iss s ALA 411 CO 0.00 -0.50 0.72 1.21 0.00 0.00 0.00 175.76 177.19 3iss s ASN 412 N -0.91 6.45 -0.01 0.00 3.84 -1.26 -4.46 114.94 118.59 3iss s ASN 412 Ca 0.53 -2.07 0.00 0.00 0.21 0.00 0.00 52.86 51.53 3iss s ASN 412 Cb -0.33 -2.25 0.01 0.00 -0.55 0.00 0.00 41.25 38.12 3iss s ASN 412 CO 0.43 -0.83 0.00 -0.51 -2.79 0.00 0.00 177.10 173.40 3iss s ILE 413 N 1.43 0.05 -0.00 -5.21 2.07 -1.26 -0.85 121.20 117.44 3iss s ILE 413 Ca 0.14 0.03 0.01 0.00 -1.41 0.00 0.00 60.65 59.42 3iss s ILE 413 Cb -0.19 -0.09 -0.00 0.00 0.13 0.00 0.00 42.46 42.31 3iss s ILE 413 CO -0.02 0.05 -0.03 -0.70 -1.91 0.00 0.00 174.94 172.32 3iss s GLU 414 N 0.32 0.27 -0.39 3.50 2.12 -0.12 -4.98 118.70 119.42 3iss s GLU 414 Ca -0.03 -0.14 -0.17 0.00 0.36 0.00 0.00 54.97 55.00 3iss s GLU 414 Cb -0.04 -0.25 0.01 0.00 0.26 0.00 0.00 34.13 34.10 3iss s GLU 414 CO -0.01 0.07 0.41 0.50 -0.54 0.00 0.00 175.26 175.69 3iss s ARG 415 N -0.13 3.29 0.28 4.30 3.52 -1.26 -0.66 118.95 128.29 3iss s ARG 415 Ca 0.01 -0.61 0.08 0.00 -0.13 0.00 0.00 55.73 55.08 3iss s ARG 415 Cb -0.02 -3.90 -0.04 0.00 -1.56 0.00 0.00 34.95 29.43 3iss s ARG 415 CO -0.00 -0.72 0.13 0.14 -0.81 0.00 0.00 175.30 174.03 3iss s VAL 416 N 2.10 3.71 -0.51 7.11 -7.23 -0.56 -4.94 120.40 120.09 3iss s VAL 416 Ca 0.12 -1.64 0.03 0.00 -1.81 0.00 0.00 61.98 58.68 3iss s VAL 416 Cb -0.17 -3.10 0.43 0.00 0.56 0.00 0.00 36.38 34.10 3iss s VAL 416 CO 0.13 -0.31 1.48 0.29 -0.31 0.00 0.00 175.10 176.38 3iss n LYS 417 N -1.10 3.23 0.00 4.82 5.02 -1.26 -2.04 118.16 126.84 3iss n LYS 417 Ca -0.06 -3.99 0.00 0.00 -2.02 0.00 0.00 58.31 52.24 3iss n LYS 417 Cb 0.59 -2.27 0.00 0.00 -0.02 0.00 0.00 35.03 33.33 3iss n LYS 417 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29