# 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 F C C 83.42 11.35 21.25 32.33 120.30 -157.66 -101.93 135.95 99.50 0.50 0.01 99.47 0.13 0.03 0.00 0.00 0.00 0.33 0.03 1 C C C 21.07 20.88 13.92 34.04 121.45 -151.75 -108.76 134.88 58.96 41.01 0.03 58.25 0.66 0.15 0.01 0.02 0.00 39.12 1.80 2 I E E 78.32 7.07 22.29 29.94 120.18 -164.82 -116.70 129.02 25.91 74.08 0.01 22.99 2.01 0.06 0.00 0.01 0.00 74.30 0.63 3 P E E 48.97 16.40 14.87 30.83 114.68 -115.46 -67.90 144.07 21.15 78.84 0.01 20.15 0.43 0.02 0.00 0.00 0.00 79.19 0.21 4 T E E 42.72 11.15 18.35 30.44 128.63 -169.10 -125.58 149.92 9.76 90.23 0.01 8.00 1.32 0.06 0.00 0.01 0.00 90.42 0.19 5 E E E 104.51 8.22 19.40 28.33 115.62 -123.43 -94.75 128.49 4.74 95.25 0.01 3.90 0.48 0.02 0.00 0.00 0.00 95.55 0.04 6 Y E E 34.27 17.31 15.30 33.05 130.60 172.22 -132.87 149.10 1.77 98.23 0.00 1.60 0.05 0.00 0.00 0.00 0.00 98.33 0.02 7 T E E 52.41 9.78 21.80 32.32 120.94 -141.04 -112.96 133.13 1.44 98.56 0.00 1.29 0.03 0.00 0.00 0.00 0.00 98.66 0.01 8 M E E 14.86 21.10 16.95 38.14 125.73 -170.72 -121.51 138.99 0.67 99.33 0.00 0.58 0.02 0.00 0.00 0.00 0.00 99.39 0.01 9 H E E 66.00 10.58 23.25 34.26 120.47 -147.22 -107.19 132.15 0.44 99.56 0.00 0.40 0.01 0.00 0.00 0.00 0.00 99.58 0.01 10 I E E 16.28 20.15 17.36 37.71 123.93 -170.04 -121.31 133.94 1.38 98.61 0.00 1.31 0.04 0.00 0.00 0.00 0.00 98.59 0.05 11 E E E 82.61 8.91 20.36 29.93 118.24 -150.26 -105.11 130.38 17.40 82.58 0.02 15.39 1.30 0.07 0.00 0.01 0.00 82.95 0.28 12 R C C 63.55 14.45 12.10 26.96 115.99 -156.52 -102.08 126.59 79.67 20.14 0.20 73.54 4.81 0.43 0.04 0.16 0.00 20.13 0.88 13 R C T 168.59 2.35 15.65 18.84 96.05 -126.55 -63.96 -31.38 92.77 1.59 5.64 2.62 14.08 74.67 0.18 6.94 0.00 1.17 0.33 14 E C T 143.05 2.14 15.12 17.53 95.79 40.90 -83.95 -0.14 93.48 0.97 5.55 2.40 12.06 77.48 0.18 6.94 0.00 0.69 0.25 15 C C C 28.76 16.11 7.94 23.22 127.28 82.44 -115.35 152.43 82.36 12.06 5.58 52.74 21.93 7.34 0.65 6.11 0.01 7.77 3.46 16 A C S 81.23 2.53 18.00 20.60 94.62 -139.73 -75.87 -15.18 93.21 6.53 0.26 8.03 75.18 9.83 0.02 0.27 0.00 6.18 0.49 17 Y C S 89.66 9.29 16.64 27.02 127.71 51.31 -120.16 149.46 69.05 30.76 0.19 14.94 45.79 7.02 0.01 0.21 0.00 31.23 0.79 18 C E E 42.13 15.05 15.95 31.08 125.37 -147.66 -111.78 141.94 37.28 62.70 0.02 34.23 1.62 0.10 0.00 0.02 0.00 63.73 0.28 19 L E E 25.87 16.09 18.73 35.52 124.72 -161.81 -120.88 137.82 1.07 98.93 0.00 1.08 0.03 0.00 0.00 0.00 0.00 98.84 0.04 20 T E E 57.49 11.04 22.30 33.51 119.39 -144.38 -102.97 132.33 0.20 99.80 0.00 0.18 0.00 0.00 0.00 0.00 0.00 99.81 0.00 21 I E E 12.15 21.84 16.68 38.76 124.15 -170.75 -123.03 134.56 0.33 99.67 0.00 0.30 0.00 0.00 0.00 0.00 0.00 99.69 0.00 22 N E E 72.27 8.44 24.78 33.52 115.21 -146.26 -98.95 124.50 1.23 98.77 0.00 1.07 0.03 0.00 0.00 0.00 0.00 98.88 0.01 23 T E E 8.92 22.77 16.94 39.62 130.42 169.39 -128.40 147.20 4.90 95.10 0.00 4.49 0.16 0.01 0.00 0.00 0.00 95.26 0.09 24 T E E 36.53 11.98 25.38 37.83 119.58 -137.58 -105.68 135.93 10.42 89.55 0.02 6.22 3.98 0.15 0.00 0.02 0.00 89.45 0.16 25 I E E 21.62 20.83 20.86 41.11 121.32 -156.11 -111.81 134.04 13.24 86.64 0.11 9.85 3.14 0.40 0.03 0.09 0.00 85.85 0.66 26 C E E 17.61 17.21 20.53 37.87 121.51 -161.12 -111.16 136.28 25.92 73.89 0.18 22.89 2.11 0.42 0.05 0.14 0.00 72.57 1.83 27 A C E 41.47 13.58 20.60 33.83 111.40 -140.69 -88.27 128.08 57.77 40.36 1.87 14.62 20.84 25.45 0.27 1.71 0.04 33.37 3.71 28 G C S 36.66 8.08 21.78 30.09 105.81 0.63 84.20 -40.88 87.12 11.45 1.43 5.37 41.52 40.72 0.08 1.38 0.00 9.83 1.10 29 Y C S 93.53 11.61 21.07 32.39 122.39 34.14 -120.87 148.29 80.49 17.60 1.92 23.73 38.13 19.39 0.23 1.88 0.01 13.52 3.12 30 C C C 20.87 21.06 16.56 36.98 121.49 -159.82 -110.97 137.42 68.40 30.79 0.81 49.29 15.90 2.79 0.25 0.74 0.00 23.69 7.35 31 M C C 62.56 12.49 22.28 34.80 114.63 -138.89 -94.51 128.34 69.21 29.69 1.11 60.28 5.92 1.73 0.37 0.83 0.00 23.23 7.62 32 T C C 44.20 16.99 17.59 33.74 105.96 -166.28 -101.97 -4.74 80.89 16.81 2.31 53.96 21.20 5.51 0.57 1.97 0.00 13.21 3.56 33 R C C 112.72 8.25 20.83 29.54 119.51 62.59 -111.43 133.17 80.59 16.59 2.81 48.18 26.24 6.32 0.81 2.18 0.01 10.13 6.12 34 D C C 40.04 16.00 13.16 29.10 112.28 -149.14 -91.30 121.00 91.07 7.55 1.39 83.40 5.83 1.75 0.55 0.78 0.00 4.97 2.73 35 I C C 94.51 6.88 16.70 24.70 98.60 -164.70 -81.92 -17.61 88.71 4.85 6.43 37.75 22.09 29.65 2.24 3.65 0.01 2.53 2.08 36 N C T 78.96 7.41 14.46 23.05 99.03 59.73 -86.33 1.89 86.46 3.86 9.68 22.59 26.49 38.12 3.49 5.32 0.03 1.81 2.17 37 G C C 32.24 9.62 13.30 23.94 99.42 -117.75 74.61 6.28 74.69 2.95 22.37 40.06 17.41 17.51 7.09 14.71 0.01 1.30 1.91 38 K H G 106.33 8.87 12.38 22.26 97.27 114.29 -74.21 -18.92 43.71 1.78 54.52 14.56 8.10 21.85 9.89 43.87 0.02 1.02 0.70 39 L H G 122.95 2.70 15.22 18.72 96.67 65.64 -73.75 -16.27 43.20 1.63 55.16 8.27 8.10 27.07 9.53 45.41 0.03 1.00 0.59 40 F H G 114.89 6.91 14.08 21.95 99.99 53.74 -90.97 -12.06 47.33 2.07 50.60 11.65 11.70 25.50 9.27 39.76 0.05 1.15 0.92 41 L C S 41.85 16.02 9.22 24.84 118.74 79.84 -102.74 132.94 94.13 1.85 4.02 23.54 68.48 2.15 3.02 0.78 0.00 0.56 1.46 42 P C C 67.33 4.39 15.87 21.46 113.40 -111.94 -66.32 147.31 87.42 0.84 11.74 77.91 4.86 5.03 6.16 5.09 0.00 0.39 0.54 43 K H G 130.46 6.66 12.72 21.01 94.13 -115.26 -61.97 -32.68 44.67 1.37 53.96 13.91 9.27 21.45 19.41 34.49 0.05 0.71 0.70 44 Y H G 150.69 3.83 14.93 20.09 93.48 59.45 -71.12 -21.54 35.80 2.02 62.18 11.01 6.84 17.97 21.48 40.72 0.07 1.23 0.69 45 A H G 48.93 9.50 15.15 25.60 94.68 63.79 -74.63 -19.84 32.60 2.80 64.60 15.07 6.78 11.56 19.66 44.40 0.02 1.89 0.62 46 L C G 46.49 16.09 14.37 30.04 98.78 57.87 -92.32 3.15 46.05 8.23 45.72 25.19 9.91 12.73 14.68 29.80 0.07 5.87 1.76 47 S C C 50.89 10.99 18.71 30.08 116.69 102.19 -95.45 130.26 61.97 18.95 19.08 41.43 12.50 8.32 8.75 10.68 0.09 13.03 5.20 48 Q C C 45.59 16.19 16.39 32.51 123.23 -171.62 -116.37 137.91 68.99 25.41 5.60 53.67 10.56 4.36 3.12 2.76 0.02 20.83 4.69 49 D C C 78.88 9.75 22.49 32.34 104.87 -145.38 -94.20 28.30 67.61 29.88 2.51 36.93 26.38 4.89 0.94 1.63 0.01 26.00 3.22 50 V C E 30.08 16.30 20.96 37.11 132.65 81.73 -130.81 151.73 49.43 48.77 1.80 32.73 14.40 3.65 0.72 1.31 0.02 41.05 6.11 51 C E E 13.60 21.83 18.94 40.82 115.56 -122.69 -89.75 130.63 47.01 52.24 0.76 37.35 7.14 1.74 0.27 0.60 0.00 46.76 6.14 52 T E E 35.72 13.46 23.66 37.32 108.47 -169.89 -105.60 24.19 48.06 51.52 0.42 34.41 12.28 1.63 0.13 0.39 0.00 46.36 4.80 53 Y E E 37.09 20.03 15.71 35.15 117.33 -143.42 -95.89 135.07 49.10 50.23 0.67 37.71 9.57 1.66 0.20 0.57 0.00 46.99 3.30 54 R C E 140.10 5.61 20.05 26.54 98.97 -164.69 -87.44 -25.42 57.89 41.84 0.26 19.81 34.12 3.05 0.02 0.26 0.00 42.23 0.51 55 D E E 74.96 4.79 22.22 27.24 130.65 19.22 -135.96 150.61 29.27 70.45 0.28 19.56 7.76 1.50 0.03 0.26 0.00 70.59 0.30 56 F E E 50.98 21.15 12.98 33.06 124.50 -161.01 -117.71 134.49 6.54 93.45 0.01 6.09 0.26 0.02 0.00 0.01 0.00 93.50 0.12 57 I E E 57.73 8.28 22.00 31.42 122.00 -165.95 -119.40 132.15 0.89 99.11 0.00 0.80 0.03 0.00 0.00 0.00 0.00 99.15 0.02 58 Y E E 81.09 16.47 15.95 32.00 119.54 -152.57 -102.93 132.09 0.79 99.21 0.00 0.68 0.02 0.00 0.00 0.00 0.00 99.29 0.01 59 R E E 77.26 10.91 19.74 31.38 126.83 -174.39 -126.17 140.10 0.83 99.17 0.00 0.72 0.02 0.00 0.00 0.00 0.00 99.24 0.00 60 T E E 54.14 13.83 18.09 31.98 124.18 -157.60 -115.63 137.08 0.53 99.47 0.00 0.49 0.01 0.00 0.00 0.00 0.00 99.49 0.00 61 V E E 22.99 15.83 17.88 34.64 128.00 -171.52 -127.96 139.59 0.32 99.68 0.00 0.29 0.01 0.00 0.00 0.00 0.00 99.69 0.00 62 E E E 95.81 8.21 22.22 30.95 115.60 -141.94 -100.02 125.86 0.74 99.26 0.00 0.69 0.02 0.00 0.00 0.00 0.00 99.23 0.05 63 I C C 12.61 21.63 12.71 34.68 111.28 -157.87 -105.30 113.88 58.29 41.70 0.01 56.84 0.77 0.03 0.00 0.01 0.00 41.95 0.40 64 P C T 75.54 5.60 19.32 25.71 113.82 -134.77 -67.08 144.70 89.48 10.24 0.29 6.16 9.20 74.32 0.01 0.32 0.00 9.68 0.31 65 G C T 56.13 2.25 18.86 21.15 95.18 20.40 80.90 1.02 97.67 2.13 0.20 4.68 15.18 77.59 0.01 0.28 0.00 2.13 0.14 66 C C C 22.18 19.76 7.71 25.83 121.30 128.91 -89.24 147.04 92.94 6.95 0.11 66.66 26.34 0.35 0.03 0.09 0.00 3.45 3.09 67 P C C 64.93 4.22 16.24 21.48 115.31 -102.57 -65.57 153.75 97.84 2.10 0.07 95.94 1.71 0.32 0.02 0.04 0.00 0.73 1.24 68 L C T 129.20 3.03 13.00 17.66 101.07 -94.33 -61.75 -18.34 99.35 0.23 0.41 1.05 10.67 87.60 0.02 0.42 0.00 0.13 0.10 69 H C T 155.79 1.86 15.37 17.52 95.18 31.97 5.48 6.84 99.37 0.23 0.40 1.63 10.79 86.90 0.02 0.46 0.00 0.14 0.06 70 V C C 47.60 12.95 10.79 24.42 122.81 99.91 -108.40 144.65 82.11 17.17 0.71 43.38 35.53 2.64 0.20 0.52 0.00 5.01 12.72 71 A C C 50.87 7.28 16.97 25.42 113.89 -117.22 -78.86 132.17 93.50 6.39 0.11 90.47 3.28 0.28 0.01 0.11 0.00 5.19 0.66 72 P C S 58.75 12.63 15.15 28.28 94.16 -137.87 -69.40 -20.81 90.42 9.21 0.37 21.90 55.06 13.15 0.01 0.55 0.00 8.97 0.36 73 Y E E 97.56 10.73 19.34 30.47 125.85 46.36 -125.30 135.99 23.20 76.39 0.41 9.35 6.82 7.48 0.02 0.49 0.00 75.54 0.30 74 F E E 34.26 17.34 17.85 35.35 129.55 -174.00 -128.43 144.46 4.46 95.52 0.02 3.87 0.43 0.04 0.00 0.01 0.00 95.54 0.10 75 S E E 37.79 13.68 22.48 35.95 125.85 -154.35 -117.05 139.39 0.64 99.36 0.00 0.59 0.02 0.00 0.00 0.00 0.00 99.35 0.04 76 Y E E 22.38 20.87 20.79 41.03 126.97 -172.79 -131.10 135.21 2.88 97.12 0.00 2.67 0.05 0.00 0.00 0.00 0.00 97.25 0.02 77 P E E 24.07 16.67 24.62 40.98 114.05 -112.98 -70.23 141.98 4.73 95.27 0.00 4.15 0.23 0.01 0.00 0.00 0.00 95.55 0.05 78 V E E 15.28 20.63 23.73 43.52 126.54 -168.06 -123.07 139.13 1.09 98.91 0.00 1.00 0.05 0.00 0.00 0.00 0.00 98.84 0.10 79 A E E 6.00 23.09 19.09 42.79 109.73 -113.36 -74.00 126.22 2.18 97.81 0.01 2.15 0.05 0.01 0.00 0.00 0.00 97.52 0.26 80 L E E 60.55 10.89 23.88 35.11 100.69 176.34 -96.70 -29.26 19.44 80.44 0.12 9.06 8.90 2.16 0.01 0.13 0.00 79.40 0.34 81 S E E 48.65 6.59 26.19 33.83 138.43 -0.23 -154.42 150.14 32.60 67.31 0.09 10.07 20.28 2.53 0.01 0.10 0.00 66.54 0.48 82 C E E 17.00 24.10 13.48 36.80 127.75 -166.05 -129.56 142.28 43.55 56.34 0.12 39.16 3.35 0.27 0.03 0.10 0.00 54.72 2.38 83 K C C 101.24 6.33 25.33 32.05 116.04 -174.36 -124.16 103.90 51.32 48.10 0.58 42.49 6.01 1.29 0.20 0.49 0.00 37.99 11.52 84 C C C 39.06 17.08 15.20 31.39 111.33 -83.73 -86.00 118.79 71.64 24.42 3.94 34.54 23.83 14.78 0.36 4.21 0.01 18.01 4.25 85 G C S 40.59 6.10 20.37 26.90 113.47 24.15 80.65 -142.92 84.84 12.42 2.73 13.32 50.54 20.71 0.14 3.07 0.00 10.67 1.54 86 K C C 126.64 4.85 20.97 26.50 115.32 -1.33 -108.20 127.72 77.36 20.20 2.44 41.03 25.78 10.48 0.33 2.70 0.01 14.51 5.16 87 C C C 21.68 21.09 11.67 31.70 123.46 107.75 -108.30 139.83 70.36 29.33 0.31 62.66 6.86 0.52 0.13 0.21 0.00 13.65 15.97 88 N C C 65.44 6.54 22.07 29.17 112.12 -141.87 -106.74 122.79 86.99 12.91 0.10 86.15 1.57 0.24 0.04 0.06 0.00 6.16 5.78 89 T C T 51.61 16.83 12.92 29.49 93.58 -150.87 -72.99 -12.67 99.20 0.36 0.43 3.89 9.85 85.44 0.06 0.39 0.00 0.22 0.14 90 D C T 112.25 2.06 18.63 20.57 94.91 61.80 -87.10 -6.93 99.36 0.19 0.45 3.12 10.82 85.40 0.06 0.41 0.00 0.12 0.06 91 Y C S 93.27 8.99 14.13 24.33 124.30 70.92 -109.92 148.15 94.21 4.17 1.62 38.35 51.08 4.50 0.60 0.89 0.00 1.43 3.16 92 S C S 63.65 9.34 16.79 26.73 97.96 -142.33 -84.40 -10.78 85.01 3.14 11.85 28.93 37.53 19.41 6.72 4.39 0.02 1.58 1.44 93 D C C 68.73 8.06 20.21 28.81 109.08 74.21 -92.38 102.19 69.40 10.95 19.65 29.19 23.06 18.45 12.14 6.72 0.26 6.05 4.14 94 C C C 18.15 20.09 14.08 33.69 106.66 -151.67 -83.42 75.83 57.09 20.92 21.99 40.78 8.77 6.66 16.74 5.88 0.14 13.72 7.30 95 I C C 65.28 10.99 19.77 30.90 100.16 115.13 -85.87 -27.32 43.72 24.73 31.55 29.40 8.84 6.31 25.56 5.78 0.23 18.35 5.54 96 H H H 87.10 9.12 18.14 27.68 98.60 57.32 -73.53 -27.06 37.32 24.14 38.54 22.83 8.39 7.69 30.07 7.24 0.43 19.40 3.95 97 E H H 87.53 8.93 16.80 26.29 99.16 56.35 -78.52 -24.04 39.33 18.08 42.59 23.76 7.72 9.07 32.01 9.33 0.26 14.95 2.90 98 A C H 41.15 12.20 13.31 25.84 97.96 59.02 -73.30 -27.87 45.85 11.15 42.99 23.19 10.01 14.23 30.57 10.98 0.37 8.20 2.44 99 I C H 91.06 7.62 14.52 23.04 98.54 53.55 -81.14 -21.71 54.59 7.58 37.83 19.94 14.44 21.44 26.10 10.49 0.52 4.68 2.38 100 K C T 135.12 3.76 15.93 20.51 101.27 44.21 -87.00 10.40 67.12 5.26 27.62 20.76 18.88 28.59 16.65 9.85 0.24 2.90 2.13 101 T C T 66.56 8.81 14.50 24.00 107.28 49.41 -92.87 98.20 76.88 4.54 18.58 25.72 18.02 34.31 8.08 9.46 0.04 2.70 1.67 102 N C C 77.36 11.27 16.00 27.41 102.11 -131.71 -91.09 35.73 78.34 10.51 11.15 35.89 19.66 24.38 2.79 7.81 0.02 7.25 2.20 103 Y C C 93.78 10.56 18.80 29.83 120.81 108.72 -112.41 136.68 66.51 26.24 7.25 42.28 13.82 10.02 2.46 5.22 0.05 18.84 7.31 104 C C C 24.76 19.22 13.39 31.96 115.91 -146.26 -100.08 131.93 67.01 30.98 2.01 53.14 9.79 2.82 0.96 1.30 0.01 19.82 12.18 105 T C C 73.21 7.92 19.04 27.49 103.30 -168.24 -97.52 0.38 81.93 17.42 0.65 51.09 29.51 1.90 0.27 0.46 0.00 11.75 5.01 106 K C S 116.68 5.57 17.07 23.82 120.30 52.64 -102.08 138.01 90.12 9.70 0.17 43.78 46.43 0.79 0.06 0.11 0.00 7.51 1.32 107 P C C 72.41 9.77 13.80 24.44 114.16 -104.98 -67.02 147.50 91.14 7.97 0.89 79.84 8.71 2.41 0.25 0.66 0.00 6.05 2.07 108 Q C C 95.45 10.07 12.04 22.88 113.50 -126.13 -87.24 130.66 84.20 12.87 2.93 70.44 9.35 3.44 1.04 1.99 0.00 6.49 7.25 109 K C C 128.50 4.71 14.31 20.62 117.64 -138.68 -98.88 137.83 84.62 8.19 7.18 64.82 13.59 5.93 2.09 5.39 0.00 5.74 2.43 110 S C C 72.33 6.80 12.67 20.78 108.76 -125.26 -82.23 119.21 77.67 8.94 13.39 45.19 20.33 12.91 3.12 10.18 0.01 6.15 2.11 111 Y C C 120.59 8.25 12.96 22.28 114.42 -163.42 -101.91 123.63 70.89 13.38 15.73 40.55 18.81 12.56 4.68 10.83 0.04 9.02 3.51 112 L C C 92.99 8.28 12.96 22.29 110.08 -147.07 -89.74 111.43 71.19 14.50 14.31 51.08 11.27 8.64 5.18 9.35 0.02 10.68 3.78 113 V C C 79.83 8.81 12.78 22.65 111.46 -170.33 -96.95 113.18 77.81 11.93 10.27 42.62 15.15 21.03 3.44 6.43 0.03 8.50 2.81 114 G C C 45.64 6.43 13.64 21.14 109.43 -89.96 76.00 81.59 84.67 8.83 6.50 41.22 19.75 24.71 1.48 4.79 0.01 6.30 1.75 115 F C C 111.62 8.49 11.12 20.69 114.08 121.21 -97.01 125.67 81.53 13.22 5.25 55.02 18.94 7.71 1.58 3.79 0.01 9.25 3.69 116 S C C 75.15 4.85 12.26 18.66 111.36 -139.83 -85.19 128.36 85.33 12.75 1.92 79.47 2.27 3.49 0.75 0.92 0.00 8.79 4.30 117 V C C 84.98 9.25 11.89 21.84 107.49 -159.41 -90.16 71.68 99.63 0.36 0.01 99.65 0.08 0.02 0.00 0.00 0.00 0.20 0.04