#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p1d s THR 8 N 0.00 2.84 0.26 6.31 -4.23 -1.26 -4.90 115.64 114.65 2p1d s THR 8 Ca 0.00 0.44 -0.02 0.00 -1.18 0.00 0.00 61.69 60.93 2p1d s THR 8 Cb 0.00 -3.03 0.23 0.00 1.34 0.00 0.00 72.50 71.04 2p1d s THR 8 CO 0.00 -0.19 1.77 0.25 -0.54 0.00 0.00 174.62 175.90 2p1d h LEU 9 N 0.29 0.52 -2.07 4.79 6.46 -2.00 -0.96 115.31 122.34 2p1d h LEU 9 Ca -0.48 0.09 0.02 0.00 -0.12 0.00 0.00 57.88 57.38 2p1d h LEU 9 Cb 1.27 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.20 2p1d h LEU 9 CO 0.53 0.23 0.05 1.23 -0.62 0.00 0.00 178.44 179.87 2p1d h GLY 10 N 0.63 0.00 1.24 3.75 0.00 -1.91 -1.80 103.07 104.97 2p1d h GLY 10 Ca 0.45 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.55 2p1d h GLY 10 CO -0.35 0.00 -0.82 0.83 0.00 0.00 0.00 176.54 176.20 2p1d h GLU 11 N 0.00 0.73 -0.90 4.80 5.08 -1.54 -1.33 114.58 121.43 2p1d h GLU 11 Ca 0.03 -0.63 0.12 0.00 -1.00 0.00 0.00 59.36 57.88 2p1d h GLU 11 Cb 0.13 0.14 -0.07 0.00 0.50 0.00 0.00 28.75 29.45 2p1d h GLU 11 CO -0.00 1.23 0.58 -0.22 -1.00 0.00 0.00 179.01 179.60 2p1d h LYS 12 N 0.49 0.78 0.24 2.33 3.11 -1.17 -1.81 116.57 120.54 2p1d h LYS 12 Ca -0.06 -0.05 -0.01 0.00 -2.81 0.00 0.00 60.65 57.72 2p1d h LYS 12 Cb 1.45 -0.18 0.00 0.00 -1.00 0.00 0.00 32.23 32.50 2p1d h LYS 12 CO 0.16 0.51 -0.12 2.35 -2.81 0.00 0.00 179.45 179.55 2p1d h TRP 13 N 0.80 -0.30 -1.03 1.91 7.01 -1.28 -2.96 115.95 120.10 2p1d h TRP 13 Ca 0.43 -0.01 0.26 0.00 2.11 0.00 0.00 58.89 61.69 2p1d h TRP 13 Cb 0.56 0.10 -0.11 0.00 -2.10 0.00 0.00 29.16 27.61 2p1d h TRP 13 CO -0.00 0.08 0.64 -0.22 -2.79 0.00 0.00 178.44 176.14 2p1d h LYS 14 N -0.85 0.47 0.00 2.65 1.63 -0.75 0.54 116.57 120.26 2p1d h LYS 14 Ca -0.03 -0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 59.74 2p1d h LYS 14 Cb 0.51 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.04 2p1d h LYS 14 CO 0.05 0.31 -0.00 0.77 -3.45 0.00 0.00 179.45 177.13 2p1d h SER 15 N 0.48 -0.00 -0.78 4.20 0.02 -1.41 -1.04 113.55 115.03 2p1d h SER 15 Ca 0.62 -0.48 0.02 0.00 -0.84 0.00 0.00 61.79 61.12 2p1d h SER 15 Cb 1.39 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.88 2p1d h SER 15 CO -0.39 0.48 0.50 0.03 -1.14 0.00 0.00 176.83 176.32 2p1d h ARG 16 N -0.48 0.97 -0.18 3.45 3.08 -0.90 0.35 114.38 120.66 2p1d h ARG 16 Ca -0.00 -0.06 0.05 0.00 0.07 0.00 0.00 59.98 60.04 2p1d h ARG 16 Cb 0.48 -0.22 -0.07 0.00 0.08 0.00 0.00 29.97 30.24 2p1d h ARG 16 CO 0.00 0.64 -0.39 1.25 -1.07 0.00 0.00 179.97 180.40 2p1d h LEU 17 N 1.00 -1.23 -1.72 3.04 5.85 0.11 -0.90 115.31 121.46 2p1d h LEU 17 Ca 0.30 0.17 -0.01 0.00 0.84 0.00 0.00 57.88 59.18 2p1d h LEU 17 Cb -0.04 0.52 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 2p1d h LEU 17 CO -0.09 -0.40 0.02 0.78 -0.34 0.00 0.00 178.44 178.41 2p1d h ASN 18 N -0.43 0.17 0.00 1.25 2.35 0.08 -1.90 115.58 117.09 2p1d h ASN 18 Ca 0.09 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2p1d h ASN 18 Cb 0.60 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.92 2p1d h ASN 18 CO -0.42 0.19 0.00 0.00 -1.65 0.00 0.00 177.43 175.56 2p1d n ALA 19 N -2.51 2.26 -2.42 -0.83 0.00 0.11 -4.82 120.51 112.30 2p1d n ALA 19 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.10 2p1d n ALA 19 Cb 0.14 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.54 2p1d n ALA 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2p1d s LEU 20 N -0.58 4.21 0.63 0.00 1.02 -0.72 -5.04 118.68 118.20 2p1d s LEU 20 Ca 0.00 0.93 -0.04 0.00 0.02 0.00 0.00 54.13 55.05 2p1d s LEU 20 Cb 0.00 -3.57 0.04 0.00 0.02 0.00 0.00 46.19 42.68 2p1d s LEU 20 CO 0.00 -0.03 0.90 -0.83 0.02 0.00 0.00 176.35 176.42 2p1d s GLY 21 N -2.22 1.71 0.10 -3.19 0.00 -1.26 -4.78 107.32 97.68 2p1d s GLY 21 Ca 0.45 -1.03 -0.25 0.00 0.00 0.00 0.00 44.72 43.89 2p1d s GLY 21 CO 0.21 -0.69 1.41 0.07 0.00 0.00 0.00 173.10 174.09 2p1d h LYS 22 N -0.28 -0.27 -0.21 2.90 -0.00 -2.00 0.17 116.57 116.88 2p1d h LYS 22 Ca -0.44 0.02 -0.02 0.00 -0.00 0.00 0.00 60.65 60.21 2p1d h LYS 22 Cb 1.30 0.06 -0.01 0.00 -0.00 0.00 0.00 32.23 33.58 2p1d h LYS 22 CO 0.58 -0.18 0.04 1.03 -0.00 0.00 0.00 179.45 180.91 2p1d h SER 23 N -0.28 0.33 0.08 7.07 0.87 -2.00 -3.08 113.55 116.53 2p1d h SER 23 Ca 0.06 -0.25 0.01 0.00 -1.23 0.00 0.00 61.79 60.37 2p1d h SER 23 Cb 0.44 -0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 62.28 2p1d h SER 23 CO -0.46 0.50 -0.29 -0.33 -0.53 0.00 0.00 176.83 175.72 2p1d h GLU 24 N 0.15 -0.40 -0.67 2.24 5.08 -1.87 -2.31 114.58 116.80 2p1d h GLU 24 Ca 0.06 0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.55 2p1d h GLU 24 Cb 0.30 0.09 -0.12 0.00 0.50 0.00 0.00 28.75 29.53 2p1d h GLU 24 CO 0.00 -0.27 -0.42 0.35 -1.00 0.00 0.00 179.01 177.67 2p1d h PHE 25 N -0.42 -1.24 -0.99 4.33 3.57 -0.76 0.86 116.94 122.30 2p1d h PHE 25 Ca -0.01 0.09 0.17 0.00 3.53 0.00 0.00 57.97 61.75 2p1d h PHE 25 Cb 0.42 0.64 -0.10 0.00 2.79 0.00 0.00 35.95 39.69 2p1d h PHE 25 CO -0.37 -0.41 0.60 1.96 -2.23 0.00 0.00 178.31 177.86 2p1d h GLN 26 N -0.17 0.79 -0.09 1.11 1.08 -1.43 0.48 115.11 116.89 2p1d h GLN 26 Ca 0.21 -0.05 -0.03 0.00 -1.45 0.00 0.00 58.65 57.34 2p1d h GLN 26 Cb 0.56 -0.18 -0.00 0.00 -0.05 0.00 0.00 27.48 27.81 2p1d h GLN 26 CO -0.75 0.52 -0.05 0.82 -0.95 0.00 0.00 178.83 178.43 2p1d h ILE 27 N 0.82 1.33 -0.70 2.54 2.04 -0.35 -3.19 117.51 119.99 2p1d h ILE 27 Ca 0.54 -1.09 -0.00 0.00 1.00 0.00 0.00 64.86 65.32 2p1d h ILE 27 Cb 0.76 1.87 -0.03 0.00 -0.74 0.00 0.00 36.82 38.67 2p1d h ILE 27 CO -0.35 0.30 0.43 0.22 0.00 0.00 0.00 178.15 178.76 2p1d h TYR 28 N -0.19 0.92 -1.35 1.37 5.03 -0.11 -2.46 116.97 120.18 2p1d h TYR 28 Ca 0.02 0.00 0.39 0.00 2.58 0.00 0.00 58.73 61.72 2p1d h TYR 28 Cb 0.51 -0.30 -0.05 0.00 1.55 0.00 0.00 36.73 38.43 2p1d h TYR 28 CO 0.07 0.61 1.09 -0.22 -1.32 0.00 0.00 178.16 178.39 2p1d h LYS 29 N 0.95 0.00 0.00 1.82 3.64 -0.05 -1.61 116.57 121.32 2p1d h LYS 29 Ca 0.25 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 2p1d h LYS 29 Cb -0.05 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 2p1d h LYS 29 CO -0.05 0.00 -0.15 1.63 -2.27 0.00 0.00 179.45 178.61 2p1d n LYS 30 N -3.86 1.01 -1.66 1.90 5.02 -1.00 -1.79 118.16 117.78 2p1d n LYS 30 Ca 0.30 -1.52 -0.43 0.00 -2.02 0.00 0.00 58.31 54.65 2p1d n LYS 30 Cb 1.51 -0.92 -0.03 0.00 -0.02 0.00 0.00 35.03 35.57 2p1d n LYS 30 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2p1d n SER 31 N -0.56 4.03 -3.95 4.39 7.64 -0.61 -3.31 113.62 121.25 2p1d n SER 31 Ca 0.05 0.84 -0.30 0.00 1.01 0.00 0.00 58.87 60.47 2p1d n SER 31 Cb 0.55 -1.52 -0.01 0.00 -1.01 0.00 0.00 64.21 62.23 2p1d n SER 31 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2p1d n GLY 32 N 4.67 -0.47 3.77 0.23 0.00 -0.73 -4.88 105.19 107.77 2p1d n GLY 32 Ca 0.21 0.25 -0.32 0.00 0.00 0.00 0.00 46.02 46.16 2p1d n GLY 32 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2p1d s ILE 33 N -3.84 1.27 -0.06 -0.61 -4.36 -1.21 -4.94 121.20 107.45 2p1d s ILE 33 Ca 0.18 -1.94 -0.04 0.00 -0.26 0.00 0.00 60.65 58.59 2p1d s ILE 33 Cb -0.08 -2.21 -0.04 0.00 1.25 0.00 0.00 42.46 41.39 2p1d s ILE 33 CO 0.91 0.00 0.16 -1.10 0.24 0.00 0.00 174.94 175.14 2p1d s GLN 34 N -3.92 3.41 0.14 0.37 -0.21 -1.04 -1.41 119.66 116.99 2p1d s GLN 34 Ca 0.11 -0.25 0.05 0.00 0.02 0.00 0.00 55.36 55.29 2p1d s GLN 34 Cb 0.02 -3.12 -0.04 0.00 1.00 0.00 0.00 33.01 30.87 2p1d s GLN 34 CO 0.06 0.72 -0.12 -1.21 -2.12 0.00 0.00 175.29 172.62 2p1d s GLU 35 N -1.52 1.06 -0.15 2.91 0.41 0.00 -4.43 118.70 116.98 2p1d s GLU 35 Ca 0.22 -1.36 -0.06 0.00 -0.41 0.00 0.00 54.97 53.36 2p1d s GLU 35 Cb -0.12 -0.78 -0.04 0.00 -1.78 0.00 0.00 34.13 31.41 2p1d s GLU 35 CO 0.12 0.13 0.04 0.08 -0.49 0.00 0.00 175.26 175.13 2p1d s VAL 36 N -2.75 4.60 -0.85 2.63 1.01 -1.26 -1.16 120.40 122.61 2p1d s VAL 36 Ca 0.13 -0.11 -0.25 0.00 0.00 0.00 0.00 61.98 61.75 2p1d s VAL 36 Cb -0.01 -3.03 0.03 0.00 0.00 0.00 0.00 36.38 33.37 2p1d s VAL 36 CO 0.02 0.51 1.45 -0.62 0.00 0.00 0.00 175.10 176.46 2p1d s ASP 37 N -0.01 6.15 0.00 3.32 2.15 -0.42 -4.82 116.67 123.04 2p1d s ASP 37 Ca 0.05 -0.80 0.21 0.00 0.43 0.00 0.00 52.55 52.44 2p1d s ASP 37 Cb -0.12 -2.56 0.18 0.00 -0.30 0.00 0.00 42.92 40.11 2p1d s ASP 37 CO 0.01 -1.82 1.17 0.54 -0.17 0.00 0.00 175.17 174.91 2p1d n ARG 38 N 9.13 1.93 0.00 4.34 1.74 -1.26 -4.07 116.66 128.47 2p1d n ARG 38 Ca 0.19 -1.77 0.00 0.00 -0.77 0.00 0.00 57.85 55.50 2p1d n ARG 38 Cb 0.50 -1.40 0.00 0.00 -1.02 0.00 0.00 32.46 30.53 2p1d n ARG 38 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 2p1d n THR 39 N 1.19 0.00 -0.14 0.55 -1.04 -1.26 -0.78 114.28 112.80 2p1d n THR 39 Ca 0.13 1.36 0.10 0.00 -2.04 0.00 0.00 64.05 63.59 2p1d n THR 39 Cb 0.53 -2.01 0.44 0.00 -1.82 0.00 0.00 70.33 67.46 2p1d n THR 39 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2p1d h LEU 40 N 0.00 0.50 -0.76 -4.42 3.38 -1.99 -1.71 115.31 110.31 2p1d h LEU 40 Ca 0.00 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 2p1d h LEU 40 Cb 0.00 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 2p1d h LEU 40 CO 0.00 0.30 0.17 0.00 0.09 0.00 0.00 178.44 179.01 2p1d h ALA 41 N 1.65 0.98 -0.24 1.53 0.00 -1.77 0.89 119.26 122.30 2p1d h ALA 41 Ca 0.31 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 2p1d h ALA 41 Cb 0.47 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2p1d h ALA 41 CO -0.10 0.66 -0.35 0.87 0.00 0.00 0.00 179.25 180.33 2p1d h LYS 42 N 1.05 0.53 -0.23 0.00 1.57 -0.10 -2.38 116.57 117.01 2p1d h LYS 42 Ca 0.22 -0.24 -0.17 0.00 -1.87 0.00 0.00 60.65 58.58 2p1d h LYS 42 Cb 0.36 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 2p1d h LYS 42 CO 0.00 0.81 -0.55 0.93 -0.57 0.00 0.00 179.45 180.07 2p1d h GLU 43 N 0.45 0.69 -0.27 3.15 4.39 -0.88 -0.58 114.58 121.52 2p1d h GLU 43 Ca 0.05 -0.44 -0.06 0.00 0.34 0.00 0.00 59.36 59.25 2p1d h GLU 43 Cb 0.82 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.51 2p1d h GLU 43 CO 0.07 1.06 -0.09 0.78 -1.16 0.00 0.00 179.01 179.66 2p1d h GLY 44 N 0.91 0.47 0.22 -3.84 0.00 -0.71 -1.97 103.07 98.15 2p1d h GLY 44 Ca 0.01 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.04 2p1d h GLY 44 CO 0.11 0.28 -0.00 -2.22 0.00 0.00 0.00 176.54 174.71 2p1d h ILE 45 N 0.41 1.58 0.00 2.60 2.04 -1.25 -0.55 117.51 122.34 2p1d h ILE 45 Ca 0.08 -1.81 0.00 0.00 1.00 0.00 0.00 64.86 64.13 2p1d h ILE 45 Cb 0.41 2.80 0.00 0.00 -0.74 0.00 0.00 36.82 39.29 2p1d h ILE 45 CO 0.02 0.46 0.04 1.17 0.00 0.00 0.00 178.15 179.84 2p1d n LYS 46 N -4.72 0.06 0.02 2.37 4.81 -0.24 0.90 118.16 121.35 2p1d n LYS 46 Ca -0.09 0.55 0.11 0.00 -0.87 0.00 0.00 58.31 58.01 2p1d n LYS 46 Cb 0.38 -1.74 0.10 0.00 0.02 0.00 0.00 35.03 33.78 2p1d n LYS 46 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 2p1d n ARG 47 N -1.84 0.14 0.00 1.64 0.63 -0.75 -4.96 116.66 111.53 2p1d n ARG 47 Ca -0.01 0.01 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2p1d n ARG 47 Cb 0.05 -1.56 0.00 0.00 0.45 0.00 0.00 32.46 31.41 2p1d n ARG 47 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2p1d n GLY 48 N 1.43 0.62 3.77 5.14 0.00 0.26 -5.07 105.19 111.33 2p1d n GLY 48 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 2p1d n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2p1d s GLU 49 N -0.76 4.24 0.00 1.61 2.02 -0.24 -4.94 118.70 120.63 2p1d s GLU 49 Ca 0.00 2.14 0.00 0.00 0.02 0.00 0.00 54.97 57.13 2p1d s GLU 49 Cb 0.00 -2.95 0.00 0.00 0.10 0.00 0.00 34.13 31.28 2p1d s GLU 49 CO 0.00 -0.26 0.53 0.25 0.02 0.00 0.00 175.26 175.80 2p1d n THR 50 N 0.56 0.15 -4.16 3.63 -2.24 -1.26 -4.54 114.28 106.42 2p1d n THR 50 Ca 0.01 -0.53 -0.32 0.00 -2.27 0.00 0.00 64.05 60.95 2p1d n THR 50 Cb 0.43 1.01 -0.08 0.00 -2.10 0.00 0.00 70.33 69.59 2p1d n THR 50 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2p1d s ASP 51 N -0.15 5.38 0.00 3.42 1.01 -1.26 -0.81 116.67 124.25 2p1d s ASP 51 Ca 0.00 0.02 0.00 0.00 0.71 0.00 0.00 52.55 53.28 2p1d s ASP 51 Cb 0.00 -1.45 0.00 0.00 1.01 0.00 0.00 42.92 42.48 2p1d s ASP 51 CO 0.00 0.24 0.00 1.41 0.21 0.00 0.00 175.17 177.03 2p1d n HIS 52 N 1.05 0.00 -1.30 4.23 8.25 0.28 -4.94 115.22 122.79 2p1d n HIS 52 Ca -0.12 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 56.99 2p1d n HIS 52 Cb 0.52 0.00 0.10 0.00 1.12 0.00 0.00 29.99 31.73 2p1d n HIS 52 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2p1d n HIS 53 N 0.00 0.83 -4.03 4.41 8.25 -1.26 -0.46 115.22 122.95 2p1d n HIS 53 Ca 0.00 0.39 -0.34 0.00 -0.26 0.00 0.00 57.72 57.51 2p1d n HIS 53 Cb 0.00 -2.09 -0.10 0.00 1.12 0.00 0.00 29.99 28.92 2p1d n HIS 53 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2p1d s ALA 54 N -1.89 3.37 0.64 -1.41 0.00 -1.26 -4.69 121.76 116.52 2p1d s ALA 54 Ca 0.73 -0.76 0.41 0.00 0.00 0.00 0.00 51.96 52.34 2p1d s ALA 54 Cb -0.33 -1.89 2.26 0.00 0.00 0.00 0.00 23.12 23.16 2p1d s ALA 54 CO 0.50 0.17 2.34 -0.39 0.00 0.00 0.00 175.76 178.39 2p1d h VAL 55 N 4.90 0.15 -2.37 0.00 -1.51 -1.92 -3.45 116.25 112.04 2p1d h VAL 55 Ca -0.36 -0.01 -0.04 0.00 -1.23 0.00 0.00 66.70 65.05 2p1d h VAL 55 Cb 1.17 1.01 -0.01 0.00 -2.13 0.00 0.00 31.29 31.33 2p1d h VAL 55 CO 0.70 0.00 0.01 -1.54 -1.23 0.00 0.00 177.57 175.51 2p1d n SER 56 N -3.29 -0.42 -0.71 4.19 3.41 -1.26 -4.94 113.62 110.60 2p1d n SER 56 Ca -0.03 -1.42 0.12 0.00 -0.26 0.00 0.00 58.87 57.28 2p1d n SER 56 Cb 0.08 0.74 0.34 0.00 -0.26 0.00 0.00 64.21 65.11 2p1d n SER 56 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2p1d n ARG 57 N -0.13 1.95 0.17 4.33 1.85 -1.26 -4.00 116.66 119.58 2p1d n ARG 57 Ca -0.01 -1.42 0.04 0.00 -1.00 0.00 0.00 57.85 55.46 2p1d n ARG 57 Cb 0.14 -1.44 0.29 0.00 -1.05 0.00 0.00 32.46 30.39 2p1d n ARG 57 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 177.63 178.40 2p1d h GLY 58 N 4.85 0.00 0.68 2.89 0.00 -1.95 -2.57 103.07 106.97 2p1d h GLY 58 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 2p1d h GLY 58 CO 0.00 0.00 -0.37 1.76 0.00 0.00 0.00 176.54 177.93 2p1d h SER 59 N 0.00 -0.99 -0.60 0.19 0.02 -1.69 0.16 113.55 110.64 2p1d h SER 59 Ca -0.00 0.08 0.08 0.00 -0.84 0.00 0.00 61.79 61.10 2p1d h SER 59 Cb 0.96 0.32 -0.07 0.00 0.14 0.00 0.00 62.40 63.75 2p1d h SER 59 CO 0.06 -0.54 0.25 0.00 -1.14 0.00 0.00 176.83 175.46 2p1d h ALA 60 N -0.42 0.78 -0.65 3.77 0.00 -1.81 -0.01 119.26 120.93 2p1d h ALA 60 Ca -0.04 0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.97 2p1d h ALA 60 Cb 0.71 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 2p1d h ALA 60 CO -0.02 -0.15 0.39 -0.22 0.00 0.00 0.00 179.25 179.25 2p1d h LYS 61 N 0.46 0.73 -0.07 0.00 3.64 -1.01 -2.03 116.57 118.29 2p1d h LYS 61 Ca 0.29 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.62 2p1d h LYS 61 Cb 0.32 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.97 2p1d h LYS 61 CO -0.27 0.48 0.00 1.25 -2.27 0.00 0.00 179.45 178.65 2p1d h LEU 62 N 0.75 0.12 -1.00 5.20 6.46 -0.11 -3.05 115.31 123.68 2p1d h LEU 62 Ca 0.27 -0.30 0.32 0.00 -0.12 0.00 0.00 57.88 58.06 2p1d h LEU 62 Cb 0.07 -0.03 -0.15 0.00 -0.73 0.00 0.00 40.66 39.82 2p1d h LEU 62 CO -0.13 0.39 0.57 -0.09 -0.62 0.00 0.00 178.44 178.56 2p1d h ARG 63 N -0.15 0.31 -0.34 1.25 2.43 -0.47 0.17 114.38 117.58 2p1d h ARG 63 Ca 0.02 -0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.20 2p1d h ARG 63 Cb 0.32 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.77 2p1d h ARG 63 CO 0.00 0.21 0.16 2.35 -1.51 0.00 0.00 179.97 181.18 2p1d h TRP 64 N 0.32 0.29 -0.30 2.20 7.01 -1.27 0.11 115.95 124.33 2p1d h TRP 64 Ca 0.74 0.01 -0.15 0.00 2.11 0.00 0.00 58.89 61.60 2p1d h TRP 64 Cb 1.68 -0.08 -0.00 0.00 -2.10 0.00 0.00 29.16 28.65 2p1d h TRP 64 CO -0.01 0.15 -0.41 0.74 -2.79 0.00 0.00 178.44 176.12 2p1d h PHE 65 N 0.33 0.99 -0.47 2.65 -1.00 -0.81 -3.31 116.94 115.33 2p1d h PHE 65 Ca 0.15 -0.33 -0.06 0.00 2.81 0.00 0.00 57.97 60.54 2p1d h PHE 65 Cb 0.07 -0.20 -0.02 0.00 3.61 0.00 0.00 35.95 39.41 2p1d h PHE 65 CO -0.11 1.12 0.07 0.28 -1.61 0.00 0.00 178.31 178.06 2p1d h VAL 66 N 0.57 1.25 0.00 -0.55 2.07 -0.97 -1.96 116.25 116.66 2p1d h VAL 66 Ca 0.03 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.62 2p1d h VAL 66 Cb 1.01 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 31.73 2p1d h VAL 66 CO 0.10 0.33 0.00 -1.84 0.02 0.00 0.00 177.57 176.17 2p1d n GLU 67 N -4.44 0.95 -0.31 1.57 0.28 0.00 -2.07 120.64 116.63 2p1d n GLU 67 Ca 0.01 0.00 0.04 0.00 -0.16 0.00 0.00 57.16 57.05 2p1d n GLU 67 Cb 0.26 -1.16 0.06 0.00 1.43 0.00 0.00 31.44 32.03 2p1d n GLU 67 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2p1d n ARG 68 N -0.32 0.57 -2.10 3.44 1.74 -1.09 -4.99 116.66 113.91 2p1d n ARG 68 Ca 0.00 -1.71 -0.03 0.00 -0.77 0.00 0.00 57.85 55.34 2p1d n ARG 68 Cb 0.08 -0.95 -0.00 0.00 -1.02 0.00 0.00 32.46 30.57 2p1d n ARG 68 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2p1d n ASN 69 N -0.64 -1.52 0.24 0.55 3.02 -0.88 -4.72 115.26 111.30 2p1d n ASN 69 Ca 0.07 0.33 0.14 0.00 -0.03 0.00 0.00 54.58 55.09 2p1d n ASN 69 Cb 0.67 -1.50 0.35 0.00 -0.61 0.00 0.00 39.78 38.70 2p1d n ASN 69 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2p1d h LEU 70 N 0.00 0.00 -7.17 3.41 3.38 -1.59 -3.42 115.31 109.92 2p1d h LEU 70 Ca -0.07 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.80 2p1d h LEU 70 Cb 0.83 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 41.31 2p1d h LEU 70 CO 0.09 0.00 -0.31 -0.69 0.09 0.00 0.00 178.44 177.63 2p1d s VAL 71 N -3.36 -0.28 -0.63 1.22 1.01 -1.22 -1.64 120.40 115.50 2p1d s VAL 71 Ca 0.05 0.12 0.05 0.00 0.00 0.00 0.00 61.98 62.19 2p1d s VAL 71 Cb 0.07 -0.66 0.16 0.00 0.00 0.00 0.00 36.38 35.94 2p1d s VAL 71 CO 0.62 0.05 0.40 -0.89 0.00 0.00 0.00 175.10 175.28 2p1d s THR 72 N 1.90 2.68 0.04 3.92 2.01 -1.26 -4.11 115.64 120.82 2p1d s THR 72 Ca -0.06 -3.87 -0.31 0.00 0.31 0.00 0.00 61.69 57.75 2p1d s THR 72 Cb -0.10 -2.80 -0.10 0.00 0.01 0.00 0.00 72.50 69.51 2p1d s THR 72 CO -0.13 -0.94 1.92 -0.81 -0.69 0.00 0.00 174.62 173.97 2p1d n PRO 73 N 2.42 2.71 -3.85 4.92 -0.04 -1.26 -4.90 135.00 134.99 2p1d n PRO 73 Ca 0.15 0.99 -0.11 0.00 -0.04 0.00 0.00 63.50 64.49 2p1d n PRO 73 Cb 0.34 -2.91 -0.09 0.00 -0.04 0.00 0.00 33.50 30.80 2p1d n PRO 73 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2p1d s GLU 74 N 3.92 0.61 7.21 0.54 1.03 -1.26 -4.31 118.70 126.43 2p1d s GLU 74 Ca 0.88 -0.51 0.00 0.00 0.03 0.00 0.00 54.97 55.37 2p1d s GLU 74 Cb -0.50 0.25 0.00 0.00 -0.80 0.00 0.00 34.13 33.08 2p1d s GLU 74 CO 0.43 -0.16 0.00 0.41 -1.33 0.00 0.00 175.26 174.61 2p1d n GLY 75 N 1.04 2.29 3.60 -3.83 0.00 0.25 -4.04 105.19 104.50 2p1d n GLY 75 Ca -0.21 -0.34 -0.43 0.00 0.00 0.00 0.00 46.02 45.05 2p1d n GLY 75 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2p1d s LYS 76 N 0.00 3.81 -0.17 1.61 2.47 -1.26 -1.40 119.74 124.81 2p1d s LYS 76 Ca 0.00 0.56 -0.04 0.00 -1.56 0.00 0.00 55.97 54.93 2p1d s LYS 76 Cb 0.00 -3.82 -0.03 0.00 -1.46 0.00 0.00 37.83 32.53 2p1d s LYS 76 CO 0.00 -1.00 -0.03 0.08 0.16 0.00 0.00 175.35 174.56 2p1d s VAL 77 N 3.58 3.86 -0.26 4.02 1.01 0.26 -1.54 120.40 131.34 2p1d s VAL 77 Ca 0.39 -0.36 -0.06 0.00 0.00 0.00 0.00 61.98 61.96 2p1d s VAL 77 Cb -0.11 -2.71 -0.00 0.00 0.00 0.00 0.00 36.38 33.55 2p1d s VAL 77 CO 0.20 0.47 0.03 -0.69 0.00 0.00 0.00 175.10 175.11 2p1d s VAL 78 N 0.63 3.80 -0.61 2.92 1.01 -0.99 0.41 120.40 127.56 2p1d s VAL 78 Ca -0.02 -0.53 -0.10 0.00 0.00 0.00 0.00 61.98 61.33 2p1d s VAL 78 Cb -0.14 -2.85 0.16 0.00 0.00 0.00 0.00 36.38 33.55 2p1d s VAL 78 CO 0.02 0.25 0.50 -0.62 0.00 0.00 0.00 175.10 175.26 2p1d s ASP 79 N 1.51 5.99 -0.48 3.32 2.15 0.47 -1.44 116.67 128.19 2p1d s ASP 79 Ca 0.04 -2.28 -0.28 0.00 0.43 0.00 0.00 52.55 50.46 2p1d s ASP 79 Cb -0.16 -2.07 0.01 0.00 -0.30 0.00 0.00 42.92 40.41 2p1d s ASP 79 CO 0.01 -0.63 1.37 -0.76 -0.17 0.00 0.00 175.17 174.98 2p1d s LEU 80 N 0.81 3.53 0.00 -1.34 1.02 -0.39 -0.26 118.68 122.04 2p1d s LEU 80 Ca 0.11 0.57 0.00 0.00 0.02 0.00 0.00 54.13 54.83 2p1d s LEU 80 Cb -0.21 -3.37 0.00 0.00 0.02 0.00 0.00 46.19 42.62 2p1d s LEU 80 CO -0.03 -1.50 0.00 0.61 0.02 0.00 0.00 176.35 175.45 2p1d n GLY 81 N 5.11 0.64 0.25 -3.19 0.00 0.38 -2.94 105.19 105.45 2p1d n GLY 81 Ca 0.14 -0.40 0.15 0.00 0.00 0.00 0.00 46.02 45.92 2p1d n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2p1d n GLY 83 N -1.21 3.43 0.24 0.00 0.00 -1.26 -1.35 105.19 105.04 2p1d n GLY 83 Ca -0.02 -0.14 0.14 0.00 0.00 0.00 0.00 46.02 46.00 2p1d n GLY 83 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2p1d h ARG 84 N 0.00 0.00 0.00 1.61 3.08 -1.81 -3.10 114.38 114.16 2p1d h ARG 84 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2p1d h ARG 84 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2p1d h ARG 84 CO 0.00 0.02 0.00 0.41 -1.07 0.00 0.00 179.97 179.33 2p1d n GLY 85 N 0.60 0.25 0.36 0.04 0.00 -0.46 -0.61 105.19 105.37 2p1d n GLY 85 Ca 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.04 2p1d n GLY 85 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2p1d h GLY 86 N 0.00 0.18 1.71 -0.02 0.00 -1.91 0.25 103.07 103.27 2p1d h GLY 86 Ca 0.00 0.44 -0.22 0.00 0.00 0.00 0.00 47.33 47.54 2p1d h GLY 86 CO 0.00 -0.24 -0.98 1.49 0.00 0.00 0.00 176.54 176.80 2p1d h TRP 87 N -0.04 0.39 0.02 5.60 4.06 -1.82 -3.11 115.95 121.05 2p1d h TRP 87 Ca 0.34 -0.24 -0.00 0.00 2.06 0.00 0.00 58.89 61.05 2p1d h TRP 87 Cb 0.60 -0.04 0.00 0.00 -1.00 0.00 0.00 29.16 28.72 2p1d h TRP 87 CO -0.76 1.09 -0.01 0.77 -3.56 0.00 0.00 178.44 175.97 2p1d h SER 88 N 0.12 -0.02 0.19 -3.49 0.02 -1.64 -1.40 113.55 107.34 2p1d h SER 88 Ca -0.07 -0.42 -0.03 0.00 -0.84 0.00 0.00 61.79 60.42 2p1d h SER 88 Cb 1.65 0.01 -0.00 0.00 0.14 0.00 0.00 62.40 64.19 2p1d h SER 88 CO 0.16 0.41 -0.16 1.88 -1.14 0.00 0.00 176.83 177.98 2p1d h TYR 89 N -0.46 0.00 -0.10 3.45 0.99 -0.68 0.55 116.97 120.73 2p1d h TYR 89 Ca -0.00 0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.64 2p1d h TYR 89 Cb 0.44 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.17 2p1d h TYR 89 CO 0.07 0.16 -0.29 -0.92 -0.00 0.00 0.00 178.16 177.18 2p1d h TYR 90 N 0.00 0.48 0.00 4.88 3.20 -1.47 -3.01 116.97 121.06 2p1d h TYR 90 Ca -0.00 -0.19 -0.04 0.00 3.14 0.00 0.00 58.73 61.64 2p1d h TYR 90 Cb 0.30 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 2p1d h TYR 90 CO 0.00 0.90 -0.19 0.00 -1.64 0.00 0.00 178.16 177.23 2p1d n GLY 92 N -0.53 -0.63 0.13 0.00 0.00 0.14 -2.07 105.19 102.23 2p1d n GLY 92 Ca -0.02 -0.02 0.04 0.00 0.00 0.00 0.00 46.02 46.02 2p1d n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2p1d n GLY 93 N -0.82 -0.04 3.73 -0.02 0.00 -0.96 -3.97 105.19 103.10 2p1d n GLY 93 Ca 0.02 -0.24 -0.41 0.00 0.00 0.00 0.00 46.02 45.39 2p1d n GLY 93 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2p1d s LEU 94 N -1.79 4.42 0.00 0.99 1.43 -0.88 -4.98 118.68 117.88 2p1d s LEU 94 Ca 0.06 2.17 0.00 0.00 -1.03 0.00 0.00 54.13 55.33 2p1d s LEU 94 Cb 0.07 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.69 2p1d s LEU 94 CO 0.25 -0.42 0.20 1.17 0.23 0.00 0.00 176.35 177.78 2p1d n LYS 95 N 3.04 0.00 0.00 1.70 4.81 -1.26 -1.69 118.16 124.76 2p1d n LYS 95 Ca 0.06 0.20 0.01 0.00 -0.87 0.00 0.00 58.31 57.71 2p1d n LYS 95 Cb 0.45 -0.54 0.06 0.00 0.02 0.00 0.00 35.03 35.02 2p1d n LYS 95 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2p1d n ASN 96 N -0.50 0.00 -4.74 3.14 3.02 -1.26 -4.69 115.26 110.23 2p1d n ASN 96 Ca 0.00 -0.36 -0.39 0.00 -0.03 0.00 0.00 54.58 53.80 2p1d n ASN 96 Cb 0.00 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.12 2p1d n ASN 96 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2p1d s VAL 97 N -2.00 5.01 -0.23 2.41 1.01 -0.68 -0.58 120.40 125.33 2p1d s VAL 97 Ca 0.03 1.28 -0.08 0.00 0.00 0.00 0.00 61.98 63.21 2p1d s VAL 97 Cb 0.01 -3.96 -0.11 0.00 0.00 0.00 0.00 36.38 32.32 2p1d s VAL 97 CO 0.02 0.33 -0.27 0.54 0.00 0.00 0.00 175.10 175.72 2p1d n ARG 98 N 3.33 0.52 -3.89 2.72 5.12 -0.49 -4.78 116.66 119.19 2p1d n ARG 98 Ca -0.04 0.19 -0.11 0.00 -1.93 0.00 0.00 57.85 55.96 2p1d n ARG 98 Cb 0.51 -1.37 -0.13 0.00 -1.16 0.00 0.00 32.46 30.31 2p1d n ARG 98 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 2p1d s GLU 99 N -2.44 0.13 -0.10 5.56 2.12 -0.71 -4.88 118.70 118.39 2p1d s GLU 99 Ca -0.32 -0.13 -0.01 0.00 0.36 0.00 0.00 54.97 54.87 2p1d s GLU 99 Cb 0.11 0.05 0.03 0.00 0.26 0.00 0.00 34.13 34.58 2p1d s GLU 99 CO 0.45 -0.02 -0.03 0.08 -0.54 0.00 0.00 175.26 175.20 2p1d s VAL 100 N -0.41 0.66 -0.24 3.70 1.01 -0.73 0.93 120.40 125.32 2p1d s VAL 100 Ca -0.05 -0.09 0.01 0.00 0.00 0.00 0.00 61.98 61.85 2p1d s VAL 100 Cb -0.03 -0.78 0.04 0.00 0.00 0.00 0.00 36.38 35.61 2p1d s VAL 100 CO -0.00 0.27 -0.12 -0.75 0.00 0.00 0.00 175.10 174.51 2p1d s LYS 101 N 1.86 2.59 -0.06 2.72 2.20 0.16 -1.05 119.74 128.16 2p1d s LYS 101 Ca 0.05 -1.12 0.00 0.00 -0.36 0.00 0.00 55.97 54.54 2p1d s LYS 101 Cb -0.13 -2.84 -0.03 0.00 -1.51 0.00 0.00 37.83 33.32 2p1d s LYS 101 CO -0.07 -0.44 -0.05 0.20 -0.36 0.00 0.00 175.35 174.64 2p1d s GLY 102 N 1.21 1.74 -0.00 5.54 0.00 0.15 -0.39 107.32 115.58 2p1d s GLY 102 Ca -0.03 -0.88 0.05 0.00 0.00 0.00 0.00 44.72 43.86 2p1d s GLY 102 CO -0.07 -0.67 -0.15 1.08 0.00 0.00 0.00 173.10 173.29 2p1d s LEU 103 N -0.90 2.06 0.15 0.66 1.43 0.64 -2.09 118.68 120.62 2p1d s LEU 103 Ca 0.13 -0.32 -0.13 0.00 -1.03 0.00 0.00 54.13 52.78 2p1d s LEU 103 Cb -0.11 -0.77 0.01 0.00 0.03 0.00 0.00 46.19 45.35 2p1d s LEU 103 CO 0.02 0.16 0.37 0.42 0.23 0.00 0.00 176.35 177.56 2p1d s THR 104 N -0.46 0.07 -0.03 5.49 -4.23 -0.66 0.14 115.64 115.97 2p1d s THR 104 Ca 0.05 -0.96 -0.21 0.00 -1.18 0.00 0.00 61.69 59.40 2p1d s THR 104 Cb -0.06 -1.50 -0.13 0.00 1.34 0.00 0.00 72.50 72.14 2p1d s THR 104 CO -0.00 -0.31 0.90 0.50 -0.54 0.00 0.00 174.62 175.17 2p1d h LYS 105 N 2.43 -0.43 0.00 3.99 3.64 -1.78 -0.76 116.57 123.66 2p1d h LYS 105 Ca -0.32 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.09 2p1d h LYS 105 Cb 1.24 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 33.16 2p1d h LYS 105 CO 0.46 -0.12 0.00 0.41 -2.27 0.00 0.00 179.45 177.93 2p1d n GLY 106 N 0.20 0.75 0.54 5.01 0.00 -1.26 0.14 105.19 110.58 2p1d n GLY 106 Ca -0.08 -0.74 0.07 0.00 0.00 0.00 0.00 46.02 45.27 2p1d n GLY 106 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2p1d n GLY 107 N 0.00 -1.72 3.61 -0.02 0.00 -1.26 -4.34 105.19 101.46 2p1d n GLY 107 Ca 0.00 -1.38 -0.47 0.00 0.00 0.00 0.00 46.02 44.17 2p1d n GLY 107 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2p1d n PRO 108 N -2.51 1.51 -1.05 1.61 -0.04 -1.26 -1.35 135.00 131.90 2p1d n PRO 108 Ca -0.00 0.54 -0.02 0.00 -0.04 0.00 0.00 63.50 63.98 2p1d n PRO 108 Cb 0.25 -2.08 -0.01 0.00 -0.04 0.00 0.00 33.50 31.62 2p1d n PRO 108 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2p1d n GLY 109 N 2.00 0.54 3.22 0.55 0.00 -1.26 -5.02 105.19 105.22 2p1d n GLY 109 Ca 0.13 -0.58 -0.13 0.00 0.00 0.00 0.00 46.02 45.44 2p1d n GLY 109 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2p1d s HIS 110 N -2.01 -0.19 0.16 1.61 3.76 -0.46 -5.08 115.29 113.08 2p1d s HIS 110 Ca 0.00 0.33 -0.31 0.00 -0.15 0.00 0.00 55.06 54.93 2p1d s HIS 110 Cb 0.00 0.09 -0.11 0.00 1.11 0.00 0.00 32.58 33.67 2p1d s HIS 110 CO 0.00 -0.34 1.71 -1.21 -0.85 0.00 0.00 174.74 174.05 2p1d s GLU 111 N -1.06 4.16 -0.09 1.40 0.41 -1.26 -4.28 118.70 117.98 2p1d s GLU 111 Ca -0.11 2.52 -0.01 0.00 -0.41 0.00 0.00 54.97 56.96 2p1d s GLU 111 Cb -0.05 -3.28 -0.03 0.00 -1.78 0.00 0.00 34.13 28.99 2p1d s GLU 111 CO 0.03 -0.74 -0.04 -1.21 -0.49 0.00 0.00 175.26 172.82 2p1d s GLU 112 N 1.73 2.97 0.16 1.61 0.41 -1.26 -4.02 118.70 120.30 2p1d s GLU 112 Ca 0.75 -0.49 -0.34 0.00 -0.41 0.00 0.00 54.97 54.48 2p1d s GLU 112 Cb -0.46 -2.71 -0.15 0.00 -1.78 0.00 0.00 34.13 29.02 2p1d s GLU 112 CO 0.33 0.62 1.37 -0.35 -0.49 0.00 0.00 175.26 176.74 2p1d n PRO 113 N 2.38 1.62 -3.56 0.39 -0.04 -1.17 -4.40 135.00 130.21 2p1d n PRO 113 Ca -0.18 0.58 -0.38 0.00 -0.04 0.00 0.00 63.50 63.48 2p1d n PRO 113 Cb 0.53 -2.22 -0.10 0.00 -0.04 0.00 0.00 33.50 31.67 2p1d n PRO 113 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2p1d s ILE 114 N 0.29 5.29 0.10 0.52 1.01 0.22 -4.99 121.20 123.65 2p1d s ILE 114 Ca 0.76 0.30 -0.31 0.00 0.00 0.00 0.00 60.65 61.40 2p1d s ILE 114 Cb -0.79 -3.57 -0.08 0.00 0.01 0.00 0.00 42.46 38.04 2p1d s ILE 114 CO 0.47 0.27 1.43 -2.16 0.00 0.00 0.00 174.94 174.95 2p1d s PRO 115 N 1.49 4.29 0.19 2.79 0.04 -1.26 -4.88 135.00 137.66 2p1d s PRO 115 Ca 0.10 2.12 0.03 0.00 0.04 0.00 0.00 61.00 63.28 2p1d s PRO 115 Cb -0.15 -3.31 -0.05 0.00 0.04 0.00 0.00 34.50 31.03 2p1d s PRO 115 CO 0.08 -0.50 -0.02 -1.64 0.04 0.00 0.00 177.00 174.96 2p1d s MET 116 N 1.41 1.18 -0.13 4.56 -1.94 -1.26 -4.91 119.30 118.21 2p1d s MET 116 Ca 0.66 -1.57 0.17 0.00 -1.71 0.00 0.00 55.69 53.24 2p1d s MET 116 Cb -0.37 -0.44 0.29 0.00 2.01 0.00 0.00 34.83 36.31 2p1d s MET 116 CO 0.30 -0.09 1.15 -1.13 -0.01 0.00 0.00 175.02 175.24 2p1d n SER 117 N -0.29 2.08 -4.65 3.03 3.41 0.01 -4.87 113.62 112.34 2p1d n SER 117 Ca -0.07 -3.10 -0.34 0.00 -0.26 0.00 0.00 58.87 55.10 2p1d n SER 117 Cb 0.63 -0.42 0.12 0.00 -0.26 0.00 0.00 64.21 64.28 2p1d n SER 117 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2p1d n THR 118 N -1.27 1.71 -1.57 6.66 -2.24 -1.02 -1.63 114.28 114.92 2p1d n THR 118 Ca 0.15 -0.21 -0.56 0.00 -2.27 0.00 0.00 64.05 61.16 2p1d n THR 118 Cb 0.66 -1.09 -0.07 0.00 -2.10 0.00 0.00 70.33 67.72 2p1d n THR 118 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2p1d n TYR 119 N -3.30 1.21 -0.86 4.78 9.36 0.86 -0.46 117.16 128.74 2p1d n TYR 119 Ca 0.13 0.84 0.00 0.00 3.32 0.00 0.00 57.90 62.18 2p1d n TYR 119 Cb 0.51 -2.23 0.00 0.00 -0.63 0.00 0.00 39.34 36.98 2p1d n TYR 119 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2p1d n GLY 120 N 2.32 0.85 0.42 2.98 0.00 -0.62 -3.89 105.19 107.24 2p1d n GLY 120 Ca 0.20 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.45 2p1d n GLY 120 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 2p1d h TRP 121 N 0.00 0.56 0.00 1.61 5.08 -0.93 0.17 115.95 122.44 2p1d h TRP 121 Ca 0.00 0.02 0.00 0.00 1.08 0.00 0.00 58.89 59.99 2p1d h TRP 121 Cb 0.00 -0.16 0.00 0.00 -3.00 0.00 0.00 29.16 26.00 2p1d h TRP 121 CO 0.00 0.08 0.00 0.27 -1.28 0.00 0.00 178.44 177.51 2p1d n ASN 122 N -4.55 0.00 -0.87 0.11 2.04 -1.26 -0.71 115.26 110.02 2p1d n ASN 122 Ca 0.24 0.32 0.09 0.00 -0.44 0.00 0.00 54.58 54.79 2p1d n ASN 122 Cb 0.86 -0.37 0.15 0.00 -2.53 0.00 0.00 39.78 37.89 2p1d n ASN 122 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 2p1d n LEU 123 N -1.37 2.95 -4.37 -4.53 4.77 0.59 -4.94 117.00 110.10 2p1d n LEU 123 Ca 0.02 -1.43 -0.34 0.00 -0.03 0.00 0.00 56.01 54.23 2p1d n LEU 123 Cb 0.06 -0.17 -0.14 0.00 -2.33 0.00 0.00 43.42 40.85 2p1d n LEU 123 CO 0.05 0.63 -0.38 -0.69 -1.33 0.00 0.00 177.39 175.67 2p1d s VAL 124 N -1.29 3.47 -0.23 4.08 1.01 0.12 -1.77 120.40 125.78 2p1d s VAL 124 Ca 0.29 -0.48 -0.04 0.00 0.00 0.00 0.00 61.98 61.75 2p1d s VAL 124 Cb 0.17 -2.55 -0.00 0.00 0.00 0.00 0.00 36.38 34.00 2p1d s VAL 124 CO 0.24 0.46 -0.03 -0.13 0.00 0.00 0.00 175.10 175.64 2p1d s ARG 125 N 1.01 3.31 -0.10 2.72 0.52 -0.21 -5.03 118.95 121.16 2p1d s ARG 125 Ca 0.00 -0.68 0.03 0.00 -0.52 0.00 0.00 55.73 54.57 2p1d s ARG 125 Cb -0.15 -3.05 0.01 0.00 0.52 0.00 0.00 34.95 32.28 2p1d s ARG 125 CO 0.00 -0.24 -0.21 -0.51 0.02 0.00 0.00 175.30 174.36 2p1d s LEU 126 N 1.47 1.98 -0.05 2.53 1.02 -1.26 -0.67 118.68 123.70 2p1d s LEU 126 Ca 0.05 -0.51 -0.02 0.00 0.02 0.00 0.00 54.13 53.67 2p1d s LEU 126 Cb -0.15 -1.29 0.04 0.00 0.02 0.00 0.00 46.19 44.81 2p1d s LEU 126 CO -0.03 0.11 0.10 0.00 0.02 0.00 0.00 176.35 176.56 2p1d s GLN 127 N 0.53 0.04 0.21 1.70 -2.07 -0.89 -5.01 119.66 114.18 2p1d s GLN 127 Ca -0.15 0.31 0.02 0.00 -1.82 0.00 0.00 55.36 53.71 2p1d s GLN 127 Cb -0.17 -0.21 0.04 0.00 -1.09 0.00 0.00 33.01 31.58 2p1d s GLN 127 CO 0.05 -0.17 0.29 -1.13 -1.32 0.00 0.00 175.29 173.01 2p1d n SER 128 N 4.22 0.57 -0.68 12.60 3.41 -1.25 -1.66 113.62 130.84 2p1d n SER 128 Ca -0.27 -1.44 -0.09 0.00 -0.26 0.00 0.00 58.87 56.81 2p1d n SER 128 Cb 0.51 -0.17 -0.04 0.00 -0.26 0.00 0.00 64.21 64.25 2p1d n SER 128 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2p1d n GLY 129 N 2.64 1.02 3.39 5.00 0.00 0.38 -4.83 105.19 112.79 2p1d n GLY 129 Ca 0.05 -0.36 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 2p1d n GLY 129 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2p1d s VAL 130 N -2.19 3.08 -0.44 1.61 1.01 -0.39 -4.95 120.40 118.12 2p1d s VAL 130 Ca 0.00 -0.66 -0.09 0.00 0.00 0.00 0.00 61.98 61.23 2p1d s VAL 130 Cb 0.00 -2.29 0.10 0.00 0.00 0.00 0.00 36.38 34.19 2p1d s VAL 130 CO 0.00 0.53 0.30 -0.62 0.00 0.00 0.00 175.10 175.31 2p1d s ASP 131 N 0.24 5.68 0.54 3.32 -1.08 -1.26 -2.36 116.67 121.74 2p1d s ASP 131 Ca -0.09 -1.69 0.22 0.00 -0.52 0.00 0.00 52.55 50.47 2p1d s ASP 131 Cb -0.15 -2.00 1.41 0.00 -1.46 0.00 0.00 42.92 40.72 2p1d s ASP 131 CO 0.05 -0.61 2.11 -0.37 0.52 0.00 0.00 175.17 176.87 2p1d h VAL 132 N 6.10 0.80 0.00 1.11 -1.51 -1.93 -2.55 116.25 118.26 2p1d h VAL 132 Ca -0.22 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.25 2p1d h VAL 132 Cb 1.08 0.90 0.00 0.00 -2.13 0.00 0.00 31.29 31.14 2p1d h VAL 132 CO 0.81 0.00 0.00 0.49 -1.23 0.00 0.00 177.57 177.64 2p1d n PHE 133 N -4.32 0.17 0.00 5.19 3.01 -1.26 -3.66 117.46 116.58 2p1d n PHE 133 Ca 0.01 0.09 0.00 0.00 1.01 0.00 0.00 57.45 58.56 2p1d n PHE 133 Cb 0.27 -0.64 0.00 0.00 -0.01 0.00 0.00 39.48 39.11 2p1d n PHE 133 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 2p1d n PHE 134 N -1.67 0.00 -0.71 1.38 3.01 -0.97 -5.06 117.46 113.45 2p1d n PHE 134 Ca 0.00 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.15 2p1d n PHE 134 Cb 0.03 0.00 0.16 0.00 -0.01 0.00 0.00 39.48 39.66 2p1d n PHE 134 CO 0.00 0.00 0.00 0.44 1.01 0.00 0.00 176.76 178.21 2p1d n ILE 135 N -1.73 0.00 -2.71 4.37 -5.35 -1.20 -4.94 119.36 107.79 2p1d n ILE 135 Ca 0.00 -0.13 -0.32 0.00 -0.27 0.00 0.00 62.75 62.03 2p1d n ILE 135 Cb 0.37 -0.82 -0.05 0.00 -1.74 0.00 0.00 39.64 37.40 2p1d n ILE 135 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2p1d s PRO 136 N -4.13 4.04 0.31 6.28 0.04 -1.26 -5.01 135.00 135.27 2p1d s PRO 136 Ca 0.62 0.91 -0.29 0.00 0.04 0.00 0.00 61.00 62.28 2p1d s PRO 136 Cb -0.22 -2.22 -0.11 0.00 0.04 0.00 0.00 34.50 31.99 2p1d s PRO 136 CO 0.63 -0.10 1.46 -2.14 0.04 0.00 0.00 177.00 176.90 2p1d s PRO 137 N -3.57 4.20 0.51 0.56 0.02 -1.26 -5.04 135.00 130.43 2p1d s PRO 137 Ca 0.58 2.43 0.08 0.00 0.02 0.00 0.00 61.00 64.11 2p1d s PRO 137 Cb -0.10 -3.04 0.08 0.00 0.02 0.00 0.00 34.50 31.46 2p1d s PRO 137 CO 0.23 -0.46 0.64 0.39 -0.33 0.00 0.00 177.00 177.47 2p1d n GLU 138 N 1.47 0.67 -3.73 5.54 1.02 -1.26 -5.10 120.64 119.25 2p1d n GLU 138 Ca 0.04 -2.84 -0.34 0.00 -0.02 0.00 0.00 57.16 54.01 2p1d n GLU 138 Cb 0.40 -0.10 -0.05 0.00 -0.02 0.00 0.00 31.44 31.67 2p1d n GLU 138 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2p1d s ARG 139 N -4.27 3.60 -0.22 3.49 3.00 -1.26 -4.93 118.95 118.37 2p1d s ARG 139 Ca 0.49 -0.07 -0.27 0.00 0.00 0.00 0.00 55.73 55.87 2p1d s ARG 139 Cb -0.04 -3.02 0.10 0.00 0.00 0.00 0.00 34.95 31.99 2p1d s ARG 139 CO 0.31 0.60 0.88 0.00 0.00 0.00 0.00 175.30 177.08 2p1d h ASP 141 N 3.92 0.49 -4.12 0.00 3.32 -1.53 -3.45 116.42 115.05 2p1d h ASP 141 Ca -0.26 -0.66 -0.51 0.00 0.02 0.00 0.00 57.03 55.62 2p1d h ASP 141 Cb 1.16 -0.16 -0.30 0.00 0.22 0.00 0.00 39.33 40.25 2p1d h ASP 141 CO 0.18 1.55 -0.82 0.42 -1.72 0.00 0.00 179.24 178.85 2p1d s THR 142 N -2.61 1.19 -0.24 0.35 -4.23 -1.07 -0.32 115.64 108.72 2p1d s THR 142 Ca -0.10 -0.62 0.02 0.00 -1.18 0.00 0.00 61.69 59.81 2p1d s THR 142 Cb 0.06 -1.00 0.05 0.00 1.34 0.00 0.00 72.50 72.95 2p1d s THR 142 CO 0.87 0.34 -0.11 -0.22 -0.54 0.00 0.00 174.62 174.95 2p1d s LEU 143 N -0.21 2.97 0.01 4.79 2.96 0.28 -2.35 118.68 127.14 2p1d s LEU 143 Ca 0.03 -1.19 0.01 0.00 -0.22 0.00 0.00 54.13 52.75 2p1d s LEU 143 Cb -0.07 -1.44 -0.04 0.00 0.50 0.00 0.00 46.19 45.14 2p1d s LEU 143 CO 0.00 -0.17 0.04 -0.76 -1.32 0.00 0.00 176.35 174.15 2p1d s LEU 144 N 1.21 3.70 -0.24 -0.68 1.43 -0.52 -2.34 118.68 121.25 2p1d s LEU 144 Ca -0.06 0.05 -0.11 0.00 -1.03 0.00 0.00 54.13 52.99 2p1d s LEU 144 Cb -0.18 -2.18 0.09 0.00 0.03 0.00 0.00 46.19 43.94 2p1d s LEU 144 CO -0.07 0.26 0.55 0.00 0.23 0.00 0.00 176.35 177.32 2p1d n ASP 146 N 4.89 3.61 -4.75 0.00 2.03 -1.15 -0.67 116.55 120.50 2p1d n ASP 146 Ca -0.16 -3.12 -0.36 0.00 0.52 0.00 0.00 54.79 51.67 2p1d n ASP 146 Cb 0.53 -0.41 -0.07 0.00 -0.72 0.00 0.00 41.12 40.45 2p1d n ASP 146 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2p1d s ILE 147 N -4.34 5.31 0.00 5.18 1.01 -1.26 -4.97 121.20 122.13 2p1d s ILE 147 Ca 0.42 0.50 0.00 0.00 0.00 0.00 0.00 60.65 61.56 2p1d s ILE 147 Cb 0.38 -3.60 0.00 0.00 0.01 0.00 0.00 42.46 39.26 2p1d s ILE 147 CO -0.01 0.43 0.00 0.61 0.00 0.00 0.00 174.94 175.98 2p1d n GLY 148 N 3.13 0.54 3.71 6.18 0.00 -1.26 -4.80 105.19 112.68 2p1d n GLY 148 Ca -0.13 0.56 -0.40 0.00 0.00 0.00 0.00 46.02 46.04 2p1d n GLY 148 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2p1d s GLU 149 N 0.00 4.45 0.10 1.61 2.12 -1.26 -4.96 118.70 120.76 2p1d s GLU 149 Ca 0.00 1.00 -0.30 0.00 0.36 0.00 0.00 54.97 56.03 2p1d s GLU 149 Cb 0.00 -3.46 -0.06 0.00 0.26 0.00 0.00 34.13 30.87 2p1d s GLU 149 CO 0.00 0.01 0.99 -1.54 -0.54 0.00 0.00 175.26 174.19 2p1d s SER 150 N 0.87 7.43 -0.04 -1.70 1.04 -1.26 -4.81 113.70 115.23 2p1d s SER 150 Ca 0.41 1.83 0.05 0.00 0.48 0.00 0.00 55.95 58.71 2p1d s SER 150 Cb -0.18 -2.59 -0.01 0.00 0.10 0.00 0.00 66.02 63.34 2p1d s SER 150 CO 0.20 -0.13 -0.18 -0.55 0.98 0.00 0.00 173.24 173.56 2p1d s SER 151 N 0.17 2.23 0.43 7.02 0.15 -1.26 -4.99 113.70 117.44 2p1d s SER 151 Ca 0.48 -0.36 0.23 0.00 0.70 0.00 0.00 55.95 57.01 2p1d s SER 151 Cb -0.24 -0.52 1.27 0.00 -1.71 0.00 0.00 66.02 64.82 2p1d s SER 151 CO 0.30 0.18 1.68 -0.65 1.20 0.00 0.00 173.24 175.95 2p1d h PRO 152 N 6.08 0.00 -4.68 5.44 0.11 -2.01 -3.36 132.00 133.58 2p1d h PRO 152 Ca -0.34 0.00 -0.71 0.00 0.11 0.00 0.00 66.00 65.06 2p1d h PRO 152 Cb 1.17 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.08 2p1d h PRO 152 CO 0.48 0.00 -0.24 1.21 -0.21 0.00 0.00 178.00 179.24 2p1d s ASN 153 N -4.04 6.17 0.43 -2.05 3.84 -1.26 -4.97 114.94 113.07 2p1d s ASN 153 Ca -0.03 -0.91 0.18 0.00 0.21 0.00 0.00 52.86 52.31 2p1d s ASN 153 Cb 0.07 -2.21 1.10 0.00 -0.55 0.00 0.00 41.25 39.66 2p1d s ASN 153 CO 0.21 -0.62 1.90 1.55 -2.79 0.00 0.00 177.10 177.34 2p1d h PRO 154 N 8.76 0.36 -0.01 0.43 0.13 -2.00 -0.49 132.00 139.18 2p1d h PRO 154 Ca -0.27 -0.02 -0.16 0.00 -0.87 0.00 0.00 66.00 64.67 2p1d h PRO 154 Cb 1.11 -0.08 -0.02 0.00 0.13 0.00 0.00 31.00 32.14 2p1d h PRO 154 CO 0.83 0.24 -0.74 1.79 -0.23 0.00 0.00 178.00 179.89 2p1d h THR 155 N 0.37 1.48 0.05 1.56 1.35 -1.93 -2.03 112.91 113.77 2p1d h THR 155 Ca 0.41 -2.40 -0.00 0.00 -0.55 0.00 0.00 66.41 63.86 2p1d h THR 155 Cb 1.03 2.30 0.00 0.00 -1.73 0.00 0.00 68.15 69.75 2p1d h THR 155 CO -0.13 0.69 -0.03 0.58 -0.25 0.00 0.00 175.52 176.39 2p1d h VAL 156 N 0.07 1.07 -0.26 6.82 2.07 -1.47 -2.34 116.25 122.20 2p1d h VAL 156 Ca -0.02 -0.40 0.06 0.00 0.82 0.00 0.00 66.70 67.16 2p1d h VAL 156 Cb 1.30 1.33 -0.05 0.00 -1.52 0.00 0.00 31.29 32.35 2p1d h VAL 156 CO 0.10 0.10 -0.10 -0.33 0.02 0.00 0.00 177.57 177.37 2p1d h GLU 157 N -0.25 -0.05 -0.98 1.57 5.08 -1.34 -0.82 114.58 117.79 2p1d h GLU 157 Ca -0.01 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.50 2p1d h GLU 157 Cb 0.22 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.39 2p1d h GLU 157 CO 0.01 -0.03 0.60 0.00 -1.00 0.00 0.00 179.01 178.59 2p1d h ALA 158 N 1.19 1.52 -0.57 3.43 0.00 -1.26 0.42 119.26 123.99 2p1d h ALA 158 Ca 0.13 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 2p1d h ALA 158 Cb 0.25 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2p1d h ALA 158 CO -0.29 0.10 0.02 0.78 0.00 0.00 0.00 179.25 179.86 2p1d h GLY 159 N 0.88 1.07 1.31 0.00 0.00 -0.77 0.21 103.07 105.77 2p1d h GLY 159 Ca 0.52 -0.77 -0.09 0.00 0.00 0.00 0.00 47.33 46.98 2p1d h GLY 159 CO -0.31 0.71 -0.07 3.21 0.00 0.00 0.00 176.54 180.08 2p1d h ARG 160 N 0.88 0.82 -0.50 4.80 3.08 0.41 -2.05 114.38 121.83 2p1d h ARG 160 Ca 0.17 -0.26 -0.13 0.00 0.07 0.00 0.00 59.98 59.82 2p1d h ARG 160 Cb 0.52 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 2p1d h ARG 160 CO 0.02 0.87 -0.20 1.15 -1.07 0.00 0.00 179.97 180.75 2p1d h THR 161 N 0.75 1.27 -0.70 2.04 2.02 0.12 -2.45 112.91 115.95 2p1d h THR 161 Ca 0.13 -1.37 -0.06 0.00 0.77 0.00 0.00 66.41 65.88 2p1d h THR 161 Cb 0.56 1.09 -0.03 0.00 -1.74 0.00 0.00 68.15 68.03 2p1d h THR 161 CO 0.03 0.48 0.21 -0.07 0.37 0.00 0.00 175.52 176.54 2p1d h LEU 162 N 0.88 1.04 -1.07 2.58 3.38 -0.75 -0.55 115.31 120.81 2p1d h LEU 162 Ca 0.12 -0.21 0.03 0.00 0.09 0.00 0.00 57.88 57.91 2p1d h LEU 162 Cb 0.78 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.21 2p1d h LEU 162 CO 0.07 0.98 0.63 0.03 0.09 0.00 0.00 178.44 180.23 2p1d h ARG 163 N 1.04 1.17 -0.37 1.13 3.08 -1.23 -2.10 114.38 117.11 2p1d h ARG 163 Ca 0.23 -0.07 -0.15 0.00 0.07 0.00 0.00 59.98 60.05 2p1d h ARG 163 Cb 0.32 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 2p1d h ARG 163 CO -0.00 0.78 -0.37 0.28 -1.07 0.00 0.00 179.97 179.58 2p1d h VAL 164 N 1.21 1.28 0.20 2.04 2.07 -0.92 -1.93 116.25 120.19 2p1d h VAL 164 Ca 0.38 -1.54 -0.01 0.00 0.82 0.00 0.00 66.70 66.35 2p1d h VAL 164 Cb -0.00 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 2p1d h VAL 164 CO -0.11 0.51 -0.10 -0.07 0.02 0.00 0.00 177.57 177.82 2p1d h LEU 165 N 0.71 -0.22 -1.21 2.57 3.38 -0.61 -1.40 115.31 118.52 2p1d h LEU 165 Ca 0.06 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.01 2p1d h LEU 165 Cb 0.96 0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.73 2p1d h LEU 165 CO 0.09 -0.12 0.54 0.78 0.09 0.00 0.00 178.44 179.82 2p1d h ASN 166 N -0.31 0.92 0.42 -0.43 2.35 -1.45 0.85 115.58 117.92 2p1d h ASN 166 Ca -0.03 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 2p1d h ASN 166 Cb 0.24 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.35 2p1d h ASN 166 CO 0.04 0.67 -0.52 0.25 -1.65 0.00 0.00 177.43 176.23 2p1d h LEU 167 N 1.09 -1.45 -1.80 1.61 6.46 -0.88 -1.89 115.31 118.46 2p1d h LEU 167 Ca 0.30 0.13 -0.03 0.00 -0.12 0.00 0.00 57.88 58.15 2p1d h LEU 167 Cb -0.12 0.49 -0.00 0.00 -0.73 0.00 0.00 40.66 40.30 2p1d h LEU 167 CO -0.07 -0.65 -0.14 -0.37 -0.62 0.00 0.00 178.44 176.59 2p1d h VAL 168 N -0.96 0.63 -0.49 1.05 -1.51 -0.88 -2.21 116.25 111.89 2p1d h VAL 168 Ca -0.05 -0.63 0.07 0.00 -1.23 0.00 0.00 66.70 64.87 2p1d h VAL 168 Cb 0.85 1.40 -0.03 0.00 -2.13 0.00 0.00 31.29 31.38 2p1d h VAL 168 CO -0.12 0.14 0.33 -0.08 -1.23 0.00 0.00 177.57 176.61 2p1d h GLU 169 N 0.00 0.35 0.00 5.19 4.81 -0.01 0.43 114.58 125.35 2p1d h GLU 169 Ca -0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2p1d h GLU 169 Cb 0.39 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.69 2p1d h GLU 169 CO 0.02 0.23 0.00 0.09 -0.73 0.00 0.00 179.01 178.62 2p1d n ASN 170 N -4.47 0.00 -0.09 1.04 3.02 -0.83 -3.38 115.26 110.55 2p1d n ASN 170 Ca 0.07 0.48 0.07 0.00 -0.03 0.00 0.00 54.58 55.17 2p1d n ASN 170 Cb 0.29 -0.49 -0.06 0.00 -0.61 0.00 0.00 39.78 38.91 2p1d n ASN 170 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 2p1d n TRP 171 N -1.49 0.00 -3.03 3.10 7.02 0.08 -4.83 117.44 118.29 2p1d n TRP 171 Ca 0.07 0.00 -0.43 0.00 -1.02 0.00 0.00 57.50 56.12 2p1d n TRP 171 Cb 0.32 0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 29.15 2p1d n TRP 171 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 2p1d s LEU 172 N -2.47 4.45 0.00 -0.99 1.43 -0.85 -4.75 118.68 115.50 2p1d s LEU 172 Ca 0.07 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.78 2p1d s LEU 172 Cb 0.11 -2.76 0.00 0.00 0.03 0.00 0.00 46.19 43.57 2p1d s LEU 172 CO 0.52 -0.92 0.00 -1.54 0.23 0.00 0.00 176.35 174.64 2p1d n SER 173 N 6.58 0.00 0.20 2.29 3.41 -1.26 -5.01 113.62 119.83 2p1d n SER 173 Ca -0.01 -0.35 -0.12 0.00 -0.26 0.00 0.00 58.87 58.14 2p1d n SER 173 Cb 0.47 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.36 2p1d n SER 173 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2p1d h ASN 174 N 0.00 -0.48 -1.89 4.04 4.21 -1.96 -3.28 115.58 116.22 2p1d h ASN 174 Ca 0.00 -0.09 -0.58 0.00 1.21 0.00 0.00 56.30 56.84 2p1d h ASN 174 Cb 0.00 0.12 -0.42 0.00 -1.12 0.00 0.00 38.32 36.91 2p1d h ASN 174 CO 0.00 -0.06 -0.72 0.59 -1.29 0.00 0.00 177.43 175.96 2p1d n ASN 175 N -5.17 4.37 -4.78 5.81 4.13 -1.26 -5.03 115.26 113.33 2p1d n ASN 175 Ca -0.09 -3.65 -0.38 0.00 1.68 0.00 0.00 54.58 52.14 2p1d n ASN 175 Cb 0.28 -0.52 -0.06 0.00 -1.54 0.00 0.00 39.78 37.94 2p1d n ASN 175 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 2p1d s THR 176 N -4.84 4.97 0.24 3.41 -4.23 -1.24 -4.99 115.64 108.97 2p1d s THR 176 Ca 0.48 1.08 -0.30 0.00 -1.18 0.00 0.00 61.69 61.77 2p1d s THR 176 Cb 0.34 -3.85 -0.09 0.00 1.34 0.00 0.00 72.50 70.24 2p1d s THR 176 CO -0.15 0.45 1.13 -1.10 -0.54 0.00 0.00 174.62 174.41 2p1d s GLN 177 N -0.33 4.59 0.00 3.99 -1.52 0.57 -4.86 119.66 122.10 2p1d s GLN 177 Ca 0.28 1.82 -0.15 0.00 -1.95 0.00 0.00 55.36 55.36 2p1d s GLN 177 Cb -0.17 -3.21 0.02 0.00 -0.22 0.00 0.00 33.01 29.43 2p1d s GLN 177 CO 0.15 0.11 0.33 -0.59 -0.25 0.00 0.00 175.29 175.04 2p1d s PHE 178 N -0.77 -0.19 -0.27 0.91 -0.71 -1.26 0.10 117.98 115.79 2p1d s PHE 178 Ca 0.47 0.22 -0.03 0.00 -1.04 0.00 0.00 56.93 56.56 2p1d s PHE 178 Cb -0.32 0.12 0.11 0.00 -1.21 0.00 0.00 43.02 41.72 2p1d s PHE 178 CO 0.40 -0.44 0.19 0.00 -1.34 0.00 0.00 175.22 174.03 2p1d s VAL 180 N 2.22 1.85 0.16 0.00 1.01 -0.01 -1.49 120.40 124.13 2p1d s VAL 180 Ca 0.08 -0.92 -0.31 0.00 0.00 0.00 0.00 61.98 60.83 2p1d s VAL 180 Cb -0.15 -1.76 -0.11 0.00 0.00 0.00 0.00 36.38 34.36 2p1d s VAL 180 CO -0.32 0.40 1.81 -0.75 0.00 0.00 0.00 175.10 176.24 2p1d s LYS 181 N 1.35 4.13 -0.65 2.72 2.20 0.15 -0.48 119.74 129.16 2p1d s LYS 181 Ca 0.03 2.62 0.01 0.00 -0.36 0.00 0.00 55.97 58.27 2p1d s LYS 181 Cb -0.14 -3.41 0.16 0.00 -1.51 0.00 0.00 37.83 32.93 2p1d s LYS 181 CO -0.11 -0.82 0.45 0.08 -0.36 0.00 0.00 175.35 174.59 2p1d s VAL 182 N 2.21 3.27 0.16 4.02 1.01 0.54 -4.78 120.40 126.84 2p1d s VAL 182 Ca 0.79 -3.52 -0.31 0.00 0.00 0.00 0.00 61.98 58.94 2p1d s VAL 182 Cb -0.48 -3.15 -0.06 0.00 0.00 0.00 0.00 36.38 32.69 2p1d s VAL 182 CO 0.35 -0.91 1.54 0.25 0.00 0.00 0.00 175.10 176.33 2p1d h LEU 183 N 6.33 -2.13 -7.34 3.92 5.85 -1.87 -2.71 115.31 117.35 2p1d h LEU 183 Ca 0.03 0.32 -0.63 0.00 0.84 0.00 0.00 57.88 58.44 2p1d h LEU 183 Cb 0.87 0.94 -0.41 0.00 0.37 0.00 0.00 40.66 42.43 2p1d h LEU 183 CO 0.73 -0.24 -0.68 0.21 -0.34 0.00 0.00 178.44 178.12 2p1d s ASN 184 N -5.47 4.24 0.00 1.25 3.84 -1.26 -3.28 114.94 114.26 2p1d s ASN 184 Ca -0.12 -2.69 0.27 0.00 0.21 0.00 0.00 52.86 50.53 2p1d s ASN 184 Cb 0.11 -1.46 0.84 0.00 -0.55 0.00 0.00 41.25 40.19 2p1d s ASN 184 CO 0.62 -0.28 1.62 -0.81 -2.79 0.00 0.00 177.10 175.46 2p1d n PRO 185 N 3.52 1.32 0.04 0.43 -0.04 -1.25 -4.25 135.00 134.77 2p1d n PRO 185 Ca 0.05 -0.81 0.03 0.00 -0.04 0.00 0.00 63.50 62.73 2p1d n PRO 185 Cb 0.35 -1.48 -0.07 0.00 -0.04 0.00 0.00 33.50 32.25 2p1d n PRO 185 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2p1d n TYR 186 N -0.13 0.90 -1.72 0.54 4.11 -1.26 -4.18 117.16 115.41 2p1d n TYR 186 Ca 0.15 0.29 -0.42 0.00 -0.00 0.00 0.00 57.90 57.92 2p1d n TYR 186 Cb 0.37 -1.03 -0.03 0.00 -0.00 0.00 0.00 39.34 38.65 2p1d n TYR 186 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.86 175.22 2p1d s MET 187 N -3.03 4.14 0.05 -3.48 -1.94 -1.26 -4.81 119.30 108.96 2p1d s MET 187 Ca -0.03 2.57 -0.03 0.00 -1.71 0.00 0.00 55.69 56.50 2p1d s MET 187 Cb 0.09 -3.81 0.06 0.00 2.01 0.00 0.00 34.83 33.18 2p1d s MET 187 CO 0.81 -0.88 0.30 -1.13 -0.01 0.00 0.00 175.02 174.12 2p1d n SER 188 N 6.38 -0.10 0.10 3.03 3.41 -1.26 -0.39 113.62 124.79 2p1d n SER 188 Ca 0.18 0.33 -0.03 0.00 -0.26 0.00 0.00 58.87 59.10 2p1d n SER 188 Cb 0.39 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 2p1d n SER 188 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2p1d h SER 189 N 0.00 0.00 0.42 4.04 4.64 -1.96 -1.96 113.55 118.73 2p1d h SER 189 Ca 0.08 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.19 2p1d h SER 189 Cb 0.12 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.21 2p1d h SER 189 CO -0.19 0.76 -0.90 0.58 -0.87 0.00 0.00 176.83 176.22 2p1d h VAL 190 N 0.00 1.43 -0.59 0.95 2.07 -1.02 -2.80 116.25 116.29 2p1d h VAL 190 Ca -0.01 -2.48 0.04 0.00 0.82 0.00 0.00 66.70 65.08 2p1d h VAL 190 Cb 1.49 2.40 -0.05 0.00 -1.52 0.00 0.00 31.29 33.62 2p1d h VAL 190 CO 0.10 0.73 0.33 0.40 0.02 0.00 0.00 177.57 179.16 2p1d h ILE 191 N 0.19 1.00 0.93 4.57 2.04 -0.92 0.45 117.51 125.76 2p1d h ILE 191 Ca -0.06 -0.22 -0.05 0.00 1.00 0.00 0.00 64.86 65.53 2p1d h ILE 191 Cb 1.52 0.30 0.01 0.00 -0.74 0.00 0.00 36.82 37.91 2p1d h ILE 191 CO 0.15 0.12 -0.45 -0.08 0.00 0.00 0.00 178.15 177.89 2p1d h GLU 192 N 0.64 -1.20 -0.62 2.37 4.81 -1.38 -1.95 114.58 117.25 2p1d h GLU 192 Ca 0.25 0.08 0.13 0.00 -0.13 0.00 0.00 59.36 59.69 2p1d h GLU 192 Cb 0.11 0.27 -0.10 0.00 0.63 0.00 0.00 28.75 29.67 2p1d h GLU 192 CO -0.15 -0.80 0.06 -0.22 -0.73 0.00 0.00 179.01 177.18 2p1d h LYS 193 N -1.27 0.17 -0.77 1.92 1.63 -1.31 -0.92 116.57 116.02 2p1d h LYS 193 Ca -0.13 -0.01 0.08 0.00 -0.85 0.00 0.00 60.65 59.74 2p1d h LYS 193 Cb 0.96 -0.04 -0.07 0.00 -0.60 0.00 0.00 32.23 32.48 2p1d h LYS 193 CO 0.21 0.11 0.43 0.52 -3.45 0.00 0.00 179.45 177.28 2p1d h MET 194 N 0.18 0.73 -0.73 1.90 2.86 -0.78 -0.07 114.93 119.03 2p1d h MET 194 Ca 0.33 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.93 2p1d h MET 194 Cb 0.53 -0.17 -0.04 0.00 0.06 0.00 0.00 31.60 31.99 2p1d h MET 194 CO -0.49 0.48 0.47 0.93 1.06 0.00 0.00 176.91 179.37 2p1d h GLU 195 N 0.75 0.96 0.33 1.72 5.08 -0.37 0.18 114.58 123.24 2p1d h GLU 195 Ca 0.36 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.64 2p1d h GLU 195 Cb 0.29 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2p1d h GLU 195 CO -0.22 0.65 -0.16 0.00 -1.00 0.00 0.00 179.01 178.28 2p1d h ALA 196 N 1.53 -0.44 -1.01 3.43 0.00 -0.97 -2.67 119.26 119.12 2p1d h ALA 196 Ca 0.27 -0.19 0.25 0.00 0.00 0.00 0.00 54.91 55.24 2p1d h ALA 196 Cb -0.10 0.17 -0.12 0.00 0.00 0.00 0.00 17.79 17.74 2p1d h ALA 196 CO -0.06 -0.54 0.60 -0.07 0.00 0.00 0.00 179.25 179.19 2p1d h LEU 197 N -0.86 0.64 -0.19 0.00 3.38 -0.56 0.20 115.31 117.91 2p1d h LEU 197 Ca -0.05 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 2p1d h LEU 197 Cb 0.53 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 2p1d h LEU 197 CO 0.07 0.09 0.08 -0.61 0.09 0.00 0.00 178.44 178.16 2p1d h GLN 198 N 0.54 0.29 -0.84 1.13 4.15 -0.61 0.13 115.11 119.91 2p1d h GLN 198 Ca 0.65 -0.05 0.09 0.00 0.77 0.00 0.00 58.65 60.10 2p1d h GLN 198 Cb 1.29 -0.05 -0.07 0.00 0.21 0.00 0.00 27.48 28.86 2p1d h GLN 198 CO -0.47 0.36 0.49 0.00 -1.93 0.00 0.00 178.83 177.28 2p1d h ARG 199 N 0.16 0.81 -0.07 1.69 3.08 -0.30 1.53 114.38 121.28 2p1d h ARG 199 Ca 0.06 -0.05 -0.18 0.00 0.07 0.00 0.00 59.98 59.89 2p1d h ARG 199 Cb 0.18 -0.18 0.01 0.00 0.08 0.00 0.00 29.97 30.05 2p1d h ARG 199 CO -0.01 0.54 -0.65 0.87 -1.07 0.00 0.00 179.97 179.65 2p1d h LYS 200 N 0.83 0.56 -0.47 0.04 1.57 -0.94 -3.40 116.57 114.76 2p1d h LYS 200 Ca 0.40 -0.51 -0.26 0.00 -1.87 0.00 0.00 60.65 58.41 2p1d h LYS 200 Cb 0.34 0.12 -0.40 0.00 0.08 0.00 0.00 32.23 32.37 2p1d h LYS 200 CO -0.24 1.14 -1.11 0.72 -0.57 0.00 0.00 179.45 179.39 2p1d n HIS 201 N -4.13 1.32 -2.10 -1.35 8.25 0.43 -5.11 115.22 112.53 2p1d n HIS 201 Ca -0.09 -2.18 0.00 0.00 -0.26 0.00 0.00 57.72 55.19 2p1d n HIS 201 Cb 0.68 -0.24 0.00 0.00 1.12 0.00 0.00 29.99 31.55 2p1d n HIS 201 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2p1d n GLY 202 N -0.58 1.35 1.20 -1.41 0.00 0.52 -4.84 105.19 101.43 2p1d n GLY 202 Ca 0.09 -0.48 0.16 0.00 0.00 0.00 0.00 46.02 45.78 2p1d n GLY 202 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2p1d n GLY 203 N 0.00 -1.89 3.62 -0.02 0.00 -1.15 -4.47 105.19 101.27 2p1d n GLY 203 Ca 0.00 -1.21 -0.11 0.00 0.00 0.00 0.00 46.02 44.69 2p1d n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2p1d s ALA 204 N -2.16 0.01 0.02 4.61 0.00 0.69 -4.65 121.76 120.29 2p1d s ALA 204 Ca 0.00 -1.09 -0.18 0.00 0.00 0.00 0.00 51.96 50.69 2p1d s ALA 204 Cb 0.00 0.99 -0.06 0.00 0.00 0.00 0.00 23.12 24.05 2p1d s ALA 204 CO 0.00 -0.87 0.52 -0.51 0.00 0.00 0.00 175.76 174.90 2p1d s LEU 205 N -3.12 4.47 -0.02 0.00 1.43 -1.26 -1.89 118.68 118.29 2p1d s LEU 205 Ca 0.24 1.12 0.01 0.00 -1.03 0.00 0.00 54.13 54.47 2p1d s LEU 205 Cb -0.02 -2.79 0.01 0.00 0.03 0.00 0.00 46.19 43.42 2p1d s LEU 205 CO 0.14 0.24 -0.02 -0.69 0.23 0.00 0.00 176.35 176.25 2p1d s VAL 206 N -0.80 0.30 -0.11 -1.59 1.01 -0.31 -4.94 120.40 113.97 2p1d s VAL 206 Ca 0.28 -0.06 -0.21 0.00 0.00 0.00 0.00 61.98 61.99 2p1d s VAL 206 Cb -0.18 -0.33 -0.04 0.00 0.00 0.00 0.00 36.38 35.83 2p1d s VAL 206 CO 0.16 0.14 0.59 -0.60 0.00 0.00 0.00 175.10 175.39 2p1d s ARG 207 N 0.56 4.36 -0.24 2.72 6.06 -1.26 -1.12 118.95 130.04 2p1d s ARG 207 Ca -0.06 0.65 -0.16 0.00 -2.50 0.00 0.00 55.73 53.66 2p1d s ARG 207 Cb -0.09 -3.46 -0.03 0.00 0.06 0.00 0.00 34.95 31.42 2p1d s ARG 207 CO -0.01 0.06 0.43 1.21 -2.50 0.00 0.00 175.30 174.50 2p1d s ASN 208 N 0.78 6.39 0.55 -2.12 3.04 -1.26 -4.97 114.94 117.34 2p1d s ASN 208 Ca 0.31 0.46 0.30 0.00 0.04 0.00 0.00 52.86 53.97 2p1d s ASN 208 Cb -0.16 -2.24 1.65 0.00 -1.54 0.00 0.00 41.25 38.96 2p1d s ASN 208 CO 0.14 -0.17 1.91 1.55 -3.04 0.00 0.00 177.10 177.49 2p1d h PRO 209 N 7.79 0.00 -0.00 0.43 0.13 -1.96 -1.00 132.00 137.38 2p1d h PRO 209 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2p1d h PRO 209 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2p1d h PRO 209 CO 0.69 0.00 -0.01 1.28 -0.23 0.00 0.00 178.00 179.73 2p1d n LEU 210 N -2.70 0.06 -4.81 1.56 4.77 -1.26 -2.51 117.00 112.11 2p1d n LEU 210 Ca -0.02 0.19 -0.33 0.00 -0.03 0.00 0.00 56.01 55.82 2p1d n LEU 210 Cb 0.21 -0.21 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 2p1d n LEU 210 CO 0.13 0.01 0.68 -0.44 -1.33 0.00 0.00 177.39 176.45 2p1d s SER 211 N -2.44 6.58 0.43 -1.43 0.01 -0.38 -4.85 113.70 111.61 2p1d s SER 211 Ca 0.33 1.77 -0.10 0.00 1.31 0.00 0.00 55.95 59.26 2p1d s SER 211 Cb 0.21 -2.54 -0.06 0.00 0.21 0.00 0.00 66.02 63.83 2p1d s SER 211 CO 0.44 -0.61 0.79 -0.13 0.41 0.00 0.00 173.24 174.14 2p1d s ARG 212 N -3.39 3.76 0.31 12.44 3.00 -1.26 -4.79 118.95 129.01 2p1d s ARG 212 Ca 0.64 0.48 0.25 0.00 0.00 0.00 0.00 55.73 57.09 2p1d s ARG 212 Cb -0.12 -2.36 1.10 0.00 0.00 0.00 0.00 34.95 33.56 2p1d s ARG 212 CO 0.20 -0.09 1.74 -0.91 0.00 0.00 0.00 175.30 176.24 2p1d h ASN 213 N 1.06 0.00 0.74 0.23 2.35 -1.59 -2.43 115.58 115.94 2p1d h ASN 213 Ca -0.47 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.28 2p1d h ASN 213 Cb 1.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.56 2p1d h ASN 213 CO 0.63 0.00 0.00 -1.54 -1.65 0.00 0.00 177.43 174.87 2p1d n SER 214 N -2.34 0.03 -4.16 5.81 3.41 -1.26 -4.67 113.62 110.43 2p1d n SER 214 Ca 0.01 0.50 -0.26 0.00 -0.26 0.00 0.00 58.87 58.86 2p1d n SER 214 Cb 0.19 -0.51 -0.16 0.00 -0.26 0.00 0.00 64.21 63.47 2p1d n SER 214 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2p1d s THR 215 N -3.01 1.50 -0.36 6.66 -1.32 -0.92 -5.01 115.64 113.19 2p1d s THR 215 Ca 0.10 -0.77 0.09 0.00 -1.21 0.00 0.00 61.69 59.90 2p1d s THR 215 Cb 0.14 -1.27 0.68 0.00 -1.51 0.00 0.00 72.50 70.53 2p1d s THR 215 CO 0.39 0.43 1.69 1.57 -2.21 0.00 0.00 174.62 176.48 2p1d n HIS 216 N 2.96 2.19 -1.85 9.09 -0.00 -1.26 -4.74 115.22 121.60 2p1d n HIS 216 Ca -0.17 -1.05 -0.41 0.00 0.46 0.00 0.00 57.72 56.55 2p1d n HIS 216 Cb 0.53 -0.62 -0.01 0.00 -0.12 0.00 0.00 29.99 29.77 2p1d n HIS 216 CO 0.00 0.00 0.00 -1.83 0.46 0.00 0.00 176.34 174.97 2p1d s GLU 217 N -2.70 4.15 0.02 1.57 -1.05 -1.21 -4.53 118.70 114.96 2p1d s GLU 217 Ca 0.49 2.51 0.01 0.00 -0.15 0.00 0.00 54.97 57.83 2p1d s GLU 217 Cb 0.39 -3.00 -0.01 0.00 -0.44 0.00 0.00 34.13 31.07 2p1d s GLU 217 CO 0.12 -0.50 -0.04 -1.64 0.95 0.00 0.00 175.26 174.15 2p1d s MET 218 N -1.60 0.34 -0.15 -4.83 -1.94 -1.02 -4.69 119.30 105.40 2p1d s MET 218 Ca 0.55 -0.43 -0.06 0.00 -1.71 0.00 0.00 55.69 54.04 2p1d s MET 218 Cb -0.46 -0.15 -0.04 0.00 2.01 0.00 0.00 34.83 36.19 2p1d s MET 218 CO 0.57 0.03 0.07 0.71 -0.01 0.00 0.00 175.02 176.39 2p1d s TYR 219 N -0.81 3.30 -0.49 -0.03 1.51 -0.27 -0.34 117.35 120.22 2p1d s TYR 219 Ca -0.07 0.19 -0.26 0.00 -1.01 0.00 0.00 57.07 55.92 2p1d s TYR 219 Cb -0.06 -1.99 0.03 0.00 -0.11 0.00 0.00 41.96 39.83 2p1d s TYR 219 CO -0.00 0.33 0.97 -0.46 -1.11 0.00 0.00 175.55 175.28 2p1d s TRP 220 N -0.15 2.86 -0.04 2.71 -0.00 0.37 -1.16 118.94 123.53 2p1d s TRP 220 Ca 0.07 0.35 0.03 0.00 -0.00 0.00 0.00 56.10 56.55 2p1d s TRP 220 Cb -0.12 -4.09 -0.03 0.00 -0.00 0.00 0.00 33.47 29.23 2p1d s TRP 220 CO 0.01 -1.21 -0.12 0.14 -0.00 0.00 0.00 176.95 175.78 2p1d s VAL 221 N 3.97 3.25 0.00 5.86 -7.23 -0.79 -0.83 120.40 124.62 2p1d s VAL 221 Ca 0.38 -0.71 0.00 0.00 -1.81 0.00 0.00 61.98 59.83 2p1d s VAL 221 Cb -0.10 -2.31 0.00 0.00 0.56 0.00 0.00 36.38 34.53 2p1d s VAL 221 CO 0.26 0.55 0.97 -1.54 -0.31 0.00 0.00 175.10 175.02 2p1d n SER 222 N 2.14 0.00 -2.49 4.85 3.41 -0.63 -2.06 113.62 118.85 2p1d n SER 222 Ca -0.17 0.97 -0.09 0.00 -0.26 0.00 0.00 58.87 59.32 2p1d n SER 222 Cb 0.52 -0.47 -0.06 0.00 -0.26 0.00 0.00 64.21 63.95 2p1d n SER 222 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2p1d n ASN 223 N -2.00 2.79 -3.63 4.04 3.02 -0.65 -2.94 115.26 115.88 2p1d n ASN 223 Ca 0.00 -2.03 -0.12 0.00 -0.03 0.00 0.00 54.58 52.41 2p1d n ASN 223 Cb 0.00 -0.73 -0.07 0.00 -0.61 0.00 0.00 39.78 38.37 2p1d n ASN 223 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2p1d s ALA 224 N 2.50 -1.86 0.41 5.41 0.00 -1.26 -4.50 121.76 122.45 2p1d s ALA 224 Ca 0.31 1.98 0.07 0.00 0.00 0.00 0.00 51.96 54.32 2p1d s ALA 224 Cb 0.13 -1.29 -0.05 0.00 0.00 0.00 0.00 23.12 21.91 2p1d s ALA 224 CO -0.01 -0.30 0.21 0.45 0.00 0.00 0.00 175.76 176.11 2p1d s SER 225 N 0.35 4.55 0.00 0.00 0.15 -1.26 -0.22 113.70 117.27 2p1d s SER 225 Ca 0.01 -1.00 0.00 0.00 0.70 0.00 0.00 55.95 55.66 2p1d s SER 225 Cb -0.05 -0.51 0.00 0.00 -1.71 0.00 0.00 66.02 63.75 2p1d s SER 225 CO -0.02 -0.54 0.00 0.61 1.20 0.00 0.00 173.24 174.48 2p1d n GLY 226 N -1.28 4.09 3.68 9.45 0.00 -1.26 -4.79 105.19 115.07 2p1d n GLY 226 Ca -0.00 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 2p1d n GLY 226 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2p1d s ASN 227 N 0.00 6.42 0.15 1.61 2.47 -1.26 -4.68 114.94 119.65 2p1d s ASN 227 Ca 0.00 2.74 -0.21 0.00 0.42 0.00 0.00 52.86 55.81 2p1d s ASN 227 Cb 0.00 -2.55 0.03 0.00 -1.45 0.00 0.00 41.25 37.28 2p1d s ASN 227 CO 0.00 -1.03 1.65 0.40 -3.72 0.00 0.00 177.10 174.40 2p1d h ILE 228 N 5.10 0.50 -0.73 -5.21 2.04 -1.97 0.18 117.51 117.43 2p1d h ILE 228 Ca -0.48 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.38 2p1d h ILE 228 Cb 1.23 0.50 -0.04 0.00 -0.74 0.00 0.00 36.82 37.77 2p1d h ILE 228 CO 0.95 0.00 0.46 0.58 0.00 0.00 0.00 178.15 180.14 2p1d h VAL 229 N -0.17 1.20 -0.47 1.67 2.07 -1.93 -1.15 116.25 117.47 2p1d h VAL 229 Ca 0.14 -0.39 -0.05 0.00 0.82 0.00 0.00 66.70 67.22 2p1d h VAL 229 Cb 0.38 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 2p1d h VAL 229 CO -0.35 0.20 0.10 -1.28 0.02 0.00 0.00 177.57 176.26 2p1d h SER 230 N 0.99 0.71 0.69 0.57 0.87 -1.84 -2.66 113.55 112.89 2p1d h SER 230 Ca 0.26 -0.24 -0.07 0.00 -1.23 0.00 0.00 61.79 60.52 2p1d h SER 230 Cb -0.08 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.68 2p1d h SER 230 CO -0.05 0.77 -0.32 0.77 -0.53 0.00 0.00 176.83 177.47 2p1d h SER 231 N 0.63 0.00 0.83 6.23 4.64 -0.32 -2.87 113.55 122.70 2p1d h SER 231 Ca 0.15 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.23 2p1d h SER 231 Cb 0.34 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.41 2p1d h SER 231 CO 0.00 0.32 -1.15 0.58 -0.87 0.00 0.00 176.83 175.71 2p1d h VAL 232 N 0.00 1.56 0.00 0.95 2.07 -1.12 -3.33 116.25 116.39 2p1d h VAL 232 Ca -0.00 -3.24 -0.15 0.00 0.82 0.00 0.00 66.70 64.12 2p1d h VAL 232 Cb 0.75 2.83 -0.02 0.00 -1.52 0.00 0.00 31.29 33.33 2p1d h VAL 232 CO 0.04 0.91 -0.73 0.78 0.02 0.00 0.00 177.57 178.59 2p1d h ASN 233 N 0.02 0.00 0.33 0.57 2.35 -1.36 -2.56 115.58 114.92 2p1d h ASN 233 Ca -0.08 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.62 2p1d h ASN 233 Cb 1.85 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 40.22 2p1d h ASN 233 CO 0.15 0.73 -0.26 0.24 -1.65 0.00 0.00 177.43 176.65 2p1d h MET 234 N 0.00 0.00 0.22 0.81 2.86 -1.61 -1.77 114.93 115.43 2p1d h MET 234 Ca -0.01 0.00 -0.32 0.00 -2.06 0.00 0.00 59.70 57.31 2p1d h MET 234 Cb 1.32 0.00 0.03 0.00 0.06 0.00 0.00 31.60 33.01 2p1d h MET 234 CO 0.10 0.26 -1.42 0.82 1.06 0.00 0.00 176.91 177.72 2p1d h ILE 235 N 0.00 1.34 -0.31 -1.22 1.08 -1.65 -2.57 117.51 114.18 2p1d h ILE 235 Ca -0.00 -2.81 0.02 0.00 -0.39 0.00 0.00 64.86 61.68 2p1d h ILE 235 Cb 0.49 3.01 -0.03 0.00 -3.07 0.00 0.00 36.82 37.23 2p1d h ILE 235 CO 0.03 0.84 0.15 0.28 -0.69 0.00 0.00 178.15 178.75 2p1d h SER 236 N 0.13 0.21 -0.50 1.72 0.02 -1.14 -0.27 113.55 113.71 2p1d h SER 236 Ca -0.22 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 60.70 2p1d h SER 236 Cb 2.12 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 64.61 2p1d h SER 236 CO 0.26 0.16 0.16 0.03 -1.14 0.00 0.00 176.83 176.30 2p1d h ARG 237 N 0.31 0.77 0.07 3.45 3.08 -1.43 -2.08 114.38 118.55 2p1d h ARG 237 Ca 0.13 -0.16 0.01 0.00 0.07 0.00 0.00 59.98 60.03 2p1d h ARG 237 Cb 0.05 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 2p1d h ARG 237 CO -0.10 0.72 -0.12 1.98 -1.07 0.00 0.00 179.97 181.38 2p1d h MET 238 N 0.68 -0.23 -0.91 0.04 4.05 -1.03 1.00 114.93 118.52 2p1d h MET 238 Ca 0.16 0.02 0.07 0.00 -0.28 0.00 0.00 59.70 59.66 2p1d h MET 238 Cb 0.26 0.05 -0.06 0.00 -0.80 0.00 0.00 31.60 31.06 2p1d h MET 238 CO -0.01 -0.16 0.59 -0.07 0.23 0.00 0.00 176.91 177.50 2p1d h LEU 239 N -0.24 0.91 -0.47 3.39 3.38 -0.97 -0.67 115.31 120.65 2p1d h LEU 239 Ca 0.02 0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.84 2p1d h LEU 239 Cb 0.26 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2p1d h LEU 239 CO -0.07 0.58 -0.47 0.40 0.09 0.00 0.00 178.44 178.97 2p1d h ILE 240 N 1.03 1.29 -0.59 1.22 2.04 -0.92 -2.92 117.51 118.66 2p1d h ILE 240 Ca 0.39 -1.67 -0.01 0.00 1.00 0.00 0.00 64.86 64.57 2p1d h ILE 240 Cb 0.21 1.58 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 2p1d h ILE 240 CO -0.15 0.54 0.32 0.78 0.00 0.00 0.00 178.15 179.64 2p1d h ASN 241 N 0.59 0.75 0.20 1.72 2.35 0.14 -2.12 115.58 119.20 2p1d h ASN 241 Ca 0.03 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 2p1d h ASN 241 Cb 1.04 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 39.22 2p1d h ASN 241 CO 0.10 0.63 0.00 0.54 -1.65 0.00 0.00 177.43 177.05 2p1d n ARG 242 N -4.57 0.06 -0.07 0.81 1.74 -0.35 -2.25 116.66 112.02 2p1d n ARG 242 Ca 0.04 0.29 -0.04 0.00 -0.77 0.00 0.00 57.85 57.37 2p1d n ARG 242 Cb 0.09 -1.50 0.18 0.00 -1.02 0.00 0.00 32.46 30.21 2p1d n ARG 242 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 2p1d h PHE 243 N 0.00 0.75 -3.42 -1.55 0.04 -1.25 -3.36 116.94 108.16 2p1d h PHE 243 Ca 0.00 -0.12 -0.71 0.00 2.80 0.00 0.00 57.97 59.94 2p1d h PHE 243 Cb 0.10 -0.20 -0.32 0.00 2.20 0.00 0.00 35.95 37.72 2p1d h PHE 243 CO 0.00 0.75 -0.45 0.95 -0.60 0.00 0.00 178.31 178.96 2p1d s THR 244 N -4.84 3.76 0.12 -1.55 -4.23 -0.96 -5.04 115.64 102.90 2p1d s THR 244 Ca -0.09 -2.05 0.09 0.00 -1.18 0.00 0.00 61.69 58.47 2p1d s THR 244 Cb 0.14 -3.51 -0.04 0.00 1.34 0.00 0.00 72.50 70.43 2p1d s THR 244 CO 0.80 -0.75 -0.22 -0.04 -0.54 0.00 0.00 174.62 173.87 2p1d s MET 245 N 1.09 1.24 -0.10 3.99 -1.94 -1.26 -5.00 119.30 117.32 2p1d s MET 245 Ca 0.08 -1.26 0.01 0.00 -1.71 0.00 0.00 55.69 52.81 2p1d s MET 245 Cb -0.24 -1.55 0.02 0.00 2.01 0.00 0.00 34.83 35.08 2p1d s MET 245 CO -0.03 0.36 -0.11 1.03 -0.01 0.00 0.00 175.02 176.26 2p1d s ARG 246 N -2.09 1.73 0.00 2.03 0.52 -1.26 -4.73 118.95 115.16 2p1d s ARG 246 Ca 0.10 -0.37 0.00 0.00 -0.52 0.00 0.00 55.73 54.94 2p1d s ARG 246 Cb -0.09 -1.59 0.00 0.00 0.52 0.00 0.00 34.95 33.79 2p1d s ARG 246 CO 0.05 -0.13 0.00 0.72 0.02 0.00 0.00 175.30 175.97 2p1d n HIS 247 N 4.40 0.00 -1.70 -0.53 8.25 -1.26 -4.99 115.22 119.40 2p1d n HIS 247 Ca -0.18 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 56.87 2p1d n HIS 247 Cb 0.51 -1.95 -0.01 0.00 1.12 0.00 0.00 29.99 29.66 2p1d n HIS 247 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2p1d n LYS 248 N -1.05 3.41 -4.46 -0.41 5.02 -1.26 -4.47 118.16 114.94 2p1d n LYS 248 Ca 0.00 -2.68 -0.29 0.00 -2.02 0.00 0.00 58.31 53.32 2p1d n LYS 248 Cb 0.45 -3.01 -0.13 0.00 -0.02 0.00 0.00 35.03 32.31 2p1d n LYS 248 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2p1d s LYS 249 N 2.05 1.49 0.14 1.97 -0.14 -1.26 -4.48 119.74 119.52 2p1d s LYS 249 Ca 0.54 -1.30 -0.06 0.00 -1.36 0.00 0.00 55.97 53.79 2p1d s LYS 249 Cb 0.15 -1.93 -0.06 0.00 -1.68 0.00 0.00 37.83 34.31 2p1d s LYS 249 CO -0.07 0.46 0.40 0.00 -0.76 0.00 0.00 175.35 175.39 2p1d s ALA 250 N -1.03 3.75 -0.18 5.17 0.00 -1.25 -1.78 121.76 126.44 2p1d s ALA 250 Ca 0.14 -0.49 -0.06 0.00 0.00 0.00 0.00 51.96 51.55 2p1d s ALA 250 Cb -0.10 -2.19 -0.03 0.00 0.00 0.00 0.00 23.12 20.79 2p1d s ALA 250 CO 0.06 0.63 0.03 0.95 0.00 0.00 0.00 175.76 177.42 2p1d s THR 251 N -1.64 4.42 0.49 0.00 -4.23 -0.50 -4.93 115.64 109.25 2p1d s THR 251 Ca 0.41 -0.16 0.04 0.00 -1.18 0.00 0.00 61.69 60.79 2p1d s THR 251 Cb -0.12 -2.98 0.02 0.00 1.34 0.00 0.00 72.50 70.76 2p1d s THR 251 CO 0.23 0.47 0.69 -0.31 -0.54 0.00 0.00 174.62 175.15 2p1d s TYR 252 N 0.44 2.89 -0.03 3.99 1.51 -1.26 -0.82 117.35 124.07 2p1d s TYR 252 Ca 0.01 -0.12 -0.17 0.00 -1.01 0.00 0.00 57.07 55.77 2p1d s TYR 252 Cb -0.13 -2.56 0.03 0.00 -0.11 0.00 0.00 41.96 39.19 2p1d s TYR 252 CO 0.01 -0.64 0.38 -1.83 -1.11 0.00 0.00 175.55 172.36 2p1d s GLU 253 N -4.58 0.71 0.71 -0.62 -1.05 -0.31 -4.85 118.70 108.71 2p1d s GLU 253 Ca 0.55 -0.04 -0.16 0.00 -0.15 0.00 0.00 54.97 55.17 2p1d s GLU 253 Cb -0.10 0.32 -0.03 0.00 -0.44 0.00 0.00 34.13 33.88 2p1d s GLU 253 CO 0.36 -0.19 0.63 -2.30 0.95 0.00 0.00 175.26 174.71 2p1d n PRO 254 N 1.39 0.36 -2.13 -4.83 -0.02 -1.26 -1.30 135.00 127.20 2p1d n PRO 254 Ca -0.20 0.16 -0.27 0.00 -2.02 0.00 0.00 63.50 61.17 2p1d n PRO 254 Cb 0.56 -1.92 0.08 0.00 -0.02 0.00 0.00 33.50 32.21 2p1d n PRO 254 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2p1d s ASP 255 N -1.50 4.62 0.24 2.55 2.15 -1.26 -4.64 116.67 118.84 2p1d s ASP 255 Ca 0.67 0.48 -0.30 0.00 0.43 0.00 0.00 52.55 53.84 2p1d s ASP 255 Cb -0.35 -1.05 -0.09 0.00 -0.30 0.00 0.00 42.92 41.13 2p1d s ASP 255 CO 0.56 -1.75 1.04 -0.69 -0.17 0.00 0.00 175.17 174.16 2p1d s VAL 256 N -3.36 3.79 -0.28 1.11 1.01 -1.26 -5.03 120.40 116.39 2p1d s VAL 256 Ca 0.62 1.75 -0.05 0.00 0.00 0.00 0.00 61.98 64.29 2p1d s VAL 256 Cb -0.10 -4.11 0.01 0.00 0.00 0.00 0.00 36.38 32.18 2p1d s VAL 256 CO 0.46 0.39 0.03 -0.62 0.00 0.00 0.00 175.10 175.37 2p1d s ASP 257 N -0.81 4.86 -0.17 3.32 -1.08 -1.26 -4.47 116.67 117.06 2p1d s ASP 257 Ca 0.44 -0.71 0.06 0.00 -0.52 0.00 0.00 52.55 51.82 2p1d s ASP 257 Cb -0.29 -1.82 0.43 0.00 -1.46 0.00 0.00 42.92 39.78 2p1d s ASP 257 CO 0.36 -0.16 1.28 0.18 0.52 0.00 0.00 175.17 177.36 2p1d n LEU 258 N 4.81 4.04 0.00 -1.34 4.77 0.39 -5.03 117.00 124.64 2p1d n LEU 258 Ca -0.15 -2.08 0.00 0.00 -0.03 0.00 0.00 56.01 53.75 2p1d n LEU 258 Cb 0.48 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 2p1d n LEU 258 CO 0.30 0.56 0.00 0.61 -1.33 0.00 0.00 177.39 177.53 2p1d n GLY 259 N 0.12 2.89 0.00 -0.72 0.00 -1.26 -0.10 105.19 106.12 2p1d n GLY 259 Ca 0.20 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2p1d n GLY 259 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2p1d n SER 260 N 1.90 0.00 -0.12 1.61 3.41 -1.26 0.10 113.62 119.25 2p1d n SER 260 Ca 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.63 2p1d n SER 260 Cb 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 63.94 2p1d n SER 260 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2p1d n GLY 261 N -0.06 -2.33 3.83 5.00 0.00 -0.65 -3.62 105.19 107.36 2p1d n GLY 261 Ca 0.00 -1.44 -0.29 0.00 0.00 0.00 0.00 46.02 44.29 2p1d n GLY 261 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2p1d s THR 262 N -2.59 1.98 -0.02 2.61 -4.23 -1.26 -1.59 115.64 110.54 2p1d s THR 262 Ca 0.00 0.00 0.02 0.00 -1.18 0.00 0.00 61.69 60.53 2p1d s THR 262 Cb 0.00 -2.84 0.00 0.00 1.34 0.00 0.00 72.50 71.00 2p1d s THR 262 CO 0.00 0.00 -0.07 -0.60 -0.54 0.00 0.00 174.62 173.41 2p1d s ARG 263 N -5.45 0.77 0.16 3.99 3.52 -1.26 -4.58 118.95 116.10 2p1d s ARG 263 Ca 0.65 -0.25 0.04 0.00 -0.13 0.00 0.00 55.73 56.04 2p1d s ARG 263 Cb -0.12 -0.74 -0.04 0.00 -1.56 0.00 0.00 34.95 32.49 2p1d s ARG 263 CO 0.52 0.10 0.17 -0.80 -0.81 0.00 0.00 175.30 174.48 2p1d s ASN 264 N 0.16 5.72 0.00 -2.12 0.01 -1.26 -4.94 114.94 112.52 2p1d s ASN 264 Ca -0.02 -0.06 0.00 0.00 -0.71 0.00 0.00 52.86 52.07 2p1d s ASN 264 Cb -0.07 -1.56 0.00 0.00 0.41 0.00 0.00 41.25 40.03 2p1d s ASN 264 CO 0.00 0.07 0.33 -0.38 -1.51 0.00 0.00 177.10 175.60