#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dal s SER -9 N 0.00 3.10 0.00 -3.46 0.01 -1.26 -4.89 113.70 107.20 3dal s SER -9 Ca 0.00 -0.80 0.00 0.00 1.31 0.00 0.00 55.95 56.46 3dal s SER -9 Cb 0.00 -0.21 0.00 0.00 0.21 0.00 0.00 66.02 66.02 3dal s SER -9 CO 0.00 0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.36 3dal n GLY -8 N 0.62 -0.57 0.37 3.44 0.00 -1.26 -4.39 105.19 103.40 3dal n GLY -8 Ca -0.16 -1.36 0.11 0.00 0.00 0.00 0.00 46.02 44.61 3dal n GLY -8 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3dal h LEU -7 N 0.00 0.59 0.58 0.99 3.38 -1.98 -1.61 115.31 117.26 3dal h LEU -7 Ca 0.00 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 3dal h LEU -7 Cb 0.00 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 40.66 3dal h LEU -7 CO 0.00 0.33 -0.28 0.58 0.09 0.00 0.00 178.44 179.16 3dal h VAL -6 N 0.64 0.00 0.00 1.22 2.07 -1.94 -2.10 116.25 116.14 3dal h VAL -6 Ca 0.39 -0.20 -0.03 0.00 0.82 0.00 0.00 66.70 67.68 3dal h VAL -6 Cb 0.62 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.38 3dal h VAL -6 CO -0.15 0.00 -0.12 1.55 0.02 0.00 0.00 177.57 178.87 3dal h PRO -5 N -0.99 0.00 -0.23 1.57 0.13 -1.77 -2.84 132.00 127.87 3dal h PRO -5 Ca -0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 3dal h PRO -5 Cb 0.60 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.72 3dal h PRO -5 CO 0.13 0.12 0.15 -0.09 -0.23 0.00 0.00 178.00 178.08 3dal h ARG -4 N 0.00 0.30 0.00 0.86 2.43 -1.30 -3.49 114.38 113.18 3dal h ARG -4 Ca -0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3dal h ARG -4 Cb 0.23 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 3dal h ARG -4 CO 0.02 0.21 0.00 0.41 -1.51 0.00 0.00 179.97 179.09 3dal n GLY -3 N -1.14 0.53 3.86 2.80 0.00 -0.79 -4.78 105.19 105.67 3dal n GLY -3 Ca -0.03 -0.84 -0.33 0.00 0.00 0.00 0.00 46.02 44.82 3dal n GLY -3 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3dal s SER -2 N -4.00 6.10 0.40 1.61 0.01 -1.26 -4.98 113.70 111.58 3dal s SER -2 Ca 0.00 0.26 -0.11 0.00 1.31 0.00 0.00 55.95 57.42 3dal s SER -2 Cb 0.00 -1.85 -0.07 0.00 0.21 0.00 0.00 66.02 64.31 3dal s SER -2 CO 0.00 0.26 0.77 -1.59 0.41 0.00 0.00 173.24 173.09 3dal s LYS -1 N -1.90 3.79 0.00 12.44 -2.85 -1.26 -5.27 119.74 124.69 3dal s LYS -1 Ca 0.26 0.48 0.00 0.00 -1.00 0.00 0.00 55.97 55.71 3dal s LYS -1 Cb -0.12 -2.39 0.00 0.00 -2.06 0.00 0.00 37.83 33.25 3dal s LYS -1 CO 0.17 -0.02 0.00 0.00 0.10 0.00 0.00 175.35 175.60 3dal n ALA 7 N -1.24 0.00 -2.63 0.59 0.00 -1.26 -5.32 120.51 110.64 3dal n ALA 7 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.04 3dal n ALA 7 Cb 0.54 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.96 3dal n ALA 7 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3dal s ASP 8 N 0.00 6.88 0.00 0.00 -1.08 -1.26 -4.92 116.67 116.29 3dal s ASP 8 Ca 0.00 0.99 0.26 0.00 -0.52 0.00 0.00 52.55 53.28 3dal s ASP 8 Cb 0.00 -2.51 1.13 0.00 -1.46 0.00 0.00 42.92 40.08 3dal s ASP 8 CO 0.00 -0.79 1.78 0.23 0.52 0.00 0.00 175.17 176.91 3dal n MET 9 N 6.64 1.53 -0.21 4.34 2.81 -1.26 -4.39 117.12 126.58 3dal n MET 9 Ca 0.10 -0.77 -0.01 0.00 -1.81 0.00 0.00 57.70 55.21 3dal n MET 9 Cb 0.47 -1.45 0.10 0.00 -0.71 0.00 0.00 33.22 31.63 3dal n MET 9 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 3dal h THR 10 N 1.78 0.86 -0.49 2.03 2.02 -1.93 -2.07 112.91 115.11 3dal h THR 10 Ca 0.00 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.00 3dal h THR 10 Cb 0.38 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 67.08 3dal h THR 10 CO 0.00 0.10 0.00 0.18 0.37 0.00 0.00 175.52 176.17 3dal n LEU 11 N -4.90 4.17 -4.76 2.58 4.77 -1.26 -4.49 117.00 113.10 3dal n LEU 11 Ca 0.09 -2.48 -0.39 0.00 -0.03 0.00 0.00 56.01 53.19 3dal n LEU 11 Cb 0.23 -0.49 0.03 0.00 -2.33 0.00 0.00 43.42 40.85 3dal n LEU 11 CO 0.25 0.76 1.06 0.26 -1.33 0.00 0.00 177.39 178.39 3dal s TRP 12 N -1.89 2.37 0.75 -1.77 0.52 -0.78 -4.96 118.94 113.19 3dal s TRP 12 Ca 0.43 1.28 -0.11 0.00 0.02 0.00 0.00 56.10 57.71 3dal s TRP 12 Cb 0.29 -3.92 0.04 0.00 -1.15 0.00 0.00 33.47 28.73 3dal s TRP 12 CO 0.19 -3.02 1.08 0.95 0.02 0.00 0.00 176.95 176.17 3dal s THR 13 N -1.22 3.46 0.32 2.01 -4.23 -1.26 -4.51 115.64 110.20 3dal s THR 13 Ca 0.64 0.47 0.01 0.00 -1.18 0.00 0.00 61.69 61.63 3dal s THR 13 Cb -0.43 -3.24 0.28 0.00 1.34 0.00 0.00 72.50 70.44 3dal s THR 13 CO 0.55 -0.62 1.95 -0.33 -0.54 0.00 0.00 174.62 175.63 3dal h GLU 14 N -0.91 0.96 -0.66 3.99 5.08 -1.95 -1.25 114.58 119.84 3dal h GLU 14 Ca -0.46 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 57.83 3dal h GLU 14 Cb 1.25 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 30.25 3dal h GLU 14 CO 0.59 0.64 0.35 0.00 -1.00 0.00 0.00 179.01 179.59 3dal h ALA 15 N 1.53 0.85 -0.47 3.43 0.00 -1.93 -2.32 119.26 120.34 3dal h ALA 15 Ca 0.34 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.14 3dal h ALA 15 Cb 0.09 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3dal h ALA 15 CO -0.11 0.38 0.30 0.93 0.00 0.00 0.00 179.25 180.75 3dal h GLU 16 N 0.91 0.59 -0.63 0.00 5.08 -1.64 -0.67 114.58 118.21 3dal h GLU 16 Ca 0.23 -0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.60 3dal h GLU 16 Cb 0.06 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 29.13 3dal h GLU 16 CO -0.03 0.39 0.36 0.74 -1.00 0.00 0.00 179.01 179.46 3dal h PHE 17 N 0.60 0.66 -0.49 4.33 0.04 -0.96 0.06 116.94 121.18 3dal h PHE 17 Ca 0.18 0.02 -0.13 0.00 2.80 0.00 0.00 57.97 60.85 3dal h PHE 17 Cb -0.03 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 37.90 3dal h PHE 17 CO -0.05 0.34 -0.19 1.49 -0.60 0.00 0.00 178.31 179.29 3dal h GLU 18 N 0.68 1.00 0.00 1.51 4.81 -1.12 -1.27 114.58 120.19 3dal h GLU 18 Ca 0.27 -0.42 -0.08 0.00 -0.13 0.00 0.00 59.36 59.00 3dal h GLU 18 Cb 0.13 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 3dal h GLU 18 CO -0.16 1.10 -0.39 0.93 -0.73 0.00 0.00 179.01 179.76 3dal h GLU 19 N 0.87 0.00 -0.01 1.92 3.07 -0.90 -3.35 114.58 116.18 3dal h GLU 19 Ca 0.12 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.98 3dal h GLU 19 Cb 0.77 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.68 3dal h GLU 19 CO 0.06 0.39 0.00 1.63 -1.40 0.00 0.00 179.01 179.70 3dal n LYS 20 N -3.21 -0.15 -1.69 2.33 5.02 -0.01 -5.02 118.16 115.41 3dal n LYS 20 Ca 0.02 -0.85 -0.34 0.00 -2.02 0.00 0.00 58.31 55.12 3dal n LYS 20 Cb 0.68 -1.10 0.06 0.00 -0.02 0.00 0.00 35.03 34.64 3dal n LYS 20 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dal n THR 22 N -2.38 1.45 -5.03 0.00 -1.04 0.26 -5.01 114.28 102.54 3dal n THR 22 Ca 0.12 -0.44 -0.31 0.00 -2.04 0.00 0.00 64.05 61.37 3dal n THR 22 Cb 0.51 -1.67 -0.15 0.00 -1.82 0.00 0.00 70.33 67.20 3dal n THR 22 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 3dal s TYR 23 N -2.49 2.44 -0.13 -1.42 2.02 -0.56 -5.03 117.35 112.19 3dal s TYR 23 Ca -0.36 -0.34 -0.00 0.00 -0.37 0.00 0.00 57.07 55.99 3dal s TYR 23 Cb 0.12 -1.50 -0.02 0.00 -0.40 0.00 0.00 41.96 40.16 3dal s TYR 23 CO 0.51 0.09 -0.11 0.42 -1.57 0.00 0.00 175.55 174.89 3dal s ILE 24 N -0.73 3.24 -0.22 2.71 1.01 -1.26 -0.43 121.20 125.51 3dal s ILE 24 Ca 0.11 -0.60 -0.01 0.00 0.00 0.00 0.00 60.65 60.15 3dal s ILE 24 Cb -0.10 -2.36 0.02 0.00 0.01 0.00 0.00 42.46 40.03 3dal s ILE 24 CO 0.01 0.53 -0.10 -0.69 0.00 0.00 0.00 174.94 174.69 3dal s VAL 25 N 0.21 2.69 0.51 2.92 1.01 0.00 -4.94 120.40 122.80 3dal s VAL 25 Ca -0.07 -0.95 -0.09 0.00 0.00 0.00 0.00 61.98 60.88 3dal s VAL 25 Cb -0.15 -2.29 -0.05 0.00 0.00 0.00 0.00 36.38 33.89 3dal s VAL 25 CO 0.05 0.32 0.86 0.20 0.00 0.00 0.00 175.10 176.53 3dal s ASN 26 N 1.33 6.33 0.75 3.32 0.02 -1.26 -3.99 114.94 121.45 3dal s ASN 26 Ca 0.02 1.15 -0.15 0.00 -1.02 0.00 0.00 52.86 52.86 3dal s ASN 26 Cb -0.15 -2.34 0.05 0.00 0.02 0.00 0.00 41.25 38.82 3dal s ASN 26 CO -0.07 -0.62 1.22 0.47 0.02 0.00 0.00 177.10 178.12 3dal n ASP 27 N -2.14 1.35 -4.74 -1.22 9.92 -1.26 -4.68 116.55 113.77 3dal n ASP 27 Ca 0.03 0.67 -0.42 0.00 -0.53 0.00 0.00 54.79 54.54 3dal n ASP 27 Cb 0.54 -1.52 -0.02 0.00 -0.64 0.00 0.00 41.12 39.48 3dal n ASP 27 CO 0.00 0.00 0.00 -2.28 0.13 0.00 0.00 177.20 175.05 3dal s HIS 28 N -1.87 2.90 -0.04 1.24 2.46 -0.30 -4.91 115.29 114.77 3dal s HIS 28 Ca 0.77 0.69 -0.30 0.00 0.47 0.00 0.00 55.06 56.69 3dal s HIS 28 Cb -0.32 -4.02 -0.02 0.00 -0.13 0.00 0.00 32.58 28.09 3dal s HIS 28 CO 0.47 -3.57 1.01 -1.25 -2.47 0.00 0.00 174.74 168.93 3dal s PRO 29 N 0.24 4.49 0.00 2.88 0.04 -1.26 -4.51 135.00 136.88 3dal s PRO 29 Ca 0.67 1.44 0.00 0.00 0.04 0.00 0.00 61.00 63.15 3dal s PRO 29 Cb -0.46 -3.49 0.00 0.00 0.04 0.00 0.00 34.50 30.59 3dal s PRO 29 CO 0.40 -0.17 0.00 0.91 0.04 0.00 0.00 177.00 178.18 3dal n TRP 30 N 4.36 0.00 0.00 0.56 8.01 -1.26 -5.03 117.44 124.08 3dal n TRP 30 Ca 0.07 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.26 3dal n TRP 30 Cb 0.50 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.80 3dal n TRP 30 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 3dal n ASP 31 N -1.12 0.00 -4.45 -0.99 9.92 -1.26 -4.24 116.55 114.41 3dal n ASP 31 Ca 0.00 0.00 -0.40 0.00 -0.53 0.00 0.00 54.79 53.86 3dal n ASP 31 Cb 0.00 0.00 0.02 0.00 -0.64 0.00 0.00 41.12 40.50 3dal n ASP 31 CO 0.00 0.00 0.00 0.55 0.13 0.00 0.00 177.20 177.88 3dal n VAL 40 N 0.00 1.84 -0.20 2.53 3.14 -1.26 -4.89 118.33 119.49 3dal n VAL 40 Ca 0.00 -0.50 0.01 0.00 -2.96 0.00 0.00 64.34 60.89 3dal n VAL 40 Cb 0.00 -0.58 0.12 0.00 -1.06 0.00 0.00 33.84 32.32 3dal n VAL 40 CO 0.00 0.00 0.00 -0.61 -6.46 0.00 0.00 176.83 169.76 3dal h GLN 41 N 0.56 0.23 -0.45 1.45 4.15 -1.79 0.40 115.11 119.67 3dal h GLN 41 Ca -0.43 -0.01 0.02 0.00 0.77 0.00 0.00 58.65 59.00 3dal h GLN 41 Cb 1.40 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 29.01 3dal h GLN 41 CO 0.49 0.15 0.30 0.00 -1.93 0.00 0.00 178.83 177.85 3dal h ALA 42 N 1.51 1.73 0.07 3.38 0.00 -0.68 -1.92 119.26 123.36 3dal h ALA 42 Ca 0.33 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 55.02 3dal h ALA 42 Cb 0.51 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 3dal h ALA 42 CO -0.43 0.23 -0.96 0.93 0.00 0.00 0.00 179.25 179.02 3dal h GLU 43 N 0.56 0.15 0.00 0.00 5.08 -1.60 -2.86 114.58 115.92 3dal h GLU 43 Ca 0.17 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 3dal h GLU 43 Cb 0.01 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 3dal h GLU 43 CO -0.04 1.13 -0.05 0.00 -1.00 0.00 0.00 179.01 179.04 3dal h ALA 44 N -0.10 1.47 -0.00 3.43 0.00 -0.83 -2.74 119.26 120.50 3dal h ALA 44 Ca -0.22 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3dal h ALA 44 Cb 1.49 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.27 3dal h ALA 44 CO 0.01 0.07 -0.02 -1.13 0.00 0.00 0.00 179.25 178.18 3dal n SER 45 N -3.84 0.04 -4.69 0.00 3.41 -0.73 -4.60 113.62 103.21 3dal n SER 45 Ca -0.03 0.14 -0.42 0.00 -0.26 0.00 0.00 58.87 58.30 3dal n SER 45 Cb 0.14 -0.36 -0.03 0.00 -0.26 0.00 0.00 64.21 63.71 3dal n SER 45 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3dal s LEU 46 N -2.79 4.38 0.60 1.04 2.96 -1.04 -1.15 118.68 122.69 3dal s LEU 46 Ca 0.21 2.58 -0.19 0.00 -0.22 0.00 0.00 54.13 56.51 3dal s LEU 46 Cb 0.20 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 43.29 3dal s LEU 46 CO 0.50 -0.93 1.22 -2.65 -1.32 0.00 0.00 176.35 173.17 3dal n PRO 47 N 5.65 1.22 0.16 0.98 -0.02 -1.26 -4.25 135.00 137.48 3dal n PRO 47 Ca 0.17 0.46 0.12 0.00 -2.02 0.00 0.00 63.50 62.23 3dal n PRO 47 Cb 0.40 -2.44 0.59 0.00 -0.02 0.00 0.00 33.50 32.03 3dal n PRO 47 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 3dal n ARG 48 N -1.38 0.16 -0.11 -0.52 1.85 -1.26 -1.67 116.66 113.73 3dal n ARG 48 Ca 0.14 0.59 0.10 0.00 -1.00 0.00 0.00 57.85 57.68 3dal n ARG 48 Cb 0.47 -1.96 0.32 0.00 -1.05 0.00 0.00 32.46 30.24 3dal n ARG 48 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 177.63 177.89 3dal n ASN 49 N -2.29 1.81 -4.40 2.89 6.94 -1.26 -4.91 115.26 114.04 3dal n ASN 49 Ca -0.01 -1.78 -0.21 0.00 -0.02 0.00 0.00 54.58 52.56 3dal n ASN 49 Cb 0.08 -0.14 -0.10 0.00 -2.36 0.00 0.00 39.78 37.26 3dal n ASN 49 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3dal s LEU 50 N -1.44 2.56 0.06 -4.53 1.43 -0.67 -0.35 118.68 115.73 3dal s LEU 50 Ca 0.31 -1.07 -0.00 0.00 -1.03 0.00 0.00 54.13 52.34 3dal s LEU 50 Cb 0.17 -0.78 -0.04 0.00 0.03 0.00 0.00 46.19 45.57 3dal s LEU 50 CO 0.24 -0.16 -0.04 -0.76 0.23 0.00 0.00 176.35 175.86 3dal s LEU 51 N -3.41 2.45 0.31 1.79 1.43 -0.07 -4.66 118.68 116.52 3dal s LEU 51 Ca 0.26 -0.91 -0.19 0.00 -1.03 0.00 0.00 54.13 52.26 3dal s LEU 51 Cb -0.01 0.11 -0.09 0.00 0.03 0.00 0.00 46.19 46.23 3dal s LEU 51 CO 0.10 -0.51 0.79 -0.36 0.23 0.00 0.00 176.35 176.60 3dal s PHE 52 N -3.41 3.48 0.11 0.29 0.08 -1.26 -0.36 117.98 116.91 3dal s PHE 52 Ca 0.04 1.40 -0.24 0.00 0.12 0.00 0.00 56.93 58.25 3dal s PHE 52 Cb 0.04 -2.66 -0.07 0.00 -0.57 0.00 0.00 43.02 39.77 3dal s PHE 52 CO -0.07 0.15 0.73 0.15 -0.10 0.00 0.00 175.22 176.07 3dal s LYS 53 N -2.60 4.47 0.09 0.44 1.02 -0.31 -4.78 119.74 118.07 3dal s LYS 53 Ca 0.52 1.04 0.10 0.00 0.02 0.00 0.00 55.97 57.64 3dal s LYS 53 Cb -0.13 -3.29 -0.03 0.00 -0.52 0.00 0.00 37.83 33.85 3dal s LYS 53 CO 0.18 0.49 -0.25 0.71 -0.92 0.00 0.00 175.35 175.56 3dal s TYR 54 N -0.77 2.18 0.55 3.18 2.02 -1.26 -0.84 117.35 122.41 3dal s TYR 54 Ca 0.35 -0.39 -0.21 0.00 -0.37 0.00 0.00 57.07 56.44 3dal s TYR 54 Cb -0.21 -1.23 -0.05 0.00 -0.40 0.00 0.00 41.96 40.07 3dal s TYR 54 CO 0.24 0.23 1.33 0.00 -1.57 0.00 0.00 175.55 175.78 3dal s ALA 55 N -0.97 2.79 0.26 3.71 0.00 -0.06 -4.84 121.76 122.64 3dal s ALA 55 Ca 0.11 1.28 -0.31 0.00 0.00 0.00 0.00 51.96 53.04 3dal s ALA 55 Cb -0.10 -3.55 -0.12 0.00 0.00 0.00 0.00 23.12 19.35 3dal s ALA 55 CO 0.04 -1.32 1.52 2.41 0.00 0.00 0.00 175.76 178.41 3dal n THR 56 N -1.08 0.88 -2.66 0.00 -1.04 -1.26 -1.91 114.28 107.22 3dal n THR 56 Ca 0.11 -0.22 -0.19 0.00 -2.04 0.00 0.00 64.05 61.71 3dal n THR 56 Cb 0.46 -1.74 0.00 0.00 -1.82 0.00 0.00 70.33 67.23 3dal n THR 56 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3dal n ASN 57 N 2.33 -5.20 -3.98 8.00 3.02 -1.26 -4.95 115.26 113.23 3dal n ASN 57 Ca 0.11 -0.06 -0.09 0.00 -0.03 0.00 0.00 54.58 54.51 3dal n ASN 57 Cb 0.34 -4.31 -0.08 0.00 -0.61 0.00 0.00 39.78 35.12 3dal n ASN 57 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3dal s SER 58 N -2.27 0.16 0.00 6.41 0.15 -0.80 -5.02 113.70 112.34 3dal s SER 58 Ca 0.11 -0.88 0.18 0.00 0.70 0.00 0.00 55.95 56.06 3dal s SER 58 Cb -0.05 0.35 0.37 0.00 -1.71 0.00 0.00 66.02 64.98 3dal s SER 58 CO 0.14 -0.78 1.29 -0.62 1.20 0.00 0.00 173.24 174.47 3dal n GLU 59 N -0.11 2.31 -2.22 5.44 4.71 -1.26 -4.52 120.64 124.99 3dal n GLU 59 Ca -0.10 -2.10 -0.42 0.00 -0.01 0.00 0.00 57.16 54.53 3dal n GLU 59 Cb 0.63 -1.41 -0.03 0.00 -1.01 0.00 0.00 31.44 29.62 3dal n GLU 59 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 3dal s GLU 60 N -1.21 4.26 0.04 3.49 2.12 -1.26 -4.94 118.70 121.19 3dal s GLU 60 Ca 0.32 1.95 -0.30 0.00 0.36 0.00 0.00 54.97 57.29 3dal s GLU 60 Cb 0.18 -3.68 -0.05 0.00 0.26 0.00 0.00 34.13 30.85 3dal s GLU 60 CO 0.25 -0.64 1.10 0.08 -0.54 0.00 0.00 175.26 175.51 3dal s VAL 61 N 2.86 4.40 0.00 3.70 1.01 -1.26 -0.88 120.40 130.22 3dal s VAL 61 Ca 0.64 1.73 0.00 0.00 0.00 0.00 0.00 61.98 64.35 3dal s VAL 61 Cb -0.30 -4.11 0.00 0.00 0.00 0.00 0.00 36.38 31.97 3dal s VAL 61 CO 0.25 0.14 0.67 2.30 0.00 0.00 0.00 175.10 178.45 3dal n ILE 62 N 3.87 0.43 0.00 2.22 -5.35 -0.02 -4.88 119.36 115.64 3dal n ILE 62 Ca 0.07 -0.60 0.00 0.00 -0.27 0.00 0.00 62.75 61.95 3dal n ILE 62 Cb 0.48 0.88 0.00 0.00 -1.74 0.00 0.00 39.64 39.27 3dal n ILE 62 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dal n GLY 63 N -0.22 -1.00 3.13 3.28 0.00 -1.23 -4.88 105.19 104.28 3dal n GLY 63 Ca 0.00 -1.14 -0.26 0.00 0.00 0.00 0.00 46.02 44.63 3dal n GLY 63 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dal s VAL 64 N -2.00 1.38 0.22 1.61 1.01 -1.25 -1.16 120.40 120.21 3dal s VAL 64 Ca 0.00 -0.70 0.11 0.00 0.00 0.00 0.00 61.98 61.39 3dal s VAL 64 Cb 0.00 -1.18 -0.05 0.00 0.00 0.00 0.00 36.38 35.15 3dal s VAL 64 CO 0.00 0.40 -0.20 -0.04 0.00 0.00 0.00 175.10 175.26 3dal s MET 65 N -0.02 1.50 0.29 2.72 1.00 0.51 -0.30 119.30 125.00 3dal s MET 65 Ca -0.02 -1.59 -0.29 0.00 0.00 0.00 0.00 55.69 53.79 3dal s MET 65 Cb -0.11 -1.62 -0.09 0.00 0.00 0.00 0.00 34.83 33.02 3dal s MET 65 CO 0.02 0.32 1.06 -1.54 0.00 0.00 0.00 175.02 174.87 3dal s SER 66 N -3.05 7.27 0.30 3.03 1.04 -0.14 -0.89 113.70 121.25 3dal s SER 66 Ca 0.23 2.16 0.22 0.00 0.48 0.00 0.00 55.95 59.05 3dal s SER 66 Cb -0.06 -2.62 0.13 0.00 0.10 0.00 0.00 66.02 63.58 3dal s SER 66 CO 0.11 -0.13 1.28 0.50 0.98 0.00 0.00 173.24 175.97 3dal h LYS 67 N 3.67 0.00 -3.40 4.02 3.64 -0.96 -0.12 116.57 123.42 3dal h LYS 67 Ca -0.47 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 58.87 3dal h LYS 67 Cb 1.21 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.97 3dal h LYS 67 CO 0.66 0.02 0.06 -1.83 -2.27 0.00 0.00 179.45 176.09 3dal s GLU 68 N -3.28 1.83 0.04 1.90 -1.05 -1.24 -4.63 118.70 112.26 3dal s GLU 68 Ca 0.03 -1.30 -0.30 0.00 -0.15 0.00 0.00 54.97 53.24 3dal s GLU 68 Cb 0.08 0.54 -0.08 0.00 -0.44 0.00 0.00 34.13 34.23 3dal s GLU 68 CO 0.74 -0.81 1.67 -0.47 0.95 0.00 0.00 175.26 177.35 3dal s TYR 69 N -3.45 2.23 -0.31 4.83 5.04 -1.26 -3.71 117.35 120.72 3dal s TYR 69 Ca 0.19 0.24 -0.11 0.00 -2.44 0.00 0.00 57.07 54.95 3dal s TYR 69 Cb -0.03 -3.97 -0.02 0.00 0.35 0.00 0.00 41.96 38.29 3dal s TYR 69 CO 0.11 -3.97 0.19 0.42 -1.34 0.00 0.00 175.55 170.95 3dal s ILE 70 N 3.11 5.00 0.70 3.14 -1.09 0.37 -4.94 121.20 127.48 3dal s ILE 70 Ca 0.75 -0.19 -0.15 0.00 -2.23 0.00 0.00 60.65 58.82 3dal s ILE 70 Cb -0.38 -3.50 0.02 0.00 -1.58 0.00 0.00 42.46 37.01 3dal s ILE 70 CO 0.32 0.10 1.18 -2.84 -1.23 0.00 0.00 174.94 172.47 3dal s PRO 71 N 1.69 2.39 0.56 2.79 0.02 -1.26 -0.92 135.00 140.26 3dal s PRO 71 Ca 0.06 1.68 -0.21 0.00 0.02 0.00 0.00 61.00 62.55 3dal s PRO 71 Cb -0.17 -1.87 -0.05 0.00 0.02 0.00 0.00 34.50 32.43 3dal s PRO 71 CO 0.09 -1.63 1.27 1.17 -0.33 0.00 0.00 177.00 177.57 3dal n LYS 72 N -2.52 1.49 -2.23 5.54 4.81 -1.26 -3.53 118.16 120.47 3dal n LYS 72 Ca 0.13 0.55 -0.02 0.00 -0.87 0.00 0.00 58.31 58.10 3dal n LYS 72 Cb 0.51 -2.47 0.00 0.00 0.02 0.00 0.00 35.03 33.08 3dal n LYS 72 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3dal n GLY 73 N 0.88 0.45 3.58 3.14 0.00 -0.14 -4.79 105.19 108.30 3dal n GLY 73 Ca 0.11 -0.73 -0.34 0.00 0.00 0.00 0.00 46.02 45.07 3dal n GLY 73 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dal s THR 74 N -2.41 4.26 -0.19 2.61 2.01 -1.23 -0.57 115.64 120.13 3dal s THR 74 Ca 0.02 -0.23 -0.09 0.00 0.31 0.00 0.00 61.69 61.70 3dal s THR 74 Cb -0.01 -2.87 -0.05 0.00 0.01 0.00 0.00 72.50 69.58 3dal s THR 74 CO 0.02 0.50 0.12 -0.60 -0.69 0.00 0.00 174.62 173.97 3dal s ARG 75 N 0.14 4.05 0.10 4.92 3.52 0.42 -0.69 118.95 131.40 3dal s ARG 75 Ca 0.01 -0.23 0.06 0.00 -0.13 0.00 0.00 55.73 55.44 3dal s ARG 75 Cb -0.13 -3.35 -0.04 0.00 -1.56 0.00 0.00 34.95 29.87 3dal s ARG 75 CO 0.02 0.36 -0.08 -0.06 -0.81 0.00 0.00 175.30 174.73 3dal s PHE 76 N 0.18 2.80 -0.81 5.12 0.08 0.59 -0.82 117.98 125.12 3dal s PHE 76 Ca 0.08 -0.12 0.00 0.00 0.12 0.00 0.00 56.93 57.01 3dal s PHE 76 Cb -0.11 -1.46 0.00 0.00 -0.57 0.00 0.00 43.02 40.88 3dal s PHE 76 CO -0.01 0.44 0.00 0.41 -0.10 0.00 0.00 175.22 175.96 3dal n GLY 77 N 0.69 0.54 3.84 4.36 0.00 -1.26 -1.07 105.19 112.30 3dal n GLY 77 Ca -0.13 -2.25 -0.32 0.00 0.00 0.00 0.00 46.02 43.32 3dal n GLY 77 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3dal s PRO 78 N -0.57 3.59 0.12 1.61 0.04 -1.26 -4.63 135.00 133.91 3dal s PRO 78 Ca 0.00 0.93 -0.31 0.00 0.04 0.00 0.00 61.00 61.66 3dal s PRO 78 Cb 0.00 -2.08 -0.09 0.00 0.04 0.00 0.00 34.50 32.37 3dal s PRO 78 CO 0.00 -0.57 1.61 -1.17 0.04 0.00 0.00 177.00 176.91 3dal s LEU 79 N -4.70 4.37 -0.08 -3.56 2.96 -0.09 -5.00 118.68 112.58 3dal s LEU 79 Ca 0.58 2.57 0.01 0.00 -0.22 0.00 0.00 54.13 57.07 3dal s LEU 79 Cb -0.12 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 42.97 3dal s LEU 79 CO 0.43 -0.86 -0.09 -0.63 -1.32 0.00 0.00 176.35 173.89 3dal s ILE 80 N 1.82 3.53 -0.02 6.68 -1.09 -1.26 -4.70 121.20 126.15 3dal s ILE 80 Ca 0.72 -0.53 -0.29 0.00 -2.23 0.00 0.00 60.65 58.32 3dal s ILE 80 Cb -0.42 -2.45 0.11 0.00 -1.58 0.00 0.00 42.46 38.11 3dal s ILE 80 CO 0.32 0.57 1.30 -0.83 -1.23 0.00 0.00 174.94 175.07 3dal s GLY 81 N -0.49 -0.24 0.48 6.18 0.00 -1.24 -2.69 107.32 109.32 3dal s GLY 81 Ca 0.07 0.31 -0.22 0.00 0.00 0.00 0.00 44.72 44.88 3dal s GLY 81 CO 0.02 3.59 1.18 -0.54 0.00 0.00 0.00 173.10 177.35 3dal s GLU 82 N -2.14 3.62 -0.13 2.90 2.02 -0.58 -4.65 118.70 119.74 3dal s GLU 82 Ca 0.24 1.79 -0.04 0.00 0.02 0.00 0.00 54.97 56.98 3dal s GLU 82 Cb 0.02 -2.31 -0.03 0.00 0.10 0.00 0.00 34.13 31.90 3dal s GLU 82 CO -0.02 -0.67 0.00 0.42 0.02 0.00 0.00 175.26 175.01 3dal s ILE 83 N -1.56 4.30 0.03 -1.63 -1.09 -1.26 0.36 121.20 120.34 3dal s ILE 83 Ca 0.66 -0.23 0.03 0.00 -2.23 0.00 0.00 60.65 58.88 3dal s ILE 83 Cb -0.29 -2.86 -0.02 0.00 -1.58 0.00 0.00 42.46 37.71 3dal s ILE 83 CO 0.34 0.54 -0.10 -0.31 -1.23 0.00 0.00 174.94 174.18 3dal s TYR 84 N -0.21 0.90 0.49 3.97 2.02 -0.30 -4.98 117.35 119.25 3dal s TYR 84 Ca 0.05 -0.33 0.08 0.00 -0.37 0.00 0.00 57.07 56.51 3dal s TYR 84 Cb -0.12 -0.54 0.03 0.00 -0.40 0.00 0.00 41.96 40.93 3dal s TYR 84 CO 0.02 -0.01 0.55 0.95 -1.57 0.00 0.00 175.55 175.49 3dal s THR 85 N -0.81 2.33 0.30 -0.71 -4.23 -1.26 -0.10 115.64 111.17 3dal s THR 85 Ca -0.01 -1.21 0.01 0.00 -1.18 0.00 0.00 61.69 59.30 3dal s THR 85 Cb -0.07 -2.54 0.28 0.00 1.34 0.00 0.00 72.50 71.51 3dal s THR 85 CO 0.01 0.00 1.90 0.78 -0.54 0.00 0.00 174.62 176.76 3dal h ASN 86 N 0.63 0.89 0.56 3.99 2.35 -1.97 0.16 115.58 122.20 3dal h ASN 86 Ca -0.36 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.40 3dal h ASN 86 Cb 1.28 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 39.48 3dal h ASN 86 CO 0.50 0.55 0.00 0.47 -1.65 0.00 0.00 177.43 177.30 3dal n ASP 87 N -4.51 0.23 0.00 5.81 9.92 -1.26 -3.75 116.55 122.98 3dal n ASP 87 Ca 0.15 0.56 0.00 0.00 -0.53 0.00 0.00 54.79 54.96 3dal n ASP 87 Cb 0.24 -0.60 0.00 0.00 -0.64 0.00 0.00 41.12 40.11 3dal n ASP 87 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 3dal n THR 88 N -1.75 0.00 -1.89 -3.53 -2.24 -0.84 -5.08 114.28 98.95 3dal n THR 88 Ca 0.03 -0.28 -0.42 0.00 -2.27 0.00 0.00 64.05 61.11 3dal n THR 88 Cb 0.18 1.16 -0.03 0.00 -2.10 0.00 0.00 70.33 69.55 3dal n THR 88 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3dal s VAL 89 N -0.35 2.79 0.00 2.28 1.01 -0.01 -4.77 120.40 121.34 3dal s VAL 89 Ca 0.00 0.39 0.00 0.00 0.00 0.00 0.00 61.98 62.37 3dal s VAL 89 Cb 0.00 -3.25 0.00 0.00 0.00 0.00 0.00 36.38 33.13 3dal s VAL 89 CO 0.00 0.01 0.24 -0.81 0.00 0.00 0.00 175.10 174.54 3dal n PRO 90 N 5.02 0.00 0.00 2.72 -0.04 -1.26 -5.05 135.00 136.39 3dal n PRO 90 Ca 0.15 0.49 0.00 0.00 -0.04 0.00 0.00 63.50 64.10 3dal n PRO 90 Cb 0.39 -1.11 0.00 0.00 -0.04 0.00 0.00 33.50 32.74 3dal n PRO 90 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 3dal n ASN 94 N -1.97 0.00 -1.48 3.54 5.15 -1.26 -5.22 115.26 114.03 3dal n ASN 94 Ca 0.00 0.00 0.09 0.00 -0.60 0.00 0.00 54.58 54.07 3dal n ASN 94 Cb 0.00 0.00 0.33 0.00 -0.53 0.00 0.00 39.78 39.58 3dal n ASN 94 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3dal n ARG 95 N 0.58 3.46 -0.08 1.20 1.74 -1.26 -4.56 116.66 117.74 3dal n ARG 95 Ca 0.00 -2.62 0.12 0.00 -0.77 0.00 0.00 57.85 54.58 3dal n ARG 95 Cb 0.00 -1.83 0.50 0.00 -1.02 0.00 0.00 32.46 30.11 3dal n ARG 95 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 3dal h LYS 96 N 3.78 0.39 -0.27 5.56 3.64 -2.03 -2.42 116.57 125.22 3dal h LYS 96 Ca 0.00 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.29 3dal h LYS 96 Cb 1.33 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 33.02 3dal h LYS 96 CO 0.20 0.26 -0.02 0.66 -2.27 0.00 0.00 179.45 178.28 3dal n TYR 97 N -4.47 0.92 -2.95 1.91 4.01 -1.26 -5.00 117.16 110.33 3dal n TYR 97 Ca 0.10 -1.15 -0.40 0.00 -0.16 0.00 0.00 57.90 56.28 3dal n TYR 97 Cb 0.37 -0.37 -0.05 0.00 -0.31 0.00 0.00 39.34 38.98 3dal n TYR 97 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 3dal s PHE 98 N -2.99 3.80 0.00 -0.72 0.40 -0.91 -0.92 117.98 116.64 3dal s PHE 98 Ca 0.42 1.57 0.07 0.00 -0.60 0.00 0.00 56.93 58.39 3dal s PHE 98 Cb 0.36 -2.84 -0.02 0.00 0.51 0.00 0.00 43.02 41.03 3dal s PHE 98 CO 0.05 0.34 -0.21 -1.58 0.70 0.00 0.00 175.22 174.52 3dal s TRP 99 N -0.38 1.86 -0.08 0.36 0.52 0.39 -4.98 118.94 116.64 3dal s TRP 99 Ca 0.39 -0.36 -0.11 0.00 0.02 0.00 0.00 56.10 56.04 3dal s TRP 99 Cb -0.22 -1.17 -0.05 0.00 -1.15 0.00 0.00 33.47 30.88 3dal s TRP 99 CO 0.25 0.00 0.27 1.03 0.02 0.00 0.00 176.95 178.53 3dal s ARG 100 N -0.68 3.79 -0.12 4.98 0.52 -1.26 -0.17 118.95 126.01 3dal s ARG 100 Ca 0.08 0.13 0.01 0.00 -0.52 0.00 0.00 55.73 55.43 3dal s ARG 100 Cb -0.08 -3.25 -0.01 0.00 0.52 0.00 0.00 34.95 32.13 3dal s ARG 100 CO -0.00 0.64 -0.17 0.42 0.02 0.00 0.00 175.30 176.21 3dal s ILE 101 N -0.77 2.68 0.15 1.52 -1.09 0.24 -4.96 121.20 118.97 3dal s ILE 101 Ca 0.19 -0.79 0.06 0.00 -2.23 0.00 0.00 60.65 57.88 3dal s ILE 101 Cb -0.14 -2.10 -0.04 0.00 -1.58 0.00 0.00 42.46 38.60 3dal s ILE 101 CO 0.08 0.54 0.01 -0.31 -1.23 0.00 0.00 174.94 174.02 3dal s TYR 102 N 0.40 2.91 -0.04 3.97 2.02 -1.26 -0.41 117.35 124.94 3dal s TYR 102 Ca -0.13 -0.10 -0.02 0.00 -0.37 0.00 0.00 57.07 56.46 3dal s TYR 102 Cb -0.17 -1.44 0.03 0.00 -0.40 0.00 0.00 41.96 39.99 3dal s TYR 102 CO 0.06 0.50 0.06 0.45 -1.57 0.00 0.00 175.55 175.06 3dal s SER 103 N -2.77 0.76 -1.34 2.29 0.15 0.54 -4.83 113.70 108.49 3dal s SER 103 Ca 0.27 0.10 -0.00 0.00 0.70 0.00 0.00 55.95 57.02 3dal s SER 103 Cb -0.10 -0.07 -0.00 0.00 -1.71 0.00 0.00 66.02 64.14 3dal s SER 103 CO 0.19 -0.21 0.59 0.54 1.20 0.00 0.00 173.24 175.54 3dal n ARG 104 N 4.95 -4.20 -0.89 5.44 1.74 -1.26 -1.75 116.66 120.69 3dal n ARG 104 Ca -0.11 0.53 0.00 0.00 -0.77 0.00 0.00 57.85 57.50 3dal n ARG 104 Cb 0.50 -4.90 0.00 0.00 -1.02 0.00 0.00 32.46 27.04 3dal n ARG 104 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dal n GLY 105 N -1.74 0.34 3.25 -0.13 0.00 -1.26 -4.99 105.19 100.66 3dal n GLY 105 Ca -0.30 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.45 3dal n GLY 105 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dal s GLU 106 N -0.83 1.59 0.19 1.61 0.41 -0.72 -5.10 118.70 115.86 3dal s GLU 106 Ca 0.00 -0.88 -0.33 0.00 -0.41 0.00 0.00 54.97 53.36 3dal s GLU 106 Cb 0.00 -1.63 -0.13 0.00 -1.78 0.00 0.00 34.13 30.59 3dal s GLU 106 CO 0.00 0.43 1.64 -0.11 -0.49 0.00 0.00 175.26 176.73 3dal n LEU 107 N 2.16 3.57 -0.06 1.80 7.94 -1.26 -0.34 117.00 130.80 3dal n LEU 107 Ca -0.16 1.08 -0.13 0.00 -1.11 0.00 0.00 56.01 55.68 3dal n LEU 107 Cb 0.53 -1.50 -0.04 0.00 0.53 0.00 0.00 43.42 42.93 3dal n LEU 107 CO 0.23 -0.06 -0.84 1.57 -1.11 0.00 0.00 177.39 177.18 3dal n HIS 108 N 3.58 0.00 -3.87 1.96 -0.00 0.45 -4.82 115.22 112.52 3dal n HIS 108 Ca 0.16 0.00 -0.08 0.00 -0.00 0.00 0.00 57.72 57.80 3dal n HIS 108 Cb 0.32 -0.46 -0.01 0.00 -0.00 0.00 0.00 29.99 29.83 3dal n HIS 108 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 3dal s HIS 109 N -2.33 0.04 -0.05 1.57 -3.43 -0.94 -4.70 115.29 105.45 3dal s HIS 109 Ca -0.19 -0.55 0.04 0.00 -0.80 0.00 0.00 55.06 53.56 3dal s HIS 109 Cb 0.06 0.65 -0.02 0.00 -1.43 0.00 0.00 32.58 31.84 3dal s HIS 109 CO 0.25 -1.31 -0.16 -0.06 -2.00 0.00 0.00 174.74 171.46 3dal s PHE 110 N -3.37 2.65 -0.22 0.38 0.08 0.85 -0.59 117.98 117.75 3dal s PHE 110 Ca 0.15 -0.20 -0.08 0.00 0.12 0.00 0.00 56.93 56.91 3dal s PHE 110 Cb -0.05 -1.61 -0.04 0.00 -0.57 0.00 0.00 43.02 40.75 3dal s PHE 110 CO 0.09 0.15 0.09 0.42 -0.10 0.00 0.00 175.22 175.88 3dal s ILE 111 N -0.71 4.81 -0.23 0.64 1.01 0.76 -1.14 121.20 126.33 3dal s ILE 111 Ca 0.11 -0.02 -0.01 0.00 0.00 0.00 0.00 60.65 60.74 3dal s ILE 111 Cb -0.11 -3.21 0.03 0.00 0.01 0.00 0.00 42.46 39.18 3dal s ILE 111 CO 0.00 0.39 -0.09 -0.62 0.00 0.00 0.00 174.94 174.62 3dal s ASP 112 N 0.93 4.10 -0.03 3.58 2.15 0.16 -0.46 116.67 127.10 3dal s ASP 112 Ca 0.05 -0.84 0.11 0.00 0.43 0.00 0.00 52.55 52.30 3dal s ASP 112 Cb -0.14 -1.62 0.38 0.00 -0.30 0.00 0.00 42.92 41.24 3dal s ASP 112 CO 0.03 -0.10 1.27 0.61 -0.17 0.00 0.00 175.17 176.81 3dal n GLY 113 N 4.65 1.25 0.17 2.66 0.00 -0.10 -1.52 105.19 112.31 3dal n GLY 113 Ca -0.17 -0.45 -0.09 0.00 0.00 0.00 0.00 46.02 45.30 3dal n GLY 113 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3dal h PHE 114 N 2.31 0.52 -3.62 1.61 3.57 -1.94 -3.40 116.94 116.00 3dal h PHE 114 Ca 0.00 -0.02 -0.56 0.00 3.53 0.00 0.00 57.97 60.91 3dal h PHE 114 Cb 0.74 -0.16 -0.07 0.00 2.79 0.00 0.00 35.95 39.25 3dal h PHE 114 CO 0.35 0.44 0.92 1.21 -2.23 0.00 0.00 178.31 179.01 3dal s ASN 115 N -5.72 6.67 0.51 0.41 3.84 -1.26 -4.89 114.94 114.49 3dal s ASN 115 Ca -0.13 0.59 0.33 0.00 0.21 0.00 0.00 52.86 53.87 3dal s ASN 115 Cb 0.10 -2.55 1.50 0.00 -0.55 0.00 0.00 41.25 39.75 3dal s ASN 115 CO 0.74 -1.20 2.00 -0.33 -2.79 0.00 0.00 177.10 175.51 3dal h GLU 116 N 9.12 0.00 0.00 0.43 5.08 -1.92 -1.35 114.58 125.94 3dal h GLU 116 Ca -0.23 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.11 3dal h GLU 116 Cb 1.06 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 3dal h GLU 116 CO 1.11 0.00 -0.08 0.93 -1.00 0.00 0.00 179.01 179.97 3dal h GLU 117 N 0.00 0.00 -0.02 2.33 5.08 -1.95 -0.89 114.58 119.13 3dal h GLU 117 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3dal h GLU 117 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 3dal h GLU 117 CO 0.00 0.08 0.00 1.63 -1.00 0.00 0.00 179.01 179.72 3dal n LYS 118 N -3.14 1.92 -4.32 2.33 5.02 -0.55 -4.50 118.16 114.92 3dal n LYS 118 Ca 0.03 -2.24 -0.17 0.00 -2.02 0.00 0.00 58.31 53.91 3dal n LYS 118 Cb 0.49 -1.35 -0.10 0.00 -0.02 0.00 0.00 35.03 34.05 3dal n LYS 118 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 3dal s SER 119 N -2.21 1.59 0.38 4.39 0.01 -0.95 -3.63 113.70 113.28 3dal s SER 119 Ca 0.22 -1.27 0.05 0.00 1.31 0.00 0.00 55.95 56.26 3dal s SER 119 Cb 0.19 0.06 0.05 0.00 0.21 0.00 0.00 66.02 66.54 3dal s SER 119 CO 0.03 -0.60 0.43 -0.46 0.41 0.00 0.00 173.24 173.05 3dal n ASN 120 N -0.43 1.74 0.29 2.44 6.94 -1.10 -2.22 115.26 122.93 3dal n ASN 120 Ca -0.04 -2.14 0.19 0.00 -0.02 0.00 0.00 54.58 52.58 3dal n ASN 120 Cb 0.65 -0.18 0.97 0.00 -2.36 0.00 0.00 39.78 38.85 3dal n ASN 120 CO 0.00 0.00 0.00 4.11 -1.03 0.00 0.00 177.26 180.34 3dal h TRP 121 N 0.29 0.00 0.00 -2.53 5.08 -1.73 -2.78 115.95 114.28 3dal h TRP 121 Ca -0.20 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.76 3dal h TRP 121 Cb 0.85 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.01 3dal h TRP 121 CO 0.00 0.00 -0.03 0.52 -1.28 0.00 0.00 178.44 177.65 3dal h MET 122 N 0.00 0.00 -0.04 0.12 2.86 -1.93 -1.09 114.93 114.85 3dal h MET 122 Ca 0.00 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 3dal h MET 122 Cb 0.16 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.82 3dal h MET 122 CO 0.00 0.03 0.05 0.07 1.06 0.00 0.00 176.91 178.11 3dal h ARG 123 N 0.00 0.00 -0.00 1.72 0.11 -1.83 -2.40 114.38 111.98 3dal h ARG 123 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3dal h ARG 123 Cb 0.18 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.26 3dal h ARG 123 CO 0.00 0.00 -0.26 0.66 0.10 0.00 0.00 179.97 180.47 3dal n TYR 124 N -3.75 0.00 -2.29 4.08 4.01 -0.41 -4.85 117.16 113.94 3dal n TYR 124 Ca -0.02 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.30 3dal n TYR 124 Cb 0.13 -0.33 -0.03 0.00 -0.31 0.00 0.00 39.34 38.81 3dal n TYR 124 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3dal s VAL 125 N -2.91 3.96 0.53 -0.72 1.01 -0.90 -3.95 120.40 117.40 3dal s VAL 125 Ca 0.15 1.26 -0.16 0.00 0.00 0.00 0.00 61.98 63.23 3dal s VAL 125 Cb 0.18 -3.81 -0.07 0.00 0.00 0.00 0.00 36.38 32.68 3dal s VAL 125 CO 0.60 -0.05 0.99 0.20 0.00 0.00 0.00 175.10 176.85 3dal s ASN 126 N 2.03 6.53 0.40 3.32 0.01 -1.26 -4.87 114.94 121.11 3dal s ASN 126 Ca 0.61 1.59 -0.23 0.00 -0.71 0.00 0.00 52.86 54.12 3dal s ASN 126 Cb -0.28 -2.51 -0.10 0.00 0.41 0.00 0.00 41.25 38.77 3dal s ASN 126 CO 0.23 -0.65 0.97 -2.16 -1.51 0.00 0.00 177.10 173.98 3dal s PRO 127 N -4.11 4.28 0.37 -0.60 0.04 -1.26 -1.48 135.00 132.23 3dal s PRO 127 Ca 0.59 1.27 -0.26 0.00 0.04 0.00 0.00 61.00 62.63 3dal s PRO 127 Cb -0.10 -2.40 -0.09 0.00 0.04 0.00 0.00 34.50 31.94 3dal s PRO 127 CO 0.33 -0.00 1.16 0.00 0.04 0.00 0.00 177.00 178.53 3dal s ALA 128 N -1.92 3.24 -0.59 8.56 0.00 0.11 -4.68 121.76 126.48 3dal s ALA 128 Ca 0.59 0.97 0.24 0.00 0.00 0.00 0.00 51.96 53.75 3dal s ALA 128 Cb -0.15 -3.37 0.41 0.00 0.00 0.00 0.00 23.12 20.01 3dal s ALA 128 CO 0.19 -0.44 1.42 0.45 0.00 0.00 0.00 175.76 177.37 3dal h HIS 129 N 2.94 0.00 -3.15 0.00 3.86 -1.91 -3.48 115.15 113.41 3dal h HIS 129 Ca -0.48 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 58.68 3dal h HIS 129 Cb 1.23 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 29.56 3dal h HIS 129 CO 0.56 0.00 0.02 -1.54 0.86 0.00 0.00 177.93 177.83 3dal s SER 130 N -4.62 -0.36 0.38 2.45 1.04 -1.26 -5.04 113.70 106.29 3dal s SER 130 Ca 0.06 -0.12 0.13 0.00 0.48 0.00 0.00 55.95 56.51 3dal s SER 130 Cb 0.12 0.51 0.96 0.00 0.10 0.00 0.00 66.02 67.70 3dal s SER 130 CO 0.70 -0.84 1.83 -0.65 0.98 0.00 0.00 173.24 175.25 3dal h PRO 131 N 2.40 0.53 -0.23 4.02 0.11 -1.96 -1.56 132.00 135.30 3dal h PRO 131 Ca -0.33 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.65 3dal h PRO 131 Cb 1.26 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3dal h PRO 131 CO 0.43 0.35 -0.26 0.00 -0.21 0.00 0.00 178.00 178.31 3dal h ARG 132 N 0.54 0.44 0.00 1.05 -0.00 -2.01 -2.82 114.38 111.59 3dal h ARG 132 Ca 0.50 -0.17 -0.10 0.00 -0.50 0.00 0.00 59.98 59.71 3dal h ARG 132 Cb 1.05 -0.03 -0.01 0.00 0.00 0.00 0.00 29.97 30.98 3dal h ARG 132 CO -0.24 0.67 -0.50 0.93 0.00 0.00 0.00 179.97 180.84 3dal h GLU 133 N 0.39 0.00 -6.65 0.04 5.08 -1.71 -3.46 114.58 108.28 3dal h GLU 133 Ca 0.06 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.89 3dal h GLU 133 Cb 0.67 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.96 3dal h GLU 133 CO 0.05 0.47 0.86 -1.14 -1.00 0.00 0.00 179.01 178.25 3dal s GLN 134 N -2.97 4.22 0.00 2.33 0.74 -0.95 -4.66 119.66 118.37 3dal s GLN 134 Ca 0.04 2.37 0.00 0.00 0.05 0.00 0.00 55.36 57.82 3dal s GLN 134 Cb 0.07 -3.14 0.00 0.00 1.10 0.00 0.00 33.01 31.05 3dal s GLN 134 CO 0.74 -0.58 0.31 0.27 -0.55 0.00 0.00 175.29 175.48 3dal n ASN 135 N 3.56 0.61 -4.10 6.67 0.23 -0.42 -4.88 115.26 116.94 3dal n ASN 135 Ca 0.12 -0.98 -0.21 0.00 -0.53 0.00 0.00 54.58 52.98 3dal n ASN 135 Cb 0.39 0.02 -0.15 0.00 -2.08 0.00 0.00 39.78 37.96 3dal n ASN 135 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 3dal s LEU 136 N -0.04 2.05 -0.12 -4.53 1.43 -0.78 -1.59 118.68 115.10 3dal s LEU 136 Ca 0.00 -0.28 -0.02 0.00 -1.03 0.00 0.00 54.13 52.80 3dal s LEU 136 Cb 0.00 -0.65 -0.03 0.00 0.03 0.00 0.00 46.19 45.54 3dal s LEU 136 CO 0.00 0.13 -0.04 0.00 0.23 0.00 0.00 176.35 176.67 3dal s ALA 137 N -0.41 3.04 -0.12 4.21 0.00 0.04 -1.62 121.76 126.90 3dal s ALA 137 Ca 0.04 -0.84 -0.14 0.00 0.00 0.00 0.00 51.96 51.02 3dal s ALA 137 Cb -0.06 -1.45 -0.05 0.00 0.00 0.00 0.00 23.12 21.57 3dal s ALA 137 CO -0.00 0.38 0.34 0.00 0.00 0.00 0.00 175.76 176.47 3dal s ALA 138 N -0.17 3.61 0.05 0.00 0.00 -0.34 -0.72 121.76 124.19 3dal s ALA 138 Ca 0.03 -0.38 0.04 0.00 0.00 0.00 0.00 51.96 51.65 3dal s ALA 138 Cb -0.13 -2.41 -0.03 0.00 0.00 0.00 0.00 23.12 20.56 3dal s ALA 138 CO 0.02 0.18 -0.11 0.00 0.00 0.00 0.00 175.76 175.85 3dal s GLN 140 N -1.61 3.93 -0.16 0.00 0.74 -1.26 -1.26 119.66 120.03 3dal s GLN 140 Ca -0.06 -0.05 0.02 0.00 0.05 0.00 0.00 55.36 55.32 3dal s GLN 140 Cb -0.10 -3.69 0.02 0.00 1.10 0.00 0.00 33.01 30.34 3dal s GLN 140 CO 0.01 -0.33 -0.21 -0.80 -0.55 0.00 0.00 175.29 173.41 3dal s ASN 141 N 1.66 3.12 1.75 6.67 -0.87 -0.09 -4.88 114.94 122.31 3dal s ASN 141 Ca 0.14 -0.63 0.00 0.00 -1.57 0.00 0.00 52.86 50.81 3dal s ASN 141 Cb -0.16 -1.46 0.00 0.00 -0.02 0.00 0.00 41.25 39.61 3dal s ASN 141 CO 0.10 0.04 0.00 0.61 -2.57 0.00 0.00 177.10 175.28 3dal n GLY 142 N 4.35 2.99 1.20 0.66 0.00 -1.26 -1.84 105.19 111.30 3dal n GLY 142 Ca -0.20 -0.20 0.11 0.00 0.00 0.00 0.00 46.02 45.73 3dal n GLY 142 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3dal n MET 143 N 13.50 2.59 -4.49 1.61 2.81 -1.26 -5.00 117.12 126.89 3dal n MET 143 Ca 0.00 -2.42 -0.25 0.00 -1.81 0.00 0.00 57.70 53.22 3dal n MET 143 Cb 0.00 -1.52 -0.10 0.00 -0.71 0.00 0.00 33.22 30.89 3dal n MET 143 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 3dal s ASN 144 N -1.23 3.69 -0.17 7.83 0.01 -0.76 -5.05 114.94 119.25 3dal s ASN 144 Ca 0.42 -1.07 -0.07 0.00 -0.71 0.00 0.00 52.86 51.42 3dal s ASN 144 Cb 0.23 -0.34 -0.04 0.00 0.41 0.00 0.00 41.25 41.51 3dal s ASN 144 CO 0.31 -0.05 0.08 -0.63 -1.51 0.00 0.00 177.10 175.30 3dal s ILE 145 N -2.54 4.94 0.16 0.60 -1.09 -1.26 -0.91 121.20 121.11 3dal s ILE 145 Ca 0.31 0.02 0.06 0.00 -2.23 0.00 0.00 60.65 58.81 3dal s ILE 145 Cb -0.02 -3.21 -0.04 0.00 -1.58 0.00 0.00 42.46 37.60 3dal s ILE 145 CO 0.16 0.49 -0.13 -0.31 -1.23 0.00 0.00 174.94 173.91 3dal s TYR 146 N 0.08 1.51 -0.10 3.97 2.02 -0.39 -0.91 117.35 123.53 3dal s TYR 146 Ca 0.06 -0.61 0.01 0.00 -0.37 0.00 0.00 57.07 56.16 3dal s TYR 146 Cb -0.12 -0.75 -0.02 0.00 -0.40 0.00 0.00 41.96 40.67 3dal s TYR 146 CO 0.00 0.22 -0.11 -0.06 -1.57 0.00 0.00 175.55 174.03 3dal s PHE 147 N -2.75 2.82 -0.06 2.71 0.08 -0.23 -1.28 117.98 119.27 3dal s PHE 147 Ca 0.16 -0.34 0.05 0.00 0.12 0.00 0.00 56.93 56.93 3dal s PHE 147 Cb -0.01 -1.77 -0.01 0.00 -0.57 0.00 0.00 43.02 40.65 3dal s PHE 147 CO 0.04 0.02 -0.22 0.71 -0.10 0.00 0.00 175.22 175.67 3dal s TYR 148 N -0.18 2.51 0.16 0.36 2.02 0.10 -0.30 117.35 122.03 3dal s TYR 148 Ca 0.01 -0.65 -0.30 0.00 -0.37 0.00 0.00 57.07 55.75 3dal s TYR 148 Cb -0.13 -1.63 -0.08 0.00 -0.40 0.00 0.00 41.96 39.72 3dal s TYR 148 CO 0.03 -0.17 1.21 0.95 -1.57 0.00 0.00 175.55 176.00 3dal s THR 149 N -0.17 3.63 -2.01 -0.71 -4.23 0.13 -0.78 115.64 111.49 3dal s THR 149 Ca -0.03 1.31 0.18 0.00 -1.18 0.00 0.00 61.69 61.98 3dal s THR 149 Cb -0.14 -3.84 0.09 0.00 1.34 0.00 0.00 72.50 69.95 3dal s THR 149 CO 0.04 0.18 1.01 2.30 -0.54 0.00 0.00 174.62 177.61 3dal n ILE 150 N 2.84 0.00 -3.85 2.99 -5.35 -0.62 -0.97 119.36 114.41 3dal n ILE 150 Ca 0.06 -0.43 -0.09 0.00 -0.27 0.00 0.00 62.75 62.02 3dal n ILE 150 Cb 0.45 1.31 -0.04 0.00 -1.74 0.00 0.00 39.64 39.62 3dal n ILE 150 CO 0.00 0.00 0.00 -1.59 -1.76 0.00 0.00 176.55 173.20 3dal s LYS 151 N -1.71 1.55 0.55 6.28 -2.85 -1.26 -4.74 119.74 117.57 3dal s LYS 151 Ca 0.19 -1.02 -0.20 0.00 -1.00 0.00 0.00 55.97 53.94 3dal s LYS 151 Cb 0.15 0.53 -0.05 0.00 -2.06 0.00 0.00 37.83 36.40 3dal s LYS 151 CO 0.31 -0.67 1.20 -2.14 0.10 0.00 0.00 175.35 174.14 3dal s PRO 152 N -3.93 3.24 -0.34 1.78 0.02 -1.26 -4.08 135.00 130.43 3dal s PRO 152 Ca 0.14 1.81 0.01 0.00 0.02 0.00 0.00 61.00 62.97 3dal s PRO 152 Cb -0.02 -2.07 0.09 0.00 0.02 0.00 0.00 34.50 32.51 3dal s PRO 152 CO 0.04 -0.99 0.06 0.42 -0.33 0.00 0.00 177.00 176.20 3dal s ILE 153 N -1.60 2.64 0.89 2.83 1.01 -0.09 -4.92 121.20 121.97 3dal s ILE 153 Ca 0.73 -2.03 -0.11 0.00 0.00 0.00 0.00 60.65 59.24 3dal s ILE 153 Cb -0.29 -2.79 0.13 0.00 0.01 0.00 0.00 42.46 39.52 3dal s ILE 153 CO 0.33 -0.47 1.12 -2.65 0.00 0.00 0.00 174.94 173.27 3dal n PRO 154 N 4.42 -0.31 -1.61 2.79 -0.02 -1.26 -0.48 135.00 138.53 3dal n PRO 154 Ca -0.03 -0.02 -0.44 0.00 -2.02 0.00 0.00 63.50 60.99 3dal n PRO 154 Cb 0.42 -2.36 -0.02 0.00 -0.02 0.00 0.00 33.50 31.52 3dal n PRO 154 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dal n ALA 155 N -4.00 0.11 -2.63 3.55 0.00 -1.24 -2.91 120.51 113.39 3dal n ALA 155 Ca 0.12 0.39 -0.15 0.00 0.00 0.00 0.00 53.44 53.80 3dal n ALA 155 Cb 0.52 -2.08 0.02 0.00 0.00 0.00 0.00 19.45 17.90 3dal n ALA 155 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3dal n ASN 156 N 1.22 -4.63 -4.45 0.00 5.03 -0.06 -4.94 115.26 107.42 3dal n ASN 156 Ca 0.09 -0.14 -0.31 0.00 0.87 0.00 0.00 54.58 55.09 3dal n ASN 156 Cb 0.32 -3.59 -0.13 0.00 -1.02 0.00 0.00 39.78 35.37 3dal n ASN 156 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 3dal s GLN 157 N -5.15 2.11 0.32 3.52 -1.52 -1.14 -4.86 119.66 112.94 3dal s GLN 157 Ca 0.15 -0.95 -0.28 0.00 -1.95 0.00 0.00 55.36 52.32 3dal s GLN 157 Cb -0.06 -2.19 -0.09 0.00 -0.22 0.00 0.00 33.01 30.44 3dal s GLN 157 CO 0.18 0.55 1.10 -2.00 -0.25 0.00 0.00 175.29 174.87 3dal s GLU 158 N -1.33 4.46 -0.06 2.91 2.12 -1.26 -0.97 118.70 124.57 3dal s GLU 158 Ca 0.14 1.75 -0.29 0.00 0.36 0.00 0.00 54.97 56.94 3dal s GLU 158 Cb -0.10 -2.98 -0.02 0.00 0.26 0.00 0.00 34.13 31.28 3dal s GLU 158 CO 0.04 0.06 0.94 -0.51 -0.54 0.00 0.00 175.26 175.25 3dal s LEU 159 N -1.85 4.31 -0.07 2.70 1.02 0.59 -4.91 118.68 120.47 3dal s LEU 159 Ca 0.49 1.51 -0.01 0.00 0.02 0.00 0.00 54.13 56.14 3dal s LEU 159 Cb -0.30 -3.47 0.03 0.00 0.02 0.00 0.00 46.19 42.47 3dal s LEU 159 CO 0.38 -0.31 0.00 -0.76 0.02 0.00 0.00 176.35 175.68 3dal s LEU 160 N 1.40 0.61 0.07 1.79 1.43 -1.26 -4.08 118.68 118.63 3dal s LEU 160 Ca 0.48 -0.08 0.03 0.00 -1.03 0.00 0.00 54.13 53.52 3dal s LEU 160 Cb -0.19 -0.44 -0.04 0.00 0.03 0.00 0.00 46.19 45.55 3dal s LEU 160 CO 0.22 -0.19 0.05 0.54 0.23 0.00 0.00 176.35 177.20 3dal s VAL 161 N 1.94 4.37 0.05 -1.59 0.11 -0.55 -1.30 120.40 123.44 3dal s VAL 161 Ca 0.04 -0.79 -0.06 0.00 -2.93 0.00 0.00 61.98 58.25 3dal s VAL 161 Cb -0.12 -3.08 -0.01 0.00 -1.53 0.00 0.00 36.38 31.64 3dal s VAL 161 CO -0.05 0.16 0.10 0.86 -3.33 0.00 0.00 175.10 172.84 3dal s TRP 162 N -1.32 0.24 0.47 1.54 -0.11 -0.64 -0.71 118.94 118.40 3dal s TRP 162 Ca 0.27 -0.63 -0.24 0.00 1.22 0.00 0.00 56.10 56.73 3dal s TRP 162 Cb -0.12 -0.16 -0.08 0.00 -1.50 0.00 0.00 33.47 31.61 3dal s TRP 162 CO 0.19 -0.42 1.25 0.66 -4.62 0.00 0.00 176.95 174.01 3dal n TYR 163 N 0.40 1.98 -1.03 5.86 4.01 -1.26 -1.20 117.16 125.92 3dal n TYR 163 Ca -0.17 0.48 -0.28 0.00 -0.16 0.00 0.00 57.90 57.77 3dal n TYR 163 Cb 0.60 -2.34 0.20 0.00 -0.31 0.00 0.00 39.34 37.49 3dal n TYR 163 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3dal h ARG 165 N -2.11 0.23 -0.36 0.00 2.43 -1.79 0.64 114.38 113.42 3dal h ARG 165 Ca -0.57 -0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 58.47 3dal h ARG 165 Cb 1.34 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.82 3dal h ARG 165 CO 0.56 0.15 -0.25 -0.44 -1.51 0.00 0.00 179.97 178.48 3dal h ASP 166 N 0.24 0.76 -0.11 -3.80 3.32 -1.92 -0.29 116.42 114.61 3dal h ASP 166 Ca 0.17 -0.28 -0.03 0.00 0.02 0.00 0.00 57.03 56.90 3dal h ASP 166 Cb 0.17 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 3dal h ASP 166 CO -0.20 0.98 -0.06 0.15 -1.72 0.00 0.00 179.24 178.39 3dal h PHE 167 N 0.64 0.27 -0.98 4.55 -0.00 -1.80 -1.47 116.94 118.15 3dal h PHE 167 Ca 0.08 -0.07 0.13 0.00 -0.00 0.00 0.00 57.97 58.11 3dal h PHE 167 Cb 0.76 -0.06 -0.09 0.00 -0.00 0.00 0.00 35.95 36.56 3dal h PHE 167 CO 0.04 0.60 0.61 0.00 -0.00 0.00 0.00 178.31 179.55 3dal h ALA 168 N 0.63 1.50 -0.33 2.41 0.00 -0.66 -1.68 119.26 121.13 3dal h ALA 168 Ca 0.02 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 3dal h ALA 168 Cb 0.53 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3dal h ALA 168 CO 0.02 0.17 -0.27 0.93 0.00 0.00 0.00 179.25 180.10 3dal h GLU 169 N 0.94 0.68 -0.44 0.00 5.08 -0.79 0.56 114.58 120.61 3dal h GLU 169 Ca 0.50 -0.29 0.02 0.00 -1.00 0.00 0.00 59.36 58.59 3dal h GLU 169 Cb 0.54 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 3dal h GLU 169 CO -0.28 0.88 0.29 0.00 -1.00 0.00 0.00 179.01 178.90 3dal h ARG 170 N 0.59 0.53 -0.01 2.33 3.08 -0.35 -2.19 114.38 118.36 3dal h ARG 170 Ca 0.08 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.09 3dal h ARG 170 Cb 0.76 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.69 3dal h ARG 170 CO 0.06 0.35 -0.03 1.28 -1.07 0.00 0.00 179.97 180.56 3dal n LEU 171 N -4.47 1.44 -3.99 3.04 4.77 -0.71 -4.93 117.00 112.14 3dal n LEU 171 Ca 0.04 -0.47 -0.31 0.00 -0.03 0.00 0.00 56.01 55.24 3dal n LEU 171 Cb 0.10 -0.01 0.01 0.00 -2.33 0.00 0.00 43.42 41.18 3dal n LEU 171 CO 0.35 0.24 0.02 1.41 -1.33 0.00 0.00 177.39 178.08 3dal n HIS 172 N 0.08 -2.05 -3.99 -1.77 8.25 -0.58 -5.00 115.22 110.16 3dal n HIS 172 Ca 0.18 0.86 -0.26 0.00 -0.26 0.00 0.00 57.72 58.24 3dal n HIS 172 Cb 0.35 -3.70 -0.04 0.00 1.12 0.00 0.00 29.99 27.73 3dal n HIS 172 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 3dal s TYR 173 N -3.39 3.39 0.86 4.41 1.51 0.09 -5.02 117.35 119.19 3dal s TYR 173 Ca 0.56 0.06 -0.12 0.00 -1.01 0.00 0.00 57.07 56.57 3dal s TYR 173 Cb -0.29 -1.61 0.11 0.00 -0.11 0.00 0.00 41.96 40.05 3dal s TYR 173 CO 0.86 0.51 1.10 -1.25 -1.11 0.00 0.00 175.55 175.66 3dal s PRO 174 N -3.29 1.55 0.02 -1.71 0.04 -1.26 -4.37 135.00 125.99 3dal s PRO 174 Ca 0.34 0.63 -0.24 0.00 0.04 0.00 0.00 61.00 61.76 3dal s PRO 174 Cb -0.11 -1.86 0.06 0.00 0.04 0.00 0.00 34.50 32.63 3dal s PRO 174 CO 0.27 -1.99 0.55 1.52 0.04 0.00 0.00 177.00 177.39 3dal s TYR 175 N -3.09 -0.48 0.23 0.56 -0.85 -1.26 -4.93 117.35 107.53 3dal s TYR 175 Ca 0.62 0.64 -0.32 0.00 -0.52 0.00 0.00 57.07 57.49 3dal s TYR 175 Cb -0.16 0.35 -0.13 0.00 0.38 0.00 0.00 41.96 42.40 3dal s TYR 175 CO 0.55 -0.62 1.49 -2.30 -1.52 0.00 0.00 175.55 173.15 3dal n PRO 176 N 0.59 2.19 -0.16 -3.49 -0.02 -1.26 -1.75 135.00 131.10 3dal n PRO 176 Ca -0.19 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 3dal n PRO 176 Cb 0.59 -2.49 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 3dal n PRO 176 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dal n GLY 177 N 2.51 1.04 3.69 -1.23 0.00 -1.26 -4.83 105.19 105.11 3dal n GLY 177 Ca 0.12 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.70 3dal n GLY 177 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3dal n GLU 178 N -2.00 2.34 -2.40 1.61 2.13 -0.71 -4.96 120.64 116.65 3dal n GLU 178 Ca 0.00 0.84 -0.40 0.00 0.66 0.00 0.00 57.16 58.26 3dal n GLU 178 Cb 0.00 -2.60 -0.04 0.00 0.27 0.00 0.00 31.44 29.07 3dal n GLU 178 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3dal s LEU 179 N 0.59 4.51 0.83 4.31 1.43 -1.26 -5.04 118.68 124.05 3dal s LEU 179 Ca 0.74 2.34 -0.10 0.00 -1.03 0.00 0.00 54.13 56.08 3dal s LEU 179 Cb -0.61 -3.66 0.14 0.00 0.03 0.00 0.00 46.19 42.09 3dal s LEU 179 CO 0.41 -0.24 1.16 0.42 0.23 0.00 0.00 176.35 178.33 3dal s THR 180 N -1.18 2.09 0.30 5.49 -4.23 -1.26 -4.90 115.64 111.95 3dal s THR 180 Ca 0.46 -0.20 -0.01 0.00 -1.18 0.00 0.00 61.69 60.76 3dal s THR 180 Cb -0.33 -2.89 0.22 0.00 1.34 0.00 0.00 72.50 70.84 3dal s THR 180 CO 0.43 0.00 1.92 0.24 -0.54 0.00 0.00 174.62 176.67 3dal h MET 181 N -1.09 0.95 -0.29 3.99 0.00 -1.99 -1.84 114.93 114.66 3dal h MET 181 Ca -0.43 -0.10 -0.00 0.00 0.00 0.00 0.00 59.70 59.17 3dal h MET 181 Cb 1.27 -0.19 -0.01 0.00 0.00 0.00 0.00 31.60 32.66 3dal h MET 181 CO 0.46 0.70 0.18 0.52 0.00 0.00 0.00 176.91 178.77 3dal h MET 182 N 0.96 0.40 -0.59 1.72 2.86 -1.95 -1.17 114.93 117.17 3dal h MET 182 Ca 0.24 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.85 3dal h MET 182 Cb 0.03 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.58 3dal h MET 182 CO -0.04 0.30 0.36 -0.91 1.06 0.00 0.00 176.91 177.68 3dal h ASN 183 N 0.38 0.71 0.69 1.22 -0.26 -1.74 -2.23 115.58 114.35 3dal h ASN 183 Ca 0.11 -0.06 -0.07 0.00 -0.56 0.00 0.00 56.30 55.71 3dal h ASN 183 Cb 0.00 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.07 3dal h ASN 183 CO -0.02 0.56 -0.34 -0.07 -1.06 0.00 0.00 177.43 176.50 3dal h LEU 184 N 0.80 0.00 -0.09 1.61 3.38 -1.04 -3.21 115.31 116.76 3dal h LEU 184 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3dal h LEU 184 Cb -0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3dal h LEU 184 CO -0.04 0.34 -0.93 0.35 0.09 0.00 0.00 178.44 178.26 3dal n THR 185 N -3.64 0.00 -0.11 0.22 -2.24 -0.47 -5.10 114.28 102.94 3dal n THR 185 Ca -0.01 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 3dal n THR 185 Cb 0.45 0.98 0.00 0.00 -2.10 0.00 0.00 70.33 69.66 3dal n THR 185 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50