#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d2n n SER 5 N 10.61 -3.57 -0.08 0.00 3.41 -1.26 -4.72 113.62 118.00 2d2n n SER 5 Ca 0.38 -0.64 -0.12 0.00 -0.26 0.00 0.00 58.87 58.23 2d2n n SER 5 Cb 0.49 -0.94 -0.05 0.00 -0.26 0.00 0.00 64.21 63.45 2d2n n SER 5 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2d2n h SER 6 N -3.23 0.54 0.39 4.04 0.02 -1.99 -2.82 113.55 110.50 2d2n h SER 6 Ca -0.36 -0.41 -0.02 0.00 -0.84 0.00 0.00 61.79 60.15 2d2n h SER 6 Cb 1.13 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.52 2d2n h SER 6 CO 0.23 0.83 -0.19 -0.33 -1.14 0.00 0.00 176.83 176.24 2d2n h GLU 7 N 0.24 -0.50 -0.91 3.45 4.39 -1.99 -2.79 114.58 116.47 2d2n h GLU 7 Ca 0.05 0.03 0.21 0.00 0.34 0.00 0.00 59.36 60.00 2d2n h GLU 7 Cb 0.63 0.11 -0.17 0.00 -0.10 0.00 0.00 28.75 29.23 2d2n h GLU 7 CO 0.04 -0.29 -0.08 -0.44 -1.16 0.00 0.00 179.01 177.07 2d2n h ASP 8 N -0.59 -0.60 -0.31 1.42 3.45 -1.89 0.65 116.42 118.55 2d2n h ASP 8 Ca -0.05 0.26 -0.05 0.00 0.43 0.00 0.00 57.03 57.62 2d2n h ASP 8 Cb 0.44 0.49 -0.01 0.00 -0.56 0.00 0.00 39.33 39.69 2d2n h ASP 8 CO 0.09 -0.29 -0.00 0.03 -1.57 0.00 0.00 179.24 177.49 2d2n h ARG 9 N 0.03 0.54 0.26 3.56 3.08 -1.42 0.14 114.38 120.57 2d2n h ARG 9 Ca 0.49 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 60.36 2d2n h ARG 9 Cb 0.88 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.89 2d2n h ARG 9 CO -0.87 0.68 -0.12 0.00 -1.07 0.00 0.00 179.97 178.59 2d2n h ALA 10 N 0.84 -0.35 -0.07 0.04 0.00 -0.80 0.60 119.26 119.54 2d2n h ALA 10 Ca 0.09 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2d2n h ALA 10 Cb 0.44 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 2d2n h ALA 10 CO 0.02 -0.66 0.12 -0.97 0.00 0.00 0.00 179.25 177.75 2d2n h ASN 11 N -0.41 0.00 0.07 0.00 -0.00 0.37 -0.24 115.58 115.38 2d2n h ASN 11 Ca -0.04 0.00 -0.28 0.00 -0.00 0.00 0.00 56.30 55.99 2d2n h ASN 11 Cb 0.31 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 38.61 2d2n h ASN 11 CO 0.06 0.00 -1.48 0.58 -0.00 0.00 0.00 177.43 176.59 2d2n h VAL 12 N 0.00 0.89 -0.26 2.57 2.07 0.16 -3.08 116.25 118.60 2d2n h VAL 12 Ca 0.03 -2.30 0.08 0.00 0.82 0.00 0.00 66.70 65.33 2d2n h VAL 12 Cb 0.27 2.49 -0.01 0.00 -1.52 0.00 0.00 31.29 32.52 2d2n h VAL 12 CO -0.00 0.61 0.21 0.24 0.02 0.00 0.00 177.57 178.65 2d2n h MET 13 N -0.48 0.00 0.11 1.57 2.86 0.95 0.48 114.93 120.43 2d2n h MET 13 Ca -0.35 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.29 2d2n h MET 13 Cb 1.65 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.31 2d2n h MET 13 CO -0.04 0.00 -0.05 1.25 1.06 0.00 0.00 176.91 179.13 2d2n h HIS 14 N 0.00 -0.14 -0.89 -0.22 6.17 -1.16 0.15 115.15 119.06 2d2n h HIS 14 Ca 0.12 -0.00 0.31 0.00 0.71 0.00 0.00 60.37 61.51 2d2n h HIS 14 Cb 0.55 0.05 -0.16 0.00 2.52 0.00 0.00 27.41 30.36 2d2n h HIS 14 CO 0.00 -0.09 0.26 0.09 0.71 0.00 0.00 177.93 178.90 2d2n n ASN 15 N -2.70 0.11 -0.43 3.26 5.03 -0.91 0.33 115.26 119.94 2d2n n ASN 15 Ca -0.02 1.49 0.10 0.00 0.87 0.00 0.00 54.58 57.02 2d2n n ASN 15 Cb 0.06 -0.64 0.39 0.00 -1.02 0.00 0.00 39.78 38.57 2d2n n ASN 15 CO 0.00 0.00 0.00 1.87 -1.83 0.00 0.00 177.26 177.30 2d2n n TRP 16 N -5.15 0.18 -0.08 3.10 -0.00 0.11 -3.63 117.44 111.97 2d2n n TRP 16 Ca 0.28 -0.09 -0.14 0.00 -0.00 0.00 0.00 57.50 57.54 2d2n n TRP 16 Cb 0.93 0.00 -0.11 0.00 -0.00 0.00 0.00 31.31 32.13 2d2n n TRP 16 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 177.69 177.91 2d2n h ASP 17 N 1.70 0.00 -4.13 5.87 -0.00 0.74 -3.42 116.42 117.18 2d2n h ASP 17 Ca 0.00 -0.72 -0.45 0.00 -0.00 0.00 0.00 57.03 55.86 2d2n h ASP 17 Cb 0.37 0.00 0.15 0.00 -0.00 0.00 0.00 39.33 39.85 2d2n h ASP 17 CO 0.00 1.08 0.35 0.00 -0.00 0.00 0.00 179.24 180.67 2d2n s ALA 18 N -2.32 2.00 -1.48 -0.78 0.00 -1.06 -3.58 121.76 114.54 2d2n s ALA 18 Ca -0.20 -0.89 -0.12 0.00 0.00 0.00 0.00 51.96 50.75 2d2n s ALA 18 Cb -0.00 -2.89 0.07 0.00 0.00 0.00 0.00 23.12 20.30 2d2n s ALA 18 CO 0.57 -2.40 0.86 0.00 0.00 0.00 0.00 175.76 174.79 2d2n n ALA 19 N -3.81 -1.20 -3.60 0.00 0.00 -1.26 -4.83 120.51 105.81 2d2n n ALA 19 Ca 0.11 0.20 -0.12 0.00 0.00 0.00 0.00 53.44 53.64 2d2n n ALA 19 Cb 0.60 -4.17 -0.06 0.00 0.00 0.00 0.00 19.45 15.81 2d2n n ALA 19 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 2d2n s TRP 20 N -3.21 -0.56 -0.11 0.00 -0.11 -1.23 -4.89 118.94 108.82 2d2n s TRP 20 Ca 0.56 1.21 -0.04 0.00 1.22 0.00 0.00 56.10 59.06 2d2n s TRP 20 Cb -0.28 0.37 0.06 0.00 -1.50 0.00 0.00 33.47 32.12 2d2n s TRP 20 CO 0.70 -0.36 0.16 0.45 -4.62 0.00 0.00 176.95 173.28 2d2n s SER 21 N -0.31 1.05 0.00 5.86 0.15 -1.26 -4.99 113.70 114.20 2d2n s SER 21 Ca -0.01 0.12 0.27 0.00 0.70 0.00 0.00 55.95 57.03 2d2n s SER 21 Cb -0.03 0.23 1.37 0.00 -1.71 0.00 0.00 66.02 65.87 2d2n s SER 21 CO 0.00 -0.27 1.93 0.00 1.20 0.00 0.00 173.24 176.10 2d2n n ALA 22 N 5.32 2.35 -0.03 5.45 0.00 -1.26 -3.40 120.51 128.94 2d2n n ALA 22 Ca -0.05 -0.13 -0.22 0.00 0.00 0.00 0.00 53.44 53.05 2d2n n ALA 22 Cb 0.50 -1.44 -0.13 0.00 0.00 0.00 0.00 19.45 18.37 2d2n n ALA 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d2n h ALA 23 N 3.27 0.36 -3.36 0.00 0.00 -2.05 -3.48 119.26 114.01 2d2n h ALA 23 Ca 0.00 -1.32 -0.63 0.00 0.00 0.00 0.00 54.91 52.96 2d2n h ALA 23 Cb 0.26 0.71 -0.33 0.00 0.00 0.00 0.00 17.79 18.43 2d2n h ALA 23 CO 0.00 1.08 -0.86 0.71 0.00 0.00 0.00 179.25 180.18 2d2n s TYR 24 N -2.49 2.24 0.17 0.00 1.51 -1.22 -5.04 117.35 112.53 2d2n s TYR 24 Ca -0.24 -0.91 -0.11 0.00 -1.01 0.00 0.00 57.07 54.80 2d2n s TYR 24 Cb 0.06 -1.53 0.05 0.00 -0.11 0.00 0.00 41.96 40.44 2d2n s TYR 24 CO 0.71 -0.38 1.65 0.66 -1.11 0.00 0.00 175.55 177.08 2d2n h SER 25 N 6.80 0.92 -0.89 2.29 4.64 -1.93 -3.32 113.55 122.06 2d2n h SER 25 Ca -0.23 -0.27 0.14 0.00 -0.47 0.00 0.00 61.79 60.96 2d2n h SER 25 Cb 1.22 -0.25 -0.14 0.00 -0.31 0.00 0.00 62.40 62.93 2d2n h SER 25 CO 0.47 0.96 -0.35 -0.90 -0.87 0.00 0.00 176.83 176.14 2d2n n ASP 26 N -4.31 -0.59 0.17 4.97 3.85 -1.26 -1.11 116.55 118.26 2d2n n ASP 26 Ca 0.02 1.55 -0.14 0.00 -0.71 0.00 0.00 54.79 55.52 2d2n n ASP 26 Cb 0.28 -0.35 -0.07 0.00 -1.35 0.00 0.00 41.12 39.63 2d2n n ASP 26 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.20 176.10 2d2n h ARG 27 N 0.00 -0.51 -0.85 0.11 2.43 -1.96 -1.32 114.38 112.29 2d2n h ARG 27 Ca 0.31 0.03 0.21 0.00 -0.81 0.00 0.00 59.98 59.72 2d2n h ARG 27 Cb 0.53 0.12 -0.13 0.00 -0.42 0.00 0.00 29.97 30.06 2d2n h ARG 27 CO -0.88 -0.34 0.26 0.00 -1.51 0.00 0.00 179.97 177.50 2d2n h ARG 28 N -0.53 0.26 -0.80 0.20 3.08 -1.30 0.13 114.38 115.43 2d2n h ARG 28 Ca -0.00 -0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.06 2d2n h ARG 28 Cb 0.50 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.44 2d2n h ARG 28 CO -0.07 0.17 0.51 0.28 -1.07 0.00 0.00 179.97 179.80 2d2n h VAL 29 N 0.27 1.12 0.00 2.04 2.07 -0.06 0.12 116.25 121.81 2d2n h VAL 29 Ca 0.52 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 67.70 2d2n h VAL 29 Cb 1.01 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.81 2d2n h VAL 29 CO -0.59 0.18 -0.00 0.00 0.02 0.00 0.00 177.57 177.18 2d2n h ALA 30 N 1.34 -0.00 -0.76 1.67 0.00 -0.24 -0.51 119.26 120.75 2d2n h ALA 30 Ca 0.32 -0.20 0.12 0.00 0.00 0.00 0.00 54.91 55.15 2d2n h ALA 30 Cb 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.72 2d2n h ALA 30 CO -0.11 -0.31 0.36 1.25 0.00 0.00 0.00 179.25 180.44 2d2n h LEU 31 N -0.40 0.43 0.05 0.00 5.85 -0.99 -1.03 115.31 119.23 2d2n h LEU 31 Ca -0.00 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 2d2n h LEU 31 Cb 0.39 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.44 2d2n h LEU 31 CO 0.00 0.22 -0.03 0.00 -0.34 0.00 0.00 178.44 178.29 2d2n h ALA 32 N 1.49 -0.86 -0.89 1.25 0.00 -0.63 -2.24 119.26 117.39 2d2n h ALA 32 Ca 0.40 -0.02 0.36 0.00 0.00 0.00 0.00 54.91 55.65 2d2n h ALA 32 Cb 0.50 0.03 -0.16 0.00 0.00 0.00 0.00 17.79 18.16 2d2n h ALA 32 CO -0.33 -0.85 0.42 1.04 0.00 0.00 0.00 179.25 179.53 2d2n n GLN 33 N -2.22 -0.06 -0.12 0.00 6.02 -0.21 0.20 117.38 120.99 2d2n n GLN 33 Ca -0.01 1.23 -0.12 0.00 -0.01 0.00 0.00 57.00 58.10 2d2n n GLN 33 Cb 0.03 -2.18 -0.03 0.00 1.02 0.00 0.00 30.24 29.08 2d2n n GLN 33 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2d2n h ALA 34 N 1.77 0.50 -0.23 -1.58 0.00 -1.13 1.87 119.26 120.45 2d2n h ALA 34 Ca 0.73 -0.36 0.06 0.00 0.00 0.00 0.00 54.91 55.34 2d2n h ALA 34 Cb 1.88 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 19.49 2d2n h ALA 34 CO -0.70 0.44 -0.16 0.28 0.00 0.00 0.00 179.25 179.11 2d2n h VAL 35 N 0.53 0.55 -0.21 0.00 2.07 0.29 -2.40 116.25 117.08 2d2n h VAL 35 Ca 0.08 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.59 2d2n h VAL 35 Cb 0.73 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 2d2n h VAL 35 CO 0.05 0.00 0.09 -0.26 0.02 0.00 0.00 177.57 177.47 2d2n h PHE 36 N -0.15 0.32 -0.98 1.57 0.04 -0.35 -2.21 116.94 115.19 2d2n h PHE 36 Ca 0.13 -0.02 0.17 0.00 2.80 0.00 0.00 57.97 61.04 2d2n h PHE 36 Cb 0.35 -0.10 -0.17 0.00 2.20 0.00 0.00 35.95 38.23 2d2n h PHE 36 CO -0.32 0.36 -0.33 0.00 -0.60 0.00 0.00 178.31 177.41 2d2n n ALA 37 N -2.24 0.00 0.14 2.45 0.00 0.63 -1.60 120.51 119.90 2d2n n ALA 37 Ca -0.04 1.01 -0.10 0.00 0.00 0.00 0.00 53.44 54.31 2d2n n ALA 37 Cb 0.12 -0.51 -0.06 0.00 0.00 0.00 0.00 19.45 19.01 2d2n n ALA 37 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2d2n h SER 38 N 0.00 -0.36 -0.43 0.00 4.64 -1.39 -2.40 113.55 113.61 2d2n h SER 38 Ca 0.38 -0.14 0.05 0.00 -0.47 0.00 0.00 61.79 61.62 2d2n h SER 38 Cb 0.63 0.09 -0.06 0.00 -0.31 0.00 0.00 62.40 62.75 2d2n h SER 38 CO -0.98 0.10 -0.22 -0.11 -0.87 0.00 0.00 176.83 174.75 2d2n n LEU 39 N -5.07 -0.38 0.20 5.97 7.94 -0.63 0.18 117.00 125.21 2d2n n LEU 39 Ca -0.08 0.76 -0.14 0.00 -1.11 0.00 0.00 56.01 55.44 2d2n n LEU 39 Cb 0.25 -0.13 -0.08 0.00 0.53 0.00 0.00 43.42 43.99 2d2n n LEU 39 CO 0.22 -0.64 0.59 -0.26 -1.11 0.00 0.00 177.39 176.19 2d2n h PHE 40 N 0.00 -0.47 -0.79 1.96 0.04 -1.44 -2.31 116.94 113.93 2d2n h PHE 40 Ca 0.10 -0.01 0.23 0.00 2.80 0.00 0.00 57.97 61.09 2d2n h PHE 40 Cb 0.21 0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.48 2d2n h PHE 40 CO -0.42 -0.17 0.94 1.03 -0.60 0.00 0.00 178.31 179.09 2d2n h SER 41 N -0.74 0.00 -0.29 2.17 0.87 0.25 1.21 113.55 117.02 2d2n h SER 41 Ca -0.05 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.51 2d2n h SER 41 Cb 0.51 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 2d2n h SER 41 CO 0.09 0.00 0.00 -2.11 -0.53 0.00 0.00 176.83 174.28 2d2n n ARG 42 N -3.38 2.65 -2.71 2.24 1.85 0.31 -4.67 116.66 112.95 2d2n n ARG 42 Ca 0.17 -1.93 -0.07 0.00 -1.00 0.00 0.00 57.85 55.03 2d2n n ARG 42 Cb 1.19 -1.25 0.09 0.00 -1.05 0.00 0.00 32.46 31.45 2d2n n ARG 42 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 2d2n n ASP 43 N 0.46 -1.98 -0.35 2.89 4.64 0.40 -5.03 116.55 117.59 2d2n n ASP 43 Ca 0.10 -2.90 0.03 0.00 -1.38 0.00 0.00 54.79 50.64 2d2n n ASP 43 Cb 0.40 1.57 0.09 0.00 -1.04 0.00 0.00 41.12 42.14 2d2n n ASP 43 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2d2n n ALA 44 N 0.67 0.09 -0.28 -1.67 0.00 -0.04 0.91 120.51 120.19 2d2n n ALA 44 Ca 0.02 0.99 0.02 0.00 0.00 0.00 0.00 53.44 54.47 2d2n n ALA 44 Cb 0.71 -0.54 0.09 0.00 0.00 0.00 0.00 19.45 19.71 2d2n n ALA 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d2n h ALA 45 N 1.64 0.45 -0.91 0.00 0.00 -1.96 0.88 119.26 119.36 2d2n h ALA 45 Ca 0.40 0.30 0.25 0.00 0.00 0.00 0.00 54.91 55.86 2d2n h ALA 45 Cb 0.63 0.65 -0.14 0.00 0.00 0.00 0.00 17.79 18.93 2d2n h ALA 45 CO -0.95 -0.44 0.34 0.00 0.00 0.00 0.00 179.25 178.19 2d2n h ALA 46 N 1.70 1.45 -0.99 0.00 0.00 0.17 -0.16 119.26 121.42 2d2n h ALA 46 Ca 0.37 0.20 0.37 0.00 0.00 0.00 0.00 54.91 55.85 2d2n h ALA 46 Cb 0.59 0.25 -0.17 0.00 0.00 0.00 0.00 17.79 18.46 2d2n h ALA 46 CO -0.82 -0.46 0.49 0.37 0.00 0.00 0.00 179.25 178.83 2d2n h GLN 47 N 0.27 0.10 -0.24 0.00 4.15 -0.80 0.56 115.11 119.16 2d2n h GLN 47 Ca 0.59 -0.01 0.07 0.00 0.77 0.00 0.00 58.65 60.08 2d2n h GLN 47 Cb 1.22 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.88 2d2n h GLN 47 CO -0.62 0.07 0.22 0.78 -1.93 0.00 0.00 178.83 177.35 2d2n h GLY 48 N 0.10 0.00 1.99 2.39 0.00 -1.14 -2.02 103.07 104.40 2d2n h GLY 48 Ca 0.78 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.11 2d2n h GLY 48 CO -0.73 0.00 0.00 1.41 0.00 0.00 0.00 176.54 177.22 2d2n h LEU 49 N 0.00 0.00 -3.67 3.11 3.38 -0.03 -1.73 115.31 116.37 2d2n h LEU 49 Ca 0.12 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.95 2d2n h LEU 49 Cb 0.55 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.22 2d2n h LEU 49 CO -0.00 0.00 0.17 0.49 0.09 0.00 0.00 178.44 179.19 2d2n n PHE 50 N -3.90 2.29 -0.25 1.13 3.01 -0.76 -4.36 117.46 114.61 2d2n n PHE 50 Ca -0.03 -1.05 0.28 0.00 1.01 0.00 0.00 57.45 57.67 2d2n n PHE 50 Cb 0.08 -0.62 0.66 0.00 -0.01 0.00 0.00 39.48 39.60 2d2n n PHE 50 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2d2n h SER 51 N 3.07 0.14 0.00 4.37 4.64 -1.45 0.76 113.55 125.08 2d2n h SER 51 Ca 0.17 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 2d2n h SER 51 Cb 2.20 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.29 2d2n h SER 51 CO 0.64 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 177.25 2d2n n GLY 52 N -1.66 0.78 3.51 -0.77 0.00 -1.26 -4.48 105.19 101.31 2d2n n GLY 52 Ca 0.22 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.09 2d2n n GLY 52 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2d2n s VAL 53 N -1.04 0.00 0.00 1.61 1.01 0.26 -5.04 120.40 117.21 2d2n s VAL 53 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.95 2d2n s VAL 53 Cb 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 36.38 35.51 2d2n s VAL 53 CO 0.00 -0.01 0.41 -1.20 0.00 0.00 0.00 175.10 174.29 2d2n n SER 54 N 2.37 0.00 -0.28 3.32 7.64 -1.26 -4.55 113.62 120.86 2d2n n SER 54 Ca -0.15 -1.35 0.09 0.00 1.01 0.00 0.00 58.87 58.48 2d2n n SER 54 Cb 0.56 0.00 0.24 0.00 -1.01 0.00 0.00 64.21 63.99 2d2n n SER 54 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2d2n h ALA 55 N 5.57 1.10 0.00 -0.43 0.00 -1.86 0.51 119.26 124.16 2d2n h ALA 55 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2d2n h ALA 55 Cb 0.00 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2d2n h ALA 55 CO 0.41 -0.41 0.00 -0.25 0.00 0.00 0.00 179.25 179.00 2d2n n ASP 56 N -5.22 0.00 -3.18 0.00 9.92 -1.26 -2.87 116.55 113.94 2d2n n ASP 56 Ca 0.18 -0.20 -0.20 0.00 -0.53 0.00 0.00 54.79 54.04 2d2n n ASP 56 Cb 0.58 -0.00 -0.04 0.00 -0.64 0.00 0.00 41.12 41.02 2d2n n ASP 56 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 2d2n n ASN 57 N -1.00 0.56 -0.17 -2.24 4.05 0.18 -5.01 115.26 111.63 2d2n n ASN 57 Ca 0.05 -2.92 -0.05 0.00 0.45 0.00 0.00 54.58 52.11 2d2n n ASN 57 Cb 0.02 -0.57 -0.04 0.00 1.23 0.00 0.00 39.78 40.42 2d2n n ASN 57 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 177.26 171.56 2d2n n PRO 58 N 0.63 -0.18 0.00 1.20 -0.02 -1.14 0.25 135.00 135.75 2d2n n PRO 58 Ca 0.23 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.57 2d2n n PRO 58 Cb 0.62 -1.27 0.00 0.00 -0.02 0.00 0.00 33.50 32.83 2d2n n PRO 58 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2d2n n ASP 59 N -4.01 0.00 -4.62 2.55 4.64 -1.26 -4.22 116.55 109.62 2d2n n ASP 59 Ca 0.01 0.00 -0.31 0.00 -1.38 0.00 0.00 54.79 53.11 2d2n n ASP 59 Cb 0.11 0.00 -0.09 0.00 -1.04 0.00 0.00 41.12 40.09 2d2n n ASP 59 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 2d2n s SER 60 N -0.11 4.70 0.04 1.67 1.04 0.14 -5.00 113.70 116.17 2d2n s SER 60 Ca 0.00 -0.21 -0.10 0.00 0.48 0.00 0.00 55.95 56.12 2d2n s SER 60 Cb 0.00 -1.06 -0.04 0.00 0.10 0.00 0.00 66.02 65.02 2d2n s SER 60 CO 0.00 0.23 1.17 0.00 0.98 0.00 0.00 173.24 175.62 2d2n h ALA 61 N 3.98 -0.53 -0.72 5.32 0.00 -1.87 0.79 119.26 126.23 2d2n h ALA 61 Ca -0.48 -0.01 0.29 0.00 0.00 0.00 0.00 54.91 54.71 2d2n h ALA 61 Cb 1.17 0.76 -0.13 0.00 0.00 0.00 0.00 17.79 19.58 2d2n h ALA 61 CO 0.55 -0.60 0.35 -3.47 0.00 0.00 0.00 179.25 176.08 2d2n n ASP 62 N -3.48 0.21 -0.05 0.00 2.03 -1.26 -0.11 116.55 113.89 2d2n n ASP 62 Ca -0.02 1.20 -0.17 0.00 0.52 0.00 0.00 54.79 56.32 2d2n n ASP 62 Cb 0.11 -0.57 -0.13 0.00 -0.72 0.00 0.00 41.12 39.81 2d2n n ASP 62 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 2d2n h PHE 63 N 0.00 0.11 -0.09 -0.67 3.04 -1.59 -3.06 116.94 114.68 2d2n h PHE 63 Ca 0.59 -0.08 0.03 0.00 3.98 0.00 0.00 57.97 62.49 2d2n h PHE 63 Cb 1.54 -0.00 -0.00 0.00 2.56 0.00 0.00 35.95 40.04 2d2n h PHE 63 CO -0.05 1.17 0.10 0.00 -2.02 0.00 0.00 178.31 177.51 2d2n h ARG 64 N -0.86 0.00 -0.16 1.11 3.08 0.19 0.44 114.38 118.17 2d2n h ARG 64 Ca -0.10 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.75 2d2n h ARG 64 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.25 2d2n h ARG 64 CO -0.01 0.00 -0.69 0.00 -1.07 0.00 0.00 179.97 178.20 2d2n h ALA 65 N 1.88 0.47 -0.45 0.04 0.00 -0.63 -2.26 119.26 118.31 2d2n h ALA 65 Ca 0.04 -0.58 -0.13 0.00 0.00 0.00 0.00 54.91 54.25 2d2n h ALA 65 Cb 0.25 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2d2n h ALA 65 CO -0.00 0.71 -0.22 1.25 0.00 0.00 0.00 179.25 180.98 2d2n h HIS 66 N 0.48 1.09 -0.22 0.00 -0.00 -0.12 -1.27 115.15 115.10 2d2n h HIS 66 Ca -0.03 -0.27 0.04 0.00 -0.00 0.00 0.00 60.37 60.12 2d2n h HIS 66 Cb 1.29 -0.25 -0.04 0.00 -0.00 0.00 0.00 27.41 28.41 2d2n h HIS 66 CO 0.07 1.08 -0.05 0.00 -0.00 0.00 0.00 177.93 179.02 2d2n h VAL 68 N 0.00 0.26 -0.93 0.00 2.07 -1.25 0.14 116.25 116.53 2d2n h VAL 68 Ca 0.11 0.00 0.25 0.00 0.82 0.00 0.00 66.70 67.87 2d2n h VAL 68 Cb 0.16 0.26 -0.17 0.00 -1.52 0.00 0.00 31.29 30.02 2d2n h VAL 68 CO -0.23 0.00 0.04 -0.09 0.02 0.00 0.00 177.57 177.31 2d2n h ARG 69 N -0.77 0.05 0.12 1.57 2.43 -0.71 0.55 114.38 117.60 2d2n h ARG 69 Ca -0.03 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 2d2n h ARG 69 Cb 0.68 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2d2n h ARG 69 CO -0.04 0.03 -0.06 0.28 -1.51 0.00 0.00 179.97 178.67 2d2n h VAL 70 N 0.05 0.00 -0.87 0.20 2.07 -0.49 -2.04 116.25 115.17 2d2n h VAL 70 Ca 0.55 -0.13 0.32 0.00 0.82 0.00 0.00 66.70 68.27 2d2n h VAL 70 Cb 1.11 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.72 2d2n h VAL 70 CO -0.85 0.00 0.32 0.52 0.02 0.00 0.00 177.57 177.59 2d2n n VAL 71 N -2.78 -0.36 -0.09 2.57 0.31 0.41 0.14 118.33 118.52 2d2n n VAL 71 Ca -0.02 1.81 -0.11 0.00 -0.01 0.00 0.00 64.34 66.01 2d2n n VAL 71 Cb 0.06 -2.83 -0.04 0.00 -0.91 0.00 0.00 33.84 30.12 2d2n n VAL 71 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 2d2n h ASN 72 N 0.00 0.47 -0.35 4.52 -1.24 -0.94 -1.86 115.58 116.17 2d2n h ASN 72 Ca 0.67 -0.31 0.07 0.00 0.71 0.00 0.00 56.30 57.44 2d2n h ASN 72 Cb 1.67 -0.13 -0.07 0.00 0.73 0.00 0.00 38.32 40.52 2d2n h ASN 72 CO -0.71 0.66 -0.11 1.23 -1.29 0.00 0.00 177.43 177.21 2d2n h GLY 73 N 0.26 0.22 2.00 1.57 0.00 0.20 0.72 103.07 108.04 2d2n h GLY 73 Ca 0.08 0.14 -0.03 0.00 0.00 0.00 0.00 47.33 47.51 2d2n h GLY 73 CO 0.01 -0.15 -0.15 -2.00 0.00 0.00 0.00 176.54 174.26 2d2n h LEU 74 N -0.03 0.00 -0.04 3.11 6.46 -1.24 -0.74 115.31 122.84 2d2n h LEU 74 Ca 0.17 0.00 -0.26 0.00 -0.12 0.00 0.00 57.88 57.67 2d2n h LEU 74 Cb 0.29 0.00 0.02 0.00 -0.73 0.00 0.00 40.66 40.24 2d2n h LEU 74 CO -0.38 0.15 -1.04 -0.78 -0.62 0.00 0.00 178.44 175.77 2d2n h ASP 75 N 0.00 0.78 0.06 1.25 3.58 -0.16 -0.06 116.42 121.86 2d2n h ASP 75 Ca -0.00 -0.64 -0.01 0.00 0.42 0.00 0.00 57.03 56.80 2d2n h ASP 75 Cb 0.27 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 41.08 2d2n h ASP 75 CO 0.02 1.44 -0.05 0.58 -2.88 0.00 0.00 179.24 178.35 2d2n h VAL 76 N 0.32 0.91 0.10 2.25 2.07 0.17 -2.50 116.25 119.57 2d2n h VAL 76 Ca -0.12 -0.17 -0.31 0.00 0.82 0.00 0.00 66.70 66.92 2d2n h VAL 76 Cb 1.69 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 32.54 2d2n h VAL 76 CO 0.20 0.05 -1.66 0.00 0.02 0.00 0.00 177.57 176.17 2d2n h ALA 77 N 1.95 0.31 -0.32 1.67 0.00 -1.05 -3.28 119.26 118.54 2d2n h ALA 77 Ca -0.00 -1.25 0.09 0.00 0.00 0.00 0.00 54.91 53.75 2d2n h ALA 77 Cb 0.09 0.63 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2d2n h ALA 77 CO 0.01 1.03 0.36 0.82 0.00 0.00 0.00 179.25 181.46 2d2n h ILE 78 N -0.25 0.40 0.00 0.00 2.04 -0.84 0.69 117.51 119.55 2d2n h ILE 78 Ca -0.37 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.44 2d2n h ILE 78 Cb 1.81 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 38.60 2d2n h ILE 78 CO 0.02 0.00 -0.74 0.78 0.00 0.00 0.00 178.15 178.21 2d2n h ASN 79 N 0.00 0.00 0.82 1.72 -0.26 -1.55 -3.15 115.58 113.15 2d2n h ASN 79 Ca 0.15 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.89 2d2n h ASN 79 Cb 0.86 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.12 2d2n h ASN 79 CO -0.00 0.21 -0.17 0.23 -1.06 0.00 0.00 177.43 176.63 2d2n n MET 80 N -2.93 0.01 0.22 0.81 2.81 0.18 -3.91 117.12 114.32 2d2n n MET 80 Ca -0.01 -0.00 0.05 0.00 -1.81 0.00 0.00 57.70 55.93 2d2n n MET 80 Cb 0.64 -1.50 0.28 0.00 -0.71 0.00 0.00 33.22 31.93 2d2n n MET 80 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 2d2n h LEU 81 N 0.01 0.00 0.03 4.03 5.85 -1.37 0.52 115.31 124.38 2d2n h LEU 81 Ca 0.00 0.00 -0.38 0.00 0.84 0.00 0.00 57.88 58.34 2d2n h LEU 81 Cb 0.50 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.47 2d2n h LEU 81 CO 0.00 0.00 -2.31 0.59 -0.34 0.00 0.00 178.44 176.38 2d2n n ASN 82 N -2.17 1.70 -3.79 1.25 5.03 -1.25 -4.57 115.26 111.45 2d2n n ASN 82 Ca -0.01 -0.01 -0.40 0.00 0.87 0.00 0.00 54.58 55.03 2d2n n ASN 82 Cb 0.55 -0.32 0.00 0.00 -1.02 0.00 0.00 39.78 38.99 2d2n n ASN 82 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 2d2n n ASP 83 N -3.23 6.37 -0.34 6.41 4.64 0.18 -4.93 116.55 125.64 2d2n n ASP 83 Ca -0.39 -3.51 -0.08 0.00 -1.38 0.00 0.00 54.79 49.43 2d2n n ASP 83 Cb 1.03 -1.15 -0.06 0.00 -1.04 0.00 0.00 41.12 39.89 2d2n n ASP 83 CO 0.00 0.00 0.00 -2.65 -0.82 0.00 0.00 177.20 173.73 2d2n n PRO 84 N 0.80 -0.34 -0.32 -0.67 -0.02 -1.18 -1.15 135.00 132.12 2d2n n PRO 84 Ca 0.33 1.26 -0.05 0.00 -2.02 0.00 0.00 63.50 63.01 2d2n n PRO 84 Cb 0.32 -1.85 -0.02 0.00 -0.02 0.00 0.00 33.50 31.92 2d2n n PRO 84 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2d2n n ALA 85 N -3.41 -0.31 0.12 3.55 0.00 -1.26 0.42 120.51 119.62 2d2n n ALA 85 Ca 0.03 0.73 -0.13 0.00 0.00 0.00 0.00 53.44 54.06 2d2n n ALA 85 Cb 0.23 -0.23 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 2d2n n ALA 85 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2d2n h VAL 86 N 0.00 0.83 -0.62 0.00 2.07 -1.49 -2.84 116.25 114.20 2d2n h VAL 86 Ca 0.20 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.84 2d2n h VAL 86 Cb 0.40 0.83 -0.12 0.00 -1.52 0.00 0.00 31.29 30.88 2d2n h VAL 86 CO -0.76 0.00 -0.24 0.25 0.02 0.00 0.00 177.57 176.84 2d2n h LEU 87 N -0.22 -0.86 -0.93 2.57 5.85 0.37 -1.00 115.31 121.09 2d2n h LEU 87 Ca -0.02 0.21 0.17 0.00 0.84 0.00 0.00 57.88 59.08 2d2n h LEU 87 Cb 0.17 0.48 -0.17 0.00 0.37 0.00 0.00 40.66 41.52 2d2n h LEU 87 CO 0.03 -0.26 -0.28 0.78 -0.34 0.00 0.00 178.44 178.36 2d2n h ASN 88 N -0.08 -1.04 -0.07 1.25 2.35 -0.45 0.30 115.58 117.84 2d2n h ASN 88 Ca 0.28 0.28 -0.00 0.00 -0.55 0.00 0.00 56.30 56.31 2d2n h ASN 88 Cb 0.52 0.63 -0.00 0.00 0.05 0.00 0.00 38.32 39.51 2d2n h ASN 88 CO -0.68 -0.30 0.03 -0.33 -1.65 0.00 0.00 177.43 174.50 2d2n h GLU 89 N -0.01 0.10 -0.95 0.81 3.07 -1.24 0.40 114.58 116.77 2d2n h GLU 89 Ca 0.41 -0.02 0.14 0.00 -0.50 0.00 0.00 59.36 59.39 2d2n h GLU 89 Cb 0.65 -0.02 -0.08 0.00 -0.84 0.00 0.00 28.75 28.47 2d2n h GLU 89 CO -0.95 0.24 0.60 0.37 -1.40 0.00 0.00 179.01 177.87 2d2n h GLN 90 N -0.06 0.79 0.07 2.33 5.75 0.06 1.04 115.11 125.10 2d2n h GLN 90 Ca 0.02 -0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.47 2d2n h GLN 90 Cb 0.18 -0.18 0.00 0.00 1.07 0.00 0.00 27.48 28.55 2d2n h GLN 90 CO -0.00 0.52 -0.03 -0.07 -2.65 0.00 0.00 178.83 176.60 2d2n h LEU 91 N 0.81 -0.08 -1.40 -2.39 3.38 -0.33 -1.40 115.31 113.90 2d2n h LEU 91 Ca 0.48 -0.52 0.44 0.00 0.09 0.00 0.00 57.88 58.37 2d2n h LEU 91 Cb 0.65 0.02 -0.13 0.00 0.09 0.00 0.00 40.66 41.29 2d2n h LEU 91 CO -0.25 0.60 0.86 0.00 0.09 0.00 0.00 178.44 179.74 2d2n h ALA 92 N -0.22 2.75 -3.00 1.53 0.00 0.10 0.76 119.26 121.19 2d2n h ALA 92 Ca -0.01 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2d2n h ALA 92 Cb 0.60 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2d2n h ALA 92 CO 0.02 -1.40 0.00 1.58 0.00 0.00 0.00 179.25 179.45 2d2n n HIS 93 N -4.71 0.00 -0.16 0.00 -0.00 0.35 -3.12 115.22 107.59 2d2n n HIS 93 Ca 0.38 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 58.23 2d2n n HIS 93 Cb 1.46 0.00 0.21 0.00 -0.00 0.00 0.00 29.99 31.66 2d2n n HIS 93 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 2d2n n LEU 94 N -0.32 0.04 0.00 0.27 4.77 -0.53 0.07 117.00 121.31 2d2n n LEU 94 Ca 0.00 0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.36 2d2n n LEU 94 Cb 0.00 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 40.90 2d2n n LEU 94 CO 0.00 -0.40 0.18 -0.24 -1.33 0.00 0.00 177.39 175.60 2d2n n SER 95 N -3.04 0.00 -0.19 -1.43 2.88 0.25 -2.86 113.62 109.22 2d2n n SER 95 Ca 0.12 0.36 0.18 0.00 -1.33 0.00 0.00 58.87 58.20 2d2n n SER 95 Cb 0.50 0.00 0.31 0.00 -0.75 0.00 0.00 64.21 64.27 2d2n n SER 95 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2d2n n ALA 96 N -1.26 0.58 0.31 -1.46 0.00 0.11 0.34 120.51 119.13 2d2n n ALA 96 Ca 0.00 0.46 0.16 0.00 0.00 0.00 0.00 53.44 54.05 2d2n n ALA 96 Cb 0.00 -0.50 0.70 0.00 0.00 0.00 0.00 19.45 19.65 2d2n n ALA 96 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2d2n h GLN 97 N 0.00 0.00 0.00 0.00 4.20 -1.40 0.24 115.11 118.15 2d2n h GLN 97 Ca 0.42 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.82 2d2n h GLN 97 Cb 1.24 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.96 2d2n h GLN 97 CO -0.30 0.00 -2.28 0.72 -0.67 0.00 0.00 178.83 176.30 2d2n n HIS 98 N -2.68 0.00 0.09 2.96 8.25 1.05 -3.76 115.22 121.13 2d2n n HIS 98 Ca 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.47 2d2n n HIS 98 Cb 0.19 -0.89 0.33 0.00 1.12 0.00 0.00 29.99 30.74 2d2n n HIS 98 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 2d2n h GLN 99 N 0.00 0.29 0.00 -0.41 4.20 -1.03 -1.47 115.11 116.69 2d2n h GLN 99 Ca -0.46 -0.08 -0.05 0.00 0.06 0.00 0.00 58.65 58.12 2d2n h GLN 99 Cb 2.03 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.77 2d2n h GLN 99 CO 0.02 0.47 -0.25 0.00 -0.67 0.00 0.00 178.83 178.40 2d2n h ALA 100 N 1.55 1.38 -1.87 3.87 0.00 -1.09 -3.39 119.26 119.71 2d2n h ALA 100 Ca 0.05 -0.23 -0.61 0.00 0.00 0.00 0.00 54.91 54.12 2d2n h ALA 100 Cb 0.47 -0.04 -0.12 0.00 0.00 0.00 0.00 17.79 18.11 2d2n h ALA 100 CO 0.03 0.32 0.55 1.03 0.00 0.00 0.00 179.25 181.18 2d2n s ARG 101 N -4.23 3.40 0.20 0.00 3.00 -0.56 -5.00 118.95 115.77 2d2n s ARG 101 Ca -0.03 -0.11 -0.33 0.00 0.00 0.00 0.00 55.73 55.27 2d2n s ARG 101 Cb 0.14 -4.00 -0.13 0.00 0.00 0.00 0.00 34.95 30.96 2d2n s ARG 101 CO 0.67 -1.36 1.61 0.00 0.00 0.00 0.00 175.30 176.22 2d2n n ALA 102 N 7.29 1.94 0.00 2.13 0.00 -1.26 -4.09 120.51 126.52 2d2n n ALA 102 Ca 0.03 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.89 2d2n n ALA 102 Cb 0.48 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.52 2d2n n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2d2n n GLY 103 N 3.36 0.98 0.00 0.00 0.00 -1.26 -5.04 105.19 103.23 2d2n n GLY 103 Ca 0.15 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.14 2d2n n GLY 103 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2d2n n VAL 104 N 0.00 0.00 -4.40 1.61 3.14 -1.26 -4.91 118.33 112.51 2d2n n VAL 104 Ca 0.00 0.00 -0.26 0.00 -2.96 0.00 0.00 64.34 61.12 2d2n n VAL 104 Cb 0.00 0.00 -0.09 0.00 -1.06 0.00 0.00 33.84 32.69 2d2n n VAL 104 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2d2n s ALA 105 N 0.00 3.35 0.03 1.55 0.00 -1.26 -4.88 121.76 120.55 2d2n s ALA 105 Ca 0.00 -2.22 -0.06 0.00 0.00 0.00 0.00 51.96 49.68 2d2n s ALA 105 Cb 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 23.12 23.03 2d2n s ALA 105 CO 0.00 -0.14 0.91 0.00 0.00 0.00 0.00 175.76 176.53 2d2n n ALA 106 N -1.08 -0.13 -0.15 0.00 0.00 -1.26 -0.65 120.51 117.23 2d2n n ALA 106 Ca -0.03 0.18 0.09 0.00 0.00 0.00 0.00 53.44 53.67 2d2n n ALA 106 Cb 0.66 0.27 0.17 0.00 0.00 0.00 0.00 19.45 20.55 2d2n n ALA 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d2n n ALA 107 N -2.95 0.30 -0.16 0.00 0.00 -1.26 0.66 120.51 117.10 2d2n n ALA 107 Ca 0.00 0.46 0.10 0.00 0.00 0.00 0.00 53.44 54.00 2d2n n ALA 107 Cb 0.05 -0.38 0.42 0.00 0.00 0.00 0.00 19.45 19.55 2d2n n ALA 107 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2d2n h HIS 108 N 0.00 0.64 0.00 0.00 -0.00 -1.29 -0.24 115.15 114.25 2d2n h HIS 108 Ca 0.30 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.69 2d2n h HIS 108 Cb 0.69 -0.21 0.00 0.00 -0.00 0.00 0.00 27.41 27.90 2d2n h HIS 108 CO -0.15 0.30 0.00 1.19 -0.00 0.00 0.00 177.93 179.27 2d2n n PHE 109 N -4.49 0.00 -0.05 2.45 3.01 0.21 -1.09 117.46 117.50 2d2n n PHE 109 Ca 0.12 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.43 2d2n n PHE 109 Cb 0.34 -0.02 -0.14 0.00 -0.01 0.00 0.00 39.48 39.65 2d2n n PHE 109 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2d2n n ASP 110 N -1.02 1.37 -0.07 4.37 8.00 -0.11 -1.83 116.55 127.27 2d2n n ASP 110 Ca 0.17 0.14 -0.14 0.00 0.71 0.00 0.00 54.79 55.67 2d2n n ASP 110 Cb 0.09 -0.20 -0.06 0.00 -0.02 0.00 0.00 41.12 40.92 2d2n n ASP 110 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2d2n h VAL 111 N 0.02 1.33 -0.12 2.53 2.07 -1.34 -2.27 116.25 118.47 2d2n h VAL 111 Ca -0.45 -1.58 -0.07 0.00 0.82 0.00 0.00 66.70 65.42 2d2n h VAL 111 Cb 2.04 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 33.63 2d2n h VAL 111 CO 0.03 0.49 -0.25 -0.03 0.02 0.00 0.00 177.57 177.83 2d2n h MET 112 N 0.29 0.22 0.20 1.57 1.85 -1.26 0.03 114.93 117.84 2d2n h MET 112 Ca 0.01 -0.07 -0.01 0.00 -0.61 0.00 0.00 59.70 59.03 2d2n h MET 112 Cb 0.95 -0.02 -0.00 0.00 0.43 0.00 0.00 31.60 32.96 2d2n h MET 112 CO 0.08 0.46 -0.13 0.00 -0.40 0.00 0.00 176.91 176.92 2d2n h ALA 113 N 1.55 -0.97 0.00 0.39 0.00 -1.09 -2.43 119.26 116.71 2d2n h ALA 113 Ca 0.03 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2d2n h ALA 113 Cb 0.56 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 2d2n h ALA 113 CO 0.04 -0.96 -0.01 1.05 0.00 0.00 0.00 179.25 179.36 2d2n h GLU 114 N -0.32 0.00 0.49 0.00 4.11 -1.31 -2.16 114.58 115.40 2d2n h GLU 114 Ca -0.03 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.38 2d2n h GLU 114 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2d2n h GLU 114 CO 0.02 0.01 -0.24 0.00 0.07 0.00 0.00 179.01 178.88 2d2n h ALA 115 N 1.99 -0.66 -0.89 1.06 0.00 -0.69 -2.33 119.26 117.73 2d2n h ALA 115 Ca -0.00 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.78 2d2n h ALA 115 Cb 0.11 0.26 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 2d2n h ALA 115 CO 0.00 -0.84 0.58 0.74 0.00 0.00 0.00 179.25 179.73 2d2n h PHE 116 N -0.73 1.09 0.00 0.00 -1.00 -0.95 -1.74 116.94 113.61 2d2n h PHE 116 Ca -0.07 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.74 2d2n h PHE 116 Cb 0.54 -0.36 0.00 0.00 3.61 0.00 0.00 35.95 39.74 2d2n h PHE 116 CO -0.03 0.64 0.13 0.00 -1.61 0.00 0.00 178.31 177.45 2d2n n ALA 117 N -2.35 0.86 -0.09 2.45 0.00 -0.86 -1.64 120.51 118.87 2d2n n ALA 117 Ca 0.11 0.17 -0.21 0.00 0.00 0.00 0.00 53.44 53.51 2d2n n ALA 117 Cb 0.07 -1.08 -0.12 0.00 0.00 0.00 0.00 19.45 18.32 2d2n n ALA 117 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2d2n n GLU 118 N -2.16 0.67 0.16 0.00 2.13 -0.67 -4.69 120.64 116.07 2d2n n GLU 118 Ca -0.01 0.22 -0.13 0.00 0.66 0.00 0.00 57.16 57.90 2d2n n GLU 118 Cb 0.16 -1.58 -0.08 0.00 0.27 0.00 0.00 31.44 30.21 2d2n n GLU 118 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2d2n h VAL 119 N -0.17 0.64 -0.96 6.31 2.07 -1.11 -3.39 116.25 119.64 2d2n h VAL 119 Ca -0.54 -0.66 0.13 0.00 0.82 0.00 0.00 66.70 66.44 2d2n h VAL 119 Cb 1.86 0.95 -0.14 0.00 -1.52 0.00 0.00 31.29 32.44 2d2n h VAL 119 CO -0.09 0.12 -0.45 0.23 0.02 0.00 0.00 177.57 177.40 2d2n n MET 120 N -5.12 -0.30 0.14 1.57 2.81 -0.93 0.27 117.12 115.57 2d2n n MET 120 Ca -0.09 1.47 0.07 0.00 -1.81 0.00 0.00 57.70 57.33 2d2n n MET 120 Cb 0.27 -2.17 0.35 0.00 -0.71 0.00 0.00 33.22 30.96 2d2n n MET 120 CO 0.00 0.00 0.00 -2.30 1.51 0.00 0.00 175.97 175.18 2d2n n PRO 121 N -5.34 0.09 0.00 0.03 -0.02 -1.26 0.18 135.00 128.68 2d2n n PRO 121 Ca 0.07 0.55 0.13 0.00 -2.02 0.00 0.00 63.50 62.23 2d2n n PRO 121 Cb 0.34 -2.00 0.23 0.00 -0.02 0.00 0.00 33.50 32.04 2d2n n PRO 121 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2d2n n GLN 122 N -1.99 1.99 0.00 -0.52 6.02 0.14 -4.56 117.38 118.46 2d2n n GLN 122 Ca -0.01 -1.52 0.00 0.00 -0.01 0.00 0.00 57.00 55.46 2d2n n GLN 122 Cb 0.23 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.03 2d2n n GLN 122 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2d2n n VAL 123 N 0.82 0.00 -3.47 5.09 0.31 0.47 -5.05 118.33 116.50 2d2n n VAL 123 Ca 0.15 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 64.10 2d2n n VAL 123 Cb 0.51 -1.12 -0.06 0.00 -0.91 0.00 0.00 33.84 32.26 2d2n n VAL 123 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2d2n s SER 124 N -4.77 6.68 0.25 4.52 1.04 0.48 -4.18 113.70 117.73 2d2n s SER 124 Ca 0.00 0.81 -0.30 0.00 0.48 0.00 0.00 55.95 56.94 2d2n s SER 124 Cb 0.00 -2.24 -0.09 0.00 0.10 0.00 0.00 66.02 63.79 2d2n s SER 124 CO 0.00 0.19 0.99 -0.94 0.98 0.00 0.00 173.24 174.46 2d2n s SER 125 N -0.27 7.53 -0.68 7.02 1.04 -1.26 -4.19 113.70 122.89 2d2n s SER 125 Ca 0.22 2.05 -0.15 0.00 0.48 0.00 0.00 55.95 58.55 2d2n s SER 125 Cb -0.15 -2.61 0.02 0.00 0.10 0.00 0.00 66.02 63.38 2d2n s SER 125 CO 0.10 0.06 0.63 0.00 0.98 0.00 0.00 173.24 175.01 2d2n s PHE 127 N -2.40 3.78 -0.82 0.00 5.36 -1.26 -4.91 117.98 117.72 2d2n s PHE 127 Ca 0.15 1.42 -0.13 0.00 -0.96 0.00 0.00 56.93 57.42 2d2n s PHE 127 Cb -0.02 -2.62 0.22 0.00 -0.34 0.00 0.00 43.02 40.26 2d2n s PHE 127 CO 0.89 0.47 0.75 -1.54 -1.46 0.00 0.00 175.22 174.34 2d2n s SER 128 N -1.33 6.64 0.22 6.13 1.04 -1.26 -4.92 113.70 120.21 2d2n s SER 128 Ca 0.36 -2.77 -0.09 0.00 0.48 0.00 0.00 55.95 53.93 2d2n s SER 128 Cb -0.20 -2.17 0.34 0.00 0.10 0.00 0.00 66.02 64.09 2d2n s SER 128 CO 0.22 -0.53 1.67 0.77 0.98 0.00 0.00 173.24 176.35 2d2n h SER 129 N 7.62 -0.20 0.34 7.02 4.64 -1.99 -1.46 113.55 129.53 2d2n h SER 129 Ca 0.10 0.15 -0.00 0.00 -0.47 0.00 0.00 61.79 61.57 2d2n h SER 129 Cb 1.02 0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 63.33 2d2n h SER 129 CO 0.76 -0.09 -0.46 0.44 -0.87 0.00 0.00 176.83 176.61 2d2n h ASP 130 N 0.16 -1.29 -0.75 4.97 3.45 -1.98 0.32 116.42 121.30 2d2n h ASP 130 Ca 0.35 0.12 0.08 0.00 0.43 0.00 0.00 57.03 58.01 2d2n h ASP 130 Cb 0.57 0.45 -0.05 0.00 -0.56 0.00 0.00 39.33 39.74 2d2n h ASP 130 CO -0.52 -0.58 0.49 0.28 -1.57 0.00 0.00 179.24 177.34 2d2n h SER 131 N -0.84 0.64 -0.23 6.45 0.02 -1.81 0.30 113.55 118.08 2d2n h SER 131 Ca -0.03 0.01 -0.14 0.00 -0.84 0.00 0.00 61.79 60.79 2d2n h SER 131 Cb 0.78 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 63.19 2d2n h SER 131 CO -0.13 0.40 -0.40 -0.25 -1.14 0.00 0.00 176.83 175.30 2d2n h TRP 132 N 0.72 0.86 0.00 3.45 2.91 -0.60 -0.01 115.95 123.27 2d2n h TRP 132 Ca 0.33 -0.30 -0.05 0.00 1.13 0.00 0.00 58.89 60.00 2d2n h TRP 132 Cb 0.36 -0.16 -0.01 0.00 -0.51 0.00 0.00 29.16 28.84 2d2n h TRP 132 CO -0.00 1.07 -0.24 -0.91 -1.03 0.00 0.00 178.44 177.32 2d2n h ASN 133 N 0.40 0.00 0.23 2.65 -0.26 0.15 0.60 115.58 119.35 2d2n h ASN 133 Ca 0.02 0.00 -0.34 0.00 -0.56 0.00 0.00 56.30 55.42 2d2n h ASN 133 Cb 1.00 0.00 0.03 0.00 -1.06 0.00 0.00 38.32 38.29 2d2n h ASN 133 CO 0.09 0.24 -1.56 -0.09 -1.06 0.00 0.00 177.43 175.06 2d2n h ARG 134 N 0.00 0.48 0.15 0.81 2.43 -0.83 -3.20 114.38 114.22 2d2n h ARG 134 Ca -0.00 -0.82 -0.35 0.00 -0.81 0.00 0.00 59.98 58.00 2d2n h ARG 134 Cb 0.71 0.31 -0.00 0.00 -0.42 0.00 0.00 29.97 30.57 2d2n h ARG 134 CO 0.03 1.39 -1.79 0.00 -1.51 0.00 0.00 179.97 178.10 2d2n h PHE 136 N 0.09 0.57 0.51 0.00 3.04 0.06 -0.98 116.94 120.22 2d2n h PHE 136 Ca -0.35 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 61.62 2d2n h PHE 136 Cb 2.07 -0.14 -0.02 0.00 2.56 0.00 0.00 35.95 40.42 2d2n h PHE 136 CO 0.09 0.13 -0.45 0.00 -2.02 0.00 0.00 178.31 176.06 2d2n h ALA 137 N 1.50 -1.14 -0.54 2.41 0.00 -1.67 -1.15 119.26 118.67 2d2n h ALA 137 Ca 0.39 -0.18 0.22 0.00 0.00 0.00 0.00 54.91 55.34 2d2n h ALA 137 Cb 0.52 0.66 -0.09 0.00 0.00 0.00 0.00 17.79 18.88 2d2n h ALA 137 CO -0.34 -1.16 0.30 -2.13 0.00 0.00 0.00 179.25 175.92 2d2n n ARG 138 N -5.21 -0.03 -0.06 0.00 3.00 -0.40 -0.34 116.66 113.62 2d2n n ARG 138 Ca -0.11 0.72 -0.02 0.00 -0.00 0.00 0.00 57.85 58.43 2d2n n ARG 138 Cb 0.42 -1.30 -0.01 0.00 0.00 0.00 0.00 32.46 31.57 2d2n n ARG 138 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.63 178.45 2d2n h ILE 139 N 0.00 0.09 -0.86 5.15 2.04 -1.03 -3.33 117.51 119.57 2d2n h ILE 139 Ca 0.45 -1.07 0.22 0.00 1.00 0.00 0.00 64.86 65.45 2d2n h ILE 139 Cb 1.21 0.17 -0.05 0.00 -0.74 0.00 0.00 36.82 37.41 2d2n h ILE 139 CO -0.39 0.03 0.59 0.00 0.00 0.00 0.00 178.15 178.38 2d2n h ALA 140 N -0.95 2.44 0.40 1.87 0.00 0.42 -1.27 119.26 122.16 2d2n h ALA 140 Ca -0.01 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2d2n h ALA 140 Cb 0.22 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2d2n h ALA 140 CO -0.00 -0.70 -0.31 -0.91 0.00 0.00 0.00 179.25 177.33 2d2n h ASN 141 N 0.24 -0.81 -0.23 0.00 -0.26 -0.85 -0.66 115.58 113.01 2d2n h ASN 141 Ca 0.44 0.06 0.07 0.00 -0.56 0.00 0.00 56.30 56.30 2d2n h ASN 141 Cb 1.33 0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 38.83 2d2n h ASN 141 CO -0.11 -0.44 0.35 1.23 -1.06 0.00 0.00 177.43 177.41 2d2n h GLY 142 N -0.68 0.00 0.00 2.83 0.00 -1.36 0.11 103.07 103.97 2d2n h GLY 142 Ca -0.05 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 2d2n h GLY 142 CO 0.01 0.00 -0.14 -2.22 0.00 0.00 0.00 176.54 174.19 2d2n h ILE 143 N 0.00 0.16 0.00 2.60 2.04 -1.02 -3.34 117.51 117.95 2d2n h ILE 143 Ca 0.11 -1.14 0.00 0.00 1.00 0.00 0.00 64.86 64.83 2d2n h ILE 143 Cb 0.81 0.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.22 2d2n h ILE 143 CO -0.00 0.06 0.00 -1.54 0.00 0.00 0.00 178.15 176.66 2d2n n SER 144 N -4.72 0.00 -4.74 1.72 3.41 -0.29 -4.27 113.62 104.73 2d2n n SER 144 Ca -0.03 -1.15 -0.41 0.00 -0.26 0.00 0.00 58.87 57.02 2d2n n SER 144 Cb 0.11 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.02 2d2n n SER 144 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2d2n s ALA 145 N -2.00 3.33 -0.89 7.33 0.00 -0.00 -2.81 121.76 126.71 2d2n s ALA 145 Ca 0.06 0.70 -0.01 0.00 0.00 0.00 0.00 51.96 52.71 2d2n s ALA 145 Cb 0.03 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.86 2d2n s ALA 145 CO 0.05 -0.04 0.15 0.41 0.00 0.00 0.00 175.76 176.33 2d2n n GLY 146 N 1.90 -0.03 0.00 0.00 0.00 -1.26 -4.93 105.19 100.87 2d2n n GLY 146 Ca 0.01 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.67 2d2n n GLY 146 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22