#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hoi s ALA 20 N 0.00 3.55 0.22 4.61 0.00 -1.26 -4.95 121.76 123.93 3hoi s ALA 20 Ca 0.00 1.29 -0.32 0.00 0.00 0.00 0.00 51.96 52.93 3hoi s ALA 20 Cb 0.00 -3.52 -0.14 0.00 0.00 0.00 0.00 23.12 19.46 3hoi s ALA 20 CO 0.00 -0.69 1.33 0.39 0.00 0.00 0.00 175.76 176.79 3hoi n GLU 21 N 1.57 1.76 0.14 0.00 1.02 -1.26 -4.90 120.64 118.97 3hoi n GLU 21 Ca 0.03 0.63 0.01 0.00 -0.02 0.00 0.00 57.16 57.81 3hoi n GLU 21 Cb 0.41 -2.23 0.31 0.00 -0.02 0.00 0.00 31.44 29.91 3hoi n GLU 21 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hoi h ARG 22 N 3.96 0.12 -3.73 3.49 3.08 -1.94 -3.42 114.38 115.94 3hoi h ARG 22 Ca -0.44 -0.05 -0.39 0.00 0.07 0.00 0.00 59.98 59.16 3hoi h ARG 22 Cb 1.30 -0.01 -0.36 0.00 0.08 0.00 0.00 29.97 30.98 3hoi h ARG 22 CO 0.74 0.47 -0.76 0.99 -1.07 0.00 0.00 179.97 180.34 3hoi s THR 23 N -4.23 0.29 -0.34 2.04 2.01 -1.26 -0.29 115.64 113.86 3hoi s THR 23 Ca -0.04 0.10 -0.17 0.00 0.31 0.00 0.00 61.69 61.90 3hoi s THR 23 Cb 0.14 -0.41 -0.01 0.00 0.01 0.00 0.00 72.50 72.23 3hoi s THR 23 CO 0.74 0.21 0.43 -0.63 -0.69 0.00 0.00 174.62 174.69 3hoi s ILE 24 N 1.49 5.10 -0.22 1.82 1.01 -0.05 -4.95 121.20 125.40 3hoi s ILE 24 Ca -0.03 0.23 -0.24 0.00 0.00 0.00 0.00 60.65 60.61 3hoi s ILE 24 Cb -0.13 -3.88 -0.01 0.00 0.01 0.00 0.00 42.46 38.46 3hoi s ILE 24 CO -0.03 -0.12 0.82 -1.58 0.00 0.00 0.00 174.94 174.03 3hoi s GLN 25 N 2.19 4.21 0.29 2.79 2.00 -1.26 -0.78 119.66 129.10 3hoi s GLN 25 Ca 0.15 0.94 -0.08 0.00 -2.00 0.00 0.00 55.36 54.37 3hoi s GLN 25 Cb -0.16 -3.63 -0.06 0.00 0.80 0.00 0.00 33.01 29.96 3hoi s GLN 25 CO 0.12 -0.46 0.60 -0.51 -0.50 0.00 0.00 175.29 174.54 3hoi s LEU 26 N 2.64 4.06 0.84 3.68 1.43 -1.07 -5.02 118.68 125.24 3hoi s LEU 26 Ca 0.35 0.88 -0.11 0.00 -1.03 0.00 0.00 54.13 54.23 3hoi s LEU 26 Cb -0.16 -3.69 0.10 0.00 0.03 0.00 0.00 46.19 42.47 3hoi s LEU 26 CO 0.09 -0.19 1.09 -2.16 0.23 0.00 0.00 176.35 175.41 3hoi s PRO 27 N -3.31 1.69 0.19 1.29 0.04 -1.26 -4.86 135.00 128.78 3hoi s PRO 27 Ca 0.47 1.04 -0.32 0.00 0.04 0.00 0.00 61.00 62.22 3hoi s PRO 27 Cb -0.11 -1.84 -0.12 0.00 0.04 0.00 0.00 34.50 32.47 3hoi s PRO 27 CO 0.26 -2.00 1.70 1.17 0.04 0.00 0.00 177.00 178.17 3hoi n LYS 28 N -3.75 2.62 -2.09 4.56 3.00 -1.26 -4.88 118.16 116.36 3hoi n LYS 28 Ca 0.08 0.94 -0.38 0.00 -0.00 0.00 0.00 58.31 58.96 3hoi n LYS 28 Cb 0.54 -2.77 0.01 0.00 0.00 0.00 0.00 35.03 32.80 3hoi n LYS 28 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 3hoi s PRO 29 N 1.24 3.62 0.79 1.64 0.04 -1.26 -4.94 135.00 136.12 3hoi s PRO 29 Ca 0.77 1.97 -0.09 0.00 0.04 0.00 0.00 61.00 63.69 3hoi s PRO 29 Cb -0.55 -2.43 0.12 0.00 0.04 0.00 0.00 34.50 31.68 3hoi s PRO 29 CO 0.34 -0.72 1.11 0.34 0.04 0.00 0.00 177.00 178.11 3hoi s ASP 30 N -1.14 4.21 0.00 6.66 2.15 -1.26 -5.04 116.67 122.25 3hoi s ASP 30 Ca 0.65 0.26 0.00 0.00 0.43 0.00 0.00 52.55 53.89 3hoi s ASP 30 Cb -0.34 -0.68 0.00 0.00 -0.30 0.00 0.00 42.92 41.61 3hoi s ASP 30 CO 0.41 -2.00 0.00 -3.20 -0.17 0.00 0.00 175.17 170.21 3hoi n ASN 32 N -3.18 0.00 -4.75 -0.34 4.05 -1.26 -5.02 115.26 104.76 3hoi n ASN 32 Ca 0.11 0.00 -0.41 0.00 0.45 0.00 0.00 54.58 54.73 3hoi n ASN 32 Cb 0.60 0.00 -0.02 0.00 1.23 0.00 0.00 39.78 41.59 3hoi n ASN 32 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 177.26 173.61 3hoi s ARG 33 N 0.00 4.29 0.74 1.20 3.52 -1.26 -4.95 118.95 122.49 3hoi s ARG 33 Ca 0.00 2.28 -0.14 0.00 -0.13 0.00 0.00 55.73 57.73 3hoi s ARG 33 Cb 0.00 -3.10 0.04 0.00 -1.56 0.00 0.00 34.95 30.34 3hoi s ARG 33 CO 0.00 -0.35 1.19 0.00 -0.81 0.00 0.00 175.30 175.33 3hoi s ALA 34 N -0.39 2.12 0.00 6.12 0.00 -1.26 -4.96 121.76 123.39 3hoi s ALA 34 Ca 0.56 0.80 0.00 0.00 0.00 0.00 0.00 51.96 53.32 3hoi s ALA 34 Cb -0.41 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.26 3hoi s ALA 34 CO 0.47 -1.87 0.00 0.41 0.00 0.00 0.00 175.76 174.77 3hoi n GLY 35 N 0.22 2.92 3.75 0.00 0.00 -1.26 -4.83 105.19 105.99 3hoi n GLY 35 Ca 0.13 -0.45 -0.40 0.00 0.00 0.00 0.00 46.02 45.30 3hoi n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hoi s LEU 36 N 0.00 4.59 0.00 0.99 1.02 -1.26 -4.97 118.68 119.05 3hoi s LEU 36 Ca 0.00 1.82 0.00 0.00 0.02 0.00 0.00 54.13 55.97 3hoi s LEU 36 Cb 0.00 -3.51 0.00 0.00 0.02 0.00 0.00 46.19 42.70 3hoi s LEU 36 CO 0.00 0.11 0.02 -0.11 0.02 0.00 0.00 176.35 176.39 3hoi n LEU 37 N 1.87 0.05 0.00 1.79 7.94 -1.26 -1.33 117.00 126.06 3hoi n LEU 37 Ca -0.02 -0.02 0.00 0.00 -1.11 0.00 0.00 56.01 54.86 3hoi n LEU 37 Cb 0.48 -0.01 0.00 0.00 0.53 0.00 0.00 43.42 44.42 3hoi n LEU 37 CO 0.49 0.01 0.00 1.17 -1.11 0.00 0.00 177.39 177.95 3hoi n LYS 39 N 0.94 0.00 -0.22 1.96 4.81 -1.26 -0.72 118.16 123.66 3hoi n LYS 39 Ca 0.00 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.40 3hoi n LYS 39 Cb 0.01 0.00 0.07 0.00 0.02 0.00 0.00 35.03 35.13 3hoi n LYS 39 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3hoi h ALA 40 N 0.00 0.84 -0.43 3.14 0.00 -1.53 -1.40 119.26 119.88 3hoi h ALA 40 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3hoi h ALA 40 Cb 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3hoi h ALA 40 CO 0.00 0.14 0.23 -0.07 0.00 0.00 0.00 179.25 179.55 3hoi h LEU 41 N 0.77 0.55 -1.46 0.00 3.38 -1.20 -1.20 115.31 116.17 3hoi h LEU 41 Ca 0.26 -0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.15 3hoi h LEU 41 Cb 0.03 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 3hoi h LEU 41 CO -0.11 0.50 0.39 -1.28 0.09 0.00 0.00 178.44 178.03 3hoi h SER 42 N 0.56 0.62 -0.25 -0.43 0.87 -1.69 -2.96 113.55 110.28 3hoi h SER 42 Ca 0.15 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.70 3hoi h SER 42 Cb 0.08 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 61.89 3hoi h SER 42 CO -0.02 0.44 0.00 -0.62 -0.53 0.00 0.00 176.83 176.09 3hoi n GLU 43 N -4.46 2.32 -1.94 2.24 1.02 -0.57 -4.94 120.64 114.32 3hoi n GLU 43 Ca 0.07 -2.09 -0.42 0.00 -0.02 0.00 0.00 57.16 54.69 3hoi n GLU 43 Cb 0.10 -1.47 -0.03 0.00 -0.02 0.00 0.00 31.44 30.03 3hoi n GLU 43 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 3hoi s ARG 44 N -1.59 4.19 0.08 3.49 3.00 -0.47 -4.90 118.95 122.75 3hoi s ARG 44 Ca 0.33 2.31 -0.26 0.00 -1.00 0.00 0.00 55.73 57.10 3hoi s ARG 44 Cb 0.21 -3.72 0.08 0.00 0.00 0.00 0.00 34.95 31.52 3hoi s ARG 44 CO 0.29 -0.77 0.81 -3.38 0.00 0.00 0.00 175.30 172.26 3hoi s HIS 45 N 3.05 -0.35 0.05 5.12 -3.43 -1.26 -5.05 115.29 113.41 3hoi s HIS 45 Ca 0.74 0.15 -0.21 0.00 -0.80 0.00 0.00 55.06 54.94 3hoi s HIS 45 Cb -0.38 0.57 -0.06 0.00 -1.43 0.00 0.00 32.58 31.28 3hoi s HIS 45 CO 0.32 -0.71 0.62 -1.12 -2.00 0.00 0.00 174.74 171.84 3hoi s SER 46 N -2.65 7.08 -0.04 7.38 0.01 -1.26 -4.68 113.70 119.53 3hoi s SER 46 Ca 0.05 1.28 0.02 0.00 1.31 0.00 0.00 55.95 58.62 3hoi s SER 46 Cb -0.01 -2.38 0.01 0.00 0.21 0.00 0.00 66.02 63.84 3hoi s SER 46 CO -0.07 0.19 -0.09 -0.89 0.41 0.00 0.00 173.24 172.78 3hoi s THR 47 N -0.70 0.85 -0.18 1.44 2.01 0.43 -4.97 115.64 114.50 3hoi s THR 47 Ca 0.31 -0.36 0.15 0.00 0.31 0.00 0.00 61.69 62.10 3hoi s THR 47 Cb -0.19 -0.78 0.39 0.00 0.01 0.00 0.00 72.50 71.93 3hoi s THR 47 CO 0.19 0.28 1.24 0.54 -0.69 0.00 0.00 174.62 176.18 3hoi n ARG 48 N 3.56 1.63 -3.92 4.92 1.74 -1.26 -3.77 116.66 119.56 3hoi n ARG 48 Ca -0.21 -2.95 -0.10 0.00 -0.77 0.00 0.00 57.85 53.82 3hoi n ARG 48 Cb 0.53 -1.62 -0.11 0.00 -1.02 0.00 0.00 32.46 30.24 3hoi n ARG 48 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 3hoi s GLU 49 N -3.05 0.29 -0.04 5.56 2.02 -1.26 -4.88 118.70 117.34 3hoi s GLU 49 Ca 0.37 -0.40 -0.10 0.00 0.02 0.00 0.00 54.97 54.86 3hoi s GLU 49 Cb 0.33 0.11 0.02 0.00 0.10 0.00 0.00 34.13 34.69 3hoi s GLU 49 CO -0.00 -0.06 0.23 0.71 0.02 0.00 0.00 175.26 176.16 3hoi s TYR 50 N -1.09 -0.15 0.81 1.61 2.02 -1.26 -4.59 117.35 114.70 3hoi s TYR 50 Ca -0.12 0.31 -0.14 0.00 -0.37 0.00 0.00 57.07 56.75 3hoi s TYR 50 Cb -0.07 0.05 0.07 0.00 -0.40 0.00 0.00 41.96 41.61 3hoi s TYR 50 CO -0.00 -0.25 1.10 0.00 -1.57 0.00 0.00 175.55 174.83 3hoi n ALA 51 N 2.05 -0.31 0.10 3.71 0.00 0.15 -4.62 120.51 121.59 3hoi n ALA 51 Ca -0.18 -0.34 -0.01 0.00 0.00 0.00 0.00 53.44 52.91 3hoi n ALA 51 Cb 0.57 -2.19 -0.03 0.00 0.00 0.00 0.00 19.45 17.80 3hoi n ALA 51 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3hoi h SER 52 N -0.90 0.00 -4.04 0.00 4.64 -1.89 -3.42 113.55 107.93 3hoi h SER 52 Ca -0.46 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.35 3hoi h SER 52 Cb 1.30 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 63.47 3hoi h SER 52 CO 0.45 0.66 0.48 -1.59 -0.87 0.00 0.00 176.83 175.96 3hoi s LYS 53 N -2.88 3.48 0.57 4.77 -2.85 -1.26 -4.68 119.74 116.89 3hoi s LYS 53 Ca 0.02 1.80 -0.20 0.00 -1.00 0.00 0.00 55.97 56.59 3hoi s LYS 53 Cb 0.08 -2.23 -0.04 0.00 -2.06 0.00 0.00 37.83 33.59 3hoi s LYS 53 CO 0.78 -0.79 1.26 0.00 0.10 0.00 0.00 175.35 176.70 3hoi s ALA 54 N -1.58 2.66 0.45 0.59 0.00 -1.26 -4.66 121.76 117.96 3hoi s ALA 54 Ca 0.69 1.13 -0.25 0.00 0.00 0.00 0.00 51.96 53.52 3hoi s ALA 54 Cb -0.29 -3.49 -0.08 0.00 0.00 0.00 0.00 23.12 19.26 3hoi s ALA 54 CO 0.34 -1.22 1.35 -0.51 0.00 0.00 0.00 175.76 175.72 3hoi s LEU 55 N -3.80 4.11 0.84 0.00 1.43 -1.26 -4.99 118.68 115.01 3hoi s LEU 55 Ca 0.75 2.75 -0.12 0.00 -1.03 0.00 0.00 54.13 56.48 3hoi s LEU 55 Cb -0.34 -3.99 0.10 0.00 0.03 0.00 0.00 46.19 41.99 3hoi s LEU 55 CO 0.39 -1.08 1.16 -0.94 0.23 0.00 0.00 176.35 176.10 3hoi s SER 56 N -0.72 3.48 0.43 2.29 1.04 -1.26 -4.81 113.70 114.15 3hoi s SER 56 Ca 0.61 2.20 0.20 0.00 0.48 0.00 0.00 55.95 59.44 3hoi s SER 56 Cb -0.40 -2.57 0.97 0.00 0.10 0.00 0.00 66.02 64.12 3hoi s SER 56 CO 0.51 -2.73 1.89 0.78 0.98 0.00 0.00 173.24 174.66 3hoi h ASN 57 N -1.32 0.00 -0.28 7.02 4.21 -1.99 -0.75 115.58 122.47 3hoi h ASN 57 Ca -0.44 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.04 3hoi h ASN 57 Cb 1.27 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.46 3hoi h ASN 57 CO 0.45 0.27 0.08 0.74 -1.29 0.00 0.00 177.43 177.68 3hoi h THR 58 N 0.00 1.21 -0.43 2.81 2.02 -1.95 -0.00 112.91 116.56 3hoi h THR 58 Ca -0.00 -0.67 -0.15 0.00 0.77 0.00 0.00 66.41 66.36 3hoi h THR 58 Cb 0.61 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 68.12 3hoi h THR 58 CO 0.04 0.22 -0.30 0.44 0.37 0.00 0.00 175.52 176.28 3hoi h ASP 59 N 0.29 1.01 -0.68 4.18 3.32 -1.80 -1.68 116.42 121.06 3hoi h ASP 59 Ca 0.09 -0.42 -0.08 0.00 0.02 0.00 0.00 57.03 56.64 3hoi h ASP 59 Cb 0.26 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 3hoi h ASP 59 CO -0.00 1.22 0.12 0.25 -1.72 0.00 0.00 179.24 179.11 3hoi h LEU 60 N 0.81 1.07 0.01 1.55 5.85 -1.03 -0.46 115.31 123.10 3hoi h LEU 60 Ca 0.09 -0.25 -0.00 0.00 0.84 0.00 0.00 57.88 58.55 3hoi h LEU 60 Cb 0.89 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.64 3hoi h LEU 60 CO 0.08 1.05 -0.00 -1.28 -0.34 0.00 0.00 178.44 177.95 3hoi h SER 61 N 1.04 -0.01 -0.77 1.25 0.87 -0.85 -1.56 113.55 113.52 3hoi h SER 61 Ca 0.21 -0.12 -0.05 0.00 -1.23 0.00 0.00 61.79 60.60 3hoi h SER 61 Cb 0.43 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.36 3hoi h SER 61 CO 0.01 0.12 0.28 0.44 -0.53 0.00 0.00 176.83 177.15 3hoi h ASP 62 N -0.13 1.08 -0.21 6.23 3.32 -1.20 -1.79 116.42 123.72 3hoi h ASP 62 Ca -0.00 -0.19 0.03 0.00 0.02 0.00 0.00 57.03 56.89 3hoi h ASP 62 Cb 0.13 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.37 3hoi h ASP 62 CO 0.00 0.97 0.04 0.25 -1.72 0.00 0.00 179.24 178.78 3hoi h LEU 63 N 1.12 0.00 -0.61 1.55 5.85 -0.93 -0.43 115.31 121.87 3hoi h LEU 63 Ca 0.25 0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.92 3hoi h LEU 63 Cb 0.25 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 3hoi h LEU 63 CO -0.02 0.03 0.03 -0.07 -0.34 0.00 0.00 178.44 178.08 3hoi h LEU 64 N 0.12 1.03 -0.27 2.25 3.38 -1.09 -0.37 115.31 120.35 3hoi h LEU 64 Ca 0.09 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.74 3hoi h LEU 64 Cb 0.09 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3hoi h LEU 64 CO -0.13 1.07 0.05 -0.25 0.09 0.00 0.00 178.44 179.27 3hoi h TRP 65 N 0.96 0.48 -0.63 1.13 7.01 -1.23 -1.84 115.95 121.83 3hoi h TRP 65 Ca 0.18 -0.06 0.06 0.00 2.11 0.00 0.00 58.89 61.17 3hoi h TRP 65 Cb 0.52 -0.13 -0.05 0.00 -2.10 0.00 0.00 29.16 27.39 3hoi h TRP 65 CO 0.04 0.54 0.34 0.00 -2.79 0.00 0.00 178.44 176.57 3hoi h ALA 66 N 0.88 0.84 0.11 2.65 0.00 -0.82 0.19 119.26 123.10 3hoi h ALA 66 Ca 0.08 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.03 3hoi h ALA 66 Cb 0.32 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3hoi h ALA 66 CO 0.00 -0.00 -0.14 0.00 0.00 0.00 0.00 179.25 179.11 3hoi h ALA 67 N 1.34 -0.25 0.00 0.00 0.00 -0.68 -3.41 119.26 116.26 3hoi h ALA 67 Ca 0.28 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 55.03 3hoi h ALA 67 Cb 0.19 0.21 -0.12 0.00 0.00 0.00 0.00 17.79 18.07 3hoi h ALA 67 CO -0.19 -0.67 -0.22 -1.71 0.00 0.00 0.00 179.25 176.47 3hoi n ASN 68 N -5.26 -1.21 -4.82 0.00 5.15 -0.73 -4.39 115.26 104.00 3hoi n ASN 68 Ca -0.07 -1.99 -0.29 0.00 -0.60 0.00 0.00 54.58 51.63 3hoi n ASN 68 Cb 0.18 0.58 0.12 0.00 -0.53 0.00 0.00 39.78 40.13 3hoi n ASN 68 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 3hoi s GLY 69 N -0.91 1.58 -0.30 8.20 0.00 0.67 -4.70 107.32 111.87 3hoi s GLY 69 Ca 0.08 -0.51 -0.27 0.00 0.00 0.00 0.00 44.72 44.02 3hoi s GLY 69 CO -0.10 0.01 0.96 -0.42 0.00 0.00 0.00 173.10 173.54 3hoi s ILE 70 N -3.34 4.65 -1.12 0.90 1.01 -1.26 -0.73 121.20 121.31 3hoi s ILE 70 Ca 0.63 1.56 0.18 0.00 0.00 0.00 0.00 60.65 63.02 3hoi s ILE 70 Cb -0.14 -4.29 -0.14 0.00 0.01 0.00 0.00 42.46 37.90 3hoi s ILE 70 CO 0.52 -0.34 0.82 -0.46 0.00 0.00 0.00 174.94 175.48 3hoi n ASN 71 N 6.52 1.14 -3.61 3.58 6.94 -0.51 -4.78 115.26 124.54 3hoi n ASN 71 Ca 0.09 -1.07 -0.29 0.00 -0.02 0.00 0.00 54.58 53.28 3hoi n ASN 71 Cb 0.47 0.84 -0.14 0.00 -2.36 0.00 0.00 39.78 38.60 3hoi n ASN 71 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 3hoi s ARG 72 N -2.53 0.75 0.15 -3.83 0.52 -1.13 -5.03 118.95 107.85 3hoi s ARG 72 Ca 0.10 -1.33 -0.15 0.00 -0.52 0.00 0.00 55.73 53.82 3hoi s ARG 72 Cb 0.14 -1.75 0.02 0.00 0.52 0.00 0.00 34.95 33.88 3hoi s ARG 72 CO 0.66 -1.11 1.77 0.77 0.02 0.00 0.00 175.30 177.41 3hoi h SER 73 N 7.42 0.55 -0.14 0.23 0.02 -1.86 0.07 113.55 119.84 3hoi h SER 73 Ca -0.05 -0.08 -0.04 0.00 -0.84 0.00 0.00 61.79 60.79 3hoi h SER 73 Cb 0.98 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.36 3hoi h SER 73 CO 0.41 0.46 -0.00 0.77 -1.14 0.00 0.00 176.83 177.33 3hoi h SER 74 N 0.58 0.33 0.57 3.07 4.64 -1.97 -2.84 113.55 117.93 3hoi h SER 74 Ca 0.16 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3hoi h SER 74 Cb 0.03 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 3hoi h SER 74 CO -0.03 0.40 -0.90 -0.62 -0.87 0.00 0.00 176.83 174.81 3hoi n GLU 75 N -4.34 0.29 -1.65 4.77 1.02 -1.00 -4.97 120.64 114.77 3hoi n GLU 75 Ca 0.00 0.02 -0.12 0.00 -0.02 0.00 0.00 57.16 57.05 3hoi n GLU 75 Cb 0.21 -1.62 -0.04 0.00 -0.02 0.00 0.00 31.44 29.97 3hoi n GLU 75 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hoi n GLY 76 N 1.36 0.81 3.95 0.62 0.00 -0.02 -5.01 105.19 106.90 3hoi n GLY 76 Ca 0.02 -0.44 -0.23 0.00 0.00 0.00 0.00 46.02 45.37 3hoi n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hoi s LYS 77 N -3.56 3.12 0.35 1.61 1.02 -1.09 -4.96 119.74 116.24 3hoi s LYS 77 Ca 0.00 -0.47 0.09 0.00 0.02 0.00 0.00 55.97 55.61 3hoi s LYS 77 Cb 0.00 -2.57 -0.06 0.00 -0.52 0.00 0.00 37.83 34.68 3hoi s LYS 77 CO 0.00 -0.22 -0.01 1.03 -0.92 0.00 0.00 175.35 175.23 3hoi s ARG 78 N -4.53 2.00 0.37 1.68 1.81 -1.26 -1.43 118.95 117.60 3hoi s ARG 78 Ca 0.47 -1.85 0.08 0.00 -1.72 0.00 0.00 55.73 52.72 3hoi s ARG 78 Cb -0.10 -1.84 0.72 0.00 -0.45 0.00 0.00 34.95 33.28 3hoi s ARG 78 CO 0.38 0.10 1.89 1.79 -0.68 0.00 0.00 175.30 178.78 3hoi h THR 79 N 1.84 1.19 -3.62 0.02 1.35 -1.21 -3.41 112.91 109.08 3hoi h THR 79 Ca -0.43 -0.84 -0.62 0.00 -0.55 0.00 0.00 66.41 63.98 3hoi h THR 79 Cb 1.25 1.19 -0.14 0.00 -1.73 0.00 0.00 68.15 68.72 3hoi h THR 79 CO 0.69 0.26 -0.44 0.00 -0.25 0.00 0.00 175.52 175.79 3hoi s ALA 80 N -4.73 3.59 0.83 6.62 0.00 -1.26 -5.01 121.76 121.79 3hoi s ALA 80 Ca -0.06 -0.85 -0.10 0.00 0.00 0.00 0.00 51.96 50.95 3hoi s ALA 80 Cb 0.15 -2.42 0.09 0.00 0.00 0.00 0.00 23.12 20.94 3hoi s ALA 80 CO 0.74 -0.29 1.11 -1.25 0.00 0.00 0.00 175.76 176.07 3hoi s PRO 81 N 1.26 1.77 0.06 0.00 0.04 -1.26 -5.03 135.00 131.84 3hoi s PRO 81 Ca 0.10 1.26 -0.07 0.00 0.04 0.00 0.00 61.00 62.33 3hoi s PRO 81 Cb -0.14 -1.83 -0.01 0.00 0.04 0.00 0.00 34.50 32.56 3hoi s PRO 81 CO 0.06 -2.01 0.14 -1.54 0.04 0.00 0.00 177.00 173.69 3hoi s SER 82 N -3.16 0.17 0.00 6.66 1.04 -1.26 -4.91 113.70 112.24 3hoi s SER 82 Ca 0.63 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 56.45 3hoi s SER 82 Cb -0.19 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.21 3hoi s SER 82 CO 0.57 -0.62 0.03 0.00 0.98 0.00 0.00 173.24 174.20 3hoi n ALA 83 N 0.34 1.16 0.00 5.32 0.00 -1.26 -4.33 120.51 121.74 3hoi n ALA 83 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 3hoi n ALA 83 Cb 0.60 -1.60 0.00 0.00 0.00 0.00 0.00 19.45 18.46 3hoi n ALA 83 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3hoi n ASN 85 N 1.86 0.00 0.10 0.00 5.15 -1.26 -4.57 115.26 116.54 3hoi n ASN 85 Ca 0.00 -0.24 0.13 0.00 -0.60 0.00 0.00 54.58 53.86 3hoi n ASN 85 Cb 0.00 0.00 0.44 0.00 -0.53 0.00 0.00 39.78 39.69 3hoi n ASN 85 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3hoi n ARG 86 N 1.15 0.21 -3.78 1.20 5.12 -1.26 -4.93 116.66 114.37 3hoi n ARG 86 Ca 0.00 0.23 -0.24 0.00 -1.93 0.00 0.00 57.85 55.91 3hoi n ARG 86 Cb 0.00 -1.78 0.01 0.00 -1.16 0.00 0.00 32.46 29.54 3hoi n ARG 86 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 3hoi n GLN 87 N -2.16 -3.71 0.22 5.56 6.02 -1.26 -4.88 117.38 117.17 3hoi n GLN 87 Ca 0.05 0.52 0.14 0.00 -0.01 0.00 0.00 57.00 57.70 3hoi n GLN 87 Cb 0.37 -4.80 0.37 0.00 1.02 0.00 0.00 30.24 27.21 3hoi n GLN 87 CO 0.00 0.00 0.00 0.38 -1.01 0.00 0.00 177.06 176.43 3hoi h ASP 88 N -1.84 0.00 -3.46 1.08 2.03 -1.92 -3.45 116.42 108.86 3hoi h ASP 88 Ca -0.63 0.00 -0.61 0.00 -0.73 0.00 0.00 57.03 55.06 3hoi h ASP 88 Cb 1.36 0.00 -0.11 0.00 -0.83 0.00 0.00 39.33 39.75 3hoi h ASP 88 CO 0.57 0.00 0.30 -0.63 -1.03 0.00 0.00 179.24 178.46 3hoi s ILE 89 N -3.35 4.85 -0.02 4.15 -1.09 -1.26 -0.66 121.20 123.82 3hoi s ILE 89 Ca 0.05 1.08 -0.06 0.00 -2.23 0.00 0.00 60.65 59.49 3hoi s ILE 89 Cb 0.07 -4.09 -0.04 0.00 -1.58 0.00 0.00 42.46 36.82 3hoi s ILE 89 CO 0.61 -0.19 0.23 -1.81 -1.23 0.00 0.00 174.94 172.54 3hoi s ASP 90 N 1.61 6.46 -0.28 3.58 1.01 -0.33 -4.94 116.67 123.77 3hoi s ASP 90 Ca 0.30 0.51 -0.04 0.00 0.71 0.00 0.00 52.55 54.02 3hoi s ASP 90 Cb -0.14 -2.07 0.02 0.00 1.01 0.00 0.00 42.92 41.74 3hoi s ASP 90 CO 0.12 0.29 0.02 -0.63 0.21 0.00 0.00 175.17 175.19 3hoi s ILE 91 N -1.24 3.44 -0.06 0.77 1.01 -1.26 -1.42 121.20 122.45 3hoi s ILE 91 Ca 0.24 -0.95 -0.13 0.00 0.00 0.00 0.00 60.65 59.81 3hoi s ILE 91 Cb -0.13 -2.81 -0.05 0.00 0.01 0.00 0.00 42.46 39.48 3hoi s ILE 91 CO 0.14 0.06 0.34 -0.31 0.00 0.00 0.00 174.94 175.17 3hoi s TYR 92 N 1.39 3.65 -0.27 3.97 1.51 -0.49 -1.02 117.35 126.10 3hoi s TYR 92 Ca 0.00 0.83 -0.01 0.00 -1.01 0.00 0.00 57.07 56.88 3hoi s TYR 92 Cb -0.18 -2.24 0.04 0.00 -0.11 0.00 0.00 41.96 39.47 3hoi s TYR 92 CO -0.00 0.58 -0.05 0.08 -1.11 0.00 0.00 175.55 175.05 3hoi s VAL 93 N -0.73 2.86 -0.44 0.71 1.01 0.11 -0.36 120.40 123.56 3hoi s VAL 93 Ca 0.21 -1.19 -0.13 0.00 0.00 0.00 0.00 61.98 60.87 3hoi s VAL 93 Cb -0.15 -2.53 0.06 0.00 0.00 0.00 0.00 36.38 33.76 3hoi s VAL 93 CO 0.10 0.08 0.32 -0.69 0.00 0.00 0.00 175.10 174.91 3hoi s VAL 94 N 1.28 4.87 0.31 2.92 1.01 0.22 -0.65 120.40 130.36 3hoi s VAL 94 Ca -0.02 -1.08 0.08 0.00 0.00 0.00 0.00 61.98 60.96 3hoi s VAL 94 Cb -0.18 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 3hoi s VAL 94 CO -0.03 -0.48 0.14 -0.76 0.00 0.00 0.00 175.10 173.96 3hoi s LEU 95 N 1.57 3.40 0.34 3.92 1.43 -0.44 -1.86 118.68 127.04 3hoi s LEU 95 Ca 0.04 -0.60 0.08 0.00 -1.03 0.00 0.00 54.13 52.62 3hoi s LEU 95 Cb -0.23 -1.92 0.80 0.00 0.03 0.00 0.00 46.19 44.87 3hoi s LEU 95 CO 0.06 -0.19 1.83 -0.65 0.23 0.00 0.00 176.35 177.63 3hoi h PRO 96 N 1.57 0.69 0.00 1.29 0.11 -1.90 -2.46 132.00 131.31 3hoi h PRO 96 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3hoi h PRO 96 Cb 1.25 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3hoi h PRO 96 CO 0.61 0.46 -0.53 -0.56 -0.21 0.00 0.00 178.00 177.77 3hoi h GLN 97 N 0.71 0.00 0.00 1.05 -0.00 -1.96 -2.86 115.11 112.05 3hoi h GLN 97 Ca 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.15 3hoi h GLN 97 Cb 0.83 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.31 3hoi h GLN 97 CO -0.26 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 178.98 3hoi n GLY 98 N 1.22 1.24 3.73 0.06 0.00 -0.92 -1.45 105.19 109.07 3hoi n GLY 98 Ca 0.03 -0.82 -0.35 0.00 0.00 0.00 0.00 46.02 44.88 3hoi n GLY 98 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hoi s THR 99 N -2.00 5.27 0.27 2.61 2.01 0.25 -1.33 115.64 122.72 3hoi s THR 99 Ca 0.00 0.14 0.09 0.00 0.31 0.00 0.00 61.69 62.23 3hoi s THR 99 Cb 0.00 -3.38 -0.05 0.00 0.01 0.00 0.00 72.50 69.08 3hoi s THR 99 CO 0.00 0.47 -0.13 -0.31 -0.69 0.00 0.00 174.62 173.96 3hoi s TYR 100 N 0.15 2.09 -0.17 4.92 1.51 0.17 -0.11 117.35 125.91 3hoi s TYR 100 Ca 0.08 -0.51 -0.01 0.00 -1.01 0.00 0.00 57.07 55.62 3hoi s TYR 100 Cb -0.11 -1.04 -0.01 0.00 -0.11 0.00 0.00 41.96 40.69 3hoi s TYR 100 CO -0.01 0.50 -0.11 -1.17 -1.11 0.00 0.00 175.55 173.65 3hoi s LEU 101 N -3.46 2.66 0.04 -1.29 2.96 0.08 0.05 118.68 119.71 3hoi s LEU 101 Ca 0.28 -0.41 -0.30 0.00 -0.22 0.00 0.00 54.13 53.48 3hoi s LEU 101 Cb -0.00 -1.63 -0.07 0.00 0.50 0.00 0.00 46.19 44.99 3hoi s LEU 101 CO 0.12 0.07 1.50 -0.47 -1.32 0.00 0.00 176.35 176.26 3hoi s TYR 102 N 0.92 2.70 -0.38 5.38 5.04 -0.19 -1.43 117.35 129.40 3hoi s TYR 102 Ca -0.02 0.62 -0.08 0.00 -2.44 0.00 0.00 57.07 55.15 3hoi s TYR 102 Cb -0.15 -3.79 0.06 0.00 0.35 0.00 0.00 41.96 38.43 3hoi s TYR 102 CO -0.01 -3.03 0.18 0.34 -1.34 0.00 0.00 175.55 171.70 3hoi s ASP 103 N 2.04 5.47 0.25 4.32 2.15 -0.01 -4.69 116.67 126.19 3hoi s ASP 103 Ca 0.68 -1.36 0.07 0.00 0.43 0.00 0.00 52.55 52.37 3hoi s ASP 103 Cb -0.35 -1.92 0.30 0.00 -0.30 0.00 0.00 42.92 40.64 3hoi s ASP 103 CO 0.29 -0.44 1.58 0.00 -0.17 0.00 0.00 175.17 176.44 3hoi h ALA 104 N 8.30 0.91 -0.42 3.66 0.00 -1.90 -1.85 119.26 127.96 3hoi h ALA 104 Ca -0.22 -0.54 -0.03 0.00 0.00 0.00 0.00 54.91 54.12 3hoi h ALA 104 Cb 1.08 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 3hoi h ALA 104 CO 0.68 0.74 0.14 0.87 0.00 0.00 0.00 179.25 181.68 3hoi h LYS 105 N 0.11 0.60 -0.39 0.00 6.56 -1.95 -3.00 116.57 118.51 3hoi h LYS 105 Ca -0.01 -0.09 0.00 0.00 -1.06 0.00 0.00 60.65 59.50 3hoi h LYS 105 Cb 1.09 -0.11 0.00 0.00 -0.57 0.00 0.00 32.23 32.64 3hoi h LYS 105 CO 0.09 0.52 0.00 0.41 -2.06 0.00 0.00 179.45 178.41 3hoi n GLY 106 N -1.12 2.15 3.82 3.86 0.00 -1.16 -4.99 105.19 107.75 3hoi n GLY 106 Ca 0.03 -0.50 -0.28 0.00 0.00 0.00 0.00 46.02 45.26 3hoi n GLY 106 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3hoi n HIS 107 N 0.90 -1.01 -4.09 1.61 -0.00 -0.73 -4.81 115.22 107.09 3hoi n HIS 107 Ca 0.15 0.16 -0.10 0.00 0.46 0.00 0.00 57.72 58.39 3hoi n HIS 107 Cb 0.47 -1.82 -0.09 0.00 -0.12 0.00 0.00 29.99 28.43 3hoi n HIS 107 CO 0.00 0.00 0.00 -1.59 0.46 0.00 0.00 176.34 175.21 3hoi s LYS 108 N -5.99 1.11 -0.10 1.57 -2.85 -1.01 -2.59 119.74 109.87 3hoi s LYS 108 Ca 0.25 -1.38 0.04 0.00 -1.00 0.00 0.00 55.97 53.87 3hoi s LYS 108 Cb -0.14 0.31 0.00 0.00 -2.06 0.00 0.00 37.83 35.94 3hoi s LYS 108 CO 0.64 -0.37 -0.23 -0.51 0.10 0.00 0.00 175.35 174.97 3hoi s LEU 109 N -3.05 2.07 -0.15 2.77 1.43 0.04 -0.83 118.68 120.97 3hoi s LEU 109 Ca 0.25 -0.55 -0.04 0.00 -1.03 0.00 0.00 54.13 52.76 3hoi s LEU 109 Cb 0.05 -1.39 -0.03 0.00 0.03 0.00 0.00 46.19 44.85 3hoi s LEU 109 CO 0.04 0.15 -0.02 0.20 0.23 0.00 0.00 176.35 176.95 3hoi s ASN 110 N 0.38 4.97 0.19 2.29 0.01 -0.51 -0.87 114.94 121.39 3hoi s ASN 110 Ca -0.18 -0.06 -0.30 0.00 -0.71 0.00 0.00 52.86 51.61 3hoi s ASN 110 Cb -0.18 -1.74 -0.08 0.00 0.41 0.00 0.00 41.25 39.66 3hoi s ASN 110 CO 0.08 0.21 1.29 -0.22 -1.51 0.00 0.00 177.10 176.95 3hoi s LEU 111 N 0.14 4.42 -0.18 0.60 2.96 0.60 -0.74 118.68 126.48 3hoi s LEU 111 Ca -0.00 2.35 -0.08 0.00 -0.22 0.00 0.00 54.13 56.18 3hoi s LEU 111 Cb -0.13 -3.61 -0.08 0.00 0.50 0.00 0.00 46.19 42.87 3hoi s LEU 111 CO 0.02 -0.51 -0.22 -0.38 -1.32 0.00 0.00 176.35 173.95 3hoi n ILE 112 N 2.74 0.97 -3.95 6.68 2.08 0.85 -4.88 119.36 123.84 3hoi n ILE 112 Ca 0.06 -0.26 -0.15 0.00 0.56 0.00 0.00 62.75 62.96 3hoi n ILE 112 Cb 0.43 -1.67 -0.15 0.00 -0.75 0.00 0.00 39.64 37.50 3hoi n ILE 112 CO 0.00 0.00 0.00 -0.44 0.56 0.00 0.00 176.55 176.67 3hoi s SER 113 N -6.49 0.31 0.51 4.38 0.01 -0.88 -4.95 113.70 106.59 3hoi s SER 113 Ca -0.24 -0.03 -0.18 0.00 1.31 0.00 0.00 55.95 56.80 3hoi s SER 113 Cb 0.09 -0.11 -0.08 0.00 0.21 0.00 0.00 66.02 66.14 3hoi s SER 113 CO 0.32 -0.04 1.01 -1.61 0.41 0.00 0.00 173.24 173.34 3hoi s GLU 114 N 0.47 3.79 0.00 12.44 2.02 -1.26 -0.59 118.70 135.57 3hoi s GLU 114 Ca -0.04 1.18 0.00 0.00 0.02 0.00 0.00 54.97 56.13 3hoi s GLU 114 Cb -0.07 -2.10 0.00 0.00 0.10 0.00 0.00 34.13 32.06 3hoi s GLU 114 CO -0.01 -0.41 0.00 0.41 0.02 0.00 0.00 175.26 175.27 3hoi n GLY 115 N -0.81 0.38 3.54 -1.39 0.00 -0.53 -4.80 105.19 101.58 3hoi n GLY 115 Ca 0.08 -1.91 -0.42 0.00 0.00 0.00 0.00 46.02 43.78 3hoi n GLY 115 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hoi s ASP 116 N -1.02 6.27 -0.20 1.61 -1.08 -1.08 -2.70 116.67 118.47 3hoi s ASP 116 Ca 0.00 -0.23 0.15 0.00 -0.52 0.00 0.00 52.55 51.95 3hoi s ASP 116 Cb 0.00 -2.25 0.48 0.00 -1.46 0.00 0.00 42.92 39.68 3hoi s ASP 116 CO 0.00 -0.51 1.38 1.41 0.52 0.00 0.00 175.17 177.96 3hoi n HIS 117 N 5.72 0.77 -0.02 -5.34 8.25 -1.26 -4.68 115.22 118.66 3hoi n HIS 117 Ca -0.06 -1.11 0.07 0.00 -0.26 0.00 0.00 57.72 56.37 3hoi n HIS 117 Cb 0.49 -0.33 0.46 0.00 1.12 0.00 0.00 29.99 31.73 3hoi n HIS 117 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3hoi h ARG 118 N 1.22 0.47 0.00 -0.41 3.08 -1.90 -2.50 114.38 114.34 3hoi h ARG 118 Ca 0.06 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.03 3hoi h ARG 118 Cb 1.41 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.34 3hoi h ARG 118 CO 0.22 0.31 -0.25 0.66 -1.07 0.00 0.00 179.97 179.84 3hoi h SER 119 N 0.48 0.00 -0.37 7.04 4.64 -1.96 0.17 113.55 123.55 3hoi h SER 119 Ca 0.20 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.44 3hoi h SER 119 Cb 0.18 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.25 3hoi h SER 119 CO -0.05 0.25 -0.04 0.00 -0.87 0.00 0.00 176.83 176.12 3hoi h ALA 120 N 1.75 1.08 -0.34 5.18 0.00 -1.80 -1.48 119.26 123.65 3hoi h ALA 120 Ca -0.00 -0.28 -0.17 0.00 0.00 0.00 0.00 54.91 54.46 3hoi h ALA 120 Cb 0.49 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 3hoi h ALA 120 CO 0.03 0.58 -0.44 0.28 0.00 0.00 0.00 179.25 179.70 3hoi h VAL 121 N 0.72 1.28 -0.68 0.00 2.07 -1.33 -0.31 116.25 117.99 3hoi h VAL 121 Ca 0.13 -1.62 -0.05 0.00 0.82 0.00 0.00 66.70 65.99 3hoi h VAL 121 Cb 0.49 1.48 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 3hoi h VAL 121 CO 0.03 0.53 0.24 0.00 0.02 0.00 0.00 177.57 178.39 3hoi h ALA 122 N 0.79 0.88 -0.95 1.67 0.00 -0.52 -3.39 119.26 117.74 3hoi h ALA 122 Ca 0.04 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3hoi h ALA 122 Cb 1.03 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.56 3hoi h ALA 122 CO 0.10 0.53 0.00 0.41 0.00 0.00 0.00 179.25 180.29 3hoi n GLY 123 N -0.79 3.66 0.00 0.00 0.00 -0.60 -1.57 105.19 105.89 3hoi n GLY 123 Ca 0.05 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.13 3hoi n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hoi n GLY 124 N 0.00 -1.05 3.19 -0.02 0.00 -1.26 -4.62 105.19 101.42 3hoi n GLY 124 Ca 0.00 -0.13 -0.40 0.00 0.00 0.00 0.00 46.02 45.49 3hoi n GLY 124 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hoi s GLN 125 N -2.43 2.63 0.62 1.61 -0.21 -0.61 -4.96 119.66 116.31 3hoi s GLN 125 Ca 0.28 -2.09 0.35 0.00 0.02 0.00 0.00 55.36 53.92 3hoi s GLN 125 Cb 0.17 -3.92 2.01 0.00 1.00 0.00 0.00 33.01 32.28 3hoi s GLN 125 CO 0.37 -1.19 2.26 0.00 -2.12 0.00 0.00 175.29 174.60 3hoi h ALA 126 N 7.92 1.37 -0.23 6.09 0.00 -1.83 -2.67 119.26 129.92 3hoi h ALA 126 Ca -0.10 -0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.87 3hoi h ALA 126 Cb 1.03 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 3hoi h ALA 126 CO 0.79 -0.06 0.19 0.27 0.00 0.00 0.00 179.25 180.43 3hoi h PHE 127 N 0.00 0.00 -0.19 0.00 -5.15 -1.93 -2.51 116.94 107.17 3hoi h PHE 127 Ca 0.01 0.00 -0.03 0.00 -0.20 0.00 0.00 57.97 57.75 3hoi h PHE 127 Cb 0.11 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.27 3hoi h PHE 127 CO 0.00 0.00 -0.03 0.28 -2.00 0.00 0.00 178.31 176.56 3hoi h VAL 128 N 0.00 1.14 0.00 0.88 2.07 -1.81 -1.45 116.25 117.08 3hoi h VAL 128 Ca 0.11 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 67.06 3hoi h VAL 128 Cb 0.48 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 3hoi h VAL 128 CO -0.00 0.19 0.00 0.59 0.02 0.00 0.00 177.57 178.36 3hoi n ASN 129 N -4.35 0.61 0.21 0.57 4.13 -0.94 -1.98 115.26 113.51 3hoi n ASN 129 Ca -0.00 0.70 0.14 0.00 1.68 0.00 0.00 54.58 57.09 3hoi n ASN 129 Cb 0.20 -0.81 0.38 0.00 -1.54 0.00 0.00 39.78 38.01 3hoi n ASN 129 CO 0.00 0.00 0.00 0.78 0.28 0.00 0.00 177.26 178.32 3hoi h ASN 130 N 0.00 0.00 -3.72 6.41 2.35 -1.43 -3.45 115.58 115.75 3hoi h ASN 130 Ca 0.00 0.00 -0.49 0.00 -0.55 0.00 0.00 56.30 55.26 3hoi h ASN 130 Cb 0.22 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.57 3hoi h ASN 130 CO 0.00 0.00 0.35 0.00 -1.65 0.00 0.00 177.43 176.13 3hoi s ALA 131 N -3.32 3.32 -0.23 -0.83 0.00 -0.84 -4.74 121.76 115.14 3hoi s ALA 131 Ca 0.06 0.62 0.28 0.00 0.00 0.00 0.00 51.96 52.92 3hoi s ALA 131 Cb 0.08 -3.22 1.16 0.00 0.00 0.00 0.00 23.12 21.13 3hoi s ALA 131 CO 0.60 0.17 1.83 -1.00 0.00 0.00 0.00 175.76 177.36 3hoi h PRO 132 N 4.39 0.00 -2.91 0.00 0.13 -1.81 -3.44 132.00 128.36 3hoi h PRO 132 Ca -0.45 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.56 3hoi h PRO 132 Cb 1.20 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.11 3hoi h PRO 132 CO 0.69 0.00 -0.26 0.54 -0.23 0.00 0.00 178.00 178.74 3hoi s VAL 133 N -3.47 0.03 -0.02 1.56 0.11 -1.21 -4.28 120.40 113.12 3hoi s VAL 133 Ca 0.03 -0.25 0.06 0.00 -2.93 0.00 0.00 61.98 58.89 3hoi s VAL 133 Cb 0.09 -0.59 -0.01 0.00 -1.53 0.00 0.00 36.38 34.34 3hoi s VAL 133 CO 0.46 -0.13 -0.20 -0.44 -3.33 0.00 0.00 175.10 171.46 3hoi s SER 134 N -0.65 2.33 -0.19 3.54 0.01 -0.78 -1.19 113.70 116.77 3hoi s SER 134 Ca -0.07 -0.36 -0.10 0.00 1.31 0.00 0.00 55.95 56.72 3hoi s SER 134 Cb -0.04 -0.36 -0.05 0.00 0.21 0.00 0.00 66.02 65.79 3hoi s SER 134 CO 0.03 0.23 0.13 -0.76 0.41 0.00 0.00 173.24 173.27 3hoi s LEU 135 N -0.35 4.21 -0.17 2.44 1.43 0.15 -0.61 118.68 125.78 3hoi s LEU 135 Ca 0.05 0.24 -0.01 0.00 -1.03 0.00 0.00 54.13 53.38 3hoi s LEU 135 Cb -0.09 -2.08 -0.01 0.00 0.03 0.00 0.00 46.19 44.04 3hoi s LEU 135 CO 0.00 0.20 -0.11 -0.69 0.23 0.00 0.00 176.35 175.98 3hoi s VAL 136 N 0.26 2.99 -0.38 -1.59 1.01 0.51 -0.39 120.40 122.82 3hoi s VAL 136 Ca 0.08 -0.65 -0.14 0.00 0.00 0.00 0.00 61.98 61.27 3hoi s VAL 136 Cb -0.11 -2.30 0.00 0.00 0.00 0.00 0.00 36.38 33.97 3hoi s VAL 136 CO -0.01 0.49 0.29 -0.76 0.00 0.00 0.00 175.10 175.10 3hoi s LEU 137 N 0.96 4.80 -0.15 3.92 1.43 -1.26 -1.39 118.68 126.99 3hoi s LEU 137 Ca -0.02 -0.63 0.02 0.00 -1.03 0.00 0.00 54.13 52.47 3hoi s LEU 137 Cb -0.15 -2.18 0.01 0.00 0.03 0.00 0.00 46.19 43.91 3hoi s LEU 137 CO -0.01 -0.36 -0.20 -0.69 0.23 0.00 0.00 176.35 175.32 3hoi s VAL 138 N 1.75 1.96 -0.18 -1.59 1.01 -0.51 -4.59 120.40 118.27 3hoi s VAL 138 Ca 0.06 -0.90 -0.19 0.00 0.00 0.00 0.00 61.98 60.96 3hoi s VAL 138 Cb -0.18 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.41 3hoi s VAL 138 CO 0.11 0.53 0.52 -0.55 0.00 0.00 0.00 175.10 175.70 3hoi s SER 139 N 1.05 6.60 -1.00 3.32 0.15 -1.26 -1.19 113.70 121.37 3hoi s SER 139 Ca -0.02 0.72 -0.23 0.00 0.70 0.00 0.00 55.95 57.11 3hoi s SER 139 Cb -0.14 -2.29 -0.01 0.00 -1.71 0.00 0.00 66.02 61.86 3hoi s SER 139 CO -0.06 -0.14 1.78 -1.81 1.20 0.00 0.00 173.24 174.20 3hoi s ASP 140 N 1.03 5.66 0.55 5.45 1.01 0.17 -4.34 116.67 126.20 3hoi s ASP 140 Ca 0.25 -1.14 0.33 0.00 0.71 0.00 0.00 52.55 52.69 3hoi s ASP 140 Cb -0.15 -2.57 1.52 0.00 1.01 0.00 0.00 42.92 42.73 3hoi s ASP 140 CO 0.10 -2.30 2.06 -0.07 0.21 0.00 0.00 175.17 175.17 3hoi h LEU 141 N 15.94 0.00 -1.86 1.23 3.38 -1.47 -1.71 115.31 130.82 3hoi h LEU 141 Ca 0.17 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 3hoi h LEU 141 Cb 0.99 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.74 3hoi h LEU 141 CO 1.30 0.07 -0.09 0.77 0.09 0.00 0.00 178.44 180.58 3hoi h SER 142 N 0.00 0.00 1.27 -0.43 4.64 -1.73 -0.83 113.55 116.47 3hoi h SER 142 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hoi h SER 142 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 3hoi h SER 142 CO 0.01 0.09 0.00 0.11 -0.87 0.00 0.00 176.83 176.17 3hoi h LYS 143 N 0.00 0.00 0.00 4.77 1.57 -1.68 -3.33 116.57 117.90 3hoi h LYS 143 Ca -0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 3hoi h LYS 143 Cb 0.38 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 3hoi h LYS 143 CO 0.01 0.00 -1.85 1.28 -0.57 0.00 0.00 179.45 178.32 3hoi n LEU 144 N -2.72 0.00 0.00 2.94 4.77 -0.36 -4.89 117.00 116.75 3hoi n LEU 144 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 3hoi n LEU 144 Cb 0.36 0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 3hoi n LEU 144 CO 0.28 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 3hoi n GLY 145 N 1.53 0.28 3.61 -0.72 0.00 -0.97 -5.00 105.19 103.93 3hoi n GLY 145 Ca -0.05 -1.24 -0.43 0.00 0.00 0.00 0.00 46.02 44.30 3hoi n GLY 145 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hoi s ASP 146 N -4.00 6.39 0.59 1.61 -1.08 -1.26 -4.21 116.67 114.71 3hoi s ASP 146 Ca 0.00 1.14 0.29 0.00 -0.52 0.00 0.00 52.55 53.46 3hoi s ASP 146 Cb 0.00 -2.54 1.59 0.00 -1.46 0.00 0.00 42.92 40.52 3hoi s ASP 146 CO 0.00 -1.33 2.02 0.00 0.52 0.00 0.00 175.17 176.39 3hoi h ALA 147 N 10.54 1.92 -0.00 3.66 0.00 -1.94 -0.96 119.26 132.48 3hoi h ALA 147 Ca -0.29 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3hoi h ALA 147 Cb 1.12 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3hoi h ALA 147 CO 1.05 -0.44 -0.19 1.63 0.00 0.00 0.00 179.25 181.30 3hoi n LYS 148 N -3.75 0.60 -2.66 0.00 4.76 -1.26 -4.77 118.16 111.08 3hoi n LYS 148 Ca 0.04 -0.26 -0.41 0.00 -2.87 0.00 0.00 58.31 54.80 3hoi n LYS 148 Cb 0.45 -1.49 -0.04 0.00 -1.84 0.00 0.00 35.03 32.10 3hoi n LYS 148 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 3hoi s SER 149 N -2.58 7.39 0.22 4.39 0.15 -0.37 -4.95 113.70 117.96 3hoi s SER 149 Ca 0.24 1.84 -0.06 0.00 0.70 0.00 0.00 55.95 58.68 3hoi s SER 149 Cb 0.19 -2.59 0.20 0.00 -1.71 0.00 0.00 66.02 62.12 3hoi s SER 149 CO 0.52 -0.17 1.75 0.78 1.20 0.00 0.00 173.24 177.32 3hoi h ASN 150 N 5.83 1.00 -0.89 5.45 -0.26 -1.89 -1.98 115.58 122.84 3hoi h ASN 150 Ca -0.43 -0.20 -0.02 0.00 -0.56 0.00 0.00 56.30 55.09 3hoi h ASN 150 Cb 1.21 -0.26 -0.04 0.00 -1.06 0.00 0.00 38.32 38.17 3hoi h ASN 150 CO 0.73 0.95 0.48 -0.74 -1.06 0.00 0.00 177.43 177.79 3hoi h HIS 151 N 1.01 1.23 -0.60 1.19 2.76 -1.94 -0.99 115.15 117.82 3hoi h HIS 151 Ca 0.22 -0.04 -0.03 0.00 -2.20 0.00 0.00 60.37 58.32 3hoi h HIS 151 Cb 0.34 -0.39 -0.03 0.00 1.55 0.00 0.00 27.41 28.88 3hoi h HIS 151 CO 0.03 0.86 0.24 0.28 -1.30 0.00 0.00 177.93 178.04 3hoi h VAL 152 N 1.25 1.23 -0.55 5.26 2.07 -1.77 -2.82 116.25 120.92 3hoi h VAL 152 Ca 0.31 -0.71 -0.02 0.00 0.82 0.00 0.00 66.70 67.10 3hoi h VAL 152 Cb 0.05 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 3hoi h VAL 152 CO -0.05 0.28 0.25 1.56 0.02 0.00 0.00 177.57 179.62 3hoi h GLN 153 N 0.83 0.79 -1.50 1.57 4.20 -0.72 -2.02 115.11 118.26 3hoi h GLN 153 Ca 0.20 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.80 3hoi h GLN 153 Cb 0.20 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.83 3hoi h GLN 153 CO -0.02 0.63 0.00 1.28 -0.67 0.00 0.00 178.83 180.05 3hoi n LEU 154 N -4.35 0.32 0.00 1.46 4.32 -0.44 -1.03 117.00 117.28 3hoi n LEU 154 Ca 0.05 -0.16 0.00 0.00 -0.02 0.00 0.00 56.01 55.88 3hoi n LEU 154 Cb 0.14 -0.06 0.00 0.00 -1.62 0.00 0.00 43.42 41.88 3hoi n LEU 154 CO 0.38 0.06 0.00 0.61 -1.22 0.00 0.00 177.39 177.21 3hoi n GLY 156 N 0.83 0.00 0.69 -0.72 0.00 -0.76 -4.57 105.19 100.65 3hoi n GLY 156 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3hoi n GLY 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hoi n ALA 157 N 0.00 1.38 0.00 4.61 0.00 -0.20 -0.99 120.51 125.31 3hoi n ALA 157 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3hoi n ALA 157 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.45 3hoi n ALA 157 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3hoi n ASP 159 N 0.62 0.00 -0.13 0.00 8.00 -1.26 -1.66 116.55 122.12 3hoi n ASP 159 Ca 0.00 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.41 3hoi n ASP 159 Cb 0.05 0.00 0.05 0.00 -0.02 0.00 0.00 41.12 41.20 3hoi n ASP 159 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hoi h ALA 160 N 0.00 0.79 -0.45 2.24 0.00 -1.45 -2.69 119.26 117.70 3hoi h ALA 160 Ca 0.00 -0.38 -0.07 0.00 0.00 0.00 0.00 54.91 54.47 3hoi h ALA 160 Cb 0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3hoi h ALA 160 CO 0.00 0.65 0.00 0.78 0.00 0.00 0.00 179.25 180.69 3hoi h GLY 161 N 0.93 0.79 0.75 0.00 0.00 -1.59 0.93 103.07 104.88 3hoi h GLY 161 Ca 0.11 -0.52 0.01 0.00 0.00 0.00 0.00 47.33 46.93 3hoi h GLY 161 CO 0.06 0.48 -0.14 -2.22 0.00 0.00 0.00 176.54 174.72 3hoi h ILE 162 N 0.69 0.68 -0.67 2.60 2.04 -1.80 -1.33 117.51 119.72 3hoi h ILE 162 Ca 0.14 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.98 3hoi h ILE 162 Cb 0.42 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 3hoi h ILE 162 CO 0.02 0.00 0.36 0.58 0.00 0.00 0.00 178.15 179.11 3hoi h VAL 163 N -0.27 1.21 -0.50 1.67 2.07 -1.14 -2.57 116.25 116.73 3hoi h VAL 163 Ca 0.03 -0.54 0.08 0.00 0.82 0.00 0.00 66.70 67.08 3hoi h VAL 163 Cb 0.29 0.34 -0.06 0.00 -1.52 0.00 0.00 31.29 30.34 3hoi h VAL 163 CO -0.09 0.24 0.15 -1.28 0.02 0.00 0.00 177.57 176.61 3hoi h SER 164 N 0.92 0.11 0.61 0.57 0.87 -0.56 -1.84 113.55 114.22 3hoi h SER 164 Ca 0.24 0.07 -0.11 0.00 -1.23 0.00 0.00 61.79 60.76 3hoi h SER 164 Cb 0.05 0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.07 3hoi h SER 164 CO -0.04 0.09 -0.52 -0.61 -0.53 0.00 0.00 176.83 175.22 3hoi h GLN 165 N 0.30 0.00 -0.39 2.24 5.75 -0.98 0.22 115.11 122.25 3hoi h GLN 165 Ca 0.24 0.00 0.07 0.00 -0.15 0.00 0.00 58.65 58.81 3hoi h GLN 165 Cb 0.29 0.00 -0.06 0.00 1.07 0.00 0.00 27.48 28.78 3hoi h GLN 165 CO -0.28 0.52 0.02 -0.91 -2.65 0.00 0.00 178.83 175.53 3hoi h ASN 166 N 0.00 -0.12 0.12 -0.69 2.35 -1.02 -0.62 115.58 115.60 3hoi h ASN 166 Ca -0.01 0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.82 3hoi h ASN 166 Cb 0.97 0.14 0.00 0.00 0.05 0.00 0.00 38.32 39.48 3hoi h ASN 166 CO 0.07 -0.02 -0.06 0.40 -1.65 0.00 0.00 177.43 176.17 3hoi h ILE 167 N 0.13 0.92 -1.00 2.81 2.04 -0.76 -1.10 117.51 120.56 3hoi h ILE 167 Ca 0.19 -0.15 0.04 0.00 1.00 0.00 0.00 64.86 65.94 3hoi h ILE 167 Cb 0.26 1.02 -0.06 0.00 -0.74 0.00 0.00 36.82 37.30 3hoi h ILE 167 CO -0.30 0.04 0.65 0.28 0.00 0.00 0.00 178.15 178.82 3hoi h SER 168 N -0.23 1.08 -0.26 1.72 0.02 -0.78 -0.47 113.55 114.64 3hoi h SER 168 Ca -0.02 -0.01 -0.20 0.00 -0.84 0.00 0.00 61.79 60.73 3hoi h SER 168 Cb 0.18 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.48 3hoi h SER 168 CO 0.03 0.74 -0.61 -0.07 -1.14 0.00 0.00 176.83 175.77 3hoi h LEU 169 N 1.25 0.98 -0.44 5.07 3.38 -1.03 -1.83 115.31 122.69 3hoi h LEU 169 Ca 0.40 -0.56 0.01 0.00 0.09 0.00 0.00 57.88 57.82 3hoi h LEU 169 Cb 0.02 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 3hoi h LEU 169 CO -0.13 1.36 0.28 0.15 0.09 0.00 0.00 178.44 180.19 3hoi h PHE 170 N 0.64 0.53 -0.90 1.13 3.57 -0.95 -0.92 116.94 120.05 3hoi h PHE 170 Ca -0.00 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.51 3hoi h PHE 170 Cb 1.22 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 39.74 3hoi h PHE 170 CO 0.08 0.33 0.56 0.00 -2.23 0.00 0.00 178.31 177.05 3hoi h SER 172 N 1.23 0.59 -0.54 0.00 0.87 -0.97 0.12 113.55 114.86 3hoi h SER 172 Ca 0.33 -0.22 -0.08 0.00 -1.23 0.00 0.00 61.79 60.58 3hoi h SER 172 Cb -0.08 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 61.70 3hoi h SER 172 CO -0.06 0.66 0.04 0.00 -0.53 0.00 0.00 176.83 176.93 3hoi h ALA 173 N 0.96 0.98 -0.02 6.23 0.00 -0.55 -3.10 119.26 123.75 3hoi h ALA 173 Ca 0.13 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3hoi h ALA 173 Cb 0.29 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3hoi h ALA 173 CO -0.00 0.63 -0.00 0.00 0.00 0.00 0.00 179.25 179.88 3hoi n ALA 174 N -2.47 2.57 -3.45 0.00 0.00 0.71 -4.78 120.51 113.09 3hoi n ALA 174 Ca 0.03 -0.46 -0.17 0.00 0.00 0.00 0.00 53.44 52.84 3hoi n ALA 174 Cb 0.31 -1.14 0.08 0.00 0.00 0.00 0.00 19.45 18.70 3hoi n ALA 174 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hoi n ARG 175 N 0.26 -6.19 -4.72 0.00 1.74 -0.05 -5.02 116.66 102.68 3hoi n ARG 175 Ca 0.19 0.83 -0.32 0.00 -0.77 0.00 0.00 57.85 57.77 3hoi n ARG 175 Cb 0.37 -5.80 -0.12 0.00 -1.02 0.00 0.00 32.46 25.90 3hoi n ARG 175 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3hoi s LEU 176 N -6.34 2.80 0.05 0.55 1.43 0.22 -4.31 118.68 113.07 3hoi s LEU 176 Ca 0.03 -0.26 -0.27 0.00 -1.03 0.00 0.00 54.13 52.60 3hoi s LEU 176 Cb -0.00 -1.61 -0.05 0.00 0.03 0.00 0.00 46.19 44.56 3hoi s LEU 176 CO 0.74 0.30 0.86 0.00 0.23 0.00 0.00 176.35 178.49 3hoi s ALA 177 N -0.86 3.28 0.19 4.21 0.00 0.13 -4.30 121.76 124.42 3hoi s ALA 177 Ca 0.14 0.41 -0.18 0.00 0.00 0.00 0.00 51.96 52.33 3hoi s ALA 177 Cb -0.11 -3.15 0.03 0.00 0.00 0.00 0.00 23.12 19.89 3hoi s ALA 177 CO 0.04 -0.04 0.53 -0.08 0.00 0.00 0.00 175.76 176.21 3hoi s THR 178 N 0.25 0.03 -0.10 0.00 -1.32 -1.26 -1.90 115.64 111.35 3hoi s THR 178 Ca 0.44 -0.72 -0.05 0.00 -1.21 0.00 0.00 61.69 60.15 3hoi s THR 178 Cb -0.21 -1.53 0.04 0.00 -1.51 0.00 0.00 72.50 69.29 3hoi s THR 178 CO 0.26 -0.12 0.22 0.54 -2.21 0.00 0.00 174.62 173.31 3hoi s VAL 179 N -3.86 -0.04 0.11 5.08 0.11 -1.23 -0.43 120.40 120.13 3hoi s VAL 179 Ca 0.08 0.15 -0.30 0.00 -2.93 0.00 0.00 61.98 58.98 3hoi s VAL 179 Cb -0.01 -0.35 -0.06 0.00 -1.53 0.00 0.00 36.38 34.43 3hoi s VAL 179 CO -0.04 0.06 1.13 -2.16 -3.33 0.00 0.00 175.10 170.77 3hoi s PRO 180 N 1.17 4.52 0.04 1.54 0.04 -1.26 -4.05 135.00 136.99 3hoi s PRO 180 Ca -0.09 1.71 0.03 0.00 0.04 0.00 0.00 61.00 62.69 3hoi s PRO 180 Cb -0.10 -3.33 -0.02 0.00 0.04 0.00 0.00 34.50 31.09 3hoi s PRO 180 CO -0.07 -0.09 -0.09 1.03 0.04 0.00 0.00 177.00 177.82 3hoi s ARG 181 N 0.41 0.59 -0.01 4.56 0.52 0.08 -4.99 118.95 120.10 3hoi s ARG 181 Ca 0.54 -0.69 0.15 0.00 -0.52 0.00 0.00 55.73 55.20 3hoi s ARG 181 Cb -0.29 -0.44 -0.19 0.00 0.52 0.00 0.00 34.95 34.55 3hoi s ARG 181 CO 0.32 0.09 0.49 0.00 0.02 0.00 0.00 175.30 176.22 3hoi n ALA 182 N 1.72 3.29 -2.25 2.13 0.00 -1.26 -0.39 120.51 123.75 3hoi n ALA 182 Ca -0.21 -0.39 -0.32 0.00 0.00 0.00 0.00 53.44 52.53 3hoi n ALA 182 Cb 0.55 -0.52 -0.05 0.00 0.00 0.00 0.00 19.45 19.42 3hoi n ALA 182 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3hoi s SER 183 N -3.01 6.67 -0.55 0.00 0.01 -1.26 -4.90 113.70 110.65 3hoi s SER 183 Ca 0.00 1.12 -0.13 0.00 1.31 0.00 0.00 55.95 58.25 3hoi s SER 183 Cb 0.10 -2.31 0.14 0.00 0.21 0.00 0.00 66.02 64.16 3hoi s SER 183 CO 0.61 -0.20 0.47 -0.62 0.41 0.00 0.00 173.24 173.91 3hoi s ASP 185 N -2.51 6.05 0.33 2.44 -1.08 -0.13 -4.79 116.67 116.97 3hoi s ASP 185 Ca 0.51 -1.98 0.04 0.00 -0.52 0.00 0.00 52.55 50.60 3hoi s ASP 185 Cb -0.10 -2.12 0.58 0.00 -1.46 0.00 0.00 42.92 39.81 3hoi s ASP 185 CO 0.22 -0.75 1.87 -0.07 0.52 0.00 0.00 175.17 176.96 3hoi h LEU 186 N 8.53 0.53 -0.11 -1.34 3.38 -1.98 0.16 115.31 124.48 3hoi h LEU 186 Ca -0.21 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.65 3hoi h LEU 186 Cb 1.08 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 3hoi h LEU 186 CO 0.93 0.58 0.01 0.58 0.09 0.00 0.00 178.44 180.63 3hoi h VAL 187 N 0.54 1.24 -0.25 1.22 2.07 -1.99 -1.41 116.25 117.68 3hoi h VAL 187 Ca 0.12 -0.77 -0.12 0.00 0.82 0.00 0.00 66.70 66.74 3hoi h VAL 187 Cb 0.31 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.62 3hoi h VAL 187 CO 0.01 0.22 -0.36 0.03 0.02 0.00 0.00 177.57 177.49 3hoi h ARG 188 N -0.07 0.54 -0.37 1.57 2.47 -1.84 -2.83 114.38 113.85 3hoi h ARG 188 Ca 0.03 -0.26 -0.16 0.00 -1.26 0.00 0.00 59.98 58.33 3hoi h ARG 188 Cb 0.34 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.65 3hoi h ARG 188 CO 0.00 0.83 -0.41 1.25 0.56 0.00 0.00 179.97 182.20 3hoi h LEU 189 N 0.46 0.98 -0.77 3.04 6.46 -0.57 -0.37 115.31 124.55 3hoi h LEU 189 Ca 0.05 -0.46 -0.13 0.00 -0.12 0.00 0.00 57.88 57.22 3hoi h LEU 189 Cb 0.84 -0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 40.48 3hoi h LEU 189 CO 0.07 1.26 -0.60 0.11 -0.62 0.00 0.00 178.44 178.66 3hoi h LYS 190 N 0.74 0.00 -0.05 1.25 1.57 -1.25 -0.57 116.57 118.26 3hoi h LYS 190 Ca 0.05 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 3hoi h LYS 190 Cb 1.00 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.31 3hoi h LYS 190 CO 0.10 0.60 -0.00 0.00 -0.57 0.00 0.00 179.45 179.57 3hoi h ALA 191 N 1.40 0.07 -0.62 3.86 0.00 -1.34 -1.98 119.26 120.65 3hoi h ALA 191 Ca -0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 3hoi h ALA 191 Cb 1.08 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 3hoi h ALA 191 CO 0.08 -0.25 0.32 0.00 0.00 0.00 0.00 179.25 179.40 3hoi h ALA 192 N 0.70 1.38 -0.02 0.00 0.00 -0.73 -2.80 119.26 117.78 3hoi h ALA 192 Ca 0.01 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3hoi h ALA 192 Cb 0.36 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3hoi h ALA 192 CO 0.00 0.49 -0.07 1.28 0.00 0.00 0.00 179.25 180.96 3hoi n LEU 193 N -4.36 2.41 -3.72 0.00 4.32 -0.25 -4.42 117.00 110.97 3hoi n LEU 193 Ca 0.06 -0.81 -0.22 0.00 -0.02 0.00 0.00 56.01 55.02 3hoi n LEU 193 Cb 0.12 -0.01 0.03 0.00 -1.62 0.00 0.00 43.42 41.94 3hoi n LEU 193 CO 0.38 0.41 -0.03 0.29 -1.22 0.00 0.00 177.39 177.21 3hoi n LYS 194 N 0.79 -5.10 -2.78 3.23 5.02 -0.97 -4.92 118.16 113.44 3hoi n LYS 194 Ca 0.15 0.63 -0.39 0.00 -2.02 0.00 0.00 58.31 56.67 3hoi n LYS 194 Cb 0.51 -5.25 -0.06 0.00 -0.02 0.00 0.00 35.03 30.21 3hoi n LYS 194 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3hoi s LEU 195 N -6.76 4.54 0.71 -0.35 1.43 -0.78 -5.05 118.68 112.41 3hoi s LEU 195 Ca 0.10 1.88 -0.11 0.00 -1.03 0.00 0.00 54.13 54.97 3hoi s LEU 195 Cb -0.05 -3.72 0.01 0.00 0.03 0.00 0.00 46.19 42.46 3hoi s LEU 195 CO 0.81 0.08 1.07 -0.54 0.23 0.00 0.00 176.35 178.00 3hoi s LYS 196 N -1.49 2.86 0.57 1.70 1.02 -1.26 -4.95 119.74 118.19 3hoi s LYS 196 Ca 0.44 0.80 0.28 0.00 0.02 0.00 0.00 55.97 57.50 3hoi s LYS 196 Cb -0.23 -1.99 1.70 0.00 -0.52 0.00 0.00 37.83 36.78 3hoi s LYS 196 CO 0.29 -1.11 2.21 -0.44 -0.92 0.00 0.00 175.35 175.38 3hoi h ASP 197 N -0.72 0.00 -0.01 2.83 5.19 -2.01 -1.22 116.42 120.48 3hoi h ASP 197 Ca -0.45 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 3hoi h ASP 197 Cb 1.22 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.73 3hoi h ASP 197 CO 0.59 0.03 0.00 0.35 -3.12 0.00 0.00 179.24 177.09 3hoi n THR 198 N -3.88 0.00 -2.89 0.35 -2.24 -1.26 -5.07 114.28 99.29 3hoi n THR 198 Ca -0.03 -0.17 -0.13 0.00 -2.27 0.00 0.00 64.05 61.45 3hoi n THR 198 Cb 0.11 0.18 0.05 0.00 -2.10 0.00 0.00 70.33 68.57 3hoi n THR 198 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hoi n GLN 199 N -0.20 0.61 -4.57 -0.78 6.02 -0.46 -1.20 117.38 116.80 3hoi n GLN 199 Ca 0.20 -1.89 -0.28 0.00 -0.01 0.00 0.00 57.00 55.03 3hoi n GLN 199 Cb 0.28 -0.21 -0.07 0.00 1.02 0.00 0.00 30.24 31.25 3hoi n GLN 199 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.06 173.91 3hoi s PRO 201 N -3.75 2.05 -0.17 -1.09 0.02 -1.26 -4.77 135.00 126.03 3hoi s PRO 201 Ca 0.39 -2.28 -0.34 0.00 0.02 0.00 0.00 61.00 58.79 3hoi s PRO 201 Cb -0.03 -0.73 0.13 0.00 0.02 0.00 0.00 34.50 33.90 3hoi s PRO 201 CO 0.25 -0.52 1.16 0.54 -0.33 0.00 0.00 177.00 178.10 3hoi s ASN 204 N -3.68 -0.17 -0.26 2.53 2.20 0.48 -4.92 114.94 111.11 3hoi s ASN 204 Ca 0.18 0.01 -0.02 0.00 -0.94 0.00 0.00 52.86 52.09 3hoi s ASN 204 Cb 0.01 0.18 0.08 0.00 -2.00 0.00 0.00 41.25 39.52 3hoi s ASN 204 CO 0.12 -0.28 0.08 -1.00 -2.94 0.00 0.00 177.10 173.08 3hoi s HIS 205 N -2.43 1.13 0.30 1.54 3.76 0.48 -0.74 115.29 119.33 3hoi s HIS 205 Ca 0.08 -1.20 -0.29 0.00 -0.15 0.00 0.00 55.06 53.50 3hoi s HIS 205 Cb -0.01 -1.26 -0.10 0.00 1.11 0.00 0.00 32.58 32.31 3hoi s HIS 205 CO -0.05 -0.76 1.41 -2.14 -0.85 0.00 0.00 174.74 172.34 3hoi s PRO 206 N 1.82 4.26 0.01 8.40 0.02 -1.26 -0.67 135.00 147.58 3hoi s PRO 206 Ca 0.05 2.33 0.02 0.00 0.02 0.00 0.00 61.00 63.42 3hoi s PRO 206 Cb -0.17 -3.07 -0.01 0.00 0.02 0.00 0.00 34.50 31.28 3hoi s PRO 206 CO -0.21 -0.37 -0.06 0.08 -0.33 0.00 0.00 177.00 176.11 3hoi s VAL 207 N -0.61 0.45 0.30 3.83 1.01 -0.33 -3.53 120.40 121.52 3hoi s VAL 207 Ca 0.55 -0.41 -0.20 0.00 0.00 0.00 0.00 61.98 61.92 3hoi s VAL 207 Cb -0.42 -0.41 0.05 0.00 0.00 0.00 0.00 36.38 35.59 3hoi s VAL 207 CO 0.50 0.01 0.81 -0.83 0.00 0.00 0.00 175.10 175.60 3hoi s GLY 208 N -0.44 0.09 0.68 4.51 0.00 -0.80 -3.28 107.32 108.09 3hoi s GLY 208 Ca -0.00 -0.43 -0.14 0.00 0.00 0.00 0.00 44.72 44.14 3hoi s GLY 208 CO -0.00 0.10 1.10 -0.19 0.00 0.00 0.00 173.10 174.11 3hoi s TYR 209 N -3.02 2.63 0.32 1.90 2.02 -1.26 0.19 117.35 120.13 3hoi s TYR 209 Ca 0.14 1.55 -0.29 0.00 -0.37 0.00 0.00 57.07 58.10 3hoi s TYR 209 Cb -0.05 -3.13 -0.11 0.00 -0.40 0.00 0.00 41.96 38.28 3hoi s TYR 209 CO 0.08 -1.68 1.43 -0.06 -1.57 0.00 0.00 175.55 173.75 3hoi s PHE 210 N -2.49 2.87 -1.57 2.71 0.08 -1.26 -0.67 117.98 117.65 3hoi s PHE 210 Ca 0.65 1.15 0.00 0.00 0.12 0.00 0.00 56.93 58.86 3hoi s PHE 210 Cb -0.19 -3.87 0.00 0.00 -0.57 0.00 0.00 43.02 38.39 3hoi s PHE 210 CO 0.45 -2.64 0.39 0.36 -0.10 0.00 0.00 175.22 173.69