#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eim n SER 2 N 0.00 0.44 0.00 0.00 2.88 -1.26 -5.10 113.62 110.58 2eim n SER 2 Ca 0.00 -0.96 0.00 0.00 -1.33 0.00 0.00 58.87 56.58 2eim n SER 2 Cb 0.00 0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.48 2eim n SER 2 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2eim n ALA 3 N -0.02 0.00 0.00 -1.46 0.00 -1.26 -4.43 120.51 113.34 2eim n ALA 3 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2eim n ALA 3 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.58 2eim n ALA 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2eim n ALA 4 N 1.55 0.00 -1.92 0.00 0.00 -1.26 -5.13 120.51 113.76 2eim n ALA 4 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2eim n ALA 4 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2eim n ALA 4 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2eim n LYS 5 N 0.00 0.00 0.00 0.00 5.02 -1.26 -5.14 118.16 116.78 2eim n LYS 5 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2eim n LYS 5 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2eim n LYS 5 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2eim n GLY 6 N 4.54 -1.14 0.00 0.72 0.00 -1.26 -5.13 105.19 102.91 2eim n GLY 6 Ca 0.00 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.49 2eim n GLY 6 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2eim n ASP 7 N 0.00 0.00 0.00 1.61 -0.08 -1.26 -4.75 116.55 112.07 2eim n ASP 7 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2eim n ASP 7 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2eim n ASP 7 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 2eim n HIS 8 N 0.00 0.00 0.32 -0.67 8.25 -1.26 -4.66 115.22 117.20 2eim n HIS 8 Ca 0.00 0.00 0.19 0.00 -0.26 0.00 0.00 57.72 57.65 2eim n HIS 8 Cb 0.00 -0.61 1.01 0.00 1.12 0.00 0.00 29.99 31.51 2eim n HIS 8 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2eim h GLY 9 N 0.00 0.00 0.00 -1.41 0.00 -2.08 -3.51 103.07 96.07 2eim h GLY 9 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2eim h GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 2eim n GLY 10 N -1.19 -0.93 0.00 4.60 0.00 -1.26 -5.31 105.19 101.10 2eim n GLY 10 Ca -0.02 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.18 2eim n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eim n GLY 12 N 0.00 0.08 0.34 -0.02 0.00 -1.26 -4.93 105.19 99.40 2eim n GLY 12 Ca 0.00 -1.75 0.04 0.00 0.00 0.00 0.00 46.02 44.31 2eim n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2eim h ALA 13 N 0.00 1.36 -0.79 4.61 0.00 -2.05 -2.15 119.26 120.24 2eim h ALA 13 Ca 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2eim h ALA 13 Cb 0.00 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 2eim h ALA 13 CO 0.00 0.23 0.41 -0.09 0.00 0.00 0.00 179.25 179.81 2eim h ARG 14 N 0.97 1.10 -0.10 0.00 2.43 -1.99 -2.17 114.38 114.61 2eim h ARG 14 Ca 0.44 -0.13 -0.01 0.00 -0.81 0.00 0.00 59.98 59.47 2eim h ARG 14 Cb 0.36 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 2eim h ARG 14 CO -0.23 0.82 0.01 1.15 -1.51 0.00 0.00 179.97 180.20 2eim h THR 15 N 1.10 1.24 0.00 0.20 2.02 -1.76 -1.56 112.91 114.15 2eim h THR 15 Ca 0.28 -0.76 -0.02 0.00 0.77 0.00 0.00 66.41 66.68 2eim h THR 15 Cb 0.05 1.56 -0.00 0.00 -1.74 0.00 0.00 68.15 68.02 2eim h THR 15 CO -0.04 0.22 -0.07 -0.50 0.37 0.00 0.00 175.52 175.49 2eim h TRP 16 N -0.09 0.00 0.09 3.16 4.06 -1.28 0.12 115.95 122.00 2eim h TRP 16 Ca 0.03 0.00 -0.27 0.00 2.06 0.00 0.00 58.89 60.71 2eim h TRP 16 Cb 0.33 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.48 2eim h TRP 16 CO 0.03 0.07 -1.26 -0.09 -3.56 0.00 0.00 178.44 173.63 2eim h ARG 17 N 0.00 0.19 -0.90 0.49 2.43 -1.36 -0.34 114.38 114.90 2eim h ARG 17 Ca -0.00 -0.32 -0.01 0.00 -0.81 0.00 0.00 59.98 58.84 2eim h ARG 17 Cb 0.34 0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.97 2eim h ARG 17 CO 0.01 1.11 0.52 0.35 -1.51 0.00 0.00 179.97 180.45 2eim h PHE 18 N 0.05 1.20 -0.03 2.20 -0.00 0.15 -1.44 116.94 119.06 2eim h PHE 18 Ca -0.13 -0.01 -0.21 0.00 -0.00 0.00 0.00 57.97 57.62 2eim h PHE 18 Cb 1.93 -0.39 -0.00 0.00 -0.00 0.00 0.00 35.95 37.49 2eim h PHE 18 CO 0.04 0.81 -0.86 -0.07 -0.00 0.00 0.00 178.31 178.23 2eim h LEU 19 N 1.24 0.53 -0.75 0.59 3.38 -0.82 0.14 115.31 119.62 2eim h LEU 19 Ca 0.32 -0.39 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 2eim h LEU 19 Cb -0.03 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 2eim h LEU 19 CO -0.06 1.17 0.39 0.74 0.09 0.00 0.00 178.44 180.77 2eim h THR 20 N 0.26 1.23 0.00 0.22 2.02 -0.46 -0.69 112.91 115.48 2eim h THR 20 Ca -0.06 -0.62 -0.26 0.00 0.77 0.00 0.00 66.41 66.25 2eim h THR 20 Cb 1.47 0.27 -0.05 0.00 -1.74 0.00 0.00 68.15 68.11 2eim h THR 20 CO 0.15 0.27 -1.81 0.49 0.37 0.00 0.00 175.52 174.99 2eim n PHE 21 N -4.43 0.69 0.54 3.16 0.99 -0.60 -1.25 117.46 116.57 2eim n PHE 21 Ca 0.07 0.24 0.12 0.00 -0.00 0.00 0.00 57.45 57.88 2eim n PHE 21 Cb 0.11 -1.07 0.12 0.00 -1.00 0.00 0.00 39.48 37.64 2eim n PHE 21 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 2eim h GLY 22 N 3.72 0.00 0.00 1.37 0.00 -0.76 -3.40 103.07 104.00 2eim h GLY 22 Ca -0.30 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.03 2eim h GLY 22 CO 0.05 0.00 0.00 -0.10 0.00 0.00 0.00 176.54 176.49 2eim n LEU 23 N -2.10 0.05 0.04 3.11 7.94 -0.80 -4.82 117.00 120.42 2eim n LEU 23 Ca 0.03 0.32 -0.11 0.00 -1.11 0.00 0.00 56.01 55.14 2eim n LEU 23 Cb 0.44 0.20 -0.04 0.00 0.53 0.00 0.00 43.42 44.55 2eim n LEU 23 CO 0.38 -0.71 0.72 0.00 -1.11 0.00 0.00 177.39 176.67 2eim h ALA 24 N 0.00 -0.24 -0.35 1.96 0.00 -1.24 -2.24 119.26 117.15 2eim h ALA 24 Ca 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2eim h ALA 24 Cb 0.00 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2eim h ALA 24 CO 0.00 -0.69 0.08 -0.07 0.00 0.00 0.00 179.25 178.57 2eim h LEU 25 N -0.32 0.53 -2.09 0.00 3.38 -1.41 -2.32 115.31 113.09 2eim h LEU 25 Ca 0.07 -0.23 0.04 0.00 0.09 0.00 0.00 57.88 57.84 2eim h LEU 25 Cb 0.41 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2eim h LEU 25 CO -0.21 0.62 0.10 -0.65 0.09 0.00 0.00 178.44 178.39 2eim h PRO 26 N 0.40 0.00 -0.25 1.13 0.11 -1.75 0.10 132.00 131.74 2eim h PRO 26 Ca 0.11 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.07 2eim h PRO 26 Cb 0.30 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.41 2eim h PRO 26 CO 0.00 0.00 -0.46 0.77 -0.21 0.00 0.00 178.00 178.10 2eim h SER 27 N 0.00 0.70 1.00 -2.05 0.02 -1.01 -0.78 113.55 111.43 2eim h SER 27 Ca 0.06 -0.34 -0.06 0.00 -0.84 0.00 0.00 61.79 60.61 2eim h SER 27 Cb 0.26 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 2eim h SER 27 CO -0.00 1.05 -0.29 0.58 -1.14 0.00 0.00 176.83 177.03 2eim h VAL 28 N 0.52 0.65 0.32 2.27 2.07 -0.36 -1.76 116.25 119.97 2eim h VAL 28 Ca 0.03 -1.34 -0.02 0.00 0.82 0.00 0.00 66.70 66.19 2eim h VAL 28 Cb 1.00 1.89 0.00 0.00 -1.52 0.00 0.00 31.29 32.66 2eim h VAL 28 CO 0.09 0.28 -0.15 0.00 0.02 0.00 0.00 177.57 177.81 2eim h ALA 29 N 1.71 -0.43 -0.80 1.67 0.00 -0.33 -1.60 119.26 119.48 2eim h ALA 29 Ca -0.00 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.74 2eim h ALA 29 Cb 0.87 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.78 2eim h ALA 29 CO 0.04 -0.52 0.52 -0.07 0.00 0.00 0.00 179.25 179.21 2eim h LEU 30 N -0.88 0.86 -1.04 0.00 3.38 -1.13 0.19 115.31 116.70 2eim h LEU 30 Ca -0.04 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 2eim h LEU 30 Cb 0.52 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2eim h LEU 30 CO 0.07 0.60 -0.23 0.00 0.09 0.00 0.00 178.44 178.97 2eim h THR 32 N 0.00 1.44 0.31 0.00 2.02 -0.38 -2.41 112.91 113.88 2eim h THR 32 Ca -0.00 -2.25 0.00 0.00 0.77 0.00 0.00 66.41 64.93 2eim h THR 32 Cb 0.78 2.78 -0.02 0.00 -1.74 0.00 0.00 68.15 69.94 2eim h THR 32 CO 0.03 0.65 -0.34 0.25 0.37 0.00 0.00 175.52 176.49 2eim h LEU 33 N -0.13 -0.92 -0.15 2.58 7.12 -0.41 -1.60 115.31 121.80 2eim h LEU 33 Ca -0.11 0.08 0.04 0.00 0.13 0.00 0.00 57.88 58.03 2eim h LEU 33 Cb 1.47 0.32 -0.05 0.00 -0.53 0.00 0.00 40.66 41.87 2eim h LEU 33 CO 0.14 -0.47 -0.16 -1.13 -0.13 0.00 0.00 178.44 176.69 2eim h ASN 34 N -0.69 -0.51 0.15 1.25 -0.73 -0.98 -3.12 115.58 110.95 2eim h ASN 34 Ca -0.01 0.09 -0.00 0.00 1.87 0.00 0.00 56.30 58.25 2eim h ASN 34 Cb 0.63 0.24 -0.01 0.00 0.27 0.00 0.00 38.32 39.46 2eim h ASN 34 CO -0.08 -0.21 -0.11 0.28 -0.37 0.00 0.00 177.43 176.95 2eim h SER 35 N -0.19 -0.28 0.00 1.15 0.02 -1.26 -2.35 113.55 110.64 2eim h SER 35 Ca 0.10 0.02 -0.56 0.00 -0.84 0.00 0.00 61.79 60.52 2eim h SER 35 Cb 0.34 0.09 0.01 0.00 0.14 0.00 0.00 62.40 62.98 2eim h SER 35 CO -0.26 -0.18 2.86 0.79 -1.14 0.00 0.00 176.83 178.91 2eim n TRP 36 N -5.23 1.85 0.10 3.45 5.03 -0.62 -1.98 117.44 120.04 2eim n TRP 36 Ca -0.08 -2.72 0.00 0.00 3.03 0.00 0.00 57.50 57.73 2eim n TRP 36 Cb 0.15 -2.29 0.00 0.00 -1.03 0.00 0.00 31.31 28.14 2eim n TRP 36 CO 0.00 0.00 0.00 -0.11 -0.03 0.00 0.00 177.69 177.55 2eim n LEU 37 N 3.33 -1.81 -0.22 -0.99 7.94 -1.10 -4.87 117.00 119.28 2eim n LEU 37 Ca 0.70 0.40 0.09 0.00 -1.11 0.00 0.00 56.01 56.09 2eim n LEU 37 Cb 0.39 1.96 0.45 0.00 0.53 0.00 0.00 43.42 46.74 2eim n LEU 37 CO 0.69 -0.16 0.80 1.41 -1.11 0.00 0.00 177.39 179.01 2eim n HIS 38 N -2.92 0.09 0.00 1.96 8.25 -0.90 -4.71 115.22 116.99 2eim n HIS 38 Ca 0.00 -0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 2eim n HIS 38 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2eim n HIS 38 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2eim n SER 39 N -0.34 0.00 -1.73 0.41 3.41 -0.84 -5.03 113.62 109.51 2eim n SER 39 Ca 0.14 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 2eim n SER 39 Cb 0.16 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.11 2eim n SER 39 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2eim n GLY 40 N 1.45 -4.94 3.64 5.00 0.00 -1.26 -4.80 105.19 104.27 2eim n GLY 40 Ca 0.00 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 2eim n GLY 40 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2eim s HIS 41 N -1.85 1.24 0.08 1.61 3.76 -1.26 -4.97 115.29 113.91 2eim s HIS 41 Ca 0.00 -0.07 -0.27 0.00 -0.15 0.00 0.00 55.06 54.57 2eim s HIS 41 Cb 0.00 -4.12 -0.06 0.00 1.11 0.00 0.00 32.58 29.51 2eim s HIS 41 CO 0.00 -4.98 0.86 1.03 -0.85 0.00 0.00 174.74 170.80 2eim s ARG 42 N 5.19 4.60 -0.41 1.40 0.52 -1.26 -4.95 118.95 124.04 2eim s ARG 42 Ca 0.93 1.26 -0.35 0.00 -0.52 0.00 0.00 55.73 57.05 2eim s ARG 42 Cb -0.39 -3.37 -0.12 0.00 0.52 0.00 0.00 34.95 31.59 2eim s ARG 42 CO 0.39 0.25 2.23 -1.91 0.02 0.00 0.00 175.30 176.28 2eim n GLU 43 N 2.78 0.91 -1.69 3.54 0.00 -1.26 -4.88 120.64 120.05 2eim n GLU 43 Ca -0.00 0.23 -0.44 0.00 0.00 0.00 0.00 57.16 56.95 2eim n GLU 43 Cb 0.50 -2.38 -0.02 0.00 0.00 0.00 0.00 31.44 29.53 2eim n GLU 43 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.13 180.02 2eim n ARG 44 N 8.21 2.22 -1.28 5.31 1.85 -1.26 -4.96 116.66 126.75 2eim n ARG 44 Ca 0.44 0.79 -0.31 0.00 -1.00 0.00 0.00 57.85 57.77 2eim n ARG 44 Cb 0.21 -2.49 0.09 0.00 -1.05 0.00 0.00 32.46 29.23 2eim n ARG 44 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 2eim s PRO 45 N -0.34 2.24 0.31 2.89 0.04 -1.26 -4.98 135.00 133.90 2eim s PRO 45 Ca 0.68 1.22 -0.29 0.00 0.04 0.00 0.00 61.00 62.64 2eim s PRO 45 Cb -0.61 -1.89 -0.11 0.00 0.04 0.00 0.00 34.50 31.93 2eim s PRO 45 CO 0.48 -1.66 1.55 0.00 0.04 0.00 0.00 177.00 177.41 2eim s ALA 46 N -2.82 3.69 0.48 8.56 0.00 -1.26 -4.95 121.76 125.46 2eim s ALA 46 Ca 0.62 1.55 -0.22 0.00 0.00 0.00 0.00 51.96 53.92 2eim s ALA 46 Cb -0.18 -3.63 -0.07 0.00 0.00 0.00 0.00 23.12 19.24 2eim s ALA 46 CO 0.54 -0.98 1.13 0.12 0.00 0.00 0.00 175.76 176.57 2eim s PHE 47 N -0.29 2.88 -0.21 0.00 2.19 -1.26 -5.03 117.98 116.26 2eim s PHE 47 Ca 0.60 1.56 -0.05 0.00 0.33 0.00 0.00 56.93 59.36 2eim s PHE 47 Cb -0.47 -3.29 0.10 0.00 -1.31 0.00 0.00 43.02 38.05 2eim s PHE 47 CO 0.51 -1.35 0.40 0.42 1.83 0.00 0.00 175.22 177.04 2eim s ILE 48 N -1.67 -0.63 0.00 3.12 1.01 -1.26 -5.07 121.20 116.71 2eim s ILE 48 Ca 0.66 0.10 -0.01 0.00 0.00 0.00 0.00 60.65 61.39 2eim s ILE 48 Cb -0.25 -0.70 -0.07 0.00 0.01 0.00 0.00 42.46 41.45 2eim s ILE 48 CO 0.30 0.01 1.25 -2.65 0.00 0.00 0.00 174.94 173.86 2eim n PRO 49 N 5.38 0.49 -1.69 2.79 -0.02 -1.26 -4.92 135.00 135.78 2eim n PRO 49 Ca -0.07 -0.24 -0.43 0.00 -2.02 0.00 0.00 63.50 60.74 2eim n PRO 49 Cb 0.50 -1.61 -0.01 0.00 -0.02 0.00 0.00 33.50 32.35 2eim n PRO 49 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2eim n TYR 50 N 2.82 2.31 0.68 6.00 4.01 -1.26 -4.89 117.16 126.83 2eim n TYR 50 Ca 0.10 0.48 0.13 0.00 -0.16 0.00 0.00 57.90 58.45 2eim n TYR 50 Cb 0.23 -2.45 0.47 0.00 -0.31 0.00 0.00 39.34 37.27 2eim n TYR 50 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2eim n HIS 51 N 1.10 0.61 1.29 -0.72 8.25 -1.26 -3.12 115.22 121.37 2eim n HIS 51 Ca 0.08 0.19 0.13 0.00 -0.26 0.00 0.00 57.72 57.86 2eim n HIS 51 Cb 0.34 -0.81 0.40 0.00 1.12 0.00 0.00 29.99 31.05 2eim n HIS 51 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2eim n HIS 52 N -2.01 0.00 -4.23 4.41 1.44 -1.26 -4.88 115.22 108.69 2eim n HIS 52 Ca 0.05 0.00 -0.28 0.00 -2.01 0.00 0.00 57.72 55.48 2eim n HIS 52 Cb 0.36 -0.10 -0.05 0.00 0.12 0.00 0.00 29.99 30.32 2eim n HIS 52 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2eim s LEU 53 N -2.40 2.69 -1.59 2.39 1.43 -1.18 -4.77 118.68 115.24 2eim s LEU 53 Ca 0.27 -1.33 -0.06 0.00 -1.03 0.00 0.00 54.13 51.98 2eim s LEU 53 Cb 0.20 -1.11 0.06 0.00 0.03 0.00 0.00 46.19 45.36 2eim s LEU 53 CO 0.48 -0.87 0.32 0.54 0.23 0.00 0.00 176.35 177.05 2eim n ARG 54 N -1.46 -1.85 -1.85 1.70 3.00 -1.26 -4.86 116.66 110.08 2eim n ARG 54 Ca -0.07 0.22 -0.38 0.00 -0.01 0.00 0.00 57.85 57.61 2eim n ARG 54 Cb 0.65 -4.23 0.04 0.00 0.00 0.00 0.00 32.46 28.92 2eim n ARG 54 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2eim s ILE 55 N -3.94 2.22 -0.37 0.55 -1.09 -1.26 -4.72 121.20 112.59 2eim s ILE 55 Ca 0.24 0.16 0.04 0.00 -2.23 0.00 0.00 60.65 58.86 2eim s ILE 55 Cb -0.14 -3.08 0.16 0.00 -1.58 0.00 0.00 42.46 37.83 2eim s ILE 55 CO 0.96 -0.01 0.43 -0.13 -1.23 0.00 0.00 174.94 174.97 2eim s ARG 56 N -2.97 0.64 -0.05 2.79 1.81 -1.26 -4.97 118.95 114.93 2eim s ARG 56 Ca 0.73 -0.59 0.21 0.00 -1.72 0.00 0.00 55.73 54.36 2eim s ARG 56 Cb -0.38 -0.49 -0.33 0.00 -0.45 0.00 0.00 34.95 33.30 2eim s ARG 56 CO 0.44 -1.17 0.42 0.25 -0.68 0.00 0.00 175.30 174.57 2eim n THR 57 N 4.45 0.19 -3.66 0.02 -2.24 -1.26 -4.93 114.28 106.86 2eim n THR 57 Ca 0.09 -0.55 -0.11 0.00 -2.27 0.00 0.00 64.05 61.22 2eim n THR 57 Cb 0.48 -0.06 -0.08 0.00 -2.10 0.00 0.00 70.33 68.57 2eim n THR 57 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2eim s LYS 58 N -3.38 0.67 0.37 -0.78 2.20 -1.26 -5.15 119.74 112.41 2eim s LYS 58 Ca -0.08 0.99 -0.28 0.00 -0.36 0.00 0.00 55.97 56.25 2eim s LYS 58 Cb 0.13 0.22 -0.10 0.00 -1.51 0.00 0.00 37.83 36.56 2eim s LYS 58 CO 0.90 -0.12 1.37 -1.25 -0.36 0.00 0.00 175.35 175.89 2eim s PRO 59 N 0.99 4.13 0.64 4.03 0.04 -1.26 -4.97 135.00 138.61 2eim s PRO 59 Ca -0.05 2.33 -0.17 0.00 0.04 0.00 0.00 61.00 63.15 2eim s PRO 59 Cb -0.05 -2.93 -0.03 0.00 0.04 0.00 0.00 34.50 31.52 2eim s PRO 59 CO -0.09 -0.42 0.95 1.19 0.04 0.00 0.00 177.00 178.66 2eim n PHE 60 N 0.45 0.71 1.79 0.56 0.99 -0.73 -4.86 117.46 116.37 2eim n PHE 60 Ca 0.02 0.42 0.00 0.00 -0.00 0.00 0.00 57.45 57.88 2eim n PHE 60 Cb 0.41 -2.11 0.00 0.00 -1.00 0.00 0.00 39.48 36.78 2eim n PHE 60 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 2eim n SER 61 N -1.03 0.12 -4.28 4.37 7.64 -1.26 -4.20 113.62 114.97 2eim n SER 61 Ca 0.14 -1.91 -0.15 0.00 1.01 0.00 0.00 58.87 57.96 2eim n SER 61 Cb 0.48 -0.06 -0.10 0.00 -1.01 0.00 0.00 64.21 63.52 2eim n SER 61 CO 0.00 0.00 0.00 -1.66 -3.01 0.00 0.00 175.04 170.37 2eim s TRP 62 N -1.88 1.35 0.00 1.43 -2.14 -1.26 -5.03 118.94 111.41 2eim s TRP 62 Ca 0.00 -0.87 0.00 0.00 2.66 0.00 0.00 56.10 57.89 2eim s TRP 62 Cb 0.00 -0.74 0.00 0.00 -3.10 0.00 0.00 33.47 29.63 2eim s TRP 62 CO 0.00 -0.03 0.00 0.41 -2.66 0.00 0.00 176.95 174.67 2eim n GLY 63 N -0.28 2.69 0.40 3.67 0.00 -1.26 -1.31 105.19 109.10 2eim n GLY 63 Ca -0.08 -0.25 0.11 0.00 0.00 0.00 0.00 46.02 45.80 2eim n GLY 63 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2eim n ASP 64 N 1.18 1.20 0.00 1.61 5.75 -1.26 -4.91 116.55 120.12 2eim n ASP 64 Ca 0.00 -1.60 0.00 0.00 -0.01 0.00 0.00 54.79 53.18 2eim n ASP 64 Cb 0.00 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.02 2eim n ASP 64 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2eim n GLY 65 N 1.05 0.53 0.00 6.12 0.00 -0.42 -4.87 105.19 107.59 2eim n GLY 65 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2eim n GLY 65 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2eim n ASN 66 N -0.06 0.15 -4.70 1.61 5.15 -1.26 -1.77 115.26 114.38 2eim n ASN 66 Ca 0.00 -0.54 -0.35 0.00 -0.60 0.00 0.00 54.58 53.09 2eim n ASN 66 Cb 0.03 0.73 -0.09 0.00 -0.53 0.00 0.00 39.78 39.92 2eim n ASN 66 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 2eim s HIS 67 N -0.73 3.27 0.81 1.20 3.76 -1.26 -4.85 115.29 117.49 2eim s HIS 67 Ca 0.00 0.19 -0.12 0.00 -0.15 0.00 0.00 55.06 54.98 2eim s HIS 67 Cb 0.00 -1.93 0.08 0.00 1.11 0.00 0.00 32.58 31.84 2eim s HIS 67 CO 0.00 0.39 1.14 0.95 -0.85 0.00 0.00 174.74 176.37 2eim s THR 68 N -0.41 2.57 0.26 1.30 -4.23 -1.26 -4.91 115.64 108.96 2eim s THR 68 Ca 0.09 0.21 -0.02 0.00 -1.18 0.00 0.00 61.69 60.79 2eim s THR 68 Cb -0.12 -2.54 0.25 0.00 1.34 0.00 0.00 72.50 71.43 2eim s THR 68 CO 0.02 -0.21 1.69 0.15 -0.54 0.00 0.00 174.62 175.72 2eim h PHE 69 N -1.10 0.38 -0.83 3.99 3.04 -1.99 -2.05 116.94 118.38 2eim h PHE 69 Ca -0.45 0.04 -0.59 0.00 3.98 0.00 0.00 57.97 60.96 2eim h PHE 69 Cb 1.26 -0.04 -0.36 0.00 2.56 0.00 0.00 35.95 39.37 2eim h PHE 69 CO 0.52 -0.08 -0.10 1.19 -2.02 0.00 0.00 178.31 177.82 2eim n PHE 70 N -5.13 2.88 -1.66 0.41 3.01 -1.26 -5.05 117.46 110.66 2eim n PHE 70 Ca 0.17 -2.52 -0.52 0.00 1.01 0.00 0.00 57.45 55.58 2eim n PHE 70 Cb 0.52 -0.80 -0.06 0.00 -0.01 0.00 0.00 39.48 39.13 2eim n PHE 70 CO 0.00 0.00 0.00 1.58 1.01 0.00 0.00 176.76 179.35 2eim n HIS 71 N -0.81 1.98 -3.96 1.38 -0.00 -0.77 -4.97 115.22 108.06 2eim n HIS 71 Ca 0.51 0.42 -0.34 0.00 0.46 0.00 0.00 57.72 58.77 2eim n HIS 71 Cb 0.85 -2.47 -0.14 0.00 -0.12 0.00 0.00 29.99 28.11 2eim n HIS 71 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 2eim s ASN 72 N 2.31 4.76 0.27 0.26 3.84 -1.26 -5.00 114.94 120.12 2eim s ASN 72 Ca 0.90 -1.42 -0.02 0.00 0.21 0.00 0.00 52.86 52.53 2eim s ASN 72 Cb -0.90 -1.66 0.46 0.00 -0.55 0.00 0.00 41.25 38.60 2eim s ASN 72 CO 0.53 -0.26 1.84 -0.65 -2.79 0.00 0.00 177.10 175.77 2eim h PRO 73 N 7.90 0.96 -0.91 0.43 0.11 -1.94 0.36 132.00 138.90 2eim h PRO 73 Ca -0.19 -0.06 0.13 0.00 0.11 0.00 0.00 66.00 66.00 2eim h PRO 73 Cb 1.05 -0.22 -0.07 0.00 0.11 0.00 0.00 31.00 31.87 2eim h PRO 73 CO 0.52 0.64 0.59 -0.09 -0.21 0.00 0.00 178.00 179.44 2eim h ARG 74 N 0.99 0.76 0.00 1.05 1.12 -1.96 -3.33 114.38 113.01 2eim h ARG 74 Ca 0.45 -0.05 0.00 0.00 -1.11 0.00 0.00 59.98 59.27 2eim h ARG 74 Cb 0.35 -0.17 0.00 0.00 -0.01 0.00 0.00 29.97 30.14 2eim h ARG 74 CO -0.23 0.50 -0.02 1.33 -3.11 0.00 0.00 179.97 178.44 2eim n VAL 75 N -4.57 0.00 -3.53 0.20 0.24 -0.90 -4.94 118.33 104.83 2eim n VAL 75 Ca 0.17 -0.33 -0.41 0.00 -2.04 0.00 0.00 64.34 61.73 2eim n VAL 75 Cb 0.43 0.98 -0.09 0.00 -1.47 0.00 0.00 33.84 33.69 2eim n VAL 75 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 2eim s ASN 76 N -0.72 5.77 0.51 -1.34 -0.87 0.12 -5.04 114.94 113.38 2eim s ASN 76 Ca 0.00 -1.64 -0.19 0.00 -1.57 0.00 0.00 52.86 49.46 2eim s ASN 76 Cb 0.00 -2.04 -0.07 0.00 -0.02 0.00 0.00 41.25 39.12 2eim s ASN 76 CO 0.00 -0.63 1.04 -2.16 -2.57 0.00 0.00 177.10 172.78 2eim s PRO 77 N 1.45 3.70 0.91 -0.60 0.04 -1.26 -4.63 135.00 134.61 2eim s PRO 77 Ca 0.04 1.31 -0.11 0.00 0.04 0.00 0.00 61.00 62.27 2eim s PRO 77 Cb -0.25 -2.08 0.20 0.00 0.04 0.00 0.00 34.50 32.41 2eim s PRO 77 CO 0.02 -0.51 1.25 -0.51 0.04 0.00 0.00 177.00 177.28 2eim s LEU 78 N -3.74 2.82 0.59 -3.56 1.43 -0.99 -4.86 118.68 110.37 2eim s LEU 78 Ca 0.66 -0.06 0.29 0.00 -1.03 0.00 0.00 54.13 53.99 2eim s LEU 78 Cb -0.16 -1.97 1.68 0.00 0.03 0.00 0.00 46.19 45.77 2eim s LEU 78 CO 0.24 -2.61 2.11 -0.65 0.23 0.00 0.00 176.35 175.67 2eim h PRO 79 N -1.38 0.00 -0.48 1.29 0.11 -1.88 -1.44 132.00 128.22 2eim h PRO 79 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2eim h PRO 79 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2eim h PRO 79 CO 0.34 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.38 2eim n THR 80 N -3.77 2.15 0.00 -1.15 -2.24 -1.26 -4.88 114.28 103.13 2eim n THR 80 Ca 0.01 -1.45 0.00 0.00 -2.27 0.00 0.00 64.05 60.34 2eim n THR 80 Cb 0.31 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 2eim n THR 80 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2eim n GLY 81 N 0.41 1.88 3.20 3.38 0.00 -0.54 -5.05 105.19 108.47 2eim n GLY 81 Ca 0.23 -2.00 -0.31 0.00 0.00 0.00 0.00 46.02 43.94 2eim n GLY 81 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2eim n TYR 82 N 1.25 -1.57 -3.60 1.61 4.01 -1.26 -2.34 117.16 115.27 2eim n TYR 82 Ca 0.00 0.17 -0.20 0.00 -0.16 0.00 0.00 57.90 57.71 2eim n TYR 82 Cb 0.00 -1.50 -0.02 0.00 -0.31 0.00 0.00 39.34 37.50 2eim n TYR 82 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 2eim s GLU 83 N -3.28 2.83 0.00 -0.72 2.02 -1.26 -4.77 118.70 113.51 2eim s GLU 83 Ca 0.50 -1.24 0.00 0.00 0.02 0.00 0.00 54.97 54.26 2eim s GLU 83 Cb -0.08 -2.59 0.00 0.00 0.10 0.00 0.00 34.13 31.56 2eim s GLU 83 CO 0.61 0.01 0.33 1.63 0.02 0.00 0.00 175.26 177.86