# 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 108.91 7.14 12.96 21.15 113.35 -155.66 -91.66 127.75 99.91 0.08 0.01 99.81 0.12 0.02 0.00 0.00 0.00 0.03 0.01 1 A C C 63.59 5.99 10.36 18.00 117.22 -128.49 -86.42 140.80 98.91 0.35 0.74 98.20 0.43 0.50 0.50 0.08 0.00 0.13 0.17 2 P C C 86.42 4.85 10.41 17.13 112.89 -106.49 -67.19 148.93 92.81 0.86 6.33 82.04 5.38 5.82 3.89 1.96 0.00 0.43 0.47 3 K C C 148.12 2.92 10.61 15.36 109.99 -117.53 -81.41 131.40 83.07 2.71 14.22 64.88 10.80 7.00 10.14 4.36 0.00 1.24 1.57 4 K C C 128.80 4.99 10.38 17.11 113.90 -132.35 -91.02 134.47 75.38 2.84 21.78 54.72 13.10 6.97 17.35 5.14 0.00 1.42 1.30 5 S C C 65.38 5.44 11.06 18.05 113.36 -140.86 -90.45 135.35 74.33 1.71 23.96 57.88 8.93 6.54 20.63 4.42 0.00 0.86 0.75 6 K C H 129.53 5.55 11.87 18.89 101.76 -138.84 -76.80 -2.04 53.63 1.01 45.36 34.00 11.36 8.87 39.67 5.19 0.01 0.45 0.45 7 S H H 70.57 4.24 13.57 19.00 100.79 80.73 -74.78 -30.06 43.36 0.76 55.87 23.70 9.65 11.18 48.47 6.29 0.01 0.36 0.34 8 E H H 111.66 5.83 14.60 21.48 99.14 53.70 -77.36 -16.45 36.25 0.78 62.97 20.28 7.47 9.99 54.84 6.69 0.02 0.37 0.34 9 A H H 43.96 12.27 12.82 25.36 101.35 63.59 -78.11 -13.25 34.55 0.74 64.71 19.62 7.20 9.28 57.94 5.29 0.02 0.34 0.33 10 Q H H 104.86 6.01 17.75 24.47 100.27 83.82 -78.18 -16.22 39.73 0.63 59.65 22.35 8.78 9.02 56.39 2.93 0.01 0.25 0.28 11 S H H 49.82 7.25 19.84 27.48 107.08 53.22 -81.82 -39.36 42.35 0.75 56.90 27.74 7.22 7.18 55.31 1.92 0.01 0.29 0.34 12 I H H 19.32 21.86 16.99 37.86 93.68 8.18 -65.02 -40.30 7.27 0.08 92.65 3.27 1.39 2.77 91.80 0.70 0.01 0.03 0.03 13 G H H 21.38 15.17 19.75 34.43 92.03 53.50 -62.30 -42.31 3.75 0.03 96.22 1.41 0.54 1.75 95.77 0.51 0.00 0.01 0.01 14 A H H 60.09 3.09 24.52 26.71 91.76 49.58 -64.94 -41.01 2.18 0.02 97.80 0.78 0.28 1.07 97.46 0.40 0.00 0.00 0.01 15 K H H 61.64 13.41 21.98 34.93 91.89 49.69 -65.43 -41.93 0.85 0.01 99.14 0.26 0.09 0.42 99.06 0.16 0.00 0.00 0.00 16 L H H 3.56 25.91 17.52 43.64 91.33 50.57 -63.60 -42.54 0.37 0.00 99.63 0.09 0.03 0.18 99.63 0.06 0.00 0.00 0.00 17 A H H 43.96 8.62 22.74 31.83 91.29 52.54 -62.29 -41.30 0.27 0.00 99.73 0.05 0.02 0.14 99.74 0.05 0.00 0.00 0.00 18 L H H 77.10 4.05 24.02 27.79 91.70 50.60 -64.38 -41.79 0.27 0.00 99.72 0.04 0.02 0.16 99.70 0.07 0.00 0.00 0.00 19 V H H 9.61 19.70 16.81 36.93 91.76 50.06 -64.23 -42.87 0.45 0.02 99.54 0.08 0.03 0.27 99.46 0.14 0.00 0.01 0.00 20 I H H 46.15 17.76 16.14 33.04 91.93 49.89 -64.10 -41.28 1.09 0.03 98.88 0.16 0.07 0.75 98.55 0.44 0.00 0.02 0.00 21 K H H 153.50 1.66 19.95 21.24 91.19 52.36 -65.51 -31.32 5.39 0.03 94.59 0.26 0.23 4.79 94.23 0.46 0.01 0.01 0.01 22 S H H 63.37 5.18 17.32 23.40 92.96 50.87 -84.00 -10.28 46.92 0.05 53.03 0.66 1.65 43.50 53.35 0.76 0.02 0.01 0.04 23 G C T 34.62 10.46 16.64 27.61 97.10 -114.02 81.40 9.22 99.55 0.22 0.23 3.65 16.53 79.45 0.07 0.10 0.00 0.18 0.03 24 K C C 94.90 9.98 21.60 31.60 102.00 111.28 -99.55 5.29 77.52 22.33 0.14 51.97 23.35 1.09 0.02 0.14 0.00 23.00 0.43 25 V E E 17.24 22.49 16.78 38.84 125.70 64.63 -119.04 136.59 11.15 88.74 0.11 9.46 1.72 0.15 0.04 0.07 0.00 87.61 0.94 26 V E E 27.26 15.39 24.18 39.63 123.16 -164.20 -118.47 134.70 4.83 95.15 0.03 4.97 0.14 0.01 0.02 0.01 0.00 93.90 0.95 27 L E E 47.76 17.43 22.92 39.10 122.65 -160.31 -115.89 133.16 17.93 82.04 0.02 16.16 1.27 0.05 0.01 0.01 0.00 81.97 0.54 28 G C S 15.42 10.99 25.45 37.48 125.35 22.05 96.80 160.05 94.80 2.61 2.58 15.57 77.26 1.96 3.04 0.21 0.00 1.30 0.65 29 Y H H 50.19 20.99 17.10 37.06 91.94 -88.84 -60.90 -39.93 1.96 0.01 98.03 0.18 0.45 1.13 98.06 0.18 0.00 0.00 0.00 30 R H H 148.29 3.69 23.91 28.22 91.44 51.24 -62.92 -41.82 0.71 0.00 99.29 0.05 0.06 0.51 99.21 0.16 0.00 0.00 0.00 31 S H H 42.13 7.48 23.18 31.17 91.82 48.23 -65.69 -40.30 0.25 0.00 99.75 0.03 0.02 0.16 99.65 0.15 0.00 0.00 0.00 32 T H H 1.98 26.29 16.90 43.73 91.31 50.74 -63.75 -43.51 0.09 0.00 99.91 0.01 0.00 0.05 99.90 0.03 0.00 0.00 0.00 33 L H H 27.59 18.25 21.99 39.47 91.23 49.83 -63.45 -42.76 0.06 0.00 99.94 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 34 K H H 114.69 2.41 26.66 27.90 91.59 50.09 -63.68 -41.91 0.05 0.00 99.95 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 35 A H H 13.98 13.44 19.90 34.59 91.39 50.25 -63.82 -42.11 0.12 0.00 99.88 0.01 0.00 0.08 99.87 0.04 0.00 0.00 0.00 36 L H H 4.71 25.38 14.84 40.39 91.34 49.76 -63.74 -42.62 0.34 0.00 99.66 0.02 0.01 0.27 99.54 0.16 0.00 0.00 0.00 37 R H H 131.28 7.86 19.76 28.54 91.24 51.24 -64.39 -34.36 2.69 0.00 97.31 0.04 0.05 2.71 96.99 0.21 0.00 0.00 0.00 38 S C T 73.92 2.44 20.30 22.09 92.11 52.76 -82.58 -8.17 70.99 0.01 29.00 0.19 0.88 69.41 29.04 0.47 0.00 0.00 0.01 39 G C T 37.94 11.24 15.34 26.95 94.77 -115.07 79.79 11.77 99.73 0.01 0.26 0.67 2.57 96.60 0.11 0.04 0.00 0.00 0.00 40 K C C 115.28 5.27 22.04 28.07 94.75 122.80 -83.57 -16.05 99.61 0.32 0.08 51.25 47.17 1.23 0.02 0.06 0.00 0.13 0.15 41 A C C 4.90 25.01 12.93 37.90 121.61 72.22 -99.48 139.99 93.09 6.84 0.06 85.77 6.64 0.38 0.00 0.07 0.00 6.84 0.29 42 K C S 88.49 9.83 26.61 37.50 100.14 -169.85 -96.20 -26.85 92.14 7.86 0.01 14.08 77.72 0.23 0.00 0.01 0.00 7.87 0.09 43 L E E 9.33 21.60 26.41 47.29 136.51 16.80 -144.16 145.15 2.09 97.91 0.00 1.48 0.51 0.02 0.00 0.00 0.00 97.94 0.05 44 I E E 1.21 27.14 27.27 54.28 121.02 -161.43 -118.51 127.70 0.10 99.90 0.00 0.09 0.00 0.00 0.00 0.00 0.00 99.90 0.00 45 L E E 1.85 25.93 29.25 54.64 116.90 -160.96 -108.26 124.67 0.02 99.98 0.00 0.02 0.00 0.00 0.00 0.00 0.00 99.98 0.00 46 I E E 4.23 24.73 26.84 50.51 128.65 -175.13 -125.44 143.07 0.16 99.84 0.00 0.15 0.00 0.00 0.00 0.00 0.00 99.84 0.01 47 A E E 5.01 21.92 21.23 43.52 114.19 -115.54 -73.77 142.20 20.45 79.53 0.02 19.62 0.51 0.04 0.00 0.01 0.00 79.59 0.22 48 A C T 46.24 11.74 21.70 33.92 92.97 -126.63 -64.87 -25.98 92.98 6.63 0.40 4.05 24.85 64.49 0.02 0.44 0.00 5.83 0.33 49 N C T 96.45 5.16 22.47 28.51 95.32 58.52 -90.87 8.30 98.29 1.44 0.27 8.59 30.05 59.67 0.01 0.35 0.00 1.15 0.17 50 T C S 12.46 23.12 9.22 31.33 118.42 116.63 -76.20 143.56 98.86 1.03 0.11 48.32 50.45 0.20 0.04 0.04 0.00 0.29 0.67 51 P C C 60.17 4.52 18.31 23.73 114.24 -102.27 -63.05 148.53 99.86 0.04 0.10 99.24 0.57 0.08 0.06 0.01 0.00 0.01 0.03 52 P H H 99.35 3.82 13.96 19.64 91.85 -111.37 -57.32 -37.07 11.38 0.03 88.60 1.51 1.29 7.86 80.22 9.07 0.01 0.01 0.01 53 L H H 115.40 1.79 17.12 18.62 91.79 54.51 -64.58 -37.28 8.39 0.03 91.59 0.93 0.78 6.13 82.38 9.73 0.02 0.01 0.01 54 R H H 68.16 14.34 15.30 29.52 92.75 48.38 -70.46 -35.17 5.67 0.07 94.26 1.44 0.70 3.14 83.55 11.11 0.01 0.04 0.02 55 K H H 62.65 16.88 15.60 31.60 91.70 56.02 -61.78 -42.78 4.72 0.04 95.24 1.40 0.62 2.45 92.67 2.82 0.01 0.02 0.01 56 S H H 61.65 2.45 23.18 24.31 91.79 51.60 -64.22 -41.17 7.37 0.02 92.61 0.88 0.55 5.32 91.23 1.99 0.01 0.01 0.01 57 E H H 75.97 7.71 22.29 30.44 91.58 50.18 -64.69 -41.12 4.36 0.02 95.62 0.67 0.35 3.08 94.77 1.12 0.00 0.01 0.01 58 L H H 2.37 26.44 15.68 42.73 91.30 50.28 -64.17 -42.30 0.57 0.00 99.43 0.13 0.05 0.28 99.33 0.21 0.00 0.00 0.00 59 E H H 79.63 12.19 21.70 33.40 91.40 52.25 -62.26 -42.07 0.19 0.00 99.81 0.03 0.01 0.10 99.80 0.07 0.00 0.00 0.00 60 Y H H 127.87 2.12 24.95 25.20 91.67 49.80 -63.67 -42.54 0.15 0.00 99.85 0.02 0.01 0.09 99.82 0.06 0.00 0.00 0.00 61 Y H H 39.68 14.25 20.30 35.01 92.09 48.91 -64.88 -42.57 0.14 0.00 99.86 0.01 0.00 0.09 99.81 0.08 0.00 0.00 0.00 62 S H H 5.22 22.38 13.97 36.49 91.65 50.66 -63.55 -42.17 0.43 0.00 99.57 0.04 0.02 0.31 99.44 0.19 0.00 0.00 0.00 63 M H H 116.59 3.58 19.90 24.19 91.92 49.09 -64.65 -40.08 1.41 0.00 98.59 0.07 0.06 1.21 98.28 0.39 0.00 0.00 0.00 64 M H H 115.71 3.48 19.20 23.09 92.06 50.46 -66.95 -35.07 5.74 0.00 94.26 0.16 0.26 5.13 94.06 0.37 0.00 0.00 0.00 65 S H H 28.00 15.04 14.07 29.46 95.23 46.45 -88.91 -2.96 48.95 0.08 50.98 1.82 4.44 40.42 52.38 0.84 0.01 0.02 0.07 66 K C T 162.63 1.67 20.68 22.16 93.79 -124.86 59.33 36.81 99.68 0.03 0.28 12.61 4.78 82.39 0.13 0.07 0.00 0.01 0.01 67 T C C 16.18 21.19 12.13 32.97 122.00 143.43 -104.06 139.57 99.67 0.32 0.01 89.23 10.43 0.08 0.00 0.00 0.00 0.20 0.05 68 P C C 64.48 6.25 25.15 31.92 112.72 -107.03 -67.52 141.91 96.82 3.17 0.01 95.36 1.39 0.05 0.00 0.00 0.00 3.09 0.09 69 V E E 27.82 23.52 14.15 36.99 124.37 -159.23 -121.45 133.46 6.90 93.09 0.01 6.85 0.22 0.01 0.00 0.00 0.00 91.83 1.08 70 H E E 55.21 12.77 23.85 36.64 120.84 -164.72 -115.15 129.83 0.77 99.22 0.00 0.72 0.02 0.00 0.00 0.00 0.00 99.19 0.06 71 H E E 85.56 14.07 21.85 35.21 118.68 -153.02 -100.99 128.91 2.20 97.80 0.00 2.11 0.06 0.01 0.00 0.00 0.00 97.72 0.10 72 Y E E 35.30 19.83 14.83 34.25 122.28 -165.94 -111.91 136.23 30.13 69.81 0.06 28.66 0.93 0.11 0.01 0.04 0.00 69.65 0.61 73 S C C 79.64 4.07 21.40 26.07 105.67 -163.22 -101.50 49.49 73.82 26.04 0.14 47.74 23.34 1.91 0.02 0.15 0.00 26.27 0.57 74 G C S 24.75 9.13 18.51 28.53 137.91 85.30 -137.06 -175.03 90.82 8.86 0.32 19.41 68.96 2.70 0.07 0.22 0.00 7.72 0.91 75 T C C 63.08 6.06 23.60 29.59 124.88 -73.68 -101.94 159.63 95.48 3.31 1.21 86.56 8.21 0.80 1.02 0.26 0.00 1.72 1.44 76 N H H 38.15 20.97 14.87 34.93 92.54 -110.15 -60.48 -37.16 4.99 0.03 94.98 1.11 1.28 2.40 94.53 0.64 0.01 0.01 0.01 77 I H H 87.88 7.58 21.81 29.70 92.47 53.58 -64.76 -41.19 2.22 0.02 97.76 0.34 0.29 1.47 97.24 0.64 0.01 0.01 0.00 78 E H H 90.93 5.22 23.76 29.01 92.24 48.79 -65.91 -40.58 1.19 0.03 98.79 0.26 0.14 0.75 98.09 0.73 0.00 0.01 0.00 79 L H H 5.47 22.93 16.53 39.77 91.80 51.01 -63.57 -43.02 0.65 0.01 99.34 0.12 0.07 0.41 98.89 0.50 0.00 0.00 0.00 80 G H H 7.49 16.42 17.14 34.40 91.45 51.27 -62.79 -42.21 1.41 0.01 98.58 0.22 0.12 0.94 97.94 0.77 0.00 0.01 0.00 81 T H H 88.89 2.72 22.02 24.27 92.12 49.82 -65.34 -40.56 2.05 0.01 97.94 0.22 0.15 1.54 96.81 1.28 0.00 0.01 0.00 82 A H H 43.07 11.72 17.91 29.99 92.29 52.28 -66.85 -34.75 6.10 0.02 93.87 0.27 0.36 5.45 92.77 1.12 0.01 0.01 0.01 83 C C T 24.42 17.91 14.82 32.67 94.80 40.91 -89.36 -5.56 52.43 0.07 47.50 0.72 1.97 49.34 46.32 1.57 0.02 0.02 0.05 84 G C T 56.36 2.28 20.30 22.12 94.19 -115.36 77.22 13.36 99.02 0.03 0.94 3.51 4.95 90.82 0.46 0.23 0.00 0.02 0.02 85 K C C 81.48 9.88 14.04 25.14 132.42 111.47 -121.42 156.50 98.33 0.88 0.79 50.70 45.29 2.36 0.31 0.43 0.00 0.32 0.59 86 L C C 110.18 5.13 18.42 24.43 104.75 -120.83 -80.39 58.56 96.54 1.92 1.54 64.53 28.70 3.22 0.41 1.17 0.00 0.92 1.05 87 F C C 61.84 15.46 16.55 31.62 128.88 99.23 -119.01 150.01 92.89 4.28 2.83 61.94 25.24 5.55 0.69 2.34 0.00 2.52 1.70 88 R C C 112.96 10.40 23.99 34.06 108.56 -113.94 -84.76 119.36 89.18 8.10 2.73 56.56 26.16 6.59 0.58 2.33 0.00 6.09 1.70 89 C C C 9.27 23.81 18.96 42.38 126.11 58.00 -114.63 143.19 75.44 22.70 1.86 61.36 11.40 2.35 0.55 1.45 0.00 20.44 2.46 90 S C S 19.47 17.96 25.99 43.34 100.70 -166.60 -94.19 -28.19 70.15 29.16 0.68 30.87 38.42 1.63 0.14 0.43 0.00 27.92 0.58 91 T E E 7.47 22.65 26.75 48.85 133.78 15.48 -140.38 143.27 10.09 89.35 0.56 8.43 1.46 0.27 0.20 0.20 0.00 89.11 0.34 92 M E E 4.83 25.76 26.95 51.92 125.37 -168.14 -124.43 135.39 1.51 98.18 0.31 1.32 0.10 0.03 0.23 0.03 0.00 98.23 0.06 93 A E E 7.75 21.83 28.18 48.91 122.40 -160.19 -115.20 131.31 0.77 98.97 0.25 0.66 0.03 0.01 0.23 0.02 0.00 99.01 0.02 94 I E E 8.02 23.49 21.95 45.34 114.50 -154.45 -102.55 120.97 2.51 97.32 0.18 2.43 0.08 0.02 0.18 0.03 0.00 97.06 0.20 95 L C E 57.63 13.34 23.16 36.16 99.62 -173.81 -86.50 -27.91 50.18 48.71 1.12 26.10 22.30 2.71 0.43 0.59 0.00 47.25 0.62 96 D C S 71.29 7.27 23.02 30.63 121.22 31.82 -127.43 117.45 84.51 11.91 3.58 23.55 50.54 10.38 1.51 1.73 0.01 11.02 1.25 97 A C T 40.66 16.77 15.17 31.25 95.49 -155.77 -70.60 -21.32 67.50 2.82 29.68 22.06 17.50 28.59 20.42 8.59 0.09 1.76 1.00 98 G C T 34.98 6.80 20.71 28.03 96.24 74.47 -60.74 -42.97 62.20 1.22 36.58 19.30 14.80 28.89 28.12 7.58 0.07 0.63 0.62 99 D H H 55.95 12.52 18.42 30.79 95.35 46.27 -80.66 -15.95 40.70 0.84 58.45 24.64 6.87 10.21 49.63 7.84 0.01 0.44 0.35 100 S H H 19.66 18.91 14.35 32.68 94.82 74.51 -65.79 -36.58 19.93 0.47 79.60 10.33 4.01 7.00 71.81 6.40 0.02 0.27 0.17 101 D H H 90.00 3.23 22.49 25.32 93.38 57.13 -66.08 -36.08 15.62 0.52 83.85 8.04 2.93 5.83 76.72 5.96 0.03 0.33 0.15 102 I H H 51.14 8.94 17.98 28.28 92.85 53.38 -66.13 -41.31 12.93 0.89 86.18 6.71 2.49 5.01 79.59 5.31 0.03 0.66 0.20 103 L H H 23.42 18.11 13.72 31.72 93.07 51.79 -66.57 -40.45 13.74 1.50 84.76 7.48 2.75 5.05 78.38 4.83 0.04 1.16 0.31 104 A H H 54.91 7.92 15.14 24.13 93.41 54.18 -66.88 -34.37 21.16 1.24 77.60 9.15 3.59 9.44 71.88 4.69 0.06 0.87 0.32 105 D H H 109.18 1.99 14.33 16.73 95.70 54.61 -77.43 -16.40 38.77 1.16 60.07 11.70 5.43 22.46 54.94 4.30 0.07 0.66 0.45 106 Q C H 106.74 6.55 10.29 18.16 100.96 68.36 -83.03 3.24 61.90 0.89 37.21 33.37 1.96 24.99 36.29 2.49 0.00 0.44 0.45 107 Q C C 119.27 4.99 12.21 19.00 105.39 133.63 -81.80 90.11 99.92 0.04 0.05 99.79 0.08 0.08 0.03 0.00 0.00 0.02 0.00