# 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 119.33 4.80 13.08 19.30 114.06 -155.86 -92.21 127.80 99.94 0.05 0.01 99.88 0.06 0.02 0.00 0.00 0.00 0.02 0.00 1 A C C 67.79 6.43 9.98 17.95 113.46 -129.20 -81.90 142.47 85.82 2.42 11.76 81.41 1.23 5.57 3.81 5.64 0.00 1.66 0.69 2 S C C 75.17 4.56 11.35 17.62 113.37 -141.66 -89.53 134.11 79.73 5.12 15.15 52.47 14.52 13.10 3.86 11.18 0.00 3.67 1.20 3 E C C 127.50 4.35 13.00 19.02 113.86 -135.12 -94.34 127.26 74.41 8.87 16.72 52.79 12.72 9.34 4.69 11.81 0.01 7.05 1.59 4 V C C 69.09 11.82 11.52 23.73 116.54 -154.72 -98.23 130.40 76.54 13.26 10.19 59.47 11.67 5.38 4.91 5.03 0.01 11.53 2.00 5 T C C 69.47 8.80 15.81 25.47 116.95 -164.33 -105.59 134.71 75.06 19.15 5.80 59.52 9.66 4.89 2.54 2.89 0.00 18.96 1.53 6 S C C 56.44 10.26 17.37 27.99 126.37 -163.29 -121.58 144.95 62.53 34.82 2.64 45.67 12.50 3.57 0.95 1.55 0.00 34.42 1.33 7 A E E 24.81 17.16 15.55 32.58 131.56 -170.52 -131.14 149.61 41.76 57.31 0.94 35.98 3.70 0.96 0.33 0.47 0.00 57.83 0.72 8 K E E 97.17 10.19 22.01 32.66 128.26 -161.18 -127.15 141.45 16.39 83.19 0.42 14.55 1.54 0.35 0.20 0.18 0.00 82.28 0.91 9 A E E 14.32 20.88 17.26 37.69 132.43 -172.75 -133.43 147.94 9.95 89.84 0.21 9.02 0.78 0.16 0.10 0.07 0.00 89.46 0.40 10 V E E 56.09 11.14 23.79 35.17 126.75 -161.91 -127.41 136.47 8.04 91.82 0.14 7.40 0.59 0.10 0.07 0.05 0.00 91.23 0.56 11 A E E 15.60 20.62 15.53 35.77 120.01 -154.77 -109.46 133.44 16.39 83.17 0.44 15.61 0.87 0.22 0.17 0.20 0.00 82.33 0.61 12 K E E 112.16 6.56 21.94 29.08 102.32 -168.42 -92.69 -30.38 35.75 63.79 0.46 14.08 19.30 2.64 0.07 0.36 0.00 63.22 0.33 13 T E E 70.54 8.31 22.63 30.90 119.16 9.54 -137.66 112.56 27.36 72.17 0.47 18.35 7.68 1.88 0.08 0.37 0.00 71.17 0.47 14 V E E 14.77 22.87 14.66 37.28 119.82 -170.26 -113.83 128.18 25.97 73.71 0.31 24.22 1.60 0.25 0.13 0.17 0.00 71.31 2.31 15 R C C 127.73 6.30 25.17 31.99 110.90 -151.95 -96.39 116.29 58.79 41.07 0.14 47.35 10.56 0.44 0.05 0.10 0.00 40.25 1.26 16 I C C 14.30 22.60 14.15 36.60 131.50 151.41 -130.67 149.37 82.26 17.61 0.14 69.18 14.35 0.23 0.09 0.07 0.00 12.58 3.50 17 A C C 39.20 6.50 22.70 29.85 116.02 -105.10 -69.70 150.93 99.67 0.25 0.08 99.45 0.31 0.03 0.05 0.00 0.00 0.11 0.04 18 P H H 50.40 15.75 15.44 31.10 91.71 -115.18 -57.78 -38.23 3.29 0.01 96.70 0.61 0.35 2.09 95.77 1.18 0.00 0.00 0.00 19 R H H 146.46 2.99 22.67 25.89 91.67 54.28 -63.55 -39.51 1.73 0.01 98.26 0.22 0.14 1.23 97.05 1.36 0.00 0.00 0.00 20 K H H 69.57 12.39 21.54 33.59 92.17 48.16 -67.10 -38.58 1.16 0.01 98.83 0.28 0.11 0.67 97.48 1.44 0.00 0.01 0.00 21 A H H 1.72 26.49 16.38 43.49 91.16 53.04 -63.15 -42.19 0.51 0.00 99.48 0.13 0.05 0.24 99.41 0.17 0.00 0.00 0.00 22 R H H 98.00 11.90 23.58 34.95 91.36 52.59 -62.28 -41.28 0.21 0.00 99.79 0.04 0.01 0.09 99.81 0.05 0.00 0.00 0.00 23 I H H 62.38 7.23 25.48 33.30 91.68 50.83 -64.17 -42.33 0.11 0.00 99.89 0.01 0.00 0.06 99.88 0.04 0.00 0.00 0.00 24 V H H 3.50 24.94 21.51 46.28 91.80 49.13 -64.25 -44.02 0.11 0.00 99.89 0.01 0.00 0.08 99.86 0.06 0.00 0.00 0.00 25 I H H 6.17 24.96 20.34 44.99 91.47 50.16 -63.11 -41.86 0.16 0.00 99.84 0.01 0.01 0.13 99.70 0.17 0.00 0.00 0.00 26 D H H 82.41 5.82 25.52 31.98 91.03 53.49 -64.25 -35.89 1.08 0.00 98.92 0.03 0.02 1.08 97.84 1.04 0.00 0.00 0.00 27 L H H 50.22 12.78 22.55 35.40 91.52 54.05 -69.25 -27.66 4.78 0.00 95.22 0.04 0.07 5.36 93.17 1.35 0.00 0.00 0.00 28 I H H 2.64 26.18 15.53 42.80 95.69 49.30 -89.49 -13.96 27.76 0.04 72.19 0.78 1.20 25.97 70.15 1.82 0.03 0.01 0.04 29 R C T 101.21 13.88 17.45 31.44 112.32 116.34 -62.53 131.67 98.35 0.07 1.57 0.31 0.62 97.72 1.16 0.11 0.00 0.02 0.06 30 G C T 52.62 2.97 21.43 24.95 94.02 18.62 84.33 -2.57 99.80 0.01 0.19 0.15 0.86 98.85 0.10 0.03 0.00 0.00 0.00 31 K C C 63.33 13.77 15.69 29.84 124.50 123.79 -86.78 154.63 99.64 0.35 0.01 59.17 40.45 0.11 0.01 0.01 0.00 0.13 0.14 32 Q E B 81.35 6.14 24.37 30.77 117.68 -105.72 -72.50 152.99 8.11 91.86 0.03 5.74 0.11 0.00 0.03 0.00 0.00 3.33 90.79 33 V H H 12.20 23.89 14.83 38.86 91.18 -112.14 -57.54 -39.79 0.47 0.00 99.53 0.03 0.02 0.37 99.27 0.31 0.00 0.00 0.00 34 G H H 33.02 7.69 22.94 31.10 91.44 53.46 -62.46 -41.46 0.16 0.00 99.84 0.01 0.01 0.13 99.59 0.27 0.00 0.00 0.00 35 E H H 95.35 4.58 25.42 29.98 91.64 48.37 -65.99 -40.06 0.06 0.00 99.94 0.00 0.00 0.04 99.76 0.20 0.00 0.00 0.00 36 A H H 2.70 24.15 17.20 41.71 91.50 51.31 -63.38 -43.34 0.08 0.00 99.92 0.01 0.00 0.05 99.89 0.05 0.00 0.00 0.00 37 I H H 30.29 18.13 20.79 38.22 91.48 50.63 -62.79 -42.21 0.13 0.00 99.87 0.01 0.00 0.08 99.83 0.08 0.00 0.00 0.00 38 A H H 55.52 3.03 25.13 27.25 91.25 51.14 -63.16 -41.61 0.38 0.00 99.62 0.01 0.01 0.33 98.99 0.66 0.00 0.00 0.00 39 I H H 38.31 12.86 20.77 34.15 91.78 49.99 -64.58 -41.70 0.94 0.00 99.06 0.03 0.02 0.82 96.32 2.80 0.00 0.00 0.00 40 L H H 4.43 25.49 14.08 39.83 91.22 52.88 -66.16 -34.13 3.47 0.01 96.52 0.19 0.15 2.96 88.26 8.43 0.00 0.00 0.00 41 K H H 121.81 7.19 19.54 27.89 91.05 61.57 -66.10 -24.09 35.64 0.03 64.32 0.66 0.80 35.66 57.12 5.71 0.01 0.01 0.03 42 Y C T 153.80 3.04 19.51 22.72 95.83 50.60 -93.44 -2.08 60.21 0.07 39.72 1.84 3.00 55.03 35.58 4.45 0.01 0.03 0.07 43 T C S 25.31 18.67 9.00 26.86 117.83 99.58 -85.30 137.14 99.47 0.25 0.28 33.74 65.18 0.58 0.20 0.06 0.00 0.05 0.20 44 P C C 106.45 2.54 18.80 21.46 96.85 -132.41 -72.82 8.22 99.10 0.37 0.53 71.54 24.25 3.24 0.18 0.32 0.00 0.13 0.33 45 R C S 98.57 11.51 13.62 25.64 120.95 104.12 -93.53 146.01 84.98 1.90 13.12 30.28 43.45 11.65 5.55 6.36 0.01 0.55 2.13 46 S C T 71.83 5.21 20.77 26.70 95.22 -120.80 -65.41 -25.61 78.44 0.63 20.93 6.89 18.44 53.59 6.85 13.31 0.02 0.27 0.63 47 A C T 11.95 20.73 16.01 36.28 94.71 57.27 -81.16 -10.92 67.21 0.46 32.33 13.94 8.40 44.45 18.47 14.11 0.01 0.18 0.43 48 S H H 13.75 19.78 16.78 36.61 92.75 91.70 -59.60 -41.19 8.46 0.04 91.50 5.34 1.25 1.83 90.27 1.28 0.00 0.01 0.01 49 P H H 69.67 5.07 25.00 30.30 91.13 54.87 -63.37 -38.23 1.85 0.01 98.15 0.56 0.15 0.85 97.93 0.50 0.00 0.00 0.00 50 I H H 36.62 13.80 23.35 37.11 91.89 50.09 -65.13 -41.94 0.34 0.00 99.66 0.07 0.02 0.17 99.50 0.23 0.00 0.00 0.00 51 I H H 1.53 27.37 20.10 47.93 91.39 49.81 -63.97 -43.08 0.07 0.00 99.93 0.01 0.00 0.04 99.91 0.04 0.00 0.00 0.00 52 E H H 53.81 16.03 23.48 38.37 91.28 51.65 -62.37 -42.19 0.05 0.00 99.95 0.00 0.00 0.02 99.96 0.01 0.00 0.00 0.00 53 K H H 108.49 3.79 27.63 31.50 91.55 50.01 -64.56 -41.39 0.04 0.00 99.96 0.00 0.00 0.02 99.97 0.00 0.00 0.00 0.00 54 V H H 10.80 19.43 22.68 41.90 91.51 49.45 -63.96 -43.69 0.05 0.00 99.95 0.00 0.00 0.03 99.97 0.00 0.00 0.00 0.00 55 L H H 2.37 26.72 20.99 47.82 91.23 48.89 -63.68 -42.86 0.09 0.00 99.91 0.00 0.00 0.05 99.93 0.01 0.00 0.00 0.00 56 K H H 101.75 8.04 26.21 34.78 91.38 50.56 -63.53 -41.68 0.16 0.00 99.84 0.01 0.01 0.10 99.87 0.01 0.00 0.00 0.00 57 S H H 43.22 6.21 26.31 33.24 91.70 49.79 -64.46 -41.94 0.36 0.00 99.64 0.03 0.02 0.26 99.67 0.02 0.00 0.00 0.00 58 A H H 4.17 22.20 20.78 43.00 91.61 49.91 -63.95 -42.89 0.40 0.00 99.60 0.06 0.03 0.26 99.61 0.04 0.00 0.00 0.00 59 I H H 22.75 18.93 21.94 40.21 91.45 49.84 -63.03 -42.79 0.26 0.00 99.74 0.04 0.02 0.16 99.73 0.05 0.00 0.00 0.00 60 A H H 51.49 3.29 25.28 27.98 91.26 50.27 -62.70 -42.39 0.45 0.00 99.55 0.05 0.02 0.29 99.57 0.08 0.00 0.00 0.00 61 N H H 51.66 7.88 22.22 30.96 92.12 48.72 -65.65 -40.17 1.28 0.00 98.72 0.11 0.08 0.92 98.70 0.19 0.00 0.00 0.00 62 A H H 5.25 20.57 13.77 34.96 91.57 51.50 -64.21 -41.59 2.09 0.01 97.90 0.23 0.18 1.48 97.66 0.44 0.00 0.00 0.00 63 E H H 93.18 8.08 16.91 25.78 92.54 50.09 -65.80 -39.81 6.15 0.03 93.81 0.61 0.53 4.84 93.24 0.73 0.02 0.01 0.02 64 H H H 146.79 1.09 17.94 17.49 95.13 43.50 -72.33 -38.36 15.53 0.03 84.44 0.60 0.98 13.83 83.63 0.90 0.02 0.01 0.02 65 N H H 93.15 4.97 14.97 20.99 100.43 32.16 -91.99 -27.36 39.37 0.08 60.55 1.65 3.41 32.88 60.94 1.02 0.03 0.02 0.06 66 Y C S 85.65 10.95 11.29 23.05 106.75 25.33 -116.91 10.51 79.11 0.49 20.41 15.41 35.06 27.37 19.85 1.71 0.01 0.13 0.46 67 D C C 131.78 0.71 17.99 16.77 94.65 -120.54 54.31 40.30 99.60 0.09 0.31 63.62 16.36 19.62 0.08 0.21 0.00 0.04 0.07 68 L C C 35.52 17.55 8.52 25.19 122.13 145.76 -99.24 146.76 99.53 0.35 0.12 88.74 10.33 0.40 0.04 0.06 0.00 0.10 0.33 69 D C C 86.42 2.94 22.60 24.70 107.42 -122.16 -85.30 114.18 99.75 0.18 0.06 99.39 0.37 0.08 0.01 0.02 0.00 0.06 0.06 70 I H G 40.97 20.82 11.27 31.38 92.98 -160.38 -64.82 -26.72 10.57 0.19 89.24 1.15 1.01 6.42 0.44 90.85 0.00 0.13 0.01 71 N H G 111.63 3.71 20.21 24.84 90.82 66.56 -69.83 -16.52 10.82 0.18 89.00 0.43 0.84 7.80 0.35 90.44 0.00 0.13 0.01 72 N H G 77.29 7.06 20.11 28.25 97.60 53.94 -96.84 4.63 11.35 0.45 88.21 1.34 1.48 6.39 0.38 90.02 0.00 0.36 0.01 73 L E E 8.20 25.00 12.55 37.75 117.23 107.04 -88.97 135.35 22.64 77.29 0.07 20.07 2.38 0.10 0.01 0.05 0.00 76.98 0.41 74 V E E 43.96 9.62 26.69 37.03 123.80 -167.21 -120.92 134.89 1.01 98.99 0.00 0.89 0.04 0.00 0.00 0.00 0.00 99.00 0.06 75 V E E 16.51 23.30 15.93 39.37 110.30 -126.62 -82.84 121.11 0.29 99.71 0.00 0.26 0.00 0.00 0.00 0.00 0.00 99.73 0.01 76 E E E 85.83 7.20 22.56 30.51 100.39 176.36 -92.89 -34.68 1.30 98.70 0.00 0.77 0.31 0.01 0.00 0.00 0.00 98.90 0.01 77 E E E 82.76 5.98 24.80 31.72 139.60 0.05 -155.08 150.13 0.66 99.34 0.00 0.42 0.10 0.00 0.00 0.00 0.00 99.47 0.00 78 A E E 15.43 24.13 14.09 37.64 129.26 -170.46 -133.70 138.75 0.53 99.47 0.00 0.45 0.02 0.00 0.00 0.00 0.00 99.52 0.00 79 F E E 77.36 7.73 25.96 34.33 130.40 -173.84 -134.83 143.23 0.30 99.70 0.00 0.26 0.01 0.00 0.00 0.00 0.00 99.72 0.00 80 V E E 33.08 20.99 15.07 35.34 121.90 -158.82 -115.31 132.69 2.39 97.61 0.00 2.19 0.08 0.00 0.00 0.00 0.00 97.68 0.05 81 D E E 59.94 8.72 20.63 29.86 121.37 -168.19 -116.35 139.20 18.03 81.95 0.02 14.98 2.41 0.13 0.00 0.02 0.00 82.07 0.39 82 E E E 108.87 9.21 17.20 27.07 116.24 -128.61 -90.98 132.96 41.37 58.54 0.08 35.34 4.91 0.34 0.02 0.08 0.00 57.70 1.61 83 G C C 21.14 13.28 11.96 25.62 126.80 -143.36 -93.07 173.75 67.42 32.44 0.14 54.86 11.00 0.75 0.03 0.14 0.00 32.22 1.01 84 P C C 85.64 4.19 16.91 21.78 113.14 -76.65 -69.82 151.23 67.31 32.32 0.37 41.67 23.06 2.45 0.05 0.36 0.00 31.57 0.84 85 T E E 81.09 7.76 12.03 21.13 118.77 -121.82 -102.26 138.09 37.68 61.64 0.68 30.18 6.77 1.24 0.22 0.48 0.00 59.16 1.96 86 L E E 86.19 7.33 10.96 20.08 119.80 -152.98 -106.34 136.08 25.03 74.46 0.51 22.42 2.26 0.43 0.24 0.25 0.00 72.76 1.64 87 K E E 135.05 3.88 12.39 18.35 117.75 -142.79 -99.47 132.73 20.08 79.65 0.27 18.12 1.52 0.28 0.10 0.13 0.00 78.85 0.98 88 R E E 133.03 5.39 11.01 18.37 122.82 -165.88 -113.06 141.09 23.63 76.12 0.25 21.67 1.61 0.26 0.11 0.12 0.00 75.03 1.20 89 F E E 122.76 5.33 9.26 16.64 117.32 -132.96 -95.55 135.53 33.82 65.86 0.32 31.51 1.82 0.29 0.17 0.16 0.00 62.57 3.49 90 R C C 147.42 3.09 10.88 15.82 119.59 -155.51 -109.08 134.84 64.98 34.46 0.56 60.76 3.00 0.44 0.27 0.27 0.00 33.90 1.36 91 P C C 91.41 3.75 8.46 14.21 113.09 -113.04 -70.24 143.67 53.40 28.02 18.57 39.45 7.41 7.06 7.43 10.97 0.02 25.00 2.66 92 R C G 157.70 2.47 7.91 12.18 112.25 -146.36 -96.23 147.67 48.68 9.10 42.22 28.43 10.10 11.87 8.93 31.92 0.03 7.12 1.61 93 A H G 90.96 1.28 7.36 9.68 113.21 -72.77 -86.95 132.97 39.09 8.05 52.86 12.22 10.66 19.64 6.54 43.14 0.13 5.94 1.73 94 Q C G 160.22 0.54 8.72 8.93 99.30 -7.94 30.26 37.07 53.18 1.53 45.28 6.23 11.10 35.49 4.12 41.38 0.02 0.88 0.77 95 G C T 64.17 0.82 8.99 10.14 99.74 -53.65 81.78 1.92 82.33 1.86 15.81 8.39 24.67 49.52 1.73 13.78 0.01 1.15 0.75 96 R C C 153.84 1.89 8.99 12.49 121.53 107.16 -103.58 146.21 69.26 21.69 9.05 33.35 22.72 14.91 2.05 6.59 0.11 14.38 5.89 97 A C C 73.33 4.61 8.51 15.13 116.58 -129.82 -90.61 140.27 64.94 30.40 4.66 45.35 13.41 6.36 1.50 3.50 0.03 24.38 5.48 98 S C C 59.28 5.16 11.33 18.34 123.50 -165.49 -113.33 148.64 64.00 34.41 1.60 48.82 11.86 3.14 0.42 1.24 0.00 32.72 1.80 99 A C C 70.55 4.83 12.81 19.36 114.33 -107.27 -74.43 141.19 55.50 43.98 0.52 48.08 5.13 0.95 0.14 0.35 0.00 44.26 1.09 100 I E E 79.17 9.24 11.44 21.96 118.15 -155.10 -107.29 134.90 29.32 70.45 0.23 26.99 1.67 0.28 0.10 0.12 0.00 68.21 2.63 101 N E E 84.83 7.26 13.77 22.50 117.35 -149.68 -102.65 128.21 23.15 76.69 0.17 20.65 1.65 0.25 0.07 0.10 0.00 74.08 3.20 102 K E E 104.63 9.05 14.74 24.88 122.17 -170.84 -115.68 136.22 42.50 57.33 0.16 34.67 6.69 0.45 0.04 0.12 0.00 56.89 1.13 103 R C E 108.96 10.08 16.35 27.01 120.19 -150.90 -102.20 136.18 51.42 48.45 0.14 45.56 4.64 0.37 0.03 0.11 0.00 48.23 1.06 104 T E E 47.71 12.36 18.24 31.02 126.80 -159.34 -118.20 146.90 40.68 59.22 0.11 38.41 1.68 0.18 0.03 0.07 0.00 57.91 1.72 105 S E E 14.36 18.91 16.49 35.44 126.05 -151.90 -119.44 145.79 22.56 77.39 0.04 20.95 1.21 0.09 0.01 0.03 0.00 76.89 0.83 106 H E E 65.85 10.68 23.23 34.31 120.39 -150.79 -112.16 132.23 10.23 89.76 0.01 8.83 0.93 0.04 0.00 0.01 0.00 90.00 0.19 107 I E E 11.44 22.95 17.74 40.75 122.10 -163.70 -114.52 131.64 2.45 97.55 0.00 2.31 0.07 0.00 0.00 0.00 0.00 97.57 0.05 108 T E E 31.72 10.94 25.62 37.42 121.48 -165.01 -114.45 132.24 0.59 99.41 0.00 0.54 0.02 0.00 0.00 0.00 0.00 99.43 0.01 109 V E E 6.62 24.09 18.90 43.31 120.20 -163.07 -113.42 128.46 0.23 99.76 0.00 0.22 0.00 0.00 0.00 0.00 0.00 99.77 0.00 110 V E E 31.62 10.59 26.38 38.14 119.67 -164.94 -114.07 128.69 0.24 99.76 0.00 0.23 0.00 0.00 0.00 0.00 0.00 99.76 0.00 111 V E E 10.06 22.94 17.82 41.01 120.19 -163.05 -109.89 130.25 1.10 98.89 0.00 1.02 0.03 0.00 0.00 0.00 0.00 98.93 0.02 112 S E E 32.86 9.77 22.42 32.84 134.18 176.88 -134.11 158.41 6.78 93.19 0.03 5.97 0.47 0.05 0.01 0.01 0.00 93.33 0.16 113 E E E 81.97 12.25 16.36 28.88 116.66 -114.76 -92.32 136.42 24.61 75.12 0.27 21.73 2.29 0.39 0.08 0.17 0.00 74.61 0.73 114 V C C 76.95 8.80 13.12 23.11 115.31 -130.54 -90.10 134.99 59.96 38.92 1.12 51.61 5.29 1.82 0.31 0.77 0.00 38.91 1.28 115 K C C 134.08 4.45 11.20 17.72 115.11 -133.79 -91.18 134.57 75.32 23.66 1.02 66.41 5.47 2.34 0.30 0.72 0.00 22.80 1.96 116 E C C 144.79 2.57 10.21 14.74 112.72 -130.84 -90.97 131.73 92.39 7.15 0.46 89.15 1.23 2.19 0.14 0.22 0.00 6.39 0.68 117 G C C 56.90 1.86 13.05 15.60 113.31 15.16 89.56 -111.68 99.91 0.08 0.01 99.63 0.18 0.13 0.00 0.00 0.00 0.05 0.01