#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d2n n ASN 3 N 9.29 -1.79 -0.23 0.00 0.23 -1.26 -4.74 115.26 116.76 2d2n n ASN 3 Ca 0.03 -1.17 -0.01 0.00 -0.53 0.00 0.00 54.58 52.91 2d2n n ASN 3 Cb 0.49 -0.95 0.11 0.00 -2.08 0.00 0.00 39.78 37.35 2d2n n ASN 3 CO 0.00 0.00 0.00 0.03 -0.93 0.00 0.00 177.26 176.36 2d2n h ARG 4 N 0.00 0.63 0.10 -3.83 2.47 -1.99 -0.90 114.38 110.87 2d2n h ARG 4 Ca -0.39 -0.04 -0.24 0.00 -1.26 0.00 0.00 59.98 58.05 2d2n h ARG 4 Cb 1.18 -0.14 -0.00 0.00 -1.65 0.00 0.00 29.97 29.35 2d2n h ARG 4 CO 0.26 0.42 -1.20 -0.07 0.56 0.00 0.00 179.97 179.94 2d2n h LEU 5 N 0.65 0.34 -2.65 3.04 3.38 -2.01 -3.27 115.31 114.80 2d2n h LEU 5 Ca 0.31 -0.86 0.00 0.00 0.09 0.00 0.00 57.88 57.43 2d2n h LEU 5 Cb 0.24 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 2d2n h LEU 5 CO -0.21 1.53 0.10 -0.33 0.09 0.00 0.00 178.44 179.62 2d2n h GLU 6 N -0.41 0.00 -0.07 1.13 5.08 -1.90 0.46 114.58 118.85 2d2n h GLU 6 Ca -0.26 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.04 2d2n h GLU 6 Cb 1.66 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.91 2d2n h GLU 6 CO 0.05 0.00 -0.21 1.96 -1.00 0.00 0.00 179.01 179.81 2d2n h GLN 7 N 0.00 0.27 0.01 2.33 4.20 -1.23 -3.17 115.11 117.52 2d2n h GLN 7 Ca 0.01 -0.19 0.00 0.00 0.06 0.00 0.00 58.65 58.52 2d2n h GLN 7 Cb 0.21 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.02 2d2n h GLN 7 CO -0.00 0.81 -0.04 0.82 -0.67 0.00 0.00 178.83 179.75 2d2n h ILE 8 N -0.22 0.00 -0.72 2.54 2.04 -0.96 0.18 117.51 120.38 2d2n h ILE 8 Ca -0.01 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.92 2d2n h ILE 8 Cb 0.82 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.82 2d2n h ILE 8 CO 0.05 0.00 -0.42 0.18 0.00 0.00 0.00 178.15 177.96 2d2n n LEU 9 N -2.66 -0.75 0.39 1.44 4.77 -1.10 -0.73 117.00 118.37 2d2n n LEU 9 Ca -0.01 1.27 -0.19 0.00 -0.03 0.00 0.00 56.01 57.06 2d2n n LEU 9 Cb 0.03 -0.17 -0.10 0.00 -2.33 0.00 0.00 43.42 40.85 2d2n n LEU 9 CO 0.01 -1.04 0.53 0.58 -1.33 0.00 0.00 177.39 176.14 2d2n h VAL 10 N 0.00 0.00 -0.98 4.08 2.07 -1.44 -0.33 116.25 119.65 2d2n h VAL 10 Ca 0.12 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.86 2d2n h VAL 10 Cb 0.30 0.00 -0.19 0.00 -1.52 0.00 0.00 31.29 29.88 2d2n h VAL 10 CO -0.68 0.00 -0.15 0.29 0.02 0.00 0.00 177.57 177.05 2d2n n LYS 11 N -5.50 -0.09 0.09 1.57 5.02 0.60 -0.13 118.16 119.72 2d2n n LYS 11 Ca -0.14 1.51 -0.12 0.00 -2.02 0.00 0.00 58.31 57.54 2d2n n LYS 11 Cb 0.48 -2.31 -0.08 0.00 -0.02 0.00 0.00 35.03 33.10 2d2n n LYS 11 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 2d2n h THR 12 N 0.00 0.86 -0.39 -0.18 1.35 -0.98 -2.70 112.91 110.87 2d2n h THR 12 Ca 0.52 -0.86 0.11 0.00 -0.55 0.00 0.00 66.41 65.63 2d2n h THR 12 Cb 0.89 1.33 -0.02 0.00 -1.73 0.00 0.00 68.15 68.63 2d2n h THR 12 CO -0.98 0.18 0.31 1.56 -0.25 0.00 0.00 175.52 176.34 2d2n h GLN 13 N -0.74 0.00 -0.02 4.72 4.20 0.75 1.04 115.11 125.07 2d2n h GLN 13 Ca -0.03 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.62 2d2n h GLN 13 Cb 0.50 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.28 2d2n h GLN 13 CO 0.05 0.00 -0.24 2.35 -0.67 0.00 0.00 178.83 180.32 2d2n h TRP 14 N 0.00 0.28 0.01 2.96 2.91 -0.53 -2.04 115.95 119.53 2d2n h TRP 14 Ca 0.19 -0.14 -0.00 0.00 1.13 0.00 0.00 58.89 60.07 2d2n h TRP 14 Cb 0.81 -0.04 0.00 0.00 -0.51 0.00 0.00 29.16 29.42 2d2n h TRP 14 CO 0.00 0.89 -0.00 0.00 -1.03 0.00 0.00 178.44 178.30 2d2n h ALA 15 N 0.32 -0.01 0.00 2.65 0.00 -0.73 0.54 119.26 122.03 2d2n h ALA 15 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2d2n h ALA 15 Cb 0.94 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2d2n h ALA 15 CO 0.05 -0.48 0.51 1.96 0.00 0.00 0.00 179.25 181.29 2d2n h GLN 16 N -0.05 0.00 0.00 0.00 4.20 0.11 1.56 115.11 120.92 2d2n h GLN 16 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2d2n h GLN 16 Cb 0.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.83 2d2n h GLN 16 CO 0.00 0.00 0.00 0.45 -0.67 0.00 0.00 178.83 178.61 2d2n n SER 17 N -2.47 0.00 -0.12 1.46 2.88 -0.52 -4.29 113.62 110.56 2d2n n SER 17 Ca -0.01 0.00 0.02 0.00 -1.33 0.00 0.00 58.87 57.55 2d2n n SER 17 Cb 0.54 -0.07 0.31 0.00 -0.75 0.00 0.00 64.21 64.24 2d2n n SER 17 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 2d2n h TYR 18 N 0.00 0.75 0.00 0.66 3.20 -0.02 -0.83 116.97 120.73 2d2n h TYR 18 Ca 0.00 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.88 2d2n h TYR 18 Cb 0.00 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.02 2d2n h TYR 18 CO 0.00 0.49 0.00 0.41 -1.64 0.00 0.00 178.16 177.42 2d2n n GLY 19 N -1.38 -2.66 0.28 1.82 0.00 0.52 -4.01 105.19 99.76 2d2n n GLY 19 Ca 0.06 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.15 2d2n n GLY 19 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2d2n h GLU 20 N 0.00 0.14 -3.42 1.61 5.08 -1.13 -3.44 114.58 113.42 2d2n h GLU 20 Ca 0.00 -0.01 -0.32 0.00 -1.00 0.00 0.00 59.36 58.03 2d2n h GLU 20 Cb 0.00 -0.03 0.13 0.00 0.50 0.00 0.00 28.75 29.34 2d2n h GLU 20 CO 0.00 0.10 -0.95 0.00 -1.00 0.00 0.00 179.01 177.15 2d2n n ALA 21 N -2.85 -3.72 -1.00 3.43 0.00 -0.32 -4.95 120.51 111.10 2d2n n ALA 21 Ca 0.15 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2d2n n ALA 21 Cb 0.52 -0.69 0.00 0.00 0.00 0.00 0.00 19.45 19.28 2d2n n ALA 21 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2d2n n GLU 22 N 1.27 0.00 -3.45 0.00 2.13 -1.26 -4.75 120.64 114.58 2d2n n GLU 22 Ca 0.00 0.00 -0.43 0.00 0.66 0.00 0.00 57.16 57.39 2d2n n GLU 22 Cb 0.31 0.00 -0.10 0.00 0.27 0.00 0.00 31.44 31.92 2d2n n GLU 22 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2d2n s ASN 23 N -1.96 6.12 0.27 4.31 4.22 -1.26 -4.97 114.94 121.67 2d2n s ASN 23 Ca 0.00 -0.96 -0.08 0.00 -2.14 0.00 0.00 52.86 49.68 2d2n s ASN 23 Cb 0.00 -2.16 0.44 0.00 1.28 0.00 0.00 41.25 40.81 2d2n s ASN 23 CO 0.00 -0.48 1.52 0.54 -2.04 0.00 0.00 177.10 176.64 2d2n n ARG 24 N 5.17 -0.09 -0.45 3.55 1.74 -1.26 0.38 116.66 125.70 2d2n n ARG 24 Ca -0.11 1.52 0.37 0.00 -0.77 0.00 0.00 57.85 58.86 2d2n n ARG 24 Cb 0.47 -2.26 0.65 0.00 -1.02 0.00 0.00 32.46 30.29 2d2n n ARG 24 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2d2n h ALA 25 N 1.93 2.74 -1.87 7.54 0.00 -1.95 0.97 119.26 128.61 2d2n h ALA 25 Ca 0.46 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.49 2d2n h ALA 25 Cb 0.71 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2d2n h ALA 25 CO -1.00 -1.38 0.00 0.00 0.00 0.00 0.00 179.25 176.87 2d2n n ALA 26 N -2.52 -0.13 -0.17 0.00 0.00 0.16 -1.22 120.51 116.63 2d2n n ALA 26 Ca 0.38 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.84 2d2n n ALA 26 Cb 1.45 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.96 2d2n n ALA 26 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2d2n n PHE 27 N -1.06 0.16 0.31 0.00 7.35 0.38 0.39 117.46 124.98 2d2n n PHE 27 Ca 0.00 0.58 -0.17 0.00 -0.76 0.00 0.00 57.45 57.11 2d2n n PHE 27 Cb 0.00 -0.77 -0.08 0.00 0.35 0.00 0.00 39.48 38.97 2d2n n PHE 27 CO 0.00 0.00 0.00 0.77 -0.76 0.00 0.00 176.76 176.77 2d2n h SER 28 N 0.00 -0.67 0.09 -2.13 0.02 0.84 0.76 113.55 112.46 2d2n h SER 28 Ca 0.23 0.03 0.02 0.00 -0.84 0.00 0.00 61.79 61.22 2d2n h SER 28 Cb 0.35 0.18 -0.03 0.00 0.14 0.00 0.00 62.40 63.04 2d2n h SER 28 CO -0.49 -0.46 -0.18 0.03 -1.14 0.00 0.00 176.83 174.59 2d2n h ARG 29 N -0.75 -0.32 -0.81 3.45 3.08 0.13 -2.14 114.38 117.01 2d2n h ARG 29 Ca -0.07 0.02 0.18 0.00 0.07 0.00 0.00 59.98 60.18 2d2n h ARG 29 Cb 0.59 0.07 -0.15 0.00 0.08 0.00 0.00 29.97 30.56 2d2n h ARG 29 CO 0.11 -0.22 -0.14 -0.25 -1.07 0.00 0.00 179.97 178.40 2d2n n ASP 30 N -5.30 -0.23 0.22 7.04 10.43 0.16 0.01 116.55 128.87 2d2n n ASP 30 Ca -0.06 1.39 -0.09 0.00 2.57 0.00 0.00 54.79 58.60 2d2n n ASP 30 Cb 0.22 -0.45 -0.04 0.00 1.84 0.00 0.00 41.12 42.69 2d2n n ASP 30 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 177.20 176.38 2d2n h LEU 31 N 0.00 -0.47 -1.99 0.64 5.85 -0.20 -2.74 115.31 116.40 2d2n h LEU 31 Ca 0.42 0.02 0.23 0.00 0.84 0.00 0.00 57.88 59.39 2d2n h LEU 31 Cb 0.72 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.84 2d2n h LEU 31 CO -0.81 -0.34 0.60 -0.26 -0.34 0.00 0.00 178.44 177.29 2d2n h PHE 32 N -0.57 0.00 0.02 1.25 0.05 -0.84 0.21 116.94 117.06 2d2n h PHE 32 Ca -0.06 0.00 0.01 0.00 3.82 0.00 0.00 57.97 61.75 2d2n h PHE 32 Cb 0.43 0.00 -0.04 0.00 2.00 0.00 0.00 35.95 38.34 2d2n h PHE 32 CO 0.13 0.00 -0.39 1.03 -0.18 0.00 0.00 178.31 178.90 2d2n h SER 33 N 0.00 -1.21 0.08 2.17 0.87 -0.12 -2.28 113.55 113.06 2d2n h SER 33 Ca 0.38 0.13 0.01 0.00 -1.23 0.00 0.00 61.79 61.09 2d2n h SER 33 Cb 1.57 0.46 -0.05 0.00 -0.44 0.00 0.00 62.40 63.94 2d2n h SER 33 CO -0.00 -0.39 -0.51 -0.33 -0.53 0.00 0.00 176.83 175.07 2d2n h GLU 34 N -0.50 -0.67 -0.68 2.24 3.07 -0.45 -0.76 114.58 116.82 2d2n h GLU 34 Ca 0.01 0.05 0.26 0.00 -0.50 0.00 0.00 59.36 59.17 2d2n h GLU 34 Cb 0.53 0.15 -0.12 0.00 -0.84 0.00 0.00 28.75 28.47 2d2n h GLU 34 CO -0.25 -0.45 0.27 -0.11 -1.40 0.00 0.00 179.01 177.07 2d2n n LEU 35 N -5.31 0.15 -0.03 1.33 7.94 -0.98 0.33 117.00 120.43 2d2n n LEU 35 Ca -0.08 1.13 -0.15 0.00 -1.11 0.00 0.00 56.01 55.81 2d2n n LEU 35 Cb 0.39 -0.51 -0.11 0.00 0.53 0.00 0.00 43.42 43.72 2d2n n LEU 35 CO 0.14 -1.23 0.44 -0.26 -1.11 0.00 0.00 177.39 175.36 2d2n h PHE 36 N 0.00 0.27 0.00 1.96 0.05 -0.65 -2.47 116.94 116.10 2d2n h PHE 36 Ca 0.53 -0.13 0.00 0.00 3.82 0.00 0.00 57.97 62.19 2d2n h PHE 36 Cb 1.33 -0.04 0.00 0.00 2.00 0.00 0.00 35.95 39.25 2d2n h PHE 36 CO -0.10 0.88 0.00 0.09 -0.18 0.00 0.00 178.31 179.00 2d2n n ASN 37 N -4.53 0.08 -0.18 2.17 5.03 1.00 -1.75 115.26 117.09 2d2n n ASN 37 Ca -0.09 0.53 0.02 0.00 0.87 0.00 0.00 54.58 55.91 2d2n n ASN 37 Cb 0.47 -0.54 0.03 0.00 -1.02 0.00 0.00 39.78 38.71 2d2n n ASN 37 CO 0.00 0.00 0.00 2.30 -1.83 0.00 0.00 177.26 177.73 2d2n n ILE 38 N -1.60 0.20 -2.70 2.41 -5.35 0.15 -4.85 119.36 107.62 2d2n n ILE 38 Ca 0.02 -0.60 -0.03 0.00 -0.27 0.00 0.00 62.75 61.87 2d2n n ILE 38 Cb 0.11 0.97 0.03 0.00 -1.74 0.00 0.00 39.64 39.01 2d2n n ILE 38 CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 2d2n s GLN 39 N -0.47 0.32 0.42 6.28 0.74 -0.81 -5.04 119.66 121.11 2d2n s GLN 39 Ca 0.06 -0.29 0.13 0.00 0.05 0.00 0.00 55.36 55.31 2d2n s GLN 39 Cb 0.04 -0.01 1.00 0.00 1.10 0.00 0.00 33.01 35.14 2d2n s GLN 39 CO 0.05 -0.41 1.95 0.78 -0.55 0.00 0.00 175.29 177.12 2d2n h GLY 40 N 4.50 0.69 -0.85 2.59 0.00 -1.56 -2.07 103.07 106.37 2d2n h GLY 40 Ca 0.00 -0.19 0.41 0.00 0.00 0.00 0.00 47.33 47.54 2d2n h GLY 40 CO -0.09 0.10 0.97 1.48 0.00 0.00 0.00 176.54 179.00 2d2n h SER 41 N 0.46 0.09 0.52 0.19 4.64 -1.93 0.14 113.55 117.66 2d2n h SER 41 Ca 0.32 0.03 -0.27 0.00 -0.47 0.00 0.00 61.79 61.40 2d2n h SER 41 Cb 0.63 0.02 0.01 0.00 -0.31 0.00 0.00 62.40 62.75 2d2n h SER 41 CO -0.10 -0.02 -1.21 0.77 -0.87 0.00 0.00 176.83 175.41 2d2n h SER 42 N 0.06 0.50 -0.90 4.97 4.64 -1.70 -3.35 113.55 117.77 2d2n h SER 42 Ca 0.70 -0.51 0.24 0.00 -0.47 0.00 0.00 61.79 61.75 2d2n h SER 42 Cb 2.60 -0.16 -0.16 0.00 -0.31 0.00 0.00 62.40 64.37 2d2n h SER 42 CO -0.11 1.37 0.07 -0.09 -0.87 0.00 0.00 176.83 177.21 2d2n h ARG 43 N 0.12 0.08 0.00 4.77 2.43 -0.85 2.93 114.38 123.86 2d2n h ARG 43 Ca -0.14 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.00 2d2n h ARG 43 Cb 1.91 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 31.44 2d2n h ARG 43 CO 0.20 0.05 -0.12 0.00 -1.51 0.00 0.00 179.97 178.59 2d2n h ALA 44 N 1.86 0.99 0.00 2.80 0.00 -1.69 -3.15 119.26 120.07 2d2n h ALA 44 Ca 0.54 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.34 2d2n h ALA 44 Cb 1.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2d2n h ALA 44 CO -0.79 0.15 0.00 -0.11 0.00 0.00 0.00 179.25 178.50 2d2n n LEU 45 N -3.23 0.00 -1.05 0.00 7.94 0.98 -1.14 117.00 120.51 2d2n n LEU 45 Ca 0.01 0.27 -0.02 0.00 -1.11 0.00 0.00 56.01 55.16 2d2n n LEU 45 Cb 0.41 -0.27 0.15 0.00 0.53 0.00 0.00 43.42 44.24 2d2n n LEU 45 CO 0.31 -0.25 0.29 0.49 -1.11 0.00 0.00 177.39 177.13 2d2n n PHE 46 N -1.27 0.75 0.14 1.96 3.72 -1.19 -4.83 117.46 116.75 2d2n n PHE 46 Ca 0.01 -1.66 0.19 0.00 -0.05 0.00 0.00 57.45 55.93 2d2n n PHE 46 Cb 0.02 -0.27 0.78 0.00 -0.94 0.00 0.00 39.48 39.07 2d2n n PHE 46 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2d2n h SER 47 N 1.34 0.00 0.95 4.37 4.64 -1.34 -1.86 113.55 121.65 2d2n h SER 47 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 2d2n h SER 47 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2d2n h SER 47 CO 0.21 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.78 2d2n n GLY 48 N -1.45 -1.42 2.64 -0.77 0.00 -1.26 -4.17 105.19 98.75 2d2n n GLY 48 Ca 0.05 -0.07 -0.28 0.00 0.00 0.00 0.00 46.02 45.71 2d2n n GLY 48 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2d2n n VAL 49 N -1.63 2.72 -2.00 1.61 0.24 -0.70 -4.94 118.33 113.64 2d2n n VAL 49 Ca 0.06 -5.12 -0.10 0.00 -2.04 0.00 0.00 64.34 57.14 2d2n n VAL 49 Cb 0.31 -1.31 -0.02 0.00 -1.47 0.00 0.00 33.84 31.35 2d2n n VAL 49 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2d2n n GLY 50 N -0.41 0.07 0.30 7.63 0.00 -1.26 -3.82 105.19 107.71 2d2n n GLY 50 Ca 0.38 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.52 2d2n n GLY 50 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2d2n h VAL 51 N 0.00 0.00 -0.18 1.61 -1.51 -1.81 -0.55 116.25 113.81 2d2n h VAL 51 Ca -0.23 0.00 0.05 0.00 -1.23 0.00 0.00 66.70 65.29 2d2n h VAL 51 Cb 0.97 0.53 -0.05 0.00 -2.13 0.00 0.00 31.29 30.61 2d2n h VAL 51 CO 0.29 0.00 -0.12 0.44 -1.23 0.00 0.00 177.57 176.95 2d2n h ASP 52 N 0.00 -0.40 -3.55 4.19 3.45 -1.90 -3.36 116.42 114.85 2d2n h ASP 52 Ca 0.00 0.09 -0.70 0.00 0.43 0.00 0.00 57.03 56.85 2d2n h ASP 52 Cb 0.78 0.21 -0.32 0.00 -0.56 0.00 0.00 39.33 39.44 2d2n h ASP 52 CO 0.00 -0.16 -0.57 -0.62 -1.57 0.00 0.00 179.24 176.32 2d2n s ASP 53 N -5.11 5.26 0.00 6.45 2.15 -0.21 -4.97 116.67 120.24 2d2n s ASP 53 Ca -0.14 -1.69 0.11 0.00 0.43 0.00 0.00 52.55 51.26 2d2n s ASP 53 Cb 0.11 -1.84 0.53 0.00 -0.30 0.00 0.00 42.92 41.42 2d2n s ASP 53 CO 0.68 -0.46 1.26 0.23 -0.17 0.00 0.00 175.17 176.71 2d2n n MET 54 N 4.68 0.12 -0.47 4.34 2.81 -1.26 -2.10 117.12 125.25 2d2n n MET 54 Ca -0.07 0.21 0.08 0.00 -1.81 0.00 0.00 57.70 56.11 2d2n n MET 54 Cb 0.42 -1.50 0.25 0.00 -0.71 0.00 0.00 33.22 31.69 2d2n n MET 54 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2d2n n ASN 55 N -1.33 3.74 -4.92 7.83 3.02 -1.26 -4.49 115.26 117.85 2d2n n ASN 55 Ca 0.05 -3.08 -0.26 0.00 -0.03 0.00 0.00 54.58 51.25 2d2n n ASN 55 Cb 0.09 -0.55 0.03 0.00 -0.61 0.00 0.00 39.78 38.74 2d2n n ASN 55 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2d2n s SER 56 N -2.01 5.67 0.03 6.41 1.04 -0.89 -4.94 113.70 119.02 2d2n s SER 56 Ca 0.42 0.65 -0.26 0.00 0.48 0.00 0.00 55.95 57.24 2d2n s SER 56 Cb 0.35 -1.71 -0.17 0.00 0.10 0.00 0.00 66.02 64.59 2d2n s SER 56 CO 0.08 -0.97 1.39 0.00 0.98 0.00 0.00 173.24 174.72 2d2n h ALA 57 N -0.05 -0.38 -0.42 5.32 0.00 -1.95 -2.25 119.26 119.53 2d2n h ALA 57 Ca -0.46 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 54.38 2d2n h ALA 57 Cb 1.25 0.15 -0.09 0.00 0.00 0.00 0.00 17.79 19.10 2d2n h ALA 57 CO 0.60 -0.59 -0.26 0.00 0.00 0.00 0.00 179.25 179.00 2d2n h ALA 58 N 0.01 -0.01 0.74 0.00 0.00 -1.93 -0.93 119.26 117.14 2d2n h ALA 58 Ca -0.04 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2d2n h ALA 58 Cb 0.45 0.59 0.01 0.00 0.00 0.00 0.00 17.79 18.83 2d2n h ALA 58 CO 0.06 -0.63 -0.36 0.35 0.00 0.00 0.00 179.25 178.68 2d2n h PHE 59 N -0.18 -0.92 -0.91 0.00 3.57 -1.64 -3.07 116.94 113.79 2d2n h PHE 59 Ca 0.20 -0.02 0.16 0.00 3.53 0.00 0.00 57.97 61.83 2d2n h PHE 59 Cb 0.49 0.31 -0.07 0.00 2.79 0.00 0.00 35.95 39.46 2d2n h PHE 59 CO -0.49 -0.56 0.58 1.15 -2.23 0.00 0.00 178.31 176.76 2d2n h THR 60 N -1.18 0.79 -0.43 4.41 2.02 -1.34 0.66 112.91 117.84 2d2n h THR 60 Ca -0.10 -0.22 0.13 0.00 0.77 0.00 0.00 66.41 66.98 2d2n h THR 60 Cb 0.78 0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 2d2n h THR 60 CO 0.17 0.12 0.32 0.00 0.37 0.00 0.00 175.52 176.49 2d2n h ALA 61 N 1.60 2.39 0.13 6.16 0.00 -1.07 -2.32 119.26 126.15 2d2n h ALA 61 Ca 0.47 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.36 2d2n h ALA 61 Cb 0.82 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2d2n h ALA 61 CO -0.22 -0.54 -0.06 1.25 0.00 0.00 0.00 179.25 179.68 2d2n h HIS 62 N 0.00 -0.16 -1.14 0.00 6.17 0.38 -3.19 115.15 117.22 2d2n h HIS 62 Ca 0.21 -0.00 0.44 0.00 0.71 0.00 0.00 60.37 61.72 2d2n h HIS 62 Cb 0.84 0.05 -0.16 0.00 2.52 0.00 0.00 27.41 30.66 2d2n h HIS 62 CO 0.00 -0.10 0.68 0.00 0.71 0.00 0.00 177.93 179.22 2d2n h LEU 64 N 0.00 -0.49 -1.11 0.00 3.38 -1.52 -0.32 115.31 115.25 2d2n h LEU 64 Ca 0.85 0.02 0.38 0.00 0.09 0.00 0.00 57.88 59.22 2d2n h LEU 64 Cb 2.46 0.13 -0.11 0.00 0.09 0.00 0.00 40.66 43.23 2d2n h LEU 64 CO -0.63 -0.33 0.72 0.54 0.09 0.00 0.00 178.44 178.83 2d2n n ARG 65 N -3.68 -0.03 0.01 1.13 1.74 0.11 0.23 116.66 116.16 2d2n n ARG 65 Ca -0.07 0.99 -0.01 0.00 -0.77 0.00 0.00 57.85 57.99 2d2n n ARG 65 Cb 0.23 -1.96 -0.01 0.00 -1.02 0.00 0.00 32.46 29.70 2d2n n ARG 65 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2d2n h VAL 66 N 0.00 0.00 0.00 1.55 2.07 -1.02 0.72 116.25 119.57 2d2n h VAL 66 Ca 0.70 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.83 2d2n h VAL 66 Cb 2.28 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 32.05 2d2n h VAL 66 CO -0.36 0.00 0.24 0.71 0.02 0.00 0.00 177.57 178.18 2d2n h THR 67 N -0.46 0.00 0.16 2.57 1.35 0.70 2.24 112.91 119.47 2d2n h THR 67 Ca -0.01 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.84 2d2n h THR 67 Cb 0.06 0.73 0.00 0.00 -1.73 0.00 0.00 68.15 67.21 2d2n h THR 67 CO 0.01 0.00 -0.08 1.23 -0.25 0.00 0.00 175.52 176.43 2d2n h GLY 68 N 0.00 -0.23 0.64 5.82 0.00 0.28 -2.38 103.07 107.20 2d2n h GLY 68 Ca 0.00 0.08 0.06 0.00 0.00 0.00 0.00 47.33 47.48 2d2n h GLY 68 CO 0.00 -0.08 0.32 0.00 0.00 0.00 0.00 176.54 176.78 2d2n h ALA 69 N -1.24 0.82 -0.22 3.60 0.00 0.20 1.08 119.26 123.50 2d2n h ALA 69 Ca -0.02 0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.98 2d2n h ALA 69 Cb 0.17 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2d2n h ALA 69 CO 0.04 -0.03 0.48 1.25 0.00 0.00 0.00 179.25 180.99 2d2n h LEU 70 N 0.59 0.00 0.00 0.00 6.46 0.36 0.13 115.31 122.85 2d2n h LEU 70 Ca 0.28 0.00 -0.09 0.00 -0.12 0.00 0.00 57.88 57.95 2d2n h LEU 70 Cb 0.21 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.13 2d2n h LEU 70 CO -0.20 0.00 -0.57 -1.13 -0.62 0.00 0.00 178.44 175.92 2d2n h ASN 71 N 0.00 0.00 0.00 1.25 -0.00 0.17 -3.19 115.58 113.81 2d2n h ASN 71 Ca 0.10 -0.56 0.00 0.00 -0.00 0.00 0.00 56.30 55.84 2d2n h ASN 71 Cb 1.07 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.39 2d2n h ASN 71 CO -0.00 1.11 0.00 -2.11 -0.00 0.00 0.00 177.43 176.43 2d2n n ARG 72 N -4.56 0.00 -0.08 6.67 1.85 0.40 -1.85 116.66 119.09 2d2n n ARG 72 Ca -0.17 0.00 -0.18 0.00 -1.00 0.00 0.00 57.85 56.50 2d2n n ARG 72 Cb 0.48 -1.42 -0.06 0.00 -1.05 0.00 0.00 32.46 30.41 2d2n n ARG 72 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 2d2n n LEU 73 N -0.85 1.22 0.18 2.89 4.32 -0.90 -4.15 117.00 119.71 2d2n n LEU 73 Ca 0.00 0.21 0.08 0.00 -0.02 0.00 0.00 56.01 56.28 2d2n n LEU 73 Cb 0.00 -0.50 0.60 0.00 -1.62 0.00 0.00 43.42 41.90 2d2n n LEU 73 CO 0.00 0.31 1.10 0.40 -1.22 0.00 0.00 177.39 177.98 2d2n h ILE 74 N -0.61 0.99 -0.20 -0.08 2.04 -1.35 -0.40 117.51 117.90 2d2n h ILE 74 Ca -0.41 -0.04 -0.17 0.00 1.00 0.00 0.00 64.86 65.24 2d2n h ILE 74 Cb 1.34 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 38.29 2d2n h ILE 74 CO -0.25 0.02 -0.56 0.77 0.00 0.00 0.00 178.15 178.14 2d2n h SER 75 N 0.11 0.67 -0.01 1.72 4.64 -1.72 -2.98 113.55 115.98 2d2n h SER 75 Ca 0.06 -0.36 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 2d2n h SER 75 Cb 0.09 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 61.99 2d2n h SER 75 CO -0.01 1.09 0.00 1.67 -0.87 0.00 0.00 176.83 178.71 2d2n n GLN 76 N -3.96 1.39 -0.24 4.77 -0.06 -0.33 -4.37 117.38 114.57 2d2n n GLN 76 Ca -0.03 -0.57 0.26 0.00 -2.00 0.00 0.00 57.00 54.66 2d2n n GLN 76 Cb 0.61 -1.49 0.64 0.00 -4.06 0.00 0.00 30.24 25.95 2d2n n GLN 76 CO 0.00 0.00 0.00 -0.07 -0.20 0.00 0.00 177.06 176.79 2d2n h LEU 77 N 1.39 0.17 -0.08 1.69 3.38 -0.98 0.15 115.31 121.03 2d2n h LEU 77 Ca 0.00 0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.85 2d2n h LEU 77 Cb 0.29 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2d2n h LEU 77 CO 0.00 0.05 -0.70 -2.24 0.09 0.00 0.00 178.44 175.65 2d2n h ASP 78 N 0.16 0.00 -1.34 -0.43 2.03 -1.83 -3.40 116.42 111.61 2d2n h ASP 78 Ca 0.49 0.00 -0.67 0.00 -0.73 0.00 0.00 57.03 56.12 2d2n h ASP 78 Cb 1.63 0.00 -0.11 0.00 -0.83 0.00 0.00 39.33 40.02 2d2n h ASP 78 CO -0.10 0.70 1.69 -1.10 -1.03 0.00 0.00 179.24 179.40 2d2n s GLN 79 N -2.92 3.84 0.15 4.15 -1.52 0.51 -4.89 119.66 118.99 2d2n s GLN 79 Ca 0.02 -1.81 -0.26 0.00 -1.95 0.00 0.00 55.36 51.36 2d2n s GLN 79 Cb 0.09 -5.33 0.00 0.00 -0.22 0.00 0.00 33.01 27.55 2d2n s GLN 79 CO 0.77 -2.10 1.59 1.96 -0.25 0.00 0.00 175.29 177.26 2d2n h GLN 80 N 8.31 -0.34 -0.73 2.91 1.08 -1.78 0.48 115.11 125.04 2d2n h GLN 80 Ca 0.32 0.02 -0.04 0.00 -1.45 0.00 0.00 58.65 57.50 2d2n h GLN 80 Cb 0.93 0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 28.40 2d2n h GLN 80 CO 1.37 -0.23 0.30 0.00 -0.95 0.00 0.00 178.83 179.33 2d2n h ALA 81 N 0.46 1.15 -0.07 3.87 0.00 -1.94 -2.30 119.26 120.43 2d2n h ALA 81 Ca 0.13 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 2d2n h ALA 81 Cb 0.58 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2d2n h ALA 81 CO -0.49 0.62 -0.20 1.15 0.00 0.00 0.00 179.25 180.32 2d2n h THR 82 N 1.06 1.43 0.00 0.00 2.02 -1.79 -3.03 112.91 112.60 2d2n h THR 82 Ca 0.25 -1.58 -0.08 0.00 0.77 0.00 0.00 66.41 65.77 2d2n h THR 82 Cb 0.18 2.29 -0.01 0.00 -1.74 0.00 0.00 68.15 68.88 2d2n h THR 82 CO -0.02 0.45 -0.36 -0.29 0.37 0.00 0.00 175.52 175.66 2d2n h ILE 83 N -0.25 0.96 -0.08 3.11 2.10 -0.93 -0.07 117.51 122.35 2d2n h ILE 83 Ca -0.01 -1.39 -0.02 0.00 1.08 0.00 0.00 64.86 64.53 2d2n h ILE 83 Cb 0.83 1.82 -0.00 0.00 -1.09 0.00 0.00 36.82 38.37 2d2n h ILE 83 CO 0.04 0.35 -0.02 0.78 -1.08 0.00 0.00 178.15 178.23 2d2n h ASN 84 N 0.00 0.16 0.33 2.19 4.21 -1.47 0.51 115.58 121.51 2d2n h ASN 84 Ca -0.00 -0.37 -0.01 0.00 1.21 0.00 0.00 56.30 57.12 2d2n h ASN 84 Cb 0.79 -0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 37.94 2d2n h ASN 84 CO 0.05 0.49 -0.26 0.00 -1.29 0.00 0.00 177.43 176.42 2d2n h ALA 85 N 0.67 -1.02 -0.84 -0.83 0.00 -1.37 0.34 119.26 116.20 2d2n h ALA 85 Ca 0.02 -0.11 0.19 0.00 0.00 0.00 0.00 54.91 55.00 2d2n h ALA 85 Cb 0.43 0.44 -0.16 0.00 0.00 0.00 0.00 17.79 18.50 2d2n h ALA 85 CO 0.01 -1.02 -0.10 0.22 0.00 0.00 0.00 179.25 178.36 2d2n h ASP 86 N -0.57 -0.59 -0.79 0.00 -0.00 -1.01 0.49 116.42 113.94 2d2n h ASP 86 Ca -0.04 0.24 0.04 0.00 -0.00 0.00 0.00 57.03 57.27 2d2n h ASP 86 Cb 0.48 0.46 -0.05 0.00 -0.00 0.00 0.00 39.33 40.22 2d2n h ASP 86 CO 0.01 -0.26 0.52 -0.07 -0.00 0.00 0.00 179.24 179.44 2d2n h LEU 87 N 0.03 0.81 -0.12 2.28 3.38 0.99 -1.26 115.31 121.42 2d2n h LEU 87 Ca 0.44 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.39 2d2n h LEU 87 Cb 0.76 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 2d2n h LEU 87 CO -0.81 0.55 0.01 0.00 0.09 0.00 0.00 178.44 178.27 2d2n h ALA 88 N 1.55 0.16 -0.63 1.53 0.00 0.39 -1.04 119.26 121.21 2d2n h ALA 88 Ca 0.32 -0.17 0.12 0.00 0.00 0.00 0.00 54.91 55.18 2d2n h ALA 88 Cb 0.10 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 17.76 2d2n h ALA 88 CO -0.10 -0.17 0.12 1.25 0.00 0.00 0.00 179.25 180.36 2d2n h HIS 89 N -0.05 0.19 -0.58 0.00 -0.00 -0.44 -1.25 115.15 113.02 2d2n h HIS 89 Ca 0.03 0.04 -0.01 0.00 -0.00 0.00 0.00 60.37 60.43 2d2n h HIS 89 Cb 0.33 0.01 -0.03 0.00 -0.00 0.00 0.00 27.41 27.73 2d2n h HIS 89 CO 0.03 -0.06 0.31 -0.07 -0.00 0.00 0.00 177.93 178.13 2d2n h LEU 90 N 0.25 0.74 -0.31 0.26 3.38 -0.96 -3.13 115.31 115.52 2d2n h LEU 90 Ca 0.34 -0.10 0.06 0.00 0.09 0.00 0.00 57.88 58.27 2d2n h LEU 90 Cb 0.53 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.03 2d2n h LEU 90 CO -0.44 0.63 -0.06 0.00 0.09 0.00 0.00 178.44 178.66 2d2n h ALA 91 N 1.14 0.22 0.00 1.53 0.00 0.03 -0.39 119.26 121.79 2d2n h ALA 91 Ca 0.20 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2d2n h ALA 91 Cb 0.07 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2d2n h ALA 91 CO -0.03 -0.45 0.00 0.41 0.00 0.00 0.00 179.25 179.18 2d2n n GLY 92 N -1.25 0.89 0.17 0.00 0.00 -1.07 -0.67 105.19 103.25 2d2n n GLY 92 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 2d2n n GLY 92 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2d2n n GLN 93 N 0.07 -0.05 -0.02 1.61 6.02 -0.16 -4.30 117.38 120.55 2d2n n GLN 93 Ca 0.00 -0.85 0.01 0.00 -0.01 0.00 0.00 57.00 56.15 2d2n n GLN 93 Cb 0.16 -1.08 0.01 0.00 1.02 0.00 0.00 30.24 30.35 2d2n n GLN 93 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2d2n n HIS 94 N 0.19 0.00 0.01 1.08 8.25 0.15 -4.75 115.22 120.15 2d2n n HIS 94 Ca 0.03 -0.41 -0.17 0.00 -0.26 0.00 0.00 57.72 56.91 2d2n n HIS 94 Cb 0.13 -0.05 -0.06 0.00 1.12 0.00 0.00 29.99 31.13 2d2n n HIS 94 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2d2n h ALA 95 N 0.00 0.32 0.06 -1.41 0.00 -1.69 -3.36 119.26 113.17 2d2n h ALA 95 Ca 0.00 -0.63 -0.00 0.00 0.00 0.00 0.00 54.91 54.28 2d2n h ALA 95 Cb 0.69 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2d2n h ALA 95 CO 0.00 0.71 -0.03 0.66 0.00 0.00 0.00 179.25 180.59 2d2n h SER 96 N 0.46 -0.07 -2.46 0.00 4.64 -1.87 -3.42 113.55 110.82 2d2n h SER 96 Ca -0.07 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.72 2d2n h SER 96 Cb 1.46 0.02 0.04 0.00 -0.31 0.00 0.00 62.40 63.61 2d2n h SER 96 CO 0.16 -0.04 1.07 0.54 -0.87 0.00 0.00 176.83 177.69 2d2n n ARG 97 N -2.23 2.69 -2.14 4.77 3.00 -1.26 -4.88 116.66 116.61 2d2n n ARG 97 Ca -0.01 0.98 -0.43 0.00 -0.01 0.00 0.00 57.85 58.38 2d2n n ARG 97 Cb 0.03 -2.85 -0.02 0.00 0.00 0.00 0.00 32.46 29.61 2d2n n ARG 97 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 2d2n s ASN 98 N 2.42 6.49 -0.08 0.55 0.01 -1.26 -4.94 114.94 118.12 2d2n s ASN 98 Ca 0.81 1.70 0.03 0.00 -0.71 0.00 0.00 52.86 54.69 2d2n s ASN 98 Cb -0.52 -2.53 0.01 0.00 0.41 0.00 0.00 41.25 38.62 2d2n s ASN 98 CO 0.38 -1.15 -0.18 -0.76 -1.51 0.00 0.00 177.10 173.87 2d2n s LEU 99 N 4.83 1.86 0.72 0.60 1.43 -1.26 -5.14 118.68 121.73 2d2n s LEU 99 Ca 0.69 -0.41 -0.02 0.00 -1.03 0.00 0.00 54.13 53.36 2d2n s LEU 99 Cb -0.25 -1.09 0.12 0.00 0.03 0.00 0.00 46.19 45.00 2d2n s LEU 99 CO 0.28 0.10 0.99 1.51 0.23 0.00 0.00 176.35 179.46 2d2n s ASP 100 N 0.45 4.38 -0.01 2.29 1.47 -1.26 -4.97 116.67 119.03 2d2n s ASP 100 Ca -0.15 -0.24 0.05 0.00 1.18 0.00 0.00 52.55 53.39 2d2n s ASP 100 Cb -0.16 -0.18 0.15 0.00 -0.34 0.00 0.00 42.92 42.38 2d2n s ASP 100 CO 0.06 -1.83 1.08 0.00 0.68 0.00 0.00 175.17 175.15 2d2n n ALA 101 N -2.85 2.51 0.94 2.11 0.00 -1.26 -3.00 120.51 118.96 2d2n n ALA 101 Ca 0.14 -0.30 0.10 0.00 0.00 0.00 0.00 53.44 53.38 2d2n n ALA 101 Cb 0.60 -0.99 -0.08 0.00 0.00 0.00 0.00 19.45 18.99 2d2n n ALA 101 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2d2n n SER 102 N -0.01 1.29 -0.09 0.00 3.41 -1.26 -3.61 113.62 113.34 2d2n n SER 102 Ca 0.05 -1.14 -0.19 0.00 -0.26 0.00 0.00 58.87 57.33 2d2n n SER 102 Cb 0.17 0.82 -0.11 0.00 -0.26 0.00 0.00 64.21 64.83 2d2n n SER 102 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2d2n h ASN 103 N 0.79 0.00 -0.67 4.04 2.35 -1.93 -2.95 115.58 117.22 2d2n h ASN 103 Ca 0.00 -0.59 0.00 0.00 -0.55 0.00 0.00 56.30 55.16 2d2n h ASN 103 Cb 0.55 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.89 2d2n h ASN 103 CO 0.00 1.31 0.43 -0.26 -1.65 0.00 0.00 177.43 177.27 2d2n h PHE 104 N -1.00 0.85 0.00 1.19 -1.00 -1.76 0.93 116.94 116.16 2d2n h PHE 104 Ca -0.24 0.01 -0.00 0.00 2.81 0.00 0.00 57.97 60.55 2d2n h PHE 104 Cb 1.16 -0.29 -0.00 0.00 3.61 0.00 0.00 35.95 40.44 2d2n h PHE 104 CO 0.12 0.55 -0.02 0.00 -1.61 0.00 0.00 178.31 177.36 2d2n h ALA 105 N 1.23 1.02 0.15 2.45 0.00 -1.72 -1.55 119.26 120.85 2d2n h ALA 105 Ca 0.24 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.84 2d2n h ALA 105 Cb -0.08 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.71 2d2n h ALA 105 CO -0.05 0.02 -1.48 0.00 0.00 0.00 0.00 179.25 177.74 2d2n h ALA 106 N 1.98 0.11 0.52 0.00 0.00 -0.57 -3.25 119.26 118.05 2d2n h ALA 106 Ca -0.00 -1.05 -0.01 0.00 0.00 0.00 0.00 54.91 53.85 2d2n h ALA 106 Cb 0.34 0.41 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2d2n h ALA 106 CO 0.00 0.84 -0.42 1.98 0.00 0.00 0.00 179.25 181.64 2d2n h MET 107 N -0.13 -0.89 0.00 0.00 -1.53 0.13 0.68 114.93 113.18 2d2n h MET 107 Ca -0.30 0.06 0.00 0.00 -3.44 0.00 0.00 59.70 56.02 2d2n h MET 107 Cb 1.90 0.20 0.00 0.00 -0.55 0.00 0.00 31.60 33.15 2d2n h MET 107 CO 0.13 -0.60 0.00 0.41 0.14 0.00 0.00 176.91 176.99 2d2n n GLY 108 N -1.53 -0.29 0.13 1.39 0.00 -0.63 0.26 105.19 104.53 2d2n n GLY 108 Ca -0.12 -0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.70 2d2n n GLY 108 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2d2n n GLN 109 N -1.27 0.74 -0.10 1.61 6.02 0.07 -2.69 117.38 121.76 2d2n n GLN 109 Ca 0.00 0.25 -0.10 0.00 -0.01 0.00 0.00 57.00 57.15 2d2n n GLN 109 Cb 0.00 -1.70 -0.03 0.00 1.02 0.00 0.00 30.24 29.53 2d2n n GLN 109 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2d2n h ALA 110 N 0.16 0.40 0.49 -1.58 0.00 0.14 -2.71 119.26 116.16 2d2n h ALA 110 Ca -0.42 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.31 2d2n h ALA 110 Cb 2.03 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.70 2d2n h ALA 110 CO 0.08 0.03 -0.25 0.28 0.00 0.00 0.00 179.25 179.39 2d2n h VAL 111 N 0.33 0.49 0.00 0.00 2.07 -1.10 -2.40 116.25 115.64 2d2n h VAL 111 Ca 0.10 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.62 2d2n h VAL 111 Cb 0.25 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 2d2n h VAL 111 CO -0.00 0.00 0.00 0.23 0.02 0.00 0.00 177.57 177.82 2d2n n MET 112 N -5.39 0.48 -0.02 1.57 2.00 -1.10 -1.66 117.12 113.01 2d2n n MET 112 Ca -0.12 0.00 0.02 0.00 0.00 0.00 0.00 57.70 57.60 2d2n n MET 112 Cb 0.29 -1.22 -0.07 0.00 0.00 0.00 0.00 33.22 32.21 2d2n n MET 112 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 2d2n n SER 113 N -0.72 2.87 -0.01 7.83 3.41 -1.03 -4.50 113.62 121.47 2d2n n SER 113 Ca 0.05 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.65 2d2n n SER 113 Cb 0.02 1.22 -0.01 0.00 -0.26 0.00 0.00 64.21 65.18 2d2n n SER 113 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2d2n h VAL 114 N 0.00 0.00 -0.24 -3.33 2.07 -0.82 -3.40 116.25 110.52 2d2n h VAL 114 Ca -0.07 -0.87 0.03 0.00 0.82 0.00 0.00 66.70 66.61 2d2n h VAL 114 Cb 0.75 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.46 2d2n h VAL 114 CO 0.00 0.00 -0.43 0.58 0.02 0.00 0.00 177.57 177.74 2d2n h VAL 115 N -0.96 0.00 -0.10 2.57 2.07 -1.74 -2.86 116.25 115.23 2d2n h VAL 115 Ca -0.01 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.54 2d2n h VAL 115 Cb 0.07 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 29.84 2d2n h VAL 115 CO 0.02 0.00 0.27 1.55 0.02 0.00 0.00 177.57 179.43 2d2n h PRO 116 N -0.36 0.00 -0.03 1.57 0.13 -1.81 -0.21 132.00 131.29 2d2n h PRO 116 Ca 0.04 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.07 2d2n h PRO 116 Cb 0.49 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.61 2d2n h PRO 116 CO -0.42 0.00 -0.48 1.79 -0.23 0.00 0.00 178.00 178.65 2d2n h THR 117 N 0.00 1.35 -0.03 1.56 1.35 -1.72 -2.97 112.91 112.45 2d2n h THR 117 Ca 0.05 -1.68 0.00 0.00 -0.55 0.00 0.00 66.41 64.23 2d2n h THR 117 Cb 0.59 1.87 0.00 0.00 -1.73 0.00 0.00 68.15 68.88 2d2n h THR 117 CO -0.00 0.48 0.00 1.41 -0.25 0.00 0.00 175.52 177.16 2d2n n HIS 118 N -3.96 0.03 -4.43 4.73 8.25 -0.09 -4.92 115.22 114.83 2d2n n HIS 118 Ca -0.02 -0.02 -0.21 0.00 -0.26 0.00 0.00 57.72 57.22 2d2n n HIS 118 Cb 0.51 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.52 2d2n n HIS 118 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2d2n s LEU 119 N -1.77 2.40 -0.05 2.41 1.43 -1.13 -4.75 118.68 117.23 2d2n s LEU 119 Ca 0.36 -1.24 0.08 0.00 -1.03 0.00 0.00 54.13 52.30 2d2n s LEU 119 Cb 0.17 -0.55 -0.24 0.00 0.03 0.00 0.00 46.19 45.60 2d2n s LEU 119 CO 0.29 -0.42 0.62 0.44 0.23 0.00 0.00 176.35 177.51 2d2n h ASP 120 N 2.24 0.09 -3.58 2.29 3.32 -1.91 -3.47 116.42 115.40 2d2n h ASP 120 Ca -0.40 -0.20 -0.35 0.00 0.02 0.00 0.00 57.03 56.09 2d2n h ASP 120 Cb 1.23 -0.03 -0.33 0.00 0.22 0.00 0.00 39.33 40.43 2d2n h ASP 120 CO 0.68 1.18 -0.75 0.00 -1.72 0.00 0.00 179.24 178.63 2d2n s PHE 122 N 0.70 -0.84 -0.66 0.00 5.36 -1.26 -4.96 117.98 116.31 2d2n s PHE 122 Ca -0.08 1.61 -0.23 0.00 -0.96 0.00 0.00 56.93 57.27 2d2n s PHE 122 Cb -0.11 0.38 0.07 0.00 -0.34 0.00 0.00 43.02 43.01 2d2n s PHE 122 CO -0.01 -0.48 0.98 -0.80 -1.46 0.00 0.00 175.22 173.46 2d2n s ASN 123 N 2.33 6.18 0.00 6.13 -0.87 -1.26 -4.98 114.94 122.47 2d2n s ASN 123 Ca -0.04 -0.93 0.00 0.00 -1.57 0.00 0.00 52.86 50.32 2d2n s ASN 123 Cb -0.11 -2.43 0.00 0.00 -0.02 0.00 0.00 41.25 38.69 2d2n s ASN 123 CO -0.14 -1.46 0.78 1.67 -2.57 0.00 0.00 177.10 175.38 2d2n n GLN 124 N 7.81 0.00 0.00 -0.60 -0.06 -1.26 -1.92 117.38 121.35 2d2n n GLN 124 Ca -0.03 0.78 0.00 0.00 -2.00 0.00 0.00 57.00 55.75 2d2n n GLN 124 Cb 0.46 -1.24 0.00 0.00 -4.06 0.00 0.00 30.24 25.39 2d2n n GLN 124 CO 0.00 0.00 0.00 1.58 -0.20 0.00 0.00 177.06 178.44 2d2n n HIS 125 N -2.30 0.00 -0.30 3.69 -0.00 -1.26 -1.31 115.22 113.74 2d2n n HIS 125 Ca 0.00 0.00 0.25 0.00 0.46 0.00 0.00 57.72 58.43 2d2n n HIS 125 Cb 0.00 -0.34 0.42 0.00 -0.12 0.00 0.00 29.99 29.95 2d2n n HIS 125 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2d2n n ALA 126 N -2.05 0.86 -0.03 1.57 0.00 -1.15 0.22 120.51 119.94 2d2n n ALA 126 Ca 0.00 0.52 -0.12 0.00 0.00 0.00 0.00 53.44 53.84 2d2n n ALA 126 Cb 0.00 -0.65 -0.10 0.00 0.00 0.00 0.00 19.45 18.70 2d2n n ALA 126 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 2d2n h TRP 127 N 0.00 -0.04 -0.68 0.00 4.06 -0.50 -3.17 115.95 115.63 2d2n h TRP 127 Ca 0.54 -0.00 0.14 0.00 2.06 0.00 0.00 58.89 61.63 2d2n h TRP 127 Cb 1.78 0.01 -0.13 0.00 -1.00 0.00 0.00 29.16 29.82 2d2n h TRP 127 CO -0.00 0.65 -0.15 0.78 -3.56 0.00 0.00 178.44 176.15 2d2n h GLY 128 N -0.86 0.52 0.04 1.49 0.00 0.38 0.50 103.07 105.13 2d2n h GLY 128 Ca -0.00 0.21 0.03 0.00 0.00 0.00 0.00 47.33 47.57 2d2n h GLY 128 CO 0.01 -0.26 -0.45 -2.09 0.00 0.00 0.00 176.54 173.75 2d2n h GLU 129 N 0.01 -0.54 -0.42 4.80 4.57 -1.44 0.21 114.58 121.78 2d2n h GLU 129 Ca 0.33 0.04 -0.10 0.00 -1.18 0.00 0.00 59.36 58.45 2d2n h GLU 129 Cb 0.51 0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.21 2d2n h GLU 129 CO -0.69 -0.36 -0.15 0.00 -1.18 0.00 0.00 179.01 176.63 2d2n h TYR 131 N 0.69 0.71 0.30 0.00 3.20 0.48 -0.53 116.97 121.82 2d2n h TYR 131 Ca 0.11 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 2d2n h TYR 131 Cb 0.63 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.67 2d2n h TYR 131 CO 0.03 0.47 -0.14 1.49 -1.64 0.00 0.00 178.16 178.37 2d2n h GLU 132 N 0.75 -0.38 -0.40 1.82 4.57 0.38 0.39 114.58 121.72 2d2n h GLU 132 Ca 0.20 0.03 0.12 0.00 -1.18 0.00 0.00 59.36 58.52 2d2n h GLU 132 Cb -0.04 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.62 2d2n h GLU 132 CO -0.04 -0.26 1.05 -0.09 -1.18 0.00 0.00 179.01 178.49 2d2n h ARG 133 N -0.42 0.00 0.00 1.92 1.12 0.33 0.70 114.38 118.04 2d2n h ARG 133 Ca -0.04 0.00 -0.36 0.00 -1.11 0.00 0.00 59.98 58.46 2d2n h ARG 133 Cb 0.31 0.00 -0.05 0.00 -0.01 0.00 0.00 29.97 30.21 2d2n h ARG 133 CO 0.07 0.00 -2.00 -0.89 -3.11 0.00 0.00 179.97 174.03 2d2n n ILE 134 N -2.82 1.54 -0.09 1.20 5.41 -0.25 -4.02 119.36 120.33 2d2n n ILE 134 Ca 0.09 -0.26 -0.07 0.00 1.00 0.00 0.00 62.75 63.51 2d2n n ILE 134 Cb 1.17 -1.92 -0.01 0.00 -0.71 0.00 0.00 39.64 38.17 2d2n n ILE 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2d2n h ALA 135 N -0.71 -0.08 -2.28 -1.39 0.00 0.47 -2.41 119.26 112.87 2d2n h ALA 135 Ca -0.55 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2d2n h ALA 135 Cb 1.52 0.57 0.00 0.00 0.00 0.00 0.00 17.79 19.88 2d2n h ALA 135 CO -0.31 -0.66 0.00 0.43 0.00 0.00 0.00 179.25 178.72 2d2n n SER 136 N -5.40 0.00 -0.49 0.00 7.64 -0.25 -0.87 113.62 114.26 2d2n n SER 136 Ca 0.01 0.62 0.38 0.00 1.01 0.00 0.00 58.87 60.89 2d2n n SER 136 Cb 0.31 -0.12 0.61 0.00 -1.01 0.00 0.00 64.21 64.00 2d2n n SER 136 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d2n n GLY 137 N -0.92 -0.74 0.06 0.23 0.00 -1.08 0.13 105.19 102.87 2d2n n GLY 137 Ca 0.00 0.57 0.12 0.00 0.00 0.00 0.00 46.02 46.71 2d2n n GLY 137 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2d2n n ILE 138 N -3.83 0.32 0.00 -0.61 5.41 -0.05 -4.31 119.36 116.29 2d2n n ILE 138 Ca 0.34 -0.25 0.00 0.00 1.00 0.00 0.00 62.75 63.84 2d2n n ILE 138 Cb 1.46 -0.11 0.00 0.00 -0.71 0.00 0.00 39.64 40.28 2d2n n ILE 138 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 2d2n n SER 139 N -2.05 0.00 0.00 4.38 3.41 0.36 -4.22 113.62 115.49 2d2n n SER 139 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 2d2n n SER 139 Cb 0.43 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.35 2d2n n SER 139 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49