#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pam s PRO 2 N 0.00 2.16 0.43 0.00 0.04 -1.26 -4.66 135.00 131.71 1pam s PRO 2 Ca 0.00 0.73 0.17 0.00 0.04 0.00 0.00 61.00 61.94 1pam s PRO 2 Cb 0.00 -1.92 1.08 0.00 0.04 0.00 0.00 34.50 33.70 1pam s PRO 2 CO 0.00 -1.59 1.90 0.38 0.04 0.00 0.00 177.00 177.73 1pam h ASP 3 N -1.07 0.38 0.24 6.66 2.03 -1.93 -2.18 116.42 120.54 1pam h ASP 3 Ca -0.47 0.03 0.00 0.00 -0.73 0.00 0.00 57.03 55.86 1pam h ASP 3 Cb 1.26 -0.05 0.00 0.00 -0.83 0.00 0.00 39.33 39.71 1pam h ASP 3 CO 0.58 0.18 -0.04 0.35 -1.03 0.00 0.00 179.24 179.29 1pam n THR 4 N -4.48 0.00 -1.94 1.15 -2.24 -1.26 -4.80 114.28 100.71 1pam n THR 4 Ca 0.16 -0.05 -0.39 0.00 -2.27 0.00 0.00 64.05 61.50 1pam n THR 4 Cb 0.60 -0.26 0.01 0.00 -2.10 0.00 0.00 70.33 68.58 1pam n THR 4 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1pam s SER 5 N -2.28 5.90 0.62 3.42 0.15 -0.82 -4.90 113.70 115.79 1pam s SER 5 Ca 0.36 2.71 0.40 0.00 0.70 0.00 0.00 55.95 60.12 1pam s SER 5 Cb 0.21 -2.64 2.08 0.00 -1.71 0.00 0.00 66.02 63.96 1pam s SER 5 CO 0.42 -1.14 2.26 1.62 1.20 0.00 0.00 173.24 177.60 1pam h VAL 6 N 2.07 0.10 0.00 4.45 3.04 -1.90 -1.82 116.25 122.19 1pam h VAL 6 Ca -0.50 -0.16 0.00 0.00 -1.01 0.00 0.00 66.70 65.03 1pam h VAL 6 Cb 1.27 1.14 0.00 0.00 -2.01 0.00 0.00 31.29 31.68 1pam h VAL 6 CO 0.60 0.01 0.00 -1.54 -1.01 0.00 0.00 177.57 175.64 1pam n SER 7 N -3.20 0.00 -4.50 3.17 3.41 -1.26 -4.56 113.62 106.68 1pam n SER 7 Ca -0.02 -0.65 -0.42 0.00 -0.26 0.00 0.00 58.87 57.52 1pam n SER 7 Cb 0.14 -0.10 -0.03 0.00 -0.26 0.00 0.00 64.21 63.95 1pam n SER 7 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1pam s ASN 8 N -2.21 6.41 0.13 4.04 2.47 -0.68 -4.78 114.94 120.31 1pam s ASN 8 Ca 0.39 -1.37 0.26 0.00 0.42 0.00 0.00 52.86 52.56 1pam s ASN 8 Cb 0.20 -2.48 0.77 0.00 -1.45 0.00 0.00 41.25 38.29 1pam s ASN 8 CO 0.38 -1.41 1.67 0.29 -3.72 0.00 0.00 177.10 174.32 1pam n LYS 9 N 7.98 0.19 0.06 0.43 5.02 -1.26 -4.17 118.16 126.42 1pam n LYS 9 Ca 0.17 0.12 -0.16 0.00 -2.02 0.00 0.00 58.31 56.43 1pam n LYS 9 Cb 0.49 -1.69 -0.14 0.00 -0.02 0.00 0.00 35.03 33.67 1pam n LYS 9 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 1pam h GLN 10 N 0.00 0.23 -5.08 1.97 7.50 -1.85 0.62 115.11 118.51 1pam h GLN 10 Ca 0.00 -0.39 -0.45 0.00 0.50 0.00 0.00 58.65 58.31 1pam h GLN 10 Cb 0.67 0.15 -0.29 0.00 0.05 0.00 0.00 27.48 28.06 1pam h GLN 10 CO 0.00 1.10 -0.80 -0.80 -1.50 0.00 0.00 178.83 176.83 1pam s ASN 11 N -6.95 1.42 -0.02 1.46 0.02 -1.26 -4.01 114.94 105.60 1pam s ASN 11 Ca -0.08 -0.24 0.03 0.00 -1.02 0.00 0.00 52.86 51.55 1pam s ASN 11 Cb 0.07 -0.15 0.05 0.00 0.02 0.00 0.00 41.25 41.24 1pam s ASN 11 CO 0.85 0.14 0.95 0.49 0.02 0.00 0.00 177.10 179.55 1pam n PHE 12 N 2.70 0.00 0.30 2.20 3.01 -1.26 -4.76 117.46 119.65 1pam n PHE 12 Ca -0.14 -0.49 0.16 0.00 1.01 0.00 0.00 57.45 57.99 1pam n PHE 12 Cb 0.56 -0.06 0.94 0.00 -0.01 0.00 0.00 39.48 40.91 1pam n PHE 12 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 1pam h SER 13 N 0.00 0.00 -0.03 4.37 0.02 -1.81 -0.69 113.55 115.40 1pam h SER 13 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1pam h SER 13 Cb 0.69 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.23 1pam h SER 13 CO 0.00 0.02 0.00 0.35 -1.14 0.00 0.00 176.83 176.06 1pam n THR 14 N -3.63 0.03 -3.83 -2.27 -2.24 -1.26 -4.64 114.28 96.44 1pam n THR 14 Ca -0.03 -0.17 -0.21 0.00 -2.27 0.00 0.00 64.05 61.38 1pam n THR 14 Cb 0.12 0.13 -0.02 0.00 -2.10 0.00 0.00 70.33 68.45 1pam n THR 14 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1pam s ASP 15 N -1.89 6.02 -0.15 3.42 1.01 -0.27 -3.72 116.67 121.09 1pam s ASP 15 Ca 0.39 -0.09 0.00 0.00 0.71 0.00 0.00 52.55 53.56 1pam s ASP 15 Cb 0.20 -1.54 0.02 0.00 1.01 0.00 0.00 42.92 42.61 1pam s ASP 15 CO 0.32 -0.19 -0.15 -0.69 0.21 0.00 0.00 175.17 174.67 1pam s VAL 16 N -2.08 1.65 0.04 -1.27 1.01 -1.26 -4.18 120.40 114.31 1pam s VAL 16 Ca 0.38 -0.69 -0.17 0.00 0.00 0.00 0.00 61.98 61.50 1pam s VAL 16 Cb -0.09 -1.54 -0.06 0.00 0.00 0.00 0.00 36.38 34.69 1pam s VAL 16 CO 0.29 0.47 0.50 -0.63 0.00 0.00 0.00 175.10 175.73 1pam s ILE 17 N 1.44 4.86 -0.24 2.22 1.01 0.02 -1.66 121.20 128.85 1pam s ILE 17 Ca 0.05 1.06 -0.02 0.00 0.00 0.00 0.00 60.65 61.74 1pam s ILE 17 Cb -0.13 -3.82 0.02 0.00 0.01 0.00 0.00 42.46 38.54 1pam s ILE 17 CO -0.11 0.56 -0.07 -0.47 0.00 0.00 0.00 174.94 174.86 1pam s TYR 18 N -1.09 3.03 -0.25 3.97 5.04 -0.08 -0.58 117.35 127.39 1pam s TYR 18 Ca 0.27 -1.46 -0.22 0.00 -2.44 0.00 0.00 57.07 53.22 1pam s TYR 18 Cb -0.18 -2.06 -0.01 0.00 0.35 0.00 0.00 41.96 40.06 1pam s TYR 18 CO 0.17 -0.71 0.73 -1.14 -1.34 0.00 0.00 175.55 173.26 1pam s GLN 19 N 1.35 4.13 -0.12 4.97 0.74 -0.03 -1.19 119.66 129.50 1pam s GLN 19 Ca 0.01 0.72 0.02 0.00 0.05 0.00 0.00 55.36 56.17 1pam s GLN 19 Cb -0.16 -3.65 -0.01 0.00 1.10 0.00 0.00 33.01 30.29 1pam s GLN 19 CO -0.05 -0.48 -0.19 0.42 -0.55 0.00 0.00 175.29 174.44 1pam s ILE 20 N 2.69 2.53 -0.56 -2.34 1.01 0.12 -0.98 121.20 123.68 1pam s ILE 20 Ca 0.30 -0.85 -0.22 0.00 0.00 0.00 0.00 60.65 59.89 1pam s ILE 20 Cb -0.15 -2.02 0.05 0.00 0.01 0.00 0.00 42.46 40.35 1pam s ILE 20 CO 0.08 0.54 0.85 -0.36 0.00 0.00 0.00 174.94 176.05 1pam s PHE 21 N 0.40 2.85 0.31 3.97 0.40 -1.26 -3.12 117.98 121.52 1pam s PHE 21 Ca -0.14 -0.28 0.07 0.00 -0.60 0.00 0.00 56.93 55.99 1pam s PHE 21 Cb -0.17 -3.95 0.82 0.00 0.51 0.00 0.00 43.02 40.23 1pam s PHE 21 CO 0.07 -1.31 1.72 1.15 0.70 0.00 0.00 175.22 177.55 1pam h THR 22 N 5.96 0.52 0.00 0.64 2.02 -1.91 -0.08 112.91 120.07 1pam h THR 22 Ca -0.27 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 66.73 1pam h THR 22 Cb 1.08 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.44 1pam h THR 22 CO 1.07 0.09 0.00 -0.78 0.37 0.00 0.00 175.52 176.27 1pam h ASP 23 N 0.52 0.00 -0.42 4.18 3.58 -1.78 -3.09 116.42 119.42 1pam h ASP 23 Ca 0.61 0.00 0.00 0.00 0.42 0.00 0.00 57.03 58.06 1pam h ASP 23 Cb 1.15 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.20 1pam h ASP 23 CO -0.49 0.00 0.00 0.54 -2.88 0.00 0.00 179.24 176.41 1pam n ARG 24 N -3.05 2.64 0.00 0.28 5.12 -0.06 -1.44 116.66 120.15 1pam n ARG 24 Ca 0.01 -2.14 0.00 0.00 -1.93 0.00 0.00 57.85 53.78 1pam n ARG 24 Cb 0.30 -1.35 0.00 0.00 -1.16 0.00 0.00 32.46 30.24 1pam n ARG 24 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1pam n PHE 25 N 0.86 0.00 -3.71 -1.55 7.35 -1.13 -1.92 117.46 117.35 1pam n PHE 25 Ca 0.15 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.71 1pam n PHE 25 Cb 0.47 0.00 -0.13 0.00 0.35 0.00 0.00 39.48 40.17 1pam n PHE 25 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 1pam s SER 26 N -2.21 -0.09 -0.92 -2.13 0.15 -1.26 -4.65 113.70 102.59 1pam s SER 26 Ca 0.00 0.56 -0.22 0.00 0.70 0.00 0.00 55.95 56.99 1pam s SER 26 Cb 0.00 0.51 0.07 0.00 -1.71 0.00 0.00 66.02 64.89 1pam s SER 26 CO 0.00 -0.19 1.29 -0.62 1.20 0.00 0.00 173.24 174.92 1pam s ASP 27 N 1.62 6.46 0.04 5.45 2.15 -1.26 -0.71 116.67 130.42 1pam s ASP 27 Ca -0.06 -1.44 0.25 0.00 0.43 0.00 0.00 52.55 51.73 1pam s ASP 27 Cb -0.11 -2.50 0.50 0.00 -0.30 0.00 0.00 42.92 40.51 1pam s ASP 27 CO -0.09 -1.42 1.42 0.61 -0.17 0.00 0.00 175.17 175.52 1pam n GLY 28 N 6.13 -1.32 2.58 2.66 0.00 -1.26 -4.68 105.19 109.30 1pam n GLY 28 Ca 0.23 -0.30 -0.28 0.00 0.00 0.00 0.00 46.02 45.67 1pam n GLY 28 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1pam s ASN 29 N -3.42 3.03 0.48 1.61 3.84 -1.26 -4.73 114.94 114.49 1pam s ASN 29 Ca 0.10 -1.00 0.26 0.00 0.21 0.00 0.00 52.86 52.43 1pam s ASN 29 Cb 0.16 -0.33 1.12 0.00 -0.55 0.00 0.00 41.25 41.65 1pam s ASN 29 CO 0.70 -0.40 1.91 -0.65 -2.79 0.00 0.00 177.10 175.87 1pam h PRO 30 N 8.40 0.00 0.00 0.43 0.11 -1.90 -3.28 132.00 135.76 1pam h PRO 30 Ca -0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.93 1pam h PRO 30 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1pam h PRO 30 CO 0.37 0.17 0.00 0.00 -0.21 0.00 0.00 178.00 178.34 1pam h ALA 31 N 1.83 1.00 -0.39 -0.75 0.00 -1.99 -1.51 119.26 117.45 1pam h ALA 31 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pam h ALA 31 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1pam h ALA 31 CO 0.02 0.00 0.00 0.27 0.00 0.00 0.00 179.25 179.54 1pam n ASN 32 N -2.68 2.90 -4.74 0.00 0.23 -1.24 -4.96 115.26 104.77 1pam n ASN 32 Ca 0.01 -1.93 -0.41 0.00 -0.53 0.00 0.00 54.58 51.72 1pam n ASN 32 Cb 0.27 -0.26 -0.03 0.00 -2.08 0.00 0.00 39.78 37.68 1pam n ASN 32 CO 0.00 0.00 0.00 0.20 -0.93 0.00 0.00 177.26 176.53 1pam s ASN 33 N -1.36 7.00 0.94 0.53 -0.87 -0.57 -4.35 114.94 116.26 1pam s ASN 33 Ca 0.37 2.31 -0.13 0.00 -1.57 0.00 0.00 52.86 53.85 1pam s ASN 33 Cb 0.21 -2.61 0.04 0.00 -0.02 0.00 0.00 41.25 38.86 1pam s ASN 33 CO 0.29 -0.44 0.44 -2.65 -2.57 0.00 0.00 177.10 172.16 1pam n PRO 34 N 2.54 -0.27 -4.45 -0.60 -0.02 -1.26 -5.02 135.00 125.92 1pam n PRO 34 Ca 0.05 -0.04 -0.22 0.00 -2.02 0.00 0.00 63.50 61.27 1pam n PRO 34 Cb 0.44 -1.88 -0.10 0.00 -0.02 0.00 0.00 33.50 31.94 1pam n PRO 34 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1pam s THR 35 N -2.38 1.81 0.00 3.45 -4.23 -1.26 -4.61 115.64 108.42 1pam s THR 35 Ca 0.58 -2.16 0.00 0.00 -1.18 0.00 0.00 61.69 58.92 1pam s THR 35 Cb -0.22 -2.45 0.00 0.00 1.34 0.00 0.00 72.50 71.17 1pam s THR 35 CO 0.67 -0.31 0.00 0.61 -0.54 0.00 0.00 174.62 175.05 1pam n GLY 36 N -0.61 2.89 0.28 3.99 0.00 -1.26 -2.30 105.19 108.17 1pam n GLY 36 Ca -0.06 -0.22 0.16 0.00 0.00 0.00 0.00 46.02 45.91 1pam n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pam h ALA 37 N -0.68 1.05 0.00 4.61 0.00 -2.03 -2.25 119.26 119.96 1pam h ALA 37 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1pam h ALA 37 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1pam h ALA 37 CO 0.00 0.07 -0.06 0.00 0.00 0.00 0.00 179.25 179.26 1pam n ALA 38 N -2.14 2.43 -2.76 0.00 0.00 -0.97 -4.90 120.51 112.17 1pam n ALA 38 Ca -0.01 -0.11 -0.27 0.00 0.00 0.00 0.00 53.44 53.05 1pam n ALA 38 Cb 0.27 -1.43 -0.16 0.00 0.00 0.00 0.00 19.45 18.13 1pam n ALA 38 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1pam s PHE 39 N -3.03 1.90 -0.30 0.00 5.36 -0.85 -1.28 117.98 119.79 1pam s PHE 39 Ca 0.13 -0.51 -0.03 0.00 -0.96 0.00 0.00 56.93 55.57 1pam s PHE 39 Cb 0.17 -1.25 0.10 0.00 -0.34 0.00 0.00 43.02 41.70 1pam s PHE 39 CO 0.56 -0.15 0.11 0.34 -1.46 0.00 0.00 175.22 174.63 1pam s ASP 40 N -0.13 3.73 0.52 6.13 2.15 0.34 -4.76 116.67 124.65 1pam s ASP 40 Ca -0.01 -1.43 0.34 0.00 0.43 0.00 0.00 52.55 51.88 1pam s ASP 40 Cb -0.11 -0.57 1.50 0.00 -0.30 0.00 0.00 42.92 43.43 1pam s ASP 40 CO 0.02 -0.43 2.00 1.23 -0.17 0.00 0.00 175.17 177.82 1pam h GLY 41 N 8.27 0.00 1.33 2.66 0.00 -1.81 0.37 103.07 113.90 1pam h GLY 41 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1pam h GLY 41 CO 0.45 0.00 -0.27 -1.14 0.00 0.00 0.00 176.54 175.58 1pam n SER 42 N -2.92 0.33 -3.98 0.19 3.41 -1.26 -4.93 113.62 104.46 1pam n SER 42 Ca 0.00 -0.03 -0.30 0.00 -0.26 0.00 0.00 58.87 58.28 1pam n SER 42 Cb 0.24 -0.06 0.01 0.00 -0.26 0.00 0.00 64.21 64.13 1pam n SER 42 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pam h THR 44 N -1.86 0.98 -3.48 0.00 2.02 -1.92 -3.43 112.91 105.22 1pam h THR 44 Ca -0.60 -2.76 -0.72 0.00 0.77 0.00 0.00 66.41 63.11 1pam h THR 44 Cb 1.38 2.55 -0.26 0.00 -1.74 0.00 0.00 68.15 70.07 1pam h THR 44 CO 0.68 0.67 -0.46 0.21 0.37 0.00 0.00 175.52 176.98 1pam s ASN 45 N -6.47 5.75 0.00 4.18 2.47 -1.26 -4.93 114.94 114.68 1pam s ASN 45 Ca -0.07 -1.29 0.09 0.00 0.42 0.00 0.00 52.86 52.00 1pam s ASN 45 Cb 0.08 -2.03 0.51 0.00 -1.45 0.00 0.00 41.25 38.36 1pam s ASN 45 CO 0.82 -0.50 0.97 0.18 -3.72 0.00 0.00 177.10 174.85 1pam n LEU 46 N 4.99 0.00 -0.52 3.21 4.32 -1.26 -2.55 117.00 125.19 1pam n LEU 46 Ca -0.11 0.00 0.06 0.00 -0.02 0.00 0.00 56.01 55.94 1pam n LEU 46 Cb 0.44 0.00 0.07 0.00 -1.62 0.00 0.00 43.42 42.31 1pam n LEU 46 CO 0.39 0.00 0.47 0.54 -1.22 0.00 0.00 177.39 177.57 1pam n ARG 47 N -0.76 0.96 -3.53 3.23 1.74 -1.26 -4.89 116.66 112.15 1pam n ARG 47 Ca 0.06 -1.34 -0.21 0.00 -0.77 0.00 0.00 57.85 55.60 1pam n ARG 47 Cb 0.03 -1.24 -0.03 0.00 -1.02 0.00 0.00 32.46 30.20 1pam n ARG 47 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1pam s LEU 48 N -1.03 3.39 0.11 0.55 1.43 -1.06 -1.61 118.68 120.47 1pam s LEU 48 Ca 0.16 -0.74 -0.31 0.00 -1.03 0.00 0.00 54.13 52.21 1pam s LEU 48 Cb 0.11 -2.07 -0.08 0.00 0.03 0.00 0.00 46.19 44.18 1pam s LEU 48 CO 0.16 -0.68 1.34 -0.31 0.23 0.00 0.00 176.35 177.09 1pam s TYR 49 N -2.48 3.29 -0.61 0.29 2.02 -0.40 -4.80 117.35 114.66 1pam s TYR 49 Ca 0.48 1.05 0.22 0.00 -0.37 0.00 0.00 57.07 58.46 1pam s TYR 49 Cb -0.04 -3.62 -0.05 0.00 -0.40 0.00 0.00 41.96 37.86 1pam s TYR 49 CO 0.28 -2.11 0.94 0.00 -1.57 0.00 0.00 175.55 173.09 1pam n GLY 51 N 1.38 1.03 3.77 0.00 0.00 -1.25 -4.57 105.19 105.54 1pam n GLY 51 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 1pam n GLY 51 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pam s GLY 52 N -2.03 2.92 0.14 -0.02 0.00 -0.52 -4.30 107.32 103.51 1pam s GLY 52 Ca 0.00 1.43 -0.02 0.00 0.00 0.00 0.00 44.72 46.13 1pam s GLY 52 CO 0.00 2.05 0.21 2.09 0.00 0.00 0.00 173.10 177.45 1pam n ASP 53 N -0.07 -0.59 -0.05 1.64 5.68 0.11 -3.77 116.55 119.50 1pam n ASP 53 Ca 0.04 -1.71 -0.14 0.00 -0.50 0.00 0.00 54.79 52.49 1pam n ASP 53 Cb 0.42 1.07 -0.03 0.00 -1.14 0.00 0.00 41.12 41.45 1pam n ASP 53 CO 0.00 0.00 0.00 -0.50 -1.33 0.00 0.00 177.20 175.37 1pam h TRP 54 N 1.39 1.01 -0.73 2.11 6.55 -1.63 -2.66 115.95 121.99 1pam h TRP 54 Ca -0.11 -0.38 0.07 0.00 0.95 0.00 0.00 58.89 59.43 1pam h TRP 54 Cb 0.46 -0.18 -0.05 0.00 -0.86 0.00 0.00 29.16 28.53 1pam h TRP 54 CO 0.00 1.19 0.48 0.37 -1.05 0.00 0.00 178.44 179.43 1pam h GLN 55 N 0.60 0.71 -0.28 0.49 5.75 -1.89 -0.95 115.11 119.53 1pam h GLN 55 Ca 0.00 -0.04 -0.10 0.00 -0.15 0.00 0.00 58.65 58.36 1pam h GLN 55 Cb 1.19 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 29.57 1pam h GLN 55 CO 0.13 0.47 -0.23 0.78 -2.65 0.00 0.00 178.83 177.32 1pam h GLY 56 N 0.73 0.57 0.92 2.39 0.00 -1.55 -0.61 103.07 105.52 1pam h GLY 56 Ca 0.32 -0.46 -0.10 0.00 0.00 0.00 0.00 47.33 47.09 1pam h GLY 56 CO -0.11 0.42 -0.21 -2.22 0.00 0.00 0.00 176.54 174.43 1pam h ILE 57 N 0.47 1.30 -0.52 2.60 2.04 -1.17 -2.00 117.51 120.23 1pam h ILE 57 Ca 0.07 -1.35 0.06 0.00 1.00 0.00 0.00 64.86 64.65 1pam h ILE 57 Cb 0.66 1.57 -0.05 0.00 -0.74 0.00 0.00 36.82 38.26 1pam h ILE 57 CO 0.05 0.43 0.22 0.40 0.00 0.00 0.00 178.15 179.25 1pam h ILE 58 N 0.36 0.88 -0.56 -0.67 2.04 -0.88 -1.14 117.51 117.53 1pam h ILE 58 Ca 0.05 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 65.76 1pam h ILE 58 Cb 0.75 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 1pam h ILE 58 CO 0.05 0.08 0.33 0.78 0.00 0.00 0.00 178.15 179.40 1pam h ASN 59 N 0.43 0.67 1.90 1.72 2.35 -0.92 -1.09 115.58 120.64 1pam h ASN 59 Ca 0.25 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 1pam h ASN 59 Cb 0.22 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.42 1pam h ASN 59 CO -0.22 0.52 0.00 0.11 -1.65 0.00 0.00 177.43 176.20 1pam h LYS 60 N 0.78 0.00 -0.00 0.81 1.79 -0.50 0.02 116.57 119.46 1pam h LYS 60 Ca 0.20 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.62 1pam h LYS 60 Cb -0.02 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.63 1pam h LYS 60 CO -0.04 0.00 -0.19 0.82 -1.08 0.00 0.00 179.45 178.96 1pam h ILE 61 N 0.00 1.56 -0.36 1.86 2.04 -0.71 -1.95 117.51 119.95 1pam h ILE 61 Ca 0.00 -1.92 -0.07 0.00 1.00 0.00 0.00 64.86 63.87 1pam h ILE 61 Cb 0.95 2.79 -0.02 0.00 -0.74 0.00 0.00 36.82 39.80 1pam h ILE 61 CO 0.00 0.52 -0.08 0.78 0.00 0.00 0.00 178.15 179.37 1pam h ASN 62 N -0.57 0.58 -0.05 1.72 -0.26 -1.10 -3.06 115.58 112.85 1pam h ASN 62 Ca -0.02 -0.15 0.00 0.00 -0.56 0.00 0.00 56.30 55.57 1pam h ASN 62 Cb 0.95 -0.16 0.00 0.00 -1.06 0.00 0.00 38.32 38.05 1pam h ASN 62 CO 0.04 0.71 0.00 -0.90 -1.06 0.00 0.00 177.43 176.22 1pam n ASP 63 N -4.21 1.22 0.00 5.81 5.68 -0.02 -4.91 116.55 120.12 1pam n ASP 63 Ca 0.01 -1.48 0.00 0.00 -0.50 0.00 0.00 54.79 52.83 1pam n ASP 63 Cb 0.31 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.27 1pam n ASP 63 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1pam n GLY 64 N 1.11 0.73 0.06 6.12 0.00 -1.16 -4.97 105.19 107.07 1pam n GLY 64 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 1pam n GLY 64 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1pam h TYR 65 N 0.00 0.01 0.09 1.61 3.20 -1.69 -1.87 116.97 118.32 1pam h TYR 65 Ca 0.00 -0.00 -0.21 0.00 3.14 0.00 0.00 58.73 61.65 1pam h TYR 65 Cb 0.00 -0.00 0.02 0.00 1.54 0.00 0.00 36.73 38.29 1pam h TYR 65 CO 0.00 0.50 -0.89 -0.07 -1.64 0.00 0.00 178.16 176.07 1pam h LEU 66 N -0.49 0.63 -0.99 2.82 3.38 -1.65 -3.28 115.31 115.73 1pam h LEU 66 Ca 0.00 -0.84 -0.09 0.00 0.09 0.00 0.00 57.88 57.04 1pam h LEU 66 Cb 0.50 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1pam h LEU 66 CO 0.00 1.41 -0.25 0.71 0.09 0.00 0.00 178.44 180.40 1pam h THR 67 N -0.06 1.26 -0.01 0.22 1.35 -1.79 -2.18 112.91 111.70 1pam h THR 67 Ca -0.14 -1.24 0.00 0.00 -0.55 0.00 0.00 66.41 64.49 1pam h THR 67 Cb 1.62 1.37 -0.00 0.00 -1.73 0.00 0.00 68.15 69.41 1pam h THR 67 CO 0.17 0.39 0.01 1.23 -0.25 0.00 0.00 175.52 177.07 1pam h GLY 68 N 1.02 0.00 1.39 5.82 0.00 -1.44 -1.86 103.07 108.00 1pam h GLY 68 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 1pam h GLY 68 CO 0.05 0.00 -0.44 -0.13 0.00 0.00 0.00 176.54 176.02 1pam n MET 69 N -3.55 0.25 -0.47 4.80 0.00 -0.82 -4.76 117.12 112.56 1pam n MET 69 Ca -0.03 0.11 0.00 0.00 0.00 0.00 0.00 57.70 57.78 1pam n MET 69 Cb 0.09 -1.70 0.00 0.00 0.00 0.00 0.00 33.22 31.62 1pam n MET 69 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1pam n GLY 70 N 1.35 0.76 3.75 -5.12 0.00 -0.70 -2.78 105.19 102.45 1pam n GLY 70 Ca 0.04 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1pam n GLY 70 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pam s ILE 71 N -2.00 2.87 0.00 -0.61 -1.09 -1.23 -4.63 121.20 114.51 1pam s ILE 71 Ca 0.00 0.78 0.00 0.00 -2.23 0.00 0.00 60.65 59.20 1pam s ILE 71 Cb 0.00 -3.50 0.00 0.00 -1.58 0.00 0.00 42.46 37.38 1pam s ILE 71 CO 0.00 0.15 0.74 0.35 -1.23 0.00 0.00 174.94 174.95 1pam n THR 72 N 1.81 0.53 -3.70 2.92 -2.24 -0.66 -4.77 114.28 108.16 1pam n THR 72 Ca 0.04 -0.70 -0.14 0.00 -2.27 0.00 0.00 64.05 60.98 1pam n THR 72 Cb 0.42 0.79 -0.09 0.00 -2.10 0.00 0.00 70.33 69.35 1pam n THR 72 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1pam s ALA 73 N -0.53 -1.12 0.04 6.98 0.00 -0.90 -1.15 121.76 125.08 1pam s ALA 73 Ca 0.00 1.02 0.09 0.00 0.00 0.00 0.00 51.96 53.07 1pam s ALA 73 Cb 0.00 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 22.67 1pam s ALA 73 CO 0.00 -0.25 -0.24 0.96 0.00 0.00 0.00 175.76 176.23 1pam s ILE 74 N -0.39 2.34 -0.17 0.00 -4.36 -0.26 -0.90 121.20 117.46 1pam s ILE 74 Ca -0.05 -1.33 0.01 0.00 -0.26 0.00 0.00 60.65 59.01 1pam s ILE 74 Cb -0.03 -1.93 0.03 0.00 1.25 0.00 0.00 42.46 41.77 1pam s ILE 74 CO 0.03 0.36 -0.14 0.86 0.24 0.00 0.00 174.94 176.29 1pam s TRP 75 N -0.84 2.34 0.31 1.37 -0.00 -0.34 -0.59 118.94 121.19 1pam s TRP 75 Ca 0.13 -1.41 0.10 0.00 -0.00 0.00 0.00 56.10 54.92 1pam s TRP 75 Cb -0.10 -1.65 -0.05 0.00 -0.00 0.00 0.00 33.47 31.66 1pam s TRP 75 CO 0.03 -0.71 -0.09 0.96 -0.00 0.00 0.00 176.95 177.13 1pam s ILE 76 N 1.43 2.60 0.56 5.86 -4.36 -0.74 0.16 121.20 126.71 1pam s ILE 76 Ca 0.03 -2.18 -0.19 0.00 -0.26 0.00 0.00 60.65 58.05 1pam s ILE 76 Cb -0.14 -2.59 -0.08 0.00 1.25 0.00 0.00 42.46 40.91 1pam s ILE 76 CO -0.10 -0.30 0.72 -1.20 0.24 0.00 0.00 174.94 174.30 1pam n SER 77 N -0.79 -0.21 -4.62 4.36 7.64 -1.18 -2.05 113.62 116.76 1pam n SER 77 Ca -0.05 0.79 -0.53 0.00 1.01 0.00 0.00 58.87 60.09 1pam n SER 77 Cb 0.61 -1.26 -0.06 0.00 -1.01 0.00 0.00 64.21 62.49 1pam n SER 77 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1pam n GLN 78 N -0.35 1.16 0.03 1.43 7.27 -1.26 -4.47 117.38 121.19 1pam n GLN 78 Ca 0.12 0.42 0.13 0.00 0.07 0.00 0.00 57.00 57.74 1pam n GLN 78 Cb 0.46 -2.08 0.40 0.00 2.41 0.00 0.00 30.24 31.43 1pam n GLN 78 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 1pam n PRO 79 N 3.27 0.09 -1.90 3.69 -0.04 -1.26 -4.74 135.00 134.11 1pam n PRO 79 Ca 0.20 0.05 -0.32 0.00 -0.04 0.00 0.00 63.50 63.39 1pam n PRO 79 Cb 0.18 -1.58 0.02 0.00 -0.04 0.00 0.00 33.50 32.08 1pam n PRO 79 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1pam s VAL 80 N -3.04 4.04 0.15 0.52 -7.23 -1.26 -0.57 120.40 113.01 1pam s VAL 80 Ca 0.11 0.83 -0.31 0.00 -1.81 0.00 0.00 61.98 60.80 1pam s VAL 80 Cb 0.17 -3.46 -0.10 0.00 0.56 0.00 0.00 36.38 33.54 1pam s VAL 80 CO 0.62 -0.70 1.64 -0.70 -0.31 0.00 0.00 175.10 175.65 1pam s GLU 81 N -4.51 4.19 0.37 4.82 2.12 -0.53 -3.55 118.70 121.61 1pam s GLU 81 Ca 0.60 2.42 0.07 0.00 0.36 0.00 0.00 54.97 58.43 1pam s GLU 81 Cb -0.14 -3.29 -0.02 0.00 0.26 0.00 0.00 34.13 30.94 1pam s GLU 81 CO 0.44 -0.69 0.38 -0.80 -0.54 0.00 0.00 175.26 174.05 1pam s ASN 82 N 1.61 5.34 0.49 -1.70 0.02 -1.26 -1.05 114.94 118.40 1pam s ASN 82 Ca 0.73 -0.53 -0.23 0.00 -1.02 0.00 0.00 52.86 51.81 1pam s ASN 82 Cb -0.44 -0.84 -0.06 0.00 0.02 0.00 0.00 41.25 39.93 1pam s ASN 82 CO 0.32 -0.51 1.30 0.27 0.02 0.00 0.00 177.10 178.50 1pam s ILE 83 N -2.35 2.43 -0.85 0.60 -4.36 -0.67 -4.67 121.20 111.34 1pam s ILE 83 Ca 0.45 0.34 0.26 0.00 -0.26 0.00 0.00 60.65 61.44 1pam s ILE 83 Cb -0.06 -3.18 0.10 0.00 1.25 0.00 0.00 42.46 40.58 1pam s ILE 83 CO 0.28 0.01 1.53 -1.22 0.24 0.00 0.00 174.94 175.79 1pam n TYR 84 N -0.65 0.29 -1.66 1.37 4.01 -1.26 -4.55 117.16 114.71 1pam n TYR 84 Ca 0.08 0.09 -0.40 0.00 -0.16 0.00 0.00 57.90 57.50 1pam n TYR 84 Cb 0.45 -0.52 0.02 0.00 -0.31 0.00 0.00 39.34 38.99 1pam n TYR 84 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1pam n SER 85 N -1.79 1.84 -4.50 7.72 7.64 -1.26 -4.99 113.62 118.27 1pam n SER 85 Ca 0.05 1.01 -0.37 0.00 1.01 0.00 0.00 58.87 60.57 1pam n SER 85 Cb 0.38 -1.44 -0.12 0.00 -1.01 0.00 0.00 64.21 62.02 1pam n SER 85 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1pam s VAL 86 N -1.29 4.71 -0.15 0.44 1.01 -1.26 -4.59 120.40 119.28 1pam s VAL 86 Ca 0.66 -0.03 -0.07 0.00 0.00 0.00 0.00 61.98 62.53 1pam s VAL 86 Cb -0.50 -3.22 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 1pam s VAL 86 CO 0.55 0.30 0.11 -0.63 0.00 0.00 0.00 175.10 175.43 1pam s ILE 87 N 1.67 5.28 -0.41 2.22 1.01 0.57 -4.84 121.20 126.71 1pam s ILE 87 Ca 0.07 0.13 -0.13 0.00 0.00 0.00 0.00 60.65 60.72 1pam s ILE 87 Cb -0.15 -3.33 0.04 0.00 0.01 0.00 0.00 42.46 39.02 1pam s ILE 87 CO 0.07 0.55 0.27 0.21 0.00 0.00 0.00 174.94 176.04 1pam s ASN 88 N -0.48 5.93 -0.32 3.58 3.84 -1.26 0.91 114.94 127.15 1pam s ASN 88 Ca 0.12 -1.05 -0.08 0.00 0.21 0.00 0.00 52.86 52.06 1pam s ASN 88 Cb -0.12 -2.10 0.02 0.00 -0.55 0.00 0.00 41.25 38.50 1pam s ASN 88 CO 0.02 -0.46 0.11 -0.31 -2.79 0.00 0.00 177.10 173.67 1pam s TYR 89 N 1.60 3.19 -1.50 0.43 2.02 0.77 -4.68 117.35 119.18 1pam s TYR 89 Ca 0.03 -1.01 -0.04 0.00 -0.37 0.00 0.00 57.07 55.69 1pam s TYR 89 Cb -0.20 -2.30 0.04 0.00 -0.40 0.00 0.00 41.96 39.10 1pam s TYR 89 CO 0.08 -0.60 0.41 -1.13 -1.57 0.00 0.00 175.55 172.74 1pam n SER 90 N 4.89 -0.69 0.00 2.29 3.41 -1.26 -0.50 113.62 121.76 1pam n SER 90 Ca -0.14 -1.06 0.00 0.00 -0.26 0.00 0.00 58.87 57.41 1pam n SER 90 Cb 0.47 -2.69 0.00 0.00 -0.26 0.00 0.00 64.21 61.74 1pam n SER 90 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pam n GLY 91 N -1.97 1.70 3.48 5.00 0.00 -1.26 -5.02 105.19 107.12 1pam n GLY 91 Ca -0.23 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.44 1pam n GLY 91 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pam s VAL 92 N -2.86 4.05 0.35 1.61 1.01 0.34 -5.08 120.40 119.82 1pam s VAL 92 Ca 0.00 -0.29 -0.25 0.00 0.00 0.00 0.00 61.98 61.44 1pam s VAL 92 Cb 0.00 -2.82 -0.10 0.00 0.00 0.00 0.00 36.38 33.46 1pam s VAL 92 CO 0.00 0.44 0.99 0.20 0.00 0.00 0.00 175.10 176.73 1pam s ASN 93 N 0.84 7.15 0.00 3.32 0.01 -1.26 -0.17 114.94 124.83 1pam s ASN 93 Ca 0.01 1.92 0.01 0.00 -0.71 0.00 0.00 52.86 54.09 1pam s ASN 93 Cb -0.14 -2.58 -0.00 0.00 0.41 0.00 0.00 41.25 38.93 1pam s ASN 93 CO 0.02 -0.21 -0.02 0.20 -1.51 0.00 0.00 177.10 175.58 1pam s ASN 94 N -1.57 0.27 0.35 -1.22 0.01 0.26 -4.67 114.94 108.37 1pam s ASN 94 Ca 0.52 -0.08 0.04 0.00 -0.71 0.00 0.00 52.86 52.64 1pam s ASN 94 Cb -0.20 -0.02 -0.06 0.00 0.41 0.00 0.00 41.25 41.38 1pam s ASN 94 CO 0.26 0.00 0.06 0.42 -1.51 0.00 0.00 177.10 176.33 1pam s THR 95 N -0.16 1.23 -0.08 1.60 -4.23 -0.63 -0.32 115.64 113.04 1pam s THR 95 Ca -0.00 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.51 1pam s THR 95 Cb -0.02 -2.76 0.06 0.00 1.34 0.00 0.00 72.50 71.13 1pam s THR 95 CO -0.00 0.00 1.87 0.00 -0.54 0.00 0.00 174.62 175.95 1pam n ALA 96 N -0.75 4.09 0.08 3.99 0.00 -1.26 -4.59 120.51 122.07 1pam n ALA 96 Ca -0.03 -0.45 0.17 0.00 0.00 0.00 0.00 53.44 53.13 1pam n ALA 96 Cb 0.67 -1.10 0.69 0.00 0.00 0.00 0.00 19.45 19.71 1pam n ALA 96 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 1pam h TYR 97 N 0.98 0.00 0.00 0.00 -0.00 -1.89 -1.08 116.97 114.97 1pam h TYR 97 Ca 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.81 1pam h TYR 97 Cb 1.02 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.75 1pam h TYR 97 CO 0.36 0.00 0.00 -2.39 -0.00 0.00 0.00 178.16 176.13 1pam n HIS 98 N -4.35 0.40 -0.82 0.10 1.44 -1.26 -4.45 115.22 106.28 1pam n HIS 98 Ca 0.06 0.12 0.00 0.00 -2.01 0.00 0.00 57.72 55.89 1pam n HIS 98 Cb 0.46 -0.70 0.00 0.00 0.12 0.00 0.00 29.99 29.87 1pam n HIS 98 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1pam n GLY 99 N 1.22 1.19 0.00 -1.39 0.00 -0.41 -4.44 105.19 101.37 1pam n GLY 99 Ca 0.06 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.22 1pam n GLY 99 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1pam n TYR 100 N -2.00 0.00 -3.30 1.61 4.01 -1.26 -4.50 117.16 111.72 1pam n TYR 100 Ca 0.00 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.39 1pam n TYR 100 Cb 0.00 -0.26 -0.04 0.00 -0.31 0.00 0.00 39.34 38.73 1pam n TYR 100 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 1pam n TRP 101 N -1.26 3.21 -2.27 -0.72 8.01 -1.26 -4.81 117.44 118.34 1pam n TRP 101 Ca 0.14 -3.54 -0.38 0.00 -1.31 0.00 0.00 57.50 52.41 1pam n TRP 101 Cb 0.21 -0.93 -0.01 0.00 -2.01 0.00 0.00 31.31 28.57 1pam n TRP 101 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1pam s ALA 102 N -2.42 3.06 -0.00 6.99 0.00 -0.82 -1.66 121.76 126.90 1pam s ALA 102 Ca 0.34 0.95 0.00 0.00 0.00 0.00 0.00 51.96 53.26 1pam s ALA 102 Cb 0.07 -3.38 -0.00 0.00 0.00 0.00 0.00 23.12 19.81 1pam s ALA 102 CO 0.01 -0.60 0.00 2.89 0.00 0.00 0.00 175.76 178.07 1pam n ARG 103 N -0.23 2.57 -3.54 0.00 1.85 -0.21 -3.99 116.66 113.10 1pam n ARG 103 Ca 0.06 -0.00 -0.17 0.00 -1.00 0.00 0.00 57.85 56.73 1pam n ARG 103 Cb 0.47 -1.01 -0.13 0.00 -1.05 0.00 0.00 32.46 30.74 1pam n ARG 103 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 1pam s ASP 104 N -2.67 1.15 0.00 2.89 -1.08 -0.98 -0.80 116.67 115.18 1pam s ASP 104 Ca -0.00 -0.03 0.23 0.00 -0.52 0.00 0.00 52.55 52.22 1pam s ASP 104 Cb 0.00 0.40 1.35 0.00 -1.46 0.00 0.00 42.92 43.21 1pam s ASP 104 CO 0.01 -0.30 1.80 0.49 0.52 0.00 0.00 175.17 177.69 1pam n PHE 105 N 5.32 0.00 0.22 -5.34 3.01 -1.26 -2.48 117.46 116.94 1pam n PHE 105 Ca -0.05 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.46 1pam n PHE 105 Cb 0.50 0.00 0.08 0.00 -0.01 0.00 0.00 39.48 40.04 1pam n PHE 105 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1pam n LYS 106 N -0.90 1.30 -4.39 -1.08 5.02 -1.26 -4.89 118.16 111.96 1pam n LYS 106 Ca 0.17 -1.43 -0.20 0.00 -2.02 0.00 0.00 58.31 54.83 1pam n LYS 106 Cb 0.08 -1.22 -0.10 0.00 -0.02 0.00 0.00 35.03 33.77 1pam n LYS 106 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1pam s LYS 107 N -0.91 1.47 0.53 1.97 1.02 -1.20 -4.90 119.74 117.72 1pam s LYS 107 Ca 0.15 -1.73 -0.03 0.00 0.02 0.00 0.00 55.97 54.38 1pam s LYS 107 Cb 0.10 -1.03 0.00 0.00 -0.52 0.00 0.00 37.83 36.38 1pam s LYS 107 CO 0.14 0.03 0.81 0.95 -0.92 0.00 0.00 175.35 176.35 1pam s THR 108 N -3.10 3.81 -0.45 2.17 -4.23 -1.26 -1.46 115.64 111.12 1pam s THR 108 Ca 0.28 -0.19 -0.28 0.00 -1.18 0.00 0.00 61.69 60.33 1pam s THR 108 Cb 0.04 -3.47 0.03 0.00 1.34 0.00 0.00 72.50 70.43 1pam s THR 108 CO 0.10 -0.42 1.04 0.21 -0.54 0.00 0.00 174.62 175.02 1pam s ASN 109 N -4.27 6.63 0.62 3.99 3.84 0.27 -3.33 114.94 122.69 1pam s ASN 109 Ca 0.52 0.43 0.31 0.00 0.21 0.00 0.00 52.86 54.33 1pam s ASN 109 Cb -0.10 -2.51 1.76 0.00 -0.55 0.00 0.00 41.25 39.85 1pam s ASN 109 CO 0.42 -1.11 2.09 1.55 -2.79 0.00 0.00 177.10 177.26 1pam h PRO 110 N 8.99 0.00 0.00 0.43 0.13 -1.91 0.65 132.00 140.29 1pam h PRO 110 Ca -0.23 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.82 1pam h PRO 110 Cb 1.07 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 1pam h PRO 110 CO 1.07 0.00 -0.38 0.00 -0.23 0.00 0.00 178.00 178.46 1pam h ALA 111 N 1.69 1.18 0.11 -0.56 0.00 -1.92 -2.97 119.26 116.80 1pam h ALA 111 Ca 0.06 -0.34 -0.31 0.00 0.00 0.00 0.00 54.91 54.32 1pam h ALA 111 Cb 0.50 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1pam h ALA 111 CO -0.00 0.47 -1.59 1.88 0.00 0.00 0.00 179.25 180.01 1pam h TYR 112 N 0.00 0.44 0.00 0.00 0.05 -1.19 -3.43 116.97 112.84 1pam h TYR 112 Ca -0.00 -0.32 0.00 0.00 0.05 0.00 0.00 58.73 58.46 1pam h TYR 112 Cb 0.76 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.48 1pam h TYR 112 CO 0.00 1.40 0.00 0.41 -1.05 0.00 0.00 178.16 178.92 1pam n GLY 113 N 1.69 -1.76 3.96 3.88 0.00 -0.74 -1.72 105.19 110.50 1pam n GLY 113 Ca -0.18 -1.49 -0.24 0.00 0.00 0.00 0.00 46.02 44.11 1pam n GLY 113 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1pam s THR 114 N -1.82 2.31 0.47 2.61 -4.23 -1.26 -3.96 115.64 109.76 1pam s THR 114 Ca 0.00 -0.44 0.13 0.00 -1.18 0.00 0.00 61.69 60.20 1pam s THR 114 Cb 0.00 -2.87 0.28 0.00 1.34 0.00 0.00 72.50 71.26 1pam s THR 114 CO 0.00 0.00 2.09 0.24 -0.54 0.00 0.00 174.62 176.41 1pam h MET 115 N -0.51 0.23 -0.25 3.99 2.86 -1.98 -1.27 114.93 118.01 1pam h MET 115 Ca -0.41 -0.01 -0.16 0.00 -2.06 0.00 0.00 59.70 57.05 1pam h MET 115 Cb 1.29 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.89 1pam h MET 115 CO 0.50 0.15 -0.51 0.37 1.06 0.00 0.00 176.91 178.48 1pam h GLN 116 N 0.24 0.69 -0.34 1.72 5.75 -1.99 -0.32 115.11 120.86 1pam h GLN 116 Ca 0.10 -0.41 -0.11 0.00 -0.15 0.00 0.00 58.65 58.08 1pam h GLN 116 Cb 0.11 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.69 1pam h GLN 116 CO -0.02 1.03 -0.23 -0.44 -2.65 0.00 0.00 178.83 176.52 1pam h ASP 117 N 0.54 0.66 -0.15 -0.69 3.32 -1.69 -1.12 116.42 117.29 1pam h ASP 117 Ca 0.02 -0.23 -0.02 0.00 0.02 0.00 0.00 57.03 56.83 1pam h ASP 117 Cb 1.07 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.43 1pam h ASP 117 CO 0.10 0.88 0.04 0.15 -1.72 0.00 0.00 179.24 178.69 1pam h PHE 118 N 0.58 0.25 -0.90 4.55 3.57 -0.88 -0.86 116.94 123.26 1pam h PHE 118 Ca 0.08 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.55 1pam h PHE 118 Cb 0.70 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.32 1pam h PHE 118 CO 0.03 0.39 0.55 0.87 -2.23 0.00 0.00 178.31 177.92 1pam h LYS 119 N 0.05 1.22 -0.96 1.11 1.57 -0.94 -1.44 116.57 117.17 1pam h LYS 119 Ca 0.05 -0.11 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1pam h LYS 119 Cb 0.26 -0.26 -0.05 0.00 0.08 0.00 0.00 32.23 32.27 1pam h LYS 119 CO 0.00 0.85 0.64 -0.91 -0.57 0.00 0.00 179.45 179.46 1pam h ASN 120 N 1.24 1.08 -0.06 0.86 2.35 -1.04 -0.43 115.58 119.59 1pam h ASN 120 Ca 0.32 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 56.05 1pam h ASN 120 Cb -0.06 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.04 1pam h ASN 120 CO -0.06 0.77 0.03 0.25 -1.65 0.00 0.00 177.43 176.77 1pam h LEU 121 N 1.27 0.08 -0.34 1.61 5.85 -0.45 -0.59 115.31 122.74 1pam h LEU 121 Ca 0.36 -0.11 0.04 0.00 0.84 0.00 0.00 57.88 59.01 1pam h LEU 121 Cb -0.09 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 40.88 1pam h LEU 121 CO -0.09 0.17 0.12 0.40 -0.34 0.00 0.00 178.44 178.69 1pam h ILE 122 N -0.02 0.91 -0.28 4.05 1.08 -0.87 -0.44 117.51 121.94 1pam h ILE 122 Ca 0.02 -0.09 -0.16 0.00 -0.39 0.00 0.00 64.86 64.24 1pam h ILE 122 Cb 0.11 0.62 -0.01 0.00 -3.07 0.00 0.00 36.82 34.48 1pam h ILE 122 CO -0.00 0.05 -0.47 0.44 -0.69 0.00 0.00 178.15 177.47 1pam h ASP 123 N 0.26 0.80 -0.40 1.72 3.32 -0.98 -1.15 116.42 119.99 1pam h ASP 123 Ca 0.15 -0.40 -0.14 0.00 0.02 0.00 0.00 57.03 56.66 1pam h ASP 123 Cb 0.12 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1pam h ASP 123 CO -0.16 1.15 -0.30 0.74 -1.72 0.00 0.00 179.24 178.95 1pam h THR 124 N 0.59 1.27 -0.03 0.35 2.02 -0.92 -0.74 112.91 115.44 1pam h THR 124 Ca 0.03 -1.47 -0.00 0.00 0.77 0.00 0.00 66.41 65.74 1pam h THR 124 Cb 1.04 1.26 -0.00 0.00 -1.74 0.00 0.00 68.15 68.71 1pam h THR 124 CO 0.10 0.50 0.01 0.00 0.37 0.00 0.00 175.52 176.50 1pam h ALA 125 N 0.86 0.04 -0.73 6.16 0.00 -0.94 -2.79 119.26 121.86 1pam h ALA 125 Ca 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1pam h ALA 125 Cb 0.88 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 1pam h ALA 125 CO 0.08 -0.37 0.41 0.45 0.00 0.00 0.00 179.25 179.82 1pam h HIS 126 N -0.13 0.99 0.00 0.00 -0.00 -1.11 0.12 115.15 115.02 1pam h HIS 126 Ca 0.01 -0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.36 1pam h HIS 126 Cb 0.18 -0.32 -0.00 0.00 -0.00 0.00 0.00 27.41 27.27 1pam h HIS 126 CO -0.01 0.70 -0.01 0.00 -0.00 0.00 0.00 177.93 178.60 1pam h ALA 127 N 1.21 1.24 -0.36 2.45 0.00 -1.09 0.18 119.26 122.89 1pam h ALA 127 Ca 0.26 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.03 1pam h ALA 127 Cb 0.02 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.74 1pam h ALA 127 CO -0.04 0.02 0.01 0.72 0.00 0.00 0.00 179.25 179.96 1pam n HIS 128 N -3.45 1.18 -4.00 0.00 8.25 -0.51 -4.97 115.22 111.73 1pam n HIS 128 Ca -0.03 -1.28 -0.32 0.00 -0.26 0.00 0.00 57.72 55.84 1pam n HIS 128 Cb 0.10 -0.45 0.01 0.00 1.12 0.00 0.00 29.99 30.78 1pam n HIS 128 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1pam n ASN 129 N -0.82 -4.34 -4.30 0.41 3.02 0.05 -4.99 115.26 104.29 1pam n ASN 129 Ca 0.30 -0.84 -0.33 0.00 -0.03 0.00 0.00 54.58 53.67 1pam n ASN 129 Cb 1.02 -3.58 -0.15 0.00 -0.61 0.00 0.00 39.78 36.46 1pam n ASN 129 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1pam s ILE 130 N -3.31 2.85 0.50 2.41 1.01 0.29 -4.75 121.20 120.20 1pam s ILE 130 Ca 0.67 -0.71 -0.11 0.00 0.00 0.00 0.00 60.65 60.50 1pam s ILE 130 Cb -0.34 -2.21 -0.05 0.00 0.01 0.00 0.00 42.46 39.86 1pam s ILE 130 CO 0.86 0.51 0.89 -0.54 0.00 0.00 0.00 174.94 176.65 1pam s LYS 131 N 0.75 3.72 -0.13 2.79 1.02 -0.30 -3.04 119.74 124.55 1pam s LYS 131 Ca -0.06 0.59 0.01 0.00 0.02 0.00 0.00 55.97 56.53 1pam s LYS 131 Cb -0.15 -2.25 0.02 0.00 -0.52 0.00 0.00 37.83 34.92 1pam s LYS 131 CO 0.01 -0.26 -0.14 0.08 -0.92 0.00 0.00 175.35 174.12 1pam s VAL 132 N -2.71 1.50 -0.10 3.17 1.01 -1.26 -1.11 120.40 120.89 1pam s VAL 132 Ca 0.53 -0.61 -0.01 0.00 0.00 0.00 0.00 61.98 61.89 1pam s VAL 132 Cb -0.10 -1.40 -0.03 0.00 0.00 0.00 0.00 36.38 34.85 1pam s VAL 132 CO 0.40 0.44 -0.05 -0.63 0.00 0.00 0.00 175.10 175.26 1pam s ILE 133 N 1.30 3.82 0.00 2.22 1.01 0.24 -0.47 121.20 129.32 1pam s ILE 133 Ca 0.00 -0.42 0.04 0.00 0.00 0.00 0.00 60.65 60.28 1pam s ILE 133 Cb -0.14 -2.61 -0.03 0.00 0.01 0.00 0.00 42.46 39.70 1pam s ILE 133 CO -0.07 0.56 -0.12 0.27 0.00 0.00 0.00 174.94 175.58 1pam s ILE 134 N -0.36 3.24 0.58 2.92 -4.36 -0.68 -1.80 121.20 120.74 1pam s ILE 134 Ca 0.06 -0.89 -0.20 0.00 -0.26 0.00 0.00 60.65 59.36 1pam s ILE 134 Cb -0.12 -2.36 -0.04 0.00 1.25 0.00 0.00 42.46 41.19 1pam s ILE 134 CO 0.02 0.43 1.28 -1.81 0.24 0.00 0.00 174.94 175.10 1pam s ASP 135 N -1.25 5.17 -0.05 4.36 1.01 -0.87 -0.72 116.67 124.32 1pam s ASP 135 Ca 0.15 2.57 -0.02 0.00 0.71 0.00 0.00 52.55 55.96 1pam s ASP 135 Cb -0.11 -2.62 0.04 0.00 1.01 0.00 0.00 42.92 41.24 1pam s ASP 135 CO 0.05 -1.62 0.10 0.12 0.21 0.00 0.00 175.17 174.03 1pam s PHE 136 N -1.44 -0.08 -0.63 4.23 5.36 0.41 -4.29 117.98 121.55 1pam s PHE 136 Ca 0.75 0.36 0.06 0.00 -0.96 0.00 0.00 56.93 57.14 1pam s PHE 136 Cb -0.35 -0.21 0.21 0.00 -0.34 0.00 0.00 43.02 42.32 1pam s PHE 136 CO 0.40 -0.16 0.58 0.00 -1.46 0.00 0.00 175.22 174.57 1pam n ALA 137 N 4.51 3.53 1.96 11.12 0.00 -1.26 -1.31 120.51 139.06 1pam n ALA 137 Ca -0.21 -4.40 0.03 0.00 0.00 0.00 0.00 53.44 48.87 1pam n ALA 137 Cb 0.51 -0.94 0.20 0.00 0.00 0.00 0.00 19.45 19.22 1pam n ALA 137 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1pam n PRO 138 N 1.58 0.98 0.15 0.00 -0.04 -1.26 -3.73 135.00 132.68 1pam n PRO 138 Ca 0.25 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.74 1pam n PRO 138 Cb 0.40 -1.11 0.04 0.00 -0.04 0.00 0.00 33.50 32.79 1pam n PRO 138 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 1pam h ASN 139 N 0.00 0.00 -5.03 3.54 -1.24 -1.92 -3.45 115.58 107.48 1pam h ASN 139 Ca 0.00 0.00 0.05 0.00 0.71 0.00 0.00 56.30 57.06 1pam h ASN 139 Cb 0.00 0.00 -0.06 0.00 0.73 0.00 0.00 38.32 38.99 1pam h ASN 139 CO 0.00 0.46 0.18 -1.38 -1.29 0.00 0.00 177.43 175.41 1pam s HIS 140 N -2.99 -0.12 0.00 0.67 -3.43 -1.24 -1.29 115.29 106.88 1pam s HIS 140 Ca 0.04 -0.32 0.00 0.00 -0.80 0.00 0.00 55.06 53.98 1pam s HIS 140 Cb 0.07 0.64 0.00 0.00 -1.43 0.00 0.00 32.58 31.86 1pam s HIS 140 CO 0.74 -1.20 0.00 0.25 -2.00 0.00 0.00 174.74 172.53 1pam n THR 141 N -0.45 0.00 -3.97 -5.38 -2.24 -0.95 -4.68 114.28 96.62 1pam n THR 141 Ca -0.04 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.63 1pam n THR 141 Cb 0.59 -0.73 -0.03 0.00 -2.10 0.00 0.00 70.33 68.07 1pam n THR 141 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1pam s SER 142 N -0.72 0.31 0.18 3.42 1.04 -1.26 -1.95 113.70 114.73 1pam s SER 142 Ca 0.00 -1.18 -0.33 0.00 0.48 0.00 0.00 55.95 54.92 1pam s SER 142 Cb 0.00 0.70 -0.14 0.00 0.10 0.00 0.00 66.02 66.68 1pam s SER 142 CO 0.00 -1.36 1.58 -2.65 0.98 0.00 0.00 173.24 171.79 1pam n PRO 143 N -0.50 2.23 -3.77 4.02 -0.02 -1.26 -1.38 135.00 134.32 1pam n PRO 143 Ca -0.03 0.80 -0.11 0.00 -2.02 0.00 0.00 63.50 62.14 1pam n PRO 143 Cb 0.61 -2.57 -0.07 0.00 -0.02 0.00 0.00 33.50 31.45 1pam n PRO 143 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pam s ALA 144 N 0.83 -0.63 -0.10 3.55 0.00 0.08 -3.80 121.76 121.69 1pam s ALA 144 Ca 0.77 -0.06 -0.01 0.00 0.00 0.00 0.00 51.96 52.66 1pam s ALA 144 Cb -0.65 0.33 0.03 0.00 0.00 0.00 0.00 23.12 22.83 1pam s ALA 144 CO 0.38 -0.42 -0.04 0.45 0.00 0.00 0.00 175.76 176.14 1pam s SER 145 N -2.12 1.99 0.39 0.00 0.15 -1.26 -4.79 113.70 108.06 1pam s SER 145 Ca -0.04 -0.25 0.19 0.00 0.70 0.00 0.00 55.95 56.54 1pam s SER 145 Cb -0.01 -0.67 0.76 0.00 -1.71 0.00 0.00 66.02 64.40 1pam s SER 145 CO -0.04 -0.16 1.78 0.77 1.20 0.00 0.00 173.24 176.79 1pam h SER 146 N 8.24 0.00 0.24 5.45 4.64 -1.96 -3.11 113.55 127.05 1pam h SER 146 Ca -0.25 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.94 1pam h SER 146 Cb 1.13 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.20 1pam h SER 146 CO 0.34 0.36 -0.50 0.44 -0.87 0.00 0.00 176.83 176.60 1pam h ASP 147 N 0.00 0.32 -4.17 4.97 3.32 -1.95 -3.38 116.42 115.53 1pam h ASP 147 Ca -0.00 -0.16 -0.63 0.00 0.02 0.00 0.00 57.03 56.25 1pam h ASP 147 Cb 0.81 -0.09 -0.41 0.00 0.22 0.00 0.00 39.33 39.85 1pam h ASP 147 CO 0.05 0.77 -0.64 -0.62 -1.72 0.00 0.00 179.24 177.08 1pam s ASP 148 N -6.89 4.24 0.00 6.45 2.15 -1.17 -4.95 116.67 116.50 1pam s ASP 148 Ca -0.05 -3.02 0.02 0.00 0.43 0.00 0.00 52.55 49.93 1pam s ASP 148 Cb 0.12 -1.55 0.08 0.00 -0.30 0.00 0.00 42.92 41.28 1pam s ASP 148 CO 0.79 -0.23 1.06 -0.81 -0.17 0.00 0.00 175.17 175.82 1pam n PRO 149 N 3.09 0.00 0.03 4.34 -0.04 -1.24 -1.83 135.00 139.34 1pam n PRO 149 Ca 0.06 0.47 0.12 0.00 -0.04 0.00 0.00 63.50 64.12 1pam n PRO 149 Cb 0.33 -1.50 0.29 0.00 -0.04 0.00 0.00 33.50 32.57 1pam n PRO 149 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1pam n SER 150 N -1.50 0.51 -4.72 3.54 3.41 -1.26 -4.47 113.62 109.13 1pam n SER 150 Ca 0.00 0.04 -0.42 0.00 -0.26 0.00 0.00 58.87 58.24 1pam n SER 150 Cb 0.02 0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 63.99 1pam n SER 150 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1pam s PHE 151 N -3.06 3.33 0.00 7.33 5.36 -0.76 -4.84 117.98 125.33 1pam s PHE 151 Ca 0.10 1.17 0.00 0.00 -0.96 0.00 0.00 56.93 57.23 1pam s PHE 151 Cb 0.16 -3.56 0.00 0.00 -0.34 0.00 0.00 43.02 39.28 1pam s PHE 151 CO 0.68 -1.81 0.00 0.00 -1.46 0.00 0.00 175.22 172.63 1pam n ALA 152 N 3.54 0.00 -1.55 11.12 0.00 -1.26 -2.07 120.51 130.29 1pam n ALA 152 Ca 0.09 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.53 1pam n ALA 152 Cb 0.44 0.00 0.20 0.00 0.00 0.00 0.00 19.45 20.09 1pam n ALA 152 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1pam n GLU 153 N 14.00 1.74 -2.77 0.00 1.02 -1.26 -4.93 120.64 128.44 1pam n GLU 153 Ca 0.00 -3.28 -0.14 0.00 -0.02 0.00 0.00 57.16 53.71 1pam n GLU 153 Cb 0.00 -1.72 -0.00 0.00 -0.02 0.00 0.00 31.44 29.69 1pam n GLU 153 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1pam n ASN 154 N -1.11 -3.40 -1.18 1.62 4.05 -0.88 -1.41 115.26 112.95 1pam n ASN 154 Ca 0.26 0.04 -0.15 0.00 0.45 0.00 0.00 54.58 55.17 1pam n ASN 154 Cb 0.85 -2.88 -0.07 0.00 1.23 0.00 0.00 39.78 38.91 1pam n ASN 154 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1pam n GLY 155 N -0.88 1.54 3.76 8.20 0.00 -1.25 -0.58 105.19 115.98 1pam n GLY 155 Ca -0.08 -0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.23 1pam n GLY 155 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pam s ARG 156 N -3.31 4.11 -0.14 1.61 0.52 -0.50 -4.57 118.95 116.67 1pam s ARG 156 Ca 0.00 2.60 -0.02 0.00 -0.52 0.00 0.00 55.73 57.78 1pam s ARG 156 Cb 0.00 -3.00 -0.03 0.00 0.52 0.00 0.00 34.95 32.44 1pam s ARG 156 CO 0.00 -0.62 -0.06 -1.17 0.02 0.00 0.00 175.30 173.47 1pam s LEU 157 N -0.94 3.13 0.22 2.53 2.96 -0.18 -4.56 118.68 121.83 1pam s LEU 157 Ca 0.61 -0.16 0.10 0.00 -0.22 0.00 0.00 54.13 54.46 1pam s LEU 157 Cb -0.48 -1.74 -0.04 0.00 0.50 0.00 0.00 46.19 44.43 1pam s LEU 157 CO 0.52 0.19 -0.09 -0.31 -1.32 0.00 0.00 176.35 175.35 1pam s TYR 158 N 0.21 2.59 -0.39 5.38 1.51 0.02 -0.18 117.35 126.49 1pam s TYR 158 Ca -0.04 -0.24 0.03 0.00 -1.01 0.00 0.00 57.07 55.81 1pam s TYR 158 Cb -0.14 -1.22 0.11 0.00 -0.11 0.00 0.00 41.96 40.60 1pam s TYR 158 CO 0.03 0.56 0.13 0.34 -1.11 0.00 0.00 175.55 175.51 1pam s ASP 159 N -3.13 4.46 -1.51 2.29 2.15 0.21 -4.39 116.67 116.74 1pam s ASP 159 Ca 0.27 -2.37 -0.08 0.00 0.43 0.00 0.00 52.55 50.80 1pam s ASP 159 Cb -0.08 -1.49 0.06 0.00 -0.30 0.00 0.00 42.92 41.12 1pam s ASP 159 CO 0.16 -0.33 0.62 -3.20 -0.17 0.00 0.00 175.17 172.24 1pam n ASN 160 N 3.95 -1.85 0.00 -0.34 2.85 -1.26 -1.26 115.26 117.34 1pam n ASN 160 Ca 0.04 -0.97 0.00 0.00 -0.11 0.00 0.00 54.58 53.54 1pam n ASN 160 Cb 0.39 -3.10 0.00 0.00 1.24 0.00 0.00 39.78 38.31 1pam n ASN 160 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1pam n GLY 161 N -1.75 2.68 3.65 8.20 0.00 -1.26 -5.05 105.19 111.66 1pam n GLY 161 Ca -0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 1pam n GLY 161 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1pam s ASN 162 N 0.53 6.99 0.01 1.61 0.01 -0.39 -4.97 114.94 118.72 1pam s ASN 162 Ca 0.00 1.24 -0.30 0.00 -0.71 0.00 0.00 52.86 53.09 1pam s ASN 162 Cb 0.00 -2.50 -0.06 0.00 0.41 0.00 0.00 41.25 39.10 1pam s ASN 162 CO 0.00 -0.59 1.56 -0.22 -1.51 0.00 0.00 177.10 176.34 1pam s LEU 163 N 2.98 4.33 -0.16 0.60 1.98 -1.26 0.63 118.68 127.78 1pam s LEU 163 Ca 0.40 2.27 -0.16 0.00 -2.89 0.00 0.00 54.13 53.75 1pam s LEU 163 Cb -0.15 -3.55 -0.23 0.00 0.66 0.00 0.00 46.19 42.92 1pam s LEU 163 CO 0.07 -0.84 0.33 -0.07 -1.89 0.00 0.00 176.35 173.95 1pam h LEU 164 N 8.98 0.19 0.00 -0.68 3.38 -0.90 -3.47 115.31 122.81 1pam h LEU 164 Ca -0.40 -0.71 0.00 0.00 0.09 0.00 0.00 57.88 56.86 1pam h LEU 164 Cb 1.18 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1pam h LEU 164 CO 0.93 1.61 0.00 0.61 0.09 0.00 0.00 178.44 181.68 1pam n GLY 165 N 1.65 1.10 3.77 0.83 0.00 -1.16 -5.01 105.19 106.38 1pam n GLY 165 Ca -0.30 -0.90 -0.33 0.00 0.00 0.00 0.00 46.02 44.49 1pam n GLY 165 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pam s GLY 166 N 0.00 2.99 0.06 -0.02 0.00 -1.26 -1.02 107.32 108.07 1pam s GLY 166 Ca 0.00 -0.43 -0.09 0.00 0.00 0.00 0.00 44.72 44.20 1pam s GLY 166 CO 0.00 -2.18 1.10 -1.82 0.00 0.00 0.00 173.10 170.20 1pam h TYR 167 N 1.31 0.70 -3.62 1.90 3.20 -1.09 -3.37 116.97 116.00 1pam h TYR 167 Ca -0.44 -0.50 -0.51 0.00 3.14 0.00 0.00 58.73 60.42 1pam h TYR 167 Cb 1.31 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.54 1pam h TYR 167 CO 1.49 1.38 0.41 0.99 -1.64 0.00 0.00 178.16 180.80 1pam s THR 168 N -2.68 4.09 -1.19 1.81 2.01 -1.26 -4.00 115.64 114.41 1pam s THR 168 Ca -0.06 1.86 -0.00 0.00 0.31 0.00 0.00 61.69 63.79 1pam s THR 168 Cb 0.06 -4.18 -0.00 0.00 0.01 0.00 0.00 72.50 68.38 1pam s THR 168 CO 0.91 0.34 0.99 -3.20 -0.69 0.00 0.00 174.62 172.97 1pam n ASN 169 N 2.24 -2.26 -4.09 3.53 5.15 -1.26 -4.91 115.26 113.66 1pam n ASN 169 Ca 0.01 -0.63 -0.43 0.00 -0.60 0.00 0.00 54.58 52.94 1pam n ASN 169 Cb 0.47 -5.13 0.00 0.00 -0.53 0.00 0.00 39.78 34.60 1pam n ASN 169 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 1pam n ASP 170 N -3.13 5.25 0.03 1.20 2.03 -1.26 -4.76 116.55 115.92 1pam n ASP 170 Ca -0.28 -3.09 -0.05 0.00 0.52 0.00 0.00 54.79 51.89 1pam n ASP 170 Cb 0.67 -1.49 0.16 0.00 -0.72 0.00 0.00 41.12 39.74 1pam n ASP 170 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1pam h THR 171 N 4.00 1.30 0.00 5.18 1.35 -1.91 -2.75 112.91 120.08 1pam h THR 171 Ca 0.35 -1.51 0.00 0.00 -0.55 0.00 0.00 66.41 64.69 1pam h THR 171 Cb 0.71 1.57 0.00 0.00 -1.73 0.00 0.00 68.15 68.70 1pam h THR 171 CO 1.46 0.47 0.00 1.56 -0.25 0.00 0.00 175.52 178.76 1pam h GLN 172 N 0.37 0.00 -5.87 4.72 4.20 -1.97 -3.47 115.11 113.08 1pam h GLN 172 Ca 0.04 0.00 -0.38 0.00 0.06 0.00 0.00 58.65 58.37 1pam h GLN 172 Cb 0.84 0.00 0.11 0.00 0.30 0.00 0.00 27.48 28.73 1pam h GLN 172 CO 0.07 0.00 -0.78 0.09 -0.67 0.00 0.00 178.83 177.54 1pam n ASN 173 N -2.75 -2.34 0.29 1.46 3.02 -1.04 -4.92 115.26 108.98 1pam n ASN 173 Ca 0.01 -0.69 0.18 0.00 -0.03 0.00 0.00 54.58 54.04 1pam n ASN 173 Cb 0.25 -4.65 0.77 0.00 -0.61 0.00 0.00 39.78 35.54 1pam n ASN 173 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1pam h LEU 174 N -1.98 0.00 -8.92 3.41 3.38 -1.92 -3.44 115.31 105.84 1pam h LEU 174 Ca -0.60 0.00 -0.43 0.00 0.09 0.00 0.00 57.88 56.94 1pam h LEU 174 Cb 1.35 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.96 1pam h LEU 174 CO 0.54 0.01 -0.70 -0.36 0.09 0.00 0.00 178.44 178.02 1pam s PHE 175 N -3.76 1.69 0.09 1.13 0.08 -1.26 -0.71 117.98 115.23 1pam s PHE 175 Ca 0.00 -0.68 -0.21 0.00 0.12 0.00 0.00 56.93 56.16 1pam s PHE 175 Cb 0.10 -0.88 -0.07 0.00 -0.57 0.00 0.00 43.02 41.60 1pam s PHE 175 CO 0.53 0.24 0.62 -1.01 -0.10 0.00 0.00 175.22 175.50 1pam s HIS 176 N -3.10 3.82 -0.49 0.36 3.76 -0.31 -4.70 115.29 114.64 1pam s HIS 176 Ca 0.24 1.36 0.08 0.00 -0.15 0.00 0.00 55.06 56.59 1pam s HIS 176 Cb 0.02 -2.58 0.31 0.00 1.11 0.00 0.00 32.58 31.45 1pam s HIS 176 CO 0.08 0.55 0.77 0.72 -0.85 0.00 0.00 174.74 176.01 1pam n HIS 177 N 1.79 1.96 0.06 1.40 8.25 -1.26 -4.67 115.22 122.74 1pam n HIS 177 Ca -0.09 -3.89 0.02 0.00 -0.26 0.00 0.00 57.72 53.50 1pam n HIS 177 Cb 0.50 -0.45 0.04 0.00 1.12 0.00 0.00 29.99 31.20 1pam n HIS 177 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1pam n TYR 178 N 0.37 0.09 -1.06 4.41 4.01 -1.26 -5.12 117.16 118.61 1pam n TYR 178 Ca 0.27 -0.24 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 1pam n TYR 178 Cb 0.51 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.52 1pam n TYR 178 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1pam n GLY 179 N 0.08 -2.09 3.92 2.72 0.00 -1.26 -4.95 105.19 103.61 1pam n GLY 179 Ca 0.04 -1.88 -0.30 0.00 0.00 0.00 0.00 46.02 43.88 1pam n GLY 179 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pam s GLY 180 N -0.35 2.07 0.45 -0.02 0.00 -1.26 -0.81 107.32 107.39 1pam s GLY 180 Ca 0.00 -0.79 -0.22 0.00 0.00 0.00 0.00 44.72 43.72 1pam s GLY 180 CO 0.00 -0.75 1.03 -1.08 0.00 0.00 0.00 173.10 172.30 1pam s THR 181 N -1.64 3.87 -1.16 0.90 -1.32 0.36 -4.75 115.64 111.90 1pam s THR 181 Ca 0.37 1.25 0.12 0.00 -1.21 0.00 0.00 61.69 62.22 1pam s THR 181 Cb -0.12 -3.56 0.26 0.00 -1.51 0.00 0.00 72.50 67.57 1pam s THR 181 CO 0.27 -0.16 1.16 -0.90 -2.21 0.00 0.00 174.62 172.78 1pam n ASP 182 N -0.60 2.72 -1.67 8.08 5.68 -1.26 -4.83 116.55 124.66 1pam n ASP 182 Ca 0.07 -1.85 -0.20 0.00 -0.50 0.00 0.00 54.79 52.31 1pam n ASP 182 Cb 0.52 -0.18 -0.07 0.00 -1.14 0.00 0.00 41.12 40.25 1pam n ASP 182 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 1pam n PHE 183 N 0.63 -0.20 -0.02 2.11 3.72 -1.26 -4.88 117.46 117.56 1pam n PHE 183 Ca 0.11 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.39 1pam n PHE 183 Cb 0.40 -3.43 0.00 0.00 -0.94 0.00 0.00 39.48 35.51 1pam n PHE 183 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1pam h SER 184 N 0.00 0.77 -3.83 4.37 4.64 -1.94 -3.45 113.55 114.10 1pam h SER 184 Ca -0.42 -0.43 -0.38 0.00 -0.47 0.00 0.00 61.79 60.09 1pam h SER 184 Cb 1.30 -0.22 -0.14 0.00 -0.31 0.00 0.00 62.40 63.03 1pam h SER 184 CO 0.59 1.19 -0.66 0.42 -0.87 0.00 0.00 176.83 177.49 1pam s THR 185 N -3.96 1.07 0.16 2.95 -4.23 -1.26 -5.02 115.64 105.35 1pam s THR 185 Ca -0.09 -2.04 -0.11 0.00 -1.18 0.00 0.00 61.69 58.28 1pam s THR 185 Cb 0.10 -2.32 0.03 0.00 1.34 0.00 0.00 72.50 71.66 1pam s THR 185 CO 0.87 -0.35 1.60 0.40 -0.54 0.00 0.00 174.62 176.59 1pam h ILE 186 N 2.48 1.27 -0.60 2.99 2.04 -1.94 -2.03 117.51 121.71 1pam h ILE 186 Ca -0.38 -1.18 0.05 0.00 1.00 0.00 0.00 64.86 64.35 1pam h ILE 186 Cb 1.22 0.95 -0.05 0.00 -0.74 0.00 0.00 36.82 38.20 1pam h ILE 186 CO 0.65 0.42 0.32 -0.08 0.00 0.00 0.00 178.15 179.46 1pam h GLU 187 N 0.85 0.60 -0.51 2.37 4.81 -1.96 -1.82 114.58 118.91 1pam h GLU 187 Ca 0.14 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.33 1pam h GLU 187 Cb 0.60 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 1pam h GLU 187 CO 0.04 0.39 0.28 -0.97 -0.73 0.00 0.00 179.01 178.02 1pam h ASN 188 N 0.61 0.64 0.78 1.04 -0.73 -1.91 -2.69 115.58 113.31 1pam h ASN 188 Ca 0.27 -0.10 0.00 0.00 1.87 0.00 0.00 56.30 58.34 1pam h ASN 188 Cb 0.16 -0.16 0.00 0.00 0.27 0.00 0.00 38.32 38.59 1pam h ASN 188 CO -0.17 0.55 0.00 0.61 -0.37 0.00 0.00 177.43 178.05 1pam n GLY 189 N -1.01 -1.26 0.08 1.57 0.00 -0.78 -2.51 105.19 101.28 1pam n GLY 189 Ca 0.02 -0.05 -0.14 0.00 0.00 0.00 0.00 46.02 45.85 1pam n GLY 189 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1pam h ILE 190 N 0.00 1.31 0.00 -0.61 2.04 -1.02 -3.42 117.51 115.81 1pam h ILE 190 Ca 0.00 -2.12 0.00 0.00 1.00 0.00 0.00 64.86 63.74 1pam h ILE 190 Cb 0.39 2.61 0.00 0.00 -0.74 0.00 0.00 36.82 39.08 1pam h ILE 190 CO 0.00 0.44 -0.94 -1.22 0.00 0.00 0.00 178.15 176.43 1pam n TYR 191 N -4.58 0.39 -3.84 1.37 4.01 -1.11 -4.66 117.16 108.74 1pam n TYR 191 Ca -0.15 0.11 -0.20 0.00 -0.16 0.00 0.00 57.90 57.50 1pam n TYR 191 Cb 0.48 -0.54 -0.02 0.00 -0.31 0.00 0.00 39.34 38.95 1pam n TYR 191 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1pam s LYS 192 N -3.21 3.35 0.39 -0.72 1.02 -1.04 -4.65 119.74 114.89 1pam s LYS 192 Ca 0.04 -0.83 -0.26 0.00 0.02 0.00 0.00 55.97 54.94 1pam s LYS 192 Cb 0.14 -2.87 -0.09 0.00 -0.52 0.00 0.00 37.83 34.49 1pam s LYS 192 CO 0.78 0.34 1.23 -0.80 -0.92 0.00 0.00 175.35 175.98 1pam s ASN 193 N -4.03 6.47 -0.34 2.83 0.01 0.01 -4.55 114.94 115.34 1pam s ASN 193 Ca 0.37 2.50 -0.24 0.00 -0.71 0.00 0.00 52.86 54.78 1pam s ASN 193 Cb -0.09 -2.63 0.01 0.00 0.41 0.00 0.00 41.25 38.95 1pam s ASN 193 CO 0.30 -0.72 0.83 -0.76 -1.51 0.00 0.00 177.10 175.23 1pam s LEU 194 N -2.38 4.08 0.00 0.60 1.43 -1.26 -0.48 118.68 120.67 1pam s LEU 194 Ca 0.56 0.56 0.00 0.00 -1.03 0.00 0.00 54.13 54.22 1pam s LEU 194 Cb -0.35 -3.12 0.00 0.00 0.03 0.00 0.00 46.19 42.76 1pam s LEU 194 CO 0.44 -0.72 0.00 -1.22 0.23 0.00 0.00 176.35 175.09 1pam n TYR 195 N 6.42 0.00 -0.69 0.29 4.01 -1.26 -1.84 117.16 124.09 1pam n TYR 195 Ca 0.05 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.86 1pam n TYR 195 Cb 0.48 0.00 0.18 0.00 -0.31 0.00 0.00 39.34 39.69 1pam n TYR 195 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1pam n ASP 196 N 7.45 3.09 -4.72 7.72 5.75 -1.26 -4.84 116.55 129.74 1pam n ASP 196 Ca 0.00 -2.66 -0.41 0.00 -0.01 0.00 0.00 54.79 51.71 1pam n ASP 196 Cb 0.00 -0.38 -0.04 0.00 -1.03 0.00 0.00 41.12 39.68 1pam n ASP 196 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1pam s LEU 197 N -2.17 4.43 -0.25 -2.12 1.43 -0.77 -0.74 118.68 118.49 1pam s LEU 197 Ca 0.30 1.68 -0.29 0.00 -1.03 0.00 0.00 54.13 54.80 1pam s LEU 197 Cb 0.23 -3.53 -0.03 0.00 0.03 0.00 0.00 46.19 42.89 1pam s LEU 197 CO 0.08 -0.15 1.81 0.00 0.23 0.00 0.00 176.35 178.32 1pam s ALA 198 N 0.49 3.04 -0.19 4.21 0.00 -0.48 -4.30 121.76 124.53 1pam s ALA 198 Ca 0.48 0.49 -0.29 0.00 0.00 0.00 0.00 51.96 52.64 1pam s ALA 198 Cb -0.22 -3.95 -0.02 0.00 0.00 0.00 0.00 23.12 18.93 1pam s ALA 198 CO 0.28 -2.34 1.46 0.34 0.00 0.00 0.00 175.76 175.50 1pam s ASP 199 N 5.65 6.66 0.47 0.00 2.15 -1.26 -2.23 116.67 128.11 1pam s ASP 199 Ca 0.81 1.67 -0.21 0.00 0.43 0.00 0.00 52.55 55.25 1pam s ASP 199 Cb -0.26 -2.54 -0.08 0.00 -0.30 0.00 0.00 42.92 39.74 1pam s ASP 199 CO 0.33 -1.01 1.07 -0.76 -0.17 0.00 0.00 175.17 174.63 1pam s LEU 200 N 4.31 3.92 -0.62 -1.34 1.43 -0.41 -1.16 118.68 124.81 1pam s LEU 200 Ca 0.64 2.04 -0.15 0.00 -1.03 0.00 0.00 54.13 55.63 1pam s LEU 200 Cb -0.24 -4.44 0.15 0.00 0.03 0.00 0.00 46.19 41.70 1pam s LEU 200 CO 0.24 -0.80 0.56 0.21 0.23 0.00 0.00 176.35 176.79 1pam s ASN 201 N -1.77 6.30 0.00 2.29 2.47 0.11 -4.64 114.94 119.70 1pam s ASN 201 Ca 0.65 -2.07 0.18 0.00 0.42 0.00 0.00 52.86 52.05 1pam s ASN 201 Cb -0.20 -2.19 0.84 0.00 -1.45 0.00 0.00 41.25 38.25 1pam s ASN 201 CO 0.25 -0.76 1.57 1.41 -3.72 0.00 0.00 177.10 175.85 1pam n HIS 202 N 4.84 0.00 1.11 0.43 8.25 -1.26 -1.84 115.22 126.76 1pam n HIS 202 Ca -0.05 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.55 1pam n HIS 202 Cb 0.42 -0.40 0.65 0.00 1.12 0.00 0.00 29.99 31.78 1pam n HIS 202 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1pam n ASN 203 N -1.40 0.01 -4.66 0.41 5.15 -1.26 -4.39 115.26 109.11 1pam n ASN 203 Ca 0.06 0.31 -0.42 0.00 -0.60 0.00 0.00 54.58 53.93 1pam n ASN 203 Cb 0.18 -0.43 -0.03 0.00 -0.53 0.00 0.00 39.78 38.97 1pam n ASN 203 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1pam s ASN 204 N -2.89 7.01 0.29 1.20 2.47 -0.77 -4.75 114.94 117.51 1pam s ASN 204 Ca 0.18 1.25 0.03 0.00 0.42 0.00 0.00 52.86 54.74 1pam s ASN 204 Cb 0.19 -2.50 0.66 0.00 -1.45 0.00 0.00 41.25 38.16 1pam s ASN 204 CO 0.51 -0.56 1.76 0.28 -3.72 0.00 0.00 177.10 175.37 1pam h SER 205 N 7.47 0.63 -0.64 -4.21 0.02 -1.89 -0.93 113.55 114.00 1pam h SER 205 Ca -0.23 0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 60.81 1pam h SER 205 Cb 1.09 -0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.60 1pam h SER 205 CO 0.91 0.22 0.37 0.28 -1.14 0.00 0.00 176.83 177.47 1pam h SER 206 N 0.66 0.81 -0.05 3.07 0.02 -1.95 -0.50 113.55 115.62 1pam h SER 206 Ca 0.54 -0.06 -0.15 0.00 -0.84 0.00 0.00 61.79 61.28 1pam h SER 206 Cb 0.84 -0.20 0.01 0.00 0.14 0.00 0.00 62.40 63.18 1pam h SER 206 CO -0.40 0.65 -0.55 0.58 -1.14 0.00 0.00 176.83 175.97 1pam h VAL 207 N 0.92 1.40 0.18 2.27 2.07 -1.49 -2.22 116.25 119.37 1pam h VAL 207 Ca 0.24 -1.95 0.01 0.00 0.82 0.00 0.00 66.70 65.82 1pam h VAL 207 Cb 0.01 2.40 -0.03 0.00 -1.52 0.00 0.00 31.29 32.16 1pam h VAL 207 CO -0.04 0.58 -0.26 -0.78 0.02 0.00 0.00 177.57 177.08 1pam h ASP 208 N -0.00 -0.74 0.02 0.57 3.58 -0.99 -1.56 116.42 117.30 1pam h ASP 208 Ca -0.05 0.08 -0.10 0.00 0.42 0.00 0.00 57.03 57.37 1pam h ASP 208 Cb 1.23 0.27 -0.01 0.00 1.72 0.00 0.00 39.33 42.53 1pam h ASP 208 CO 0.11 -0.37 -0.30 0.58 -2.88 0.00 0.00 179.24 176.38 1pam h VAL 209 N -0.51 1.28 -0.26 2.25 2.07 -1.16 -2.72 116.25 117.20 1pam h VAL 209 Ca 0.02 -1.34 -0.00 0.00 0.82 0.00 0.00 66.70 66.19 1pam h VAL 209 Cb 0.51 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 1pam h VAL 209 CO -0.12 0.42 0.14 0.22 0.02 0.00 0.00 177.57 178.26 1pam h TYR 210 N 0.37 0.35 -0.51 1.57 3.20 -1.20 0.05 116.97 120.81 1pam h TYR 210 Ca 0.05 -0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.80 1pam h TYR 210 Cb 0.72 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.86 1pam h TYR 210 CO 0.02 0.29 -0.11 -0.07 -1.64 0.00 0.00 178.16 176.66 1pam h LEU 211 N 0.31 0.95 -0.45 2.82 4.07 -1.19 0.22 115.31 122.04 1pam h LEU 211 Ca 0.09 -0.30 -0.16 0.00 0.08 0.00 0.00 57.88 57.59 1pam h LEU 211 Cb 0.05 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 41.53 1pam h LEU 211 CO -0.02 1.06 -0.41 0.11 -1.08 0.00 0.00 178.44 178.10 1pam h LYS 212 N 0.85 0.84 -0.46 1.13 1.57 -1.44 -1.37 116.57 117.69 1pam h LYS 212 Ca 0.14 -0.45 -0.11 0.00 -1.87 0.00 0.00 60.65 58.35 1pam h LYS 212 Cb 0.65 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.96 1pam h LYS 212 CO 0.04 1.09 -0.16 -0.44 -0.57 0.00 0.00 179.45 179.41 1pam h ASP 213 N 0.68 0.90 -0.43 0.86 3.32 -0.78 -2.59 116.42 118.37 1pam h ASP 213 Ca 0.05 -0.31 -0.03 0.00 0.02 0.00 0.00 57.03 56.76 1pam h ASP 213 Cb 0.99 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 40.28 1pam h ASP 213 CO 0.10 1.05 0.15 0.00 -1.72 0.00 0.00 179.24 178.82 1pam h ALA 214 N 1.02 0.56 -0.33 3.45 0.00 -0.33 -2.32 119.26 121.31 1pam h ALA 214 Ca 0.12 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 1pam h ALA 214 Cb 0.70 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1pam h ALA 214 CO 0.05 0.18 -0.23 0.97 0.00 0.00 0.00 179.25 180.23 1pam h ILE 215 N 0.55 1.27 -0.34 0.00 6.09 -1.17 -2.33 117.51 121.58 1pam h ILE 215 Ca 0.14 -1.31 -0.02 0.00 -1.37 0.00 0.00 64.86 62.31 1pam h ILE 215 Cb 0.22 1.26 -0.02 0.00 0.47 0.00 0.00 36.82 38.76 1pam h ILE 215 CO -0.01 0.43 0.13 0.11 -3.07 0.00 0.00 178.15 175.74 1pam h LYS 216 N 0.57 0.47 -0.22 2.19 1.57 -1.32 -0.82 116.57 119.01 1pam h LYS 216 Ca 0.08 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1pam h LYS 216 Cb 0.70 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 1pam h LYS 216 CO 0.05 0.39 0.12 1.98 -0.57 0.00 0.00 179.45 181.43 1pam h MET 217 N 0.47 0.31 -0.03 3.15 4.05 -0.87 -0.14 114.93 121.87 1pam h MET 217 Ca 0.12 -0.04 -0.10 0.00 -0.28 0.00 0.00 59.70 59.40 1pam h MET 217 Cb 0.10 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 30.83 1pam h MET 217 CO -0.01 0.29 -0.44 -1.49 0.23 0.00 0.00 176.91 175.50 1pam h TRP 218 N 0.25 0.09 -0.49 1.39 4.06 -1.08 -2.00 115.95 118.17 1pam h TRP 218 Ca 0.08 -0.02 -0.07 0.00 2.06 0.00 0.00 58.89 60.93 1pam h TRP 218 Cb 0.07 -0.02 -0.02 0.00 -1.00 0.00 0.00 29.16 28.20 1pam h TRP 218 CO -0.03 0.50 0.01 -0.07 -3.56 0.00 0.00 178.44 175.29 1pam h LEU 219 N 0.07 0.83 -2.02 -4.49 3.38 -0.83 -2.16 115.31 110.09 1pam h LEU 219 Ca 0.00 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 1pam h LEU 219 Cb 0.80 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 1pam h LEU 219 CO 0.06 0.93 -0.09 0.44 0.09 0.00 0.00 178.44 179.87 1pam h ASP 220 N 0.71 0.00 0.34 -0.43 3.32 -0.72 -1.56 116.42 118.09 1pam h ASP 220 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1pam h ASP 220 Cb 0.49 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1pam h ASP 220 CO 0.02 0.09 0.00 0.18 -1.72 0.00 0.00 179.24 177.81 1pam n LEU 221 N -3.96 0.00 0.00 1.55 4.77 -0.78 -4.91 117.00 113.66 1pam n LEU 221 Ca -0.02 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 1pam n LEU 221 Cb 0.18 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 1pam n LEU 221 CO 0.31 -0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.90 1pam n GLY 222 N 0.45 1.04 3.77 -0.72 0.00 -0.59 -4.95 105.19 104.20 1pam n GLY 222 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 1pam n GLY 222 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1pam s VAL 223 N -2.00 3.23 -0.93 1.61 -7.23 -1.21 -4.88 120.40 108.98 1pam s VAL 223 Ca 0.00 0.86 0.18 0.00 -1.81 0.00 0.00 61.98 61.21 1pam s VAL 223 Cb 0.00 -3.40 -0.18 0.00 0.56 0.00 0.00 36.38 33.36 1pam s VAL 223 CO 0.00 -0.07 0.79 0.47 -0.31 0.00 0.00 175.10 175.97 1pam n ASP 224 N -0.75 0.94 -3.50 4.85 8.00 0.39 -4.86 116.55 121.61 1pam n ASP 224 Ca 0.09 -0.97 -0.10 0.00 0.71 0.00 0.00 54.79 54.52 1pam n ASP 224 Cb 0.49 0.96 -0.02 0.00 -0.02 0.00 0.00 41.12 42.53 1pam n ASP 224 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1pam s GLY 225 N -2.67 -0.51 -0.07 0.44 0.00 -1.01 -3.72 107.32 99.79 1pam s GLY 225 Ca 0.08 0.51 0.01 0.00 0.00 0.00 0.00 44.72 45.32 1pam s GLY 225 CO 0.72 0.17 -0.07 -0.42 0.00 0.00 0.00 173.10 173.50 1pam s ILE 226 N -3.60 0.79 -0.28 0.90 1.01 -0.21 -1.69 121.20 118.13 1pam s ILE 226 Ca 0.04 -0.23 -0.08 0.00 0.00 0.00 0.00 60.65 60.37 1pam s ILE 226 Cb -0.02 -0.79 -0.02 0.00 0.01 0.00 0.00 42.46 41.64 1pam s ILE 226 CO -0.09 0.30 0.11 -0.60 0.00 0.00 0.00 174.94 174.66 1pam s ARG 227 N 1.11 3.48 -0.21 2.79 3.00 0.10 -1.62 118.95 127.61 1pam s ARG 227 Ca -0.07 -0.61 -0.16 0.00 -1.00 0.00 0.00 55.73 53.90 1pam s ARG 227 Cb -0.14 -3.45 -0.04 0.00 0.00 0.00 0.00 34.95 31.32 1pam s ARG 227 CO -0.01 -0.31 0.39 0.08 0.00 0.00 0.00 175.30 175.45 1pam s VAL 228 N 1.61 5.20 0.37 7.11 1.01 -0.21 -0.44 120.40 135.05 1pam s VAL 228 Ca 0.05 0.68 -0.22 0.00 0.00 0.00 0.00 61.98 62.49 1pam s VAL 228 Cb -0.16 -3.72 -0.10 0.00 0.00 0.00 0.00 36.38 32.40 1pam s VAL 228 CO 0.05 0.25 0.92 -0.62 0.00 0.00 0.00 175.10 175.70 1pam s ASP 229 N 1.08 7.08 -1.36 3.32 2.15 -0.42 -1.93 116.67 126.58 1pam s ASP 229 Ca 0.18 1.70 -0.06 0.00 0.43 0.00 0.00 52.55 54.80 1pam s ASP 229 Cb -0.15 -2.53 0.03 0.00 -0.30 0.00 0.00 42.92 39.97 1pam s ASP 229 CO 0.08 -0.22 0.95 0.00 -0.17 0.00 0.00 175.17 175.80 1pam n ALA 230 N -0.12 -1.65 0.30 3.66 0.00 -1.25 -4.69 120.51 116.75 1pam n ALA 230 Ca 0.04 0.08 0.18 0.00 0.00 0.00 0.00 53.44 53.75 1pam n ALA 230 Cb 0.52 -3.56 0.81 0.00 0.00 0.00 0.00 19.45 17.23 1pam n ALA 230 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1pam h VAL 231 N -2.13 0.00 0.00 0.00 -1.51 -1.74 0.10 116.25 110.97 1pam h VAL 231 Ca -0.59 -0.37 0.00 0.00 -1.23 0.00 0.00 66.70 64.51 1pam h VAL 231 Cb 1.36 1.35 0.00 0.00 -2.13 0.00 0.00 31.29 31.87 1pam h VAL 231 CO 0.58 0.00 0.00 1.17 -1.23 0.00 0.00 177.57 178.09 1pam n LYS 232 N -3.04 0.30 -0.13 5.19 4.81 -1.26 -3.63 118.16 120.40 1pam n LYS 232 Ca -0.00 0.05 0.05 0.00 -0.87 0.00 0.00 58.31 57.54 1pam n LYS 232 Cb 0.24 -1.50 0.11 0.00 0.02 0.00 0.00 35.03 33.90 1pam n LYS 232 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1pam n HIS 233 N -1.32 0.24 -4.27 5.64 8.25 0.36 -4.53 115.22 119.60 1pam n HIS 233 Ca 0.11 -0.71 -0.19 0.00 -0.26 0.00 0.00 57.72 56.68 1pam n HIS 233 Cb 0.22 -0.12 -0.11 0.00 1.12 0.00 0.00 29.99 31.10 1pam n HIS 233 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1pam s MET 234 N -1.84 1.09 0.21 -0.41 -1.94 -1.24 -4.39 119.30 110.78 1pam s MET 234 Ca 0.21 -1.29 -0.31 0.00 -1.71 0.00 0.00 55.69 52.58 1pam s MET 234 Cb 0.16 -1.00 -0.11 0.00 2.01 0.00 0.00 34.83 35.89 1pam s MET 234 CO 0.05 0.19 1.61 -2.14 -0.01 0.00 0.00 175.02 174.73 1pam s PRO 235 N -2.76 4.17 0.20 2.03 0.02 -1.26 -4.90 135.00 132.50 1pam s PRO 235 Ca 0.11 2.48 -0.11 0.00 0.02 0.00 0.00 61.00 63.50 1pam s PRO 235 Cb -0.05 -3.10 0.23 0.00 0.02 0.00 0.00 34.50 31.60 1pam s PRO 235 CO 0.04 -0.64 1.74 0.35 -0.33 0.00 0.00 177.00 178.16 1pam h PHE 236 N 6.31 0.34 -0.97 6.54 3.04 -1.90 -0.83 116.94 129.46 1pam h PHE 236 Ca -0.44 0.03 0.07 0.00 3.98 0.00 0.00 57.97 61.61 1pam h PHE 236 Cb 1.21 -0.07 -0.07 0.00 2.56 0.00 0.00 35.95 39.58 1pam h PHE 236 CO 0.63 0.09 0.63 0.78 -2.02 0.00 0.00 178.31 178.42 1pam h GLY 237 N 0.37 1.47 0.99 2.40 0.00 -1.90 0.12 103.07 106.51 1pam h GLY 237 Ca 0.28 -0.45 -0.16 0.00 0.00 0.00 0.00 47.33 47.00 1pam h GLY 237 CO -0.29 0.31 -0.48 -0.25 0.00 0.00 0.00 176.54 175.83 1pam h TRP 238 N 1.11 0.87 -0.49 5.60 7.01 -1.47 -2.75 115.95 125.83 1pam h TRP 238 Ca 0.43 -0.33 -0.04 0.00 2.11 0.00 0.00 58.89 61.05 1pam h TRP 238 Cb 0.21 -0.15 -0.02 0.00 -2.10 0.00 0.00 29.16 27.10 1pam h TRP 238 CO -0.00 1.11 0.13 1.96 -2.79 0.00 0.00 178.44 178.85 1pam h GLN 239 N 0.37 0.73 -0.52 2.65 4.20 -0.42 -0.30 115.11 121.82 1pam h GLN 239 Ca -0.00 -0.13 -0.08 0.00 0.06 0.00 0.00 58.65 58.49 1pam h GLN 239 Cb 1.10 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.74 1pam h GLN 239 CO 0.11 0.65 -0.01 -0.22 -0.67 0.00 0.00 178.83 178.68 1pam h LYS 240 N 0.71 0.88 0.00 1.46 3.64 -0.73 -0.08 116.57 122.45 1pam h LYS 240 Ca 0.16 -0.26 -0.12 0.00 -1.27 0.00 0.00 60.65 59.17 1pam h LYS 240 Cb 0.24 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 1pam h LYS 240 CO -0.01 0.89 -0.55 0.66 -2.27 0.00 0.00 179.45 178.17 1pam h SER 241 N 0.82 0.00 -0.21 4.20 4.64 -1.10 -0.70 113.55 121.20 1pam h SER 241 Ca 0.15 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.44 1pam h SER 241 Cb 0.50 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 1pam h SER 241 CO 0.03 0.55 -0.00 0.15 -0.87 0.00 0.00 176.83 176.68 1pam h PHE 242 N 0.00 0.40 -0.78 4.77 3.57 -0.58 -1.93 116.94 122.39 1pam h PHE 242 Ca -0.01 -0.07 -0.04 0.00 3.53 0.00 0.00 57.97 61.38 1pam h PHE 242 Cb 1.02 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.62 1pam h PHE 242 CO 0.00 0.56 0.32 0.52 -2.23 0.00 0.00 178.31 177.48 1pam h MET 243 N 0.12 1.15 -0.18 1.11 2.86 -0.86 -2.15 114.93 116.98 1pam h MET 243 Ca 0.06 -0.20 -0.04 0.00 -2.06 0.00 0.00 59.70 57.45 1pam h MET 243 Cb 0.40 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 1pam h MET 243 CO 0.01 0.93 -0.07 0.00 1.06 0.00 0.00 176.91 178.84 1pam h ALA 244 N 1.17 1.54 -0.44 6.32 0.00 -1.03 -0.45 119.26 126.36 1pam h ALA 244 Ca 0.26 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1pam h ALA 244 Cb 0.20 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1pam h ALA 244 CO -0.02 0.33 0.20 1.15 0.00 0.00 0.00 179.25 180.91 1pam h THR 245 N 0.27 1.19 0.35 0.00 2.02 -0.73 0.34 112.91 116.34 1pam h THR 245 Ca 0.06 -0.54 -0.02 0.00 0.77 0.00 0.00 66.41 66.68 1pam h THR 245 Cb 0.31 0.73 0.00 0.00 -1.74 0.00 0.00 68.15 67.46 1pam h THR 245 CO 0.01 0.20 -0.17 0.40 0.37 0.00 0.00 175.52 176.34 1pam h ILE 246 N 0.56 0.66 0.00 3.11 2.04 -1.10 -2.95 117.51 119.83 1pam h ILE 246 Ca 0.15 -0.39 -0.04 0.00 1.00 0.00 0.00 64.86 65.58 1pam h ILE 246 Cb 0.14 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 1pam h ILE 246 CO -0.02 0.08 -0.18 0.78 0.00 0.00 0.00 178.15 178.80 1pam h ASN 247 N -0.69 0.00 0.19 1.72 2.35 -1.00 0.55 115.58 118.71 1pam h ASN 247 Ca -0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 1pam h ASN 247 Cb 0.48 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.85 1pam h ASN 247 CO 0.08 0.18 -0.12 0.59 -1.65 0.00 0.00 177.43 176.51 1pam n ASN 248 N -4.29 0.89 0.00 5.81 3.02 0.10 -4.20 115.26 116.59 1pam n ASN 248 Ca -0.02 -0.96 0.00 0.00 -0.03 0.00 0.00 54.58 53.57 1pam n ASN 248 Cb 0.25 0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.44 1pam n ASN 248 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pam n TYR 249 N -0.56 0.00 -3.42 3.10 9.36 -0.39 -4.99 117.16 120.26 1pam n TYR 249 Ca 0.16 0.00 -0.27 0.00 3.32 0.00 0.00 57.90 61.10 1pam n TYR 249 Cb 0.31 0.00 -0.11 0.00 -0.63 0.00 0.00 39.34 38.91 1pam n TYR 249 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 1pam s LYS 250 N -0.81 0.73 0.19 2.98 1.02 0.05 -5.10 119.74 118.82 1pam s LYS 250 Ca 0.00 -1.72 -0.32 0.00 0.02 0.00 0.00 55.97 53.95 1pam s LYS 250 Cb 0.00 -1.33 -0.11 0.00 -0.52 0.00 0.00 37.83 35.87 1pam s LYS 250 CO 0.00 -1.30 1.67 -1.25 -0.92 0.00 0.00 175.35 173.54 1pam s PRO 251 N 0.55 4.15 0.06 -1.68 0.04 -1.17 -4.71 135.00 132.24 1pam s PRO 251 Ca 0.26 2.52 0.00 0.00 0.04 0.00 0.00 61.00 63.83 1pam s PRO 251 Cb -0.09 -3.10 -0.04 0.00 0.04 0.00 0.00 34.50 31.32 1pam s PRO 251 CO -0.10 -0.70 -0.05 0.14 0.04 0.00 0.00 177.00 176.33 1pam s VAL 252 N 1.15 0.39 0.04 -0.36 -7.23 -1.26 -4.53 120.40 108.60 1pam s VAL 252 Ca 0.73 -1.59 -0.30 0.00 -1.81 0.00 0.00 61.98 59.01 1pam s VAL 252 Cb -0.48 -1.23 -0.09 0.00 0.56 0.00 0.00 36.38 35.15 1pam s VAL 252 CO 0.32 -0.79 1.93 0.12 -0.31 0.00 0.00 175.10 176.37 1pam s PHE 253 N -3.06 1.41 -0.04 2.82 5.36 0.21 -4.85 117.98 119.83 1pam s PHE 253 Ca 0.02 -0.38 0.05 0.00 -0.96 0.00 0.00 56.93 55.66 1pam s PHE 253 Cb 0.02 -4.22 -0.01 0.00 -0.34 0.00 0.00 43.02 38.47 1pam s PHE 253 CO -0.05 -5.40 -0.19 0.99 -1.46 0.00 0.00 175.22 169.10 1pam s THR 254 N 4.26 1.56 0.01 0.12 2.01 -1.26 -1.04 115.64 121.30 1pam s THR 254 Ca 0.87 -0.80 -0.08 0.00 0.31 0.00 0.00 61.69 61.98 1pam s THR 254 Cb -0.42 -1.33 0.00 0.00 0.01 0.00 0.00 72.50 70.76 1pam s THR 254 CO 0.40 0.44 0.16 0.72 -0.69 0.00 0.00 174.62 175.66 1pam s PHE 255 N -0.12 0.04 0.45 4.92 -0.71 -0.64 -2.08 117.98 119.84 1pam s PHE 255 Ca -0.01 -0.16 0.05 0.00 -1.04 0.00 0.00 56.93 55.77 1pam s PHE 255 Cb -0.11 -0.04 -0.05 0.00 -1.21 0.00 0.00 43.02 41.61 1pam s PHE 255 CO 0.02 -0.34 0.06 0.20 -1.34 0.00 0.00 175.22 173.82 1pam s GLY 256 N -1.61 2.63 -0.23 1.99 0.00 -0.20 -1.05 107.32 108.85 1pam s GLY 256 Ca -0.12 -1.65 -0.06 0.00 0.00 0.00 0.00 44.72 42.89 1pam s GLY 256 CO 0.00 -2.09 0.04 1.85 0.00 0.00 0.00 173.10 172.90 1pam s GLU 257 N -3.82 3.65 -0.22 2.90 2.12 -0.81 -1.09 118.70 121.43 1pam s GLU 257 Ca 0.27 -0.49 -0.03 0.00 0.36 0.00 0.00 54.97 55.08 1pam s GLU 257 Cb 0.06 -3.23 0.07 0.00 0.26 0.00 0.00 34.13 31.29 1pam s GLU 257 CO 0.14 -0.10 0.07 -0.46 -0.54 0.00 0.00 175.26 174.37 1pam s TRP 258 N 1.35 0.85 0.37 5.30 -0.11 -1.26 -2.86 118.94 122.57 1pam s TRP 258 Ca 0.05 -0.88 -0.27 0.00 1.22 0.00 0.00 56.10 56.22 1pam s TRP 258 Cb -0.15 -1.04 -0.09 0.00 -1.50 0.00 0.00 33.47 30.69 1pam s TRP 258 CO 0.02 -0.66 1.21 0.12 -4.62 0.00 0.00 176.95 173.02 1pam s PHE 259 N 1.92 3.11 -0.03 5.86 2.19 -1.26 -4.80 117.98 124.97 1pam s PHE 259 Ca 0.03 1.53 0.02 0.00 0.33 0.00 0.00 56.93 58.83 1pam s PHE 259 Cb -0.17 -3.48 0.01 0.00 -1.31 0.00 0.00 43.02 38.07 1pam s PHE 259 CO -0.15 -1.43 -0.07 -0.51 1.83 0.00 0.00 175.22 174.89 1pam s LEU 260 N -2.17 1.71 0.94 6.12 1.43 -1.26 -5.11 118.68 120.34 1pam s LEU 260 Ca 0.53 -0.16 -0.15 0.00 -1.03 0.00 0.00 54.13 53.32 1pam s LEU 260 Cb -0.34 -0.49 0.18 0.00 0.03 0.00 0.00 46.19 45.58 1pam s LEU 260 CO 0.44 0.04 1.30 -0.83 0.23 0.00 0.00 176.35 177.53 1pam s GLY 261 N 0.32 1.76 0.19 -3.19 0.00 -1.26 -4.88 107.32 100.25 1pam s GLY 261 Ca -0.05 -1.13 -0.32 0.00 0.00 0.00 0.00 44.72 43.23 1pam s GLY 261 CO 0.00 -0.40 1.63 0.14 0.00 0.00 0.00 173.10 174.48 1pam s VAL 262 N -3.85 2.32 -2.14 1.40 1.01 -1.26 -2.05 120.40 115.83 1pam s VAL 262 Ca 0.72 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.94 1pam s VAL 262 Cb -0.05 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.18 1pam s VAL 262 CO 0.52 0.02 0.00 0.59 0.00 0.00 0.00 175.10 176.23 1pam n ASN 263 N 3.83 -5.50 -4.67 3.32 3.02 -1.26 -4.97 115.26 109.02 1pam n ASN 263 Ca 0.14 0.46 -0.37 0.00 -0.03 0.00 0.00 54.58 54.78 1pam n ASN 263 Cb 0.37 -4.78 -0.08 0.00 -0.61 0.00 0.00 39.78 34.68 1pam n ASN 263 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1pam s GLU 264 N -3.84 4.16 -0.08 3.52 2.12 -0.87 -5.05 118.70 118.65 1pam s GLU 264 Ca 0.00 0.06 0.02 0.00 0.36 0.00 0.00 54.97 55.41 1pam s GLU 264 Cb 0.00 -3.52 0.01 0.00 0.26 0.00 0.00 34.13 30.88 1pam s GLU 264 CO 0.00 0.02 -0.13 0.42 -0.54 0.00 0.00 175.26 175.03 1pam s ILE 265 N 1.14 1.28 -0.11 -3.70 1.01 -1.26 -4.74 121.20 114.82 1pam s ILE 265 Ca 0.16 -0.54 0.01 0.00 0.00 0.00 0.00 60.65 60.27 1pam s ILE 265 Cb -0.14 -1.17 0.02 0.00 0.01 0.00 0.00 42.46 41.17 1pam s ILE 265 CO 0.06 0.39 -0.14 -0.55 0.00 0.00 0.00 174.94 174.71 1pam s SER 266 N 0.79 2.34 0.35 3.58 0.15 -1.26 -5.02 113.70 114.63 1pam s SER 266 Ca -0.12 -0.40 0.09 0.00 0.70 0.00 0.00 55.95 56.22 1pam s SER 266 Cb -0.16 -1.03 0.65 0.00 -1.71 0.00 0.00 66.02 63.78 1pam s SER 266 CO 0.02 -0.01 1.82 1.55 1.20 0.00 0.00 173.24 177.83 1pam h PRO 267 N 7.51 0.21 -0.35 5.44 0.13 -1.99 -2.42 132.00 140.53 1pam h PRO 267 Ca -0.32 -0.07 -0.12 0.00 -0.87 0.00 0.00 66.00 64.62 1pam h PRO 267 Cb 1.17 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 1pam h PRO 267 CO 0.48 0.47 -0.28 0.93 -0.23 0.00 0.00 178.00 179.37 1pam h GLU 268 N 0.19 0.72 0.17 0.86 3.07 -1.98 0.33 114.58 117.93 1pam h GLU 268 Ca 0.03 -0.31 0.01 0.00 -0.50 0.00 0.00 59.36 58.58 1pam h GLU 268 Cb 0.58 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.44 1pam h GLU 268 CO 0.04 0.92 -0.20 -0.92 -1.40 0.00 0.00 179.01 177.45 1pam h TYR 269 N 0.62 -0.52 -0.38 4.33 5.03 -1.95 -0.39 116.97 123.71 1pam h TYR 269 Ca 0.08 0.01 -0.10 0.00 2.58 0.00 0.00 58.73 61.29 1pam h TYR 269 Cb 0.79 0.21 -0.02 0.00 1.55 0.00 0.00 36.73 39.26 1pam h TYR 269 CO 0.04 -0.29 -0.17 0.45 -1.32 0.00 0.00 178.16 176.87 1pam h HIS 270 N -0.41 0.79 -0.83 -3.82 3.86 -1.20 -2.48 115.15 111.07 1pam h HIS 270 Ca 0.01 -0.16 -0.01 0.00 -1.16 0.00 0.00 60.37 59.05 1pam h HIS 270 Cb 0.40 -0.20 -0.04 0.00 1.06 0.00 0.00 27.41 28.63 1pam h HIS 270 CO -0.16 0.83 0.46 0.37 0.86 0.00 0.00 177.93 180.29 1pam h GLN 271 N 0.63 1.15 0.03 2.45 4.15 -0.75 -1.81 115.11 120.96 1pam h GLN 271 Ca 0.10 -0.13 -0.00 0.00 0.77 0.00 0.00 58.65 59.39 1pam h GLN 271 Cb 0.64 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 28.10 1pam h GLN 271 CO 0.05 0.84 -0.02 0.35 -1.93 0.00 0.00 178.83 178.12 1pam h PHE 272 N 1.15 -0.04 -0.54 3.99 3.57 -0.76 0.24 116.94 124.54 1pam h PHE 272 Ca 0.29 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.82 1pam h PHE 272 Cb 0.02 0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.74 1pam h PHE 272 CO 0.00 0.01 0.36 0.00 -2.23 0.00 0.00 178.31 176.45 1pam h ALA 273 N 0.89 1.71 0.00 2.41 0.00 -1.23 0.22 119.26 123.25 1pam h ALA 273 Ca -0.00 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 1pam h ALA 273 Cb 0.07 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1pam h ALA 273 CO 0.01 0.24 -0.75 -0.91 0.00 0.00 0.00 179.25 177.83 1pam h ASN 274 N 0.64 0.00 0.00 0.00 2.35 -0.92 -3.40 115.58 114.25 1pam h ASN 274 Ca 0.21 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 1pam h ASN 274 Cb 0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.43 1pam h ASN 274 CO -0.05 0.35 0.00 -0.62 -1.65 0.00 0.00 177.43 175.46 1pam n GLU 275 N -3.02 3.84 0.10 0.81 1.02 0.04 -4.79 120.64 118.65 1pam n GLU 275 Ca -0.01 -0.09 -0.03 0.00 -0.02 0.00 0.00 57.16 57.01 1pam n GLU 275 Cb 0.70 -0.50 -0.01 0.00 -0.02 0.00 0.00 31.44 31.62 1pam n GLU 275 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1pam h SER 276 N 0.00 0.00 0.00 1.62 4.64 -1.14 -3.47 113.55 115.20 1pam h SER 276 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1pam h SER 276 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1pam h SER 276 CO 0.00 0.76 0.00 0.61 -0.87 0.00 0.00 176.83 177.33 1pam n GLY 277 N 1.09 1.26 3.44 -0.77 0.00 -1.26 -4.45 105.19 104.49 1pam n GLY 277 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 1pam n GLY 277 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1pam s MET 278 N -0.67 1.60 0.00 1.61 0.23 -1.26 -4.79 119.30 116.01 1pam s MET 278 Ca 0.00 -1.74 0.00 0.00 -1.03 0.00 0.00 55.69 52.92 1pam s MET 278 Cb 0.00 -1.56 0.00 0.00 -1.53 0.00 0.00 34.83 31.74 1pam s MET 278 CO 0.00 0.25 0.00 -1.13 -2.03 0.00 0.00 175.02 172.11 1pam n SER 279 N -0.58 0.00 -4.05 -1.18 3.41 -0.88 -4.49 113.62 105.86 1pam n SER 279 Ca -0.06 -0.62 -0.08 0.00 -0.26 0.00 0.00 58.87 57.85 1pam n SER 279 Cb 0.61 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.45 1pam n SER 279 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1pam s LEU 280 N 0.00 2.38 0.20 1.04 1.43 -1.26 -1.04 118.68 121.44 1pam s LEU 280 Ca 0.00 -0.80 -0.30 0.00 -1.03 0.00 0.00 54.13 51.99 1pam s LEU 280 Cb 0.00 0.17 -0.09 0.00 0.03 0.00 0.00 46.19 46.29 1pam s LEU 280 CO 0.00 -0.48 1.42 -0.76 0.23 0.00 0.00 176.35 176.76 1pam s LEU 281 N -2.35 4.39 -1.22 1.79 1.43 -0.25 -1.67 118.68 120.80 1pam s LEU 281 Ca -0.02 2.54 -0.13 0.00 -1.03 0.00 0.00 54.13 55.49 1pam s LEU 281 Cb 0.01 -3.61 0.17 0.00 0.03 0.00 0.00 46.19 42.79 1pam s LEU 281 CO -0.06 -0.67 1.51 -0.67 0.23 0.00 0.00 176.35 176.68 1pam n ASP 282 N 2.91 5.21 0.14 2.29 -0.08 0.12 -4.76 116.55 122.38 1pam n ASP 282 Ca 0.08 -3.00 -0.00 0.00 -1.51 0.00 0.00 54.79 50.36 1pam n ASP 282 Cb 0.41 -1.55 0.27 0.00 2.34 0.00 0.00 41.12 42.58 1pam n ASP 282 CO 0.00 0.00 0.00 -0.26 0.12 0.00 0.00 177.20 177.06 1pam h PHE 283 N 6.90 0.13 -0.72 -0.67 -1.00 -1.87 -1.44 116.94 118.27 1pam h PHE 283 Ca 0.33 -0.03 0.05 0.00 2.81 0.00 0.00 57.97 61.13 1pam h PHE 283 Cb 0.83 -0.03 -0.05 0.00 3.61 0.00 0.00 35.95 40.31 1pam h PHE 283 CO 1.12 0.53 0.42 -0.09 -1.61 0.00 0.00 178.31 178.68 1pam h ARG 284 N 0.09 0.77 0.23 1.51 2.43 -1.90 -0.60 114.38 116.92 1pam h ARG 284 Ca 0.01 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.12 1pam h ARG 284 Cb 0.80 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 1pam h ARG 284 CO 0.06 0.51 -0.11 0.35 -1.51 0.00 0.00 179.97 179.27 1pam h PHE 285 N 0.79 -0.29 -0.58 2.20 3.04 -1.83 -3.06 116.94 117.21 1pam h PHE 285 Ca 0.31 -0.01 0.04 0.00 3.98 0.00 0.00 57.97 62.29 1pam h PHE 285 Cb 0.13 0.10 -0.04 0.00 2.56 0.00 0.00 35.95 38.70 1pam h PHE 285 CO -0.06 0.01 0.32 0.00 -2.02 0.00 0.00 178.31 176.57 1pam h ALA 286 N 0.07 0.75 -0.42 2.41 0.00 -0.92 -0.07 119.26 121.08 1pam h ALA 286 Ca -0.03 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1pam h ALA 286 Cb 0.44 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1pam h ALA 286 CO 0.05 0.01 0.02 1.96 0.00 0.00 0.00 179.25 181.29 1pam h GLN 287 N 0.62 0.74 -0.24 0.00 1.08 -1.20 -1.07 115.11 115.04 1pam h GLN 287 Ca 0.25 -0.23 -0.09 0.00 -1.45 0.00 0.00 58.65 57.13 1pam h GLN 287 Cb 0.11 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 27.46 1pam h GLN 287 CO -0.14 0.81 -0.19 -0.22 -0.95 0.00 0.00 178.83 178.13 1pam h LYS 288 N 0.58 0.55 -0.92 1.46 1.63 -1.39 -1.58 116.57 116.90 1pam h LYS 288 Ca 0.12 -0.27 0.11 0.00 -0.85 0.00 0.00 60.65 59.76 1pam h LYS 288 Cb 0.46 0.00 -0.07 0.00 -0.60 0.00 0.00 32.23 32.02 1pam h LYS 288 CO 0.02 0.85 0.59 0.00 -3.45 0.00 0.00 179.45 177.46 1pam h ALA 289 N 0.69 1.64 -0.14 5.00 0.00 -0.86 -1.23 119.26 124.36 1pam h ALA 289 Ca 0.04 0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.79 1pam h ALA 289 Cb 0.73 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1pam h ALA 289 CO 0.05 0.15 -0.61 0.00 0.00 0.00 0.00 179.25 178.84 1pam h ARG 290 N 0.88 0.47 -0.75 0.00 3.08 -0.91 0.42 114.38 117.58 1pam h ARG 290 Ca 0.44 -0.33 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 1pam h ARG 290 Cb 0.48 0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.54 1pam h ARG 290 CO -0.20 0.94 0.47 1.96 -1.07 0.00 0.00 179.97 182.06 1pam h GLN 291 N 0.35 1.01 0.10 0.04 4.20 -0.43 0.58 115.11 120.96 1pam h GLN 291 Ca -0.01 -0.08 -0.20 0.00 0.06 0.00 0.00 58.65 58.42 1pam h GLN 291 Cb 1.16 -0.22 0.01 0.00 0.30 0.00 0.00 27.48 28.73 1pam h GLN 291 CO 0.11 0.70 -0.97 0.28 -0.67 0.00 0.00 178.83 178.28 1pam h VAL 292 N 1.02 1.33 0.00 -0.54 2.07 -1.14 0.17 116.25 119.17 1pam h VAL 292 Ca 0.27 -2.44 0.00 0.00 0.82 0.00 0.00 66.70 65.35 1pam h VAL 292 Cb -0.06 2.98 0.00 0.00 -1.52 0.00 0.00 31.29 32.69 1pam h VAL 292 CO -0.05 0.67 -1.39 0.49 0.02 0.00 0.00 177.57 177.30 1pam n PHE 293 N -4.13 0.32 -0.03 1.57 3.72 0.13 -4.34 117.46 114.70 1pam n PHE 293 Ca -0.19 0.09 -0.07 0.00 -0.05 0.00 0.00 57.45 57.24 1pam n PHE 293 Cb 0.80 -0.56 -0.02 0.00 -0.94 0.00 0.00 39.48 38.75 1pam n PHE 293 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 1pam n ARG 294 N -2.22 0.23 0.06 -1.08 0.63 -0.19 -4.82 116.66 109.27 1pam n ARG 294 Ca -0.01 0.09 0.11 0.00 -0.92 0.00 0.00 57.85 57.12 1pam n ARG 294 Cb 0.51 -0.89 -0.07 0.00 0.45 0.00 0.00 32.46 32.46 1pam n ARG 294 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1pam n ASP 295 N -3.75 0.54 -3.21 6.15 8.00 0.02 -4.99 116.55 119.31 1pam n ASP 295 Ca -0.12 0.21 -0.20 0.00 0.71 0.00 0.00 54.79 55.39 1pam n ASP 295 Cb 0.38 1.00 0.07 0.00 -0.02 0.00 0.00 41.12 42.56 1pam n ASP 295 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1pam n ASN 296 N -2.54 -5.15 -1.17 -2.24 5.15 0.45 -4.91 115.26 104.86 1pam n ASN 296 Ca -0.02 -0.49 0.09 0.00 -0.60 0.00 0.00 54.58 53.56 1pam n ASN 296 Cb 0.57 -4.51 0.28 0.00 -0.53 0.00 0.00 39.78 35.60 1pam n ASN 296 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1pam n THR 297 N -4.53 1.32 -3.84 -0.44 -2.24 -0.26 -4.97 114.28 99.32 1pam n THR 297 Ca -0.04 -1.12 -0.07 0.00 -2.27 0.00 0.00 64.05 60.55 1pam n THR 297 Cb 0.57 0.35 -0.01 0.00 -2.10 0.00 0.00 70.33 69.14 1pam n THR 297 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1pam s ASP 298 N -1.05 -0.20 0.08 3.42 -1.08 -1.21 -4.96 116.67 111.67 1pam s ASP 298 Ca 0.41 -0.66 0.00 0.00 -0.52 0.00 0.00 52.55 51.79 1pam s ASP 298 Cb 0.24 0.71 -0.00 0.00 -1.46 0.00 0.00 42.92 42.41 1pam s ASP 298 CO 0.24 -1.33 0.02 -0.46 0.52 0.00 0.00 175.17 174.15 1pam n ASN 299 N -0.62 1.40 0.19 -0.34 0.23 -1.26 -4.39 115.26 110.47 1pam n ASN 299 Ca -0.05 -1.38 0.15 0.00 -0.53 0.00 0.00 54.58 52.76 1pam n ASN 299 Cb 0.59 0.14 0.75 0.00 -2.08 0.00 0.00 39.78 39.19 1pam n ASN 299 CO 0.00 0.00 0.00 0.24 -0.93 0.00 0.00 177.26 176.57 1pam h MET 300 N 0.00 0.00 -0.02 -3.83 2.86 -1.51 -0.65 114.93 111.78 1pam h MET 300 Ca -0.06 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.49 1pam h MET 300 Cb 0.22 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 1pam h MET 300 CO 0.10 0.00 -0.41 1.88 1.06 0.00 0.00 176.91 179.54 1pam h TYR 301 N 0.00 0.05 -0.16 -0.22 0.05 -1.84 0.32 116.97 115.17 1pam h TYR 301 Ca 0.08 -0.01 -0.16 0.00 0.05 0.00 0.00 58.73 58.68 1pam h TYR 301 Cb 0.37 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 38.10 1pam h TYR 301 CO 0.00 0.45 -0.59 0.78 -1.05 0.00 0.00 178.16 177.75 1pam h GLY 302 N 1.24 0.57 0.94 3.88 0.00 -1.51 -1.21 103.07 106.97 1pam h GLY 302 Ca 0.00 -0.69 -0.03 0.00 0.00 0.00 0.00 47.33 46.62 1pam h GLY 302 CO 0.06 0.61 0.14 -2.00 0.00 0.00 0.00 176.54 175.35 1pam h LEU 303 N 0.39 0.55 -0.41 3.11 5.85 -1.24 -1.10 115.31 122.45 1pam h LEU 303 Ca -0.00 -0.18 0.05 0.00 0.84 0.00 0.00 57.88 58.59 1pam h LEU 303 Cb 1.13 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.97 1pam h LEU 303 CO 0.11 0.58 0.14 0.50 -0.34 0.00 0.00 178.44 179.43 1pam h LYS 304 N 0.48 0.30 -0.26 1.25 3.64 -0.80 -0.81 116.57 120.37 1pam h LYS 304 Ca 0.13 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.41 1pam h LYS 304 Cb 0.21 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 1pam h LYS 304 CO -0.01 0.20 -0.19 0.00 -2.27 0.00 0.00 179.45 177.18 1pam h ALA 305 N 1.27 1.21 -0.19 5.00 0.00 -0.96 -0.69 119.26 124.90 1pam h ALA 305 Ca 0.19 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1pam h ALA 305 Cb 0.18 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1pam h ALA 305 CO -0.20 0.51 0.03 1.98 0.00 0.00 0.00 179.25 181.58 1pam h MET 306 N 0.41 0.31 -0.55 0.00 1.85 -0.68 0.04 114.93 116.31 1pam h MET 306 Ca 0.07 -0.08 -0.03 0.00 -0.61 0.00 0.00 59.70 59.05 1pam h MET 306 Cb 0.56 -0.04 -0.02 0.00 0.43 0.00 0.00 31.60 32.53 1pam h MET 306 CO 0.04 0.47 0.22 -0.07 -0.40 0.00 0.00 176.91 177.16 1pam h LEU 307 N 0.10 0.76 -0.21 3.39 3.38 -0.79 0.13 115.31 122.07 1pam h LEU 307 Ca 0.06 -0.17 -0.20 0.00 0.09 0.00 0.00 57.88 57.66 1pam h LEU 307 Cb 0.31 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 40.86 1pam h LEU 307 CO 0.00 0.73 -0.64 -0.33 0.09 0.00 0.00 178.44 178.28 1pam h GLU 308 N 0.75 0.80 -0.38 1.13 5.08 -1.07 -2.83 114.58 118.06 1pam h GLU 308 Ca 0.18 -0.59 -0.12 0.00 -1.00 0.00 0.00 59.36 57.84 1pam h GLU 308 Cb 0.21 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1pam h GLU 308 CO -0.01 1.21 -0.24 0.78 -1.00 0.00 0.00 179.01 179.74 1pam h GLY 309 N 0.55 0.90 2.00 -3.84 0.00 -0.88 -3.18 103.07 98.61 1pam h GLY 309 Ca -0.02 -0.84 -0.10 0.00 0.00 0.00 0.00 47.33 46.36 1pam h GLY 309 CO 0.14 0.76 -0.49 1.48 0.00 0.00 0.00 176.54 178.43 1pam h SER 310 N 0.62 0.00 0.01 0.19 4.64 -1.01 -1.52 113.55 116.49 1pam h SER 310 Ca 0.08 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1pam h SER 310 Cb 0.80 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.89 1pam h SER 310 CO 0.07 0.49 -0.01 -0.08 -0.87 0.00 0.00 176.83 176.42 1pam h GLU 311 N 0.00 0.00 0.08 4.77 4.81 -1.48 -1.72 114.58 121.04 1pam h GLU 311 Ca -0.00 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 58.94 1pam h GLU 311 Cb 1.00 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.36 1pam h GLU 311 CO 0.06 0.01 -1.52 0.28 -0.73 0.00 0.00 179.01 177.11 1pam h VAL 312 N 0.00 0.87 0.00 0.32 2.07 -1.49 -3.40 116.25 114.63 1pam h VAL 312 Ca -0.00 -2.30 -0.11 0.00 0.82 0.00 0.00 66.70 65.10 1pam h VAL 312 Cb 0.02 2.49 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 1pam h VAL 312 CO 0.00 0.63 -0.53 0.44 0.02 0.00 0.00 177.57 178.13 1pam h ASP 313 N -0.43 0.00 -3.46 0.57 3.32 -1.14 -3.40 116.42 111.87 1pam h ASP 313 Ca -0.35 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.10 1pam h ASP 313 Cb 1.68 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 41.12 1pam h ASP 313 CO -0.02 0.53 0.03 -0.31 -1.72 0.00 0.00 179.24 177.74 1pam s TYR 314 N -3.75 3.36 0.34 4.55 2.02 -0.66 -4.92 117.35 118.29 1pam s TYR 314 Ca -0.02 0.81 0.09 0.00 -0.37 0.00 0.00 57.07 57.59 1pam s TYR 314 Cb 0.13 -2.73 0.62 0.00 -0.40 0.00 0.00 41.96 39.58 1pam s TYR 314 CO 0.74 -0.16 1.80 0.00 -1.57 0.00 0.00 175.55 176.36 1pam h ALA 315 N 7.55 1.30 -2.70 3.71 0.00 -1.88 -3.30 119.26 123.93 1pam h ALA 315 Ca -0.32 -0.33 -0.61 0.00 0.00 0.00 0.00 54.91 53.65 1pam h ALA 315 Cb 1.15 -0.08 -0.41 0.00 0.00 0.00 0.00 17.79 18.45 1pam h ALA 315 CO 0.75 0.49 -0.73 1.04 0.00 0.00 0.00 179.25 180.80 1pam n GLN 316 N -4.11 1.36 0.29 0.00 3.00 -1.26 -4.94 117.38 111.71 1pam n GLN 316 Ca -0.01 -4.04 0.16 0.00 -0.01 0.00 0.00 57.00 53.10 1pam n GLN 316 Cb 0.40 -2.03 0.89 0.00 0.00 0.00 0.00 30.24 29.49 1pam n GLN 316 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.06 176.82 1pam h VAL 317 N 4.17 0.37 0.00 5.09 3.04 -1.88 -1.71 116.25 125.33 1pam h VAL 317 Ca 0.19 -0.28 0.00 0.00 -1.01 0.00 0.00 66.70 65.60 1pam h VAL 317 Cb 0.80 1.20 0.00 0.00 -2.01 0.00 0.00 31.29 31.27 1pam h VAL 317 CO 0.61 0.05 0.00 0.59 -1.01 0.00 0.00 177.57 177.81 1pam n ASN 318 N -3.50 0.00 -0.80 3.17 3.02 -1.26 -2.40 115.26 113.49 1pam n ASN 318 Ca -0.02 0.17 0.12 0.00 -0.03 0.00 0.00 54.58 54.82 1pam n ASN 318 Cb 0.17 -0.36 0.13 0.00 -0.61 0.00 0.00 39.78 39.11 1pam n ASN 318 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1pam n ASP 319 N -1.36 2.60 -4.79 6.41 8.00 -0.64 -4.31 116.55 122.46 1pam n ASP 319 Ca 0.08 -1.82 -0.38 0.00 0.71 0.00 0.00 54.79 53.38 1pam n ASP 319 Cb 0.18 0.10 -0.06 0.00 -0.02 0.00 0.00 41.12 41.32 1pam n ASP 319 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1pam s GLN 320 N -2.11 4.51 -0.35 -1.24 -1.52 -1.01 -4.56 119.66 113.38 1pam s GLN 320 Ca 0.27 1.14 -0.16 0.00 -1.95 0.00 0.00 55.36 54.66 1pam s GLN 320 Cb 0.20 -3.09 -0.01 0.00 -0.22 0.00 0.00 33.01 29.89 1pam s GLN 320 CO 0.36 0.48 0.40 0.08 -0.25 0.00 0.00 175.29 176.36 1pam s VAL 321 N -1.32 5.13 0.34 1.09 1.01 -0.67 -0.09 120.40 125.89 1pam s VAL 321 Ca 0.40 0.11 0.03 0.00 0.00 0.00 0.00 61.98 62.52 1pam s VAL 321 Cb -0.21 -3.86 -0.02 0.00 0.00 0.00 0.00 36.38 32.29 1pam s VAL 321 CO 0.25 -0.13 0.51 0.42 0.00 0.00 0.00 175.10 176.15 1pam s THR 322 N 2.11 4.71 -0.07 3.92 -4.23 -0.40 0.13 115.64 121.81 1pam s THR 322 Ca 0.13 -0.70 -0.32 0.00 -1.18 0.00 0.00 61.69 59.63 1pam s THR 322 Cb -0.16 -3.69 0.12 0.00 1.34 0.00 0.00 72.50 70.11 1pam s THR 322 CO 0.12 -0.38 1.24 0.72 -0.54 0.00 0.00 174.62 175.78 1pam s PHE 323 N -2.26 -0.08 -0.24 3.99 -0.71 -1.26 -0.73 117.98 116.69 1pam s PHE 323 Ca 0.41 -0.01 0.06 0.00 -1.04 0.00 0.00 56.93 56.35 1pam s PHE 323 Cb -0.10 0.54 -0.07 0.00 -1.21 0.00 0.00 43.02 42.19 1pam s PHE 323 CO 0.34 -0.28 0.23 0.44 -1.34 0.00 0.00 175.22 174.61 1pam n ILE 324 N -0.34 0.00 -3.71 -4.49 -5.35 -1.26 -4.01 119.36 100.19 1pam n ILE 324 Ca -0.05 -0.34 -0.05 0.00 -0.27 0.00 0.00 62.75 62.04 1pam n ILE 324 Cb 0.61 0.93 -0.01 0.00 -1.74 0.00 0.00 39.64 39.42 1pam n ILE 324 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 1pam s ASP 325 N -1.67 -0.22 0.00 7.28 1.47 -1.26 -4.72 116.67 117.55 1pam s ASP 325 Ca 0.02 -0.33 0.00 0.00 1.18 0.00 0.00 52.55 53.41 1pam s ASP 325 Cb 0.04 0.48 0.00 0.00 -0.34 0.00 0.00 42.92 43.11 1pam s ASP 325 CO 0.24 -0.87 0.00 -0.46 0.68 0.00 0.00 175.17 174.75 1pam n ASN 326 N -0.43 0.00 0.33 2.11 0.23 -1.26 -4.50 115.26 111.74 1pam n ASN 326 Ca -0.07 -0.69 0.19 0.00 -0.53 0.00 0.00 54.58 53.48 1pam n ASN 326 Cb 0.61 0.00 1.01 0.00 -2.08 0.00 0.00 39.78 39.32 1pam n ASN 326 CO 0.00 0.00 0.00 1.12 -0.93 0.00 0.00 177.26 177.45 1pam h HIS 327 N 0.69 0.00 -0.38 -2.53 2.07 -1.99 -2.87 115.15 110.14 1pam h HIS 327 Ca 0.00 0.00 -0.09 0.00 -2.85 0.00 0.00 60.37 57.43 1pam h HIS 327 Cb 0.00 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 29.93 1pam h HIS 327 CO 0.00 0.00 0.04 -0.25 -3.07 0.00 0.00 177.93 174.65 1pam n ASP 328 N -2.94 3.76 -3.86 3.10 8.00 -1.26 -4.61 116.55 118.73 1pam n ASP 328 Ca -0.02 -3.24 -0.10 0.00 0.71 0.00 0.00 54.79 52.13 1pam n ASP 328 Cb 0.20 -0.61 -0.08 0.00 -0.02 0.00 0.00 41.12 40.61 1pam n ASP 328 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1pam s MET 329 N -2.97 0.71 0.52 -1.24 -1.94 -1.09 -5.00 119.30 108.30 1pam s MET 329 Ca 0.46 -0.73 -0.23 0.00 -1.71 0.00 0.00 55.69 53.48 1pam s MET 329 Cb 0.38 0.29 -0.06 0.00 2.01 0.00 0.00 34.83 37.45 1pam s MET 329 CO 0.08 -0.21 1.36 -1.21 -0.01 0.00 0.00 175.02 175.03 1pam s GLU 330 N -2.89 3.28 0.55 2.03 2.02 -1.26 -4.57 118.70 117.86 1pam s GLU 330 Ca -0.03 2.25 -0.21 0.00 0.02 0.00 0.00 54.97 57.01 1pam s GLU 330 Cb 0.00 -2.35 -0.06 0.00 0.10 0.00 0.00 34.13 31.83 1pam s GLU 330 CO -0.06 -1.08 1.14 0.54 0.02 0.00 0.00 175.26 175.82 1pam n ARG 331 N -0.83 1.29 0.09 1.61 5.12 -0.13 -4.78 116.66 119.04 1pam n ARG 331 Ca 0.09 0.48 -0.13 0.00 -1.93 0.00 0.00 57.85 56.36 1pam n ARG 331 Cb 0.44 -2.33 -0.08 0.00 -1.16 0.00 0.00 32.46 29.33 1pam n ARG 331 CO 0.00 0.00 0.00 0.35 -1.93 0.00 0.00 177.63 176.05 1pam h PHE 332 N 1.03 -0.21 -3.13 -1.55 3.04 -1.84 -3.42 116.94 110.86 1pam h PHE 332 Ca -0.49 -0.00 -0.53 0.00 3.98 0.00 0.00 57.97 60.93 1pam h PHE 332 Cb 1.33 0.07 0.03 0.00 2.56 0.00 0.00 35.95 39.94 1pam h PHE 332 CO 0.42 0.08 0.72 -1.58 -2.02 0.00 0.00 178.31 175.93 1pam s HIS 333 N -5.03 3.21 0.19 0.41 2.46 -1.26 -4.98 115.29 110.30 1pam s HIS 333 Ca -0.15 1.01 0.04 0.00 0.47 0.00 0.00 55.06 56.43 1pam s HIS 333 Cb 0.03 -3.69 -0.03 0.00 -0.13 0.00 0.00 32.58 28.76 1pam s HIS 333 CO 0.62 -2.34 0.32 0.95 -2.47 0.00 0.00 174.74 171.82 1pam s THR 334 N 0.73 5.29 0.22 0.89 -4.23 -1.26 -4.32 115.64 112.95 1pam s THR 334 Ca 0.62 -0.82 -0.31 0.00 -1.18 0.00 0.00 61.69 60.00 1pam s THR 334 Cb -0.38 -3.80 -0.11 0.00 1.34 0.00 0.00 72.50 69.56 1pam s THR 334 CO 0.34 -0.21 1.57 -0.94 -0.54 0.00 0.00 174.62 174.84 1pam s SER 335 N -3.58 6.53 -1.67 3.99 1.04 -1.26 -2.20 113.70 116.54 1pam s SER 335 Ca 0.34 2.73 -0.15 0.00 0.48 0.00 0.00 55.95 59.36 1pam s SER 335 Cb -0.10 -2.61 0.13 0.00 0.10 0.00 0.00 66.02 63.54 1pam s SER 335 CO 0.29 -0.84 0.62 -0.46 0.98 0.00 0.00 173.24 173.83 1pam n ASN 336 N 3.24 -2.16 -4.98 7.02 6.94 -1.26 -4.99 115.26 119.07 1pam n ASN 336 Ca 0.11 -1.07 -0.19 0.00 -0.02 0.00 0.00 54.58 53.41 1pam n ASN 336 Cb 0.38 -2.52 -0.01 0.00 -2.36 0.00 0.00 39.78 35.28 1pam n ASN 336 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1pam s GLY 337 N -3.57 1.65 -0.30 4.83 0.00 -0.94 -5.07 107.32 103.91 1pam s GLY 337 Ca 0.56 -1.50 -0.29 0.00 0.00 0.00 0.00 44.72 43.49 1pam s GLY 337 CO 0.94 -1.40 1.16 -0.35 0.00 0.00 0.00 173.10 173.45 1pam s ASP 338 N -4.18 6.86 0.56 1.64 -1.08 -1.26 -4.88 116.67 114.33 1pam s ASP 338 Ca 0.46 1.16 0.23 0.00 -0.52 0.00 0.00 52.55 53.88 1pam s ASP 338 Cb -0.09 -2.54 1.53 0.00 -1.46 0.00 0.00 42.92 40.36 1pam s ASP 338 CO 0.31 -0.93 2.17 0.03 0.52 0.00 0.00 175.17 177.27 1pam h ARG 339 N 8.46 0.00 0.00 4.34 3.08 -1.97 -1.44 114.38 126.85 1pam h ARG 339 Ca -0.23 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.81 1pam h ARG 339 Cb 1.08 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.12 1pam h ARG 339 CO 1.03 0.00 -0.06 -0.09 -1.07 0.00 0.00 179.97 179.78 1pam h ARG 340 N 0.00 0.00 -0.42 0.04 9.65 -1.99 -1.23 114.38 120.44 1pam h ARG 340 Ca 0.03 0.00 -0.05 0.00 -1.10 0.00 0.00 59.98 58.86 1pam h ARG 340 Cb 0.13 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.70 1pam h ARG 340 CO -0.00 0.06 0.06 0.87 2.80 0.00 0.00 179.97 183.75 1pam h LYS 341 N 0.00 0.70 -0.35 0.20 1.57 -1.57 -0.64 116.57 116.47 1pam h LYS 341 Ca -0.00 -0.19 -0.05 0.00 -1.87 0.00 0.00 60.65 58.53 1pam h LYS 341 Cb 0.19 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1pam h LYS 341 CO 0.01 0.75 0.02 1.25 -0.57 0.00 0.00 179.45 180.90 1pam h LEU 342 N 0.55 0.59 -0.52 2.94 5.85 -1.39 -1.88 115.31 121.45 1pam h LEU 342 Ca 0.13 -0.30 -0.05 0.00 0.84 0.00 0.00 57.88 58.50 1pam h LEU 342 Cb 0.39 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1pam h LEU 342 CO 0.01 0.74 0.13 -0.33 -0.34 0.00 0.00 178.44 178.65 1pam h GLU 343 N 0.42 0.83 -0.38 1.25 5.08 -1.22 -0.49 114.58 120.08 1pam h GLU 343 Ca 0.10 -0.20 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1pam h GLU 343 Cb 0.43 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1pam h GLU 343 CO 0.01 0.79 0.23 1.96 -1.00 0.00 0.00 179.01 181.00 1pam h GLN 344 N 0.73 0.51 -0.25 2.33 4.20 -1.06 -1.72 115.11 119.85 1pam h GLN 344 Ca 0.16 -0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.75 1pam h GLN 344 Cb 0.33 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 1pam h GLN 344 CO 0.00 0.39 -0.17 0.00 -0.67 0.00 0.00 178.83 178.37 1pam h ALA 345 N 1.10 1.25 -0.24 3.87 0.00 -1.13 0.78 119.26 124.88 1pam h ALA 345 Ca 0.13 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1pam h ALA 345 Cb 0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1pam h ALA 345 CO -0.03 0.49 0.04 -0.07 0.00 0.00 0.00 179.25 179.69 1pam h LEU 346 N 0.39 0.38 -0.92 0.00 3.38 -0.95 -0.96 115.31 116.64 1pam h LEU 346 Ca 0.07 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1pam h LEU 346 Cb 0.53 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 1pam h LEU 346 CO 0.03 0.55 0.58 0.00 0.09 0.00 0.00 178.44 179.69 1pam h ALA 347 N 0.85 1.17 -0.05 1.53 0.00 -0.95 -0.11 119.26 121.70 1pam h ALA 347 Ca 0.07 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1pam h ALA 347 Cb 0.32 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1pam h ALA 347 CO 0.00 0.61 -0.04 0.35 0.00 0.00 0.00 179.25 180.18 1pam h PHE 348 N 1.26 -0.08 -0.52 0.00 3.57 -0.69 -2.44 116.94 118.04 1pam h PHE 348 Ca 0.33 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.81 1pam h PHE 348 Cb -0.09 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 1pam h PHE 348 CO -0.00 -0.06 0.21 1.15 -2.23 0.00 0.00 178.31 177.39 1pam h THR 349 N -0.04 1.21 0.00 4.41 2.02 -0.65 -2.29 112.91 117.58 1pam h THR 349 Ca 0.03 -0.65 -0.04 0.00 0.77 0.00 0.00 66.41 66.52 1pam h THR 349 Cb 0.09 0.67 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 1pam h THR 349 CO -0.08 0.25 -0.18 -0.07 0.37 0.00 0.00 175.52 175.82 1pam h LEU 350 N 0.70 0.00 -1.96 2.58 3.38 -0.91 -2.69 115.31 116.41 1pam h LEU 350 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1pam h LEU 350 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1pam h LEU 350 CO -0.02 0.18 0.00 0.35 0.09 0.00 0.00 178.44 179.04 1pam n THR 351 N -3.81 0.20 -2.79 0.22 -2.24 -0.93 -4.89 114.28 100.04 1pam n THR 351 Ca -0.02 -0.60 -0.20 0.00 -2.27 0.00 0.00 64.05 60.96 1pam n THR 351 Cb 0.28 1.22 0.03 0.00 -2.10 0.00 0.00 70.33 69.76 1pam n THR 351 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1pam s SER 352 N -1.49 5.45 0.78 3.42 0.01 -0.88 -4.91 113.70 116.08 1pam s SER 352 Ca 0.26 -0.07 -0.12 0.00 1.31 0.00 0.00 55.95 57.33 1pam s SER 352 Cb 0.17 -0.92 0.07 0.00 0.21 0.00 0.00 66.02 65.54 1pam s SER 352 CO 0.25 -0.98 1.14 0.00 0.41 0.00 0.00 173.24 174.05 1pam s ARG 353 N -4.63 1.98 0.00 12.44 3.03 -1.26 -4.84 118.95 125.67 1pam s ARG 353 Ca 0.55 1.45 0.00 0.00 2.03 0.00 0.00 55.73 59.76 1pam s ARG 353 Cb -0.10 -1.84 0.00 0.00 -1.03 0.00 0.00 34.95 31.97 1pam s ARG 353 CO 0.37 -1.89 0.00 0.41 -1.13 0.00 0.00 175.30 173.06 1pam n GLY 354 N -0.32 0.05 2.90 3.88 0.00 -1.26 -4.85 105.19 105.60 1pam n GLY 354 Ca 0.11 -1.82 -0.30 0.00 0.00 0.00 0.00 46.02 44.01 1pam n GLY 354 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pam s VAL 355 N 0.00 1.42 0.24 1.61 1.01 0.87 -4.58 120.40 120.96 1pam s VAL 355 Ca 0.00 -1.30 -0.30 0.00 0.00 0.00 0.00 61.98 60.39 1pam s VAL 355 Cb 0.00 -1.80 -0.09 0.00 0.00 0.00 0.00 36.38 34.50 1pam s VAL 355 CO 0.00 -0.24 1.08 -2.16 0.00 0.00 0.00 175.10 173.78 1pam s PRO 356 N 1.42 4.65 -0.04 2.72 0.04 -1.26 -1.27 135.00 141.25 1pam s PRO 356 Ca -0.01 1.74 0.06 0.00 0.04 0.00 0.00 61.00 62.83 1pam s PRO 356 Cb -0.18 -3.23 -0.01 0.00 0.04 0.00 0.00 34.50 31.11 1pam s PRO 356 CO -0.09 0.19 -0.23 0.00 0.04 0.00 0.00 177.00 176.91 1pam s ALA 357 N -0.80 2.01 -0.14 8.56 0.00 0.09 -0.80 121.76 130.67 1pam s ALA 357 Ca 0.46 -0.99 -0.00 0.00 0.00 0.00 0.00 51.96 51.43 1pam s ALA 357 Cb -0.30 -0.59 -0.01 0.00 0.00 0.00 0.00 23.12 22.22 1pam s ALA 357 CO 0.38 0.42 -0.14 0.42 0.00 0.00 0.00 175.76 176.84 1pam s ILE 358 N -0.28 2.86 0.04 0.00 1.01 0.25 -4.44 121.20 120.65 1pam s ILE 358 Ca 0.01 -0.72 -0.30 0.00 0.00 0.00 0.00 60.65 59.64 1pam s ILE 358 Cb -0.12 -2.20 -0.05 0.00 0.01 0.00 0.00 42.46 40.10 1pam s ILE 358 CO 0.02 0.52 1.09 -0.47 0.00 0.00 0.00 174.94 176.10 1pam s TYR 359 N 0.62 3.55 0.26 3.97 5.04 -1.26 -0.85 117.35 128.68 1pam s TYR 359 Ca -0.08 1.50 -0.29 0.00 -2.44 0.00 0.00 57.07 55.77 1pam s TYR 359 Cb -0.16 -3.27 -0.15 0.00 0.35 0.00 0.00 41.96 38.74 1pam s TYR 359 CO 0.03 -0.65 0.98 2.48 -1.34 0.00 0.00 175.55 177.05 1pam n TYR 360 N 3.79 1.07 -0.33 4.97 4.11 -0.15 -1.49 117.16 129.13 1pam n TYR 360 Ca 0.07 0.73 0.00 0.00 -0.00 0.00 0.00 57.90 58.70 1pam n TYR 360 Cb 0.48 -2.22 0.00 0.00 -0.00 0.00 0.00 39.34 37.60 1pam n TYR 360 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1pam n GLY 361 N 1.44 1.66 0.37 -7.48 0.00 -1.26 -4.88 105.19 95.03 1pam n GLY 361 Ca 0.11 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.20 1pam n GLY 361 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1pam h SER 362 N 0.00 0.95 0.45 1.61 0.02 -1.62 -0.81 113.55 114.15 1pam h SER 362 Ca 0.00 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1pam h SER 362 Cb 0.00 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.39 1pam h SER 362 CO 0.00 0.53 0.00 -1.84 -1.14 0.00 0.00 176.83 174.38 1pam n GLU 363 N -4.59 0.06 -0.24 3.45 0.00 -1.26 -1.43 120.64 116.63 1pam n GLU 363 Ca 0.18 0.22 0.07 0.00 0.00 0.00 0.00 57.16 57.63 1pam n GLU 363 Cb 0.32 -1.50 0.19 0.00 0.00 0.00 0.00 31.44 30.45 1pam n GLU 363 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1pam n GLN 364 N -1.44 2.90 -3.72 3.44 1.13 -0.32 -4.20 117.38 115.16 1pam n GLN 364 Ca 0.05 -2.22 -0.23 0.00 -1.94 0.00 0.00 57.00 52.66 1pam n GLN 364 Cb 0.16 -1.37 0.04 0.00 0.11 0.00 0.00 30.24 29.17 1pam n GLN 364 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1pam n TYR 365 N 0.57 -2.09 -2.16 1.08 4.01 -0.51 -4.96 117.16 113.09 1pam n TYR 365 Ca 0.14 0.88 -0.41 0.00 -0.16 0.00 0.00 57.90 58.35 1pam n TYR 365 Cb 0.50 -4.39 -0.03 0.00 -0.31 0.00 0.00 39.34 35.11 1pam n TYR 365 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 1pam s MET 366 N -6.10 4.38 0.40 -0.72 -1.94 -1.13 -4.97 119.30 109.22 1pam s MET 366 Ca 0.20 2.14 0.06 0.00 -1.71 0.00 0.00 55.69 56.38 1pam s MET 366 Cb -0.10 -3.12 -0.08 0.00 2.01 0.00 0.00 34.83 33.54 1pam s MET 366 CO 0.80 -0.20 0.02 -1.54 -0.01 0.00 0.00 175.02 174.09 1pam s SER 367 N -0.16 3.69 0.00 3.03 1.04 -1.26 -4.36 113.70 115.68 1pam s SER 367 Ca 0.52 -1.38 0.00 0.00 0.48 0.00 0.00 55.95 55.57 1pam s SER 367 Cb -0.38 -0.33 0.00 0.00 0.10 0.00 0.00 66.02 65.41 1pam s SER 367 CO 0.46 -0.49 0.00 0.61 0.98 0.00 0.00 173.24 174.80 1pam n GLY 368 N -0.94 3.74 0.00 7.32 0.00 -1.26 -4.86 105.19 109.19 1pam n GLY 368 Ca -0.05 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1pam n GLY 368 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pam n GLY 369 N -1.22 0.27 3.79 -0.02 0.00 -1.26 -0.96 105.19 105.79 1pam n GLY 369 Ca 0.00 -1.63 -0.30 0.00 0.00 0.00 0.00 46.02 44.09 1pam n GLY 369 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1pam s ASN 370 N -1.00 4.38 -0.11 1.61 0.01 -1.26 -1.74 114.94 116.83 1pam s ASN 370 Ca 0.00 1.34 -0.20 0.00 -0.71 0.00 0.00 52.86 53.29 1pam s ASN 370 Cb 0.00 -2.07 -0.09 0.00 0.41 0.00 0.00 41.25 39.50 1pam s ASN 370 CO 0.00 -2.04 0.61 -0.67 -1.51 0.00 0.00 177.10 173.49 1pam n ASP 371 N -3.48 0.27 -0.76 -1.22 2.03 -1.26 -1.06 116.55 111.06 1pam n ASP 371 Ca 0.07 0.54 0.09 0.00 0.52 0.00 0.00 54.79 56.02 1pam n ASP 371 Cb 0.56 -0.42 0.28 0.00 -0.72 0.00 0.00 41.12 40.82 1pam n ASP 371 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1pam n PRO 372 N 1.25 1.97 0.14 -0.67 -0.04 -1.26 -4.93 135.00 131.47 1pam n PRO 372 Ca 0.12 -1.49 0.12 0.00 -0.04 0.00 0.00 63.50 62.21 1pam n PRO 372 Cb 0.01 -1.39 0.52 0.00 -0.04 0.00 0.00 33.50 32.59 1pam n PRO 372 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1pam h ASP 373 N 2.73 0.00 -0.19 3.54 3.32 -1.26 -0.67 116.42 123.89 1pam h ASP 373 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1pam h ASP 373 Cb 0.61 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.16 1pam h ASP 373 CO 0.00 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.06 1pam n ASN 374 N -2.31 1.81 -1.94 6.45 0.23 -0.71 -4.16 115.26 114.63 1pam n ASN 374 Ca 0.02 -1.75 -0.19 0.00 -0.53 0.00 0.00 54.58 52.13 1pam n ASN 374 Cb 0.23 -0.12 0.04 0.00 -2.08 0.00 0.00 39.78 37.85 1pam n ASN 374 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1pam n ARG 375 N 0.42 3.24 -1.38 -3.83 1.74 -0.26 -4.91 116.66 111.68 1pam n ARG 375 Ca 0.16 -4.01 -0.29 0.00 -0.77 0.00 0.00 57.85 52.93 1pam n ARG 375 Cb 0.35 -2.14 0.13 0.00 -1.02 0.00 0.00 32.46 29.78 1pam n ARG 375 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1pam s ALA 376 N -3.55 1.71 0.36 7.54 0.00 -1.26 -4.89 121.76 121.67 1pam s ALA 376 Ca 0.48 -0.26 -0.26 0.00 0.00 0.00 0.00 51.96 51.91 1pam s ALA 376 Cb 0.40 -3.12 -0.09 0.00 0.00 0.00 0.00 23.12 20.31 1pam s ALA 376 CO 0.02 -2.23 1.14 0.50 0.00 0.00 0.00 175.76 175.19 1pam s ARG 377 N -5.08 4.27 0.23 0.00 3.52 -1.26 -4.90 118.95 115.73 1pam s ARG 377 Ca 0.63 1.80 -0.30 0.00 -0.13 0.00 0.00 55.73 57.73 1pam s ARG 377 Cb -0.16 -2.83 -0.09 0.00 -1.56 0.00 0.00 34.95 30.31 1pam s ARG 377 CO 0.55 -0.12 1.10 -0.48 -0.81 0.00 0.00 175.30 175.54 1pam s LEU 378 N -2.16 4.53 0.00 -0.88 2.34 -0.81 -4.90 118.68 116.80 1pam s LEU 378 Ca 0.53 2.18 0.27 0.00 0.06 0.00 0.00 54.13 57.17 1pam s LEU 378 Cb -0.30 -3.62 0.80 0.00 -0.56 0.00 0.00 46.19 42.51 1pam s LEU 378 CO 0.38 -0.17 1.62 -0.81 -1.06 0.00 0.00 176.35 176.31 1pam n PRO 379 N 1.73 0.05 -3.53 1.48 -0.04 -1.26 -4.92 135.00 128.50 1pam n PRO 379 Ca 0.01 -0.02 -0.14 0.00 -0.04 0.00 0.00 63.50 63.31 1pam n PRO 379 Cb 0.45 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.36 1pam n PRO 379 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1pam s SER 380 N -2.96 -0.51 -0.27 3.54 0.15 -1.26 -5.03 113.70 107.35 1pam s SER 380 Ca 0.13 0.48 0.09 0.00 0.70 0.00 0.00 55.95 57.35 1pam s SER 380 Cb 0.18 0.44 0.45 0.00 -1.71 0.00 0.00 66.02 65.38 1pam s SER 380 CO 0.63 -0.53 1.27 0.49 1.20 0.00 0.00 173.24 176.29 1pam n PHE 381 N 0.65 1.33 -1.99 3.44 3.72 -1.26 -4.96 117.46 118.39 1pam n PHE 381 Ca -0.15 -1.85 -0.42 0.00 -0.05 0.00 0.00 57.45 54.99 1pam n PHE 381 Cb 0.58 -0.36 -0.03 0.00 -0.94 0.00 0.00 39.48 38.74 1pam n PHE 381 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1pam s SER 382 N -3.25 6.64 -0.04 4.37 0.15 -1.26 -4.92 113.70 115.39 1pam s SER 382 Ca 0.45 2.59 0.21 0.00 0.70 0.00 0.00 55.95 59.90 1pam s SER 382 Cb 0.40 -2.60 0.68 0.00 -1.71 0.00 0.00 66.02 62.79 1pam s SER 382 CO -0.02 -0.77 1.58 0.35 1.20 0.00 0.00 173.24 175.59 1pam n THR 383 N 3.55 1.31 -0.83 6.45 -2.24 -1.26 -4.43 114.28 116.82 1pam n THR 383 Ca 0.12 -1.07 0.08 0.00 -2.27 0.00 0.00 64.05 60.90 1pam n THR 383 Cb 0.39 0.37 0.21 0.00 -2.10 0.00 0.00 70.33 69.20 1pam n THR 383 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1pam n THR 384 N 1.49 1.94 -2.37 4.28 -2.24 -1.26 -4.67 114.28 111.45 1pam n THR 384 Ca 0.25 -1.77 -0.34 0.00 -2.27 0.00 0.00 64.05 59.93 1pam n THR 384 Cb 0.73 -0.09 -0.02 0.00 -2.10 0.00 0.00 70.33 68.85 1pam n THR 384 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1pam s THR 385 N -2.45 3.74 0.25 4.28 -4.23 -1.26 -4.90 115.64 111.06 1pam s THR 385 Ca 0.35 1.00 -0.04 0.00 -1.18 0.00 0.00 61.69 61.82 1pam s THR 385 Cb 0.28 -3.42 0.24 0.00 1.34 0.00 0.00 72.50 70.94 1pam s THR 385 CO 0.08 -0.31 1.86 0.74 -0.54 0.00 0.00 174.62 176.46 1pam h THR 386 N 1.20 1.06 -0.88 3.99 2.02 -1.94 -1.00 112.91 117.35 1pam h THR 386 Ca -0.49 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.33 1pam h THR 386 Cb 1.22 -0.09 -0.04 0.00 -1.74 0.00 0.00 68.15 67.50 1pam h THR 386 CO 0.58 0.19 0.55 0.00 0.37 0.00 0.00 175.52 177.22 1pam h ALA 387 N 1.43 1.31 -0.57 6.16 0.00 -1.92 0.10 119.26 125.77 1pam h ALA 387 Ca 0.40 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.14 1pam h ALA 387 Cb 0.18 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1pam h ALA 387 CO -0.18 0.61 0.03 -0.92 0.00 0.00 0.00 179.25 178.79 1pam h TYR 388 N 1.21 1.08 -0.47 0.00 5.03 -1.40 -2.23 116.97 120.19 1pam h TYR 388 Ca 0.32 -0.18 -0.09 0.00 2.58 0.00 0.00 58.73 61.36 1pam h TYR 388 Cb -0.09 -0.28 -0.02 0.00 1.55 0.00 0.00 36.73 37.89 1pam h TYR 388 CO 0.00 0.96 -0.07 1.96 -1.32 0.00 0.00 178.16 179.70 1pam h GLN 389 N 0.89 0.83 -0.14 1.82 4.20 -0.58 -1.06 115.11 121.06 1pam h GLN 389 Ca 0.17 -0.26 -0.00 0.00 0.06 0.00 0.00 58.65 58.61 1pam h GLN 389 Cb 0.51 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.21 1pam h GLN 389 CO 0.02 0.87 0.08 0.28 -0.67 0.00 0.00 178.83 179.41 1pam h VAL 390 N 0.76 1.09 -0.50 -0.54 2.07 -0.62 0.04 116.25 118.54 1pam h VAL 390 Ca 0.13 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 1pam h VAL 390 Cb 0.55 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1pam h VAL 390 CO 0.03 0.09 0.28 0.40 0.02 0.00 0.00 177.57 178.39 1pam h ILE 391 N 0.13 1.17 -0.85 4.57 2.04 -1.26 -2.25 117.51 121.06 1pam h ILE 391 Ca 0.05 -0.43 0.06 0.00 1.00 0.00 0.00 64.86 65.54 1pam h ILE 391 Cb 0.07 0.54 -0.05 0.00 -0.74 0.00 0.00 36.82 36.64 1pam h ILE 391 CO -0.01 0.18 0.56 -0.61 0.00 0.00 0.00 178.15 178.27 1pam h GLN 392 N 0.67 0.94 0.04 2.37 4.15 -0.83 0.64 115.11 123.10 1pam h GLN 392 Ca 0.18 -0.06 -0.22 0.00 0.77 0.00 0.00 58.65 59.32 1pam h GLN 392 Cb 0.04 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 27.51 1pam h GLN 392 CO -0.03 0.62 -1.03 0.87 -1.93 0.00 0.00 178.83 177.34 1pam h LYS 393 N 0.97 0.14 0.00 1.69 1.57 -0.74 -3.39 116.57 116.81 1pam h LYS 393 Ca 0.36 -0.20 -0.36 0.00 -1.87 0.00 0.00 60.65 58.58 1pam h LYS 393 Cb 0.18 0.07 -0.07 0.00 0.08 0.00 0.00 32.23 32.49 1pam h LYS 393 CO -0.13 1.04 -2.37 1.28 -0.57 0.00 0.00 179.45 178.71 1pam n LEU 394 N -3.50 0.00 -0.24 2.94 4.77 -0.87 -4.43 117.00 115.67 1pam n LEU 394 Ca -0.04 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 55.94 1pam n LEU 394 Cb 0.92 0.48 0.12 0.00 -2.33 0.00 0.00 43.42 42.61 1pam n LEU 394 CO 0.49 0.48 1.09 0.00 -1.33 0.00 0.00 177.39 178.12 1pam h ALA 395 N 1.02 0.96 0.00 -1.18 0.00 -1.08 -1.65 119.26 117.33 1pam h ALA 395 Ca -0.53 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 1pam h ALA 395 Cb 2.21 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.89 1pam h ALA 395 CO 0.03 0.03 -0.06 -1.35 0.00 0.00 0.00 179.25 177.90 1pam h PRO 396 N 0.67 0.00 0.00 0.00 0.11 -1.77 -2.00 132.00 129.01 1pam h PRO 396 Ca 0.33 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.43 1pam h PRO 396 Cb 0.27 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.38 1pam h PRO 396 CO -0.22 0.06 -0.04 -0.07 -0.21 0.00 0.00 178.00 177.51 1pam h LEU 397 N 0.00 0.00 -0.60 2.35 4.07 -1.52 -0.49 115.31 119.12 1pam h LEU 397 Ca -0.00 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.96 1pam h LEU 397 Cb 0.20 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.94 1pam h LEU 397 CO 0.01 0.04 -0.02 0.03 -1.08 0.00 0.00 178.44 177.42 1pam h ARG 398 N 0.00 0.00 0.15 1.13 3.08 -1.48 0.11 114.38 117.38 1pam h ARG 398 Ca -0.00 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 59.72 1pam h ARG 398 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 1pam h ARG 398 CO 0.01 0.02 -1.69 0.87 -1.07 0.00 0.00 179.97 178.11 1pam h LYS 399 N 0.00 0.32 0.06 0.04 1.79 -1.20 -3.40 116.57 114.18 1pam h LYS 399 Ca -0.00 -0.55 -0.31 0.00 -2.18 0.00 0.00 60.65 57.60 1pam h LYS 399 Cb 0.81 0.21 -0.03 0.00 -1.58 0.00 0.00 32.23 31.64 1pam h LYS 399 CO 0.00 1.26 -1.74 0.66 -1.08 0.00 0.00 179.45 178.56 1pam h SER 400 N -0.04 0.21 -3.51 0.86 4.64 -1.28 -3.45 113.55 110.98 1pam h SER 400 Ca -0.35 -0.41 -0.71 0.00 -0.47 0.00 0.00 61.79 59.85 1pam h SER 400 Cb 1.97 -0.07 -0.27 0.00 -0.31 0.00 0.00 62.40 63.73 1pam h SER 400 CO 0.12 1.36 -0.49 0.21 -0.87 0.00 0.00 176.83 177.16 1pam s ASN 401 N -6.58 5.66 0.41 4.97 3.04 0.39 -4.97 114.94 117.85 1pam s ASN 401 Ca -0.11 -1.31 0.29 0.00 0.04 0.00 0.00 52.86 51.77 1pam s ASN 401 Cb 0.07 -1.99 1.42 0.00 -1.54 0.00 0.00 41.25 39.21 1pam s ASN 401 CO 0.81 -0.48 1.87 1.55 -3.04 0.00 0.00 177.10 177.82 1pam h PRO 402 N 8.41 0.00 -0.54 0.43 0.13 -1.86 -1.71 132.00 136.86 1pam h PRO 402 Ca -0.24 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.78 1pam h PRO 402 Cb 1.09 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.20 1pam h PRO 402 CO 0.72 0.00 -0.08 0.00 -0.23 0.00 0.00 178.00 178.40 1pam h ALA 403 N 2.07 0.83 -0.15 -0.56 0.00 -1.83 0.11 119.26 119.72 1pam h ALA 403 Ca 0.00 -0.34 -0.12 0.00 0.00 0.00 0.00 54.91 54.46 1pam h ALA 403 Cb 0.16 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1pam h ALA 403 CO 0.00 0.66 -0.36 0.82 0.00 0.00 0.00 179.25 180.37 1pam h ILE 404 N 0.89 1.35 -0.18 0.00 2.04 -1.62 0.90 117.51 120.90 1pam h ILE 404 Ca 0.14 -1.62 -0.14 0.00 1.00 0.00 0.00 64.86 64.25 1pam h ILE 404 Cb 0.64 1.99 -0.01 0.00 -0.74 0.00 0.00 36.82 38.70 1pam h ILE 404 CO 0.04 0.49 -0.47 0.00 0.00 0.00 0.00 178.15 178.22 1pam h ALA 405 N 0.55 0.86 0.00 1.87 0.00 -1.44 -3.39 119.26 117.70 1pam h ALA 405 Ca -0.00 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1pam h ALA 405 Cb 0.96 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1pam h ALA 405 CO 0.08 0.66 0.00 0.66 0.00 0.00 0.00 179.25 180.65 1pam n TYR 406 N -3.99 0.00 -1.38 0.00 4.01 0.36 -4.70 117.16 111.46 1pam n TYR 406 Ca -0.02 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.41 1pam n TYR 406 Cb 0.54 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.65 1pam n TYR 406 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1pam s GLY 407 N -0.41 1.67 0.90 2.72 0.00 0.31 -4.96 107.32 107.55 1pam s GLY 407 Ca 0.00 0.18 -0.11 0.00 0.00 0.00 0.00 44.72 44.79 1pam s GLY 407 CO 0.00 0.52 1.10 -1.35 0.00 0.00 0.00 173.10 173.36 1pam s SER 408 N -3.56 3.31 -0.07 1.64 1.04 -0.86 -4.69 113.70 110.51 1pam s SER 408 Ca 0.60 1.75 0.05 0.00 0.48 0.00 0.00 55.95 58.83 1pam s SER 408 Cb -0.16 -2.37 -0.01 0.00 0.10 0.00 0.00 66.02 63.58 1pam s SER 408 CO 0.56 -2.78 -0.24 -0.89 0.98 0.00 0.00 173.24 170.87 1pam s THR 409 N -2.80 2.14 -0.05 2.02 2.01 -1.26 -2.79 115.64 114.89 1pam s THR 409 Ca 0.64 -1.02 -0.02 0.00 0.31 0.00 0.00 61.69 61.60 1pam s THR 409 Cb -0.20 -1.79 0.03 0.00 0.01 0.00 0.00 72.50 70.56 1pam s THR 409 CO 0.58 0.57 0.06 -2.28 -0.69 0.00 0.00 174.62 172.86 1pam s HIS 410 N -0.00 0.07 0.16 4.92 5.04 -0.14 -4.98 115.29 120.36 1pam s HIS 410 Ca -0.08 0.21 -0.30 0.00 -1.54 0.00 0.00 55.06 53.34 1pam s HIS 410 Cb -0.15 -0.50 -0.08 0.00 0.04 0.00 0.00 32.58 31.89 1pam s HIS 410 CO 0.05 -0.22 1.31 -2.00 -2.34 0.00 0.00 174.74 171.54 1pam s GLU 411 N 2.17 4.38 -0.06 2.88 -6.30 -1.26 -0.75 118.70 119.76 1pam s GLU 411 Ca 0.05 2.02 0.06 0.00 -2.50 0.00 0.00 54.97 54.59 1pam s GLU 411 Cb -0.12 -3.23 -0.08 0.00 0.00 0.00 0.00 34.13 30.70 1pam s GLU 411 CO -0.04 -0.29 0.02 0.54 0.02 0.00 0.00 175.26 175.52 1pam n ARG 412 N 3.09 2.96 -3.75 4.30 5.12 0.35 -4.93 116.66 123.80 1pam n ARG 412 Ca 0.08 -0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.86 1pam n ARG 412 Cb 0.43 -1.16 -0.10 0.00 -1.16 0.00 0.00 32.46 30.47 1pam n ARG 412 CO 0.00 0.00 0.00 -0.46 -1.93 0.00 0.00 177.63 175.24 1pam s TRP 413 N -2.15 -0.36 -0.02 -1.55 -0.00 -1.10 -4.70 118.94 109.06 1pam s TRP 413 Ca -0.03 0.86 -0.25 0.00 -0.00 0.00 0.00 56.10 56.68 1pam s TRP 413 Cb 0.02 0.13 0.05 0.00 -0.00 0.00 0.00 33.47 33.67 1pam s TRP 413 CO 0.26 -0.22 0.55 -1.50 -0.00 0.00 0.00 176.95 176.03 1pam s ILE 414 N -0.06 0.02 0.00 5.86 2.07 -1.26 -1.06 121.20 126.77 1pam s ILE 414 Ca -0.02 -0.17 0.00 0.00 -1.41 0.00 0.00 60.65 59.05 1pam s ILE 414 Cb -0.03 -0.90 0.00 0.00 0.13 0.00 0.00 42.46 41.66 1pam s ILE 414 CO 0.01 -0.09 0.00 -0.46 -1.91 0.00 0.00 174.94 172.49 1pam n ASN 415 N 0.89 0.00 0.05 4.50 2.04 -0.79 -4.98 115.26 116.96 1pam n ASN 415 Ca -0.19 -0.75 0.01 0.00 -0.44 0.00 0.00 54.58 53.21 1pam n ASN 415 Cb 0.57 0.00 0.34 0.00 -2.53 0.00 0.00 39.78 38.17 1pam n ASN 415 CO 0.00 0.00 0.00 0.78 -0.44 0.00 0.00 177.26 177.60 1pam h ASN 416 N 0.00 0.38 -0.01 0.53 -0.26 -1.98 -3.16 115.58 111.08 1pam h ASN 416 Ca 0.00 -0.07 0.00 0.00 -0.56 0.00 0.00 56.30 55.67 1pam h ASN 416 Cb 0.00 -0.10 0.00 0.00 -1.06 0.00 0.00 38.32 37.16 1pam h ASN 416 CO 0.00 0.47 -0.09 0.47 -1.06 0.00 0.00 177.43 177.23 1pam n ASP 417 N -4.29 1.59 -4.11 5.81 8.00 -1.26 -1.63 116.55 120.66 1pam n ASP 417 Ca 0.01 -1.29 -0.23 0.00 0.71 0.00 0.00 54.79 53.98 1pam n ASP 417 Cb 0.25 0.20 -0.15 0.00 -0.02 0.00 0.00 41.12 41.39 1pam n ASP 417 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1pam s VAL 418 N -1.07 1.19 -0.02 2.53 1.01 -1.19 -1.05 120.40 121.80 1pam s VAL 418 Ca 0.10 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.49 1pam s VAL 418 Cb 0.08 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.46 1pam s VAL 418 CO 0.18 0.34 -0.07 -0.51 0.00 0.00 0.00 175.10 175.04 1pam s ILE 419 N -0.19 0.62 -0.19 2.22 2.07 -0.79 -1.89 121.20 123.05 1pam s ILE 419 Ca 0.02 -0.30 0.01 0.00 -1.41 0.00 0.00 60.65 58.97 1pam s ILE 419 Cb -0.07 -0.54 0.04 0.00 0.13 0.00 0.00 42.46 42.01 1pam s ILE 419 CO 0.00 0.19 -0.10 -0.63 -1.91 0.00 0.00 174.94 172.49 1pam s ILE 420 N 0.06 1.54 0.22 2.00 1.01 -0.23 -1.25 121.20 124.55 1pam s ILE 420 Ca -0.01 -0.89 0.11 0.00 0.00 0.00 0.00 60.65 59.87 1pam s ILE 420 Cb -0.06 -1.61 -0.05 0.00 0.01 0.00 0.00 42.46 40.76 1pam s ILE 420 CO -0.00 0.21 -0.20 -0.72 0.00 0.00 0.00 174.94 174.22 1pam s TYR 421 N 1.45 2.15 -0.01 3.97 1.13 -0.68 -0.50 117.35 124.85 1pam s TYR 421 Ca 0.00 -0.39 0.07 0.00 -1.41 0.00 0.00 57.07 55.34 1pam s TYR 421 Cb -0.16 -1.00 -0.02 0.00 -1.10 0.00 0.00 41.96 39.69 1pam s TYR 421 CO -0.08 0.54 -0.23 -2.00 -2.51 0.00 0.00 175.55 171.27 1pam s GLU 422 N -3.14 1.81 -0.12 -3.49 2.12 0.07 -0.97 118.70 114.98 1pam s GLU 422 Ca 0.24 -0.84 -0.01 0.00 0.36 0.00 0.00 54.97 54.72 1pam s GLU 422 Cb -0.06 -1.77 -0.02 0.00 0.26 0.00 0.00 34.13 32.54 1pam s GLU 422 CO 0.11 0.48 -0.09 1.03 -0.54 0.00 0.00 175.26 176.25 1pam s ARG 423 N -0.62 3.28 -0.03 4.30 1.81 -0.17 -0.96 118.95 126.56 1pam s ARG 423 Ca 0.09 -0.61 -0.01 0.00 -1.72 0.00 0.00 55.73 53.48 1pam s ARG 423 Cb -0.09 -2.69 0.03 0.00 -0.45 0.00 0.00 34.95 31.75 1pam s ARG 423 CO -0.01 0.34 0.07 0.21 -0.68 0.00 0.00 175.30 175.24 1pam s LYS 424 N 0.04 0.03 -0.21 3.54 2.20 -1.12 -1.55 119.74 122.67 1pam s LYS 424 Ca -0.03 0.21 -0.04 0.00 -0.36 0.00 0.00 55.97 55.76 1pam s LYS 424 Cb -0.14 -0.14 0.10 0.00 -1.51 0.00 0.00 37.83 36.13 1pam s LYS 424 CO 0.04 -0.12 0.22 0.12 -0.36 0.00 0.00 175.35 175.25 1pam s PHE 425 N 0.79 -0.28 0.00 4.03 5.36 -0.75 -2.04 117.98 125.10 1pam s PHE 425 Ca -0.06 0.20 0.00 0.00 -0.96 0.00 0.00 56.93 56.10 1pam s PHE 425 Cb -0.09 -0.37 0.00 0.00 -0.34 0.00 0.00 43.02 42.22 1pam s PHE 425 CO -0.03 -0.62 0.00 0.41 -1.46 0.00 0.00 175.22 173.52 1pam n GLY 426 N 5.32 3.48 1.17 13.12 0.00 -1.26 -1.47 105.19 125.54 1pam n GLY 426 Ca -0.05 -0.09 0.09 0.00 0.00 0.00 0.00 46.02 45.97 1pam n GLY 426 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1pam n ASN 427 N 6.86 3.84 -4.79 1.61 3.02 -1.26 -4.92 115.26 119.62 1pam n ASN 427 Ca 0.00 -2.17 -0.38 0.00 -0.03 0.00 0.00 54.58 52.00 1pam n ASN 427 Cb 0.00 -0.44 -0.06 0.00 -0.61 0.00 0.00 39.78 38.67 1pam n ASN 427 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1pam s ASN 428 N -1.04 7.23 -0.01 6.41 0.01 -0.54 -4.51 114.94 122.49 1pam s ASN 428 Ca 0.41 1.49 -0.04 0.00 -0.71 0.00 0.00 52.86 54.01 1pam s ASN 428 Cb 0.24 -2.44 -0.00 0.00 0.41 0.00 0.00 41.25 39.45 1pam s ASN 428 CO 0.25 0.19 0.09 -0.69 -1.51 0.00 0.00 177.10 175.42 1pam s VAL 429 N -1.23 0.06 -0.00 1.60 1.01 0.07 -1.81 120.40 120.11 1pam s VAL 429 Ca 0.36 -0.51 0.01 0.00 0.00 0.00 0.00 61.98 61.84 1pam s VAL 429 Cb -0.21 -0.30 -0.00 0.00 0.00 0.00 0.00 36.38 35.87 1pam s VAL 429 CO 0.23 -0.28 -0.04 0.00 0.00 0.00 0.00 175.10 175.01 1pam s ALA 430 N -0.92 0.32 -0.05 5.51 0.00 -0.60 -1.14 121.76 124.89 1pam s ALA 430 Ca -0.10 -0.17 0.03 0.00 0.00 0.00 0.00 51.96 51.72 1pam s ALA 430 Cb -0.06 -0.08 0.01 0.00 0.00 0.00 0.00 23.12 22.99 1pam s ALA 430 CO 0.01 0.07 -0.12 0.08 0.00 0.00 0.00 175.76 175.80 1pam s VAL 431 N -0.11 1.06 -0.07 0.00 1.01 0.30 -1.00 120.40 121.60 1pam s VAL 431 Ca 0.01 -0.48 0.03 0.00 0.00 0.00 0.00 61.98 61.54 1pam s VAL 431 Cb -0.02 -0.95 0.01 0.00 0.00 0.00 0.00 36.38 35.42 1pam s VAL 431 CO -0.00 0.33 -0.16 -0.69 0.00 0.00 0.00 175.10 174.58 1pam s VAL 432 N 0.38 1.40 -0.11 2.92 1.01 -0.14 -0.97 120.40 124.88 1pam s VAL 432 Ca -0.08 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.28 1pam s VAL 432 Cb -0.12 -1.24 -0.00 0.00 0.00 0.00 0.00 36.38 35.01 1pam s VAL 432 CO 0.02 0.41 -0.20 0.00 0.00 0.00 0.00 175.10 175.33 1pam s ALA 433 N 0.47 2.31 -0.06 5.51 0.00 -0.55 -1.69 121.76 127.75 1pam s ALA 433 Ca -0.14 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 50.87 1pam s ALA 433 Cb -0.15 -0.95 0.02 0.00 0.00 0.00 0.00 23.12 22.03 1pam s ALA 433 CO 0.05 0.23 -0.08 0.42 0.00 0.00 0.00 175.76 176.38 1pam s ILE 434 N 0.41 0.87 -0.35 0.00 1.01 -0.38 -1.81 121.20 120.95 1pam s ILE 434 Ca -0.15 -0.30 -0.01 0.00 0.00 0.00 0.00 60.65 60.18 1pam s ILE 434 Cb -0.17 -0.85 0.08 0.00 0.01 0.00 0.00 42.46 41.53 1pam s ILE 434 CO 0.07 0.31 0.08 0.21 0.00 0.00 0.00 174.94 175.61 1pam s ASN 435 N 0.93 5.01 0.00 3.58 2.47 0.01 -1.89 114.94 125.05 1pam s ASN 435 Ca -0.10 -1.68 0.28 0.00 0.42 0.00 0.00 52.86 51.78 1pam s ASN 435 Cb -0.15 -1.74 1.31 0.00 -1.45 0.00 0.00 41.25 39.22 1pam s ASN 435 CO 0.01 -0.38 1.93 -2.11 -3.72 0.00 0.00 177.10 172.83 1pam n ARG 436 N 4.56 0.20 -2.67 0.43 1.85 -0.22 -2.93 116.66 117.88 1pam n ARG 436 Ca -0.07 0.02 -0.43 0.00 -1.00 0.00 0.00 57.85 56.38 1pam n ARG 436 Cb 0.42 -1.50 -0.02 0.00 -1.05 0.00 0.00 32.46 30.31 1pam n ARG 436 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 1pam s ASN 437 N -2.78 7.20 0.00 2.89 3.84 -1.26 -4.76 114.94 120.06 1pam s ASN 437 Ca 0.20 1.49 0.26 0.00 0.21 0.00 0.00 52.86 55.02 1pam s ASN 437 Cb 0.19 -2.55 1.00 0.00 -0.55 0.00 0.00 41.25 39.34 1pam s ASN 437 CO 0.47 -0.51 1.71 0.23 -2.79 0.00 0.00 177.10 176.20 1pam n MET 438 N 5.39 1.63 0.00 0.43 2.81 -1.26 -1.11 117.12 125.01 1pam n MET 438 Ca 0.10 -0.93 0.00 0.00 -1.81 0.00 0.00 57.70 55.06 1pam n MET 438 Cb 0.48 -1.45 0.00 0.00 -0.71 0.00 0.00 33.22 31.54 1pam n MET 438 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1pam n ASN 439 N 0.13 3.87 -4.38 7.83 4.13 -1.26 -4.65 115.26 120.93 1pam n ASN 439 Ca 0.18 0.00 -0.35 0.00 1.68 0.00 0.00 54.58 56.09 1pam n ASN 439 Cb 0.33 0.47 -0.13 0.00 -1.54 0.00 0.00 39.78 38.90 1pam n ASN 439 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1pam s THR 440 N -1.73 3.77 0.85 3.41 2.01 -1.26 -4.86 115.64 117.84 1pam s THR 440 Ca 0.00 -0.36 -0.10 0.00 0.31 0.00 0.00 61.69 61.54 1pam s THR 440 Cb 0.00 -2.73 0.10 0.00 0.01 0.00 0.00 72.50 69.88 1pam s THR 440 CO 0.00 0.40 1.11 -2.16 -0.69 0.00 0.00 174.62 173.28 1pam s PRO 441 N 1.42 1.62 -0.06 4.92 0.04 -1.26 -4.26 135.00 137.42 1pam s PRO 441 Ca 0.05 1.26 0.03 0.00 0.04 0.00 0.00 61.00 62.38 1pam s PRO 441 Cb -0.15 -1.82 0.01 0.00 0.04 0.00 0.00 34.50 32.59 1pam s PRO 441 CO -0.00 -2.12 -0.13 0.00 0.04 0.00 0.00 177.00 174.79 1pam s ALA 442 N -2.80 1.27 -0.38 8.56 0.00 -0.10 -4.93 121.76 123.37 1pam s ALA 442 Ca 0.64 -0.47 -0.18 0.00 0.00 0.00 0.00 51.96 51.95 1pam s ALA 442 Cb -0.19 -0.52 0.01 0.00 0.00 0.00 0.00 23.12 22.41 1pam s ALA 442 CO 0.57 0.15 0.52 -1.12 0.00 0.00 0.00 175.76 175.89 1pam s SER 443 N 0.46 6.29 -0.36 0.00 0.01 -1.26 -0.36 113.70 118.49 1pam s SER 443 Ca -0.11 -0.21 -0.15 0.00 1.31 0.00 0.00 55.95 56.79 1pam s SER 443 Cb -0.14 -2.27 -0.01 0.00 0.21 0.00 0.00 66.02 63.81 1pam s SER 443 CO 0.03 -0.56 0.34 -0.63 0.41 0.00 0.00 173.24 172.84 1pam s ILE 444 N 2.43 5.19 -0.02 1.44 -1.09 0.50 -4.98 121.20 124.66 1pam s ILE 444 Ca 0.18 -0.10 0.05 0.00 -2.23 0.00 0.00 60.65 58.56 1pam s ILE 444 Cb -0.15 -3.83 -0.01 0.00 -1.58 0.00 0.00 42.46 36.88 1pam s ILE 444 CO 0.14 -0.13 -0.18 0.42 -1.23 0.00 0.00 174.94 173.97 1pam s THR 445 N 1.95 1.44 0.00 2.92 -4.23 -1.26 -2.54 115.64 113.92 1pam s THR 445 Ca 0.10 -0.77 0.00 0.00 -1.18 0.00 0.00 61.69 59.85 1pam s THR 445 Cb -0.17 -1.21 0.00 0.00 1.34 0.00 0.00 72.50 72.46 1pam s THR 445 CO 0.12 0.41 0.00 0.61 -0.54 0.00 0.00 174.62 175.21 1pam n GLY 446 N 2.75 0.69 3.69 3.99 0.00 -1.26 -5.02 105.19 110.03 1pam n GLY 446 Ca -0.16 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 1pam n GLY 446 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1pam s LEU 447 N 0.00 4.28 -0.07 0.99 2.96 -1.26 -4.98 118.68 120.59 1pam s LEU 447 Ca 0.00 1.89 0.03 0.00 -0.22 0.00 0.00 54.13 55.83 1pam s LEU 447 Cb 0.00 -3.56 -0.02 0.00 0.50 0.00 0.00 46.19 43.11 1pam s LEU 447 CO 0.00 -0.63 -0.17 -0.69 -1.32 0.00 0.00 176.35 173.53 1pam s VAL 448 N 2.36 2.75 0.35 1.68 1.01 -1.26 -1.19 120.40 126.11 1pam s VAL 448 Ca 0.58 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.79 1pam s VAL 448 Cb -0.26 -2.08 -0.03 0.00 0.00 0.00 0.00 36.38 34.00 1pam s VAL 448 CO 0.23 0.57 0.15 0.42 0.00 0.00 0.00 175.10 176.46 1pam s THR 449 N -0.25 0.48 -1.36 3.92 -4.23 -0.21 -4.91 115.64 109.08 1pam s THR 449 Ca 0.00 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 58.66 1pam s THR 449 Cb -0.13 -2.46 0.54 0.00 1.34 0.00 0.00 72.50 71.79 1pam s THR 449 CO 0.03 0.00 1.42 -1.20 -0.54 0.00 0.00 174.62 174.33 1pam n SER 450 N -1.14 3.61 -4.75 3.99 7.64 -1.26 -4.36 113.62 117.35 1pam n SER 450 Ca -0.02 -2.28 -0.40 0.00 1.01 0.00 0.00 58.87 57.17 1pam n SER 450 Cb 0.65 -0.48 -0.04 0.00 -1.01 0.00 0.00 64.21 63.32 1pam n SER 450 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1pam s LEU 451 N -1.43 4.54 0.77 -3.43 1.43 -1.26 -4.98 118.68 114.32 1pam s LEU 451 Ca 0.39 2.22 -0.15 0.00 -1.03 0.00 0.00 54.13 55.55 1pam s LEU 451 Cb 0.24 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.83 1pam s LEU 451 CO 0.20 -0.15 0.62 -2.65 0.23 0.00 0.00 176.35 174.60 1pam n PRO 452 N 1.48 0.22 -1.67 1.29 -0.02 -1.26 -4.23 135.00 130.82 1pam n PRO 452 Ca -0.00 0.12 -0.45 0.00 -2.02 0.00 0.00 63.50 61.15 1pam n PRO 452 Cb 0.45 -1.94 -0.03 0.00 -0.02 0.00 0.00 33.50 31.97 1pam n PRO 452 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1pam n ARG 453 N -1.25 2.02 -3.09 -0.52 0.63 -1.26 -4.79 116.66 108.41 1pam n ARG 453 Ca 0.10 0.72 0.00 0.00 -0.92 0.00 0.00 57.85 57.75 1pam n ARG 453 Cb 0.50 -2.37 0.00 0.00 0.45 0.00 0.00 32.46 31.05 1pam n ARG 453 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1pam n GLY 454 N 2.07 -1.37 3.42 5.14 0.00 -0.23 -4.97 105.19 109.25 1pam n GLY 454 Ca 0.11 -1.42 -0.32 0.00 0.00 0.00 0.00 46.02 44.39 1pam n GLY 454 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1pam s SER 455 N -2.24 3.76 -0.13 1.61 0.01 -1.26 -0.29 113.70 115.16 1pam s SER 455 Ca 0.00 -0.28 0.01 0.00 1.31 0.00 0.00 55.95 56.99 1pam s SER 455 Cb 0.00 -0.76 0.02 0.00 0.21 0.00 0.00 66.02 65.48 1pam s SER 455 CO 0.00 0.33 -0.15 -0.31 0.41 0.00 0.00 173.24 173.51 1pam s TYR 456 N -0.63 2.12 0.36 2.43 2.02 0.63 -4.97 117.35 119.31 1pam s TYR 456 Ca 0.09 -1.09 -0.26 0.00 -0.37 0.00 0.00 57.07 55.44 1pam s TYR 456 Cb -0.11 -1.54 -0.09 0.00 -0.40 0.00 0.00 41.96 39.83 1pam s TYR 456 CO 0.01 -0.58 1.12 -0.80 -1.57 0.00 0.00 175.55 173.73 1pam s ASN 457 N 1.19 6.82 0.08 2.29 0.02 -1.26 -0.85 114.94 123.24 1pam s ASN 457 Ca -0.01 2.25 -0.31 0.00 -1.02 0.00 0.00 52.86 53.77 1pam s ASN 457 Cb -0.14 -2.61 -0.09 0.00 0.02 0.00 0.00 41.25 38.42 1pam s ASN 457 CO -0.06 -0.46 1.83 -0.62 0.02 0.00 0.00 177.10 177.82 1pam s ASP 458 N -1.15 6.47 0.37 -1.22 2.15 -1.25 -4.61 116.67 117.43 1pam s ASP 458 Ca 0.53 2.67 0.27 0.00 0.43 0.00 0.00 52.55 56.45 1pam s ASP 458 Cb -0.29 -2.55 1.11 0.00 -0.30 0.00 0.00 42.92 40.89 1pam s ASP 458 CO 0.37 -1.00 1.81 -0.37 -0.17 0.00 0.00 175.17 175.82 1pam h VAL 459 N 5.00 0.00 0.00 1.11 -1.51 -1.28 0.53 116.25 120.09 1pam h VAL 459 Ca -0.46 -0.35 0.00 0.00 -1.23 0.00 0.00 66.70 64.66 1pam h VAL 459 Cb 1.22 1.19 0.00 0.00 -2.13 0.00 0.00 31.29 31.57 1pam h VAL 459 CO 0.94 0.00 0.00 0.18 -1.23 0.00 0.00 177.57 177.46 1pam n LEU 460 N -2.56 0.00 -1.98 4.19 4.77 -1.26 -4.90 117.00 115.26 1pam n LEU 460 Ca 0.02 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.80 1pam n LEU 460 Cb 0.27 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.32 1pam n LEU 460 CO 0.23 0.00 -0.23 0.61 -1.33 0.00 0.00 177.39 176.67 1pam n GLY 461 N 0.92 0.48 2.32 -0.72 0.00 0.18 -2.00 105.19 106.36 1pam n GLY 461 Ca 0.21 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1pam n GLY 461 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pam n GLY 462 N -0.82 0.50 0.22 -0.02 0.00 -1.26 -4.92 105.19 98.88 1pam n GLY 462 Ca -0.22 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.89 1pam n GLY 462 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1pam h ILE 463 N 0.00 0.70 -0.87 -0.61 3.07 -1.75 -1.44 117.51 116.62 1pam h ILE 463 Ca 0.00 -1.11 -0.58 0.00 1.55 0.00 0.00 64.86 64.72 1pam h ILE 463 Cb 0.12 1.71 -0.31 0.00 -0.27 0.00 0.00 36.82 38.07 1pam h ILE 463 CO 0.00 0.25 0.29 0.18 -1.05 0.00 0.00 178.15 177.82 1pam n LEU 464 N -3.54 6.50 -2.55 0.16 4.77 -1.26 -4.90 117.00 116.19 1pam n LEU 464 Ca -0.01 -4.31 -0.20 0.00 -0.03 0.00 0.00 56.01 51.47 1pam n LEU 464 Cb 0.41 -0.76 0.02 0.00 -2.33 0.00 0.00 43.42 40.76 1pam n LEU 464 CO 0.34 1.59 -0.07 0.59 -1.33 0.00 0.00 177.39 178.51 1pam n ASN 465 N -0.90 -5.61 -4.41 -1.43 3.02 -0.54 -1.39 115.26 104.00 1pam n ASN 465 Ca 0.55 -0.19 -0.28 0.00 -0.03 0.00 0.00 54.58 54.63 1pam n ASN 465 Cb 0.87 -4.50 0.15 0.00 -0.61 0.00 0.00 39.78 35.69 1pam n ASN 465 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1pam s GLY 466 N -2.57 1.75 0.22 7.41 0.00 -1.21 -4.47 107.32 108.46 1pam s GLY 466 Ca 0.19 -1.26 -0.01 0.00 0.00 0.00 0.00 44.72 43.64 1pam s GLY 466 CO 0.24 -0.60 0.19 0.54 0.00 0.00 0.00 173.10 173.46 1pam s ASN 467 N -4.79 0.36 0.16 1.64 2.20 -1.26 -4.43 114.94 108.82 1pam s ASN 467 Ca 0.70 -1.41 -0.30 0.00 -0.94 0.00 0.00 52.86 50.91 1pam s ASN 467 Cb -0.05 0.43 -0.07 0.00 -2.00 0.00 0.00 41.25 39.55 1pam s ASN 467 CO 0.50 -0.90 0.96 -0.89 -2.94 0.00 0.00 177.10 173.82 1pam s THR 468 N -4.03 4.32 -0.18 0.54 2.01 -1.26 -3.75 115.64 113.29 1pam s THR 468 Ca 0.38 2.06 -0.06 0.00 0.31 0.00 0.00 61.69 64.37 1pam s THR 468 Cb 0.06 -4.31 -0.04 0.00 0.01 0.00 0.00 72.50 68.22 1pam s THR 468 CO 0.14 0.38 0.04 -0.22 -0.69 0.00 0.00 174.62 174.27 1pam s LEU 469 N -0.45 3.64 -0.25 4.42 2.96 -0.03 -4.92 118.68 124.04 1pam s LEU 469 Ca 0.45 0.00 -0.08 0.00 -0.22 0.00 0.00 54.13 54.28 1pam s LEU 469 Cb -0.25 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.50 1pam s LEU 469 CO 0.31 0.16 0.10 -0.89 -1.32 0.00 0.00 176.35 174.71 1pam s THR 470 N 0.47 4.62 -0.09 3.68 2.01 -1.26 -0.27 115.64 124.80 1pam s THR 470 Ca 0.01 -0.07 -0.00 0.00 0.31 0.00 0.00 61.69 61.94 1pam s THR 470 Cb -0.13 -3.17 -0.03 0.00 0.01 0.00 0.00 72.50 69.18 1pam s THR 470 CO 0.01 0.32 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.51 1pam s VAL 471 N 1.57 3.67 0.00 3.82 1.01 0.60 -1.05 120.40 130.03 1pam s VAL 471 Ca 0.06 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 61.57 1pam s VAL 471 Cb -0.15 -2.53 0.00 0.00 0.00 0.00 0.00 36.38 33.70 1pam s VAL 471 CO 0.06 0.57 0.00 0.61 0.00 0.00 0.00 175.10 176.33 1pam n GLY 472 N 2.66 3.14 3.76 4.51 0.00 -0.47 -1.07 105.19 117.72 1pam n GLY 472 Ca -0.18 -1.85 -0.41 0.00 0.00 0.00 0.00 46.02 43.58 1pam n GLY 472 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pam s ALA 473 N -2.61 3.52 -1.08 4.61 0.00 -1.26 -2.90 121.76 122.04 1pam s ALA 473 Ca 0.00 1.24 0.00 0.00 0.00 0.00 0.00 51.96 53.20 1pam s ALA 473 Cb 0.00 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.63 1pam s ALA 473 CO 0.00 -0.63 0.00 0.41 0.00 0.00 0.00 175.76 175.54 1pam n GLY 474 N 1.31 1.15 2.74 0.00 0.00 -1.26 -3.19 105.19 105.94 1pam n GLY 474 Ca 0.02 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1pam n GLY 474 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pam n GLY 475 N -1.54 0.65 3.70 -0.02 0.00 -1.14 -4.70 105.19 102.14 1pam n GLY 475 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 1pam n GLY 475 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pam s ALA 476 N -2.77 3.33 0.29 4.61 0.00 -1.19 -1.05 121.76 124.98 1pam s ALA 476 Ca 0.00 0.61 -0.11 0.00 0.00 0.00 0.00 51.96 52.45 1pam s ALA 476 Cb 0.00 -3.42 -0.08 0.00 0.00 0.00 0.00 23.12 19.62 1pam s ALA 476 CO 0.00 -0.46 0.64 0.00 0.00 0.00 0.00 175.76 175.94 1pam s ALA 477 N 1.46 3.45 0.63 0.00 0.00 -0.33 -1.37 121.76 125.59 1pam s ALA 477 Ca 0.54 -0.17 -0.17 0.00 0.00 0.00 0.00 51.96 52.15 1pam s ALA 477 Cb -0.23 -2.58 -0.02 0.00 0.00 0.00 0.00 23.12 20.29 1pam s ALA 477 CO 0.25 0.36 1.18 -1.12 0.00 0.00 0.00 175.76 176.43 1pam s SER 478 N -2.49 5.04 0.43 0.00 0.01 -0.21 -4.66 113.70 111.83 1pam s SER 478 Ca 0.50 2.28 -0.26 0.00 1.31 0.00 0.00 55.95 59.78 1pam s SER 478 Cb -0.11 -2.59 -0.09 0.00 0.21 0.00 0.00 66.02 63.45 1pam s SER 478 CO 0.22 -1.69 1.46 0.20 0.41 0.00 0.00 173.24 173.84 1pam s ASN 479 N -1.89 6.03 0.14 2.44 -0.87 -1.26 -4.83 114.94 114.70 1pam s ASN 479 Ca 0.74 2.99 -0.14 0.00 -1.57 0.00 0.00 52.86 54.88 1pam s ASN 479 Cb -0.27 -2.66 0.02 0.00 -0.02 0.00 0.00 41.25 38.32 1pam s ASN 479 CO 0.36 -1.08 0.38 0.72 -2.57 0.00 0.00 177.10 174.91 1pam s PHE 480 N -1.17 -0.02 -0.19 2.20 -0.71 -1.05 -5.02 117.98 112.02 1pam s PHE 480 Ca 0.58 -0.33 -0.07 0.00 -1.04 0.00 0.00 56.93 56.07 1pam s PHE 480 Cb -0.45 0.19 -0.04 0.00 -1.21 0.00 0.00 43.02 41.51 1pam s PHE 480 CO 0.59 -0.74 0.06 0.99 -1.34 0.00 0.00 175.22 174.79 1pam s THR 481 N -3.86 4.72 -0.33 -4.49 2.01 -1.26 -0.37 115.64 112.05 1pam s THR 481 Ca 0.07 -0.05 -0.16 0.00 0.31 0.00 0.00 61.69 61.86 1pam s THR 481 Cb 0.02 -3.14 -0.01 0.00 0.01 0.00 0.00 72.50 69.38 1pam s THR 481 CO -0.07 0.45 0.40 -0.22 -0.69 0.00 0.00 174.62 174.48 1pam s LEU 482 N 0.52 4.37 0.88 4.42 2.96 0.51 -4.93 118.68 127.40 1pam s LEU 482 Ca 0.03 -0.12 -0.14 0.00 -0.22 0.00 0.00 54.13 53.68 1pam s LEU 482 Cb -0.13 -2.41 0.01 0.00 0.50 0.00 0.00 46.19 44.16 1pam s LEU 482 CO 0.01 -0.35 0.41 0.00 -1.32 0.00 0.00 176.35 175.09 1pam n ALA 483 N 5.46 -2.35 -1.70 5.97 0.00 -1.26 -0.93 120.51 125.71 1pam n ALA 483 Ca -0.08 -0.50 -0.44 0.00 0.00 0.00 0.00 53.44 52.43 1pam n ALA 483 Cb 0.49 -1.80 -0.03 0.00 0.00 0.00 0.00 19.45 18.11 1pam n ALA 483 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1pam n PRO 484 N -1.26 2.53 -1.00 0.00 -0.02 -1.26 -1.14 135.00 132.85 1pam n PRO 484 Ca 0.07 0.91 -0.00 0.00 -2.02 0.00 0.00 63.50 62.47 1pam n PRO 484 Cb 0.52 -2.73 -0.00 0.00 -0.02 0.00 0.00 33.50 31.28 1pam n PRO 484 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pam n GLY 485 N 3.75 0.26 3.75 -1.23 0.00 -0.27 -4.90 105.19 106.55 1pam n GLY 485 Ca 0.16 -0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1pam n GLY 485 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pam s GLY 486 N -2.00 2.69 -0.02 -0.02 0.00 -0.29 -4.77 107.32 102.91 1pam s GLY 486 Ca 0.00 1.22 -0.00 0.00 0.00 0.00 0.00 44.72 45.93 1pam s GLY 486 CO 0.00 2.02 0.04 -1.59 0.00 0.00 0.00 173.10 173.57 1pam s THR 487 N -0.53 -0.07 0.02 0.90 2.01 -0.49 -0.81 115.64 116.67 1pam s THR 487 Ca 0.53 0.27 0.01 0.00 0.31 0.00 0.00 61.69 62.81 1pam s THR 487 Cb -0.39 -0.10 -0.01 0.00 0.01 0.00 0.00 72.50 72.01 1pam s THR 487 CO 0.46 0.11 -0.05 0.00 -0.69 0.00 0.00 174.62 174.45 1pam s ALA 488 N 1.33 0.35 -0.07 7.40 0.00 -0.75 -3.30 121.76 126.72 1pam s ALA 488 Ca -0.06 -0.45 0.01 0.00 0.00 0.00 0.00 51.96 51.47 1pam s ALA 488 Cb -0.13 0.01 0.02 0.00 0.00 0.00 0.00 23.12 23.02 1pam s ALA 488 CO -0.03 -0.01 -0.09 0.08 0.00 0.00 0.00 175.76 175.71 1pam s VAL 489 N -0.79 0.94 0.03 0.00 1.01 -1.26 -1.48 120.40 118.85 1pam s VAL 489 Ca -0.06 -0.33 0.07 0.00 0.00 0.00 0.00 61.98 61.65 1pam s VAL 489 Cb -0.06 -0.91 -0.02 0.00 0.00 0.00 0.00 36.38 35.39 1pam s VAL 489 CO -0.00 0.32 -0.19 0.26 0.00 0.00 0.00 175.10 175.49 1pam s TRP 490 N 0.98 1.69 0.17 5.22 0.51 -0.14 -0.69 118.94 126.68 1pam s TRP 490 Ca -0.09 -0.36 -0.04 0.00 -2.12 0.00 0.00 56.10 53.49 1pam s TRP 490 Cb -0.15 -1.02 -0.03 0.00 -0.81 0.00 0.00 33.47 31.46 1pam s TRP 490 CO 0.00 0.05 0.18 1.14 -0.51 0.00 0.00 176.95 177.81 1pam s GLN 491 N -0.99 1.13 -0.14 4.98 -2.07 -1.26 -0.53 119.66 120.77 1pam s GLN 491 Ca 0.06 -1.41 -0.06 0.00 -1.82 0.00 0.00 55.36 52.14 1pam s GLN 491 Cb -0.08 0.31 0.07 0.00 -1.09 0.00 0.00 33.01 32.21 1pam s GLN 491 CO 0.01 -0.38 0.31 -0.47 -1.32 0.00 0.00 175.29 173.44 1pam s TYR 492 N -4.06 -0.50 0.15 9.60 5.04 -0.29 -4.99 117.35 122.30 1pam s TYR 492 Ca 0.26 1.09 0.10 0.00 -2.44 0.00 0.00 57.07 56.08 1pam s TYR 492 Cb 0.05 0.09 -0.04 0.00 0.35 0.00 0.00 41.96 42.41 1pam s TYR 492 CO 0.05 -0.36 -0.18 0.95 -1.34 0.00 0.00 175.55 174.67 1pam s THR 493 N 2.11 2.74 0.10 4.34 -4.23 -1.26 -0.75 115.64 118.70 1pam s THR 493 Ca -0.03 -1.70 -0.20 0.00 -1.18 0.00 0.00 61.69 58.58 1pam s THR 493 Cb -0.11 -2.29 0.05 0.00 1.34 0.00 0.00 72.50 71.48 1pam s THR 493 CO -0.10 -0.01 0.49 0.28 -0.54 0.00 0.00 174.62 174.75 1pam s THR 494 N -1.40 0.04 0.66 3.99 -1.32 -1.26 -4.98 115.64 111.36 1pam s THR 494 Ca 0.20 -0.31 -0.13 0.00 -1.21 0.00 0.00 61.69 60.23 1pam s THR 494 Cb -0.09 -1.05 -0.01 0.00 -1.51 0.00 0.00 72.50 69.84 1pam s THR 494 CO 0.11 -0.17 1.07 -1.81 -2.21 0.00 0.00 174.62 171.60 1pam s ASP 495 N -2.46 5.41 -0.14 8.08 1.01 -1.26 -4.64 116.67 122.68 1pam s ASP 495 Ca -0.01 1.76 -0.04 0.00 0.71 0.00 0.00 52.55 54.97 1pam s ASP 495 Cb 0.00 -2.52 -0.03 0.00 1.01 0.00 0.00 42.92 41.38 1pam s ASP 495 CO -0.08 -1.42 0.00 0.00 0.21 0.00 0.00 175.17 173.88 1pam s ALA 496 N -2.72 3.21 -0.24 5.23 0.00 -1.26 -4.91 121.76 121.08 1pam s ALA 496 Ca 0.61 -0.79 0.22 0.00 0.00 0.00 0.00 51.96 52.01 1pam s ALA 496 Cb -0.16 -1.63 -0.12 0.00 0.00 0.00 0.00 23.12 21.21 1pam s ALA 496 CO 0.46 0.33 0.83 0.25 0.00 0.00 0.00 175.76 177.64 1pam n THR 497 N 3.06 0.30 -4.97 0.00 -2.24 -1.26 -4.04 114.28 105.13 1pam n THR 497 Ca -0.18 -0.46 -0.32 0.00 -2.27 0.00 0.00 64.05 60.83 1pam n THR 497 Cb 0.53 -0.09 -0.14 0.00 -2.10 0.00 0.00 70.33 68.53 1pam n THR 497 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1pam s THR 498 N -3.38 2.64 0.21 4.28 -1.32 -1.26 -4.96 115.64 111.84 1pam s THR 498 Ca -0.02 -0.98 -0.30 0.00 -1.21 0.00 0.00 61.69 59.17 1pam s THR 498 Cb 0.12 -2.02 -0.09 0.00 -1.51 0.00 0.00 72.50 69.00 1pam s THR 498 CO 0.84 0.52 1.41 -2.16 -2.21 0.00 0.00 174.62 173.02 1pam s PRO 499 N -0.88 4.30 -0.05 7.08 0.04 -1.12 -4.29 135.00 140.08 1pam s PRO 499 Ca 0.12 2.21 -0.01 0.00 0.04 0.00 0.00 61.00 63.36 1pam s PRO 499 Cb -0.10 -3.16 0.03 0.00 0.04 0.00 0.00 34.50 31.31 1pam s PRO 499 CO 0.01 -0.40 0.01 0.42 0.04 0.00 0.00 177.00 177.09 1pam s ILE 500 N 0.30 0.21 -0.23 0.56 1.01 0.03 -4.13 121.20 118.95 1pam s ILE 500 Ca 0.60 0.16 -0.22 0.00 0.00 0.00 0.00 60.65 61.19 1pam s ILE 500 Cb -0.40 -0.36 -0.01 0.00 0.01 0.00 0.00 42.46 41.69 1pam s ILE 500 CO 0.39 0.20 0.72 -0.63 0.00 0.00 0.00 174.94 175.62 1pam s ILE 501 N 1.60 4.93 -0.19 2.92 1.01 -1.26 -1.44 121.20 128.77 1pam s ILE 501 Ca -0.01 1.35 0.18 0.00 0.00 0.00 0.00 60.65 62.17 1pam s ILE 501 Cb -0.13 -4.02 -0.25 0.00 0.01 0.00 0.00 42.46 38.07 1pam s ILE 501 CO -0.03 0.00 0.08 0.61 0.00 0.00 0.00 174.94 175.60 1pam n GLY 502 N 3.89 -1.00 3.53 6.18 0.00 0.63 -4.97 105.19 113.46 1pam n GLY 502 Ca 0.02 -0.34 -0.10 0.00 0.00 0.00 0.00 46.02 45.59 1pam n GLY 502 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1pam s ASN 503 N -5.45 -0.40 -0.01 1.61 3.84 -0.95 -4.90 114.94 108.68 1pam s ASN 503 Ca -0.10 0.24 0.01 0.00 0.21 0.00 0.00 52.86 53.22 1pam s ASN 503 Cb 0.06 0.37 0.00 0.00 -0.55 0.00 0.00 41.25 41.14 1pam s ASN 503 CO 0.83 -0.51 -0.02 -0.69 -2.79 0.00 0.00 177.10 173.91 1pam s VAL 504 N -2.11 0.19 -0.15 -5.21 1.01 -1.26 -1.18 120.40 111.69 1pam s VAL 504 Ca 0.00 -0.08 -0.13 0.00 0.00 0.00 0.00 61.98 61.78 1pam s VAL 504 Cb -0.01 -0.18 0.04 0.00 0.00 0.00 0.00 36.38 36.23 1pam s VAL 504 CO -0.03 0.07 0.39 -0.83 0.00 0.00 0.00 175.10 174.70 1pam s GLY 505 N 0.09 -0.30 1.00 4.51 0.00 -0.28 -4.57 107.32 107.78 1pam s GLY 505 Ca -0.01 1.17 -0.12 0.00 0.00 0.00 0.00 44.72 45.77 1pam s GLY 505 CO -0.00 1.08 1.09 2.56 0.00 0.00 0.00 173.10 177.82 1pam s PRO 506 N 0.42 0.40 0.00 2.90 0.04 -1.26 -0.79 135.00 136.71 1pam s PRO 506 Ca -0.02 0.60 0.17 0.00 0.04 0.00 0.00 61.00 61.79 1pam s PRO 506 Cb -0.04 -1.73 0.37 0.00 0.04 0.00 0.00 34.50 33.14 1pam s PRO 506 CO -0.02 -2.77 1.29 -1.33 0.04 0.00 0.00 177.00 174.21 1pam n MET 507 N -4.22 2.34 -3.62 4.56 2.81 -1.26 -4.86 117.12 112.87 1pam n MET 507 Ca 0.05 -2.10 -0.05 0.00 -1.81 0.00 0.00 57.70 53.80 1pam n MET 507 Cb 0.57 -1.40 -0.07 0.00 -0.71 0.00 0.00 33.22 31.61 1pam n MET 507 CO 0.00 0.00 0.00 1.41 1.51 0.00 0.00 175.97 178.89 1pam s MET 508 N -1.17 0.45 0.05 0.03 -2.45 -1.25 -0.65 119.30 114.30 1pam s MET 508 Ca 0.31 1.21 -0.28 0.00 -1.25 0.00 0.00 55.69 55.68 1pam s MET 508 Cb 0.18 0.56 0.09 0.00 1.25 0.00 0.00 34.83 36.91 1pam s MET 508 CO 0.24 -0.26 1.07 0.00 1.05 0.00 0.00 175.02 177.13 1pam s ALA 509 N 2.75 -1.89 0.46 4.11 0.00 -0.84 -4.82 121.76 121.52 1pam s ALA 509 Ca -0.02 0.55 -0.01 0.00 0.00 0.00 0.00 51.96 52.48 1pam s ALA 509 Cb -0.12 0.46 -0.01 0.00 0.00 0.00 0.00 23.12 23.45 1pam s ALA 509 CO -0.16 -0.96 0.70 -1.59 0.00 0.00 0.00 175.76 173.75 1pam s LYS 510 N -2.93 3.12 0.20 0.00 -2.85 -1.26 -0.80 119.74 115.23 1pam s LYS 510 Ca 0.11 -0.36 -0.31 0.00 -1.00 0.00 0.00 55.97 54.42 1pam s LYS 510 Cb 0.01 -2.52 -0.16 0.00 -2.06 0.00 0.00 37.83 33.10 1pam s LYS 510 CO -0.02 -0.28 0.94 -2.30 0.10 0.00 0.00 175.35 173.79 1pam n PRO 511 N -2.13 0.83 0.00 1.78 -0.02 -1.26 -2.65 135.00 131.55 1pam n PRO 511 Ca 0.01 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 1pam n PRO 511 Cb 0.57 -1.62 0.00 0.00 -0.02 0.00 0.00 33.50 32.43 1pam n PRO 511 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pam n GLY 512 N 1.72 3.12 3.76 -1.23 0.00 0.01 -4.94 105.19 107.62 1pam n GLY 512 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 1pam n GLY 512 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pam s VAL 513 N -2.65 3.89 -0.13 1.61 1.01 -1.08 -4.67 120.40 118.39 1pam s VAL 513 Ca 0.00 1.85 -0.26 0.00 0.00 0.00 0.00 61.98 63.57 1pam s VAL 513 Cb 0.00 -4.16 -0.02 0.00 0.00 0.00 0.00 36.38 32.21 1pam s VAL 513 CO 0.00 0.40 0.87 -0.89 0.00 0.00 0.00 175.10 175.48 1pam s THR 514 N -1.24 4.88 0.28 3.92 2.01 -1.26 -1.03 115.64 123.20 1pam s THR 514 Ca 0.44 1.74 0.08 0.00 0.31 0.00 0.00 61.69 64.25 1pam s THR 514 Cb -0.27 -4.18 -0.04 0.00 0.01 0.00 0.00 72.50 68.02 1pam s THR 514 CO 0.34 0.07 0.12 0.27 -0.69 0.00 0.00 174.62 174.72 1pam s ILE 515 N 1.82 3.79 -0.21 1.82 -4.36 0.17 -4.78 121.20 119.45 1pam s ILE 515 Ca 0.42 -1.64 -0.03 0.00 -0.26 0.00 0.00 60.65 59.13 1pam s ILE 515 Cb -0.17 -3.11 -0.01 0.00 1.25 0.00 0.00 42.46 40.42 1pam s ILE 515 CO 0.16 -0.32 -0.05 -0.89 0.24 0.00 0.00 174.94 174.07 1pam s THR 516 N -2.26 3.34 -0.23 8.37 2.01 0.03 -1.89 115.64 125.01 1pam s THR 516 Ca 0.34 -0.51 -0.04 0.00 0.31 0.00 0.00 61.69 61.79 1pam s THR 516 Cb -0.06 -2.50 -0.00 0.00 0.01 0.00 0.00 72.50 69.94 1pam s THR 516 CO 0.23 0.44 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.94 1pam s ILE 517 N 1.33 3.41 0.04 1.82 1.01 0.08 -1.12 121.20 127.77 1pam s ILE 517 Ca 0.04 -0.55 0.05 0.00 0.00 0.00 0.00 60.65 60.20 1pam s ILE 517 Cb -0.14 -2.59 -0.03 0.00 0.01 0.00 0.00 42.46 39.71 1pam s ILE 517 CO -0.03 0.37 -0.12 -1.81 0.00 0.00 0.00 174.94 173.36 1pam s ASP 518 N 1.47 4.28 0.00 3.58 1.01 -0.32 -0.62 116.67 126.06 1pam s ASP 518 Ca 0.05 -0.30 0.00 0.00 0.71 0.00 0.00 52.55 53.01 1pam s ASP 518 Cb -0.15 -0.86 0.00 0.00 1.01 0.00 0.00 42.92 42.93 1pam s ASP 518 CO -0.03 0.25 0.00 0.61 0.21 0.00 0.00 175.17 176.21 1pam n GLY 519 N 1.36 -0.89 3.13 0.21 0.00 -0.35 -0.27 105.19 108.38 1pam n GLY 519 Ca -0.15 -0.10 -0.08 0.00 0.00 0.00 0.00 46.02 45.69 1pam n GLY 519 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pam s ARG 520 N -0.57 0.69 -0.89 1.61 1.81 -0.52 -4.34 118.95 116.74 1pam s ARG 520 Ca 0.00 -1.06 0.00 0.00 -1.72 0.00 0.00 55.73 52.95 1pam s ARG 520 Cb 0.00 0.26 0.00 0.00 -0.45 0.00 0.00 34.95 34.76 1pam s ARG 520 CO 0.00 -0.17 0.00 0.41 -0.68 0.00 0.00 175.30 174.86 1pam n GLY 521 N 0.15 1.01 0.22 -3.53 0.00 -1.17 -0.79 105.19 101.09 1pam n GLY 521 Ca -0.15 -0.65 0.11 0.00 0.00 0.00 0.00 46.02 45.33 1pam n GLY 521 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1pam h PHE 522 N 0.00 0.00 -0.03 1.61 0.04 -1.67 -2.96 116.94 113.92 1pam h PHE 522 Ca -0.17 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.60 1pam h PHE 522 Cb 0.56 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.71 1pam h PHE 522 CO 0.24 0.14 -0.01 0.41 -0.60 0.00 0.00 178.31 178.48 1pam n GLY 523 N 0.59 -2.21 0.06 -1.45 0.00 -1.26 -4.56 105.19 96.37 1pam n GLY 523 Ca 0.02 -1.48 0.13 0.00 0.00 0.00 0.00 46.02 44.69 1pam n GLY 523 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1pam n SER 524 N -2.32 0.56 -4.82 1.61 7.64 -1.26 -3.26 113.62 111.76 1pam n SER 524 Ca -0.00 0.40 -0.35 0.00 1.01 0.00 0.00 58.87 59.93 1pam n SER 524 Cb 0.01 -0.44 -0.07 0.00 -1.01 0.00 0.00 64.21 62.70 1pam n SER 524 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1pam s GLY 525 N -3.39 2.06 0.28 0.23 0.00 -1.26 -4.77 107.32 100.47 1pam s GLY 525 Ca 0.11 -0.76 -0.30 0.00 0.00 0.00 0.00 44.72 43.77 1pam s GLY 525 CO 0.61 -0.57 1.34 0.28 0.00 0.00 0.00 173.10 174.76 1pam n LYS 526 N 1.61 2.02 0.00 2.90 5.02 -1.26 -4.25 118.16 124.20 1pam n LYS 526 Ca -0.16 0.71 0.00 0.00 -2.02 0.00 0.00 58.31 56.84 1pam n LYS 526 Cb 0.54 -2.32 0.00 0.00 -0.02 0.00 0.00 35.03 33.22 1pam n LYS 526 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1pam n GLY 527 N 1.61 3.28 3.01 0.72 0.00 -1.26 -4.22 105.19 108.33 1pam n GLY 527 Ca 0.09 -0.60 -0.15 0.00 0.00 0.00 0.00 46.02 45.35 1pam n GLY 527 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pam s THR 528 N 3.98 0.52 -0.08 2.61 2.01 0.11 -4.69 115.64 120.11 1pam s THR 528 Ca 0.00 -0.61 0.04 0.00 0.31 0.00 0.00 61.69 61.42 1pam s THR 528 Cb 0.00 -0.50 -0.01 0.00 0.01 0.00 0.00 72.50 71.99 1pam s THR 528 CO 0.00 -0.08 -0.19 -0.69 -0.69 0.00 0.00 174.62 172.97 1pam s VAL 529 N -0.66 2.59 -0.11 3.82 1.01 -0.76 -0.72 120.40 125.56 1pam s VAL 529 Ca -0.03 -0.86 -0.01 0.00 0.00 0.00 0.00 61.98 61.08 1pam s VAL 529 Cb -0.06 -2.01 -0.02 0.00 0.00 0.00 0.00 36.38 34.29 1pam s VAL 529 CO 0.00 0.56 -0.08 -0.31 0.00 0.00 0.00 175.10 175.27 1pam s TYR 530 N -0.13 2.92 -0.39 5.22 1.51 0.35 -0.13 117.35 126.70 1pam s TYR 530 Ca -0.03 -0.28 -0.06 0.00 -1.01 0.00 0.00 57.07 55.69 1pam s TYR 530 Cb -0.14 -1.83 0.08 0.00 -0.11 0.00 0.00 41.96 39.97 1pam s TYR 530 CO 0.04 0.04 0.19 -0.06 -1.11 0.00 0.00 175.55 174.65 1pam s PHE 531 N -0.08 3.40 0.00 2.71 0.40 -0.05 -2.18 117.98 122.18 1pam s PHE 531 Ca 0.00 -1.86 0.00 0.00 -0.60 0.00 0.00 56.93 54.47 1pam s PHE 531 Cb -0.13 -2.86 0.00 0.00 0.51 0.00 0.00 43.02 40.54 1pam s PHE 531 CO 0.03 -0.87 0.00 0.41 0.70 0.00 0.00 175.22 175.49 1pam n GLY 532 N 4.76 3.51 1.15 4.36 0.00 0.16 -1.76 105.19 117.37 1pam n GLY 532 Ca -0.08 -0.08 0.12 0.00 0.00 0.00 0.00 46.02 45.97 1pam n GLY 532 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1pam n THR 533 N 0.00 0.44 -2.98 2.61 -2.24 -1.26 -4.88 114.28 105.97 1pam n THR 533 Ca 0.00 -0.72 -0.42 0.00 -2.27 0.00 0.00 64.05 60.64 1pam n THR 533 Cb 0.00 1.06 -0.05 0.00 -2.10 0.00 0.00 70.33 69.23 1pam n THR 533 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1pam s THR 534 N -1.56 4.78 0.04 4.28 2.01 -0.72 -5.03 115.64 119.44 1pam s THR 534 Ca 0.38 0.97 -0.23 0.00 0.31 0.00 0.00 61.69 63.12 1pam s THR 534 Cb 0.23 -4.16 -0.06 0.00 0.01 0.00 0.00 72.50 68.52 1pam s THR 534 CO 0.32 -0.33 0.70 0.00 -0.69 0.00 0.00 174.62 174.61 1pam s ALA 535 N 2.98 3.43 -0.11 7.40 0.00 -1.26 -0.87 121.76 133.32 1pam s ALA 535 Ca 0.31 0.19 0.03 0.00 0.00 0.00 0.00 51.96 52.49 1pam s ALA 535 Cb -0.14 -2.89 0.00 0.00 0.00 0.00 0.00 23.12 20.10 1pam s ALA 535 CO 0.15 0.13 -0.23 0.08 0.00 0.00 0.00 175.76 175.90 1pam s VAL 536 N -0.24 1.99 0.32 0.00 1.01 0.82 -4.97 120.40 119.32 1pam s VAL 536 Ca 0.35 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.38 1pam s VAL 536 Cb -0.20 -1.73 -0.01 0.00 0.00 0.00 0.00 36.38 34.44 1pam s VAL 536 CO 0.21 0.54 0.37 0.42 0.00 0.00 0.00 175.10 176.64 1pam s THR 537 N 0.50 0.00 0.00 3.92 -4.23 -1.26 -1.83 115.64 112.73 1pam s THR 537 Ca -0.15 -1.77 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 1pam s THR 537 Cb -0.17 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.11 1pam s THR 537 CO 0.06 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.75 1pam n GLY 538 N -0.55 3.27 0.33 3.99 0.00 -1.26 -2.99 105.19 107.97 1pam n GLY 538 Ca 0.03 -0.07 0.21 0.00 0.00 0.00 0.00 46.02 46.19 1pam n GLY 538 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pam h ALA 539 N -0.69 1.09 0.00 4.61 0.00 -2.01 -0.55 119.26 121.70 1pam h ALA 539 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pam h ALA 539 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1pam h ALA 539 CO 0.00 0.01 0.00 -0.44 0.00 0.00 0.00 179.25 178.82 1pam h ASP 540 N 0.00 0.00 -3.58 0.00 3.32 -1.94 -3.37 116.42 110.85 1pam h ASP 540 Ca -0.00 0.00 -0.66 0.00 0.02 0.00 0.00 57.03 56.39 1pam h ASP 540 Cb 0.05 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 39.44 1pam h ASP 540 CO 0.00 0.00 0.05 -0.63 -1.72 0.00 0.00 179.24 176.94 1pam s ILE 541 N -3.19 4.88 0.16 0.35 1.01 -0.22 -0.78 121.20 123.40 1pam s ILE 541 Ca 0.08 0.01 -0.06 0.00 0.00 0.00 0.00 60.65 60.68 1pam s ILE 541 Cb 0.11 -4.17 -0.10 0.00 0.01 0.00 0.00 42.46 38.31 1pam s ILE 541 CO 0.55 -0.56 1.42 0.58 0.00 0.00 0.00 174.94 176.93 1pam h VAL 542 N 5.85 1.32 -2.63 2.92 2.07 -0.96 -3.47 116.25 121.35 1pam h VAL 542 Ca -0.26 -1.93 -0.10 0.00 0.82 0.00 0.00 66.70 65.23 1pam h VAL 542 Cb 1.10 1.90 -0.21 0.00 -1.52 0.00 0.00 31.29 32.56 1pam h VAL 542 CO 0.87 0.60 -0.13 0.00 0.02 0.00 0.00 177.57 178.93 1pam s ALA 543 N -3.84 -1.15 -0.13 1.67 0.00 -0.82 -4.95 121.76 112.53 1pam s ALA 543 Ca -0.08 0.96 -0.06 0.00 0.00 0.00 0.00 51.96 52.78 1pam s ALA 543 Cb 0.10 -0.30 0.06 0.00 0.00 0.00 0.00 23.12 22.97 1pam s ALA 543 CO 0.86 -0.27 0.30 -0.46 0.00 0.00 0.00 175.76 176.19 1pam s TRP 544 N -0.63 -0.45 0.32 0.00 -0.11 -1.26 -1.07 118.94 115.75 1pam s TRP 544 Ca -0.07 0.99 -0.05 0.00 1.22 0.00 0.00 56.10 58.19 1pam s TRP 544 Cb -0.03 0.10 0.02 0.00 -1.50 0.00 0.00 33.47 32.05 1pam s TRP 544 CO 0.04 -0.30 0.52 -0.85 -4.62 0.00 0.00 176.95 171.73 1pam n GLU 545 N 4.57 0.74 -0.01 5.86 0.28 -0.57 -4.85 120.64 126.67 1pam n GLU 545 Ca -0.19 -2.28 0.02 0.00 -0.16 0.00 0.00 57.16 54.55 1pam n GLU 545 Cb 0.52 2.38 0.37 0.00 1.43 0.00 0.00 31.44 36.15 1pam n GLU 545 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 177.13 177.19 1pam h ASP 546 N 1.73 0.49 -0.01 -1.84 3.58 -1.88 -2.93 116.42 115.56 1pam h ASP 546 Ca -0.26 -0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.15 1pam h ASP 546 Cb 1.05 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.98 1pam h ASP 546 CO 0.34 0.43 -0.53 0.35 -2.88 0.00 0.00 179.24 176.95 1pam n THR 547 N -4.40 0.00 -3.69 2.25 -2.24 -1.26 -2.06 114.28 102.88 1pam n THR 547 Ca 0.03 -0.23 -0.12 0.00 -2.27 0.00 0.00 64.05 61.45 1pam n THR 547 Cb 0.12 1.14 -0.09 0.00 -2.10 0.00 0.00 70.33 69.40 1pam n THR 547 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1pam s GLN 548 N -2.27 0.60 -0.02 -0.78 0.74 -1.11 -1.21 119.66 115.61 1pam s GLN 548 Ca 0.12 0.80 0.05 0.00 0.05 0.00 0.00 55.36 56.39 1pam s GLN 548 Cb 0.14 0.23 -0.01 0.00 1.10 0.00 0.00 33.01 34.47 1pam s GLN 548 CO 0.54 -0.10 -0.18 0.42 -0.55 0.00 0.00 175.29 175.43 1pam s ILE 549 N 0.61 1.45 -0.15 -2.34 1.01 0.20 -1.52 121.20 120.47 1pam s ILE 549 Ca -0.03 -0.77 0.01 0.00 0.00 0.00 0.00 60.65 59.87 1pam s ILE 549 Cb -0.05 -1.22 0.00 0.00 0.01 0.00 0.00 42.46 41.21 1pam s ILE 549 CO -0.04 0.41 -0.18 -1.10 0.00 0.00 0.00 174.94 174.03 1pam s GLN 550 N -0.30 3.14 0.02 2.79 -0.21 -0.23 -0.74 119.66 124.13 1pam s GLN 550 Ca 0.04 -0.79 0.00 0.00 0.02 0.00 0.00 55.36 54.63 1pam s GLN 550 Cb -0.08 -2.54 -0.02 0.00 1.00 0.00 0.00 33.01 31.36 1pam s GLN 550 CO 0.00 0.01 -0.03 0.54 -2.12 0.00 0.00 175.29 173.69 1pam s VAL 551 N 0.80 0.15 0.05 1.09 0.11 -0.79 -0.48 120.40 121.32 1pam s VAL 551 Ca -0.06 -0.98 -0.23 0.00 -2.93 0.00 0.00 61.98 57.77 1pam s VAL 551 Cb -0.15 -0.37 -0.06 0.00 -1.53 0.00 0.00 36.38 34.27 1pam s VAL 551 CO -0.00 -0.52 0.70 -0.54 -3.33 0.00 0.00 175.10 171.40 1pam s LYS 552 N -1.63 4.43 0.09 1.54 1.02 0.04 -0.65 119.74 124.58 1pam s LYS 552 Ca -0.14 0.95 -0.31 0.00 0.02 0.00 0.00 55.97 56.49 1pam s LYS 552 Cb -0.09 -3.34 -0.09 0.00 -0.52 0.00 0.00 37.83 33.79 1pam s LYS 552 CO -0.01 0.37 1.75 0.42 -0.92 0.00 0.00 175.35 176.95 1pam s ILE 553 N -0.29 2.79 0.90 2.17 1.01 -0.20 -4.84 121.20 122.73 1pam s ILE 553 Ca 0.35 0.25 -0.11 0.00 0.00 0.00 0.00 60.65 61.14 1pam s ILE 553 Cb -0.20 -3.16 0.13 0.00 0.01 0.00 0.00 42.46 39.24 1pam s ILE 553 CO 0.21 -0.00 1.09 -2.16 0.00 0.00 0.00 174.94 174.09 1pam s PRO 554 N 2.77 1.25 -1.33 2.79 0.04 -1.26 -0.81 135.00 138.44 1pam s PRO 554 Ca 0.78 1.02 -0.12 0.00 0.04 0.00 0.00 61.00 62.71 1pam s PRO 554 Cb -0.43 -1.79 0.11 0.00 0.04 0.00 0.00 34.50 32.43 1pam s PRO 554 CO 0.35 -2.30 1.92 0.00 0.04 0.00 0.00 177.00 177.00 1pam n ALA 555 N -3.95 5.01 -2.94 8.56 0.00 -1.26 -4.59 120.51 121.34 1pam n ALA 555 Ca 0.08 -4.11 -0.22 0.00 0.00 0.00 0.00 53.44 49.19 1pam n ALA 555 Cb 0.54 -3.25 -0.03 0.00 0.00 0.00 0.00 19.45 16.72 1pam n ALA 555 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1pam s VAL 556 N 1.93 5.13 0.61 0.00 -7.23 -1.26 -5.10 120.40 114.48 1pam s VAL 556 Ca 0.44 -1.03 -0.18 0.00 -1.81 0.00 0.00 61.98 59.41 1pam s VAL 556 Cb 0.09 -3.77 -0.06 0.00 0.56 0.00 0.00 36.38 33.19 1pam s VAL 556 CO -0.02 -0.31 0.66 -2.65 -0.31 0.00 0.00 175.10 172.48 1pam n PRO 557 N -1.27 0.57 -1.96 4.82 -0.02 -1.26 -4.92 135.00 130.95 1pam n PRO 557 Ca -0.09 0.23 -0.41 0.00 -2.02 0.00 0.00 63.50 61.21 1pam n PRO 557 Cb 0.57 -1.87 -0.01 0.00 -0.02 0.00 0.00 33.50 32.17 1pam n PRO 557 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1pam s GLY 558 N -1.27 2.97 0.00 -1.23 0.00 -1.26 -4.87 107.32 101.65 1pam s GLY 558 Ca 0.71 1.41 0.00 0.00 0.00 0.00 0.00 44.72 46.83 1pam s GLY 558 CO 0.53 2.07 0.00 0.61 0.00 0.00 0.00 173.10 176.30 1pam n GLY 559 N 0.63 -1.61 3.63 0.20 0.00 -0.33 -4.63 105.19 103.08 1pam n GLY 559 Ca 0.01 -1.20 -0.35 0.00 0.00 0.00 0.00 46.02 44.47 1pam n GLY 559 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pam s ILE 560 N -2.83 4.97 0.09 -0.61 -1.09 -1.26 -0.51 121.20 119.97 1pam s ILE 560 Ca 0.00 0.04 0.09 0.00 -2.23 0.00 0.00 60.65 58.55 1pam s ILE 560 Cb 0.00 -3.28 -0.03 0.00 -1.58 0.00 0.00 42.46 37.56 1pam s ILE 560 CO 0.00 0.40 -0.22 -0.31 -1.23 0.00 0.00 174.94 173.58 1pam s TYR 561 N 0.77 1.94 0.07 3.97 1.51 0.15 -4.91 117.35 120.85 1pam s TYR 561 Ca 0.05 -0.40 -0.13 0.00 -1.01 0.00 0.00 57.07 55.59 1pam s TYR 561 Cb -0.13 -1.09 -0.06 0.00 -0.11 0.00 0.00 41.96 40.57 1pam s TYR 561 CO 0.02 0.20 0.44 -0.51 -1.11 0.00 0.00 175.55 174.60 1pam s ASP 562 N -1.73 6.75 -0.05 2.29 1.01 -1.26 -1.91 116.67 121.78 1pam s ASP 562 Ca 0.09 0.93 0.02 0.00 0.71 0.00 0.00 52.55 54.29 1pam s ASP 562 Cb -0.10 -2.23 -0.03 0.00 1.01 0.00 0.00 42.92 41.57 1pam s ASP 562 CO 0.04 0.21 -0.07 -0.63 0.21 0.00 0.00 175.17 174.93 1pam s ILE 563 N -1.30 3.69 -0.03 0.77 1.01 0.17 -0.66 121.20 124.84 1pam s ILE 563 Ca 0.31 -0.57 -0.13 0.00 0.00 0.00 0.00 60.65 60.26 1pam s ILE 563 Cb -0.15 -2.54 0.02 0.00 0.01 0.00 0.00 42.46 39.80 1pam s ILE 563 CO 0.17 0.54 0.28 -0.60 0.00 0.00 0.00 174.94 175.33 1pam s ARG 564 N -1.00 0.57 0.01 2.79 3.52 -0.93 -0.73 118.95 123.18 1pam s ARG 564 Ca 0.14 -0.08 0.07 0.00 -0.13 0.00 0.00 55.73 55.72 1pam s ARG 564 Cb -0.11 0.25 -0.03 0.00 -1.56 0.00 0.00 34.95 33.50 1pam s ARG 564 CO 0.03 -0.14 -0.20 0.08 -0.81 0.00 0.00 175.30 174.27 1pam s VAL 565 N -0.99 2.65 -0.11 7.11 1.01 -1.26 -0.50 120.40 128.31 1pam s VAL 565 Ca -0.11 -1.08 0.01 0.00 0.00 0.00 0.00 61.98 60.81 1pam s VAL 565 Cb -0.05 -2.05 0.02 0.00 0.00 0.00 0.00 36.38 34.29 1pam s VAL 565 CO 0.03 0.45 -0.14 0.00 0.00 0.00 0.00 175.10 175.44 1pam s ALA 566 N -0.81 1.63 1.14 5.51 0.00 0.10 0.14 121.76 129.48 1pam s ALA 566 Ca 0.13 -0.71 -0.18 0.00 0.00 0.00 0.00 51.96 51.20 1pam s ALA 566 Cb -0.10 -0.86 0.26 0.00 0.00 0.00 0.00 23.12 22.42 1pam s ALA 566 CO 0.03 -0.16 1.17 0.54 0.00 0.00 0.00 175.76 177.33 1pam s ASN 567 N 1.15 1.51 0.62 0.00 2.20 -0.01 -0.71 114.94 119.70 1pam s ASN 567 Ca -0.04 0.54 0.37 0.00 -0.94 0.00 0.00 52.86 52.79 1pam s ASN 567 Cb -0.14 -0.73 2.05 0.00 -2.00 0.00 0.00 41.25 40.42 1pam s ASN 567 CO -0.04 -3.75 2.28 0.00 -2.94 0.00 0.00 177.10 172.65 1pam h ALA 568 N -2.33 1.23 -0.01 3.54 0.00 -1.74 0.31 119.26 120.26 1pam h ALA 568 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1pam h ALA 568 Cb 1.28 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1pam h ALA 568 CO 0.35 0.02 -0.02 0.00 0.00 0.00 0.00 179.25 179.60 1pam n ALA 569 N -2.19 2.65 -0.47 0.00 0.00 -1.26 -4.94 120.51 114.29 1pam n ALA 569 Ca -0.03 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.07 1pam n ALA 569 Cb 0.11 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.26 1pam n ALA 569 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pam n GLY 570 N 1.13 0.74 3.70 0.00 0.00 0.10 -5.04 105.19 105.82 1pam n GLY 570 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 1pam n GLY 570 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pam s ALA 571 N -2.90 3.39 0.13 4.61 0.00 -1.26 -4.77 121.76 120.97 1pam s ALA 571 Ca 0.00 0.68 0.01 0.00 0.00 0.00 0.00 51.96 52.65 1pam s ALA 571 Cb 0.00 -3.45 -0.04 0.00 0.00 0.00 0.00 23.12 19.63 1pam s ALA 571 CO 0.00 -0.54 0.28 0.00 0.00 0.00 0.00 175.76 175.50 1pam s ALA 572 N 1.57 3.96 0.70 0.00 0.00 -1.26 -0.83 121.76 125.90 1pam s ALA 572 Ca 0.56 -0.94 -0.00 0.00 0.00 0.00 0.00 51.96 51.57 1pam s ALA 572 Cb -0.25 -1.83 0.13 0.00 0.00 0.00 0.00 23.12 21.16 1pam s ALA 572 CO 0.25 0.61 0.88 -1.13 0.00 0.00 0.00 175.76 176.37 1pam n SER 573 N -0.32 1.17 -4.70 0.00 3.41 0.12 -4.70 113.62 108.60 1pam n SER 573 Ca -0.06 -1.99 -0.31 0.00 -0.26 0.00 0.00 58.87 56.25 1pam n SER 573 Cb 0.53 -0.57 0.14 0.00 -0.26 0.00 0.00 64.21 64.06 1pam n SER 573 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1pam s ASN 574 N -4.56 3.35 -0.03 4.04 4.22 -1.26 -4.78 114.94 115.92 1pam s ASN 574 Ca 0.58 2.12 -0.22 0.00 -2.14 0.00 0.00 52.86 53.21 1pam s ASN 574 Cb -0.03 -2.56 -0.05 0.00 1.28 0.00 0.00 41.25 39.89 1pam s ASN 574 CO 0.38 -2.81 0.63 -0.63 -2.04 0.00 0.00 177.10 172.63 1pam s ILE 575 N -2.66 4.97 -0.35 0.54 1.01 -1.26 -4.59 121.20 118.86 1pam s ILE 575 Ca 0.66 1.32 -0.05 0.00 0.00 0.00 0.00 60.65 62.58 1pam s ILE 575 Cb -0.22 -3.97 0.05 0.00 0.01 0.00 0.00 42.46 38.33 1pam s ILE 575 CO 0.57 0.35 0.11 -0.47 0.00 0.00 0.00 174.94 175.49 1pam s TYR 576 N 0.24 3.31 0.60 3.97 6.14 0.09 -4.95 117.35 126.74 1pam s TYR 576 Ca 0.33 -1.67 0.02 0.00 0.64 0.00 0.00 57.07 56.40 1pam s TYR 576 Cb -0.18 -2.42 0.11 0.00 0.42 0.00 0.00 41.96 39.90 1pam s TYR 576 CO 0.17 -0.79 0.82 -0.40 0.64 0.00 0.00 175.55 175.99 1pam n ASP 577 N 4.75 1.36 -1.33 4.32 5.75 -1.26 -0.65 116.55 129.49 1pam n ASP 577 Ca -0.11 -2.09 -0.12 0.00 -0.01 0.00 0.00 54.79 52.46 1pam n ASP 577 Cb 0.44 -0.51 -0.02 0.00 -1.03 0.00 0.00 41.12 40.00 1pam n ASP 577 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1pam n ASN 578 N -2.78 -4.04 -4.72 -1.12 4.05 -1.21 -4.91 115.26 100.54 1pam n ASN 578 Ca 0.14 0.05 -0.41 0.00 0.45 0.00 0.00 54.58 54.81 1pam n ASN 578 Cb 0.51 -3.12 -0.04 0.00 1.23 0.00 0.00 39.78 38.36 1pam n ASN 578 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 177.26 174.33 1pam s PHE 579 N -2.59 3.66 -0.24 1.20 5.36 -0.80 -4.86 117.98 119.70 1pam s PHE 579 Ca 0.00 1.56 -0.08 0.00 -0.96 0.00 0.00 56.93 57.45 1pam s PHE 579 Cb 0.00 -2.99 -0.03 0.00 -0.34 0.00 0.00 43.02 39.66 1pam s PHE 579 CO 0.00 0.07 0.08 -2.00 -1.46 0.00 0.00 175.22 171.91 1pam s GLU 580 N 0.74 3.71 -0.24 10.12 2.12 0.18 -0.67 118.70 134.65 1pam s GLU 580 Ca 0.46 -0.45 -0.18 0.00 0.36 0.00 0.00 54.97 55.16 1pam s GLU 580 Cb -0.20 -3.34 -0.03 0.00 0.26 0.00 0.00 34.13 30.82 1pam s GLU 580 CO 0.25 -0.14 0.50 0.08 -0.54 0.00 0.00 175.26 175.41 1pam s VAL 581 N 1.50 5.09 0.45 3.70 1.01 0.34 -1.99 120.40 130.49 1pam s VAL 581 Ca 0.06 0.87 -0.20 0.00 0.00 0.00 0.00 61.98 62.71 1pam s VAL 581 Cb -0.15 -3.82 -0.10 0.00 0.00 0.00 0.00 36.38 32.31 1pam s VAL 581 CO 0.04 0.12 0.95 -0.76 0.00 0.00 0.00 175.10 175.45 1pam s LEU 582 N 2.10 3.86 0.53 3.92 1.43 0.02 -1.18 118.68 129.35 1pam s LEU 582 Ca 0.21 1.65 0.25 0.00 -1.03 0.00 0.00 54.13 55.21 1pam s LEU 582 Cb -0.16 -4.52 1.45 0.00 0.03 0.00 0.00 46.19 43.00 1pam s LEU 582 CO 0.09 -0.41 2.11 0.74 0.23 0.00 0.00 176.35 179.11 1pam h THR 583 N 1.66 0.69 0.00 5.49 2.02 -1.92 -3.40 112.91 117.45 1pam h THR 583 Ca -0.48 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 66.31 1pam h THR 583 Cb 1.18 1.24 0.00 0.00 -1.74 0.00 0.00 68.15 68.83 1pam h THR 583 CO 0.61 0.09 0.00 0.61 0.37 0.00 0.00 175.52 177.21 1pam n GLY 584 N -0.96 -0.65 3.73 2.16 0.00 -1.26 -4.93 105.19 103.28 1pam n GLY 584 Ca -0.02 -0.82 -0.34 0.00 0.00 0.00 0.00 46.02 44.84 1pam n GLY 584 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1pam s ASP 585 N -4.00 4.37 0.09 1.61 1.01 -1.26 -4.78 116.67 113.70 1pam s ASP 585 Ca 0.00 2.25 0.07 0.00 0.71 0.00 0.00 52.55 55.57 1pam s ASP 585 Cb 0.00 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.31 1pam s ASP 585 CO 0.00 -2.14 -0.10 -1.10 0.21 0.00 0.00 175.17 172.04 1pam s GLN 586 N -4.01 2.18 0.08 8.23 -1.52 -1.26 -0.17 119.66 123.19 1pam s GLN 586 Ca 0.72 -0.98 0.03 0.00 -1.95 0.00 0.00 55.36 53.18 1pam s GLN 586 Cb -0.26 -2.33 -0.03 0.00 -0.22 0.00 0.00 33.01 30.17 1pam s GLN 586 CO 0.45 0.52 -0.09 0.14 -0.25 0.00 0.00 175.29 176.06 1pam s VAL 587 N -1.18 0.80 -0.24 1.09 -7.23 -0.10 -4.74 120.40 108.81 1pam s VAL 587 Ca 0.21 -1.44 -0.12 0.00 -1.81 0.00 0.00 61.98 58.81 1pam s VAL 587 Cb -0.11 -1.11 -0.05 0.00 0.56 0.00 0.00 36.38 35.67 1pam s VAL 587 CO 0.13 -0.49 0.24 -0.89 -0.31 0.00 0.00 175.10 173.77 1pam s THR 588 N -2.08 5.30 -0.08 5.32 2.01 -1.26 -0.70 115.64 124.16 1pam s THR 588 Ca 0.00 0.34 0.01 0.00 0.31 0.00 0.00 61.69 62.35 1pam s THR 588 Cb -0.05 -3.58 -0.03 0.00 0.01 0.00 0.00 72.50 68.85 1pam s THR 588 CO -0.00 0.29 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.44 1pam s VAL 589 N 1.30 3.48 -0.28 3.82 1.01 -0.45 -3.48 120.40 125.81 1pam s VAL 589 Ca 0.11 -0.55 -0.18 0.00 0.00 0.00 0.00 61.98 61.36 1pam s VAL 589 Cb -0.14 -2.43 -0.02 0.00 0.00 0.00 0.00 36.38 33.79 1pam s VAL 589 CO 0.07 0.58 0.54 -0.60 0.00 0.00 0.00 175.10 175.68 1pam s ARG 590 N -0.52 4.00 -0.18 2.72 3.52 0.28 -1.08 118.95 127.69 1pam s ARG 590 Ca 0.07 0.28 -0.09 0.00 -0.13 0.00 0.00 55.73 55.87 1pam s ARG 590 Cb -0.12 -3.68 -0.05 0.00 -1.56 0.00 0.00 34.95 29.55 1pam s ARG 590 CO 0.02 -0.41 0.13 -0.06 -0.81 0.00 0.00 175.30 174.16 1pam s PHE 591 N 2.37 3.43 -0.07 5.12 0.40 -0.41 0.07 117.98 128.90 1pam s PHE 591 Ca 0.22 0.35 0.02 0.00 -0.60 0.00 0.00 56.93 56.92 1pam s PHE 591 Cb -0.15 -2.11 0.01 0.00 0.51 0.00 0.00 43.02 41.28 1pam s PHE 591 CO 0.10 0.36 -0.13 0.08 0.70 0.00 0.00 175.22 176.33 1pam s VAL 592 N 0.10 1.19 -0.09 -0.44 1.01 0.19 -1.84 120.40 120.52 1pam s VAL 592 Ca 0.09 -0.51 0.01 0.00 0.00 0.00 0.00 61.98 61.58 1pam s VAL 592 Cb -0.11 -1.09 0.02 0.00 0.00 0.00 0.00 36.38 35.20 1pam s VAL 592 CO -0.01 0.37 -0.12 -0.51 0.00 0.00 0.00 175.10 174.83 1pam s ILE 593 N 0.69 1.24 0.16 2.22 1.10 -0.28 -0.65 121.20 125.68 1pam s ILE 593 Ca -0.14 -0.49 0.03 0.00 -0.51 0.00 0.00 60.65 59.54 1pam s ILE 593 Cb -0.16 -1.16 -0.03 0.00 0.15 0.00 0.00 42.46 41.26 1pam s ILE 593 CO 0.03 0.39 0.29 0.20 -2.11 0.00 0.00 174.94 173.74 1pam s ASN 594 N 1.07 6.32 -1.51 4.50 0.01 0.91 -1.12 114.94 125.12 1pam s ASN 594 Ca -0.06 0.15 -0.13 0.00 -0.71 0.00 0.00 52.86 52.11 1pam s ASN 594 Cb -0.15 -1.90 0.07 0.00 0.41 0.00 0.00 41.25 39.69 1pam s ASN 594 CO -0.02 0.04 1.01 0.59 -1.51 0.00 0.00 177.10 177.22 1pam n ASN 595 N -0.65 -5.02 -4.35 -1.22 4.13 -1.05 -1.21 115.26 105.89 1pam n ASN 595 Ca -0.07 -0.75 -0.46 0.00 1.68 0.00 0.00 54.58 54.99 1pam n ASN 595 Cb 0.54 -4.05 -0.01 0.00 -1.54 0.00 0.00 39.78 34.72 1pam n ASN 595 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1pam s ALA 596 N -3.31 4.38 0.06 5.41 0.00 -0.37 -4.70 121.76 123.23 1pam s ALA 596 Ca 0.65 -3.57 -0.31 0.00 0.00 0.00 0.00 51.96 48.74 1pam s ALA 596 Cb -0.32 -3.63 -0.06 0.00 0.00 0.00 0.00 23.12 19.11 1pam s ALA 596 CO 0.82 -2.32 1.21 0.99 0.00 0.00 0.00 175.76 176.45 1pam s THR 597 N -0.31 3.99 0.33 0.00 2.01 -1.26 -4.77 115.64 115.64 1pam s THR 597 Ca 0.27 1.43 0.07 0.00 0.31 0.00 0.00 61.69 63.77 1pam s THR 597 Cb -0.09 -3.91 -0.07 0.00 0.01 0.00 0.00 72.50 68.44 1pam s THR 597 CO -0.08 0.11 -0.04 0.42 -0.69 0.00 0.00 174.62 174.34 1pam s THR 598 N 1.09 1.85 0.00 -0.82 -4.23 -1.26 -5.10 115.64 107.16 1pam s THR 598 Ca 0.59 -2.11 0.00 0.00 -1.18 0.00 0.00 61.69 58.99 1pam s THR 598 Cb -0.30 -2.67 0.00 0.00 1.34 0.00 0.00 72.50 70.87 1pam s THR 598 CO 0.29 -0.17 0.00 0.00 -0.54 0.00 0.00 174.62 174.20 1pam n ALA 599 N -0.74 0.00 -1.55 3.99 0.00 -1.26 -4.93 120.51 116.02 1pam n ALA 599 Ca -0.05 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.26 1pam n ALA 599 Cb 0.65 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 20.01 1pam n ALA 599 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1pam n LEU 600 N 0.00 1.41 -0.49 0.00 -0.00 -1.26 -2.25 117.00 114.41 1pam n LEU 600 Ca 0.00 -1.64 -0.04 0.00 -0.00 0.00 0.00 56.01 54.33 1pam n LEU 600 Cb 0.00 -1.58 -0.00 0.00 -0.00 0.00 0.00 43.42 41.83 1pam n LEU 600 CO 0.00 -2.76 -0.06 0.61 -0.00 0.00 0.00 177.39 175.18 1pam n GLY 601 N 6.54 0.20 3.79 1.47 0.00 -1.26 -5.02 105.19 110.91 1pam n GLY 601 Ca 0.46 -0.71 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 1pam n GLY 601 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1pam s GLN 602 N -4.18 4.05 0.24 1.61 0.74 -0.95 -4.58 119.66 116.59 1pam s GLN 602 Ca 0.00 0.28 0.06 0.00 0.05 0.00 0.00 55.36 55.76 1pam s GLN 602 Cb 0.00 -3.32 -0.05 0.00 1.10 0.00 0.00 33.01 30.74 1pam s GLN 602 CO 0.00 0.47 -0.08 -0.80 -0.55 0.00 0.00 175.29 174.33 1pam s ASN 603 N -0.32 2.54 -0.07 6.67 0.01 -0.82 -4.48 114.94 118.46 1pam s ASN 603 Ca 0.21 -1.14 -0.08 0.00 -0.71 0.00 0.00 52.86 51.15 1pam s ASN 603 Cb -0.15 -0.13 -0.04 0.00 0.41 0.00 0.00 41.25 41.34 1pam s ASN 603 CO 0.09 -0.31 0.22 -0.69 -1.51 0.00 0.00 177.10 174.90 1pam s VAL 604 N -3.07 5.38 0.14 1.60 1.01 -1.26 -1.35 120.40 122.84 1pam s VAL 604 Ca 0.27 0.31 0.02 0.00 0.00 0.00 0.00 61.98 62.58 1pam s VAL 604 Cb 0.03 -3.49 -0.04 0.00 0.00 0.00 0.00 36.38 32.87 1pam s VAL 604 CO 0.09 0.56 -0.04 -0.36 0.00 0.00 0.00 175.10 175.35 1pam s PHE 605 N -1.10 1.07 -0.02 5.22 0.40 0.19 -1.22 117.98 122.52 1pam s PHE 605 Ca 0.19 -0.94 0.07 0.00 -0.60 0.00 0.00 56.93 55.65 1pam s PHE 605 Cb -0.13 -0.60 -0.02 0.00 0.51 0.00 0.00 43.02 42.78 1pam s PHE 605 CO 0.08 -0.15 -0.23 -1.17 0.70 0.00 0.00 175.22 174.45 1pam s LEU 606 N -3.11 2.05 0.22 -0.37 2.96 -0.20 -0.97 118.68 119.25 1pam s LEU 606 Ca 0.18 -0.42 -0.07 0.00 -0.22 0.00 0.00 54.13 53.60 1pam s LEU 606 Cb 0.05 -1.19 -0.02 0.00 0.50 0.00 0.00 46.19 45.53 1pam s LEU 606 CO -0.00 0.28 0.29 0.28 -1.32 0.00 0.00 176.35 175.88 1pam s THR 607 N -0.55 0.01 0.01 3.68 -1.32 -0.78 0.28 115.64 116.97 1pam s THR 607 Ca 0.09 -1.70 -0.05 0.00 -1.21 0.00 0.00 61.69 58.81 1pam s THR 607 Cb -0.09 -2.33 0.02 0.00 -1.51 0.00 0.00 72.50 68.59 1pam s THR 607 CO -0.01 -0.02 0.23 0.61 -2.21 0.00 0.00 174.62 173.22 1pam n GLY 608 N -0.31 0.82 0.91 6.08 0.00 -0.96 -1.69 105.19 110.03 1pam n GLY 608 Ca -0.00 -0.91 0.06 0.00 0.00 0.00 0.00 46.02 45.16 1pam n GLY 608 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1pam n ASN 609 N -0.50 2.63 -4.51 1.61 6.94 -0.51 -0.87 115.26 120.05 1pam n ASN 609 Ca 0.00 -2.16 -0.24 0.00 -0.02 0.00 0.00 54.58 52.17 1pam n ASN 609 Cb 0.11 -0.37 -0.09 0.00 -2.36 0.00 0.00 39.78 37.07 1pam n ASN 609 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 1pam s VAL 610 N -1.61 2.73 0.43 3.53 -7.23 -1.26 -4.84 120.40 112.15 1pam s VAL 610 Ca 0.28 -2.24 0.22 0.00 -1.81 0.00 0.00 61.98 58.43 1pam s VAL 610 Cb 0.17 -2.43 0.24 0.00 0.56 0.00 0.00 36.38 34.92 1pam s VAL 610 CO 0.16 -0.37 2.04 0.77 -0.31 0.00 0.00 175.10 177.39 1pam h SER 611 N 2.25 0.00 0.47 4.85 4.64 -1.89 -0.09 113.55 123.78 1pam h SER 611 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1pam h SER 611 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1pam h SER 611 CO 0.59 0.15 0.00 -0.33 -0.87 0.00 0.00 176.83 176.37 1pam h GLU 612 N 0.00 0.00 -0.49 4.77 3.07 -1.93 -0.76 114.58 119.24 1pam h GLU 612 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1pam h GLU 612 Cb 0.33 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.24 1pam h GLU 612 CO 0.02 0.00 0.00 1.28 -1.40 0.00 0.00 179.01 178.91 1pam n LEU 613 N -3.08 3.87 0.00 1.33 4.32 -0.09 -4.95 117.00 118.40 1pam n LEU 613 Ca -0.01 -2.34 0.00 0.00 -0.02 0.00 0.00 56.01 53.64 1pam n LEU 613 Cb 0.18 -0.44 0.00 0.00 -1.62 0.00 0.00 43.42 41.54 1pam n LEU 613 CO 0.23 0.78 0.00 0.61 -1.22 0.00 0.00 177.39 177.80 1pam n GLY 614 N 0.68 0.72 4.00 -0.72 0.00 -0.29 -2.27 105.19 107.32 1pam n GLY 614 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.94 1pam n GLY 614 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1pam n ASN 615 N 0.00 -1.30 0.00 1.61 5.03 -0.94 -1.56 115.26 118.09 1pam n ASN 615 Ca 0.00 -0.99 0.00 0.00 0.87 0.00 0.00 54.58 54.46 1pam n ASN 615 Cb 0.00 -3.08 0.00 0.00 -1.02 0.00 0.00 39.78 35.68 1pam n ASN 615 CO 0.00 0.00 0.00 0.79 -1.83 0.00 0.00 177.26 176.22 1pam n TRP 616 N -4.42 0.00 -2.79 3.10 7.02 -0.05 -4.94 117.44 115.37 1pam n TRP 616 Ca -0.20 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 55.85 1pam n TRP 616 Cb 0.63 -0.89 -0.03 0.00 -2.42 0.00 0.00 31.31 28.60 1pam n TRP 616 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 1pam s ASP 617 N -2.32 6.82 0.49 -0.99 2.15 -0.60 -4.91 116.67 117.30 1pam s ASP 617 Ca 0.00 0.90 0.16 0.00 0.43 0.00 0.00 52.55 54.05 1pam s ASP 617 Cb 0.00 -2.47 1.19 0.00 -0.30 0.00 0.00 42.92 41.34 1pam s ASP 617 CO 0.00 -0.72 2.07 -0.65 -0.17 0.00 0.00 175.17 175.71 1pam h PRO 618 N 8.02 0.15 0.00 4.34 0.11 -1.94 0.22 132.00 142.90 1pam h PRO 618 Ca -0.22 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1pam h PRO 618 Cb 1.08 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1pam h PRO 618 CO 0.95 0.10 0.00 -0.91 -0.21 0.00 0.00 178.00 177.93 1pam h ASN 619 N 0.16 0.00 -0.15 -2.05 4.21 -1.96 -2.61 115.58 113.19 1pam h ASN 619 Ca 0.12 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.63 1pam h ASN 619 Cb 0.30 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.50 1pam h ASN 619 CO -0.02 0.00 0.00 0.59 -1.29 0.00 0.00 177.43 176.71 1pam n ASN 620 N -2.49 3.02 -4.78 5.81 4.13 0.75 -5.07 115.26 116.63 1pam n ASN 620 Ca 0.01 -2.82 -0.32 0.00 1.68 0.00 0.00 54.58 53.13 1pam n ASN 620 Cb 0.21 -0.41 0.06 0.00 -1.54 0.00 0.00 39.78 38.10 1pam n ASN 620 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1pam s ALA 621 N -2.44 2.45 -0.08 5.41 0.00 -0.98 -4.11 121.76 122.01 1pam s ALA 621 Ca 0.32 0.44 -0.28 0.00 0.00 0.00 0.00 51.96 52.44 1pam s ALA 621 Cb 0.26 -3.29 -0.02 0.00 0.00 0.00 0.00 23.12 20.06 1pam s ALA 621 CO 0.07 -1.35 0.91 0.42 0.00 0.00 0.00 175.76 175.80 1pam s ILE 622 N -2.53 4.88 -5.00 0.00 -1.09 0.14 -4.86 121.20 112.74 1pam s ILE 622 Ca 0.65 1.87 0.00 0.00 -2.23 0.00 0.00 60.65 60.94 1pam s ILE 622 Cb -0.19 -4.24 0.00 0.00 -1.58 0.00 0.00 42.46 36.45 1pam s ILE 622 CO 0.45 0.10 0.00 0.61 -1.23 0.00 0.00 174.94 174.88 1pam n GLY 623 N 3.10 0.60 3.77 6.18 0.00 -1.26 -1.03 105.19 116.54 1pam n GLY 623 Ca 0.05 -1.79 -0.40 0.00 0.00 0.00 0.00 46.02 43.89 1pam n GLY 623 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1pam s PRO 624 N -2.00 4.24 0.97 1.61 0.04 -1.26 -5.07 135.00 133.53 1pam s PRO 624 Ca 0.00 2.02 -0.12 0.00 0.04 0.00 0.00 61.00 62.95 1pam s PRO 624 Cb 0.00 -2.91 0.17 0.00 0.04 0.00 0.00 34.50 31.80 1pam s PRO 624 CO 0.00 -0.22 1.08 -1.64 0.04 0.00 0.00 177.00 176.27 1pam s MET 625 N -1.97 0.62 0.34 4.56 -1.94 -0.36 -5.02 119.30 115.54 1pam s MET 625 Ca 0.52 0.89 -0.04 0.00 -1.71 0.00 0.00 55.69 55.35 1pam s MET 625 Cb -0.35 -1.73 -0.04 0.00 2.01 0.00 0.00 34.83 34.71 1pam s MET 625 CO 0.46 -2.70 0.60 0.71 -0.01 0.00 0.00 175.02 174.09 1pam s TYR 626 N -2.79 3.50 0.00 -0.03 2.02 -0.04 -4.85 117.35 115.16 1pam s TYR 626 Ca 0.65 0.61 0.06 0.00 -0.37 0.00 0.00 57.07 58.03 1pam s TYR 626 Cb -0.20 -2.10 0.10 0.00 -0.40 0.00 0.00 41.96 39.36 1pam s TYR 626 CO 0.59 0.07 0.95 0.27 -1.57 0.00 0.00 175.55 175.86 1pam n ASN 627 N -1.42 -0.28 -0.00 2.29 0.23 -1.26 -1.05 115.26 113.77 1pam n ASN 627 Ca -0.02 -1.83 -0.03 0.00 -0.53 0.00 0.00 54.58 52.17 1pam n ASN 627 Cb 0.55 0.07 -0.01 0.00 -2.08 0.00 0.00 39.78 38.31 1pam n ASN 627 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1pam n GLN 628 N 0.12 0.07 -0.04 -3.83 6.02 -0.98 -1.10 117.38 117.63 1pam n GLN 628 Ca -0.13 0.03 -0.03 0.00 -0.01 0.00 0.00 57.00 56.86 1pam n GLN 628 Cb 0.77 -0.62 -0.01 0.00 1.02 0.00 0.00 30.24 31.41 1pam n GLN 628 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1pam n VAL 629 N -3.26 0.72 0.01 5.09 0.31 -1.26 -4.45 118.33 115.49 1pam n VAL 629 Ca -0.05 0.35 -0.11 0.00 -0.01 0.00 0.00 64.34 64.52 1pam n VAL 629 Cb 0.43 -1.95 0.02 0.00 -0.91 0.00 0.00 33.84 31.43 1pam n VAL 629 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1pam h VAL 630 N -0.51 1.33 -4.00 2.52 2.07 -1.97 -3.44 116.25 112.25 1pam h VAL 630 Ca 0.00 -1.95 -0.20 0.00 0.82 0.00 0.00 66.70 65.37 1pam h VAL 630 Cb 0.30 1.93 -0.20 0.00 -1.52 0.00 0.00 31.29 31.80 1pam h VAL 630 CO 0.00 0.60 -0.71 -0.31 0.02 0.00 0.00 177.57 177.18 1pam s TYR 631 N -3.82 0.47 0.03 1.57 2.02 -1.26 -5.16 117.35 111.21 1pam s TYR 631 Ca -0.07 -0.64 0.06 0.00 -0.37 0.00 0.00 57.07 56.05 1pam s TYR 631 Cb 0.10 -0.31 -0.03 0.00 -0.40 0.00 0.00 41.96 41.32 1pam s TYR 631 CO 0.85 -0.19 -0.16 -0.65 -1.57 0.00 0.00 175.55 173.84 1pam s GLN 632 N -2.08 2.17 0.25 -0.62 1.11 -1.26 -2.32 119.66 116.90 1pam s GLN 632 Ca -0.08 -0.93 -0.28 0.00 0.01 0.00 0.00 55.36 54.08 1pam s GLN 632 Cb -0.06 -2.25 -0.15 0.00 -1.01 0.00 0.00 33.01 29.54 1pam s GLN 632 CO -0.02 0.55 0.83 0.98 0.01 0.00 0.00 175.29 177.64 1pam n TYR 633 N 1.58 0.59 1.16 0.91 9.36 -0.26 -0.85 117.16 129.64 1pam n TYR 633 Ca -0.16 0.81 0.00 0.00 3.32 0.00 0.00 57.90 61.87 1pam n TYR 633 Cb 0.52 -2.14 0.00 0.00 -0.63 0.00 0.00 39.34 37.09 1pam n TYR 633 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1pam n PRO 634 N 0.88 0.90 -3.30 2.98 -0.04 -1.26 -5.06 135.00 130.10 1pam n PRO 634 Ca 0.13 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.21 1pam n PRO 634 Cb 0.29 -1.32 -0.06 0.00 -0.04 0.00 0.00 33.50 32.36 1pam n PRO 634 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1pam s THR 635 N -1.28 4.97 0.10 0.52 2.01 -0.03 -1.24 115.64 120.68 1pam s THR 635 Ca 0.00 1.10 0.09 0.00 0.31 0.00 0.00 61.69 63.19 1pam s THR 635 Cb 0.00 -3.86 -0.03 0.00 0.01 0.00 0.00 72.50 68.62 1pam s THR 635 CO 0.00 0.45 -0.24 0.26 -0.69 0.00 0.00 174.62 174.40 1pam s TRP 636 N -0.32 2.07 0.07 4.92 0.52 -0.27 -4.09 118.94 121.84 1pam s TRP 636 Ca 0.28 -0.40 -0.08 0.00 0.02 0.00 0.00 56.10 55.92 1pam s TRP 636 Cb -0.17 -1.16 -0.00 0.00 -1.15 0.00 0.00 33.47 30.98 1pam s TRP 636 CO 0.15 0.23 0.18 1.52 0.02 0.00 0.00 176.95 179.05 1pam s TYR 637 N -1.01 0.13 -0.24 -1.98 1.13 -0.21 -1.13 117.35 114.05 1pam s TYR 637 Ca 0.10 -0.49 -0.26 0.00 -1.41 0.00 0.00 57.07 55.02 1pam s TYR 637 Cb -0.10 -0.07 0.08 0.00 -1.10 0.00 0.00 41.96 40.78 1pam s TYR 637 CO 0.04 -0.49 0.80 -0.47 -2.51 0.00 0.00 175.55 172.92 1pam s TYR 638 N -3.33 -0.68 -0.32 -3.49 5.04 -0.77 -0.86 117.35 112.95 1pam s TYR 638 Ca 0.01 1.57 -0.14 0.00 -2.44 0.00 0.00 57.07 56.07 1pam s TYR 638 Cb 0.03 0.32 -0.02 0.00 0.35 0.00 0.00 41.96 42.63 1pam s TYR 638 CO -0.08 -0.38 0.31 -0.51 -1.34 0.00 0.00 175.55 173.55 1pam s ASP 639 N 0.04 6.14 -0.06 4.32 1.01 -1.26 -1.28 116.67 125.58 1pam s ASP 639 Ca -0.01 -0.14 0.05 0.00 0.71 0.00 0.00 52.55 53.17 1pam s ASP 639 Cb -0.04 -2.17 -0.01 0.00 1.01 0.00 0.00 42.92 41.71 1pam s ASP 639 CO 0.01 -0.24 -0.22 -0.69 0.21 0.00 0.00 175.17 174.24 1pam s VAL 640 N 1.92 1.83 -0.03 -1.27 1.01 -0.24 -3.48 120.40 120.14 1pam s VAL 640 Ca 0.10 -0.94 -0.30 0.00 0.00 0.00 0.00 61.98 60.85 1pam s VAL 640 Cb -0.16 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 1pam s VAL 640 CO 0.11 0.51 1.17 -0.55 0.00 0.00 0.00 175.10 176.35 1pam s SER 641 N -0.05 7.09 0.08 3.32 0.15 -1.24 -1.34 113.70 121.71 1pam s SER 641 Ca -0.05 1.83 0.02 0.00 0.70 0.00 0.00 55.95 58.45 1pam s SER 641 Cb -0.13 -2.56 -0.04 0.00 -1.71 0.00 0.00 66.02 61.58 1pam s SER 641 CO 0.03 -0.53 -0.07 0.68 1.20 0.00 0.00 173.24 174.56 1pam s VAL 642 N 1.86 0.62 0.24 4.45 -7.23 0.13 -4.85 120.40 115.62 1pam s VAL 642 Ca 0.56 -1.64 -0.31 0.00 -1.81 0.00 0.00 61.98 58.78 1pam s VAL 642 Cb -0.25 -1.31 -0.11 0.00 0.56 0.00 0.00 36.38 35.27 1pam s VAL 642 CO 0.24 -0.71 1.59 -2.16 -0.31 0.00 0.00 175.10 173.74 1pam s PRO 643 N -3.08 4.17 0.29 4.82 0.04 -1.26 -0.92 135.00 139.06 1pam s PRO 643 Ca 0.04 2.50 -0.29 0.00 0.04 0.00 0.00 61.00 63.29 1pam s PRO 643 Cb 0.00 -3.07 -0.10 0.00 0.04 0.00 0.00 34.50 31.37 1pam s PRO 643 CO -0.03 -0.61 1.11 0.00 0.04 0.00 0.00 177.00 177.50 1pam s ALA 644 N 0.45 3.39 -0.60 8.56 0.00 0.76 -4.27 121.76 130.05 1pam s ALA 644 Ca 0.66 0.91 -0.01 0.00 0.00 0.00 0.00 51.96 53.52 1pam s ALA 644 Cb -0.46 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.32 1pam s ALA 644 CO 0.41 -0.20 0.13 0.41 0.00 0.00 0.00 175.76 176.50 1pam n GLY 645 N 1.10 0.16 3.31 0.00 0.00 -0.55 -4.83 105.19 104.39 1pam n GLY 645 Ca -0.01 -0.50 -0.09 0.00 0.00 0.00 0.00 46.02 45.42 1pam n GLY 645 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1pam s GLN 646 N -4.70 1.09 -0.13 1.61 -2.07 -1.25 -4.87 119.66 109.34 1pam s GLN 646 Ca 0.06 -1.13 -0.24 0.00 -1.82 0.00 0.00 55.36 52.24 1pam s GLN 646 Cb -0.03 0.37 -0.03 0.00 -1.09 0.00 0.00 33.01 32.24 1pam s GLN 646 CO 0.08 -0.39 0.76 0.99 -1.32 0.00 0.00 175.29 175.40 1pam s THR 647 N -3.94 4.96 0.09 3.63 2.01 -1.26 -0.82 115.64 120.32 1pam s THR 647 Ca 0.15 1.51 0.06 0.00 0.31 0.00 0.00 61.69 63.71 1pam s THR 647 Cb 0.04 -4.08 -0.04 0.00 0.01 0.00 0.00 72.50 68.43 1pam s THR 647 CO -0.02 0.13 -0.07 0.27 -0.69 0.00 0.00 174.62 174.23 1pam s ILE 648 N 1.57 3.56 -0.03 1.82 -4.36 0.75 -4.92 121.20 119.59 1pam s ILE 648 Ca 0.37 -1.16 0.03 0.00 -0.26 0.00 0.00 60.65 59.63 1pam s ILE 648 Cb -0.17 -2.66 -0.03 0.00 1.25 0.00 0.00 42.46 40.85 1pam s ILE 648 CO 0.15 0.14 -0.08 -1.61 0.24 0.00 0.00 174.94 173.77 1pam s GLU 649 N -2.17 2.59 0.23 0.37 2.02 -1.26 -1.31 118.70 119.18 1pam s GLU 649 Ca 0.22 -0.67 -0.17 0.00 0.02 0.00 0.00 54.97 54.37 1pam s GLU 649 Cb -0.11 -2.50 0.02 0.00 0.10 0.00 0.00 34.13 31.63 1pam s GLU 649 CO 0.14 0.62 0.57 -0.59 0.02 0.00 0.00 175.26 176.02 1pam s PHE 650 N -0.90 0.00 0.09 1.61 -0.71 0.77 -1.42 117.98 117.42 1pam s PHE 650 Ca 0.15 -0.38 -0.18 0.00 -1.04 0.00 0.00 56.93 55.47 1pam s PHE 650 Cb -0.11 0.43 0.04 0.00 -1.21 0.00 0.00 43.02 42.17 1pam s PHE 650 CO 0.04 -1.03 0.43 0.21 -1.34 0.00 0.00 175.22 173.54 1pam s LYS 651 N -3.93 1.03 0.21 1.99 2.20 -0.68 -0.55 119.74 120.01 1pam s LYS 651 Ca 0.14 -0.52 0.06 0.00 -0.36 0.00 0.00 55.97 55.28 1pam s LYS 651 Cb -0.02 0.46 -0.04 0.00 -1.51 0.00 0.00 37.83 36.72 1pam s LYS 651 CO 0.03 -0.39 0.19 -0.06 -0.36 0.00 0.00 175.35 174.76 1pam s PHE 652 N -3.21 3.17 0.08 4.03 0.40 -1.26 -1.87 117.98 119.31 1pam s PHE 652 Ca -0.01 -0.06 -0.09 0.00 -0.60 0.00 0.00 56.93 56.18 1pam s PHE 652 Cb 0.01 -1.47 -0.00 0.00 0.51 0.00 0.00 43.02 42.07 1pam s PHE 652 CO -0.08 0.51 0.19 -0.48 0.70 0.00 0.00 175.22 176.07 1pam s LEU 653 N -3.54 1.42 -0.06 -0.37 2.34 -0.14 -2.31 118.68 116.02 1pam s LEU 653 Ca 0.32 -0.58 0.02 0.00 0.06 0.00 0.00 54.13 53.96 1pam s LEU 653 Cb -0.09 1.01 -0.03 0.00 -0.56 0.00 0.00 46.19 46.52 1pam s LEU 653 CO 0.25 -0.68 -0.12 -0.54 -1.06 0.00 0.00 176.35 174.19 1pam s LYS 654 N -3.52 2.67 -0.12 1.48 1.02 0.67 -0.64 119.74 121.30 1pam s LYS 654 Ca 0.02 -0.65 0.03 0.00 0.02 0.00 0.00 55.97 55.39 1pam s LYS 654 Cb 0.03 -2.46 0.01 0.00 -0.52 0.00 0.00 37.83 34.88 1pam s LYS 654 CO -0.09 0.59 -0.22 0.15 -0.92 0.00 0.00 175.35 174.85 1pam s LYS 655 N -0.62 2.96 -0.47 1.68 1.02 -0.46 -0.57 119.74 123.27 1pam s LYS 655 Ca 0.09 -0.84 0.04 0.00 0.02 0.00 0.00 55.97 55.28 1pam s LYS 655 Cb -0.11 -2.32 0.12 0.00 -0.52 0.00 0.00 37.83 35.01 1pam s LYS 655 CO 0.01 0.08 0.21 -1.14 -0.92 0.00 0.00 175.35 173.59 1pam s GLN 656 N 0.59 1.78 7.41 1.68 2.00 0.28 -1.95 119.66 131.46 1pam s GLN 656 Ca -0.13 -2.38 0.00 0.00 -2.00 0.00 0.00 55.36 50.85 1pam s GLN 656 Cb -0.17 -3.16 0.00 0.00 0.80 0.00 0.00 33.01 30.49 1pam s GLN 656 CO 0.03 -1.08 0.00 0.41 -0.50 0.00 0.00 175.29 174.15 1pam n GLY 657 N 3.40 3.04 0.81 2.59 0.00 -1.26 -1.09 105.19 112.69 1pam n GLY 657 Ca 0.05 0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.22 1pam n GLY 657 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1pam n SER 658 N 9.69 2.60 -4.66 1.61 2.88 -1.26 -4.84 113.62 119.64 1pam n SER 658 Ca 0.00 -1.84 -0.42 0.00 -1.33 0.00 0.00 58.87 55.29 1pam n SER 658 Cb 0.00 0.06 -0.04 0.00 -0.75 0.00 0.00 64.21 63.48 1pam n SER 658 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1pam s THR 659 N -2.07 4.84 -0.19 2.46 2.01 -0.25 -5.00 115.64 117.44 1pam s THR 659 Ca 0.28 1.69 -0.04 0.00 0.31 0.00 0.00 61.69 63.93 1pam s THR 659 Cb 0.20 -4.16 -0.02 0.00 0.01 0.00 0.00 72.50 68.52 1pam s THR 659 CO 0.34 -0.03 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.54 1pam s VAL 660 N 2.45 3.86 -0.23 3.82 1.01 -1.26 -0.56 120.40 129.48 1pam s VAL 660 Ca 0.39 -0.35 -0.02 0.00 0.00 0.00 0.00 61.98 61.99 1pam s VAL 660 Cb -0.16 -2.73 0.01 0.00 0.00 0.00 0.00 36.38 33.51 1pam s VAL 660 CO 0.11 0.45 -0.07 -0.89 0.00 0.00 0.00 175.10 174.70 1pam s THR 661 N 0.83 2.94 0.21 3.92 2.01 0.27 -4.96 115.64 120.85 1pam s THR 661 Ca -0.00 -0.85 -0.06 0.00 0.31 0.00 0.00 61.69 61.08 1pam s THR 661 Cb -0.14 -2.42 -0.06 0.00 0.01 0.00 0.00 72.50 69.89 1pam s THR 661 CO 0.02 0.30 0.48 0.26 -0.69 0.00 0.00 174.62 174.99 1pam s TRP 662 N 1.37 3.46 0.34 4.92 0.52 -1.26 -0.24 118.94 128.05 1pam s TRP 662 Ca 0.02 0.68 -0.28 0.00 0.02 0.00 0.00 56.10 56.55 1pam s TRP 662 Cb -0.15 -2.11 -0.10 0.00 -1.15 0.00 0.00 33.47 29.96 1pam s TRP 662 CO -0.05 0.32 1.24 -2.00 0.02 0.00 0.00 176.95 176.48 1pam s GLU 663 N -2.91 4.32 0.54 4.98 2.12 -0.98 -4.96 118.70 121.81 1pam s GLU 663 Ca 0.44 2.07 -0.06 0.00 0.36 0.00 0.00 54.97 57.77 1pam s GLU 663 Cb -0.11 -2.99 0.12 0.00 0.26 0.00 0.00 34.13 31.40 1pam s GLU 663 CO 0.24 -0.17 0.74 0.41 -0.54 0.00 0.00 175.26 175.95 1pam n GLY 664 N 0.83 -0.56 0.33 -1.50 0.00 -0.93 -4.97 105.19 98.40 1pam n GLY 664 Ca 0.01 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.22 1pam n GLY 664 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pam n GLY 665 N -0.10 -3.11 3.80 -0.02 0.00 -1.26 -4.70 105.19 99.80 1pam n GLY 665 Ca 0.10 -1.79 -0.31 0.00 0.00 0.00 0.00 46.02 44.02 1pam n GLY 665 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pam s ALA 666 N -1.04 2.55 0.37 4.61 0.00 -1.26 -5.00 121.76 122.00 1pam s ALA 666 Ca 0.00 0.17 -0.27 0.00 0.00 0.00 0.00 51.96 51.85 1pam s ALA 666 Cb 0.00 -3.21 -0.10 0.00 0.00 0.00 0.00 23.12 19.81 1pam s ALA 666 CO 0.00 -1.36 1.34 -0.80 0.00 0.00 0.00 175.76 174.94 1pam s ASN 667 N -3.59 6.49 0.43 0.00 0.01 -1.26 -5.00 114.94 112.02 1pam s ASN 667 Ca 0.59 2.76 -0.21 0.00 -0.71 0.00 0.00 52.86 55.29 1pam s ASN 667 Cb -0.15 -2.65 -0.11 0.00 0.41 0.00 0.00 41.25 38.75 1pam s ASN 667 CO 0.54 -0.74 0.95 -0.13 -1.51 0.00 0.00 177.10 176.21 1pam s ARG 668 N -2.04 4.21 0.06 -0.60 0.52 0.29 -4.83 118.95 116.56 1pam s ARG 668 Ca 0.53 1.14 0.05 0.00 -0.52 0.00 0.00 55.73 56.93 1pam s ARG 668 Cb -0.41 -2.19 -0.03 0.00 0.52 0.00 0.00 34.95 32.85 1pam s ARG 668 CO 0.54 -0.05 -0.14 -0.08 0.02 0.00 0.00 175.30 175.59 1pam s THR 669 N -2.16 1.13 -0.22 0.02 -1.32 -1.26 -0.16 115.64 111.67 1pam s THR 669 Ca 0.62 -1.15 -0.18 0.00 -1.21 0.00 0.00 61.69 59.77 1pam s THR 669 Cb -0.10 -1.05 0.06 0.00 -1.51 0.00 0.00 72.50 69.90 1pam s THR 669 CO 0.14 -0.10 0.57 0.12 -2.21 0.00 0.00 174.62 173.14 1pam s PHE 670 N -1.05 -0.69 -0.36 9.09 5.36 -0.42 -4.96 117.98 124.94 1pam s PHE 670 Ca 0.00 1.60 -0.13 0.00 -0.96 0.00 0.00 56.93 57.44 1pam s PHE 670 Cb -0.09 0.29 0.01 0.00 -0.34 0.00 0.00 43.02 42.88 1pam s PHE 670 CO 0.02 -0.34 0.24 0.99 -1.46 0.00 0.00 175.22 174.66 1pam s THR 671 N 0.66 5.00 0.56 0.12 2.01 -1.26 -0.18 115.64 122.55 1pam s THR 671 Ca -0.03 -0.52 -0.19 0.00 0.31 0.00 0.00 61.69 61.25 1pam s THR 671 Cb -0.05 -3.68 -0.05 0.00 0.01 0.00 0.00 72.50 68.73 1pam s THR 671 CO -0.04 -0.14 1.15 0.42 -0.69 0.00 0.00 174.62 175.33 1pam s THR 672 N 1.65 2.99 0.87 -0.82 -4.23 0.00 -4.87 115.64 111.24 1pam s THR 672 Ca 0.05 0.62 -0.11 0.00 -1.18 0.00 0.00 61.69 61.07 1pam s THR 672 Cb -0.18 -3.25 0.12 0.00 1.34 0.00 0.00 72.50 70.52 1pam s THR 672 CO 0.09 -0.13 1.10 -2.16 -0.54 0.00 0.00 174.62 172.98 1pam s PRO 673 N -3.29 1.43 0.26 3.99 0.04 -1.26 -2.37 135.00 133.80 1pam s PRO 673 Ca 0.74 1.12 0.16 0.00 0.04 0.00 0.00 61.00 63.06 1pam s PRO 673 Cb -0.26 -1.81 0.05 0.00 0.04 0.00 0.00 34.50 32.53 1pam s PRO 673 CO 0.29 -2.21 1.37 1.79 0.04 0.00 0.00 177.00 178.28 1pam h THR 674 N -1.54 0.77 -3.24 1.26 1.35 -1.94 -1.45 112.91 108.11 1pam h THR 674 Ca -0.47 -2.11 0.01 0.00 -0.55 0.00 0.00 66.41 63.29 1pam h THR 674 Cb 1.26 2.34 -0.08 0.00 -1.73 0.00 0.00 68.15 69.95 1pam h THR 674 CO 0.50 0.44 0.09 -0.94 -0.25 0.00 0.00 175.52 175.36 1pam s SER 675 N -6.35 -0.23 0.00 5.36 1.04 -1.26 -4.78 113.70 107.48 1pam s SER 675 Ca 0.03 -0.63 0.00 0.00 0.48 0.00 0.00 55.95 55.83 1pam s SER 675 Cb 0.08 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.85 1pam s SER 675 CO 0.75 -1.21 0.00 0.61 0.98 0.00 0.00 173.24 174.37 1pam n GLY 676 N -0.41 -2.02 3.79 7.32 0.00 -1.26 -4.96 105.19 107.65 1pam n GLY 676 Ca -0.05 -1.42 -0.30 0.00 0.00 0.00 0.00 46.02 44.25 1pam n GLY 676 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1pam s THR 677 N 0.00 1.47 0.09 2.61 -4.23 -1.26 -4.25 115.64 110.07 1pam s THR 677 Ca 0.00 -1.82 -0.20 0.00 -1.18 0.00 0.00 61.69 58.49 1pam s THR 677 Cb 0.00 -2.29 0.05 0.00 1.34 0.00 0.00 72.50 71.59 1pam s THR 677 CO 0.00 0.00 0.48 0.00 -0.54 0.00 0.00 174.62 174.56 1pam s ALA 678 N -2.81 -1.21 -0.04 3.99 0.00 -1.23 -4.88 121.76 115.59 1pam s ALA 678 Ca 0.19 0.35 0.06 0.00 0.00 0.00 0.00 51.96 52.56 1pam s ALA 678 Cb 0.01 0.55 -0.01 0.00 0.00 0.00 0.00 23.12 23.67 1pam s ALA 678 CO 0.11 -0.58 -0.22 0.99 0.00 0.00 0.00 175.76 176.06 1pam s THR 679 N -3.07 1.75 -0.21 0.00 2.01 -1.26 -0.56 115.64 114.31 1pam s THR 679 Ca -0.02 -0.91 -0.00 0.00 0.31 0.00 0.00 61.69 61.06 1pam s THR 679 Cb 0.00 -1.48 0.02 0.00 0.01 0.00 0.00 72.50 71.05 1pam s THR 679 CO -0.07 0.49 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.54 1pam s VAL 680 N -0.22 2.53 -0.13 3.82 1.01 0.11 -4.93 120.40 122.60 1pam s VAL 680 Ca 0.00 -0.92 0.03 0.00 0.00 0.00 0.00 61.98 61.09 1pam s VAL 680 Cb -0.11 -2.17 0.00 0.00 0.00 0.00 0.00 36.38 34.10 1pam s VAL 680 CO 0.02 0.39 -0.22 0.21 0.00 0.00 0.00 175.10 175.50 1pam s ASN 681 N 1.32 3.16 0.17 3.32 3.84 -1.26 0.54 114.94 126.03 1pam s ASN 681 Ca 0.03 -0.57 -0.11 0.00 0.21 0.00 0.00 52.86 52.42 1pam s ASN 681 Cb -0.15 -1.44 -0.00 0.00 -0.55 0.00 0.00 41.25 39.11 1pam s ASN 681 CO -0.08 0.11 0.33 0.54 -2.79 0.00 0.00 177.10 175.21 1pam s VAL 682 N 0.63 0.06 -0.09 -5.21 0.11 0.18 -4.96 120.40 111.11 1pam s VAL 682 Ca -0.11 -1.26 -0.01 0.00 -2.93 0.00 0.00 61.98 57.67 1pam s VAL 682 Cb -0.16 -1.76 -0.03 0.00 -1.53 0.00 0.00 36.38 32.89 1pam s VAL 682 CO 0.02 -0.28 -0.03 0.20 -3.33 0.00 0.00 175.10 171.68 1pam s ASN 683 N -2.94 4.93 -0.04 3.54 -0.87 -1.26 -0.07 114.94 118.23 1pam s ASN 683 Ca 0.15 0.03 -0.30 0.00 -1.57 0.00 0.00 52.86 51.17 1pam s ASN 683 Cb 0.03 -1.43 -0.07 0.00 -0.02 0.00 0.00 41.25 39.76 1pam s ASN 683 CO -0.01 0.33 1.90 0.86 -2.57 0.00 0.00 177.10 177.61 1pam s TRP 684 N -0.59 1.48 -0.23 2.20 -0.11 -0.35 -4.87 118.94 116.47 1pam s TRP 684 Ca 0.09 -0.11 -0.24 0.00 1.22 0.00 0.00 56.10 57.07 1pam s TRP 684 Cb -0.12 -4.11 -0.01 0.00 -1.50 0.00 0.00 33.47 27.73 1pam s TRP 684 CO 0.02 -4.79 0.77 -0.65 -4.62 0.00 0.00 176.95 167.68 1pam s GLN 685 N 4.64 4.19 0.00 5.86 -0.21 -1.26 -5.03 119.66 127.86 1pam s GLN 685 Ca 0.85 0.85 0.21 0.00 0.02 0.00 0.00 55.36 57.29 1pam s GLN 685 Cb -0.38 -3.63 1.24 0.00 1.00 0.00 0.00 33.01 31.25 1pam s GLN 685 CO 0.37 -0.44 1.63 -2.30 -2.12 0.00 0.00 175.29 172.43