#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a5e h GLU 2 N 0.00 -0.45 -4.70 0.03 5.08 -2.06 -3.10 114.58 109.38 1a5e h GLU 2 Ca 0.00 0.03 -0.60 0.00 -1.00 0.00 0.00 59.36 57.79 1a5e h GLU 2 Cb 0.00 0.10 0.01 0.00 0.50 0.00 0.00 28.75 29.36 1a5e h GLU 2 CO 0.00 -0.30 2.15 -0.35 -1.00 0.00 0.00 179.01 179.51 1a5e n PRO 3 N -5.42 1.80 -1.48 2.33 -0.04 -1.26 -4.87 135.00 126.05 1a5e n PRO 3 Ca -0.04 -2.16 -0.17 0.00 -0.04 0.00 0.00 63.50 61.09 1a5e n PRO 3 Cb 0.34 -3.17 -0.15 0.00 -0.04 0.00 0.00 33.50 30.48 1a5e n PRO 3 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a5e n ALA 4 N 8.79 0.77 -3.37 0.55 0.00 -1.17 -3.03 120.51 123.04 1a5e n ALA 4 Ca 0.49 -1.10 -0.22 0.00 0.00 0.00 0.00 53.44 52.61 1a5e n ALA 4 Cb 0.42 -2.59 0.02 0.00 0.00 0.00 0.00 19.45 17.30 1a5e n ALA 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1a5e n ALA 5 N 10.62 -2.63 -1.00 0.00 0.00 -1.26 -4.98 120.51 121.26 1a5e n ALA 5 Ca 0.54 0.29 0.00 0.00 0.00 0.00 0.00 53.44 54.27 1a5e n ALA 5 Cb 0.28 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.71 1a5e n ALA 5 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a5e n GLY 6 N -0.89 -1.18 0.00 0.00 0.00 -1.17 -4.82 105.19 97.14 1a5e n GLY 6 Ca -0.09 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1a5e n GLY 6 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1a5e n SER 7 N 0.00 0.00 -4.87 1.61 7.64 -1.26 -4.77 113.62 111.96 1a5e n SER 7 Ca 0.00 0.85 -0.33 0.00 1.01 0.00 0.00 58.87 60.41 1a5e n SER 7 Cb 0.00 -0.41 -0.05 0.00 -1.01 0.00 0.00 64.21 62.73 1a5e n SER 7 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1a5e s SER 8 N -2.08 6.16 0.10 6.43 0.01 -1.26 -5.02 113.70 118.05 1a5e s SER 8 Ca 0.00 0.27 -0.27 0.00 1.31 0.00 0.00 55.95 57.26 1a5e s SER 8 Cb 0.00 -1.88 -0.09 0.00 0.21 0.00 0.00 66.02 64.26 1a5e s SER 8 CO 0.00 0.25 1.44 -0.03 0.41 0.00 0.00 173.24 175.31 1a5e h MET 9 N 3.74 -0.33 0.00 12.44 1.85 -1.90 -3.44 114.93 127.30 1a5e h MET 9 Ca -0.48 0.02 0.00 0.00 -0.61 0.00 0.00 59.70 58.63 1a5e h MET 9 Cb 1.18 0.08 0.00 0.00 0.43 0.00 0.00 31.60 33.29 1a5e h MET 9 CO 0.68 -0.22 0.00 -0.85 -0.40 0.00 0.00 176.91 176.12 1a5e n GLU 10 N -4.85 0.00 -1.98 0.39 0.28 -1.26 -4.76 120.64 108.45 1a5e n GLU 10 Ca -0.03 0.00 -0.34 0.00 -0.16 0.00 0.00 57.16 56.63 1a5e n GLU 10 Cb 0.28 0.00 0.02 0.00 1.43 0.00 0.00 31.44 33.17 1a5e n GLU 10 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 1a5e s PRO 11 N 0.00 3.09 0.27 3.44 0.04 -1.26 -4.94 135.00 135.64 1a5e s PRO 11 Ca 0.00 1.42 -0.30 0.00 0.04 0.00 0.00 61.00 62.16 1a5e s PRO 11 Cb 0.00 -1.99 -0.14 0.00 0.04 0.00 0.00 34.50 32.42 1a5e s PRO 11 CO 0.00 -1.03 1.27 0.43 0.04 0.00 0.00 177.00 177.71 1a5e n SER 12 N -1.98 2.28 -4.77 6.66 7.64 -1.26 -4.91 113.62 117.29 1a5e n SER 12 Ca 0.10 1.17 -0.39 0.00 1.01 0.00 0.00 58.87 60.76 1a5e n SER 12 Cb 0.52 -1.39 -0.03 0.00 -1.01 0.00 0.00 64.21 62.30 1a5e n SER 12 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1a5e s ALA 13 N -0.55 3.27 0.00 -0.43 0.00 -1.26 -4.73 121.76 118.06 1a5e s ALA 13 Ca 0.64 0.95 0.00 0.00 0.00 0.00 0.00 51.96 53.55 1a5e s ALA 13 Cb -0.66 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.09 1a5e s ALA 13 CO 0.55 -0.39 0.00 -3.47 0.00 0.00 0.00 175.76 172.45 1a5e n ASP 14 N 0.49 -0.00 -0.69 0.00 2.03 -1.26 -4.95 116.55 112.17 1a5e n ASP 14 Ca 0.02 0.00 0.52 0.00 0.52 0.00 0.00 54.79 55.86 1a5e n ASP 14 Cb 0.46 0.07 0.81 0.00 -0.72 0.00 0.00 41.12 41.74 1a5e n ASP 14 CO 0.00 0.00 0.00 -0.50 -1.92 0.00 0.00 177.20 174.78 1a5e h TRP 15 N 0.00 0.05 0.10 -0.67 6.55 -1.98 0.65 115.95 120.65 1a5e h TRP 15 Ca 0.00 0.00 -0.00 0.00 0.95 0.00 0.00 58.89 59.84 1a5e h TRP 15 Cb 0.00 -0.01 0.00 0.00 -0.86 0.00 0.00 29.16 28.29 1a5e h TRP 15 CO 0.00 -0.03 -0.05 -0.07 -1.05 0.00 0.00 178.44 177.25 1a5e h LEU 16 N 0.00 -0.11 -1.93 -4.49 3.38 -1.94 -1.40 115.31 108.81 1a5e h LEU 16 Ca 0.94 -0.42 -0.00 0.00 0.09 0.00 0.00 57.88 58.48 1a5e h LEU 16 Cb 3.70 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 44.47 1a5e h LEU 16 CO -0.05 0.52 0.01 0.00 0.09 0.00 0.00 178.44 179.01 1a5e h ALA 17 N -0.38 1.95 0.29 1.53 0.00 -0.21 -2.17 119.26 120.27 1a5e h ALA 17 Ca -0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1a5e h ALA 17 Cb 0.53 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1a5e h ALA 17 CO 0.02 0.04 -0.14 1.79 0.00 0.00 0.00 179.25 180.97 1a5e h THR 18 N 0.05 0.11 -0.30 0.00 1.35 -0.23 -3.00 112.91 110.89 1a5e h THR 18 Ca 0.01 -0.76 0.07 0.00 -0.55 0.00 0.00 66.41 65.18 1a5e h THR 18 Cb 0.02 0.18 -0.08 0.00 -1.73 0.00 0.00 68.15 66.54 1a5e h THR 18 CO -0.00 0.03 -0.31 0.00 -0.25 0.00 0.00 175.52 174.99 1a5e h ALA 19 N -1.02 -0.23 -0.61 6.62 0.00 -1.14 0.20 119.26 123.10 1a5e h ALA 19 Ca -0.04 0.08 0.12 0.00 0.00 0.00 0.00 54.91 55.07 1a5e h ALA 19 Cb 0.35 0.65 -0.12 0.00 0.00 0.00 0.00 17.79 18.67 1a5e h ALA 19 CO 0.07 -0.74 -0.16 0.00 0.00 0.00 0.00 179.25 178.42 1a5e h ALA 20 N 0.67 0.38 -0.37 0.00 0.00 -1.52 0.44 119.26 118.85 1a5e h ALA 20 Ca 0.14 0.23 -0.11 0.00 0.00 0.00 0.00 54.91 55.18 1a5e h ALA 20 Cb 0.53 0.48 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1a5e h ALA 20 CO -0.46 -0.44 -0.20 0.00 0.00 0.00 0.00 179.25 178.15 1a5e h ALA 21 N 1.57 0.95 -0.26 0.00 0.00 -1.12 0.12 119.26 120.52 1a5e h ALA 21 Ca 0.29 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1a5e h ALA 21 Cb 0.45 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1a5e h ALA 21 CO -0.63 0.61 0.00 0.54 0.00 0.00 0.00 179.25 179.77 1a5e n ARG 22 N -4.13 2.12 -3.24 0.00 1.74 0.61 -4.29 116.66 109.48 1a5e n ARG 22 Ca 0.00 -1.15 -0.10 0.00 -0.77 0.00 0.00 57.85 55.83 1a5e n ARG 22 Cb 0.41 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 1a5e n ARG 22 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1a5e n GLY 23 N 0.60 -1.18 2.24 -0.13 0.00 0.13 -4.97 105.19 101.88 1a5e n GLY 23 Ca 0.10 0.66 -0.23 0.00 0.00 0.00 0.00 46.02 46.55 1a5e n GLY 23 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a5e n ARG 24 N -1.68 1.08 0.30 1.61 1.74 -0.38 -4.98 116.66 114.34 1a5e n ARG 24 Ca -0.07 -3.49 -0.14 0.00 -0.77 0.00 0.00 57.85 53.38 1a5e n ARG 24 Cb 0.56 -1.47 -0.07 0.00 -1.02 0.00 0.00 32.46 30.46 1a5e n ARG 24 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1a5e h VAL 25 N 2.01 0.00 -1.32 1.55 2.07 -1.93 -2.16 116.25 116.47 1a5e h VAL 25 Ca 0.09 0.00 0.47 0.00 0.82 0.00 0.00 66.70 68.08 1a5e h VAL 25 Cb 0.85 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.48 1a5e h VAL 25 CO 0.53 0.00 0.83 -0.62 0.02 0.00 0.00 177.57 178.33 1a5e n GLU 26 N -4.65 -0.04 -0.03 1.57 1.02 -1.26 0.06 120.64 117.31 1a5e n GLU 26 Ca -0.10 1.26 -0.13 0.00 -0.02 0.00 0.00 57.16 58.17 1a5e n GLU 26 Cb 0.36 -2.46 -0.11 0.00 -0.02 0.00 0.00 31.44 29.22 1a5e n GLU 26 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1a5e h GLU 27 N 0.00 -0.01 -0.75 3.49 5.08 -1.84 -3.02 114.58 117.54 1a5e h GLU 27 Ca 0.87 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 59.20 1a5e h GLU 27 Cb 2.74 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 31.96 1a5e h GLU 27 CO -0.51 0.61 0.33 0.28 -1.00 0.00 0.00 179.01 178.72 1a5e h VAL 28 N -0.62 1.24 -0.93 3.13 2.07 0.23 0.18 116.25 121.56 1a5e h VAL 28 Ca -0.00 -0.72 0.11 0.00 0.82 0.00 0.00 66.70 66.91 1a5e h VAL 28 Cb 0.61 0.31 -0.07 0.00 -1.52 0.00 0.00 31.29 30.63 1a5e h VAL 28 CO 0.00 0.30 0.59 0.03 0.02 0.00 0.00 177.57 178.51 1a5e h ARG 29 N 1.08 0.85 0.01 1.57 -0.00 -1.01 0.20 114.38 117.08 1a5e h ARG 29 Ca 0.26 -0.05 -0.00 0.00 -0.50 0.00 0.00 59.98 59.68 1a5e h ARG 29 Cb 0.15 -0.19 0.00 0.00 0.00 0.00 0.00 29.97 29.93 1a5e h ARG 29 CO -0.03 0.56 -0.01 0.00 0.00 0.00 0.00 179.97 180.50 1a5e h ALA 30 N 1.56 -0.02 0.27 0.04 0.00 -1.20 -2.88 119.26 117.02 1a5e h ALA 30 Ca 0.45 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1a5e h ALA 30 Cb 0.50 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1a5e h ALA 30 CO -0.21 -0.08 -0.21 -0.07 0.00 0.00 0.00 179.25 178.68 1a5e h LEU 31 N -0.87 -0.56 -0.81 0.00 3.38 -0.13 0.77 115.31 117.10 1a5e h LEU 31 Ca -0.00 0.04 0.16 0.00 0.09 0.00 0.00 57.88 58.16 1a5e h LEU 31 Cb 0.79 0.17 -0.15 0.00 0.09 0.00 0.00 40.66 41.56 1a5e h LEU 31 CO 0.00 -0.30 -0.25 -0.07 0.09 0.00 0.00 178.44 177.92 1a5e h LEU 32 N -0.46 -0.90 -0.80 1.67 3.38 -0.80 1.79 115.31 119.18 1a5e h LEU 32 Ca -0.04 0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1a5e h LEU 32 Cb 0.39 0.55 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1a5e h LEU 32 CO 0.01 -0.28 0.00 -0.33 0.09 0.00 0.00 178.44 177.93 1a5e h GLU 33 N -0.02 0.00 -0.01 1.13 5.08 -1.27 -2.38 114.58 117.12 1a5e h GLU 33 Ca 0.37 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.73 1a5e h GLU 33 Cb 0.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1a5e h GLU 33 CO -0.84 0.00 -0.23 0.00 -1.00 0.00 0.00 179.01 176.93 1a5e n ALA 34 N -1.81 3.02 0.00 3.43 0.00 0.60 -4.87 120.51 120.88 1a5e n ALA 34 Ca 0.02 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1a5e n ALA 34 Cb 0.23 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.49 1a5e n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a5e n GLY 35 N 1.34 1.98 3.82 0.00 0.00 -0.68 -5.03 105.19 106.61 1a5e n GLY 35 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 1a5e n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a5e s ALA 36 N -2.00 2.31 0.18 4.61 0.00 -0.91 -4.98 121.76 120.98 1a5e s ALA 36 Ca 0.00 -0.27 -0.30 0.00 0.00 0.00 0.00 51.96 51.39 1a5e s ALA 36 Cb 0.00 -3.08 -0.08 0.00 0.00 0.00 0.00 23.12 19.96 1a5e s ALA 36 CO 0.00 -1.69 0.93 -0.51 0.00 0.00 0.00 175.76 174.49 1a5e s LEU 37 N -5.73 4.59 0.06 0.00 1.02 -1.26 -4.85 118.68 112.50 1a5e s LEU 37 Ca 0.61 1.86 -0.15 0.00 0.02 0.00 0.00 54.13 56.46 1a5e s LEU 37 Cb -0.14 -3.57 -0.24 0.00 0.02 0.00 0.00 46.19 42.26 1a5e s LEU 37 CO 0.54 0.08 1.16 1.55 0.02 0.00 0.00 176.35 179.70 1a5e h PRO 38 N 4.71 0.64 0.00 1.29 0.13 -1.89 -3.43 132.00 133.46 1a5e h PRO 38 Ca -0.44 -0.71 0.00 0.00 -0.87 0.00 0.00 66.00 63.97 1a5e h PRO 38 Cb 1.20 0.21 0.00 0.00 0.13 0.00 0.00 31.00 32.54 1a5e h PRO 38 CO 0.69 1.30 0.00 0.09 -0.23 0.00 0.00 178.00 179.85 1a5e n ASN 39 N -3.92 0.00 -3.16 1.44 4.13 -1.17 -2.76 115.26 109.82 1a5e n ASN 39 Ca -0.11 0.00 -0.04 0.00 1.68 0.00 0.00 54.58 56.11 1a5e n ASN 39 Cb 0.86 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 39.10 1a5e n ASN 39 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1a5e n ALA 40 N -2.07 -2.54 -2.13 5.41 0.00 -1.26 -4.41 120.51 113.51 1a5e n ALA 40 Ca 0.00 -0.03 -0.40 0.00 0.00 0.00 0.00 53.44 53.01 1a5e n ALA 40 Cb 0.00 -1.53 -0.03 0.00 0.00 0.00 0.00 19.45 17.89 1a5e n ALA 40 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1a5e s PRO 41 N -3.31 2.86 0.00 0.00 0.04 -1.26 -4.57 135.00 128.77 1a5e s PRO 41 Ca 0.02 0.61 0.00 0.00 0.04 0.00 0.00 61.00 61.67 1a5e s PRO 41 Cb -0.00 -4.31 0.00 0.00 0.04 0.00 0.00 34.50 30.23 1a5e s PRO 41 CO 0.77 -2.46 0.00 0.27 0.04 0.00 0.00 177.00 175.62 1a5e n ASN 42 N 11.69 0.00 -2.67 6.66 0.23 -1.26 -4.98 115.26 124.93 1a5e n ASN 42 Ca 0.18 0.00 -0.03 0.00 -0.53 0.00 0.00 54.58 54.20 1a5e n ASN 42 Cb 0.51 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.21 1a5e n ASN 42 CO 0.00 0.00 0.00 -0.24 -0.93 0.00 0.00 177.26 176.09 1a5e n SER 43 N 0.00 -7.51 0.00 0.53 2.88 -1.26 -3.33 113.62 104.94 1a5e n SER 43 Ca 0.00 0.93 0.00 0.00 -1.33 0.00 0.00 58.87 58.47 1a5e n SER 43 Cb 0.00 -5.01 0.00 0.00 -0.75 0.00 0.00 64.21 58.45 1a5e n SER 43 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 1a5e n TYR 44 N 0.19 0.00 -1.86 0.66 4.01 -1.26 -2.44 117.16 116.46 1a5e n TYR 44 Ca 0.05 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.60 1a5e n TYR 44 Cb 0.20 -1.35 -0.06 0.00 -0.31 0.00 0.00 39.34 37.82 1a5e n TYR 44 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1a5e n GLY 45 N -0.47 0.99 2.27 2.72 0.00 -1.21 -4.84 105.19 104.64 1a5e n GLY 45 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1a5e n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a5e n ARG 46 N -2.51 2.46 -0.81 1.61 5.12 -1.02 -4.73 116.66 116.78 1a5e n ARG 46 Ca -0.20 -3.10 0.11 0.00 -1.93 0.00 0.00 57.85 52.72 1a5e n ARG 46 Cb 0.64 -2.22 -0.03 0.00 -1.16 0.00 0.00 32.46 29.70 1a5e n ARG 46 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 1a5e n ARG 47 N -0.98 -1.63 0.05 5.56 3.00 -1.26 -0.32 116.66 121.08 1a5e n ARG 47 Ca 0.60 1.08 -0.06 0.00 -0.00 0.00 0.00 57.85 59.47 1a5e n ARG 47 Cb 1.11 -1.99 -0.11 0.00 0.00 0.00 0.00 32.46 31.47 1a5e n ARG 47 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.63 176.63 1a5e h PRO 48 N 0.00 0.00 0.00 -0.14 0.13 -1.80 -3.32 132.00 126.86 1a5e h PRO 48 Ca 0.02 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.91 1a5e h PRO 48 Cb 0.74 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.83 1a5e h PRO 48 CO 0.01 0.81 -1.90 -0.89 -0.23 0.00 0.00 178.00 175.79 1a5e n ILE 49 N -3.25 0.91 0.08 -3.56 5.41 -1.26 -4.36 119.36 113.32 1a5e n ILE 49 Ca -0.04 -0.44 0.04 0.00 1.00 0.00 0.00 62.75 63.32 1a5e n ILE 49 Cb 0.94 -0.89 0.22 0.00 -0.71 0.00 0.00 39.64 39.20 1a5e n ILE 49 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 176.55 178.22 1a5e n GLN 50 N -2.75 0.05 -0.09 0.38 7.27 -1.12 -0.31 117.38 120.81 1a5e n GLN 50 Ca -0.25 0.54 0.09 0.00 0.07 0.00 0.00 57.00 57.44 1a5e n GLN 50 Cb 0.85 -1.66 0.13 0.00 2.41 0.00 0.00 30.24 31.97 1a5e n GLN 50 CO 0.00 0.00 0.00 1.55 0.07 0.00 0.00 177.06 178.68 1a5e n VAL 51 N -1.77 0.34 -1.42 1.69 3.14 0.57 -4.86 118.33 116.01 1a5e n VAL 51 Ca -0.00 -0.67 -0.30 0.00 -2.96 0.00 0.00 64.34 60.41 1a5e n VAL 51 Cb 0.02 1.07 0.12 0.00 -1.06 0.00 0.00 33.84 33.99 1a5e n VAL 51 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1a5e s MET 52 N -1.28 1.53 0.00 1.45 0.23 0.57 -3.61 119.30 118.19 1a5e s MET 52 Ca 0.25 0.61 0.06 0.00 -1.03 0.00 0.00 55.69 55.58 1a5e s MET 52 Cb 0.16 -1.86 0.28 0.00 -1.53 0.00 0.00 34.83 31.88 1a5e s MET 52 CO 0.22 -2.00 1.07 -0.12 -2.03 0.00 0.00 175.02 172.16 1a5e n MET 53 N -3.69 0.06 -1.30 3.16 1.56 0.37 -4.72 117.12 112.57 1a5e n MET 53 Ca 0.07 0.27 -0.12 0.00 -0.27 0.00 0.00 57.70 57.65 1a5e n MET 53 Cb 0.57 -1.50 -0.05 0.00 2.15 0.00 0.00 33.22 34.38 1a5e n MET 53 CO 0.00 0.00 0.00 -1.33 -0.73 0.00 0.00 175.97 173.91 1a5e n MET 54 N -1.34 -1.55 0.00 2.12 2.81 -1.26 -4.72 117.12 113.19 1a5e n MET 54 Ca 0.02 0.83 0.04 0.00 -1.81 0.00 0.00 57.70 56.79 1a5e n MET 54 Cb 0.05 -5.09 0.03 0.00 -0.71 0.00 0.00 33.22 27.50 1a5e n MET 54 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1a5e n GLY 55 N -0.00 -0.62 2.47 3.03 0.00 -1.26 -4.59 105.19 104.22 1a5e n GLY 55 Ca -0.12 -0.22 -0.29 0.00 0.00 0.00 0.00 46.02 45.39 1a5e n GLY 55 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1a5e s SER 56 N -0.72 2.82 0.61 1.61 0.01 -1.26 -4.97 113.70 111.79 1a5e s SER 56 Ca 0.09 -2.32 0.29 0.00 1.31 0.00 0.00 55.95 55.32 1a5e s SER 56 Cb 0.06 -0.44 1.54 0.00 0.21 0.00 0.00 66.02 67.40 1a5e s SER 56 CO 0.11 -0.29 1.94 0.00 0.41 0.00 0.00 173.24 175.41 1a5e h ALA 57 N 6.83 1.92 -0.42 1.44 0.00 -1.89 -1.12 119.26 126.02 1a5e h ALA 57 Ca 0.08 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.05 1a5e h ALA 57 Cb 0.96 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.71 1a5e h ALA 57 CO 0.29 -0.55 0.05 0.00 0.00 0.00 0.00 179.25 179.03 1a5e h ARG 58 N 0.00 0.17 -0.41 0.00 2.47 -1.93 -0.46 114.38 114.21 1a5e h ARG 58 Ca 0.14 -0.01 0.08 0.00 -1.26 0.00 0.00 59.98 58.93 1a5e h ARG 58 Cb 0.94 -0.04 -0.07 0.00 -1.65 0.00 0.00 29.97 29.15 1a5e h ARG 58 CO -0.00 0.11 -0.06 0.28 0.56 0.00 0.00 179.97 180.86 1a5e h VAL 59 N 0.17 0.63 -0.20 2.04 2.07 -1.60 -0.34 116.25 119.02 1a5e h VAL 59 Ca 0.21 -0.01 0.06 0.00 0.82 0.00 0.00 66.70 67.77 1a5e h VAL 59 Cb 0.28 0.58 -0.07 0.00 -1.52 0.00 0.00 31.29 30.56 1a5e h VAL 59 CO -0.30 0.01 -0.25 0.00 0.02 0.00 0.00 177.57 177.04 1a5e h ALA 60 N 1.39 -0.18 -0.67 1.67 0.00 -1.22 -0.36 119.26 119.88 1a5e h ALA 60 Ca 0.20 0.06 0.14 0.00 0.00 0.00 0.00 54.91 55.31 1a5e h ALA 60 Cb 0.30 0.51 -0.11 0.00 0.00 0.00 0.00 17.79 18.50 1a5e h ALA 60 CO -0.39 -0.69 0.08 1.49 0.00 0.00 0.00 179.25 179.73 1a5e h GLU 61 N -0.28 0.18 0.00 0.00 4.81 0.18 1.11 114.58 120.58 1a5e h GLU 61 Ca 0.12 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1a5e h GLU 61 Cb 0.47 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.81 1a5e h GLU 61 CO -0.37 0.12 0.00 -0.11 -0.73 0.00 0.00 179.01 177.92 1a5e n LEU 62 N -5.23 0.00 -0.09 1.64 0.00 -0.22 -0.42 117.00 112.67 1a5e n LEU 62 Ca 0.11 0.78 -0.06 0.00 0.00 0.00 0.00 56.01 56.84 1a5e n LEU 62 Cb 0.40 -0.28 0.00 0.00 0.00 0.00 0.00 43.42 43.55 1a5e n LEU 62 CO 0.11 -0.28 0.81 -0.07 0.00 0.00 0.00 177.39 177.97 1a5e h LEU 63 N 0.00 -0.28 0.01 -1.96 3.38 -1.17 -1.47 115.31 113.82 1a5e h LEU 63 Ca 0.00 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1a5e h LEU 63 Cb 0.00 0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 1a5e h LEU 63 CO 0.00 -0.10 -0.04 0.25 0.09 0.00 0.00 178.44 178.64 1a5e h LEU 64 N 0.01 -0.13 -1.76 1.67 6.46 0.13 1.47 115.31 123.16 1a5e h LEU 64 Ca 0.16 0.01 0.06 0.00 -0.12 0.00 0.00 57.88 57.99 1a5e h LEU 64 Cb 0.24 0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.21 1a5e h LEU 64 CO -0.33 -0.04 0.48 0.17 -0.62 0.00 0.00 178.44 178.10 1a5e h LEU 65 N -0.06 0.00 0.02 2.25 8.10 -0.68 -0.22 115.31 124.72 1a5e h LEU 65 Ca -0.00 0.00 -0.11 0.00 0.11 0.00 0.00 57.88 57.88 1a5e h LEU 65 Cb 0.06 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.27 1a5e h LEU 65 CO -0.03 0.00 -0.60 0.45 -4.11 0.00 0.00 178.44 174.15 1a5e h HIS 66 N 0.00 0.07 0.00 0.17 3.86 0.18 -3.48 115.15 115.95 1a5e h HIS 66 Ca 0.10 -0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.25 1a5e h HIS 66 Cb 1.06 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.53 1a5e h HIS 66 CO 0.00 1.23 0.00 0.41 0.86 0.00 0.00 177.93 180.43 1a5e n GLY 67 N 1.57 0.00 1.42 2.45 0.00 0.48 -4.85 105.19 106.25 1a5e n GLY 67 Ca -0.19 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.71 1a5e n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a5e n ALA 68 N 0.00 -1.28 -3.05 4.61 0.00 0.23 -3.06 120.51 117.96 1a5e n ALA 68 Ca 0.00 -0.66 -0.32 0.00 0.00 0.00 0.00 53.44 52.46 1a5e n ALA 68 Cb 0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 19.45 19.37 1a5e n ALA 68 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1a5e n GLU 69 N -2.76 3.57 0.01 0.00 1.02 -1.26 -4.78 120.64 116.44 1a5e n GLU 69 Ca 0.06 -4.73 0.08 0.00 -0.02 0.00 0.00 57.16 52.55 1a5e n GLU 69 Cb 0.24 -2.32 0.34 0.00 -0.02 0.00 0.00 31.44 29.68 1a5e n GLU 69 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1a5e n PRO 70 N 0.36 0.01 -0.06 3.49 -0.04 -1.26 -2.76 135.00 134.74 1a5e n PRO 70 Ca 0.33 0.24 -0.05 0.00 -0.04 0.00 0.00 63.50 63.98 1a5e n PRO 70 Cb 0.37 -1.52 -0.10 0.00 -0.04 0.00 0.00 33.50 32.20 1a5e n PRO 70 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1a5e n ASN 71 N -1.55 1.97 -4.92 3.54 2.85 -1.26 -3.93 115.26 111.97 1a5e n ASN 71 Ca 0.04 0.00 -0.27 0.00 -0.11 0.00 0.00 54.58 54.24 1a5e n ASN 71 Cb 0.19 0.88 -0.01 0.00 1.24 0.00 0.00 39.78 42.07 1a5e n ASN 71 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1a5e n ALA 73 N -1.81 0.00 -2.73 0.00 0.00 -1.26 -4.21 120.51 110.51 1a5e n ALA 73 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.09 1a5e n ALA 73 Cb 0.55 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.92 1a5e n ALA 73 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1a5e s ASP 74 N 1.00 5.42 0.11 0.00 2.15 -1.26 -4.92 116.67 119.18 1a5e s ASP 74 Ca 0.00 0.12 0.23 0.00 0.43 0.00 0.00 52.55 53.33 1a5e s ASP 74 Cb 0.00 -1.53 0.90 0.00 -0.30 0.00 0.00 42.92 41.99 1a5e s ASP 74 CO 0.00 0.32 1.70 -0.81 -0.17 0.00 0.00 175.17 176.21 1a5e n PRO 75 N 1.61 0.11 0.00 4.34 -0.04 -1.26 -0.24 135.00 139.53 1a5e n PRO 75 Ca -0.16 0.23 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 1a5e n PRO 75 Cb 0.53 -1.66 0.00 0.00 -0.04 0.00 0.00 33.50 32.33 1a5e n PRO 75 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a5e n ALA 76 N -1.63 -0.00 0.85 0.55 0.00 -1.26 -4.55 120.51 114.46 1a5e n ALA 76 Ca 0.04 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.58 1a5e n ALA 76 Cb 0.28 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.77 1a5e n ALA 76 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1a5e n THR 77 N -1.82 0.00 -1.58 0.00 -1.04 -1.26 -4.83 114.28 103.76 1a5e n THR 77 Ca 0.00 -0.39 -0.17 0.00 -2.04 0.00 0.00 64.05 61.45 1a5e n THR 77 Cb 0.00 1.32 -0.07 0.00 -1.82 0.00 0.00 70.33 69.76 1a5e n THR 77 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1a5e n LEU 78 N 0.49 -1.30 -4.55 -4.42 4.77 0.67 0.25 117.00 112.91 1a5e n LEU 78 Ca 0.10 0.39 -0.32 0.00 -0.03 0.00 0.00 56.01 56.14 1a5e n LEU 78 Cb 0.45 -2.46 -0.04 0.00 -2.33 0.00 0.00 43.42 39.04 1a5e n LEU 78 CO 0.19 -0.84 1.64 -0.89 -1.33 0.00 0.00 177.39 176.16 1a5e s THR 79 N -2.66 3.21 0.88 -5.08 2.01 -1.26 -4.40 115.64 108.34 1a5e s THR 79 Ca 0.00 0.02 -0.11 0.00 0.31 0.00 0.00 61.69 61.90 1a5e s THR 79 Cb 0.00 -3.54 0.12 0.00 0.01 0.00 0.00 72.50 69.09 1a5e s THR 79 CO 0.00 -0.52 1.09 -0.13 -0.69 0.00 0.00 174.62 174.37 1a5e s ARG 80 N 7.67 1.41 0.56 4.92 1.81 -1.26 -4.01 118.95 130.04 1a5e s ARG 80 Ca 0.80 0.88 0.34 0.00 -1.72 0.00 0.00 55.73 56.03 1a5e s ARG 80 Cb -0.13 -1.82 1.55 0.00 -0.45 0.00 0.00 34.95 34.10 1a5e s ARG 80 CO 0.17 -2.16 2.06 -1.00 -0.68 0.00 0.00 175.30 173.70 1a5e h PRO 81 N -1.49 0.00 -0.00 3.54 0.13 -1.79 -2.29 132.00 130.10 1a5e h PRO 81 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1a5e h PRO 81 Cb 1.28 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.41 1a5e h PRO 81 CO 0.54 0.05 0.00 0.28 -0.23 0.00 0.00 178.00 178.64 1a5e h VAL 82 N 0.00 0.73 0.05 1.56 2.07 -1.86 -1.20 116.25 117.60 1a5e h VAL 82 Ca -0.00 0.00 -0.24 0.00 0.82 0.00 0.00 66.70 67.28 1a5e h VAL 82 Cb 0.40 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.15 1a5e h VAL 82 CO 0.01 0.00 -1.13 0.45 0.02 0.00 0.00 177.57 176.91 1a5e h HIS 83 N 0.00 0.20 -0.66 1.57 3.86 -1.76 -3.13 115.15 115.24 1a5e h HIS 83 Ca 0.00 -0.15 -0.01 0.00 -1.16 0.00 0.00 60.37 59.06 1a5e h HIS 83 Cb 0.00 -0.01 -0.03 0.00 1.06 0.00 0.00 27.41 28.43 1a5e h HIS 83 CO 0.00 1.12 0.39 -0.44 0.86 0.00 0.00 177.93 179.86 1a5e h ASP 84 N 0.03 0.80 0.56 2.45 5.19 -1.32 1.39 116.42 125.52 1a5e h ASP 84 Ca -0.07 -0.07 -0.03 0.00 -0.62 0.00 0.00 57.03 56.24 1a5e h ASP 84 Cb 1.86 -0.20 0.01 0.00 0.18 0.00 0.00 39.33 41.18 1a5e h ASP 84 CO 0.16 0.63 -0.27 0.00 -3.12 0.00 0.00 179.24 176.64 1a5e h ALA 85 N 1.20 -1.19 -0.56 3.45 0.00 -1.55 -2.93 119.26 117.69 1a5e h ALA 85 Ca 0.23 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.99 1a5e h ALA 85 Cb -0.01 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1a5e h ALA 85 CO -0.04 -1.13 0.37 0.00 0.00 0.00 0.00 179.25 178.44 1a5e h ALA 86 N -1.64 1.65 -0.57 0.00 0.00 -1.48 0.30 119.26 117.51 1a5e h ALA 86 Ca -0.08 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 54.89 1a5e h ALA 86 Cb 0.58 -0.21 -0.11 0.00 0.00 0.00 0.00 17.79 18.05 1a5e h ALA 86 CO 0.13 0.31 -0.41 -0.09 0.00 0.00 0.00 179.25 179.20 1a5e h ARG 87 N 0.71 -0.21 -0.13 0.00 9.65 0.21 0.69 114.38 125.30 1a5e h ARG 87 Ca 0.21 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.11 1a5e h ARG 87 Cb -0.02 0.05 0.00 0.00 -1.39 0.00 0.00 29.97 28.61 1a5e h ARG 87 CO -0.05 -0.14 0.00 -1.91 2.80 0.00 0.00 179.97 180.67 1a5e n GLU 88 N -5.41 1.51 -1.94 0.20 2.13 -1.11 -4.87 120.64 111.15 1a5e n GLU 88 Ca 0.02 -0.77 -0.08 0.00 0.66 0.00 0.00 57.16 57.00 1a5e n GLU 88 Cb 0.35 -1.34 -0.01 0.00 0.27 0.00 0.00 31.44 30.71 1a5e n GLU 88 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1a5e n GLY 89 N 1.01 0.26 3.42 8.31 0.00 0.24 -4.97 105.19 113.45 1a5e n GLY 89 Ca 0.14 -0.60 -0.44 0.00 0.00 0.00 0.00 46.02 45.13 1a5e n GLY 89 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1a5e s PHE 90 N -2.36 3.05 0.00 1.61 2.19 1.00 -4.76 117.98 118.71 1a5e s PHE 90 Ca 0.00 -0.71 -0.20 0.00 0.33 0.00 0.00 56.93 56.35 1a5e s PHE 90 Cb 0.00 -3.65 -0.26 0.00 -1.31 0.00 0.00 43.02 37.80 1a5e s PHE 90 CO 0.00 -1.09 1.06 1.25 1.83 0.00 0.00 175.22 178.27 1a5e h LEU 91 N 9.68 0.57 -1.51 6.12 6.46 -1.91 -3.23 115.31 131.49 1a5e h LEU 91 Ca -0.28 -0.81 0.39 0.00 -0.12 0.00 0.00 57.88 57.06 1a5e h LEU 91 Cb 1.09 -0.18 -0.11 0.00 -0.73 0.00 0.00 40.66 40.74 1a5e h LEU 91 CO 1.00 1.31 0.85 0.44 -0.62 0.00 0.00 178.44 181.42 1a5e h ASP 92 N -0.10 0.25 -0.60 1.25 5.19 -1.97 1.01 116.42 121.45 1a5e h ASP 92 Ca -0.10 0.10 -0.10 0.00 -0.62 0.00 0.00 57.03 56.30 1a5e h ASP 92 Cb 1.46 0.07 -0.02 0.00 0.18 0.00 0.00 39.33 41.02 1a5e h ASP 92 CO 0.14 -0.08 -0.02 0.74 -3.12 0.00 0.00 179.24 176.90 1a5e h THR 93 N 0.15 1.27 0.67 0.35 2.02 -1.88 -3.14 112.91 112.35 1a5e h THR 93 Ca 0.74 -1.18 -0.03 0.00 0.77 0.00 0.00 66.41 66.71 1a5e h THR 93 Cb 2.37 0.82 0.01 0.00 -1.74 0.00 0.00 68.15 69.60 1a5e h THR 93 CO -0.31 0.43 -0.32 -0.07 0.37 0.00 0.00 175.52 175.62 1a5e h LEU 94 N 0.97 -0.77 -0.91 2.58 4.07 0.95 -2.63 115.31 119.57 1a5e h LEU 94 Ca 0.17 -0.01 0.15 0.00 0.08 0.00 0.00 57.88 58.27 1a5e h LEU 94 Cb 0.58 0.20 -0.15 0.00 1.08 0.00 0.00 40.66 42.37 1a5e h LEU 94 CO 0.03 -0.43 -0.33 0.52 -1.08 0.00 0.00 178.44 177.15 1a5e n VAL 95 N -5.41 -0.46 0.20 1.22 0.31 -0.96 -0.04 118.33 113.18 1a5e n VAL 95 Ca -0.13 2.12 -0.15 0.00 -0.01 0.00 0.00 64.34 66.18 1a5e n VAL 95 Cb 0.38 -2.83 -0.07 0.00 -0.91 0.00 0.00 33.84 30.40 1a5e n VAL 95 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1a5e h VAL 96 N 0.00 0.29 -0.91 2.52 2.07 -1.49 1.08 116.25 119.81 1a5e h VAL 96 Ca 0.34 0.00 0.25 0.00 0.82 0.00 0.00 66.70 68.12 1a5e h VAL 96 Cb 0.57 0.29 -0.15 0.00 -1.52 0.00 0.00 31.29 30.48 1a5e h VAL 96 CO -0.91 0.00 0.24 -0.07 0.02 0.00 0.00 177.57 176.84 1a5e h LEU 97 N -0.68 -0.03 0.00 2.57 4.07 -0.07 0.56 115.31 121.72 1a5e h LEU 97 Ca -0.01 0.21 -0.16 0.00 0.08 0.00 0.00 57.88 58.01 1a5e h LEU 97 Cb 0.64 0.29 -0.02 0.00 1.08 0.00 0.00 40.66 42.65 1a5e h LEU 97 CO -0.09 -0.20 -0.88 -0.74 -1.08 0.00 0.00 178.44 175.45 1a5e h HIS 98 N 0.17 0.00 0.00 1.13 2.76 -0.56 -2.46 115.15 116.19 1a5e h HIS 98 Ca 0.58 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.75 1a5e h HIS 98 Cb 1.22 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.18 1a5e h HIS 98 CO -0.27 0.69 0.00 -2.13 -1.30 0.00 0.00 177.93 174.91 1a5e n ARG 99 N -3.19 0.01 0.02 5.26 0.63 0.37 -4.33 116.66 115.42 1a5e n ARG 99 Ca -0.02 0.38 0.00 0.00 -0.92 0.00 0.00 57.85 57.30 1a5e n ARG 99 Cb 0.83 -1.53 0.00 0.00 0.45 0.00 0.00 32.46 32.21 1a5e n ARG 99 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1a5e n ALA 100 N -1.52 3.00 -3.15 5.13 0.00 -0.84 -5.03 120.51 118.10 1a5e n ALA 100 Ca 0.02 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.51 1a5e n ALA 100 Cb 0.09 0.01 -0.01 0.00 0.00 0.00 0.00 19.45 19.54 1a5e n ALA 100 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1a5e s GLY 101 N -3.79 -0.45 0.00 0.00 0.00 -0.95 -5.12 107.32 97.01 1a5e s GLY 101 Ca 0.00 2.66 0.00 0.00 0.00 0.00 0.00 44.72 47.38 1a5e s GLY 101 CO 0.00 3.89 0.00 0.00 0.00 0.00 0.00 173.10 176.99 1a5e n ALA 102 N 5.40 0.00 -3.15 3.20 0.00 -1.04 -3.98 120.51 120.94 1a5e n ALA 102 Ca -0.04 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.44 1a5e n ALA 102 Cb 0.55 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.99 1a5e n ALA 102 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1a5e s ARG 103 N 1.44 0.49 -1.09 0.00 3.52 -1.25 -4.82 118.95 117.23 1a5e s ARG 103 Ca 0.00 0.71 -0.04 0.00 -0.13 0.00 0.00 55.73 56.27 1a5e s ARG 103 Cb 0.00 0.38 0.30 0.00 -1.56 0.00 0.00 34.95 34.06 1a5e s ARG 103 CO 0.00 -0.69 1.59 1.28 -0.81 0.00 0.00 175.30 176.67 1a5e n LEU 104 N 5.41 6.63 -1.98 -0.88 4.32 -1.26 -4.48 117.00 124.75 1a5e n LEU 104 Ca 0.01 -5.19 -0.01 0.00 -0.02 0.00 0.00 56.01 50.80 1a5e n LEU 104 Cb 0.53 -1.28 0.02 0.00 -1.62 0.00 0.00 43.42 41.08 1a5e n LEU 104 CO -0.03 1.73 0.41 -0.67 -1.22 0.00 0.00 177.39 177.61 1a5e n ASP 105 N 1.34 -0.55 -3.51 -1.43 2.03 -1.26 -3.60 116.55 109.57 1a5e n ASP 105 Ca 0.31 -1.39 -0.13 0.00 0.52 0.00 0.00 54.79 54.10 1a5e n ASP 105 Cb 0.32 0.36 0.01 0.00 -0.72 0.00 0.00 41.12 41.09 1a5e n ASP 105 CO 0.00 0.00 0.00 0.55 -1.92 0.00 0.00 177.20 175.83 1a5e n VAL 106 N -0.40 0.00 -4.84 5.18 3.14 -1.26 -5.07 118.33 115.09 1a5e n VAL 106 Ca -0.09 -1.11 -0.26 0.00 -2.96 0.00 0.00 64.34 59.91 1a5e n VAL 106 Cb 0.61 -0.39 -0.16 0.00 -1.06 0.00 0.00 33.84 32.84 1a5e n VAL 106 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 1a5e s ARG 107 N -3.24 1.90 -0.55 1.45 0.52 -1.26 -4.44 118.95 113.33 1a5e s ARG 107 Ca 0.21 -0.60 -0.13 0.00 -0.52 0.00 0.00 55.73 54.69 1a5e s ARG 107 Cb -0.02 -1.61 -0.12 0.00 0.52 0.00 0.00 34.95 33.73 1a5e s ARG 107 CO 0.13 0.20 1.75 -3.47 0.02 0.00 0.00 175.30 173.93 1a5e n ASP 108 N 3.30 2.64 0.00 0.23 2.03 -1.25 -4.69 116.55 118.80 1a5e n ASP 108 Ca -0.19 -2.38 0.00 0.00 0.52 0.00 0.00 54.79 52.74 1a5e n ASP 108 Cb 0.53 -0.89 0.00 0.00 -0.72 0.00 0.00 41.12 40.04 1a5e n ASP 108 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1a5e n ALA 109 N 5.97 0.00 -1.00 -1.67 0.00 0.14 -4.03 120.51 119.92 1a5e n ALA 109 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1a5e n ALA 109 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.67 1a5e n ALA 109 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1a5e n TRP 110 N 0.00 0.00 0.00 0.00 8.01 -1.26 -4.82 117.44 119.37 1a5e n TRP 110 Ca 0.00 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.19 1a5e n TRP 110 Cb 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.30 1a5e n TRP 110 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1a5e n GLY 111 N -0.78 -2.02 0.00 6.99 0.00 -1.26 -5.12 105.19 103.00 1a5e n GLY 111 Ca 0.00 0.98 0.00 0.00 0.00 0.00 0.00 46.02 47.00 1a5e n GLY 111 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a5e n ARG 112 N 0.00 0.90 -3.86 1.61 1.74 -1.26 -4.92 116.66 110.87 1a5e n ARG 112 Ca 0.00 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.99 1a5e n ARG 112 Cb 0.00 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.39 1a5e n ARG 112 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1a5e s LEU 113 N 0.00 0.32 -0.03 0.55 2.96 -1.26 -3.88 118.68 117.35 1a5e s LEU 113 Ca 0.00 -0.69 -0.22 0.00 -0.22 0.00 0.00 54.13 52.99 1a5e s LEU 113 Cb 0.00 1.86 -0.16 0.00 0.50 0.00 0.00 46.19 48.40 1a5e s LEU 113 CO 0.00 -1.06 1.00 1.55 -1.32 0.00 0.00 176.35 176.53 1a5e h PRO 114 N 2.28 -0.31 0.00 0.98 0.13 -1.93 -3.15 132.00 130.00 1a5e h PRO 114 Ca -0.28 0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.86 1a5e h PRO 114 Cb 1.25 0.07 -0.00 0.00 0.13 0.00 0.00 31.00 32.45 1a5e h PRO 114 CO 0.38 0.06 -0.07 -0.24 -0.23 0.00 0.00 178.00 177.90 1a5e h VAL 115 N -0.84 0.65 -0.02 1.56 3.04 -1.92 -2.01 116.25 116.71 1a5e h VAL 115 Ca -0.03 -0.27 -0.03 0.00 -1.01 0.00 0.00 66.70 65.37 1a5e h VAL 115 Cb 0.51 1.16 -0.00 0.00 -2.01 0.00 0.00 31.29 30.95 1a5e h VAL 115 CO 0.05 0.06 -0.11 -0.78 -1.01 0.00 0.00 177.57 175.79 1a5e h ASP 116 N 0.00 0.03 0.14 3.17 3.58 -1.94 -2.30 116.42 119.09 1a5e h ASP 116 Ca -0.00 -0.00 -0.21 0.00 0.42 0.00 0.00 57.03 57.24 1a5e h ASP 116 Cb 0.16 -0.01 0.02 0.00 1.72 0.00 0.00 39.33 41.22 1a5e h ASP 116 CO 0.01 0.14 -0.94 -0.07 -2.88 0.00 0.00 179.24 175.50 1a5e h LEU 117 N 0.03 0.46 -0.55 2.28 3.38 -1.40 -2.92 115.31 116.59 1a5e h LEU 117 Ca 0.01 -0.93 0.10 0.00 0.09 0.00 0.00 57.88 57.14 1a5e h LEU 117 Cb 0.21 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 40.73 1a5e h LEU 117 CO 0.01 1.44 0.12 0.00 0.09 0.00 0.00 178.44 180.11 1a5e h ALA 118 N 0.06 0.64 -0.38 1.53 0.00 -1.45 0.49 119.26 120.14 1a5e h ALA 118 Ca -0.17 0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1a5e h ALA 118 Cb 1.68 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.60 1a5e h ALA 118 CO 0.14 -0.30 0.02 0.93 0.00 0.00 0.00 179.25 180.04 1a5e h GLU 119 N 0.26 0.59 0.00 0.00 4.39 -1.52 0.92 114.58 119.23 1a5e h GLU 119 Ca 0.28 -0.13 -0.09 0.00 0.34 0.00 0.00 59.36 59.76 1a5e h GLU 119 Cb 0.39 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1a5e h GLU 119 CO -0.36 0.60 -0.44 0.93 -1.16 0.00 0.00 179.01 178.58 1a5e h GLU 120 N 0.56 0.00 -0.20 2.33 5.08 -0.72 -3.18 114.58 118.45 1a5e h GLU 120 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1a5e h GLU 120 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1a5e h GLU 120 CO 0.01 0.44 0.00 1.28 -1.00 0.00 0.00 179.01 179.74 1a5e n LEU 121 N -3.30 3.09 -1.33 1.33 4.77 0.15 -4.97 117.00 116.74 1a5e n LEU 121 Ca 0.01 -1.26 -0.05 0.00 -0.03 0.00 0.00 56.01 54.69 1a5e n LEU 121 Cb 0.66 -0.12 0.02 0.00 -2.33 0.00 0.00 43.42 41.65 1a5e n LEU 121 CO 0.39 0.60 0.05 0.61 -1.33 0.00 0.00 177.39 177.71 1a5e n GLY 122 N 1.30 0.49 2.75 -0.72 0.00 0.43 -4.97 105.19 104.48 1a5e n GLY 122 Ca 0.15 -0.42 -0.36 0.00 0.00 0.00 0.00 46.02 45.39 1a5e n GLY 122 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1a5e n HIS 123 N -2.60 3.17 -0.36 1.61 -0.00 0.29 -4.85 115.22 112.48 1a5e n HIS 123 Ca -0.02 -2.84 -0.07 0.00 -0.00 0.00 0.00 57.72 54.79 1a5e n HIS 123 Cb 0.52 -0.90 -0.04 0.00 -0.00 0.00 0.00 29.99 29.57 1a5e n HIS 123 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1a5e h ARG 124 N 3.38 -0.05 -0.93 -0.41 2.47 -1.94 1.60 114.38 118.51 1a5e h ARG 124 Ca 0.44 0.00 0.27 0.00 -1.26 0.00 0.00 59.98 59.44 1a5e h ARG 124 Cb 0.35 0.01 -0.16 0.00 -1.65 0.00 0.00 29.97 28.53 1a5e h ARG 124 CO 1.14 -0.03 0.26 0.22 0.56 0.00 0.00 179.97 182.12 1a5e h ASP 125 N -0.05 -0.02 0.00 7.04 1.82 -1.93 0.43 116.42 123.71 1a5e h ASP 125 Ca 0.23 0.22 -0.15 0.00 -0.39 0.00 0.00 57.03 56.94 1a5e h ASP 125 Cb 0.51 0.30 -0.02 0.00 0.68 0.00 0.00 39.33 40.80 1a5e h ASP 125 CO -0.90 -0.23 -0.83 0.58 -1.61 0.00 0.00 179.24 176.24 1a5e h VAL 126 N 0.15 1.07 -0.47 2.25 2.07 -0.28 -3.14 116.25 117.89 1a5e h VAL 126 Ca 0.62 -2.11 0.10 0.00 0.82 0.00 0.00 66.70 66.12 1a5e h VAL 126 Cb 1.33 2.32 -0.09 0.00 -1.52 0.00 0.00 31.29 33.33 1a5e h VAL 126 CO -0.73 0.36 -0.15 0.00 0.02 0.00 0.00 177.57 177.07 1a5e h ALA 127 N -0.41 0.24 0.35 1.67 0.00 0.26 0.61 119.26 121.99 1a5e h ALA 127 Ca -0.22 0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1a5e h ALA 127 Cb 1.13 0.42 0.00 0.00 0.00 0.00 0.00 17.79 19.35 1a5e h ALA 127 CO -0.13 -0.49 -0.17 0.00 0.00 0.00 0.00 179.25 178.46 1a5e h ARG 128 N -0.05 -0.46 -0.98 0.00 -0.00 -0.34 -0.72 114.38 111.84 1a5e h ARG 128 Ca 0.23 0.03 0.25 0.00 -0.50 0.00 0.00 59.98 59.99 1a5e h ARG 128 Cb 0.39 0.10 -0.13 0.00 0.00 0.00 0.00 29.97 30.34 1a5e h ARG 128 CO -0.51 -0.30 0.55 -0.92 0.00 0.00 0.00 179.97 178.79 1a5e h TYR 129 N -0.52 0.92 0.42 3.04 3.20 -1.47 -0.70 116.97 121.86 1a5e h TYR 129 Ca -0.05 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.84 1a5e h TYR 129 Cb 0.36 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.38 1a5e h TYR 129 CO 0.12 -0.01 -0.20 -0.07 -1.64 0.00 0.00 178.16 176.37 1a5e h LEU 130 N 0.49 -0.47 -1.33 2.82 3.38 0.38 -2.27 115.31 118.32 1a5e h LEU 130 Ca 0.64 0.01 0.35 0.00 0.09 0.00 0.00 57.88 58.97 1a5e h LEU 130 Cb 1.28 0.12 -0.12 0.00 0.09 0.00 0.00 40.66 42.03 1a5e h LEU 130 CO -0.51 -0.33 0.73 -0.09 0.09 0.00 0.00 178.44 178.33 1a5e h ARG 131 N -0.57 0.24 -0.10 1.13 2.43 0.44 2.08 114.38 120.03 1a5e h ARG 131 Ca -0.06 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.04 1a5e h ARG 131 Cb 0.43 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.93 1a5e h ARG 131 CO 0.09 0.16 -0.16 0.00 -1.51 0.00 0.00 179.97 178.55 1a5e h ALA 132 N 1.65 0.16 -0.00 2.80 0.00 -1.29 0.25 119.26 122.82 1a5e h ALA 132 Ca 0.72 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1a5e h ALA 132 Cb 2.01 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.77 1a5e h ALA 132 CO -0.40 0.06 -0.02 0.00 0.00 0.00 0.00 179.25 178.89 1a5e n ALA 133 N -2.43 2.66 0.02 0.00 0.00 0.14 -3.58 120.51 117.33 1a5e n ALA 133 Ca -0.07 -0.28 0.04 0.00 0.00 0.00 0.00 53.44 53.14 1a5e n ALA 133 Cb 0.38 -1.39 -0.07 0.00 0.00 0.00 0.00 19.45 18.37 1a5e n ALA 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1a5e n ALA 134 N -0.69 2.37 -2.00 0.00 0.00 0.66 -4.44 120.51 116.40 1a5e n ALA 134 Ca 0.20 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1a5e n ALA 134 Cb 0.21 -0.30 0.00 0.00 0.00 0.00 0.00 19.45 19.37 1a5e n ALA 134 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a5e n GLY 135 N 1.96 1.52 0.00 0.00 0.00 0.85 -4.82 105.19 104.70 1a5e n GLY 135 Ca -0.01 0.33 0.00 0.00 0.00 0.00 0.00 46.02 46.33 1a5e n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a5e n GLY 136 N 0.00 0.94 2.11 -0.02 0.00 -1.19 -4.67 105.19 102.36 1a5e n GLY 136 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1a5e n GLY 136 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1a5e n THR 137 N -0.95 0.00 -4.41 2.61 -2.24 -1.26 -5.12 114.28 102.91 1a5e n THR 137 Ca 0.00 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.53 1a5e n THR 137 Cb 0.00 -0.10 -0.11 0.00 -2.10 0.00 0.00 70.33 68.01 1a5e n THR 137 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1a5e s ARG 138 N -1.63 1.48 -0.43 -0.78 1.81 -1.26 -5.10 118.95 113.04 1a5e s ARG 138 Ca 0.00 -1.53 0.06 0.00 -1.72 0.00 0.00 55.73 52.53 1a5e s ARG 138 Cb 0.00 -1.71 0.19 0.00 -0.45 0.00 0.00 34.95 32.97 1a5e s ARG 138 CO 0.00 0.36 0.72 0.20 -0.68 0.00 0.00 175.30 175.90 1a5e s GLY 139 N -2.79 -1.32 0.35 -3.53 0.00 -1.26 -4.68 107.32 94.09 1a5e s GLY 139 Ca 0.21 0.12 0.00 0.00 0.00 0.00 0.00 44.72 45.05 1a5e s GLY 139 CO 0.10 3.75 0.00 -1.26 0.00 0.00 0.00 173.10 175.69 1a5e n SER 140 N 3.80 -3.13 0.08 1.64 2.88 -1.26 -5.09 113.62 112.55 1a5e n SER 140 Ca 0.13 0.67 0.00 0.00 -1.33 0.00 0.00 58.87 58.34 1a5e n SER 140 Cb 0.58 3.03 0.00 0.00 -0.75 0.00 0.00 64.21 67.07 1a5e n SER 140 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1a5e n ASN 141 N -3.21 -0.04 -3.73 -3.46 3.02 -1.26 -4.93 115.26 101.65 1a5e n ASN 141 Ca 0.00 0.27 -0.42 0.00 -0.03 0.00 0.00 54.58 54.40 1a5e n ASN 141 Cb 0.00 0.21 0.00 0.00 -0.61 0.00 0.00 39.78 39.38 1a5e n ASN 141 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 1a5e n HIS 142 N -3.07 2.83 -1.49 3.10 -0.00 -1.26 -5.00 115.22 110.33 1a5e n HIS 142 Ca 0.00 -2.81 -0.42 0.00 0.46 0.00 0.00 57.72 54.95 1a5e n HIS 142 Cb 0.00 -1.95 0.00 0.00 -0.12 0.00 0.00 29.99 27.92 1a5e n HIS 142 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1a5e n ALA 143 N 3.31 -1.20 -0.65 1.57 0.00 -1.26 -4.88 120.51 117.39 1a5e n ALA 143 Ca 0.48 0.21 -0.31 0.00 0.00 0.00 0.00 53.44 53.82 1a5e n ALA 143 Cb 0.33 -1.84 0.18 0.00 0.00 0.00 0.00 19.45 18.12 1a5e n ALA 143 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1a5e n ARG 144 N 0.56 -0.84 -1.27 0.00 0.63 -1.26 -4.87 116.66 109.60 1a5e n ARG 144 Ca 0.11 -0.19 -0.38 0.00 -0.92 0.00 0.00 57.85 56.47 1a5e n ARG 144 Cb 0.38 -2.27 0.02 0.00 0.45 0.00 0.00 32.46 31.03 1a5e n ARG 144 CO 0.00 0.00 0.00 1.51 -2.51 0.00 0.00 177.63 176.63 1a5e n ILE 145 N -4.34 0.53 0.00 5.15 3.06 -1.26 -4.97 119.36 117.53 1a5e n ILE 145 Ca 0.10 -0.49 0.00 0.00 -2.50 0.00 0.00 62.75 59.85 1a5e n ILE 145 Cb 0.53 -0.17 0.00 0.00 0.54 0.00 0.00 39.64 40.54 1a5e n ILE 145 CO 0.00 0.00 0.00 -0.67 -2.50 0.00 0.00 176.55 173.38 1a5e n ASP 146 N 2.04 0.00 -0.79 9.51 -0.08 -1.26 -5.14 116.55 120.83 1a5e n ASP 146 Ca 0.08 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.36 1a5e n ASP 146 Cb 0.48 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.94 1a5e n ASP 146 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1a5e n ALA 147 N 0.00 0.00 -0.90 -1.67 0.00 -1.26 -4.93 120.51 111.75 1a5e n ALA 147 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1a5e n ALA 147 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1a5e n ALA 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1a5e n ALA 148 N 0.16 0.00 -1.00 0.00 0.00 -1.26 -4.75 120.51 113.66 1a5e n ALA 148 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1a5e n ALA 148 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1a5e n ALA 148 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1a5e n GLU 149 N -1.56 1.83 0.00 0.00 2.13 -1.26 -5.08 120.64 116.70 1a5e n GLU 149 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1a5e n GLU 149 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1a5e n GLU 149 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1a5e n GLY 150 N 0.00 1.64 3.74 8.31 0.00 -1.26 -4.84 105.19 112.78 1a5e n GLY 150 Ca 0.00 -0.43 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 1a5e n GLY 150 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1a5e s PRO 151 N -2.00 4.51 -0.33 1.61 0.04 -1.26 -4.97 135.00 132.60 1a5e s PRO 151 Ca 0.00 1.88 -0.09 0.00 0.04 0.00 0.00 61.00 62.83 1a5e s PRO 151 Cb 0.00 -3.23 0.20 0.00 0.04 0.00 0.00 34.50 31.52 1a5e s PRO 151 CO 0.00 -0.05 1.11 0.45 0.04 0.00 0.00 177.00 178.54 1a5e s SER 152 N -0.03 -0.22 0.54 6.66 0.15 -1.26 -5.14 113.70 114.40 1a5e s SER 152 Ca 0.52 -0.19 -0.19 0.00 0.70 0.00 0.00 55.95 56.78 1a5e s SER 152 Cb -0.33 0.28 -0.09 0.00 -1.71 0.00 0.00 66.02 64.18 1a5e s SER 152 CO 0.38 -0.02 0.68 0.47 1.20 0.00 0.00 173.24 175.96 1a5e n ASP 153 N 3.04 -0.34 -3.60 5.45 8.00 -1.26 -4.94 116.55 122.89 1a5e n ASP 153 Ca 0.08 0.81 -0.27 0.00 0.71 0.00 0.00 54.79 56.12 1a5e n ASP 153 Cb 0.65 -1.23 -0.10 0.00 -0.02 0.00 0.00 41.12 40.41 1a5e n ASP 153 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1a5e n ILE 154 N -1.44 0.72 -2.47 0.53 5.41 -1.26 -5.07 119.36 115.77 1a5e n ILE 154 Ca 0.12 -4.44 -0.43 0.00 1.00 0.00 0.00 62.75 59.00 1a5e n ILE 154 Cb 0.45 -2.00 -0.02 0.00 -0.71 0.00 0.00 39.64 37.36 1a5e n ILE 154 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1a5e s PRO 155 N -1.19 4.24 0.00 0.38 0.04 -1.26 -5.38 135.00 131.83 1a5e s PRO 155 Ca 0.31 1.59 0.17 0.00 0.04 0.00 0.00 61.00 63.11 1a5e s PRO 155 Cb 0.04 -3.74 0.13 0.00 0.04 0.00 0.00 34.50 30.97 1a5e s PRO 155 CO -0.15 -0.69 1.03 -3.47 0.04 0.00 0.00 177.00 173.76