A0A5K4F153_SCHMA Loading...

DUF4206 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F153, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 806 aa.

						>A0A5K4F153_SCHMA|A0A5K4F153
MNYGSVRPGITVKLGKRIIDPRHCKILHSVPVGIEATEYLQFSVDDLVTSDMSTASSHVIPTLNSGGFLPPKFYHDKIHPFHTSDVYPKACWFYDLYANSTNTMQLQSSCCHVVRLNGLIRSVSMEHLRCLKQTSVDYSQQANGLKNSFISCDRLNTTPFADANIPVGSRSSGDGQTEDEEESNGVNYRITPDMQSKINSTCSNFSNEVNVLLGSHSKLGSPSTSFTHDQINTKHLLLPGRSSFEKHLVREVAYFEICEFLIEQIEEIYDMENCEFLNSMYNEKNKDNSLQILTDLQVHKSNTLPSSLLSSHMTLVDVTDQNLHNPLINSILHSQSRETDYCEHCVDSATGLAVSLINTCIQKTAQNEKQEVILFKFLKLQELLLTTCDINWVRLNQKFIESPRPTRFNCDTKFQNFSKNNWLSSTSSDSIQLDSQGRWNKFHHLTSLSQSTNSKRAMKSISQSDYSPSVLTSSSSFGSHTTTLSKPTINKLSNNSTIIMDTLLKNDNSNNNDSHANNRSSISLIKDFQLSDKIRSDNQDYPTSSLSLSSAFGCTPLPYGLLINPPIQKSKRKGVLVSQNNRCAGCGAFIETRYLKRMRFCEFFGRYFCCVCHSNTLMTLPGNLVTCWDFRMLSVSNFARDRLRQLHNKPLLRTIDFNKQVLNRQSNLLNCLTLRKQGNLMLPFIQRCQTAQQLVDFTSIPSHWFETPDLWSMADLHSVHDGKLSIALRALLLPIVEHISICKRCLACGFICEICKSGQILFPFGQVNTTICSGCSACFHRACLHSPNPETCPRCIRRAVKREQLI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28	Very low	25.8	Very low	226 Å²	226	147.6 Å²	147.6	100%	1.113	83%	0.825	S	S	*	*				0	79.7	0	-57.7	165.9	-179.1	0	0	106.5
2	N	28.3	Very low	25.4	Very low	143 Å²	143	144.6 Å²	144.6	77%	0.765	81%	0.813	S	S	*	*			cis	60.6	108.3	43.8	-53.1	48.9	0	0	0	109.5
3	Y	27	Very low	25.2	Very low	234 Å²	234	148.5 Å²	148.5	92%	0.918	82%	0.816	S	S	*	*			cis	-129.4	158.5	17.8	-88	-104.6	0	0	0	113.2
4	G	26.8	Very low	25	Very low	76 Å²	76	148.9 Å²	148.9	78%	0.784	82%	0.815	S	S	*	*			trans	-173.9	38.2	-176.2	0	0	0	0	0	119.6
5	S	27.4	Very low	24.9	Very low	118 Å²	118	144.1 Å²	144.1	83%	0.825	81%	0.813	S	S	*	*			trans	46.2	118.6	164.1	-156.8	0	0	0	0	120.7
6	V	24.7	Very low	25	Very low	135 Å²	135	146.9 Å²	146.9	82%	0.818	81%	0.814	S	S	*	*			trans	-82.9	140.1	174	176.6	0	0	0	0	111.8
7	R	24.2	Very low	24.8	Very low	227 Å²	227	152.4 Å²	152.4	86%	0.857	82%	0.819	S	S	*	*			trans	-134.9	133.3	155.9	-76.3	-171.4	174.1	-167.3	-0.9	110.2	G9	R7-G9 PolarHBondContact O-N 3.49Å
8	P	26.6	Very low	24.8	Very low	126 Å²	126	152 Å²	152	82%	0.818	82%	0.815	S	S	*	*			trans	-73.7	113.2	172.3	29.5	-32.4	0	0	0	110.3	I10	P8-I10 PolarHBondContact O-N 3.19Å
9	G	25.1	Very low	24.7	Very low	63 Å²	63	152 Å²	152	65%	0.649	81%	0.813	S	S	*	*			trans	-86.5	98.9	-178.9	0	0	0	0	0	113	R7 T11	R7-G9 PolarHBondContact O-N 3.49Å; G9-T11 PolarHBondContact O-N 2.98Å; G9-T11 PolarHBondContact O-OG1 3.38Å
10	I	21.7	Very low	24.5	Very low	159 Å²	159	151.4 Å²	151.4	82%	0.815	81%	0.81	S	S	*	*			trans	-62.7	105.3	168.6	-60	177.9	0	0	0	108.3	P8 V12	P8-I10 PolarHBondContact O-N 3.19Å; I10-V12 HydrophobicContact CG2-CG2 4.25Å; I10-V12 PolarHBondContact O-N 3.03Å
11	T	24	Very low	24.6	Very low	117 Å²	117	148.6 Å²	148.6	72%	0.718	80%	0.8	S	S	*	*			trans	-94.2	79.2	-168.2	-57.9	0	0	0	0	110.9	G9 K13	G9-T11 PolarHBondContact O-N 2.98Å; G9-T11 PolarHBondContact O-OG1 3.38Å; T11-K13 PolarHBondContact O-N 3.43Å; T11-K13 VanDerWaalsContact O-N 3.1Å
12	V	21.1	Very low	24.3	Very low	111 Å²	111	147.9 Å²	147.9	67%	0.673	79%	0.785	S	S	*	*			trans	-70.3	102.7	173.5	-175.2	0	0	0	0	109.6	I10 L14	I10-V12 HydrophobicContact CG2-CG2 4.25Å; I10-V12 PolarHBondContact O-N 3.03Å; V12-L14 VanDerWaalsContact C-N 3.32Å; V12-L14 HydrophobicContact CG1-CG 4.36Å; V12-L14 PolarHBondContact O-N 2.9Å
13	K	22.9	Very low	24.1	Very low	196 Å²	196	149.7 Å²	149.7	85%	0.852	79%	0.789	S	S	*	*			trans	-72.7	78.6	177.1	-76.5	-175	176.6	176.1	0	111.8	T11 G15	T11-K13 PolarHBondContact O-N 3.43Å; T11-K13 VanDerWaalsContact O-N 3.1Å; K13-G15 PolarHBondContact O-N 3.15Å
14	L	22.6	Very low	24	Very low	153 Å²	153	144.8 Å²	144.8	80%	0.801	79%	0.787	S	S	*	*			trans	-68.6	98.7	165.7	-78.2	169.3	0	0	0	110.2	V12 K16	V12-L14 VanDerWaalsContact C-N 3.32Å; V12-L14 HydrophobicContact CG1-CG 4.36Å; V12-L14 PolarHBondContact O-N 2.9Å; L14-K16 PolarHBondContact O-N 2.86Å
15	G	23.9	Very low	23.7	Very low	77 Å²	77	150.7 Å²	150.7	79%	0.794	79%	0.791	S	S	*	*			trans	-68	89.2	-177.9	0	0	0	0	0	113.6	K13 R17	K13-G15 PolarHBondContact O-N 3.15Å; G15-R17 PolarHBondContact O-N 3Å
16	K	25.4	Very low	23.6	Very low	189 Å²	189	152.3 Å²	152.3	82%	0.822	79%	0.789	S	S	*	*			trans	-64.9	113.1	170.6	-71.2	-174.8	177	-177.5	0	110.7	L14 I18	L14-K16 PolarHBondContact O-N 2.86Å; K16-I18 PolarHBondContact O-N 3.18Å; K16-I18 VanDerWaalsContact O-N 3.12Å
17	R	22.9	Very low	23.3	Very low	241 Å²	241	152.4 Å²	152.4	91%	0.909	78%	0.784	S	S	*	*			trans	-73.1	96.2	160.5	-76.3	-173.3	174.3	-173.7	-1.6	109.5	G15	G15-R17 PolarHBondContact O-N 3Å
18	I	24.1	Very low	23.3	Very low	145 Å²	145	149.2 Å²	149.2	74%	0.744	78%	0.778	S	S	*	*			trans	-85.7	131.6	160.1	-61.2	177.4	0	0	0	107	K16	K16-I18 PolarHBondContact O-N 3.18Å; K16-I18 VanDerWaalsContact O-N 3.12Å
19	I	22	Very low	23	Very low	152 Å²	152	147.6 Å²	147.6	78%	0.779	77%	0.77	S	S	*	*			trans	-112.7	112.7	170.6	-59.8	174.9	0	0	0	106.5
20	D	22	Very low	22.8	Very low	139 Å²	139	151.1 Å²	151.1	74%	0.743	78%	0.779	S	S	*	*			trans	-120	117.1	169.7	-167.8	-9.2	0	0	0	108.8
21	P	25.9	Very low	22.9	Very low	93 Å²	93	149 Å²	149	60%	0.604	78%	0.775	S	S	*	*			trans	-101.6	105.3	-170.7	35.6	-31.8	0	0	0	114.1
22	R	21.5	Very low	22.8	Very low	212 Å²	212	149.4 Å²	149.4	80%	0.8	78%	0.777	S	S	*	*			trans	-160	145.4	151.1	-85.7	114.2	-161.5	-123.3	5	112.4
23	H	25.2	Very low	22.7	Very low	181 Å²	181	147.8 Å²	147.8	84%	0.838	78%	0.783	S	S	*	*			trans	69.8	139.5	174.9	-42.2	110.7	0	0	0	114.9
24	C	25	Very low	22.7	Very low	130 Å²	130	145 Å²	145	88%	0.878	78%	0.776	S	S	*	*			cis	-124	168.2	2.4	-90.8	0	0	0	0	113
25	K	20.5	Very low	22.7	Very low	200 Å²	200	147.4 Å²	147.4	87%	0.87	78%	0.783	S	S	*	*			trans	-103.4	165	167.4	-74.2	-178.4	175.4	179.2	0	110.8
26	I	23.6	Very low	22.6	Very low	153 Å²	153	148.1 Å²	148.1	79%	0.785	78%	0.782	S	S	*	*			trans	143.5	100.8	155.1	-78.6	158.7	0	0	0	106.4
27	L	20.2	Very low	22.4	Very low	137 Å²	137	145 Å²	145	72%	0.717	78%	0.778	S	S	*	*				63.7	133.4	88.9	-61.1	169.6	0	0	0	112.2
28	H	23.1	Very low	22.3	Very low	159 Å²	159	140 Å²	140	74%	0.736	77%	0.766	S	S	*	*			cis	-151.7	164.9	12.6	-120.7	-74.7	0	0	0	111.1
29	S	20.7	Very low	22.3	Very low	93 Å²	93	140.7 Å²	140.7	65%	0.65	76%	0.76	S	S	*	*			trans	1.1	151.5	156.8	51.2	0	0	0	0	121.5
30	V	21	Very low	22.3	Very low	136 Å²	136	141.1 Å²	141.1	82%	0.824	76%	0.763	S	S	*	*			cis	-143.4	-158.2	40.1	-135.2	0	0	0	0	112.9
31	P	22.7	Very low	22.3	Very low	115 Å²	115	142.4 Å²	142.4	75%	0.747	77%	0.765	S	S	*	*			trans	-97.1	159.9	-145.7	42.4	-34	0	0	0	115.5
32	V	22.7	Very low	22.1	Very low	125 Å²	125	147.2 Å²	147.2	76%	0.758	78%	0.776	S	S	*	*			trans	-126.7	109.9	165.4	178.4	0	0	0	0	110	I34	V32-I34 HydrophobicContact CG1-CB 3.94Å; V32-I34 HydrophobicContact CG1-CD1 4.25Å; V32-I34 HydrophobicContact CG1-CG1 4.4Å
33	G	19.6	Very low	22.1	Very low	77 Å²	77	141 Å²	141	79%	0.794	77%	0.766	S	S	*	*			trans	-105.5	124.2	142.6	0	0	0	0	0	106.8
34	I	23	Very low	22	Very low	139 Å²	139	139.2 Å²	139.2	71%	0.713	77%	0.767	S	S	*	*			trans	-147.5	132.4	175.4	-100.6	164.2	0	0	0	107.6	V32 A36	V32-I34 HydrophobicContact CG1-CB 3.94Å; V32-I34 HydrophobicContact CG1-CD1 4.25Å; V32-I34 HydrophobicContact CG1-CG1 4.4Å; I34-A36 HydrophobicContact CG2-CB 4Å
35	E	20.9	Very low	21.9	Very low	202 Å²	202	139.5 Å²	139.5	94%	0.944	76%	0.76	S	S	*	*			trans	-80.7	126.1	163.4	-60.7	174.7	118.1	0	0	107.5
36	A	22.2	Very low	22	Very low	92 Å²	92	137.3 Å²	137.3	76%	0.76	76%	0.758	S	S	*	*			trans	-133.6	111.6	-177.6	0	0	0	0	0	112	I34	I34-A36 HydrophobicContact CG2-CB 4Å
37	T	21.3	Very low	22.1	Very low	123 Å²	123	138 Å²	138	76%	0.755	76%	0.762	S	S	*	*			trans	-80.4	148.4	167.8	39.6	0	0	0	0	112
38	E	22.1	Very low	22.3	Very low	138 Å²	138	138.1 Å²	138.1	65%	0.645	77%	0.768	S	S	*	*			trans	68.4	175	153.2	-64.2	169.4	155	0	0	118.7
39	Y	23.2	Very low	22.3	Very low	158 Å²	158	136.4 Å²	136.4	62%	0.62	77%	0.769	S	S	*	*			trans	54.1	99.4	173.4	-57.9	-82.6	0	0	0	119
40	L	21.5	Very low	22.5	Very low	161 Å²	161	137.6 Å²	137.6	84%	0.843	78%	0.777	S	S	*	*			trans	-113.6	97	147.4	-80.2	176.8	0	0	0	108.8
41	Q	21.6	Very low	22.5	Very low	166 Å²	166	137.8 Å²	137.8	78%	0.776	77%	0.774	S	S	*	*			trans	-111.6	124.5	174.3	-173.4	164.2	-10.4	0	0	108
42	F	21.8	Very low	22.6	Very low	194 Å²	194	141 Å²	141	85%	0.851	78%	0.781	S	S	*	*			trans	-89.4	108.8	174.7	-70.3	-83.3	0	0	0	108.5
43	S	22.4	Very low	22.5	Very low	83 Å²	83	139.8 Å²	139.8	58%	0.58	78%	0.778	S	S	*	*			trans	-79.5	138.5	164.9	162.9	0	0	0	0	109.6	D45	S43-D45 WeakPolarHBondContact CB-OD2 3.48Å; S43-D45 PolarHBondContact OG-N 3.37Å; S43-D45 PolarHBondContact OG-OD2 3.34Å
44	V	22.8	Very low	22.8	Very low	142 Å²	142	142.7 Å²	142.7	86%	0.861	78%	0.78	S	S	*	*			trans	-138.8	71.9	159	-174.9	0	0	0	0	106.2
45	D	23	Very low	23	Very low	136 Å²	136	140.1 Å²	140.1	73%	0.727	78%	0.78	S	S	*	*			trans	-96.4	106.4	175.7	-63.9	-76.8	0	0	0	109.2	S43	S43-D45 WeakPolarHBondContact CB-OD2 3.48Å; S43-D45 PolarHBondContact OG-N 3.37Å; S43-D45 PolarHBondContact OG-OD2 3.34Å
46	D	22.9	Very low	23.1	Very low	154 Å²	154	135.5 Å²	135.5	82%	0.824	77%	0.77	S	S	*	*			trans	-160.4	77.6	166.1	-132.1	-9.1	0	0	0	111.3
47	L	24.6	Very low	23.1	Very low	167 Å²	167	135.7 Å²	135.7	87%	0.874	77%	0.766	S	S	*	*			trans	-173.1	121.7	130.6	-122.4	69.6	0	0	0	111.2
48	V	25.3	Very low	23.2	Very low	140 Å²	140	138.5 Å²	138.5	85%	0.848	77%	0.77	S	S	*	*			trans	-87.3	147.1	165.8	174	0	0	0	0	109.2
49	T	22.4	Very low	23.3	Very low	123 Å²	123	138.5 Å²	138.5	76%	0.755	78%	0.779	S	S	*	*			trans	-72	152.4	-179.3	45.5	0	0	0	0	113.6
50	S	25.5	Very low	23.3	Very low	118 Å²	118	138.3 Å²	138.3	83%	0.825	79%	0.787	S	S	*	*			trans	-138.4	112.2	155.7	55.4	0	0	0	0	109.5
51	D	20.7	Very low	24	Very low	140 Å²	140	135.5 Å²	135.5	75%	0.749	78%	0.779	S	S	*	*			trans	-70.9	140.9	175.6	-69.2	-63	0	0	0	111.3
52	M	25.1	Very low	24.1	Very low	183 Å²	183	133.3 Å²	133.3	90%	0.901	78%	0.777	S	S	*	*			trans	-148.1	143.1	142.5	-91.5	-57.1	102.8	0	0	109.4
53	S	21.6	Very low	24.1	Very low	99 Å²	99	130.7 Å²	130.7	69%	0.692	77%	0.771	S	S	*	*			trans	-96	152.6	-166.7	54.2	0	0	0	0	113.8
54	T	25.7	Very low	24.3	Very low	138 Å²	138	133.1 Å²	133.1	85%	0.847	78%	0.777	S	S	*	*				169.3	158.6	116.5	35.5	0	0	0	0	114.7
55	A	26.3	Very low	24.3	Very low	85 Å²	85	131.2 Å²	131.2	70%	0.702	77%	0.77	S	S	*	*			trans	66	83.3	147.5	0	0	0	0	0	122.4
56	S	22.5	Very low	24.4	Very low	106 Å²	106	128.8 Å²	128.8	74%	0.741	78%	0.778	S	S	*	*				53.3	122.6	115.6	64.6	0	0	0	0	124.2
57	S	23.3	Very low	24.4	Very low	95 Å²	95	124.7 Å²	124.7	66%	0.664	77%	0.771	S	S	*	*				97.5	131.9	120.8	75.7	0	0	0	0	123
58	H	23	Very low	24.5	Very low	183 Å²	183	127.2 Å²	127.2	85%	0.847	78%	0.776	S	S	*	*			trans	52	144.2	156.6	-53.2	-60.6	0	0	0	119.1
59	V	24.2	Very low	24.4	Very low	137 Å²	137	128.3 Å²	128.3	83%	0.83	78%	0.776	S	S	*	*			cis	-153.8	163.2	42	163.7	0	0	0	0	110.1
60	I	22.6	Very low	25.5	Very low	154 Å²	154	127.7 Å²	127.7	79%	0.79	77%	0.774	S	S	*	*			trans	-116.4	176.5	174.7	-16.8	178.4	0	0	0	111.5
61	P	37.1	Very low	26.1	Very low	103 Å²	103	127.7 Å²	127.7	67%	0.669	77%	0.771	S	S	*	*				-104.4	-163.2	-115.4	41.6	-25.1	0	0	0	113.8
62	T	22.8	Very low	26.2	Very low	119 Å²	119	129.3 Å²	129.3	73%	0.73	77%	0.772	S	S	*	*				166.5	160.7	120	38.8	0	0	0	0	116.3
63	L	22.9	Very low	26.1	Very low	139 Å²	139	127.5 Å²	127.5	73%	0.728	76%	0.759	S	S	*	*			trans	82.7	132.4	143.8	-77.5	154.3	0	0	0	123.9
64	N	25.5	Very low	26.2	Very low	135 Å²	135	130.4 Å²	130.4	72%	0.722	76%	0.756	S	S	*	*			trans	77.7	151.7	140	-74.1	-9.9	0	0	0	123.4
65	S	23	Very low	26.1	Very low	102 Å²	102	130.9 Å²	130.9	71%	0.713	75%	0.748	S	S	*	*			cis	-179.3	145.2	-34.1	51.7	0	0	0	0	112.4
66	G	26.4	Very low	26	Very low	85 Å²	85	131.5 Å²	131.5	88%	0.876	74%	0.74	S	S	*	*			trans	84.1	158.2	160.5	0	0	0	0	0	117.5
67	G	23.2	Very low	26.1	Very low	67 Å²	67	133.9 Å²	133.9	69%	0.691	74%	0.736	S	S	*	*			cis	170.5	170.2	-8.5	0	0	0	0	0	115.2
68	F	25.2	Very low	26.2	Very low	221 Å²	221	135.1 Å²	135.1	97%	0.969	74%	0.735	S	S	*	*			trans	83.8	152.2	167.7	-70.3	-83.1	0	0	0	122.1
69	L	23.3	Very low	26.2	Very low	162 Å²	162	131.4 Å²	131.4	85%	0.848	72%	0.717	S	S	*	*			trans	-141.6	160	-168.9	-86	171.2	0	0	0	113
70	P	45.4	Very low	26.4	Very low	111 Å²	111	128 Å²	128	72%	0.721	70%	0.698	S	S	*	*			trans	-91.9	-156.3	164.2	43.1	-37.9	0	0	0	110.4
71	P	38.6	Very low	26.6	Very low	117 Å²	117	127.7 Å²	127.7	76%	0.76	69%	0.691	S	S	*	*			cis	-136.9	-171.4	-4.1	44.2	-25.7	0	0	0	116.3
72	K	23.5	Very low	26.1	Very low	175 Å²	175	129.2 Å²	129.2	76%	0.761	69%	0.689	S	S	*	*			trans	-151.8	160.1	167	-72.4	-176.9	-178.7	177.4	0	106.7
73	F	23.2	Very low	26.2	Very low	144 Å²	144	127.7 Å²	127.7	63%	0.632	68%	0.68	S	S	*	*			cis	-171	171	-12.1	-98.3	-24.6	0	0	0	105.6
74	Y	23.9	Very low	26.4	Very low	161 Å²	161	126 Å²	126	63%	0.631	68%	0.679	S	S	*	*			cis	-164	151.5	2.6	-119.9	-44.8	0	0	0	108.4
75	H	23.5	Very low	26.3	Very low	147 Å²	147	126.8 Å²	126.8	68%	0.681	68%	0.684	S	S	*	*			trans	62.8	150.6	153.9	-72.1	-58.7	0	0	0	119.5
76	D	23.1	Very low	26.4	Very low	99 Å²	99	127.9 Å²	127.9	53%	0.529	69%	0.686	S	S	.	*			cis	-160.4	159.8	-7	-130	3.9	0	0	0	115.7
77	K	23.8	Very low	26.5	Very low	155 Å²	155	134 Å²	134	67%	0.674	68%	0.684	S	S	*	*			trans	74.4	129.8	140.5	-81.8	171.9	-179.8	114.7	0	126.4
78	I	25.7	Very low	26.7	Very low	122 Å²	122	136.7 Å²	136.7	63%	0.626	69%	0.689	S	S	*	*			trans	90.7	110.1	136.4	-64.7	163	0	0	0	121.7	T412	I78-T412 WeakPolarHBondContact O-CG2 3.2Å
79	H	23	Very low	26.5	Very low	104 Å²	104	136.1 Å²	136.1	48%	0.481	69%	0.686	S	S	.	*			trans	-77.6	-171.9	165	-96.6	-133.9	0	0	0	113.6	N409 D411	H79-N409 PolarHBondContact NE2-OD1 3.15Å; H79-D411 PolarHBondContact CD2-O 3.01Å; H79-D411 VanDerWaalsContact CE1-CB 3.42Å; H79-D411 WeakPolarHBondContact CE1-CB 3.5Å; H79-D411 IonicContact CE1-OD2 2.83Å; H79-D411 PolarHBondContact CE1-OD2 3.09Å; H79-D411 IonicContact ND1-OD2 3.96Å; H79-D411 WeakPolarHBondContact NE2-CB 3.26Å
80	P	30	Very low	26.4	Very low	67 Å²	67	132.7 Å²	132.7	44%	0.435	68%	0.681	S	S	.	*			cis	-140.2	-167.2	-28.5	32.3	-9.3	0	0	0	115.1
81	F	26	Very low	25.4	Very low	147 Å²	147	132.5 Å²	132.5	65%	0.645	68%	0.681	S	S	*	*			trans	122.4	92.2	152	-77.3	-72.8	0	0	0	121.1	Q415	F81-Q415 VanDerWaalsContact C-CG 3.46Å; F81-Q415 WeakPolarHBondContact O-CG 3.2Å
82	H	25.8	Very low	24.6	Very low	135 Å²	135	137 Å²	137	63%	0.625	68%	0.683	S	S	*	*				80.1	118.6	128.2	-95.4	-121.4	0	0	0	124.1
83	T	26.4	Very low	24.5	Very low	86 Å²	86	135.5 Å²	135.5	53%	0.528	68%	0.677	S	S	.	*			trans	68.3	149.9	132.6	59.7	0	0	0	0	121.8	S418	T83-S418 PolarHBondContact O-OG 3.34Å
84	S	26.5	Very low	24.5	Very low	103 Å²	103	137.7 Å²	137.7	72%	0.72	68%	0.682	S	S	*	*			cis	-168.2	161.2	-21.4	-99.2	0	0	0	0	108.7
85	D	23.2	Very low	24.5	Very low	153 Å²	153	137.2 Å²	137.2	82%	0.818	69%	0.691	S	S	*	*			trans	-137.7	178.1	169.8	-158.6	-6	0	0	0	109.7
86	V	25.2	Very low	24.5	Very low	124 Å²	124	136.9 Å²	136.9	75%	0.752	69%	0.693	S	S	*	*			trans	80.9	144.3	167.3	-154.2	0	0	0	0	118.3
87	Y	28.1	Very low	24.6	Very low	215 Å²	215	143.2 Å²	143.2	84%	0.843	71%	0.711	S	S	*	*			trans	-55.4	171.2	160.4	-74.7	-115.7	0	0	0	112.8
88	P	27.1	Very low	24.7	Very low	122 Å²	122	139.5 Å²	139.5	79%	0.792	71%	0.71	S	S	*	*			trans	-124.7	154.4	141.6	35.5	-26.7	0	0	0	114.3
89	K	21	Very low	24.6	Very low	210 Å²	210	141.2 Å²	141.2	91%	0.913	72%	0.72	S	S	*	*			trans	-78.4	-178.2	163.5	-74.8	177.9	179.9	170.9	0	110.5
90	A	22.2	Very low	24.7	Very low	90 Å²	90	141.3 Å²	141.3	74%	0.744	73%	0.732	S	S	*	*			trans	-50.4	164.2	179	0	0	0	0	0	115.7
91	C	23.4	Very low	24.4	Very low	106 Å²	106	143.7 Å²	143.7	72%	0.716	75%	0.746	S	S	*	*			trans	-138.3	129.7	151.8	-175.9	0	0	0	0	108.2
92	W	21.6	Very low	24.2	Very low	212 Å²	212	143.9 Å²	143.9	80%	0.803	75%	0.754	S	S	*	*			trans	-122.8	127.2	165.5	-83.4	80.6	0	0	0	106.3	Y94	W92-Y94 HydrophobicContact CE3-CD2 4.47Å; W92-Y94 HydrophobicContact CE3-CE2 4.17Å; W92-Y94 HydrophobicContact CZ3-CE2 4.06Å
93	F	22.2	Very low	24.3	Very low	143 Å²	143	144.7 Å²	144.7	63%	0.627	77%	0.768	S	S	*	*			trans	-127.6	135.1	167.4	-109.3	-100.2	0	0	0	108.1
94	Y	23.2	Very low	24.2	Very low	191 Å²	191	149 Å²	149	75%	0.749	79%	0.785	S	S	*	*			trans	-117.9	103	171.3	-106.2	-75.9	0	0	0	107.7	W92	W92-Y94 HydrophobicContact CE3-CD2 4.47Å; W92-Y94 HydrophobicContact CE3-CE2 4.17Å; W92-Y94 HydrophobicContact CZ3-CE2 4.06Å
95	D	23.8	Very low	24.3	Very low	151 Å²	151	152.5 Å²	152.5	81%	0.807	79%	0.79	S	S	*	*			trans	-92	140	160.2	-86.9	-51.6	0	0	0	109.2
96	L	23.4	Very low	24.3	Very low	140 Å²	140	153.2 Å²	153.2	73%	0.733	79%	0.792	S	S	*	*			trans	-146.4	104.3	-179.3	-127.6	175.6	0	0	0	109.3
97	Y	24.5	Very low	24.7	Very low	232 Å²	232	153 Å²	153	91%	0.91	78%	0.783	S	S	*	*			trans	-172.2	154	138.3	-106.5	-66.1	0	0	0	113.1
98	A	25.7	Very low	24.7	Very low	77 Å²	77	148.7 Å²	148.7	64%	0.636	79%	0.785	S	S	*	*			trans	70.4	103.5	163.1	0	0	0	0	0	119.9
99	N	23.5	Very low	25.4	Very low	158 Å²	158	148.7 Å²	148.7	85%	0.845	79%	0.787	S	S	*	*			trans	47.3	124	134.2	-50.3	-15.9	0	0	0	118.8
100	S	25.3	Very low	27	Very low	105 Å²	105	140.7 Å²	140.7	73%	0.734	76%	0.757	S	S	*	*			cis	-170.9	160.4	49.8	50.3	0	0	0	0	115
101	T	24.4	Very low	28.5	Very low	118 Å²	118	142 Å²	142	72%	0.724	76%	0.76	S	S	*	*			trans	32.5	120.6	153.2	53.2	0	0	0	0	122.8
102	N	22	Very low	29.9	Very low	151 Å²	151	139.9 Å²	139.9	81%	0.807	74%	0.739	S	S	*	*			trans	57.6	103.8	139.7	-65	-9.7	0	0	0	121
103	T	28.3	Very low	31.1	Very low	152 Å²	152	131.2 Å²	131.2	93%	0.933	71%	0.709	S	S	*	*				-161.5	146.5	123.9	5.4	0	0	0	0	110.5
104	M	22.7	Very low	32.5	Very low	177 Å²	177	128.4 Å²	128.4	87%	0.872	70%	0.704	S	S	*	*			trans	-95	128.4	175.5	-66.8	-160.2	79	0	0	111.5
105	Q	29	Very low	34.1	Very low	176 Å²	176	124.8 Å²	124.8	82%	0.822	69%	0.689	S	S	*	*			trans	-148.7	131.5	160.5	-109.1	-179.1	11.1	0	0	111.4
106	L	24.5	Very low	35.3	Very low	167 Å²	167	121.9 Å²	121.9	87%	0.874	67%	0.673	S	S	*	*			trans	-79.3	116.7	176.6	-71.9	73.9	0	0	0	109.9
107	Q	32.6	Very low	36.4	Very low	121 Å²	121	122.6 Å²	122.6	57%	0.565	68%	0.678	S	S	*	*			trans	-141.7	117.3	160.3	-67	-165.4	-3.7	0	0	111.4	S109	Q107-S109 PolarHBondContact O-N 3.21Å
108	S	28.8	Very low	37.7	Very low	124 Å²	124	114.3 Å²	114.3	87%	0.867	66%	0.662	S	S	*	*			trans	-79.2	108.6	171.9	39.6	0	0	0	0	110.4	C110	S108-C110 PolarHBondContact O-N 2.86Å
109	S	41.7	Very low	38.2	Very low	121 Å²	121	117 Å²	117	85%	0.846	67%	0.665	S	S	*	*			trans	-76.9	83.6	-177.8	40.3	0	0	0	0	112.5	Q107 C111	Q107-S109 PolarHBondContact O-N 3.21Å; S109-C111 PolarHBondContact O-N 3.01Å
110	C	54.1	Low	39.5	Very low	43 Å²	43	114.1 Å²	114.1	29%	0.291	65%	0.649	S	S	.	*			trans	-60.5	122.8	164.5	176.6	0	0	0	0	110.1	S108 H112 V113	S108-C110 PolarHBondContact O-N 2.86Å; C110-H112 PolarHBondContact O-N 3.05Å; C110-H112 PolarHBondContact SG-ND1 3.42Å; C110-V113 PolarHBondContact O-N 2.92Å
111	C	53.9	Low	40.3	Very low	117 Å²	117	118.3 Å²	118.3	79%	0.791	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-6.3	-176.2	55.9	0	0	0	0	115.7	S109	S109-C111 PolarHBondContact O-N 3.01Å
112	H	51.8	Low	41.1	Very low	61 Å²	61	115.8 Å²	115.8	28%	0.282	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.9	4.4	178.2	-57.7	118.8	0	0	0	114.6	C110 S124 H127 C130	C110-H112 PolarHBondContact O-N 3.05Å; C110-H112 PolarHBondContact SG-ND1 3.42Å; H112-S124 PolarHBondContact O-N 3.01Å; H112-S124 VanDerWaalsContact O-N 3.09Å; H112-H127 HydrophobicContact CB-CB 3.79Å; H112-C130 PolarHBondContact ND1-SG 2.83Å
113	V	47.9	Very low	41.8	Very low	30 Å²	30	112.1 Å²	112.1	18%	0.182	62%	0.619	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.5	118	178.9	-177.2	0	0	0	0	110.1	C110 R115 I120 H127	C110-V113 PolarHBondContact O-N 2.92Å; V113-R115 HydrophobicContact CG1-CG 4.22Å; V113-I120 HydrophobicContact CG1-CB 4.48Å; V113-I120 HydrophobicContact CG1-CD1 4.25Å; V113-I120 HydrophobicContact CG1-CG1 3.95Å; V113-I120 HydrophobicContact CG1-CG2 3.89Å; V113-H127 WeakPolarHBondContact CG2-CE1 3.47Å; V113-H127 WeakPolarHBondContact CG2-ND1 3.39Å
114	V	51.9	Low	42.7	Very low	84 Å²	84	107.5 Å²	107.5	51%	0.509	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.3	124.9	172.7	-177.5	0	0	0	0	108.9	R121 S122	V114-R121 PolarHBondContact O-N 2.86Å; V114-S122 PolarHBondContact N-O 2.91Å; V114-S122 VanDerWaalsContact N-O 3.12Å; V114-S122 PolarHBondContact O-N 3.49Å
115	R	55.6	Low	43.5	Very low	115 Å²	115	105.7 Å²	105.7	43%	0.434	58%	0.584	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.3	147.4	170.7	-60.5	-155.8	-171.4	168.2	15.6	111.4	V113 G118 L119 I120	V113-R115 HydrophobicContact CG1-CG 4.22Å; R115-G118 WeakPolarHBondContact CD-O 3.45Å; R115-L119 CarbonylContact C-O 3.56Å; R115-L119 WeakPolarHBondContact CA-O 3.27Å; R115-L119 WeakPolarHBondContact CB-O 3.26Å; R115-I120 HydrophobicContact CG-CG1 4.02Å
116	L	49.3	Very low	44.2	Very low	90 Å²	90	100.8 Å²	100.8	47%	0.471	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-137.2	134	168	-164	74.6	0	0	0	107.7	G118 L119	L116-G118 PolarHBondContact O-N 2.75Å; L116-L119 PolarHBondContact N-O 2.95Å; L116-L119 PolarHBondContact O-N 2.91Å; L116-L119 VanDerWaalsContact O-N 3.08Å
117	N	46.4	Very low	45.5	Very low	156 Å²	156	94.7 Å²	94.7	83%	0.834	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	44.6	-178.3	-57.6	4.6	0	0	0	112.8	L119	N117-L119 PolarHBondContact O-N 2.72Å; N117-L119 VanDerWaalsContact O-N 3.11Å
118	G	51.6	Low	45.7	Very low	57 Å²	57	93.6 Å²	93.6	59%	0.588	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	-23.8	-179.5	0	0	0	0	0	115.9	R115 L116	R115-G118 WeakPolarHBondContact CD-O 3.45Å; L116-G118 PolarHBondContact O-N 2.75Å
119	L	38	Very low	46.6	Very low	133 Å²	133	93.9 Å²	93.9	70%	0.696	51%	0.507	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	143.4	-177.1	-69.7	167.1	0	0	0	112.4	R115 L116 N117 R121	R115-L119 CarbonylContact C-O 3.56Å; R115-L119 WeakPolarHBondContact CA-O 3.27Å; R115-L119 WeakPolarHBondContact CB-O 3.26Å; L116-L119 PolarHBondContact N-O 2.95Å; L116-L119 PolarHBondContact O-N 2.91Å; L116-L119 VanDerWaalsContact O-N 3.08Å; N117-L119 PolarHBondContact O-N 2.72Å; N117-L119 VanDerWaalsContact O-N 3.11Å; L119-R121 PolarHBondContact O-N 3.41Å
120	I	50	Low	46.8	Very low	98 Å²	98	89.8 Å²	89.8	50%	0.503	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	119.4	173.5	-64.7	172.2	0	0	0	108.7	V113 R115 V123	V113-I120 HydrophobicContact CG1-CB 4.48Å; V113-I120 HydrophobicContact CG1-CD1 4.25Å; V113-I120 HydrophobicContact CG1-CG1 3.95Å; V113-I120 HydrophobicContact CG1-CG2 3.89Å; R115-I120 HydrophobicContact CG-CG1 4.02Å; I120-V123 HydrophobicContact CG2-CG2 3.49Å; I120-V123 VanDerWaalsContact CG2-CG2 3.49Å
121	R	42	Very low	46.2	Very low	193 Å²	193	91.8 Å²	91.8	73%	0.728	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.5	-27.9	-174.2	-148.8	-179.8	-166.1	-162.1	5	113	V114 L119	V114-R121 PolarHBondContact O-N 2.86Å; L119-R121 PolarHBondContact O-N 3.41Å
122	S	40.5	Very low	45.5	Very low	66 Å²	66	93.5 Å²	93.5	46%	0.462	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	154.8	168.7	63.5	0	0	0	0	111.6	V114	V114-S122 PolarHBondContact N-O 2.91Å; V114-S122 VanDerWaalsContact N-O 3.12Å; V114-S122 PolarHBondContact O-N 3.49Å
123	V	37.8	Very low	45.2	Very low	74 Å²	74	96.5 Å²	96.5	45%	0.448	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	126.4	-179.1	178.9	0	0	0	0	108.2	I120 H127	I120-V123 HydrophobicContact CG2-CG2 3.49Å; I120-V123 VanDerWaalsContact CG2-CG2 3.49Å; V123-H127 HydrophobicContact CG1-CB 3.59Å
124	S	46.2	Very low	44.7	Very low	54 Å²	54	98.8 Å²	98.8	38%	0.378	51%	0.508	S	S	.	.			trans	-76.1	151.8	175.2	-178.6	0	0	0	0	111.9	H112 E126 H127	H112-S124 PolarHBondContact O-N 3.01Å; H112-S124 VanDerWaalsContact O-N 3.09Å; S124-E126 PolarHBondContact O-N 2.93Å; S124-E126 VanDerWaalsContact O-N 3.13Å; S124-E126 PolarHBondContact OG-N 3.06Å; S124-H127 WeakPolarHBondContact O-CB 3.5Å; S124-H127 PolarHBondContact O-N 3.12Å
125	M	39.4	Very low	43.9	Very low	139 Å²	139	98.5 Å²	98.5	69%	0.685	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-24.2	169.1	-78.6	-67.8	-68.4	0	0	112.8	H127 L128	M125-H127 VanDerWaalsContact C-N 3.3Å; M125-H127 PolarHBondContact O-N 3.08Å; M125-L128 HydrophobicContact CE-CD1 4.45Å; M125-L128 PolarHBondContact O-N 3.06Å; M125-L128 HydrophobicContact SD-CD1 3.93Å
126	E	44.1	Very low	42.9	Very low	74 Å²	74	97.1 Å²	97.1	35%	0.346	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-29.2	173.1	-99.8	55.3	-160.1	0	0	112	S124 L128 R129 C130	S124-E126 PolarHBondContact O-N 2.93Å; S124-E126 VanDerWaalsContact O-N 3.13Å; S124-E126 PolarHBondContact OG-N 3.06Å; E126-L128 VanDerWaalsContact C-N 3.31Å; E126-L128 PolarHBondContact O-N 3.1Å; E126-R129 WeakPolarHBondContact O-CA 3.39Å; E126-R129 VanDerWaalsContact O-CB 3.26Å; E126-R129 WeakPolarHBondContact O-CB 3.28Å; E126-R129 PolarHBondContact O-N 3.28Å; E126-R129 IonicContact OE1-CZ 3.35Å; E126-R129 IonicContact OE1-NH1 3.69Å; E126-R129 PolarHBondContact OE1-NH1 3.3Å; E126-R129 IonicContact OE1-NH2 3.5Å; E126-R129 PolarHBondContact OE1-NH2 2.86Å; E126-R129 IonicContact OE2-CZ 3.72Å; E126-R129 IonicContact OE2-NH2 3.2Å; E126-R129 PolarHBondContact OE2-NH2 3.28Å; E126-C130 PolarHBondContact O-N 3.02Å; E126-C130 VanDerWaalsContact O-N 3.09Å
127	H	53	Low	42.1	Very low	38 Å²	38	97.9 Å²	97.9	18%	0.176	52%	0.519	C	S	.	.	H	α-helix	trans	-64.9	-34.3	177.5	-172.5	61.6	0	0	0	112.3	H112 V113 V123 S124 M125 R129 C130 L131	H112-H127 HydrophobicContact CB-CB 3.79Å; V113-H127 WeakPolarHBondContact CG2-CE1 3.47Å; V113-H127 WeakPolarHBondContact CG2-ND1 3.39Å; V123-H127 HydrophobicContact CG1-CB 3.59Å; S124-H127 WeakPolarHBondContact O-CB 3.5Å; S124-H127 PolarHBondContact O-N 3.12Å; M125-H127 VanDerWaalsContact C-N 3.3Å; M125-H127 PolarHBondContact O-N 3.08Å; H127-R129 PolarHBondContact O-N 2.65Å; H127-C130 WeakPolarHBondContact O-CB 3.3Å; H127-C130 PolarHBondContact O-N 3.32Å; H127-L131 PolarHBondContact O-N 2.84Å
128	L	36.8	Very low	41.3	Very low	98 Å²	98	99.6 Å²	99.6	51%	0.513	52%	0.515	S	S	.	.	H	α-helix	trans	-64.7	-22.6	173	-64.8	173	0	0	0	112.5	M125 E126 L131 K132	M125-L128 HydrophobicContact CE-CD1 4.45Å; M125-L128 PolarHBondContact O-N 3.06Å; M125-L128 HydrophobicContact SD-CD1 3.93Å; E126-L128 VanDerWaalsContact C-N 3.31Å; E126-L128 PolarHBondContact O-N 3.1Å; L128-L131 HydrophobicContact CD2-CD1 4.49Å; L128-K132 PolarHBondContact O-N 3.25Å
129	R	46.2	Very low	40.3	Very low	131 Å²	131	101 Å²	101	49%	0.494	52%	0.515	S	S	.	.	H	α-helix	trans	-79.1	-44.7	171	-113.1	172.2	-72.7	141.9	3.4	111.4	E126 H127 L131 K132 Q133	E126-R129 WeakPolarHBondContact O-CA 3.39Å; E126-R129 VanDerWaalsContact O-CB 3.26Å; E126-R129 WeakPolarHBondContact O-CB 3.28Å; E126-R129 PolarHBondContact O-N 3.28Å; E126-R129 IonicContact OE1-CZ 3.35Å; E126-R129 IonicContact OE1-NH1 3.69Å; E126-R129 PolarHBondContact OE1-NH1 3.3Å; E126-R129 IonicContact OE1-NH2 3.5Å; E126-R129 PolarHBondContact OE1-NH2 2.86Å; E126-R129 IonicContact OE2-CZ 3.72Å; E126-R129 IonicContact OE2-NH2 3.2Å; E126-R129 PolarHBondContact OE2-NH2 3.28Å; H127-R129 PolarHBondContact O-N 2.65Å; R129-L131 PolarHBondContact O-N 3.37Å; R129-K132 PolarHBondContact O-N 3.26Å; R129-Q133 PolarHBondContact O-N 2.92Å; R129-Q133 VanDerWaalsContact O-N 3.08Å
130	C	47.1	Very low	40.1	Very low	34 Å²	34	102.5 Å²	102.5	23%	0.23	52%	0.519	C	S	.	.	H	α-helix	trans	-55.5	-48.9	172.3	-67.2	0	0	0	0	112	H112 E126 H127 K132 Q133 T134	H112-C130 PolarHBondContact ND1-SG 2.83Å; E126-C130 PolarHBondContact O-N 3.02Å; E126-C130 VanDerWaalsContact O-N 3.09Å; H127-C130 WeakPolarHBondContact O-CB 3.3Å; H127-C130 PolarHBondContact O-N 3.32Å; C130-K132 VanDerWaalsContact C-N 3.28Å; C130-K132 PolarHBondContact O-N 2.89Å; C130-Q133 PolarHBondContact O-N 3.45Å; C130-Q133 VanDerWaalsContact O-N 3.1Å; C130-T134 PolarHBondContact O-N 2.89Å; C130-T134 PolarHBondContact O-OG1 2.9Å
131	L	40.5	Very low	39.2	Very low	85 Å²	85	106 Å²	106	45%	0.445	53%	0.533	S	S	.	.	H	α-helix	trans	-56.8	-40.1	178.3	-79.7	167.8	0	0	0	112.4	H127 L128 R129 T134 S135	H127-L131 PolarHBondContact O-N 2.84Å; L128-L131 HydrophobicContact CD2-CD1 4.49Å; R129-L131 PolarHBondContact O-N 3.37Å; L131-T134 WeakPolarHBondContact CA-OG1 3.29Å; L131-T134 PolarHBondContact O-OG1 3.32Å; L131-S135 WeakPolarHBondContact O-CB 3.29Å; L131-S135 PolarHBondContact O-N 3.26Å; L131-S135 PolarHBondContact O-OG 2.89Å
132	K	40.5	Very low	38.5	Very low	153 Å²	153	100.7 Å²	100.7	67%	0.665	53%	0.53	S	S	*	.	H	α-helix	trans	-65.1	-43.7	175	-81.7	-169.2	173.2	-171	0	112.6	L128 R129 C130 S135 V136	L128-K132 PolarHBondContact O-N 3.25Å; R129-K132 PolarHBondContact O-N 3.26Å; C130-K132 VanDerWaalsContact C-N 3.28Å; C130-K132 PolarHBondContact O-N 2.89Å; K132-S135 WeakPolarHBondContact CA-OG 3.43Å; K132-S135 PolarHBondContact O-N 2.93Å; K132-S135 PolarHBondContact O-OG 3.46Å; K132-V136 WeakPolarHBondContact O-CG2 3.37Å; K132-V136 PolarHBondContact O-N 2.96Å
133	Q	44.5	Very low	37.8	Very low	124 Å²	124	105.4 Å²	105.4	58%	0.579	55%	0.55	S	S	*	*	H	α-helix	trans	-65.2	-46.1	177.9	-72.2	173.7	-92.6	0	0	111.3	R129 C130 S135 V136 D137	R129-Q133 PolarHBondContact O-N 2.92Å; R129-Q133 VanDerWaalsContact O-N 3.08Å; C130-Q133 PolarHBondContact O-N 3.45Å; C130-Q133 VanDerWaalsContact O-N 3.1Å; Q133-S135 PolarHBondContact O-N 2.81Å; Q133-S135 VanDerWaalsContact O-N 3.16Å; Q133-V136 PolarHBondContact O-N 2.83Å; Q133-D137 PolarHBondContact O-N 3.05Å
134	T	38.1	Very low	37.3	Very low	78 Å²	78	104.9 Å²	104.9	48%	0.479	56%	0.56	S	S	.	*	H	α-helix	trans	-59.6	-29.8	174	50.6	0	0	0	0	113.3	C130 L131 Y138	C130-T134 PolarHBondContact O-N 2.89Å; C130-T134 PolarHBondContact O-OG1 2.9Å; L131-T134 WeakPolarHBondContact CA-OG1 3.29Å; L131-T134 PolarHBondContact O-OG1 3.32Å; T134-Y138 WeakPolarHBondContact O-CB 3.39Å; T134-Y138 PolarHBondContact O-N 2.89Å
135	S	33.9	Very low	36.5	Very low	79 Å²	79	110.6 Å²	110.6	55%	0.552	59%	0.585	S	S	*	*	H	α-helix	trans	-75.7	-20.8	175.1	73.9	0	0	0	0	114.3	L131 K132 Q133	L131-S135 WeakPolarHBondContact O-CB 3.29Å; L131-S135 PolarHBondContact O-N 3.26Å; L131-S135 PolarHBondContact O-OG 2.89Å; K132-S135 WeakPolarHBondContact CA-OG 3.43Å; K132-S135 PolarHBondContact O-N 2.93Å; K132-S135 PolarHBondContact O-OG 3.46Å; Q133-S135 PolarHBondContact O-N 2.81Å; Q133-S135 VanDerWaalsContact O-N 3.16Å
136	V	34.3	Very low	36	Very low	86 Å²	86	112.9 Å²	112.9	52%	0.521	59%	0.591	S	S	.	*	H	α-helix	trans	-85.3	-46.8	175.8	171.6	0	0	0	0	110	K132 Q133 Y138 S139	K132-V136 WeakPolarHBondContact O-CG2 3.37Å; K132-V136 PolarHBondContact O-N 2.96Å; Q133-V136 PolarHBondContact O-N 2.83Å; V136-Y138 VanDerWaalsContact C-N 3.33Å; V136-Y138 PolarHBondContact O-N 2.82Å; V136-S139 WeakPolarHBondContact O-CB 3.47Å; V136-S139 PolarHBondContact O-N 2.8Å; V136-S139 PolarHBondContact O-OG 2.76Å
137	D	32.6	Very low	35.3	Very low	106 Å²	106	116.1 Å²	116.1	57%	0.567	61%	0.611	S	S	*	*	H	α-helix	trans	-66.1	-34.7	-176.3	-59	-35.9	0	0	0	112.2	Q133 S139 Q140	Q133-D137 PolarHBondContact O-N 3.05Å; D137-S139 PolarHBondContact O-N 3.33Å; D137-S139 VanDerWaalsContact O-N 3.17Å; D137-Q140 PolarHBondContact O-N 3.24Å
138	Y	29.9	Very low	34.1	Very low	192 Å²	192	118.6 Å²	118.6	75%	0.753	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-14.8	173.1	-101.7	-89.7	0	0	0	114.5	T134 V136 Q140	T134-Y138 WeakPolarHBondContact O-CB 3.39Å; T134-Y138 PolarHBondContact O-N 2.89Å; V136-Y138 VanDerWaalsContact C-N 3.33Å; V136-Y138 PolarHBondContact O-N 2.82Å; Y138-Q140 VanDerWaalsContact C-N 3.34Å
139	S	31.8	Very low	33.5	Very low	85 Å²	85	122.5 Å²	122.5	59%	0.594	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-10.5	178.1	74.6	0	0	0	0	114.1	V136 D137	V136-S139 WeakPolarHBondContact O-CB 3.47Å; V136-S139 PolarHBondContact O-N 2.8Å; V136-S139 PolarHBondContact O-OG 2.76Å; D137-S139 PolarHBondContact O-N 3.33Å; D137-S139 VanDerWaalsContact O-N 3.17Å
140	Q	33	Very low	32.6	Very low	165 Å²	165	123.1 Å²	123.1	77%	0.771	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	-10.8	-175.7	-65	-167.7	-9.4	0	0	115.1	D137 Y138	D137-Q140 PolarHBondContact O-N 3.24Å; Y138-Q140 VanDerWaalsContact C-N 3.34Å
141	Q	31.3	Very low	31.4	Very low	172 Å²	172	126.4 Å²	126.4	80%	0.804	68%	0.681	S	S	*	*	S	Bend	trans	-98.6	-4.8	176.5	-69.9	-171.7	-18.7	0	0	114.4	N143	Q141-N143 PolarHBondContact O-N 2.98Å
142	A	26.3	Very low	30.6	Very low	81 Å²	81	127.2 Å²	127.2	67%	0.669	69%	0.693	S	S	*	*			trans	-80.3	44.5	179.6	0	0	0	0	0	114
143	N	26.2	Very low	30	Very low	166 Å²	166	125.8 Å²	125.8	89%	0.888	69%	0.692	S	S	*	*			trans	-152.9	68.2	175.7	-103.3	-35.3	0	0	0	112.2	Q141	Q141-N143 PolarHBondContact O-N 2.98Å
144	G	27.6	Very low	29	Very low	63 Å²	63	129.7 Å²	129.7	65%	0.649	70%	0.701	S	S	*	*	S	Bend	trans	-174	110.9	173.8	0	0	0	0	0	114.2
145	L	30.3	Very low	28.4	Very low	174 Å²	174	132.5 Å²	132.5	91%	0.911	71%	0.713	S	S	*	*			trans	40.7	88.3	154.5	-61.1	161.5	0	0	0	116.5
146	K	28.6	Very low	27.9	Very low	187 Å²	187	134.7 Å²	134.7	81%	0.813	72%	0.719	S	S	*	*				45.9	116.7	84.1	-78.3	-168.5	172.9	-177.7	0	116.7
147	N	29.1	Very low	27.5	Very low	142 Å²	142	136.4 Å²	136.4	76%	0.759	73%	0.729	S	S	*	*			trans	72.7	115.9	159.1	-49.9	6.7	0	0	0	116
148	S	26.8	Very low	27.2	Very low	90 Å²	90	137.6 Å²	137.6	63%	0.629	74%	0.741	S	S	*	*			cis	83.2	131.9	36.8	83.8	0	0	0	0	113.9
149	F	25.7	Very low	27.4	Very low	180 Å²	180	133.4 Å²	133.4	79%	0.789	74%	0.737	S	S	*	*			cis	-158.5	160.6	20.4	-98.3	-65.2	0	0	0	113
150	I	25.8	Very low	27.2	Very low	143 Å²	143	139.2 Å²	139.2	73%	0.733	75%	0.752	S	S	*	*			trans	59.4	118.6	144.2	-71.6	161.4	0	0	0	118.5
151	S	23.2	Very low	27.1	Very low	103 Å²	103	135.6 Å²	135.6	72%	0.72	75%	0.75	S	S	*	*				67.5	141.8	68.6	-78.1	0	0	0	0	114.8
152	C	24	Very low	26.9	Very low	103 Å²	103	134.9 Å²	134.9	70%	0.696	75%	0.752	S	S	*	*			cis	-171.3	168.9	-4.4	-107.1	0	0	0	0	107.6
153	D	26.7	Very low	27.1	Very low	122 Å²	122	134.2 Å²	134.2	65%	0.652	75%	0.746	S	S	*	*			cis	-160.6	-174.4	0	-136.6	-45.5	0	0	0	112.7
154	R	25	Very low	27.1	Very low	206 Å²	206	133.6 Å²	133.6	78%	0.777	74%	0.743	S	S	*	*			trans	-7.6	154.7	146.1	-74.3	160.5	-179.8	-127.7	-6.5	119.8
155	L	24	Very low	27.2	Very low	138 Å²	138	138.3 Å²	138.3	72%	0.723	75%	0.752	S	S	*	*			cis	-157.9	169.2	-1.8	-93	152.6	0	0	0	105.9
156	N	24.6	Very low	27.7	Very low	125 Å²	125	135 Å²	135	67%	0.668	74%	0.741	S	S	*	*			cis	-173.4	167.1	39.2	-143.4	2.9	0	0	0	111.5
157	T	25.6	Very low	28	Very low	121 Å²	121	132.9 Å²	132.9	74%	0.742	74%	0.743	S	S	*	*			trans	38.9	125.3	152.4	53.1	0	0	0	0	123.8
158	T	25.4	Very low	28	Very low	132 Å²	132	129.3 Å²	129.3	81%	0.81	74%	0.74	S	S	*	*			trans	-85.6	178.5	154.4	53.7	0	0	0	0	111.3
159	P	35.2	Very low	28.3	Very low	104 Å²	104	130.4 Å²	130.4	68%	0.675	75%	0.748	S	S	*	*			cis	-137.1	165.5	2.5	24.5	1	0	0	0	119.2
160	F	27.8	Very low	28.4	Very low	206 Å²	206	133.9 Å²	133.9	90%	0.904	76%	0.755	S	S	*	*			trans	56.3	125.3	148.7	-70.4	-59.4	0	0	0	125.1
161	A	29.7	Very low	28.7	Very low	89 Å²	89	133 Å²	133	74%	0.736	76%	0.762	S	S	*	*			trans	66.1	135.8	144.6	0	0	0	0	0	119.8
162	D	27.9	Very low	29.1	Very low	157 Å²	157	134 Å²	134	84%	0.84	77%	0.769	S	S	*	*			cis	-153.9	179.7	-3.3	-129.6	-39.2	0	0	0	114.4
163	A	29.5	Very low	29.4	Very low	67 Å²	67	132.7 Å²	132.7	55%	0.554	77%	0.773	S	S	*	*			trans	-51.5	166.4	-174.8	0	0	0	0	0	117.2
164	N	27.5	Very low	29.6	Very low	153 Å²	153	135.2 Å²	135.2	82%	0.818	79%	0.787	S	S	*	*			cis	-166.3	151.9	47.6	-73.4	-88.5	0	0	0	113
165	I	29.1	Very low	29.7	Very low	163 Å²	163	129 Å²	129	84%	0.836	79%	0.786	S	S	*	*			trans	-153.2	139.7	173.9	-87.7	-170.9	0	0	0	110.1
166	P	40.6	Very low	29.9	Very low	104 Å²	104	131.1 Å²	131.1	68%	0.675	79%	0.792	S	S	*	*			cis	-152	-173.9	-21.3	46.9	-28.3	0	0	0	117.3
167	V	34.2	Very low	30	Very low	142 Å²	142	130 Å²	130	86%	0.861	79%	0.79	S	S	*	*			trans	64.7	130.6	155.5	174.5	0	0	0	0	119.2
168	G	30	Very low	30	Very low	68 Å²	68	131.7 Å²	131.7	70%	0.701	79%	0.789	S	S	*	*			cis	160.8	-180	-8.8	0	0	0	0	0	115.8
169	S	33.5	Very low	30.2	Very low	113 Å²	113	132 Å²	132	79%	0.79	79%	0.786	S	S	*	*			trans	85	90.1	162.5	-58.3	0	0	0	0	121.8
170	R	27.3	Very low	30	Very low	252 Å²	252	135 Å²	135	95%	0.951	79%	0.791	S	S	*	*				53	119.9	127.4	-66.8	179.1	168.5	-175.1	-4.9	122
171	S	32.6	Very low	30.2	Very low	126 Å²	126	133.4 Å²	133.4	88%	0.881	79%	0.787	S	S	*	*				-151.2	173.5	118.5	-160.8	0	0	0	0	110.2
172	S	31.8	Very low	30.3	Very low	124 Å²	124	136.4 Å²	136.4	87%	0.867	79%	0.785	S	S	*	*			trans	-113.8	160.6	-164.2	-50.4	0	0	0	0	114.8
173	G	30.5	Very low	30.5	Very low	75 Å²	75	133 Å²	133	77%	0.773	77%	0.773	S	S	*	*			trans	173.6	129.9	165.1	0	0	0	0	0	112.2
174	D	28.9	Very low	30.6	Very low	175 Å²	175	136.4 Å²	136.4	94%	0.936	78%	0.783	S	S	*	*			trans	-95.6	157	-179.4	-55.9	-81.4	0	0	0	112
175	G	28.8	Very low	30.7	Very low	74 Å²	74	132.6 Å²	132.6	76%	0.763	78%	0.779	S	S	*	*			trans	150.7	125.1	160.7	0	0	0	0	0	118.2
176	Q	26.5	Very low	30.9	Very low	184 Å²	184	131.9 Å²	131.9	86%	0.86	78%	0.782	S	S	*	*			trans	-38.9	160.6	146	-76.2	159.6	-50.5	0	0	114.1
177	T	27.8	Very low	30.3	Very low	100 Å²	100	134.6 Å²	134.6	61%	0.613	79%	0.791	S	S	*	*			cis	-162.7	166.7	22	-6.5	0	0	0	0	112.5
178	E	26.5	Very low	30	Very low	157 Å²	157	138.2 Å²	138.2	73%	0.734	79%	0.791	S	S	*	*			trans	46.8	127.9	140.8	-73.9	146.8	-162.6	0	0	123.9
179	D	28.6	Very low	29.9	Very low	139 Å²	139	146.4 Å²	146.4	74%	0.743	80%	0.8	S	S	*	*				86	138.1	129.3	-60.4	-8.4	0	0	0	126.4
180	E	31.2	Very low	29.4	Very low	166 Å²	166	148.9 Å²	148.9	78%	0.776	80%	0.803	S	S	*	*			trans	68.8	125	150	-72.4	177.9	175.9	0	0	125.2
181	E	31.1	Very low	29.5	Very low	174 Å²	174	143.1 Å²	143.1	81%	0.813	80%	0.796	S	S	*	*			trans	55	145.2	140.7	-56.6	-168.7	154.8	0	0	121.6
182	E	31.8	Very low	29.5	Very low	152 Å²	152	142.7 Å²	142.7	71%	0.71	79%	0.791	S	S	*	*			cis	-145.1	-177.6	-6.2	-139.3	-120.8	126.3	0	0	106.3	N184	E182-N184 PolarHBondContact OE1-N 2.99Å
183	S	32.4	Very low	29.2	Very low	84 Å²	84	143.3 Å²	143.3	59%	0.587	78%	0.784	S	S	*	*			cis	-160.4	-175.4	21.8	71.9	0	0	0	0	115.1
184	N	31.6	Very low	29	Very low	140 Å²	140	146.3 Å²	146.3	75%	0.749	78%	0.78	S	S	*	*			trans	4.7	138.7	147.7	-59.1	-66.9	0	0	0	118.7	E182	E182-N184 PolarHBondContact OE1-N 2.99Å
185	G	30.4	Very low	28.9	Very low	72 Å²	72	145.8 Å²	145.8	74%	0.742	77%	0.771	S	S	*	*			cis	166.4	159.2	6.8	0	0	0	0	0	107.1
186	V	32	Very low	28.7	Very low	149 Å²	149	147.4 Å²	147.4	90%	0.903	77%	0.771	S	S	*	*			cis	-148.7	167.9	35	167.1	0	0	0	0	110
187	N	30	Very low	28.9	Very low	161 Å²	161	147.3 Å²	147.3	86%	0.861	77%	0.768	S	S	*	*			trans	-77.2	153.6	-159.3	-89.1	-63.8	0	0	0	119.9
188	Y	27.6	Very low	28.9	Very low	218 Å²	218	148.9 Å²	148.9	86%	0.855	77%	0.771	S	S	*	*			trans	-80.7	174.3	165	-73.7	-106.7	0	0	0	113.1
189	R	26.7	Very low	29	Very low	239 Å²	239	148.3 Å²	148.3	90%	0.902	77%	0.773	S	S	*	*				-168.6	110	121.5	-109.5	178.7	-171.7	-167.9	3.3	115.5
190	I	23.9	Very low	29	Very low	165 Å²	165	146.5 Å²	146.5	85%	0.846	77%	0.772	S	S	*	*			trans	-149.9	123	131.7	-54.5	-175.3	0	0	0	107.1
191	T	28.1	Very low	28.8	Very low	131 Å²	131	145.2 Å²	145.2	80%	0.804	78%	0.775	S	S	*	*			trans	-153.3	148.9	166.2	36.5	0	0	0	0	110.4
192	P	34.3	Very low	28.6	Very low	118 Å²	118	142.8 Å²	142.8	77%	0.766	78%	0.776	S	S	*	*			trans	-110.5	148.5	177.7	39.2	-31.7	0	0	0	115.2
193	D	25.6	Very low	28.1	Very low	137 Å²	137	140.1 Å²	140.1	73%	0.733	77%	0.774	S	S	*	*			trans	73.6	139.1	142.8	-107.5	-15.7	0	0	0	125.1
194	M	26.2	Very low	27.8	Very low	137 Å²	137	143.3 Å²	143.3	68%	0.675	79%	0.785	S	S	*	*			trans	60.5	138.2	162.4	-52.8	-54.9	169.3	0	0	118.7
195	Q	25.7	Very low	27.4	Very low	164 Å²	164	145.9 Å²	145.9	77%	0.766	79%	0.789	S	S	*	*			cis	-163.5	145.6	-5	-127.7	166.8	30	0	0	110.8
196	S	25.1	Very low	27	Very low	108 Å²	108	147.2 Å²	147.2	76%	0.755	79%	0.788	S	S	*	*				174.9	147.7	128.2	54.1	0	0	0	0	116
197	K	30.2	Very low	26.6	Very low	182 Å²	182	146.6 Å²	146.6	79%	0.791	78%	0.779	S	S	*	*			trans	71.7	113.3	147.7	-78.9	176.1	178	176.2	0	122.9
198	I	28.1	Very low	26.2	Very low	134 Å²	134	146.8 Å²	146.8	69%	0.687	78%	0.775	S	S	*	*			trans	83.2	86.5	132.7	-56.6	163.7	0	0	0	117.8
199	N	28.1	Very low	25.9	Very low	144 Å²	144	141.6 Å²	141.6	77%	0.77	77%	0.766	S	S	*	*				178.8	151.4	101.3	-98.6	-33	0	0	0	113.7
200	S	28.4	Very low	25.7	Very low	102 Å²	102	137.1 Å²	137.1	71%	0.713	76%	0.76	S	S	*	*			trans	33.2	126.8	151.3	58.5	0	0	0	0	121
201	T	26.6	Very low	25.7	Very low	138 Å²	138	134.7 Å²	134.7	85%	0.847	75%	0.752	S	S	*	*			cis	-156.9	168.9	5.2	-58.6	0	0	0	0	110.4
202	C	27.6	Very low	25.5	Very low	123 Å²	123	135.5 Å²	135.5	83%	0.831	75%	0.751	S	S	*	*			trans	-71.5	163.5	-165.5	-57.3	0	0	0	0	119
203	S	22.3	Very low	25.1	Very low	96 Å²	96	137.2 Å²	137.2	67%	0.671	75%	0.753	S	S	*	*			trans	-72.1	160.8	164.4	55.5	0	0	0	0	114.5
204	N	26.2	Very low	25.1	Very low	151 Å²	151	133.8 Å²	133.8	81%	0.807	75%	0.75	S	S	*	*				-178	-179.5	111.4	-94.2	-13.9	0	0	0	115
205	F	21.7	Very low	25.2	Very low	194 Å²	194	131.6 Å²	131.6	85%	0.851	75%	0.748	S	S	*	*			trans	-84.8	167.9	-165.2	-90.8	-106.1	0	0	0	116.6
206	S	21.9	Very low	25.3	Very low	101 Å²	101	132.5 Å²	132.5	71%	0.706	75%	0.752	S	S	*	*			trans	88.6	131.9	139.8	62.2	0	0	0	0	122.4
207	N	23.8	Very low	25.4	Very low	135 Å²	135	133.3 Å²	133.3	72%	0.722	76%	0.757	S	S	*	*			trans	70.2	113.8	144.8	-65.9	22.1	0	0	0	122.9
208	E	22.1	Very low	25.2	Very low	165 Å²	165	133.8 Å²	133.8	77%	0.771	76%	0.759	S	S	*	*				78.8	129.7	125.2	-73	-164.9	120.1	0	0	123.7
209	V	21.5	Very low	25.2	Very low	109 Å²	109	135.6 Å²	135.6	66%	0.661	77%	0.77	S	S	*	*			trans	86.6	109.7	133.1	165.9	0	0	0	0	120.1
210	N	23.2	Very low	25	Very low	146 Å²	146	132.3 Å²	132.3	78%	0.781	77%	0.769	S	S	*	*			trans	72.3	150.7	142.5	-75.3	-2.7	0	0	0	120.8
211	V	22.6	Very low	24.7	Very low	114 Å²	114	133.1 Å²	133.1	69%	0.691	78%	0.775	S	S	*	*			cis	-168	172.9	-18.5	78.7	0	0	0	0	110.7
212	L	25	Very low	24.6	Very low	147 Å²	147	132.8 Å²	132.8	77%	0.77	78%	0.776	S	S	*	*			trans	64.8	151.7	175.9	-94.8	88.5	0	0	0	115.4
213	L	26.4	Very low	24.3	Very low	154 Å²	154	131.7 Å²	131.7	81%	0.806	77%	0.769	S	S	*	*			cis	-171.7	151.7	-21.3	-173.5	63.3	0	0	0	106.4
214	G	24.8	Very low	24.2	Very low	65 Å²	65	133.3 Å²	133.3	67%	0.67	78%	0.775	S	S	*	*			cis	-161.6	-138	-1.8	0	0	0	0	0	107.6
215	S	28.2	Very low	24.1	Very low	91 Å²	91	131.8 Å²	131.8	64%	0.636	78%	0.776	S	S	*	*			cis	-157.4	146.5	-6.6	-70	0	0	0	0	110
216	H	28.3	Very low	24.1	Very low	184 Å²	184	132.3 Å²	132.3	85%	0.852	78%	0.779	S	S	*	*			trans	59	94.6	161.4	-53.4	-53.4	0	0	0	121.4
217	S	27.6	Very low	24.3	Very low	124 Å²	124	134.2 Å²	134.2	87%	0.867	79%	0.786	S	S	*	*				-138.8	157.6	114.8	62.2	0	0	0	0	109.1
218	K	25.1	Very low	24.2	Very low	192 Å²	192	136.2 Å²	136.2	84%	0.835	79%	0.791	S	S	*	*			trans	-149.9	161.3	-167.8	-135.5	-178.2	-173.7	-175.8	0	110.8
219	L	27.2	Very low	24.4	Very low	173 Å²	173	135.7 Å²	135.7	91%	0.906	79%	0.793	S	S	*	*			trans	71	123.3	-166.3	-66.3	76.5	0	0	0	112.9
220	G	24	Very low	24.5	Very low	74 Å²	74	138.3 Å²	138.3	76%	0.763	80%	0.798	S	S	*	*			cis	-175.2	154.7	-7.4	0	0	0	0	0	114.4
221	S	22.1	Very low	24.6	Very low	119 Å²	119	138.4 Å²	138.4	83%	0.832	80%	0.798	S	S	*	*			trans	-133.1	150.9	169.3	-51.5	0	0	0	0	108.4
222	P	25.4	Very low	24.8	Very low	132 Å²	132	139.4 Å²	139.4	86%	0.857	80%	0.799	S	S	*	*			trans	-125.8	134.6	138.6	34.7	-26.8	0	0	0	111.2
223	S	20.3	Very low	24.9	Very low	100 Å²	100	136.2 Å²	136.2	70%	0.699	79%	0.786	S	S	*	*			trans	-99.9	171.7	159.8	50.8	0	0	0	0	109.6
224	T	21.6	Very low	25.1	Very low	130 Å²	130	135.2 Å²	135.2	80%	0.798	78%	0.775	S	S	*	*			trans	72.2	104.8	171.9	67.1	0	0	0	0	118.4
225	S	23.8	Very low	25.8	Very low	119 Å²	119	135.2 Å²	135.2	83%	0.832	76%	0.757	S	S	*	*			trans	-153	126.5	135	59.6	0	0	0	0	108.3
226	F	21.7	Very low	26.3	Very low	204 Å²	204	134.4 Å²	134.4	90%	0.895	75%	0.745	S	S	*	*			trans	-82.2	142.5	175.9	-73.7	-109.1	0	0	0	110.7
227	T	25	Very low	26.6	Very low	142 Å²	142	126 Å²	126	87%	0.871	71%	0.706	S	S	*	*			trans	-140.9	148	147.4	43.3	0	0	0	0	110.1
228	H	22.7	Very low	26.7	Very low	176 Å²	176	123.8 Å²	123.8	82%	0.815	69%	0.685	S	S	*	*			trans	-83.8	120.1	-169.9	-147	-95.5	0	0	0	110.7
229	D	25.6	Very low	27	Very low	154 Å²	154	119.1 Å²	119.1	82%	0.824	67%	0.674	S	S	*	*			trans	-148.1	62.8	175.5	-136.8	-7.4	0	0	0	112.1
230	Q	25.1	Very low	27.3	Very low	164 Å²	164	113.3 Å²	113.3	77%	0.766	66%	0.656	S	S	*	*			trans	-134.9	103.5	170.2	-72.4	-170.8	4.2	0	0	110.1
231	I	24.9	Very low	27.7	Very low	149 Å²	149	120 Å²	120	76%	0.764	66%	0.659	S	S	*	*			trans	-162.2	142.8	159.4	-102	142.5	0	0	0	109.7
232	N	25.6	Very low	28.5	Very low	134 Å²	134	116.6 Å²	116.6	72%	0.717	63%	0.634	S	S	*	*			trans	60.8	66	166.7	-71.8	-24.2	0	0	0	120.3
233	T	27.8	Very low	29.2	Very low	80 Å²	80	115.2 Å²	115.2	49%	0.491	63%	0.628	S	S	.	*			trans	-131.4	63.3	151.3	70.4	0	0	0	0	112.8	H235	T233-H235 PolarHBondContact O-N 3.41Å
234	K	30.2	Very low	30.2	Very low	134 Å²	134	117 Å²	117	58%	0.583	62%	0.624	S	S	*	*			trans	-72.9	76.8	-178.5	-70.9	-169.7	176.1	-173.7	0	113.9
235	H	38.7	Very low	31.2	Very low	64 Å²	64	113.3 Å²	113.3	30%	0.296	60%	0.597	S	S	.	*			trans	-133.6	85.4	171.6	-87.6	-71	0	0	0	115.9	T233 L237 T673 Q677	T233-H235 PolarHBondContact O-N 3.41Å; H235-L237 PolarHBondContact O-N 3.2Å; H235-L237 VanDerWaalsContact O-N 3.11Å; H235-T673 WeakPolarHBondContact CE1-CB 3.37Å; H235-T673 WeakPolarHBondContact CE1-CG2 3.17Å; H235-T673 VanDerWaalsContact NE2-CB 3.34Å; H235-T673 WeakPolarHBondContact NE2-CB 3.25Å; H235-T673 WeakPolarHBondContact NE2-CG2 3.24Å; H235-Q677 PolarHBondContact ND1-OE1 3.48Å
236	L	38.9	Very low	32.1	Very low	74 Å²	74	113 Å²	113	39%	0.387	58%	0.581	S	S	.	*			trans	-61.9	95	165.4	-74.5	140.7	0	0	0	112.1	E245 R729	L236-E245 HydrophobicContact CD2-CB 4.11Å; L236-E245 HydrophobicContact CD2-CG 3.94Å; L236-E245 WeakPolarHBondContact CD2-OE1 3.36Å; L236-R729 PolarHBondContact O-NH1 3.06Å
237	L	34.6	Very low	33.3	Very low	7 Å²	7	107.8 Å²	107.8	4%	0.037	56%	0.559	C	S	.	*			trans	-158.1	54.4	162.8	-86.5	-166.4	0	0	0	111.8	H235 L674 M681 R729 L732 L733 V736	H235-L237 PolarHBondContact O-N 3.2Å; H235-L237 VanDerWaalsContact O-N 3.11Å; L237-L674 HydrophobicContact CD1-CD2 3.63Å; L237-L674 HydrophobicContact CG-CD2 3.98Å; L237-M681 HydrophobicContact CD1-CE 4.45Å; L237-R729 HydrophobicContact CD2-CG 4.49Å; L237-L732 HydrophobicContact CD1-CB 3.83Å; L237-L732 HydrophobicContact CD1-CD1 3.93Å; L237-L733 HydrophobicContact CD2-CD2 3.73Å; L237-L733 HydrophobicContact CD2-CG 3.86Å; L237-V736 WeakPolarHBondContact O-CG1 3.04Å
238	L	30.8	Very low	34.4	Very low	78 Å²	78	103.2 Å²	103.2	41%	0.408	53%	0.529	S	S	.	.	S	Bend	trans	-156.2	145.6	164.2	-98.9	170.8	0	0	0	108.7	G240 V736 Q766	L238-G240 VanDerWaalsContact C-N 3.31Å; L238-G240 PolarHBondContact O-N 2.87Å; L238-V736 HydrophobicContact CD2-CG1 3.56Å; L238-V736 HydrophobicContact CG-CG1 3.99Å; L238-Q766 HydrophobicContact CD1-CG 4.31Å
239	P	31.2	Very low	35.6	Very low	94 Å²	94	98.4 Å²	98.4	61%	0.61	51%	0.512	S	S	*	.	S	Bend	trans	-79	77	-178.4	32.1	-34.4	0	0	0	111.7
240	G	33.4	Very low	36.8	Very low	52 Å²	52	95.3 Å²	95.3	54%	0.536	49%	0.489	S	S	.	.			trans	-133.1	59.1	174.9	0	0	0	0	0	111.1	L238 S242	L238-G240 VanDerWaalsContact C-N 3.31Å; L238-G240 PolarHBondContact O-N 2.87Å; G240-S242 VanDerWaalsContact C-N 3.31Å; G240-S242 PolarHBondContact O-N 3.18Å
241	R	31.9	Very low	37.8	Very low	215 Å²	215	91 Å²	91	81%	0.811	47%	0.468	S	S	*	.			trans	-55.4	83.6	-172.2	-77.6	-179.2	166.7	-175.3	-4.9	113
242	S	40.4	Very low	39.3	Very low	46 Å²	46	86.3 Å²	86.3	32%	0.322	45%	0.447	S	S	.	.			trans	-68.9	151.2	171.6	64.9	0	0	0	0	110.7	G240 F244 E245	G240-S242 VanDerWaalsContact C-N 3.31Å; G240-S242 PolarHBondContact O-N 3.18Å; S242-F244 PolarHBondContact O-N 2.96Å; S242-E245 PolarHBondContact O-N 3.1Å; S242-E245 WeakPolarHBondContact OG-CG 3.34Å; S242-E245 PolarHBondContact OG-N 3.12Å; S242-E245 VanDerWaalsContact OG-N 3.17Å; S242-E245 PolarHBondContact OG-OE2 3.24Å
243	S	39	Very low	40.5	Very low	104 Å²	104	81.3 Å²	81.3	73%	0.727	42%	0.424	S	S	*	.	H	α-helix	trans	-58.9	-34.6	169.6	47.2	0	0	0	0	111.5	E245 K246 H247	S243-E245 PolarHBondContact O-N 3.33Å; S243-K246 PolarHBondContact O-N 2.71Å; S243-H247 PolarHBondContact O-N 2.95Å
244	F	41.3	Very low	41.7	Very low	138 Å²	138	79.7 Å²	79.7	61%	0.605	41%	0.409	S	S	*	.	H	α-helix	trans	-58.4	-44.3	176.7	-177.1	-99.8	0	0	0	113.3	S242 H247 L248	S242-F244 PolarHBondContact O-N 2.96Å; F244-H247 WeakPolarHBondContact O-CB 3.21Å; F244-H247 PolarHBondContact O-N 3.38Å; F244-L248 WeakPolarHBondContact O-CB 3.35Å; F244-L248 PolarHBondContact O-N 2.91Å
245	E	43.3	Very low	42.9	Very low	52 Å²	52	79.3 Å²	79.3	24%	0.243	41%	0.408	C	S	.	.	H	α-helix	trans	-68.7	-34.8	178.4	-76.9	173.1	135	0	0	112.9	L236 S242 S243 H247 L248 V249	L236-E245 HydrophobicContact CD2-CB 4.11Å; L236-E245 HydrophobicContact CD2-CG 3.94Å; L236-E245 WeakPolarHBondContact CD2-OE1 3.36Å; S242-E245 PolarHBondContact O-N 3.1Å; S242-E245 WeakPolarHBondContact OG-CG 3.34Å; S242-E245 PolarHBondContact OG-N 3.12Å; S242-E245 VanDerWaalsContact OG-N 3.17Å; S242-E245 PolarHBondContact OG-OE2 3.24Å; S243-E245 PolarHBondContact O-N 3.33Å; E245-H247 VanDerWaalsContact C-N 3.34Å; E245-L248 PolarHBondContact O-N 3.31Å; E245-V249 WeakPolarHBondContact O-CG2 3.5Å; E245-V249 PolarHBondContact O-N 3.47Å; E245-V249 VanDerWaalsContact O-N 3.11Å
246	K	42.8	Very low	43.9	Very low	112 Å²	112	81.8 Å²	81.8	49%	0.487	42%	0.419	S	S	.	.	H	α-helix	trans	-62.8	-43.4	171.1	-64.7	-176.7	179.3	-177.9	0	110.9	S243 V249 R250	S243-K246 PolarHBondContact O-N 2.71Å; K246-V249 PolarHBondContact O-N 2.78Å; K246-R250 PolarHBondContact O-N 3.36Å
247	H	45.3	Very low	44.9	Very low	95 Å²	95	80 Å²	80	44%	0.44	41%	0.41	S	S	.	.	H	α-helix	trans	-62.8	-43.7	175.6	-163.3	-16.8	0	0	0	111.3	S243 F244 E245 V249 R250 E251	S243-H247 PolarHBondContact O-N 2.95Å; F244-H247 WeakPolarHBondContact O-CB 3.21Å; F244-H247 PolarHBondContact O-N 3.38Å; E245-H247 VanDerWaalsContact C-N 3.34Å; H247-V249 VanDerWaalsContact C-N 3.32Å; H247-V249 PolarHBondContact O-N 3.11Å; H247-R250 WeakPolarHBondContact O-CA 3.37Å; H247-R250 WeakPolarHBondContact O-CB 3.5Å; H247-R250 PolarHBondContact O-N 3.21Å; H247-R250 VanDerWaalsContact O-N 3.1Å; H247-E251 IonicContact CE1-OE1 2.68Å; H247-E251 PolarHBondContact CE1-OE1 3.29Å; H247-E251 IonicContact ND1-OE1 3.88Å; H247-E251 PolarHBondContact ND1-OE1 3.29Å; H247-E251 WeakPolarHBondContact O-CG 3.43Å; H247-E251 PolarHBondContact O-N 3.37Å
248	L	48.9	Very low	46	Very low	45 Å²	45	80.7 Å²	80.7	24%	0.236	42%	0.415	C	S	.	.	H	α-helix	trans	-63.8	-33.6	-179.9	-174.1	64.5	0	0	0	113.1	F244 E245 V252	F244-L248 WeakPolarHBondContact O-CB 3.35Å; F244-L248 PolarHBondContact O-N 2.91Å; E245-L248 PolarHBondContact O-N 3.31Å; L248-V252 WeakPolarHBondContact O-CG2 3.29Å; L248-V252 PolarHBondContact O-N 3.09Å
249	V	48.9	Very low	47.3	Very low	75 Å²	75	83.3 Å²	83.3	46%	0.455	43%	0.425	S	S	.	.	H	α-helix	trans	-69	-40.4	172.4	172.7	0	0	0	0	111.1	E245 K246 H247 V252 A253	E245-V249 WeakPolarHBondContact O-CG2 3.5Å; E245-V249 PolarHBondContact O-N 3.47Å; E245-V249 VanDerWaalsContact O-N 3.11Å; K246-V249 PolarHBondContact O-N 2.78Å; H247-V249 VanDerWaalsContact C-N 3.32Å; H247-V249 PolarHBondContact O-N 3.11Å; V249-V252 PolarHBondContact O-N 2.9Å; V249-A253 WeakPolarHBondContact O-CB 3.21Å; V249-A253 PolarHBondContact O-N 3.08Å
250	R	48.8	Very low	49.3	Very low	90 Å²	90	82.7 Å²	82.7	34%	0.34	41%	0.413	S	S	.	.	H	α-helix	trans	-61.3	-45.1	173.2	-174.6	-176.4	-173.3	-151.7	3.7	111.6	K246 H247 Y254 C345 S348	K246-R250 PolarHBondContact O-N 3.36Å; H247-R250 WeakPolarHBondContact O-CA 3.37Å; H247-R250 WeakPolarHBondContact O-CB 3.5Å; H247-R250 PolarHBondContact O-N 3.21Å; H247-R250 VanDerWaalsContact O-N 3.1Å; R250-Y254 WeakPolarHBondContact O-CB 3.46Å; R250-Y254 PolarHBondContact O-N 3.04Å; R250-C345 HydrophobicContact CB-CB 4.25Å; R250-C345 HydrophobicContact CG-CB 4.05Å; R250-S348 PolarHBondContact NH2-OG 3.23Å; R250-S348 VanDerWaalsContact NH2-OG 3.1Å
251	E	47.4	Very low	50.7	Low	73 Å²	73	80.3 Å²	80.3	34%	0.341	39%	0.388	S	S	.	.	H	α-helix	trans	-58.1	-53	175.4	-70	-61	109.6	0	0	111.2	H247 A253 Y254 F255	H247-E251 IonicContact CE1-OE1 2.68Å; H247-E251 PolarHBondContact CE1-OE1 3.29Å; H247-E251 IonicContact ND1-OE1 3.88Å; H247-E251 PolarHBondContact ND1-OE1 3.29Å; H247-E251 WeakPolarHBondContact O-CG 3.43Å; H247-E251 PolarHBondContact O-N 3.37Å; E251-A253 PolarHBondContact O-N 3.08Å; E251-Y254 WeakPolarHBondContact O-CB 3.44Å; E251-Y254 PolarHBondContact O-N 3.01Å; E251-Y254 VanDerWaalsContact O-N 3.13Å; E251-F255 VanDerWaalsContact O-CD2 3.3Å; E251-F255 WeakPolarHBondContact O-CD2 3.43Å; E251-F255 PolarHBondContact O-N 3.4Å
252	V	57.1	Low	52.3	Low	51 Å²	51	73.5 Å²	73.5	31%	0.309	37%	0.367	S	S	.	.	H	α-helix	trans	-62.7	-43.1	-177.2	170.5	0	0	0	0	111.6	L248 V249 Y254 F255 E256	L248-V252 WeakPolarHBondContact O-CG2 3.29Å; L248-V252 PolarHBondContact O-N 3.09Å; V249-V252 PolarHBondContact O-N 2.9Å; V252-Y254 VanDerWaalsContact C-N 3.3Å; V252-Y254 PolarHBondContact O-N 3.28Å; V252-F255 PolarHBondContact O-N 3.42Å; V252-E256 HydrophobicContact CG1-CG 4.4Å; V252-E256 WeakPolarHBondContact O-CG 3.28Å; V252-E256 PolarHBondContact O-N 3.32Å
253	A	50.9	Low	53.5	Low	29 Å²	29	77.8 Å²	77.8	24%	0.24	38%	0.382	C	S	.	.	H	α-helix	trans	-63.9	-35.3	175.6	0	0	0	0	0	112.5	V249 E251 I257	V249-A253 WeakPolarHBondContact O-CB 3.21Å; V249-A253 PolarHBondContact O-N 3.08Å; E251-A253 PolarHBondContact O-N 3.08Å; A253-I257 WeakPolarHBondContact O-CB 2.99Å; A253-I257 WeakPolarHBondContact O-CD1 3.47Å; A253-I257 VanDerWaalsContact O-CG1 3.28Å; A253-I257 WeakPolarHBondContact O-CG1 3.05Å; A253-I257 PolarHBondContact O-N 2.9Å
254	Y	51.5	Low	55	Low	45 Å²	45	75.3 Å²	75.3	18%	0.176	36%	0.359	C	S	.	.	H	α-helix	trans	-67.1	-46.8	174.2	-170.7	-107.9	0	0	0	111.5	R250 E251 V252 I257 C258 A349 L352	R250-Y254 WeakPolarHBondContact O-CB 3.46Å; R250-Y254 PolarHBondContact O-N 3.04Å; E251-Y254 WeakPolarHBondContact O-CB 3.44Å; E251-Y254 PolarHBondContact O-N 3.01Å; E251-Y254 VanDerWaalsContact O-N 3.13Å; V252-Y254 VanDerWaalsContact C-N 3.3Å; V252-Y254 PolarHBondContact O-N 3.28Å; Y254-I257 PolarHBondContact O-N 2.86Å; Y254-C258 WeakPolarHBondContact O-CB 3.36Å; Y254-C258 PolarHBondContact O-N 3.12Å; Y254-C258 PolarHBondContact O-SG 3.45Å; Y254-A349 HydrophobicContact CD2-CB 4.03Å; Y254-L352 HydrophobicContact CE2-CB 4.18Å; Y254-L352 HydrophobicContact CE2-CD1 3.68Å
255	F	55.6	Low	56.2	Low	127 Å²	127	70.2 Å²	70.2	56%	0.557	34%	0.338	S	S	*	.	H	α-helix	trans	-62	-45.6	177	-87.4	-74.7	0	0	0	113	E251 V252 I257 C258 E259	E251-F255 VanDerWaalsContact O-CD2 3.3Å; E251-F255 WeakPolarHBondContact O-CD2 3.43Å; E251-F255 PolarHBondContact O-N 3.4Å; V252-F255 PolarHBondContact O-N 3.42Å; F255-I257 VanDerWaalsContact C-N 3.34Å; F255-I257 PolarHBondContact O-N 3.03Å; F255-C258 PolarHBondContact O-N 3.24Å; F255-E259 PolarHBondContact O-N 2.86Å
256	E	59.4	Low	57.4	Low	116 Å²	116	73.9 Å²	73.9	54%	0.542	36%	0.355	S	S	.	.	H	α-helix	trans	-64.3	-37.5	179.2	-72.2	-179.7	177.4	0	0	112	V252 F260	V252-E256 HydrophobicContact CG1-CG 4.4Å; V252-E256 WeakPolarHBondContact O-CG 3.28Å; V252-E256 PolarHBondContact O-N 3.32Å; E256-F260 WeakPolarHBondContact O-CB 3.34Å; E256-F260 PolarHBondContact O-N 3.4Å
257	I	61	Low	58.6	Low	37 Å²	37	74.1 Å²	74.1	19%	0.19	36%	0.357	C	S	.	.	H	α-helix	trans	-68.7	-40.8	172.9	-69.6	170.8	0	0	0	110.8	A253 Y254 F255 L261 A349 T350 A353	A253-I257 WeakPolarHBondContact O-CB 2.99Å; A253-I257 WeakPolarHBondContact O-CD1 3.47Å; A253-I257 VanDerWaalsContact O-CG1 3.28Å; A253-I257 WeakPolarHBondContact O-CG1 3.05Å; A253-I257 PolarHBondContact O-N 2.9Å; Y254-I257 PolarHBondContact O-N 2.86Å; F255-I257 VanDerWaalsContact C-N 3.34Å; F255-I257 PolarHBondContact O-N 3.03Å; I257-L261 HydrophobicContact CG2-CD1 3.88Å; I257-L261 HydrophobicContact CG2-CG 4.43Å; I257-L261 WeakPolarHBondContact O-CB 3.4Å; I257-L261 WeakPolarHBondContact O-CD1 3.31Å; I257-L261 WeakPolarHBondContact O-CG 3.41Å; I257-L261 PolarHBondContact O-N 3.16Å; I257-A349 HydrophobicContact CD1-CB 4Å; I257-T350 HydrophobicContact CD1-CG2 4.16Å; I257-A353 HydrophobicContact CG2-CB 3.85Å
258	C	56.4	Low	59.6	Low	20 Å²	20	69.9 Å²	69.9	14%	0.135	34%	0.338	C	S	.	.	H	α-helix	trans	-67.4	-43.1	178.6	-76.1	0	0	0	0	113.2	Y254 F255 L261 I262	Y254-C258 WeakPolarHBondContact O-CB 3.36Å; Y254-C258 PolarHBondContact O-N 3.12Å; Y254-C258 PolarHBondContact O-SG 3.45Å; F255-C258 PolarHBondContact O-N 3.24Å; C258-L261 PolarHBondContact O-N 3.05Å; C258-I262 WeakPolarHBondContact O-CB 3.28Å; C258-I262 WeakPolarHBondContact O-CD1 3.41Å; C258-I262 WeakPolarHBondContact O-CG1 3.29Å; C258-I262 PolarHBondContact O-N 3.13Å
259	E	59.8	Low	60.3	Low	134 Å²	134	71.2 Å²	71.2	63%	0.626	34%	0.341	S	S	*	.	H	α-helix	trans	-61.3	-45.1	175.2	-74.8	-167.1	143.8	0	0	111.1	F255 L261 I262 E263	F255-E259 PolarHBondContact O-N 2.86Å; E259-L261 PolarHBondContact O-N 3.44Å; E259-I262 PolarHBondContact O-N 3.18Å; E259-E263 PolarHBondContact O-N 2.91Å
260	F	72.8	Confident	61	Low	80 Å²	80	72.8 Å²	72.8	35%	0.351	35%	0.346	S	S	.	.	H	α-helix	trans	-59.4	-43.8	175.5	173.4	-104.2	0	0	0	112.8	E256 Q264 L380 L383	E256-F260 WeakPolarHBondContact O-CB 3.34Å; E256-F260 PolarHBondContact O-N 3.4Å; F260-Q264 HydrophobicContact CD2-CG 4.3Å; F260-Q264 HydrophobicContact CE1-CG 4.47Å; F260-Q264 HydrophobicContact CE2-CG 3.84Å; F260-Q264 HydrophobicContact CZ-CG 3.94Å; F260-Q264 WeakPolarHBondContact O-CB 3.3Å; F260-Q264 WeakPolarHBondContact O-CG 3.47Å; F260-Q264 PolarHBondContact O-N 3.18Å; F260-Q264 VanDerWaalsContact O-N 3.15Å; F260-L380 HydrophobicContact CE1-CD1 4.12Å; F260-L380 HydrophobicContact CZ-CD1 4.19Å; F260-L383 HydrophobicContact CZ-CD2 3.96Å
261	L	62.6	Low	61.2	Low	3 Å²	3	72 Å²	72	2%	0.016	35%	0.347	C	S	.	.	H	α-helix	trans	-63	-41.9	175.4	-73.4	167.3	0	0	0	111.9	I257 C258 E259 Q264 I265 A353 L356 I357 L384	I257-L261 HydrophobicContact CG2-CD1 3.88Å; I257-L261 HydrophobicContact CG2-CG 4.43Å; I257-L261 WeakPolarHBondContact O-CB 3.4Å; I257-L261 WeakPolarHBondContact O-CD1 3.31Å; I257-L261 WeakPolarHBondContact O-CG 3.41Å; I257-L261 PolarHBondContact O-N 3.16Å; C258-L261 PolarHBondContact O-N 3.05Å; E259-L261 PolarHBondContact O-N 3.44Å; L261-Q264 PolarHBondContact O-N 3.12Å; L261-I265 VanDerWaalsContact O-CB 3.3Å; L261-I265 WeakPolarHBondContact O-CB 3.37Å; L261-I265 WeakPolarHBondContact O-CD1 3.3Å; L261-I265 WeakPolarHBondContact O-CG1 3.47Å; L261-I265 PolarHBondContact O-N 3.45Å; L261-A353 HydrophobicContact CD1-CB 3.66Å; L261-L356 HydrophobicContact CB-CD2 4.46Å; L261-L356 HydrophobicContact CD1-CD2 4.14Å; L261-I357 HydrophobicContact CD2-CD1 3.6Å; L261-I357 HydrophobicContact CD2-CG1 3.94Å; L261-L384 HydrophobicContact CD2-CD1 3.82Å
262	I	64.3	Low	61.2	Low	71 Å²	71	72.3 Å²	72.3	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-66	-50.3	-179.5	-70.6	163.4	0	0	0	110.3	C258 E259 Q264 I265 E266	C258-I262 WeakPolarHBondContact O-CB 3.28Å; C258-I262 WeakPolarHBondContact O-CD1 3.41Å; C258-I262 WeakPolarHBondContact O-CG1 3.29Å; C258-I262 PolarHBondContact O-N 3.13Å; E259-I262 PolarHBondContact O-N 3.18Å; I262-Q264 VanDerWaalsContact C-N 3.28Å; I262-Q264 PolarHBondContact O-N 3.26Å; I262-I265 PolarHBondContact O-N 2.59Å; I262-I265 VanDerWaalsContact O-N 3.14Å; I262-E266 HydrophobicContact CG2-CG 4.37Å; I262-E266 WeakPolarHBondContact O-CG 3.17Å; I262-E266 PolarHBondContact O-N 3.44Å
263	E	66.3	Low	60.8	Low	137 Å²	137	73.4 Å²	73.4	64%	0.64	35%	0.353	S	S	*	.	H	α-helix	trans	-56.1	-43	177.2	-75	-164.2	145	0	0	111.7	E259 E266 E267	E259-E263 PolarHBondContact O-N 2.91Å; E263-E266 PolarHBondContact O-N 3.13Å; E263-E267 WeakPolarHBondContact O-CB 3.32Å; E263-E267 PolarHBondContact O-N 2.71Å
264	Q	71.6	Confident	60.2	Low	52 Å²	52	75.1 Å²	75.1	24%	0.243	36%	0.362	C	S	.	.	H	α-helix	trans	-71.5	-34.7	178.5	-68.7	-64.8	-85.3	0	0	113	F260 L261 I262 E267 I268 L380	F260-Q264 HydrophobicContact CD2-CG 4.3Å; F260-Q264 HydrophobicContact CE1-CG 4.47Å; F260-Q264 HydrophobicContact CE2-CG 3.84Å; F260-Q264 HydrophobicContact CZ-CG 3.94Å; F260-Q264 WeakPolarHBondContact O-CB 3.3Å; F260-Q264 WeakPolarHBondContact O-CG 3.47Å; F260-Q264 PolarHBondContact O-N 3.18Å; F260-Q264 VanDerWaalsContact O-N 3.15Å; L261-Q264 PolarHBondContact O-N 3.12Å; I262-Q264 VanDerWaalsContact C-N 3.28Å; I262-Q264 PolarHBondContact O-N 3.26Å; Q264-E267 PolarHBondContact NE2-OE2 2.76Å; Q264-I268 WeakPolarHBondContact O-CB 3.44Å; Q264-I268 VanDerWaalsContact O-CD1 3.31Å; Q264-I268 WeakPolarHBondContact O-CD1 3.44Å; Q264-I268 WeakPolarHBondContact O-CG1 3.44Å; Q264-I268 PolarHBondContact O-N 3.37Å; Q264-L380 HydrophobicContact CB-CD1 3.72Å; Q264-L380 HydrophobicContact CB-CD2 3.86Å; Q264-L380 HydrophobicContact CB-CG 4.47Å; Q264-L380 HydrophobicContact CG-CD1 3.82Å
265	I	66.2	Low	59.7	Low	31 Å²	31	77.6 Å²	77.6	16%	0.159	38%	0.376	C	S	.	.	H	α-helix	trans	-66.3	-42.5	173.1	-74.3	165.1	0	0	0	110.8	L261 I262 I268 Y269 L356 F377	L261-I265 VanDerWaalsContact O-CB 3.3Å; L261-I265 WeakPolarHBondContact O-CB 3.37Å; L261-I265 WeakPolarHBondContact O-CD1 3.3Å; L261-I265 WeakPolarHBondContact O-CG1 3.47Å; L261-I265 PolarHBondContact O-N 3.45Å; I262-I265 PolarHBondContact O-N 2.59Å; I262-I265 VanDerWaalsContact O-N 3.14Å; I265-I268 WeakPolarHBondContact O-CB 3.27Å; I265-I268 PolarHBondContact O-N 2.98Å; I265-Y269 HydrophobicContact CG2-CD2 4.1Å; I265-Y269 HydrophobicContact CG2-CE2 4.13Å; I265-Y269 WeakPolarHBondContact O-CD2 3.44Å; I265-Y269 PolarHBondContact O-N 2.99Å; I265-L356 HydrophobicContact CD1-CD2 3.99Å; I265-F377 HydrophobicContact CG1-CE1 3.83Å; I265-F377 HydrophobicContact CG1-CZ 4.13Å
266	E	66.8	Low	58.9	Low	129 Å²	129	78.3 Å²	78.3	60%	0.603	38%	0.379	S	S	*	.	H	α-helix	trans	-65.6	-46.2	177	-69.4	-173.3	158.3	0	0	111.2	I262 E263 I268 Y269 D270	I262-E266 HydrophobicContact CG2-CG 4.37Å; I262-E266 WeakPolarHBondContact O-CG 3.17Å; I262-E266 PolarHBondContact O-N 3.44Å; E263-E266 PolarHBondContact O-N 3.13Å; E266-I268 PolarHBondContact O-N 2.8Å; E266-Y269 PolarHBondContact O-N 3.26Å; E266-Y269 VanDerWaalsContact O-N 3.15Å; E266-D270 WeakPolarHBondContact O-CB 3.4Å; E266-D270 PolarHBondContact O-N 3.21Å
267	E	69.7	Low	57.5	Low	116 Å²	116	77.4 Å²	77.4	54%	0.542	38%	0.377	S	S	.	.	H	α-helix	trans	-61.6	-27.9	174.1	-177.2	175.8	-155	0	0	113.2	E263 Q264 K376	E263-E267 WeakPolarHBondContact O-CB 3.32Å; E263-E267 PolarHBondContact O-N 2.71Å; Q264-E267 PolarHBondContact NE2-OE2 2.76Å; E267-K376 PolarHBondContact O-NZ 3.04Å
268	I	64.6	Low	56.2	Low	7 Å²	7	80.5 Å²	80.5	4%	0.036	39%	0.394	C	S	.	.	H	α-helix	trans	-67	-49	173.1	-75.2	165.7	0	0	0	110.9	Q264 I265 E266 I373 K376 F377 L380	Q264-I268 WeakPolarHBondContact O-CB 3.44Å; Q264-I268 VanDerWaalsContact O-CD1 3.31Å; Q264-I268 WeakPolarHBondContact O-CD1 3.44Å; Q264-I268 WeakPolarHBondContact O-CG1 3.44Å; Q264-I268 PolarHBondContact O-N 3.37Å; I265-I268 WeakPolarHBondContact O-CB 3.27Å; I265-I268 PolarHBondContact O-N 2.98Å; E266-I268 PolarHBondContact O-N 2.8Å; I268-I373 HydrophobicContact CG2-CB 4.26Å; I268-I373 HydrophobicContact CG2-CG1 4.26Å; I268-I373 HydrophobicContact CG2-CG2 3.71Å; I268-K376 HydrophobicContact CB-CD 4.22Å; I268-K376 HydrophobicContact CD1-CB 4.04Å; I268-K376 HydrophobicContact CG1-CB 3.7Å; I268-K376 HydrophobicContact CG1-CD 3.65Å; I268-K376 HydrophobicContact CG1-CG 4.38Å; I268-K376 HydrophobicContact CG2-CB 4.41Å; I268-K376 HydrophobicContact CG2-CD 4.35Å; I268-F377 HydrophobicContact CB-CE2 4.45Å; I268-F377 HydrophobicContact CD1-CD1 3.97Å; I268-F377 HydrophobicContact CD1-CD2 4.32Å; I268-F377 HydrophobicContact CD1-CE1 3.97Å; I268-F377 HydrophobicContact CD1-CE2 4.31Å; I268-F377 HydrophobicContact CD1-CG 4.13Å; I268-F377 HydrophobicContact CD1-CZ 4.12Å; I268-F377 HydrophobicContact CG2-CD2 3.91Å; I268-F377 HydrophobicContact CG2-CE2 3.54Å; I268-F377 HydrophobicContact CG2-CZ 4.11Å; I268-L380 HydrophobicContact CD1-CD2 4.23Å
269	Y	63.9	Low	55.3	Low	73 Å²	73	83.6 Å²	83.6	29%	0.286	42%	0.416	S	S	.	.	H	α-helix	trans	-78.7	-34.7	-177.3	-77.1	-72.5	0	0	0	114	I265 E266 M271 E272 T364 I373 F377	I265-Y269 HydrophobicContact CG2-CD2 4.1Å; I265-Y269 HydrophobicContact CG2-CE2 4.13Å; I265-Y269 WeakPolarHBondContact O-CD2 3.44Å; I265-Y269 PolarHBondContact O-N 2.99Å; E266-Y269 PolarHBondContact O-N 3.26Å; E266-Y269 VanDerWaalsContact O-N 3.15Å; Y269-M271 PolarHBondContact O-N 2.8Å; Y269-E272 VanDerWaalsContact O-CB 3.28Å; Y269-E272 WeakPolarHBondContact O-CB 3.41Å; Y269-E272 PolarHBondContact O-N 3.42Å; Y269-T364 WeakPolarHBondContact OH-CG2 3.49Å; Y269-I373 HydrophobicContact CD1-CD1 4.39Å; Y269-I373 HydrophobicContact CE1-CG2 4.45Å; Y269-F377 HydrophobicContact CE2-CE2 4.12Å; Y269-F377 HydrophobicContact CE2-CZ 4.05Å
270	D	63.5	Low	54.1	Low	107 Å²	107	82 Å²	82	57%	0.572	41%	0.41	S	S	*	.	H	α-helix	trans	-69.9	-16.5	-176.6	-132.4	8.1	0	0	0	113	E266 E272 N273 C274	E266-D270 WeakPolarHBondContact O-CB 3.4Å; E266-D270 PolarHBondContact O-N 3.21Å; D270-E272 VanDerWaalsContact C-N 3.32Å; D270-N273 PolarHBondContact OD1-ND2 3.02Å; D270-C274 PolarHBondContact O-SG 2.97Å
271	M	53	Low	52.2	Low	74 Å²	74	87 Å²	87	37%	0.365	43%	0.427	S	S	.	.	H	α-helix	trans	-69.1	-25.5	168.6	-99.6	-160.2	61.1	0	0	113.8	Y269 N273 C274 E275 K376	Y269-M271 PolarHBondContact O-N 2.8Å; M271-N273 VanDerWaalsContact C-N 3.31Å; M271-N273 PolarHBondContact O-N 2.88Å; M271-C274 WeakPolarHBondContact O-CB 3.31Å; M271-C274 PolarHBondContact O-N 3.39Å; M271-E275 HydrophobicContact CE-CG 4.33Å; M271-E275 VanDerWaalsContact CE-OE1 3.28Å; M271-E275 WeakPolarHBondContact CE-OE1 3.37Å; M271-E275 PolarHBondContact O-N 3.46Å; M271-K376 VanDerWaalsContact SD-CE 3.53Å; M271-K376 PolarHBondContact SD-NZ 3.41Å
272	E	48.6	Very low	50.7	Low	79 Å²	79	93.3 Å²	93.3	37%	0.369	46%	0.461	S	S	.	.	H	α-helix	trans	-65.1	-38.1	176.9	-159.2	168.1	-151.7	0	0	110.8	Y269 D270 C274 F276 Q370 I373	Y269-E272 VanDerWaalsContact O-CB 3.28Å; Y269-E272 WeakPolarHBondContact O-CB 3.41Å; Y269-E272 PolarHBondContact O-N 3.42Å; D270-E272 VanDerWaalsContact C-N 3.32Å; E272-C274 VanDerWaalsContact C-N 3.29Å; E272-C274 PolarHBondContact O-N 2.93Å; E272-F276 VanDerWaalsContact O-CB 3.29Å; E272-F276 WeakPolarHBondContact O-CB 3.33Å; E272-F276 PolarHBondContact O-N 3.35Å; E272-F276 VanDerWaalsContact O-N 3.1Å; E272-Q370 VanDerWaalsContact CD-NE2 3.3Å; E272-Q370 WeakPolarHBondContact OE1-CG 3.27Å; E272-Q370 PolarHBondContact OE1-NE2 2.77Å; E272-Q370 PolarHBondContact OE2-NE2 2.6Å; E272-I373 HydrophobicContact CB-CD1 4.12Å; E272-I373 VanDerWaalsContact CD-CD1 3.5Å; E272-I373 HydrophobicContact CG-CD1 4.11Å
273	N	48.1	Very low	49.2	Very low	74 Å²	74	98.5 Å²	98.5	40%	0.396	48%	0.484	S	S	.	.	H	α-helix	trans	-60.1	-38.8	170.4	-72.1	-44.2	0	0	0	111.8	D270 M271 L277	D270-N273 PolarHBondContact OD1-ND2 3.02Å; M271-N273 VanDerWaalsContact C-N 3.31Å; M271-N273 PolarHBondContact O-N 2.88Å; N273-L277 WeakPolarHBondContact O-CB 3.34Å; N273-L277 WeakPolarHBondContact O-CD1 3.41Å; N273-L277 VanDerWaalsContact O-CG 3.23Å; N273-L277 WeakPolarHBondContact O-CG 3.42Å; N273-L277 PolarHBondContact O-N 3.34Å; N273-L277 VanDerWaalsContact O-N 3.09Å
274	C	37.6	Very low	47.4	Very low	65 Å²	65	100.1 Å²	100.1	44%	0.439	49%	0.489	S	S	.	.	H	α-helix	trans	-74.2	-40.9	-176.5	-64.6	0	0	0	0	113.1	D270 M271 E272 L277 N278	D270-C274 PolarHBondContact O-SG 2.97Å; M271-C274 WeakPolarHBondContact O-CB 3.31Å; M271-C274 PolarHBondContact O-N 3.39Å; E272-C274 VanDerWaalsContact C-N 3.29Å; E272-C274 PolarHBondContact O-N 2.93Å; C274-L277 PolarHBondContact O-N 3.29Å; C274-N278 PolarHBondContact O-N 2.97Å; C274-N278 PolarHBondContact O-ND2 3.02Å; C274-N278 VanDerWaalsContact O-ND2 3.12Å
275	E	41.2	Very low	45.2	Very low	98 Å²	98	105.1 Å²	105.1	46%	0.458	52%	0.517	S	S	.	.	H	α-helix	trans	-71.5	-37.4	176.8	-68.9	-173.1	173.6	0	0	111.8	M271 L277 N278 S279	M271-E275 HydrophobicContact CE-CG 4.33Å; M271-E275 VanDerWaalsContact CE-OE1 3.28Å; M271-E275 WeakPolarHBondContact CE-OE1 3.37Å; M271-E275 PolarHBondContact O-N 3.46Å; E275-L277 PolarHBondContact O-N 2.88Å; E275-N278 PolarHBondContact O-N 2.91Å; E275-S279 PolarHBondContact O-N 3.45Å
276	F	39.5	Very low	43.3	Very low	142 Å²	142	112.4 Å²	112.4	62%	0.623	55%	0.548	S	S	*	.	H	α-helix	trans	-61	-42	172.1	-172.1	-97.7	0	0	0	112.4	E272 S279 M280	E272-F276 VanDerWaalsContact O-CB 3.29Å; E272-F276 WeakPolarHBondContact O-CB 3.33Å; E272-F276 PolarHBondContact O-N 3.35Å; E272-F276 VanDerWaalsContact O-N 3.1Å; F276-S279 PolarHBondContact O-N 3.11Å; F276-M280 HydrophobicContact CE1-CG 4.43Å; F276-M280 PolarHBondContact O-N 3.5Å; F276-M280 VanDerWaalsContact O-N 3.1Å
277	L	30	Very low	41.3	Very low	97 Å²	97	112.7 Å²	112.7	51%	0.508	55%	0.554	S	S	.	*	H	α-helix	trans	-65.4	-40.3	174.4	-75.4	169.4	0	0	0	112.5	N273 C274 E275 S279 M280 Y281	N273-L277 WeakPolarHBondContact O-CB 3.34Å; N273-L277 WeakPolarHBondContact O-CD1 3.41Å; N273-L277 VanDerWaalsContact O-CG 3.23Å; N273-L277 WeakPolarHBondContact O-CG 3.42Å; N273-L277 PolarHBondContact O-N 3.34Å; N273-L277 VanDerWaalsContact O-N 3.09Å; C274-L277 PolarHBondContact O-N 3.29Å; E275-L277 PolarHBondContact O-N 2.88Å; L277-S279 VanDerWaalsContact C-N 3.33Å; L277-S279 PolarHBondContact O-N 3.2Å; L277-M280 PolarHBondContact O-N 3.4Å; L277-Y281 WeakPolarHBondContact O-CD2 3.5Å; L277-Y281 PolarHBondContact O-N 2.93Å
278	N	34.8	Very low	39.2	Very low	102 Å²	102	114.1 Å²	114.1	55%	0.545	57%	0.565	S	S	.	*	H	α-helix	trans	-67.6	-31.1	176.3	-76.1	-41	0	0	0	112.9	C274 E275 N282	C274-N278 PolarHBondContact O-N 2.97Å; C274-N278 PolarHBondContact O-ND2 3.02Å; C274-N278 VanDerWaalsContact O-ND2 3.12Å; E275-N278 PolarHBondContact O-N 2.91Å; N278-N282 PolarHBondContact O-ND2 2.71Å
279	S	37.4	Very low	37.2	Very low	84 Å²	84	118.5 Å²	118.5	59%	0.587	60%	0.596	S	S	*	*	H	α-helix	trans	-63.5	-49.9	169.7	177.4	0	0	0	0	111.1	E275 F276 L277 Y281 N282	E275-S279 PolarHBondContact O-N 3.45Å; F276-S279 PolarHBondContact O-N 3.11Å; L277-S279 VanDerWaalsContact C-N 3.33Å; L277-S279 PolarHBondContact O-N 3.2Å; S279-Y281 PolarHBondContact O-N 3.03Å; S279-Y281 VanDerWaalsContact O-N 3.15Å; S279-N282 PolarHBondContact O-N 3.17Å
280	M	34.6	Very low	35.3	Very low	102 Å²	102	123.5 Å²	123.5	50%	0.502	63%	0.627	S	S	.	*	H	α-helix	trans	-58.3	-26.2	178.4	-91.3	-100.8	66.3	0	0	115	F276 L277	F276-M280 HydrophobicContact CE1-CG 4.43Å; F276-M280 PolarHBondContact O-N 3.5Å; F276-M280 VanDerWaalsContact O-N 3.1Å; L277-M280 PolarHBondContact O-N 3.4Å
281	Y	32.5	Very low	33.4	Very low	184 Å²	184	126.5 Å²	126.5	72%	0.722	64%	0.638	S	S	*	*	H	α-helix	trans	-93.3	-13.4	-176.6	-93	-85.8	0	0	0	115.4	L277 S279	L277-Y281 WeakPolarHBondContact O-CD2 3.5Å; L277-Y281 PolarHBondContact O-N 2.93Å; S279-Y281 PolarHBondContact O-N 3.03Å; S279-Y281 VanDerWaalsContact O-N 3.15Å
282	N	31.1	Very low	31.9	Very low	136 Å²	136	129.9 Å²	129.9	73%	0.727	66%	0.655	S	S	*	*	H	α-helix	trans	-89.3	-13.4	-175.5	-82.7	-50.8	0	0	0	115.3	N278 S279	N278-N282 PolarHBondContact O-ND2 2.71Å; S279-N282 PolarHBondContact O-N 3.17Å
283	E	31.7	Very low	30.6	Very low	179 Å²	179	133.8 Å²	133.8	84%	0.836	68%	0.678	S	S	*	*	S	Bend	trans	-91.3	-13.9	177.2	-67.6	-164.5	132.2	0	0	114.4	N285	E283-N285 VanDerWaalsContact C-N 3.29Å; E283-N285 PolarHBondContact O-N 2.94Å
284	K	29.2	Very low	29.4	Very low	171 Å²	171	136 Å²	136	74%	0.743	69%	0.694	S	S	*	*			trans	-87	63	-176	-72.5	-171.4	175.1	179.5	0	113.4
285	N	26.3	Very low	28.6	Very low	158 Å²	158	139.4 Å²	139.4	85%	0.845	71%	0.708	S	S	*	*			trans	-133.4	54.5	168.7	-107.1	-30.6	0	0	0	112	E283	E283-N285 VanDerWaalsContact C-N 3.29Å; E283-N285 PolarHBondContact O-N 2.94Å
286	K	25.4	Very low	27.7	Very low	184 Å²	184	142 Å²	142	80%	0.8	72%	0.724	S	S	*	*	S	Bend	trans	-157.3	120.6	154.2	-109	160.4	-173.8	177.3	0	111.7
287	D	25.3	Very low	26.9	Very low	135 Å²	135	143 Å²	143	72%	0.722	73%	0.731	S	S	*	*			trans	60.4	120.4	150.5	-48.3	-29.5	0	0	0	122
288	N	25.7	Very low	26.7	Very low	145 Å²	145	143.9 Å²	143.9	78%	0.775	74%	0.74	S	S	*	*			trans	65.9	92.2	140.7	-59.4	-16.2	0	0	0	121.2
289	S	22.4	Very low	26.2	Very low	100 Å²	100	146.3 Å²	146.3	70%	0.699	75%	0.748	S	S	*	*				20.3	116.2	123	60.4	0	0	0	0	120
290	L	23.7	Very low	25.6	Very low	178 Å²	178	152 Å²	152	93%	0.932	76%	0.762	S	S	*	*				-156.7	-170.6	109.4	-136.5	75.6	0	0	0	111.3
291	Q	23	Very low	25.1	Very low	170 Å²	170	151.1 Å²	151.1	79%	0.794	77%	0.766	S	S	*	*			trans	-119.6	146.3	-164.3	-155.3	172.8	-24	0	0	111.2
292	I	22.2	Very low	24.9	Very low	144 Å²	144	149.4 Å²	149.4	74%	0.738	77%	0.769	S	S	*	*			trans	70.6	111.5	173.8	-45.2	178	0	0	0	116
293	L	21.6	Very low	24.7	Very low	161 Å²	161	148 Å²	148	84%	0.843	77%	0.766	S	S	*	*				-144.4	132.8	124.1	-165.2	63.8	0	0	0	110.7	D295	L293-D295 PolarHBondContact O-N 3.01Å
294	T	22.3	Very low	24.5	Very low	120 Å²	120	144.3 Å²	144.3	74%	0.736	75%	0.751	S	S	*	*			trans	-85	86.6	171.2	46	0	0	0	0	110.1
295	D	21.3	Very low	24.5	Very low	137 Å²	137	139.5 Å²	139.5	73%	0.733	74%	0.738	S	S	*	*			trans	-165.1	105.6	146.4	-108.4	-33.1	0	0	0	111.1	L293	L293-D295 PolarHBondContact O-N 3.01Å
296	L	23	Very low	24.6	Very low	152 Å²	152	137 Å²	137	80%	0.796	73%	0.732	S	S	*	*			trans	-144.3	82.9	166.8	-116.2	169.1	0	0	0	108.6	V298	L296-V298 HydrophobicContact CD2-CG2 4.1Å; L296-V298 PolarHBondContact O-N 2.6Å
297	Q	22.6	Very low	25	Very low	164 Å²	164	131.9 Å²	131.9	77%	0.766	72%	0.72	S	S	*	*			trans	-66.4	77.8	159.8	-67.9	-170.1	8.4	0	0	108.8	H299	Q297-H299 PolarHBondContact O-N 3.33Å
298	V	24.3	Very low	25.2	Very low	116 Å²	116	128 Å²	128	70%	0.703	70%	0.698	S	S	*	*			trans	-57.6	112.7	163.1	178.2	0	0	0	0	106.3	L296 K300	L296-V298 HydrophobicContact CD2-CG2 4.1Å; L296-V298 PolarHBondContact O-N 2.6Å; V298-K300 PolarHBondContact O-N 2.89Å
299	H	25.8	Very low	25.3	Very low	153 Å²	153	126.5 Å²	126.5	71%	0.708	69%	0.69	S	S	*	*			trans	-55.2	128	-176.3	-90.4	-118.8	0	0	0	109.9	Q297 S301	Q297-H299 PolarHBondContact O-N 3.33Å; H299-S301 PolarHBondContact O-N 3.47Å
300	K	24.4	Very low	25.8	Very low	204 Å²	204	125 Å²	125	89%	0.887	68%	0.68	S	S	*	*	S	Bend	trans	-73.8	70.6	174	-71	-176.7	177.1	177.5	0	109.9	V298	V298-K300 PolarHBondContact O-N 2.89Å
301	S	24.2	Very low	26.1	Very low	83 Å²	83	118.2 Å²	118.2	58%	0.58	65%	0.647	S	S	*	*			trans	-140.3	32.7	-176.2	60.2	0	0	0	0	112.8	H299	H299-S301 PolarHBondContact O-N 3.47Å
302	N	28.3	Very low	26.5	Very low	147 Å²	147	115.9 Å²	115.9	79%	0.786	64%	0.636	S	S	*	*			trans	-127.5	26.8	160.2	-93.3	11.2	0	0	0	110.7
303	T	25.9	Very low	26.8	Very low	107 Å²	107	114.6 Å²	114.6	66%	0.656	63%	0.628	S	S	*	*	S	Bend	trans	-72.8	135.3	162.1	46.2	0	0	0	0	108.9	P305	T303-P305 VanDerWaalsContact O-N 3.17Å
304	L	28.3	Very low	27.4	Very low	102 Å²	102	109.7 Å²	109.7	53%	0.534	61%	0.605	S	S	.	*			trans	-39.8	122.3	168.6	-172	83.9	0	0	0	109.6	S306 L308 L309	L304-S306 PolarHBondContact O-N 3.12Å; L304-L308 HydrophobicContact CD1-CB 4.21Å; L304-L308 HydrophobicContact CD1-CD1 3.77Å; L304-L308 HydrophobicContact CD2-CB 4.13Å; L304-L308 HydrophobicContact CG-CB 4.02Å; L304-L308 HydrophobicContact CG-CD1 4.35Å; L304-L309 HydrophobicContact CD2-CB 4.33Å; L304-L309 HydrophobicContact CD2-CD1 3.82Å
305	P	28.5	Very low	27.8	Very low	70 Å²	70	106.9 Å²	106.9	46%	0.455	59%	0.585	S	S	.	*			trans	-59.6	134.8	-176.7	23.9	-34.1	0	0	0	109.4	T303 S307 L308	T303-P305 VanDerWaalsContact O-N 3.17Å; P305-S307 PolarHBondContact O-N 3.45Å; P305-L308 HydrophobicContact CG-CD1 3.89Å; P305-L308 HydrophobicContact CG-CG 4.15Å; P305-L308 PolarHBondContact O-N 3.46Å
306	S	29.3	Very low	28.3	Very low	105 Å²	105	104.4 Å²	104.4	73%	0.734	58%	0.575	S	S	*	*	H	α-helix	trans	-57.3	-20.5	-172.1	-32.8	0	0	0	0	113.5	L304 S310	L304-S306 PolarHBondContact O-N 3.12Å; S306-S310 WeakPolarHBondContact O-CB 3.48Å; S306-S310 PolarHBondContact O-N 3.36Å
307	S	32.6	Very low	28.7	Very low	76 Å²	76	100.9 Å²	100.9	53%	0.531	56%	0.557	S	S	.	*	H	α-helix	trans	-68.2	-28.3	173	51.5	0	0	0	0	114.2	P305 S311	P305-S307 PolarHBondContact O-N 3.45Å; S307-S311 PolarHBondContact O-N 3.29Å; S307-S311 PolarHBondContact O-OG 3.49Å
308	L	28.9	Very low	29.2	Very low	53 Å²	53	96 Å²	96	28%	0.277	54%	0.538	S	S	.	.	H	α-helix	trans	-74.3	-40.8	173.4	-80.5	175.5	0	0	0	111.8	L304 P305 S310 S311 H312	L304-L308 HydrophobicContact CD1-CB 4.21Å; L304-L308 HydrophobicContact CD1-CD1 3.77Å; L304-L308 HydrophobicContact CD2-CB 4.13Å; L304-L308 HydrophobicContact CG-CB 4.02Å; L304-L308 HydrophobicContact CG-CD1 4.35Å; P305-L308 HydrophobicContact CG-CD1 3.89Å; P305-L308 HydrophobicContact CG-CG 4.15Å; P305-L308 PolarHBondContact O-N 3.46Å; L308-S310 VanDerWaalsContact C-N 3.3Å; L308-S311 WeakPolarHBondContact CA-OG 3.49Å; L308-S311 PolarHBondContact O-N 3.21Å; L308-S311 PolarHBondContact O-OG 3.04Å; L308-H312 PolarHBondContact O-N 3.13Å
309	L	29.4	Very low	29.5	Very low	114 Å²	114	92.8 Å²	92.8	60%	0.597	52%	0.519	S	S	*	.	H	α-helix	trans	-68.9	-31.4	172.6	-144.2	76	0	0	0	111.6	L304 H312	L304-L309 HydrophobicContact CD2-CB 4.33Å; L304-L309 HydrophobicContact CD2-CD1 3.82Å; L309-H312 WeakPolarHBondContact O-CB 3.25Å; L309-H312 PolarHBondContact O-N 3.08Å
310	S	32.6	Very low	29.7	Very low	69 Å²	69	90.7 Å²	90.7	48%	0.483	51%	0.513	S	S	.	.	H	α-helix	trans	-63.5	-40.1	169.6	-167.1	0	0	0	0	112.1	S306 L308 H312 M313 T314	S306-S310 WeakPolarHBondContact O-CB 3.48Å; S306-S310 PolarHBondContact O-N 3.36Å; L308-S310 VanDerWaalsContact C-N 3.3Å; S310-H312 PolarHBondContact O-N 3.32Å; S310-H312 VanDerWaalsContact O-N 3.13Å; S310-M313 PolarHBondContact O-N 2.71Å; S310-T314 PolarHBondContact O-N 3.38Å; S310-T314 VanDerWaalsContact O-N 3.13Å
311	S	30.3	Very low	30.2	Very low	36 Å²	36	87.7 Å²	87.7	25%	0.252	50%	0.502	S	S	.	.	H	α-helix	trans	-65.8	-13.7	174.9	46.6	0	0	0	0	114.6	S307 L308 M313 T314 L315	S307-S311 PolarHBondContact O-N 3.29Å; S307-S311 PolarHBondContact O-OG 3.49Å; L308-S311 WeakPolarHBondContact CA-OG 3.49Å; L308-S311 PolarHBondContact O-N 3.21Å; L308-S311 PolarHBondContact O-OG 3.04Å; S311-M313 VanDerWaalsContact C-N 3.29Å; S311-T314 VanDerWaalsContact CA-OG1 3.29Å; S311-T314 WeakPolarHBondContact CA-OG1 3.48Å; S311-T314 PolarHBondContact O-N 2.95Å; S311-T314 PolarHBondContact O-OG1 3.01Å; S311-L315 PolarHBondContact O-N 3.39Å
312	H	30.5	Very low	30.6	Very low	120 Å²	120	87 Å²	87	56%	0.556	49%	0.491	S	S	*	.	H	α-helix	trans	-73.5	-20.5	171.6	-151.5	-44.8	0	0	0	112.9	L308 L309 S310	L308-H312 PolarHBondContact O-N 3.13Å; L309-H312 WeakPolarHBondContact O-CB 3.25Å; L309-H312 PolarHBondContact O-N 3.08Å; S310-H312 PolarHBondContact O-N 3.32Å; S310-H312 VanDerWaalsContact O-N 3.13Å
313	M	29.2	Very low	30.8	Very low	117 Å²	117	84.1 Å²	84.1	58%	0.576	48%	0.476	S	S	*	.	H	α-helix	trans	-89.2	-41.8	166.4	-60.1	-74.1	80.3	0	0	110.7	S310 S311 L315 V316 D317	S310-M313 PolarHBondContact O-N 2.71Å; S311-M313 VanDerWaalsContact C-N 3.29Å; M313-L315 PolarHBondContact O-N 3.3Å; M313-L315 VanDerWaalsContact O-N 3.09Å; M313-V316 WeakPolarHBondContact O-CA 3.22Å; M313-V316 WeakPolarHBondContact O-CB 3.18Å; M313-V316 PolarHBondContact O-N 3.5Å; M313-D317 PolarHBondContact O-N 2.73Å
314	T	33.5	Very low	31.2	Very low	58 Å²	58	87.1 Å²	87.1	36%	0.356	48%	0.482	S	S	.	.	H	α-helix	trans	-63.5	-21.4	179.8	72.7	0	0	0	0	113.5	S310 S311 V316 V318	S310-T314 PolarHBondContact O-N 3.38Å; S310-T314 VanDerWaalsContact O-N 3.13Å; S311-T314 VanDerWaalsContact CA-OG1 3.29Å; S311-T314 WeakPolarHBondContact CA-OG1 3.48Å; S311-T314 PolarHBondContact O-N 2.95Å; S311-T314 PolarHBondContact O-OG1 3.01Å; T314-V316 PolarHBondContact O-N 2.94Å; T314-V318 WeakPolarHBondContact O-CB 3.35Å; T314-V318 WeakPolarHBondContact O-CG2 3.24Å; T314-V318 PolarHBondContact O-N 3.21Å
315	L	30.2	Very low	31.3	Very low	61 Å²	61	85.1 Å²	85.1	32%	0.319	47%	0.472	S	S	.	.	H	α-helix	trans	-61.8	-34.1	171.3	-121.4	74	0	0	0	112.2	S311 M313 T319 L356	S311-L315 PolarHBondContact O-N 3.39Å; M313-L315 PolarHBondContact O-N 3.3Å; M313-L315 VanDerWaalsContact O-N 3.09Å; L315-T319 PolarHBondContact O-N 2.92Å; L315-T319 PolarHBondContact O-OG1 3.39Å; L315-L356 HydrophobicContact CD1-CD1 4.09Å
316	V	32.7	Very low	31.3	Very low	85 Å²	85	86.2 Å²	86.2	52%	0.515	48%	0.479	S	S	.	.	H	α-helix	trans	-82	-45.8	176.7	-174.2	0	0	0	0	110.6	M313 T314 V318 T319 D320	M313-V316 WeakPolarHBondContact O-CA 3.22Å; M313-V316 WeakPolarHBondContact O-CB 3.18Å; M313-V316 PolarHBondContact O-N 3.5Å; T314-V316 PolarHBondContact O-N 2.94Å; V316-V318 VanDerWaalsContact C-N 3.3Å; V316-V318 PolarHBondContact O-N 3.26Å; V316-T319 WeakPolarHBondContact CA-OG1 3.32Å; V316-T319 PolarHBondContact O-N 3.01Å; V316-T319 VanDerWaalsContact O-N 3.09Å; V316-T319 PolarHBondContact O-OG1 3.11Å; V316-D320 PolarHBondContact O-N 3.3Å; V316-D320 VanDerWaalsContact O-N 3.11Å
317	D	31.1	Very low	31.3	Very low	79 Å²	79	87.3 Å²	87.3	42%	0.422	48%	0.476	S	S	.	.	H	α-helix	trans	-63.2	-35.9	178.5	-56.5	-48.1	0	0	0	112.2	M313 T319 D320 Q321	M313-D317 PolarHBondContact O-N 2.73Å; D317-T319 VanDerWaalsContact C-N 3.35Å; D317-D320 PolarHBondContact O-N 2.63Å; D317-Q321 WeakPolarHBondContact O-CB 3.33Å; D317-Q321 VanDerWaalsContact O-CG 3.32Å; D317-Q321 WeakPolarHBondContact O-CG 3.41Å; D317-Q321 PolarHBondContact O-N 2.95Å
318	V	32.6	Very low	31.3	Very low	61 Å²	61	87.1 Å²	87.1	37%	0.37	47%	0.468	S	S	.	.	H	α-helix	trans	-72.8	-26.9	176.4	171.7	0	0	0	0	111.4	T314 V316 N322	T314-V318 WeakPolarHBondContact O-CB 3.35Å; T314-V318 WeakPolarHBondContact O-CG2 3.24Å; T314-V318 PolarHBondContact O-N 3.21Å; V316-V318 VanDerWaalsContact C-N 3.3Å; V316-V318 PolarHBondContact O-N 3.26Å; V318-N322 WeakPolarHBondContact CG1-ND2 3.48Å; V318-N322 WeakPolarHBondContact O-CB 3.15Å; V318-N322 PolarHBondContact O-N 3.32Å; V318-N322 VanDerWaalsContact O-N 3.15Å; V318-N322 PolarHBondContact O-ND2 3.24Å
319	T	31.1	Very low	31.3	Very low	49 Å²	49	88.2 Å²	88.2	30%	0.301	47%	0.474	S	S	.	.	H	α-helix	trans	-68.5	-47.4	168.5	37.8	0	0	0	0	111.8	L315 V316 D317 Q321 N322 L323	L315-T319 PolarHBondContact O-N 2.92Å; L315-T319 PolarHBondContact O-OG1 3.39Å; V316-T319 WeakPolarHBondContact CA-OG1 3.32Å; V316-T319 PolarHBondContact O-N 3.01Å; V316-T319 VanDerWaalsContact O-N 3.09Å; V316-T319 PolarHBondContact O-OG1 3.11Å; D317-T319 VanDerWaalsContact C-N 3.35Å; T319-Q321 PolarHBondContact O-N 2.95Å; T319-N322 PolarHBondContact O-N 3.12Å; T319-L323 WeakPolarHBondContact O-CD1 3.06Å; T319-L323 PolarHBondContact O-N 3.42Å
320	D	30.6	Very low	31.3	Very low	108 Å²	108	86 Å²	86	58%	0.578	47%	0.469	S	S	*	.	H	α-helix	trans	-62.3	-45.3	177.5	-96.6	-8.4	0	0	0	112.3	V316 D317 N322 L323 H324	V316-D320 PolarHBondContact O-N 3.3Å; V316-D320 VanDerWaalsContact O-N 3.11Å; D317-D320 PolarHBondContact O-N 2.63Å; D320-N322 VanDerWaalsContact C-N 3.27Å; D320-N322 PolarHBondContact O-N 3.04Å; D320-L323 PolarHBondContact O-N 3.2Å; D320-H324 PolarHBondContact O-N 2.79Å; D320-H324 VanDerWaalsContact O-N 3.07Å
321	Q	33.6	Very low	31.3	Very low	142 Å²	142	86.9 Å²	86.9	66%	0.664	47%	0.467	S	S	*	.	H	α-helix	trans	-64.5	-29.4	177.8	-71.7	-178.6	16.1	0	0	113.1	D317 T319 N325	D317-Q321 WeakPolarHBondContact O-CB 3.33Å; D317-Q321 VanDerWaalsContact O-CG 3.32Å; D317-Q321 WeakPolarHBondContact O-CG 3.41Å; D317-Q321 PolarHBondContact O-N 2.95Å; T319-Q321 PolarHBondContact O-N 2.95Å; Q321-N325 PolarHBondContact O-N 2.8Å
322	N	32.6	Very low	31.3	Very low	67 Å²	67	89.2 Å²	89.2	36%	0.358	48%	0.476	S	S	.	.	H	α-helix	trans	-81.7	-30.7	173	-79	-67.5	0	0	0	113.3	V318 T319 D320 H324 N325 I328	V318-N322 WeakPolarHBondContact CG1-ND2 3.48Å; V318-N322 WeakPolarHBondContact O-CB 3.15Å; V318-N322 PolarHBondContact O-N 3.32Å; V318-N322 VanDerWaalsContact O-N 3.15Å; V318-N322 PolarHBondContact O-ND2 3.24Å; T319-N322 PolarHBondContact O-N 3.12Å; D320-N322 VanDerWaalsContact C-N 3.27Å; D320-N322 PolarHBondContact O-N 3.04Å; N322-H324 PolarHBondContact O-N 3.25Å; N322-N325 WeakPolarHBondContact O-CB 3.34Å; N322-N325 PolarHBondContact O-N 3.46Å; N322-N325 VanDerWaalsContact O-N 3.17Å; N322-I328 HydrophobicContact CB-CD1 4.11Å
323	L	33.2	Very low	31.2	Very low	87 Å²	87	91.7 Å²	91.7	46%	0.455	49%	0.488	S	S	.	.	H	α-helix	trans	-62.9	-31.9	170.3	-96.5	80.6	0	0	0	112	T319 D320 N329	T319-L323 WeakPolarHBondContact O-CD1 3.06Å; T319-L323 PolarHBondContact O-N 3.42Å; D320-L323 PolarHBondContact O-N 3.2Å; L323-N329 PolarHBondContact O-ND2 2.98Å
324	H	33.9	Very low	31.3	Very low	170 Å²	170	89.8 Å²	89.8	79%	0.787	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	2.1	174.4	-82.4	2.4	0	0	0	115.1	D320 N322 P326	D320-H324 PolarHBondContact O-N 2.79Å; D320-H324 VanDerWaalsContact O-N 3.07Å; N322-H324 PolarHBondContact O-N 3.25Å; H324-P326 VanDerWaalsContact O-CD 3.29Å; H324-P326 WeakPolarHBondContact O-CD 3.2Å
325	N	31.8	Very low	31.2	Very low	60 Å²	60	92.8 Å²	92.8	32%	0.321	50%	0.496	S	S	.	.			trans	-84.4	109.8	-179.4	-166.2	-21	0	0	0	111.4	Q321 N322 L327 I328	Q321-N325 PolarHBondContact O-N 2.8Å; N322-N325 WeakPolarHBondContact O-CB 3.34Å; N322-N325 PolarHBondContact O-N 3.46Å; N322-N325 VanDerWaalsContact O-N 3.17Å; N325-L327 PolarHBondContact O-N 3.41Å; N325-L327 VanDerWaalsContact O-N 3.11Å; N325-I328 HydrophobicContact CB-CD1 4.28Å; N325-I328 HydrophobicContact CB-CG1 4.45Å; N325-I328 PolarHBondContact O-N 3.48Å
326	P	28	Very low	31	Very low	94 Å²	94	95.3 Å²	95.3	61%	0.61	52%	0.518	S	S	*	.	H	α-helix	trans	-65.8	-20.5	-170	26.5	-35.3	0	0	0	114	H324 I328 N329 S330	H324-P326 VanDerWaalsContact O-CD 3.29Å; H324-P326 WeakPolarHBondContact O-CD 3.2Å; P326-I328 VanDerWaalsContact C-N 3.25Å; P326-I328 PolarHBondContact O-N 2.96Å; P326-N329 PolarHBondContact O-N 3.27Å; P326-S330 PolarHBondContact O-N 3.03Å; P326-S330 PolarHBondContact O-OG 2.84Å
327	L	28.7	Very low	30.9	Very low	128 Å²	128	101.2 Å²	101.2	67%	0.67	53%	0.531	S	S	*	.	H	α-helix	trans	-70.7	-17.4	175	-77.4	166	0	0	0	113.8	N325 S330 I331	N325-L327 PolarHBondContact O-N 3.41Å; N325-L327 VanDerWaalsContact O-N 3.11Å; L327-S330 PolarHBondContact O-OG 2.95Å; L327-I331 WeakPolarHBondContact O-CD1 3.45Å; L327-I331 WeakPolarHBondContact O-CG1 3.43Å
328	I	32.4	Very low	30.9	Very low	72 Å²	72	106.1 Å²	106.1	37%	0.369	55%	0.552	S	S	.	*	H	α-helix	trans	-84.8	-43.2	172.9	-62.9	179.4	0	0	0	109.5	N322 N325 P326 S330 I331 L332	N322-I328 HydrophobicContact CB-CD1 4.11Å; N325-I328 HydrophobicContact CB-CD1 4.28Å; N325-I328 HydrophobicContact CB-CG1 4.45Å; N325-I328 PolarHBondContact O-N 3.48Å; P326-I328 VanDerWaalsContact C-N 3.25Å; P326-I328 PolarHBondContact O-N 2.96Å; I328-S330 PolarHBondContact O-N 2.74Å; I328-I331 PolarHBondContact O-N 2.77Å; I328-L332 HydrophobicContact CG2-CD1 4.25Å; I328-L332 PolarHBondContact O-N 2.9Å
329	N	29.3	Very low	30.9	Very low	75 Å²	75	108.5 Å²	108.5	40%	0.401	57%	0.567	S	S	.	*	H	α-helix	trans	-68.4	-31.2	178.8	-69	-36.6	0	0	0	113.4	L323 P326 L332 H333	L323-N329 PolarHBondContact O-ND2 2.98Å; P326-N329 PolarHBondContact O-N 3.27Å; N329-L332 PolarHBondContact O-N 2.94Å; N329-H333 PolarHBondContact O-N 2.95Å; N329-H333 VanDerWaalsContact O-N 3.14Å
330	S	30.3	Very low	31.1	Very low	69 Å²	69	110.7 Å²	110.7	48%	0.483	58%	0.577	S	S	.	*	H	α-helix	trans	-68	-33.5	175.1	64.7	0	0	0	0	113.3	P326 L327 I328	P326-S330 PolarHBondContact O-N 3.03Å; P326-S330 PolarHBondContact O-OG 2.84Å; L327-S330 PolarHBondContact O-OG 2.95Å; I328-S330 PolarHBondContact O-N 2.74Å
331	I	32.2	Very low	31.5	Very low	87 Å²	87	110.5 Å²	110.5	45%	0.446	57%	0.569	S	S	.	*	H	α-helix	trans	-70.5	-43.9	174	-64.2	172.8	0	0	0	110	L327 I328 H333 S334	L327-I331 WeakPolarHBondContact O-CD1 3.45Å; L327-I331 WeakPolarHBondContact O-CG1 3.43Å; I328-I331 PolarHBondContact O-N 2.77Å; I331-H333 VanDerWaalsContact C-N 3.29Å; I331-H333 PolarHBondContact O-N 3.49Å; I331-S334 WeakPolarHBondContact O-CB 3.19Å; I331-S334 PolarHBondContact O-N 3.22Å; I331-S334 PolarHBondContact O-OG 3.16Å
332	L	30.4	Very low	31.7	Very low	84 Å²	84	107.7 Å²	107.7	44%	0.44	56%	0.564	S	S	.	*	H	α-helix	trans	-58.5	-37.6	177.9	-76.4	164.9	0	0	0	112.9	I328 N329 S334 Y341	I328-L332 HydrophobicContact CG2-CD1 4.25Å; I328-L332 PolarHBondContact O-N 2.9Å; N329-L332 PolarHBondContact O-N 2.94Å; L332-S334 VanDerWaalsContact C-N 3.26Å; L332-S334 PolarHBondContact O-N 2.77Å; L332-Y341 HydrophobicContact CD2-CE1 4.5Å
333	H	28.9	Very low	31.9	Very low	172 Å²	172	111.3 Å²	111.3	80%	0.796	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-7.9	176.1	-88.4	-69.4	0	0	0	115.2	N329 I331	N329-H333 PolarHBondContact O-N 2.95Å; N329-H333 VanDerWaalsContact O-N 3.14Å; I331-H333 VanDerWaalsContact C-N 3.29Å; I331-H333 PolarHBondContact O-N 3.49Å
334	S	31.2	Very low	32.5	Very low	77 Å²	77	111.9 Å²	111.9	54%	0.538	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.9	-10.4	-174	74	0	0	0	0	115.5	I331 L332	I331-S334 WeakPolarHBondContact O-CB 3.19Å; I331-S334 PolarHBondContact O-N 3.22Å; I331-S334 PolarHBondContact O-OG 3.16Å; L332-S334 VanDerWaalsContact C-N 3.26Å; L332-S334 PolarHBondContact O-N 2.77Å
335	Q	30.5	Very low	33	Very low	121 Å²	121	105.6 Å²	105.6	57%	0.565	55%	0.553	S	S	*	*			trans	-128.5	74.6	-174.7	-63.1	-169.9	7.7	0	0	112.4	R337	Q335-R337 PolarHBondContact O-N 3.11Å; Q335-R337 VanDerWaalsContact O-N 3.13Å
336	S	25.8	Very low	34	Very low	114 Å²	114	106 Å²	106	80%	0.797	56%	0.558	S	S	*	*			trans	-83	74.7	179.4	49.7	0	0	0	0	113.6
337	R	30	Very low	35.2	Very low	209 Å²	209	105 Å²	105	79%	0.789	55%	0.547	S	S	*	.			trans	-133.3	139.1	155.2	-71.9	-168.6	173	-177.3	-1.9	110	Q335 T339	Q335-R337 PolarHBondContact O-N 3.11Å; Q335-R337 VanDerWaalsContact O-N 3.13Å; R337-T339 VanDerWaalsContact C-N 3.3Å; R337-T339 PolarHBondContact O-N 2.92Å
338	E	31.5	Very low	36.7	Very low	182 Å²	182	100.9 Å²	100.9	85%	0.85	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	11.4	-156.7	-61.3	-173.5	96.4	0	0	115.9
339	T	33.8	Very low	37.8	Very low	112 Å²	112	97.7 Å²	97.7	69%	0.687	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-37.8	-170	42.3	0	0	0	0	114.6	R337 Y341	R337-T339 VanDerWaalsContact C-N 3.3Å; R337-T339 PolarHBondContact O-N 2.92Å; T339-Y341 PolarHBondContact O-N 3.07Å
340	D	34.9	Very low	39.4	Very low	94 Å²	94	94.3 Å²	94.3	50%	0.503	50%	0.496	S	S	.	.			trans	-99.4	5.3	-152	-50.9	-15	0	0	0	114.8	C342 E343	D340-C342 PolarHBondContact O-N 3.25Å; D340-E343 PolarHBondContact O-N 2.62Å
341	Y	38.3	Very low	41	Very low	105 Å²	105	92.3 Å²	92.3	41%	0.412	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-14.5	-172.9	-85.1	-92.6	0	0	0	115.8	L332 T339 C345	L332-Y341 HydrophobicContact CD2-CE1 4.5Å; T339-Y341 PolarHBondContact O-N 3.07Å; Y341-C345 PolarHBondContact O-SG 2.86Å
342	C	37.3	Very low	42.5	Very low	83 Å²	83	91.1 Å²	91.1	56%	0.561	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-41.5	-177.2	-153.5	0	0	0	0	112.3	D340 C345 V346	D340-C342 PolarHBondContact O-N 3.25Å; C342-C345 WeakPolarHBondContact O-CB 3.44Å; C342-C345 PolarHBondContact O-N 3.25Å; C342-V346 PolarHBondContact O-N 3.11Å
343	E	38.3	Very low	44.2	Very low	142 Å²	142	87.2 Å²	87.2	66%	0.664	46%	0.46	S	S	*	.	H	α-helix	trans	-63.7	-45.8	178.4	-62.7	-175.6	153.3	0	0	110.4	D340 C345 V346 D347	D340-E343 PolarHBondContact O-N 2.62Å; E343-C345 PolarHBondContact O-N 3.38Å; E343-V346 WeakPolarHBondContact O-CA 3.31Å; E343-V346 PolarHBondContact O-N 3.13Å; E343-D347 PolarHBondContact O-N 3.12Å
344	H	45.3	Very low	46.1	Very low	99 Å²	99	80.2 Å²	80.2	46%	0.458	43%	0.429	S	S	.	.	H	α-helix	trans	-57.7	-24.6	175.5	-92.7	-34.3	0	0	0	114.9	D347 S348	H344-D347 IonicContact ND1-OD2 2.77Å; H344-S348 WeakPolarHBondContact O-CB 3.17Å; H344-S348 PolarHBondContact O-N 2.98Å; H344-S348 VanDerWaalsContact O-N 3.14Å
345	C	45	Very low	47.9	Very low	38 Å²	38	79.8 Å²	79.8	26%	0.257	43%	0.426	S	S	.	.	H	α-helix	trans	-75.3	-37.6	173.2	-69	0	0	0	0	112	R250 Y341 C342 E343 S348 A349	R250-C345 HydrophobicContact CB-CB 4.25Å; R250-C345 HydrophobicContact CG-CB 4.05Å; Y341-C345 PolarHBondContact O-SG 2.86Å; C342-C345 WeakPolarHBondContact O-CB 3.44Å; C342-C345 PolarHBondContact O-N 3.25Å; E343-C345 PolarHBondContact O-N 3.38Å; C345-S348 PolarHBondContact O-N 3.08Å; C345-A349 PolarHBondContact O-N 2.97Å; C345-A349 VanDerWaalsContact O-N 3.15Å
346	V	51.1	Low	49.8	Very low	70 Å²	70	76.5 Å²	76.5	42%	0.424	41%	0.412	S	S	.	.	H	α-helix	trans	-71.3	-42.6	175.6	-178.8	0	0	0	0	110.5	C342 E343 S348 A349 T350	C342-V346 PolarHBondContact O-N 3.11Å; E343-V346 WeakPolarHBondContact O-CA 3.31Å; E343-V346 PolarHBondContact O-N 3.13Å; V346-S348 VanDerWaalsContact C-N 3.26Å; V346-S348 PolarHBondContact O-N 3.14Å; V346-A349 PolarHBondContact O-N 3.48Å; V346-T350 HydrophobicContact CG1-CG2 4.19Å; V346-T350 WeakPolarHBondContact O-CB 3.24Å; V346-T350 WeakPolarHBondContact O-CG2 3.46Å; V346-T350 PolarHBondContact O-N 2.98Å; V346-T350 PolarHBondContact O-OG1 3.47Å
347	D	53.7	Low	52	Low	71 Å²	71	71.2 Å²	71.2	38%	0.38	38%	0.375	S	S	.	.	H	α-helix	trans	-54.6	-42.5	170.9	-72.9	-20.6	0	0	0	111.7	E343 H344 T350 G351	E343-D347 PolarHBondContact O-N 3.12Å; H344-D347 IonicContact ND1-OD2 2.77Å; D347-T350 WeakPolarHBondContact CA-OG1 3.38Å; D347-T350 PolarHBondContact O-OG1 2.94Å; D347-G351 PolarHBondContact O-N 3.22Å
348	S	60.4	Low	54	Low	43 Å²	43	63.9 Å²	63.9	30%	0.301	35%	0.352	S	S	.	.	H	α-helix	trans	-66.4	-40.3	179	178.1	0	0	0	0	112.6	R250 H344 C345 V346 L352	R250-S348 PolarHBondContact NH2-OG 3.23Å; R250-S348 VanDerWaalsContact NH2-OG 3.1Å; H344-S348 WeakPolarHBondContact O-CB 3.17Å; H344-S348 PolarHBondContact O-N 2.98Å; H344-S348 VanDerWaalsContact O-N 3.14Å; C345-S348 PolarHBondContact O-N 3.08Å; V346-S348 VanDerWaalsContact C-N 3.26Å; V346-S348 PolarHBondContact O-N 3.14Å; S348-L352 PolarHBondContact O-N 2.86Å
349	A	56.2	Low	56	Low	4 Å²	4	58 Å²	58	3%	0.033	33%	0.328	C	S	.	.	H	α-helix	trans	-74	-44.4	179.4	0	0	0	0	0	111.7	Y254 I257 C345 V346 L352 A353	Y254-A349 HydrophobicContact CD2-CB 4.03Å; I257-A349 HydrophobicContact CD1-CB 4Å; C345-A349 PolarHBondContact O-N 2.97Å; C345-A349 VanDerWaalsContact O-N 3.15Å; V346-A349 PolarHBondContact O-N 3.48Å; A349-L352 PolarHBondContact O-N 3.19Å; A349-A353 PolarHBondContact O-N 2.95Å
350	T	62.2	Low	57.6	Low	5 Å²	5	53.3 Å²	53.3	3%	0.031	30%	0.3	C	S	.	.	H	α-helix	trans	-68.2	-34.7	177	54.5	0	0	0	0	112.7	I257 V346 D347 L352 A353 V354 C388 I390	I257-T350 HydrophobicContact CD1-CG2 4.16Å; V346-T350 HydrophobicContact CG1-CG2 4.19Å; V346-T350 WeakPolarHBondContact O-CB 3.24Å; V346-T350 WeakPolarHBondContact O-CG2 3.46Å; V346-T350 PolarHBondContact O-N 2.98Å; V346-T350 PolarHBondContact O-OG1 3.47Å; D347-T350 WeakPolarHBondContact CA-OG1 3.38Å; D347-T350 PolarHBondContact O-OG1 2.94Å; T350-L352 VanDerWaalsContact C-N 3.32Å; T350-L352 PolarHBondContact O-N 3.49Å; T350-A353 WeakPolarHBondContact O-CB 3.4Å; T350-A353 PolarHBondContact O-N 3.15Å; T350-V354 WeakPolarHBondContact O-CB 3.42Å; T350-V354 WeakPolarHBondContact O-CG2 3.35Å; T350-V354 PolarHBondContact O-N 3.35Å; T350-C388 HydrophobicContact CG2-CB 4.26Å; T350-I390 HydrophobicContact CG2-CD1 4.03Å
351	G	63.7	Low	59.4	Low	26 Å²	26	50 Å²	50	27%	0.268	28%	0.282	S	S	.	.	H	α-helix	trans	-60.9	-38.9	170.9	0	0	0	0	0	112.9	D347 S355	D347-G351 PolarHBondContact O-N 3.22Å; G351-S355 WeakPolarHBondContact O-CB 3.48Å; G351-S355 PolarHBondContact O-N 3.3Å
352	L	64.5	Low	60.9	Low	62 Å²	62	51.3 Å²	51.3	33%	0.325	29%	0.292	S	S	.	.	H	α-helix	trans	-68.2	-41.3	172.3	-83.8	162.5	0	0	0	112	Y254 S348 A349 T350 V354 S355 L356	Y254-L352 HydrophobicContact CE2-CB 4.18Å; Y254-L352 HydrophobicContact CE2-CD1 3.68Å; S348-L352 PolarHBondContact O-N 2.86Å; A349-L352 PolarHBondContact O-N 3.19Å; T350-L352 VanDerWaalsContact C-N 3.32Å; T350-L352 PolarHBondContact O-N 3.49Å; L352-V354 PolarHBondContact O-N 2.83Å; L352-S355 PolarHBondContact O-N 3.24Å; L352-L356 WeakPolarHBondContact O-CB 3.34Å; L352-L356 PolarHBondContact O-N 2.84Å
353	A	65.9	Low	62.3	Low	3 Å²	3	52 Å²	52	3%	0.025	29%	0.285	C	S	.	.	H	α-helix	trans	-58	-47.4	173.8	0	0	0	0	0	112.6	I257 L261 A349 T350 S355 L356 I357	I257-A353 HydrophobicContact CG2-CB 3.85Å; L261-A353 HydrophobicContact CD1-CB 3.66Å; A349-A353 PolarHBondContact O-N 2.95Å; T350-A353 WeakPolarHBondContact O-CB 3.4Å; T350-A353 PolarHBondContact O-N 3.15Å; A353-S355 VanDerWaalsContact C-N 3.35Å; A353-S355 PolarHBondContact O-N 3.5Å; A353-L356 PolarHBondContact O-N 3.25Å; A353-I357 PolarHBondContact O-N 3.35Å
354	V	69.6	Low	63.5	Low	25 Å²	25	45.4 Å²	45.4	15%	0.152	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-42.2	175.8	165.8	0	0	0	0	111.1	T350 L352 N358 W392	T350-V354 WeakPolarHBondContact O-CB 3.42Å; T350-V354 WeakPolarHBondContact O-CG2 3.35Å; T350-V354 PolarHBondContact O-N 3.35Å; L352-V354 PolarHBondContact O-N 2.83Å; V354-N358 VanDerWaalsContact O-CB 3.3Å; V354-N358 WeakPolarHBondContact O-CB 3.41Å; V354-N358 VanDerWaalsContact O-CG 3.25Å; V354-N358 PolarHBondContact O-N 3Å; V354-N358 PolarHBondContact O-ND2 3.17Å; V354-W392 HydrophobicContact CG1-CH2 3.64Å; V354-W392 HydrophobicContact CG1-CZ2 3.66Å; V354-W392 HydrophobicContact CG2-CZ2 4.15Å
355	S	68.4	Low	64.4	Low	67 Å²	67	43 Å²	43	47%	0.469	25%	0.252	S	S	.	.	H	α-helix	trans	-63.4	-43	175.9	-170.2	0	0	0	0	112.4	G351 L352 A353 N358 T359	G351-S355 WeakPolarHBondContact O-CB 3.48Å; G351-S355 PolarHBondContact O-N 3.3Å; L352-S355 PolarHBondContact O-N 3.24Å; A353-S355 VanDerWaalsContact C-N 3.35Å; A353-S355 PolarHBondContact O-N 3.5Å; S355-N358 PolarHBondContact O-N 3.31Å; S355-T359 WeakPolarHBondContact O-CB 3.38Å; S355-T359 PolarHBondContact O-N 2.84Å; S355-T359 PolarHBondContact O-OG1 2.88Å
356	L	70.4	Confident	65.2	Low	52 Å²	52	48.9 Å²	48.9	27%	0.272	28%	0.276	S	S	.	.	H	α-helix	trans	-62.1	-47.5	177.6	-165.5	80.5	0	0	0	111.4	L261 I265 L315 L352 A353 T359 C360	L261-L356 HydrophobicContact CB-CD2 4.46Å; L261-L356 HydrophobicContact CD1-CD2 4.14Å; I265-L356 HydrophobicContact CD1-CD2 3.99Å; L315-L356 HydrophobicContact CD1-CD1 4.09Å; L352-L356 WeakPolarHBondContact O-CB 3.34Å; L352-L356 PolarHBondContact O-N 2.84Å; A353-L356 PolarHBondContact O-N 3.25Å; L356-T359 WeakPolarHBondContact O-CB 3.37Å; L356-T359 PolarHBondContact O-N 2.76Å; L356-C360 PolarHBondContact O-N 2.89Å; L356-C360 PolarHBondContact O-SG 3.33Å
357	I	70.7	Confident	65.7	Low	3 Å²	3	49 Å²	49	2%	0.015	27%	0.274	C	S	.	.	H	α-helix	trans	-66.2	-45.2	178.3	-74.3	176.4	0	0	0	111.4	L261 A353 T359 C360 I361 L380 Q381 L384	L261-I357 HydrophobicContact CD2-CD1 3.6Å; L261-I357 HydrophobicContact CD2-CG1 3.94Å; A353-I357 PolarHBondContact O-N 3.35Å; I357-T359 PolarHBondContact O-N 3.38Å; I357-C360 CarbonylContact O-C 3.59Å; I357-C360 PolarHBondContact O-N 3.15Å; I357-I361 HydrophobicContact CG2-CD1 3.64Å; I357-I361 HydrophobicContact CG2-CG1 4.2Å; I357-I361 WeakPolarHBondContact O-CB 3.43Å; I357-I361 WeakPolarHBondContact O-CG1 3.5Å; I357-I361 PolarHBondContact O-N 2.87Å; I357-L380 HydrophobicContact CD1-CB 4.35Å; I357-L380 HydrophobicContact CD1-CD2 3.84Å; I357-L380 HydrophobicContact CD1-CG 3.73Å; I357-L380 HydrophobicContact CG1-CD2 4.27Å; I357-Q381 HydrophobicContact CG2-CB 3.87Å; I357-Q381 HydrophobicContact CG2-CG 4.39Å; I357-L384 HydrophobicContact CD1-CD1 3.28Å
358	N	73	Confident	65.8	Low	56 Å²	56	54.6 Å²	54.6	30%	0.299	30%	0.298	S	S	.	.	H	α-helix	trans	-57.6	-37.6	174.9	-77.6	-27.7	0	0	0	111.7	V354 S355 Q362 Q381	V354-N358 VanDerWaalsContact O-CB 3.3Å; V354-N358 WeakPolarHBondContact O-CB 3.41Å; V354-N358 VanDerWaalsContact O-CG 3.25Å; V354-N358 PolarHBondContact O-N 3Å; V354-N358 PolarHBondContact O-ND2 3.17Å; S355-N358 PolarHBondContact O-N 3.31Å; N358-Q362 WeakPolarHBondContact O-CB 2.99Å; N358-Q362 WeakPolarHBondContact O-CG 3.38Å; N358-Q362 PolarHBondContact O-N 3.46Å; N358-Q381 PolarHBondContact OD1-NE2 3.05Å
359	T	72.9	Confident	65.5	Low	57 Å²	57	61.9 Å²	61.9	35%	0.35	32%	0.324	S	S	.	.	H	α-helix	trans	-67.4	-38.1	174.5	-57.2	0	0	0	0	112.2	S355 L356 I357 Q362 K363	S355-T359 WeakPolarHBondContact O-CB 3.38Å; S355-T359 PolarHBondContact O-N 2.84Å; S355-T359 PolarHBondContact O-OG1 2.88Å; L356-T359 WeakPolarHBondContact O-CB 3.37Å; L356-T359 PolarHBondContact O-N 2.76Å; I357-T359 PolarHBondContact O-N 3.38Å; T359-Q362 PolarHBondContact O-N 3.32Å; T359-K363 HydrophobicContact CG2-CD 4.44Å; T359-K363 WeakPolarHBondContact O-CG 3.4Å; T359-K363 PolarHBondContact O-N 2.98Å
360	C	68.6	Low	66	Low	15 Å²	15	62.8 Å²	62.8	10%	0.101	33%	0.328	C	S	.	.	H	α-helix	trans	-70.4	-41	176.1	-64.3	0	0	0	0	112.4	L356 I357 K363 T364 F377	L356-C360 PolarHBondContact O-N 2.89Å; L356-C360 PolarHBondContact O-SG 3.33Å; I357-C360 CarbonylContact O-C 3.59Å; I357-C360 PolarHBondContact O-N 3.15Å; C360-K363 PolarHBondContact O-N 3.5Å; C360-T364 WeakPolarHBondContact O-CB 3.14Å; C360-T364 WeakPolarHBondContact O-CG2 3.37Å; C360-T364 PolarHBondContact O-N 3.17Å; C360-T364 PolarHBondContact O-OG1 2.76Å; C360-F377 HydrophobicContact CB-CD1 3.69Å; C360-F377 HydrophobicContact CB-CE1 3.29Å; C360-F377 HydrophobicContact CB-CE2 4.23Å; C360-F377 HydrophobicContact CB-CG 4.33Å; C360-F377 HydrophobicContact CB-CZ 3.61Å
361	I	72.7	Confident	66.1	Low	25 Å²	25	69.1 Å²	69.1	13%	0.128	36%	0.357	C	S	.	.	H	α-helix	trans	-57.3	-49.8	170.5	-70.1	168.8	0	0	0	109.7	I357 K363 T364 A365 L374 F377 L378 Q381	I357-I361 HydrophobicContact CG2-CD1 3.64Å; I357-I361 HydrophobicContact CG2-CG1 4.2Å; I357-I361 WeakPolarHBondContact O-CB 3.43Å; I357-I361 WeakPolarHBondContact O-CG1 3.5Å; I357-I361 PolarHBondContact O-N 2.87Å; I361-K363 PolarHBondContact O-N 3.2Å; I361-T364 PolarHBondContact O-N 2.99Å; I361-T364 PolarHBondContact O-OG1 3.39Å; I361-A365 WeakPolarHBondContact O-CB 3.47Å; I361-A365 PolarHBondContact O-N 2.89Å; I361-L374 HydrophobicContact CB-CD1 4.44Å; I361-L374 HydrophobicContact CG2-CD1 3.91Å; I361-F377 HydrophobicContact CG1-CB 3.75Å; I361-L378 HydrophobicContact CD1-CD2 4.03Å; I361-L378 HydrophobicContact CG2-CD2 4.45Å; I361-Q381 HydrophobicContact CD1-CB 4.27Å
362	Q	69	Low	66.2	Low	132 Å²	132	71.5 Å²	71.5	62%	0.617	37%	0.366	S	S	*	.	H	α-helix	trans	-60.9	-40.3	177.8	-79.3	-174.5	-5.3	0	0	113.3	N358 T359 Q366	N358-Q362 WeakPolarHBondContact O-CB 2.99Å; N358-Q362 WeakPolarHBondContact O-CG 3.38Å; N358-Q362 PolarHBondContact O-N 3.46Å; T359-Q362 PolarHBondContact O-N 3.32Å; Q362-Q366 WeakPolarHBondContact O-CG 3.45Å
363	K	65.8	Low	66.2	Low	98 Å²	98	69 Å²	69	43%	0.426	35%	0.353	S	S	.	.	H	α-helix	trans	-69.5	-40.9	177.9	-76.6	176.5	178.2	175.6	0	112.7	T359 C360 I361 Q366	T359-K363 HydrophobicContact CG2-CD 4.44Å; T359-K363 WeakPolarHBondContact O-CG 3.4Å; T359-K363 PolarHBondContact O-N 2.98Å; C360-K363 PolarHBondContact O-N 3.5Å; I361-K363 PolarHBondContact O-N 3.2Å; K363-Q366 PolarHBondContact O-N 2.85Å
364	T	64.7	Low	66.5	Low	2 Å²	2	70.4 Å²	70.4	1%	0.012	36%	0.36	C	S	.	.	H	α-helix	trans	-76.3	-31.8	-179.9	50.6	0	0	0	0	112.2	Y269 C360 I361 Q366 N367 I373 F377	Y269-T364 WeakPolarHBondContact OH-CG2 3.49Å; C360-T364 WeakPolarHBondContact O-CB 3.14Å; C360-T364 WeakPolarHBondContact O-CG2 3.37Å; C360-T364 PolarHBondContact O-N 3.17Å; C360-T364 PolarHBondContact O-OG1 2.76Å; I361-T364 PolarHBondContact O-N 2.99Å; I361-T364 PolarHBondContact O-OG1 3.39Å; T364-Q366 PolarHBondContact O-N 2.83Å; T364-N367 PolarHBondContact O-N 3.01Å; T364-N367 VanDerWaalsContact O-N 3.07Å; T364-I373 HydrophobicContact CG2-CG2 3.56Å; T364-F377 HydrophobicContact CG2-CD2 4Å; T364-F377 HydrophobicContact CG2-CE2 3.88Å
365	A	64.5	Low	66.7	Low	50 Å²	50	73.7 Å²	73.7	41%	0.413	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-11.7	171.3	0	0	0	0	0	114.5	I361 N367 L374	I361-A365 WeakPolarHBondContact O-CB 3.47Å; I361-A365 PolarHBondContact O-N 2.89Å; A365-N367 VanDerWaalsContact C-N 3.32Å; A365-L374 HydrophobicContact CB-CD1 3.98Å; A365-L374 HydrophobicContact CB-CD2 4.07Å
366	Q	60.8	Low	66.9	Low	160 Å²	160	72.8 Å²	72.8	75%	0.748	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-5.6	171.7	-71.2	169.4	15.2	0	0	113.2	Q362 K363 T364	Q362-Q366 WeakPolarHBondContact O-CG 3.45Å; K363-Q366 PolarHBondContact O-N 2.85Å; T364-Q366 PolarHBondContact O-N 2.83Å
367	N	61.2	Low	67	Low	74 Å²	74	70.3 Å²	70.3	40%	0.396	35%	0.347	S	S	.	.			trans	-124.1	90.3	-172.5	-164	9.3	0	0	0	110.6	T364 A365 K369 Q370	T364-N367 PolarHBondContact O-N 3.01Å; T364-N367 VanDerWaalsContact O-N 3.07Å; A365-N367 VanDerWaalsContact C-N 3.32Å; N367-K369 PolarHBondContact O-N 3.43Å; N367-Q370 HydrophobicContact CB-CG 4.37Å; N367-Q370 PolarHBondContact ND2-OE1 2.86Å; N367-Q370 WeakPolarHBondContact O-CB 3.35Å; N367-Q370 PolarHBondContact O-N 2.9Å
368	E	56.4	Low	67.2	Low	187 Å²	187	73.8 Å²	73.8	87%	0.874	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-55	-19.4	-169.5	-62.8	-176.1	145.5	0	0	115.3	Q370	E368-Q370 VanDerWaalsContact C-N 3.28Å; E368-Q370 PolarHBondContact O-N 2.95Å
369	K	55.1	Low	67.2	Low	196 Å²	196	76.5 Å²	76.5	85%	0.852	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-79.2	-5.9	177.1	-63.4	-175.3	179.1	-178.6	0	114.1	N367	N367-K369 PolarHBondContact O-N 3.43Å
370	Q	65.7	Low	67.2	Low	23 Å²	23	74 Å²	74	11%	0.107	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-110.1	30.2	-170.7	-65.8	-169.9	-45.6	0	0	113.8	E272 N367 E368 V372 I373 L374	E272-Q370 VanDerWaalsContact CD-NE2 3.3Å; E272-Q370 WeakPolarHBondContact OE1-CG 3.27Å; E272-Q370 PolarHBondContact OE1-NE2 2.77Å; E272-Q370 PolarHBondContact OE2-NE2 2.6Å; N367-Q370 HydrophobicContact CB-CG 4.37Å; N367-Q370 PolarHBondContact ND2-OE1 2.86Å; N367-Q370 WeakPolarHBondContact O-CB 3.35Å; N367-Q370 PolarHBondContact O-N 2.9Å; E368-Q370 VanDerWaalsContact C-N 3.28Å; E368-Q370 PolarHBondContact O-N 2.95Å; Q370-V372 VanDerWaalsContact C-N 3.25Å; Q370-V372 PolarHBondContact O-N 3.35Å; Q370-I373 HydrophobicContact CB-CB 4.19Å; Q370-I373 HydrophobicContact CB-CD1 4.24Å; Q370-I373 HydrophobicContact CG-CD1 4.07Å; Q370-I373 PolarHBondContact O-N 3.21Å; Q370-I373 VanDerWaalsContact O-N 3.1Å; Q370-L374 PolarHBondContact O-N 3.42Å
371	E	64.6	Low	67.5	Low	139 Å²	139	75.5 Å²	75.5	65%	0.65	36%	0.364	S	S	*	.	H	α-helix	trans	-49.9	-41.9	176.9	-88.1	-162.4	136.2	0	0	113	L374 F375	E371-L374 PolarHBondContact O-N 3.48Å; E371-F375 WeakPolarHBondContact O-CB 3.32Å; E371-F375 PolarHBondContact O-N 2.77Å
372	V	65.4	Low	67.3	Low	75 Å²	75	79.6 Å²	79.6	46%	0.455	38%	0.383	S	S	.	.	H	α-helix	trans	-64.1	-42.6	-179.2	177.2	0	0	0	0	111.4	Q370 F375 K376	Q370-V372 VanDerWaalsContact C-N 3.25Å; Q370-V372 PolarHBondContact O-N 3.35Å; V372-F375 PolarHBondContact O-N 2.76Å; V372-K376 PolarHBondContact O-N 3.15Å; V372-K376 VanDerWaalsContact O-N 3.08Å
373	I	65.2	Low	67.1	Low	9 Å²	9	76.6 Å²	76.6	5%	0.046	37%	0.371	C	S	.	.	H	α-helix	trans	-67.5	-46.5	178	-75.1	165.8	0	0	0	110.3	I268 Y269 E272 T364 Q370 F375 K376 F377	I268-I373 HydrophobicContact CG2-CB 4.26Å; I268-I373 HydrophobicContact CG2-CG1 4.26Å; I268-I373 HydrophobicContact CG2-CG2 3.71Å; Y269-I373 HydrophobicContact CD1-CD1 4.39Å; Y269-I373 HydrophobicContact CE1-CG2 4.45Å; E272-I373 HydrophobicContact CB-CD1 4.12Å; E272-I373 VanDerWaalsContact CD-CD1 3.5Å; E272-I373 HydrophobicContact CG-CD1 4.11Å; T364-I373 HydrophobicContact CG2-CG2 3.56Å; Q370-I373 HydrophobicContact CB-CB 4.19Å; Q370-I373 HydrophobicContact CB-CD1 4.24Å; Q370-I373 HydrophobicContact CG-CD1 4.07Å; Q370-I373 PolarHBondContact O-N 3.21Å; Q370-I373 VanDerWaalsContact O-N 3.1Å; I373-F375 VanDerWaalsContact C-N 3.3Å; I373-F375 PolarHBondContact O-N 3.37Å; I373-K376 PolarHBondContact O-N 2.9Å; I373-F377 HydrophobicContact CG2-CD2 3.85Å; I373-F377 HydrophobicContact CG2-CE2 3.86Å; I373-F377 WeakPolarHBondContact O-CD2 3.34Å; I373-F377 PolarHBondContact O-N 3.5Å
374	L	72.8	Confident	66.9	Low	34 Å²	34	72.7 Å²	72.7	18%	0.178	36%	0.355	C	S	.	.	H	α-helix	trans	-59.4	-41.4	176.2	-179.6	63.2	0	0	0	111.5	I361 A365 Q370 E371 F377 L378	I361-L374 HydrophobicContact CB-CD1 4.44Å; I361-L374 HydrophobicContact CG2-CD1 3.91Å; A365-L374 HydrophobicContact CB-CD1 3.98Å; A365-L374 HydrophobicContact CB-CD2 4.07Å; Q370-L374 PolarHBondContact O-N 3.42Å; E371-L374 PolarHBondContact O-N 3.48Å; L374-F377 PolarHBondContact O-N 3.23Å; L374-L378 HydrophobicContact CG-CD1 4.28Å; L374-L378 WeakPolarHBondContact O-CG 3.07Å; L374-L378 PolarHBondContact O-N 3Å
375	F	72.3	Confident	66.7	Low	94 Å²	94	76.8 Å²	76.8	41%	0.412	38%	0.376	S	S	.	.	H	α-helix	trans	-64	-41.1	175.7	-178.4	-102.9	0	0	0	112.6	E371 V372 I373 L378 K379 F414	E371-F375 WeakPolarHBondContact O-CB 3.32Å; E371-F375 PolarHBondContact O-N 2.77Å; V372-F375 PolarHBondContact O-N 2.76Å; I373-F375 VanDerWaalsContact C-N 3.3Å; I373-F375 PolarHBondContact O-N 3.37Å; F375-L378 PolarHBondContact O-N 3.01Å; F375-K379 HydrophobicContact CE1-CD 4.29Å; F375-K379 HydrophobicContact CE1-CG 4.13Å; F375-K379 HydrophobicContact CZ-CD 4.34Å; F375-K379 HydrophobicContact CZ-CG 4.08Å; F375-K379 PolarHBondContact O-N 2.95Å; F375-F414 AromaticContact CE2-CE2 3.79Å; F375-F414 HydrophobicContact CE2-CE2 3.79Å; F375-F414 AromaticContact CE2-CZ 3.61Å; F375-F414 HydrophobicContact CE2-CZ 3.61Å; F375-F414 HydrophobicContact CZ-CE2 4.37Å; F375-F414 AromaticContact CZ-CZ 3.73Å; F375-F414 HydrophobicContact CZ-CZ 3.73Å
376	K	72.3	Confident	66.3	Low	47 Å²	47	79.3 Å²	79.3	20%	0.204	39%	0.386	C	S	.	.	H	α-helix	trans	-62.4	-41.7	172.5	-70.7	-169.8	177.5	-169.3	0	112	E267 I268 M271 V372 I373 L378 K379 L380	E267-K376 PolarHBondContact O-NZ 3.04Å; I268-K376 HydrophobicContact CB-CD 4.22Å; I268-K376 HydrophobicContact CD1-CB 4.04Å; I268-K376 HydrophobicContact CG1-CB 3.7Å; I268-K376 HydrophobicContact CG1-CD 3.65Å; I268-K376 HydrophobicContact CG1-CG 4.38Å; I268-K376 HydrophobicContact CG2-CB 4.41Å; I268-K376 HydrophobicContact CG2-CD 4.35Å; M271-K376 VanDerWaalsContact SD-CE 3.53Å; M271-K376 PolarHBondContact SD-NZ 3.41Å; V372-K376 PolarHBondContact O-N 3.15Å; V372-K376 VanDerWaalsContact O-N 3.08Å; I373-K376 PolarHBondContact O-N 2.9Å; K376-L378 VanDerWaalsContact C-N 3.35Å; K376-L378 PolarHBondContact O-N 3.34Å; K376-K379 CarbonylContact O-C 3.55Å; K376-K379 WeakPolarHBondContact O-CB 3.46Å; K376-K379 PolarHBondContact O-N 3.3Å; K376-K379 VanDerWaalsContact O-N 3.16Å; K376-L380 PolarHBondContact O-N 3.08Å
377	F	73.6	Confident	65.7	Low	0 Å²	0	75.8 Å²	75.8	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-62	-40.2	176.8	-90.3	-65.5	0	0	0	112.9	I265 I268 Y269 C360 I361 T364 I373 L374 K379 L380 Q381	I265-F377 HydrophobicContact CG1-CE1 3.83Å; I265-F377 HydrophobicContact CG1-CZ 4.13Å; I268-F377 HydrophobicContact CB-CE2 4.45Å; I268-F377 HydrophobicContact CD1-CD1 3.97Å; I268-F377 HydrophobicContact CD1-CD2 4.32Å; I268-F377 HydrophobicContact CD1-CE1 3.97Å; I268-F377 HydrophobicContact CD1-CE2 4.31Å; I268-F377 HydrophobicContact CD1-CG 4.13Å; I268-F377 HydrophobicContact CD1-CZ 4.12Å; I268-F377 HydrophobicContact CG2-CD2 3.91Å; I268-F377 HydrophobicContact CG2-CE2 3.54Å; I268-F377 HydrophobicContact CG2-CZ 4.11Å; Y269-F377 HydrophobicContact CE2-CE2 4.12Å; Y269-F377 HydrophobicContact CE2-CZ 4.05Å; C360-F377 HydrophobicContact CB-CD1 3.69Å; C360-F377 HydrophobicContact CB-CE1 3.29Å; C360-F377 HydrophobicContact CB-CE2 4.23Å; C360-F377 HydrophobicContact CB-CG 4.33Å; C360-F377 HydrophobicContact CB-CZ 3.61Å; I361-F377 HydrophobicContact CG1-CB 3.75Å; T364-F377 HydrophobicContact CG2-CD2 4Å; T364-F377 HydrophobicContact CG2-CE2 3.88Å; I373-F377 HydrophobicContact CG2-CD2 3.85Å; I373-F377 HydrophobicContact CG2-CE2 3.86Å; I373-F377 WeakPolarHBondContact O-CD2 3.34Å; I373-F377 PolarHBondContact O-N 3.5Å; L374-F377 PolarHBondContact O-N 3.23Å; F377-K379 VanDerWaalsContact C-N 3.34Å; F377-L380 PolarHBondContact O-N 3.34Å; F377-Q381 PolarHBondContact O-N 3.47Å
378	L	74.3	Confident	65.2	Low	76 Å²	76	74.1 Å²	74.1	40%	0.398	37%	0.37	S	S	.	.	H	α-helix	trans	-64.2	-37.7	173	-71.7	163.3	0	0	0	111.9	I361 L374 F375 K376 Q381 E382	I361-L378 HydrophobicContact CD1-CD2 4.03Å; I361-L378 HydrophobicContact CG2-CD2 4.45Å; L374-L378 HydrophobicContact CG-CD1 4.28Å; L374-L378 WeakPolarHBondContact O-CG 3.07Å; L374-L378 PolarHBondContact O-N 3Å; F375-L378 PolarHBondContact O-N 3.01Å; K376-L378 VanDerWaalsContact C-N 3.35Å; K376-L378 PolarHBondContact O-N 3.34Å; L378-Q381 WeakPolarHBondContact O-CB 3.29Å; L378-Q381 PolarHBondContact O-N 2.98Å; L378-E382 PolarHBondContact O-N 3.04Å
379	K	72.7	Confident	64.5	Low	114 Å²	114	71.8 Å²	71.8	50%	0.496	36%	0.363	S	S	.	.	H	α-helix	trans	-66.7	-33.5	171.4	-83.4	-133.8	160.5	-157.4	0	113.9	F375 K376 F377 Q381 E382 L383	F375-K379 HydrophobicContact CE1-CD 4.29Å; F375-K379 HydrophobicContact CE1-CG 4.13Å; F375-K379 HydrophobicContact CZ-CD 4.34Å; F375-K379 HydrophobicContact CZ-CG 4.08Å; F375-K379 PolarHBondContact O-N 2.95Å; K376-K379 CarbonylContact O-C 3.55Å; K376-K379 WeakPolarHBondContact O-CB 3.46Å; K376-K379 PolarHBondContact O-N 3.3Å; K376-K379 VanDerWaalsContact O-N 3.16Å; F377-K379 VanDerWaalsContact C-N 3.34Å; K379-Q381 VanDerWaalsContact C-N 3.34Å; K379-E382 PolarHBondContact O-N 3.26Å; K379-L383 WeakPolarHBondContact O-CB 3.43Å; K379-L383 PolarHBondContact O-N 3.21Å
380	L	73.1	Confident	64	Low	5 Å²	5	64.1 Å²	64.1	3%	0.026	33%	0.331	C	S	.	.	H	α-helix	trans	-68.6	-36	174.6	-169	63.8	0	0	0	111.1	F260 Q264 I268 I357 K376 F377 L384	F260-L380 HydrophobicContact CE1-CD1 4.12Å; F260-L380 HydrophobicContact CZ-CD1 4.19Å; Q264-L380 HydrophobicContact CB-CD1 3.72Å; Q264-L380 HydrophobicContact CB-CD2 3.86Å; Q264-L380 HydrophobicContact CB-CG 4.47Å; Q264-L380 HydrophobicContact CG-CD1 3.82Å; I268-L380 HydrophobicContact CD1-CD2 4.23Å; I357-L380 HydrophobicContact CD1-CB 4.35Å; I357-L380 HydrophobicContact CD1-CD2 3.84Å; I357-L380 HydrophobicContact CD1-CG 3.73Å; I357-L380 HydrophobicContact CG1-CD2 4.27Å; K376-L380 PolarHBondContact O-N 3.08Å; F377-L380 PolarHBondContact O-N 3.34Å; L380-L384 PolarHBondContact O-N 3.14Å; L380-L384 VanDerWaalsContact O-N 3.12Å
381	Q	75.1	Confident	62.6	Low	45 Å²	45	68.7 Å²	68.7	21%	0.21	36%	0.356	C	S	.	.	H	α-helix	trans	-63.8	-47.1	170.6	-171.2	173.7	26.5	0	0	112.3	I357 N358 I361 F377 L378 K379 L383 L384 L385	I357-Q381 HydrophobicContact CG2-CB 3.87Å; I357-Q381 HydrophobicContact CG2-CG 4.39Å; N358-Q381 PolarHBondContact OD1-NE2 3.05Å; I361-Q381 HydrophobicContact CD1-CB 4.27Å; F377-Q381 PolarHBondContact O-N 3.47Å; L378-Q381 WeakPolarHBondContact O-CB 3.29Å; L378-Q381 PolarHBondContact O-N 2.98Å; K379-Q381 VanDerWaalsContact C-N 3.34Å; Q381-L383 VanDerWaalsContact C-N 3.34Å; Q381-L383 PolarHBondContact O-N 2.74Å; Q381-L384 PolarHBondContact O-N 3.1Å; Q381-L385 HydrophobicContact CG-CD1 4.33Å; Q381-L385 WeakPolarHBondContact O-CD1 3.17Å; Q381-L385 PolarHBondContact O-N 3.22Å
382	E	68.5	Low	61.2	Low	112 Å²	112	65.3 Å²	65.3	52%	0.523	34%	0.338	S	S	.	.	H	α-helix	trans	-57	-47.2	175	-178.9	-177.1	-148.7	0	0	111.1	L378 K379 L384 L385 T386	L378-E382 PolarHBondContact O-N 3.04Å; K379-E382 PolarHBondContact O-N 3.26Å; E382-L384 PolarHBondContact O-N 3.21Å; E382-L385 WeakPolarHBondContact O-CB 3.4Å; E382-L385 PolarHBondContact O-N 2.95Å; E382-T386 WeakPolarHBondContact O-CG2 3.44Å; E382-T386 PolarHBondContact O-N 3.2Å; E382-T386 VanDerWaalsContact O-N 3.12Å
383	L	64.8	Low	59.6	Low	68 Å²	68	66.8 Å²	66.8	36%	0.356	35%	0.347	S	S	.	.	H	α-helix	trans	-58.4	-48.3	178.8	-176.6	61.2	0	0	0	111.6	F260 K379 Q381 L385 T386 T387	F260-L383 HydrophobicContact CZ-CD2 3.96Å; K379-L383 WeakPolarHBondContact O-CB 3.43Å; K379-L383 PolarHBondContact O-N 3.21Å; Q381-L383 VanDerWaalsContact C-N 3.34Å; Q381-L383 PolarHBondContact O-N 2.74Å; L383-L385 VanDerWaalsContact C-N 3.33Å; L383-L385 PolarHBondContact O-N 3.04Å; L383-T386 CarbonylContact O-C 3.6Å; L383-T386 WeakPolarHBondContact O-CA 3.47Å; L383-T386 PolarHBondContact O-N 3.5Å; L383-T386 PolarHBondContact O-OG1 2.94Å; L383-T387 HydrophobicContact CD1-CG2 4.15Å; L383-T387 HydrophobicContact CG-CG2 4.43Å; L383-T387 WeakPolarHBondContact O-CG2 3.2Å; L383-T387 PolarHBondContact O-N 3.16Å; L383-T387 PolarHBondContact O-OG1 3.29Å
384	L	62.4	Low	58	Low	17 Å²	17	75.5 Å²	75.5	9%	0.089	38%	0.379	C	S	.	.	H	α-helix	trans	-65.8	-31	178.6	-84.7	155.9	0	0	0	113.8	L261 I357 L380 Q381 E382 T386 T387	L261-L384 HydrophobicContact CD2-CD1 3.82Å; I357-L384 HydrophobicContact CD1-CD1 3.28Å; L380-L384 PolarHBondContact O-N 3.14Å; L380-L384 VanDerWaalsContact O-N 3.12Å; Q381-L384 PolarHBondContact O-N 3.1Å; E382-L384 PolarHBondContact O-N 3.21Å; L384-T386 VanDerWaalsContact C-N 3.31Å; L384-T387 WeakPolarHBondContact CA-OG1 3.38Å
385	L	59.9	Low	56.1	Low	87 Å²	87	77.6 Å²	77.6	46%	0.455	39%	0.39	S	S	.	.	H	α-helix	trans	-60.8	-40.9	167.4	-102.4	80.4	0	0	0	111.5	Q381 E382 L383 W392	Q381-L385 HydrophobicContact CG-CD1 4.33Å; Q381-L385 WeakPolarHBondContact O-CD1 3.17Å; Q381-L385 PolarHBondContact O-N 3.22Å; E382-L385 WeakPolarHBondContact O-CB 3.4Å; E382-L385 PolarHBondContact O-N 2.95Å; L383-L385 VanDerWaalsContact C-N 3.33Å; L383-L385 PolarHBondContact O-N 3.04Å; L385-W392 HydrophobicContact CD1-CZ2 4.44Å
386	T	56	Low	54.1	Low	103 Å²	103	76.4 Å²	76.4	63%	0.632	39%	0.388	S	S	*	.	H	α-helix	trans	-79.9	-16.9	-177.8	65.1	0	0	0	0	115.3	E382 L383 L384	E382-T386 WeakPolarHBondContact O-CG2 3.44Å; E382-T386 PolarHBondContact O-N 3.2Å; E382-T386 VanDerWaalsContact O-N 3.12Å; L383-T386 CarbonylContact O-C 3.6Å; L383-T386 WeakPolarHBondContact O-CA 3.47Å; L383-T386 PolarHBondContact O-N 3.5Å; L383-T386 PolarHBondContact O-OG1 2.94Å; L384-T386 VanDerWaalsContact C-N 3.31Å
387	T	48.6	Very low	52.2	Low	86 Å²	86	82.2 Å²	82.2	53%	0.528	42%	0.416	S	S	.	.	H	α-helix	trans	-99.5	-14.7	-175.6	52.3	0	0	0	0	115.1	L383 L384	L383-T387 HydrophobicContact CD1-CG2 4.15Å; L383-T387 HydrophobicContact CG-CG2 4.43Å; L383-T387 WeakPolarHBondContact O-CG2 3.2Å; L383-T387 PolarHBondContact O-N 3.16Å; L383-T387 PolarHBondContact O-OG1 3.29Å; L384-T387 WeakPolarHBondContact CA-OG1 3.38Å
388	C	51.2	Low	50.1	Low	40 Å²	40	89.7 Å²	89.7	27%	0.27	45%	0.448	S	S	.	.	S	Bend	trans	-118.5	0.6	-165.1	-62.8	0	0	0	0	115.7	T350 I390	T350-C388 HydrophobicContact CG2-CB 4.26Å; C388-I390 HydrophobicContact CB-CD1 3.73Å; C388-I390 HydrophobicContact CB-CG1 3.65Å; C388-I390 WeakPolarHBondContact O-CG1 3.38Å; C388-I390 PolarHBondContact O-N 3.01Å
389	D	40.8	Very low	47.9	Very low	138 Å²	138	94.7 Å²	94.7	74%	0.738	47%	0.467	S	S	*	.			trans	49.7	27.7	178.7	-84.5	-40.9	0	0	0	115.5	N391	D389-N391 PolarHBondContact O-N 3.02Å
390	I	44.9	Very low	45.7	Very low	34 Å²	34	94.9 Å²	94.9	17%	0.174	47%	0.472	C	S	.	.			trans	-73.6	119	-172.5	-53.9	170.8	0	0	0	111.1	T350 C388 W392 L395	T350-I390 HydrophobicContact CG2-CD1 4.03Å; C388-I390 HydrophobicContact CB-CD1 3.73Å; C388-I390 HydrophobicContact CB-CG1 3.65Å; C388-I390 WeakPolarHBondContact O-CG1 3.38Å; C388-I390 PolarHBondContact O-N 3.01Å; I390-W392 VanDerWaalsContact C-N 3.3Å; I390-W392 PolarHBondContact O-N 2.84Å; I390-L395 HydrophobicContact CG2-CD1 4.27Å
391	N	35.5	Very low	43.4	Very low	120 Å²	120	104 Å²	104	64%	0.642	52%	0.515	S	S	*	.			trans	-79.9	75.9	178.4	-150.9	-27.4	0	0	0	111.8	D389 V393 R394	D389-N391 PolarHBondContact O-N 3.02Å; N391-V393 PolarHBondContact O-N 3.46Å; N391-R394 PolarHBondContact O-N 3.1Å
392	W	36.5	Very low	41	Very low	68 Å²	68	106.3 Å²	106.3	26%	0.258	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-21.2	-171.5	-99.2	89.8	0	0	0	116.9	V354 L385 I390 R394 L395 N396	V354-W392 HydrophobicContact CG1-CH2 3.64Å; V354-W392 HydrophobicContact CG1-CZ2 3.66Å; V354-W392 HydrophobicContact CG2-CZ2 4.15Å; L385-W392 HydrophobicContact CD1-CZ2 4.44Å; I390-W392 VanDerWaalsContact C-N 3.3Å; I390-W392 PolarHBondContact O-N 2.84Å; W392-R394 PolarHBondContact O-N 3.2Å; W392-R394 VanDerWaalsContact O-N 3.15Å; W392-L395 PolarHBondContact O-N 3.37Å; W392-N396 PolarHBondContact O-N 3.38Å
393	V	30.3	Very low	39.1	Very low	106 Å²	106	105.9 Å²	105.9	64%	0.642	54%	0.543	S	S	*	.	H	α-helix	trans	-53.4	-34.2	177.6	-176.1	0	0	0	0	111.8	N391	N391-V393 PolarHBondContact O-N 3.46Å
394	R	31.9	Very low	37	Very low	191 Å²	191	113.9 Å²	113.9	72%	0.721	57%	0.568	S	S	*	*	H	α-helix	trans	-80.4	-24.3	-176.2	-145.6	175.9	-166.7	-177.6	2.9	114.4	N391 W392	N391-R394 PolarHBondContact O-N 3.1Å; W392-R394 PolarHBondContact O-N 3.2Å; W392-R394 VanDerWaalsContact O-N 3.15Å
395	L	32.9	Very low	35.2	Very low	78 Å²	78	118.9 Å²	118.9	41%	0.408	60%	0.602	S	S	.	*	H	α-helix	trans	-84.7	-40.4	178.8	-83.1	162.7	0	0	0	112.2	I390 W392 Q397 K398	I390-L395 HydrophobicContact CG2-CD1 4.27Å; W392-L395 PolarHBondContact O-N 3.37Å; L395-Q397 PolarHBondContact O-N 3.45Å; L395-Q397 VanDerWaalsContact O-N 3.15Å; L395-K398 PolarHBondContact O-N 3.11Å; L395-K398 VanDerWaalsContact O-N 3.13Å
396	N	31.5	Very low	33.5	Very low	69 Å²	69	120.5 Å²	120.5	37%	0.369	62%	0.615	S	S	.	*	H	α-helix	trans	-62.9	-22	-177.1	-81.5	-28.3	0	0	0	114.1	W392 K398 I400	W392-N396 PolarHBondContact O-N 3.38Å; N396-K398 VanDerWaalsContact C-N 3.3Å; N396-K398 PolarHBondContact O-N 3.11Å; N396-I400 HydrophobicContact CB-CD1 3.91Å; N396-I400 WeakPolarHBondContact O-CD1 3.25Å; N396-I400 VanDerWaalsContact O-CG1 3.25Å; N396-I400 WeakPolarHBondContact O-CG1 3.38Å
397	Q	31.1	Very low	31.9	Very low	170 Å²	170	126.5 Å²	126.5	79%	0.794	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-11.1	176.4	-75.6	-172.3	-25.3	0	0	115	L395	L395-Q397 PolarHBondContact O-N 3.45Å; L395-Q397 VanDerWaalsContact O-N 3.15Å
398	K	31	Very low	30.8	Very low	157 Å²	157	130 Å²	130	68%	0.683	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.3	-5.9	178.3	-76.3	-167.3	174.3	-174.2	0	115.4	L395 N396	L395-K398 PolarHBondContact O-N 3.11Å; L395-K398 VanDerWaalsContact O-N 3.13Å; N396-K398 VanDerWaalsContact C-N 3.3Å; N396-K398 PolarHBondContact O-N 3.11Å
399	F	28.3	Very low	29.5	Very low	181 Å²	181	131.9 Å²	131.9	79%	0.794	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126	5.9	-177.3	-80.1	-79.4	0	0	0	114.6
400	I	25.5	Very low	28.7	Very low	117 Å²	117	130.2 Å²	130.2	60%	0.6	64%	0.64	S	S	*	*			trans	-105.7	57	175.2	-52.8	173.6	0	0	0	110.3	N396 S402	N396-I400 HydrophobicContact CB-CD1 3.91Å; N396-I400 WeakPolarHBondContact O-CD1 3.25Å; N396-I400 VanDerWaalsContact O-CG1 3.25Å; N396-I400 WeakPolarHBondContact O-CG1 3.38Å; I400-S402 VanDerWaalsContact C-N 3.29Å; I400-S402 PolarHBondContact O-N 2.92Å
401	E	24.2	Very low	27.6	Very low	198 Å²	198	131.2 Å²	131.2	93%	0.925	65%	0.646	S	S	*	*			trans	-85	83.7	145.9	-73.7	-161.9	156.6	0	0	107.8
402	S	24.8	Very low	27.1	Very low	93 Å²	93	129.2 Å²	129.2	65%	0.65	64%	0.638	S	S	*	*			trans	-69.7	159.4	173.1	95	0	0	0	0	110.1	I400	I400-S402 VanDerWaalsContact C-N 3.29Å; I400-S402 PolarHBondContact O-N 2.92Å
403	P	29	Very low	26.6	Very low	103 Å²	103	134.3 Å²	134.3	67%	0.669	66%	0.662	S	S	*	*			cis	-145.2	144.6	41.2	35.7	-14.5	0	0	0	118
404	R	21.9	Very low	26.4	Very low	235 Å²	235	136.6 Å²	136.6	89%	0.887	66%	0.664	S	S	*	*				-162.6	141.4	102.4	-101.1	163.8	-166.7	-160.1	3.7	111.7	T406	R404-T406 PolarHBondContact O-N 3.13Å
405	P	24.1	Very low	26.1	Very low	122 Å²	122	129.8 Å²	129.8	79%	0.792	64%	0.64	S	S	*	*			trans	-86.1	92.5	-173.4	33.2	-34.8	0	0	0	112.4	R407	P405-R407 VanDerWaalsContact C-N 3.29Å; P405-R407 PolarHBondContact O-N 3.22Å
406	T	23.5	Very low	25.7	Very low	122 Å²	122	132.8 Å²	132.8	75%	0.748	66%	0.656	S	S	*	*			trans	-71.6	87.6	161.2	33.6	0	0	0	0	109.6	R404 F408	R404-T406 PolarHBondContact O-N 3.13Å; T406-F408 VanDerWaalsContact C-N 3.27Å; T406-F408 PolarHBondContact O-N 3.42Å
407	R	22.6	Very low	25.4	Very low	228 Å²	228	139.8 Å²	139.8	86%	0.86	68%	0.684	S	S	*	*			trans	-68.2	76.4	-179.1	-168	-178.5	-167.8	167.5	4.4	111.4	P405 N409	P405-R407 VanDerWaalsContact C-N 3.29Å; P405-R407 PolarHBondContact O-N 3.22Å; R407-N409 PolarHBondContact O-N 3.08Å
408	F	24.6	Very low	25.1	Very low	159 Å²	159	134.9 Å²	134.9	70%	0.697	67%	0.668	S	S	*	*			trans	-61	104	172.6	-99.1	-86.5	0	0	0	109.9	T406 C410	T406-F408 VanDerWaalsContact C-N 3.27Å; T406-F408 PolarHBondContact O-N 3.42Å; F408-C410 VanDerWaalsContact C-N 3.25Å; F408-C410 PolarHBondContact O-N 2.96Å; F408-C410 VanDerWaalsContact O-N 3.08Å
409	N	23.7	Very low	24.7	Very low	80 Å²	80	136.6 Å²	136.6	43%	0.428	68%	0.676	S	S	.	*			trans	-89.4	61.6	-175.1	-158.4	46.6	0	0	0	110.3	H79 R407 D411	H79-N409 PolarHBondContact NE2-OD1 3.15Å; R407-N409 PolarHBondContact O-N 3.08Å; N409-D411 PolarHBondContact O-N 3.05Å
410	C	24.7	Very low	24.5	Very low	103 Å²	103	135.1 Å²	135.1	70%	0.696	68%	0.676	S	S	*	*			trans	-74.4	49.9	-174.7	-71.3	0	0	0	0	113.9	F408	F408-C410 VanDerWaalsContact C-N 3.25Å; F408-C410 PolarHBondContact O-N 2.96Å; F408-C410 VanDerWaalsContact O-N 3.08Å
411	D	22.9	Very low	24.4	Very low	55 Å²	55	137.1 Å²	137.1	29%	0.294	69%	0.688	S	S	.	*			trans	-147.8	89	179.3	-121	-43.3	0	0	0	109.8	H79 N409	H79-D411 PolarHBondContact CD2-O 3.01Å; H79-D411 VanDerWaalsContact CE1-CB 3.42Å; H79-D411 WeakPolarHBondContact CE1-CB 3.5Å; H79-D411 IonicContact CE1-OD2 2.83Å; H79-D411 PolarHBondContact CE1-OD2 3.09Å; H79-D411 IonicContact ND1-OD2 3.96Å; H79-D411 WeakPolarHBondContact NE2-CB 3.26Å; N409-D411 PolarHBondContact O-N 3.05Å
412	T	23.6	Very low	24.4	Very low	78 Å²	78	139.7 Å²	139.7	48%	0.479	69%	0.69	S	S	.	*	S	Bend	trans	-174.4	-27.2	166.2	3.8	0	0	0	0	113.8	I78	I78-T412 WeakPolarHBondContact O-CG2 3.2Å
413	K	26.3	Very low	24.3	Very low	175 Å²	175	142.6 Å²	142.6	76%	0.761	70%	0.697	S	S	*	*	S	Bend	trans	-90.1	-9	177.7	-77.5	-176.2	177	176.9	0	114.6
414	F	26.5	Very low	24	Very low	155 Å²	155	142.8 Å²	142.8	68%	0.68	70%	0.7	S	S	*	*	S	Bend	trans	-93.6	14.8	-174.4	-104.9	-80.3	0	0	0	116.3	F375	F375-F414 AromaticContact CE2-CE2 3.79Å; F375-F414 HydrophobicContact CE2-CE2 3.79Å; F375-F414 AromaticContact CE2-CZ 3.61Å; F375-F414 HydrophobicContact CE2-CZ 3.61Å; F375-F414 HydrophobicContact CZ-CE2 4.37Å; F375-F414 AromaticContact CZ-CZ 3.73Å; F375-F414 HydrophobicContact CZ-CZ 3.73Å
415	Q	25.3	Very low	24.2	Very low	48 Å²	48	136.7 Å²	136.7	22%	0.224	69%	0.694	C	S	.	*	S	Bend	trans	-105.2	-24.6	175.5	-94.1	101.9	72.6	0	0	115.3	F81 F417	F81-Q415 VanDerWaalsContact C-CG 3.46Å; F81-Q415 WeakPolarHBondContact O-CG 3.2Å; Q415-F417 VanDerWaalsContact C-N 3.32Å; Q415-F417 PolarHBondContact O-N 3.38Å
416	N	24.2	Very low	24.3	Very low	140 Å²	140	137.1 Å²	137.1	75%	0.749	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	13.3	-167.7	-74.4	-18.2	0	0	0	115.5
417	F	25.2	Very low	24.4	Very low	216 Å²	216	136.7 Å²	136.7	95%	0.947	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.5	26.5	173	-95.7	-86.4	0	0	0	113.7	Q415	Q415-F417 VanDerWaalsContact C-N 3.32Å; Q415-F417 PolarHBondContact O-N 3.38Å
418	S	24.3	Very low	24.4	Very low	67 Å²	67	131.5 Å²	131.5	47%	0.469	70%	0.695	S	S	.	*	S	Bend	trans	-130	34.7	173.7	-163.5	0	0	0	0	112.3	T83	T83-S418 PolarHBondContact O-OG 3.34Å
419	K	23.5	Very low	24.4	Very low	193 Å²	193	131.9 Å²	131.9	84%	0.839	70%	0.704	S	S	*	*	S	Bend	trans	-166.5	64.5	-179.5	-111.7	159.5	-170.9	169.6	0	112.9
420	N	24.5	Very low	24.3	Very low	150 Å²	150	132.5 Å²	132.5	80%	0.802	72%	0.715	S	S	*	*			trans	-166.3	72.5	165.7	-102.1	-27.6	0	0	0	112.7
421	N	23.8	Very low	24.2	Very low	159 Å²	159	134.4 Å²	134.4	85%	0.85	72%	0.717	S	S	*	*	S	Bend	trans	-160.9	27.8	158.2	-125.4	-13.2	0	0	0	115.2
422	W	22.5	Very low	24.2	Very low	253 Å²	253	140.4 Å²	140.4	96%	0.958	74%	0.743	S	S	*	*			trans	-136.5	74	172.2	-93.3	82	0	0	0	110.9
423	L	23.6	Very low	24.1	Very low	153 Å²	153	144.1 Å²	144.1	80%	0.801	76%	0.76	S	S	*	*			trans	-139.4	140.7	163.6	-73.7	173.5	0	0	0	106.8
424	S	23.2	Very low	23.9	Very low	107 Å²	107	143.2 Å²	143.2	75%	0.748	76%	0.763	S	S	*	*			cis	-171.1	143.8	-6.4	47.5	0	0	0	0	111.1
425	S	25.4	Very low	23.7	Very low	108 Å²	108	139.8 Å²	139.8	76%	0.755	76%	0.758	S	S	*	*			trans	-158.9	108.7	147.3	58.8	0	0	0	0	110.9
426	T	26	Very low	23.6	Very low	131 Å²	131	146.7 Å²	146.7	80%	0.804	79%	0.79	S	S	*	*			trans	33.1	135.3	138.6	57.3	0	0	0	0	120.5
427	S	26.8	Very low	23.5	Very low	112 Å²	112	143.7 Å²	143.7	78%	0.783	79%	0.793	S	S	*	*			cis	-173.9	139.9	-9.5	38.3	0	0	0	0	107.4
428	S	21.5	Very low	23.4	Very low	120 Å²	120	144.8 Å²	144.8	84%	0.839	79%	0.791	S	S	*	*			trans	-76.1	137.1	172.9	-54.1	0	0	0	0	110.9
429	D	25.6	Very low	23.2	Very low	166 Å²	166	152.4 Å²	152.4	89%	0.888	81%	0.809	S	S	*	*			trans	-140	161.1	141.9	-118.6	-37.9	0	0	0	108.9
430	S	21.5	Very low	23.2	Very low	94 Å²	94	149.8 Å²	149.8	66%	0.657	80%	0.804	S	S	*	*			trans	-131.3	155.9	-157.7	64.1	0	0	0	0	113.7
431	I	22.2	Very low	23.1	Very low	143 Å²	143	150.1 Å²	150.1	73%	0.733	80%	0.799	S	S	*	*			trans	161	135.8	132.1	-85.2	158.4	0	0	0	113.3
432	Q	23.4	Very low	23	Very low	180 Å²	180	151.1 Å²	151.1	84%	0.841	80%	0.796	S	S	*	*			trans	63.6	153.1	158.2	-82.1	164.6	-29.8	0	0	123.5
433	L	20.1	Very low	23	Very low	157 Å²	157	146.7 Å²	146.7	82%	0.822	79%	0.786	S	S	*	*			trans	-94	157.7	169.1	-47.8	78.6	0	0	0	108.8
434	D	23.4	Very low	22.9	Very low	156 Å²	156	147.7 Å²	147.7	83%	0.834	79%	0.786	S	S	*	*				-162.8	-160.1	101.7	-139.5	-55.7	0	0	0	110.8
435	S	21.9	Very low	22.7	Very low	82 Å²	82	149.8 Å²	149.8	57%	0.573	79%	0.788	S	S	*	*			trans	-133.4	170.3	-145.3	60.6	0	0	0	0	117.4
436	Q	22.8	Very low	22.5	Very low	193 Å²	193	150.5 Å²	150.5	90%	0.902	79%	0.788	S	S	*	*			trans	78.9	135.7	170.5	-45.1	-174.3	28	0	0	117.2
437	G	23.3	Very low	22.3	Very low	78 Å²	78	149.3 Å²	149.3	80%	0.804	79%	0.785	S	S	*	*			trans	-170.6	-0.9	-171.1	0	0	0	0	0	123
438	R	22.2	Very low	22.2	Very low	238 Å²	238	152.3 Å²	152.3	90%	0.898	79%	0.791	S	S	*	*			trans	66.5	116.8	162.2	-156	-179.4	-159.2	171.7	6	121.5
439	W	19.8	Very low	22.1	Very low	228 Å²	228	151.3 Å²	151.3	86%	0.864	78%	0.784	S	S	*	*			trans	-16.4	135.1	154.7	-48	73.9	0	0	0	120.6
440	N	22.7	Very low	22.2	Very low	137 Å²	137	152.9 Å²	152.9	73%	0.733	79%	0.786	S	S	*	*				175.9	127.4	102.2	-97.5	-58.2	0	0	0	117.3
441	K	22.8	Very low	22.3	Very low	157 Å²	157	153.4 Å²	153.4	68%	0.683	79%	0.79	S	S	*	*				55.7	116.9	122.7	-148.4	176.5	-169.2	175.9	0	121.3
442	F	22	Very low	22.5	Very low	181 Å²	181	152.5 Å²	152.5	79%	0.794	79%	0.791	S	S	*	*				-173.1	173.2	101.9	-106.5	-73.2	0	0	0	113.5
443	H	21.9	Very low	22.7	Very low	160 Å²	160	149.9 Å²	149.9	74%	0.741	78%	0.783	S	S	*	*			trans	-119.7	166.9	-169	-83.7	-149	0	0	0	113.6
444	H	22.5	Very low	23	Very low	173 Å²	173	148.3 Å²	148.3	80%	0.801	79%	0.785	S	S	*	*				126.1	158	124.7	-100.6	-66.1	0	0	0	118.7
445	L	19.8	Very low	23.1	Very low	152 Å²	152	149.9 Å²	149.9	80%	0.796	78%	0.784	S	S	*	*			trans	-105	178.1	-169.8	-93.8	162.3	0	0	0	111.8
446	T	21.3	Very low	23.4	Very low	122 Å²	122	157.5 Å²	157.5	75%	0.748	80%	0.8	S	S	*	*			trans	82.3	111.8	157.2	19	0	0	0	0	119.9
447	S	21.3	Very low	23.5	Very low	106 Å²	106	152.4 Å²	152.4	74%	0.741	79%	0.791	S	S	*	*			trans	55.7	123.6	139.8	61.9	0	0	0	0	121.3
448	L	23.4	Very low	23.6	Very low	176 Å²	176	156.3 Å²	156.3	92%	0.921	79%	0.791	S	S	*	*				-149	162.3	115.5	-138.9	92.6	0	0	0	111
449	S	21.3	Very low	23.8	Very low	98 Å²	98	154 Å²	154	69%	0.685	79%	0.787	S	S	*	*			trans	-137.3	134.2	170.5	58.9	0	0	0	0	110.1
450	Q	25.8	Very low	24.1	Very low	200 Å²	200	147.5 Å²	147.5	94%	0.935	78%	0.776	S	S	*	*			trans	-174.6	173.6	138.5	-104.8	171.5	28.9	0	0	111.6
451	S	23.7	Very low	24.2	Very low	105 Å²	105	148.6 Å²	148.6	73%	0.734	78%	0.781	S	S	*	*			trans	-119.4	160.7	-161.2	57.9	0	0	0	0	113.2
452	T	27.4	Very low	24.5	Very low	124 Å²	124	145.5 Å²	145.5	76%	0.761	78%	0.778	S	S	*	*			trans	171.5	156.9	139.3	29.8	0	0	0	0	108.4
453	N	26.8	Very low	24.8	Very low	125 Å²	125	145 Å²	145	67%	0.668	78%	0.779	S	S	*	*			cis	-152.9	147.6	-2.5	-126	-28.9	0	0	0	110
454	S	26.4	Very low	25.2	Very low	124 Å²	124	142 Å²	142	87%	0.867	78%	0.776	S	S	*	*			trans	-158.4	129	147.4	-170.3	0	0	0	0	109.3
455	K	26.6	Very low	25.4	Very low	189 Å²	189	140.2 Å²	140.2	82%	0.822	77%	0.772	S	S	*	*			trans	-150.6	127.1	-172.7	-86.1	-175.9	174.9	176.3	0	113
456	R	26.6	Very low	25.8	Very low	241 Å²	241	144.1 Å²	144.1	91%	0.909	78%	0.778	S	S	*	*			trans	-161.3	120	151.1	-126.4	171.4	177	163.5	-0.9	105.3
457	A	26.5	Very low	25.9	Very low	86 Å²	86	143.5 Å²	143.5	71%	0.711	78%	0.779	S	S	*	*			cis	69.9	129.6	44.3	0	0	0	0	0	112.8
458	M	24.2	Very low	26.7	Very low	161 Å²	161	144.3 Å²	144.3	79%	0.793	78%	0.781	S	S	*	*			cis	-169.8	151	-6.7	-126.2	-161.9	-164.3	0	0	110.6
459	K	26.3	Very low	27	Very low	190 Å²	190	140.6 Å²	140.6	83%	0.826	77%	0.77	S	S	*	*			trans	61.1	156.1	157	-76.6	-177.6	178.1	-176.4	0	117.4
460	S	25.8	Very low	27.4	Very low	91 Å²	91	141.8 Å²	141.8	64%	0.636	77%	0.773	S	S	*	*			cis	-173.2	155.9	6	35.9	0	0	0	0	112.3
461	I	24.8	Very low	27.6	Very low	160 Å²	160	139 Å²	139	82%	0.821	76%	0.764	S	S	*	*			trans	65.5	137.5	147.6	-66.7	162.5	0	0	0	116.1
462	S	29	Very low	27.6	Very low	91 Å²	91	139.7 Å²	139.7	64%	0.636	76%	0.764	S	S	*	*			cis	-155.8	160.8	35.3	5.2	0	0	0	0	113.9
463	Q	28.9	Very low	27.6	Very low	172 Å²	172	138.4 Å²	138.4	80%	0.804	76%	0.76	S	S	*	*			trans	37.8	148.6	137	-71.6	164.5	-31.6	0	0	121.5
464	S	29.9	Very low	27.6	Very low	97 Å²	97	138.6 Å²	138.6	68%	0.678	77%	0.771	S	S	*	*			cis	-176.7	170.2	-2.4	45	0	0	0	0	110.4
465	D	27.3	Very low	27.5	Very low	135 Å²	135	138.1 Å²	138.1	72%	0.722	77%	0.767	S	S	*	*			cis	-173.4	146	-36.5	-85.1	-44.6	0	0	0	107.2
466	Y	27.4	Very low	27.6	Very low	233 Å²	233	135 Å²	135	91%	0.914	77%	0.77	S	S	*	*			trans	-157	144.8	165.5	-113.7	-77.6	0	0	0	110.8
467	S	25.3	Very low	27.5	Very low	110 Å²	110	134 Å²	134	77%	0.769	77%	0.772	S	S	*	*			trans	-173.3	177.9	-171.3	-82.4	0	0	0	0	110.9
468	P	37.8	Very low	27.5	Very low	122 Å²	122	133.4 Å²	133.4	79%	0.792	77%	0.774	S	S	*	*			cis	-105.7	-136	-11.8	32.1	-12.3	0	0	0	109.4
469	S	28.7	Very low	27.4	Very low	99 Å²	99	131.8 Å²	131.8	69%	0.692	78%	0.779	S	S	*	*			cis	-161	-173.7	-1.3	33.6	0	0	0	0	106.9
470	V	31	Very low	27.3	Very low	122 Å²	122	131.3 Å²	131.3	74%	0.739	78%	0.779	S	S	*	*			cis	-148.2	165.9	23	-179.9	0	0	0	0	110.5
471	L	28.2	Very low	27.3	Very low	142 Å²	142	133.1 Å²	133.1	74%	0.743	79%	0.787	S	S	*	*			trans	-27.5	137.7	164.6	-52.1	175	0	0	0	116.7
472	T	23.8	Very low	27.2	Very low	119 Å²	119	131.2 Å²	131.2	73%	0.73	78%	0.783	S	S	*	*				62.4	141	60.4	74.8	0	0	0	0	114.1
473	S	28.3	Very low	27	Very low	98 Å²	98	133.4 Å²	133.4	69%	0.685	79%	0.792	S	S	*	*			cis	-165.3	165.5	35.5	-43	0	0	0	0	115.7
474	S	26.9	Very low	26.7	Very low	129 Å²	129	133 Å²	133	90%	0.902	80%	0.795	S	S	*	*			trans	77.6	163.7	141.7	-58.2	0	0	0	0	123.6
475	S	25.1	Very low	26.5	Very low	113 Å²	113	133.9 Å²	133.9	79%	0.79	80%	0.801	S	S	*	*			trans	-149.2	162.8	-166.6	57.8	0	0	0	0	113.8
476	S	27.4	Very low	26.3	Very low	124 Å²	124	137 Å²	137	87%	0.867	81%	0.808	S	S	*	*			trans	-173.9	174.7	157.4	-88.9	0	0	0	0	115.2
477	F	24.7	Very low	26.5	Very low	221 Å²	221	131.6 Å²	131.6	97%	0.969	80%	0.801	S	S	*	*			trans	-106.2	170.5	-164.8	-79.7	-107.1	0	0	0	116.2
478	G	26.2	Very low	26.5	Very low	73 Å²	73	132.3 Å²	132.3	75%	0.753	80%	0.801	S	S	*	*			trans	-166.1	162.7	168.1	0	0	0	0	0	113.5
479	S	23.2	Very low	25.7	Very low	127 Å²	127	133.1 Å²	133.1	89%	0.888	80%	0.798	S	S	*	*			trans	-133.9	178	-158.3	-58.3	0	0	0	0	117.5
480	H	24.6	Very low	25.5	Very low	179 Å²	179	136.2 Å²	136.2	83%	0.829	81%	0.807	S	S	*	*			trans	-86.7	161	-171.2	-48.5	-94.1	0	0	0	117.3
481	T	23.9	Very low	25.2	Very low	130 Å²	130	139.3 Å²	139.3	80%	0.798	81%	0.81	S	S	*	*				169.5	124.1	114.8	34.9	0	0	0	0	118.8
482	T	24.3	Very low	25	Very low	120 Å²	120	140.9 Å²	140.9	74%	0.736	82%	0.818	S	S	*	*			trans	46	156.3	135.6	58.2	0	0	0	0	128.9
483	T	24.5	Very low	24.9	Very low	137 Å²	137	139.4 Å²	139.4	84%	0.84	81%	0.813	S	S	*	*			trans	99.7	147.9	156.3	69.2	0	0	0	0	119.2
484	L	21.8	Very low	24.8	Very low	164 Å²	164	141.3 Å²	141.3	86%	0.859	82%	0.815	S	S	*	*			cis	-173	142	-24.1	175.2	71	0	0	0	111.6
485	S	26	Very low	24.6	Very low	115 Å²	115	142.1 Å²	142.1	80%	0.804	81%	0.809	S	S	*	*			trans	167.5	171.3	143.2	48.8	0	0	0	0	116
486	K	23	Very low	24.5	Very low	200 Å²	200	141.9 Å²	141.9	87%	0.87	81%	0.808	S	S	*	*			trans	-157	-175.2	-173.8	-77.5	-173.3	178.4	178	0	108.6
487	P	31.9	Very low	24.2	Very low	119 Å²	119	141.5 Å²	141.5	77%	0.773	80%	0.8	S	S	*	*			cis	-116.9	-138.5	-5.1	20.1	7.9	0	0	0	112.1
488	T	25.5	Very low	24.2	Very low	125 Å²	125	136.1 Å²	136.1	77%	0.767	78%	0.78	S	S	*	*			cis	-154.2	166.2	16.9	-52.7	0	0	0	0	114.5
489	I	21.9	Very low	24.1	Very low	140 Å²	140	138.7 Å²	138.7	72%	0.718	78%	0.776	S	S	*	*			trans	-74.3	143.4	-175.1	-67.7	155.1	0	0	0	116.3
490	N	24.5	Very low	24.2	Very low	164 Å²	164	140.5 Å²	140.5	88%	0.877	77%	0.772	S	S	*	*				-154.8	156.1	122.5	-129.5	-20.3	0	0	0	114.2
491	K	22.8	Very low	24.2	Very low	187 Å²	187	137.9 Å²	137.9	81%	0.813	76%	0.764	S	S	*	*			trans	-111.6	149.4	-174.5	-67.1	177.6	178.5	175.9	0	112.6
492	L	24.5	Very low	24.3	Very low	175 Å²	175	137.3 Å²	137.3	92%	0.916	76%	0.761	S	S	*	*			trans	-163	158.4	142.7	-111.5	148.8	0	0	0	111.3
493	S	22	Very low	24.3	Very low	88 Å²	88	139.8 Å²	139.8	62%	0.615	77%	0.769	S	S	*	*			trans	-104.8	159.2	-180	56.8	0	0	0	0	111.9
494	N	26.1	Very low	24.3	Very low	138 Å²	138	140.2 Å²	140.2	74%	0.738	77%	0.765	S	S	*	*				172.7	130.6	119.4	-81.9	-13.5	0	0	0	114.1
495	N	22.6	Very low	24.4	Very low	145 Å²	145	141.2 Å²	141.2	78%	0.775	76%	0.763	S	S	*	*			trans	23.5	124.6	145.4	-56.9	-15.4	0	0	0	122.8
496	S	23.1	Very low	24.3	Very low	109 Å²	109	141.1 Å²	141.1	76%	0.762	75%	0.753	S	S	*	*				90.4	130.5	124.8	75	0	0	0	0	123.4
497	T	22.1	Very low	24.4	Very low	115 Å²	115	137.2 Å²	137.2	71%	0.706	74%	0.742	S	S	*	*			trans	92.6	95.7	143.1	-48.4	0	0	0	0	121.6
498	I	23.1	Very low	24.1	Very low	108 Å²	108	139 Å²	139	55%	0.554	75%	0.745	S	S	*	*			trans	40.4	120.2	135.7	-33.6	165.2	0	0	0	120.2
499	I	25.9	Very low	24.2	Very low	127 Å²	127	137.9 Å²	137.9	65%	0.651	74%	0.742	S	S	*	*				-179.8	151	120.4	-94.2	161.8	0	0	0	110.1
500	M	23.7	Very low	24.5	Very low	165 Å²	165	137.9 Å²	137.9	81%	0.813	74%	0.743	S	S	*	*			trans	-104.4	134.6	167.5	-78.7	-94.6	-69.5	0	0	109.6
501	D	25.1	Very low	24.7	Very low	124 Å²	124	135.7 Å²	135.7	66%	0.663	73%	0.732	S	S	*	*			trans	-151.5	148.3	156.5	-104.3	-27.1	0	0	0	106.3	R802	D501-R802 IonicContact OD2-CZ 3.9Å; D501-R802 IonicContact OD2-NH2 2.75Å; D501-R802 PolarHBondContact OD2-NH2 2.84Å
502	T	26.5	Very low	24.9	Very low	119 Å²	119	133.1 Å²	133.1	73%	0.73	73%	0.727	S	S	*	*			trans	-125.3	135.4	-168.6	45.1	0	0	0	0	114.2
503	L	24.2	Very low	25.1	Very low	171 Å²	171	131.4 Å²	131.4	90%	0.895	72%	0.719	S	S	*	*			trans	-156.4	-176.5	155.9	-112.7	146	0	0	0	111.7
504	L	23.8	Very low	25.2	Very low	147 Å²	147	131.8 Å²	131.8	77%	0.77	72%	0.721	S	S	*	*			trans	-114.8	150.6	-145.5	-83.2	141.3	0	0	0	116.1
505	K	25.5	Very low	25.3	Very low	185 Å²	185	134.5 Å²	134.5	80%	0.804	73%	0.729	S	S	*	*			trans	72.9	150.4	160.6	-67.5	-179.8	178.4	-179.1	0	116.9
506	N	23.8	Very low	25.5	Very low	113 Å²	113	131.4 Å²	131.4	60%	0.604	72%	0.723	S	S	*	*			cis	-146.2	161.4	4.2	-128.1	36.5	0	0	0	112.5
507	D	25	Very low	25.6	Very low	118 Å²	118	133.9 Å²	133.9	63%	0.631	73%	0.728	S	S	*	*			trans	55	126.6	150.7	-50.4	-26.6	0	0	0	124.9
508	N	25.4	Very low	25.9	Very low	156 Å²	156	136.2 Å²	136.2	83%	0.834	74%	0.737	S	S	*	*			trans	62.1	139.9	144.6	-61.5	-27.6	0	0	0	120.8
509	S	27.7	Very low	25.9	Very low	102 Å²	102	142.3 Å²	142.3	71%	0.713	75%	0.753	S	S	*	*			cis	-164.6	154.5	-5	52.8	0	0	0	0	112.4
510	N	27.3	Very low	26.2	Very low	139 Å²	139	139.1 Å²	139.1	74%	0.743	74%	0.742	S	S	*	*			trans	17.8	141.5	144.8	-64.7	2.2	0	0	0	120.4
511	N	29.2	Very low	26.5	Very low	119 Å²	119	135.5 Å²	135.5	64%	0.636	73%	0.732	S	S	*	*			cis	-164.2	156.6	14.1	-109.5	-12.4	0	0	0	111.3
512	N	27	Very low	26.7	Very low	132 Å²	132	135.1 Å²	135.1	71%	0.706	73%	0.729	S	S	*	*			trans	46.4	142.1	144.2	-58.2	-9.6	0	0	0	120.5
513	D	27.4	Very low	26.8	Very low	139 Å²	139	132.1 Å²	132.1	74%	0.743	71%	0.713	S	S	*	*				-155.2	151.8	53.5	-130.4	-38.7	0	0	0	117.4
514	S	24.5	Very low	27.1	Very low	96 Å²	96	128.2 Å²	128.2	67%	0.671	69%	0.692	S	S	*	*			trans	34.1	93.7	147.2	-64.6	0	0	0	0	121.1
515	H	28.6	Very low	27.5	Very low	196 Å²	196	125.9 Å²	125.9	91%	0.907	68%	0.68	S	S	*	*			trans	-148.5	151.3	137.3	-117.5	-82.2	0	0	0	113.3
516	A	25.9	Very low	27.6	Very low	79 Å²	79	125 Å²	125	65%	0.653	68%	0.676	S	S	*	*			trans	-29.7	129.5	-170.5	0	0	0	0	0	120.7	N518	A516-N518 PolarHBondContact O-N 3.32Å
517	N	25.6	Very low	27.8	Very low	161 Å²	161	125.5 Å²	125.5	86%	0.861	68%	0.679	S	S	*	*			trans	29.3	72.6	135.8	-67.6	-9.6	0	0	0	118.9
518	N	27.6	Very low	28	Very low	165 Å²	165	123.2 Å²	123.2	88%	0.882	66%	0.663	S	S	*	*			trans	-150	57.6	156.2	-108.2	-32.8	0	0	0	112.2	A516 S520	A516-N518 PolarHBondContact O-N 3.32Å; N518-S520 PolarHBondContact O-N 3.3Å
519	R	25.1	Very low	28	Very low	236 Å²	236	124.5 Å²	124.5	89%	0.891	66%	0.664	S	S	*	*			trans	-82	63.4	-174.4	-151.4	174.7	-163.2	170	5.5	113.4
520	S	30.4	Very low	27.8	Very low	60 Å²	60	124.8 Å²	124.8	42%	0.42	66%	0.657	S	S	.	*			trans	40.9	108	152.6	57.7	0	0	0	0	118.5	N518 I522 S523	N518-S520 PolarHBondContact O-N 3.3Å; S520-I522 PolarHBondContact O-N 3.49Å; S520-S523 WeakPolarHBondContact O-CB 3.29Å; S520-S523 PolarHBondContact O-N 3.31Å; S520-S523 PolarHBondContact O-OG 3.41Å
521	S	30.3	Very low	27.6	Very low	88 Å²	88	123.6 Å²	123.6	62%	0.615	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52	-25.3	165.9	-48.4	0	0	0	0	113.7	S523 L524	S521-S523 PolarHBondContact O-N 3.48Å; S521-L524 PolarHBondContact O-N 3.36Å
522	I	30.1	Very low	27.3	Very low	116 Å²	116	124.8 Å²	124.8	60%	0.595	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	-25.6	175.7	-63.6	167.8	0	0	0	112.6	S520 I525	S520-I522 PolarHBondContact O-N 3.49Å; I522-I525 PolarHBondContact O-N 2.97Å
523	S	29.2	Very low	27.2	Very low	56 Å²	56	127.4 Å²	127.4	39%	0.392	67%	0.671	S	S	.	*	H	α-helix	trans	-62.9	-44.6	179.3	58.8	0	0	0	0	112.4	S520 S521 I525 K526	S520-S523 WeakPolarHBondContact O-CB 3.29Å; S520-S523 PolarHBondContact O-N 3.31Å; S520-S523 PolarHBondContact O-OG 3.41Å; S521-S523 PolarHBondContact O-N 3.48Å; S523-I525 PolarHBondContact O-N 3.44Å; S523-I525 VanDerWaalsContact O-N 3.11Å; S523-K526 PolarHBondContact O-N 3.04Å
524	L	29.5	Very low	27.2	Very low	89 Å²	89	127.5 Å²	127.5	47%	0.466	67%	0.67	S	S	.	*	H	α-helix	trans	-66.2	-10.9	178.9	-72.5	171.1	0	0	0	114.4	S521 F528	S521-L524 PolarHBondContact O-N 3.36Å; L524-F528 VanDerWaalsContact O-CD2 3.24Å; L524-F528 WeakPolarHBondContact O-CD2 3.16Å; L524-F528 WeakPolarHBondContact O-CE2 3.42Å
525	I	32.7	Very low	27.1	Very low	99 Å²	99	135.3 Å²	135.3	51%	0.508	69%	0.685	S	S	.	*	H	α-helix	trans	-89.7	-30.8	-179.6	-59.4	177.3	0	0	0	111	I522 S523 D527 F528 L710	I522-I525 PolarHBondContact O-N 2.97Å; S523-I525 PolarHBondContact O-N 3.44Å; S523-I525 VanDerWaalsContact O-N 3.11Å; I525-D527 VanDerWaalsContact C-N 3.28Å; I525-D527 PolarHBondContact O-N 3.49Å; I525-F528 PolarHBondContact O-N 2.8Å; I525-L710 HydrophobicContact CD1-CD1 4.44Å
526	K	28.1	Very low	27	Very low	165 Å²	165	130.5 Å²	130.5	72%	0.717	67%	0.673	S	S	*	*	H	α-helix	trans	-70.6	-22.1	-177.7	-73.5	-170.1	172.9	-174.5	0	114	S523 F528	S523-K526 PolarHBondContact O-N 3.04Å; K526-F528 PolarHBondContact O-N 2.83Å
527	D	27.4	Very low	26.9	Very low	124 Å²	124	134.3 Å²	134.3	66%	0.663	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-3.1	175.8	-62.8	-21.6	0	0	0	113.3	I525	I525-D527 VanDerWaalsContact C-N 3.28Å; I525-D527 PolarHBondContact O-N 3.49Å
528	F	28.3	Very low	26.9	Very low	70 Å²	70	133 Å²	133	31%	0.307	68%	0.676	S	S	.	*			trans	-108.2	67.5	174.2	-68.7	-74	0	0	0	111.7	L524 I525 K526 L530 L557 Y559	L524-F528 VanDerWaalsContact O-CD2 3.24Å; L524-F528 WeakPolarHBondContact O-CD2 3.16Å; L524-F528 WeakPolarHBondContact O-CE2 3.42Å; I525-F528 PolarHBondContact O-N 2.8Å; K526-F528 PolarHBondContact O-N 2.83Å; F528-L530 PolarHBondContact O-N 3.18Å; F528-L557 WeakPolarHBondContact CE1-O 3.27Å; F528-Y559 HydrophobicContact CD1-CD2 4.48Å; F528-Y559 HydrophobicContact CE1-CD2 4.42Å
529	Q	25.3	Very low	27	Very low	183 Å²	183	131.7 Å²	131.7	86%	0.855	66%	0.664	S	S	*	*			trans	-63.7	119.4	163.4	-71.7	-170.6	-7.8	0	0	109.6	S531	Q529-S531 PolarHBondContact O-N 3.19Å
530	L	24.6	Very low	27.2	Very low	108 Å²	108	126.6 Å²	126.6	57%	0.565	66%	0.655	S	S	*	*			trans	-67.8	120.8	167.3	-87.8	76.2	0	0	0	108.8	F528 D532	F528-L530 PolarHBondContact O-N 3.18Å; L530-D532 PolarHBondContact O-N 2.99Å
531	S	23.6	Very low	27.4	Very low	114 Å²	114	126.5 Å²	126.5	80%	0.797	65%	0.646	S	S	*	*			trans	-85.4	93.5	164.4	58.5	0	0	0	0	109.2	Q529 K533	Q529-S531 PolarHBondContact O-N 3.19Å; S531-K533 PolarHBondContact O-N 3.01Å
532	D	23	Very low	27.4	Very low	144 Å²	144	126.2 Å²	126.2	77%	0.77	64%	0.642	S	S	*	*			trans	-66.1	97.6	175.1	-75.1	-51.1	0	0	0	110.9	L530	L530-D532 PolarHBondContact O-N 2.99Å
533	K	24.7	Very low	27.4	Very low	187 Å²	187	125.4 Å²	125.4	81%	0.813	64%	0.642	S	S	*	*			trans	-157.7	126.3	164	-114.2	160.3	-173.7	173.5	0	113.8	S531	S531-K533 PolarHBondContact O-N 3.01Å
534	I	26.8	Very low	27.4	Very low	141 Å²	141	126.3 Å²	126.3	72%	0.723	65%	0.649	S	S	*	*			trans	67.5	90.8	156.7	-53.3	165.3	0	0	0	115.4	S536	I534-S536 PolarHBondContact O-N 3.49Å
535	R	22.9	Very low	27.6	Very low	261 Å²	261	127.6 Å²	127.6	99%	0.985	67%	0.665	S	S	*	*			trans	-77.9	100.7	146.1	177.7	-176.2	176.9	-169	-1.4	108
536	S	25.4	Very low	27.7	Very low	95 Å²	95	127.6 Å²	127.6	66%	0.664	67%	0.666	S	S	*	*			trans	-146.7	157.8	168.8	-165.3	0	0	0	0	109.3	I534 N538	I534-S536 PolarHBondContact O-N 3.49Å; S536-N538 PolarHBondContact O-N 3.4Å
537	D	24.9	Very low	28	Very low	158 Å²	158	123.9 Å²	123.9	85%	0.845	66%	0.66	S	S	*	*	S	Bend	trans	-72.7	99.5	-169	-73.6	-63	0	0	0	113.2
538	N	24.9	Very low	28.8	Very low	134 Å²	134	118.5 Å²	118.5	72%	0.717	63%	0.631	S	S	*	*			trans	-160.2	134.4	138.8	-97	-32.5	0	0	0	111	S536 D540	S536-N538 PolarHBondContact O-N 3.4Å; N538-D540 PolarHBondContact O-N 3.26Å; N538-D540 VanDerWaalsContact O-N 3.08Å
539	Q	30	Very low	29	Very low	138 Å²	138	118.4 Å²	118.4	65%	0.645	64%	0.64	S	S	*	*			trans	-85.7	54.3	175.3	-74.2	-171.7	-25.3	0	0	111.5	Y541	Q539-Y541 PolarHBondContact O-N 2.73Å; Q539-Y541 VanDerWaalsContact O-N 3.14Å
540	D	28.2	Very low	29.6	Very low	128 Å²	128	115.8 Å²	115.8	68%	0.684	64%	0.642	S	S	*	*			trans	-76.6	101.7	177.2	-73.5	-40.5	0	0	0	110.4	N538	N538-D540 PolarHBondContact O-N 3.26Å; N538-D540 VanDerWaalsContact O-N 3.08Å
541	Y	35.8	Very low	30.1	Very low	59 Å²	59	113.6 Å²	113.6	23%	0.231	64%	0.639	C	S	.	*			trans	-56.2	142.6	161.5	-94.1	-110.5	0	0	0	109.1	Q539 T543 P565 I567	Q539-Y541 PolarHBondContact O-N 2.73Å; Q539-Y541 VanDerWaalsContact O-N 3.14Å; Y541-T543 PolarHBondContact O-N 3.05Å; Y541-T543 PolarHBondContact O-OG1 3.33Å; Y541-P565 PolarHBondContact OH-O 3.04Å; Y541-I567 HydrophobicContact CD1-CD1 3.94Å; Y541-I567 HydrophobicContact CD1-CG1 4.36Å; Y541-I567 HydrophobicContact CD2-CD1 3.89Å; Y541-I567 HydrophobicContact CD2-CG1 4.04Å; Y541-I567 HydrophobicContact CE1-CD1 3.88Å; Y541-I567 HydrophobicContact CE1-CG1 3.82Å; Y541-I567 HydrophobicContact CE2-CD1 3.83Å; Y541-I567 HydrophobicContact CE2-CG1 3.45Å; Y541-I567 VanDerWaalsContact CE2-CG1 3.45Å; Y541-I567 HydrophobicContact CG-CD1 3.93Å; Y541-I567 HydrophobicContact CG-CG1 4.45Å; Y541-I567 WeakPolarHBondContact OH-CG1 3.3Å
542	P	29.9	Very low	31	Very low	82 Å²	82	112 Å²	112	53%	0.532	62%	0.618	S	S	.	*			trans	-59	101.3	178.9	23.3	-32.9	0	0	0	109.6	S544 R606	P542-S544 VanDerWaalsContact C-N 3.29Å; P542-R606 PolarHBondContact O-NH2 3.46Å
543	T	29.8	Very low	31.7	Very low	98 Å²	98	108.3 Å²	108.3	60%	0.601	61%	0.613	S	S	*	*			trans	-91.5	1.3	-175.1	-62.2	0	0	0	0	111.1	Y541	Y541-T543 PolarHBondContact O-N 3.05Å; Y541-T543 PolarHBondContact O-OG1 3.33Å
544	S	30.7	Very low	32.4	Very low	76 Å²	76	105.4 Å²	105.4	53%	0.531	62%	0.615	S	S	.	*	S	Bend	trans	-55.5	150	167.3	50.1	0	0	0	0	112.1	P542 L546 R606	P542-S544 VanDerWaalsContact C-N 3.29Å; S544-L546 PolarHBondContact O-N 3.11Å; S544-R606 PolarHBondContact O-NH2 2.85Å
545	S	33.2	Very low	33.5	Very low	116 Å²	116	101.5 Å²	101.5	81%	0.811	60%	0.598	S	S	*	*			trans	-77.5	58.5	-166.8	55.9	0	0	0	0	113.5	S547	S545-S547 VanDerWaalsContact C-N 3.33Å; S545-S547 PolarHBondContact O-N 3.02Å
546	L	35.3	Very low	35.2	Very low	99 Å²	99	93.4 Å²	93.4	52%	0.518	58%	0.579	S	S	.	*			trans	-66.1	94.2	162.9	-66	178.4	0	0	0	109.1	S544 L548 R606	S544-L546 PolarHBondContact O-N 3.11Å; L546-L548 HydrophobicContact CB-CD1 4.08Å; L546-L548 WeakPolarHBondContact O-CD1 3.34Å; L546-R606 PolarHBondContact O-NH1 3.44Å
547	S	32.5	Very low	37.2	Very low	87 Å²	87	89.5 Å²	89.5	61%	0.608	55%	0.551	S	S	*	*			trans	-74.5	112.3	159.4	-62.8	0	0	0	0	107.8	S545 S549	S545-S547 VanDerWaalsContact C-N 3.33Å; S545-S547 PolarHBondContact O-N 3.02Å; S547-S549 PolarHBondContact O-N 3Å
548	L	44.9	Very low	39.7	Very low	10 Å²	10	86 Å²	86	5%	0.052	54%	0.537	C	S	.	.			trans	-76.2	18.3	-173.6	-74.4	52.4	0	0	0	114.1	L546 S550 F552 A584 G585 F608	L546-L548 HydrophobicContact CB-CD1 4.08Å; L546-L548 WeakPolarHBondContact O-CD1 3.34Å; L548-S550 PolarHBondContact O-N 3.44Å; L548-F552 HydrophobicContact CB-CD2 4.29Å; L548-F552 HydrophobicContact CB-CE2 3.89Å; L548-F552 HydrophobicContact CG-CD2 4.42Å; L548-F552 HydrophobicContact CG-CE2 3.68Å; L548-F552 HydrophobicContact CG-CZ 4.06Å; L548-A584 VanDerWaalsContact CB-O 3.27Å; L548-A584 WeakPolarHBondContact CB-O 3.43Å; L548-A584 PolarHBondContact N-O 3.1Å; L548-G585 CarbonylContact C-O 3.59Å; L548-F608 HydrophobicContact CD2-CE1 3.9Å; L548-F608 HydrophobicContact CD2-CZ 3.86Å
549	S	33.7	Very low	42.4	Very low	69 Å²	69	81.7 Å²	81.7	48%	0.483	51%	0.511	S	S	.	.	S	Bend	trans	-63.2	123.7	174.8	47.7	0	0	0	0	111.5	S547 A551	S547-S549 PolarHBondContact O-N 3Å; S549-A551 VanDerWaalsContact C-N 3.25Å; S549-A551 PolarHBondContact O-N 3.35Å
550	S	36.4	Very low	44.9	Very low	128 Å²	128	76.5 Å²	76.5	90%	0.895	49%	0.494	S	S	*	.	S	Bend	trans	56.7	-20.9	164	47.2	0	0	0	0	121.1	L548 F552	L548-S550 PolarHBondContact O-N 3.44Å; S550-F552 PolarHBondContact O-N 3.31Å
551	A	35.6	Very low	47.7	Very low	61 Å²	61	72.1 Å²	72.1	50%	0.504	47%	0.471	S	S	.	.			trans	-80.6	-7.1	-168.6	0	0	0	0	0	117.1	S549 G553	S549-A551 VanDerWaalsContact C-N 3.25Å; S549-A551 PolarHBondContact O-N 3.35Å; A551-G553 VanDerWaalsContact C-N 3.25Å; A551-G553 PolarHBondContact O-N 2.96Å
552	F	42.6	Very low	50.3	Low	81 Å²	81	69.8 Å²	69.8	36%	0.355	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	15.1	-163.9	-83.4	-85.9	0	0	0	117.2	L548 S550	L548-F552 HydrophobicContact CB-CD2 4.29Å; L548-F552 HydrophobicContact CB-CE2 3.89Å; L548-F552 HydrophobicContact CG-CD2 4.42Å; L548-F552 HydrophobicContact CG-CE2 3.68Å; L548-F552 HydrophobicContact CG-CZ 4.06Å; S550-F552 PolarHBondContact O-N 3.31Å
553	G	37.2	Very low	53.2	Low	66 Å²	66	67.6 Å²	67.6	68%	0.68	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-40.9	169.8	0	0	0	0	0	113.3	A551	A551-G553 VanDerWaalsContact C-N 3.25Å; A551-G553 PolarHBondContact O-N 2.96Å
554	C	40.5	Very low	56.1	Low	126 Å²	126	67 Å²	67	85%	0.851	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.8	-4.9	-162.5	-60.6	0	0	0	0	115.8
555	T	49.5	Very low	58.9	Low	60 Å²	60	65.8 Å²	65.8	37%	0.368	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-74.2	131.4	178.7	41.7	0	0	0	0	111.9	L557 R642	T555-L557 PolarHBondContact O-N 2.82Å; T555-R642 PolarHBondContact O-NH2 3.39Å
556	P	58.9	Low	61.6	Low	90 Å²	90	61.5 Å²	61.5	58%	0.584	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-56.8	138.3	166.7	-25	35.3	0	0	0	110.3
557	L	66.8	Low	64.2	Low	14 Å²	14	57.6 Å²	57.6	7%	0.073	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-81.2	127.2	174.9	-167.7	80.1	0	0	0	108	F528 T555 Y559 L561 L562 F603 R642 L646	F528-L557 WeakPolarHBondContact CE1-O 3.27Å; T555-L557 PolarHBondContact O-N 2.82Å; L557-Y559 PolarHBondContact O-N 3.41Å; L557-L561 HydrophobicContact CD1-CD2 3.88Å; L557-L561 HydrophobicContact CG-CD2 4.28Å; L557-L562 HydrophobicContact CD2-CD1 4.49Å; L557-L562 HydrophobicContact CD2-CD2 3.67Å; L557-L562 HydrophobicContact CD2-CG 3.86Å; L557-F603 HydrophobicContact CD2-CE1 4.22Å; L557-F603 HydrophobicContact CD2-CZ 3.75Å; L557-R642 HydrophobicContact CD2-CG 4.47Å; L557-L646 HydrophobicContact CD2-CD1 4.23Å
558	P	78.1	Confident	66.8	Low	84 Å²	84	59 Å²	59	55%	0.545	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-56.3	127.9	179.2	-25.9	34.8	0	0	0	111.1	G560 L561	P558-G560 VanDerWaalsContact C-N 3.27Å; P558-G560 PolarHBondContact O-N 3.11Å; P558-L561 VanDerWaalsContact O-CB 3.3Å; P558-L561 WeakPolarHBondContact O-CB 3.25Å; P558-L561 PolarHBondContact O-N 2.99Å
559	Y	81.6	Confident	68.8	Low	44 Å²	44	66.5 Å²	66.5	17%	0.173	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-38.9	-171.1	-167.2	-102.9	0	0	0	113	F528 L557 L561 L562 I563 L651 D656	F528-Y559 HydrophobicContact CD1-CD2 4.48Å; F528-Y559 HydrophobicContact CE1-CD2 4.42Å; L557-Y559 PolarHBondContact O-N 3.41Å; Y559-L561 PolarHBondContact O-N 3.01Å; Y559-L561 VanDerWaalsContact O-N 3.12Å; Y559-L562 HydrophobicContact CD2-CD1 4.4Å; Y559-L562 WeakPolarHBondContact O-CB 3.24Å; Y559-L562 PolarHBondContact O-N 3.16Å; Y559-I563 HydrophobicContact CD1-CD1 4.07Å; Y559-I563 HydrophobicContact CD1-CG1 4.45Å; Y559-I563 HydrophobicContact CD1-CG2 4.35Å; Y559-I563 HydrophobicContact CE1-CD1 4.06Å; Y559-I563 HydrophobicContact CE1-CG2 3.73Å; Y559-I563 PolarHBondContact O-N 3.24Å; Y559-L651 VanDerWaalsContact CE2-O 3.26Å; Y559-L651 WeakPolarHBondContact CE2-O 3.27Å; Y559-L651 PolarHBondContact OH-O 3.23Å; Y559-D656 PolarHBondContact OH-OD2 3.16Å; Y559-D656 VanDerWaalsContact OH-OD2 3.04Å
560	G	82.1	Confident	71.4	Confident	29 Å²	29	67.2 Å²	67.2	30%	0.299	41%	0.412	S	S	.	.	H	α-helix	trans	-53.8	-30.5	173.5	0	0	0	0	0	114.1	P558 L562 I563 N564	P558-G560 VanDerWaalsContact C-N 3.27Å; P558-G560 PolarHBondContact O-N 3.11Å; G560-L562 VanDerWaalsContact C-N 3.27Å; G560-L562 PolarHBondContact O-N 3.34Å; G560-I563 PolarHBondContact O-N 3.33Å; G560-N564 WeakPolarHBondContact O-CB 3.42Å; G560-N564 PolarHBondContact O-N 3.36Å; G560-N564 PolarHBondContact O-ND2 2.94Å; G560-N564 PolarHBondContact O-OD1 3.4Å
561	L	86.8	Confident	73.7	Confident	35 Å²	35	66.1 Å²	66.1	18%	0.183	39%	0.391	C	S	.	.	H	α-helix	trans	-73.4	-17.5	177.8	-172.2	59.7	0	0	0	113.2	L557 P558 Y559 F603 F604	L557-L561 HydrophobicContact CD1-CD2 3.88Å; L557-L561 HydrophobicContact CG-CD2 4.28Å; P558-L561 VanDerWaalsContact O-CB 3.3Å; P558-L561 WeakPolarHBondContact O-CB 3.25Å; P558-L561 PolarHBondContact O-N 2.99Å; Y559-L561 PolarHBondContact O-N 3.01Å; Y559-L561 VanDerWaalsContact O-N 3.12Å; L561-F603 WeakPolarHBondContact CD1-O 3.48Å; L561-F603 HydrophobicContact CG-CZ 4.39Å; L561-F603 WeakPolarHBondContact O-CE2 3.45Å; L561-F604 HydrophobicContact CD2-CD1 3.81Å; L561-F604 HydrophobicContact CD2-CE1 3.85Å
562	L	89.5	Confident	76.3	Confident	10 Å²	10	64.8 Å²	64.8	5%	0.052	37%	0.373	C	S	.	.	H	α-helix	trans	-82.3	-43.4	170.8	-67.6	170.8	0	0	0	111.6	L557 Y559 G560 F603 P621 G622 L646 L651 L652	L557-L562 HydrophobicContact CD2-CD1 4.49Å; L557-L562 HydrophobicContact CD2-CD2 3.67Å; L557-L562 HydrophobicContact CD2-CG 3.86Å; Y559-L562 HydrophobicContact CD2-CD1 4.4Å; Y559-L562 WeakPolarHBondContact O-CB 3.24Å; Y559-L562 PolarHBondContact O-N 3.16Å; G560-L562 VanDerWaalsContact C-N 3.27Å; G560-L562 PolarHBondContact O-N 3.34Å; L562-F603 HydrophobicContact CD2-CE2 4.28Å; L562-F603 HydrophobicContact CD2-CZ 4.11Å; L562-P621 HydrophobicContact CB-CG 4.45Å; L562-P621 HydrophobicContact CD2-CG 4.06Å; L562-P621 CarbonylContact O-C 3.44Å; L562-P621 VanDerWaalsContact O-CB 3.31Å; L562-P621 WeakPolarHBondContact O-CB 3.48Å; L562-P621 VanDerWaalsContact O-CG 3.3Å; L562-P621 WeakPolarHBondContact O-CG 3.11Å; L562-G622 WeakPolarHBondContact O-CA 3.34Å; L562-G622 PolarHBondContact O-N 2.82Å; L562-L646 HydrophobicContact CD1-CD1 4.48Å; L562-L646 HydrophobicContact CD2-CD1 3.86Å; L562-L651 HydrophobicContact CD1-CD1 4.46Å; L562-L652 HydrophobicContact CB-CD2 4.48Å
563	I	91.8	Very high	78.2	Confident	36 Å²	36	69.7 Å²	69.7	19%	0.185	39%	0.394	C	S	.	.	H	α-helix	trans	-90.1	-20.5	-172.7	61.5	170.7	0	0	0	114.3	Y559 G560 G622 V625 L652 D656	Y559-I563 HydrophobicContact CD1-CD1 4.07Å; Y559-I563 HydrophobicContact CD1-CG1 4.45Å; Y559-I563 HydrophobicContact CD1-CG2 4.35Å; Y559-I563 HydrophobicContact CE1-CD1 4.06Å; Y559-I563 HydrophobicContact CE1-CG2 3.73Å; Y559-I563 PolarHBondContact O-N 3.24Å; G560-I563 PolarHBondContact O-N 3.33Å; I563-G622 VanDerWaalsContact O-CA 3.26Å; I563-G622 WeakPolarHBondContact O-CA 3.49Å; I563-V625 HydrophobicContact CB-CG1 4.5Å; I563-L652 HydrophobicContact CG2-CD2 4.2Å; I563-D656 HydrophobicContact CG2-CB 4.19Å
564	N	90.1	Very high	80.5	Confident	85 Å²	85	68.7 Å²	68.7	46%	0.455	38%	0.384	S	S	.	.	S	Bend	trans	-71.4	138.5	-179.2	-74.9	-8.3	0	0	0	112	G560	G560-N564 WeakPolarHBondContact O-CB 3.42Å; G560-N564 PolarHBondContact O-N 3.36Å; G560-N564 PolarHBondContact O-ND2 2.94Å; G560-N564 PolarHBondContact O-OD1 3.4Å
565	P	89.4	Confident	82.9	Confident	51 Å²	51	63.7 Å²	63.7	33%	0.331	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-71.3	153.7	178.1	30.3	-34.5	0	0	0	111.7	Y541 T626	Y541-P565 PolarHBondContact OH-O 3.04Å; P565-T626 HydrophobicContact CB-CG2 4.06Å; P565-T626 HydrophobicContact CG-CG2 4.08Å
566	P	89.8	Confident	84.6	Confident	26 Å²	26	62.1 Å²	62.1	17%	0.169	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-61.5	151.8	-179.7	-23.3	35.3	0	0	0	114.1	Q568 L620 N623 L633	P566-Q568 PolarHBondContact O-N 3.01Å; P566-L620 HydrophobicContact CB-CD1 4.49Å; P566-L620 HydrophobicContact CG-CD1 3.74Å; P566-N623 WeakPolarHBondContact CD-OD1 3.29Å; P566-L633 HydrophobicContact CB-CD1 4.48Å; P566-L633 HydrophobicContact CG-CD1 3.9Å
567	I	89.3	Confident	85.9	Confident	17 Å²	17	62.9 Å²	62.9	9%	0.087	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-62.9	121.2	-179.9	-57.5	-168.1	0	0	0	111	Y541 K569 K571 R572 V575 F600 G605	Y541-I567 HydrophobicContact CD1-CD1 3.94Å; Y541-I567 HydrophobicContact CD1-CG1 4.36Å; Y541-I567 HydrophobicContact CD2-CD1 3.89Å; Y541-I567 HydrophobicContact CD2-CG1 4.04Å; Y541-I567 HydrophobicContact CE1-CD1 3.88Å; Y541-I567 HydrophobicContact CE1-CG1 3.82Å; Y541-I567 HydrophobicContact CE2-CD1 3.83Å; Y541-I567 HydrophobicContact CE2-CG1 3.45Å; Y541-I567 VanDerWaalsContact CE2-CG1 3.45Å; Y541-I567 HydrophobicContact CG-CD1 3.93Å; Y541-I567 HydrophobicContact CG-CG1 4.45Å; Y541-I567 WeakPolarHBondContact OH-CG1 3.3Å; I567-K569 PolarHBondContact O-N 2.98Å; I567-K571 HydrophobicContact CG2-CB 3.78Å; I567-R572 HydrophobicContact CB-CG 4.5Å; I567-R572 HydrophobicContact CG2-CG 3.94Å; I567-R572 VanDerWaalsContact O-CZ 3.27Å; I567-R572 PolarHBondContact O-NE 2.91Å; I567-R572 PolarHBondContact O-NH2 3.23Å; I567-V575 HydrophobicContact CD1-CG2 4.38Å; I567-F600 HydrophobicContact CB-CE1 4.4Å; I567-F600 HydrophobicContact CB-CZ 3.92Å; I567-F600 HydrophobicContact CD1-CZ 4.18Å; I567-F600 HydrophobicContact CG1-CZ 4.29Å; I567-F600 HydrophobicContact CG2-CZ 4.48Å; I567-G605 WeakPolarHBondContact CD1-O 3.41Å
568	Q	87.3	Confident	87	Confident	118 Å²	118	65.5 Å²	65.5	55%	0.551	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-49.3	135.7	171.7	-67.4	-177.5	-8.3	0	0	111.8	P566 S570 K571	P566-Q568 PolarHBondContact O-N 3.01Å; Q568-S570 PolarHBondContact O-N 3.35Å; Q568-K571 PolarHBondContact O-N 2.68Å
569	K	87.9	Confident	87.6	Confident	167 Å²	167	62.6 Å²	62.6	73%	0.726	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-33.6	-175.7	-71.9	175.5	176.7	174.1	0	113.9	I567	I567-K569 PolarHBondContact O-N 2.98Å
570	S	87.2	Confident	88.1	Confident	83 Å²	83	66 Å²	66	58%	0.58	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-49.5	174	48.1	0	0	0	0	113.5	Q568 R572	Q568-S570 PolarHBondContact O-N 3.35Å; S570-R572 VanDerWaalsContact C-N 3.28Å; S570-R572 PolarHBondContact O-N 3.09Å
571	K	86	Confident	88.6	Confident	105 Å²	105	66.4 Å²	66.4	46%	0.457	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-17.6	-174	-64	-170.7	176.9	-169.7	0	113.8	I567 Q568 K573	I567-K571 HydrophobicContact CG2-CB 3.78Å; Q568-K571 PolarHBondContact O-N 2.68Å; K571-K573 VanDerWaalsContact C-N 3.27Å; K571-K573 PolarHBondContact O-N 3.11Å
572	R	90.5	Very high	88.9	Confident	33 Å²	33	70.7 Å²	70.7	13%	0.125	37%	0.37	C	S	.	.	H	α-helix	trans	-64.5	-24.8	-173.5	-58.4	-178	-166.9	-177.5	3.5	114.4	I567 S570 G574 V575 F600 E602	I567-R572 HydrophobicContact CB-CG 4.5Å; I567-R572 HydrophobicContact CG2-CG 3.94Å; I567-R572 VanDerWaalsContact O-CZ 3.27Å; I567-R572 PolarHBondContact O-NE 2.91Å; I567-R572 PolarHBondContact O-NH2 3.23Å; S570-R572 VanDerWaalsContact C-N 3.28Å; S570-R572 PolarHBondContact O-N 3.09Å; R572-G574 VanDerWaalsContact C-N 3.28Å; R572-G574 PolarHBondContact O-N 2.88Å; R572-V575 WeakPolarHBondContact O-CB 3.34Å; R572-V575 PolarHBondContact O-N 3.19Å; R572-V575 VanDerWaalsContact O-N 3.1Å; R572-F600 HydrophobicContact CB-CD2 4.47Å; R572-F600 HydrophobicContact CB-CE2 4.21Å; R572-F600 HydrophobicContact CG-CD2 4.32Å; R572-F600 HydrophobicContact CG-CE1 4.15Å; R572-F600 HydrophobicContact CG-CE2 3.86Å; R572-F600 HydrophobicContact CG-CZ 3.76Å; R572-E602 IonicContact CZ-OE1 2.71Å; R572-E602 IonicContact CZ-OE2 3Å; R572-E602 IonicContact NE-OE2 2.71Å; R572-E602 VanDerWaalsContact NH1-CD 3.29Å; R572-E602 IonicContact NH1-OE1 3.54Å; R572-E602 PolarHBondContact NH1-OE1 3.41Å; R572-E602 IonicContact NH1-OE2 2.76Å; R572-E602 PolarHBondContact NH1-OE2 2.81Å; R572-E602 IonicContact NH2-OE1 3.08Å; R572-E602 PolarHBondContact NH2-OE1 3.28Å; R572-E602 IonicContact NH2-OE2 3.13Å; R572-E602 PolarHBondContact NH2-OE2 3.18Å
573	K	82.5	Confident	89.2	Confident	184 Å²	184	70.3 Å²	70.3	80%	0.8	37%	0.368	S	S	*	.	H	α-helix	trans	-56.9	-38.6	-177.5	-67.2	-175.2	179.3	-179.4	0	113	K571	K571-K573 VanDerWaalsContact C-N 3.27Å; K571-K573 PolarHBondContact O-N 3.11Å
574	G	85.9	Confident	89.3	Confident	45 Å²	45	69 Å²	69	46%	0.464	36%	0.363	S	S	.	.	H	α-helix	trans	-75.5	-24.6	178.8	0	0	0	0	0	114.5	R572 L576 V577 S578	R572-G574 VanDerWaalsContact C-N 3.28Å; R572-G574 PolarHBondContact O-N 2.88Å; G574-L576 VanDerWaalsContact C-N 3.33Å; G574-L576 PolarHBondContact O-N 2.92Å; G574-V577 WeakPolarHBondContact O-CB 3.37Å; G574-V577 PolarHBondContact O-N 3.49Å; G574-V577 VanDerWaalsContact O-N 3.13Å; G574-S578 PolarHBondContact O-N 3.31Å
575	V	90.1	Very high	89.5	Confident	21 Å²	21	65 Å²	65	13%	0.127	34%	0.342	C	S	.	.	H	α-helix	trans	-64.4	-35.6	-172.2	179.8	0	0	0	0	112.4	I567 R572 V577 S578 Q579 F600 G605 Y607	I567-V575 HydrophobicContact CD1-CG2 4.38Å; R572-V575 WeakPolarHBondContact O-CB 3.34Å; R572-V575 PolarHBondContact O-N 3.19Å; R572-V575 VanDerWaalsContact O-N 3.1Å; V575-V577 VanDerWaalsContact C-N 3.31Å; V575-V577 PolarHBondContact O-N 3.44Å; V575-S578 PolarHBondContact O-N 3.24Å; V575-S578 PolarHBondContact O-OG 3.4Å; V575-S578 VanDerWaalsContact O-OG 3.11Å; V575-Q579 WeakPolarHBondContact O-CB 3.36Å; V575-Q579 WeakPolarHBondContact O-CG 3.32Å; V575-Q579 PolarHBondContact O-N 3.32Å; V575-Q579 VanDerWaalsContact O-N 3.09Å; V575-F600 HydrophobicContact CG1-CE2 4.33Å; V575-G605 WeakPolarHBondContact CG1-O 3.32Å; V575-Y607 HydrophobicContact CB-CD2 4.34Å; V575-Y607 HydrophobicContact CB-CE2 4.35Å; V575-Y607 HydrophobicContact CG1-CD2 4.21Å
576	L	84.9	Confident	89.7	Confident	28 Å²	28	65.7 Å²	65.7	15%	0.147	35%	0.348	C	S	.	.	H	α-helix	trans	-68.7	-33.4	178.5	-174.1	57	0	0	0	112.2	G574 Q579 N581 L595 M598 Y607	G574-L576 VanDerWaalsContact C-N 3.33Å; G574-L576 PolarHBondContact O-N 2.92Å; L576-Q579 PolarHBondContact O-N 2.98Å; L576-N581 PolarHBondContact O-N 3.07Å; L576-L595 HydrophobicContact CD1-CD2 4.24Å; L576-L595 HydrophobicContact CD2-CB 4.1Å; L576-L595 HydrophobicContact CD2-CD1 4.3Å; L576-L595 HydrophobicContact CD2-CD2 4.12Å; L576-L595 HydrophobicContact CD2-CG 4.39Å; L576-L595 HydrophobicContact CG-CD2 4.41Å; L576-M598 HydrophobicContact CD1-CE 4.36Å; L576-M598 HydrophobicContact CD1-SD 3.58Å; L576-M598 VanDerWaalsContact CD1-SD 3.58Å; L576-Y607 HydrophobicContact CB-CD2 3.84Å; L576-Y607 HydrophobicContact CB-CE2 3.98Å; L576-Y607 HydrophobicContact CD1-CD2 4.24Å; L576-Y607 HydrophobicContact CD1-CG 4.12Å
577	V	85.8	Confident	89.9	Confident	105 Å²	105	65.9 Å²	65.9	64%	0.636	35%	0.354	S	S	*	.	H	α-helix	trans	-71.6	-45.8	175.9	-175.5	0	0	0	0	110.3	G574 V575 Q579 N580	G574-V577 WeakPolarHBondContact O-CB 3.37Å; G574-V577 PolarHBondContact O-N 3.49Å; G574-V577 VanDerWaalsContact O-N 3.13Å; V575-V577 VanDerWaalsContact C-N 3.31Å; V575-V577 PolarHBondContact O-N 3.44Å; V577-Q579 PolarHBondContact O-N 3.22Å; V577-N580 PolarHBondContact O-N 2.89Å
578	S	89.7	Confident	90.1	Very high	70 Å²	70	67.1 Å²	67.1	49%	0.49	37%	0.366	S	S	.	.	H	α-helix	trans	-65.8	-18.5	176.3	67.4	0	0	0	0	113.7	G574 V575 N580	G574-S578 PolarHBondContact O-N 3.31Å; V575-S578 PolarHBondContact O-N 3.24Å; V575-S578 PolarHBondContact O-OG 3.4Å; V575-S578 VanDerWaalsContact O-OG 3.11Å; S578-N580 VanDerWaalsContact C-N 3.32Å
579	Q	91.3	Very high	90.4	Very high	22 Å²	22	66.9 Å²	66.9	10%	0.103	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	2.3	168.9	-77.5	-177.4	-123.6	0	0	114.6	V575 L576 V577 N581 R582 Y607	V575-Q579 WeakPolarHBondContact O-CB 3.36Å; V575-Q579 WeakPolarHBondContact O-CG 3.32Å; V575-Q579 PolarHBondContact O-N 3.32Å; V575-Q579 VanDerWaalsContact O-N 3.09Å; L576-Q579 PolarHBondContact O-N 2.98Å; V577-Q579 PolarHBondContact O-N 3.22Å; Q579-N581 PolarHBondContact O-N 2.83Å; Q579-R582 PolarHBondContact NE2-O 3.13Å; Q579-R582 WeakPolarHBondContact O-CB 3.45Å; Q579-R582 PolarHBondContact O-N 3.19Å; Q579-Y607 PolarHBondContact NE2-O 3.44Å
580	N	92.7	Very high	90.5	Very high	116 Å²	116	60.3 Å²	60.3	62%	0.62	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	40	-176.3	-63.9	-39.1	0	0	0	112.9	V577 S578 R582	V577-N580 PolarHBondContact O-N 2.89Å; S578-N580 VanDerWaalsContact C-N 3.32Å; N580-R582 PolarHBondContact O-N 2.85Å
581	N	91.4	Very high	90.6	Very high	38 Å²	38	60.2 Å²	60.2	20%	0.203	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	22.5	-175.1	-66.7	-22.5	0	0	0	115.2	L576 Q579 F589 I590 L595	L576-N581 PolarHBondContact O-N 3.07Å; Q579-N581 PolarHBondContact O-N 2.83Å; N581-F589 HydrophobicContact CB-CD2 4.18Å; N581-F589 HydrophobicContact CB-CE2 3.82Å; N581-I590 PolarHBondContact O-N 3.32Å; N581-L595 HydrophobicContact CB-CD2 3.89Å
582	R	94.1	Very high	90.7	Very high	125 Å²	125	60.3 Å²	60.3	47%	0.472	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-99.2	141.6	178.7	-66.5	174.5	179.5	-84.7	-0.1	112.6	Q579 N580 A584 G587 A588 F589	Q579-R582 PolarHBondContact NE2-O 3.13Å; Q579-R582 WeakPolarHBondContact O-CB 3.45Å; Q579-R582 PolarHBondContact O-N 3.19Å; N580-R582 PolarHBondContact O-N 2.85Å; R582-A584 PolarHBondContact O-N 3.43Å; R582-G587 WeakPolarHBondContact CG-O 3.1Å; R582-G587 PolarHBondContact NH1-O 3.33Å; R582-A588 WeakPolarHBondContact CA-O 3.32Å; R582-F589 HydrophobicContact CG-CB 4.31Å; R582-F589 HydrophobicContact CG-CD2 4.43Å
583	C	95.4	Very high	90.6	Very high	1 Å²	1	66.9 Å²	66.9	1%	0.007	36%	0.361	C	S	.	.			trans	-59.8	122.4	166.7	176.4	0	0	0	0	109.9	G585 G587 A588 M598 C609	C583-G585 PolarHBondContact O-N 3.1Å; C583-G585 PolarHBondContact SG-N 3.02Å; C583-G587 WeakPolarHBondContact O-CA 3.47Å; C583-G587 PolarHBondContact O-N 3.41Å; C583-A588 PolarHBondContact N-O 3.21Å; C583-M598 HydrophobicContact CB-CE 4.26Å; C583-C609 HydrophobicContact CB-CB 4.08Å; C583-C609 PolarHBondContact SG-N 3.14Å; C583-C609 VanDerWaalsContact SG-SG 3.61Å
584	A	94.6	Very high	90.9	Very high	9 Å²	9	62.7 Å²	62.7	7%	0.074	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-38.7	177.9	0	0	0	0	0	112.3	L548 R582 R606 Y607 F608	L548-A584 VanDerWaalsContact CB-O 3.27Å; L548-A584 WeakPolarHBondContact CB-O 3.43Å; L548-A584 PolarHBondContact N-O 3.1Å; R582-A584 PolarHBondContact O-N 3.43Å; A584-R606 HydrophobicContact CB-CB 3.92Å; A584-Y607 WeakPolarHBondContact CB-O 3.37Å; A584-Y607 PolarHBondContact N-O 3.21Å; A584-F608 HydrophobicContact CB-CD1 4.32Å; A584-F608 HydrophobicContact CB-CD2 4.31Å; A584-F608 HydrophobicContact CB-CE1 3.97Å; A584-F608 HydrophobicContact CB-CE2 3.92Å; A584-F608 HydrophobicContact CB-CG 4.49Å; A584-F608 HydrophobicContact CB-CZ 3.75Å
585	G	93.4	Very high	91	Very high	2 Å²	2	61.9 Å²	61.9	2%	0.021	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-55	-177	0	0	0	0	0	115.1	L548 C583 F608	L548-G585 CarbonylContact C-O 3.59Å; C583-G585 PolarHBondContact O-N 3.1Å; C583-G585 PolarHBondContact SG-N 3.02Å; G585-F608 VanDerWaalsContact N-CE1 3.3Å
586	C	94.4	Very high	90.9	Very high	65 Å²	65	71 Å²	71	44%	0.439	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	3.3	-172.6	62.9	0	0	0	0	114.8	A588	C586-A588 PolarHBondContact O-N 3.13Å
587	G	93	Very high	91.1	Very high	29 Å²	29	78 Å²	78	30%	0.299	39%	0.388	S	S	.	.			trans	68.8	-9.2	-179.7	0	0	0	0	0	115.8	R582 C583 F589	R582-G587 WeakPolarHBondContact CG-O 3.1Å; R582-G587 PolarHBondContact NH1-O 3.33Å; C583-G587 WeakPolarHBondContact O-CA 3.47Å; C583-G587 PolarHBondContact O-N 3.41Å; G587-F589 PolarHBondContact O-N 3.27Å
588	A	92.9	Very high	91.4	Very high	43 Å²	43	73.8 Å²	73.8	36%	0.355	36%	0.362	S	S	.	.			trans	-57.1	128	-179.9	0	0	0	0	0	111.3	R582 C583 C586	R582-A588 WeakPolarHBondContact CA-O 3.32Å; C583-A588 PolarHBondContact N-O 3.21Å; C586-A588 PolarHBondContact O-N 3.13Å
589	F	94	Very high	91.6	Very high	113 Å²	113	74.5 Å²	74.5	50%	0.496	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-71.4	134.9	172.8	177.3	-98.3	0	0	0	110	N581 R582 G587 E591	N581-F589 HydrophobicContact CB-CD2 4.18Å; N581-F589 HydrophobicContact CB-CE2 3.82Å; R582-F589 HydrophobicContact CG-CB 4.31Å; R582-F589 HydrophobicContact CG-CD2 4.43Å; G587-F589 PolarHBondContact O-N 3.27Å; F589-E591 HydrophobicContact CE1-CG 4.45Å
590	I	90.8	Very high	91.9	Very high	29 Å²	29	74.4 Å²	74.4	15%	0.149	35%	0.353	C	S	.	.			trans	-111.5	116.9	178.9	-53.3	-57.7	0	0	0	107.9	N581 L595 M598 C609	N581-I590 PolarHBondContact O-N 3.32Å; I590-L595 HydrophobicContact CB-CD2 4.03Å; I590-L595 HydrophobicContact CG2-CD2 4.01Å; I590-L595 WeakPolarHBondContact O-CD2 3.39Å; I590-M598 HydrophobicContact CB-CG 4.44Å; I590-M598 HydrophobicContact CB-SD 3.88Å; I590-M598 HydrophobicContact CG1-CE 3.96Å; I590-M598 HydrophobicContact CG1-CG 4.19Å; I590-M598 HydrophobicContact CG1-SD 3.67Å; I590-M598 HydrophobicContact CG2-CG 4.11Å; I590-M598 HydrophobicContact CG2-SD 4.15Å; I590-C609 HydrophobicContact CD1-CB 4.14Å
591	E	88.7	Confident	92	Very high	81 Å²	81	68.9 Å²	68.9	38%	0.379	32%	0.324	S	S	.	.			trans	-58.4	149.5	177.3	-57.5	171.8	140.2	0	0	111.7	F589 R593 Y594 L595	F589-E591 HydrophobicContact CE1-CG 4.45Å; E591-R593 HydrophobicContact CB-CG 4.17Å; E591-R593 VanDerWaalsContact CD-NH2 3.27Å; E591-R593 PolarHBondContact O-N 3.2Å; E591-R593 IonicContact OE1-CZ 3.28Å; E591-R593 IonicContact OE1-NH2 3.12Å; E591-R593 PolarHBondContact OE1-NH2 2.98Å; E591-R593 IonicContact OE2-CZ 3.08Å; E591-R593 IonicContact OE2-NE 2.67Å; E591-R593 PolarHBondContact OE2-NE 3.42Å; E591-R593 IonicContact OE2-NH2 3.93Å; E591-R593 PolarHBondContact OE2-NH2 3.22Å; E591-Y594 HydrophobicContact CB-CD2 4.28Å; E591-Y594 PolarHBondContact O-N 3.45Å; E591-Y594 WeakPolarHBondContact OE2-CD2 3.26Å; E591-Y594 WeakPolarHBondContact OE2-CE2 3.36Å; E591-L595 PolarHBondContact O-N 2.89Å
592	T	88	Confident	92.3	Very high	108 Å²	108	67.8 Å²	67.8	66%	0.663	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-50.2	-38.9	-175.2	-43.6	0	0	0	0	113.5	Y594 L595	T592-Y594 PolarHBondContact O-N 2.83Å; T592-L595 HydrophobicContact CG2-CD1 4.14Å; T592-L595 PolarHBondContact O-N 2.93Å
593	R	88.6	Confident	92.3	Very high	171 Å²	171	62.4 Å²	62.4	65%	0.645	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-62.4	-23.5	177.2	60.7	179.2	171.3	-171	-7	114.6	E591	E591-R593 HydrophobicContact CB-CG 4.17Å; E591-R593 VanDerWaalsContact CD-NH2 3.27Å; E591-R593 PolarHBondContact O-N 3.2Å; E591-R593 IonicContact OE1-CZ 3.28Å; E591-R593 IonicContact OE1-NH2 3.12Å; E591-R593 PolarHBondContact OE1-NH2 2.98Å; E591-R593 IonicContact OE2-CZ 3.08Å; E591-R593 IonicContact OE2-NE 2.67Å; E591-R593 PolarHBondContact OE2-NE 3.42Å; E591-R593 IonicContact OE2-NH2 3.93Å; E591-R593 PolarHBondContact OE2-NH2 3.22Å
594	Y	88.9	Confident	92.2	Very high	95 Å²	95	63.6 Å²	63.6	37%	0.373	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-107	-2.9	-178.1	-59.6	-49.6	0	0	0	114.3	E591 T592 K596 R597	E591-Y594 HydrophobicContact CB-CD2 4.28Å; E591-Y594 PolarHBondContact O-N 3.45Å; E591-Y594 WeakPolarHBondContact OE2-CD2 3.26Å; E591-Y594 WeakPolarHBondContact OE2-CE2 3.36Å; T592-Y594 PolarHBondContact O-N 2.83Å; Y594-K596 PolarHBondContact O-N 3.35Å; Y594-K596 VanDerWaalsContact O-N 3.17Å; Y594-R597 WeakPolarHBondContact O-CB 3.4Å; Y594-R597 PolarHBondContact O-N 3.03Å
595	L	88	Confident	92.2	Very high	29 Å²	29	63.2 Å²	63.2	15%	0.152	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-55.7	-34.4	178.3	-66.5	178	0	0	0	113.2	L576 N581 I590 E591 T592 R597 M598	L576-L595 HydrophobicContact CD1-CD2 4.24Å; L576-L595 HydrophobicContact CD2-CB 4.1Å; L576-L595 HydrophobicContact CD2-CD1 4.3Å; L576-L595 HydrophobicContact CD2-CD2 4.12Å; L576-L595 HydrophobicContact CD2-CG 4.39Å; L576-L595 HydrophobicContact CG-CD2 4.41Å; N581-L595 HydrophobicContact CB-CD2 3.89Å; I590-L595 HydrophobicContact CB-CD2 4.03Å; I590-L595 HydrophobicContact CG2-CD2 4.01Å; I590-L595 WeakPolarHBondContact O-CD2 3.39Å; E591-L595 PolarHBondContact O-N 2.89Å; T592-L595 HydrophobicContact CG2-CD1 4.14Å; T592-L595 PolarHBondContact O-N 2.93Å; L595-R597 PolarHBondContact O-N 3.25Å; L595-M598 HydrophobicContact CD2-SD 3.97Å; L595-M598 WeakPolarHBondContact O-CB 3.22Å; L595-M598 PolarHBondContact O-N 3.32Å
596	K	87.4	Confident	92.3	Very high	211 Å²	211	65.4 Å²	65.4	92%	0.917	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-59.7	-15.4	173.7	-65.3	-173.9	179.9	-178.3	0	114.2	Y594	Y594-K596 PolarHBondContact O-N 3.35Å; Y594-K596 VanDerWaalsContact O-N 3.17Å
597	R	90.2	Very high	92.4	Very high	176 Å²	176	64.5 Å²	64.5	66%	0.664	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-95.5	-4.1	176.3	-61.1	180	173	179.2	-4.4	113.3	Y594 L595	Y594-R597 WeakPolarHBondContact O-CB 3.4Å; Y594-R597 PolarHBondContact O-N 3.03Å; L595-R597 PolarHBondContact O-N 3.25Å
598	M	92	Very high	92.5	Very high	17 Å²	17	63.1 Å²	63.1	8%	0.084	28%	0.281	C	S	.	.			trans	-73.9	145	173.9	-64.9	-165.8	77.7	0	0	111	L576 C583 I590 L595 Y607 F608	L576-M598 HydrophobicContact CD1-CE 4.36Å; L576-M598 HydrophobicContact CD1-SD 3.58Å; L576-M598 VanDerWaalsContact CD1-SD 3.58Å; C583-M598 HydrophobicContact CB-CE 4.26Å; I590-M598 HydrophobicContact CB-CG 4.44Å; I590-M598 HydrophobicContact CB-SD 3.88Å; I590-M598 HydrophobicContact CG1-CE 3.96Å; I590-M598 HydrophobicContact CG1-CG 4.19Å; I590-M598 HydrophobicContact CG1-SD 3.67Å; I590-M598 HydrophobicContact CG2-CG 4.11Å; I590-M598 HydrophobicContact CG2-SD 4.15Å; L595-M598 HydrophobicContact CD2-SD 3.97Å; L595-M598 WeakPolarHBondContact O-CB 3.22Å; L595-M598 PolarHBondContact O-N 3.32Å; M598-Y607 HydrophobicContact CB-CD1 4.01Å; M598-F608 CarbonylContact C-O 3.6Å; M598-F608 WeakPolarHBondContact CA-O 3.47Å
599	R	94.7	Very high	92.6	Very high	84 Å²	84	61.8 Å²	61.8	32%	0.317	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	135.4	-173.3	-67	159.1	169.4	179.3	-3	109.3	Y607 F608 C610 H613 N615	R599-Y607 WeakPolarHBondContact O-CA 3.22Å; R599-F608 PolarHBondContact N-O 2.89Å; R599-F608 PolarHBondContact O-N 3.06Å; R599-C610 PolarHBondContact NH1-O 3.2Å; R599-H613 HydrophobicContact CB-CB 3.99Å; R599-H613 WeakPolarHBondContact CB-ND1 3.3Å; R599-H613 WeakPolarHBondContact CD-O 3.41Å; R599-H613 PolarHBondContact NH1-O 2.88Å; R599-N615 WeakPolarHBondContact CD-OD1 3.3Å; R599-N615 WeakPolarHBondContact CG-OD1 3.43Å; R599-N615 PolarHBondContact NE-OD1 2.93Å
600	F	95.6	Very high	92.6	Very high	20 Å²	20	59.7 Å²	59.7	9%	0.088	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	119.8	-176.6	-172.9	-94.5	0	0	0	110.4	I567 R572 V575 E602 G605 Y607 H613	I567-F600 HydrophobicContact CB-CE1 4.4Å; I567-F600 HydrophobicContact CB-CZ 3.92Å; I567-F600 HydrophobicContact CD1-CZ 4.18Å; I567-F600 HydrophobicContact CG1-CZ 4.29Å; I567-F600 HydrophobicContact CG2-CZ 4.48Å; R572-F600 HydrophobicContact CB-CD2 4.47Å; R572-F600 HydrophobicContact CB-CE2 4.21Å; R572-F600 HydrophobicContact CG-CD2 4.32Å; R572-F600 HydrophobicContact CG-CE1 4.15Å; R572-F600 HydrophobicContact CG-CE2 3.86Å; R572-F600 HydrophobicContact CG-CZ 3.76Å; V575-F600 HydrophobicContact CG1-CE2 4.33Å; F600-E602 HydrophobicContact CD1-CG 4.43Å; F600-E602 WeakPolarHBondContact CE1-OE2 3.3Å; F600-E602 PolarHBondContact O-N 3.3Å; F600-G605 VanDerWaalsContact CZ-C 3.45Å; F600-Y607 HydrophobicContact CB-CD1 4.14Å; F600-Y607 HydrophobicContact CB-CE1 3.86Å; F600-Y607 HydrophobicContact CD2-CD1 4.32Å; F600-Y607 AromaticContact CD2-CD2 3.83Å; F600-Y607 HydrophobicContact CD2-CD2 3.83Å; F600-Y607 HydrophobicContact CD2-CE1 4.15Å; F600-Y607 AromaticContact CD2-CE2 3.63Å; F600-Y607 HydrophobicContact CD2-CE2 3.63Å; F600-Y607 HydrophobicContact CD2-CG 4.17Å; F600-Y607 AromaticContact CD2-CZ 3.8Å; F600-Y607 HydrophobicContact CE2-CD2 4.41Å; F600-Y607 HydrophobicContact CE2-CE2 4.23Å; F600-H613 PolarHBondContact O-NE2 3.5Å
601	C	96.6	Very high	92.7	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	113.6	174	177	0	0	0	0	109.7	F603 F604 G605 R606 F608 H613 S636 A639	C601-F603 VanDerWaalsContact C-N 3.27Å; C601-F603 PolarHBondContact O-N 3.49Å; C601-F604 HydrophobicContact CB-CB 4.43Å; C601-F604 PolarHBondContact O-N 3.12Å; C601-G605 WeakPolarHBondContact O-CA 3.38Å; C601-G605 PolarHBondContact O-N 3.09Å; C601-R606 PolarHBondContact N-O 3.35Å; C601-F608 HydrophobicContact CB-CD2 3.61Å; C601-F608 HydrophobicContact CB-CE2 3.47Å; C601-F608 VanDerWaalsContact CB-CE2 3.47Å; C601-F608 HydrophobicContact CB-CZ 4.49Å; C601-H613 WeakPolarHBondContact CA-NE2 3.31Å; C601-H613 PolarHBondContact N-NE2 3.09Å; C601-S636 PolarHBondContact SG-N 3.48Å; C601-A639 VanDerWaalsContact SG-CB 3.59Å
602	E	96.1	Very high	93	Very high	16 Å²	16	60.5 Å²	60.5	8%	0.075	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-31.6	-176.2	-63.2	-76.8	-161.7	0	0	112.6	R572 F600 L620 L633 S634	R572-E602 IonicContact CZ-OE1 2.71Å; R572-E602 IonicContact CZ-OE2 3Å; R572-E602 IonicContact NE-OE2 2.71Å; R572-E602 VanDerWaalsContact NH1-CD 3.29Å; R572-E602 IonicContact NH1-OE1 3.54Å; R572-E602 PolarHBondContact NH1-OE1 3.41Å; R572-E602 IonicContact NH1-OE2 2.76Å; R572-E602 PolarHBondContact NH1-OE2 2.81Å; R572-E602 IonicContact NH2-OE1 3.08Å; R572-E602 PolarHBondContact NH2-OE1 3.28Å; R572-E602 IonicContact NH2-OE2 3.13Å; R572-E602 PolarHBondContact NH2-OE2 3.18Å; F600-E602 HydrophobicContact CD1-CG 4.43Å; F600-E602 WeakPolarHBondContact CE1-OE2 3.3Å; F600-E602 PolarHBondContact O-N 3.3Å; E602-L620 HydrophobicContact CB-CD1 3.69Å; E602-L633 HydrophobicContact CB-CB 3.91Å; E602-L633 HydrophobicContact CG-CB 3.96Å; E602-S634 WeakPolarHBondContact CB-O 3.34Å; E602-S634 WeakPolarHBondContact CG-O 3.49Å; E602-S634 PolarHBondContact N-O 2.67Å
603	F	95.6	Very high	93.5	Very high	11 Å²	11	55.4 Å²	55.4	5%	0.048	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-52.5	176.5	-176.5	-116.4	0	0	0	113.5	L557 L561 L562 C601 G605 L620 P621 V635 A639 L643	L557-F603 HydrophobicContact CD2-CE1 4.22Å; L557-F603 HydrophobicContact CD2-CZ 3.75Å; L561-F603 WeakPolarHBondContact CD1-O 3.48Å; L561-F603 HydrophobicContact CG-CZ 4.39Å; L561-F603 WeakPolarHBondContact O-CE2 3.45Å; L562-F603 HydrophobicContact CD2-CE2 4.28Å; L562-F603 HydrophobicContact CD2-CZ 4.11Å; C601-F603 VanDerWaalsContact C-N 3.27Å; C601-F603 PolarHBondContact O-N 3.49Å; F603-G605 VanDerWaalsContact C-N 3.31Å; F603-G605 PolarHBondContact O-N 3.45Å; F603-L620 HydrophobicContact CB-CD1 4.44Å; F603-L620 HydrophobicContact CB-CD2 3.94Å; F603-L620 HydrophobicContact CD2-CD2 4.13Å; F603-L620 HydrophobicContact CG-CD2 4.42Å; F603-P621 HydrophobicContact CE2-CG 4.33Å; F603-V635 HydrophobicContact CB-CG1 3.92Å; F603-A639 HydrophobicContact CB-CB 3.99Å; F603-A639 HydrophobicContact CD1-CB 3.65Å; F603-A639 HydrophobicContact CG-CB 4.21Å; F603-L643 HydrophobicContact CB-CD1 4.5Å; F603-L643 HydrophobicContact CD2-CD1 4.28Å; F603-L643 HydrophobicContact CD2-CD2 4.13Å; F603-L643 HydrophobicContact CD2-CG 4.49Å; F603-L643 HydrophobicContact CE2-CD2 3.77Å; F603-L643 HydrophobicContact CE2-CG 4.4Å; F603-L643 HydrophobicContact CG-CD1 4.23Å; F603-L643 HydrophobicContact CZ-CD2 4.02Å; F603-L643 HydrophobicContact CZ-CG 4.39Å
604	F	93.4	Very high	93.8	Very high	26 Å²	26	50 Å²	50	11%	0.114	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-11.2	-179.1	-75.9	-60.1	0	0	0	113.8	L561 C601 R606 F608 F638 A639	L561-F604 HydrophobicContact CD2-CD1 3.81Å; L561-F604 HydrophobicContact CD2-CE1 3.85Å; C601-F604 HydrophobicContact CB-CB 4.43Å; C601-F604 PolarHBondContact O-N 3.12Å; F604-R606 PolarHBondContact O-N 2.83Å; F604-F608 HydrophobicContact CB-CE2 4.2Å; F604-F608 HydrophobicContact CB-CZ 4.36Å; F604-F608 HydrophobicContact CD2-CE2 4.2Å; F604-F608 AromaticContact CD2-CZ 3.74Å; F604-F608 HydrophobicContact CD2-CZ 3.74Å; F604-F608 HydrophobicContact CE2-CZ 4.43Å; F604-F608 HydrophobicContact CG-CZ 4.33Å; F604-F638 HydrophobicContact CE2-CB 4.01Å; F604-A639 HydrophobicContact CD2-CB 3.77Å; F604-A639 HydrophobicContact CE2-CB 3.6Å
605	G	94.5	Very high	94	Very high	2 Å²	2	49 Å²	49	2%	0.021	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	24.1	-175.2	0	0	0	0	0	113.9	I567 V575 F600 C601 F603	I567-G605 WeakPolarHBondContact CD1-O 3.41Å; V575-G605 WeakPolarHBondContact CG1-O 3.32Å; F600-G605 VanDerWaalsContact CZ-C 3.45Å; C601-G605 WeakPolarHBondContact O-CA 3.38Å; C601-G605 PolarHBondContact O-N 3.09Å; F603-G605 VanDerWaalsContact C-N 3.31Å; F603-G605 PolarHBondContact O-N 3.45Å
606	R	95.1	Very high	94.4	Very high	48 Å²	48	49.4 Å²	49.4	18%	0.181	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	155.2	-171.5	-71.9	-174.9	-177.7	-162.3	1	112.3	P542 S544 L546 A584 C601 F604 F608	P542-R606 PolarHBondContact O-NH2 3.46Å; S544-R606 PolarHBondContact O-NH2 2.85Å; L546-R606 PolarHBondContact O-NH1 3.44Å; A584-R606 HydrophobicContact CB-CB 3.92Å; C601-R606 PolarHBondContact N-O 3.35Å; F604-R606 PolarHBondContact O-N 2.83Å; R606-F608 HydrophobicContact CB-CE2 4.24Å; R606-F608 VanDerWaalsContact O-CD2 3.29Å; R606-F608 WeakPolarHBondContact O-CD2 3.46Å; R606-F608 WeakPolarHBondContact O-CE2 3.24Å
607	Y	95.4	Very high	94.9	Very high	45 Å²	45	43.5 Å²	43.5	18%	0.176	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	139.8	176.4	-79	-83.2	0	0	0	113.3	V575 L576 Q579 A584 M598 R599 F600	V575-Y607 HydrophobicContact CB-CD2 4.34Å; V575-Y607 HydrophobicContact CB-CE2 4.35Å; V575-Y607 HydrophobicContact CG1-CD2 4.21Å; L576-Y607 HydrophobicContact CB-CD2 3.84Å; L576-Y607 HydrophobicContact CB-CE2 3.98Å; L576-Y607 HydrophobicContact CD1-CD2 4.24Å; L576-Y607 HydrophobicContact CD1-CG 4.12Å; Q579-Y607 PolarHBondContact NE2-O 3.44Å; A584-Y607 WeakPolarHBondContact CB-O 3.37Å; A584-Y607 PolarHBondContact N-O 3.21Å; M598-Y607 HydrophobicContact CB-CD1 4.01Å; R599-Y607 WeakPolarHBondContact O-CA 3.22Å; F600-Y607 HydrophobicContact CB-CD1 4.14Å; F600-Y607 HydrophobicContact CB-CE1 3.86Å; F600-Y607 HydrophobicContact CD2-CD1 4.32Å; F600-Y607 AromaticContact CD2-CD2 3.83Å; F600-Y607 HydrophobicContact CD2-CD2 3.83Å; F600-Y607 HydrophobicContact CD2-CE1 4.15Å; F600-Y607 AromaticContact CD2-CE2 3.63Å; F600-Y607 HydrophobicContact CD2-CE2 3.63Å; F600-Y607 HydrophobicContact CD2-CG 4.17Å; F600-Y607 AromaticContact CD2-CZ 3.8Å; F600-Y607 HydrophobicContact CE2-CD2 4.41Å; F600-Y607 HydrophobicContact CE2-CE2 4.23Å
608	F	96.1	Very high	95.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	156.1	179.5	-69.5	-103.9	0	0	0	110.5	L548 A584 G585 M598 R599 C601 F604 R606 C612 H613 F638	L548-F608 HydrophobicContact CD2-CE1 3.9Å; L548-F608 HydrophobicContact CD2-CZ 3.86Å; A584-F608 HydrophobicContact CB-CD1 4.32Å; A584-F608 HydrophobicContact CB-CD2 4.31Å; A584-F608 HydrophobicContact CB-CE1 3.97Å; A584-F608 HydrophobicContact CB-CE2 3.92Å; A584-F608 HydrophobicContact CB-CG 4.49Å; A584-F608 HydrophobicContact CB-CZ 3.75Å; G585-F608 VanDerWaalsContact N-CE1 3.3Å; M598-F608 CarbonylContact C-O 3.6Å; M598-F608 WeakPolarHBondContact CA-O 3.47Å; R599-F608 PolarHBondContact N-O 2.89Å; R599-F608 PolarHBondContact O-N 3.06Å; C601-F608 HydrophobicContact CB-CD2 3.61Å; C601-F608 HydrophobicContact CB-CE2 3.47Å; C601-F608 VanDerWaalsContact CB-CE2 3.47Å; C601-F608 HydrophobicContact CB-CZ 4.49Å; F604-F608 HydrophobicContact CB-CE2 4.2Å; F604-F608 HydrophobicContact CB-CZ 4.36Å; F604-F608 HydrophobicContact CD2-CE2 4.2Å; F604-F608 AromaticContact CD2-CZ 3.74Å; F604-F608 HydrophobicContact CD2-CZ 3.74Å; F604-F608 HydrophobicContact CE2-CZ 4.43Å; F604-F608 HydrophobicContact CG-CZ 4.33Å; R606-F608 HydrophobicContact CB-CE2 4.24Å; R606-F608 VanDerWaalsContact O-CD2 3.29Å; R606-F608 WeakPolarHBondContact O-CD2 3.46Å; R606-F608 WeakPolarHBondContact O-CE2 3.24Å; F608-C612 HydrophobicContact CB-CB 4.19Å; F608-C612 HydrophobicContact CD1-CB 3.88Å; F608-H613 HydrophobicContact CB-CB 3.79Å; F608-F638 HydrophobicContact CD1-CD2 4.32Å; F608-F638 HydrophobicContact CD1-CE2 4.46Å; F608-F638 AromaticContact CE1-CD2 3.86Å; F608-F638 HydrophobicContact CE1-CD2 3.86Å; F608-F638 HydrophobicContact CE1-CE2 4.26Å
609	C	94.7	Very high	95.4	Very high	16 Å²	16	35.8 Å²	35.8	11%	0.108	19%	0.191	C	C	.	.			trans	-73.8	166.9	171	70.9	0	0	0	0	111.5	C583 I590 V611 C612 H613	C583-C609 HydrophobicContact CB-CB 4.08Å; C583-C609 PolarHBondContact SG-N 3.14Å; C583-C609 VanDerWaalsContact SG-SG 3.61Å; I590-C609 HydrophobicContact CD1-CB 4.14Å; C609-V611 PolarHBondContact O-N 3.13Å; C609-C612 PolarHBondContact O-N 3.18Å; C609-C612 VanDerWaalsContact SG-SG 3.64Å; C609-H613 PolarHBondContact O-N 2.95Å
610	C	93.7	Very high	95.5	Very high	68 Å²	68	32 Å²	32	46%	0.459	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.9	-178.8	53.8	0	0	0	0	114.7	R599	R599-C610 PolarHBondContact NH1-O 3.2Å
611	V	93.8	Very high	95.6	Very high	115 Å²	115	31.2 Å²	31.2	70%	0.697	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-46.1	177	-178	0	0	0	0	111.3	C609 H613 N637	C609-V611 PolarHBondContact O-N 3.13Å; V611-H613 PolarHBondContact O-N 3.2Å; V611-N637 PolarHBondContact O-ND2 3.44Å
612	C	95.7	Very high	95.5	Very high	13 Å²	13	31.3 Å²	31.3	9%	0.088	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-6.1	-178.6	-66.7	0	0	0	0	114.3	F608 C609 S636 N637 F638	F608-C612 HydrophobicContact CB-CB 4.19Å; F608-C612 HydrophobicContact CD1-CB 3.88Å; C609-C612 PolarHBondContact O-N 3.18Å; C609-C612 VanDerWaalsContact SG-SG 3.64Å; C612-S636 WeakPolarHBondContact O-CB 3.38Å; C612-N637 PolarHBondContact O-N 2.85Å; C612-N637 PolarHBondContact O-OD1 3.47Å; C612-F638 HydrophobicContact CB-CE2 3.91Å
613	H	97.2	Very high	95.5	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	18%	0.175	C	C	.	.			trans	-146.2	92.7	-171.1	-167.4	-64.2	0	0	0	110.8	R599 F600 C601 F608 C609 V611 N615 V635 S636 N637	R599-H613 HydrophobicContact CB-CB 3.99Å; R599-H613 WeakPolarHBondContact CB-ND1 3.3Å; R599-H613 WeakPolarHBondContact CD-O 3.41Å; R599-H613 PolarHBondContact NH1-O 2.88Å; F600-H613 PolarHBondContact O-NE2 3.5Å; C601-H613 WeakPolarHBondContact CA-NE2 3.31Å; C601-H613 PolarHBondContact N-NE2 3.09Å; F608-H613 HydrophobicContact CB-CB 3.79Å; C609-H613 PolarHBondContact O-N 2.95Å; V611-H613 PolarHBondContact O-N 3.2Å; H613-N615 PolarHBondContact CE1-OD1 2.91Å; H613-N615 PolarHBondContact ND1-N 3.29Å; H613-N615 PolarHBondContact ND1-OD1 2.86Å; H613-N615 PolarHBondContact O-N 3.46Å; H613-N615 VanDerWaalsContact O-N 3.14Å; H613-V635 PolarHBondContact CE1-O 2.93Å; H613-V635 PolarHBondContact NE2-O 3.46Å; H613-S636 VanDerWaalsContact CD2-CA 3.42Å; H613-S636 WeakPolarHBondContact CD2-CA 3.16Å; H613-S636 PolarHBondContact CD2-N 3.47Å; H613-S636 VanDerWaalsContact CD2-N 3.29Å; H613-S636 PolarHBondContact NE2-N 2.98Å; H613-N637 WeakPolarHBondContact CA-OD1 3.18Å
614	S	94.6	Very high	95.5	Very high	58 Å²	58	30.6 Å²	30.6	41%	0.406	17%	0.173	S	C	.	.			trans	-75.4	9.1	-179.7	57.2	0	0	0	0	114.9	T616 N637 R640	S614-T616 PolarHBondContact O-N 3.32Å; S614-T616 PolarHBondContact OG-OG1 2.84Å; S614-N637 PolarHBondContact N-OD1 2.79Å; S614-N637 PolarHBondContact OG-OD1 3.15Å; S614-R640 PolarHBondContact OG-NH1 3.31Å
615	N	94.7	Very high	95.6	Very high	73 Å²	73	29.5 Å²	29.5	39%	0.39	17%	0.168	S	C	.	.			trans	58.5	26.2	-170.5	-73	-0.3	0	0	0	113.8	R599 H613 L617 S634	R599-N615 WeakPolarHBondContact CD-OD1 3.3Å; R599-N615 WeakPolarHBondContact CG-OD1 3.43Å; R599-N615 PolarHBondContact NE-OD1 2.93Å; H613-N615 PolarHBondContact CE1-OD1 2.91Å; H613-N615 PolarHBondContact ND1-N 3.29Å; H613-N615 PolarHBondContact ND1-OD1 2.86Å; H613-N615 PolarHBondContact O-N 3.46Å; H613-N615 VanDerWaalsContact O-N 3.14Å; N615-L617 PolarHBondContact O-N 2.43Å; N615-S634 WeakPolarHBondContact CA-OG 3.32Å
616	T	96	Very high	95.6	Very high	37 Å²	37	31.3 Å²	31.3	23%	0.227	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	134.7	171.8	-56.9	0	0	0	0	109.5	S614 V635 R640	S614-T616 PolarHBondContact O-N 3.32Å; S614-T616 PolarHBondContact OG-OG1 2.84Å; T616-V635 VanDerWaalsContact O-CG2 3.29Å; T616-V635 WeakPolarHBondContact O-CG2 3.45Å; T616-V635 PolarHBondContact O-N 3.13Å; T616-R640 HydrophobicContact CG2-CG 3.9Å
617	L	97.5	Very high	95.6	Very high	87 Å²	87	32.3 Å²	32.3	46%	0.455	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	142.2	176.2	-50.5	-178.7	0	0	0	109.8	N615 M632 L633	N615-L617 PolarHBondContact O-N 2.43Å; L617-M632 HydrophobicContact CB-CB 3.67Å; L617-M632 HydrophobicContact CB-CE 4.37Å; L617-M632 WeakPolarHBondContact O-CE 3.46Å; L617-L633 CarbonylContact C-O 3.59Å; L617-L633 WeakPolarHBondContact CA-O 3.37Å
618	M	96.9	Very high	95.6	Very high	26 Å²	26	31.5 Å²	31.5	13%	0.128	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	142.1	176	-67.5	-66	-61.7	0	0	109.8	L633 V635 R640 L643 R644	M618-L633 PolarHBondContact N-O 3.2Å; M618-L633 PolarHBondContact O-N 2.82Å; M618-V635 HydrophobicContact CB-CG1 4.48Å; M618-V635 HydrophobicContact CB-CG2 3.97Å; M618-V635 HydrophobicContact CG-CG2 3.52Å; M618-R640 HydrophobicContact CG-CB 4.44Å; M618-R640 HydrophobicContact CG-CG 4.42Å; M618-R640 HydrophobicContact SD-CG 4.25Å; M618-L643 HydrophobicContact CB-CD1 4Å; M618-L643 HydrophobicContact CE-CB 3.94Å; M618-L643 HydrophobicContact CG-CD1 4.31Å; M618-R644 HydrophobicContact CE-CG 4.25Å
619	T	96.7	Very high	95.6	Very high	5 Å²	5	32.6 Å²	32.6	3%	0.031	20%	0.195	C	C	.	.			trans	-63.4	140.9	164	-41.9	0	0	0	0	109.7	L624 F630 M713 H717	T619-L624 HydrophobicContact CG2-CD1 4.14Å; T619-L624 HydrophobicContact CG2-CD2 3.78Å; T619-L624 HydrophobicContact CG2-CG 4.14Å; T619-F630 HydrophobicContact CG2-CD1 4.17Å; T619-M713 HydrophobicContact CG2-CE 3.98Å; T619-H717 WeakPolarHBondContact CB-NE2 3.36Å; T619-H717 WeakPolarHBondContact CG2-NE2 3.17Å; T619-H717 PolarHBondContact OG1-CE1 2.96Å; T619-H717 PolarHBondContact OG1-NE2 3.18Å
620	L	96.6	Very high	95.7	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.021	20%	0.195	C	C	.	.			trans	-112.2	130.5	-176.1	-59.5	-174.5	0	0	0	112	P566 E602 F603 G622 N623 L624 L633 V635 L643	P566-L620 HydrophobicContact CB-CD1 4.49Å; P566-L620 HydrophobicContact CG-CD1 3.74Å; E602-L620 HydrophobicContact CB-CD1 3.69Å; F603-L620 HydrophobicContact CB-CD1 4.44Å; F603-L620 HydrophobicContact CB-CD2 3.94Å; F603-L620 HydrophobicContact CD2-CD2 4.13Å; F603-L620 HydrophobicContact CG-CD2 4.42Å; L620-G622 PolarHBondContact O-N 2.88Å; L620-N623 HydrophobicContact CB-CB 4.36Å; L620-N623 VanDerWaalsContact O-CB 3.25Å; L620-N623 WeakPolarHBondContact O-CB 3.23Å; L620-N623 PolarHBondContact O-N 3.19Å; L620-N623 VanDerWaalsContact O-N 3.13Å; L620-L624 PolarHBondContact O-N 3.23Å; L620-L633 HydrophobicContact CD1-CB 3.91Å; L620-L633 HydrophobicContact CD1-CD1 3.87Å; L620-L633 HydrophobicContact CG-CB 4.18Å; L620-L633 HydrophobicContact CG-CD1 4.39Å; L620-V635 HydrophobicContact CD2-CG1 3.87Å; L620-L643 HydrophobicContact CD2-CD1 3.61Å
621	P	95.9	Very high	95.8	Very high	4 Å²	4	37.9 Å²	37.9	3%	0.026	20%	0.204	C	C	.	.	H	α-helix	trans	-56.3	-46.5	-175.5	14.9	-27	0	0	0	113.5	L562 F603 N623 L624 V625 L643 L652 M713	L562-P621 HydrophobicContact CB-CG 4.45Å; L562-P621 HydrophobicContact CD2-CG 4.06Å; L562-P621 CarbonylContact O-C 3.44Å; L562-P621 VanDerWaalsContact O-CB 3.31Å; L562-P621 WeakPolarHBondContact O-CB 3.48Å; L562-P621 VanDerWaalsContact O-CG 3.3Å; L562-P621 WeakPolarHBondContact O-CG 3.11Å; F603-P621 HydrophobicContact CE2-CG 4.33Å; P621-N623 PolarHBondContact O-N 2.96Å; P621-L624 WeakPolarHBondContact O-CB 3.4Å; P621-L624 PolarHBondContact O-N 3.47Å; P621-V625 WeakPolarHBondContact O-CG2 3.46Å; P621-V625 PolarHBondContact O-N 3.27Å; P621-L643 HydrophobicContact CG-CD2 4.18Å; P621-L652 HydrophobicContact CB-CD1 3.98Å; P621-L652 HydrophobicContact CB-CD2 3.94Å; P621-M713 HydrophobicContact CB-SD 3.67Å; P621-M713 HydrophobicContact CG-SD 4.27Å
622	G	95.1	Very high	96	Very high	3 Å²	3	37.6 Å²	37.6	3%	0.031	20%	0.196	C	C	.	.	H	α-helix	trans	-59.5	-33.2	179.8	0	0	0	0	0	113.6	L562 I563 L620 V625 T626	L562-G622 WeakPolarHBondContact O-CA 3.34Å; L562-G622 PolarHBondContact O-N 2.82Å; I563-G622 VanDerWaalsContact O-CA 3.26Å; I563-G622 WeakPolarHBondContact O-CA 3.49Å; L620-G622 PolarHBondContact O-N 2.88Å; G622-V625 PolarHBondContact O-N 3.49Å; G622-T626 WeakPolarHBondContact O-CB 3.45Å; G622-T626 WeakPolarHBondContact O-CG2 3.24Å; G622-T626 PolarHBondContact O-N 3.29Å; G622-T626 PolarHBondContact O-OG1 2.89Å
623	N	95.4	Very high	96	Very high	12 Å²	12	38.9 Å²	38.9	6%	0.064	20%	0.202	C	C	.	.	H	α-helix	trans	-63.3	-44.8	173.6	-122.7	36.4	0	0	0	111.4	P566 L620 P621 C627 W628 D629	P566-N623 WeakPolarHBondContact CD-OD1 3.29Å; L620-N623 HydrophobicContact CB-CB 4.36Å; L620-N623 VanDerWaalsContact O-CB 3.25Å; L620-N623 WeakPolarHBondContact O-CB 3.23Å; L620-N623 PolarHBondContact O-N 3.19Å; L620-N623 VanDerWaalsContact O-N 3.13Å; P621-N623 PolarHBondContact O-N 2.96Å; N623-C627 CarbonylContact O-C 3.39Å; N623-C627 PolarHBondContact O-N 3.1Å; N623-C627 PolarHBondContact O-SG 2.67Å; N623-W628 PolarHBondContact O-N 2.93Å; N623-D629 HydrophobicContact CB-CB 4.37Å; N623-D629 WeakPolarHBondContact ND2-CB 3.29Å; N623-D629 PolarHBondContact ND2-O 3.35Å; N623-D629 PolarHBondContact ND2-OD2 2.92Å; N623-D629 PolarHBondContact O-N 3.36Å
624	L	96.1	Very high	96	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64	-44.4	177.1	-54.6	-171.3	0	0	0	111.2	T619 L620 P621 W628 F630 M713 L716	T619-L624 HydrophobicContact CG2-CD1 4.14Å; T619-L624 HydrophobicContact CG2-CD2 3.78Å; T619-L624 HydrophobicContact CG2-CG 4.14Å; L620-L624 PolarHBondContact O-N 3.23Å; P621-L624 WeakPolarHBondContact O-CB 3.4Å; P621-L624 PolarHBondContact O-N 3.47Å; L624-W628 WeakPolarHBondContact O-CA 3.3Å; L624-W628 PolarHBondContact O-N 3.38Å; L624-W628 VanDerWaalsContact O-N 3.08Å; L624-F630 HydrophobicContact CD1-CD1 4.34Å; L624-F630 HydrophobicContact CD1-CE1 3.76Å; L624-F630 HydrophobicContact CD1-CZ 4.04Å; L624-F630 HydrophobicContact CD2-CB 4.37Å; L624-F630 HydrophobicContact CD2-CD1 3.62Å; L624-F630 HydrophobicContact CD2-CD2 3.66Å; L624-F630 HydrophobicContact CD2-CE1 3.62Å; L624-F630 HydrophobicContact CD2-CE2 3.65Å; L624-F630 HydrophobicContact CD2-CG 3.63Å; L624-F630 HydrophobicContact CD2-CZ 3.62Å; L624-F630 HydrophobicContact CG-CE1 4.34Å; L624-F630 HydrophobicContact CG-CZ 4.36Å; L624-M713 HydrophobicContact CD1-CE 3.59Å; L624-M713 HydrophobicContact CD1-SD 3.97Å; L624-M713 HydrophobicContact CG-CE 4.39Å; L624-L716 HydrophobicContact CB-CD1 4.19Å; L624-L716 HydrophobicContact CD1-CB 3.96Å; L624-L716 HydrophobicContact CD1-CD1 3.84Å
625	V	95.7	Very high	96.1	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.012	19%	0.191	C	C	.	.	H	α-helix	trans	-68	-40	-177.4	173.3	0	0	0	0	112.2	I563 P621 G622 L652 D656 F657 N658	I563-V625 HydrophobicContact CB-CG1 4.5Å; P621-V625 WeakPolarHBondContact O-CG2 3.46Å; P621-V625 PolarHBondContact O-N 3.27Å; G622-V625 PolarHBondContact O-N 3.49Å; V625-L652 HydrophobicContact CG2-CD1 4.16Å; V625-L652 HydrophobicContact CG2-CD2 4.22Å; V625-D656 HydrophobicContact CG1-CB 4.2Å; V625-D656 WeakPolarHBondContact CG1-O 3.47Å; V625-F657 HydrophobicContact CG2-CD1 4.49Å; V625-F657 HydrophobicContact CG2-CE1 4.15Å; V625-F657 HydrophobicContact CG2-CE2 4.42Å; V625-F657 HydrophobicContact CG2-CZ 4.12Å; V625-N658 PolarHBondContact O-N 2.88Å
626	T	94.9	Very high	96.2	Very high	40 Å²	40	33.9 Å²	33.9	25%	0.245	17%	0.173	C	C	.	.	H	α-helix	trans	-88.7	-34	-177.6	61.4	0	0	0	0	115.1	P565 G622 N658	P565-T626 HydrophobicContact CB-CG2 4.06Å; P565-T626 HydrophobicContact CG-CG2 4.08Å; G622-T626 WeakPolarHBondContact O-CB 3.45Å; G622-T626 WeakPolarHBondContact O-CG2 3.24Å; G622-T626 PolarHBondContact O-N 3.29Å; G622-T626 PolarHBondContact O-OG1 2.89Å; T626-N658 WeakPolarHBondContact O-CB 3.16Å; T626-N658 PolarHBondContact O-ND2 2.67Å
627	C	94.8	Very high	96.2	Very high	70 Å²	70	33.9 Å²	33.9	47%	0.473	17%	0.171	S	C	.	.	H	α-helix	trans	-147	8.7	-170	55.3	0	0	0	0	115.2	N623 D629	N623-C627 CarbonylContact O-C 3.39Å; N623-C627 PolarHBondContact O-N 3.1Å; N623-C627 PolarHBondContact O-SG 2.67Å; C627-D629 PolarHBondContact O-N 3.35Å
628	W	96.1	Very high	96.1	Very high	27 Å²	27	33.1 Å²	33.1	10%	0.102	17%	0.165	C	C	.	.			trans	58.5	30.3	179.1	-155.4	-112.5	0	0	0	114.4	N623 L624 F630 F657 V661 Q665 L668 L716 V719	N623-W628 PolarHBondContact O-N 2.93Å; L624-W628 WeakPolarHBondContact O-CA 3.3Å; L624-W628 PolarHBondContact O-N 3.38Å; L624-W628 VanDerWaalsContact O-N 3.08Å; W628-F630 AromaticContact CD1-CE2 3.91Å; W628-F630 AromaticContact CD2-CE2 3.7Å; W628-F630 HydrophobicContact CD2-CE2 3.7Å; W628-F630 HydrophobicContact CD2-CZ 4.33Å; W628-F630 AromaticContact CE2-CE2 3.54Å; W628-F630 HydrophobicContact CE3-CE2 4.24Å; W628-F630 AromaticContact CG-CE2 3.97Å; W628-F630 HydrophobicContact CG-CE2 3.97Å; W628-F630 HydrophobicContact CH2-CE2 4.46Å; W628-F630 HydrophobicContact CH2-CZ 4.19Å; W628-F630 AromaticContact CZ2-CE2 3.95Å; W628-F630 HydrophobicContact CZ2-CE2 3.95Å; W628-F630 HydrophobicContact CZ2-CZ 4Å; W628-F630 HydrophobicContact CZ3-CZ 4.45Å; W628-F630 AromaticContact NE1-CE2 3.68Å; W628-F630 WeakPolarHBondContact O-CD2 3.32Å; W628-F630 PolarHBondContact O-N 3.27Å; W628-F657 HydrophobicContact CE3-CE1 4.38Å; W628-F657 AromaticContact CZ3-CE1 4Å; W628-F657 HydrophobicContact CZ3-CE1 4Å; W628-V661 HydrophobicContact CB-CG1 3.99Å; W628-V661 HydrophobicContact CB-CG2 4.21Å; W628-V661 HydrophobicContact CD2-CG1 4.08Å; W628-V661 HydrophobicContact CE3-CG1 3.62Å; W628-V661 HydrophobicContact CG-CG1 4.28Å; W628-V661 HydrophobicContact CZ3-CG1 4.44Å; W628-Q665 HydrophobicContact CB-CG 4.32Å; W628-Q665 HydrophobicContact CD2-CG 3.78Å; W628-Q665 HydrophobicContact CG-CG 3.67Å; W628-L668 HydrophobicContact CE3-CD2 4.39Å; W628-L668 HydrophobicContact CH2-CB 4.13Å; W628-L668 HydrophobicContact CH2-CD1 4.03Å; W628-L668 HydrophobicContact CH2-CD2 4.07Å; W628-L668 HydrophobicContact CH2-CG 4.3Å; W628-L668 HydrophobicContact CZ2-CB 4.48Å; W628-L668 HydrophobicContact CZ3-CD1 4.3Å; W628-L668 HydrophobicContact CZ3-CD2 3.76Å; W628-L668 HydrophobicContact CZ3-CG 4.46Å; W628-L716 HydrophobicContact CH2-CD2 4.11Å; W628-L716 HydrophobicContact CZ3-CD2 4.05Å; W628-V719 HydrophobicContact CH2-CB 4.26Å; W628-V719 HydrophobicContact CH2-CG1 3.87Å; W628-V719 HydrophobicContact CZ2-CB 4.37Å; W628-V719 HydrophobicContact CZ2-CG1 3.78Å
629	D	95.7	Very high	96	Very high	24 Å²	24	31.9 Å²	31.9	13%	0.128	16%	0.158	C	C	.	.			trans	-92.7	99.8	-173.5	176	13.2	0	0	0	112.8	N623 C627 R631	N623-D629 HydrophobicContact CB-CB 4.37Å; N623-D629 WeakPolarHBondContact ND2-CB 3.29Å; N623-D629 PolarHBondContact ND2-O 3.35Å; N623-D629 PolarHBondContact ND2-OD2 2.92Å; N623-D629 PolarHBondContact O-N 3.36Å; C627-D629 PolarHBondContact O-N 3.35Å; D629-R631 VanDerWaalsContact C-N 3.28Å; D629-R631 VanDerWaalsContact CG-NE 3.34Å; D629-R631 PolarHBondContact O-N 3.44Å; D629-R631 VanDerWaalsContact OD1-CB 3.24Å; D629-R631 WeakPolarHBondContact OD1-CB 3.36Å; D629-R631 WeakPolarHBondContact OD1-CG 3.48Å; D629-R631 IonicContact OD1-CZ 3.54Å; D629-R631 PolarHBondContact OD1-N 2.9Å; D629-R631 VanDerWaalsContact OD1-N 3.09Å; D629-R631 IonicContact OD1-NE 3.92Å; D629-R631 PolarHBondContact OD1-NE 2.96Å; D629-R631 IonicContact OD1-NH2 3.26Å; D629-R631 IonicContact OD2-CZ 2.71Å; D629-R631 IonicContact OD2-NE 3.16Å; D629-R631 PolarHBondContact OD2-NE 3.33Å; D629-R631 VanDerWaalsContact OD2-NE 3.12Å; D629-R631 IonicContact OD2-NH2 2.8Å; D629-R631 PolarHBondContact OD2-NH2 3.17Å
630	F	96.4	Very high	96	Very high	22 Å²	22	33.7 Å²	33.7	10%	0.096	17%	0.165	C	C	.	.			trans	-77.1	-1.2	-178.5	-74.8	-95.5	0	0	0	115.3	T619 L624 W628 M632 L716 H717 H720	T619-F630 HydrophobicContact CG2-CD1 4.17Å; L624-F630 HydrophobicContact CD1-CD1 4.34Å; L624-F630 HydrophobicContact CD1-CE1 3.76Å; L624-F630 HydrophobicContact CD1-CZ 4.04Å; L624-F630 HydrophobicContact CD2-CB 4.37Å; L624-F630 HydrophobicContact CD2-CD1 3.62Å; L624-F630 HydrophobicContact CD2-CD2 3.66Å; L624-F630 HydrophobicContact CD2-CE1 3.62Å; L624-F630 HydrophobicContact CD2-CE2 3.65Å; L624-F630 HydrophobicContact CD2-CG 3.63Å; L624-F630 HydrophobicContact CD2-CZ 3.62Å; L624-F630 HydrophobicContact CG-CE1 4.34Å; L624-F630 HydrophobicContact CG-CZ 4.36Å; W628-F630 AromaticContact CD1-CE2 3.91Å; W628-F630 AromaticContact CD2-CE2 3.7Å; W628-F630 HydrophobicContact CD2-CE2 3.7Å; W628-F630 HydrophobicContact CD2-CZ 4.33Å; W628-F630 AromaticContact CE2-CE2 3.54Å; W628-F630 HydrophobicContact CE3-CE2 4.24Å; W628-F630 AromaticContact CG-CE2 3.97Å; W628-F630 HydrophobicContact CG-CE2 3.97Å; W628-F630 HydrophobicContact CH2-CE2 4.46Å; W628-F630 HydrophobicContact CH2-CZ 4.19Å; W628-F630 AromaticContact CZ2-CE2 3.95Å; W628-F630 HydrophobicContact CZ2-CE2 3.95Å; W628-F630 HydrophobicContact CZ2-CZ 4Å; W628-F630 HydrophobicContact CZ3-CZ 4.45Å; W628-F630 AromaticContact NE1-CE2 3.68Å; W628-F630 WeakPolarHBondContact O-CD2 3.32Å; W628-F630 PolarHBondContact O-N 3.27Å; F630-M632 PolarHBondContact O-N 2.96Å; F630-L716 HydrophobicContact CE1-CB 4.47Å; F630-L716 HydrophobicContact CZ-CB 4.35Å; F630-L716 WeakPolarHBondContact CZ-O 3.47Å; F630-H717 AromaticContact CD1-CE1 3.82Å; F630-H717 AromaticContact CD1-ND1 3.66Å; F630-H717 AromaticContact CE1-ND1 3.99Å; F630-H720 HydrophobicContact CD1-CB 4.27Å; F630-H720 HydrophobicContact CD2-CB 4.25Å; F630-H720 AromaticContact CD2-CD2 3.27Å; F630-H720 WeakPolarHBondContact CD2-CD2 3.35Å; F630-H720 AromaticContact CD2-CG 3.9Å; F630-H720 AromaticContact CD2-NE2 3.95Å; F630-H720 HydrophobicContact CE1-CB 3.8Å; F630-H720 HydrophobicContact CE2-CB 3.77Å; F630-H720 AromaticContact CE2-CD2 3.56Å; F630-H720 AromaticContact CE2-CG 3.93Å; F630-H720 HydrophobicContact CG-CB 4.49Å; F630-H720 AromaticContact CG-CD2 3.68Å; F630-H720 HydrophobicContact CZ-CB 3.53Å
631	R	96.4	Very high	95.9	Very high	173 Å²	173	36.4 Å²	36.4	65%	0.653	18%	0.179	S	C	*	.			trans	-56.9	131.9	-179.3	-68.3	176.8	-61.9	-172.1	0.9	111.3	D629 L633	D629-R631 VanDerWaalsContact C-N 3.28Å; D629-R631 VanDerWaalsContact CG-NE 3.34Å; D629-R631 PolarHBondContact O-N 3.44Å; D629-R631 VanDerWaalsContact OD1-CB 3.24Å; D629-R631 WeakPolarHBondContact OD1-CB 3.36Å; D629-R631 WeakPolarHBondContact OD1-CG 3.48Å; D629-R631 IonicContact OD1-CZ 3.54Å; D629-R631 PolarHBondContact OD1-N 2.9Å; D629-R631 VanDerWaalsContact OD1-N 3.09Å; D629-R631 IonicContact OD1-NE 3.92Å; D629-R631 PolarHBondContact OD1-NE 2.96Å; D629-R631 IonicContact OD1-NH2 3.26Å; D629-R631 IonicContact OD2-CZ 2.71Å; D629-R631 IonicContact OD2-NE 3.16Å; D629-R631 PolarHBondContact OD2-NE 3.33Å; D629-R631 VanDerWaalsContact OD2-NE 3.12Å; D629-R631 IonicContact OD2-NH2 2.8Å; D629-R631 PolarHBondContact OD2-NH2 3.17Å; R631-L633 PolarHBondContact O-N 3.3Å
632	M	96.8	Very high	95.7	Very high	109 Å²	109	38.9 Å²	38.9	54%	0.537	19%	0.188	S	C	.	.			trans	-76.8	119.5	-179.2	-56.4	-177.9	71.6	0	0	110.4	L617 F630	L617-M632 HydrophobicContact CB-CB 3.67Å; L617-M632 HydrophobicContact CB-CE 4.37Å; L617-M632 WeakPolarHBondContact O-CE 3.46Å; F630-M632 PolarHBondContact O-N 2.96Å
633	L	96.2	Very high	95.7	Very high	39 Å²	39	39 Å²	39	20%	0.204	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	150.1	-172.9	-73.8	176	0	0	0	111.7	P566 E602 L617 M618 L620 R631	P566-L633 HydrophobicContact CB-CD1 4.48Å; P566-L633 HydrophobicContact CG-CD1 3.9Å; E602-L633 HydrophobicContact CB-CB 3.91Å; E602-L633 HydrophobicContact CG-CB 3.96Å; L617-L633 CarbonylContact C-O 3.59Å; L617-L633 WeakPolarHBondContact CA-O 3.37Å; M618-L633 PolarHBondContact N-O 3.2Å; M618-L633 PolarHBondContact O-N 2.82Å; L620-L633 HydrophobicContact CD1-CB 3.91Å; L620-L633 HydrophobicContact CD1-CD1 3.87Å; L620-L633 HydrophobicContact CG-CB 4.18Å; L620-L633 HydrophobicContact CG-CD1 4.39Å; R631-L633 PolarHBondContact O-N 3.3Å
634	S	97.2	Very high	95.7	Very high	28 Å²	28	45.7 Å²	45.7	20%	0.196	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	131	-171.1	-147.8	0	0	0	0	112.4	E602 N615	E602-S634 WeakPolarHBondContact CB-O 3.34Å; E602-S634 WeakPolarHBondContact CG-O 3.49Å; E602-S634 PolarHBondContact N-O 2.67Å; N615-S634 WeakPolarHBondContact CA-OG 3.32Å
635	V	97.2	Very high	95.6	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	156.1	-174.2	-67.3	0	0	0	0	113.6	F603 H613 T616 M618 L620 A639 R640 L643	F603-V635 HydrophobicContact CB-CG1 3.92Å; H613-V635 PolarHBondContact CE1-O 2.93Å; H613-V635 PolarHBondContact NE2-O 3.46Å; T616-V635 VanDerWaalsContact O-CG2 3.29Å; T616-V635 WeakPolarHBondContact O-CG2 3.45Å; T616-V635 PolarHBondContact O-N 3.13Å; M618-V635 HydrophobicContact CB-CG1 4.48Å; M618-V635 HydrophobicContact CB-CG2 3.97Å; M618-V635 HydrophobicContact CG-CG2 3.52Å; L620-V635 HydrophobicContact CD2-CG1 3.87Å; V635-A639 HydrophobicContact CB-CB 3.83Å; V635-A639 HydrophobicContact CG1-CB 4.29Å; V635-R640 HydrophobicContact CG2-CB 3.94Å; V635-L643 HydrophobicContact CG1-CD1 4.41Å
636	S	97	Very high	95.5	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.241	C	C	.	.			trans	-68.3	161.6	170.6	70	0	0	0	0	111	C601 C612 H613 F638 A639 R640	C601-S636 PolarHBondContact SG-N 3.48Å; C612-S636 WeakPolarHBondContact O-CB 3.38Å; H613-S636 VanDerWaalsContact CD2-CA 3.42Å; H613-S636 WeakPolarHBondContact CD2-CA 3.16Å; H613-S636 PolarHBondContact CD2-N 3.47Å; H613-S636 VanDerWaalsContact CD2-N 3.29Å; H613-S636 PolarHBondContact NE2-N 2.98Å; S636-F638 VanDerWaalsContact C-N 3.27Å; S636-F638 PolarHBondContact O-N 3.13Å; S636-A639 PolarHBondContact O-N 3.09Å; S636-A639 VanDerWaalsContact O-N 3.1Å; S636-A639 PolarHBondContact OG-N 3.32Å; S636-R640 PolarHBondContact O-N 3.06Å
637	N	96.7	Very high	95.6	Very high	36 Å²	36	52.6 Å²	52.6	19%	0.193	24%	0.242	C	C	.	.	H	α-helix	trans	-58.8	-44.3	179.3	-56.1	-2.9	0	0	0	110	V611 C612 H613 S614 A639 R640 D641	V611-N637 PolarHBondContact O-ND2 3.44Å; C612-N637 PolarHBondContact O-N 2.85Å; C612-N637 PolarHBondContact O-OD1 3.47Å; H613-N637 WeakPolarHBondContact CA-OD1 3.18Å; S614-N637 PolarHBondContact N-OD1 2.79Å; S614-N637 PolarHBondContact OG-OD1 3.15Å; N637-A639 VanDerWaalsContact C-N 3.34Å; N637-A639 PolarHBondContact O-N 3.17Å; N637-R640 WeakPolarHBondContact O-CB 3.38Å; N637-R640 PolarHBondContact O-N 3.11Å; N637-D641 WeakPolarHBondContact O-CB 3.38Å; N637-D641 PolarHBondContact O-N 3.03Å; N637-D641 VanDerWaalsContact O-OD2 3.08Å
638	F	94.4	Very high	95.6	Very high	72 Å²	72	54.9 Å²	54.9	32%	0.316	25%	0.25	S	C	.	.	H	α-helix	trans	-55	-45.1	174	-55.1	-83.1	0	0	0	112.9	F604 F608 C612 S636 R642	F604-F638 HydrophobicContact CE2-CB 4.01Å; F608-F638 HydrophobicContact CD1-CD2 4.32Å; F608-F638 HydrophobicContact CD1-CE2 4.46Å; F608-F638 AromaticContact CE1-CD2 3.86Å; F608-F638 HydrophobicContact CE1-CD2 3.86Å; F608-F638 HydrophobicContact CE1-CE2 4.26Å; C612-F638 HydrophobicContact CB-CE2 3.91Å; S636-F638 VanDerWaalsContact C-N 3.27Å; S636-F638 PolarHBondContact O-N 3.13Å; F638-R642 WeakPolarHBondContact O-CB 3.39Å; F638-R642 PolarHBondContact O-N 3.2Å
639	A	95.3	Very high	95.6	Very high	0 Å²	0	58 Å²	58	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-69.6	-45.3	179.4	0	0	0	0	0	111.8	C601 F603 F604 V635 S636 N637 D641 R642 L643	C601-A639 VanDerWaalsContact SG-CB 3.59Å; F603-A639 HydrophobicContact CB-CB 3.99Å; F603-A639 HydrophobicContact CD1-CB 3.65Å; F603-A639 HydrophobicContact CG-CB 4.21Å; F604-A639 HydrophobicContact CD2-CB 3.77Å; F604-A639 HydrophobicContact CE2-CB 3.6Å; V635-A639 HydrophobicContact CB-CB 3.83Å; V635-A639 HydrophobicContact CG1-CB 4.29Å; S636-A639 PolarHBondContact O-N 3.09Å; S636-A639 VanDerWaalsContact O-N 3.1Å; S636-A639 PolarHBondContact OG-N 3.32Å; N637-A639 VanDerWaalsContact C-N 3.34Å; N637-A639 PolarHBondContact O-N 3.17Å; A639-D641 VanDerWaalsContact C-N 3.34Å; A639-D641 PolarHBondContact O-N 2.92Å; A639-R642 PolarHBondContact O-N 3.43Å; A639-L643 VanDerWaalsContact O-CB 3.29Å; A639-L643 WeakPolarHBondContact O-CB 3.22Å; A639-L643 WeakPolarHBondContact O-CD1 3.35Å; A639-L643 WeakPolarHBondContact O-CG 3.45Å; A639-L643 PolarHBondContact O-N 3.33Å
640	R	96.3	Very high	95.6	Very high	42 Å²	42	58.4 Å²	58.4	16%	0.158	27%	0.268	C	S	.	.	H	α-helix	trans	-53.5	-51	173.1	174.8	-162.1	70	-151.2	-0.4	111.3	S614 T616 M618 V635 S636 N637 L643 R644	S614-R640 PolarHBondContact OG-NH1 3.31Å; T616-R640 HydrophobicContact CG2-CG 3.9Å; M618-R640 HydrophobicContact CG-CB 4.44Å; M618-R640 HydrophobicContact CG-CG 4.42Å; M618-R640 HydrophobicContact SD-CG 4.25Å; V635-R640 HydrophobicContact CG2-CB 3.94Å; S636-R640 PolarHBondContact O-N 3.06Å; N637-R640 WeakPolarHBondContact O-CB 3.38Å; N637-R640 PolarHBondContact O-N 3.11Å; R640-L643 PolarHBondContact O-N 2.87Å; R640-R644 WeakPolarHBondContact O-CB 3.43Å; R640-R644 VanDerWaalsContact O-CG 3.28Å; R640-R644 WeakPolarHBondContact O-CG 3.44Å; R640-R644 PolarHBondContact O-N 3.02Å
641	D	95.5	Very high	95.5	Very high	61 Å²	61	59.2 Å²	59.2	33%	0.326	27%	0.273	S	S	.	.	H	α-helix	trans	-71.6	-34.9	-173.8	-62.6	-26.6	0	0	0	111.2	N637 A639 R644 Q645	N637-D641 WeakPolarHBondContact O-CB 3.38Å; N637-D641 PolarHBondContact O-N 3.03Å; N637-D641 VanDerWaalsContact O-OD2 3.08Å; A639-D641 VanDerWaalsContact C-N 3.34Å; A639-D641 PolarHBondContact O-N 2.92Å; D641-R644 IonicContact OD1-NH1 3Å; D641-Q645 WeakPolarHBondContact O-CG 3.44Å; D641-Q645 PolarHBondContact O-N 3.26Å; D641-Q645 VanDerWaalsContact O-N 3.16Å
642	R	91.6	Very high	95.5	Very high	56 Å²	56	51.3 Å²	51.3	21%	0.211	24%	0.244	C	C	.	.	H	α-helix	trans	-67.8	-46	170.3	-172.1	52.5	159.2	-158.4	-11.8	112.7	T555 L557 F638 A639 R644 Q645 L646	T555-R642 PolarHBondContact O-NH2 3.39Å; L557-R642 HydrophobicContact CD2-CG 4.47Å; F638-R642 WeakPolarHBondContact O-CB 3.39Å; F638-R642 PolarHBondContact O-N 3.2Å; A639-R642 PolarHBondContact O-N 3.43Å; R642-R644 VanDerWaalsContact C-N 3.27Å; R642-R644 PolarHBondContact O-N 2.9Å; R642-Q645 VanDerWaalsContact CD-OE1 3.31Å; R642-Q645 WeakPolarHBondContact O-CB 3.15Å; R642-Q645 PolarHBondContact O-N 3.41Å; R642-Q645 VanDerWaalsContact O-N 3.11Å; R642-L646 HydrophobicContact CG-CD1 4.18Å; R642-L646 WeakPolarHBondContact O-CG 3.42Å; R642-L646 PolarHBondContact O-N 3.36Å; R642-L646 VanDerWaalsContact O-N 3.16Å
643	L	94.6	Very high	95.4	Very high	7 Å²	7	49.8 Å²	49.8	4%	0.037	23%	0.232	C	C	.	.	H	α-helix	trans	-60.2	-38.1	178.1	-74.4	166.1	0	0	0	111.4	F603 M618 L620 P621 V635 A639 R640 L646 H647	F603-L643 HydrophobicContact CB-CD1 4.5Å; F603-L643 HydrophobicContact CD2-CD1 4.28Å; F603-L643 HydrophobicContact CD2-CD2 4.13Å; F603-L643 HydrophobicContact CD2-CG 4.49Å; F603-L643 HydrophobicContact CE2-CD2 3.77Å; F603-L643 HydrophobicContact CE2-CG 4.4Å; F603-L643 HydrophobicContact CG-CD1 4.23Å; F603-L643 HydrophobicContact CZ-CD2 4.02Å; F603-L643 HydrophobicContact CZ-CG 4.39Å; M618-L643 HydrophobicContact CB-CD1 4Å; M618-L643 HydrophobicContact CE-CB 3.94Å; M618-L643 HydrophobicContact CG-CD1 4.31Å; L620-L643 HydrophobicContact CD2-CD1 3.61Å; P621-L643 HydrophobicContact CG-CD2 4.18Å; V635-L643 HydrophobicContact CG1-CD1 4.41Å; A639-L643 VanDerWaalsContact O-CB 3.29Å; A639-L643 WeakPolarHBondContact O-CB 3.22Å; A639-L643 WeakPolarHBondContact O-CD1 3.35Å; A639-L643 WeakPolarHBondContact O-CG 3.45Å; A639-L643 PolarHBondContact O-N 3.33Å; R640-L643 PolarHBondContact O-N 2.87Å; L643-L646 PolarHBondContact O-N 3.33Å; L643-H647 PolarHBondContact O-N 3Å
644	R	96	Very high	95.3	Very high	151 Å²	151	48.6 Å²	48.6	57%	0.57	23%	0.226	S	C	*	.	H	α-helix	trans	-60.9	-45	171.8	-74.7	169.6	171.5	-170.5	-9.6	112.7	M618 R640 D641 R642 L646 H647	M618-R644 HydrophobicContact CE-CG 4.25Å; R640-R644 WeakPolarHBondContact O-CB 3.43Å; R640-R644 VanDerWaalsContact O-CG 3.28Å; R640-R644 WeakPolarHBondContact O-CG 3.44Å; R640-R644 PolarHBondContact O-N 3.02Å; D641-R644 IonicContact OD1-NH1 3Å; R642-R644 VanDerWaalsContact C-N 3.27Å; R642-R644 PolarHBondContact O-N 2.9Å; R644-L646 PolarHBondContact O-N 3.38Å; R644-H647 PolarHBondContact O-N 3.29Å
645	Q	93.9	Very high	95.2	Very high	109 Å²	109	54 Å²	54	51%	0.509	25%	0.251	S	S	.	.	H	α-helix	trans	-62.1	-24.1	175.6	-70.1	168.7	4	0	0	114	D641 R642 K649	D641-Q645 WeakPolarHBondContact O-CG 3.44Å; D641-Q645 PolarHBondContact O-N 3.26Å; D641-Q645 VanDerWaalsContact O-N 3.16Å; R642-Q645 VanDerWaalsContact CD-OE1 3.31Å; R642-Q645 WeakPolarHBondContact O-CB 3.15Å; R642-Q645 PolarHBondContact O-N 3.41Å; R642-Q645 VanDerWaalsContact O-N 3.11Å; Q645-K649 VanDerWaalsContact O-CE 3.29Å; Q645-K649 WeakPolarHBondContact O-CE 3.35Å
646	L	93.3	Very high	95	Very high	21 Å²	21	55.6 Å²	55.6	11%	0.11	26%	0.26	C	S	.	.	H	α-helix	trans	-102.5	-7.3	-177.5	-56.7	-177.2	0	0	0	113.2	L557 L562 R642 L643 R644 N648 K649 L651	L557-L646 HydrophobicContact CD2-CD1 4.23Å; L562-L646 HydrophobicContact CD1-CD1 4.48Å; L562-L646 HydrophobicContact CD2-CD1 3.86Å; R642-L646 HydrophobicContact CG-CD1 4.18Å; R642-L646 WeakPolarHBondContact O-CG 3.42Å; R642-L646 PolarHBondContact O-N 3.36Å; R642-L646 VanDerWaalsContact O-N 3.16Å; L643-L646 PolarHBondContact O-N 3.33Å; R644-L646 PolarHBondContact O-N 3.38Å; L646-N648 VanDerWaalsContact C-N 3.34Å; L646-N648 PolarHBondContact O-N 3.47Å; L646-K649 HydrophobicContact CD2-CD 4.05Å; L646-K649 PolarHBondContact O-N 2.99Å; L646-L651 HydrophobicContact CB-CD1 4.19Å; L646-L651 HydrophobicContact CD1-CD1 4.38Å; L646-L651 HydrophobicContact CD2-CD1 3.95Å; L646-L651 HydrophobicContact CG-CD1 4.38Å
647	H	95.6	Very high	95	Very high	57 Å²	57	56 Å²	56	26%	0.264	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-43.5	-169.1	-173.4	-86.8	0	0	0	113.9	L643 R644 S712 M713 A714	L643-H647 PolarHBondContact O-N 3Å; R644-H647 PolarHBondContact O-N 3.29Å; H647-S712 WeakPolarHBondContact O-CB 3.46Å; H647-M713 WeakPolarHBondContact O-CB 3.21Å; H647-M713 PolarHBondContact O-N 2.99Å; H647-A714 PolarHBondContact O-N 3.19Å
648	N	95.8	Very high	94.9	Very high	118 Å²	118	57.2 Å²	57.2	63%	0.631	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	10.3	-179.5	-59.9	5.5	0	0	0	112.7	L646	L646-N648 VanDerWaalsContact C-N 3.34Å; L646-N648 PolarHBondContact O-N 3.47Å
649	K	95.4	Very high	94.9	Very high	92 Å²	92	61.7 Å²	61.7	40%	0.4	29%	0.288	S	S	.	.	S	Bend	trans	-94.2	125.9	-178.3	-64.1	-165.1	178.5	-172.3	0	110.5	Q645 L646 L651 S712	Q645-K649 VanDerWaalsContact O-CE 3.29Å; Q645-K649 WeakPolarHBondContact O-CE 3.35Å; L646-K649 HydrophobicContact CD2-CD 4.05Å; L646-K649 PolarHBondContact O-N 2.99Å; K649-L651 HydrophobicContact CB-CD1 3.79Å; K649-L651 HydrophobicContact CB-CD2 4.5Å; K649-L651 HydrophobicContact CB-CG 3.84Å; K649-L651 PolarHBondContact O-N 3.41Å; K649-S712 VanDerWaalsContact C-CB 3.45Å; K649-S712 VanDerWaalsContact O-CA 3.32Å; K649-S712 WeakPolarHBondContact O-CA 3.36Å; K649-S712 WeakPolarHBondContact O-CB 3.4Å
650	P	96	Very high	94.8	Very high	33 Å²	33	67.6 Å²	67.6	21%	0.214	32%	0.315	C	S	.	.			trans	-75.8	94.6	180	31.1	-35.3	0	0	0	110.2	H703 L710	P650-H703 HydrophobicContact CB-CB 3.86Å; P650-H703 HydrophobicContact CG-CB 3.82Å; P650-L710 HydrophobicContact CB-CB 3.94Å
651	L	94.3	Very high	94.8	Very high	40 Å²	40	66 Å²	66	21%	0.209	31%	0.31	C	S	.	.			trans	-124.9	-25.1	-169.4	-65.3	174.6	0	0	0	113.7	Y559 L562 L646 K649 W711	Y559-L651 VanDerWaalsContact CE2-O 3.26Å; Y559-L651 WeakPolarHBondContact CE2-O 3.27Å; Y559-L651 PolarHBondContact OH-O 3.23Å; L562-L651 HydrophobicContact CD1-CD1 4.46Å; L646-L651 HydrophobicContact CB-CD1 4.19Å; L646-L651 HydrophobicContact CD1-CD1 4.38Å; L646-L651 HydrophobicContact CD2-CD1 3.95Å; L646-L651 HydrophobicContact CG-CD1 4.38Å; K649-L651 HydrophobicContact CB-CD1 3.79Å; K649-L651 HydrophobicContact CB-CD2 4.5Å; K649-L651 HydrophobicContact CB-CG 3.84Å; K649-L651 PolarHBondContact O-N 3.41Å; L651-W711 PolarHBondContact N-O 3.19Å
652	L	95.7	Very high	94.7	Very high	7 Å²	7	65.1 Å²	65.1	4%	0.037	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	122.2	-178.2	-53.5	172.5	0	0	0	108.3	L562 I563 P621 V625 F657 L710 W711 M713 L716	L562-L652 HydrophobicContact CB-CD2 4.48Å; I563-L652 HydrophobicContact CG2-CD2 4.2Å; P621-L652 HydrophobicContact CB-CD1 3.98Å; P621-L652 HydrophobicContact CB-CD2 3.94Å; V625-L652 HydrophobicContact CG2-CD1 4.16Å; V625-L652 HydrophobicContact CG2-CD2 4.22Å; L652-F657 HydrophobicContact CB-CE2 4.47Å; L652-L710 CarbonylContact O-C 3.59Å; L652-W711 HydrophobicContact CB-CB 4.35Å; L652-W711 PolarHBondContact N-O 3.34Å; L652-W711 PolarHBondContact O-N 3.41Å; L652-M713 HydrophobicContact CD1-SD 4.24Å; L652-L716 HydrophobicContact CD1-CD1 3.61Å
653	R	95.4	Very high	94.7	Very high	76 Å²	76	68.7 Å²	68.7	29%	0.287	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	148.4	-179.2	-44.5	167.4	-67.7	179	3.7	109.5	I655 D656 F657 D709 L710	R653-I655 HydrophobicContact CB-CG2 3.84Å; R653-I655 PolarHBondContact O-N 3.21Å; R653-I655 VanDerWaalsContact O-N 3.13Å; R653-D656 WeakPolarHBondContact CB-OD2 3.42Å; R653-D656 WeakPolarHBondContact CG-OD2 3.46Å; R653-D656 IonicContact CZ-OD1 3.76Å; R653-D656 IonicContact CZ-OD2 3.76Å; R653-D656 PolarHBondContact N-OD2 3.14Å; R653-D656 IonicContact NE-OD1 3.68Å; R653-D656 IonicContact NE-OD2 3.52Å; R653-D656 PolarHBondContact NE-OD2 2.69Å; R653-D656 IonicContact NH2-OD1 3.32Å; R653-D656 PolarHBondContact NH2-OD1 3.44Å; R653-D656 IonicContact NH2-OD2 3.6Å; R653-D656 WeakPolarHBondContact O-CB 3.38Å; R653-D656 PolarHBondContact O-N 3.15Å; R653-F657 VanDerWaalsContact O-CD2 3.32Å; R653-F657 WeakPolarHBondContact O-CD2 3.29Å; R653-D709 CarbonylContact C-O 3.44Å; R653-D709 WeakPolarHBondContact CA-O 3.33Å; R653-L710 HydrophobicContact CB-CD2 4.36Å; R653-L710 HydrophobicContact CG-CD2 3.7Å
654	T	95.3	Very high	94.7	Very high	14 Å²	14	77.6 Å²	77.6	9%	0.086	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-55.3	-32.8	176.9	-58.1	0	0	0	0	112.4	D656 F657 L662 L672 D709 W711	T654-D656 VanDerWaalsContact C-N 3.3Å; T654-D656 PolarHBondContact O-N 3.34Å; T654-F657 PolarHBondContact O-N 2.76Å; T654-L662 HydrophobicContact CG2-CD2 4.12Å; T654-L672 HydrophobicContact CG2-CD1 4.36Å; T654-L672 HydrophobicContact CG2-CD2 3.73Å; T654-D709 PolarHBondContact N-O 3.49Å; T654-D709 WeakPolarHBondContact OG1-CA 3.42Å; T654-D709 PolarHBondContact OG1-O 2.9Å; T654-W711 PolarHBondContact OG1-NE1 3.21Å
655	I	94	Very high	94.7	Very high	141 Å²	141	73.2 Å²	73.2	72%	0.723	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-67.9	-22.2	176.9	-169.3	165.1	0	0	0	114.3	R653 F657	R653-I655 HydrophobicContact CB-CG2 3.84Å; R653-I655 PolarHBondContact O-N 3.21Å; R653-I655 VanDerWaalsContact O-N 3.13Å; I655-F657 VanDerWaalsContact C-N 3.32Å
656	D	93.4	Very high	94.6	Very high	34 Å²	34	71.7 Å²	71.7	18%	0.182	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-78.7	-17.7	179.4	-59.4	-62.5	0	0	0	112.5	Y559 I563 V625 R653 T654	Y559-D656 PolarHBondContact OH-OD2 3.16Å; Y559-D656 VanDerWaalsContact OH-OD2 3.04Å; I563-D656 HydrophobicContact CG2-CB 4.19Å; V625-D656 HydrophobicContact CG1-CB 4.2Å; V625-D656 WeakPolarHBondContact CG1-O 3.47Å; R653-D656 WeakPolarHBondContact CB-OD2 3.42Å; R653-D656 WeakPolarHBondContact CG-OD2 3.46Å; R653-D656 IonicContact CZ-OD1 3.76Å; R653-D656 IonicContact CZ-OD2 3.76Å; R653-D656 PolarHBondContact N-OD2 3.14Å; R653-D656 IonicContact NE-OD1 3.68Å; R653-D656 IonicContact NE-OD2 3.52Å; R653-D656 PolarHBondContact NE-OD2 2.69Å; R653-D656 IonicContact NH2-OD1 3.32Å; R653-D656 PolarHBondContact NH2-OD1 3.44Å; R653-D656 IonicContact NH2-OD2 3.6Å; R653-D656 WeakPolarHBondContact O-CB 3.38Å; R653-D656 PolarHBondContact O-N 3.15Å; T654-D656 VanDerWaalsContact C-N 3.3Å; T654-D656 PolarHBondContact O-N 3.34Å
657	F	95.8	Very high	94.7	Very high	9 Å²	9	73.3 Å²	73.3	4%	0.039	36%	0.358	C	S	.	.	S	Bend	trans	-69.4	140.6	-179.1	-74	-100.1	0	0	0	112.1	V625 W628 L652 R653 T654 I655 K659 V661 L662 L668 L716	V625-F657 HydrophobicContact CG2-CD1 4.49Å; V625-F657 HydrophobicContact CG2-CE1 4.15Å; V625-F657 HydrophobicContact CG2-CE2 4.42Å; V625-F657 HydrophobicContact CG2-CZ 4.12Å; W628-F657 HydrophobicContact CE3-CE1 4.38Å; W628-F657 AromaticContact CZ3-CE1 4Å; W628-F657 HydrophobicContact CZ3-CE1 4Å; L652-F657 HydrophobicContact CB-CE2 4.47Å; R653-F657 VanDerWaalsContact O-CD2 3.32Å; R653-F657 WeakPolarHBondContact O-CD2 3.29Å; T654-F657 PolarHBondContact O-N 2.76Å; I655-F657 VanDerWaalsContact C-N 3.32Å; F657-K659 PolarHBondContact O-N 2.69Å; F657-V661 HydrophobicContact CD1-CG1 4.06Å; F657-L662 HydrophobicContact CB-CD1 4.12Å; F657-L662 HydrophobicContact CB-CD2 3.89Å; F657-L662 HydrophobicContact CB-CG 3.81Å; F657-L662 HydrophobicContact CG-CD2 4.28Å; F657-L668 HydrophobicContact CD1-CD2 4.24Å; F657-L668 HydrophobicContact CE1-CD2 4.28Å; F657-L716 HydrophobicContact CE1-CD1 4.34Å; F657-L716 HydrophobicContact CE1-CD2 4.38Å; F657-L716 HydrophobicContact CZ-CD1 3.88Å; F657-L716 HydrophobicContact CZ-CD2 3.89Å
658	N	94.9	Very high	94.7	Very high	61 Å²	61	70.7 Å²	70.7	33%	0.326	35%	0.346	S	S	.	.			trans	-57.4	130	168.9	176.8	-1.1	0	0	0	109.6	V625 T626 Q660 V661 L662	V625-N658 PolarHBondContact O-N 2.88Å; T626-N658 WeakPolarHBondContact O-CB 3.16Å; T626-N658 PolarHBondContact O-ND2 2.67Å; N658-Q660 PolarHBondContact O-N 2.87Å; N658-Q660 VanDerWaalsContact O-N 3.08Å; N658-Q660 PolarHBondContact OD1-N 3.01Å; N658-V661 HydrophobicContact CB-CG2 4.13Å; N658-V661 WeakPolarHBondContact O-CA 3.32Å; N658-V661 WeakPolarHBondContact O-CB 3.49Å; N658-V661 PolarHBondContact O-N 3.07Å; N658-L662 PolarHBondContact O-N 3.47Å
659	K	94.1	Very high	94.7	Very high	167 Å²	167	69.5 Å²	69.5	73%	0.726	34%	0.339	S	S	*	.	H	α-helix	trans	-52.6	-32.4	176.9	-62.5	-168.7	177.9	-168.5	0	112.6	F657 V661 L662 N663	F657-K659 PolarHBondContact O-N 2.69Å; K659-V661 VanDerWaalsContact C-N 3.34Å; K659-V661 PolarHBondContact O-N 3.48Å; K659-L662 PolarHBondContact O-N 3.25Å; K659-N663 VanDerWaalsContact O-CB 3.3Å; K659-N663 WeakPolarHBondContact O-CB 3.28Å; K659-N663 PolarHBondContact O-N 2.95Å; K659-N663 PolarHBondContact O-OD1 2.88Å; K659-N663 VanDerWaalsContact O-OD1 3.13Å
660	Q	94.4	Very high	94.6	Very high	123 Å²	123	67 Å²	67	58%	0.575	33%	0.33	S	S	*	.	H	α-helix	trans	-67.9	-30	175	-66.3	-175.8	-17.3	0	0	113.6	N658 R664	N658-Q660 PolarHBondContact O-N 2.87Å; N658-Q660 VanDerWaalsContact O-N 3.08Å; N658-Q660 PolarHBondContact OD1-N 3.01Å; Q660-R664 WeakPolarHBondContact O-CB 3.44Å; Q660-R664 VanDerWaalsContact O-CG 3.24Å; Q660-R664 WeakPolarHBondContact O-CG 3.45Å; Q660-R664 PolarHBondContact O-N 2.91Å
661	V	95.2	Very high	94.7	Very high	8 Å²	8	65.5 Å²	65.5	5%	0.048	32%	0.32	C	S	.	.	H	α-helix	trans	-71	-51.3	173.2	171.9	0	0	0	0	109.5	W628 F657 N658 K659 N663 R664 Q665 L668	W628-V661 HydrophobicContact CB-CG1 3.99Å; W628-V661 HydrophobicContact CB-CG2 4.21Å; W628-V661 HydrophobicContact CD2-CG1 4.08Å; W628-V661 HydrophobicContact CE3-CG1 3.62Å; W628-V661 HydrophobicContact CG-CG1 4.28Å; W628-V661 HydrophobicContact CZ3-CG1 4.44Å; F657-V661 HydrophobicContact CD1-CG1 4.06Å; N658-V661 HydrophobicContact CB-CG2 4.13Å; N658-V661 WeakPolarHBondContact O-CA 3.32Å; N658-V661 WeakPolarHBondContact O-CB 3.49Å; N658-V661 PolarHBondContact O-N 3.07Å; K659-V661 VanDerWaalsContact C-N 3.34Å; K659-V661 PolarHBondContact O-N 3.48Å; V661-N663 VanDerWaalsContact C-N 3.28Å; V661-N663 PolarHBondContact O-N 2.86Å; V661-R664 PolarHBondContact O-N 2.83Å; V661-Q665 HydrophobicContact CG1-CG 4.14Å; V661-Q665 VanDerWaalsContact O-CB 3.32Å; V661-Q665 WeakPolarHBondContact O-CB 3.47Å; V661-Q665 WeakPolarHBondContact O-CG 3.47Å; V661-Q665 PolarHBondContact O-N 3.01Å; V661-L668 HydrophobicContact CG1-CD2 4.31Å
662	L	94.1	Very high	94.8	Very high	43 Å²	43	64.3 Å²	64.3	23%	0.225	31%	0.314	C	S	.	.	H	α-helix	trans	-57.2	-40.5	178.4	-64.7	173.4	0	0	0	112.5	T654 F657 N658 K659 L668	T654-L662 HydrophobicContact CG2-CD2 4.12Å; F657-L662 HydrophobicContact CB-CD1 4.12Å; F657-L662 HydrophobicContact CB-CD2 3.89Å; F657-L662 HydrophobicContact CB-CG 3.81Å; F657-L662 HydrophobicContact CG-CD2 4.28Å; N658-L662 PolarHBondContact O-N 3.47Å; K659-L662 PolarHBondContact O-N 3.25Å; L662-L668 HydrophobicContact CD2-CD2 3.88Å
663	N	92.1	Very high	94.7	Very high	132 Å²	132	65.8 Å²	65.8	71%	0.706	32%	0.324	S	S	*	.	H	α-helix	trans	-76.1	-26.2	-178.5	-69.1	13	0	0	0	113.9	K659 V661	K659-N663 VanDerWaalsContact O-CB 3.3Å; K659-N663 WeakPolarHBondContact O-CB 3.28Å; K659-N663 PolarHBondContact O-N 2.95Å; K659-N663 PolarHBondContact O-OD1 2.88Å; K659-N663 VanDerWaalsContact O-OD1 3.13Å; V661-N663 VanDerWaalsContact C-N 3.28Å; V661-N663 PolarHBondContact O-N 2.86Å
664	R	94.1	Very high	94.8	Very high	193 Å²	193	62.2 Å²	62.2	73%	0.728	31%	0.31	S	S	*	.	H	α-helix	trans	-92.3	-31.2	-179.8	-72.5	176.7	174.7	-165.5	-4.8	113	Q660 V661 S666	Q660-R664 WeakPolarHBondContact O-CB 3.44Å; Q660-R664 VanDerWaalsContact O-CG 3.24Å; Q660-R664 WeakPolarHBondContact O-CG 3.45Å; Q660-R664 PolarHBondContact O-N 2.91Å; V661-R664 PolarHBondContact O-N 2.83Å; R664-S666 PolarHBondContact O-N 3.34Å; R664-S666 VanDerWaalsContact O-N 3.15Å
665	Q	95.3	Very high	94.9	Very high	59 Å²	59	61.5 Å²	61.5	28%	0.276	31%	0.306	S	S	.	.			trans	-91.7	80.3	-171.3	-62.9	-58.3	-36.7	0	0	111.4	W628 V661 N667 L668 L669	W628-Q665 HydrophobicContact CB-CG 4.32Å; W628-Q665 HydrophobicContact CD2-CG 3.78Å; W628-Q665 HydrophobicContact CG-CG 3.67Å; V661-Q665 HydrophobicContact CG1-CG 4.14Å; V661-Q665 VanDerWaalsContact O-CB 3.32Å; V661-Q665 WeakPolarHBondContact O-CB 3.47Å; V661-Q665 WeakPolarHBondContact O-CG 3.47Å; V661-Q665 PolarHBondContact O-N 3.01Å; Q665-N667 PolarHBondContact O-N 3.38Å; Q665-L668 HydrophobicContact CB-CB 3.87Å; Q665-L668 WeakPolarHBondContact O-CB 3.48Å; Q665-L668 PolarHBondContact O-N 3.42Å; Q665-L669 PolarHBondContact O-N 3.4Å; Q665-L669 VanDerWaalsContact O-N 3.15Å
666	S	93.1	Very high	94.9	Very high	77 Å²	77	58.3 Å²	58.3	54%	0.538	29%	0.287	S	S	.	.	H	α-helix	trans	-47.6	-43.2	176.4	59.1	0	0	0	0	112.8	R664 L668 L669 N670	R664-S666 PolarHBondContact O-N 3.34Å; R664-S666 VanDerWaalsContact O-N 3.15Å; S666-L668 PolarHBondContact O-N 3.29Å; S666-L669 PolarHBondContact O-N 2.99Å; S666-N670 WeakPolarHBondContact O-CB 3.46Å; S666-N670 PolarHBondContact O-N 3.41Å
667	N	94	Very high	94.9	Very high	55 Å²	55	57.2 Å²	57.2	29%	0.294	28%	0.28	S	S	.	.	H	α-helix	trans	-66.2	-34.9	178.2	-82.9	-39	0	0	0	113.7	Q665 C671 V719	Q665-N667 PolarHBondContact O-N 3.38Å; N667-C671 WeakPolarHBondContact O-CB 3.42Å; N667-C671 PolarHBondContact O-N 2.9Å; N667-C671 PolarHBondContact O-SG 3.2Å; N667-V719 HydrophobicContact CB-CG1 4.17Å
668	L	96.5	Very high	94.9	Very high	3 Å²	3	56.8 Å²	56.8	2%	0.016	28%	0.279	C	S	.	.	H	α-helix	trans	-66.7	-44	174.3	178.7	62.3	0	0	0	110.8	W628 F657 V661 L662 Q665 S666 C671 L672 W711 L716 V719	W628-L668 HydrophobicContact CE3-CD2 4.39Å; W628-L668 HydrophobicContact CH2-CB 4.13Å; W628-L668 HydrophobicContact CH2-CD1 4.03Å; W628-L668 HydrophobicContact CH2-CD2 4.07Å; W628-L668 HydrophobicContact CH2-CG 4.3Å; W628-L668 HydrophobicContact CZ2-CB 4.48Å; W628-L668 HydrophobicContact CZ3-CD1 4.3Å; W628-L668 HydrophobicContact CZ3-CD2 3.76Å; W628-L668 HydrophobicContact CZ3-CG 4.46Å; F657-L668 HydrophobicContact CD1-CD2 4.24Å; F657-L668 HydrophobicContact CE1-CD2 4.28Å; V661-L668 HydrophobicContact CG1-CD2 4.31Å; L662-L668 HydrophobicContact CD2-CD2 3.88Å; Q665-L668 HydrophobicContact CB-CB 3.87Å; Q665-L668 WeakPolarHBondContact O-CB 3.48Å; Q665-L668 PolarHBondContact O-N 3.42Å; S666-L668 PolarHBondContact O-N 3.29Å; L668-C671 PolarHBondContact O-N 3.48Å; L668-L672 WeakPolarHBondContact O-CB 3.36Å; L668-L672 PolarHBondContact O-N 3.34Å; L668-W711 HydrophobicContact CD1-CD2 4.36Å; L668-W711 HydrophobicContact CD1-CE3 4.37Å; L668-W711 HydrophobicContact CD1-CH2 3.79Å; L668-W711 HydrophobicContact CD1-CZ2 3.75Å; L668-W711 HydrophobicContact CD1-CZ3 4.11Å; L668-L716 HydrophobicContact CD1-CD2 4.12Å; L668-V719 HydrophobicContact CB-CG1 3.97Å; L668-V719 HydrophobicContact CD1-CG1 4.35Å; L668-V719 HydrophobicContact CD1-CG2 4.46Å
669	L	95.2	Very high	94.9	Very high	93 Å²	93	56.6 Å²	56.6	49%	0.487	28%	0.278	S	S	.	.	H	α-helix	trans	-67.9	-42.4	178.1	-173.5	60.6	0	0	0	112.3	Q665 S666 C671 L672 T673	Q665-L669 PolarHBondContact O-N 3.4Å; Q665-L669 VanDerWaalsContact O-N 3.15Å; S666-L669 PolarHBondContact O-N 2.99Å; L669-C671 PolarHBondContact O-N 3.36Å; L669-L672 HydrophobicContact CD1-CD2 4.41Å; L669-L672 PolarHBondContact O-N 2.9Å; L669-T673 PolarHBondContact O-N 3.38Å; L669-T673 PolarHBondContact O-OG1 3.29Å
670	N	94.9	Very high	94.9	Very high	39 Å²	39	51.3 Å²	51.3	21%	0.209	26%	0.257	C	S	.	.	H	α-helix	trans	-56.1	-49.4	172.7	179	22.2	0	0	0	110.9	S666 T673 L674 R729	S666-N670 WeakPolarHBondContact O-CB 3.46Å; S666-N670 PolarHBondContact O-N 3.41Å; N670-T673 PolarHBondContact O-N 2.99Å; N670-L674 WeakPolarHBondContact O-CB 3.27Å; N670-L674 VanDerWaalsContact O-CG 3.25Å; N670-L674 WeakPolarHBondContact O-CG 3.36Å; N670-L674 PolarHBondContact O-N 2.68Å; N670-R729 PolarHBondContact OD1-NH2 3.17Å
671	C	97.4	Very high	94.9	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.007	23%	0.23	C	C	.	.	H	α-helix	trans	-64.3	-42.4	175.6	-67.8	0	0	0	0	112.5	N667 L668 L669 T673 L674 R675 W711 V719 L724 L728	N667-C671 WeakPolarHBondContact O-CB 3.42Å; N667-C671 PolarHBondContact O-N 2.9Å; N667-C671 PolarHBondContact O-SG 3.2Å; L668-C671 PolarHBondContact O-N 3.48Å; L669-C671 PolarHBondContact O-N 3.36Å; C671-T673 PolarHBondContact O-N 2.92Å; C671-L674 PolarHBondContact O-N 3.31Å; C671-R675 WeakPolarHBondContact O-CB 3.5Å; C671-R675 WeakPolarHBondContact O-CG 3.43Å; C671-R675 PolarHBondContact O-N 2.89Å; C671-W711 HydrophobicContact CB-CH2 3.92Å; C671-W711 HydrophobicContact CB-CZ3 4.35Å; C671-V719 HydrophobicContact CB-CG2 4.08Å; C671-L724 HydrophobicContact CB-CD2 4.22Å; C671-L728 HydrophobicContact CB-CD1 4.11Å
672	L	96.5	Very high	94.8	Very high	16 Å²	16	46.4 Å²	46.4	8%	0.084	23%	0.234	C	C	.	.	H	α-helix	trans	-58.4	-47	177.5	179.9	63.7	0	0	0	111.5	T654 L668 L669 R675 K676 P708 W711	T654-L672 HydrophobicContact CG2-CD1 4.36Å; T654-L672 HydrophobicContact CG2-CD2 3.73Å; L668-L672 WeakPolarHBondContact O-CB 3.36Å; L668-L672 PolarHBondContact O-N 3.34Å; L669-L672 HydrophobicContact CD1-CD2 4.41Å; L669-L672 PolarHBondContact O-N 2.9Å; L672-R675 PolarHBondContact O-N 3.17Å; L672-K676 HydrophobicContact CD1-CD 4.48Å; L672-K676 HydrophobicContact CG-CD 4.42Å; L672-K676 WeakPolarHBondContact O-CG 3.48Å; L672-K676 PolarHBondContact O-N 2.69Å; L672-P708 WeakPolarHBondContact CD1-O 3.41Å; L672-W711 HydrophobicContact CB-CH2 4.46Å; L672-W711 HydrophobicContact CB-CZ2 3.99Å; L672-W711 HydrophobicContact CD1-CZ2 3.95Å
673	T	94.2	Very high	94.7	Very high	38 Å²	38	46.5 Å²	46.5	23%	0.233	24%	0.238	C	C	.	.	H	α-helix	trans	-71.2	-41.8	179.7	-52.4	0	0	0	0	111.6	H235 L669 N670 C671 R675 K676 Q677	H235-T673 WeakPolarHBondContact CE1-CB 3.37Å; H235-T673 WeakPolarHBondContact CE1-CG2 3.17Å; H235-T673 VanDerWaalsContact NE2-CB 3.34Å; H235-T673 WeakPolarHBondContact NE2-CB 3.25Å; H235-T673 WeakPolarHBondContact NE2-CG2 3.24Å; L669-T673 PolarHBondContact O-N 3.38Å; L669-T673 PolarHBondContact O-OG1 3.29Å; N670-T673 PolarHBondContact O-N 2.99Å; C671-T673 PolarHBondContact O-N 2.92Å; T673-R675 PolarHBondContact O-N 3.28Å; T673-K676 CarbonylContact O-C 3.53Å; T673-K676 WeakPolarHBondContact O-CA 3.4Å; T673-K676 PolarHBondContact O-N 3.18Å; T673-Q677 HydrophobicContact CG2-CG 4.17Å; T673-Q677 VanDerWaalsContact O-CG 3.31Å; T673-Q677 WeakPolarHBondContact O-CG 3.29Å; T673-Q677 PolarHBondContact O-N 3.23Å
674	L	96.2	Very high	94.8	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-53.9	-42.4	173.2	-74.7	166.7	0	0	0	111.5	L237 N670 C671 Q677 G678 L728 R729 L732	L237-L674 HydrophobicContact CD1-CD2 3.63Å; L237-L674 HydrophobicContact CG-CD2 3.98Å; N670-L674 WeakPolarHBondContact O-CB 3.27Å; N670-L674 VanDerWaalsContact O-CG 3.25Å; N670-L674 WeakPolarHBondContact O-CG 3.36Å; N670-L674 PolarHBondContact O-N 2.68Å; C671-L674 PolarHBondContact O-N 3.31Å; L674-Q677 PolarHBondContact O-N 2.93Å; L674-G678 PolarHBondContact O-N 3.14Å; L674-L728 HydrophobicContact CB-CB 4.13Å; L674-L728 HydrophobicContact CB-CD1 4.03Å; L674-L728 HydrophobicContact CD1-CB 4.13Å; L674-L728 HydrophobicContact CD1-CD1 4.45Å; L674-R729 HydrophobicContact CD1-CG 3.95Å; L674-R729 HydrophobicContact CD2-CG 3.97Å; L674-L732 HydrophobicContact CB-CD1 4.29Å; L674-L732 HydrophobicContact CD2-CD1 4.3Å; L674-L732 VanDerWaalsContact O-CD1 3.29Å; L674-L732 WeakPolarHBondContact O-CD1 3.32Å
675	R	97.2	Very high	94.8	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.9	-40.2	174.3	-72.1	178	65.2	-168.6	-0.2	112.9	C671 L672 T673 G678 N679 H703 W704 T707 P708 L710 W711 L728	C671-R675 WeakPolarHBondContact O-CB 3.5Å; C671-R675 WeakPolarHBondContact O-CG 3.43Å; C671-R675 PolarHBondContact O-N 2.89Å; L672-R675 PolarHBondContact O-N 3.17Å; T673-R675 PolarHBondContact O-N 3.28Å; R675-G678 PolarHBondContact O-N 3.31Å; R675-N679 PolarHBondContact O-N 3.37Å; R675-H703 PolarHBondContact NH2-O 3.1Å; R675-W704 WeakPolarHBondContact CB-O 3.21Å; R675-W704 WeakPolarHBondContact CG-O 3.47Å; R675-W704 PolarHBondContact NE-O 3.46Å; R675-T707 PolarHBondContact NH2-O 3Å; R675-P708 HydrophobicContact CB-CB 3.74Å; R675-P708 PolarHBondContact NH1-O 3.13Å; R675-P708 PolarHBondContact NH2-O 3.32Å; R675-L710 VanDerWaalsContact CZ-O 3.25Å; R675-L710 PolarHBondContact NH1-O 2.92Å; R675-L710 PolarHBondContact NH2-O 3.23Å; R675-W711 VanDerWaalsContact NH1-CD2 3.27Å; R675-L728 HydrophobicContact CG-CD1 3.72Å; R675-L728 HydrophobicContact CG-CD2 3.88Å; R675-L728 HydrophobicContact CG-CG 4.49Å
676	K	94.8	Very high	94.6	Very high	74 Å²	74	34.9 Å²	34.9	32%	0.322	19%	0.187	S	C	.	.	H	α-helix	trans	-68.6	-36.4	173.9	-71.7	-179.5	178.1	-178.8	0	113	L672 T673 N679 L680 P708 D709	L672-K676 HydrophobicContact CD1-CD 4.48Å; L672-K676 HydrophobicContact CG-CD 4.42Å; L672-K676 WeakPolarHBondContact O-CG 3.48Å; L672-K676 PolarHBondContact O-N 2.69Å; T673-K676 CarbonylContact O-C 3.53Å; T673-K676 WeakPolarHBondContact O-CA 3.4Å; T673-K676 PolarHBondContact O-N 3.18Å; K676-N679 WeakPolarHBondContact O-CB 3.38Å; K676-N679 PolarHBondContact O-N 3.36Å; K676-L680 WeakPolarHBondContact O-CG 3.48Å; K676-L680 PolarHBondContact O-N 3.16Å; K676-L680 VanDerWaalsContact O-N 3.11Å; K676-P708 HydrophobicContact CG-CB 3.76Å; K676-P708 HydrophobicContact CG-CG 3.8Å; K676-D709 VanDerWaalsContact CE-CG 3.46Å; K676-D709 WeakPolarHBondContact CE-OD1 3.44Å; K676-D709 WeakPolarHBondContact CE-OD2 3.47Å; K676-D709 IonicContact NZ-OD1 2.69Å; K676-D709 PolarHBondContact NZ-OD1 3.32Å; K676-D709 IonicContact NZ-OD2 4Å; K676-D709 PolarHBondContact NZ-OD2 3.48Å
677	Q	93.8	Very high	94.6	Very high	10 Å²	10	36.2 Å²	36.2	5%	0.047	18%	0.181	C	C	.	.	H	α-helix	trans	-61.9	-46.8	171.1	-65.4	179.7	-88.2	0	0	110.1	H235 T673 L674 L680 M681 F764	H235-Q677 PolarHBondContact ND1-OE1 3.48Å; T673-Q677 HydrophobicContact CG2-CG 4.17Å; T673-Q677 VanDerWaalsContact O-CG 3.31Å; T673-Q677 WeakPolarHBondContact O-CG 3.29Å; T673-Q677 PolarHBondContact O-N 3.23Å; L674-Q677 PolarHBondContact O-N 2.93Å; Q677-L680 PolarHBondContact O-N 3.34Å; Q677-M681 HydrophobicContact CB-CE 4.27Å; Q677-M681 WeakPolarHBondContact O-CG 3.44Å; Q677-M681 PolarHBondContact O-N 2.92Å; Q677-M681 VanDerWaalsContact O-N 3.08Å; Q677-F764 HydrophobicContact CB-CB 4.43Å; Q677-F764 WeakPolarHBondContact CB-O 3.28Å; Q677-F764 WeakPolarHBondContact CG-O 3.42Å; Q677-F764 PolarHBondContact NE2-O 2.92Å; Q677-F764 WeakPolarHBondContact O-CB 3.47Å
678	G	95.2	Very high	94.7	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-61.6	-41.3	174.6	0	0	0	0	0	114	L674 R675 L680 M681 L682	L674-G678 PolarHBondContact O-N 3.14Å; R675-G678 PolarHBondContact O-N 3.31Å; G678-L680 VanDerWaalsContact C-N 3.29Å; G678-L680 PolarHBondContact O-N 2.9Å; G678-M681 WeakPolarHBondContact O-CA 3.34Å; G678-M681 WeakPolarHBondContact O-CB 3.45Å; G678-M681 PolarHBondContact O-N 2.75Å; G678-L682 PolarHBondContact O-N 3.22Å; G678-L682 VanDerWaalsContact O-N 3.09Å
679	N	95.3	Very high	94.5	Very high	56 Å²	56	40 Å²	40	30%	0.299	20%	0.197	S	C	.	.	H	α-helix	trans	-54.4	-45.6	172	-179	-98.3	0	0	0	111.8	R675 K676 M681 L682 F705 E706 P708	R675-N679 PolarHBondContact O-N 3.37Å; K676-N679 WeakPolarHBondContact O-CB 3.38Å; K676-N679 PolarHBondContact O-N 3.36Å; N679-M681 VanDerWaalsContact C-N 3.26Å; N679-M681 PolarHBondContact O-N 3.03Å; N679-L682 WeakPolarHBondContact O-CB 3.36Å; N679-L682 PolarHBondContact O-N 3.02Å; N679-F705 WeakPolarHBondContact CA-O 3.36Å; N679-F705 WeakPolarHBondContact CB-O 2.8Å; N679-F705 PolarHBondContact ND2-O 2.63Å; N679-E706 PolarHBondContact ND2-O 2.94Å; N679-P708 HydrophobicContact CB-CG 4.12Å
680	L	93.4	Very high	94.5	Very high	56 Å²	56	39.2 Å²	39.2	29%	0.293	20%	0.196	S	C	.	.	H	α-helix	trans	-71.8	-15.2	177.6	-67.1	168.7	0	0	0	113.6	K676 Q677 G678 P763 F764 I771	K676-L680 WeakPolarHBondContact O-CG 3.48Å; K676-L680 PolarHBondContact O-N 3.16Å; K676-L680 VanDerWaalsContact O-N 3.11Å; Q677-L680 PolarHBondContact O-N 3.34Å; G678-L680 VanDerWaalsContact C-N 3.29Å; G678-L680 PolarHBondContact O-N 2.9Å; L680-P763 HydrophobicContact CB-CB 4.32Å; L680-P763 HydrophobicContact CB-CG 4.19Å; L680-P763 HydrophobicContact CD1-CB 4.32Å; L680-P763 HydrophobicContact CD2-CB 4.26Å; L680-F764 HydrophobicContact CB-CB 3.89Å; L680-I771 HydrophobicContact CD1-CD1 4.12Å
681	M	94	Very high	94.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-85.4	-25.8	170	-65.9	173.9	-156.6	0	0	113.3	L237 Q677 G678 N679 P683 F684 I685 L732 I735 V736 I739 F764	L237-M681 HydrophobicContact CD1-CE 4.45Å; Q677-M681 HydrophobicContact CB-CE 4.27Å; Q677-M681 WeakPolarHBondContact O-CG 3.44Å; Q677-M681 PolarHBondContact O-N 2.92Å; Q677-M681 VanDerWaalsContact O-N 3.08Å; G678-M681 WeakPolarHBondContact O-CA 3.34Å; G678-M681 WeakPolarHBondContact O-CB 3.45Å; G678-M681 PolarHBondContact O-N 2.75Å; N679-M681 VanDerWaalsContact C-N 3.26Å; N679-M681 PolarHBondContact O-N 3.03Å; M681-P683 VanDerWaalsContact C-N 3.31Å; M681-P683 VanDerWaalsContact O-N 3.15Å; M681-F684 WeakPolarHBondContact O-CA 3.49Å; M681-F684 WeakPolarHBondContact O-CB 3.29Å; M681-F684 PolarHBondContact O-N 3.01Å; M681-I685 HydrophobicContact CB-CD1 4Å; M681-I685 WeakPolarHBondContact O-CG1 3.27Å; M681-I685 PolarHBondContact O-N 3.39Å; M681-I685 VanDerWaalsContact O-N 3.08Å; M681-L732 HydrophobicContact CE-CD2 4.25Å; M681-L732 HydrophobicContact SD-CD2 3.71Å; M681-I735 HydrophobicContact CB-CG2 4.22Å; M681-I735 HydrophobicContact CG-CG2 4.41Å; M681-I735 HydrophobicContact SD-CB 4.33Å; M681-I735 HydrophobicContact SD-CG2 3.75Å; M681-V736 HydrophobicContact CE-CG2 3.43Å; M681-V736 VanDerWaalsContact CE-CG2 3.43Å; M681-V736 HydrophobicContact SD-CG2 4.12Å; M681-I739 HydrophobicContact CB-CD1 4.3Å; M681-I739 HydrophobicContact CG-CD1 4.19Å; M681-F764 HydrophobicContact CB-CD1 4.46Å; M681-F764 HydrophobicContact CE-CB 3.98Å; M681-F764 HydrophobicContact CE-CD2 3.57Å; M681-F764 HydrophobicContact CE-CE2 4.26Å; M681-F764 HydrophobicContact CE-CG 3.84Å; M681-F764 HydrophobicContact CG-CB 3.88Å; M681-F764 HydrophobicContact CG-CD1 3.54Å; M681-F764 HydrophobicContact CG-CD2 4.07Å; M681-F764 HydrophobicContact CG-CE1 4.08Å; M681-F764 HydrophobicContact CG-CG 3.54Å
682	L	93.7	Very high	94.1	Very high	28 Å²	28	41.7 Å²	41.7	15%	0.147	21%	0.206	C	C	.	.	H	α-helix	trans	-48.4	-42.4	-178.8	-68.4	178.2	0	0	0	114.1	G678 N679 F684 I685 Q686 F705 E706	G678-L682 PolarHBondContact O-N 3.22Å; G678-L682 VanDerWaalsContact O-N 3.09Å; N679-L682 WeakPolarHBondContact O-CB 3.36Å; N679-L682 PolarHBondContact O-N 3.02Å; L682-F684 VanDerWaalsContact C-N 3.26Å; L682-F684 PolarHBondContact O-N 2.99Å; L682-I685 HydrophobicContact CD2-CD1 4.26Å; L682-I685 PolarHBondContact O-N 2.83Å; L682-Q686 VanDerWaalsContact O-CB 3.32Å; L682-Q686 WeakPolarHBondContact O-CB 3.47Å; L682-Q686 WeakPolarHBondContact O-CG 3.49Å; L682-Q686 PolarHBondContact O-N 3.25Å; L682-F705 HydrophobicContact CD1-CB 3.97Å; L682-F705 HydrophobicContact CD2-CB 4.02Å; L682-F705 HydrophobicContact CG-CB 4.12Å; L682-E706 HydrophobicContact CD1-CG 4.32Å
683	P	92.6	Very high	93.9	Very high	45 Å²	45	47.5 Å²	47.5	29%	0.292	23%	0.233	S	C	.	.	H	α-helix	trans	-68	-21.4	179	-19.9	33.9	0	0	0	114.3	M681 R687	M681-P683 VanDerWaalsContact C-N 3.31Å; M681-P683 VanDerWaalsContact O-N 3.15Å; P683-R687 VanDerWaalsContact CB-NH1 3.32Å; P683-R687 WeakPolarHBondContact O-CG 3.41Å; P683-R687 PolarHBondContact O-NH1 2.85Å
684	F	93.6	Very high	93.8	Very high	11 Å²	11	49.1 Å²	49.1	5%	0.048	24%	0.24	C	C	.	.	H	α-helix	trans	-81.2	-47	173.4	-62.4	-94.2	0	0	0	110.1	M681 L682 Q686 R687 C688 I739 C745 C748 F762 P763 F764	M681-F684 WeakPolarHBondContact O-CA 3.49Å; M681-F684 WeakPolarHBondContact O-CB 3.29Å; M681-F684 PolarHBondContact O-N 3.01Å; L682-F684 VanDerWaalsContact C-N 3.26Å; L682-F684 PolarHBondContact O-N 2.99Å; F684-Q686 PolarHBondContact O-N 3.15Å; F684-R687 PolarHBondContact O-N 3.25Å; F684-R687 VanDerWaalsContact O-N 3.13Å; F684-C688 PolarHBondContact O-N 3.14Å; F684-C688 VanDerWaalsContact O-N 3.12Å; F684-I739 HydrophobicContact CB-CD1 3.7Å; F684-I739 HydrophobicContact CB-CG1 4.08Å; F684-I739 HydrophobicContact CD1-CG2 4.3Å; F684-I739 HydrophobicContact CG-CD1 4.14Å; F684-C745 HydrophobicContact CD1-CB 4.47Å; F684-C748 HydrophobicContact CD1-CB 3.93Å; F684-C748 HydrophobicContact CE1-CB 3.83Å; F684-C748 WeakPolarHBondContact CE1-O 3.34Å; F684-F762 HydrophobicContact CD1-CE1 4.34Å; F684-F762 AromaticContact CE1-CD1 3.76Å; F684-F762 HydrophobicContact CE1-CD1 3.76Å; F684-F762 AromaticContact CE1-CE1 3.73Å; F684-F762 HydrophobicContact CE1-CE1 3.73Å; F684-F762 AromaticContact CZ-CD1 3.83Å; F684-F762 HydrophobicContact CZ-CD1 3.83Å; F684-F762 HydrophobicContact CZ-CE1 4.28Å; F684-P763 HydrophobicContact CE2-CG 4.09Å; F684-F764 HydrophobicContact CD2-CD1 4.39Å; F684-F764 HydrophobicContact CD2-CE1 4.13Å; F684-F764 HydrophobicContact CE2-CD1 4.2Å; F684-F764 HydrophobicContact CE2-CE1 4.02Å; F684-F764 HydrophobicContact CZ-CE1 4.43Å
685	I	93.4	Very high	93.4	Very high	9 Å²	9	49.8 Å²	49.8	5%	0.046	24%	0.244	C	C	.	.	H	α-helix	trans	-55.7	-51.1	175.8	-60	158.9	0	0	0	109.9	M681 L682 R687 C688 Q692 F697 I735	M681-I685 HydrophobicContact CB-CD1 4Å; M681-I685 WeakPolarHBondContact O-CG1 3.27Å; M681-I685 PolarHBondContact O-N 3.39Å; M681-I685 VanDerWaalsContact O-N 3.08Å; L682-I685 HydrophobicContact CD2-CD1 4.26Å; L682-I685 PolarHBondContact O-N 2.83Å; I685-R687 PolarHBondContact O-N 3.48Å; I685-C688 PolarHBondContact O-N 2.87Å; I685-C688 VanDerWaalsContact O-N 3.16Å; I685-Q692 HydrophobicContact CG2-CG 4.14Å; I685-Q692 WeakPolarHBondContact O-CG 3.28Å; I685-Q692 PolarHBondContact O-NE2 2.93Å; I685-F697 HydrophobicContact CD1-CE1 4.28Å; I685-F697 HydrophobicContact CD1-CZ 3.86Å; I685-F697 HydrophobicContact CG1-CZ 4.46Å; I685-F697 HydrophobicContact CG2-CE2 3.72Å; I685-F697 HydrophobicContact CG2-CZ 3.85Å; I685-I735 HydrophobicContact CD1-CD1 4.01Å; I685-I735 HydrophobicContact CD1-CG2 3.93Å; I685-I735 HydrophobicContact CG1-CG2 3.83Å
686	Q	92.7	Very high	93.1	Very high	121 Å²	121	54 Å²	54	57%	0.565	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.7	-179.9	-74.2	171.8	-7.2	0	0	114.6	L682 F684 Q692	L682-Q686 VanDerWaalsContact O-CB 3.32Å; L682-Q686 WeakPolarHBondContact O-CB 3.47Å; L682-Q686 WeakPolarHBondContact O-CG 3.49Å; L682-Q686 PolarHBondContact O-N 3.25Å; F684-Q686 PolarHBondContact O-N 3.15Å; Q686-Q692 PolarHBondContact O-NE2 3.01Å
687	R	92.9	Very high	92.7	Very high	104 Å²	104	53.2 Å²	53.2	39%	0.392	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-6.8	-179.3	-63.8	-176	-167.8	100.2	12.3	114	P683 F684 I685 R744	P683-R687 VanDerWaalsContact CB-NH1 3.32Å; P683-R687 WeakPolarHBondContact O-CG 3.41Å; P683-R687 PolarHBondContact O-NH1 2.85Å; F684-R687 PolarHBondContact O-N 3.25Å; F684-R687 VanDerWaalsContact O-N 3.13Å; I685-R687 PolarHBondContact O-N 3.48Å; R687-R744 VanDerWaalsContact O-CD 3.31Å; R687-R744 WeakPolarHBondContact O-CD 3.09Å
688	C	95.2	Very high	92.4	Very high	3 Å²	3	59 Å²	59	2%	0.02	30%	0.299	C	S	.	.			trans	-121.8	104.2	179.9	-170.2	0	0	0	0	110.9	F684 I685 T690 A691 Q692 H738	F684-C688 PolarHBondContact O-N 3.14Å; F684-C688 VanDerWaalsContact O-N 3.12Å; I685-C688 PolarHBondContact O-N 2.87Å; I685-C688 VanDerWaalsContact O-N 3.16Å; C688-T690 PolarHBondContact O-N 3.29Å; C688-A691 HydrophobicContact CB-CB 3.87Å; C688-A691 WeakPolarHBondContact O-CA 3.06Å; C688-A691 WeakPolarHBondContact O-CB 3.36Å; C688-A691 PolarHBondContact O-N 2.81Å; C688-Q692 PolarHBondContact O-N 3.5Å; C688-Q692 VanDerWaalsContact O-N 3.12Å; C688-H738 PolarHBondContact SG-NE2 3.15Å
689	Q	93.1	Very high	92.1	Very high	136 Å²	136	63 Å²	63	64%	0.636	33%	0.327	S	S	*	.	H	α-helix	trans	-53.6	-38.2	179.9	-173	177.5	7.4	0	0	112.8	A691 Q692 Q693	Q689-A691 PolarHBondContact O-N 3.23Å; Q689-Q692 WeakPolarHBondContact O-CB 3.06Å; Q689-Q692 PolarHBondContact O-N 3.26Å; Q689-Q693 WeakPolarHBondContact O-CG 3.18Å; Q689-Q693 PolarHBondContact O-N 2.85Å
690	T	93.8	Very high	92	Very high	75 Å²	75	61.4 Å²	61.4	46%	0.46	32%	0.318	S	S	.	.	H	α-helix	trans	-63.1	-40.7	175	-47.1	0	0	0	0	111.9	C688 Q692 Q693 L694	C688-T690 PolarHBondContact O-N 3.29Å; T690-Q692 VanDerWaalsContact C-N 3.32Å; T690-Q692 PolarHBondContact O-N 3.45Å; T690-Q693 PolarHBondContact O-N 3.26Å; T690-Q693 VanDerWaalsContact O-N 3.12Å; T690-L694 WeakPolarHBondContact O-CG 3.32Å; T690-L694 PolarHBondContact O-N 2.97Å
691	A	92.4	Very high	92.1	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.9	-32.4	177.3	0	0	0	0	0	112.7	C688 Q689 Q693 L694	C688-A691 HydrophobicContact CB-CB 3.87Å; C688-A691 WeakPolarHBondContact O-CA 3.06Å; C688-A691 WeakPolarHBondContact O-CB 3.36Å; C688-A691 PolarHBondContact O-N 2.81Å; Q689-A691 PolarHBondContact O-N 3.23Å; A691-Q693 PolarHBondContact O-N 3.25Å; A691-L694 PolarHBondContact O-N 3.5Å
692	Q	91.9	Very high	92	Very high	92 Å²	92	64 Å²	64	43%	0.43	34%	0.34	S	S	.	.	H	α-helix	trans	-66	-21.2	173.5	-60.3	173.4	-19.1	0	0	112.8	I685 Q686 C688 Q689 T690	I685-Q692 HydrophobicContact CG2-CG 4.14Å; I685-Q692 WeakPolarHBondContact O-CG 3.28Å; I685-Q692 PolarHBondContact O-NE2 2.93Å; Q686-Q692 PolarHBondContact O-NE2 3.01Å; C688-Q692 PolarHBondContact O-N 3.5Å; C688-Q692 VanDerWaalsContact O-N 3.12Å; Q689-Q692 WeakPolarHBondContact O-CB 3.06Å; Q689-Q692 PolarHBondContact O-N 3.26Å; T690-Q692 VanDerWaalsContact C-N 3.32Å; T690-Q692 PolarHBondContact O-N 3.45Å
693	Q	93	Very high	92.1	Very high	138 Å²	138	63.3 Å²	63.3	65%	0.645	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-8.6	-176.7	-68.9	168.3	-25.6	0	0	113.5	Q689 T690 A691 V695	Q689-Q693 WeakPolarHBondContact O-CG 3.18Å; Q689-Q693 PolarHBondContact O-N 2.85Å; T690-Q693 PolarHBondContact O-N 3.26Å; T690-Q693 VanDerWaalsContact O-N 3.12Å; A691-Q693 PolarHBondContact O-N 3.25Å; Q693-V695 VanDerWaalsContact C-N 3.34Å
694	L	92.4	Very high	92.3	Very high	72 Å²	72	62.7 Å²	62.7	38%	0.377	33%	0.327	S	S	.	.	S	Bend	trans	-73.9	-26	178.9	-61.6	172.2	0	0	0	113.3	T690 A691 H738	T690-L694 WeakPolarHBondContact O-CG 3.32Å; T690-L694 PolarHBondContact O-N 2.97Å; A691-L694 PolarHBondContact O-N 3.5Å; L694-H738 HydrophobicContact CD1-CB 3.46Å; L694-H738 VanDerWaalsContact CD1-CB 3.46Å
695	V	88.1	Confident	92.4	Very high	14 Å²	14	62.6 Å²	62.6	9%	0.085	33%	0.327	C	S	.	.	S	Bend	trans	-143.7	129.9	-170.1	168.9	0	0	0	0	108.5	Q693 F697 I700 L731 I735	Q693-V695 VanDerWaalsContact C-N 3.34Å; V695-F697 VanDerWaalsContact C-N 3.34Å; V695-F697 HydrophobicContact CB-CD2 4.29Å; V695-F697 HydrophobicContact CB-CE1 4.45Å; V695-F697 HydrophobicContact CB-CE2 3.81Å; V695-F697 HydrophobicContact CB-CZ 3.89Å; V695-F697 HydrophobicContact CG1-CD1 4.2Å; V695-F697 HydrophobicContact CG1-CD2 4.28Å; V695-F697 HydrophobicContact CG1-CE1 4.03Å; V695-F697 HydrophobicContact CG1-CE2 4.12Å; V695-F697 HydrophobicContact CG1-CG 4.32Å; V695-F697 HydrophobicContact CG1-CZ 3.98Å; V695-F697 WeakPolarHBondContact O-CD2 3.39Å; V695-F697 WeakPolarHBondContact O-CE2 3.21Å; V695-F697 PolarHBondContact O-N 3.01Å; V695-I700 HydrophobicContact CG1-CD1 3.39Å; V695-L731 HydrophobicContact CG1-CD2 3.75Å; V695-L731 HydrophobicContact CG2-CD2 4.45Å; V695-I735 HydrophobicContact CG2-CD1 4.13Å; V695-I735 HydrophobicContact CG2-CG1 4.27Å
696	D	89.7	Confident	92.5	Very high	88 Å²	88	67.7 Å²	67.7	47%	0.471	35%	0.351	S	S	.	.			trans	-76.2	87.1	171.2	178.5	13.9	0	0	0	110.9	T698 S699 I700	D696-T698 PolarHBondContact O-N 2.82Å; D696-T698 VanDerWaalsContact O-N 3.13Å; D696-T698 WeakPolarHBondContact OD1-CA 3.44Å; D696-T698 VanDerWaalsContact OD1-CB 3.29Å; D696-T698 WeakPolarHBondContact OD1-CB 3.43Å; D696-T698 PolarHBondContact OD1-N 3.04Å; D696-T698 PolarHBondContact OD1-OG1 3.37Å; D696-T698 PolarHBondContact OD2-OG1 3.06Å; D696-S699 PolarHBondContact O-N 2.99Å; D696-S699 VanDerWaalsContact O-N 3.14Å; D696-S699 PolarHBondContact O-OG 2.87Å; D696-S699 PolarHBondContact OD1-N 3.23Å; D696-S699 WeakPolarHBondContact OD2-CB 3.35Å; D696-I700 WeakPolarHBondContact O-CD1 3.47Å
697	F	87.1	Confident	92.7	Very high	58 Å²	58	64.7 Å²	64.7	25%	0.254	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-11.8	173.9	-64.9	-80.2	0	0	0	114.3	I685 V695 F705 I735	I685-F697 HydrophobicContact CD1-CE1 4.28Å; I685-F697 HydrophobicContact CD1-CZ 3.86Å; I685-F697 HydrophobicContact CG1-CZ 4.46Å; I685-F697 HydrophobicContact CG2-CE2 3.72Å; I685-F697 HydrophobicContact CG2-CZ 3.85Å; V695-F697 VanDerWaalsContact C-N 3.34Å; V695-F697 HydrophobicContact CB-CD2 4.29Å; V695-F697 HydrophobicContact CB-CE1 4.45Å; V695-F697 HydrophobicContact CB-CE2 3.81Å; V695-F697 HydrophobicContact CB-CZ 3.89Å; V695-F697 HydrophobicContact CG1-CD1 4.2Å; V695-F697 HydrophobicContact CG1-CD2 4.28Å; V695-F697 HydrophobicContact CG1-CE1 4.03Å; V695-F697 HydrophobicContact CG1-CE2 4.12Å; V695-F697 HydrophobicContact CG1-CG 4.32Å; V695-F697 HydrophobicContact CG1-CZ 3.98Å; V695-F697 WeakPolarHBondContact O-CD2 3.39Å; V695-F697 WeakPolarHBondContact O-CE2 3.21Å; V695-F697 PolarHBondContact O-N 3.01Å; F697-F705 HydrophobicContact CE1-CD2 4.38Å; F697-F705 HydrophobicContact CE1-CE2 4.34Å; F697-I735 HydrophobicContact CE1-CD1 4.3Å; F697-I735 HydrophobicContact CZ-CD1 3.74Å
698	T	87.7	Confident	92.8	Very high	132 Å²	132	60.2 Å²	60.2	81%	0.81	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-24.5	174.8	77.8	0	0	0	0	112.6	D696 I700	D696-T698 PolarHBondContact O-N 2.82Å; D696-T698 VanDerWaalsContact O-N 3.13Å; D696-T698 WeakPolarHBondContact OD1-CA 3.44Å; D696-T698 VanDerWaalsContact OD1-CB 3.29Å; D696-T698 WeakPolarHBondContact OD1-CB 3.43Å; D696-T698 PolarHBondContact OD1-N 3.04Å; D696-T698 PolarHBondContact OD1-OG1 3.37Å; D696-T698 PolarHBondContact OD2-OG1 3.06Å; T698-I700 VanDerWaalsContact C-N 3.34Å
699	S	89.5	Confident	92.8	Very high	86 Å²	86	63.1 Å²	63.1	60%	0.601	34%	0.34	S	S	*	.	S	Bend	trans	-79.8	-12.3	175.1	72.3	0	0	0	0	114.3	D696	D696-S699 PolarHBondContact O-N 2.99Å; D696-S699 VanDerWaalsContact O-N 3.14Å; D696-S699 PolarHBondContact O-OG 2.87Å; D696-S699 PolarHBondContact OD1-N 3.23Å; D696-S699 WeakPolarHBondContact OD2-CB 3.35Å
700	I	92	Very high	93	Very high	21 Å²	21	58 Å²	58	11%	0.108	32%	0.318	C	S	.	.	S	Bend	trans	-107.8	138.6	-169	-62.1	158.8	0	0	0	110	V695 D696 T698 S702 W704 F705 L731	V695-I700 HydrophobicContact CG1-CD1 3.39Å; D696-I700 WeakPolarHBondContact O-CD1 3.47Å; T698-I700 VanDerWaalsContact C-N 3.34Å; I700-S702 PolarHBondContact O-N 2.86Å; I700-S702 VanDerWaalsContact O-N 3.11Å; I700-W704 HydrophobicContact CG2-CB 4.49Å; I700-W704 HydrophobicContact CG2-CD2 4.08Å; I700-W704 HydrophobicContact CG2-CE3 3.63Å; I700-W704 HydrophobicContact CG2-CG 4.47Å; I700-W704 HydrophobicContact CG2-CZ3 4.2Å; I700-F705 HydrophobicContact CG2-CE2 4.38Å; I700-L731 HydrophobicContact CD1-CD1 3.81Å; I700-L731 HydrophobicContact CD1-CD2 3.5Å; I700-L731 VanDerWaalsContact CD1-CD2 3.5Å; I700-L731 HydrophobicContact CD1-CG 4.27Å; I700-L731 HydrophobicContact CG1-CD1 4.22Å; I700-L731 HydrophobicContact CG1-CD2 4.38Å; I700-L731 HydrophobicContact CG2-CD1 4.37Å
701	P	94.9	Very high	93.2	Very high	54 Å²	54	54.6 Å²	54.6	35%	0.351	30%	0.296	S	S	.	.			trans	-61.9	115.8	175.4	-20.2	32.3	0	0	0	111.2	H703 W704	P701-H703 WeakPolarHBondContact CB-CE1 3.32Å; P701-H703 PolarHBondContact O-N 3.2Å; P701-H703 VanDerWaalsContact O-N 3.07Å; P701-W704 HydrophobicContact CB-CG 4.4Å; P701-W704 HydrophobicContact CG-CD2 4.5Å; P701-W704 HydrophobicContact CG-CZ2 4.25Å; P701-W704 VanDerWaalsContact O-CB 3.27Å; P701-W704 WeakPolarHBondContact O-CB 3.49Å; P701-W704 PolarHBondContact O-N 3.22Å
702	S	93.4	Very high	93.4	Very high	56 Å²	56	54.7 Å²	54.7	39%	0.392	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-31.1	-169.2	79.7	0	0	0	0	113.5	I700 W704 F705 E706	I700-S702 PolarHBondContact O-N 2.86Å; I700-S702 VanDerWaalsContact O-N 3.11Å; S702-W704 PolarHBondContact O-N 3.27Å; S702-W704 VanDerWaalsContact O-N 3.11Å; S702-F705 PolarHBondContact O-N 3.14Å; S702-F705 VanDerWaalsContact O-N 3.16Å; S702-E706 WeakPolarHBondContact CB-OE2 3.42Å; S702-E706 WeakPolarHBondContact O-CB 3.46Å; S702-E706 WeakPolarHBondContact O-CG 3.46Å; S702-E706 PolarHBondContact O-N 3.18Å; S702-E706 PolarHBondContact OG-OE2 3.32Å
703	H	95.9	Very high	93.7	Very high	14 Å²	14	51 Å²	51	7%	0.065	28%	0.28	C	S	.	.	H	α-helix	trans	-59.9	-21.9	176.4	69.6	-91.5	0	0	0	113.7	P650 R675 P701 F705 T707 D715	P650-H703 HydrophobicContact CB-CB 3.86Å; P650-H703 HydrophobicContact CG-CB 3.82Å; R675-H703 PolarHBondContact NH2-O 3.1Å; P701-H703 WeakPolarHBondContact CB-CE1 3.32Å; P701-H703 PolarHBondContact O-N 3.2Å; P701-H703 VanDerWaalsContact O-N 3.07Å; H703-F705 PolarHBondContact O-N 2.75Å; H703-T707 WeakPolarHBondContact CA-OG1 3.48Å; H703-T707 WeakPolarHBondContact CB-OG1 3.34Å; H703-T707 CarbonylContact O-C 3.55Å; H703-T707 VanDerWaalsContact O-C 3.24Å; H703-T707 PolarHBondContact O-N 2.93Å; H703-T707 VanDerWaalsContact O-O 3.1Å; H703-D715 IonicContact CD2-OD2 2.95Å; H703-D715 IonicContact CE1-OD2 2.69Å; H703-D715 IonicContact NE2-OD1 3.5Å; H703-D715 PolarHBondContact NE2-OD1 3.41Å; H703-D715 IonicContact NE2-OD2 3.2Å; H703-D715 PolarHBondContact NE2-OD2 3.02Å
704	W	96.7	Very high	93.9	Very high	32 Å²	32	45.6 Å²	45.6	12%	0.121	26%	0.259	C	S	.	.	H	α-helix	trans	-52.1	-41.8	174.6	-77.1	14.8	0	0	0	111.4	R675 I700 P701 S702 D715 L724 A727 L728 L731	R675-W704 WeakPolarHBondContact CB-O 3.21Å; R675-W704 WeakPolarHBondContact CG-O 3.47Å; R675-W704 PolarHBondContact NE-O 3.46Å; I700-W704 HydrophobicContact CG2-CB 4.49Å; I700-W704 HydrophobicContact CG2-CD2 4.08Å; I700-W704 HydrophobicContact CG2-CE3 3.63Å; I700-W704 HydrophobicContact CG2-CG 4.47Å; I700-W704 HydrophobicContact CG2-CZ3 4.2Å; P701-W704 HydrophobicContact CB-CG 4.4Å; P701-W704 HydrophobicContact CG-CD2 4.5Å; P701-W704 HydrophobicContact CG-CZ2 4.25Å; P701-W704 VanDerWaalsContact O-CB 3.27Å; P701-W704 WeakPolarHBondContact O-CB 3.49Å; P701-W704 PolarHBondContact O-N 3.22Å; S702-W704 PolarHBondContact O-N 3.27Å; S702-W704 VanDerWaalsContact O-N 3.11Å; W704-D715 PolarHBondContact NE1-OD1 2.93Å; W704-L724 HydrophobicContact CD2-CD1 4.11Å; W704-L724 HydrophobicContact CE3-CD1 4.23Å; W704-L724 HydrophobicContact CH2-CD1 3.48Å; W704-L724 VanDerWaalsContact CH2-CD1 3.48Å; W704-L724 HydrophobicContact CZ2-CD1 3.3Å; W704-L724 HydrophobicContact CZ3-CD1 3.93Å; W704-A727 HydrophobicContact CH2-CB 4.29Å; W704-A727 HydrophobicContact CZ3-CB 4.28Å; W704-L728 HydrophobicContact CD2-CD2 4.33Å; W704-L728 HydrophobicContact CE3-CD2 3.81Å; W704-L728 HydrophobicContact CZ3-CD2 4.43Å; W704-L731 HydrophobicContact CE3-CD1 4.06Å; W704-L731 HydrophobicContact CZ3-CD1 3.8Å
705	F	95.6	Very high	94.2	Very high	9 Å²	9	42.3 Å²	42.3	4%	0.039	24%	0.242	C	C	.	.	H	α-helix	trans	-113.8	-30.9	179.9	-53.2	-52.6	0	0	0	113.8	N679 L682 F697 I700 S702 H703 L728 L731 L732	N679-F705 WeakPolarHBondContact CA-O 3.36Å; N679-F705 WeakPolarHBondContact CB-O 2.8Å; N679-F705 PolarHBondContact ND2-O 2.63Å; L682-F705 HydrophobicContact CD1-CB 3.97Å; L682-F705 HydrophobicContact CD2-CB 4.02Å; L682-F705 HydrophobicContact CG-CB 4.12Å; F697-F705 HydrophobicContact CE1-CD2 4.38Å; F697-F705 HydrophobicContact CE1-CE2 4.34Å; I700-F705 HydrophobicContact CG2-CE2 4.38Å; S702-F705 PolarHBondContact O-N 3.14Å; S702-F705 VanDerWaalsContact O-N 3.16Å; H703-F705 PolarHBondContact O-N 2.75Å; F705-L728 HydrophobicContact CE1-CD2 3.7Å; F705-L728 HydrophobicContact CZ-CD2 3.98Å; F705-L731 HydrophobicContact CZ-CB 4.43Å; F705-L731 HydrophobicContact CZ-CD1 4.32Å; F705-L732 HydrophobicContact CE1-CD1 4.24Å; F705-L732 HydrophobicContact CE1-CD2 3.83Å; F705-L732 HydrophobicContact CE1-CG 4.19Å; F705-L732 HydrophobicContact CZ-CD2 4.07Å; F705-L732 HydrophobicContact CZ-CG 4.35Å
706	E	95.1	Very high	94.7	Very high	116 Å²	116	41.7 Å²	41.7	54%	0.542	24%	0.238	S	C	.	.	H	α-helix	trans	-72.1	-38.3	-178.9	-67.8	-179.4	151.9	0	0	112.9	N679 L682 S702	N679-E706 PolarHBondContact ND2-O 2.94Å; L682-E706 HydrophobicContact CD1-CG 4.32Å; S702-E706 WeakPolarHBondContact CB-OE2 3.42Å; S702-E706 WeakPolarHBondContact O-CB 3.46Å; S702-E706 WeakPolarHBondContact O-CG 3.46Å; S702-E706 PolarHBondContact O-N 3.18Å; S702-E706 PolarHBondContact OG-OE2 3.32Å
707	T	96.1	Very high	95	Very high	58 Å²	58	40.3 Å²	40.3	36%	0.356	23%	0.229	S	C	.	.	S	Bend	trans	-135.1	69.2	-175.4	37.8	0	0	0	0	109.7	R675 H703 D709 L710	R675-T707 PolarHBondContact NH2-O 3Å; H703-T707 WeakPolarHBondContact CA-OG1 3.48Å; H703-T707 WeakPolarHBondContact CB-OG1 3.34Å; H703-T707 CarbonylContact O-C 3.55Å; H703-T707 VanDerWaalsContact O-C 3.24Å; H703-T707 PolarHBondContact O-N 2.93Å; H703-T707 VanDerWaalsContact O-O 3.1Å; T707-D709 PolarHBondContact O-N 3.44Å; T707-L710 HydrophobicContact CG2-CD1 4.18Å; T707-L710 PolarHBondContact O-N 2.76Å
708	P	95.8	Very high	95.6	Very high	11 Å²	11	39.4 Å²	39.4	7%	0.071	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-23	-168.4	25.7	-36.5	0	0	0	114.1	L672 R675 K676 N679	L672-P708 WeakPolarHBondContact CD1-O 3.41Å; R675-P708 HydrophobicContact CB-CB 3.74Å; R675-P708 PolarHBondContact NH1-O 3.13Å; R675-P708 PolarHBondContact NH2-O 3.32Å; K676-P708 HydrophobicContact CG-CB 3.76Å; K676-P708 HydrophobicContact CG-CG 3.8Å; N679-P708 HydrophobicContact CB-CG 4.12Å
709	D	95.7	Very high	96	Very high	63 Å²	63	33.1 Å²	33.1	34%	0.337	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-2.2	177.8	-66	-83.7	0	0	0	114.7	R653 T654 K676 T707	R653-D709 CarbonylContact C-O 3.44Å; R653-D709 WeakPolarHBondContact CA-O 3.33Å; T654-D709 PolarHBondContact N-O 3.49Å; T654-D709 WeakPolarHBondContact OG1-CA 3.42Å; T654-D709 PolarHBondContact OG1-O 2.9Å; K676-D709 VanDerWaalsContact CE-CG 3.46Å; K676-D709 WeakPolarHBondContact CE-OD1 3.44Å; K676-D709 WeakPolarHBondContact CE-OD2 3.47Å; K676-D709 IonicContact NZ-OD1 2.69Å; K676-D709 PolarHBondContact NZ-OD1 3.32Å; K676-D709 IonicContact NZ-OD2 4Å; K676-D709 PolarHBondContact NZ-OD2 3.48Å; T707-D709 PolarHBondContact O-N 3.44Å
710	L	97.3	Very high	96.4	Very high	30 Å²	30	33.6 Å²	33.6	16%	0.157	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	142.4	174.6	-67.2	179.3	0	0	0	112.5	I525 P650 L652 R653 R675 T707	I525-L710 HydrophobicContact CD1-CD1 4.44Å; P650-L710 HydrophobicContact CB-CB 3.94Å; L652-L710 CarbonylContact O-C 3.59Å; R653-L710 HydrophobicContact CB-CD2 4.36Å; R653-L710 HydrophobicContact CG-CD2 3.7Å; R675-L710 VanDerWaalsContact CZ-O 3.25Å; R675-L710 PolarHBondContact NH1-O 2.92Å; R675-L710 PolarHBondContact NH2-O 3.23Å; T707-L710 HydrophobicContact CG2-CD1 4.18Å; T707-L710 PolarHBondContact O-N 2.76Å
711	W	97.8	Very high	96.6	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.008	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	140.5	-177	-55.8	87	0	0	0	112	L651 L652 T654 L668 C671 L672 R675 D715 L716 V719 L724	L651-W711 PolarHBondContact N-O 3.19Å; L652-W711 HydrophobicContact CB-CB 4.35Å; L652-W711 PolarHBondContact N-O 3.34Å; L652-W711 PolarHBondContact O-N 3.41Å; T654-W711 PolarHBondContact OG1-NE1 3.21Å; L668-W711 HydrophobicContact CD1-CD2 4.36Å; L668-W711 HydrophobicContact CD1-CE3 4.37Å; L668-W711 HydrophobicContact CD1-CH2 3.79Å; L668-W711 HydrophobicContact CD1-CZ2 3.75Å; L668-W711 HydrophobicContact CD1-CZ3 4.11Å; C671-W711 HydrophobicContact CB-CH2 3.92Å; C671-W711 HydrophobicContact CB-CZ3 4.35Å; L672-W711 HydrophobicContact CB-CH2 4.46Å; L672-W711 HydrophobicContact CB-CZ2 3.99Å; L672-W711 HydrophobicContact CD1-CZ2 3.95Å; R675-W711 VanDerWaalsContact NH1-CD2 3.27Å; W711-D715 HydrophobicContact CE3-CB 3.89Å; W711-D715 HydrophobicContact CZ3-CB 4.49Å; W711-L716 HydrophobicContact CB-CD2 3.92Å; W711-L716 HydrophobicContact CB-CG 4.15Å; W711-L716 HydrophobicContact CD2-CD2 3.94Å; W711-L716 HydrophobicContact CE3-CD2 3.82Å; W711-L716 HydrophobicContact CG-CD2 4Å; W711-V719 HydrophobicContact CE3-CG2 4.4Å; W711-V719 HydrophobicContact CH2-CG2 4.37Å; W711-V719 HydrophobicContact CZ3-CG2 3.67Å; W711-L724 HydrophobicContact CZ3-CD2 3.9Å
712	S	97.1	Very high	96.5	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.021	19%	0.19	C	C	.	.			trans	-100.1	167.1	166.4	75.1	0	0	0	0	111	H647 K649 A714 D715 L716	H647-S712 WeakPolarHBondContact O-CB 3.46Å; K649-S712 VanDerWaalsContact C-CB 3.45Å; K649-S712 VanDerWaalsContact O-CA 3.32Å; K649-S712 WeakPolarHBondContact O-CA 3.36Å; K649-S712 WeakPolarHBondContact O-CB 3.4Å; S712-A714 PolarHBondContact O-N 3.08Å; S712-A714 PolarHBondContact OG-N 3.09Å; S712-D715 WeakPolarHBondContact CA-OD2 3.43Å; S712-D715 VanDerWaalsContact CB-OD2 3.24Å; S712-D715 WeakPolarHBondContact CB-OD2 3.42Å; S712-D715 PolarHBondContact N-OD2 3.46Å; S712-D715 PolarHBondContact O-N 3.45Å; S712-D715 PolarHBondContact OG-N 3Å; S712-D715 PolarHBondContact OG-OD2 3.32Å; S712-L716 WeakPolarHBondContact O-CG 3.41Å; S712-L716 PolarHBondContact O-N 3.27Å; S712-L716 VanDerWaalsContact O-N 3.15Å
713	M	97.1	Very high	96.7	Very high	14 Å²	14	37.6 Å²	37.6	7%	0.069	20%	0.196	C	C	.	.	H	α-helix	trans	-62.2	-35.3	174.7	-63.9	-65.8	-67.3	0	0	111.5	T619 P621 L624 H647 L652 D715 L716 H717	T619-M713 HydrophobicContact CG2-CE 3.98Å; P621-M713 HydrophobicContact CB-SD 3.67Å; P621-M713 HydrophobicContact CG-SD 4.27Å; L624-M713 HydrophobicContact CD1-CE 3.59Å; L624-M713 HydrophobicContact CD1-SD 3.97Å; L624-M713 HydrophobicContact CG-CE 4.39Å; H647-M713 WeakPolarHBondContact O-CB 3.21Å; H647-M713 PolarHBondContact O-N 2.99Å; L652-M713 HydrophobicContact CD1-SD 4.24Å; M713-D715 VanDerWaalsContact C-N 3.34Å; M713-L716 PolarHBondContact O-N 3.02Å; M713-H717 PolarHBondContact O-CD2 3.47Å; M713-H717 PolarHBondContact O-N 3.41Å
714	A	97.5	Very high	96.8	Very high	24 Å²	24	37 Å²	37	20%	0.198	19%	0.194	C	C	.	.	H	α-helix	trans	-61.9	-40.5	175.5	0	0	0	0	0	112.4	H647 S712 S718	H647-A714 PolarHBondContact O-N 3.19Å; S712-A714 PolarHBondContact O-N 3.08Å; S712-A714 PolarHBondContact OG-N 3.09Å; A714-S718 WeakPolarHBondContact O-CB 3.34Å; A714-S718 PolarHBondContact O-N 3.39Å; A714-S718 PolarHBondContact O-OG 2.89Å
715	D	98.1	Very high	96.7	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-66.5	-46.4	177.3	-52.1	-55.2	0	0	0	110.5	H703 W704 W711 S712 M713 H717 S718 V719 L724	H703-D715 IonicContact CD2-OD2 2.95Å; H703-D715 IonicContact CE1-OD2 2.69Å; H703-D715 IonicContact NE2-OD1 3.5Å; H703-D715 PolarHBondContact NE2-OD1 3.41Å; H703-D715 IonicContact NE2-OD2 3.2Å; H703-D715 PolarHBondContact NE2-OD2 3.02Å; W704-D715 PolarHBondContact NE1-OD1 2.93Å; W711-D715 HydrophobicContact CE3-CB 3.89Å; W711-D715 HydrophobicContact CZ3-CB 4.49Å; S712-D715 WeakPolarHBondContact CA-OD2 3.43Å; S712-D715 VanDerWaalsContact CB-OD2 3.24Å; S712-D715 WeakPolarHBondContact CB-OD2 3.42Å; S712-D715 PolarHBondContact N-OD2 3.46Å; S712-D715 PolarHBondContact O-N 3.45Å; S712-D715 PolarHBondContact OG-N 3Å; S712-D715 PolarHBondContact OG-OD2 3.32Å; M713-D715 VanDerWaalsContact C-N 3.34Å; D715-H717 PolarHBondContact O-N 3.06Å; D715-S718 CarbonylContact O-C 3.59Å; D715-S718 WeakPolarHBondContact O-CA 3.47Å; D715-S718 WeakPolarHBondContact O-CB 3.37Å; D715-S718 PolarHBondContact O-N 3.46Å; D715-V719 WeakPolarHBondContact O-CG2 3.5Å; D715-V719 PolarHBondContact O-N 2.96Å; D715-L724 HydrophobicContact CB-CD2 4.32Å
716	L	97.9	Very high	96.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-66.1	-38.9	-177.7	-61.6	-179.8	0	0	0	112.9	L624 W628 F630 L652 F657 L668 W711 S712 M713 S718 V719 H720	L624-L716 HydrophobicContact CB-CD1 4.19Å; L624-L716 HydrophobicContact CD1-CB 3.96Å; L624-L716 HydrophobicContact CD1-CD1 3.84Å; W628-L716 HydrophobicContact CH2-CD2 4.11Å; W628-L716 HydrophobicContact CZ3-CD2 4.05Å; F630-L716 HydrophobicContact CE1-CB 4.47Å; F630-L716 HydrophobicContact CZ-CB 4.35Å; F630-L716 WeakPolarHBondContact CZ-O 3.47Å; L652-L716 HydrophobicContact CD1-CD1 3.61Å; F657-L716 HydrophobicContact CE1-CD1 4.34Å; F657-L716 HydrophobicContact CE1-CD2 4.38Å; F657-L716 HydrophobicContact CZ-CD1 3.88Å; F657-L716 HydrophobicContact CZ-CD2 3.89Å; L668-L716 HydrophobicContact CD1-CD2 4.12Å; W711-L716 HydrophobicContact CB-CD2 3.92Å; W711-L716 HydrophobicContact CB-CG 4.15Å; W711-L716 HydrophobicContact CD2-CD2 3.94Å; W711-L716 HydrophobicContact CE3-CD2 3.82Å; W711-L716 HydrophobicContact CG-CD2 4Å; S712-L716 WeakPolarHBondContact O-CG 3.41Å; S712-L716 PolarHBondContact O-N 3.27Å; S712-L716 VanDerWaalsContact O-N 3.15Å; M713-L716 PolarHBondContact O-N 3.02Å; L716-S718 VanDerWaalsContact C-N 3.29Å; L716-S718 PolarHBondContact O-N 2.83Å; L716-V719 PolarHBondContact O-N 3.25Å; L716-H720 WeakPolarHBondContact O-CB 3.29Å; L716-H720 PolarHBondContact O-N 2.81Å
717	H	97.9	Very high	96.8	Very high	60 Å²	60	37.5 Å²	37.5	28%	0.278	21%	0.207	S	C	.	.	H	α-helix	trans	-60.7	-39.8	168.2	-87.3	-73.9	0	0	0	111.5	T619 F630 M713 D715 V719 H720 D721	T619-H717 WeakPolarHBondContact CB-NE2 3.36Å; T619-H717 WeakPolarHBondContact CG2-NE2 3.17Å; T619-H717 PolarHBondContact OG1-CE1 2.96Å; T619-H717 PolarHBondContact OG1-NE2 3.18Å; F630-H717 AromaticContact CD1-CE1 3.82Å; F630-H717 AromaticContact CD1-ND1 3.66Å; F630-H717 AromaticContact CE1-ND1 3.99Å; M713-H717 PolarHBondContact O-CD2 3.47Å; M713-H717 PolarHBondContact O-N 3.41Å; D715-H717 PolarHBondContact O-N 3.06Å; H717-V719 PolarHBondContact O-N 3.18Å; H717-H720 PolarHBondContact O-N 3.3Å; H717-D721 WeakPolarHBondContact O-CB 3.34Å; H717-D721 VanDerWaalsContact O-CG 3.29Å; H717-D721 PolarHBondContact O-N 3.18Å
718	S	97.7	Very high	96.8	Very high	39 Å²	39	34.8 Å²	34.8	27%	0.273	19%	0.19	S	C	.	.	H	α-helix	trans	-71.9	-26	177.6	-55.4	0	0	0	0	113.5	A714 D715 L716 G722 K723 L724	A714-S718 WeakPolarHBondContact O-CB 3.34Å; A714-S718 PolarHBondContact O-N 3.39Å; A714-S718 PolarHBondContact O-OG 2.89Å; D715-S718 CarbonylContact O-C 3.59Å; D715-S718 WeakPolarHBondContact O-CA 3.47Å; D715-S718 WeakPolarHBondContact O-CB 3.37Å; D715-S718 PolarHBondContact O-N 3.46Å; L716-S718 VanDerWaalsContact C-N 3.29Å; L716-S718 PolarHBondContact O-N 2.83Å; S718-G722 CarbonylContact O-C 3.55Å; S718-K723 PolarHBondContact O-N 3.44Å; S718-K723 VanDerWaalsContact O-N 3.11Å; S718-L724 PolarHBondContact O-N 2.87Å
719	V	97.8	Very high	96.8	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-70.7	-49.5	169.7	172.5	0	0	0	0	110.4	W628 N667 L668 C671 W711 D715 L716 H717 D721 G722 L724	W628-V719 HydrophobicContact CH2-CB 4.26Å; W628-V719 HydrophobicContact CH2-CG1 3.87Å; W628-V719 HydrophobicContact CZ2-CB 4.37Å; W628-V719 HydrophobicContact CZ2-CG1 3.78Å; N667-V719 HydrophobicContact CB-CG1 4.17Å; L668-V719 HydrophobicContact CB-CG1 3.97Å; L668-V719 HydrophobicContact CD1-CG1 4.35Å; L668-V719 HydrophobicContact CD1-CG2 4.46Å; C671-V719 HydrophobicContact CB-CG2 4.08Å; W711-V719 HydrophobicContact CE3-CG2 4.4Å; W711-V719 HydrophobicContact CH2-CG2 4.37Å; W711-V719 HydrophobicContact CZ3-CG2 3.67Å; D715-V719 WeakPolarHBondContact O-CG2 3.5Å; D715-V719 PolarHBondContact O-N 2.96Å; L716-V719 PolarHBondContact O-N 3.25Å; H717-V719 PolarHBondContact O-N 3.18Å; V719-D721 VanDerWaalsContact C-N 3.31Å; V719-D721 PolarHBondContact O-N 3.19Å; V719-G722 PolarHBondContact O-N 3.01Å; V719-L724 HydrophobicContact CG2-CB 4.31Å; V719-L724 HydrophobicContact CG2-CD2 3.6Å
720	H	96.8	Very high	96.7	Very high	95 Å²	95	37 Å²	37	44%	0.44	21%	0.207	S	C	.	.	H	α-helix	trans	-56.6	-45.7	178.4	169.4	-85.2	0	0	0	111.6	F630 L716 H717 G722	F630-H720 HydrophobicContact CD1-CB 4.27Å; F630-H720 HydrophobicContact CD2-CB 4.25Å; F630-H720 AromaticContact CD2-CD2 3.27Å; F630-H720 WeakPolarHBondContact CD2-CD2 3.35Å; F630-H720 AromaticContact CD2-CG 3.9Å; F630-H720 AromaticContact CD2-NE2 3.95Å; F630-H720 HydrophobicContact CE1-CB 3.8Å; F630-H720 HydrophobicContact CE2-CB 3.77Å; F630-H720 AromaticContact CE2-CD2 3.56Å; F630-H720 AromaticContact CE2-CG 3.93Å; F630-H720 HydrophobicContact CG-CB 4.49Å; F630-H720 AromaticContact CG-CD2 3.68Å; F630-H720 HydrophobicContact CZ-CB 3.53Å; L716-H720 WeakPolarHBondContact O-CB 3.29Å; L716-H720 PolarHBondContact O-N 2.81Å; H717-H720 PolarHBondContact O-N 3.3Å; H720-G722 PolarHBondContact O-N 2.96Å
721	D	95.8	Very high	96.6	Very high	76 Å²	76	37.2 Å²	37.2	41%	0.406	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	6.9	178.3	-68.1	8.4	0	0	0	113.7	H717 V719 K723	H717-D721 WeakPolarHBondContact O-CB 3.34Å; H717-D721 VanDerWaalsContact O-CG 3.29Å; H717-D721 PolarHBondContact O-N 3.18Å; V719-D721 VanDerWaalsContact C-N 3.31Å; V719-D721 PolarHBondContact O-N 3.19Å; D721-K723 HydrophobicContact CB-CD 3.68Å; D721-K723 HydrophobicContact CB-CG 4.1Å; D721-K723 PolarHBondContact O-N 3.02Å; D721-K723 IonicContact OD2-NZ 2.78Å; D721-K723 PolarHBondContact OD2-NZ 2.94Å
722	G	94.5	Very high	96.4	Very high	18 Å²	18	37.1 Å²	37.1	19%	0.186	21%	0.207	C	C	.	.	S	Bend	trans	70.7	-22.4	-177.1	0	0	0	0	0	116	S718 V719 H720 L724 S725	S718-G722 CarbonylContact O-C 3.55Å; V719-G722 PolarHBondContact O-N 3.01Å; H720-G722 PolarHBondContact O-N 2.96Å; G722-L724 VanDerWaalsContact C-N 3.32Å; G722-L724 PolarHBondContact O-N 2.78Å; G722-S725 PolarHBondContact O-N 3.28Å; G722-S725 PolarHBondContact O-OG 3.3Å
723	K	96.9	Very high	96.3	Very high	122 Å²	122	40.3 Å²	40.3	53%	0.53	22%	0.224	S	C	.	.	H	α-helix	trans	-50.8	-40.5	-174.1	-67.4	161.3	-169.8	162.7	0	114.5	S718 D721 S725 I726 A727	S718-K723 PolarHBondContact O-N 3.44Å; S718-K723 VanDerWaalsContact O-N 3.11Å; D721-K723 HydrophobicContact CB-CD 3.68Å; D721-K723 HydrophobicContact CB-CG 4.1Å; D721-K723 PolarHBondContact O-N 3.02Å; D721-K723 IonicContact OD2-NZ 2.78Å; D721-K723 PolarHBondContact OD2-NZ 2.94Å; K723-S725 VanDerWaalsContact C-N 3.34Å; K723-S725 PolarHBondContact O-N 2.99Å; K723-I726 PolarHBondContact O-N 2.95Å; K723-A727 PolarHBondContact O-N 3.27Å
724	L	97	Very high	96.2	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-66.7	-36.2	-175.6	-174.2	61.2	0	0	0	112.1	C671 W704 W711 D715 S718 V719 G722 I726 A727 L728	C671-L724 HydrophobicContact CB-CD2 4.22Å; W704-L724 HydrophobicContact CD2-CD1 4.11Å; W704-L724 HydrophobicContact CE3-CD1 4.23Å; W704-L724 HydrophobicContact CH2-CD1 3.48Å; W704-L724 VanDerWaalsContact CH2-CD1 3.48Å; W704-L724 HydrophobicContact CZ2-CD1 3.3Å; W704-L724 HydrophobicContact CZ3-CD1 3.93Å; W711-L724 HydrophobicContact CZ3-CD2 3.9Å; D715-L724 HydrophobicContact CB-CD2 4.32Å; S718-L724 PolarHBondContact O-N 2.87Å; V719-L724 HydrophobicContact CG2-CB 4.31Å; V719-L724 HydrophobicContact CG2-CD2 3.6Å; G722-L724 VanDerWaalsContact C-N 3.32Å; G722-L724 PolarHBondContact O-N 2.78Å; L724-I726 VanDerWaalsContact C-N 3.33Å; L724-I726 PolarHBondContact O-N 3.48Å; L724-A727 PolarHBondContact O-N 2.91Å; L724-L728 HydrophobicContact CD1-CD1 4.19Å; L724-L728 HydrophobicContact CD1-CG 4.08Å; L724-L728 HydrophobicContact CD2-CD1 4.36Å; L724-L728 HydrophobicContact CG-CD1 3.79Å; L724-L728 HydrophobicContact CG-CG 4.18Å; L724-L728 WeakPolarHBondContact O-CB 3.29Å; L724-L728 VanDerWaalsContact O-CG 3.22Å; L724-L728 WeakPolarHBondContact O-CG 3.46Å; L724-L728 PolarHBondContact O-N 2.89Å
725	S	95.2	Very high	96	Very high	14 Å²	14	40.8 Å²	40.8	10%	0.098	23%	0.226	C	C	.	.	H	α-helix	trans	-65.9	-39	179.2	73.1	0	0	0	0	111.5	G722 K723 R729	G722-S725 PolarHBondContact O-N 3.28Å; G722-S725 PolarHBondContact O-OG 3.3Å; K723-S725 VanDerWaalsContact C-N 3.34Å; K723-S725 PolarHBondContact O-N 2.99Å; S725-R729 WeakPolarHBondContact O-CB 3.43Å; S725-R729 WeakPolarHBondContact O-CD 3.3Å; S725-R729 WeakPolarHBondContact O-CG 3.14Å; S725-R729 PolarHBondContact O-N 3.12Å; S725-R729 VanDerWaalsContact O-N 3.08Å
726	I	96.1	Very high	95.8	Very high	118 Å²	118	40.7 Å²	40.7	61%	0.605	23%	0.225	S	C	*	.	H	α-helix	trans	-66.4	-49.2	176.2	-58.5	171.3	0	0	0	109.8	K723 L724 L728 R729 A730	K723-I726 PolarHBondContact O-N 2.95Å; L724-I726 VanDerWaalsContact C-N 3.33Å; L724-I726 PolarHBondContact O-N 3.48Å; I726-L728 PolarHBondContact O-N 3.49Å; I726-R729 PolarHBondContact O-N 3.37Å; I726-A730 PolarHBondContact O-N 3.04Å
727	A	96.2	Very high	95.6	Very high	35 Å²	35	45.1 Å²	45.1	29%	0.289	25%	0.246	S	C	.	.	H	α-helix	trans	-58.8	-49.5	178.2	0	0	0	0	0	111.9	W704 K723 L724 R729 A730 L731	W704-A727 HydrophobicContact CH2-CB 4.29Å; W704-A727 HydrophobicContact CZ3-CB 4.28Å; K723-A727 PolarHBondContact O-N 3.27Å; L724-A727 PolarHBondContact O-N 2.91Å; A727-R729 VanDerWaalsContact C-N 3.3Å; A727-R729 PolarHBondContact O-N 3.44Å; A727-A730 PolarHBondContact O-N 2.74Å; A727-L731 VanDerWaalsContact O-CG 3.23Å; A727-L731 WeakPolarHBondContact O-CG 3.37Å; A727-L731 PolarHBondContact O-N 2.98Å
728	L	96.9	Very high	95.5	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.5	-39.2	177.3	-71.2	167.8	0	0	0	112.1	C671 L674 R675 W704 F705 L724 I726 L731 L732	C671-L728 HydrophobicContact CB-CD1 4.11Å; L674-L728 HydrophobicContact CB-CB 4.13Å; L674-L728 HydrophobicContact CB-CD1 4.03Å; L674-L728 HydrophobicContact CD1-CB 4.13Å; L674-L728 HydrophobicContact CD1-CD1 4.45Å; R675-L728 HydrophobicContact CG-CD1 3.72Å; R675-L728 HydrophobicContact CG-CD2 3.88Å; R675-L728 HydrophobicContact CG-CG 4.49Å; W704-L728 HydrophobicContact CD2-CD2 4.33Å; W704-L728 HydrophobicContact CE3-CD2 3.81Å; W704-L728 HydrophobicContact CZ3-CD2 4.43Å; F705-L728 HydrophobicContact CE1-CD2 3.7Å; F705-L728 HydrophobicContact CZ-CD2 3.98Å; L724-L728 HydrophobicContact CD1-CD1 4.19Å; L724-L728 HydrophobicContact CD1-CG 4.08Å; L724-L728 HydrophobicContact CD2-CD1 4.36Å; L724-L728 HydrophobicContact CG-CD1 3.79Å; L724-L728 HydrophobicContact CG-CG 4.18Å; L724-L728 WeakPolarHBondContact O-CB 3.29Å; L724-L728 VanDerWaalsContact O-CG 3.22Å; L724-L728 WeakPolarHBondContact O-CG 3.46Å; L724-L728 PolarHBondContact O-N 2.89Å; I726-L728 PolarHBondContact O-N 3.49Å; L728-L731 PolarHBondContact O-N 3.24Å; L728-L732 WeakPolarHBondContact O-CB 3.48Å; L728-L732 WeakPolarHBondContact O-CD1 3.35Å; L728-L732 WeakPolarHBondContact O-CG 3.38Å; L728-L732 PolarHBondContact O-N 2.88Å
729	R	95.5	Very high	95.3	Very high	57 Å²	57	41.5 Å²	41.5	22%	0.215	23%	0.225	C	C	.	.	H	α-helix	trans	-67	-45.7	177.3	-74.4	168.4	-179.7	-70.7	-10.7	112.2	L236 L237 N670 L674 S725 I726 A727 L731 L732 L733	L236-R729 PolarHBondContact O-NH1 3.06Å; L237-R729 HydrophobicContact CD2-CG 4.49Å; N670-R729 PolarHBondContact OD1-NH2 3.17Å; L674-R729 HydrophobicContact CD1-CG 3.95Å; L674-R729 HydrophobicContact CD2-CG 3.97Å; S725-R729 WeakPolarHBondContact O-CB 3.43Å; S725-R729 WeakPolarHBondContact O-CD 3.3Å; S725-R729 WeakPolarHBondContact O-CG 3.14Å; S725-R729 PolarHBondContact O-N 3.12Å; S725-R729 VanDerWaalsContact O-N 3.08Å; I726-R729 PolarHBondContact O-N 3.37Å; A727-R729 VanDerWaalsContact C-N 3.3Å; A727-R729 PolarHBondContact O-N 3.44Å; R729-L731 VanDerWaalsContact C-N 3.25Å; R729-L731 PolarHBondContact O-N 3.2Å; R729-L732 PolarHBondContact O-N 3.25Å; R729-L733 WeakPolarHBondContact O-CB 3.46Å; R729-L733 VanDerWaalsContact O-CG 3.3Å; R729-L733 WeakPolarHBondContact O-CG 3.35Å; R729-L733 PolarHBondContact O-N 3.38Å
730	A	94.5	Very high	95	Very high	65 Å²	65	43.7 Å²	43.7	54%	0.537	24%	0.24	S	C	.	.	H	α-helix	trans	-59.9	-35.7	176.6	0	0	0	0	0	112.6	I726 A727 P734	I726-A730 PolarHBondContact O-N 3.04Å; A727-A730 PolarHBondContact O-N 2.74Å; A730-P734 VanDerWaalsContact O-CD 3.27Å; A730-P734 WeakPolarHBondContact O-CD 3.47Å
731	L	94.6	Very high	94.8	Very high	33 Å²	33	45.3 Å²	45.3	17%	0.173	25%	0.251	C	S	.	.	H	α-helix	trans	-74	-39.1	176.4	-66.6	171.7	0	0	0	113.2	V695 I700 W704 F705 A727 L728 R729 I735	V695-L731 HydrophobicContact CG1-CD2 3.75Å; V695-L731 HydrophobicContact CG2-CD2 4.45Å; I700-L731 HydrophobicContact CD1-CD1 3.81Å; I700-L731 HydrophobicContact CD1-CD2 3.5Å; I700-L731 VanDerWaalsContact CD1-CD2 3.5Å; I700-L731 HydrophobicContact CD1-CG 4.27Å; I700-L731 HydrophobicContact CG1-CD1 4.22Å; I700-L731 HydrophobicContact CG1-CD2 4.38Å; I700-L731 HydrophobicContact CG2-CD1 4.37Å; W704-L731 HydrophobicContact CE3-CD1 4.06Å; W704-L731 HydrophobicContact CZ3-CD1 3.8Å; F705-L731 HydrophobicContact CZ-CB 4.43Å; F705-L731 HydrophobicContact CZ-CD1 4.32Å; A727-L731 VanDerWaalsContact O-CG 3.23Å; A727-L731 WeakPolarHBondContact O-CG 3.37Å; A727-L731 PolarHBondContact O-N 2.98Å; L728-L731 PolarHBondContact O-N 3.24Å; R729-L731 VanDerWaalsContact C-N 3.25Å; R729-L731 PolarHBondContact O-N 3.2Å; L731-I735 VanDerWaalsContact O-CD1 3.24Å; L731-I735 WeakPolarHBondContact O-CD1 3.45Å
732	L	94.2	Very high	94.8	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-86	-27.2	-172.5	-66.8	168.9	0	0	0	113.9	L237 L674 M681 F705 L728 R729 I735 V736	L237-L732 HydrophobicContact CD1-CB 3.83Å; L237-L732 HydrophobicContact CD1-CD1 3.93Å; L674-L732 HydrophobicContact CB-CD1 4.29Å; L674-L732 HydrophobicContact CD2-CD1 4.3Å; L674-L732 VanDerWaalsContact O-CD1 3.29Å; L674-L732 WeakPolarHBondContact O-CD1 3.32Å; M681-L732 HydrophobicContact CE-CD2 4.25Å; M681-L732 HydrophobicContact SD-CD2 3.71Å; F705-L732 HydrophobicContact CE1-CD1 4.24Å; F705-L732 HydrophobicContact CE1-CD2 3.83Å; F705-L732 HydrophobicContact CE1-CG 4.19Å; F705-L732 HydrophobicContact CZ-CD2 4.07Å; F705-L732 HydrophobicContact CZ-CG 4.35Å; L728-L732 WeakPolarHBondContact O-CB 3.48Å; L728-L732 WeakPolarHBondContact O-CD1 3.35Å; L728-L732 WeakPolarHBondContact O-CG 3.38Å; L728-L732 PolarHBondContact O-N 2.88Å; R729-L732 PolarHBondContact O-N 3.25Å; L732-I735 WeakPolarHBondContact O-CB 3.45Å; L732-I735 PolarHBondContact O-N 3.12Å; L732-V736 WeakPolarHBondContact O-CG2 3.43Å; L732-V736 PolarHBondContact O-N 3.31Å
733	L	94.3	Very high	94.8	Very high	69 Å²	69	50.7 Å²	50.7	36%	0.361	27%	0.268	S	S	.	.	H	α-helix	trans	-59	-51	-178.1	-79.4	165.4	0	0	0	113.5	L237 R729 I735 V736 E737	L237-L733 HydrophobicContact CD2-CD2 3.73Å; L237-L733 HydrophobicContact CD2-CG 3.86Å; R729-L733 WeakPolarHBondContact O-CB 3.46Å; R729-L733 VanDerWaalsContact O-CG 3.3Å; R729-L733 WeakPolarHBondContact O-CG 3.35Å; R729-L733 PolarHBondContact O-N 3.38Å; L733-I735 PolarHBondContact O-N 3.42Å; L733-V736 PolarHBondContact O-N 3.23Å; L733-E737 WeakPolarHBondContact O-CG 3.4Å; L733-E737 PolarHBondContact O-N 3.15Å
734	P	94.3	Very high	94.7	Very high	47 Å²	47	52.9 Å²	52.9	31%	0.305	27%	0.273	S	S	.	.	H	α-helix	trans	-62	-32.3	177.8	-22.8	34.2	0	0	0	112.9	A730 H738	A730-P734 VanDerWaalsContact O-CD 3.27Å; A730-P734 WeakPolarHBondContact O-CD 3.47Å; P734-H738 VanDerWaalsContact O-CB 3.25Å; P734-H738 WeakPolarHBondContact O-CB 3.44Å; P734-H738 PolarHBondContact O-N 2.88Å
735	I	94.4	Very high	94.6	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-68.9	-43.5	178.8	-60.8	170.8	0	0	0	110.3	M681 I685 V695 F697 L731 L732 L733 H738 I739	M681-I735 HydrophobicContact CB-CG2 4.22Å; M681-I735 HydrophobicContact CG-CG2 4.41Å; M681-I735 HydrophobicContact SD-CB 4.33Å; M681-I735 HydrophobicContact SD-CG2 3.75Å; I685-I735 HydrophobicContact CD1-CD1 4.01Å; I685-I735 HydrophobicContact CD1-CG2 3.93Å; I685-I735 HydrophobicContact CG1-CG2 3.83Å; V695-I735 HydrophobicContact CG2-CD1 4.13Å; V695-I735 HydrophobicContact CG2-CG1 4.27Å; F697-I735 HydrophobicContact CE1-CD1 4.3Å; F697-I735 HydrophobicContact CZ-CD1 3.74Å; L731-I735 VanDerWaalsContact O-CD1 3.24Å; L731-I735 WeakPolarHBondContact O-CD1 3.45Å; L732-I735 WeakPolarHBondContact O-CB 3.45Å; L732-I735 PolarHBondContact O-N 3.12Å; L733-I735 PolarHBondContact O-N 3.42Å; I735-H738 PolarHBondContact O-N 3.22Å; I735-I739 HydrophobicContact CG2-CD1 3.76Å; I735-I739 HydrophobicContact CG2-CG1 4.5Å; I735-I739 WeakPolarHBondContact O-CB 3.35Å; I735-I739 VanDerWaalsContact O-CG1 3.25Å; I735-I739 WeakPolarHBondContact O-CG1 3.37Å; I735-I739 PolarHBondContact O-N 2.9Å
736	V	93.6	Very high	94.5	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-60.3	-50.7	174.3	165.6	0	0	0	0	111.1	L237 L238 M681 L732 L733 H738 I739 S740 F764	L237-V736 WeakPolarHBondContact O-CG1 3.04Å; L238-V736 HydrophobicContact CD2-CG1 3.56Å; L238-V736 HydrophobicContact CG-CG1 3.99Å; M681-V736 HydrophobicContact CE-CG2 3.43Å; M681-V736 VanDerWaalsContact CE-CG2 3.43Å; M681-V736 HydrophobicContact SD-CG2 4.12Å; L732-V736 WeakPolarHBondContact O-CG2 3.43Å; L732-V736 PolarHBondContact O-N 3.31Å; L733-V736 PolarHBondContact O-N 3.23Å; V736-H738 VanDerWaalsContact C-N 3.28Å; V736-H738 PolarHBondContact O-N 2.71Å; V736-I739 PolarHBondContact O-N 2.78Å; V736-I739 VanDerWaalsContact O-N 3.17Å; V736-S740 PolarHBondContact O-N 3Å; V736-S740 PolarHBondContact O-OG 3.12Å; V736-F764 HydrophobicContact CG2-CE2 4.38Å
737	E	93.4	Very high	94.3	Very high	94 Å²	94	52.9 Å²	52.9	44%	0.439	29%	0.285	S	S	.	.	H	α-helix	trans	-61.4	-38.6	-179.7	-71	173.9	177.1	0	0	111.5	L733 S740 I741	L733-E737 WeakPolarHBondContact O-CG 3.4Å; L733-E737 PolarHBondContact O-N 3.15Å; E737-S740 PolarHBondContact O-OG 3.38Å; E737-I741 WeakPolarHBondContact O-CG1 3.37Å
738	H	95.6	Very high	94	Very high	22 Å²	22	53.7 Å²	53.7	10%	0.102	29%	0.288	C	S	.	.	H	α-helix	trans	-67.1	-43.8	173	-179.9	82	0	0	0	112.8	C688 L694 P734 I735 V736 S740 I741 C742	C688-H738 PolarHBondContact SG-NE2 3.15Å; L694-H738 HydrophobicContact CD1-CB 3.46Å; L694-H738 VanDerWaalsContact CD1-CB 3.46Å; P734-H738 VanDerWaalsContact O-CB 3.25Å; P734-H738 WeakPolarHBondContact O-CB 3.44Å; P734-H738 PolarHBondContact O-N 2.88Å; I735-H738 PolarHBondContact O-N 3.22Å; V736-H738 VanDerWaalsContact C-N 3.28Å; V736-H738 PolarHBondContact O-N 2.71Å; H738-S740 VanDerWaalsContact C-N 3.31Å; H738-S740 PolarHBondContact O-N 3.09Å; H738-I741 PolarHBondContact O-N 3.1Å; H738-C742 VanDerWaalsContact NE2-CB 3.35Å; H738-C742 WeakPolarHBondContact NE2-CB 3.4Å; H738-C742 PolarHBondContact NE2-SG 3.09Å; H738-C742 VanDerWaalsContact NE2-SG 3.4Å; H738-C742 WeakPolarHBondContact O-CB 3.37Å; H738-C742 PolarHBondContact O-N 3.04Å
739	I	94.4	Very high	93.8	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-66.1	-33.7	-178.2	-70.2	166	0	0	0	111.8	M681 F684 I735 V736 C745 F762 F764	M681-I739 HydrophobicContact CB-CD1 4.3Å; M681-I739 HydrophobicContact CG-CD1 4.19Å; F684-I739 HydrophobicContact CB-CD1 3.7Å; F684-I739 HydrophobicContact CB-CG1 4.08Å; F684-I739 HydrophobicContact CD1-CG2 4.3Å; F684-I739 HydrophobicContact CG-CD1 4.14Å; I735-I739 HydrophobicContact CG2-CD1 3.76Å; I735-I739 HydrophobicContact CG2-CG1 4.5Å; I735-I739 WeakPolarHBondContact O-CB 3.35Å; I735-I739 VanDerWaalsContact O-CG1 3.25Å; I735-I739 WeakPolarHBondContact O-CG1 3.37Å; I735-I739 PolarHBondContact O-N 2.9Å; V736-I739 PolarHBondContact O-N 2.78Å; V736-I739 VanDerWaalsContact O-N 3.17Å; I739-C745 HydrophobicContact CB-CB 4.15Å; I739-C745 HydrophobicContact CG1-CB 4.11Å; I739-C745 HydrophobicContact CG2-CB 3.97Å; I739-F762 HydrophobicContact CG2-CD1 3.85Å; I739-F762 HydrophobicContact CG2-CE1 3.38Å; I739-F762 HydrophobicContact CG2-CE2 4.14Å; I739-F762 HydrophobicContact CG2-CG 4.41Å; I739-F762 HydrophobicContact CG2-CZ 3.53Å; I739-F764 HydrophobicContact CB-CZ 4.11Å; I739-F764 HydrophobicContact CD1-CE1 3.91Å; I739-F764 HydrophobicContact CD1-CZ 4Å; I739-F764 HydrophobicContact CG2-CE1 3.9Å; I739-F764 HydrophobicContact CG2-CZ 3.53Å
740	S	90.4	Very high	93.6	Very high	47 Å²	47	54.3 Å²	54.3	33%	0.329	30%	0.299	S	S	.	.	H	α-helix	trans	-72.4	-24.1	179.8	66.6	0	0	0	0	114.3	V736 E737 H738	V736-S740 PolarHBondContact O-N 3Å; V736-S740 PolarHBondContact O-OG 3.12Å; E737-S740 PolarHBondContact O-OG 3.38Å; H738-S740 VanDerWaalsContact C-N 3.31Å; H738-S740 PolarHBondContact O-N 3.09Å
741	I	93.7	Very high	93.5	Very high	128 Å²	128	55.8 Å²	55.8	66%	0.656	30%	0.296	S	S	*	.	H	α-helix	trans	-109.7	-25.3	-179.1	71.7	-173.2	0	0	0	114	E737 H738 K743	E737-I741 WeakPolarHBondContact O-CG1 3.37Å; H738-I741 PolarHBondContact O-N 3.1Å; I741-K743 PolarHBondContact O-N 3.25Å
742	C	95.7	Very high	93.5	Very high	22 Å²	22	54.2 Å²	54.2	15%	0.149	29%	0.288	C	S	.	.			trans	-74.1	115	-174.5	178.5	0	0	0	0	111.2	H738 R744 C745 L746	H738-C742 VanDerWaalsContact NE2-CB 3.35Å; H738-C742 WeakPolarHBondContact NE2-CB 3.4Å; H738-C742 PolarHBondContact NE2-SG 3.09Å; H738-C742 VanDerWaalsContact NE2-SG 3.4Å; H738-C742 WeakPolarHBondContact O-CB 3.37Å; H738-C742 PolarHBondContact O-N 3.04Å; C742-R744 PolarHBondContact O-N 3.47Å; C742-C745 HydrophobicContact CB-CB 4.05Å; C742-C745 PolarHBondContact O-N 3.48Å; C742-L746 WeakPolarHBondContact O-CG 3.11Å; C742-L746 PolarHBondContact O-N 3.1Å
743	K	94.4	Very high	93.5	Very high	186 Å²	186	56.7 Å²	56.7	81%	0.809	30%	0.3	S	S	*	.	H	α-helix	trans	-50.4	-33.9	178.8	-63.8	-176	179.4	-178.7	0	113.5	I741 A747	I741-K743 PolarHBondContact O-N 3.25Å; K743-A747 VanDerWaalsContact O-CB 3.3Å; K743-A747 WeakPolarHBondContact O-CB 3.26Å; K743-A747 PolarHBondContact O-N 2.99Å
744	R	94.5	Very high	93.5	Very high	167 Å²	167	56.9 Å²	56.9	63%	0.63	30%	0.301	S	S	*	.	H	α-helix	trans	-71.5	-39.2	176.9	-173.6	177.5	-67.1	-120.1	-1.9	112.6	R687 C742 C748	R687-R744 VanDerWaalsContact O-CD 3.31Å; R687-R744 WeakPolarHBondContact O-CD 3.09Å; C742-R744 PolarHBondContact O-N 3.47Å; R744-C748 PolarHBondContact O-N 3.12Å; R744-C748 PolarHBondContact O-SG 3.38Å
745	C	95	Very high	93.5	Very high	2 Å²	2	57.4 Å²	57.4	1%	0.014	31%	0.305	C	S	.	.	H	α-helix	trans	-74.6	-40.7	177.7	-59.5	0	0	0	0	111.4	F684 I739 C742 A747 C748 G749	F684-C745 HydrophobicContact CD1-CB 4.47Å; I739-C745 HydrophobicContact CB-CB 4.15Å; I739-C745 HydrophobicContact CG1-CB 4.11Å; I739-C745 HydrophobicContact CG2-CB 3.97Å; C742-C745 HydrophobicContact CB-CB 4.05Å; C742-C745 PolarHBondContact O-N 3.48Å; C745-A747 PolarHBondContact O-N 3.47Å; C745-C748 CarbonylContact O-C 3.52Å; C745-C748 WeakPolarHBondContact O-CA 3.43Å; C745-C748 WeakPolarHBondContact O-CB 3.49Å; C745-C748 PolarHBondContact O-N 3.05Å; C745-G749 PolarHBondContact O-N 2.92Å
746	L	93.4	Very high	93.5	Very high	45 Å²	45	64.7 Å²	64.7	24%	0.236	34%	0.336	C	S	.	.	H	α-helix	trans	-57.3	-45.1	172.1	-73.6	163.5	0	0	0	111.7	C742 C748 G749 I760 F762	C742-L746 WeakPolarHBondContact O-CG 3.11Å; C742-L746 PolarHBondContact O-N 3.1Å; L746-C748 PolarHBondContact O-N 2.79Å; L746-G749 PolarHBondContact O-N 3.39Å; L746-I760 HydrophobicContact CB-CD1 4Å; L746-I760 HydrophobicContact CD2-CD1 3.9Å; L746-I760 HydrophobicContact CD2-CG2 4.34Å; L746-F762 HydrophobicContact CD2-CE2 4.27Å; L746-F762 HydrophobicContact CD2-CZ 3.96Å
747	A	92	Very high	93.3	Very high	88 Å²	88	68.1 Å²	68.1	73%	0.727	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-12.6	174.3	0	0	0	0	0	114.5	K743 C745	K743-A747 VanDerWaalsContact O-CB 3.3Å; K743-A747 WeakPolarHBondContact O-CB 3.26Å; K743-A747 PolarHBondContact O-N 2.99Å; C745-A747 PolarHBondContact O-N 3.47Å
748	C	90.4	Very high	93	Very high	51 Å²	51	66 Å²	66	35%	0.345	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-2.4	171.2	-62.8	0	0	0	0	113.1	F684 R744 C745 L746	F684-C748 HydrophobicContact CD1-CB 3.93Å; F684-C748 HydrophobicContact CE1-CB 3.83Å; F684-C748 WeakPolarHBondContact CE1-O 3.34Å; R744-C748 PolarHBondContact O-N 3.12Å; R744-C748 PolarHBondContact O-SG 3.38Å; C745-C748 CarbonylContact O-C 3.52Å; C745-C748 WeakPolarHBondContact O-CA 3.43Å; C745-C748 WeakPolarHBondContact O-CB 3.49Å; C745-C748 PolarHBondContact O-N 3.05Å; L746-C748 PolarHBondContact O-N 2.79Å
749	G	91	Very high	92.8	Very high	22 Å²	22	69.6 Å²	69.6	23%	0.227	38%	0.38	C	S	.	.	S	Bend	trans	-74.8	178.5	174.2	0	0	0	0	0	112.6	C745 L746	C745-G749 PolarHBondContact O-N 2.92Å; L746-G749 PolarHBondContact O-N 3.39Å
750	F	92.1	Very high	92.6	Very high	49 Å²	49	72.4 Å²	72.4	22%	0.215	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	153.8	-179.4	-64.6	-92.2	0	0	0	111.3	I760 L761 S776 A777 C778	F750-I760 CarbonylContact O-C 3.55Å; F750-I760 WeakPolarHBondContact O-CA 3.37Å; F750-L761 HydrophobicContact CB-CB 4.31Å; F750-L761 PolarHBondContact N-O 3.28Å; F750-L761 PolarHBondContact O-N 2.77Å; F750-S776 VanDerWaalsContact CZ-O 3.27Å; F750-S776 WeakPolarHBondContact CZ-O 3.42Å; F750-A777 HydrophobicContact CD1-CB 4.46Å; F750-A777 HydrophobicContact CE1-CB 4.28Å; F750-C778 HydrophobicContact CB-CB 3.83Å; F750-C778 HydrophobicContact CD2-CB 3.77Å; F750-C778 WeakPolarHBondContact CD2-SG 3.31Å; F750-C778 HydrophobicContact CE2-CB 4.47Å; F750-C778 HydrophobicContact CG-CB 3.8Å
751	I	93.1	Very high	92.7	Very high	95 Å²	95	70.2 Å²	70.2	49%	0.487	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	133.6	160	-61.2	174	0	0	0	106.2	E753	I751-E753 PolarHBondContact O-N 3.41Å; I751-E753 VanDerWaalsContact O-N 3.12Å
752	C	94.7	Very high	92.7	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	35%	0.351	C	S	.	.			trans	-61.1	115.4	178.2	-179.8	0	0	0	0	110	I754 K756 L761 H780	C752-I754 PolarHBondContact O-N 3.33Å; C752-K756 VanDerWaalsContact O-CA 3.28Å; C752-K756 WeakPolarHBondContact O-CA 3.43Å; C752-K756 PolarHBondContact O-N 3.5Å; C752-L761 HydrophobicContact CB-CD1 3.93Å; C752-H780 VanDerWaalsContact CB-ND1 3.28Å; C752-H780 WeakPolarHBondContact CB-ND1 3.11Å
753	E	93.5	Very high	92.4	Very high	53 Å²	53	64.7 Å²	64.7	25%	0.248	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-14.6	-174.7	-55.8	-173.1	158.1	0	0	113.7	I751 K756 F779 R794 R797	I751-E753 PolarHBondContact O-N 3.41Å; I751-E753 VanDerWaalsContact O-N 3.12Å; E753-K756 WeakPolarHBondContact O-CE 3.23Å; E753-K756 WeakPolarHBondContact O-CG 3.48Å; E753-F779 HydrophobicContact CB-CE1 4.11Å; E753-F779 HydrophobicContact CG-CE1 4.27Å; E753-R794 WeakPolarHBondContact OE1-CG 3.37Å; E753-R794 IonicContact OE1-NE 2.67Å; E753-R797 IonicContact OE1-CZ 3.99Å; E753-R797 IonicContact OE1-NH2 2.91Å; E753-R797 PolarHBondContact OE1-NH2 2.9Å; E753-R797 IonicContact OE2-CZ 3.23Å; E753-R797 VanDerWaalsContact OE2-CZ 3.23Å; E753-R797 IonicContact OE2-NH1 2.72Å; E753-R797 PolarHBondContact OE2-NH1 2.94Å; E753-R797 IonicContact OE2-NH2 2.83Å; E753-R797 PolarHBondContact OE2-NH2 3.02Å
754	I	94.5	Very high	92.1	Very high	74 Å²	74	56.3 Å²	56.3	38%	0.379	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-66.8	-175.6	-60.2	173.8	0	0	0	110.2	C752 F779 C783 L784 P793	C752-I754 PolarHBondContact O-N 3.33Å; I754-F779 HydrophobicContact CD1-CD1 3.88Å; I754-F779 HydrophobicContact CD1-CE1 4.31Å; I754-F779 HydrophobicContact CG1-CD1 4.08Å; I754-F779 HydrophobicContact CG1-CE1 4.29Å; I754-C783 HydrophobicContact CB-CB 4.04Å; I754-C783 HydrophobicContact CD1-CB 4.11Å; I754-C783 WeakPolarHBondContact CD1-O 3.36Å; I754-C783 HydrophobicContact CG2-CB 4.05Å; I754-L784 HydrophobicContact CD1-CB 4.11Å; I754-P793 HydrophobicContact CD1-CG 4.14Å; I754-P793 HydrophobicContact CG1-CG 4.01Å
755	C	94.9	Very high	90.7	Very high	58 Å²	58	49.4 Å²	49.4	39%	0.392	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-22.7	-180	66.7	0	0	0	0	114	S757 H780	C755-S757 PolarHBondContact O-N 3Å; C755-H780 VanDerWaalsContact SG-CE1 3.54Å; C755-H780 PolarHBondContact SG-ND1 3.49Å
756	K	92.9	Very high	89.6	Confident	154 Å²	154	51.1 Å²	51.1	67%	0.67	30%	0.302	S	S	*	.			trans	52.6	26.8	178.5	-54.8	176	-171.8	170.1	0	114.8	C752 E753 G758	C752-K756 VanDerWaalsContact O-CA 3.28Å; C752-K756 WeakPolarHBondContact O-CA 3.43Å; C752-K756 PolarHBondContact O-N 3.5Å; E753-K756 WeakPolarHBondContact O-CE 3.23Å; E753-K756 WeakPolarHBondContact O-CG 3.48Å; K756-G758 PolarHBondContact O-N 3.12Å
757	S	89.8	Confident	88.7	Confident	73 Å²	73	53.4 Å²	53.4	51%	0.51	32%	0.318	S	S	.	.			trans	-67	10.5	-170.1	64	0	0	0	0	116.6	C755 Q759	C755-S757 PolarHBondContact O-N 3Å; S757-Q759 PolarHBondContact O-N 3.4Å
758	G	88	Confident	88.4	Confident	49 Å²	49	54.4 Å²	54.4	51%	0.505	31%	0.311	S	S	.	.	S	Bend	trans	69.6	-15.3	-175.8	0	0	0	0	0	115.4	K756 I760	K756-G758 PolarHBondContact O-N 3.12Å; G758-I760 PolarHBondContact O-N 2.97Å
759	Q	89.8	Confident	88.4	Confident	99 Å²	99	52.5 Å²	52.5	46%	0.463	30%	0.298	S	S	.	.			trans	-62.9	126.1	177.7	-171.6	-177.9	18.1	0	0	111	S757 L761 H780	S757-Q759 PolarHBondContact O-N 3.4Å; Q759-L761 HydrophobicContact CG-CD2 4.25Å; Q759-H780 PolarHBondContact OE1-NE2 2.96Å
760	I	91.5	Very high	88.4	Confident	59 Å²	59	52.5 Å²	52.5	30%	0.303	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	123.9	178.1	-60.4	174.3	0	0	0	109.8	L746 F750 G758 F762 Q766	L746-I760 HydrophobicContact CB-CD1 4Å; L746-I760 HydrophobicContact CD2-CD1 3.9Å; L746-I760 HydrophobicContact CD2-CG2 4.34Å; F750-I760 CarbonylContact O-C 3.55Å; F750-I760 WeakPolarHBondContact O-CA 3.37Å; G758-I760 PolarHBondContact O-N 2.97Å; I760-F762 HydrophobicContact CG2-CE1 4.32Å; I760-F762 HydrophobicContact CG2-CE2 4.15Å; I760-F762 HydrophobicContact CG2-CZ 3.93Å; I760-Q766 PolarHBondContact O-NE2 3.19Å
761	L	92.8	Very high	88.5	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	145	-179.9	-56.1	-173.2	0	0	0	112.1	F750 C752 Q759 T769 C778	F750-L761 HydrophobicContact CB-CB 4.31Å; F750-L761 PolarHBondContact N-O 3.28Å; F750-L761 PolarHBondContact O-N 2.77Å; C752-L761 HydrophobicContact CB-CD1 3.93Å; Q759-L761 HydrophobicContact CG-CD2 4.25Å; L761-T769 HydrophobicContact CB-CG2 4.36Å; L761-T769 HydrophobicContact CD1-CG2 4.47Å; L761-C778 HydrophobicContact CB-CB 4.01Å
762	F	92.4	Very high	88.6	Confident	14 Å²	14	48.1 Å²	48.1	6%	0.061	27%	0.273	C	S	.	.			trans	-128.6	139.7	-179.7	-66.9	-67	0	0	0	111.1	F684 I739 L746 I760 F764	F684-F762 HydrophobicContact CD1-CE1 4.34Å; F684-F762 AromaticContact CE1-CD1 3.76Å; F684-F762 HydrophobicContact CE1-CD1 3.76Å; F684-F762 AromaticContact CE1-CE1 3.73Å; F684-F762 HydrophobicContact CE1-CE1 3.73Å; F684-F762 AromaticContact CZ-CD1 3.83Å; F684-F762 HydrophobicContact CZ-CD1 3.83Å; F684-F762 HydrophobicContact CZ-CE1 4.28Å; I739-F762 HydrophobicContact CG2-CD1 3.85Å; I739-F762 HydrophobicContact CG2-CE1 3.38Å; I739-F762 HydrophobicContact CG2-CE2 4.14Å; I739-F762 HydrophobicContact CG2-CG 4.41Å; I739-F762 HydrophobicContact CG2-CZ 3.53Å; L746-F762 HydrophobicContact CD2-CE2 4.27Å; L746-F762 HydrophobicContact CD2-CZ 3.96Å; I760-F762 HydrophobicContact CG2-CE1 4.32Å; I760-F762 HydrophobicContact CG2-CE2 4.15Å; I760-F762 HydrophobicContact CG2-CZ 3.93Å; F762-F764 VanDerWaalsContact C-N 3.28Å; F762-F764 HydrophobicContact CB-CD1 4.19Å; F762-F764 HydrophobicContact CB-CE1 3.68Å; F762-F764 HydrophobicContact CB-CE2 4.05Å; F762-F764 HydrophobicContact CB-CZ 3.59Å; F762-F764 AromaticContact CD1-CE1 3.82Å; F762-F764 HydrophobicContact CD1-CE1 3.82Å; F762-F764 AromaticContact CD1-CZ 3.92Å; F762-F764 HydrophobicContact CD1-CZ 3.92Å; F762-F764 HydrophobicContact CD2-CZ 4.22Å; F762-F764 AromaticContact CG-CE1 3.91Å; F762-F764 HydrophobicContact CG-CE1 3.91Å; F762-F764 HydrophobicContact CG-CE2 4.45Å; F762-F764 AromaticContact CG-CZ 3.66Å; F762-F764 HydrophobicContact CG-CZ 3.66Å; F762-F764 PolarHBondContact O-N 2.81Å
763	P	89.9	Confident	88.4	Confident	20 Å²	20	52.8 Å²	52.8	13%	0.13	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-20.4	-175.3	27.6	-35	0	0	0	113.9	L680 F684 I771	L680-P763 HydrophobicContact CB-CB 4.32Å; L680-P763 HydrophobicContact CB-CG 4.19Å; L680-P763 HydrophobicContact CD1-CB 4.32Å; L680-P763 HydrophobicContact CD2-CB 4.26Å; F684-P763 HydrophobicContact CE2-CG 4.09Å; P763-I771 HydrophobicContact CB-CD1 3.74Å; P763-I771 HydrophobicContact CB-CG1 4.23Å; P763-I771 WeakPolarHBondContact O-CD1 3.44Å
764	F	87.6	Confident	88.4	Confident	10 Å²	10	52.7 Å²	52.7	4%	0.044	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	7.5	-160.9	53.6	-109.7	0	0	0	116.1	Q677 L680 M681 F684 V736 I739 F762	Q677-F764 HydrophobicContact CB-CB 4.43Å; Q677-F764 WeakPolarHBondContact CB-O 3.28Å; Q677-F764 WeakPolarHBondContact CG-O 3.42Å; Q677-F764 PolarHBondContact NE2-O 2.92Å; Q677-F764 WeakPolarHBondContact O-CB 3.47Å; L680-F764 HydrophobicContact CB-CB 3.89Å; M681-F764 HydrophobicContact CB-CD1 4.46Å; M681-F764 HydrophobicContact CE-CB 3.98Å; M681-F764 HydrophobicContact CE-CD2 3.57Å; M681-F764 HydrophobicContact CE-CE2 4.26Å; M681-F764 HydrophobicContact CE-CG 3.84Å; M681-F764 HydrophobicContact CG-CB 3.88Å; M681-F764 HydrophobicContact CG-CD1 3.54Å; M681-F764 HydrophobicContact CG-CD2 4.07Å; M681-F764 HydrophobicContact CG-CE1 4.08Å; M681-F764 HydrophobicContact CG-CG 3.54Å; F684-F764 HydrophobicContact CD2-CD1 4.39Å; F684-F764 HydrophobicContact CD2-CE1 4.13Å; F684-F764 HydrophobicContact CE2-CD1 4.2Å; F684-F764 HydrophobicContact CE2-CE1 4.02Å; F684-F764 HydrophobicContact CZ-CE1 4.43Å; V736-F764 HydrophobicContact CG2-CE2 4.38Å; I739-F764 HydrophobicContact CB-CZ 4.11Å; I739-F764 HydrophobicContact CD1-CE1 3.91Å; I739-F764 HydrophobicContact CD1-CZ 4Å; I739-F764 HydrophobicContact CG2-CE1 3.9Å; I739-F764 HydrophobicContact CG2-CZ 3.53Å; F762-F764 VanDerWaalsContact C-N 3.28Å; F762-F764 HydrophobicContact CB-CD1 4.19Å; F762-F764 HydrophobicContact CB-CE1 3.68Å; F762-F764 HydrophobicContact CB-CE2 4.05Å; F762-F764 HydrophobicContact CB-CZ 3.59Å; F762-F764 AromaticContact CD1-CE1 3.82Å; F762-F764 HydrophobicContact CD1-CE1 3.82Å; F762-F764 AromaticContact CD1-CZ 3.92Å; F762-F764 HydrophobicContact CD1-CZ 3.92Å; F762-F764 HydrophobicContact CD2-CZ 4.22Å; F762-F764 AromaticContact CG-CE1 3.91Å; F762-F764 HydrophobicContact CG-CE1 3.91Å; F762-F764 HydrophobicContact CG-CE2 4.45Å; F762-F764 AromaticContact CG-CZ 3.66Å; F762-F764 HydrophobicContact CG-CZ 3.66Å; F762-F764 PolarHBondContact O-N 2.81Å
765	G	65.8	Low	88.3	Confident	22 Å²	22	49.6 Å²	49.6	23%	0.227	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	164.3	15.4	177.5	0	0	0	0	0	120.4
766	Q	72.1	Confident	88.2	Confident	38 Å²	38	50.5 Å²	50.5	18%	0.178	31%	0.31	C	S	.	.			trans	-81.5	127.6	175.9	-76.1	172.2	-27	0	0	111.7	L238 I760 N768 T769	L238-Q766 HydrophobicContact CD1-CG 4.31Å; I760-Q766 PolarHBondContact O-NE2 3.19Å; Q766-N768 PolarHBondContact O-N 3.47Å; Q766-N768 VanDerWaalsContact O-N 3.12Å; Q766-T769 VanDerWaalsContact CB-OG1 3.27Å; Q766-T769 WeakPolarHBondContact CB-OG1 3.33Å; Q766-T769 PolarHBondContact O-N 3.39Å; Q766-T769 VanDerWaalsContact O-N 3.1Å; Q766-T769 PolarHBondContact OE1-OG1 2.99Å
767	V	73.9	Confident	88.1	Confident	93 Å²	93	43.3 Å²	43.3	56%	0.564	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-29.8	-177.9	-177.4	0	0	0	0	113.1	R781	V767-R781 WeakPolarHBondContact O-CD 3.39Å; V767-R781 PolarHBondContact O-NH1 3.29Å
768	N	85	Confident	88.4	Confident	108 Å²	108	39.9 Å²	39.9	58%	0.578	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	16.1	-177.5	-67.6	0.2	0	0	0	113.6	Q766 H780 R781	Q766-N768 PolarHBondContact O-N 3.47Å; Q766-N768 VanDerWaalsContact O-N 3.12Å; N768-H780 CarbonylContact O-C 3.5Å; N768-H780 WeakPolarHBondContact O-CA 3.48Å; N768-R781 PolarHBondContact O-N 3.05Å
769	T	91	Very high	88.7	Confident	11 Å²	11	37.6 Å²	37.6	7%	0.067	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	137.7	-172.5	-59.2	0	0	0	0	113.7	L761 Q766 C778 F779 R781	L761-T769 HydrophobicContact CB-CG2 4.36Å; L761-T769 HydrophobicContact CD1-CG2 4.47Å; Q766-T769 VanDerWaalsContact CB-OG1 3.27Å; Q766-T769 WeakPolarHBondContact CB-OG1 3.33Å; Q766-T769 PolarHBondContact O-N 3.39Å; Q766-T769 VanDerWaalsContact O-N 3.1Å; Q766-T769 PolarHBondContact OE1-OG1 2.99Å; T769-C778 HydrophobicContact CG2-CB 3.81Å; T769-F779 CarbonylContact C-O 3.53Å; T769-F779 VanDerWaalsContact CA-O 3.32Å; T769-F779 WeakPolarHBondContact CA-O 3.46Å; T769-R781 PolarHBondContact O-NE 3.35Å
770	T	92.1	Very high	88.9	Confident	22 Å²	22	33.9 Å²	33.9	14%	0.135	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	156.7	166.4	28.1	0	0	0	0	110.6	C778 F779 R781 L784 P787	T770-C778 CarbonylContact O-C 3.53Å; T770-C778 VanDerWaalsContact O-CA 3.3Å; T770-C778 WeakPolarHBondContact O-CA 3.08Å; T770-F779 PolarHBondContact N-O 3.43Å; T770-F779 PolarHBondContact O-N 2.91Å; T770-R781 HydrophobicContact CG2-CG 3.77Å; T770-L784 PolarHBondContact OG1-O 3.43Å; T770-P787 HydrophobicContact CG2-CB 4.49Å; T770-P787 HydrophobicContact CG2-CG 4.05Å
771	I	92.7	Very high	88.9	Confident	52 Å²	52	35.8 Å²	35.8	27%	0.267	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	128.5	-177.7	-47.4	167.5	0	0	0	108.8	L680 P763 S773 A777 P787	L680-I771 HydrophobicContact CD1-CD1 4.12Å; P763-I771 HydrophobicContact CB-CD1 3.74Å; P763-I771 HydrophobicContact CB-CG1 4.23Å; P763-I771 WeakPolarHBondContact O-CD1 3.44Å; I771-S773 PolarHBondContact O-N 2.89Å; I771-A777 WeakPolarHBondContact CA-O 3.4Å; I771-P787 WeakPolarHBondContact O-CB 3.46Å; I771-P787 WeakPolarHBondContact O-CG 3.45Å
772	C	94.7	Very high	88.9	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.007	26%	0.26	C	S	.	.			trans	-65.7	122	173.6	172.8	0	0	0	0	111.4	G774 C775 S776 A777 F779 P787 C792	C772-G774 VanDerWaalsContact C-N 3.28Å; C772-G774 PolarHBondContact O-N 3.16Å; C772-C775 PolarHBondContact O-N 3.04Å; C772-C775 VanDerWaalsContact SG-SG 3.66Å; C772-S776 VanDerWaalsContact O-CA 3.29Å; C772-S776 WeakPolarHBondContact O-CA 3.39Å; C772-S776 PolarHBondContact O-N 2.9Å; C772-A777 PolarHBondContact N-O 3.27Å; C772-F779 HydrophobicContact CB-CE2 4.19Å; C772-P787 VanDerWaalsContact CA-O 3.31Å; C772-P787 WeakPolarHBondContact CA-O 3.46Å; C772-C792 HydrophobicContact CB-CB 4.01Å; C772-C792 WeakPolarHBondContact SG-CB 3.4Å; C772-C792 VanDerWaalsContact SG-SG 3.6Å
773	S	92.2	Very high	89.1	Confident	97 Å²	97	42 Å²	42	68%	0.678	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-35.3	-179.6	58.4	0	0	0	0	113.6	I771 P787	I771-S773 PolarHBondContact O-N 2.89Å; S773-P787 PolarHBondContact N-O 3.01Å
774	G	92.3	Very high	89.2	Confident	52 Å²	52	41.8 Å²	41.8	54%	0.536	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-28.7	-177.9	0	0	0	0	0	116.1	C772	C772-G774 VanDerWaalsContact C-N 3.28Å; C772-G774 PolarHBondContact O-N 3.16Å
775	C	93.3	Very high	89.3	Confident	9 Å²	9	48 Å²	48	6%	0.061	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.7	11	-174.6	77.8	0	0	0	0	116	C772 A777 C795	C772-C775 PolarHBondContact O-N 3.04Å; C772-C775 VanDerWaalsContact SG-SG 3.66Å; C775-A777 PolarHBondContact O-N 3.23Å; C775-C795 VanDerWaalsContact CB-SG 3.58Å; C775-C795 PolarHBondContact SG-SG 2.86Å
776	S	91.3	Very high	90.6	Very high	76 Å²	76	49.8 Å²	49.8	53%	0.531	31%	0.305	S	S	.	.			trans	49.5	20.1	178.9	64.2	0	0	0	0	116.4	F750 C772	F750-S776 VanDerWaalsContact CZ-O 3.27Å; F750-S776 WeakPolarHBondContact CZ-O 3.42Å; C772-S776 VanDerWaalsContact O-CA 3.29Å; C772-S776 WeakPolarHBondContact O-CA 3.39Å; C772-S776 PolarHBondContact O-N 2.9Å
777	A	92.8	Very high	91.4	Very high	3 Å²	3	49 Å²	49	3%	0.025	30%	0.303	C	S	.	.			trans	-77.3	136.1	176	0	0	0	0	0	111.4	F750 I771 C772 C775 F779	F750-A777 HydrophobicContact CD1-CB 4.46Å; F750-A777 HydrophobicContact CE1-CB 4.28Å; I771-A777 WeakPolarHBondContact CA-O 3.4Å; C772-A777 PolarHBondContact N-O 3.27Å; C775-A777 PolarHBondContact O-N 3.23Å; A777-F779 HydrophobicContact CB-CE2 3.71Å; A777-F779 HydrophobicContact CB-CZ 4.1Å; A777-F779 WeakPolarHBondContact O-CD2 3.36Å; A777-F779 WeakPolarHBondContact O-CE2 3.46Å
778	C	94.2	Very high	92.3	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.014	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	139.1	-179.7	-58.9	0	0	0	0	112	F750 L761 T769 T770	F750-C778 HydrophobicContact CB-CB 3.83Å; F750-C778 HydrophobicContact CD2-CB 3.77Å; F750-C778 WeakPolarHBondContact CD2-SG 3.31Å; F750-C778 HydrophobicContact CE2-CB 4.47Å; F750-C778 HydrophobicContact CG-CB 3.8Å; L761-C778 HydrophobicContact CB-CB 4.01Å; T769-C778 HydrophobicContact CG2-CB 3.81Å; T770-C778 CarbonylContact O-C 3.53Å; T770-C778 VanDerWaalsContact O-CA 3.3Å; T770-C778 WeakPolarHBondContact O-CA 3.08Å
779	F	95.1	Very high	92.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	163.7	178.3	-60	-93.8	0	0	0	109.1	E753 I754 T769 T770 C772 A777 L784 C792	E753-F779 HydrophobicContact CB-CE1 4.11Å; E753-F779 HydrophobicContact CG-CE1 4.27Å; I754-F779 HydrophobicContact CD1-CD1 3.88Å; I754-F779 HydrophobicContact CD1-CE1 4.31Å; I754-F779 HydrophobicContact CG1-CD1 4.08Å; I754-F779 HydrophobicContact CG1-CE1 4.29Å; T769-F779 CarbonylContact C-O 3.53Å; T769-F779 VanDerWaalsContact CA-O 3.32Å; T769-F779 WeakPolarHBondContact CA-O 3.46Å; T770-F779 PolarHBondContact N-O 3.43Å; T770-F779 PolarHBondContact O-N 2.91Å; C772-F779 HydrophobicContact CB-CE2 4.19Å; A777-F779 HydrophobicContact CB-CE2 3.71Å; A777-F779 HydrophobicContact CB-CZ 4.1Å; A777-F779 WeakPolarHBondContact O-CD2 3.36Å; A777-F779 WeakPolarHBondContact O-CE2 3.46Å; F779-L784 HydrophobicContact CB-CB 3.81Å; F779-L784 HydrophobicContact CB-CD2 4.3Å; F779-L784 HydrophobicContact CD1-CD2 4.3Å; F779-L784 HydrophobicContact CD2-CD2 3.5Å; F779-L784 VanDerWaalsContact CD2-CD2 3.5Å; F779-L784 HydrophobicContact CE2-CD2 3.83Å; F779-L784 HydrophobicContact CG-CB 4.08Å; F779-L784 HydrophobicContact CG-CD2 3.78Å; F779-L784 HydrophobicContact CZ-CD2 4.37Å; F779-C792 VanDerWaalsContact CE2-SG 3.5Å; F779-C792 WeakPolarHBondContact CZ-SG 3.28Å
780	H	94.3	Very high	92.8	Very high	21 Å²	21	51.6 Å²	51.6	10%	0.097	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	145.1	167	-62.7	92.2	0	0	0	110.6	C752 C755 Q759 N768 A782 C783 L784	C752-H780 VanDerWaalsContact CB-ND1 3.28Å; C752-H780 WeakPolarHBondContact CB-ND1 3.11Å; C755-H780 VanDerWaalsContact SG-CE1 3.54Å; C755-H780 PolarHBondContact SG-ND1 3.49Å; Q759-H780 PolarHBondContact OE1-NE2 2.96Å; N768-H780 CarbonylContact O-C 3.5Å; N768-H780 WeakPolarHBondContact O-CA 3.48Å; H780-A782 VanDerWaalsContact C-N 3.28Å; H780-A782 PolarHBondContact O-N 3.13Å; H780-C783 HydrophobicContact CB-CB 4.03Å; H780-C783 CarbonylContact O-C 3.24Å; H780-C783 WeakPolarHBondContact O-CA 3.22Å; H780-C783 WeakPolarHBondContact O-CB 3.41Å; H780-C783 PolarHBondContact O-N 3.15Å; H780-L784 PolarHBondContact O-N 3.46Å
781	R	92	Very high	92.9	Very high	100 Å²	100	53.3 Å²	53.3	38%	0.377	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-42.7	175.3	-75.3	-179.2	175.9	172.5	-15.6	112.5	V767 N768 T769 T770 C783 L784	V767-R781 WeakPolarHBondContact O-CD 3.39Å; V767-R781 PolarHBondContact O-NH1 3.29Å; N768-R781 PolarHBondContact O-N 3.05Å; T769-R781 PolarHBondContact O-NE 3.35Å; T770-R781 HydrophobicContact CG2-CG 3.77Å; R781-C783 PolarHBondContact O-N 3.38Å; R781-L784 CarbonylContact O-C 3.52Å
782	A	93.2	Very high	93.1	Very high	107 Å²	107	50.8 Å²	50.8	88%	0.884	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-10.3	174.5	0	0	0	0	0	114.4	H780	H780-A782 VanDerWaalsContact C-N 3.28Å; H780-A782 PolarHBondContact O-N 3.13Å
783	C	95.2	Very high	93.1	Very high	39 Å²	39	52.5 Å²	52.5	26%	0.264	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-32.9	176.1	-69.5	0	0	0	0	113	I754 H780 R781	I754-C783 HydrophobicContact CB-CB 4.04Å; I754-C783 HydrophobicContact CD1-CB 4.11Å; I754-C783 WeakPolarHBondContact CD1-O 3.36Å; I754-C783 HydrophobicContact CG2-CB 4.05Å; H780-C783 HydrophobicContact CB-CB 4.03Å; H780-C783 CarbonylContact O-C 3.24Å; H780-C783 WeakPolarHBondContact O-CA 3.22Å; H780-C783 WeakPolarHBondContact O-CB 3.41Å; H780-C783 PolarHBondContact O-N 3.15Å; R781-C783 PolarHBondContact O-N 3.38Å
784	L	93	Very high	93.2	Very high	14 Å²	14	51.4 Å²	51.4	7%	0.073	30%	0.301	C	S	.	.			trans	-140.6	95.5	177.7	-171.5	64.4	0	0	0	110	I754 T770 F779 H780 R781 P787 C792	I754-L784 HydrophobicContact CD1-CB 4.11Å; T770-L784 PolarHBondContact OG1-O 3.43Å; F779-L784 HydrophobicContact CB-CB 3.81Å; F779-L784 HydrophobicContact CB-CD2 4.3Å; F779-L784 HydrophobicContact CD1-CD2 4.3Å; F779-L784 HydrophobicContact CD2-CD2 3.5Å; F779-L784 VanDerWaalsContact CD2-CD2 3.5Å; F779-L784 HydrophobicContact CE2-CD2 3.83Å; F779-L784 HydrophobicContact CG-CB 4.08Å; F779-L784 HydrophobicContact CG-CD2 3.78Å; F779-L784 HydrophobicContact CZ-CD2 4.37Å; H780-L784 PolarHBondContact O-N 3.46Å; R781-L784 CarbonylContact O-C 3.52Å; L784-P787 HydrophobicContact CD2-CB 3.99Å; L784-P787 HydrophobicContact CG-CB 4.21Å; L784-C792 HydrophobicContact CD2-CB 4.39Å
785	H	89.9	Confident	93.4	Very high	142 Å²	142	49.8 Å²	49.8	66%	0.657	28%	0.281	S	S	*	.	S	Bend	trans	-75.7	-46.1	-173.7	-165.3	107.2	0	0	0	112.6	P787	H785-P787 WeakPolarHBondContact O-CD 3.29Å
786	S	91.5	Very high	93.5	Very high	59 Å²	59	53 Å²	53	41%	0.413	30%	0.297	S	S	.	.	S	Bend	trans	-103.4	106.4	167.9	-176.3	0	0	0	0	109	N788 T791	S786-N788 PolarHBondContact O-N 3.22Å; S786-N788 PolarHBondContact OG-ND2 2.89Å; S786-N788 VanDerWaalsContact OG-ND2 3.1Å; S786-T791 PolarHBondContact O-OG1 3.29Å
787	P	89.1	Confident	93.7	Very high	20 Å²	20	55.8 Å²	55.8	13%	0.13	30%	0.296	C	S	.	.			trans	-95.7	68.9	-171.7	39.5	-37.7	0	0	0	111.7	T770 I771 C772 S773 L784 H785	T770-P787 HydrophobicContact CG2-CB 4.49Å; T770-P787 HydrophobicContact CG2-CG 4.05Å; I771-P787 WeakPolarHBondContact O-CB 3.46Å; I771-P787 WeakPolarHBondContact O-CG 3.45Å; C772-P787 VanDerWaalsContact CA-O 3.31Å; C772-P787 WeakPolarHBondContact CA-O 3.46Å; S773-P787 PolarHBondContact N-O 3.01Å; L784-P787 HydrophobicContact CD2-CB 3.99Å; L784-P787 HydrophobicContact CG-CB 4.21Å; H785-P787 WeakPolarHBondContact O-CD 3.29Å
788	N	94.1	Very high	93.7	Very high	37 Å²	37	60.7 Å²	60.7	20%	0.198	31%	0.314	C	S	.	.	S	Bend	trans	-110.1	175.1	-177	73.1	51.7	0	0	0	111.6	S786 E790 T791 C792	S786-N788 PolarHBondContact O-N 3.22Å; S786-N788 PolarHBondContact OG-ND2 2.89Å; S786-N788 VanDerWaalsContact OG-ND2 3.1Å; N788-E790 VanDerWaalsContact C-N 3.31Å; N788-E790 PolarHBondContact O-N 3.08Å; N788-E790 WeakPolarHBondContact OD1-CA 3.43Å; N788-E790 WeakPolarHBondContact OD1-CB 3.47Å; N788-E790 PolarHBondContact OD1-N 3.15Å; N788-T791 PolarHBondContact N-OG1 3.33Å; N788-T791 WeakPolarHBondContact ND2-CG2 3.49Å; N788-T791 PolarHBondContact O-OG1 2.86Å; N788-T791 PolarHBondContact OD1-N 3.2Å; N788-T791 PolarHBondContact OD1-OG1 2.94Å; N788-C792 WeakPolarHBondContact O-CB 3.44Å; N788-C792 PolarHBondContact O-N 2.94Å; N788-C792 VanDerWaalsContact O-N 3.08Å
789	P	93.5	Very high	93.7	Very high	63 Å²	63	62.6 Å²	62.6	41%	0.409	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-26.8	-178.3	-20.2	33.5	0	0	0	114.7	C795	P789-C795 HydrophobicContact CB-CB 4.4Å; P789-C795 WeakPolarHBondContact O-CB 3.3Å
790	E	93.1	Very high	93.7	Very high	167 Å²	167	65.5 Å²	65.5	78%	0.78	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-35.6	-176.3	-52.4	180	161.7	0	0	111.6	N788 I796	N788-E790 VanDerWaalsContact C-N 3.31Å; N788-E790 PolarHBondContact O-N 3.08Å; N788-E790 WeakPolarHBondContact OD1-CA 3.43Å; N788-E790 WeakPolarHBondContact OD1-CB 3.47Å; N788-E790 PolarHBondContact OD1-N 3.15Å; E790-I796 VanDerWaalsContact O-CD1 3.29Å; E790-I796 WeakPolarHBondContact O-CD1 3.42Å; E790-I796 WeakPolarHBondContact O-CG1 3.5Å
791	T	94.4	Very high	93.7	Very high	58 Å²	58	71 Å²	71	36%	0.356	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-25.8	178.5	59.1	0	0	0	0	113.4	S786 N788 P793	S786-T791 PolarHBondContact O-OG1 3.29Å; N788-T791 PolarHBondContact N-OG1 3.33Å; N788-T791 WeakPolarHBondContact ND2-CG2 3.49Å; N788-T791 PolarHBondContact O-OG1 2.86Å; N788-T791 PolarHBondContact OD1-N 3.2Å; N788-T791 PolarHBondContact OD1-OG1 2.94Å; T791-P793 VanDerWaalsContact O-CD 3.29Å; T791-P793 WeakPolarHBondContact O-CD 3.46Å
792	C	96.5	Very high	93.6	Very high	0 Å²	0	73.7 Å²	73.7	0%	0	38%	0.381	C	S	.	.			trans	-71.9	118.4	-173	178.3	0	0	0	0	111.8	C772 F779 L784 N788 R794 C795 I796	C772-C792 HydrophobicContact CB-CB 4.01Å; C772-C792 WeakPolarHBondContact SG-CB 3.4Å; C772-C792 VanDerWaalsContact SG-SG 3.6Å; F779-C792 VanDerWaalsContact CE2-SG 3.5Å; F779-C792 WeakPolarHBondContact CZ-SG 3.28Å; L784-C792 HydrophobicContact CD2-CB 4.39Å; N788-C792 WeakPolarHBondContact O-CB 3.44Å; N788-C792 PolarHBondContact O-N 2.94Å; N788-C792 VanDerWaalsContact O-N 3.08Å; C792-R794 PolarHBondContact O-N 3.46Å; C792-C795 HydrophobicContact CB-CB 4.06Å; C792-C795 PolarHBondContact O-N 2.91Å; C792-I796 WeakPolarHBondContact O-CG1 3.42Å; C792-I796 PolarHBondContact O-N 3.1Å
793	P	94.8	Very high	93.5	Very high	36 Å²	36	74.4 Å²	74.4	23%	0.234	37%	0.366	C	S	.	.	H	α-helix	trans	-56.1	-30.8	-178.6	-27.3	35.8	0	0	0	113.8	I754 T791 R797	I754-P793 HydrophobicContact CD1-CG 4.14Å; I754-P793 HydrophobicContact CG1-CG 4.01Å; T791-P793 VanDerWaalsContact O-CD 3.29Å; T791-P793 WeakPolarHBondContact O-CD 3.46Å; P793-R797 VanDerWaalsContact C-NH1 3.29Å; P793-R797 WeakPolarHBondContact O-CB 3.39Å; P793-R797 VanDerWaalsContact O-CG 3.29Å; P793-R797 WeakPolarHBondContact O-CG 3.34Å; P793-R797 PolarHBondContact O-N 3.19Å; P793-R797 VanDerWaalsContact O-N 3.09Å; P793-R797 PolarHBondContact O-NH1 2.88Å
794	R	94.1	Very high	93.2	Very high	74 Å²	74	79.5 Å²	79.5	28%	0.279	39%	0.386	S	S	.	.	H	α-helix	trans	-75.1	-30.3	178.7	-159	-176.4	-165.1	-139.9	8	113	E753 C792 R798	E753-R794 WeakPolarHBondContact OE1-CG 3.37Å; E753-R794 IonicContact OE1-NE 2.67Å; C792-R794 PolarHBondContact O-N 3.46Å; R794-R798 WeakPolarHBondContact O-CB 3.5Å; R794-R798 WeakPolarHBondContact O-CD 3.5Å; R794-R798 WeakPolarHBondContact O-CG 3.42Å; R794-R798 PolarHBondContact O-N 3.39Å
795	C	96.5	Very high	92.8	Very high	18 Å²	18	85.2 Å²	85.2	12%	0.122	42%	0.416	C	S	.	.	H	α-helix	trans	-75.5	-47.5	171.9	-72.7	0	0	0	0	110.8	C775 P789 C792 R797 R798 A799	C775-C795 VanDerWaalsContact CB-SG 3.58Å; C775-C795 PolarHBondContact SG-SG 2.86Å; P789-C795 HydrophobicContact CB-CB 4.4Å; P789-C795 WeakPolarHBondContact O-CB 3.3Å; C792-C795 HydrophobicContact CB-CB 4.06Å; C792-C795 PolarHBondContact O-N 2.91Å; C795-R797 PolarHBondContact O-N 3.44Å; C795-R798 CarbonylContact O-C 3.59Å; C795-R798 WeakPolarHBondContact O-CA 3.47Å; C795-R798 WeakPolarHBondContact O-CB 3.42Å; C795-R798 PolarHBondContact O-N 3.07Å; C795-A799 PolarHBondContact O-N 3.2Å
796	I	95.1	Very high	91.9	Very high	78 Å²	78	88.1 Å²	88.1	40%	0.4	43%	0.434	S	S	.	.	H	α-helix	trans	-54.5	-50.6	177.4	-58.2	164.9	0	0	0	110.7	E790 C792 R798 A799 V800	E790-I796 VanDerWaalsContact O-CD1 3.29Å; E790-I796 WeakPolarHBondContact O-CD1 3.42Å; E790-I796 WeakPolarHBondContact O-CG1 3.5Å; C792-I796 WeakPolarHBondContact O-CG1 3.42Å; C792-I796 PolarHBondContact O-N 3.1Å; I796-R798 PolarHBondContact O-N 3.47Å; I796-A799 PolarHBondContact O-N 3.08Å; I796-A799 VanDerWaalsContact O-N 3.15Å; I796-V800 PolarHBondContact O-N 2.99Å
797	R	94.5	Very high	91.9	Very high	133 Å²	133	89.6 Å²	89.6	50%	0.502	44%	0.436	S	S	.	.	H	α-helix	trans	-63.3	-23.5	176.5	-68.6	-168.8	-39.5	-84	2.6	113.9	E753 P793 C795 K801	E753-R797 IonicContact OE1-CZ 3.99Å; E753-R797 IonicContact OE1-NH2 2.91Å; E753-R797 PolarHBondContact OE1-NH2 2.9Å; E753-R797 IonicContact OE2-CZ 3.23Å; E753-R797 VanDerWaalsContact OE2-CZ 3.23Å; E753-R797 IonicContact OE2-NH1 2.72Å; E753-R797 PolarHBondContact OE2-NH1 2.94Å; E753-R797 IonicContact OE2-NH2 2.83Å; E753-R797 PolarHBondContact OE2-NH2 3.02Å; P793-R797 VanDerWaalsContact C-NH1 3.29Å; P793-R797 WeakPolarHBondContact O-CB 3.39Å; P793-R797 VanDerWaalsContact O-CG 3.29Å; P793-R797 WeakPolarHBondContact O-CG 3.34Å; P793-R797 PolarHBondContact O-N 3.19Å; P793-R797 VanDerWaalsContact O-N 3.09Å; P793-R797 PolarHBondContact O-NH1 2.88Å; C795-R797 PolarHBondContact O-N 3.44Å; R797-K801 VanDerWaalsContact O-CB 3.28Å; R797-K801 WeakPolarHBondContact O-CB 3.17Å; R797-K801 PolarHBondContact O-N 3.22Å
798	R	94.6	Very high	92	Very high	106 Å²	106	93.3 Å²	93.3	40%	0.4	45%	0.452	S	S	.	.	H	α-helix	trans	-81.4	-34.9	174.1	-79.1	172.2	169.8	-158.2	-5.1	112.2	R794 C795 I796 R802	R794-R798 WeakPolarHBondContact O-CB 3.5Å; R794-R798 WeakPolarHBondContact O-CD 3.5Å; R794-R798 WeakPolarHBondContact O-CG 3.42Å; R794-R798 PolarHBondContact O-N 3.39Å; C795-R798 CarbonylContact O-C 3.59Å; C795-R798 WeakPolarHBondContact O-CA 3.47Å; C795-R798 WeakPolarHBondContact O-CB 3.42Å; C795-R798 PolarHBondContact O-N 3.07Å; I796-R798 PolarHBondContact O-N 3.47Å; R798-R802 WeakPolarHBondContact O-CB 3.47Å; R798-R802 WeakPolarHBondContact O-CG 3.38Å; R798-R802 PolarHBondContact O-N 2.82Å
799	A	94.1	Very high	91.9	Very high	42 Å²	42	96.4 Å²	96.4	35%	0.347	47%	0.466	S	S	.	.	H	α-helix	trans	-65	-56.3	174.3	0	0	0	0	0	110.5	C795 I796 K801 R802 E803	C795-A799 PolarHBondContact O-N 3.2Å; I796-A799 PolarHBondContact O-N 3.08Å; I796-A799 VanDerWaalsContact O-N 3.15Å; A799-K801 PolarHBondContact O-N 3.11Å; A799-R802 CarbonylContact O-C 3.55Å; A799-R802 WeakPolarHBondContact O-CA 3.37Å; A799-R802 WeakPolarHBondContact O-CB 3.14Å; A799-R802 PolarHBondContact O-N 2.97Å; A799-E803 WeakPolarHBondContact O-CG 3.41Å; A799-E803 PolarHBondContact O-N 3.01Å
800	V	94.2	Very high	91.8	Very high	62 Å²	62	98.4 Å²	98.4	38%	0.376	47%	0.469	S	S	.	.	H	α-helix	trans	-56	-38.7	177	176.9	0	0	0	0	112	I796 E803 Q804	I796-V800 PolarHBondContact O-N 2.99Å; V800-E803 PolarHBondContact O-N 2.3Å; V800-Q804 WeakPolarHBondContact O-CB 3.25Å; V800-Q804 VanDerWaalsContact O-CG 3.26Å; V800-Q804 WeakPolarHBondContact O-CG 3.41Å; V800-Q804 PolarHBondContact O-N 2.97Å
801	K	93.4	Very high	91.8	Very high	135 Å²	135	94.1 Å²	94.1	59%	0.587	45%	0.45	S	S	*	.	H	α-helix	trans	-73.1	-25.6	175.5	-174.6	163.9	-177.8	171.7	0	113.7	R797 A799 L805	R797-K801 VanDerWaalsContact O-CB 3.28Å; R797-K801 WeakPolarHBondContact O-CB 3.17Å; R797-K801 PolarHBondContact O-N 3.22Å; A799-K801 PolarHBondContact O-N 3.11Å; K801-L805 HydrophobicContact CG-CD1 4.39Å; K801-L805 VanDerWaalsContact O-CD1 3.3Å; K801-L805 WeakPolarHBondContact O-CD1 3.08Å; K801-L805 VanDerWaalsContact O-CG 3.27Å; K801-L805 WeakPolarHBondContact O-CG 3.42Å
802	R	91.8	Very high	91.6	Very high	157 Å²	157	96.5 Å²	96.5	59%	0.592	46%	0.456	S	S	*	.	H	α-helix	trans	-72.8	-41.7	170.4	-80.2	174.3	168.9	-178.5	-5.7	110.5	D501 R798 A799 Q804 L805 I806	D501-R802 IonicContact OD2-CZ 3.9Å; D501-R802 IonicContact OD2-NH2 2.75Å; D501-R802 PolarHBondContact OD2-NH2 2.84Å; R798-R802 WeakPolarHBondContact O-CB 3.47Å; R798-R802 WeakPolarHBondContact O-CG 3.38Å; R798-R802 PolarHBondContact O-N 2.82Å; A799-R802 CarbonylContact O-C 3.55Å; A799-R802 WeakPolarHBondContact O-CA 3.37Å; A799-R802 WeakPolarHBondContact O-CB 3.14Å; A799-R802 PolarHBondContact O-N 2.97Å; R802-Q804 PolarHBondContact O-N 3.47Å; R802-L805 PolarHBondContact O-N 3.08Å; R802-L805 VanDerWaalsContact O-N 3.15Å; R802-I806 WeakPolarHBondContact O-CG1 2.98Å
803	E	90.5	Very high	91.2	Very high	122 Å²	122	103.4 Å²	103.4	57%	0.57	49%	0.488	S	S	*	.	H	α-helix	trans	-61.9	-39.4	175.2	-68.9	154.1	-158.9	0	0	112.3	A799 V800 L805 I806	A799-E803 WeakPolarHBondContact O-CG 3.41Å; A799-E803 PolarHBondContact O-N 3.01Å; V800-E803 PolarHBondContact O-N 2.3Å; E803-L805 PolarHBondContact O-N 3.08Å; E803-I806 PolarHBondContact O-N 3.27Å
804	Q	87.8	Confident	91	Very high	147 Å²	147	108.5 Å²	108.5	69%	0.687	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	2.4	175.1	-71.6	173.2	-6.6	0	0	115	V800 R802	V800-Q804 WeakPolarHBondContact O-CB 3.25Å; V800-Q804 VanDerWaalsContact O-CG 3.26Å; V800-Q804 WeakPolarHBondContact O-CG 3.41Å; V800-Q804 PolarHBondContact O-N 2.97Å; R802-Q804 PolarHBondContact O-N 3.47Å
805	L	84.3	Confident	90.7	Very high	134 Å²	134	111.4 Å²	111.4	70%	0.702	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.6	11.5	177.7	-70.7	171.3	0	0	0	112.4	K801 R802 E803	K801-L805 HydrophobicContact CG-CD1 4.39Å; K801-L805 VanDerWaalsContact O-CD1 3.3Å; K801-L805 WeakPolarHBondContact O-CD1 3.08Å; K801-L805 VanDerWaalsContact O-CG 3.27Å; K801-L805 WeakPolarHBondContact O-CG 3.42Å; R802-L805 PolarHBondContact O-N 3.08Å; R802-L805 VanDerWaalsContact O-N 3.15Å; E803-L805 PolarHBondContact O-N 3.08Å
806	I	71.5	Confident	90.2	Very high	203 Å²	203	119.9 Å²	119.9	100%	1.041	56%	0.564	S	S	*	*			trans	-114.7	0	177.4	-62.5	168.9	0	0	0	108.3	R802 E803	R802-I806 WeakPolarHBondContact O-CG1 2.98Å; E803-I806 PolarHBondContact O-N 3.27Å

Retrieved 806 of 806 residues in 173.1 ms (Link to these results)

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