# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 M C C 69.32 13.47 16.13 29.18 105.70 88.07 -83.37 51.01 99.54 0.13 0.34 99.37 0.13 0.14 0.26 0.01 0.00 0.06 0.03 1 A C C 48.42 10.25 13.70 24.63 97.87 75.42 -68.07 -37.06 49.96 1.61 48.43 44.57 1.48 5.01 43.57 3.92 0.00 0.88 0.57 2 A H H 66.52 3.73 15.19 19.77 94.83 58.34 -67.91 -34.90 36.42 3.22 60.36 24.14 5.85 7.78 50.38 8.76 0.03 2.35 0.71 3 A H H 48.85 7.68 14.17 23.24 96.82 58.75 -70.53 -32.27 29.69 6.63 63.69 20.08 4.75 6.46 51.58 10.43 0.06 5.61 1.04 4 L H H 42.80 15.86 11.37 26.76 96.44 58.28 -72.69 -29.59 25.33 7.81 66.86 17.28 4.43 5.67 54.10 10.64 0.07 6.56 1.25 5 A H H 66.48 6.10 14.59 22.04 94.79 66.30 -66.69 -35.10 27.51 6.11 66.38 16.69 4.71 7.72 52.58 12.04 0.09 5.08 1.11 6 R H H 166.70 2.29 16.45 19.18 93.91 55.69 -70.18 -23.19 34.86 5.02 60.12 13.23 6.06 16.08 46.19 13.01 0.24 4.09 1.10 7 L C T 58.92 13.21 13.16 26.59 97.88 52.82 -89.11 0.54 59.88 2.68 37.44 8.88 9.08 40.28 25.97 12.73 0.21 1.75 1.09 8 G C T 49.15 3.66 21.05 24.82 96.18 -112.23 74.29 21.61 93.33 2.45 4.23 18.48 10.85 64.58 1.95 1.86 0.00 1.80 0.48 9 L C C 20.37 22.03 10.79 32.11 120.91 139.78 -95.81 141.72 77.45 20.07 2.49 64.38 8.88 3.20 1.09 1.49 0.00 14.03 6.92 10 R C C 117.64 6.75 23.86 31.04 120.21 -131.65 -95.74 142.57 75.63 22.29 2.08 59.56 11.91 3.54 0.70 1.38 0.00 19.80 3.10 11 A C C 40.71 15.50 20.02 34.69 114.42 -106.50 -73.88 142.03 72.35 26.22 1.43 57.53 10.93 3.14 0.38 1.10 0.00 24.18 2.73 12 V E E 15.73 22.38 14.67 36.72 117.99 -136.32 -93.77 129.51 49.36 50.44 0.20 47.77 1.22 0.19 0.07 0.11 0.00 48.90 1.74 13 K C E 112.87 6.15 22.28 29.12 98.61 -169.22 -89.10 -30.20 54.10 45.85 0.06 26.68 26.49 0.52 0.01 0.04 0.00 46.02 0.24 14 Q E E 80.30 6.95 23.64 31.44 136.86 6.41 -150.45 145.99 5.68 94.30 0.02 4.38 0.93 0.09 0.00 0.01 0.00 94.51 0.08 15 V E E 8.71 24.58 14.56 39.46 123.92 -165.25 -126.32 129.74 0.71 99.29 0.00 0.66 0.02 0.00 0.00 0.00 0.00 99.31 0.01 16 R E E 100.57 7.71 25.99 34.16 116.65 -159.82 -109.08 124.77 0.22 99.78 0.00 0.20 0.00 0.00 0.00 0.00 0.00 99.80 0.00 17 V E E 7.57 24.54 16.44 41.33 124.73 -171.45 -122.28 135.10 0.33 99.67 0.00 0.29 0.01 0.00 0.00 0.00 0.00 99.70 0.00 18 Q E E 66.95 9.74 26.47 36.74 120.48 -163.21 -112.80 130.37 1.95 98.05 0.00 1.79 0.05 0.00 0.00 0.00 0.00 98.12 0.03 19 F E E 14.07 22.99 18.02 40.57 134.12 171.42 -133.31 155.66 18.52 81.48 0.01 17.38 1.01 0.02 0.00 0.00 0.00 80.43 1.16 20 C C C 18.77 14.28 21.12 36.44 109.15 -123.70 -96.98 114.87 96.70 3.29 0.01 96.14 1.00 0.04 0.00 0.01 0.00 2.52 0.29 21 P C T 34.11 15.89 17.19 34.09 92.45 -157.36 -66.77 -19.31 99.32 0.21 0.47 1.75 7.26 90.30 0.03 0.45 0.00 0.14 0.07 22 F C T 102.99 8.94 18.35 28.13 94.77 60.77 -89.06 -2.05 99.34 0.13 0.52 1.71 7.71 89.93 0.05 0.48 0.00 0.08 0.05 23 E C S 67.37 11.93 12.12 24.94 120.00 98.36 -85.66 142.73 96.17 2.48 1.36 42.07 52.08 1.74 0.42 0.79 0.00 0.84 2.07 24 K C T 166.72 1.37 17.10 18.28 93.76 -126.20 -65.12 -26.61 92.80 0.48 6.72 3.96 9.86 79.88 1.72 4.03 0.00 0.24 0.30 25 N C T 72.46 10.13 15.37 26.28 96.34 51.33 -92.26 10.15 94.04 0.34 5.62 10.19 6.30 78.09 2.58 2.47 0.00 0.16 0.22 26 V H H 20.69 19.93 13.00 32.55 94.90 108.76 -68.05 -28.97 29.46 0.37 70.17 24.39 3.18 3.94 64.61 3.54 0.00 0.14 0.21 27 E H H 114.36 3.72 24.12 28.13 91.95 69.52 -63.49 -40.91 4.30 0.03 95.67 1.85 0.60 1.79 95.12 0.62 0.00 0.01 0.01 28 S H H 22.68 12.94 21.91 35.42 91.58 51.20 -64.91 -40.92 2.50 0.02 97.48 0.84 0.33 1.29 96.85 0.65 0.01 0.01 0.01 29 T H H 3.29 25.31 19.29 44.59 91.45 50.95 -64.24 -42.01 0.66 0.00 99.33 0.18 0.08 0.35 99.07 0.32 0.00 0.00 0.00 30 R H H 75.77 14.14 24.16 37.47 91.53 52.21 -62.75 -41.63 0.15 0.00 99.85 0.03 0.01 0.07 99.84 0.05 0.00 0.00 0.00 31 T H H 59.81 6.95 26.86 34.44 91.65 50.56 -64.16 -41.82 0.13 0.00 99.87 0.02 0.01 0.07 99.88 0.02 0.00 0.00 0.00 32 F H H 5.36 24.48 21.93 45.98 91.33 50.35 -63.19 -44.09 0.14 0.00 99.86 0.01 0.01 0.09 99.88 0.02 0.00 0.00 0.00 33 L H H 9.02 23.48 22.12 44.72 91.20 50.18 -63.32 -42.42 0.22 0.00 99.78 0.02 0.01 0.14 99.77 0.05 0.00 0.00 0.00 34 Q H H 90.74 6.55 26.02 33.01 91.67 51.30 -64.13 -40.62 0.85 0.00 99.15 0.05 0.04 0.69 99.00 0.22 0.00 0.00 0.00 35 A H H 22.66 13.80 22.32 36.32 91.87 50.49 -65.34 -40.60 3.35 0.01 96.65 0.14 0.17 2.93 96.10 0.65 0.01 0.00 0.00 36 V H H 5.58 24.65 18.26 42.76 92.30 50.59 -70.31 -28.85 15.22 0.05 84.73 0.87 1.10 13.12 83.83 1.00 0.03 0.02 0.03 37 S C T 36.38 14.08 19.84 34.19 96.11 53.32 -92.69 -0.61 59.48 0.47 40.05 8.04 6.82 43.20 39.06 2.36 0.04 0.16 0.32 38 S C C 33.10 10.94 14.62 27.28 116.05 114.34 -71.39 142.55 92.24 1.05 6.72 46.68 42.67 2.23 6.77 0.58 0.00 0.22 0.86 39 E H H 139.90 2.58 16.54 20.34 92.09 -121.84 -59.85 -35.40 8.12 0.05 91.83 1.11 1.82 5.33 90.33 1.34 0.03 0.02 0.03 40 K H H 122.38 3.08 18.28 21.80 91.85 54.72 -64.68 -39.29 6.21 0.03 93.76 0.62 0.68 4.89 91.76 1.98 0.03 0.01 0.01 41 V H H 9.70 20.81 12.32 33.01 93.08 47.01 -67.15 -41.46 3.57 0.03 96.39 0.47 0.39 2.67 93.69 2.74 0.02 0.02 0.01 42 R H H 89.15 13.46 14.67 28.02 91.86 51.85 -65.40 -36.50 4.37 0.06 95.57 0.60 0.51 3.22 93.14 2.44 0.02 0.03 0.02 43 C H H 97.56 1.50 18.92 19.35 92.43 51.83 -70.69 -30.63 19.74 0.11 80.16 1.00 1.46 17.49 78.02 1.87 0.07 0.04 0.06 44 T H H 69.62 7.04 16.88 24.70 98.88 39.21 -90.59 -27.28 33.11 0.30 66.60 1.96 6.32 24.93 65.05 1.30 0.13 0.09 0.21 45 N C C 29.36 17.40 11.35 28.38 113.07 31.49 -128.99 88.64 95.60 2.14 2.26 78.45 13.51 3.36 1.47 0.80 0.00 1.01 1.40 46 L C T 112.20 4.57 16.67 23.03 94.31 168.52 -68.56 -18.80 96.93 1.64 1.44 5.58 15.27 76.28 0.22 1.12 0.00 1.14 0.39 47 N C T 110.84 3.18 19.55 23.15 96.18 58.31 -91.06 1.52 96.47 2.78 0.75 4.73 16.65 74.98 0.05 0.73 0.00 2.64 0.21 48 C C C 11.98 23.38 9.42 31.83 117.52 108.68 -82.18 136.43 70.92 29.00 0.09 57.22 12.03 0.39 0.01 0.09 0.00 29.70 0.55 49 S E E 60.16 4.51 25.83 30.34 117.12 -151.06 -101.42 132.43 6.81 93.18 0.01 6.51 0.21 0.01 0.00 0.00 0.00 93.06 0.19 50 V E E 26.82 23.62 12.34 35.18 121.82 -160.96 -115.98 129.36 1.15 98.85 0.00 1.11 0.02 0.00 0.00 0.00 0.00 98.85 0.02 51 I E E 80.57 5.55 24.61 30.44 118.49 -168.85 -117.00 125.25 0.48 99.52 0.00 0.45 0.01 0.00 0.00 0.00 0.00 99.54 0.01 52 A E E 33.19 20.82 12.79 32.38 123.37 -166.04 -116.33 133.82 0.98 99.02 0.00 0.90 0.02 0.00 0.00 0.00 0.00 99.07 0.01 53 D E E 76.29 5.07 23.56 28.96 117.66 -171.63 -121.49 120.67 2.07 97.93 0.00 1.79 0.11 0.00 0.00 0.00 0.00 98.08 0.02 54 V E E 48.04 18.60 13.14 31.11 118.03 -159.26 -105.32 126.96 5.32 94.67 0.01 5.17 0.13 0.01 0.00 0.00 0.00 94.49 0.19 55 R E E 111.21 6.56 19.07 26.58 118.42 -166.74 -110.65 129.74 24.27 75.66 0.07 23.19 0.86 0.10 0.02 0.04 0.00 74.66 1.13 56 H C C 97.98 11.92 12.18 24.46 113.83 -154.89 -101.94 118.44 70.31 29.27 0.42 60.36 7.04 1.51 0.08 0.40 0.00 29.20 1.42 57 D C C 89.79 4.76 14.92 20.90 100.66 175.42 -95.46 4.63 93.03 6.06 0.91 48.94 27.72 16.74 0.11 1.02 0.00 4.44 1.04 58 G C S 55.24 3.20 14.99 19.48 96.06 -110.54 77.85 8.34 97.48 1.91 0.61 29.19 47.86 20.43 0.05 0.75 0.00 1.22 0.49 59 S C S 50.94 6.39 16.04 23.83 127.39 110.91 -105.15 158.26 96.11 3.67 0.23 44.74 49.73 2.10 0.04 0.20 0.00 1.67 1.53 60 E C C 98.43 8.22 20.34 28.99 116.14 -98.68 -76.83 143.60 97.84 2.12 0.04 60.85 36.87 0.47 0.00 0.03 0.00 1.47 0.29 61 P C C 13.11 22.68 15.12 37.67 114.72 -101.97 -68.12 144.18 93.83 6.15 0.02 80.45 12.79 0.35 0.00 0.02 0.00 6.16 0.22 62 C E E 34.26 10.76 25.33 36.79 130.88 -172.47 -131.54 148.05 2.58 97.42 0.00 2.39 0.10 0.00 0.00 0.00 0.00 97.34 0.17 63 V E E 4.34 25.35 17.41 43.60 121.77 -154.64 -116.72 130.52 0.14 99.86 0.00 0.13 0.00 0.00 0.00 0.00 0.00 99.87 0.00 64 D E E 41.46 8.97 26.53 36.52 116.51 -159.30 -108.82 124.90 0.04 99.96 0.00 0.04 0.00 0.00 0.00 0.00 0.00 99.96 0.00 65 V E E 4.76 24.69 16.53 41.92 123.77 -170.57 -119.60 134.16 0.04 99.96 0.00 0.03 0.00 0.00 0.00 0.00 0.00 99.97 0.00 66 L E E 51.45 7.48 24.73 33.19 115.17 -155.97 -107.15 123.31 0.09 99.91 0.00 0.09 0.00 0.00 0.00 0.00 0.00 99.91 0.00 67 F E E 15.81 20.18 13.18 33.58 122.41 -154.04 -88.35 162.39 28.07 71.90 0.04 27.70 0.44 0.05 0.01 0.02 0.00 71.29 0.48 68 G C T 38.42 9.38 15.36 25.57 92.45 -99.17 -62.16 -26.35 97.59 0.54 1.87 0.59 3.59 93.47 0.03 1.87 0.00 0.38 0.07 69 D C T 99.73 2.91 15.34 18.96 93.21 56.42 -87.69 1.91 97.89 0.10 2.02 0.29 2.97 94.56 0.04 2.06 0.00 0.05 0.03 70 G C S 49.04 3.37 14.71 19.24 96.85 -100.75 88.69 5.05 97.93 0.44 1.63 10.15 83.04 4.97 0.15 1.30 0.00 0.20 0.19 71 H C C 89.77 6.50 14.53 22.91 116.98 137.20 -76.75 142.76 97.16 2.81 0.03 96.55 0.86 0.13 0.00 0.01 0.00 2.22 0.23 72 R E E 124.18 9.62 15.71 26.83 123.55 -156.76 -119.26 134.92 1.50 98.50 0.00 1.45 0.04 0.00 0.00 0.00 0.00 98.40 0.11 73 L E E 32.26 16.23 17.20 33.95 123.74 -169.44 -121.32 134.05 0.10 99.90 0.00 0.09 0.00 0.00 0.00 0.00 0.00 99.90 0.00 74 I E E 72.97 10.58 22.40 33.27 117.60 -154.14 -106.84 125.30 0.10 99.89 0.00 0.09 0.00 0.00 0.00 0.00 0.00 99.90 0.00 75 M E E 16.12 21.52 16.57 38.06 121.22 -170.14 -117.04 130.74 1.06 98.94 0.00 0.99 0.03 0.00 0.00 0.00 0.00 98.95 0.03 76 R E E 120.99 7.02 24.59 32.06 115.34 -150.02 -97.28 126.10 18.44 81.48 0.08 15.96 1.85 0.28 0.02 0.05 0.00 81.42 0.41 77 G C C 8.80 20.93 14.82 35.03 106.14 172.37 -108.26 10.58 87.85 10.56 1.58 77.15 7.81 2.64 0.18 1.84 0.00 9.18 1.20 78 A C T 53.40 9.37 19.56 29.20 97.06 125.25 -67.81 -28.28 96.74 2.36 0.90 3.51 17.34 75.97 0.05 0.97 0.00 1.78 0.38 79 H C T 136.98 3.47 21.17 24.97 98.75 13.25 -92.45 24.71 97.76 1.52 0.72 5.91 16.48 75.31 0.04 0.89 0.00 1.15 0.23 80 L C C 24.31 19.50 11.84 31.12 119.71 135.98 -88.92 143.39 96.21 3.64 0.15 78.20 18.20 0.22 0.06 0.07 0.00 1.61 1.63 81 T C C 57.01 4.62 24.29 28.54 124.06 -133.84 -86.18 164.89 83.99 15.86 0.14 83.12 0.84 0.04 0.11 0.02 0.00 2.29 13.57 82 A H H 27.49 19.24 14.98 33.79 91.36 -104.68 -58.54 -38.51 0.99 0.00 99.01 0.14 0.14 0.57 99.00 0.14 0.00 0.00 0.00 83 Q H H 108.13 4.14 21.43 26.07 91.50 53.08 -63.68 -40.80 0.32 0.00 99.67 0.04 0.02 0.20 99.63 0.11 0.00 0.00 0.00 84 E H H 83.35 6.39 21.92 28.71 91.87 48.71 -65.80 -40.44 0.10 0.00 99.90 0.02 0.00 0.05 99.85 0.08 0.00 0.00 0.00 85 M H H 5.33 24.36 16.64 41.19 91.36 50.07 -63.27 -43.91 0.04 0.00 99.96 0.00 0.00 0.02 99.96 0.01 0.00 0.00 0.00 86 L H H 35.35 16.47 20.58 36.61 91.48 50.26 -63.06 -42.20 0.04 0.00 99.96 0.00 0.00 0.02 99.97 0.01 0.00 0.00 0.00 87 T H H 78.35 2.70 25.13 26.88 91.62 49.81 -64.33 -41.73 0.05 0.00 99.95 0.00 0.00 0.03 99.96 0.01 0.00 0.00 0.00 88 A H H 21.51 12.29 21.13 34.25 91.63 49.63 -64.05 -42.44 0.07 0.00 99.93 0.00 0.00 0.05 99.94 0.01 0.00 0.00 0.00 89 F H H 8.82 23.64 18.46 41.92 91.64 49.16 -63.77 -43.02 0.12 0.00 99.88 0.01 0.00 0.08 99.89 0.02 0.00 0.00 0.00 90 A H H 39.43 10.19 20.96 31.71 91.39 51.09 -62.76 -41.16 0.37 0.00 99.63 0.03 0.01 0.25 99.65 0.05 0.00 0.00 0.00 91 S H H 59.18 2.81 23.48 25.26 91.56 50.91 -64.85 -41.40 1.66 0.00 98.34 0.11 0.07 1.31 98.28 0.21 0.00 0.00 0.00 92 H H H 46.54 13.39 19.23 32.92 92.60 48.83 -66.32 -41.33 3.86 0.01 96.12 0.38 0.27 2.98 95.93 0.43 0.00 0.01 0.00 93 I H H 23.92 17.54 16.05 33.61 92.47 49.08 -65.56 -41.99 7.80 0.16 92.04 2.49 1.22 4.21 91.10 0.83 0.02 0.07 0.06 94 Q H H 109.50 3.42 19.63 23.42 92.62 50.79 -65.34 -39.24 14.53 0.61 84.86 6.41 2.38 6.33 82.70 1.64 0.03 0.33 0.19 95 A H H 61.86 3.70 17.21 21.52 93.35 52.70 -68.13 -34.51 23.84 0.59 75.56 8.79 3.36 12.09 72.80 2.40 0.03 0.31 0.22 96 R H H 102.38 9.98 14.26 24.86 95.64 52.15 -72.68 -24.05 30.14 0.71 69.14 9.63 6.06 15.96 64.75 2.88 0.07 0.32 0.34 97 G H H 40.45 6.27 15.47 22.71 100.31 40.11 -6.94 -19.67 47.78 1.21 51.01 19.45 12.32 17.09 47.01 3.01 0.05 0.50 0.58 98 A C C 60.32 5.74 12.77 19.94 101.50 71.22 -75.04 -8.13 58.81 1.82 39.36 36.13 10.05 12.86 35.02 4.18 0.02 0.79 0.94 99 A C C 71.61 4.41 11.94 17.79 103.61 79.38 -75.61 15.60 64.17 2.13 33.70 30.91 11.95 22.36 26.23 6.39 0.05 0.98 1.14 100 G C T 51.18 3.36 11.98 16.77 105.67 2.58 32.01 -13.20 73.24 1.62 25.14 28.74 15.99 29.49 16.43 7.63 0.03 0.71 0.97 101 S C T 85.41 2.58 10.99 14.95 103.16 43.98 -84.48 14.03 81.81 1.37 16.82 26.95 21.11 34.66 8.45 7.34 0.01 0.60 0.87 102 G C T 57.67 2.25 11.61 15.08 104.59 -39.91 80.56 2.08 90.64 1.42 7.93 31.10 27.71 32.47 2.41 4.92 0.00 0.68 0.71 103 D C C 100.05 3.39 11.04 16.31 115.00 123.93 -88.09 136.55 93.30 2.98 3.73 60.15 26.53 6.59 1.22 2.43 0.00 1.39 1.68 104 K C C 135.43 3.94 11.50 17.58 117.80 -139.21 -96.69 138.37 96.33 3.13 0.53 74.10 21.74 0.77 0.26 0.25 0.00 1.59 1.30 105 P C C 73.71 7.90 10.05 19.41 114.13 -107.30 -67.02 150.08 92.59 4.80 2.61 83.60 5.63 3.21 1.11 1.34 0.00 2.46 2.64 106 S C C 78.76 3.42 11.43 16.59 112.38 -108.75 -76.13 147.64 92.91 2.97 4.12 77.84 9.25 5.66 1.63 2.34 0.00 1.51 1.75 107 A C C 80.11 3.67 10.09 15.55 108.39 -103.40 -74.36 134.57 86.75 2.67 10.58 50.83 19.21 16.80 2.70 7.77 0.00 1.41 1.27 108 S C C 82.08 3.22 9.39 14.43 109.64 -121.28 -88.82 112.73 86.26 2.77 10.97 46.31 19.38 20.65 2.31 8.67 0.00 1.44 1.25 109 T C C 97.09 3.76 8.18 13.78 108.52 170.04 -92.68 73.13 87.39 3.38 9.23 45.20 19.32 23.07 1.75 7.48 0.00 1.79 1.40 110 G C C 55.78 2.39 9.90 13.78 111.03 -88.10 64.49 150.21 93.15 2.65 4.20 71.35 6.31 15.86 0.83 2.94 0.00 1.66 1.05 111 R C C 171.83 2.52 10.87 15.00 107.77 -77.58 -89.22 106.70 99.71 0.26 0.03 99.49 0.24 0.08 0.01 0.00 0.00 0.13 0.04