A0A5K4F4W8_SCHMA Loading...

Cadherin

AlphaFold DB , UniProt , Accession A0A5K4F4W8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,339 aa.

						>A0A5K4F4W8_SCHMA|A0A5K4F4W8
MILCNSIQLIMFSLFIIKLVTFNSSTIYSLTFLPISSNLLLLSSSSLLLSSTSTVLMTSKYKKSGSLSINHSTDWSYQSILNKINNHNHNHREESLKSFNKQITYTLIEEEFNLPKLIGNLIDDLQLNNYLLNYILNYSPNTLSLWNNHNNQSKQLLSIDLIANQYPIINNQSNHDLARLYLFPSNQWSSNYFHINYYNLFKQELIQIKKLDRDQLCHYINDNNNNNNNSNTMKHIINPCICFKNICSIINNQSINNQSINNRSTNNNQLYLPYCQFTITLAMNLLNIDLNIMTILIQLMDINDNVPKFQWNQQNYIINFIENDQIGKKYQLPIAIDNDLCLHSNIDYQLEWINKPKINNSLLINYTTDNTTNNTTNNQYIDSINYFSLIFNKINNNNQLLEIQLDHKLDREWIDKYELHLLAIDHYYQYDINKKQHTTTLSLIIYIQDVNDCKPEFNLIQSLMNTTYSTTYTTYNNNNETLYIEVPENVRVGQVITKFHAIDKDIGKNSEIQYRISQYTHSITKLLNSTTGELIIQQSLDRELLPLSNGLHYLTITAYDQGIPQRSSNLFMIINILDINDNFPMIHLIDETEKFKKSNTQQSPWQQMIQSNNNNNHNNTIKNNQYMIELWQSISNHNKSINIHYIINQLNNYSIHTNMIGNQPMNTIVNILIINDPDLNENGTVQCFIKNQLLIYLKQKNNGGNNHSNNNNNYNLSDKLQFISMEPFNFIDPLNYRQQQQQQQQHEQQKEERIVENRKFQNKMDINLTMRENSMSSKKRKKESRMSKKQDVLPGNNTNNSNIDSLSNHNSYQLRTNMIFDPDQISDLYLLIECSDYGLPSLTTMETIHFNIIQPDIHSISNELHFSHLQILNPHIINDNHCLYFNYFQQNFNIRSLFINSSSSSSILDTFGHDDDLSLRKRIYPTRSSVCLILMANIQIYEPLFNMIININEKRKEENFQIIYKLIEEIPNENYFTINSTTGIVSLMKQFNKPTNITKQLMIQASKIGTLYDYSKNLNYKIQILINMTILNFKHSFMETSSRSSSSERTPYNNDDRVIIYLRMNSSNSLIKTYSNYTYEFDITHSIQSGDSVVPNIIVYCIKYPLFYIENYTNHHCELTMYNEMDTFMSGDKQNMDHFLLKPIKFLCHNNNQSNVLCNGYTIHRNHLLKHQLKDRYILTITSTTTSESSHGNISKNSKISSIKIILYIKENQYQKDQFIKEPFYFIKSINEPFKSIFNKLGLKPPYCITNLSISYKVYKDYVIMKLNSKNEKNIKNKKIFRLRHIWLLSKSNLMNSNHYNNEEMKIWNGIPFITLNPYTGILSIIRELLLKDVGDVFQ
					

Structure Viewer

Loading PAE data...

(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	32	Very low	32.5	Very low	233 Å²	233	161.8 Å²	161.8	100%	1.148	86%	0.855	S	S	*	*				0	124.6	0	-71.1	-159	-137.6	0	0	108.7
2	I	28.9	Very low	32.3	Very low	145 Å²	145	165.7 Å²	165.7	74%	0.744	86%	0.86	S	S	*	*			cis	179.2	131.5	-28.3	-94.2	153.3	0	0	0	101.8
3	L	34.4	Very low	32.2	Very low	158 Å²	158	160.2 Å²	160.2	83%	0.827	85%	0.845	S	S	*	*			trans	83.8	127.8	179.5	-63.9	128.3	0	0	0	117.6
4	C	31	Very low	32.2	Very low	113 Å²	113	160.8 Å²	160.8	76%	0.764	85%	0.847	S	S	*	*			cis	-171.9	128.4	-18.1	-124	0	0	0	0	108.1
5	N	33.7	Very low	32.2	Very low	169 Å²	169	163.8 Å²	163.8	90%	0.904	85%	0.851	S	S	*	*			trans	-71.2	128.8	164.2	-82.4	-32.5	0	0	0	110.2
6	S	32.7	Very low	32.1	Very low	101 Å²	101	163.7 Å²	163.7	71%	0.706	85%	0.85	S	S	*	*			trans	179.7	79.9	153.5	54.4	0	0	0	0	112.8
7	I	35.5	Very low	32.3	Very low	179 Å²	179	162.9 Å²	162.9	92%	0.918	85%	0.845	S	S	*	*			trans	-153.2	78.2	145.2	-72.3	112.3	0	0	0	105.9
8	Q	32.6	Very low	32.2	Very low	187 Å²	187	164.4 Å²	164.4	87%	0.874	84%	0.844	S	S	*	*	S	Bend	trans	-142	21.1	172.4	-135.9	174.7	3.4	0	0	112.1
9	L	30.2	Very low	32.2	Very low	158 Å²	158	163.8 Å²	163.8	83%	0.827	84%	0.842	S	S	*	*	S	Bend	trans	-145.4	105.3	170.7	-89.2	101.5	0	0	0	107.1
10	I	33.6	Very low	32.3	Very low	156 Å²	156	161 Å²	161	80%	0.8	83%	0.832	S	S	*	*	S	Bend	trans	-178.5	-9.5	155.5	-93.2	151.6	0	0	0	113.6
11	M	33	Very low	32.3	Very low	181 Å²	181	158.5 Å²	158.5	89%	0.892	82%	0.824	S	S	*	*	S	Bend	trans	-118.4	46.1	177.3	-66.4	-65.1	-75.6	0	0	113.3
12	F	30.7	Very low	32.4	Very low	208 Å²	208	156.7 Å²	156.7	91%	0.912	81%	0.81	S	S	*	*			trans	-137	40.8	176	-136	-88	0	0	0	113.1
13	S	30.4	Very low	32.5	Very low	95 Å²	95	156.8 Å²	156.8	66%	0.664	81%	0.812	S	S	*	*	S	Bend	trans	-145.9	124.2	169.6	54.6	0	0	0	0	109.3
14	L	32.3	Very low	32.5	Very low	168 Å²	168	154.3 Å²	154.3	88%	0.88	81%	0.808	S	S	*	*	S	Bend	trans	97.3	70.6	178.6	-53.5	166.1	0	0	0	116.2
15	F	31.7	Very low	32.5	Very low	206 Å²	206	153.7 Å²	153.7	90%	0.904	81%	0.805	S	S	*	*				179.9	70.7	121.2	-120.8	-103.5	0	0	0	111.6
16	I	31.5	Very low	32.6	Very low	162 Å²	162	151.4 Å²	151.4	83%	0.831	80%	0.798	S	S	*	*			trans	-120.9	114.2	151.2	-67.2	179	0	0	0	104.5
17	I	35.2	Very low	32.5	Very low	150 Å²	150	153.4 Å²	153.4	77%	0.769	80%	0.799	S	S	*	*			trans	-178.9	130.2	144	-89	149.5	0	0	0	109.3
18	K	31	Very low	32.2	Very low	190 Å²	190	154.6 Å²	154.6	83%	0.826	79%	0.793	S	S	*	*			trans	82.5	86.1	169.9	-83.8	173.9	173.7	178.4	0	117.7
19	L	31.3	Very low	32	Very low	154 Å²	154	149.9 Å²	149.9	81%	0.806	78%	0.781	S	S	*	*				69	105.8	77.4	-92.2	107.3	0	0	0	115.8
20	V	33.9	Very low	31.9	Very low	106 Å²	106	149.3 Å²	149.3	64%	0.642	78%	0.778	S	S	*	*				83.7	103.2	117.1	169.4	0	0	0	0	118.9
21	T	33.4	Very low	31.8	Very low	109 Å²	109	146.8 Å²	146.8	67%	0.669	77%	0.77	S	S	*	*			trans	65.6	138	135	69.1	0	0	0	0	118.2
22	F	33.6	Very low	31.6	Very low	196 Å²	196	146.8 Å²	146.8	86%	0.86	77%	0.765	S	S	*	*				-166.7	159.4	55.6	-124.9	-88.7	0	0	0	111
23	N	31.3	Very low	31.6	Very low	146 Å²	146	144.1 Å²	144.1	78%	0.781	76%	0.76	S	S	*	*			trans	-64.2	162.3	-176.7	-84.1	-30.7	0	0	0	117.8
24	S	33.8	Very low	31.5	Very low	106 Å²	106	145.4 Å²	145.4	74%	0.741	77%	0.766	S	S	*	*			trans	107.9	111.7	134.6	70.5	0	0	0	0	120.3
25	S	31.9	Very low	31.6	Very low	100 Å²	100	145.6 Å²	145.6	70%	0.699	77%	0.766	S	S	*	*			trans	44.1	123.7	134.1	61.9	0	0	0	0	121.1
26	T	34.3	Very low	31.7	Very low	122 Å²	122	140.4 Å²	140.4	75%	0.748	76%	0.755	S	S	*	*				161	113.3	121.4	42.5	0	0	0	0	109.2
27	I	30.7	Very low	31.7	Very low	143 Å²	143	137.1 Å²	137.1	73%	0.733	75%	0.747	S	S	*	*				81.2	112.6	99.4	-73.7	174.8	0	0	0	114.4
28	Y	29.7	Very low	31.5	Very low	203 Å²	203	137 Å²	137	80%	0.796	75%	0.748	S	S	*	*			trans	72.1	117.3	142.7	-81.8	-105	0	0	0	123.2
29	S	27.9	Very low	31.5	Very low	89 Å²	89	135.4 Å²	135.4	62%	0.622	75%	0.747	S	S	*	*				70.1	151.4	124.8	73.2	0	0	0	0	120.9
30	L	29.5	Very low	31.4	Very low	145 Å²	145	134.7 Å²	134.7	76%	0.759	74%	0.743	S	S	*	*			trans	92	91.9	166.4	-65.1	139.8	0	0	0	113.9
31	T	30.4	Very low	31.1	Very low	104 Å²	104	136.4 Å²	136.4	64%	0.638	75%	0.748	S	S	*	*				98.8	127.8	75.5	44.1	0	0	0	0	111.9
32	F	29.1	Very low	31	Very low	181 Å²	181	138.1 Å²	138.1	79%	0.794	75%	0.753	S	S	*	*			trans	63.7	108.6	144.4	-78.9	-105	0	0	0	118.9
33	L	30.7	Very low	30.8	Very low	152 Å²	152	133.7 Å²	133.7	80%	0.796	75%	0.746	S	S	*	*				164.4	135	95.5	-98.3	136.6	0	0	0	110.7
34	P	29.2	Very low	30.8	Very low	121 Å²	121	131.7 Å²	131.7	79%	0.786	74%	0.743	S	S	*	*			trans	-89.7	137.6	175.9	34.5	-28.8	0	0	0	110.8
35	I	34.4	Very low	30.9	Very low	173 Å²	173	131.9 Å²	131.9	89%	0.887	75%	0.745	S	S	*	*			trans	-107.7	121.7	167.4	-63.3	173.8	0	0	0	108.2
36	S	32.4	Very low	31	Very low	97 Å²	97	131.8 Å²	131.8	68%	0.678	74%	0.744	S	S	*	*			trans	-79.4	165.6	178.9	51.5	0	0	0	0	113.6
37	S	33	Very low	30.9	Very low	93 Å²	93	133.2 Å²	133.2	65%	0.65	75%	0.746	S	S	*	*			trans	88.6	110.1	142.1	51.8	0	0	0	0	120.9
38	N	29.5	Very low	30.9	Very low	147 Å²	147	133.2 Å²	133.2	79%	0.786	75%	0.747	S	S	*	*				65.7	113.9	124.2	-61.4	-14.8	0	0	0	119.8
39	L	31.4	Very low	30.9	Very low	156 Å²	156	130.5 Å²	130.5	82%	0.817	75%	0.746	S	S	*	*				-168.4	114.6	122.5	-126.4	74	0	0	0	109.7
40	L	29.4	Very low	31	Very low	139 Å²	139	130.8 Å²	130.8	73%	0.728	75%	0.748	S	S	*	*				46.9	112.2	114.6	-81.2	111.8	0	0	0	115.9
41	L	27.9	Very low	31.3	Very low	142 Å²	142	128.8 Å²	128.8	74%	0.743	75%	0.746	S	S	*	*				101.5	144	74.4	-124.4	145.9	0	0	0	110.6
42	L	30.5	Very low	31.2	Very low	146 Å²	146	130.2 Å²	130.2	76%	0.764	75%	0.754	S	S	*	*			trans	97.5	95.7	169.9	-56.9	164.5	0	0	0	114.4
43	S	30.1	Very low	31.3	Very low	103 Å²	103	127.6 Å²	127.6	72%	0.72	76%	0.758	S	S	*	*				84.6	139.5	90.2	70	0	0	0	0	111.2
44	S	30.5	Very low	31	Very low	103 Å²	103	126.6 Å²	126.6	72%	0.72	76%	0.759	S	S	*	*			cis	174.3	150.2	3.4	40.9	0	0	0	0	105.9
45	S	36.9	Very low	30.9	Very low	110 Å²	110	127.8 Å²	127.8	77%	0.769	76%	0.764	S	S	*	*			trans	144.3	104.3	147.4	54.2	0	0	0	0	109.5
46	S	33.6	Very low	30.5	Very low	98 Å²	98	126.5 Å²	126.5	69%	0.685	76%	0.758	S	S	*	*				83.2	114.8	59.3	72.1	0	0	0	0	114
47	L	32.5	Very low	30	Very low	153 Å²	153	131.2 Å²	131.2	80%	0.801	77%	0.772	S	S	*	*			trans	177	101.6	132	-91	143.5	0	0	0	106.5
48	L	29.6	Very low	29.7	Very low	142 Å²	142	132 Å²	132	74%	0.743	77%	0.772	S	S	*	*				66.1	129.8	83.5	-75.5	162.1	0	0	0	111
49	L	30.8	Very low	29.5	Very low	147 Å²	147	129.9 Å²	129.9	77%	0.77	77%	0.769	S	S	*	*			cis	-166.1	168.5	39.2	-88.2	109.6	0	0	0	106.9
50	S	30	Very low	29.1	Very low	95 Å²	95	131 Å²	131	66%	0.664	77%	0.768	S	S	*	*			cis	-177.8	146.2	-7.7	49.1	0	0	0	0	104.5
51	S	34.8	Very low	28.9	Very low	103 Å²	103	132.7 Å²	132.7	72%	0.72	77%	0.765	S	S	*	*				176.5	104.9	80.9	38.7	0	0	0	0	107.6
52	T	28.1	Very low	28.7	Very low	133 Å²	133	136 Å²	136	82%	0.816	77%	0.774	S	S	*	*				64.9	101.9	97.1	59	0	0	0	0	116.9
53	S	31.3	Very low	28.5	Very low	126 Å²	126	139 Å²	139	88%	0.881	78%	0.781	S	S	*	*				-153.1	127.1	127.7	57.4	0	0	0	0	110.4
54	T	25.8	Very low	28.3	Very low	131 Å²	131	140 Å²	140	80%	0.804	79%	0.788	S	S	*	*			trans	-95	128.7	-166.9	43.7	0	0	0	0	112.2
55	V	27.1	Very low	28	Very low	146 Å²	146	138 Å²	138	89%	0.885	78%	0.783	S	S	*	*			trans	-149.3	134.4	148.7	-177.4	0	0	0	0	110.4
56	L	25.4	Very low	27.4	Very low	147 Å²	147	138.7 Å²	138.7	77%	0.77	79%	0.788	S	S	*	*			trans	-26.7	130.1	-179.8	-85.5	72.9	0	0	0	119.4	T58	L56-T58 PolarHBondContact O-N 3.35Å
57	M	22.3	Very low	26.9	Very low	196 Å²	196	141.2 Å²	141.2	97%	0.966	79%	0.793	S	S	*	*			trans	-69.2	111.8	152.2	-83.6	-94.6	-157.9	0	0	110.6
58	T	25.6	Very low	26.5	Very low	109 Å²	109	138.5 Å²	138.5	67%	0.669	79%	0.787	S	S	*	*			trans	-138.1	133.9	161	47.4	0	0	0	0	108.9	L56	L56-T58 PolarHBondContact O-N 3.35Å
59	S	25.3	Very low	26.3	Very low	103 Å²	103	139.2 Å²	139.2	72%	0.72	79%	0.79	S	S	*	*			trans	49	103	166.4	60.6	0	0	0	0	117.8
60	K	23.9	Very low	26	Very low	180 Å²	180	139.4 Å²	139.4	78%	0.783	79%	0.792	S	S	*	*	S	Bend		27.5	109.8	84.8	-73.9	-177.7	178.1	175.7	0	113.2
61	Y	24.7	Very low	25.7	Very low	173 Å²	173	144 Å²	144	68%	0.678	80%	0.802	S	S	*	*			trans	79.1	102.9	-175.9	-54.8	-78.7	0	0	0	116	N120	Y61-N120 PolarHBondContact OH-ND2 3.09Å
62	K	24.6	Very low	25.2	Very low	211 Å²	211	143.5 Å²	143.5	92%	0.917	80%	0.799	S	S	*	*			trans	-103.2	106.5	164.8	-128.7	178.9	-174	178.1	0	108.8	S64	K62-S64 PolarHBondContact O-N 3.33Å
63	K	25.4	Very low	25.2	Very low	209 Å²	209	142.9 Å²	142.9	91%	0.909	80%	0.795	S	S	*	*			trans	-68.5	107.9	165.2	-144.4	177	-171.5	178.4	0	106.7	G65	K63-G65 PolarHBondContact O-N 3.46Å
64	S	26.1	Very low	24.9	Very low	126 Å²	126	144.4 Å²	144.4	88%	0.881	79%	0.793	S	S	*	*			trans	-72.8	95.4	168.1	43	0	0	0	0	108.5	K62	K62-S64 PolarHBondContact O-N 3.33Å
65	G	25.3	Very low	25.1	Very low	60 Å²	60	145.5 Å²	145.5	62%	0.619	78%	0.783	S	S	*	*			trans	-78.1	156.4	165.6	0	0	0	0	0	111.7	K63	K63-G65 PolarHBondContact O-N 3.46Å
66	S	23.1	Very low	25.4	Very low	125 Å²	125	142 Å²	142	87%	0.874	77%	0.765	S	S	*	*			trans	85.9	65.3	174	74.3	0	0	0	0	117.9
67	L	23.9	Very low	25.7	Very low	151 Å²	151	142.8 Å²	142.8	79%	0.791	76%	0.759	S	S	*	*			trans	-116.4	116.8	134.8	-100.8	140.9	0	0	0	107.3	I69	L67-I69 PolarHBondContact O-N 3.02Å
68	S	22.6	Very low	26.3	Very low	96 Å²	96	140.2 Å²	140.2	67%	0.671	74%	0.744	S	S	*	*			trans	-50.2	115.9	-177.5	51.1	0	0	0	0	112
69	I	25.7	Very low	26.8	Very low	156 Å²	156	136.7 Å²	136.7	80%	0.8	73%	0.725	S	S	*	*			trans	-126.2	124.5	163.7	-60.2	176.3	0	0	0	106.6	L67 H71	L67-I69 PolarHBondContact O-N 3.02Å; I69-H71 PolarHBondContact O-N 3.32Å
70	N	24.6	Very low	27.4	Very low	152 Å²	152	135.4 Å²	135.4	81%	0.813	71%	0.709	S	S	*	*			trans	-41.9	119.3	-175	-71.8	-30.9	0	0	0	113	S72	N70-S72 PolarHBondContact O-N 3.12Å
71	H	23.8	Very low	28.1	Very low	191 Å²	191	130.7 Å²	130.7	88%	0.884	69%	0.692	S	S	*	*			trans	-67.1	99.1	160.3	-85.1	-74.4	0	0	0	108.8	I69	I69-H71 PolarHBondContact O-N 3.32Å
72	S	24.8	Very low	28.7	Very low	93 Å²	93	127.6 Å²	127.6	65%	0.65	69%	0.687	S	S	*	*			trans	-142.9	124.8	154.7	61.1	0	0	0	0	109.3	N70	N70-S72 PolarHBondContact O-N 3.12Å
73	T	28	Very low	29.2	Very low	120 Å²	120	123.5 Å²	123.5	74%	0.736	67%	0.669	S	S	*	*			trans	77.5	80.3	173.8	69.5	0	0	0	0	117.7	W75	T73-W75 PolarHBondContact O-N 2.96Å
74	D	25.1	Very low	30	Very low	157 Å²	157	118.9 Å²	118.9	84%	0.84	65%	0.653	S	S	*	*			trans	-56.2	110.1	153	-84.9	-36	0	0	0	110.4
75	W	29.7	Very low	30.5	Very low	154 Å²	154	118.8 Å²	118.8	58%	0.583	64%	0.643	S	S	*	*			trans	-112.1	99	161.6	-78.5	33.2	0	0	0	107.6	T73 I80 K83	T73-W75 PolarHBondContact O-N 2.96Å; W75-I80 HydrophobicContact CE3-CG1 4.38Å; W75-K83 HydrophobicContact CZ3-CD 4.27Å
76	S	33.3	Very low	31	Very low	74 Å²	74	121.3 Å²	121.3	52%	0.517	64%	0.642	S	S	.	*			trans	-62.3	149.3	174.3	60.2	0	0	0	0	110.9	Q78 S79	S76-Q78 PolarHBondContact O-N 3.19Å; S76-Q78 VanDerWaalsContact O-N 3.09Å; S76-S79 WeakPolarHBondContact O-CA 3.06Å; S76-S79 WeakPolarHBondContact O-CB 3.42Å; S76-S79 PolarHBondContact O-N 3.44Å; S76-S79 PolarHBondContact O-OG 2.85Å
77	Y	32.8	Very low	31.5	Very low	163 Å²	163	124.2 Å²	124.2	64%	0.639	64%	0.641	S	S	*	*	H	α-helix	trans	-52.6	-30.1	177.2	-164.5	-101.8	0	0	0	112.6	L81	Y77-L81 HydrophobicContact CD1-CD1 3.84Å; Y77-L81 HydrophobicContact CE1-CD1 3.76Å; Y77-L81 PolarHBondContact O-N 3.27Å
78	Q	34.1	Very low	31.9	Very low	141 Å²	141	123.8 Å²	123.8	66%	0.659	64%	0.64	S	S	*	*	H	α-helix	trans	-65	-32.6	171.2	-113.8	92.5	-0.3	0	0	114.1	S76 N82	S76-Q78 PolarHBondContact O-N 3.19Å; S76-Q78 VanDerWaalsContact O-N 3.09Å; Q78-N82 PolarHBondContact O-N 3.49Å
79	S	36.7	Very low	32.5	Very low	36 Å²	36	125.4 Å²	125.4	25%	0.252	64%	0.637	S	S	.	*	H	α-helix	trans	-74.5	-26.3	-179.3	77.1	0	0	0	0	113.1	S76 K83	S76-S79 WeakPolarHBondContact O-CA 3.06Å; S76-S79 WeakPolarHBondContact O-CB 3.42Å; S76-S79 PolarHBondContact O-N 3.44Å; S76-S79 PolarHBondContact O-OG 2.85Å; S79-K83 PolarHBondContact O-N 3.14Å
80	I	37.6	Very low	33	Very low	76 Å²	76	125.4 Å²	125.4	39%	0.39	64%	0.638	S	S	.	*	H	α-helix	trans	-80.7	-40.5	178.3	-63.8	171.8	0	0	0	110	W75 N82 K83 I84	W75-I80 HydrophobicContact CE3-CG1 4.38Å; I80-N82 VanDerWaalsContact C-N 3.35Å; I80-N82 PolarHBondContact O-N 3.36Å; I80-K83 PolarHBondContact O-N 3.14Å; I80-I84 HydrophobicContact CG2-CD1 3.77Å; I80-I84 VanDerWaalsContact O-CG1 3.31Å; I80-I84 WeakPolarHBondContact O-CG1 3.26Å; I80-I84 PolarHBondContact O-N 3.27Å; I80-I84 VanDerWaalsContact O-N 3.09Å
81	L	37.4	Very low	33.4	Very low	81 Å²	81	125 Å²	125	42%	0.424	63%	0.631	S	S	.	*	H	α-helix	trans	-62.8	-36.5	173.2	-91.2	152.3	0	0	0	113.2	Y77 K83 I84 N85	Y77-L81 HydrophobicContact CD1-CD1 3.84Å; Y77-L81 HydrophobicContact CE1-CD1 3.76Å; Y77-L81 PolarHBondContact O-N 3.27Å; L81-K83 VanDerWaalsContact C-N 3.34Å; L81-K83 PolarHBondContact O-N 3.44Å; L81-I84 PolarHBondContact O-N 3.3Å; L81-N85 PolarHBondContact O-N 3.29Å
82	N	37.8	Very low	33.8	Very low	108 Å²	108	123.7 Å²	123.7	58%	0.578	62%	0.618	S	S	*	*	H	α-helix	trans	-74.9	-19.8	176.3	-76.2	-12.7	0	0	0	113.9	Q78 I80	Q78-N82 PolarHBondContact O-N 3.49Å; I80-N82 VanDerWaalsContact C-N 3.35Å; I80-N82 PolarHBondContact O-N 3.36Å
83	K	36.1	Very low	34.2	Very low	124 Å²	124	127.6 Å²	127.6	54%	0.539	63%	0.627	S	S	.	*	H	α-helix	trans	-87.4	-24.1	173.5	-80.7	-179.9	178.1	178	0	113.4	W75 S79 I80 L81	W75-K83 HydrophobicContact CZ3-CD 4.27Å; S79-K83 PolarHBondContact O-N 3.14Å; I80-K83 PolarHBondContact O-N 3.14Å; L81-K83 VanDerWaalsContact C-N 3.34Å; L81-K83 PolarHBondContact O-N 3.44Å
84	I	41.1	Very low	34.4	Very low	113 Å²	113	128.9 Å²	128.9	58%	0.579	62%	0.624	S	S	*	*	H	α-helix	trans	-81.5	-27.8	177.8	-68.5	167.7	0	0	0	111.9	I80 L81	I80-I84 HydrophobicContact CG2-CD1 3.77Å; I80-I84 VanDerWaalsContact O-CG1 3.31Å; I80-I84 WeakPolarHBondContact O-CG1 3.26Å; I80-I84 PolarHBondContact O-N 3.27Å; I80-I84 VanDerWaalsContact O-N 3.09Å; L81-I84 PolarHBondContact O-N 3.3Å
85	N	37.7	Very low	34.7	Very low	123 Å²	123	124.6 Å²	124.6	66%	0.658	61%	0.607	S	S	*	*	S	Bend	trans	-84.5	-9.2	178.5	-74.6	-19.2	0	0	0	114.6	L81	L81-N85 PolarHBondContact O-N 3.29Å
86	N	34.7	Very low	34.8	Very low	113 Å²	113	123.4 Å²	123.4	60%	0.604	61%	0.611	S	S	*	*	S	Bend	trans	-128	81.4	-178.8	-77.3	-29	0	0	0	109.4
87	H	33.7	Very low	34.7	Very low	186 Å²	186	128.3 Å²	128.3	86%	0.861	62%	0.623	S	S	*	*	S	Bend	trans	171.2	141.6	139.7	-91.3	-59.3	0	0	0	111.8
88	N	33.4	Very low	34.7	Very low	142 Å²	142	125 Å²	125	76%	0.759	62%	0.624	S	S	*	*			trans	-53.7	146.1	-169.3	-72.8	-33	0	0	0	115.2	N90	N88-N90 PolarHBondContact O-N 2.89Å
89	H	35.3	Very low	34.8	Very low	131 Å²	131	125.6 Å²	125.6	61%	0.606	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-29.3	-1.3	-179.2	-88.5	-81.7	0	0	0	122.5	R92	H89-R92 PolarHBondContact CE1-NH1 2.94Å
90	N	35	Very low	34.5	Very low	156 Å²	156	130.5 Å²	130.5	83%	0.834	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	6.8	-174.9	-71.4	-5	0	0	0	115.3	N88	N88-N90 PolarHBondContact O-N 2.89Å
91	H	34.4	Very low	34.4	Very low	143 Å²	143	133 Å²	133	66%	0.662	66%	0.656	S	S	*	*	S	Bend	trans	-121	14.9	173.8	-83.9	-68.2	0	0	0	114.5	E93 E94	H91-E93 VanDerWaalsContact C-N 3.29Å; H91-E93 PolarHBondContact O-N 3.28Å; H91-E94 IonicContact ND1-OE2 3.75Å
92	R	31.6	Very low	34.3	Very low	163 Å²	163	136.5 Å²	136.5	62%	0.615	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-18.7	-176.6	-86.3	-177.2	173	176.5	-0.2	115	H89	H89-R92 PolarHBondContact CE1-NH1 2.94Å
93	E	32.6	Very low	34.3	Very low	176 Å²	176	133.2 Å²	133.2	82%	0.822	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-17.4	-177.8	-74.1	-175.1	157.4	0	0	114.8	H91	H91-E93 VanDerWaalsContact C-N 3.29Å; H91-E93 PolarHBondContact O-N 3.28Å
94	E	31.5	Very low	34.1	Very low	146 Å²	146	131 Å²	131	68%	0.682	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-23.8	178.8	-78.3	-177.8	146.2	0	0	113.3	H91	H91-E94 IonicContact ND1-OE2 3.75Å
95	S	32.8	Very low	34	Very low	68 Å²	68	127.1 Å²	127.1	48%	0.476	63%	0.627	S	S	.	*	S	Bend	trans	-82.8	-9.9	-179.2	52.2	0	0	0	0	115.1	S98	S95-S98 PolarHBondContact O-OG 3.45Å
96	L	31.8	Very low	33.9	Very low	128 Å²	128	125.4 Å²	125.4	67%	0.67	62%	0.622	S	S	*	*	S	Bend	trans	-98.8	-12.4	178.5	-81.9	159.1	0	0	0	113.8	S98	L96-S98 PolarHBondContact O-N 3.2Å
97	K	31.7	Very low	34.1	Very low	178 Å²	178	121.7 Å²	121.7	77%	0.774	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-4.4	173.7	-78.4	179.6	178.2	170.8	0	114
98	S	32.7	Very low	34.4	Very low	94 Å²	94	116.9 Å²	116.9	66%	0.657	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	13.6	-175.3	64.9	0	0	0	0	115.3	S95 L96	S95-S98 PolarHBondContact O-OG 3.45Å; L96-S98 PolarHBondContact O-N 3.2Å
99	F	34.7	Very low	34.6	Very low	152 Å²	152	115.8 Å²	115.8	67%	0.667	57%	0.572	S	S	*	*			trans	-99.7	32	178.6	-108.7	-84.4	0	0	0	114.6	K101	F99-K101 PolarHBondContact O-N 3.03Å
100	N	30.5	Very low	34.8	Very low	140 Å²	140	118.6 Å²	118.6	75%	0.749	59%	0.585	S	S	*	*			trans	-84.1	82.4	163.2	-84.3	-17.5	0	0	0	109.7	Q102	N100-Q102 PolarHBondContact O-N 3.5Å
101	K	35.5	Very low	34.9	Very low	128 Å²	128	119.9 Å²	119.9	56%	0.557	59%	0.586	S	S	*	*			trans	-79.9	105.8	165.2	-100.2	-178.1	175.3	179.6	0	108.6	F99 I103 L125	F99-K101 PolarHBondContact O-N 3.03Å; K101-I103 HydrophobicContact CB-CG1 4.2Å; K101-I103 PolarHBondContact O-N 2.97Å; K101-L125 HydrophobicContact CD-CD2 4.49Å
102	Q	35.3	Very low	35.3	Very low	154 Å²	154	115.9 Å²	115.9	72%	0.72	57%	0.567	S	S	*	*			trans	-69	108.1	157.5	-90.2	-178.5	-19.9	0	0	107.6	N100	N100-Q102 PolarHBondContact O-N 3.5Å
103	I	37.8	Very low	36	Very low	40 Å²	40	112.2 Å²	112.2	21%	0.205	56%	0.559	C	S	.	*			trans	-100.8	103	169.2	-54.8	178.9	0	0	0	106.8	K101 Y105 L121 L125	K101-I103 HydrophobicContact CB-CG1 4.2Å; K101-I103 PolarHBondContact O-N 2.97Å; I103-Y105 HydrophobicContact CB-CE2 4.05Å; I103-Y105 HydrophobicContact CG2-CD2 3.84Å; I103-Y105 HydrophobicContact CG2-CE1 4.38Å; I103-Y105 HydrophobicContact CG2-CE2 3.24Å; I103-Y105 PolarHBondContact O-N 3.44Å; I103-L121 HydrophobicContact CD1-CD2 4.27Å; I103-L125 HydrophobicContact CD1-CD2 3.55Å; I103-L125 HydrophobicContact CD1-CG 4Å
104	T	33.4	Very low	36.6	Very low	76 Å²	76	104.8 Å²	104.8	47%	0.466	53%	0.525	S	S	.	.			trans	-83.3	111.9	175.4	-40.4	0	0	0	0	108.6	Q298	T104-Q298 HydrophobicContact CG2-CB 4.43Å; T104-Q298 HydrophobicContact CG2-CG 4.22Å
105	Y	38.7	Very low	37.2	Very low	32 Å²	32	101.3 Å²	101.3	13%	0.125	52%	0.515	C	S	.	.			trans	-94	120.9	168.3	-72.3	-82.5	0	0	0	109.3	I103 L107 L117 L121 D124	I103-Y105 HydrophobicContact CB-CE2 4.05Å; I103-Y105 HydrophobicContact CG2-CD2 3.84Å; I103-Y105 HydrophobicContact CG2-CE1 4.38Å; I103-Y105 HydrophobicContact CG2-CE2 3.24Å; I103-Y105 PolarHBondContact O-N 3.44Å; Y105-L107 PolarHBondContact O-N 3.24Å; Y105-L117 HydrophobicContact CD1-CD1 3.62Å; Y105-L117 HydrophobicContact CD2-CD1 4.2Å; Y105-L117 HydrophobicContact CE1-CD1 3.93Å; Y105-L117 HydrophobicContact CE2-CD1 4.45Å; Y105-L117 HydrophobicContact CG-CD1 3.79Å; Y105-L121 HydrophobicContact CE2-CD1 4.2Å; Y105-L121 HydrophobicContact CE2-CD2 3.56Å; Y105-L121 HydrophobicContact CE2-CG 3.7Å; Y105-L121 WeakPolarHBondContact OH-CD2 3.48Å; Y105-L121 WeakPolarHBondContact OH-CG 3.48Å; Y105-D124 PolarHBondContact OH-OD2 3.48Å
106	T	35	Very low	38	Very low	88 Å²	88	102.7 Å²	102.7	54%	0.54	51%	0.513	S	S	.	.	B	Isolated β-bridge	trans	-83.8	103.3	166.4	-16.5	0	0	0	0	107.7	M300	T106-M300 HydrophobicContact CG2-CE 4.45Å; T106-M300 HydrophobicContact CG2-CG 4.44Å; T106-M300 HydrophobicContact CG2-SD 3.26Å; T106-M300 WeakPolarHBondContact CG2-SD 3.28Å
107	L	39	Very low	38.9	Very low	35 Å²	35	97.3 Å²	97.3	18%	0.183	49%	0.485	C	S	.	.			trans	-88.8	117.1	176.3	-71.7	164.5	0	0	0	108.4	Y105 F112 L117 I297 L299	Y105-L107 PolarHBondContact O-N 3.24Å; L107-F112 HydrophobicContact CD1-CD2 4.44Å; L107-F112 HydrophobicContact CD1-CE2 3.79Å; L107-F112 HydrophobicContact CD2-CD2 4.17Å; L107-F112 HydrophobicContact CD2-CE2 4.02Å; L107-L117 HydrophobicContact CD2-CD1 4.42Å; L107-I297 HydrophobicContact CD1-CG2 4.06Å; L107-L299 HydrophobicContact CD1-CD2 3.83Å
108	I	39.6	Very low	39.7	Very low	84 Å²	84	91.3 Å²	91.3	43%	0.431	46%	0.46	S	S	.	.			trans	-115.8	105.8	177	-55.7	141.8	0	0	0	104.3	I302 I432	I108-I302 HydrophobicContact CG2-CD1 4.17Å; I108-I432 HydrophobicContact CB-CD1 4.36Å; I108-I432 HydrophobicContact CD1-CD1 3.1Å; I108-I432 HydrophobicContact CG1-CD1 3.57Å; I108-I432 HydrophobicContact CG2-CB 4.48Å; I108-I432 HydrophobicContact CG2-CD1 3.97Å; I108-I432 HydrophobicContact CG2-CG2 4.45Å
109	E	37.4	Very low	40.7	Very low	120 Å²	120	88.1 Å²	88.1	56%	0.561	44%	0.442	S	S	*	.			trans	-65.7	143.2	-172.8	-61.1	-161.8	147.5	0	0	111.6	I302	E109-I302 HydrophobicContact CB-CD1 4.41Å
110	E	39.4	Very low	41.6	Very low	190 Å²	190	83 Å²	83	89%	0.888	42%	0.422	S	S	*	.	S	Bend		-137.8	-5.5	95.2	-76.6	175.1	162.4	0	0	114.3
111	E	37.9	Very low	42.6	Very low	182 Å²	182	77 Å²	77	85%	0.85	39%	0.389	S	S	*	.			trans	-136.1	80.4	175.7	-78.3	-170.6	159	0	0	111.5	N113	E111-N113 PolarHBondContact O-N 3.33Å
112	F	42.1	Very low	43.3	Very low	59 Å²	59	73.4 Å²	73.4	26%	0.259	38%	0.376	S	S	.	.			trans	-65.8	110.5	172	-172	-112.4	0	0	0	110.7	L107 L114 K209	L107-F112 HydrophobicContact CD1-CD2 4.44Å; L107-F112 HydrophobicContact CD1-CE2 3.79Å; L107-F112 HydrophobicContact CD2-CD2 4.17Å; L107-F112 HydrophobicContact CD2-CE2 4.02Å; F112-L114 HydrophobicContact CD1-CB 4.25Å; F112-L114 HydrophobicContact CE1-CB 3.54Å; F112-L114 HydrophobicContact CE1-CD1 4.03Å; F112-L114 HydrophobicContact CE1-CG 4.22Å; F112-L114 HydrophobicContact CE2-CD1 4.36Å; F112-L114 HydrophobicContact CZ-CB 3.81Å; F112-L114 HydrophobicContact CZ-CD1 3.48Å; F112-L114 VanDerWaalsContact CZ-CD1 3.48Å; F112-L114 HydrophobicContact CZ-CG 4.15Å; F112-K209 PolarHBondContact O-NZ 3.18Å
113	N	47.8	Very low	44.2	Very low	87 Å²	87	70.4 Å²	70.4	47%	0.465	37%	0.365	S	S	.	.			trans	-115.4	83.3	171.2	-171.9	-18.4	0	0	0	108.4	E111 P115 K116 L117	E111-N113 PolarHBondContact O-N 3.33Å; N113-P115 VanDerWaalsContact C-CD 3.48Å; N113-P115 VanDerWaalsContact C-N 3.3Å; N113-P115 WeakPolarHBondContact OD1-CB 2.92Å; N113-P115 WeakPolarHBondContact OD1-CD 3.26Å; N113-P115 WeakPolarHBondContact OD1-CG 3.15Å; N113-K116 HydrophobicContact CB-CB 3.91Å; N113-K116 WeakPolarHBondContact O-CA 3.48Å; N113-K116 VanDerWaalsContact O-CB 3.24Å; N113-K116 WeakPolarHBondContact O-CB 3.49Å; N113-K116 PolarHBondContact O-N 3.42Å; N113-K116 PolarHBondContact OD1-N 3.36Å; N113-L117 PolarHBondContact O-N 3.43Å
114	L	43.2	Very low	44.8	Very low	20 Å²	20	73.2 Å²	73.2	11%	0.105	38%	0.38	C	S	.	.	H	α-helix	trans	-53.2	-39.7	177.7	-171.9	69.1	0	0	0	113.2	F112 K116 L117 I118 F201 L205	F112-L114 HydrophobicContact CD1-CB 4.25Å; F112-L114 HydrophobicContact CE1-CB 3.54Å; F112-L114 HydrophobicContact CE1-CD1 4.03Å; F112-L114 HydrophobicContact CE1-CG 4.22Å; F112-L114 HydrophobicContact CE2-CD1 4.36Å; F112-L114 HydrophobicContact CZ-CB 3.81Å; F112-L114 HydrophobicContact CZ-CD1 3.48Å; F112-L114 VanDerWaalsContact CZ-CD1 3.48Å; F112-L114 HydrophobicContact CZ-CG 4.15Å; L114-K116 PolarHBondContact O-N 3.1Å; L114-L117 HydrophobicContact CD1-CB 4.34Å; L114-L117 HydrophobicContact CD1-CD2 3.77Å; L114-L117 WeakPolarHBondContact O-CB 3.49Å; L114-L117 PolarHBondContact O-N 3.24Å; L114-I118 HydrophobicContact CD1-CG1 4.44Å; L114-I118 HydrophobicContact CD2-CD1 4.27Å; L114-I118 HydrophobicContact CG-CD1 3.92Å; L114-I118 HydrophobicContact CG-CG1 4.25Å; L114-I118 WeakPolarHBondContact O-CG1 3.44Å; L114-I118 PolarHBondContact O-N 3.21Å; L114-F201 HydrophobicContact CD2-CE1 4.04Å; L114-F201 HydrophobicContact CD2-CZ 4.48Å; L114-L205 HydrophobicContact CB-CD1 4.48Å; L114-L205 HydrophobicContact CB-CD2 4.3Å; L114-L205 HydrophobicContact CD2-CD1 4.04Å; L114-L205 HydrophobicContact CD2-CD2 3.37Å; L114-L205 HydrophobicContact CD2-CG 4.31Å; L114-L205 HydrophobicContact CG-CD2 4.46Å
115	P	44.8	Very low	45.7	Very low	73 Å²	73	71.1 Å²	71.1	47%	0.474	37%	0.366	S	S	.	.	H	α-helix	trans	-54.2	-35.9	170.8	-27.6	32	0	0	0	113.9	N113 G119	N113-P115 VanDerWaalsContact C-CD 3.48Å; N113-P115 VanDerWaalsContact C-N 3.3Å; N113-P115 WeakPolarHBondContact OD1-CB 2.92Å; N113-P115 WeakPolarHBondContact OD1-CD 3.26Å; N113-P115 WeakPolarHBondContact OD1-CG 3.15Å; P115-G119 PolarHBondContact O-N 2.94Å
116	K	50.1	Low	46.2	Very low	97 Å²	97	74.7 Å²	74.7	42%	0.422	38%	0.384	S	S	.	.	H	α-helix	trans	-73.9	-36.9	175.1	-167.2	-179.4	-179.2	-175	0	112.3	N113 L114 G119 N120	N113-K116 HydrophobicContact CB-CB 3.91Å; N113-K116 WeakPolarHBondContact O-CA 3.48Å; N113-K116 VanDerWaalsContact O-CB 3.24Å; N113-K116 WeakPolarHBondContact O-CB 3.49Å; N113-K116 PolarHBondContact O-N 3.42Å; N113-K116 PolarHBondContact OD1-N 3.36Å; L114-K116 PolarHBondContact O-N 3.1Å; K116-G119 PolarHBondContact O-N 3.02Å; K116-N120 WeakPolarHBondContact O-CB 3.48Å; K116-N120 PolarHBondContact O-N 3.17Å; K116-N120 PolarHBondContact O-ND2 3.16Å; K116-N120 PolarHBondContact O-OD1 2.82Å
117	L	50	Low	47	Very low	15 Å²	15	72 Å²	72	8%	0.079	37%	0.366	C	S	.	.	H	α-helix	trans	-62.7	-45.3	171.9	-176	74.4	0	0	0	110.9	Y105 L107 N113 L114 N120 L121 I297	Y105-L117 HydrophobicContact CD1-CD1 3.62Å; Y105-L117 HydrophobicContact CD2-CD1 4.2Å; Y105-L117 HydrophobicContact CE1-CD1 3.93Å; Y105-L117 HydrophobicContact CE2-CD1 4.45Å; Y105-L117 HydrophobicContact CG-CD1 3.79Å; L107-L117 HydrophobicContact CD2-CD1 4.42Å; N113-L117 PolarHBondContact O-N 3.43Å; L114-L117 HydrophobicContact CD1-CB 4.34Å; L114-L117 HydrophobicContact CD1-CD2 3.77Å; L114-L117 WeakPolarHBondContact O-CB 3.49Å; L114-L117 PolarHBondContact O-N 3.24Å; L117-N120 PolarHBondContact O-N 3.05Å; L117-L121 HydrophobicContact CG-CD1 4.19Å; L117-L121 VanDerWaalsContact O-CB 3.31Å; L117-L121 WeakPolarHBondContact O-CB 3.47Å; L117-L121 WeakPolarHBondContact O-CG 3.34Å; L117-L121 PolarHBondContact O-N 2.71Å; L117-I297 HydrophobicContact CD2-CD1 4.5Å
118	I	49.4	Very low	47.2	Very low	52 Å²	52	74.1 Å²	74.1	27%	0.267	38%	0.377	S	S	.	.	H	α-helix	trans	-64.5	-42.6	176.2	-66.4	171.5	0	0	0	110.3	L114 L121 I122	L114-I118 HydrophobicContact CD1-CG1 4.44Å; L114-I118 HydrophobicContact CD2-CD1 4.27Å; L114-I118 HydrophobicContact CG-CD1 3.92Å; L114-I118 HydrophobicContact CG-CG1 4.25Å; L114-I118 WeakPolarHBondContact O-CG1 3.44Å; L114-I118 PolarHBondContact O-N 3.21Å; I118-L121 WeakPolarHBondContact O-CB 3.47Å; I118-L121 PolarHBondContact O-N 3.2Å; I118-I122 HydrophobicContact CG2-CD1 3.96Å; I118-I122 VanDerWaalsContact O-CG1 3.26Å; I118-I122 WeakPolarHBondContact O-CG1 3.24Å; I118-I122 PolarHBondContact O-N 3.43Å
119	G	52.6	Low	47.4	Very low	26 Å²	26	74 Å²	74	27%	0.268	38%	0.378	S	S	.	.	H	α-helix	trans	-59.1	-48.8	173.5	0	0	0	0	0	112.3	P115 K116 L121 I122 D123	P115-G119 PolarHBondContact O-N 2.94Å; K116-G119 PolarHBondContact O-N 3.02Å; G119-L121 VanDerWaalsContact C-N 3.32Å; G119-L121 PolarHBondContact O-N 3.43Å; G119-I122 WeakPolarHBondContact O-CB 3.31Å; G119-I122 PolarHBondContact O-N 3.12Å; G119-D123 PolarHBondContact O-N 3.42Å
120	N	53.6	Low	47.8	Very low	45 Å²	45	75.2 Å²	75.2	24%	0.241	38%	0.378	C	S	.	.	H	α-helix	trans	-62.2	-37.9	174.8	-67.2	-9.4	0	0	0	111.9	Y61 K116 L117 D123 D124	Y61-N120 PolarHBondContact OH-ND2 3.09Å; K116-N120 WeakPolarHBondContact O-CB 3.48Å; K116-N120 PolarHBondContact O-N 3.17Å; K116-N120 PolarHBondContact O-ND2 3.16Å; K116-N120 PolarHBondContact O-OD1 2.82Å; L117-N120 PolarHBondContact O-N 3.05Å; N120-D123 PolarHBondContact O-N 3.17Å; N120-D124 WeakPolarHBondContact O-CB 3.2Å; N120-D124 PolarHBondContact O-N 3.47Å
121	L	51.7	Low	47.9	Very low	13 Å²	13	69.5 Å²	69.5	7%	0.068	35%	0.353	C	S	.	.	H	α-helix	trans	-61.9	-44.3	174.7	-95.1	159	0	0	0	111.2	I103 Y105 L117 I118 G119 D123 L125 I295	I103-L121 HydrophobicContact CD1-CD2 4.27Å; Y105-L121 HydrophobicContact CE2-CD1 4.2Å; Y105-L121 HydrophobicContact CE2-CD2 3.56Å; Y105-L121 HydrophobicContact CE2-CG 3.7Å; Y105-L121 WeakPolarHBondContact OH-CD2 3.48Å; Y105-L121 WeakPolarHBondContact OH-CG 3.48Å; L117-L121 HydrophobicContact CG-CD1 4.19Å; L117-L121 VanDerWaalsContact O-CB 3.31Å; L117-L121 WeakPolarHBondContact O-CB 3.47Å; L117-L121 WeakPolarHBondContact O-CG 3.34Å; L117-L121 PolarHBondContact O-N 2.71Å; I118-L121 WeakPolarHBondContact O-CB 3.47Å; I118-L121 PolarHBondContact O-N 3.2Å; G119-L121 VanDerWaalsContact C-N 3.32Å; G119-L121 PolarHBondContact O-N 3.43Å; L121-D123 VanDerWaalsContact C-N 3.31Å; L121-D123 PolarHBondContact O-N 3.24Å; L121-L125 HydrophobicContact CD2-CD1 4.11Å; L121-L125 WeakPolarHBondContact O-CB 3.1Å; L121-L125 WeakPolarHBondContact O-CD1 3.32Å; L121-L125 WeakPolarHBondContact O-CG 2.94Å; L121-L125 PolarHBondContact O-N 3.47Å; L121-I295 HydrophobicContact CD1-CD1 3.79Å; L121-I295 HydrophobicContact CD2-CD1 3.7Å; L121-I295 HydrophobicContact CG-CD1 4.37Å
122	I	51.6	Low	48	Very low	54 Å²	54	65.6 Å²	65.6	28%	0.277	34%	0.338	S	S	.	.	H	α-helix	trans	-61.5	-41.9	175.6	-69	165.3	0	0	0	110.4	I118 G119 L127 N128	I118-I122 HydrophobicContact CG2-CD1 3.96Å; I118-I122 VanDerWaalsContact O-CG1 3.26Å; I118-I122 WeakPolarHBondContact O-CG1 3.24Å; I118-I122 PolarHBondContact O-N 3.43Å; G119-I122 WeakPolarHBondContact O-CB 3.31Å; G119-I122 PolarHBondContact O-N 3.12Å; I122-L127 HydrophobicContact CG2-CB 4.17Å; I122-L127 WeakPolarHBondContact O-CB 3.18Å; I122-L127 PolarHBondContact O-N 3.48Å; I122-N128 WeakPolarHBondContact CG2-OD1 3.43Å
123	D	53.5	Low	47.9	Very low	91 Å²	91	67.2 Å²	67.2	49%	0.487	35%	0.349	S	S	.	.	H	α-helix	trans	-70.6	-47.9	178.4	-68.7	-24.9	0	0	0	112.6	G119 N120 L121 L125 Q126 N128	G119-D123 PolarHBondContact O-N 3.42Å; N120-D123 PolarHBondContact O-N 3.17Å; L121-D123 VanDerWaalsContact C-N 3.31Å; L121-D123 PolarHBondContact O-N 3.24Å; D123-L125 VanDerWaalsContact C-N 3.34Å; D123-L125 PolarHBondContact O-N 3.13Å; D123-Q126 WeakPolarHBondContact O-CA 3.32Å; D123-Q126 PolarHBondContact O-N 3.24Å; D123-N128 PolarHBondContact OD1-ND2 2.93Å
124	D	50.8	Low	47.5	Very low	99 Å²	99	68.8 Å²	68.8	53%	0.529	35%	0.349	S	S	.	.	H	α-helix	trans	-65.8	-34.6	-178	-78.9	-24.3	0	0	0	112.1	Y105 N120 Q126	Y105-D124 PolarHBondContact OH-OD2 3.48Å; N120-D124 WeakPolarHBondContact O-CB 3.2Å; N120-D124 PolarHBondContact O-N 3.47Å; D124-Q126 PolarHBondContact O-N 3.31Å
125	L	51.8	Low	47.4	Very low	32 Å²	32	74 Å²	74	17%	0.168	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-1.5	173.9	-70.5	166.2	0	0	0	112.4	K101 I103 L121 D123 L127 M293	K101-L125 HydrophobicContact CD-CD2 4.49Å; I103-L125 HydrophobicContact CD1-CD2 3.55Å; I103-L125 HydrophobicContact CD1-CG 4Å; L121-L125 HydrophobicContact CD2-CD1 4.11Å; L121-L125 WeakPolarHBondContact O-CB 3.1Å; L121-L125 WeakPolarHBondContact O-CD1 3.32Å; L121-L125 WeakPolarHBondContact O-CG 2.94Å; L121-L125 PolarHBondContact O-N 3.47Å; D123-L125 VanDerWaalsContact C-N 3.34Å; D123-L125 PolarHBondContact O-N 3.13Å; L125-L127 HydrophobicContact CB-CB 4.5Å; L125-L127 HydrophobicContact CB-CD1 3.72Å; L125-L127 HydrophobicContact CB-CG 3.73Å; L125-L127 HydrophobicContact CD1-CD1 3.63Å; L125-L127 HydrophobicContact CD1-CG 4.49Å; L125-L127 HydrophobicContact CG-CD1 4.32Å; L125-L127 PolarHBondContact O-N 3.17Å; L125-L127 VanDerWaalsContact O-N 3.08Å; L125-M293 HydrophobicContact CD1-CE 3.83Å; L125-M293 HydrophobicContact CD1-SD 3.64Å; L125-M293 HydrophobicContact CD2-CE 4.19Å; L125-M293 HydrophobicContact CD2-SD 4.5Å
126	Q	49.5	Very low	47	Very low	106 Å²	106	76.5 Å²	76.5	50%	0.495	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.1	31.9	-168.8	-62.5	-164.6	-12.4	0	0	112.2	D123 D124 N128 N129 Y130	D123-Q126 WeakPolarHBondContact O-CA 3.32Å; D123-Q126 PolarHBondContact O-N 3.24Å; D124-Q126 PolarHBondContact O-N 3.31Å; Q126-N128 PolarHBondContact O-N 2.94Å; Q126-N129 HydrophobicContact CB-CB 4.46Å; Q126-N129 PolarHBondContact O-N 2.93Å; Q126-Y130 PolarHBondContact O-N 3.47Å; Q126-Y130 VanDerWaalsContact O-N 3.13Å
127	L	50.5	Low	46.4	Very low	32 Å²	32	77.5 Å²	77.5	17%	0.168	40%	0.395	C	S	.	.	H	α-helix	trans	-61.2	-29.7	-179.5	-84.1	160.4	0	0	0	110.4	I122 L125 N129 Y130 L131 M283	I122-L127 HydrophobicContact CG2-CB 4.17Å; I122-L127 WeakPolarHBondContact O-CB 3.18Å; I122-L127 PolarHBondContact O-N 3.48Å; L125-L127 HydrophobicContact CB-CB 4.5Å; L125-L127 HydrophobicContact CB-CD1 3.72Å; L125-L127 HydrophobicContact CB-CG 3.73Å; L125-L127 HydrophobicContact CD1-CD1 3.63Å; L125-L127 HydrophobicContact CD1-CG 4.49Å; L125-L127 HydrophobicContact CG-CD1 4.32Å; L125-L127 PolarHBondContact O-N 3.17Å; L125-L127 VanDerWaalsContact O-N 3.08Å; L127-N129 VanDerWaalsContact C-N 3.35Å; L127-N129 PolarHBondContact O-N 3.49Å; L127-Y130 PolarHBondContact O-N 3.44Å; L127-L131 WeakPolarHBondContact O-CB 3.33Å; L127-L131 PolarHBondContact O-N 2.82Å; L127-M283 HydrophobicContact CD2-CE 4.34Å; L127-M283 HydrophobicContact CD2-SD 4.45Å
128	N	44.3	Very low	45.7	Very low	80 Å²	80	85.4 Å²	85.4	43%	0.428	43%	0.425	S	S	.	.	H	α-helix	trans	-56.8	-44.3	171	-73.9	-23.2	0	0	0	112.2	I122 D123 Q126 L132	I122-N128 WeakPolarHBondContact CG2-OD1 3.43Å; D123-N128 PolarHBondContact OD1-ND2 2.93Å; Q126-N128 PolarHBondContact O-N 2.94Å; N128-L132 WeakPolarHBondContact O-CB 3.46Å; N128-L132 PolarHBondContact O-N 3.09Å
129	N	43.8	Very low	44.8	Very low	81 Å²	81	88.6 Å²	88.6	43%	0.433	45%	0.452	S	S	.	.	H	α-helix	trans	-72.6	-31.5	177	-74.9	-19.3	0	0	0	112.4	Q126 L127 N133	Q126-N129 HydrophobicContact CB-CB 4.46Å; Q126-N129 PolarHBondContact O-N 2.93Å; L127-N129 VanDerWaalsContact C-N 3.35Å; L127-N129 PolarHBondContact O-N 3.49Å; N129-N133 VanDerWaalsContact O-CB 3.29Å; N129-N133 WeakPolarHBondContact O-CB 3.49Å; N129-N133 PolarHBondContact O-N 2.93Å
130	Y	44.3	Very low	44	Very low	145 Å²	145	92.1 Å²	92.1	57%	0.569	47%	0.47	S	S	*	.	H	α-helix	trans	-69.1	-42	176.3	-141.7	-86.9	0	0	0	111.3	Q126 L127 Y134	Q126-Y130 PolarHBondContact O-N 3.47Å; Q126-Y130 VanDerWaalsContact O-N 3.13Å; L127-Y130 PolarHBondContact O-N 3.44Å; Y130-Y134 WeakPolarHBondContact O-CB 3.17Å; Y130-Y134 PolarHBondContact O-N 3.36Å
131	L	41.8	Very low	42.8	Very low	71 Å²	71	97.6 Å²	97.6	37%	0.372	50%	0.499	S	S	.	.	H	α-helix	trans	-70.6	-42.6	174.6	-80.9	154.5	0	0	0	111.8	L127 Y134 I135	L127-L131 WeakPolarHBondContact O-CB 3.33Å; L127-L131 PolarHBondContact O-N 2.82Å; L131-Y134 PolarHBondContact O-N 3.19Å; L131-I135 WeakPolarHBondContact O-CB 3.43Å; L131-I135 WeakPolarHBondContact O-CD1 3.4Å; L131-I135 WeakPolarHBondContact O-CG1 3.25Å; L131-I135 PolarHBondContact O-N 3.37Å; L131-I135 VanDerWaalsContact O-N 3.09Å
132	L	39.9	Very low	41.8	Very low	99 Å²	99	104.3 Å²	104.3	52%	0.518	54%	0.541	S	S	.	.	H	α-helix	trans	-68.8	-41.9	-178.1	-155.3	82.5	0	0	0	112.4	N128 Y134 L136	N128-L132 WeakPolarHBondContact O-CB 3.46Å; N128-L132 PolarHBondContact O-N 3.09Å; L132-Y134 VanDerWaalsContact C-N 3.33Å; L132-Y134 PolarHBondContact O-N 2.9Å; L132-L136 HydrophobicContact CG-CD1 4.22Å; L132-L136 WeakPolarHBondContact O-CB 3.45Å; L132-L136 WeakPolarHBondContact O-CD1 3.38Å; L132-L136 VanDerWaalsContact O-CG 3.27Å; L132-L136 WeakPolarHBondContact O-CG 3.31Å; L132-L136 PolarHBondContact O-N 2.96Å; L132-L136 VanDerWaalsContact O-N 3.13Å
133	N	40.7	Very low	40.5	Very low	94 Å²	94	109.8 Å²	109.8	50%	0.503	57%	0.57	S	S	.	*	H	α-helix	trans	-73.3	-22.4	176.9	-81.5	-26.8	0	0	0	113.4	N129 N137	N129-N133 VanDerWaalsContact O-CB 3.29Å; N129-N133 WeakPolarHBondContact O-CB 3.49Å; N129-N133 PolarHBondContact O-N 2.93Å; N133-N137 WeakPolarHBondContact O-CB 3.29Å; N133-N137 PolarHBondContact O-ND2 3.19Å
134	Y	40	Very low	39.2	Very low	120 Å²	120	110.3 Å²	110.3	47%	0.471	58%	0.581	S	S	.	*	H	α-helix	trans	-80.7	-37.8	176.4	-147.7	-90.5	0	0	0	111.4	Y130 L131 L132 L136 N137 L286	Y130-Y134 WeakPolarHBondContact O-CB 3.17Å; Y130-Y134 PolarHBondContact O-N 3.36Å; L131-Y134 PolarHBondContact O-N 3.19Å; L132-Y134 VanDerWaalsContact C-N 3.33Å; L132-Y134 PolarHBondContact O-N 2.9Å; Y134-L136 VanDerWaalsContact C-N 3.34Å; Y134-N137 PolarHBondContact O-N 3.37Å; Y134-L286 HydrophobicContact CE1-CD1 4.01Å
135	I	40.4	Very low	38.1	Very low	129 Å²	129	112.9 Å²	112.9	66%	0.662	59%	0.593	S	S	*	*	H	α-helix	trans	-66.9	-34.2	174.4	-67.7	166.4	0	0	0	111.4	L131	L131-I135 WeakPolarHBondContact O-CB 3.43Å; L131-I135 WeakPolarHBondContact O-CD1 3.4Å; L131-I135 WeakPolarHBondContact O-CG1 3.25Å; L131-I135 PolarHBondContact O-N 3.37Å; L131-I135 VanDerWaalsContact O-N 3.09Å
136	L	37.2	Very low	36.9	Very low	126 Å²	126	122.9 Å²	122.9	66%	0.66	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-14.8	-179.2	-72.7	167.8	0	0	0	114.6	L132 Y134	L132-L136 HydrophobicContact CG-CD1 4.22Å; L132-L136 WeakPolarHBondContact O-CB 3.45Å; L132-L136 WeakPolarHBondContact O-CD1 3.38Å; L132-L136 VanDerWaalsContact O-CG 3.27Å; L132-L136 WeakPolarHBondContact O-CG 3.31Å; L132-L136 PolarHBondContact O-N 2.96Å; L132-L136 VanDerWaalsContact O-N 3.13Å; Y134-L136 VanDerWaalsContact C-N 3.34Å
137	N	37.2	Very low	35.7	Very low	118 Å²	118	124.9 Å²	124.9	63%	0.631	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.6	-2.1	-172.2	-74.1	-38.3	0	0	0	115.6	N133 Y134	N133-N137 WeakPolarHBondContact O-CB 3.29Å; N133-N137 PolarHBondContact O-ND2 3.19Å; Y134-N137 PolarHBondContact O-N 3.37Å
138	Y	35.2	Very low	34.7	Very low	181 Å²	181	129.8 Å²	129.8	71%	0.71	67%	0.67	S	S	*	*			trans	-139	109.7	-177.9	-87.7	-89.2	0	0	0	113.4
139	S	31	Very low	34	Very low	119 Å²	119	132.7 Å²	132.7	83%	0.832	68%	0.68	S	S	*	*			trans	-143.3	155.7	164.3	93.2	0	0	0	0	109
140	P	35.4	Very low	33.2	Very low	99 Å²	99	134.8 Å²	134.8	64%	0.643	69%	0.691	S	S	*	*				-112.7	158.5	-110.2	38.1	-30.7	0	0	0	114.3
141	N	29.3	Very low	32.3	Very low	161 Å²	161	134.5 Å²	134.5	86%	0.861	70%	0.7	S	S	*	*			trans	-167.1	102.2	156.3	-94.3	-26.9	0	0	0	111.4
142	T	28.9	Very low	31.6	Very low	154 Å²	154	139.1 Å²	139.1	95%	0.945	72%	0.719	S	S	*	*			trans	177.1	125.8	130.4	37.2	0	0	0	0	111.6
143	L	25.6	Very low	30.8	Very low	168 Å²	168	139.5 Å²	139.5	88%	0.88	73%	0.731	S	S	*	*			trans	-87.7	142.2	177.3	-153.3	84.5	0	0	0	109.7
144	S	26.6	Very low	30	Very low	103 Å²	103	144.8 Å²	144.8	72%	0.72	75%	0.749	S	S	*	*				159.5	141.1	123.2	62.2	0	0	0	0	115.1
145	L	26.8	Very low	29.3	Very low	152 Å²	152	147.7 Å²	147.7	80%	0.796	77%	0.767	S	S	*	*			trans	96.8	110	155.1	-64.3	158.1	0	0	0	120.4
146	W	26	Very low	28.5	Very low	243 Å²	243	147.3 Å²	147.3	92%	0.92	77%	0.766	S	S	*	*			trans	106.7	85.8	144.4	-80.1	22.5	0	0	0	120.2
147	N	25.5	Very low	27.8	Very low	147 Å²	147	147.3 Å²	147.3	79%	0.786	77%	0.765	S	S	*	*			trans	-65.5	137.4	143.9	-72.3	-31.9	0	0	0	110.6
148	N	28.6	Very low	27.3	Very low	135 Å²	135	145 Å²	145	72%	0.722	76%	0.759	S	S	*	*				172.4	143.1	106.1	-101.2	-15.1	0	0	0	114.5
149	H	30.2	Very low	26.9	Very low	142 Å²	142	142 Å²	142	66%	0.657	75%	0.754	S	S	*	*			trans	86.6	98.6	152.4	-67.2	-50	0	0	0	121.2
150	N	27	Very low	26.9	Very low	124 Å²	124	139.8 Å²	139.8	66%	0.663	73%	0.732	S	S	*	*				54.2	105	111.4	-63.7	-5.1	0	0	0	117.4
151	N	26.1	Very low	26.8	Very low	139 Å²	139	141.4 Å²	141.4	74%	0.743	74%	0.735	S	S	*	*				168.1	140.6	88	-98.6	-25.1	0	0	0	112.7
152	Q	25.6	Very low	26.8	Very low	168 Å²	168	139.5 Å²	139.5	79%	0.785	72%	0.724	S	S	*	*			trans	73.9	80.9	148.2	-66.4	-179.5	-9.8	0	0	119.6
153	S	23.8	Very low	26.9	Very low	108 Å²	108	136.3 Å²	136.3	76%	0.755	71%	0.713	S	S	*	*				48.7	99.2	116.1	63.4	0	0	0	0	119.2
154	K	22.9	Very low	26.9	Very low	205 Å²	205	135.2 Å²	135.2	89%	0.891	71%	0.708	S	S	*	*				-156.9	128.1	124	-104.5	171.1	-174.5	179.9	0	108.6	L156	K154-L156 PolarHBondContact O-N 3.49Å
155	Q	25	Very low	27.1	Very low	180 Å²	180	138.9 Å²	138.9	84%	0.841	71%	0.714	S	S	*	*			trans	-57.2	114.9	-166.1	-72.4	163.7	-34.2	0	0	113.6	N196	Q155-N196 PolarHBondContact O-ND2 3.19Å
156	L	23.9	Very low	27.2	Very low	122 Å²	122	141.2 Å²	141.2	64%	0.639	71%	0.713	S	S	*	*			trans	-80	118.1	159.8	-94.1	141.2	0	0	0	107.9	K154	K154-L156 PolarHBondContact O-N 3.49Å
157	L	22.9	Very low	27.3	Very low	125 Å²	125	135.7 Å²	135.7	65%	0.654	71%	0.709	S	S	*	*			trans	-103.4	99	173.4	-140.5	102.8	0	0	0	105.9	I159 N196	L157-I159 PolarHBondContact O-N 3.21Å; L157-N196 PolarHBondContact N-ND2 3.1Å; L157-N196 PolarHBondContact N-OD1 3.16Å; L157-N196 PolarHBondContact O-OD1 3.29Å
158	S	26	Very low	27.5	Very low	70 Å²	70	136.3 Å²	136.3	49%	0.49	71%	0.71	S	S	.	*			trans	-61	132.6	174.3	49.8	0	0	0	0	109.7	D160	S158-D160 VanDerWaalsContact C-N 3.29Å; S158-D160 WeakPolarHBondContact CB-OD1 3.4Å; S158-D160 PolarHBondContact O-N 3.25Å; S158-D160 PolarHBondContact OG-OD1 3.46Å
159	I	28.7	Very low	27.5	Very low	118 Å²	118	136.9 Å²	136.9	61%	0.605	71%	0.712	S	S	*	*			trans	-79.9	93.5	158.8	-65.4	172	0	0	0	105	L157 L161	L157-I159 PolarHBondContact O-N 3.21Å; I159-L161 PolarHBondContact O-N 3.23Å
160	D	30.4	Very low	27.5	Very low	72 Å²	72	136.4 Å²	136.4	39%	0.385	71%	0.714	S	S	.	*			trans	-63.2	124.2	164.4	-62.6	-6.1	0	0	0	106.3	S158 I162 L177	S158-D160 VanDerWaalsContact C-N 3.29Å; S158-D160 WeakPolarHBondContact CB-OD1 3.4Å; S158-D160 PolarHBondContact O-N 3.25Å; S158-D160 PolarHBondContact OG-OD1 3.46Å; D160-I162 HydrophobicContact CB-CG1 3.98Å; D160-I162 PolarHBondContact O-N 3.18Å; D160-L177 HydrophobicContact CB-CD1 4.21Å; D160-L177 VanDerWaalsContact CG-CD1 3.46Å; D160-L177 WeakPolarHBondContact OD1-CD1 3.03Å
161	L	32.3	Very low	27.6	Very low	133 Å²	133	137.1 Å²	137.1	70%	0.696	72%	0.718	S	S	*	*			trans	-67	77.4	164	-81.9	162.2	0	0	0	107.1	I159 A163	I159-L161 PolarHBondContact O-N 3.23Å; L161-A163 VanDerWaalsContact C-N 3.32Å; L161-A163 PolarHBondContact O-N 3.34Å
162	I	30.1	Very low	27.8	Very low	121 Å²	121	139.1 Å²	139.1	62%	0.621	72%	0.723	S	S	*	*			trans	-67.5	100	168.1	-62.4	175.1	0	0	0	105.2	D160 N164	D160-I162 HydrophobicContact CB-CG1 3.98Å; D160-I162 PolarHBondContact O-N 3.18Å; I162-N164 WeakPolarHBondContact CG2-OD1 3.44Å; I162-N164 PolarHBondContact O-N 3.29Å
163	A	30.7	Very low	28.2	Very low	87 Å²	87	135.4 Å²	135.4	72%	0.719	72%	0.716	S	S	*	*			trans	-58.4	88.3	160.3	0	0	0	0	0	107.7	L161 Q165	L161-A163 VanDerWaalsContact C-N 3.32Å; L161-A163 PolarHBondContact O-N 3.34Å; A163-Q165 PolarHBondContact O-N 3.15Å
164	N	26.3	Very low	28.5	Very low	145 Å²	145	138.6 Å²	138.6	78%	0.775	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	80.1	172.2	-90.4	-22.3	0	0	0	108.8	I162	I162-N164 WeakPolarHBondContact CG2-OD1 3.44Å; I162-N164 PolarHBondContact O-N 3.29Å
165	Q	29.4	Very low	29.2	Very low	180 Å²	180	135.5 Å²	135.5	84%	0.841	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-163.7	11.5	155.8	-109.8	171.7	23.4	0	0	116.4	A163	A163-Q165 PolarHBondContact O-N 3.15Å
166	Y	28.9	Very low	29.8	Very low	202 Å²	202	133.7 Å²	133.7	79%	0.792	71%	0.709	S	S	*	*	S	Bend	trans	-136.6	129.5	172.7	-77.8	-86.1	0	0	0	112.6	I168	Y166-I168 PolarHBondContact O-N 3.42Å
167	P	28.1	Very low	30.3	Very low	126 Å²	126	132.5 Å²	132.5	82%	0.818	70%	0.702	S	S	*	*			trans	-77.4	113.9	178.1	30.7	-29.5	0	0	0	109.9
168	I	30.3	Very low	30.8	Very low	161 Å²	161	129 Å²	129	83%	0.826	69%	0.692	S	S	*	*			trans	-80.4	121.4	174.6	-62.7	172.5	0	0	0	109	Y166	Y166-I168 PolarHBondContact O-N 3.42Å
169	I	28.9	Very low	31.4	Very low	146 Å²	146	132.3 Å²	132.3	75%	0.749	69%	0.693	S	S	*	*			trans	-96.1	129.6	160.4	-73.6	163.4	0	0	0	108
170	N	31	Very low	31.8	Very low	132 Å²	132	130.9 Å²	130.9	71%	0.706	69%	0.686	S	S	*	*			trans	79.6	100.1	160.2	-67.8	-12.9	0	0	0	120.7
171	N	29.2	Very low	32.3	Very low	140 Å²	140	131.6 Å²	131.6	75%	0.749	68%	0.684	S	S	*	*				51.9	120.3	115.4	-77.9	-10.5	0	0	0	121
172	Q	28.8	Very low	32.7	Very low	180 Å²	180	128.7 Å²	128.7	84%	0.841	67%	0.669	S	S	*	*			trans	75.3	88.8	144.3	-64.4	179.3	-17.8	0	0	118
173	S	34.7	Very low	33.1	Very low	91 Å²	91	127.4 Å²	127.4	64%	0.636	66%	0.659	S	S	*	*			trans	179.8	136.6	134.1	35.5	0	0	0	0	111.2	H175	S173-H175 PolarHBondContact O-N 3.45Å; S173-H175 VanDerWaalsContact O-N 3.12Å
174	N	31.1	Very low	33.3	Very low	174 Å²	174	126.9 Å²	126.9	93%	0.93	65%	0.648	S	S	*	*			trans	-59.4	107.7	174.6	-82.3	-21.6	0	0	0	110
175	H	36.7	Very low	34	Very low	141 Å²	141	121.8 Å²	121.8	65%	0.653	62%	0.624	S	S	*	*			trans	-111.1	129	170.6	-80.1	-67.4	0	0	0	109.9	S173 L177	S173-H175 PolarHBondContact O-N 3.45Å; S173-H175 VanDerWaalsContact O-N 3.12Å; H175-L177 PolarHBondContact O-N 3.45Å
176	D	37.2	Very low	34.2	Very low	142 Å²	142	116.7 Å²	116.7	76%	0.759	60%	0.603	S	S	*	*			trans	-60.5	94.1	175.1	-75.1	-43.2	0	0	0	110.2
177	L	34	Very low	34.5	Very low	96 Å²	96	112 Å²	112	50%	0.503	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-64	136.2	176.6	-74.3	158.5	0	0	0	110.2	D160 H175 R179	D160-L177 HydrophobicContact CB-CD1 4.21Å; D160-L177 VanDerWaalsContact CG-CD1 3.46Å; D160-L177 WeakPolarHBondContact OD1-CD1 3.03Å; H175-L177 PolarHBondContact O-N 3.45Å; L177-R179 PolarHBondContact O-N 3.12Å; L177-R179 VanDerWaalsContact O-N 3.11Å
178	A	34.4	Very low	34.5	Very low	52 Å²	52	118.4 Å²	118.4	43%	0.43	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-53.3	117.9	169.6	0	0	0	0	0	109.5	L285	A178-L285 HydrophobicContact CB-CD2 4.48Å
179	R	38	Very low	34.6	Very low	140 Å²	140	115.1 Å²	115.1	53%	0.528	59%	0.587	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101	121.2	179.5	-73.3	177	-175	165.8	2.5	109.6	L177 Y181	L177-R179 PolarHBondContact O-N 3.12Å; L177-R179 VanDerWaalsContact O-N 3.11Å; R179-Y181 HydrophobicContact CB-CD2 4.16Å; R179-Y181 HydrophobicContact CB-CE2 3.48Å; R179-Y181 VanDerWaalsContact CB-CE2 3.48Å; R179-Y181 VanDerWaalsContact CD-OH 3.23Å; R179-Y181 WeakPolarHBondContact CD-OH 3.49Å; R179-Y181 WeakPolarHBondContact O-CD2 3.38Å
180	L	37.2	Very low	34.5	Very low	87 Å²	87	113.7 Å²	113.7	46%	0.455	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.3	115.8	168.6	-167	89.5	0	0	0	108.1	L182 L281 M283	L180-L182 HydrophobicContact CD2-CG 4.37Å; L180-L281 HydrophobicContact CD1-CD2 3.53Å; L180-L281 HydrophobicContact CD2-CD2 3.97Å; L180-L281 HydrophobicContact CG-CD2 3.73Å; L180-M283 HydrophobicContact CD1-CG 4.18Å; L180-M283 HydrophobicContact CD1-SD 4.28Å
181	Y	41.8	Very low	34.3	Very low	87 Å²	87	113.7 Å²	113.7	34%	0.341	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.3	120.3	171.3	-61.1	-87.6	0	0	0	109.6	R179 F183 A282 N284	R179-Y181 HydrophobicContact CB-CD2 4.16Å; R179-Y181 HydrophobicContact CB-CE2 3.48Å; R179-Y181 VanDerWaalsContact CB-CE2 3.48Å; R179-Y181 VanDerWaalsContact CD-OH 3.23Å; R179-Y181 WeakPolarHBondContact CD-OH 3.49Å; R179-Y181 WeakPolarHBondContact O-CD2 3.38Å; Y181-F183 HydrophobicContact CD1-CZ 4.03Å; Y181-F183 HydrophobicContact CG-CE2 4.01Å; Y181-F183 AromaticContact CG-CZ 3.96Å; Y181-F183 HydrophobicContact CG-CZ 3.96Å; Y181-A282 PolarHBondContact N-O 3.17Å; Y181-A282 PolarHBondContact O-N 2.67Å; Y181-A282 VanDerWaalsContact O-N 3.15Å; Y181-N284 HydrophobicContact CE2-CB 4.43Å
182	L	38.8	Very low	34.3	Very low	72 Å²	72	117.6 Å²	117.6	38%	0.377	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.7	115.9	171.1	-75.4	162.4	0	0	0	108.1	L180 F201 I279 L281	L180-L182 HydrophobicContact CD2-CG 4.37Å; L182-F201 HydrophobicContact CD1-CZ 4.2Å; L182-I279 HydrophobicContact CD2-CG2 3.78Å; L182-L281 HydrophobicContact CD2-CD2 3.68Å; L182-L281 HydrophobicContact CD2-CG 3.93Å; L182-L281 HydrophobicContact CG-CD2 4.33Å
183	F	39.8	Very low	34.2	Very low	95 Å²	95	116.6 Å²	116.6	42%	0.417	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117	127.7	176.2	-61.8	-72.2	0	0	0	110	Y181 T280 A282	Y181-F183 HydrophobicContact CD1-CZ 4.03Å; Y181-F183 HydrophobicContact CG-CE2 4.01Å; Y181-F183 AromaticContact CG-CZ 3.96Å; Y181-F183 HydrophobicContact CG-CZ 3.96Å; F183-T280 PolarHBondContact N-O 3.5Å; F183-T280 VanDerWaalsContact N-O 3.09Å; F183-T280 PolarHBondContact O-N 3.43Å; F183-A282 HydrophobicContact CD2-CB 3.85Å; F183-A282 HydrophobicContact CE2-CB 3.75Å
184	P	35.5	Very low	33.9	Very low	75 Å²	75	118.7 Å²	118.7	49%	0.487	59%	0.588	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-63.8	135.4	159.1	26.8	-29.2	0	0	0	107.7	N186 Q187	P184-N186 PolarHBondContact O-N 3.49Å; P184-Q187 HydrophobicContact CG-CG 4.41Å; P184-Q187 PolarHBondContact O-N 3.44Å
185	S	39.6	Very low	33.9	Very low	38 Å²	38	116.2 Å²	116.2	27%	0.266	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.1	4.1	-166.7	50.7	0	0	0	0	116.7	T278	S185-T278 PolarHBondContact OG-OG1 3.49Å
186	N	35	Very low	33.5	Very low	73 Å²	73	111.5 Å²	111.5	39%	0.39	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-130.9	6.3	-165	-67.8	49.5	0	0	0	115	P184 I237 P239	P184-N186 PolarHBondContact O-N 3.49Å; N186-I237 PolarHBondContact ND2-O 3.31Å; N186-P239 HydrophobicContact CB-CB 4.5Å; N186-P239 HydrophobicContact CB-CG 4.15Å; N186-P239 VanDerWaalsContact CG-CG 3.47Å; N186-P239 WeakPolarHBondContact ND2-CD 3.4Å; N186-P239 WeakPolarHBondContact ND2-CG 2.93Å; N186-P239 VanDerWaalsContact OD1-CB 3.3Å; N186-P239 WeakPolarHBondContact OD1-CB 3.12Å
187	Q	33.3	Very low	33.4	Very low	105 Å²	105	111.8 Å²	111.8	49%	0.491	55%	0.545	S	S	.	.			trans	-104	75.9	175.4	-72.4	-171.4	-14.7	0	0	112.1	P184	P184-Q187 HydrophobicContact CG-CG 4.41Å; P184-Q187 PolarHBondContact O-N 3.44Å
188	W	30	Very low	33.3	Very low	260 Å²	260	115 Å²	115	99%	0.985	55%	0.552	S	S	*	*			trans	-106.8	69.1	159.7	-78.7	45.5	0	0	0	108.1
189	S	30.5	Very low	33.1	Very low	91 Å²	91	117.7 Å²	117.7	64%	0.636	56%	0.559	S	S	*	*	S	Bend	trans	-132.6	136	170.4	64	0	0	0	0	109.4	N191	S189-N191 PolarHBondContact O-N 2.97Å
190	S	27.8	Very low	32.9	Very low	116 Å²	116	115 Å²	115	81%	0.811	55%	0.554	S	S	*	*	S	Bend	trans	-61	24.1	-164.3	54.1	0	0	0	0	118.4
191	N	26.6	Very low	32.7	Very low	132 Å²	132	114.8 Å²	114.8	71%	0.706	55%	0.55	S	S	*	.	S	Bend	trans	-117.3	104.6	173.6	-72.4	-15.9	0	0	0	109.4	S189 F193	S189-N191 PolarHBondContact O-N 2.97Å; N191-F193 PolarHBondContact O-N 3.08Å; N191-F193 VanDerWaalsContact O-N 3.13Å
192	Y	28.5	Very low	32.4	Very low	223 Å²	223	117 Å²	117	88%	0.875	56%	0.562	S	S	*	*			trans	-50.2	111.4	177.1	-67.8	-91.4	0	0	0	111.8	H194	Y192-H194 PolarHBondContact O-N 2.88Å
193	F	28.4	Very low	32.2	Very low	158 Å²	158	119.5 Å²	119.5	69%	0.693	57%	0.571	S	S	*	*			trans	-82.8	98.2	164.1	-93.3	-87.4	0	0	0	109.3	N191 I195	N191-F193 PolarHBondContact O-N 3.08Å; N191-F193 VanDerWaalsContact O-N 3.13Å; F193-I195 PolarHBondContact O-N 3.46Å
194	H	27.2	Very low	32	Very low	135 Å²	135	120.1 Å²	120.1	63%	0.625	58%	0.575	S	S	*	*			trans	-71.5	105.6	165.5	-96.9	-85	0	0	0	109.4	Y192	Y192-H194 PolarHBondContact O-N 2.88Å
195	I	31.6	Very low	32	Very low	122 Å²	122	118 Å²	118	63%	0.626	56%	0.56	S	S	*	*			trans	-105.7	84.6	170.8	-55.6	177.3	0	0	0	108.6	F193	F193-I195 PolarHBondContact O-N 3.46Å
196	N	27.4	Very low	31.9	Very low	43 Å²	43	120 Å²	120	23%	0.23	57%	0.567	C	S	.	*			trans	-73.4	153.1	150.1	-95.6	-15.1	0	0	0	107.5	Q155 L157	Q155-N196 PolarHBondContact O-ND2 3.19Å; L157-N196 PolarHBondContact N-ND2 3.1Å; L157-N196 PolarHBondContact N-OD1 3.16Å; L157-N196 PolarHBondContact O-OD1 3.29Å
197	Y	36	Very low	31.8	Very low	147 Å²	147	122.5 Å²	122.5	58%	0.576	58%	0.576	S	S	*	*			trans	96.1	94.7	166.9	-61.7	-84.6	0	0	0	117.7	N199 L200 F201	Y197-N199 PolarHBondContact O-N 3.48Å; Y197-L200 PolarHBondContact O-N 3.36Å; Y197-F201 PolarHBondContact O-N 3.37Å; Y197-F201 VanDerWaalsContact O-N 3.16Å
198	Y	30.7	Very low	32	Very low	165 Å²	165	122 Å²	122	65%	0.647	58%	0.576	S	S	*	*	H	α-helix	trans	-41	-30.7	154.5	-170.5	-99.4	0	0	0	113.8	K202	Y198-K202 PolarHBondContact O-N 3.22Å
199	N	32.1	Very low	32.3	Very low	107 Å²	107	116.1 Å²	116.1	57%	0.572	56%	0.557	S	S	*	*	H	α-helix	trans	-78.2	-30.4	177.8	-71.4	-23.4	0	0	0	114.1	Y197 Q203	Y197-N199 PolarHBondContact O-N 3.48Å; N199-Q203 PolarHBondContact O-N 2.81Å
200	L	33.2	Very low	32.6	Very low	83 Å²	83	119.5 Å²	119.5	44%	0.435	56%	0.561	S	S	.	*	H	α-helix	trans	-77.4	-36.3	173.7	-102.9	142.6	0	0	0	111	Y197 K202 Q203 E204	Y197-L200 PolarHBondContact O-N 3.36Å; L200-K202 VanDerWaalsContact C-N 3.26Å; L200-K202 PolarHBondContact O-N 3.17Å; L200-Q203 CarbonylContact O-C 3.56Å; L200-Q203 WeakPolarHBondContact O-CA 3.38Å; L200-Q203 PolarHBondContact O-N 3.5Å; L200-E204 PolarHBondContact O-N 3.19Å
201	F	33.3	Very low	33	Very low	83 Å²	83	117 Å²	117	36%	0.364	54%	0.537	S	S	.	.	H	α-helix	trans	-60.4	-37.8	172.3	-156.1	-104.1	0	0	0	111.5	L114 L182 Y197 L205	L114-F201 HydrophobicContact CD2-CE1 4.04Å; L114-F201 HydrophobicContact CD2-CZ 4.48Å; L182-F201 HydrophobicContact CD1-CZ 4.2Å; Y197-F201 PolarHBondContact O-N 3.37Å; Y197-F201 VanDerWaalsContact O-N 3.16Å; F201-L205 HydrophobicContact CD1-CD1 3.48Å; F201-L205 VanDerWaalsContact CD1-CD1 3.48Å; F201-L205 HydrophobicContact CD1-CG 4.17Å; F201-L205 HydrophobicContact CE1-CD1 3.68Å; F201-L205 HydrophobicContact CE1-CG 4.23Å; F201-L205 HydrophobicContact CG-CD1 4.44Å; F201-L205 WeakPolarHBondContact O-CB 3.09Å; F201-L205 WeakPolarHBondContact O-CD1 3.27Å; F201-L205 WeakPolarHBondContact O-CG 3.32Å; F201-L205 PolarHBondContact O-N 2.82Å
202	K	34.6	Very low	33.8	Very low	135 Å²	135	115.4 Å²	115.4	59%	0.587	53%	0.529	S	S	*	.	H	α-helix	trans	-65.6	-36.9	171.5	-165.3	178.7	-178.6	-178.4	0	112.6	Y198 L200 I206	Y198-K202 PolarHBondContact O-N 3.22Å; L200-K202 VanDerWaalsContact C-N 3.26Å; L200-K202 PolarHBondContact O-N 3.17Å; K202-I206 HydrophobicContact CG-CD1 4.44Å; K202-I206 WeakPolarHBondContact O-CD1 3.34Å; K202-I206 WeakPolarHBondContact O-CG1 3.47Å; K202-I206 PolarHBondContact O-N 3.34Å
203	Q	34.2	Very low	34.3	Very low	123 Å²	123	109 Å²	109	58%	0.575	50%	0.504	S	S	*	.	H	α-helix	trans	-72.9	-40.1	177.4	-76.1	-178.5	-18.5	0	0	112.8	N199 L200 I206 Q207	N199-Q203 PolarHBondContact O-N 2.81Å; L200-Q203 CarbonylContact O-C 3.56Å; L200-Q203 WeakPolarHBondContact O-CA 3.38Å; L200-Q203 PolarHBondContact O-N 3.5Å; Q203-I206 WeakPolarHBondContact O-CB 3.24Å; Q203-I206 PolarHBondContact O-N 3.12Å; Q203-Q207 PolarHBondContact O-N 3.12Å
204	E	36.6	Very low	35	Very low	108 Å²	108	106 Å²	106	51%	0.505	49%	0.494	S	S	.	.	H	α-helix	trans	-71.7	-30.6	172.8	-71.8	-156.9	168.9	0	0	112.1	L200 I206 Q207 I208	L200-E204 PolarHBondContact O-N 3.19Å; E204-I206 VanDerWaalsContact C-N 3.32Å; E204-I206 PolarHBondContact O-N 3.24Å; E204-Q207 CarbonylContact O-C 3.45Å; E204-Q207 WeakPolarHBondContact O-CA 3.44Å; E204-Q207 WeakPolarHBondContact O-CB 3.48Å; E204-Q207 PolarHBondContact O-N 3.48Å; E204-I208 WeakPolarHBondContact O-CG1 3.49Å; E204-I208 PolarHBondContact O-N 3.2Å
205	L	36	Very low	35.7	Very low	30 Å²	30	106.2 Å²	106.2	16%	0.157	50%	0.496	C	S	.	.	H	α-helix	trans	-66.8	-32.8	168.8	-77.5	166.3	0	0	0	112.8	L114 F201 Q207 I208 K209	L114-L205 HydrophobicContact CB-CD1 4.48Å; L114-L205 HydrophobicContact CB-CD2 4.3Å; L114-L205 HydrophobicContact CD2-CD1 4.04Å; L114-L205 HydrophobicContact CD2-CD2 3.37Å; L114-L205 HydrophobicContact CD2-CG 4.31Å; L114-L205 HydrophobicContact CG-CD2 4.46Å; F201-L205 HydrophobicContact CD1-CD1 3.48Å; F201-L205 VanDerWaalsContact CD1-CD1 3.48Å; F201-L205 HydrophobicContact CD1-CG 4.17Å; F201-L205 HydrophobicContact CE1-CD1 3.68Å; F201-L205 HydrophobicContact CE1-CG 4.23Å; F201-L205 HydrophobicContact CG-CD1 4.44Å; F201-L205 WeakPolarHBondContact O-CB 3.09Å; F201-L205 WeakPolarHBondContact O-CD1 3.27Å; F201-L205 WeakPolarHBondContact O-CG 3.32Å; F201-L205 PolarHBondContact O-N 2.82Å; L205-Q207 VanDerWaalsContact C-N 3.3Å; L205-I208 HydrophobicContact CD2-CD1 4.19Å; L205-I208 PolarHBondContact O-N 2.99Å; L205-K209 WeakPolarHBondContact O-CG 3.38Å; L205-K209 PolarHBondContact O-N 3.33Å
206	I	36	Very low	36.1	Very low	82 Å²	82	104.2 Å²	104.2	42%	0.421	49%	0.486	S	S	.	.	H	α-helix	trans	-69	-32.1	169.1	-70.3	162	0	0	0	110.5	K202 Q203 E204 K210	K202-I206 HydrophobicContact CG-CD1 4.44Å; K202-I206 WeakPolarHBondContact O-CD1 3.34Å; K202-I206 WeakPolarHBondContact O-CG1 3.47Å; K202-I206 PolarHBondContact O-N 3.34Å; Q203-I206 WeakPolarHBondContact O-CB 3.24Å; Q203-I206 PolarHBondContact O-N 3.12Å; E204-I206 VanDerWaalsContact C-N 3.32Å; E204-I206 PolarHBondContact O-N 3.24Å; I206-K210 WeakPolarHBondContact O-CG 3.31Å; I206-K210 PolarHBondContact O-N 3.06Å
207	Q	34.4	Very low	36.8	Very low	124 Å²	124	104.4 Å²	104.4	58%	0.579	49%	0.49	S	S	*	.	H	α-helix	trans	-70.5	-37.5	170.8	-70.6	-171.3	-7.5	0	0	111.9	Q203 E204 L205 K209 K210 L211	Q203-Q207 PolarHBondContact O-N 3.12Å; E204-Q207 CarbonylContact O-C 3.45Å; E204-Q207 WeakPolarHBondContact O-CA 3.44Å; E204-Q207 WeakPolarHBondContact O-CB 3.48Å; E204-Q207 PolarHBondContact O-N 3.48Å; L205-Q207 VanDerWaalsContact C-N 3.3Å; Q207-K209 VanDerWaalsContact C-N 3.33Å; Q207-K209 PolarHBondContact O-N 3.47Å; Q207-K210 CarbonylContact O-C 3.55Å; Q207-K210 VanDerWaalsContact O-C 3.23Å; Q207-K210 VanDerWaalsContact O-CA 3.31Å; Q207-K210 WeakPolarHBondContact O-CA 3.49Å; Q207-K210 WeakPolarHBondContact O-CB 3.24Å; Q207-K210 PolarHBondContact O-N 2.99Å; Q207-L211 WeakPolarHBondContact O-CG 3.33Å; Q207-L211 PolarHBondContact O-N 2.91Å
208	I	36.9	Very low	36.9	Very low	96 Å²	96	104 Å²	104	49%	0.492	49%	0.493	S	S	.	.	H	α-helix	trans	-63.7	-38.7	173	-66.4	164.9	0	0	0	111.2	E204 L205 K210 L211	E204-I208 WeakPolarHBondContact O-CG1 3.49Å; E204-I208 PolarHBondContact O-N 3.2Å; L205-I208 HydrophobicContact CD2-CD1 4.19Å; L205-I208 PolarHBondContact O-N 2.99Å; I208-K210 PolarHBondContact O-N 3.38Å; I208-L211 HydrophobicContact CB-CD1 4.26Å; I208-L211 HydrophobicContact CG1-CD1 3.9Å; I208-L211 PolarHBondContact O-N 2.97Å
209	K	35.7	Very low	37.1	Very low	136 Å²	136	106.9 Å²	106.9	59%	0.591	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-12	169.1	-75.7	-169.5	176.7	-168	0	114.3	F112 L205 Q207	F112-K209 PolarHBondContact O-NZ 3.18Å; L205-K209 WeakPolarHBondContact O-CG 3.38Å; L205-K209 PolarHBondContact O-N 3.33Å; Q207-K209 VanDerWaalsContact C-N 3.33Å; Q207-K209 PolarHBondContact O-N 3.47Å
210	K	36.7	Very low	37.2	Very low	162 Å²	162	107.1 Å²	107.1	70%	0.704	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	1.9	177.2	-73.5	-179.4	175.3	-173.2	0	112.6	I206 Q207 I208 D212	I206-K210 WeakPolarHBondContact O-CG 3.31Å; I206-K210 PolarHBondContact O-N 3.06Å; Q207-K210 CarbonylContact O-C 3.55Å; Q207-K210 VanDerWaalsContact O-C 3.23Å; Q207-K210 VanDerWaalsContact O-CA 3.31Å; Q207-K210 WeakPolarHBondContact O-CA 3.49Å; Q207-K210 WeakPolarHBondContact O-CB 3.24Å; Q207-K210 PolarHBondContact O-N 2.99Å; I208-K210 PolarHBondContact O-N 3.38Å; K210-D212 PolarHBondContact O-N 2.93Å
211	L	37.3	Very low	37.3	Very low	62 Å²	62	109.6 Å²	109.6	33%	0.325	52%	0.518	S	S	.	.			trans	-75.2	102.2	-179.6	-85.3	169.4	0	0	0	107.6	Q207 I208 Q215 L216	Q207-L211 WeakPolarHBondContact O-CG 3.33Å; Q207-L211 PolarHBondContact O-N 2.91Å; I208-L211 HydrophobicContact CB-CD1 4.26Å; I208-L211 HydrophobicContact CG1-CD1 3.9Å; I208-L211 PolarHBondContact O-N 2.97Å; L211-Q215 HydrophobicContact CD2-CB 4Å; L211-L216 HydrophobicContact CB-CD1 3.78Å; L211-L216 HydrophobicContact CB-CG 4.07Å; L211-L216 HydrophobicContact CD1-CD2 4.16Å; L211-L216 HydrophobicContact CD1-CG 4.27Å
212	D	42.7	Very low	37.2	Very low	100 Å²	100	113.3 Å²	113.3	54%	0.535	54%	0.542	S	S	.	.			trans	-55.7	140.3	167.5	-154.7	-15.1	0	0	0	109.2	K210 D214 Q215 L216	K210-D212 PolarHBondContact O-N 2.93Å; D212-D214 PolarHBondContact O-N 3.36Å; D212-D214 VanDerWaalsContact O-N 3.09Å; D212-Q215 HydrophobicContact CB-CG 4.48Å; D212-Q215 WeakPolarHBondContact O-CA 3.36Å; D212-Q215 WeakPolarHBondContact O-CB 3.2Å; D212-Q215 PolarHBondContact O-N 3.46Å; D212-L216 PolarHBondContact O-N 2.93Å
213	R	40	Very low	37.2	Very low	89 Å²	89	114.3 Å²	114.3	34%	0.336	55%	0.554	S	S	.	*	H	α-helix	trans	-58.1	-30.2	-172.6	-173.7	179.4	157.7	-149	-13.5	112.2	Q215 L216 C217 N338 D339 L340	R213-Q215 VanDerWaalsContact C-N 3.33Å; R213-Q215 PolarHBondContact O-N 3.44Å; R213-L216 PolarHBondContact O-N 3.15Å; R213-C217 WeakPolarHBondContact O-CB 3.12Å; R213-C217 PolarHBondContact O-N 3.29Å; R213-C217 VanDerWaalsContact O-N 3.1Å; R213-N338 PolarHBondContact NH1-O 3.42Å; R213-D339 PolarHBondContact NH1-O 3.02Å; R213-L340 VanDerWaalsContact CZ-CD2 3.48Å; R213-L340 VanDerWaalsContact NH2-CG 3.34Å
214	D	42.3	Very low	37.1	Very low	94 Å²	94	115.4 Å²	115.4	50%	0.503	56%	0.564	S	S	.	*	H	α-helix	trans	-64.4	-35.4	174.2	-73.2	-20.7	0	0	0	112.1	D212 C217 H218	D212-D214 PolarHBondContact O-N 3.36Å; D212-D214 VanDerWaalsContact O-N 3.09Å; D214-C217 PolarHBondContact O-N 3.08Å; D214-H218 WeakPolarHBondContact O-CB 3.21Å; D214-H218 PolarHBondContact O-CD2 3.05Å; D214-H218 VanDerWaalsContact O-CD2 3.29Å; D214-H218 PolarHBondContact O-N 3.06Å
215	Q	41.9	Very low	36.8	Very low	140 Å²	140	117.5 Å²	117.5	65%	0.654	58%	0.578	S	S	*	*	H	α-helix	trans	-72.8	-29.4	175.9	-62.9	-172.7	-7.2	0	0	112.6	L211 D212 R213	L211-Q215 HydrophobicContact CD2-CB 4Å; D212-Q215 HydrophobicContact CB-CG 4.48Å; D212-Q215 WeakPolarHBondContact O-CA 3.36Å; D212-Q215 WeakPolarHBondContact O-CB 3.2Å; D212-Q215 PolarHBondContact O-N 3.46Å; R213-Q215 VanDerWaalsContact C-N 3.33Å; R213-Q215 PolarHBondContact O-N 3.44Å
216	L	40.1	Very low	36.7	Very low	80 Å²	80	123.1 Å²	123.1	42%	0.419	61%	0.608	S	S	.	*	H	α-helix	trans	-76.9	-24.2	175.5	-82.3	156.1	0	0	0	113.1	L211 D212 R213	L211-L216 HydrophobicContact CB-CD1 3.78Å; L211-L216 HydrophobicContact CB-CG 4.07Å; L211-L216 HydrophobicContact CD1-CD2 4.16Å; L211-L216 HydrophobicContact CD1-CG 4.27Å; D212-L216 PolarHBondContact O-N 2.93Å; R213-L216 PolarHBondContact O-N 3.15Å
217	C	41.5	Very low	36.6	Very low	47 Å²	47	125.8 Å²	125.8	32%	0.318	62%	0.623	S	S	.	*	H	α-helix	trans	-110	-8.1	-175.3	-65.3	0	0	0	0	115.1	R213 D214 Y219	R213-C217 WeakPolarHBondContact O-CB 3.12Å; R213-C217 PolarHBondContact O-N 3.29Å; R213-C217 VanDerWaalsContact O-N 3.1Å; D214-C217 PolarHBondContact O-N 3.08Å; C217-Y219 PolarHBondContact O-N 3.36Å
218	H	38.5	Very low	36.4	Very low	139 Å²	139	126.4 Å²	126.4	64%	0.644	63%	0.631	S	S	*	*			trans	-81.5	10.6	-171.3	-91	-24.6	0	0	0	118.2	D214 I220	D214-H218 WeakPolarHBondContact O-CB 3.21Å; D214-H218 PolarHBondContact O-CD2 3.05Å; D214-H218 VanDerWaalsContact O-CD2 3.29Å; D214-H218 PolarHBondContact O-N 3.06Å; H218-I220 PolarHBondContact O-N 3.41Å; H218-I220 VanDerWaalsContact O-N 3.15Å
219	Y	35.5	Very low	36	Very low	225 Å²	225	129 Å²	129	88%	0.882	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	14.7	176.2	-122.4	-87	0	0	0	115.6	C217	C217-Y219 PolarHBondContact O-N 3.36Å
220	I	34.8	Very low	35.7	Very low	111 Å²	111	127.8 Å²	127.8	57%	0.569	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	-8.5	-168.4	-68	-179.5	0	0	0	116.2	H218	H218-I220 PolarHBondContact O-N 3.41Å; H218-I220 VanDerWaalsContact O-N 3.15Å
221	N	33.4	Very low	35.2	Very low	136 Å²	136	128.2 Å²	128.2	73%	0.727	66%	0.664	S	S	*	*	S	Bend	trans	-124.2	6.5	-172.1	-98.2	-1.4	0	0	0	119.7
222	D	33.1	Very low	34.8	Very low	160 Å²	160	130.6 Å²	130.6	86%	0.856	68%	0.681	S	S	*	*	S	Bend	trans	-98.1	10.3	-176.8	-79.5	-14.6	0	0	0	116.5
223	N	33	Very low	33.8	Very low	157 Å²	157	134.1 Å²	134.1	84%	0.84	70%	0.697	S	S	*	*			trans	-131.2	19.9	-177.5	-85	-30.7	0	0	0	116.6
224	N	32.1	Very low	33.1	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	72%	0.718	S	S	*	*			trans	-102.8	63.8	171.4	-82.4	-19.4	0	0	0	111.6
225	N	30.5	Very low	32.4	Very low	151 Å²	151	141.9 Å²	141.9	81%	0.807	73%	0.731	S	S	*	*	S	Bend	trans	-156.5	80.6	158.5	-93.7	-25.1	0	0	0	107.2
226	N	33.5	Very low	31.8	Very low	148 Å²	148	141.8 Å²	141.8	79%	0.791	73%	0.733	S	S	*	*	S	Bend	trans	170.6	117.5	141.8	-84.6	-29.1	0	0	0	111.1
227	N	33.8	Very low	31.5	Very low	138 Å²	138	143.4 Å²	143.4	74%	0.738	74%	0.741	S	S	*	*			trans	66.1	103.1	144.2	-61.8	-22.6	0	0	0	119.7
228	N	30.8	Very low	31.2	Very low	138 Å²	138	144 Å²	144	74%	0.738	74%	0.741	S	S	*	*				39.9	126.8	115.7	-66.5	-14.3	0	0	0	119.1
229	N	28.5	Very low	31.3	Very low	151 Å²	151	139.6 Å²	139.6	81%	0.807	73%	0.725	S	S	*	*			trans	81.9	96.2	154.6	-55.3	-19.9	0	0	0	116.8
230	S	30	Very low	31.5	Very low	109 Å²	109	130.9 Å²	130.9	76%	0.762	70%	0.696	S	S	*	*				167.8	125	110.5	46.5	0	0	0	0	110.9	T232	S230-T232 PolarHBondContact O-N 2.91Å; S230-T232 VanDerWaalsContact O-N 3.13Å
231	N	25.3	Very low	31.8	Very low	172 Å²	172	128.4 Å²	128.4	92%	0.92	68%	0.684	S	S	*	*			trans	-67.4	100.1	169.3	-77	-26.7	0	0	0	109.7
232	T	29	Very low	32.4	Very low	111 Å²	111	123.5 Å²	123.5	68%	0.681	66%	0.659	S	S	*	*			trans	-148.5	123.3	154.9	48.8	0	0	0	0	109.6	S230 K234	S230-T232 PolarHBondContact O-N 2.91Å; S230-T232 VanDerWaalsContact O-N 3.13Å; T232-K234 PolarHBondContact O-N 3.23Å; T232-K234 VanDerWaalsContact O-N 3.09Å
233	M	22.9	Very low	33.1	Very low	175 Å²	175	119 Å²	119	86%	0.862	63%	0.633	S	S	*	*			trans	-27.1	104.9	169.2	-76.5	-108.6	-167.3	0	0	113.9
234	K	25.6	Very low	33.8	Very low	178 Å²	178	119.9 Å²	119.9	77%	0.774	63%	0.629	S	S	*	*			trans	-128.3	88.8	158.8	-85.7	-176.2	176.3	176.5	0	108.1	T232 I236	T232-K234 PolarHBondContact O-N 3.23Å; T232-K234 VanDerWaalsContact O-N 3.09Å; K234-I236 HydrophobicContact CB-CG1 4.35Å; K234-I236 PolarHBondContact O-N 3.42Å
235	H	26.5	Very low	34.4	Very low	168 Å²	168	118.8 Å²	118.8	78%	0.778	62%	0.623	S	S	*	*			trans	-62.1	88.4	158.3	-85.5	-75.6	0	0	0	107.9	I237	H235-I237 PolarHBondContact O-N 3.48Å; H235-I237 VanDerWaalsContact O-N 3.17Å
236	I	29.7	Very low	35.2	Very low	137 Å²	137	112 Å²	112	70%	0.703	59%	0.587	S	S	*	*			trans	-78.3	94.8	165.8	-60.9	175.4	0	0	0	105.4	K234 N238	K234-I236 HydrophobicContact CB-CG1 4.35Å; K234-I236 PolarHBondContact O-N 3.42Å; I236-N238 PolarHBondContact O-N 2.76Å
237	I	34.5	Very low	36	Very low	114 Å²	114	106.4 Å²	106.4	59%	0.585	56%	0.559	S	S	*	*			trans	-66.9	102.6	174.1	-62.2	171.6	0	0	0	106.6	N186 H235	N186-I237 PolarHBondContact ND2-O 3.31Å; H235-I237 PolarHBondContact O-N 3.48Å; H235-I237 VanDerWaalsContact O-N 3.17Å
238	N	35.1	Very low	36.3	Very low	60 Å²	60	102.7 Å²	102.7	32%	0.321	54%	0.543	S	S	.	.			trans	-65.7	129.2	172.1	-115.4	-14.2	0	0	0	108.4	I236 C240 I241	I236-N238 PolarHBondContact O-N 2.76Å; N238-C240 PolarHBondContact O-N 3.33Å; N238-I241 HydrophobicContact CB-CG1 4.26Å
239	P	40	Very low	36.8	Very low	47 Å²	47	100.4 Å²	100.4	31%	0.305	53%	0.53	S	S	.	.	S	Bend	trans	-71.9	-15.2	-175.4	21.8	-15	0	0	0	112.5	N186 F277	N186-P239 HydrophobicContact CB-CB 4.5Å; N186-P239 HydrophobicContact CB-CG 4.15Å; N186-P239 VanDerWaalsContact CG-CG 3.47Å; N186-P239 WeakPolarHBondContact ND2-CD 3.4Å; N186-P239 WeakPolarHBondContact ND2-CG 2.93Å; N186-P239 VanDerWaalsContact OD1-CB 3.3Å; N186-P239 WeakPolarHBondContact OD1-CB 3.12Å; P239-F277 VanDerWaalsContact O-CA 3.31Å; P239-F277 WeakPolarHBondContact O-CA 3.39Å; P239-F277 WeakPolarHBondContact O-CB 3.23Å
240	C	38.7	Very low	37.3	Very low	41 Å²	41	95.6 Å²	95.6	28%	0.277	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	110.7	167.6	-88.6	0	0	0	0	108	N238 Q276	N238-C240 PolarHBondContact O-N 3.33Å; C240-Q276 WeakPolarHBondContact CA-O 3.22Å
241	I	42.7	Very low	37.6	Very low	60 Å²	60	95 Å²	95	31%	0.308	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	90	165.4	-59.6	168.1	0	0	0	105.2	N238 F243 Q276	N238-I241 HydrophobicContact CB-CG1 4.26Å; I241-F243 HydrophobicContact CB-CE2 4.43Å; I241-F243 HydrophobicContact CG2-CD1 3.84Å; I241-F243 HydrophobicContact CG2-CD2 3.86Å; I241-F243 HydrophobicContact CG2-CE1 3.78Å; I241-F243 HydrophobicContact CG2-CE2 3.81Å; I241-F243 HydrophobicContact CG2-CG 3.88Å; I241-F243 HydrophobicContact CG2-CZ 3.77Å; I241-F243 PolarHBondContact O-N 3.22Å; I241-Q276 HydrophobicContact CB-CG 3.85Å; I241-Q276 PolarHBondContact N-O 3.03Å; I241-Q276 WeakPolarHBondContact O-CG 3.47Å; I241-Q276 PolarHBondContact O-N 3.02Å
242	C	45.6	Very low	38	Very low	32 Å²	32	93.6 Å²	93.6	22%	0.216	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	108.7	158.5	-66	0	0	0	0	106	K244 C275	C242-K244 PolarHBondContact O-N 3.43Å; C242-C275 HydrophobicContact CB-CB 4.25Å; C242-C275 WeakPolarHBondContact CB-SG 3.5Å; C242-C275 WeakPolarHBondContact SG-CB 3.29Å; C242-C275 CovalentContact SG-SG 2.05Å; C242-C275 PolarHBondContact SG-SG 3.48Å
243	F	48.4	Very low	38.1	Very low	66 Å²	66	95.4 Å²	95.4	29%	0.289	49%	0.486	S	S	.	.			trans	-71.9	80.6	-178.3	-76.5	-84.3	0	0	0	110.3	I241 N245 I246 Y274 Q276	I241-F243 HydrophobicContact CB-CE2 4.43Å; I241-F243 HydrophobicContact CG2-CD1 3.84Å; I241-F243 HydrophobicContact CG2-CD2 3.86Å; I241-F243 HydrophobicContact CG2-CE1 3.78Å; I241-F243 HydrophobicContact CG2-CE2 3.81Å; I241-F243 HydrophobicContact CG2-CG 3.88Å; I241-F243 HydrophobicContact CG2-CZ 3.77Å; I241-F243 PolarHBondContact O-N 3.22Å; F243-N245 PolarHBondContact O-N 2.84Å; F243-N245 VanDerWaalsContact O-N 3.14Å; F243-I246 HydrophobicContact CB-CB 3.88Å; F243-I246 HydrophobicContact CB-CD1 3.38Å; F243-I246 HydrophobicContact CB-CG1 3.52Å; F243-I246 HydrophobicContact CD1-CD1 4.13Å; F243-I246 HydrophobicContact CD1-CG1 4.29Å; F243-I246 HydrophobicContact CD2-CD1 3.79Å; F243-I246 HydrophobicContact CG-CD1 3.53Å; F243-I246 HydrophobicContact CG-CG1 3.99Å; F243-I246 PolarHBondContact O-N 3.36Å; F243-Y274 HydrophobicContact CD2-CD2 4.41Å; F243-Y274 AromaticContact CD2-CE2 3.73Å; F243-Y274 HydrophobicContact CD2-CE2 3.73Å; F243-Y274 AromaticContact CD2-CZ 3.85Å; F243-Y274 AromaticContact CE2-CE2 3.68Å; F243-Y274 HydrophobicContact CE2-CE2 3.68Å; F243-Y274 AromaticContact CE2-CZ 3.83Å; F243-Q276 HydrophobicContact CD2-CG 4.48Å; F243-Q276 VanDerWaalsContact CE2-CD 3.44Å; F243-Q276 HydrophobicContact CE2-CG 3.91Å; F243-Q276 VanDerWaalsContact CZ-NE2 3.25Å
244	K	46.9	Very low	38.4	Very low	175 Å²	175	91.9 Å²	91.9	76%	0.761	48%	0.478	S	S	*	.	H	α-helix	trans	-52.6	-32	168.5	-95.6	-175.8	173.6	179.8	0	111.7	C242	C242-K244 PolarHBondContact O-N 3.43Å
245	N	44.5	Very low	38.6	Very low	123 Å²	123	89.8 Å²	89.8	66%	0.658	47%	0.474	S	S	*	.	H	α-helix	trans	-80.7	-5.3	179.1	-71.9	-5.6	0	0	0	114.7	F243 S248	F243-N245 PolarHBondContact O-N 2.84Å; F243-N245 VanDerWaalsContact O-N 3.14Å; N245-S248 PolarHBondContact O-OG 3.5Å
246	I	48.1	Very low	38.7	Very low	10 Å²	10	89.1 Å²	89.1	5%	0.051	48%	0.476	C	S	.	.	H	α-helix	trans	-75.2	-37	171.2	-79.4	174.5	0	0	0	110.1	F243 S248 I249 Y271 Y274	F243-I246 HydrophobicContact CB-CB 3.88Å; F243-I246 HydrophobicContact CB-CD1 3.38Å; F243-I246 HydrophobicContact CB-CG1 3.52Å; F243-I246 HydrophobicContact CD1-CD1 4.13Å; F243-I246 HydrophobicContact CD1-CG1 4.29Å; F243-I246 HydrophobicContact CD2-CD1 3.79Å; F243-I246 HydrophobicContact CG-CD1 3.53Å; F243-I246 HydrophobicContact CG-CG1 3.99Å; F243-I246 PolarHBondContact O-N 3.36Å; I246-S248 PolarHBondContact O-N 3.41Å; I246-I249 PolarHBondContact O-N 3.03Å; I246-I249 VanDerWaalsContact O-N 3.09Å; I246-Y271 VanDerWaalsContact CG2-O 3.3Å; I246-Y271 WeakPolarHBondContact CG2-O 3.3Å; I246-Y274 HydrophobicContact CD1-CD1 4.3Å; I246-Y274 HydrophobicContact CD1-CE1 3.56Å
247	C	48.7	Very low	38.5	Very low	29 Å²	29	89.6 Å²	89.6	20%	0.196	48%	0.48	C	S	.	.	H	α-helix	trans	-59.4	-32.3	176.5	-54	0	0	0	0	112.7	C341	C247-C341 WeakPolarHBondContact CA-SG 3.2Å; C247-C341 HydrophobicContact CB-CB 3.87Å; C247-C341 WeakPolarHBondContact CB-SG 3.37Å; C247-C341 VanDerWaalsContact SG-CA 3.5Å; C247-C341 WeakPolarHBondContact SG-CB 3.36Å; C247-C341 CovalentContact SG-SG 2.02Å; C247-C341 PolarHBondContact SG-SG 3.4Å
248	S	41.6	Very low	38.1	Very low	60 Å²	60	92.5 Å²	92.5	42%	0.42	49%	0.491	S	S	.	.	H	α-helix	trans	-75.4	-20.9	179.5	55.2	0	0	0	0	113.9	N245 I246	N245-S248 PolarHBondContact O-OG 3.5Å; I246-S248 PolarHBondContact O-N 3.41Å
249	I	39.9	Very low	37.6	Very low	91 Å²	91	95 Å²	95	47%	0.467	51%	0.513	S	S	.	.	H	α-helix	trans	-78.1	-31.3	177	-63.3	169.8	0	0	0	110.8	I246	I246-I249 PolarHBondContact O-N 3.03Å; I246-I249 VanDerWaalsContact O-N 3.09Å
250	I	39.6	Very low	37.1	Very low	49 Å²	49	100.4 Å²	100.4	25%	0.251	54%	0.538	S	S	.	.	H	α-helix	trans	-71.5	-38.1	179	-54.4	168.7	0	0	0	111.4	N252 Y271 Y428	I250-N252 VanDerWaalsContact C-N 3.3Å; I250-N252 PolarHBondContact O-N 3.39Å; I250-Y271 WeakPolarHBondContact CD1-O 3.43Å; I250-Y271 WeakPolarHBondContact CG1-O 3.37Å; I250-Y428 WeakPolarHBondContact CD1-OH 3.38Å
251	N	36.2	Very low	36.5	Very low	98 Å²	98	105.6 Å²	105.6	52%	0.524	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.8	-12.5	-177.6	-79.4	-15.5	0	0	0	114.7
252	N	33.3	Very low	35.8	Very low	141 Å²	141	109.2 Å²	109.2	75%	0.754	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	11.3	179.4	-85	-12.8	0	0	0	114.2	I250	I250-N252 VanDerWaalsContact C-N 3.3Å; I250-N252 PolarHBondContact O-N 3.39Å
253	Q	32.3	Very low	34.9	Very low	150 Å²	150	118.9 Å²	118.9	70%	0.701	62%	0.615	S	S	*	*			trans	-98.6	37.4	172	-69.1	-168.7	-15.1	0	0	113.3	I255	Q253-I255 VanDerWaalsContact C-N 3.26Å; Q253-I255 PolarHBondContact O-N 3.44Å; Q253-I255 VanDerWaalsContact O-N 3.14Å
254	S	28.6	Very low	33.8	Very low	101 Å²	101	120.6 Å²	120.6	71%	0.706	64%	0.635	S	S	*	*			trans	-77.6	87.3	152.4	51.2	0	0	0	0	107.7	N256	S254-N256 PolarHBondContact O-N 3.25Å
255	I	30.3	Very low	32.8	Very low	134 Å²	134	118.2 Å²	118.2	69%	0.687	64%	0.636	S	S	*	*			trans	-58.2	106.2	175.4	-67.7	168.6	0	0	0	107.7	Q253 N257	Q253-I255 VanDerWaalsContact C-N 3.26Å; Q253-I255 PolarHBondContact O-N 3.44Å; Q253-I255 VanDerWaalsContact O-N 3.14Å; I255-N257 VanDerWaalsContact C-N 3.28Å; I255-N257 PolarHBondContact O-N 3.44Å
256	N	27.3	Very low	31.9	Very low	153 Å²	153	118.7 Å²	118.7	82%	0.818	64%	0.638	S	S	*	*			trans	-50.6	100.7	151.7	-87.6	-26.7	0	0	0	106.9	S254 Q258	S254-N256 PolarHBondContact O-N 3.25Å; N256-Q258 PolarHBondContact O-N 3.35Å
257	N	26.4	Very low	30.9	Very low	148 Å²	148	124.2 Å²	124.2	79%	0.791	67%	0.668	S	S	*	*	S	Bend	trans	-66	79.9	167.4	-90	-23.2	0	0	0	108.4	I255	I255-N257 VanDerWaalsContact C-N 3.28Å; I255-N257 PolarHBondContact O-N 3.44Å
258	Q	25.8	Very low	29.9	Very low	174 Å²	174	130.2 Å²	130.2	81%	0.813	70%	0.698	S	S	*	*	S	Bend	trans	-168.7	119.3	155.3	-104.8	162.4	32.4	0	0	108.8	N256	N256-Q258 PolarHBondContact O-N 3.35Å
259	S	25.4	Very low	29.5	Very low	112 Å²	112	133.3 Å²	133.3	78%	0.783	71%	0.706	S	S	*	*			trans	72.3	102.3	177.2	76.3	0	0	0	0	116
260	I	29.3	Very low	29.4	Very low	162 Å²	162	133.9 Å²	133.9	83%	0.831	71%	0.709	S	S	*	*				-175.1	93.8	116.2	-82.6	147.6	0	0	0	105.3
261	N	25.7	Very low	29.7	Very low	149 Å²	149	137.1 Å²	137.1	80%	0.797	72%	0.719	S	S	*	*			trans	-70.3	144	157.4	-85.4	-27.4	0	0	0	108.1
262	N	28	Very low	30.3	Very low	137 Å²	137	135.2 Å²	135.2	73%	0.733	71%	0.708	S	S	*	*			trans	99.7	103.6	160.8	-58.9	-27.8	0	0	0	117.7
263	R	26	Very low	31.1	Very low	235 Å²	235	128.8 Å²	128.8	89%	0.887	67%	0.674	S	S	*	*			trans	102.5	111.1	135.2	-70.8	174.8	-179.9	179.1	-0	117.6
264	S	26.3	Very low	32	Very low	102 Å²	102	123.8 Å²	123.8	71%	0.713	65%	0.649	S	S	*	*			trans	84.7	102.9	137.2	60.2	0	0	0	0	119.4
265	T	26	Very low	33	Very low	125 Å²	125	119.9 Å²	119.9	77%	0.767	62%	0.622	S	S	*	*				75.3	101.9	129.1	57.8	0	0	0	0	118.3
266	N	25.3	Very low	33.9	Very low	133 Å²	133	115 Å²	115	71%	0.711	60%	0.596	S	S	*	*			trans	40.6	96.2	135.3	-65.3	-4.5	0	0	0	116.6
267	N	27.7	Very low	34.9	Very low	125 Å²	125	110.3 Å²	110.3	67%	0.668	57%	0.569	S	S	*	*			trans	-170.4	83	138.7	-90.4	-19	0	0	0	109.2	Q269	N267-Q269 PolarHBondContact O-N 3.24Å
268	N	26	Very low	35.9	Very low	156 Å²	156	104.9 Å²	104.9	83%	0.834	54%	0.541	S	S	*	.			trans	-73.4	68.7	156.2	-77.4	-1.8	0	0	0	107.7	L270	N268-L270 PolarHBondContact O-N 2.9Å
269	Q	34	Very low	37.1	Very low	124 Å²	124	98.4 Å²	98.4	58%	0.579	51%	0.512	S	S	*	.			trans	-78.2	93.4	166.5	-91.1	179.8	-31	0	0	107.2	N267 Y271	N267-Q269 PolarHBondContact O-N 3.24Å; Q269-Y271 WeakPolarHBondContact O-CD2 3.25Å; Q269-Y271 PolarHBondContact O-N 3.42Å; Q269-Y271 VanDerWaalsContact O-N 3.08Å
270	L	38.2	Very low	38.1	Very low	104 Å²	104	94.3 Å²	94.3	55%	0.545	48%	0.482	S	S	.	.			trans	-58.9	109.3	163.4	-98.1	97.9	0	0	0	107.6	N268 L272 Y428	N268-L270 PolarHBondContact O-N 2.9Å; L270-L272 PolarHBondContact O-N 3.04Å; L270-Y428 HydrophobicContact CD2-CD1 4.16Å; L270-Y428 HydrophobicContact CD2-CE1 3.88Å
271	Y	45.6	Very low	39	Very low	116 Å²	116	87.6 Å²	87.6	46%	0.455	45%	0.447	S	S	.	.			trans	-75.2	93.7	173.8	-68.8	-84.4	0	0	0	108.8	I246 I250 Q269	I246-Y271 VanDerWaalsContact CG2-O 3.3Å; I246-Y271 WeakPolarHBondContact CG2-O 3.3Å; I250-Y271 WeakPolarHBondContact CD1-O 3.43Å; I250-Y271 WeakPolarHBondContact CG1-O 3.37Å; Q269-Y271 WeakPolarHBondContact O-CD2 3.25Å; Q269-Y271 PolarHBondContact O-N 3.42Å; Q269-Y271 VanDerWaalsContact O-N 3.08Å
272	L	48.3	Very low	39.9	Very low	58 Å²	58	80.9 Å²	80.9	30%	0.304	41%	0.413	S	S	.	.			trans	-65.2	146.6	171.1	-68.5	162.2	0	0	0	109.6	L270 Y274 M300 Y428	L270-L272 PolarHBondContact O-N 3.04Å; L272-Y274 VanDerWaalsContact O-CD1 3.29Å; L272-Y274 WeakPolarHBondContact O-CD1 3.22Å; L272-Y274 PolarHBondContact O-N 3.09Å; L272-M300 HydrophobicContact CB-CE 4.36Å; L272-M300 HydrophobicContact CD1-CE 3.36Å; L272-M300 HydrophobicContact CG-CE 4.41Å; L272-Y428 HydrophobicContact CD2-CD1 3.93Å; L272-Y428 HydrophobicContact CD2-CD2 3.49Å; L272-Y428 VanDerWaalsContact CD2-CD2 3.49Å; L272-Y428 HydrophobicContact CD2-CE1 3.85Å; L272-Y428 HydrophobicContact CD2-CE2 3.4Å; L272-Y428 VanDerWaalsContact CD2-CE2 3.4Å; L272-Y428 HydrophobicContact CD2-CG 3.76Å
273	P	50.3	Low	40.8	Very low	6 Å²	6	76.1 Å²	76.1	4%	0.039	39%	0.387	C	S	.	.			trans	-54.9	126.6	165.2	17.6	-26.3	0	0	0	110	D301 L340 C341	P273-D301 HydrophobicContact CG-CB 4.44Å; P273-L340 HydrophobicContact CB-CB 3.66Å; P273-L340 HydrophobicContact CB-CD1 4.38Å; P273-L340 HydrophobicContact CB-CD2 4.4Å; P273-L340 HydrophobicContact CB-CG 4.38Å; P273-L340 HydrophobicContact CG-CB 3.86Å; P273-C341 HydrophobicContact CB-CB 4.15Å; P273-C341 WeakPolarHBondContact CB-SG 3.26Å; P273-C341 VanDerWaalsContact CD-SG 3.59Å; P273-C341 HydrophobicContact CG-CB 3.64Å; P273-C341 WeakPolarHBondContact CG-SG 3.12Å
274	Y	51.4	Low	41.7	Very low	45 Å²	45	67.7 Å²	67.7	18%	0.176	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	145.3	165	61.6	-88.7	0	0	0	109.3	F243 I246 L272 Q276 Q298 L299	F243-Y274 HydrophobicContact CD2-CD2 4.41Å; F243-Y274 AromaticContact CD2-CE2 3.73Å; F243-Y274 HydrophobicContact CD2-CE2 3.73Å; F243-Y274 AromaticContact CD2-CZ 3.85Å; F243-Y274 AromaticContact CE2-CE2 3.68Å; F243-Y274 HydrophobicContact CE2-CE2 3.68Å; F243-Y274 AromaticContact CE2-CZ 3.83Å; I246-Y274 HydrophobicContact CD1-CD1 4.3Å; I246-Y274 HydrophobicContact CD1-CE1 3.56Å; L272-Y274 VanDerWaalsContact O-CD1 3.29Å; L272-Y274 WeakPolarHBondContact O-CD1 3.22Å; L272-Y274 PolarHBondContact O-N 3.09Å; Y274-Q276 HydrophobicContact CD2-CB 4.11Å; Y274-Q276 HydrophobicContact CE2-CB 4.04Å; Y274-Q276 HydrophobicContact CE2-CG 4.37Å; Y274-Q298 HydrophobicContact CD2-CB 4.25Å; Y274-Q298 HydrophobicContact CD2-CG 4.01Å; Y274-Q298 HydrophobicContact CE2-CG 4.34Å; Y274-L299 CarbonylContact C-O 3.59Å; Y274-L299 WeakPolarHBondContact CA-O 3.48Å; Y274-L299 WeakPolarHBondContact CB-O 3.48Å
275	C	49.9	Very low	42.6	Very low	19 Å²	19	65.3 Å²	65.3	13%	0.128	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	119	161.9	-68.9	0	0	0	0	107.1	C242 L299	C242-C275 HydrophobicContact CB-CB 4.25Å; C242-C275 WeakPolarHBondContact CB-SG 3.5Å; C242-C275 WeakPolarHBondContact SG-CB 3.29Å; C242-C275 CovalentContact SG-SG 2.05Å; C242-C275 PolarHBondContact SG-SG 3.48Å; C275-L299 HydrophobicContact CB-CB 4.47Å; C275-L299 PolarHBondContact N-O 3.46Å; C275-L299 PolarHBondContact O-N 3.41Å
276	Q	49.8	Very low	43.4	Very low	32 Å²	32	64.1 Å²	64.1	15%	0.15	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	135.5	170.9	59.3	176.4	-0.3	0	0	109.7	C240 I241 F243 Y274 I297	C240-Q276 WeakPolarHBondContact CA-O 3.22Å; I241-Q276 HydrophobicContact CB-CG 3.85Å; I241-Q276 PolarHBondContact N-O 3.03Å; I241-Q276 WeakPolarHBondContact O-CG 3.47Å; I241-Q276 PolarHBondContact O-N 3.02Å; F243-Q276 HydrophobicContact CD2-CG 4.48Å; F243-Q276 VanDerWaalsContact CE2-CD 3.44Å; F243-Q276 HydrophobicContact CE2-CG 3.91Å; F243-Q276 VanDerWaalsContact CZ-NE2 3.25Å; Y274-Q276 HydrophobicContact CD2-CB 4.11Å; Y274-Q276 HydrophobicContact CE2-CB 4.04Å; Y274-Q276 HydrophobicContact CE2-CG 4.37Å; Q276-I297 WeakPolarHBondContact CA-O 3.47Å
277	F	48.7	Very low	44.4	Very low	55 Å²	55	65 Å²	65	24%	0.241	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	145.1	162.8	76.1	-86.8	0	0	0	110.6	P239 I279 I297 L299	P239-F277 VanDerWaalsContact O-CA 3.31Å; P239-F277 WeakPolarHBondContact O-CA 3.39Å; P239-F277 WeakPolarHBondContact O-CB 3.23Å; F277-I279 HydrophobicContact CD2-CG1 3.93Å; F277-I279 HydrophobicContact CE2-CD1 3.73Å; F277-I279 HydrophobicContact CE2-CG1 3.53Å; F277-I279 HydrophobicContact CZ-CD1 4.48Å; F277-I297 HydrophobicContact CD1-CB 3.9Å; F277-I297 HydrophobicContact CD1-CG2 4.08Å; F277-I297 HydrophobicContact CD2-CB 4.47Å; F277-I297 HydrophobicContact CE1-CB 3.44Å; F277-I297 VanDerWaalsContact CE1-CB 3.44Å; F277-I297 HydrophobicContact CE1-CD1 4.21Å; F277-I297 HydrophobicContact CE1-CG1 4.37Å; F277-I297 HydrophobicContact CE1-CG2 3.29Å; F277-I297 HydrophobicContact CE2-CB 4.09Å; F277-I297 HydrophobicContact CE2-CD1 3.67Å; F277-I297 HydrophobicContact CE2-CG1 4.27Å; F277-I297 HydrophobicContact CG-CB 4.4Å; F277-I297 HydrophobicContact CZ-CB 3.56Å; F277-I297 HydrophobicContact CZ-CD1 3.4Å; F277-I297 HydrophobicContact CZ-CG1 3.98Å; F277-I297 HydrophobicContact CZ-CG2 3.61Å; F277-I297 PolarHBondContact N-O 2.8Å; F277-I297 PolarHBondContact O-N 3.46Å; F277-L299 HydrophobicContact CD1-CD1 3.83Å; F277-L299 HydrophobicContact CD1-CG 3.97Å; F277-L299 HydrophobicContact CE1-CD1 3.71Å; F277-L299 HydrophobicContact CE1-CD2 4.02Å; F277-L299 HydrophobicContact CE1-CG 3.72Å
278	T	47.3	Very low	45	Very low	34 Å²	34	65.4 Å²	65.4	21%	0.209	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	114.9	-175.9	45	0	0	0	0	109.9	S185 T294	S185-T278 PolarHBondContact OG-OG1 3.49Å; T278-T294 HydrophobicContact CG2-CG2 4.31Å
279	I	49.9	Very low	46	Very low	38 Å²	38	64 Å²	64	20%	0.195	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	123.3	166.2	-58.7	-176	0	0	0	107.3	L182 F277 I295 I297	L182-I279 HydrophobicContact CD2-CG2 3.78Å; F277-I279 HydrophobicContact CD2-CG1 3.93Å; F277-I279 HydrophobicContact CE2-CD1 3.73Å; F277-I279 HydrophobicContact CE2-CG1 3.53Å; F277-I279 HydrophobicContact CZ-CD1 4.48Å; I279-I295 HydrophobicContact CB-CB 4.44Å; I279-I295 PolarHBondContact N-O 2.8Å; I279-I295 PolarHBondContact O-N 3.49Å; I279-I297 HydrophobicContact CD1-CD1 3.52Å; I279-I297 HydrophobicContact CG1-CD1 4.06Å
280	T	46.5	Very low	46.7	Very low	26 Å²	26	63.5 Å²	63.5	16%	0.16	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	112.9	172.7	-51.6	0	0	0	0	108.7	F183 I292	F183-T280 PolarHBondContact N-O 3.5Å; F183-T280 VanDerWaalsContact N-O 3.09Å; F183-T280 PolarHBondContact O-N 3.43Å; T280-I292 HydrophobicContact CG2-CG2 3.3Å
281	L	47.8	Very low	47.4	Very low	20 Å²	20	62.7 Å²	62.7	11%	0.105	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	112.9	169.8	-84.1	143.3	0	0	0	108.2	L180 L182 M293 I295	L180-L281 HydrophobicContact CD1-CD2 3.53Å; L180-L281 HydrophobicContact CD2-CD2 3.97Å; L180-L281 HydrophobicContact CG-CD2 3.73Å; L182-L281 HydrophobicContact CD2-CD2 3.68Å; L182-L281 HydrophobicContact CD2-CG 3.93Å; L182-L281 HydrophobicContact CG-CD2 4.33Å; L281-M293 WeakPolarHBondContact CA-O 3.34Å; L281-M293 HydrophobicContact CB-CB 4.18Å; L281-M293 WeakPolarHBondContact CB-O 3.21Å; L281-M293 PolarHBondContact N-O 2.78Å; L281-M293 PolarHBondContact O-N 3.45Å; L281-I295 HydrophobicContact CD1-CD1 3.16Å; L281-I295 HydrophobicContact CD1-CG1 3.76Å
282	A	45.9	Very low	47.9	Very low	8 Å²	8	62 Å²	62	7%	0.066	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	115.9	167.9	0	0	0	0	0	107.7	Y181 F183 L290	Y181-A282 PolarHBondContact N-O 3.17Å; Y181-A282 PolarHBondContact O-N 2.67Å; Y181-A282 VanDerWaalsContact O-N 3.15Å; F183-A282 HydrophobicContact CD2-CB 3.85Å; F183-A282 HydrophobicContact CE2-CB 3.75Å; A282-L290 HydrophobicContact CB-CD2 3.95Å
283	M	46.3	Very low	48	Very low	38 Å²	38	61.5 Å²	61.5	19%	0.187	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	112.8	172.6	-62.6	-171.4	-55.4	0	0	107.6	L127 L180 L285 N291	L127-M283 HydrophobicContact CD2-CE 4.34Å; L127-M283 HydrophobicContact CD2-SD 4.45Å; L180-M283 HydrophobicContact CD1-CG 4.18Å; L180-M283 HydrophobicContact CD1-SD 4.28Å; M283-L285 PolarHBondContact O-N 2.96Å; M283-N291 PolarHBondContact N-O 2.85Å; M283-N291 PolarHBondContact O-N 2.89Å
284	N	45	Very low	48.2	Very low	57 Å²	57	64.2 Å²	64.2	31%	0.305	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	96.1	167.8	-172.1	-5.3	0	0	0	107.6	Y181 L286 N287	Y181-N284 HydrophobicContact CE2-CB 4.43Å; N284-L286 PolarHBondContact O-N 2.67Å; N284-N287 PolarHBondContact OD1-N 3.11Å
285	L	45	Very low	48.4	Very low	53 Å²	53	62.6 Å²	62.6	28%	0.277	33%	0.332	S	S	.	.			trans	-87.5	92.8	170.6	-70.9	163.6	0	0	0	107.3	A178 M283 N287	A178-L285 HydrophobicContact CB-CD2 4.48Å; M283-L285 PolarHBondContact O-N 2.96Å; L285-N287 PolarHBondContact O-N 3.48Å
286	L	43	Very low	48.5	Very low	100 Å²	100	63 Å²	63	52%	0.524	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	53.4	160.5	-64.1	162.3	0	0	0	116.6	Y134 N284 I288	Y134-L286 HydrophobicContact CE1-CD1 4.01Å; N284-L286 PolarHBondContact O-N 2.67Å; L286-I288 PolarHBondContact O-N 3.35Å
287	N	45.2	Very low	48.9	Very low	152 Å²	152	61.6 Å²	61.6	81%	0.813	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	13.1	168.9	-90	-9	0	0	0	116	N284 L285	N284-N287 PolarHBondContact OD1-N 3.11Å; L285-N287 PolarHBondContact O-N 3.48Å
288	I	40.6	Very low	49.3	Very low	132 Å²	132	61.2 Å²	61.2	68%	0.677	33%	0.325	S	S	*	.	S	Bend	trans	-134.5	100.8	179.6	-54.7	168.4	0	0	0	106.2	L286	L286-I288 PolarHBondContact O-N 3.35Å
289	D	48	Very low	50.1	Low	127 Å²	127	63 Å²	63	68%	0.679	33%	0.333	S	S	*	.			trans	64.2	116.6	178.7	-56.8	-32.4	0	0	0	117.2	N291	D289-N291 PolarHBondContact O-N 3.35Å; D289-N291 VanDerWaalsContact O-N 3.1Å
290	L	48.4	Very low	50.8	Low	113 Å²	113	64.3 Å²	64.3	59%	0.592	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	101.5	167.7	-100.8	152.7	0	0	0	108.9	A282 I292	A282-L290 HydrophobicContact CB-CD2 3.95Å; L290-I292 PolarHBondContact O-N 2.82Å
291	N	52.9	Low	51.9	Low	88 Å²	88	64.6 Å²	64.6	47%	0.471	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	109.6	169.7	-82.3	-24.9	0	0	0	109.3	M283 D289	M283-N291 PolarHBondContact N-O 2.85Å; M283-N291 PolarHBondContact O-N 2.89Å; D289-N291 PolarHBondContact O-N 3.35Å; D289-N291 VanDerWaalsContact O-N 3.1Å
292	I	54.8	Low	53.2	Low	101 Å²	101	64.8 Å²	64.8	52%	0.518	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	110.7	177.6	-56.9	176.7	0	0	0	108.1	T280 L290	T280-I292 HydrophobicContact CG2-CG2 3.3Å; L290-I292 PolarHBondContact O-N 2.82Å
293	M	51.8	Low	54.8	Low	47 Å²	47	64.5 Å²	64.5	23%	0.232	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	119	168.2	-179.3	-175.5	-62.9	0	0	108.6	L125 L281 I295	L125-M293 HydrophobicContact CD1-CE 3.83Å; L125-M293 HydrophobicContact CD1-SD 3.64Å; L125-M293 HydrophobicContact CD2-CE 4.19Å; L125-M293 HydrophobicContact CD2-SD 4.5Å; L281-M293 WeakPolarHBondContact CA-O 3.34Å; L281-M293 HydrophobicContact CB-CB 4.18Å; L281-M293 WeakPolarHBondContact CB-O 3.21Å; L281-M293 PolarHBondContact N-O 2.78Å; L281-M293 PolarHBondContact O-N 3.45Å; M293-I295 HydrophobicContact CG-CG1 4.31Å; M293-I295 HydrophobicContact SD-CD1 4.46Å; M293-I295 HydrophobicContact SD-CG1 4.23Å
294	T	54.3	Low	56.4	Low	64 Å²	64	67.2 Å²	67.2	39%	0.393	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	114.8	171.8	-51.7	0	0	0	0	108.6	T278	T278-T294 HydrophobicContact CG2-CG2 4.31Å
295	I	55.4	Low	58.2	Low	11 Å²	11	67 Å²	67	6%	0.056	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	118.4	170.2	-59.5	-177.1	0	0	0	107.8	L121 I279 L281 M293 I297	L121-I295 HydrophobicContact CD1-CD1 3.79Å; L121-I295 HydrophobicContact CD2-CD1 3.7Å; L121-I295 HydrophobicContact CG-CD1 4.37Å; I279-I295 HydrophobicContact CB-CB 4.44Å; I279-I295 PolarHBondContact N-O 2.8Å; I279-I295 PolarHBondContact O-N 3.49Å; L281-I295 HydrophobicContact CD1-CD1 3.16Å; L281-I295 HydrophobicContact CD1-CG1 3.76Å; M293-I295 HydrophobicContact CG-CG1 4.31Å; M293-I295 HydrophobicContact SD-CD1 4.46Å; M293-I295 HydrophobicContact SD-CG1 4.23Å; I295-I297 HydrophobicContact CG2-CD1 4.31Å; I295-I297 HydrophobicContact CG2-CG1 3.8Å
296	L	52.6	Low	60.4	Low	27 Å²	27	67 Å²	67	14%	0.141	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	115.1	172.4	-169.5	151.6	0	0	0	108.4	Q298	L296-Q298 HydrophobicContact CD2-CG 3.38Å
297	I	57.5	Low	62.7	Low	3 Å²	3	62.2 Å²	62.2	2%	0.015	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	120.7	176.4	-57.7	179.1	0	0	0	107.8	L107 L117 Q276 F277 I279 I295 L299	L107-I297 HydrophobicContact CD1-CG2 4.06Å; L117-I297 HydrophobicContact CD2-CD1 4.5Å; Q276-I297 WeakPolarHBondContact CA-O 3.47Å; F277-I297 HydrophobicContact CD1-CB 3.9Å; F277-I297 HydrophobicContact CD1-CG2 4.08Å; F277-I297 HydrophobicContact CD2-CB 4.47Å; F277-I297 HydrophobicContact CE1-CB 3.44Å; F277-I297 VanDerWaalsContact CE1-CB 3.44Å; F277-I297 HydrophobicContact CE1-CD1 4.21Å; F277-I297 HydrophobicContact CE1-CG1 4.37Å; F277-I297 HydrophobicContact CE1-CG2 3.29Å; F277-I297 HydrophobicContact CE2-CB 4.09Å; F277-I297 HydrophobicContact CE2-CD1 3.67Å; F277-I297 HydrophobicContact CE2-CG1 4.27Å; F277-I297 HydrophobicContact CG-CB 4.4Å; F277-I297 HydrophobicContact CZ-CB 3.56Å; F277-I297 HydrophobicContact CZ-CD1 3.4Å; F277-I297 HydrophobicContact CZ-CG1 3.98Å; F277-I297 HydrophobicContact CZ-CG2 3.61Å; F277-I297 PolarHBondContact N-O 2.8Å; F277-I297 PolarHBondContact O-N 3.46Å; I279-I297 HydrophobicContact CD1-CD1 3.52Å; I279-I297 HydrophobicContact CG1-CD1 4.06Å; I295-I297 HydrophobicContact CG2-CD1 4.31Å; I295-I297 HydrophobicContact CG2-CG1 3.8Å; I297-L299 HydrophobicContact CG2-CD2 4.26Å
298	Q	56.8	Low	65	Low	47 Å²	47	61 Å²	61	22%	0.22	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	110.7	173	-62.5	-174.9	-26.4	0	0	108.1	T104 Y274 L296 M300	T104-Q298 HydrophobicContact CG2-CB 4.43Å; T104-Q298 HydrophobicContact CG2-CG 4.22Å; Y274-Q298 HydrophobicContact CD2-CB 4.25Å; Y274-Q298 HydrophobicContact CD2-CG 4.01Å; Y274-Q298 HydrophobicContact CE2-CG 4.34Å; L296-Q298 HydrophobicContact CD2-CG 3.38Å; Q298-M300 PolarHBondContact O-N 3.22Å
299	L	63.6	Low	67.4	Low	72 Å²	72	56.1 Å²	56.1	38%	0.377	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	110.3	169.1	-63	175.4	0	0	0	107.5	L107 Y274 C275 F277 I297	L107-L299 HydrophobicContact CD1-CD2 3.83Å; Y274-L299 CarbonylContact C-O 3.59Å; Y274-L299 WeakPolarHBondContact CA-O 3.48Å; Y274-L299 WeakPolarHBondContact CB-O 3.48Å; C275-L299 HydrophobicContact CB-CB 4.47Å; C275-L299 PolarHBondContact N-O 3.46Å; C275-L299 PolarHBondContact O-N 3.41Å; F277-L299 HydrophobicContact CD1-CD1 3.83Å; F277-L299 HydrophobicContact CD1-CG 3.97Å; F277-L299 HydrophobicContact CE1-CD1 3.71Å; F277-L299 HydrophobicContact CE1-CD2 4.02Å; F277-L299 HydrophobicContact CE1-CG 3.72Å; I297-L299 HydrophobicContact CG2-CD2 4.26Å
300	M	64.7	Low	69.1	Low	65 Å²	65	56.5 Å²	56.5	32%	0.32	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	133.5	172.2	-69.8	-177.5	54.3	0	0	108.7	T106 L272 Q298	T106-M300 HydrophobicContact CG2-CE 4.45Å; T106-M300 HydrophobicContact CG2-CG 4.44Å; T106-M300 HydrophobicContact CG2-SD 3.26Å; T106-M300 WeakPolarHBondContact CG2-SD 3.28Å; L272-M300 HydrophobicContact CB-CE 4.36Å; L272-M300 HydrophobicContact CD1-CE 3.36Å; L272-M300 HydrophobicContact CG-CE 4.41Å; Q298-M300 PolarHBondContact O-N 3.22Å
301	D	70.8	Confident	70.9	Confident	32 Å²	32	55.6 Å²	55.6	17%	0.171	28%	0.277	C	S	.	.			trans	-67.7	137.5	169.9	-170.6	75.4	0	0	0	110	P273 L340 H343	P273-D301 HydrophobicContact CG-CB 4.44Å; D301-L340 HydrophobicContact CB-CB 3.74Å; D301-L340 HydrophobicContact CB-CD1 3.86Å; D301-L340 HydrophobicContact CB-CG 4.32Å; D301-L340 VanDerWaalsContact CG-CB 3.48Å; D301-L340 PolarHBondContact OD1-N 2.81Å; D301-L340 WeakPolarHBondContact OD2-CB 3.3Å; D301-L340 PolarHBondContact OD2-N 2.87Å; D301-H343 IonicContact OD2-CG 2.69Å; D301-H343 IonicContact OD2-ND1 3.59Å; D301-H343 PolarHBondContact OD2-ND1 2.98Å; D301-H343 VanDerWaalsContact OD2-ND1 3.11Å
302	I	74	Confident	72.1	Confident	23 Å²	23	59.6 Å²	59.6	12%	0.118	30%	0.298	C	S	.	.			trans	-113.7	148.4	174.2	-55.7	169.9	0	0	0	105.8	I108 E109 D304	I108-I302 HydrophobicContact CG2-CD1 4.17Å; E109-I302 HydrophobicContact CB-CD1 4.41Å; I302-D304 PolarHBondContact O-N 3.08Å
303	N	79.7	Confident	73.5	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.011	30%	0.302	C	S	.	.	S	Bend	trans	-71.7	76.8	174.4	-160.7	52.4	0	0	0	110.2	D339 H343 D425 K435 H437	N303-D339 WeakPolarHBondContact CA-OD2 3.44Å; N303-D339 PolarHBondContact OD1-OD2 3.12Å; N303-H343 HydrophobicContact CB-CB 4.37Å; N303-H343 PolarHBondContact N-CE1 3.45Å; N303-H343 PolarHBondContact N-ND1 2.98Å; N303-H343 VanDerWaalsContact OD1-CB 3.32Å; N303-H343 WeakPolarHBondContact OD1-CB 3.16Å; N303-D425 VanDerWaalsContact ND2-CG 3.31Å; N303-D425 PolarHBondContact ND2-OD2 2.91Å; N303-D425 PolarHBondContact OD1-OD2 2.84Å; N303-K435 PolarHBondContact ND2-O 3.25Å; N303-H437 PolarHBondContact ND2-CD2 3.41Å; N303-H437 PolarHBondContact O-NE2 3.31Å
304	D	80.3	Confident	74.9	Confident	96 Å²	96	66.8 Å²	66.8	51%	0.513	33%	0.33	S	S	.	.			trans	-116.1	-8.3	-174.1	78.9	-38.3	0	0	0	113.7	I302 D339	I302-D304 PolarHBondContact O-N 3.08Å; D304-D339 PolarHBondContact N-OD2 3.1Å
305	N	83.9	Confident	76.7	Confident	51 Å²	51	66.8 Å²	66.8	27%	0.273	33%	0.327	S	S	.	.	S	Bend	trans	-95.2	158.3	166.6	-64	-80.8	0	0	0	110.6	D337 N338 D339 H437	N305-D337 WeakPolarHBondContact CB-OD1 3.28Å; N305-N338 HydrophobicContact CB-CB 4.16Å; N305-D339 WeakPolarHBondContact CB-OD1 3.33Å; N305-D339 PolarHBondContact N-OD1 2.86Å; N305-D339 PolarHBondContact N-OD2 3.39Å; N305-D339 PolarHBondContact ND2-OD1 3.12Å; N305-H437 PolarHBondContact O-CD2 3.18Å; N305-H437 VanDerWaalsContact O-CD2 3.29Å
306	V	89.5	Confident	78.5	Confident	54 Å²	54	68.7 Å²	68.7	33%	0.327	33%	0.334	S	S	.	.			trans	-112	143.4	174.7	-54.5	0	0	0	0	108	K308 H437 T439	V306-K308 HydrophobicContact CG2-CG 4.35Å; V306-K308 PolarHBondContact O-N 2.78Å; V306-H437 HydrophobicContact CB-CB 3.88Å; V306-H437 HydrophobicContact CG1-CB 3.59Å; V306-T439 HydrophobicContact CB-CG2 4.3Å; V306-T439 HydrophobicContact CG2-CG2 4.12Å
307	P	92.5	Very high	80.5	Confident	0 Å²	0	72 Å²	72	0%	0	35%	0.351	C	S	.	.			trans	-57	137.8	174.8	-24.1	31.5	0	0	0	110.4	A335 I336 D337 I346 A423 D425 T439	P307-A335 HydrophobicContact CB-CB 4.17Å; P307-I336 CarbonylContact C-O 3.52Å; P307-D337 WeakPolarHBondContact CD-OD2 3.28Å; P307-D337 HydrophobicContact CG-CB 4.43Å; P307-D337 VanDerWaalsContact CG-OD2 3.28Å; P307-D337 WeakPolarHBondContact CG-OD2 3.4Å; P307-I346 HydrophobicContact CB-CD1 4.01Å; P307-I346 HydrophobicContact CB-CG1 4.18Å; P307-I346 HydrophobicContact CG-CG1 4.24Å; P307-A423 HydrophobicContact CB-CB 4.02Å; P307-D425 HydrophobicContact CG-CB 3.9Å; P307-T439 VanDerWaalsContact O-CB 3.23Å; P307-T439 WeakPolarHBondContact O-CB 3.45Å; P307-T439 WeakPolarHBondContact O-CG2 3.37Å; P307-T439 PolarHBondContact O-OG1 3.48Å
308	K	92.1	Very high	82.3	Confident	126 Å²	126	72.2 Å²	72.2	55%	0.548	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	121.8	178.2	-70.7	173.8	-170.9	167	0	111.1	V306 Q310 A335 I336	V306-K308 HydrophobicContact CG2-CG 4.35Å; V306-K308 PolarHBondContact O-N 2.78Å; K308-Q310 PolarHBondContact O-N 2.64Å; K308-A335 CarbonylContact O-C 3.55Å; K308-A335 VanDerWaalsContact O-CA 3.27Å; K308-A335 WeakPolarHBondContact O-CA 3.09Å; K308-I336 PolarHBondContact N-O 3.26Å; K308-I336 PolarHBondContact O-N 2.97Å
309	F	92.1	Very high	84.2	Confident	29 Å²	29	73.3 Å²	73.3	13%	0.127	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	134	171.5	-70.4	-76.8	0	0	0	111.1	W311 A335 Y348 L421 A423 L441	F309-W311 PolarHBondContact O-N 3.32Å; F309-A335 HydrophobicContact CD1-CB 3.9Å; F309-A335 HydrophobicContact CE1-CB 4.04Å; F309-A335 HydrophobicContact CG-CB 4.19Å; F309-A335 HydrophobicContact CZ-CB 4.43Å; F309-Y348 HydrophobicContact CE1-CD1 4.36Å; F309-Y348 AromaticContact CE1-CE1 3.91Å; F309-Y348 HydrophobicContact CE1-CE1 3.91Å; F309-Y348 HydrophobicContact CZ-CE1 4.38Å; F309-L421 HydrophobicContact CE1-CD2 3.64Å; F309-L421 HydrophobicContact CE1-CG 4.02Å; F309-L421 HydrophobicContact CZ-CB 4.49Å; F309-L421 HydrophobicContact CZ-CD2 3.98Å; F309-L421 HydrophobicContact CZ-CG 3.84Å; F309-A423 HydrophobicContact CE1-CB 4.16Å; F309-A423 HydrophobicContact CE2-CB 3.8Å; F309-A423 HydrophobicContact CZ-CB 3.5Å; F309-A423 VanDerWaalsContact CZ-CB 3.5Å; F309-L441 HydrophobicContact CD1-CB 4.45Å; F309-L441 HydrophobicContact CD1-CD2 4.16Å; F309-L441 HydrophobicContact CD2-CB 3.65Å; F309-L441 HydrophobicContact CE1-CB 4.48Å; F309-L441 HydrophobicContact CE2-CB 3.68Å; F309-L441 HydrophobicContact CG-CB 4.06Å; F309-L441 HydrophobicContact CG-CD2 4.19Å; F309-L441 HydrophobicContact CZ-CB 4.11Å
310	Q	83.8	Confident	85.8	Confident	136 Å²	136	69.9 Å²	69.9	64%	0.636	34%	0.341	S	S	*	.	S	Bend	trans	-77.3	54.3	172.1	-62.4	-170.8	-55.1	0	0	111.6	K308 I334 I336	K308-Q310 PolarHBondContact O-N 2.64Å; Q310-I334 PolarHBondContact N-O 2.85Å; Q310-I336 HydrophobicContact CG-CD1 3.83Å; Q310-I336 HydrophobicContact CG-CG1 4.11Å
311	W	85.7	Confident	87.2	Confident	93 Å²	93	69.5 Å²	69.5	35%	0.352	34%	0.34	S	S	.	.			trans	-140.7	122.9	-178.4	-174.1	-110.7	0	0	0	110.4	F309 Q313 N315 Y316 P333	F309-W311 PolarHBondContact O-N 3.32Å; W311-Q313 HydrophobicContact CZ2-CB 4.31Å; W311-Q313 HydrophobicContact CZ2-CG 4.34Å; W311-Q313 PolarHBondContact NE1-O 2.97Å; W311-N315 PolarHBondContact NE1-O 2.89Å; W311-Y316 AromaticContact CD2-CD2 3.84Å; W311-Y316 HydrophobicContact CD2-CD2 3.84Å; W311-Y316 HydrophobicContact CD2-CE2 4.34Å; W311-Y316 AromaticContact CE2-CD2 3.68Å; W311-Y316 HydrophobicContact CE3-CD2 4.14Å; W311-Y316 HydrophobicContact CE3-CE2 4.17Å; W311-Y316 HydrophobicContact CG-CD2 4.37Å; W311-Y316 HydrophobicContact CH2-CD2 4.18Å; W311-Y316 HydrophobicContact CH2-CE2 4.15Å; W311-Y316 AromaticContact CZ2-CD2 3.88Å; W311-Y316 HydrophobicContact CZ2-CD2 3.88Å; W311-Y316 HydrophobicContact CZ2-CE2 4.32Å; W311-Y316 HydrophobicContact CZ3-CD2 4.3Å; W311-Y316 HydrophobicContact CZ3-CE2 4.07Å; W311-P333 HydrophobicContact CB-CB 4.26Å; W311-P333 HydrophobicContact CB-CG 4.37Å
312	N	79	Confident	88.4	Confident	172 Å²	172	68.3 Å²	68.3	92%	0.92	33%	0.333	S	S	*	.			trans	-85	-13.4	-171.2	-67.9	-14.3	0	0	0	113.7
313	Q	83.5	Confident	89.3	Confident	128 Å²	128	72 Å²	72	60%	0.598	35%	0.353	S	S	*	.	S	Bend	trans	-96.4	156	179.2	-56.2	-179.2	-21.6	0	0	110.3	W311 N315	W311-Q313 HydrophobicContact CZ2-CB 4.31Å; W311-Q313 HydrophobicContact CZ2-CG 4.34Å; W311-Q313 PolarHBondContact NE1-O 2.97Å; Q313-N315 VanDerWaalsContact C-N 3.29Å; Q313-N315 PolarHBondContact O-N 3.08Å
314	Q	81.7	Confident	90	Very high	172 Å²	172	73 Å²	73	80%	0.804	36%	0.358	S	S	*	.	S	Bend	trans	-68.3	-30.4	178.6	-70.5	179.7	-24	0	0	112.8
315	N	90.5	Very high	90.6	Very high	63 Å²	63	76.3 Å²	76.3	34%	0.337	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	141.5	-174.7	-57.5	-21.3	0	0	0	110.6	W311 Q313 S442 I444	W311-N315 PolarHBondContact NE1-O 2.89Å; Q313-N315 VanDerWaalsContact C-N 3.29Å; Q313-N315 PolarHBondContact O-N 3.08Å; N315-S442 CarbonylContact C-O 3.58Å; N315-S442 VanDerWaalsContact CA-O 3.25Å; N315-S442 WeakPolarHBondContact CA-O 3.48Å; N315-S442 VanDerWaalsContact OD1-CB 3.25Å; N315-S442 WeakPolarHBondContact OD1-CB 3.37Å; N315-I444 HydrophobicContact CB-CD1 4.07Å
316	Y	94.7	Very high	91.1	Very high	51 Å²	51	78.6 Å²	78.6	20%	0.2	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127.8	167.1	-165.8	-93.4	0	0	0	108.4	W311 I318 Q331 L332 P333 S442 L443 I444	W311-Y316 AromaticContact CD2-CD2 3.84Å; W311-Y316 HydrophobicContact CD2-CD2 3.84Å; W311-Y316 HydrophobicContact CD2-CE2 4.34Å; W311-Y316 AromaticContact CE2-CD2 3.68Å; W311-Y316 HydrophobicContact CE3-CD2 4.14Å; W311-Y316 HydrophobicContact CE3-CE2 4.17Å; W311-Y316 HydrophobicContact CG-CD2 4.37Å; W311-Y316 HydrophobicContact CH2-CD2 4.18Å; W311-Y316 HydrophobicContact CH2-CE2 4.15Å; W311-Y316 AromaticContact CZ2-CD2 3.88Å; W311-Y316 HydrophobicContact CZ2-CD2 3.88Å; W311-Y316 HydrophobicContact CZ2-CE2 4.32Å; W311-Y316 HydrophobicContact CZ3-CD2 4.3Å; W311-Y316 HydrophobicContact CZ3-CE2 4.07Å; Y316-I318 HydrophobicContact CD1-CD1 4.22Å; Y316-I318 HydrophobicContact CD1-CG1 3.92Å; Y316-I318 HydrophobicContact CE1-CD1 4.05Å; Y316-I318 HydrophobicContact CE1-CG1 3.79Å; Y316-Q331 PolarHBondContact OH-O 3.45Å; Y316-L332 HydrophobicContact CD1-CD2 3.95Å; Y316-L332 HydrophobicContact CE1-CD2 3.97Å; Y316-P333 HydrophobicContact CD2-CG 3.89Å; Y316-P333 HydrophobicContact CE2-CG 4.13Å; Y316-P333 HydrophobicContact CG-CG 4.34Å; Y316-S442 PolarHBondContact N-O 2.82Å; Y316-L443 HydrophobicContact CD1-CD1 3.72Å; Y316-L443 HydrophobicContact CG-CD1 4.44Å; Y316-L443 WeakPolarHBondContact O-CA 3.26Å; Y316-I444 PolarHBondContact O-N 2.78Å
317	I	94.9	Very high	91.2	Very high	97 Å²	97	77.5 Å²	77.5	50%	0.497	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	130.8	-172.9	-58.6	174.6	0	0	0	110	I444 Y446	I317-I444 VanDerWaalsContact CA-O 3.3Å; I317-I444 WeakPolarHBondContact CA-O 3.09Å; I317-I444 HydrophobicContact CG1-CB 4.43Å; I317-Y446 HydrophobicContact CG2-CD2 3.69Å; I317-Y446 HydrophobicContact CG2-CE2 3.85Å
318	I	95.3	Very high	91.4	Very high	7 Å²	7	81.6 Å²	81.6	4%	0.036	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	142.5	174.6	-58.9	-178.6	0	0	0	109	Y316 F320 Y330 L332 I403 L443 I444 I445 Y446	Y316-I318 HydrophobicContact CD1-CD1 4.22Å; Y316-I318 HydrophobicContact CD1-CG1 3.92Å; Y316-I318 HydrophobicContact CE1-CD1 4.05Å; Y316-I318 HydrophobicContact CE1-CG1 3.79Å; I318-F320 HydrophobicContact CG2-CD2 3.84Å; I318-F320 HydrophobicContact CG2-CE2 3.69Å; I318-Y330 HydrophobicContact CG2-CD1 4.15Å; I318-Y330 HydrophobicContact CG2-CD2 3.58Å; I318-Y330 HydrophobicContact CG2-CE2 3.98Å; I318-Y330 HydrophobicContact CG2-CG 3.67Å; I318-L332 HydrophobicContact CD1-CD2 3.72Å; I318-I403 HydrophobicContact CD1-CG2 3.6Å; I318-L443 HydrophobicContact CD1-CD1 3.71Å; I318-L443 HydrophobicContact CG1-CD1 3.97Å; I318-I444 PolarHBondContact N-O 3.39Å; I318-I445 HydrophobicContact CB-CG1 4.45Å; I318-I445 HydrophobicContact CB-CG2 4.47Å; I318-I445 CarbonylContact O-C 3.58Å; I318-I445 VanDerWaalsContact O-CA 3.3Å; I318-I445 WeakPolarHBondContact O-CA 3.23Å; I318-Y446 PolarHBondContact O-N 3.4Å
319	N	95.9	Very high	91.5	Very high	70 Å²	70	79.5 Å²	79.5	37%	0.374	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	115.6	174.5	-60.2	-25.8	0	0	0	108.9	Y330 Y446 Q448	N319-Y330 VanDerWaalsContact O-CZ 3.31Å; N319-Y330 PolarHBondContact O-OH 3.28Å; N319-Y446 WeakPolarHBondContact CA-O 3.18Å; N319-Q448 HydrophobicContact CB-CG 4.4Å
320	F	96.6	Very high	91.6	Very high	0 Å²	0	81.6 Å²	81.6	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	154.8	165.4	-78.6	-93.7	0	0	0	109.3	I318 D324 K328 Y330 F387 L405 L409 I445 Y446 I447 Q448	I318-F320 HydrophobicContact CG2-CD2 3.84Å; I318-F320 HydrophobicContact CG2-CE2 3.69Å; F320-D324 HydrophobicContact CD1-CB 4.39Å; F320-K328 HydrophobicContact CD1-CG 4.16Å; F320-K328 HydrophobicContact CE1-CB 4.09Å; F320-K328 HydrophobicContact CE1-CG 3.87Å; F320-Y330 HydrophobicContact CD1-CD2 4.26Å; F320-Y330 AromaticContact CD1-CE2 3.73Å; F320-Y330 HydrophobicContact CD1-CE2 3.73Å; F320-Y330 HydrophobicContact CD2-CD2 4.28Å; F320-Y330 HydrophobicContact CD2-CE2 4.11Å; F320-Y330 AromaticContact CE1-CD2 3.68Å; F320-Y330 HydrophobicContact CE1-CD2 3.68Å; F320-Y330 AromaticContact CE1-CE2 3.59Å; F320-Y330 HydrophobicContact CE1-CE2 3.59Å; F320-Y330 AromaticContact CE2-CD2 3.73Å; F320-Y330 HydrophobicContact CE2-CD2 3.73Å; F320-Y330 HydrophobicContact CE2-CE2 4.01Å; F320-Y330 HydrophobicContact CG-CE2 4Å; F320-Y330 AromaticContact CZ-CD2 3.41Å; F320-Y330 HydrophobicContact CZ-CD2 3.41Å; F320-Y330 VanDerWaalsContact CZ-CD2 3.41Å; F320-Y330 AromaticContact CZ-CE2 3.77Å; F320-Y330 HydrophobicContact CZ-CE2 3.77Å; F320-F387 AromaticContact CD2-CE1 3.91Å; F320-F387 HydrophobicContact CD2-CE1 3.91Å; F320-F387 HydrophobicContact CE2-CD1 4.11Å; F320-F387 AromaticContact CE2-CE1 3.59Å; F320-F387 HydrophobicContact CE2-CE1 3.59Å; F320-F387 HydrophobicContact CZ-CD1 4.21Å; F320-F387 AromaticContact CZ-CE1 3.97Å; F320-F387 HydrophobicContact CZ-CE1 3.97Å; F320-L405 HydrophobicContact CD1-CB 4.37Å; F320-L405 HydrophobicContact CD1-CD2 4.28Å; F320-L405 HydrophobicContact CE1-CB 3.76Å; F320-L405 HydrophobicContact CE1-CD2 4.47Å; F320-L405 HydrophobicContact CZ-CB 4.33Å; F320-L409 HydrophobicContact CB-CD1 3.56Å; F320-L409 HydrophobicContact CD1-CD1 4.3Å; F320-L409 HydrophobicContact CG-CD1 4.07Å; F320-I445 HydrophobicContact CD2-CG2 3.48Å; F320-I445 VanDerWaalsContact CD2-CG2 3.48Å; F320-I445 HydrophobicContact CE2-CG2 4.01Å; F320-Y446 PolarHBondContact N-O 2.7Å; F320-I447 HydrophobicContact CB-CD1 4.08Å; F320-I447 CarbonylContact O-C 3.57Å; F320-I447 WeakPolarHBondContact O-CA 3.3Å; F320-Q448 PolarHBondContact O-N 3.36Å
321	I	95.3	Very high	92.1	Very high	58 Å²	58	80.7 Å²	80.7	30%	0.297	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	138.4	167.5	-53.3	174.9	0	0	0	106.6	N323 D324 Q448 V450	I321-N323 WeakPolarHBondContact CG2-OD1 3.36Å; I321-N323 PolarHBondContact O-N 3.45Å; I321-N323 VanDerWaalsContact O-N 3.12Å; I321-D324 PolarHBondContact N-OD2 3.08Å; I321-D324 WeakPolarHBondContact O-CB 3.11Å; I321-D324 PolarHBondContact O-N 2.67Å; I321-Q448 HydrophobicContact CG1-CB 4.27Å; I321-V450 HydrophobicContact CG2-CG2 3.35Å
322	E	94.4	Very high	92.5	Very high	7 Å²	7	76.4 Å²	76.4	3%	0.033	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-26.5	-172.7	73.5	-165.4	150.8	0	0	114.4	D324 L409 R411 I447 Q448 V450	E322-D324 VanDerWaalsContact C-N 3.3Å; E322-L409 HydrophobicContact CB-CB 4.15Å; E322-R411 WeakPolarHBondContact OE2-CB 3.05Å; E322-R411 PolarHBondContact OE2-N 3.25Å; E322-I447 HydrophobicContact CB-CG2 3.66Å; E322-Q448 PolarHBondContact N-O 3.4Å; E322-Q448 VanDerWaalsContact N-O 3.11Å; E322-V450 HydrophobicContact CG-CB 3.88Å; E322-V450 HydrophobicContact CG-CG2 3.81Å; E322-V450 VanDerWaalsContact OE1-CA 3.27Å; E322-V450 WeakPolarHBondContact OE1-CA 3.5Å; E322-V450 WeakPolarHBondContact OE1-CB 3.11Å; E322-V450 PolarHBondContact OE1-N 2.8Å
323	N	93.2	Very high	93.2	Very high	100 Å²	100	69 Å²	69	54%	0.535	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	6.9	173.9	74	1.3	0	0	0	114.1	I321 Q325 V450	I321-N323 WeakPolarHBondContact CG2-OD1 3.36Å; I321-N323 PolarHBondContact O-N 3.45Å; I321-N323 VanDerWaalsContact O-N 3.12Å; N323-Q325 PolarHBondContact O-N 3.37Å; N323-V450 HydrophobicContact CB-CG1 4.45Å; N323-V450 HydrophobicContact CB-CG2 4.07Å
324	D	94.8	Very high	93.5	Very high	22 Å²	22	64.2 Å²	64.2	12%	0.118	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-55.4	136.5	172.9	-89.9	-42.3	0	0	0	109.5	F320 I321 E322 K328 L405	F320-D324 HydrophobicContact CD1-CB 4.39Å; I321-D324 PolarHBondContact N-OD2 3.08Å; I321-D324 WeakPolarHBondContact O-CB 3.11Å; I321-D324 PolarHBondContact O-N 2.67Å; E322-D324 VanDerWaalsContact C-N 3.3Å; D324-K328 HydrophobicContact CB-CB 4.27Å; D324-K328 HydrophobicContact CB-CG 4.26Å; D324-K328 IonicContact OD1-NZ 3.96Å; D324-L405 HydrophobicContact CB-CD2 4.05Å
325	Q	93.4	Very high	94	Very high	166 Å²	166	56.2 Å²	56.2	78%	0.776	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-69.1	142.7	179.2	-65.9	-174.3	-22.2	0	0	110.8	N323 G327 K328	N323-Q325 PolarHBondContact O-N 3.37Å; Q325-G327 PolarHBondContact O-N 3.17Å; Q325-K328 WeakPolarHBondContact O-CB 3.03Å; Q325-K328 PolarHBondContact O-N 2.75Å
326	I	93.5	Very high	93.9	Very high	99 Å²	99	56.7 Å²	56.7	51%	0.508	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	131.4	168.6	-62.9	171.6	0	0	0	108.6	D406 K408	I326-D406 WeakPolarHBondContact CG2-O 3.21Å; I326-K408 HydrophobicContact CD1-CG 4.23Å
327	G	93.1	Very high	93.6	Very high	31 Å²	31	54.9 Å²	54.9	32%	0.32	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.2	-5	-173.1	0	0	0	0	0	114.6	Q325 K329 L405	Q325-G327 PolarHBondContact O-N 3.17Å; G327-K329 WeakPolarHBondContact O-CG 3.14Å; G327-K329 PolarHBondContact O-N 3.49Å; G327-L405 PolarHBondContact N-O 3.37Å
328	K	95.3	Very high	93.1	Very high	86 Å²	86	54.8 Å²	54.8	37%	0.374	28%	0.276	S	S	.	.			trans	-57.7	135.1	172.1	-175.5	74.7	174.7	-152.9	0	110.5	F320 D324 Q325 Y330 Q404 L405	F320-K328 HydrophobicContact CD1-CG 4.16Å; F320-K328 HydrophobicContact CE1-CB 4.09Å; F320-K328 HydrophobicContact CE1-CG 3.87Å; D324-K328 HydrophobicContact CB-CB 4.27Å; D324-K328 HydrophobicContact CB-CG 4.26Å; D324-K328 IonicContact OD1-NZ 3.96Å; Q325-K328 WeakPolarHBondContact O-CB 3.03Å; Q325-K328 PolarHBondContact O-N 2.75Å; K328-Y330 HydrophobicContact CG-CE2 4.27Å; K328-Q404 CarbonylContact O-C 3.41Å; K328-Q404 WeakPolarHBondContact O-CA 3.39Å; K328-L405 HydrophobicContact CB-CB 4.34Å; K328-L405 PolarHBondContact O-N 2.82Å
329	K	94.5	Very high	92.5	Very high	82 Å²	82	54.5 Å²	54.5	36%	0.357	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	147.5	-176	-54.4	-173.1	-177.4	-177.1	0	113.2	G327 I390 E402 I403 Q404	G327-K329 WeakPolarHBondContact O-CG 3.14Å; G327-K329 PolarHBondContact O-N 3.49Å; K329-I390 HydrophobicContact CD-CD1 4.23Å; K329-E402 HydrophobicContact CB-CB 4.46Å; K329-E402 HydrophobicContact CD-CB 4.48Å; K329-E402 WeakPolarHBondContact CD-OE2 3.28Å; K329-E402 IonicContact NZ-OE2 3.6Å; K329-I403 CarbonylContact C-O 3.55Å; K329-I403 VanDerWaalsContact CA-O 3.23Å; K329-I403 WeakPolarHBondContact CA-O 3.43Å; K329-Q404 HydrophobicContact CG-CB 4.23Å; K329-Q404 HydrophobicContact CG-CG 4.19Å
330	Y	94.8	Very high	91.3	Very high	74 Å²	74	52.1 Å²	52.1	29%	0.29	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	139	166.7	-73.9	-85.3	0	0	0	110.3	I318 N319 F320 K328 E402 I403	I318-Y330 HydrophobicContact CG2-CD1 4.15Å; I318-Y330 HydrophobicContact CG2-CD2 3.58Å; I318-Y330 HydrophobicContact CG2-CE2 3.98Å; I318-Y330 HydrophobicContact CG2-CG 3.67Å; N319-Y330 VanDerWaalsContact O-CZ 3.31Å; N319-Y330 PolarHBondContact O-OH 3.28Å; F320-Y330 HydrophobicContact CD1-CD2 4.26Å; F320-Y330 AromaticContact CD1-CE2 3.73Å; F320-Y330 HydrophobicContact CD1-CE2 3.73Å; F320-Y330 HydrophobicContact CD2-CD2 4.28Å; F320-Y330 HydrophobicContact CD2-CE2 4.11Å; F320-Y330 AromaticContact CE1-CD2 3.68Å; F320-Y330 HydrophobicContact CE1-CD2 3.68Å; F320-Y330 AromaticContact CE1-CE2 3.59Å; F320-Y330 HydrophobicContact CE1-CE2 3.59Å; F320-Y330 AromaticContact CE2-CD2 3.73Å; F320-Y330 HydrophobicContact CE2-CD2 3.73Å; F320-Y330 HydrophobicContact CE2-CE2 4.01Å; F320-Y330 HydrophobicContact CG-CE2 4Å; F320-Y330 AromaticContact CZ-CD2 3.41Å; F320-Y330 HydrophobicContact CZ-CD2 3.41Å; F320-Y330 VanDerWaalsContact CZ-CD2 3.41Å; F320-Y330 AromaticContact CZ-CE2 3.77Å; F320-Y330 HydrophobicContact CZ-CE2 3.77Å; K328-Y330 HydrophobicContact CG-CE2 4.27Å; Y330-E402 CarbonylContact O-C 3.57Å; Y330-E402 VanDerWaalsContact O-CA 3.25Å; Y330-E402 WeakPolarHBondContact O-CA 3.31Å; Y330-I403 PolarHBondContact N-O 2.88Å; Y330-I403 PolarHBondContact O-N 2.89Å
331	Q	93.5	Very high	90	Very high	117 Å²	117	52.7 Å²	52.7	55%	0.547	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	136.6	175.7	-176.2	175.2	-3.6	0	0	110.4	Y316 L400	Y316-Q331 PolarHBondContact OH-O 3.45Å; Q331-L400 VanDerWaalsContact CD-CD1 3.42Å; Q331-L400 HydrophobicContact CG-CD1 3.68Å
332	L	94.5	Very high	89	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.016	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	154.4	175.6	-72.4	175.3	0	0	0	111	Y316 I318 L389 L401 I403 L421 L443	Y316-L332 HydrophobicContact CD1-CD2 3.95Å; Y316-L332 HydrophobicContact CE1-CD2 3.97Å; I318-L332 HydrophobicContact CD1-CD2 3.72Å; L332-L389 HydrophobicContact CD1-CD2 3.46Å; L332-L389 VanDerWaalsContact CD1-CD2 3.46Å; L332-L401 HydrophobicContact CB-CB 4.37Å; L332-L401 HydrophobicContact CB-CD2 3.89Å; L332-L401 HydrophobicContact CB-CG 3.98Å; L332-L401 HydrophobicContact CD1-CD2 4.21Å; L332-L401 HydrophobicContact CD1-CG 4.24Å; L332-L401 PolarHBondContact N-O 3.12Å; L332-I403 HydrophobicContact CD1-CB 3.82Å; L332-I403 HydrophobicContact CD1-CG2 4.32Å; L332-I403 HydrophobicContact CD2-CG2 4.35Å; L332-I403 HydrophobicContact CG-CB 4.2Å; L332-I403 HydrophobicContact CG-CG2 4.17Å; L332-L421 HydrophobicContact CB-CD2 4.43Å; L332-L421 HydrophobicContact CD1-CD1 4.27Å; L332-L421 HydrophobicContact CD1-CD2 4.05Å; L332-L443 HydrophobicContact CD2-CD1 3.84Å; L332-L443 HydrophobicContact CD2-CD2 4.28Å
333	P	93	Very high	88.3	Confident	17 Å²	17	51.6 Å²	51.6	11%	0.11	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-67.1	142.2	171.9	29.4	-33.8	0	0	0	110.5	W311 Y316 L441	W311-P333 HydrophobicContact CB-CB 4.26Å; W311-P333 HydrophobicContact CB-CG 4.37Å; Y316-P333 HydrophobicContact CD2-CG 3.89Å; Y316-P333 HydrophobicContact CE2-CG 4.13Å; Y316-P333 HydrophobicContact CG-CG 4.34Å; P333-L441 HydrophobicContact CG-CD2 3.41Å; P333-L441 VanDerWaalsContact CG-CD2 3.41Å
334	I	91.5	Very high	87.5	Confident	27 Å²	27	48.8 Å²	48.8	14%	0.138	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-95.2	146.6	-179.3	-55.9	178.3	0	0	0	108.3	Q310 Y348 Q399 L401	Q310-I334 PolarHBondContact N-O 2.85Å; I334-Y348 WeakPolarHBondContact CG2-OH 3.11Å; I334-Q399 VanDerWaalsContact CD1-C 3.42Å; I334-Q399 HydrophobicContact CD1-CB 3.88Å; I334-Q399 WeakPolarHBondContact CD1-O 3.24Å; I334-L401 HydrophobicContact CG1-CB 4.03Å
335	A	91.5	Very high	87	Confident	3 Å²	3	49.5 Å²	49.5	3%	0.025	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	147.1	170.2	0	0	0	0	0	110.9	P307 K308 F309 I346 Y348 A423	P307-A335 HydrophobicContact CB-CB 4.17Å; K308-A335 CarbonylContact O-C 3.55Å; K308-A335 VanDerWaalsContact O-CA 3.27Å; K308-A335 WeakPolarHBondContact O-CA 3.09Å; F309-A335 HydrophobicContact CD1-CB 3.9Å; F309-A335 HydrophobicContact CE1-CB 4.04Å; F309-A335 HydrophobicContact CG-CB 4.19Å; F309-A335 HydrophobicContact CZ-CB 4.43Å; A335-I346 HydrophobicContact CB-CD1 4Å; A335-I346 WeakPolarHBondContact O-CD1 3.15Å; A335-Y348 HydrophobicContact CB-CE1 4.17Å; A335-Y348 PolarHBondContact N-OH 2.83Å; A335-Y348 PolarHBondContact O-OH 3.06Å; A335-A423 HydrophobicContact CB-CB 3.51Å
336	I	89.1	Confident	86.8	Confident	74 Å²	74	42.6 Å²	42.6	38%	0.379	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	132.9	174.8	-61.7	-177.1	0	0	0	108.4	P307 K308 Q310	P307-I336 CarbonylContact C-O 3.52Å; K308-I336 PolarHBondContact N-O 3.26Å; K308-I336 PolarHBondContact O-N 2.97Å; Q310-I336 HydrophobicContact CG-CD1 3.83Å; Q310-I336 HydrophobicContact CG-CG1 4.11Å
337	D	88.1	Confident	86.7	Confident	13 Å²	13	41.7 Å²	41.7	7%	0.07	22%	0.217	C	C	.	.			trans	-112.3	134.6	170.1	-158.4	-38.4	0	0	0	109.1	N305 P307 D339 I346	N305-D337 WeakPolarHBondContact CB-OD1 3.28Å; P307-D337 WeakPolarHBondContact CD-OD2 3.28Å; P307-D337 HydrophobicContact CG-CB 4.43Å; P307-D337 VanDerWaalsContact CG-OD2 3.28Å; P307-D337 WeakPolarHBondContact CG-OD2 3.4Å; D337-D339 VanDerWaalsContact C-N 3.33Å; D337-D339 PolarHBondContact OD1-N 2.93Å; D337-D339 VanDerWaalsContact OD1-N 3.14Å; D337-I346 HydrophobicContact CB-CD1 4.03Å; D337-I346 HydrophobicContact CB-CG1 4.22Å
338	N	84.6	Confident	86.7	Confident	94 Å²	94	41.6 Å²	41.6	50%	0.503	21%	0.207	S	C	.	.			trans	-88	-2.3	-174.1	-73	-7.6	0	0	0	113.2	R213 N305	R213-N338 PolarHBondContact NH1-O 3.42Å; N305-N338 HydrophobicContact CB-CB 4.16Å
339	D	81.3	Confident	86.6	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.011	21%	0.213	C	C	.	.	S	Bend	trans	-72.1	-172.8	175.8	-66.7	-21	0	0	0	112.7	R213 N303 D304 N305 D337 H343 S344	R213-D339 PolarHBondContact NH1-O 3.02Å; N303-D339 WeakPolarHBondContact CA-OD2 3.44Å; N303-D339 PolarHBondContact OD1-OD2 3.12Å; D304-D339 PolarHBondContact N-OD2 3.1Å; N305-D339 WeakPolarHBondContact CB-OD1 3.33Å; N305-D339 PolarHBondContact N-OD1 2.86Å; N305-D339 PolarHBondContact N-OD2 3.39Å; N305-D339 PolarHBondContact ND2-OD1 3.12Å; D337-D339 VanDerWaalsContact C-N 3.33Å; D337-D339 PolarHBondContact OD1-N 2.93Å; D337-D339 VanDerWaalsContact OD1-N 3.14Å; D339-H343 HydrophobicContact CB-CB 3.36Å; D339-S344 WeakPolarHBondContact O-CB 3.42Å
340	L	72.3	Confident	86.5	Confident	20 Å²	20	41 Å²	41	11%	0.105	21%	0.209	C	C	.	.			trans	-115.4	148.6	-177.7	-84.6	157.8	0	0	0	114.3	R213 P273 D301 L342 H343	R213-L340 VanDerWaalsContact CZ-CD2 3.48Å; R213-L340 VanDerWaalsContact NH2-CG 3.34Å; P273-L340 HydrophobicContact CB-CB 3.66Å; P273-L340 HydrophobicContact CB-CD1 4.38Å; P273-L340 HydrophobicContact CB-CD2 4.4Å; P273-L340 HydrophobicContact CB-CG 4.38Å; P273-L340 HydrophobicContact CG-CB 3.86Å; D301-L340 HydrophobicContact CB-CB 3.74Å; D301-L340 HydrophobicContact CB-CD1 3.86Å; D301-L340 HydrophobicContact CB-CG 4.32Å; D301-L340 VanDerWaalsContact CG-CB 3.48Å; D301-L340 PolarHBondContact OD1-N 2.81Å; D301-L340 WeakPolarHBondContact OD2-CB 3.3Å; D301-L340 PolarHBondContact OD2-N 2.87Å; L340-L342 PolarHBondContact O-N 2.92Å; L340-H343 PolarHBondContact O-N 3.34Å; L340-H343 VanDerWaalsContact O-N 3.09Å
341	C	69.2	Low	86.2	Confident	11 Å²	11	42.6 Å²	42.6	7%	0.074	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	43.7	-106.3	178.7	-56.2	0	0	0	0	114	C247 P273 S344 N345	C247-C341 WeakPolarHBondContact CA-SG 3.2Å; C247-C341 HydrophobicContact CB-CB 3.87Å; C247-C341 WeakPolarHBondContact CB-SG 3.37Å; C247-C341 VanDerWaalsContact SG-CA 3.5Å; C247-C341 WeakPolarHBondContact SG-CB 3.36Å; C247-C341 CovalentContact SG-SG 2.02Å; C247-C341 PolarHBondContact SG-SG 3.4Å; P273-C341 HydrophobicContact CB-CB 4.15Å; P273-C341 WeakPolarHBondContact CB-SG 3.26Å; P273-C341 VanDerWaalsContact CD-SG 3.59Å; P273-C341 HydrophobicContact CG-CB 3.64Å; P273-C341 WeakPolarHBondContact CG-SG 3.12Å; C341-S344 PolarHBondContact N-OG 3.29Å; C341-S344 PolarHBondContact O-N 3.3Å; C341-S344 PolarHBondContact O-OG 3.21Å; C341-N345 PolarHBondContact O-N 2.89Å; C341-N345 PolarHBondContact O-OD1 3.06Å
342	L	73.4	Confident	85.8	Confident	37 Å²	37	39.4 Å²	39.4	19%	0.194	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-42.6	-174.7	-169.3	72.7	0	0	0	109.8	L340 S344 N345 H426 Y428	L340-L342 PolarHBondContact O-N 2.92Å; L342-S344 PolarHBondContact O-N 3.3Å; L342-N345 VanDerWaalsContact O-CB 3.31Å; L342-N345 WeakPolarHBondContact O-CB 3.23Å; L342-N345 PolarHBondContact O-N 3.16Å; L342-H426 HydrophobicContact CD1-CB 3.84Å; L342-H426 HydrophobicContact CD2-CB 4.34Å; L342-H426 HydrophobicContact CG-CB 3.62Å; L342-H426 WeakPolarHBondContact O-CB 3.37Å; L342-Y428 HydrophobicContact CB-CD2 4.11Å; L342-Y428 HydrophobicContact CB-CE1 4.24Å; L342-Y428 HydrophobicContact CB-CE2 3.39Å; L342-Y428 VanDerWaalsContact CB-CZ 3.46Å; L342-Y428 HydrophobicContact CD2-CD1 3.54Å; L342-Y428 HydrophobicContact CD2-CD2 3.8Å; L342-Y428 HydrophobicContact CD2-CE1 3.5Å; L342-Y428 HydrophobicContact CD2-CE2 3.77Å; L342-Y428 HydrophobicContact CD2-CG 3.68Å; L342-Y428 HydrophobicContact CG-CE1 4.44Å; L342-Y428 HydrophobicContact CG-CE2 4.2Å
343	H	78.9	Confident	85.3	Confident	5 Å²	5	41.9 Å²	41.9	2%	0.023	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-32.1	176.1	-58.9	160	0	0	0	112.2	D301 N303 D339 L340 N345 H426 Y428 D431	D301-H343 IonicContact OD2-CG 2.69Å; D301-H343 IonicContact OD2-ND1 3.59Å; D301-H343 PolarHBondContact OD2-ND1 2.98Å; D301-H343 VanDerWaalsContact OD2-ND1 3.11Å; N303-H343 HydrophobicContact CB-CB 4.37Å; N303-H343 PolarHBondContact N-CE1 3.45Å; N303-H343 PolarHBondContact N-ND1 2.98Å; N303-H343 VanDerWaalsContact OD1-CB 3.32Å; N303-H343 WeakPolarHBondContact OD1-CB 3.16Å; D339-H343 HydrophobicContact CB-CB 3.36Å; L340-H343 PolarHBondContact O-N 3.34Å; L340-H343 VanDerWaalsContact O-N 3.09Å; H343-N345 VanDerWaalsContact C-N 3.32Å; H343-N345 PolarHBondContact O-N 2.9Å; H343-H426 VanDerWaalsContact CA-O 3.3Å; H343-H426 WeakPolarHBondContact CA-O 3.31Å; H343-H426 PolarHBondContact CD2-O 2.65Å; H343-Y428 AromaticContact NE2-CD2 3.49Å; H343-Y428 WeakPolarHBondContact NE2-CD2 3.45Å; H343-D431 IonicContact CE1-OD2 3.11Å; H343-D431 PolarHBondContact CE1-OD2 2.65Å; H343-D431 VanDerWaalsContact CE1-OD2 3.27Å; H343-D431 IonicContact NE2-OD2 3.27Å; H343-D431 PolarHBondContact NE2-OD2 2.86Å
344	S	78.4	Confident	84.3	Confident	42 Å²	42	46.2 Å²	46.2	29%	0.294	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-8.5	173.1	67.8	0	0	0	0	115.8	D339 C341 L342	D339-S344 WeakPolarHBondContact O-CB 3.42Å; C341-S344 PolarHBondContact N-OG 3.29Å; C341-S344 PolarHBondContact O-N 3.3Å; C341-S344 PolarHBondContact O-OG 3.21Å; L342-S344 PolarHBondContact O-N 3.3Å
345	N	83.7	Confident	83.3	Confident	36 Å²	36	51.3 Å²	51.3	19%	0.193	26%	0.258	C	S	.	.			trans	-81.3	128.3	178.8	-73.1	-23.2	0	0	0	109.8	C341 L342 H343 D425 H426	C341-N345 PolarHBondContact O-N 2.89Å; C341-N345 PolarHBondContact O-OD1 3.06Å; L342-N345 VanDerWaalsContact O-CB 3.31Å; L342-N345 WeakPolarHBondContact O-CB 3.23Å; L342-N345 PolarHBondContact O-N 3.16Å; H343-N345 VanDerWaalsContact C-N 3.32Å; H343-N345 PolarHBondContact O-N 2.9Å; N345-D425 CarbonylContact O-C 3.57Å; N345-D425 WeakPolarHBondContact O-CA 3.49Å; N345-H426 HydrophobicContact CB-CB 4.44Å; N345-H426 WeakPolarHBondContact CB-ND1 3.31Å; N345-H426 PolarHBondContact O-N 3.49Å
346	I	88.4	Confident	82	Confident	21 Å²	21	53.7 Å²	53.7	11%	0.108	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	126.5	-177	-59.8	164	0	0	0	109.1	P307 A335 D337 Y348 A423 I424	P307-I346 HydrophobicContact CB-CD1 4.01Å; P307-I346 HydrophobicContact CB-CG1 4.18Å; P307-I346 HydrophobicContact CG-CG1 4.24Å; A335-I346 HydrophobicContact CB-CD1 4Å; A335-I346 WeakPolarHBondContact O-CD1 3.15Å; D337-I346 HydrophobicContact CB-CD1 4.03Å; D337-I346 HydrophobicContact CB-CG1 4.22Å; I346-Y348 HydrophobicContact CB-CE2 4.4Å; I346-Y348 HydrophobicContact CG2-CD1 4.43Å; I346-Y348 HydrophobicContact CG2-CD2 4.43Å; I346-Y348 HydrophobicContact CG2-CE1 3.94Å; I346-Y348 HydrophobicContact CG2-CE2 3.92Å; I346-A423 HydrophobicContact CG2-CB 3.72Å; I346-I424 CarbonylContact C-O 3.57Å; I346-I424 WeakPolarHBondContact CA-O 3.36Å
347	D	90.8	Very high	80.5	Confident	81 Å²	81	60 Å²	60	43%	0.433	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	145	163.6	-76.4	-16.7	0	0	0	110.5	I424 H426	D347-I424 PolarHBondContact N-O 3.06Å; D347-I424 PolarHBondContact O-N 2.92Å; D347-H426 IonicContact OD1-CE1 3.29Å; D347-H426 IonicContact OD1-NE2 3.53Å; D347-H426 PolarHBondContact OD1-NE2 3.37Å; D347-H426 VanDerWaalsContact OD1-NE2 3.14Å; D347-H426 IonicContact OD2-CD2 3.06Å; D347-H426 IonicContact OD2-CE1 2.85Å; D347-H426 IonicContact OD2-NE2 3.68Å; D347-H426 PolarHBondContact OD2-NE2 3.02Å
348	Y	93.9	Very high	78.9	Confident	29 Å²	29	60.7 Å²	60.7	11%	0.114	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	137.9	178	-62	-85.3	0	0	0	111.3	F309 I334 A335 I346 F391 L401 L421 L422 A423	F309-Y348 HydrophobicContact CE1-CD1 4.36Å; F309-Y348 AromaticContact CE1-CE1 3.91Å; F309-Y348 HydrophobicContact CE1-CE1 3.91Å; F309-Y348 HydrophobicContact CZ-CE1 4.38Å; I334-Y348 WeakPolarHBondContact CG2-OH 3.11Å; A335-Y348 HydrophobicContact CB-CE1 4.17Å; A335-Y348 PolarHBondContact N-OH 2.83Å; A335-Y348 PolarHBondContact O-OH 3.06Å; I346-Y348 HydrophobicContact CB-CE2 4.4Å; I346-Y348 HydrophobicContact CG2-CD1 4.43Å; I346-Y348 HydrophobicContact CG2-CD2 4.43Å; I346-Y348 HydrophobicContact CG2-CE1 3.94Å; I346-Y348 HydrophobicContact CG2-CE2 3.92Å; Y348-F391 HydrophobicContact CD2-CD2 4.19Å; Y348-F391 AromaticContact CE2-CD2 3.98Å; Y348-F391 HydrophobicContact CE2-CD2 3.98Å; Y348-F391 AromaticContact CE2-CE2 3.86Å; Y348-F391 HydrophobicContact CE2-CE2 3.86Å; Y348-L401 HydrophobicContact CD1-CD2 3.58Å; Y348-L401 HydrophobicContact CD2-CD1 3.83Å; Y348-L401 HydrophobicContact CD2-CD2 4.14Å; Y348-L401 HydrophobicContact CE1-CD2 3.76Å; Y348-L401 HydrophobicContact CE2-CD1 4.43Å; Y348-L401 HydrophobicContact CE2-CD2 4.32Å; Y348-L401 HydrophobicContact CG-CD1 3.91Å; Y348-L401 HydrophobicContact CG-CD2 3.78Å; Y348-L421 HydrophobicContact CD1-CD1 4.38Å; Y348-L422 VanDerWaalsContact CA-O 3.28Å; Y348-L422 WeakPolarHBondContact CA-O 3.38Å; Y348-A423 HydrophobicContact CD1-CB 4.23Å; Y348-A423 HydrophobicContact CE1-CB 3.94Å
349	Q	92.7	Very high	77	Confident	105 Å²	105	62.4 Å²	62.4	49%	0.491	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	150.7	175.9	-62.7	-176.6	-3.8	0	0	110.8	L422 I424	Q349-L422 HydrophobicContact CB-CB 4.32Å; Q349-L422 HydrophobicContact CB-CD1 4.37Å; Q349-L422 PolarHBondContact N-O 3.26Å; Q349-L422 PolarHBondContact O-N 3.28Å; Q349-I424 HydrophobicContact CG-CD1 4.06Å
350	L	92.2	Very high	74.9	Confident	51 Å²	51	66.3 Å²	66.3	27%	0.267	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130.8	170.8	-70.5	173.1	0	0	0	109.6	F387 L389 I403 L419 H420 L421 L443	L350-F387 HydrophobicContact CD1-CB 4.19Å; L350-L389 HydrophobicContact CD1-CD1 4.47Å; L350-L389 HydrophobicContact CD1-CD2 3.97Å; L350-L389 HydrophobicContact CD1-CG 3.85Å; L350-L389 HydrophobicContact CD2-CD1 4.39Å; L350-L389 HydrophobicContact CD2-CD2 4.23Å; L350-L389 HydrophobicContact CD2-CG 4.46Å; L350-L389 HydrophobicContact CG-CD1 3.84Å; L350-L389 HydrophobicContact CG-CD2 4.03Å; L350-L389 HydrophobicContact CG-CG 3.78Å; L350-I403 HydrophobicContact CD1-CD1 4Å; L350-I403 HydrophobicContact CD1-CG1 4.44Å; L350-L419 HydrophobicContact CD2-CD1 4.45Å; L350-H420 WeakPolarHBondContact CA-O 3.42Å; L350-L421 HydrophobicContact CD2-CB 4.41Å; L350-L421 HydrophobicContact CD2-CD1 3.97Å; L350-L443 HydrophobicContact CD2-CD2 4.1Å
351	E	89	Confident	73.2	Confident	107 Å²	107	70 Å²	70	50%	0.5	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	147.4	173.7	-173.2	175.2	-167.6	0	0	110	L419 H420 L422	E351-L419 CarbonylContact O-C 3.46Å; E351-L419 WeakPolarHBondContact O-CA 3.4Å; E351-H420 HydrophobicContact CB-CB 4.37Å; E351-H420 PolarHBondContact N-O 3.4Å; E351-H420 PolarHBondContact O-N 3.28Å; E351-L422 HydrophobicContact CB-CD1 4.27Å
352	W	85.5	Confident	71.8	Confident	49 Å²	49	76.9 Å²	76.9	19%	0.186	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	133.4	175.9	-75.9	83.8	0	0	0	110.9	K355 P356 Y417 L419	W352-K355 HydrophobicContact CB-CG 3.6Å; W352-K355 HydrophobicContact CD2-CG 4.09Å; W352-K355 HydrophobicContact CG-CD 4.5Å; W352-K355 HydrophobicContact CG-CG 3.69Å; W352-P356 HydrophobicContact CH2-CG 4.36Å; W352-P356 VanDerWaalsContact CZ3-CD 3.49Å; W352-P356 HydrophobicContact CZ3-CG 4.18Å; W352-Y417 AromaticContact CH2-CD1 3.12Å; W352-Y417 HydrophobicContact CH2-CD1 3.12Å; W352-Y417 AromaticContact CH2-CE1 3.44Å; W352-Y417 HydrophobicContact CH2-CE1 3.44Å; W352-Y417 VanDerWaalsContact CH2-CE1 3.44Å; W352-Y417 HydrophobicContact CH2-CG 4.25Å; W352-Y417 AromaticContact CZ2-CD1 3.84Å; W352-Y417 HydrophobicContact CZ2-CD1 3.84Å; W352-Y417 HydrophobicContact CZ2-CE1 4.07Å; W352-Y417 AromaticContact CZ3-CD1 3.67Å; W352-Y417 HydrophobicContact CZ3-CD1 3.67Å; W352-Y417 HydrophobicContact CZ3-CE1 4.34Å; W352-Y417 HydrophobicContact CZ3-CG 4.44Å; W352-L419 HydrophobicContact CB-CD2 4.46Å; W352-L419 HydrophobicContact CD2-CD2 3.54Å; W352-L419 HydrophobicContact CE3-CD2 3.76Å; W352-L419 HydrophobicContact CG-CD2 3.86Å; W352-L419 HydrophobicContact CZ2-CD2 4.47Å; W352-L419 HydrophobicContact CZ3-CD2 4.35Å
353	I	83.1	Confident	70.1	Confident	56 Å²	56	77.6 Å²	77.6	29%	0.287	40%	0.397	S	S	.	.	S	Bend	trans	-72.4	-50.8	172.4	-53.3	-170.7	0	0	0	109.5	E418 H420	I353-E418 HydrophobicContact CB-CB 4.07Å; I353-E418 HydrophobicContact CD1-CB 4.16Å; I353-E418 HydrophobicContact CG1-CB 4.23Å; I353-E418 PolarHBondContact N-O 3.2Å; I353-H420 VanDerWaalsContact CD1-CE1 3.42Å; I353-H420 WeakPolarHBondContact CD1-CE1 3.39Å
354	N	73.4	Confident	68	Low	107 Å²	107	83.9 Å²	83.9	57%	0.572	43%	0.43	S	S	*	.	S	Bend	trans	-138.2	109.1	177.4	-68.2	-53.7	0	0	0	108.2	P356	N354-P356 WeakPolarHBondContact O-CD 3.47Å
355	K	69.6	Low	65.7	Low	135 Å²	135	88.6 Å²	88.6	59%	0.587	45%	0.452	S	S	*	.			trans	-69	124.6	173.6	-73.4	-170.4	175.5	-168.5	0	109.5	W352 K357	W352-K355 HydrophobicContact CB-CG 3.6Å; W352-K355 HydrophobicContact CD2-CG 4.09Å; W352-K355 HydrophobicContact CG-CD 4.5Å; W352-K355 HydrophobicContact CG-CG 3.69Å; K355-K357 PolarHBondContact O-N 2.95Å
356	P	64.1	Low	63.2	Low	53 Å²	53	97 Å²	97	34%	0.344	48%	0.482	S	S	.	.			trans	-62.1	133.3	176	22.6	-29.4	0	0	0	109.8	W352 N354 I358 I414	W352-P356 HydrophobicContact CH2-CG 4.36Å; W352-P356 VanDerWaalsContact CZ3-CD 3.49Å; W352-P356 HydrophobicContact CZ3-CG 4.18Å; N354-P356 WeakPolarHBondContact O-CD 3.47Å; P356-I358 PolarHBondContact O-N 3.34Å; P356-I358 VanDerWaalsContact O-N 3.1Å; P356-I414 HydrophobicContact CG-CD1 3.88Å; P356-I414 HydrophobicContact CG-CG1 4.47Å
357	K	58.2	Low	60.3	Low	205 Å²	205	101.8 Å²	101.8	89%	0.891	51%	0.513	S	S	*	.			trans	-75	97.8	172.9	-72	-177.4	-179.7	177.8	0	108.5	K355 N359	K355-K357 PolarHBondContact O-N 2.95Å; K357-N359 PolarHBondContact O-N 3.05Å
358	I	55.4	Low	57.3	Low	29 Å²	29	104 Å²	104	15%	0.149	53%	0.53	C	S	.	.			trans	-73.3	118.8	174.2	-67.1	166.9	0	0	0	108.3	P356 N360 L363 I381 W413	P356-I358 PolarHBondContact O-N 3.34Å; P356-I358 VanDerWaalsContact O-N 3.1Å; I358-N360 PolarHBondContact O-N 3.19Å; I358-N360 VanDerWaalsContact O-N 3.11Å; I358-L363 HydrophobicContact CG2-CD1 3.67Å; I358-I381 HydrophobicContact CD1-CG2 3.88Å; I358-W413 HydrophobicContact CB-CZ2 4.42Å; I358-W413 HydrophobicContact CD1-CH2 4.11Å; I358-W413 HydrophobicContact CD1-CZ2 3.65Å; I358-W413 HydrophobicContact CG1-CZ2 4.01Å; I358-W413 HydrophobicContact CG2-CZ2 3.56Å
359	N	44	Very low	54.3	Low	129 Å²	129	110.6 Å²	110.6	69%	0.69	57%	0.567	S	S	*	*			trans	-70.9	105.1	169.4	-90	-18.8	0	0	0	109.3	K357 S361	K357-N359 PolarHBondContact O-N 3.05Å; N359-S361 PolarHBondContact O-N 2.87Å
360	N	37.2	Very low	51.3	Low	85 Å²	85	113.1 Å²	113.1	46%	0.455	58%	0.583	S	S	.	*	G	3₁₀ helix	trans	-59.8	-1.4	-179.1	-81	-21.9	0	0	0	115.7	I358 L362	I358-N360 PolarHBondContact O-N 3.19Å; I358-N360 VanDerWaalsContact O-N 3.11Å; N360-L362 VanDerWaalsContact C-N 3.32Å; N360-L362 PolarHBondContact O-N 3.27Å
361	S	36.7	Very low	48.5	Very low	98 Å²	98	116.7 Å²	116.7	69%	0.685	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-75.8	-13.1	-179.3	49.4	0	0	0	0	114.7	N359	N359-S361 PolarHBondContact O-N 2.87Å
362	L	39.4	Very low	46	Very low	154 Å²	154	117.6 Å²	117.6	81%	0.806	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-105.4	-0.6	-175	-79.7	155.3	0	0	0	115.2	N360	N360-L362 VanDerWaalsContact C-N 3.32Å; N360-L362 PolarHBondContact O-N 3.27Å
363	L	37.5	Very low	43.3	Very low	52 Å²	52	122.1 Å²	122.1	27%	0.272	65%	0.648	S	S	.	*			trans	-98.8	11.1	-168.3	-88.8	148.8	0	0	0	116.4	I358 N365 I381 W413	I358-L363 HydrophobicContact CG2-CD1 3.67Å; L363-N365 VanDerWaalsContact C-N 3.35Å; L363-N365 PolarHBondContact O-N 2.89Å; L363-I381 HydrophobicContact CB-CD1 3.96Å; L363-I381 HydrophobicContact CD1-CD1 3.37Å; L363-I381 HydrophobicContact CD1-CG2 4.18Å; L363-I381 HydrophobicContact CD2-CD1 3.6Å; L363-I381 HydrophobicContact CG-CD1 3.8Å; L363-W413 HydrophobicContact CD1-CH2 4.19Å; L363-W413 HydrophobicContact CD1-CZ2 3.7Å; L363-W413 HydrophobicContact CD2-CH2 4.06Å; L363-W413 HydrophobicContact CD2-CZ2 4.23Å; L363-W413 HydrophobicContact CG-CZ2 4.3Å
364	I	34.1	Very low	40.8	Very low	138 Å²	138	126 Å²	126	71%	0.708	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-11	-174.4	-62.7	177.6	0	0	0	113.4
365	N	31.1	Very low	38.7	Very low	140 Å²	140	126.7 Å²	126.7	75%	0.749	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-0.7	-167.4	-72.2	-13.2	0	0	0	117.3	L363	L363-N365 VanDerWaalsContact C-N 3.35Å; L363-N365 PolarHBondContact O-N 2.89Å
366	Y	31.6	Very low	37	Very low	212 Å²	212	126.1 Å²	126.1	83%	0.831	69%	0.686	S	S	*	*	S	Bend	trans	-107.7	56.2	175.1	-70.1	-73.1	0	0	0	112.5
367	T	27.7	Very low	35.3	Very low	122 Å²	122	129.2 Å²	129.2	75%	0.748	70%	0.7	S	S	*	*			trans	-142.8	86.4	161.5	48.8	0	0	0	0	110.2
368	T	27.7	Very low	34.1	Very low	129 Å²	129	126.7 Å²	126.7	79%	0.791	70%	0.696	S	S	*	*			trans	-131	61.7	160	50	0	0	0	0	110.5
369	D	30.3	Very low	32.9	Very low	166 Å²	166	133.5 Å²	133.5	89%	0.888	73%	0.727	S	S	*	*			trans	-115.4	110.9	146.3	-91	-33.2	0	0	0	108.7	T371	D369-T371 PolarHBondContact O-N 2.84Å
370	N	29.9	Very low	32.4	Very low	158 Å²	158	134.5 Å²	134.5	85%	0.845	72%	0.722	S	S	*	*			trans	-70.4	100.6	-178.9	-77.5	-54.6	0	0	0	110.6
371	T	34.2	Very low	32.7	Very low	127 Å²	127	132.7 Å²	132.7	78%	0.779	71%	0.712	S	S	*	*			trans	-159.4	117.5	143.8	38.3	0	0	0	0	111.9	D369	D369-T371 PolarHBondContact O-N 2.84Å
372	T	34.5	Very low	32.8	Very low	125 Å²	125	132.6 Å²	132.6	77%	0.767	70%	0.704	S	S	*	*			trans	66.8	100.2	150.7	57.9	0	0	0	0	120.4
373	N	29.6	Very low	33.3	Very low	144 Å²	144	128.6 Å²	128.6	77%	0.77	69%	0.689	S	S	*	*				39	104.9	126.5	-64.6	-12	0	0	0	118.9
374	N	31	Very low	34.5	Very low	137 Å²	137	128.8 Å²	128.8	73%	0.733	69%	0.69	S	S	*	*				159.7	121.6	108.3	-82.4	-24	0	0	0	110.6
375	T	29.9	Very low	36.7	Very low	123 Å²	123	127.2 Å²	127.2	76%	0.755	68%	0.683	S	S	*	*	S	Bend	trans	18	116.2	143.6	53.8	0	0	0	0	118.2
376	T	32	Very low	39.5	Very low	123 Å²	123	121.4 Å²	121.4	76%	0.755	65%	0.651	S	S	*	*			trans	120.7	57.4	160.6	68.5	0	0	0	0	116.3
377	N	30.2	Very low	42.5	Very low	117 Å²	117	112 Å²	112	63%	0.626	61%	0.614	S	S	*	*			trans	-119.7	35.4	-178.3	-78.6	2.4	0	0	0	115.7
378	N	31.7	Very low	45.6	Very low	153 Å²	153	107.9 Å²	107.9	82%	0.818	59%	0.59	S	S	*	*	S	Bend	trans	-103.8	11.1	172.4	-78.5	5.7	0	0	0	114.2
379	Q	31.6	Very low	48.7	Very low	172 Å²	172	103.9 Å²	103.9	80%	0.804	56%	0.564	S	S	*	*	S	Bend	trans	-119.6	1.7	176.2	-84.9	-177.5	-38.8	0	0	113.8
380	Y	32.7	Very low	51.6	Low	150 Å²	150	97.7 Å²	97.7	59%	0.588	53%	0.53	S	S	*	.	S	Bend	trans	-87.5	-18.9	-165.1	-101.1	-83.8	0	0	0	115.5	S383	Y380-S383 PolarHBondContact O-OG 3.46Å
381	I	42.3	Very low	54.4	Low	46 Å²	46	93.7 Å²	93.7	24%	0.236	51%	0.505	C	S	.	.	G	3₁₀ helix	trans	-82.7	-27.4	-172.3	-61.2	170.5	0	0	0	112	I358 L363 S383 I384 W413	I358-I381 HydrophobicContact CD1-CG2 3.88Å; L363-I381 HydrophobicContact CB-CD1 3.96Å; L363-I381 HydrophobicContact CD1-CD1 3.37Å; L363-I381 HydrophobicContact CD1-CG2 4.18Å; L363-I381 HydrophobicContact CD2-CD1 3.6Å; L363-I381 HydrophobicContact CG-CD1 3.8Å; I381-S383 PolarHBondContact O-N 2.95Å; I381-I384 PolarHBondContact O-N 2.03Å; I381-W413 HydrophobicContact CG2-CH2 3.71Å; I381-W413 HydrophobicContact CG2-CZ2 4.14Å
382	D	40	Very low	56.5	Low	96 Å²	96	91 Å²	91	51%	0.513	49%	0.486	S	S	.	.	G	3₁₀ helix	trans	-69.9	-2.8	175.9	-69.6	-22.5	0	0	0	114.1
383	S	49.6	Very low	58.3	Low	71 Å²	71	91 Å²	91	50%	0.497	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-113.6	-1.1	-175.1	70.7	0	0	0	0	115	Y380 I381 N385	Y380-S383 PolarHBondContact O-OG 3.46Å; I381-S383 PolarHBondContact O-N 2.95Å; S383-N385 PolarHBondContact O-N 3.45Å
384	I	62.4	Low	59.9	Low	55 Å²	55	88.8 Å²	88.8	28%	0.282	46%	0.463	S	S	.	.			trans	-76.5	112.9	-176.5	-57.4	176.5	0	0	0	109.3	I381 Y386 H407	I381-I384 PolarHBondContact O-N 2.03Å; I384-Y386 HydrophobicContact CB-CE2 4.4Å; I384-Y386 HydrophobicContact CG2-CD2 4.35Å; I384-Y386 HydrophobicContact CG2-CE2 4.23Å; I384-Y386 PolarHBondContact O-N 3.49Å; I384-H407 HydrophobicContact CG2-CB 4.5Å; I384-H407 VanDerWaalsContact CG2-CD2 3.44Å; I384-H407 WeakPolarHBondContact CG2-CD2 3.36Å
385	N	80.3	Confident	61.3	Low	105 Å²	105	87.6 Å²	87.6	56%	0.561	46%	0.456	S	S	*	.			trans	-83.4	99.2	170.4	-72.5	-15.8	0	0	0	108.7	S383 F387 H407	S383-N385 PolarHBondContact O-N 3.45Å; N385-F387 PolarHBondContact O-N 3.45Å; N385-H407 PolarHBondContact O-CD2 2.82Å; N385-H407 VanDerWaalsContact O-CD2 3.25Å
386	Y	90.2	Very high	62.5	Low	19 Å²	19	89.8 Å²	89.8	8%	0.075	46%	0.464	C	S	.	.	S	Bend	trans	-60.6	-23.8	178.4	-75.6	-93.9	0	0	0	113.7	I384 D406 H407 L409 W413 Y417	I384-Y386 HydrophobicContact CB-CE2 4.4Å; I384-Y386 HydrophobicContact CG2-CD2 4.35Å; I384-Y386 HydrophobicContact CG2-CE2 4.23Å; I384-Y386 PolarHBondContact O-N 3.49Å; Y386-D406 PolarHBondContact O-N 3.15Å; Y386-H407 HydrophobicContact CD1-CB 3.79Å; Y386-H407 HydrophobicContact CE1-CB 4.15Å; Y386-L409 HydrophobicContact CD1-CD2 4.17Å; Y386-W413 WeakPolarHBondContact OH-CZ3 3.32Å; Y386-Y417 AromaticContact CD2-CE1 3.78Å; Y386-Y417 HydrophobicContact CD2-CE1 3.78Å; Y386-Y417 HydrophobicContact CE2-CE1 4.36Å; Y386-Y417 AromaticContact CG-CE1 3.96Å; Y386-Y417 HydrophobicContact CG-CE1 3.96Å
387	F	94	Very high	63.7	Low	14 Å²	14	91.1 Å²	91.1	6%	0.061	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	140.4	-175.6	-51.2	-79.4	0	0	0	111.7	F320 L350 N385 I403 Q404 L405 L409 Y417 L419 I445	F320-F387 AromaticContact CD2-CE1 3.91Å; F320-F387 HydrophobicContact CD2-CE1 3.91Å; F320-F387 HydrophobicContact CE2-CD1 4.11Å; F320-F387 AromaticContact CE2-CE1 3.59Å; F320-F387 HydrophobicContact CE2-CE1 3.59Å; F320-F387 HydrophobicContact CZ-CD1 4.21Å; F320-F387 AromaticContact CZ-CE1 3.97Å; F320-F387 HydrophobicContact CZ-CE1 3.97Å; L350-F387 HydrophobicContact CD1-CB 4.19Å; N385-F387 PolarHBondContact O-N 3.45Å; F387-I403 HydrophobicContact CB-CD1 3.71Å; F387-I403 HydrophobicContact CB-CG1 3.78Å; F387-I403 HydrophobicContact CD1-CD1 4.17Å; F387-I403 HydrophobicContact CD1-CG1 4.27Å; F387-I403 HydrophobicContact CG-CD1 3.97Å; F387-I403 HydrophobicContact CG-CG1 4.3Å; F387-Q404 VanDerWaalsContact CA-O 3.25Å; F387-Q404 WeakPolarHBondContact CA-O 3.43Å; F387-L405 HydrophobicContact CD1-CD1 4.13Å; F387-L405 HydrophobicContact CE1-CD1 3.75Å; F387-L405 HydrophobicContact CZ-CD1 4.48Å; F387-L409 HydrophobicContact CZ-CD2 4.14Å; F387-Y417 HydrophobicContact CD2-CD1 4.44Å; F387-Y417 AromaticContact CE2-CD1 3.62Å; F387-Y417 HydrophobicContact CE2-CD1 3.62Å; F387-Y417 HydrophobicContact CE2-CD2 4.01Å; F387-Y417 AromaticContact CE2-CE1 3.97Å; F387-Y417 HydrophobicContact CE2-CE1 3.97Å; F387-Y417 HydrophobicContact CE2-CE2 4.35Å; F387-Y417 AromaticContact CE2-CG 3.68Å; F387-Y417 HydrophobicContact CE2-CG 3.68Å; F387-Y417 HydrophobicContact CZ-CD2 4.19Å; F387-Y417 HydrophobicContact CZ-CE2 4.4Å; F387-Y417 HydrophobicContact CZ-CG 4.31Å; F387-L419 HydrophobicContact CD2-CD1 4.06Å; F387-I445 HydrophobicContact CD1-CD1 4.14Å; F387-I445 HydrophobicContact CD2-CD1 3.82Å; F387-I445 HydrophobicContact CE1-CD1 3.95Å; F387-I445 HydrophobicContact CE1-CG2 4.41Å; F387-I445 HydrophobicContact CE2-CD1 3.62Å; F387-I445 HydrophobicContact CG-CD1 4.08Å; F387-I445 HydrophobicContact CZ-CD1 3.69Å; F387-I445 HydrophobicContact CZ-CG2 4.03Å
388	S	92.7	Very high	65.3	Low	35 Å²	35	89.9 Å²	89.9	25%	0.245	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	159.8	168.4	55.5	0	0	0	0	111.8	I403 Q404 D406	S388-I403 CarbonylContact O-C 3.48Å; S388-I403 WeakPolarHBondContact O-CA 3.5Å; S388-Q404 PolarHBondContact N-O 3.01Å; S388-Q404 PolarHBondContact O-N 2.82Å; S388-D406 WeakPolarHBondContact CB-OD2 3.21Å; S388-D406 PolarHBondContact N-OD2 2.95Å; S388-D406 VanDerWaalsContact OG-CG 3.25Å; S388-D406 PolarHBondContact OG-OD1 3.2Å; S388-D406 PolarHBondContact OG-OD2 3.2Å
389	L	94.3	Very high	67.6	Low	46 Å²	46	86.7 Å²	86.7	24%	0.241	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	136.8	173.8	-66.4	177.4	0	0	0	110.3	L332 L350 L401 E402 I403 L421	L332-L389 HydrophobicContact CD1-CD2 3.46Å; L332-L389 VanDerWaalsContact CD1-CD2 3.46Å; L350-L389 HydrophobicContact CD1-CD1 4.47Å; L350-L389 HydrophobicContact CD1-CD2 3.97Å; L350-L389 HydrophobicContact CD1-CG 3.85Å; L350-L389 HydrophobicContact CD2-CD1 4.39Å; L350-L389 HydrophobicContact CD2-CD2 4.23Å; L350-L389 HydrophobicContact CD2-CG 4.46Å; L350-L389 HydrophobicContact CG-CD1 3.84Å; L350-L389 HydrophobicContact CG-CD2 4.03Å; L350-L389 HydrophobicContact CG-CG 3.78Å; L389-L401 HydrophobicContact CB-CD1 4.45Å; L389-L401 HydrophobicContact CD2-CD1 4.47Å; L389-E402 CarbonylContact C-O 3.53Å; L389-E402 WeakPolarHBondContact CA-O 3.46Å; L389-I403 HydrophobicContact CD2-CB 4.28Å; L389-I403 HydrophobicContact CD2-CG1 4.47Å; L389-L421 HydrophobicContact CD1-CD1 3.73Å; L389-L421 HydrophobicContact CD2-CD1 4.15Å
390	I	91.3	Very high	70.3	Confident	36 Å²	36	79.9 Å²	79.9	19%	0.185	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	120.7	173.3	-62	176.2	0	0	0	107.6	K329 E402 Q404	K329-I390 HydrophobicContact CD-CD1 4.23Å; I390-E402 HydrophobicContact CB-CB 4.41Å; I390-E402 PolarHBondContact N-O 2.88Å; I390-E402 PolarHBondContact O-N 3.32Å; I390-Q404 HydrophobicContact CD1-CB 3.86Å; I390-Q404 HydrophobicContact CD1-CG 4.33Å; I390-Q404 HydrophobicContact CG1-CB 4.41Å
391	F	87.5	Confident	73.1	Confident	73 Å²	73	72.8 Å²	72.8	32%	0.32	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	114.9	176.8	-176.8	-109.5	0	0	0	110.3	Y348 K393 Q399 L400 L401	Y348-F391 HydrophobicContact CD2-CD2 4.19Å; Y348-F391 AromaticContact CE2-CD2 3.98Å; Y348-F391 HydrophobicContact CE2-CD2 3.98Å; Y348-F391 AromaticContact CE2-CE2 3.86Å; Y348-F391 HydrophobicContact CE2-CE2 3.86Å; F391-K393 HydrophobicContact CE1-CG 4.03Å; F391-K393 HydrophobicContact CZ-CG 4.42Å; F391-Q399 HydrophobicContact CE2-CB 4.06Å; F391-Q399 HydrophobicContact CZ-CB 4.12Å; F391-Q399 HydrophobicContact CZ-CG 4.24Å; F391-L400 WeakPolarHBondContact CA-O 3.19Å; F391-L401 HydrophobicContact CB-CD1 4.21Å; F391-L401 HydrophobicContact CD2-CB 4.28Å; F391-L401 HydrophobicContact CD2-CD1 4.11Å
392	N	79.5	Confident	75.6	Confident	71 Å²	71	72.2 Å²	72.2	38%	0.38	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	122.2	-177.6	-70.3	-32.8	0	0	0	110.5	I394 L400	N392-I394 PolarHBondContact O-N 3.24Å; N392-L400 PolarHBondContact N-O 2.91Å; N392-L400 PolarHBondContact O-N 3.07Å
393	K	71.8	Confident	78.3	Confident	126 Å²	126	67.7 Å²	67.7	55%	0.548	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	99.7	165.6	-68.7	-176.2	179.3	177.3	0	107.9	F391 Q399	F391-K393 HydrophobicContact CE1-CG 4.03Å; F391-K393 HydrophobicContact CZ-CG 4.42Å; K393-Q399 HydrophobicContact CG-CG 4.37Å
394	I	63.4	Low	80.4	Confident	97 Å²	97	66.2 Å²	66.2	50%	0.497	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	-48.1	-177	-59.3	172.4	0	0	0	109.9	N392 N398 L400	N392-I394 PolarHBondContact O-N 3.24Å; I394-N398 HydrophobicContact CB-CB 4.19Å; I394-N398 WeakPolarHBondContact CB-O 3.38Å; I394-N398 PolarHBondContact N-O 2.81Å; I394-L400 HydrophobicContact CD1-CB 3.94Å; I394-L400 HydrophobicContact CD1-CD2 4.23Å; I394-L400 HydrophobicContact CG1-CB 4.47Å
395	N	60.2	Low	82	Confident	112 Å²	112	63.6 Å²	63.6	60%	0.599	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.1	168.4	176.4	-73.9	-30.9	0	0	0	108.7	N397 N398	N395-N397 PolarHBondContact O-N 3Å; N395-N398 HydrophobicContact CB-CB 4.46Å; N395-N398 PolarHBondContact N-O 3.07Å; N395-N398 PolarHBondContact O-N 3.5Å
396	N	54.4	Low	82.6	Confident	169 Å²	169	60.9 Å²	60.9	90%	0.904	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	-22.5	178.9	-76.2	-7	0	0	0	114.6
397	N	57.2	Low	82.7	Confident	150 Å²	150	63.8 Å²	63.8	80%	0.802	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	-12.7	179.8	-61.6	-1.8	0	0	0	114.2	N395	N395-N397 PolarHBondContact O-N 3Å
398	N	64.4	Low	82.5	Confident	92 Å²	92	71.2 Å²	71.2	49%	0.492	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	99.9	-175	-73.3	11.5	0	0	0	109.7	I394 N395	I394-N398 HydrophobicContact CB-CB 4.19Å; I394-N398 WeakPolarHBondContact CB-O 3.38Å; I394-N398 PolarHBondContact N-O 2.81Å; N395-N398 HydrophobicContact CB-CB 4.46Å; N395-N398 PolarHBondContact N-O 3.07Å; N395-N398 PolarHBondContact O-N 3.5Å
399	Q	79.7	Confident	82.6	Confident	85 Å²	85	70.1 Å²	70.1	40%	0.397	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	146.1	167	-58.2	-177.5	-2.1	0	0	108.4	I334 F391 K393	I334-Q399 VanDerWaalsContact CD1-C 3.42Å; I334-Q399 HydrophobicContact CD1-CB 3.88Å; I334-Q399 WeakPolarHBondContact CD1-O 3.24Å; F391-Q399 HydrophobicContact CE2-CB 4.06Å; F391-Q399 HydrophobicContact CZ-CB 4.12Å; F391-Q399 HydrophobicContact CZ-CG 4.24Å; K393-Q399 HydrophobicContact CG-CG 4.37Å
400	L	87.7	Confident	82.6	Confident	30 Å²	30	71 Å²	71	16%	0.157	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	122.8	176.8	-174.5	73	0	0	0	108.7	Q331 F391 N392 I394 E402	Q331-L400 VanDerWaalsContact CD-CD1 3.42Å; Q331-L400 HydrophobicContact CG-CD1 3.68Å; F391-L400 WeakPolarHBondContact CA-O 3.19Å; N392-L400 PolarHBondContact N-O 2.91Å; N392-L400 PolarHBondContact O-N 3.07Å; I394-L400 HydrophobicContact CD1-CB 3.94Å; I394-L400 HydrophobicContact CD1-CD2 4.23Å; I394-L400 HydrophobicContact CG1-CB 4.47Å; L400-E402 HydrophobicContact CD2-CG 3.73Å; L400-E402 HydrophobicContact CG-CG 3.79Å
401	L	92.9	Very high	82.8	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	124.7	169.2	-177.3	67.2	0	0	0	108.1	L332 I334 Y348 L389 F391 L421	L332-L401 HydrophobicContact CB-CB 4.37Å; L332-L401 HydrophobicContact CB-CD2 3.89Å; L332-L401 HydrophobicContact CB-CG 3.98Å; L332-L401 HydrophobicContact CD1-CD2 4.21Å; L332-L401 HydrophobicContact CD1-CG 4.24Å; L332-L401 PolarHBondContact N-O 3.12Å; I334-L401 HydrophobicContact CG1-CB 4.03Å; Y348-L401 HydrophobicContact CD1-CD2 3.58Å; Y348-L401 HydrophobicContact CD2-CD1 3.83Å; Y348-L401 HydrophobicContact CD2-CD2 4.14Å; Y348-L401 HydrophobicContact CE1-CD2 3.76Å; Y348-L401 HydrophobicContact CE2-CD1 4.43Å; Y348-L401 HydrophobicContact CE2-CD2 4.32Å; Y348-L401 HydrophobicContact CG-CD1 3.91Å; Y348-L401 HydrophobicContact CG-CD2 3.78Å; L389-L401 HydrophobicContact CB-CD1 4.45Å; L389-L401 HydrophobicContact CD2-CD1 4.47Å; F391-L401 HydrophobicContact CB-CD1 4.21Å; F391-L401 HydrophobicContact CD2-CB 4.28Å; F391-L401 HydrophobicContact CD2-CD1 4.11Å; L401-L421 HydrophobicContact CD2-CD1 4.39Å; L401-L421 HydrophobicContact CD2-CD2 4.16Å
402	E	94.6	Very high	83.1	Confident	35 Å²	35	69.1 Å²	69.1	16%	0.164	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	143.5	177.8	-54.3	-178.9	114.7	0	0	109.8	K329 Y330 L389 I390 L400	K329-E402 HydrophobicContact CB-CB 4.46Å; K329-E402 HydrophobicContact CD-CB 4.48Å; K329-E402 WeakPolarHBondContact CD-OE2 3.28Å; K329-E402 IonicContact NZ-OE2 3.6Å; Y330-E402 CarbonylContact O-C 3.57Å; Y330-E402 VanDerWaalsContact O-CA 3.25Å; Y330-E402 WeakPolarHBondContact O-CA 3.31Å; L389-E402 CarbonylContact C-O 3.53Å; L389-E402 WeakPolarHBondContact CA-O 3.46Å; I390-E402 HydrophobicContact CB-CB 4.41Å; I390-E402 PolarHBondContact N-O 2.88Å; I390-E402 PolarHBondContact O-N 3.32Å; L400-E402 HydrophobicContact CD2-CG 3.73Å; L400-E402 HydrophobicContact CG-CG 3.79Å
403	I	95.5	Very high	83.5	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	132.5	163.2	-170.4	166.6	0	0	0	108.8	I318 K329 Y330 L332 L350 F387 S388 L389 L443 I445	I318-I403 HydrophobicContact CD1-CG2 3.6Å; K329-I403 CarbonylContact C-O 3.55Å; K329-I403 VanDerWaalsContact CA-O 3.23Å; K329-I403 WeakPolarHBondContact CA-O 3.43Å; Y330-I403 PolarHBondContact N-O 2.88Å; Y330-I403 PolarHBondContact O-N 2.89Å; L332-I403 HydrophobicContact CD1-CB 3.82Å; L332-I403 HydrophobicContact CD1-CG2 4.32Å; L332-I403 HydrophobicContact CD2-CG2 4.35Å; L332-I403 HydrophobicContact CG-CB 4.2Å; L332-I403 HydrophobicContact CG-CG2 4.17Å; L350-I403 HydrophobicContact CD1-CD1 4Å; L350-I403 HydrophobicContact CD1-CG1 4.44Å; F387-I403 HydrophobicContact CB-CD1 3.71Å; F387-I403 HydrophobicContact CB-CG1 3.78Å; F387-I403 HydrophobicContact CD1-CD1 4.17Å; F387-I403 HydrophobicContact CD1-CG1 4.27Å; F387-I403 HydrophobicContact CG-CD1 3.97Å; F387-I403 HydrophobicContact CG-CG1 4.3Å; S388-I403 CarbonylContact O-C 3.48Å; S388-I403 WeakPolarHBondContact O-CA 3.5Å; L389-I403 HydrophobicContact CD2-CB 4.28Å; L389-I403 HydrophobicContact CD2-CG1 4.47Å; I403-L443 HydrophobicContact CD1-CD2 3.69Å; I403-I445 HydrophobicContact CD1-CD1 3.81Å
404	Q	94.7	Very high	84.4	Confident	41 Å²	41	65.1 Å²	65.1	19%	0.192	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	140.8	179	-176.6	-178.6	-81.1	0	0	110.5	K328 K329 F387 S388 I390 D406	K328-Q404 CarbonylContact O-C 3.41Å; K328-Q404 WeakPolarHBondContact O-CA 3.39Å; K329-Q404 HydrophobicContact CG-CB 4.23Å; K329-Q404 HydrophobicContact CG-CG 4.19Å; F387-Q404 VanDerWaalsContact CA-O 3.25Å; F387-Q404 WeakPolarHBondContact CA-O 3.43Å; S388-Q404 PolarHBondContact N-O 3.01Å; S388-Q404 PolarHBondContact O-N 2.82Å; I390-Q404 HydrophobicContact CD1-CB 3.86Å; I390-Q404 HydrophobicContact CD1-CG 4.33Å; I390-Q404 HydrophobicContact CG1-CB 4.41Å; Q404-D406 PolarHBondContact NE2-OD1 3.49Å
405	L	95.5	Very high	85.8	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	122.1	169.6	-177.4	66.1	0	0	0	111.4	F320 D324 G327 K328 F387 H407 L409	F320-L405 HydrophobicContact CD1-CB 4.37Å; F320-L405 HydrophobicContact CD1-CD2 4.28Å; F320-L405 HydrophobicContact CE1-CB 3.76Å; F320-L405 HydrophobicContact CE1-CD2 4.47Å; F320-L405 HydrophobicContact CZ-CB 4.33Å; D324-L405 HydrophobicContact CB-CD2 4.05Å; G327-L405 PolarHBondContact N-O 3.37Å; K328-L405 HydrophobicContact CB-CB 4.34Å; K328-L405 PolarHBondContact O-N 2.82Å; F387-L405 HydrophobicContact CD1-CD1 4.13Å; F387-L405 HydrophobicContact CE1-CD1 3.75Å; F387-L405 HydrophobicContact CZ-CD1 4.48Å; L405-H407 VanDerWaalsContact CD1-O 3.23Å; L405-H407 WeakPolarHBondContact CD1-O 3.33Å; L405-H407 VanDerWaalsContact CG-O 3.31Å; L405-H407 WeakPolarHBondContact CG-O 3.07Å; L405-L409 HydrophobicContact CD1-CD1 3.75Å; L405-L409 HydrophobicContact CD1-CD2 3.69Å; L405-L409 HydrophobicContact CD1-CG 3.61Å; L405-L409 HydrophobicContact CD2-CD1 3.83Å; L405-L409 HydrophobicContact CD2-CG 4.09Å; L405-L409 HydrophobicContact CG-CD1 4.45Å; L405-L409 HydrophobicContact CG-CG 4.48Å
406	D	92.9	Very high	87.4	Confident	48 Å²	48	62.9 Å²	62.9	26%	0.257	31%	0.306	S	S	.	.			trans	-107.6	-18.9	-177.4	-71.2	-21.2	0	0	0	114.1	I326 Y386 S388 Q404	I326-D406 WeakPolarHBondContact CG2-O 3.21Å; Y386-D406 PolarHBondContact O-N 3.15Å; S388-D406 WeakPolarHBondContact CB-OD2 3.21Å; S388-D406 PolarHBondContact N-OD2 2.95Å; S388-D406 VanDerWaalsContact OG-CG 3.25Å; S388-D406 PolarHBondContact OG-OD1 3.2Å; S388-D406 PolarHBondContact OG-OD2 3.2Å; Q404-D406 PolarHBondContact NE2-OD1 3.49Å
407	H	91.4	Very high	89.2	Confident	80 Å²	80	54.9 Å²	54.9	37%	0.37	26%	0.263	S	S	.	.	S	Bend	trans	-128.9	157.8	-179.6	-66.2	-77.9	0	0	0	110.9	I384 N385 Y386 L405	I384-H407 HydrophobicContact CG2-CB 4.5Å; I384-H407 VanDerWaalsContact CG2-CD2 3.44Å; I384-H407 WeakPolarHBondContact CG2-CD2 3.36Å; N385-H407 PolarHBondContact O-CD2 2.82Å; N385-H407 VanDerWaalsContact O-CD2 3.25Å; Y386-H407 HydrophobicContact CD1-CB 3.79Å; Y386-H407 HydrophobicContact CE1-CB 4.15Å; L405-H407 VanDerWaalsContact CD1-O 3.23Å; L405-H407 WeakPolarHBondContact CD1-O 3.33Å; L405-H407 VanDerWaalsContact CG-O 3.31Å; L405-H407 WeakPolarHBondContact CG-O 3.07Å
408	K	91.6	Very high	90.9	Very high	170 Å²	170	50.5 Å²	50.5	74%	0.739	24%	0.238	S	C	*	.			trans	-63.1	140.5	172.4	-67.9	-171.5	177.3	-174.8	0	109.7	I326	I326-K408 HydrophobicContact CD1-CG 4.23Å
409	L	93.8	Very high	92.3	Very high	12 Å²	12	46.4 Å²	46.4	6%	0.063	22%	0.216	C	C	.	.			trans	-94	156.5	174.6	-62.6	168.4	0	0	0	109.1	F320 E322 Y386 F387 L405 Y417 I447	F320-L409 HydrophobicContact CB-CD1 3.56Å; F320-L409 HydrophobicContact CD1-CD1 4.3Å; F320-L409 HydrophobicContact CG-CD1 4.07Å; E322-L409 HydrophobicContact CB-CB 4.15Å; Y386-L409 HydrophobicContact CD1-CD2 4.17Å; F387-L409 HydrophobicContact CZ-CD2 4.14Å; L405-L409 HydrophobicContact CD1-CD1 3.75Å; L405-L409 HydrophobicContact CD1-CD2 3.69Å; L405-L409 HydrophobicContact CD1-CG 3.61Å; L405-L409 HydrophobicContact CD2-CD1 3.83Å; L405-L409 HydrophobicContact CD2-CG 4.09Å; L405-L409 HydrophobicContact CG-CD1 4.45Å; L405-L409 HydrophobicContact CG-CG 4.48Å; L409-Y417 HydrophobicContact CD2-CE2 4.3Å; L409-I447 HydrophobicContact CB-CG2 4.31Å; L409-I447 HydrophobicContact CD1-CD1 3.88Å; L409-I447 HydrophobicContact CD2-CD1 4.04Å; L409-I447 HydrophobicContact CG-CD1 4.46Å
410	D	93.9	Very high	93	Very high	64 Å²	64	44.7 Å²	44.7	34%	0.342	21%	0.208	S	C	.	.			trans	-151.2	108.4	176.7	173.1	-21.5	0	0	0	105.3	E412 W413 I414	D410-E412 VanDerWaalsContact C-N 3.35Å; D410-E412 WeakPolarHBondContact OD1-CB 3.31Å; D410-E412 PolarHBondContact OD1-N 3.23Å; D410-E412 VanDerWaalsContact OD1-N 3.08Å; D410-W413 HydrophobicContact CB-CB 4.22Å; D410-W413 PolarHBondContact O-N 3.48Å; D410-W413 PolarHBondContact OD1-N 2.8Å; D410-I414 PolarHBondContact O-N 2.7Å
411	R	95.3	Very high	93.3	Very high	21 Å²	21	43.2 Å²	43.2	8%	0.079	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-34.5	-175.3	-173.9	-159.7	62.1	77.2	-10.1	110.8	E322 W413 I414 D415 I447 D449 K504 I506	E322-R411 WeakPolarHBondContact OE2-CB 3.05Å; E322-R411 PolarHBondContact OE2-N 3.25Å; R411-W413 PolarHBondContact O-N 2.69Å; R411-I414 CarbonylContact O-C 3.53Å; R411-I414 PolarHBondContact O-N 3.31Å; R411-D415 HydrophobicContact CG-CB 3.89Å; R411-D415 PolarHBondContact O-N 3.04Å; R411-I447 HydrophobicContact CB-CB 4.3Å; R411-I447 HydrophobicContact CB-CG2 3.89Å; R411-I447 HydrophobicContact CG-CB 4.26Å; R411-I447 HydrophobicContact CG-CG2 4.33Å; R411-D449 IonicContact CZ-OD1 3.74Å; R411-D449 IonicContact NE-OD1 3.62Å; R411-D449 PolarHBondContact NE-OD1 2.96Å; R411-D449 IonicContact NH2-OD1 2.74Å; R411-D449 PolarHBondContact NH2-OD1 2.79Å; R411-K504 PolarHBondContact NH2-O 3.45Å; R411-I506 VanDerWaalsContact CZ-CD1 3.46Å
412	E	93.8	Very high	93.4	Very high	49 Å²	49	44.1 Å²	44.1	23%	0.229	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-25.2	177.8	-70.2	56.9	-115.4	0	0	110.9	D410 K504	D410-E412 VanDerWaalsContact C-N 3.35Å; D410-E412 WeakPolarHBondContact OD1-CB 3.31Å; D410-E412 PolarHBondContact OD1-N 3.23Å; D410-E412 VanDerWaalsContact OD1-N 3.08Å; E412-K504 HydrophobicContact CG-CB 3.67Å
413	W	89.2	Confident	93.4	Very high	99 Å²	99	42.4 Å²	42.4	38%	0.375	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-49.9	175.3	-163.9	26.4	0	0	0	114.2	I358 L363 I381 Y386 D410 R411	I358-W413 HydrophobicContact CB-CZ2 4.42Å; I358-W413 HydrophobicContact CD1-CH2 4.11Å; I358-W413 HydrophobicContact CD1-CZ2 3.65Å; I358-W413 HydrophobicContact CG1-CZ2 4.01Å; I358-W413 HydrophobicContact CG2-CZ2 3.56Å; L363-W413 HydrophobicContact CD1-CH2 4.19Å; L363-W413 HydrophobicContact CD1-CZ2 3.7Å; L363-W413 HydrophobicContact CD2-CH2 4.06Å; L363-W413 HydrophobicContact CD2-CZ2 4.23Å; L363-W413 HydrophobicContact CG-CZ2 4.3Å; I381-W413 HydrophobicContact CG2-CH2 3.71Å; I381-W413 HydrophobicContact CG2-CZ2 4.14Å; Y386-W413 WeakPolarHBondContact OH-CZ3 3.32Å; D410-W413 HydrophobicContact CB-CB 4.22Å; D410-W413 PolarHBondContact O-N 3.48Å; D410-W413 PolarHBondContact OD1-N 2.8Å; R411-W413 PolarHBondContact O-N 2.69Å
414	I	90.7	Very high	93.2	Very high	14 Å²	14	43.4 Å²	43.4	7%	0.072	20%	0.202	C	C	.	.			trans	-141.8	105.7	176.9	-55.6	174.7	0	0	0	109.2	P356 D410 R411 K416 Y417	P356-I414 HydrophobicContact CG-CD1 3.88Å; P356-I414 HydrophobicContact CG-CG1 4.47Å; D410-I414 PolarHBondContact O-N 2.7Å; R411-I414 CarbonylContact O-C 3.53Å; R411-I414 PolarHBondContact O-N 3.31Å; I414-K416 WeakPolarHBondContact CG2-O 3.41Å; I414-Y417 HydrophobicContact CB-CE2 4.2Å; I414-Y417 HydrophobicContact CD1-CE1 4.48Å; I414-Y417 HydrophobicContact CG2-CD2 4.13Å; I414-Y417 HydrophobicContact CG2-CE1 4.13Å; I414-Y417 HydrophobicContact CG2-CE2 3.67Å
415	D	92.7	Very high	93	Very high	95 Å²	95	41.4 Å²	41.4	51%	0.508	19%	0.193	S	C	.	.	S	Bend	trans	-82.8	-17.6	-177.9	65.5	-13.5	0	0	0	114	R411 I447	R411-D415 HydrophobicContact CG-CB 3.89Å; R411-D415 PolarHBondContact O-N 3.04Å; D415-I447 PolarHBondContact O-N 3.16Å
416	K	93.5	Very high	92.4	Very high	66 Å²	66	43.5 Å²	43.5	29%	0.287	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	135	-173.7	-175	-174.2	175.6	-168.4	0	112.6	I414 E418 I444 I445 Y446	I414-K416 WeakPolarHBondContact CG2-O 3.41Å; K416-E418 HydrophobicContact CD-CG 4.42Å; K416-E418 WeakPolarHBondContact CE-OE1 3.29Å; K416-E418 IonicContact NZ-OE1 3.79Å; K416-E418 PolarHBondContact NZ-OE1 3.04Å; K416-I444 HydrophobicContact CD-CG2 4.44Å; K416-I444 VanDerWaalsContact CE-CG2 3.49Å; K416-I444 HydrophobicContact CG-CG2 4.27Å; K416-I445 CarbonylContact C-O 3.59Å; K416-I445 WeakPolarHBondContact CA-O 3.26Å; K416-Y446 HydrophobicContact CB-CD1 4.41Å; K416-Y446 HydrophobicContact CD-CD1 4.39Å; K416-Y446 HydrophobicContact CD-CE1 3.78Å; K416-Y446 HydrophobicContact CG-CD1 4.13Å; K416-Y446 HydrophobicContact CG-CE1 4Å
417	Y	92.9	Very high	91.7	Very high	2 Å²	2	45 Å²	45	1%	0.008	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126.3	171.8	-59.6	-109.4	0	0	0	109.9	W352 Y386 F387 L409 I414 I444 I445 I447	W352-Y417 AromaticContact CH2-CD1 3.12Å; W352-Y417 HydrophobicContact CH2-CD1 3.12Å; W352-Y417 AromaticContact CH2-CE1 3.44Å; W352-Y417 HydrophobicContact CH2-CE1 3.44Å; W352-Y417 VanDerWaalsContact CH2-CE1 3.44Å; W352-Y417 HydrophobicContact CH2-CG 4.25Å; W352-Y417 AromaticContact CZ2-CD1 3.84Å; W352-Y417 HydrophobicContact CZ2-CD1 3.84Å; W352-Y417 HydrophobicContact CZ2-CE1 4.07Å; W352-Y417 AromaticContact CZ3-CD1 3.67Å; W352-Y417 HydrophobicContact CZ3-CD1 3.67Å; W352-Y417 HydrophobicContact CZ3-CE1 4.34Å; W352-Y417 HydrophobicContact CZ3-CG 4.44Å; Y386-Y417 AromaticContact CD2-CE1 3.78Å; Y386-Y417 HydrophobicContact CD2-CE1 3.78Å; Y386-Y417 HydrophobicContact CE2-CE1 4.36Å; Y386-Y417 AromaticContact CG-CE1 3.96Å; Y386-Y417 HydrophobicContact CG-CE1 3.96Å; F387-Y417 HydrophobicContact CD2-CD1 4.44Å; F387-Y417 AromaticContact CE2-CD1 3.62Å; F387-Y417 HydrophobicContact CE2-CD1 3.62Å; F387-Y417 HydrophobicContact CE2-CD2 4.01Å; F387-Y417 AromaticContact CE2-CE1 3.97Å; F387-Y417 HydrophobicContact CE2-CE1 3.97Å; F387-Y417 HydrophobicContact CE2-CE2 4.35Å; F387-Y417 AromaticContact CE2-CG 3.68Å; F387-Y417 HydrophobicContact CE2-CG 3.68Å; F387-Y417 HydrophobicContact CZ-CD2 4.19Å; F387-Y417 HydrophobicContact CZ-CE2 4.4Å; F387-Y417 HydrophobicContact CZ-CG 4.31Å; L409-Y417 HydrophobicContact CD2-CE2 4.3Å; I414-Y417 HydrophobicContact CB-CE2 4.2Å; I414-Y417 HydrophobicContact CD1-CE1 4.48Å; I414-Y417 HydrophobicContact CG2-CD2 4.13Å; I414-Y417 HydrophobicContact CG2-CE1 4.13Å; I414-Y417 HydrophobicContact CG2-CE2 3.67Å; Y417-I444 WeakPolarHBondContact O-CA 3.39Å; Y417-I445 PolarHBondContact N-O 3.13Å; Y417-I445 PolarHBondContact O-N 2.82Å; Y417-I447 HydrophobicContact CD2-CD1 4.01Å; Y417-I447 HydrophobicContact CD2-CG1 4.14Å; Y417-I447 HydrophobicContact CE2-CD1 3.88Å; Y417-I447 HydrophobicContact CE2-CG1 3.79Å
418	E	92.6	Very high	90.6	Very high	58 Å²	58	42.1 Å²	42.1	27%	0.271	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	108.5	172.9	-68.5	-172.9	167	0	0	109	I353 K416	I353-E418 HydrophobicContact CB-CB 4.07Å; I353-E418 HydrophobicContact CD1-CB 4.16Å; I353-E418 HydrophobicContact CG1-CB 4.23Å; I353-E418 PolarHBondContact N-O 3.2Å; K416-E418 HydrophobicContact CD-CG 4.42Å; K416-E418 WeakPolarHBondContact CE-OE1 3.29Å; K416-E418 IonicContact NZ-OE1 3.79Å; K416-E418 PolarHBondContact NZ-OE1 3.04Å
419	L	93.6	Very high	89.3	Confident	5 Å²	5	40.8 Å²	40.8	3%	0.026	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	149.9	-175.8	-54.5	176.6	0	0	0	110.4	L350 E351 W352 F387 L443 I445	L350-L419 HydrophobicContact CD2-CD1 4.45Å; E351-L419 CarbonylContact O-C 3.46Å; E351-L419 WeakPolarHBondContact O-CA 3.4Å; W352-L419 HydrophobicContact CB-CD2 4.46Å; W352-L419 HydrophobicContact CD2-CD2 3.54Å; W352-L419 HydrophobicContact CE3-CD2 3.76Å; W352-L419 HydrophobicContact CG-CD2 3.86Å; W352-L419 HydrophobicContact CZ2-CD2 4.47Å; W352-L419 HydrophobicContact CZ3-CD2 4.35Å; F387-L419 HydrophobicContact CD2-CD1 4.06Å; L419-L443 HydrophobicContact CB-CB 4.3Å; L419-L443 HydrophobicContact CD1-CD2 4.46Å; L419-L443 PolarHBondContact N-O 3.33Å; L419-L443 PolarHBondContact O-N 2.81Å; L419-L443 VanDerWaalsContact O-O 3.14Å; L419-I445 HydrophobicContact CD1-CD1 3.9Å
420	H	93.7	Very high	87.6	Confident	49 Å²	49	49.4 Å²	49.4	23%	0.227	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	124.3	162.3	-74.5	-47.1	0	0	0	109	L350 E351 I353 L422	L350-H420 WeakPolarHBondContact CA-O 3.42Å; E351-H420 HydrophobicContact CB-CB 4.37Å; E351-H420 PolarHBondContact N-O 3.4Å; E351-H420 PolarHBondContact O-N 3.28Å; I353-H420 VanDerWaalsContact CD1-CE1 3.42Å; I353-H420 WeakPolarHBondContact CD1-CE1 3.39Å; H420-L422 HydrophobicContact CB-CD2 4.01Å
421	L	95.2	Very high	86	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	111.6	164.2	179.1	65.5	0	0	0	107.9	F309 L332 Y348 L350 L389 L401 T440 L441	F309-L421 HydrophobicContact CE1-CD2 3.64Å; F309-L421 HydrophobicContact CE1-CG 4.02Å; F309-L421 HydrophobicContact CZ-CB 4.49Å; F309-L421 HydrophobicContact CZ-CD2 3.98Å; F309-L421 HydrophobicContact CZ-CG 3.84Å; L332-L421 HydrophobicContact CB-CD2 4.43Å; L332-L421 HydrophobicContact CD1-CD1 4.27Å; L332-L421 HydrophobicContact CD1-CD2 4.05Å; Y348-L421 HydrophobicContact CD1-CD1 4.38Å; L350-L421 HydrophobicContact CD2-CB 4.41Å; L350-L421 HydrophobicContact CD2-CD1 3.97Å; L389-L421 HydrophobicContact CD1-CD1 3.73Å; L389-L421 HydrophobicContact CD2-CD1 4.15Å; L401-L421 HydrophobicContact CD2-CD1 4.39Å; L401-L421 HydrophobicContact CD2-CD2 4.16Å; L421-T440 WeakPolarHBondContact O-CA 3.47Å; L421-L441 HydrophobicContact CB-CB 4.41Å; L421-L441 HydrophobicContact CD2-CD2 4.45Å; L421-L441 PolarHBondContact N-O 2.87Å; L421-L441 PolarHBondContact O-N 3.48Å
422	L	94.7	Very high	84.3	Confident	18 Å²	18	51.7 Å²	51.7	9%	0.094	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	131.1	179.4	-50.4	179.9	0	0	0	109.1	Y348 Q349 E351 H420 I424 T438 T439 T440	Y348-L422 VanDerWaalsContact CA-O 3.28Å; Y348-L422 WeakPolarHBondContact CA-O 3.38Å; Q349-L422 HydrophobicContact CB-CB 4.32Å; Q349-L422 HydrophobicContact CB-CD1 4.37Å; Q349-L422 PolarHBondContact N-O 3.26Å; Q349-L422 PolarHBondContact O-N 3.28Å; E351-L422 HydrophobicContact CB-CD1 4.27Å; H420-L422 HydrophobicContact CB-CD2 4.01Å; L422-I424 HydrophobicContact CB-CD1 4.36Å; L422-I424 HydrophobicContact CB-CG1 4.25Å; L422-T438 HydrophobicContact CB-CG2 4.11Å; L422-T438 HydrophobicContact CD2-CG2 4.39Å; L422-T439 CarbonylContact C-O 3.56Å; L422-T439 WeakPolarHBondContact CA-O 3.38Å; L422-T440 HydrophobicContact CD2-CG2 3.31Å
423	A	93.8	Very high	82.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	117.5	165.7	0	0	0	0	0	108.2	P307 F309 A335 I346 Y348 T438 T439	P307-A423 HydrophobicContact CB-CB 4.02Å; F309-A423 HydrophobicContact CE1-CB 4.16Å; F309-A423 HydrophobicContact CE2-CB 3.8Å; F309-A423 HydrophobicContact CZ-CB 3.5Å; F309-A423 VanDerWaalsContact CZ-CB 3.5Å; A335-A423 HydrophobicContact CB-CB 3.51Å; I346-A423 HydrophobicContact CG2-CB 3.72Å; Y348-A423 HydrophobicContact CD1-CB 4.23Å; Y348-A423 HydrophobicContact CE1-CB 3.94Å; A423-T438 CarbonylContact O-C 3.23Å; A423-T438 VanDerWaalsContact O-CA 3.26Å; A423-T438 WeakPolarHBondContact O-CA 3.43Å; A423-T439 PolarHBondContact N-O 3.23Å; A423-T439 PolarHBondContact O-N 2.76Å
424	I	92.7	Very high	81.5	Confident	20 Å²	20	55.2 Å²	55.2	10%	0.103	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	122.5	-171.8	-53.2	166.7	0	0	0	108	I346 D347 Q349 L422 Q436 H437 T438	I346-I424 CarbonylContact C-O 3.57Å; I346-I424 WeakPolarHBondContact CA-O 3.36Å; D347-I424 PolarHBondContact N-O 3.06Å; D347-I424 PolarHBondContact O-N 2.92Å; Q349-I424 HydrophobicContact CG-CD1 4.06Å; L422-I424 HydrophobicContact CB-CD1 4.36Å; L422-I424 HydrophobicContact CB-CG1 4.25Å; I424-Q436 HydrophobicContact CG2-CB 4.29Å; I424-H437 WeakPolarHBondContact CA-O 3.35Å; I424-T438 HydrophobicContact CG1-CG2 3.73Å
425	D	89.2	Confident	80.7	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	161.8	173.6	64	16.5	0	0	0	112	N303 P307 N345 Q436 H437	N303-D425 VanDerWaalsContact ND2-CG 3.31Å; N303-D425 PolarHBondContact ND2-OD2 2.91Å; N303-D425 PolarHBondContact OD1-OD2 2.84Å; P307-D425 HydrophobicContact CG-CB 3.9Å; N345-D425 CarbonylContact O-C 3.57Å; N345-D425 WeakPolarHBondContact O-CA 3.49Å; D425-Q436 PolarHBondContact O-NE2 3.15Å; D425-Q436 WeakPolarHBondContact OD1-CA 3.3Å; D425-Q436 WeakPolarHBondContact OD1-CB 3.27Å; D425-H437 PolarHBondContact N-O 2.93Å; D425-H437 PolarHBondContact OD1-N 2.85Å; D425-H437 WeakPolarHBondContact OD2-CA 3.27Å; D425-H437 WeakPolarHBondContact OD2-CB 3.29Å; D425-H437 IonicContact OD2-CD2 3.35Å; D425-H437 PolarHBondContact OD2-CD2 3.4Å; D425-H437 VanDerWaalsContact OD2-CD2 3.29Å; D425-H437 IonicContact OD2-CG 2.72Å; D425-H437 PolarHBondContact OD2-N 3.17Å
426	H	83.7	Confident	80.4	Confident	43 Å²	43	60.7 Å²	60.7	20%	0.199	27%	0.274	C	S	.	.			trans	-93.9	148.6	166.3	-62.4	171.9	0	0	0	109.5	L342 H343 N345 D347	L342-H426 HydrophobicContact CD1-CB 3.84Å; L342-H426 HydrophobicContact CD2-CB 4.34Å; L342-H426 HydrophobicContact CG-CB 3.62Å; L342-H426 WeakPolarHBondContact O-CB 3.37Å; H343-H426 VanDerWaalsContact CA-O 3.3Å; H343-H426 WeakPolarHBondContact CA-O 3.31Å; H343-H426 PolarHBondContact CD2-O 2.65Å; N345-H426 HydrophobicContact CB-CB 4.44Å; N345-H426 WeakPolarHBondContact CB-ND1 3.31Å; N345-H426 PolarHBondContact O-N 3.49Å; D347-H426 IonicContact OD1-CE1 3.29Å; D347-H426 IonicContact OD1-NE2 3.53Å; D347-H426 PolarHBondContact OD1-NE2 3.37Å; D347-H426 VanDerWaalsContact OD1-NE2 3.14Å; D347-H426 IonicContact OD2-CD2 3.06Å; D347-H426 IonicContact OD2-CE1 2.85Å; D347-H426 IonicContact OD2-NE2 3.68Å; D347-H426 PolarHBondContact OD2-NE2 3.02Å
427	Y	78.2	Confident	80.2	Confident	81 Å²	81	59.2 Å²	59.2	32%	0.318	27%	0.268	S	S	.	.			trans	-126.1	151.1	173.5	75	-68	0	0	0	109.5	K434 Q436	Y427-K434 HydrophobicContact CE2-CB 4.22Å; Y427-Q436 HydrophobicContact CD1-CB 4.49Å; Y427-Q436 HydrophobicContact CD1-CG 3.08Å; Y427-Q436 HydrophobicContact CE1-CG 3.47Å; Y427-Q436 VanDerWaalsContact CE1-CG 3.47Å; Y427-Q436 HydrophobicContact CG-CG 3.97Å
428	Y	67.6	Low	80.1	Confident	19 Å²	19	62.3 Å²	62.3	8%	0.075	29%	0.287	C	S	.	.			trans	-74.6	133.5	168.3	-76	-78	0	0	0	110	I250 L270 L272 L342 H343 Y430 D431	I250-Y428 WeakPolarHBondContact CD1-OH 3.38Å; L270-Y428 HydrophobicContact CD2-CD1 4.16Å; L270-Y428 HydrophobicContact CD2-CE1 3.88Å; L272-Y428 HydrophobicContact CD2-CD1 3.93Å; L272-Y428 HydrophobicContact CD2-CD2 3.49Å; L272-Y428 VanDerWaalsContact CD2-CD2 3.49Å; L272-Y428 HydrophobicContact CD2-CE1 3.85Å; L272-Y428 HydrophobicContact CD2-CE2 3.4Å; L272-Y428 VanDerWaalsContact CD2-CE2 3.4Å; L272-Y428 HydrophobicContact CD2-CG 3.76Å; L342-Y428 HydrophobicContact CB-CD2 4.11Å; L342-Y428 HydrophobicContact CB-CE1 4.24Å; L342-Y428 HydrophobicContact CB-CE2 3.39Å; L342-Y428 VanDerWaalsContact CB-CZ 3.46Å; L342-Y428 HydrophobicContact CD2-CD1 3.54Å; L342-Y428 HydrophobicContact CD2-CD2 3.8Å; L342-Y428 HydrophobicContact CD2-CE1 3.5Å; L342-Y428 HydrophobicContact CD2-CE2 3.77Å; L342-Y428 HydrophobicContact CD2-CG 3.68Å; L342-Y428 HydrophobicContact CG-CE1 4.44Å; L342-Y428 HydrophobicContact CG-CE2 4.2Å; H343-Y428 AromaticContact NE2-CD2 3.49Å; H343-Y428 WeakPolarHBondContact NE2-CD2 3.45Å; Y428-Y430 PolarHBondContact O-N 3.07Å; Y428-D431 VanDerWaalsContact O-CB 3.29Å; Y428-D431 WeakPolarHBondContact O-CB 3.41Å; Y428-D431 PolarHBondContact O-N 2.95Å
429	Q	65	Low	80.1	Confident	141 Å²	141	61 Å²	61	66%	0.659	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-23.4	176.2	-174.1	177.1	-5.7	0	0	113.4
430	Y	58.4	Low	80.1	Confident	193 Å²	193	64.8 Å²	64.8	76%	0.757	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-0.4	177.7	-58.7	-73.2	0	0	0	114	Y428	Y428-Y430 PolarHBondContact O-N 3.07Å
431	D	60	Low	80.1	Confident	23 Å²	23	62.9 Å²	62.9	12%	0.123	30%	0.298	C	S	.	.			trans	-62.2	140.6	171.8	-158.9	-14.7	0	0	0	109.3	H343 Y428 N433 K434	H343-D431 IonicContact CE1-OD2 3.11Å; H343-D431 PolarHBondContact CE1-OD2 2.65Å; H343-D431 VanDerWaalsContact CE1-OD2 3.27Å; H343-D431 IonicContact NE2-OD2 3.27Å; H343-D431 PolarHBondContact NE2-OD2 2.86Å; Y428-D431 VanDerWaalsContact O-CB 3.29Å; Y428-D431 WeakPolarHBondContact O-CB 3.41Å; Y428-D431 PolarHBondContact O-N 2.95Å; D431-N433 PolarHBondContact O-N 3.31Å; D431-N433 PolarHBondContact OD1-N 3.12Å; D431-K434 WeakPolarHBondContact O-CG 3.34Å
432	I	58.2	Low	80.1	Confident	110 Å²	110	64.2 Å²	64.2	56%	0.564	31%	0.307	S	S	*	.	S	Bend	trans	-69.7	-30.5	-176.6	-63.3	170.7	0	0	0	109.2	I108	I108-I432 HydrophobicContact CB-CD1 4.36Å; I108-I432 HydrophobicContact CD1-CD1 3.1Å; I108-I432 HydrophobicContact CG1-CD1 3.57Å; I108-I432 HydrophobicContact CG2-CB 4.48Å; I108-I432 HydrophobicContact CG2-CD1 3.97Å; I108-I432 HydrophobicContact CG2-CG2 4.45Å
433	N	59.3	Low	80.1	Confident	72 Å²	72	63.4 Å²	63.4	39%	0.385	30%	0.303	S	S	.	.	S	Bend	trans	-99	82.3	170.7	-69.5	-14.1	0	0	0	109.3	D431 K435	D431-N433 PolarHBondContact O-N 3.31Å; D431-N433 PolarHBondContact OD1-N 3.12Å; N433-K435 PolarHBondContact O-N 3.41Å
434	K	66.2	Low	80.1	Confident	150 Å²	150	64.2 Å²	64.2	65%	0.652	31%	0.307	S	S	*	.			trans	-67.8	61.8	175.3	-63.5	-177.2	178.7	-178.1	0	112.4	Y427 D431	Y427-K434 HydrophobicContact CE2-CB 4.22Å; D431-K434 WeakPolarHBondContact O-CG 3.34Å
435	K	74.5	Confident	80.2	Confident	134 Å²	134	63.3 Å²	63.3	58%	0.583	30%	0.303	S	S	*	.			trans	-135	115.9	-176.9	-167.7	176.2	179.5	-174.3	0	108.8	N303 N433	N303-K435 PolarHBondContact ND2-O 3.25Å; N433-K435 PolarHBondContact O-N 3.41Å
436	Q	85	Confident	80.5	Confident	90 Å²	90	67.8 Å²	67.8	42%	0.421	32%	0.32	S	S	.	.			trans	-73.7	137.1	162.4	-67.9	-176.9	-69.4	0	0	108.7	I424 D425 Y427	I424-Q436 HydrophobicContact CG2-CB 4.29Å; D425-Q436 PolarHBondContact O-NE2 3.15Å; D425-Q436 WeakPolarHBondContact OD1-CA 3.3Å; D425-Q436 WeakPolarHBondContact OD1-CB 3.27Å; Y427-Q436 HydrophobicContact CD1-CB 4.49Å; Y427-Q436 HydrophobicContact CD1-CG 3.08Å; Y427-Q436 HydrophobicContact CE1-CG 3.47Å; Y427-Q436 VanDerWaalsContact CE1-CG 3.47Å; Y427-Q436 HydrophobicContact CG-CG 3.97Å
437	H	89	Confident	81.1	Confident	35 Å²	35	66.3 Å²	66.3	16%	0.162	31%	0.314	C	S	.	.			trans	-94.8	140.2	166.5	-57.2	-75.6	0	0	0	110	N303 N305 V306 I424 D425	N303-H437 PolarHBondContact ND2-CD2 3.41Å; N303-H437 PolarHBondContact O-NE2 3.31Å; N305-H437 PolarHBondContact O-CD2 3.18Å; N305-H437 VanDerWaalsContact O-CD2 3.29Å; V306-H437 HydrophobicContact CB-CB 3.88Å; V306-H437 HydrophobicContact CG1-CB 3.59Å; I424-H437 WeakPolarHBondContact CA-O 3.35Å; D425-H437 PolarHBondContact N-O 2.93Å; D425-H437 PolarHBondContact OD1-N 2.85Å; D425-H437 WeakPolarHBondContact OD2-CA 3.27Å; D425-H437 WeakPolarHBondContact OD2-CB 3.29Å; D425-H437 IonicContact OD2-CD2 3.35Å; D425-H437 PolarHBondContact OD2-CD2 3.4Å; D425-H437 VanDerWaalsContact OD2-CD2 3.29Å; D425-H437 IonicContact OD2-CG 2.72Å; D425-H437 PolarHBondContact OD2-N 3.17Å
438	T	91.5	Very high	82	Confident	68 Å²	68	66.9 Å²	66.9	42%	0.417	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	132.9	179.1	-55.7	0	0	0	0	108.5	L422 A423 I424	L422-T438 HydrophobicContact CB-CG2 4.11Å; L422-T438 HydrophobicContact CD2-CG2 4.39Å; A423-T438 CarbonylContact O-C 3.23Å; A423-T438 VanDerWaalsContact O-CA 3.26Å; A423-T438 WeakPolarHBondContact O-CA 3.43Å; I424-T438 HydrophobicContact CG1-CG2 3.73Å
439	T	93.2	Very high	83.3	Confident	30 Å²	30	67.9 Å²	67.9	18%	0.184	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	151.2	167	56	0	0	0	0	111.2	V306 P307 L422 A423	V306-T439 HydrophobicContact CB-CG2 4.3Å; V306-T439 HydrophobicContact CG2-CG2 4.12Å; P307-T439 VanDerWaalsContact O-CB 3.23Å; P307-T439 WeakPolarHBondContact O-CB 3.45Å; P307-T439 WeakPolarHBondContact O-CG2 3.37Å; P307-T439 PolarHBondContact O-OG1 3.48Å; L422-T439 CarbonylContact C-O 3.56Å; L422-T439 WeakPolarHBondContact CA-O 3.38Å; A423-T439 PolarHBondContact N-O 3.23Å; A423-T439 PolarHBondContact O-N 2.76Å
440	T	93.7	Very high	84.7	Confident	85 Å²	85	62.8 Å²	62.8	52%	0.521	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	135.7	-172.1	66.7	0	0	0	0	109.6	L421 L422	L421-T440 WeakPolarHBondContact O-CA 3.47Å; L422-T440 HydrophobicContact CD2-CG2 3.31Å
441	L	94	Very high	86.5	Confident	8 Å²	8	54 Å²	54	4%	0.042	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	128	169.5	175.9	64.5	0	0	0	108.5	F309 P333 L421 L443	F309-L441 HydrophobicContact CD1-CB 4.45Å; F309-L441 HydrophobicContact CD1-CD2 4.16Å; F309-L441 HydrophobicContact CD2-CB 3.65Å; F309-L441 HydrophobicContact CE1-CB 4.48Å; F309-L441 HydrophobicContact CE2-CB 3.68Å; F309-L441 HydrophobicContact CG-CB 4.06Å; F309-L441 HydrophobicContact CG-CD2 4.19Å; F309-L441 HydrophobicContact CZ-CB 4.11Å; P333-L441 HydrophobicContact CG-CD2 3.41Å; P333-L441 VanDerWaalsContact CG-CD2 3.41Å; L421-L441 HydrophobicContact CB-CB 4.41Å; L421-L441 HydrophobicContact CD2-CD2 4.45Å; L421-L441 PolarHBondContact N-O 2.87Å; L421-L441 PolarHBondContact O-N 3.48Å; L441-L443 PolarHBondContact O-N 2.78Å
442	S	93.8	Very high	88.1	Confident	28 Å²	28	56.2 Å²	56.2	20%	0.196	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	117.4	176.7	-64.6	0	0	0	0	109.9	N315 Y316	N315-S442 CarbonylContact C-O 3.58Å; N315-S442 VanDerWaalsContact CA-O 3.25Å; N315-S442 WeakPolarHBondContact CA-O 3.48Å; N315-S442 VanDerWaalsContact OD1-CB 3.25Å; N315-S442 WeakPolarHBondContact OD1-CB 3.37Å; Y316-S442 PolarHBondContact N-O 2.82Å
443	L	94.5	Very high	89.8	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	119.7	176.3	-179	65.7	0	0	0	109.2	Y316 I318 L332 L350 I403 L419 L441 I445	Y316-L443 HydrophobicContact CD1-CD1 3.72Å; Y316-L443 HydrophobicContact CG-CD1 4.44Å; Y316-L443 WeakPolarHBondContact O-CA 3.26Å; I318-L443 HydrophobicContact CD1-CD1 3.71Å; I318-L443 HydrophobicContact CG1-CD1 3.97Å; L332-L443 HydrophobicContact CD2-CD1 3.84Å; L332-L443 HydrophobicContact CD2-CD2 4.28Å; L350-L443 HydrophobicContact CD2-CD2 4.1Å; I403-L443 HydrophobicContact CD1-CD2 3.69Å; L419-L443 HydrophobicContact CB-CB 4.3Å; L419-L443 HydrophobicContact CD1-CD2 4.46Å; L419-L443 PolarHBondContact N-O 3.33Å; L419-L443 PolarHBondContact O-N 2.81Å; L419-L443 VanDerWaalsContact O-O 3.14Å; L441-L443 PolarHBondContact O-N 2.78Å; L443-I445 HydrophobicContact CD2-CD1 4.15Å; L443-I445 HydrophobicContact CD2-CG1 4.31Å; L443-I445 HydrophobicContact CG-CD1 4.46Å; L443-I445 HydrophobicContact CG-CG1 4.08Å
444	I	94.4	Very high	91.4	Very high	18 Å²	18	53.7 Å²	53.7	9%	0.092	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	118	176.9	-58	176.3	0	0	0	108.2	N315 Y316 I317 I318 K416 Y417 Y446	N315-I444 HydrophobicContact CB-CD1 4.07Å; Y316-I444 PolarHBondContact O-N 2.78Å; I317-I444 VanDerWaalsContact CA-O 3.3Å; I317-I444 WeakPolarHBondContact CA-O 3.09Å; I317-I444 HydrophobicContact CG1-CB 4.43Å; I318-I444 PolarHBondContact N-O 3.39Å; K416-I444 HydrophobicContact CD-CG2 4.44Å; K416-I444 VanDerWaalsContact CE-CG2 3.49Å; K416-I444 HydrophobicContact CG-CG2 4.27Å; Y417-I444 WeakPolarHBondContact O-CA 3.39Å; I444-Y446 HydrophobicContact CG2-CD2 4.1Å; I444-Y446 HydrophobicContact CG2-CE1 4.37Å; I444-Y446 HydrophobicContact CG2-CE2 3.56Å
445	I	95.3	Very high	92.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	117.3	178.2	-48.7	177	0	0	0	108.4	I318 F320 F387 I403 K416 Y417 L419 L443 I447	I318-I445 HydrophobicContact CB-CG1 4.45Å; I318-I445 HydrophobicContact CB-CG2 4.47Å; I318-I445 CarbonylContact O-C 3.58Å; I318-I445 VanDerWaalsContact O-CA 3.3Å; I318-I445 WeakPolarHBondContact O-CA 3.23Å; F320-I445 HydrophobicContact CD2-CG2 3.48Å; F320-I445 VanDerWaalsContact CD2-CG2 3.48Å; F320-I445 HydrophobicContact CE2-CG2 4.01Å; F387-I445 HydrophobicContact CD1-CD1 4.14Å; F387-I445 HydrophobicContact CD2-CD1 3.82Å; F387-I445 HydrophobicContact CE1-CD1 3.95Å; F387-I445 HydrophobicContact CE1-CG2 4.41Å; F387-I445 HydrophobicContact CE2-CD1 3.62Å; F387-I445 HydrophobicContact CG-CD1 4.08Å; F387-I445 HydrophobicContact CZ-CD1 3.69Å; F387-I445 HydrophobicContact CZ-CG2 4.03Å; I403-I445 HydrophobicContact CD1-CD1 3.81Å; K416-I445 CarbonylContact C-O 3.59Å; K416-I445 WeakPolarHBondContact CA-O 3.26Å; Y417-I445 PolarHBondContact N-O 3.13Å; Y417-I445 PolarHBondContact O-N 2.82Å; L419-I445 HydrophobicContact CD1-CD1 3.9Å; L443-I445 HydrophobicContact CD2-CD1 4.15Å; L443-I445 HydrophobicContact CD2-CG1 4.31Å; L443-I445 HydrophobicContact CG-CD1 4.46Å; L443-I445 HydrophobicContact CG-CG1 4.08Å; I445-I447 HydrophobicContact CG2-CD1 4.13Å
446	Y	96.2	Very high	93.7	Very high	95 Å²	95	45.7 Å²	45.7	37%	0.373	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	138.4	171.2	-67.9	-75.8	0	0	0	110.3	I317 I318 N319 F320 K416 I444	I317-Y446 HydrophobicContact CG2-CD2 3.69Å; I317-Y446 HydrophobicContact CG2-CE2 3.85Å; I318-Y446 PolarHBondContact O-N 3.4Å; N319-Y446 WeakPolarHBondContact CA-O 3.18Å; F320-Y446 PolarHBondContact N-O 2.7Å; K416-Y446 HydrophobicContact CB-CD1 4.41Å; K416-Y446 HydrophobicContact CD-CD1 4.39Å; K416-Y446 HydrophobicContact CD-CE1 3.78Å; K416-Y446 HydrophobicContact CG-CD1 4.13Å; K416-Y446 HydrophobicContact CG-CE1 4Å; I444-Y446 HydrophobicContact CG2-CD2 4.1Å; I444-Y446 HydrophobicContact CG2-CE1 4.37Å; I444-Y446 HydrophobicContact CG2-CE2 3.56Å
447	I	96.2	Very high	93.9	Very high	11 Å²	11	42.7 Å²	42.7	6%	0.056	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	122.9	173.5	-48.8	-47.1	0	0	0	108.8	F320 E322 L409 R411 D415 Y417 I445	F320-I447 HydrophobicContact CB-CD1 4.08Å; F320-I447 CarbonylContact O-C 3.57Å; F320-I447 WeakPolarHBondContact O-CA 3.3Å; E322-I447 HydrophobicContact CB-CG2 3.66Å; L409-I447 HydrophobicContact CB-CG2 4.31Å; L409-I447 HydrophobicContact CD1-CD1 3.88Å; L409-I447 HydrophobicContact CD2-CD1 4.04Å; L409-I447 HydrophobicContact CG-CD1 4.46Å; R411-I447 HydrophobicContact CB-CB 4.3Å; R411-I447 HydrophobicContact CB-CG2 3.89Å; R411-I447 HydrophobicContact CG-CB 4.26Å; R411-I447 HydrophobicContact CG-CG2 4.33Å; D415-I447 PolarHBondContact O-N 3.16Å; Y417-I447 HydrophobicContact CD2-CD1 4.01Å; Y417-I447 HydrophobicContact CD2-CG1 4.14Å; Y417-I447 HydrophobicContact CE2-CD1 3.88Å; Y417-I447 HydrophobicContact CE2-CG1 3.79Å; I445-I447 HydrophobicContact CG2-CD1 4.13Å
448	Q	95.4	Very high	93.8	Very high	94 Å²	94	43.5 Å²	43.5	44%	0.439	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	138	176.9	-62.9	-173.4	-24	0	0	110.7	N319 F320 I321 E322	N319-Q448 HydrophobicContact CB-CG 4.4Å; F320-Q448 PolarHBondContact O-N 3.36Å; I321-Q448 HydrophobicContact CG1-CB 4.27Å; E322-Q448 PolarHBondContact N-O 3.4Å; E322-Q448 VanDerWaalsContact N-O 3.11Å
449	D	95.4	Very high	93.1	Very high	40 Å²	40	40.9 Å²	40.9	21%	0.214	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-67.8	141	-178.3	-172.7	74.3	0	0	0	112.7	R411 I506 N509	R411-D449 IonicContact CZ-OD1 3.74Å; R411-D449 IonicContact NE-OD1 3.62Å; R411-D449 PolarHBondContact NE-OD1 2.96Å; R411-D449 IonicContact NH2-OD1 2.74Å; R411-D449 PolarHBondContact NH2-OD1 2.79Å; D449-I506 PolarHBondContact OD1-N 3.41Å; D449-I506 PolarHBondContact OD2-N 3.45Å; D449-N509 PolarHBondContact OD2-ND2 2.86Å
450	V	94.7	Very high	92.1	Very high	33 Å²	33	44.7 Å²	44.7	20%	0.2	23%	0.227	C	C	.	.			trans	-127.4	145.5	169.8	176.5	0	0	0	0	106.4	I321 E322 N323 D452	I321-V450 HydrophobicContact CG2-CG2 3.35Å; E322-V450 HydrophobicContact CG-CB 3.88Å; E322-V450 HydrophobicContact CG-CG2 3.81Å; E322-V450 VanDerWaalsContact OE1-CA 3.27Å; E322-V450 WeakPolarHBondContact OE1-CA 3.5Å; E322-V450 WeakPolarHBondContact OE1-CB 3.11Å; E322-V450 PolarHBondContact OE1-N 2.8Å; N323-V450 HydrophobicContact CB-CG1 4.45Å; N323-V450 HydrophobicContact CB-CG2 4.07Å; V450-D452 PolarHBondContact O-N 3.15Å
451	N	95.6	Very high	91.1	Very high	9 Å²	9	44 Å²	44	5%	0.048	22%	0.217	C	C	.	.	S	Bend	trans	-73	76.9	-179.9	-163.5	26.1	0	0	0	111.5	D505 N509 D560 P564 R566	N451-D505 WeakPolarHBondContact CA-OD2 3.14Å; N451-D505 PolarHBondContact OD1-OD2 3.39Å; N451-N509 HydrophobicContact CB-CB 4.07Å; N451-N509 WeakPolarHBondContact OD1-CB 3.27Å; N451-N509 PolarHBondContact OD1-O 2.88Å; N451-D560 VanDerWaalsContact ND2-CG 3.26Å; N451-D560 PolarHBondContact ND2-OD1 3.22Å; N451-D560 VanDerWaalsContact ND2-OD1 3.13Å; N451-D560 PolarHBondContact ND2-OD2 2.81Å; N451-D560 PolarHBondContact OD1-OD2 3.4Å; N451-P564 PolarHBondContact ND2-O 3.45Å; N451-R566 WeakPolarHBondContact O-CD 3.42Å; N451-R566 PolarHBondContact O-NH1 3.33Å
452	D	94	Very high	90	Very high	70 Å²	70	43.6 Å²	43.6	37%	0.374	22%	0.215	S	C	.	.			trans	-112.4	-11	-171.6	103.6	-26.8	0	0	0	113.5	V450 D505 R566	V450-D452 PolarHBondContact O-N 3.15Å; D452-D505 PolarHBondContact N-OD2 2.91Å; D452-D505 VanDerWaalsContact N-OD2 3.13Å; D452-R566 VanDerWaalsContact C-CZ 3.41Å; D452-R566 PolarHBondContact O-NH1 3.07Å; D452-R566 PolarHBondContact O-NH2 3.15Å
453	C	94	Very high	88.9	Confident	27 Å²	27	43.9 Å²	43.9	18%	0.182	22%	0.215	C	C	.	.			trans	-93.9	160	164.7	-67.4	0	0	0	0	111.1	D503 K504 D505 R566	C453-D503 VanDerWaalsContact CB-OD1 3.29Å; C453-D503 WeakPolarHBondContact CB-OD1 3.37Å; C453-K504 HydrophobicContact CB-CB 4.37Å; C453-D505 WeakPolarHBondContact CB-OD1 3.47Å; C453-D505 PolarHBondContact N-OD1 3.07Å; C453-D505 PolarHBondContact N-OD2 3.35Å; C453-D505 PolarHBondContact SG-OD1 2.8Å; C453-D505 VanDerWaalsContact SG-OD1 3.4Å; C453-R566 WeakPolarHBondContact O-CD 3.41Å; C453-R566 PolarHBondContact O-NE 2.81Å
454	K	94	Very high	87.7	Confident	101 Å²	101	50.2 Å²	50.2	44%	0.439	25%	0.246	S	C	.	.			trans	-120.9	154.8	171.5	62.5	179.2	179.4	178.6	0	106.9	E456 R566	K454-E456 PolarHBondContact O-N 2.82Å; K454-R566 HydrophobicContact CB-CB 3.86Å
455	P	95.6	Very high	86.8	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.254	C	S	.	.			trans	-59	136.5	177	-24.8	33	0	0	0	110.3	A501 D503 I512 A558 D560 S568	P455-A501 HydrophobicContact CB-CB 4.21Å; P455-D503 WeakPolarHBondContact CA-OD2 3.27Å; P455-D503 WeakPolarHBondContact CD-OD2 3.43Å; P455-D503 WeakPolarHBondContact CG-OD2 3.3Å; P455-I512 HydrophobicContact CB-CD1 4.28Å; P455-I512 HydrophobicContact CB-CG1 4.28Å; P455-I512 HydrophobicContact CG-CG1 4.35Å; P455-A558 HydrophobicContact CB-CB 3.93Å; P455-D560 HydrophobicContact CG-CB 4.14Å; P455-S568 WeakPolarHBondContact O-CB 3.36Å; P455-S568 PolarHBondContact O-OG 2.93Å
456	E	92.5	Very high	85.9	Confident	117 Å²	117	52.8 Å²	52.8	55%	0.547	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	126.1	175.7	-68	-168.5	157.3	0	0	110.4	K454 N458 A501 I502	K454-E456 PolarHBondContact O-N 2.82Å; E456-N458 PolarHBondContact O-N 3.35Å; E456-A501 CarbonylContact O-C 3.49Å; E456-A501 WeakPolarHBondContact O-CA 3.12Å; E456-I502 PolarHBondContact N-O 3.11Å; E456-I502 PolarHBondContact O-N 2.82Å
457	F	90.2	Very high	84.9	Confident	26 Å²	26	52.4 Å²	52.4	11%	0.114	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	124.4	176.8	-74.5	-82.5	0	0	0	111	L459 F499 A501 Y514 I556 A558 S568 L570	F457-L459 PolarHBondContact O-N 2.77Å; F457-F499 HydrophobicContact CE1-CB 4.16Å; F457-A501 HydrophobicContact CD1-CB 4.11Å; F457-A501 HydrophobicContact CE1-CB 4.35Å; F457-A501 HydrophobicContact CG-CB 4.4Å; F457-Y514 HydrophobicContact CE1-CD1 4.2Å; F457-Y514 HydrophobicContact CE1-CE1 4.03Å; F457-I556 HydrophobicContact CE1-CG2 4.25Å; F457-I556 HydrophobicContact CZ-CG2 4.09Å; F457-A558 HydrophobicContact CE1-CB 4.11Å; F457-A558 HydrophobicContact CE2-CB 3.9Å; F457-A558 HydrophobicContact CZ-CB 3.55Å; F457-S568 WeakPolarHBondContact CE2-O 3.44Å; F457-S568 WeakPolarHBondContact CE2-OG 3.19Å; F457-L570 HydrophobicContact CD1-CB 4.13Å; F457-L570 HydrophobicContact CD1-CD2 4.03Å; F457-L570 HydrophobicContact CD2-CB 3.71Å; F457-L570 HydrophobicContact CE1-CB 4.09Å; F457-L570 HydrophobicContact CE1-CD2 4.3Å; F457-L570 HydrophobicContact CE2-CB 3.66Å; F457-L570 HydrophobicContact CG-CB 3.94Å; F457-L570 HydrophobicContact CG-CD2 4.35Å; F457-L570 HydrophobicContact CZ-CB 3.85Å
458	N	86.2	Confident	84.2	Confident	53 Å²	53	53.6 Å²	53.6	28%	0.283	27%	0.272	S	S	.	.			trans	-84.4	94.8	167.9	-174.7	-20.5	0	0	0	108.6	E456 I460 Q461 S462 H500 I502	E456-N458 PolarHBondContact O-N 3.35Å; N458-I460 VanDerWaalsContact C-N 3.28Å; N458-I460 PolarHBondContact O-N 2.91Å; N458-I460 PolarHBondContact OD1-N 2.67Å; N458-Q461 HydrophobicContact CB-CB 4.13Å; N458-Q461 PolarHBondContact O-N 2.93Å; N458-Q461 PolarHBondContact OD1-N 2.81Å; N458-Q461 VanDerWaalsContact OD1-N 3.12Å; N458-S462 WeakPolarHBondContact O-CB 3.33Å; N458-S462 PolarHBondContact O-N 3.27Å; N458-S462 PolarHBondContact O-OG 3.23Å; N458-H500 PolarHBondContact N-O 3.05Å; N458-I502 HydrophobicContact CB-CD1 4.32Å
459	L	77.5	Confident	83.3	Confident	12 Å²	12	52.4 Å²	52.4	6%	0.063	27%	0.274	C	S	.	.	H	α-helix	trans	-58.5	-39.4	179.7	-74.4	-173.2	0	0	0	112.9	F457 Q461 S462 L463 Y472 E480 L570	F457-L459 PolarHBondContact O-N 2.77Å; L459-Q461 VanDerWaalsContact C-N 3.34Å; L459-Q461 PolarHBondContact O-N 2.94Å; L459-S462 CarbonylContact O-C 3.53Å; L459-S462 PolarHBondContact O-N 2.8Å; L459-L463 WeakPolarHBondContact O-CB 3.36Å; L459-L463 WeakPolarHBondContact O-CD1 3.46Å; L459-L463 WeakPolarHBondContact O-CG 3.32Å; L459-L463 PolarHBondContact O-N 3.01Å; L459-Y472 HydrophobicContact CD1-CD2 3.88Å; L459-Y472 HydrophobicContact CD1-CE2 4.48Å; L459-Y472 HydrophobicContact CD1-CG 4.27Å; L459-E480 HydrophobicContact CD1-CB 3.84Å; L459-E480 HydrophobicContact CD1-CG 3.67Å; L459-E480 WeakPolarHBondContact CD1-OE2 3.31Å; L459-E480 HydrophobicContact CD2-CB 4.31Å; L459-E480 HydrophobicContact CG-CB 4.44Å; L459-E480 WeakPolarHBondContact CG-OE2 3.36Å; L459-L570 HydrophobicContact CD2-CD1 3.57Å
460	I	70.7	Confident	82.5	Confident	111 Å²	111	52.1 Å²	52.1	57%	0.569	27%	0.274	S	S	*	.	H	α-helix	trans	-63.1	-45.1	-177.3	-65.2	173.9	0	0	0	109.8	N458 S462 L463 M464	N458-I460 VanDerWaalsContact C-N 3.28Å; N458-I460 PolarHBondContact O-N 2.91Å; N458-I460 PolarHBondContact OD1-N 2.67Å; I460-S462 VanDerWaalsContact C-N 3.34Å; I460-L463 PolarHBondContact O-N 2.67Å; I460-M464 HydrophobicContact CG2-CE 3.45Å; I460-M464 VanDerWaalsContact CG2-CE 3.45Å; I460-M464 WeakPolarHBondContact O-CG 3.49Å; I460-M464 PolarHBondContact O-N 2.77Å
461	Q	73.4	Confident	81.7	Confident	69 Å²	69	54 Å²	54	32%	0.322	29%	0.285	S	S	.	.	H	α-helix	trans	-66.2	-39.9	175.3	-168.3	64	40.9	0	0	111.4	N458 L459 L463 M464 N465 H500	N458-Q461 HydrophobicContact CB-CB 4.13Å; N458-Q461 PolarHBondContact O-N 2.93Å; N458-Q461 PolarHBondContact OD1-N 2.81Å; N458-Q461 VanDerWaalsContact OD1-N 3.12Å; L459-Q461 VanDerWaalsContact C-N 3.34Å; L459-Q461 PolarHBondContact O-N 2.94Å; Q461-L463 VanDerWaalsContact C-N 3.3Å; Q461-L463 PolarHBondContact O-N 2.81Å; Q461-M464 PolarHBondContact O-N 3.44Å; Q461-N465 PolarHBondContact NE2-OD1 2.87Å; Q461-N465 WeakPolarHBondContact O-CB 3.49Å; Q461-N465 PolarHBondContact O-N 3.21Å; Q461-N465 VanDerWaalsContact O-N 3.08Å; Q461-N465 PolarHBondContact O-ND2 3.31Å; Q461-N465 PolarHBondContact O-OD1 2.97Å; Q461-H500 HydrophobicContact CB-CB 4.12Å; Q461-H500 HydrophobicContact CG-CB 3.87Å
462	S	70.8	Confident	80.6	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.7	-37.7	177	-57.2	0	0	0	0	111.6	N458 L459 I460 N465 T466 H500	N458-S462 WeakPolarHBondContact O-CB 3.33Å; N458-S462 PolarHBondContact O-N 3.27Å; N458-S462 PolarHBondContact O-OG 3.23Å; L459-S462 CarbonylContact O-C 3.53Å; L459-S462 PolarHBondContact O-N 2.8Å; I460-S462 VanDerWaalsContact C-N 3.34Å; S462-N465 PolarHBondContact O-N 3.07Å; S462-T466 VanDerWaalsContact O-CG2 3.23Å; S462-T466 WeakPolarHBondContact O-CG2 3.17Å; S462-T466 PolarHBondContact O-N 2.85Å; S462-H500 PolarHBondContact OG-N 3.24Å
463	L	70.4	Confident	79.3	Confident	35 Å²	35	59 Å²	59	18%	0.183	31%	0.306	C	S	.	.	H	α-helix	trans	-69	-42.1	174.4	-71.2	160	0	0	0	112.1	L459 I460 Q461 N465 T466 Y472 L482	L459-L463 WeakPolarHBondContact O-CB 3.36Å; L459-L463 WeakPolarHBondContact O-CD1 3.46Å; L459-L463 WeakPolarHBondContact O-CG 3.32Å; L459-L463 PolarHBondContact O-N 3.01Å; I460-L463 PolarHBondContact O-N 2.67Å; Q461-L463 VanDerWaalsContact C-N 3.3Å; Q461-L463 PolarHBondContact O-N 2.81Å; L463-N465 PolarHBondContact O-N 3.25Å; L463-T466 PolarHBondContact O-N 3.3Å; L463-T466 PolarHBondContact O-OG1 3.25Å; L463-Y472 HydrophobicContact CD1-CD1 3.36Å; L463-Y472 HydrophobicContact CD1-CE1 3.67Å; L463-Y472 HydrophobicContact CD1-CG 4.22Å; L463-Y472 HydrophobicContact CD2-CD1 4.15Å; L463-Y472 HydrophobicContact CG-CD1 4.36Å; L463-L482 HydrophobicContact CD2-CD1 3.57Å; L463-L482 HydrophobicContact CG-CD1 4.32Å
464	M	69	Low	77.6	Confident	134 Å²	134	62.2 Å²	62.2	66%	0.66	33%	0.325	S	S	*	.	H	α-helix	trans	-64.5	-24.5	176.2	-74.3	-162.7	-110.4	0	0	112.8	I460 Q461	I460-M464 HydrophobicContact CG2-CE 3.45Å; I460-M464 VanDerWaalsContact CG2-CE 3.45Å; I460-M464 WeakPolarHBondContact O-CG 3.49Å; I460-M464 PolarHBondContact O-N 2.77Å; Q461-M464 PolarHBondContact O-N 3.44Å
465	N	76.8	Confident	75.5	Confident	50 Å²	50	62.3 Å²	62.3	27%	0.267	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	0.3	179.8	-65.5	-13.1	0	0	0	114	Q461 S462 L463 K498	Q461-N465 PolarHBondContact NE2-OD1 2.87Å; Q461-N465 WeakPolarHBondContact O-CB 3.49Å; Q461-N465 PolarHBondContact O-N 3.21Å; Q461-N465 VanDerWaalsContact O-N 3.08Å; Q461-N465 PolarHBondContact O-ND2 3.31Å; Q461-N465 PolarHBondContact O-OD1 2.97Å; S462-N465 PolarHBondContact O-N 3.07Å; L463-N465 PolarHBondContact O-N 3.25Å; N465-K498 HydrophobicContact CB-CB 3.95Å; N465-K498 WeakPolarHBondContact CB-O 3.34Å; N465-K498 PolarHBondContact ND2-O 2.96Å; N465-K498 VanDerWaalsContact ND2-O 3.09Å
466	T	74.8	Confident	73.2	Confident	21 Å²	21	68.4 Å²	68.4	13%	0.129	36%	0.356	C	S	.	.			trans	-85.8	129.5	179.5	58	0	0	0	0	110.9	S462 L463 Y468 T470 I484 T497	S462-T466 VanDerWaalsContact O-CG2 3.23Å; S462-T466 WeakPolarHBondContact O-CG2 3.17Å; S462-T466 PolarHBondContact O-N 2.85Å; L463-T466 PolarHBondContact O-N 3.3Å; L463-T466 PolarHBondContact O-OG1 3.25Å; T466-Y468 VanDerWaalsContact C-N 3.29Å; T466-T470 HydrophobicContact CG2-CG2 3.47Å; T466-T470 VanDerWaalsContact CG2-CG2 3.47Å; T466-T470 WeakPolarHBondContact OG1-CG2 3.26Å; T466-T470 PolarHBondContact OG1-OG1 3.39Å; T466-I484 HydrophobicContact CG2-CD1 4.12Å; T466-T497 WeakPolarHBondContact CG2-OG1 3.3Å
467	T	76	Confident	71.1	Confident	87 Å²	87	70.3 Å²	70.3	53%	0.534	37%	0.37	S	S	.	.	S	Bend	trans	-81	-11.7	179.7	48.6	0	0	0	0	113.3	V495 I496	T467-V495 PolarHBondContact OG1-O 3.36Å; T467-I496 PolarHBondContact N-O 2.81Å; T467-I496 PolarHBondContact OG1-O 2.83Å
468	Y	82.1	Confident	69.3	Low	37 Å²	37	76.4 Å²	76.4	15%	0.145	40%	0.404	C	S	.	.	S	Bend	trans	-117	173.1	-173.9	-65.3	-75	0	0	0	112.5	T466 T470 E485 V486 P487 V490 Q494 I496	T466-Y468 VanDerWaalsContact C-N 3.29Å; Y468-T470 WeakPolarHBondContact O-CG2 3.35Å; Y468-T470 PolarHBondContact O-N 3.39Å; Y468-E485 VanDerWaalsContact CB-O 3.25Å; Y468-E485 WeakPolarHBondContact CB-O 3.16Å; Y468-V486 HydrophobicContact CD2-CG2 4Å; Y468-V486 HydrophobicContact CE1-CG1 4.34Å; Y468-V486 HydrophobicContact CE2-CG1 4.18Å; Y468-V486 HydrophobicContact CE2-CG2 4.37Å; Y468-V486 HydrophobicContact CG-CG2 4.19Å; Y468-P487 VanDerWaalsContact CE1-CD 3.5Å; Y468-P487 HydrophobicContact CE1-CG 4.14Å; Y468-V490 HydrophobicContact CE1-CG2 3.97Å; Y468-V490 WeakPolarHBondContact OH-CG1 3.31Å; Y468-V490 WeakPolarHBondContact OH-CG2 3.43Å; Y468-Q494 PolarHBondContact OH-NE2 3.28Å; Y468-I496 HydrophobicContact CD2-CG2 4.16Å
469	S	76.5	Confident	68.2	Low	68 Å²	68	78.1 Å²	78.1	48%	0.476	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	119.2	172.4	172.8	0	0	0	0	109.5	I484 E485	S469-I484 WeakPolarHBondContact O-CA 3.49Å; S469-E485 WeakPolarHBondContact CB-OE2 3.08Å; S469-E485 PolarHBondContact O-N 2.79Å; S469-E485 PolarHBondContact OG-OE2 2.89Å
470	T	77.1	Confident	68	Low	34 Å²	34	81.2 Å²	81.2	21%	0.209	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	141.3	-178.7	59.3	0	0	0	0	112.8	T466 Y468 Y483 I484	T466-T470 HydrophobicContact CG2-CG2 3.47Å; T466-T470 VanDerWaalsContact CG2-CG2 3.47Å; T466-T470 WeakPolarHBondContact OG1-CG2 3.26Å; T466-T470 PolarHBondContact OG1-OG1 3.39Å; Y468-T470 WeakPolarHBondContact O-CG2 3.35Å; Y468-T470 PolarHBondContact O-N 3.39Å; T470-Y483 CarbonylContact C-O 3.55Å; T470-Y483 VanDerWaalsContact CA-O 3.23Å; T470-Y483 WeakPolarHBondContact CA-O 3.43Å; T470-I484 HydrophobicContact CG2-CB 3.99Å; T470-I484 HydrophobicContact CG2-CD1 4.09Å; T470-I484 HydrophobicContact CG2-CG1 3.6Å; T470-I484 HydrophobicContact CG2-CG2 3.81Å
471	T	78	Confident	68.5	Low	73 Å²	73	77 Å²	77	45%	0.448	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	156.3	170.1	60.6	0	0	0	0	108.6	Y483	T471-Y483 PolarHBondContact N-O 3.18Å; T471-Y483 PolarHBondContact O-N 2.81Å
472	Y	73.9	Confident	69.2	Low	121 Å²	121	73.8 Å²	73.8	48%	0.475	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	148.9	171	68.1	-79.5	0	0	0	108.9	L459 L463 T481	L459-Y472 HydrophobicContact CD1-CD2 3.88Å; L459-Y472 HydrophobicContact CD1-CE2 4.48Å; L459-Y472 HydrophobicContact CD1-CG 4.27Å; L463-Y472 HydrophobicContact CD1-CD1 3.36Å; L463-Y472 HydrophobicContact CD1-CE1 3.67Å; L463-Y472 HydrophobicContact CD1-CG 4.22Å; L463-Y472 HydrophobicContact CD2-CD1 4.15Å; L463-Y472 HydrophobicContact CG-CD1 4.36Å; Y472-T481 CarbonylContact C-O 3.55Å; Y472-T481 VanDerWaalsContact CA-O 3.29Å; Y472-T481 WeakPolarHBondContact CA-O 3.45Å
473	T	66.2	Low	69.9	Low	62 Å²	62	76.7 Å²	76.7	38%	0.38	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	133	173	58	0	0	0	0	109.2	T481	T473-T481 PolarHBondContact N-O 2.8Å; T473-T481 PolarHBondContact O-N 2.64Å
474	T	58.5	Low	70.8	Confident	95 Å²	95	75 Å²	75	58%	0.583	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	106.3	169.1	48.2	0	0	0	0	107.6	E480	T474-E480 HydrophobicContact CG2-CG 4.06Å
475	Y	49.4	Very low	71.8	Confident	104 Å²	104	71.4 Å²	71.4	41%	0.408	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	117	173.9	-105.9	-88.9	0	0	0	109.3	N479	Y475-N479 PolarHBondContact N-O 3.16Å; Y475-N479 VanDerWaalsContact N-O 3.11Å
476	N	47.9	Very low	72.3	Confident	127 Å²	127	69 Å²	69	68%	0.679	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	78.5	171.7	-60	-17.2	0	0	0	114.4	N478	N476-N478 PolarHBondContact O-N 2.76Å; N476-N478 VanDerWaalsContact O-N 3.07Å
477	N	47.2	Very low	73	Confident	157 Å²	157	69.5 Å²	69.5	84%	0.84	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	35.5	59.2	164.8	-60.4	4.7	0	0	0	114.9
478	N	53.1	Low	73.5	Confident	154 Å²	154	65.6 Å²	65.6	82%	0.824	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	151.2	-6.5	152	-70.9	-8	0	0	0	114.8	N476	N476-N478 PolarHBondContact O-N 2.76Å; N476-N478 VanDerWaalsContact O-N 3.07Å
479	N	63.2	Low	73.7	Confident	89 Å²	89	69.1 Å²	69.1	48%	0.476	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	106.3	177.7	-69.5	10.6	0	0	0	111	Y475 F571	Y475-N479 PolarHBondContact N-O 3.16Å; Y475-N479 VanDerWaalsContact N-O 3.11Å; N479-F571 HydrophobicContact CB-CD2 4.36Å; N479-F571 HydrophobicContact CB-CE2 4.22Å
480	E	72.3	Confident	74.2	Confident	78 Å²	78	66.5 Å²	66.5	36%	0.364	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	129.5	176.3	-72.5	171.3	166.8	0	0	110.5	L459 T474 F571	L459-E480 HydrophobicContact CD1-CB 3.84Å; L459-E480 HydrophobicContact CD1-CG 3.67Å; L459-E480 WeakPolarHBondContact CD1-OE2 3.31Å; L459-E480 HydrophobicContact CD2-CB 4.31Å; L459-E480 HydrophobicContact CG-CB 4.44Å; L459-E480 WeakPolarHBondContact CG-OE2 3.36Å; T474-E480 HydrophobicContact CG2-CG 4.06Å; E480-F571 PolarHBondContact O-N 2.88Å
481	T	82.7	Confident	74.7	Confident	23 Å²	23	70.9 Å²	70.9	14%	0.141	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	123.1	176.8	-55	0	0	0	0	109.8	Y472 T473 F571 I573	Y472-T481 CarbonylContact C-O 3.55Å; Y472-T481 VanDerWaalsContact CA-O 3.29Å; Y472-T481 WeakPolarHBondContact CA-O 3.45Å; T473-T481 PolarHBondContact N-O 2.8Å; T473-T481 PolarHBondContact O-N 2.64Å; T481-F571 CarbonylContact C-O 3.57Å; T481-F571 VanDerWaalsContact CA-O 3.28Å; T481-F571 WeakPolarHBondContact CA-O 3.08Å; T481-F571 HydrophobicContact CG2-CB 4.24Å; T481-I573 HydrophobicContact CG2-CD1 3.89Å; T481-I573 HydrophobicContact CG2-CG1 3.91Å
482	L	86.7	Confident	75.1	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	127.8	174.2	-172.9	62.1	0	0	0	110.2	L463 I484 F499 F571 M572 I573	L463-L482 HydrophobicContact CD2-CD1 3.57Å; L463-L482 HydrophobicContact CG-CD1 4.32Å; L482-I484 HydrophobicContact CD2-CD1 4.02Å; L482-I484 HydrophobicContact CD2-CG1 4.38Å; L482-I484 HydrophobicContact CG-CD1 4.27Å; L482-I484 HydrophobicContact CG-CG1 4.06Å; L482-F499 HydrophobicContact CD2-CE1 4.28Å; L482-F571 PolarHBondContact N-O 2.88Å; L482-M572 HydrophobicContact CB-CE 4.47Å; L482-M572 HydrophobicContact CD2-CE 3.62Å; L482-M572 HydrophobicContact CG-CE 4.24Å; L482-M572 CarbonylContact O-C 3.55Å; L482-M572 VanDerWaalsContact O-CA 3.26Å; L482-M572 WeakPolarHBondContact O-CA 3.41Å; L482-I573 PolarHBondContact O-N 2.82Å
483	Y	87.3	Confident	75.7	Confident	61 Å²	61	68.4 Å²	68.4	24%	0.239	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.3	178.2	-176	-90.2	0	0	0	109.1	T470 T471 E485 L551 I573 N575	T470-Y483 CarbonylContact C-O 3.55Å; T470-Y483 VanDerWaalsContact CA-O 3.23Å; T470-Y483 WeakPolarHBondContact CA-O 3.43Å; T471-Y483 PolarHBondContact N-O 3.18Å; T471-Y483 PolarHBondContact O-N 2.81Å; Y483-E485 HydrophobicContact CD1-CG 4.21Å; Y483-E485 HydrophobicContact CE1-CG 3.52Å; Y483-L551 HydrophobicContact CE2-CD2 4.48Å; Y483-I573 CarbonylContact C-O 3.56Å; Y483-I573 WeakPolarHBondContact CA-O 3.39Å; Y483-I573 HydrophobicContact CD2-CB 3.84Å; Y483-I573 HydrophobicContact CD2-CG2 3.77Å; Y483-I573 HydrophobicContact CE2-CB 4.45Å; Y483-I573 HydrophobicContact CE2-CG2 3.87Å; Y483-N575 HydrophobicContact CE1-CB 4.38Å; Y483-N575 HydrophobicContact CE2-CB 4.19Å; Y483-N575 WeakPolarHBondContact OH-CB 3.46Å; Y483-N575 PolarHBondContact OH-ND2 3.32Å
484	I	88.4	Confident	76.7	Confident	0 Å²	0	69 Å²	69	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	132.3	-176.1	-50.1	-169.1	0	0	0	109.5	T466 S469 T470 L482 V486 I496 T497 M572 I573 I574 N575	T466-I484 HydrophobicContact CG2-CD1 4.12Å; S469-I484 WeakPolarHBondContact O-CA 3.49Å; T470-I484 HydrophobicContact CG2-CB 3.99Å; T470-I484 HydrophobicContact CG2-CD1 4.09Å; T470-I484 HydrophobicContact CG2-CG1 3.6Å; T470-I484 HydrophobicContact CG2-CG2 3.81Å; L482-I484 HydrophobicContact CD2-CD1 4.02Å; L482-I484 HydrophobicContact CD2-CG1 4.38Å; L482-I484 HydrophobicContact CG-CD1 4.27Å; L482-I484 HydrophobicContact CG-CG1 4.06Å; I484-V486 HydrophobicContact CG2-CG2 3.79Å; I484-I496 HydrophobicContact CD1-CG2 4.11Å; I484-I496 HydrophobicContact CG2-CG2 3.85Å; I484-T497 HydrophobicContact CD1-CG2 3.82Å; I484-M572 HydrophobicContact CD1-CE 3.53Å; I484-M572 HydrophobicContact CD1-SD 4.29Å; I484-M572 HydrophobicContact CG1-CE 4.29Å; I484-I573 PolarHBondContact N-O 3.47Å; I484-I574 CarbonylContact O-C 3.5Å; I484-I574 WeakPolarHBondContact O-CA 3.29Å; I484-N575 PolarHBondContact O-N 2.84Å
485	E	89.1	Confident	78.1	Confident	58 Å²	58	66.8 Å²	66.8	27%	0.271	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	117.5	176.4	-59	180	140.6	0	0	111	Y468 S469 Y483 N575 L577	Y468-E485 VanDerWaalsContact CB-O 3.25Å; Y468-E485 WeakPolarHBondContact CB-O 3.16Å; S469-E485 WeakPolarHBondContact CB-OE2 3.08Å; S469-E485 PolarHBondContact O-N 2.79Å; S469-E485 PolarHBondContact OG-OE2 2.89Å; Y483-E485 HydrophobicContact CD1-CG 4.21Å; Y483-E485 HydrophobicContact CE1-CG 3.52Å; E485-N575 CarbonylContact C-O 3.58Å; E485-N575 WeakPolarHBondContact CA-O 3.23Å; E485-N575 HydrophobicContact CG-CB 4.38Å; E485-L577 HydrophobicContact CB-CD1 3.9Å; E485-L577 HydrophobicContact CB-CD2 4.04Å; E485-L577 HydrophobicContact CB-CG 3.97Å; E485-L577 HydrophobicContact CG-CD2 4.37Å
486	V	88.6	Confident	79.9	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	123.4	-173.9	-176.1	0	0	0	0	108.8	Y468 I484 V490 I496 I536 L540 I574 N575 I576 L577	Y468-V486 HydrophobicContact CD2-CG2 4Å; Y468-V486 HydrophobicContact CE1-CG1 4.34Å; Y468-V486 HydrophobicContact CE2-CG1 4.18Å; Y468-V486 HydrophobicContact CE2-CG2 4.37Å; Y468-V486 HydrophobicContact CG-CG2 4.19Å; I484-V486 HydrophobicContact CG2-CG2 3.79Å; V486-V490 HydrophobicContact CG1-CB 4.34Å; V486-V490 HydrophobicContact CG1-CG2 3.84Å; V486-I496 HydrophobicContact CG2-CG2 3.86Å; V486-I536 HydrophobicContact CG1-CD1 4.27Å; V486-L540 HydrophobicContact CG1-CD1 3.69Å; V486-I574 HydrophobicContact CB-CG2 4.23Å; V486-I574 HydrophobicContact CG2-CG2 3.78Å; V486-N575 PolarHBondContact N-O 3.42Å; V486-I576 HydrophobicContact CB-CD1 4.27Å; V486-I576 CarbonylContact O-C 3.37Å; V486-I576 WeakPolarHBondContact O-CA 3.17Å; V486-L577 PolarHBondContact O-N 2.84Å
487	P	88.9	Confident	81.8	Confident	31 Å²	31	55.8 Å²	55.8	20%	0.201	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	150.7	174.6	16.5	-17	0	0	0	112	Y468 N489 V490 I579	Y468-P487 VanDerWaalsContact CE1-CD 3.5Å; Y468-P487 HydrophobicContact CE1-CG 4.14Å; P487-N489 PolarHBondContact O-N 2.85Å; P487-V490 HydrophobicContact CB-CG2 4.28Å; P487-V490 HydrophobicContact CG-CG2 3.62Å; P487-V490 WeakPolarHBondContact O-CG2 3.24Å; P487-I579 HydrophobicContact CB-CD1 3.62Å; P487-I579 HydrophobicContact CB-CG1 4.39Å
488	E	87	Confident	83.9	Confident	5 Å²	5	51.9 Å²	51.9	2%	0.023	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-29.1	-177.9	76.3	-161.8	143.2	0	0	113.9	V490 L540 R542 I576 L577 I579	E488-V490 PolarHBondContact O-N 2.81Å; E488-L540 HydrophobicContact CB-CB 4.34Å; E488-L540 VanDerWaalsContact O-O 3.06Å; E488-R542 WeakPolarHBondContact OE2-CB 3.28Å; E488-R542 PolarHBondContact OE2-N 2.83Å; E488-I576 HydrophobicContact CB-CG2 3.59Å; E488-L577 PolarHBondContact N-O 3.48Å; E488-L577 VanDerWaalsContact N-O 3.16Å; E488-I579 HydrophobicContact CG-CB 4.1Å; E488-I579 HydrophobicContact CG-CG1 4.4Å; E488-I579 VanDerWaalsContact OE1-CA 3.31Å; E488-I579 WeakPolarHBondContact OE1-CA 3.2Å; E488-I579 WeakPolarHBondContact OE1-CB 3.22Å; E488-I579 PolarHBondContact OE1-N 2.83Å
489	N	86.7	Confident	85.7	Confident	112 Å²	112	44.7 Å²	44.7	60%	0.599	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.2	13.1	178.8	76.2	-14.4	0	0	0	114.8	P487 I579	P487-N489 PolarHBondContact O-N 2.85Å; N489-I579 HydrophobicContact CB-CD1 3.65Å; N489-I579 VanDerWaalsContact ND2-CD1 3.33Å; N489-I579 WeakPolarHBondContact ND2-CD1 3.28Å; N489-I579 WeakPolarHBondContact OD1-CD1 3.24Å
490	V	86.7	Confident	87	Confident	12 Å²	12	43.8 Å²	43.8	7%	0.073	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-67.3	138.1	-179.5	173	0	0	0	0	110.9	Y468 V486 P487 E488 Q494 I536 L540	Y468-V490 HydrophobicContact CE1-CG2 3.97Å; Y468-V490 WeakPolarHBondContact OH-CG1 3.31Å; Y468-V490 WeakPolarHBondContact OH-CG2 3.43Å; V486-V490 HydrophobicContact CG1-CB 4.34Å; V486-V490 HydrophobicContact CG1-CG2 3.84Å; P487-V490 HydrophobicContact CB-CG2 4.28Å; P487-V490 HydrophobicContact CG-CG2 3.62Å; P487-V490 WeakPolarHBondContact O-CG2 3.24Å; E488-V490 PolarHBondContact O-N 2.81Å; V490-Q494 HydrophobicContact CG1-CB 3.89Å; V490-Q494 HydrophobicContact CG1-CG 4.13Å; V490-I536 HydrophobicContact CB-CD1 3.86Å; V490-I536 HydrophobicContact CG1-CD1 3.14Å; V490-L540 HydrophobicContact CB-CD1 4.49Å
491	R	87.4	Confident	88	Confident	126 Å²	126	40.3 Å²	40.3	48%	0.475	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-68.8	138.5	-177.8	-65.4	-178.6	179.6	168.7	1.7	111.5	G493 Q494	R491-G493 PolarHBondContact O-N 3.48Å; R491-Q494 VanDerWaalsContact O-CB 3.24Å; R491-Q494 WeakPolarHBondContact O-CB 3.28Å; R491-Q494 PolarHBondContact O-N 2.89Å
492	V	86.7	Confident	88.5	Confident	89 Å²	89	43 Å²	43	54%	0.539	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	135.1	167.9	178.7	0	0	0	0	110.2	Q537	V492-Q537 WeakPolarHBondContact CG1-O 3.04Å
493	G	86	Confident	88.9	Confident	53 Å²	53	43.7 Å²	43.7	55%	0.546	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.2	-3.5	-175.6	0	0	0	0	0	114.7	R491 I536	R491-G493 PolarHBondContact O-N 3.48Å; G493-I536 PolarHBondContact N-O 2.94Å
494	Q	86.7	Confident	89.3	Confident	75 Å²	75	47.3 Å²	47.3	35%	0.35	25%	0.246	S	C	.	.			trans	-76	140.5	176.2	-172.9	159.8	-10	0	0	111.9	Y468 V490 R491 I535 I536	Y468-Q494 PolarHBondContact OH-NE2 3.28Å; V490-Q494 HydrophobicContact CG1-CB 3.89Å; V490-Q494 HydrophobicContact CG1-CG 4.13Å; R491-Q494 VanDerWaalsContact O-CB 3.24Å; R491-Q494 WeakPolarHBondContact O-CB 3.28Å; R491-Q494 PolarHBondContact O-N 2.89Å; Q494-I535 WeakPolarHBondContact O-CA 3.16Å; Q494-I536 PolarHBondContact O-N 3.31Å
495	V	88.5	Confident	89.7	Confident	48 Å²	48	47.6 Å²	47.6	29%	0.291	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	122.4	175.4	-179.6	0	0	0	0	109.4	T467 T497 E533 L534 I535	T467-V495 PolarHBondContact OG1-O 3.36Å; V495-T497 WeakPolarHBondContact CG1-O 3.41Å; V495-E533 HydrophobicContact CG1-CB 4.24Å; V495-E533 HydrophobicContact CG1-CG 4.29Å; V495-L534 WeakPolarHBondContact CA-O 3.49Å; V495-I535 HydrophobicContact CG2-CG1 4.01Å
496	I	86.9	Confident	89.9	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	-48.4	175.9	-59.4	177.9	0	0	0	110.3	T467 Y468 I484 V486 T524 L534 I536 I574	T467-I496 PolarHBondContact N-O 2.81Å; T467-I496 PolarHBondContact OG1-O 2.83Å; Y468-I496 HydrophobicContact CD2-CG2 4.16Å; I484-I496 HydrophobicContact CD1-CG2 4.11Å; I484-I496 HydrophobicContact CG2-CG2 3.85Å; V486-I496 HydrophobicContact CG2-CG2 3.86Å; I496-T524 HydrophobicContact CD1-CG2 4.16Å; I496-L534 HydrophobicContact CD1-CD2 4.33Å; I496-L534 HydrophobicContact CD1-CG 4.48Å; I496-L534 PolarHBondContact N-O 3.21Å; I496-I536 HydrophobicContact CD1-CD1 4.05Å; I496-I536 HydrophobicContact CD1-CG1 3.62Å; I496-I536 HydrophobicContact CG1-CD1 3.81Å; I496-I536 HydrophobicContact CG1-CG1 3.68Å; I496-I574 HydrophobicContact CD1-CD1 4.09Å
497	T	88.5	Confident	90.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	162.5	-178.7	-177.7	0	0	0	0	110.1	T466 I484 V495 F499 L534 M572	T466-T497 WeakPolarHBondContact CG2-OG1 3.3Å; I484-T497 HydrophobicContact CD1-CG2 3.82Å; V495-T497 WeakPolarHBondContact CG1-O 3.41Å; T497-F499 HydrophobicContact CG2-CE1 3.85Å; T497-F499 HydrophobicContact CG2-CE2 4.12Å; T497-F499 HydrophobicContact CG2-CZ 3.58Å; T497-L534 HydrophobicContact CG2-CB 4.05Å; T497-L534 HydrophobicContact CG2-CD2 4.3Å; T497-L534 PolarHBondContact O-N 3.36Å; T497-M572 HydrophobicContact CG2-CE 3.92Å
498	K	90.5	Very high	90.5	Very high	76 Å²	76	56.9 Å²	56.9	33%	0.33	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	113.5	172.1	178	176.2	-170.2	152.4	0	109.9	N465 T531 G532 E533	N465-K498 HydrophobicContact CB-CB 3.95Å; N465-K498 WeakPolarHBondContact CB-O 3.34Å; N465-K498 PolarHBondContact ND2-O 2.96Å; N465-K498 VanDerWaalsContact ND2-O 3.09Å; K498-T531 WeakPolarHBondContact CE-O 3.38Å; K498-T531 WeakPolarHBondContact CG-O 3.24Å; K498-G532 WeakPolarHBondContact CA-O 3.42Å; K498-E533 HydrophobicContact CB-CG 3.99Å; K498-E533 HydrophobicContact CD-CG 3.84Å; K498-E533 HydrophobicContact CG-CG 3.81Å; K498-E533 IonicContact NZ-OE1 3.01Å; K498-E533 PolarHBondContact NZ-OE1 2.9Å
499	F	90.8	Very high	90.9	Very high	2 Å²	2	58 Å²	58	1%	0.009	31%	0.306	C	S	.	.			trans	-72	145.5	177.6	-55.9	-66.9	0	0	0	111.3	F457 L482 T497 Y514 L527 G532 L534 I556 L570 M572	F457-F499 HydrophobicContact CE1-CB 4.16Å; L482-F499 HydrophobicContact CD2-CE1 4.28Å; T497-F499 HydrophobicContact CG2-CE1 3.85Å; T497-F499 HydrophobicContact CG2-CE2 4.12Å; T497-F499 HydrophobicContact CG2-CZ 3.58Å; F499-Y514 HydrophobicContact CB-CD1 4.19Å; F499-Y514 HydrophobicContact CB-CE1 3.98Å; F499-L527 HydrophobicContact CD2-CD1 3.82Å; F499-L527 HydrophobicContact CE2-CD1 3.88Å; F499-G532 WeakPolarHBondContact CD2-O 3.37Å; F499-G532 PolarHBondContact N-O 3.05Å; F499-L534 HydrophobicContact CE2-CB 4Å; F499-L534 HydrophobicContact CZ-CD2 4.41Å; F499-I556 HydrophobicContact CD2-CG1 4.42Å; F499-I556 HydrophobicContact CD2-CG2 3.82Å; F499-I556 HydrophobicContact CE1-CG1 4.08Å; F499-I556 HydrophobicContact CE2-CB 4.41Å; F499-I556 HydrophobicContact CE2-CD1 3.83Å; F499-I556 HydrophobicContact CE2-CG1 3.72Å; F499-I556 HydrophobicContact CE2-CG2 3.95Å; F499-I556 HydrophobicContact CG-CG2 4.16Å; F499-I556 HydrophobicContact CZ-CB 4.43Å; F499-I556 HydrophobicContact CZ-CD1 3.98Å; F499-I556 HydrophobicContact CZ-CG1 3.53Å; F499-I556 HydrophobicContact CZ-CG2 4.4Å; F499-L570 HydrophobicContact CD1-CD2 3.61Å; F499-L570 HydrophobicContact CE1-CD2 3.72Å; F499-M572 HydrophobicContact CE1-CE 3.35Å; F499-M572 HydrophobicContact CZ-CE 3.28Å; F499-M572 HydrophobicContact CZ-SD 4.08Å
500	H	91.4	Very high	91.3	Very high	71 Å²	71	54.3 Å²	54.3	33%	0.329	29%	0.29	S	S	.	.			trans	-133.9	111.4	173.2	-172.6	59.9	0	0	0	109.1	N458 Q461 S462 I502	N458-H500 PolarHBondContact N-O 3.05Å; Q461-H500 HydrophobicContact CB-CB 4.12Å; Q461-H500 HydrophobicContact CG-CB 3.87Å; S462-H500 PolarHBondContact OG-N 3.24Å; H500-I502 WeakPolarHBondContact NE2-CG1 3.41Å
501	A	92.9	Very high	91.8	Very high	4 Å²	4	58.4 Å²	58.4	3%	0.033	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	153.5	165.5	0	0	0	0	0	109.8	P455 E456 F457 I512 Y514 A558	P455-A501 HydrophobicContact CB-CB 4.21Å; E456-A501 CarbonylContact O-C 3.49Å; E456-A501 WeakPolarHBondContact O-CA 3.12Å; F457-A501 HydrophobicContact CD1-CB 4.11Å; F457-A501 HydrophobicContact CE1-CB 4.35Å; F457-A501 HydrophobicContact CG-CB 4.4Å; A501-I512 HydrophobicContact CB-CD1 3.93Å; A501-I512 HydrophobicContact CB-CG2 4.3Å; A501-I512 WeakPolarHBondContact O-CD1 3.35Å; A501-Y514 HydrophobicContact CB-CE1 4.03Å; A501-Y514 PolarHBondContact N-OH 3.19Å; A501-A558 HydrophobicContact CB-CB 3.71Å
502	I	93.5	Very high	92.2	Very high	80 Å²	80	53.7 Å²	53.7	41%	0.41	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	135	178.3	-58.3	171.8	0	0	0	107.3	E456 N458 H500	E456-I502 PolarHBondContact N-O 3.11Å; E456-I502 PolarHBondContact O-N 2.82Å; N458-I502 HydrophobicContact CB-CD1 4.32Å; H500-I502 WeakPolarHBondContact NE2-CG1 3.41Å
503	D	95.6	Very high	92.6	Very high	15 Å²	15	53.1 Å²	53.1	8%	0.08	28%	0.283	C	S	.	.			trans	-121.1	139.6	170.5	-158.3	-44	0	0	0	107.9	C453 P455 D505 I512	C453-D503 VanDerWaalsContact CB-OD1 3.29Å; C453-D503 WeakPolarHBondContact CB-OD1 3.37Å; P455-D503 WeakPolarHBondContact CA-OD2 3.27Å; P455-D503 WeakPolarHBondContact CD-OD2 3.43Å; P455-D503 WeakPolarHBondContact CG-OD2 3.3Å; D503-D505 PolarHBondContact OD1-N 2.88Å; D503-I512 HydrophobicContact CB-CD1 4.27Å; D503-I512 HydrophobicContact CB-CG1 4.41Å
504	K	95.1	Very high	93	Very high	137 Å²	137	51.4 Å²	51.4	60%	0.596	26%	0.26	S	S	*	.			trans	-89	-11	-173.3	-64.3	179.2	-176.3	169.2	0	112.7	R411 E412 C453	R411-K504 PolarHBondContact NH2-O 3.45Å; E412-K504 HydrophobicContact CG-CB 3.67Å; C453-K504 HydrophobicContact CB-CB 4.37Å
505	D	96.6	Very high	93.3	Very high	6 Å²	6	55.8 Å²	55.8	3%	0.032	27%	0.274	C	S	.	.	S	Bend	trans	-70.1	-179.8	178.8	-63.9	-11.3	0	0	0	111.5	N451 D452 C453 D503 N509 S510	N451-D505 WeakPolarHBondContact CA-OD2 3.14Å; N451-D505 PolarHBondContact OD1-OD2 3.39Å; D452-D505 PolarHBondContact N-OD2 2.91Å; D452-D505 VanDerWaalsContact N-OD2 3.13Å; C453-D505 WeakPolarHBondContact CB-OD1 3.47Å; C453-D505 PolarHBondContact N-OD1 3.07Å; C453-D505 PolarHBondContact N-OD2 3.35Å; C453-D505 PolarHBondContact SG-OD1 2.8Å; C453-D505 VanDerWaalsContact SG-OD1 3.4Å; D503-D505 PolarHBondContact OD1-N 2.88Å; D505-N509 HydrophobicContact CB-CB 3.46Å; D505-N509 VanDerWaalsContact CB-CB 3.46Å; D505-S510 WeakPolarHBondContact O-CB 3.46Å; D505-S510 PolarHBondContact O-OG 3.35Å
506	I	94.1	Very high	93.4	Very high	97 Å²	97	55 Å²	55	50%	0.497	27%	0.268	S	S	.	.			trans	-113.4	145.1	-179.9	-78.4	172.9	0	0	0	112.5	R411 D449 K508 N509	R411-I506 VanDerWaalsContact CZ-CD1 3.46Å; D449-I506 PolarHBondContact OD1-N 3.41Å; D449-I506 PolarHBondContact OD2-N 3.45Å; I506-K508 PolarHBondContact O-N 2.78Å; I506-N509 PolarHBondContact O-N 3.45Å
507	G	95	Very high	93.5	Very high	47 Å²	47	57.4 Å²	57.4	49%	0.485	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	68.6	-124.9	170.3	0	0	0	0	0	111.4	N509 S510 E511	G507-N509 VanDerWaalsContact C-N 3.26Å; G507-N509 PolarHBondContact O-N 3.19Å; G507-S510 PolarHBondContact N-OG 3.11Å; G507-S510 PolarHBondContact O-N 2.92Å; G507-S510 PolarHBondContact O-OG 3.49Å; G507-E511 PolarHBondContact O-N 2.87Å; G507-E511 VanDerWaalsContact O-N 3.08Å
508	K	95	Very high	93.3	Very high	140 Å²	140	63.5 Å²	63.5	61%	0.609	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-66.3	-30.2	-179.8	-70.6	-169.4	175.9	-173.2	0	112.9	I506 S510 E511 Q561 G562	I506-K508 PolarHBondContact O-N 2.78Å; K508-S510 PolarHBondContact O-N 2.8Å; K508-E511 PolarHBondContact O-N 3.19Å; K508-Q561 HydrophobicContact CB-CB 4.29Å; K508-Q561 CarbonylContact O-C 3.59Å; K508-Q561 VanDerWaalsContact O-CA 3.26Å; K508-Q561 WeakPolarHBondContact O-CA 3.16Å; K508-Q561 WeakPolarHBondContact O-CB 3.44Å; K508-Q561 PolarHBondContact O-N 2.92Å; K508-G562 PolarHBondContact O-N 2.83Å
509	N	95.3	Very high	92.8	Very high	28 Å²	28	65.7 Å²	65.7	15%	0.15	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-68.3	-17.9	178.5	-62.3	-14.4	0	0	0	111.7	D449 N451 D505 I506 G507 D560 G562	D449-N509 PolarHBondContact OD2-ND2 2.86Å; N451-N509 HydrophobicContact CB-CB 4.07Å; N451-N509 WeakPolarHBondContact OD1-CB 3.27Å; N451-N509 PolarHBondContact OD1-O 2.88Å; D505-N509 HydrophobicContact CB-CB 3.46Å; D505-N509 VanDerWaalsContact CB-CB 3.46Å; I506-N509 PolarHBondContact O-N 3.45Å; G507-N509 VanDerWaalsContact C-N 3.26Å; G507-N509 PolarHBondContact O-N 3.19Å; N509-D560 WeakPolarHBondContact O-CB 3.42Å; N509-G562 WeakPolarHBondContact OD1-CA 3.09Å
510	S	95.2	Very high	91.8	Very high	35 Å²	35	69 Å²	69	25%	0.245	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-115.8	7.5	171.3	54	0	0	0	0	115.8	D505 G507 K508 I512	D505-S510 WeakPolarHBondContact O-CB 3.46Å; D505-S510 PolarHBondContact O-OG 3.35Å; G507-S510 PolarHBondContact N-OG 3.11Å; G507-S510 PolarHBondContact O-N 2.92Å; G507-S510 PolarHBondContact O-OG 3.49Å; K508-S510 PolarHBondContact O-N 2.8Å; S510-I512 PolarHBondContact O-N 2.84Å
511	E	95.5	Very high	90.5	Very high	97 Å²	97	68.2 Å²	68.2	45%	0.453	34%	0.336	S	S	.	.			trans	-81.2	105.6	177.8	-165.2	-175.4	153.5	0	0	110.2	G507 K508 D560 Q561	G507-E511 PolarHBondContact O-N 2.87Å; G507-E511 VanDerWaalsContact O-N 3.08Å; K508-E511 PolarHBondContact O-N 3.19Å; E511-D560 CarbonylContact O-C 3.57Å; E511-D560 WeakPolarHBondContact O-CA 3.43Å; E511-Q561 HydrophobicContact CB-CB 4.3Å; E511-Q561 HydrophobicContact CB-CG 4.31Å; E511-Q561 VanDerWaalsContact CD-CD 3.48Å; E511-Q561 VanDerWaalsContact CG-NE2 3.34Å; E511-Q561 WeakPolarHBondContact O-CG 3.38Å; E511-Q561 PolarHBondContact O-N 3.14Å; E511-Q561 VanDerWaalsContact O-N 3.14Å; E511-Q561 PolarHBondContact OE1-NE2 2.79Å
512	I	96.1	Very high	88.9	Confident	28 Å²	28	70 Å²	70	14%	0.144	35%	0.349	C	S	.	.			trans	-87.6	136.3	-169.8	-63.8	166.7	0	0	0	112.3	P455 A501 D503 S510 Y514 A558 Y559	P455-I512 HydrophobicContact CB-CD1 4.28Å; P455-I512 HydrophobicContact CB-CG1 4.28Å; P455-I512 HydrophobicContact CG-CG1 4.35Å; A501-I512 HydrophobicContact CB-CD1 3.93Å; A501-I512 HydrophobicContact CB-CG2 4.3Å; A501-I512 WeakPolarHBondContact O-CD1 3.35Å; D503-I512 HydrophobicContact CB-CD1 4.27Å; D503-I512 HydrophobicContact CB-CG1 4.41Å; S510-I512 PolarHBondContact O-N 2.84Å; I512-Y514 HydrophobicContact CG2-CD1 4.45Å; I512-Y514 HydrophobicContact CG2-CD2 4.4Å; I512-Y514 HydrophobicContact CG2-CE1 3.95Å; I512-Y514 HydrophobicContact CG2-CE2 3.88Å; I512-A558 HydrophobicContact CG2-CB 4.02Å; I512-Y559 CarbonylContact C-O 3.6Å; I512-Y559 VanDerWaalsContact CA-O 3.29Å; I512-Y559 WeakPolarHBondContact CA-O 3.35Å
513	Q	95.8	Very high	87.2	Confident	76 Å²	76	67 Å²	67	36%	0.355	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	141.1	165.8	-62.9	-171.7	-1.5	0	0	111.5	S529 A558 Y559 Q561	Q513-S529 CarbonylContact C-O 3.58Å; Q513-S529 VanDerWaalsContact CA-O 3.3Å; Q513-S529 WeakPolarHBondContact CA-O 3.41Å; Q513-A558 WeakPolarHBondContact O-CA 3.26Å; Q513-Y559 PolarHBondContact N-O 3.21Å; Q513-Y559 PolarHBondContact O-N 3.35Å; Q513-Q561 HydrophobicContact CG-CG 4.23Å
514	Y	94.9	Very high	85.4	Confident	18 Å²	18	66.5 Å²	66.5	7%	0.071	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	143.2	179.5	-54.8	-87.8	0	0	0	111.8	F457 F499 A501 I512 S529 G532 T557 A558	F457-Y514 HydrophobicContact CE1-CD1 4.2Å; F457-Y514 HydrophobicContact CE1-CE1 4.03Å; F499-Y514 HydrophobicContact CB-CD1 4.19Å; F499-Y514 HydrophobicContact CB-CE1 3.98Å; A501-Y514 HydrophobicContact CB-CE1 4.03Å; A501-Y514 PolarHBondContact N-OH 3.19Å; I512-Y514 HydrophobicContact CG2-CD1 4.45Å; I512-Y514 HydrophobicContact CG2-CD2 4.4Å; I512-Y514 HydrophobicContact CG2-CE1 3.95Å; I512-Y514 HydrophobicContact CG2-CE2 3.88Å; Y514-S529 WeakPolarHBondContact CD2-O 3.18Å; Y514-S529 PolarHBondContact N-O 3.05Å; Y514-S529 WeakPolarHBondContact O-CA 3.12Å; Y514-S529 WeakPolarHBondContact O-CB 3.49Å; Y514-G532 VanDerWaalsContact CD2-CA 3.44Å; Y514-T557 WeakPolarHBondContact CA-O 3.12Å; Y514-A558 HydrophobicContact CD1-CB 4.09Å; Y514-A558 HydrophobicContact CE1-CB 4.09Å
515	R	92.9	Very high	83.8	Confident	166 Å²	166	63 Å²	63	63%	0.626	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.7	145.8	174.4	-177.5	178	172.7	176.3	0.6	111	S517 T557 Y559	R515-S517 PolarHBondContact O-N 2.87Å; R515-T557 PolarHBondContact N-O 2.85Å; R515-T557 PolarHBondContact O-N 2.88Å; R515-Y559 HydrophobicContact CB-CE2 4.08Å
516	I	90.7	Very high	82.5	Confident	33 Å²	33	66.8 Å²	66.8	17%	0.169	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	109.8	164.8	-53.1	176.5	0	0	0	107.4	Y519 L527 L534 L554 I556	I516-Y519 HydrophobicContact CG2-CD1 4.04Å; I516-L527 HydrophobicContact CD1-CB 3.96Å; I516-L527 HydrophobicContact CG1-CB 3.82Å; I516-L527 HydrophobicContact CG1-CD2 3.75Å; I516-L527 HydrophobicContact CG1-CG 4.45Å; I516-L534 HydrophobicContact CD1-CD1 4.11Å; I516-L554 HydrophobicContact CD1-CD2 4.14Å; I516-L554 HydrophobicContact CG2-CD2 3.99Å; I516-I556 HydrophobicContact CG1-CD1 3.95Å
517	S	87.8	Confident	82.2	Confident	49 Å²	49	63.4 Å²	63.4	34%	0.343	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-32.1	-178.1	52.4	0	0	0	0	113.1	R515 T555 T557	R515-S517 PolarHBondContact O-N 2.87Å; S517-T555 PolarHBondContact N-O 2.87Å; S517-T555 WeakPolarHBondContact OG-CB 3.3Å; S517-T555 VanDerWaalsContact OG-CG2 3.32Å; S517-T555 WeakPolarHBondContact OG-CG2 3.3Å; S517-T555 PolarHBondContact OG-O 3.13Å; S517-T557 WeakPolarHBondContact CB-OG1 3.49Å; S517-T557 PolarHBondContact OG-OG1 2.9Å
518	Q	84.3	Confident	82	Confident	128 Å²	128	63.8 Å²	63.8	60%	0.598	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.2	143.1	176.3	-61	-177.3	-10.6	0	0	110.3	L554 T555	Q518-L554 CarbonylContact O-C 3.58Å; Q518-L554 WeakPolarHBondContact O-CA 3.31Å; Q518-T555 PolarHBondContact O-N 2.89Å
519	Y	81	Confident	81.8	Confident	122 Å²	122	59.6 Å²	59.6	48%	0.478	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	146.9	173.6	59.8	-87.4	0	0	0	110.6	I516 K525 Y553	I516-Y519 HydrophobicContact CG2-CD1 4.04Å; Y519-K525 VanDerWaalsContact CE2-NZ 3.3Å; Y519-K525 VanDerWaalsContact CZ-NZ 3.3Å; Y519-K525 PolarHBondContact OH-NZ 2.97Å; Y519-Y553 CarbonylContact C-O 3.18Å; Y519-Y553 VanDerWaalsContact CA-O 3.24Å; Y519-Y553 WeakPolarHBondContact CA-O 3.46Å
520	T	68.8	Low	81.6	Confident	71 Å²	71	62.9 Å²	62.9	44%	0.436	32%	0.319	S	S	.	.	S	Bend	trans	-85.5	-34.3	178.4	49.5	0	0	0	0	113.6	Y553	T520-Y553 HydrophobicContact CG2-CD2 3.88Å; T520-Y553 HydrophobicContact CG2-CG 4.25Å; T520-Y553 PolarHBondContact N-O 2.76Å; T520-Y553 VanDerWaalsContact N-O 3.07Å; T520-Y553 PolarHBondContact OG1-N 3.23Å
521	H	64.8	Low	81.5	Confident	55 Å²	55	63.3 Å²	63.3	26%	0.255	32%	0.32	S	S	.	.	S	Bend	trans	-141.7	152.5	-176.5	-62.8	-66.3	0	0	0	111.7	I523 L545	H521-I523 PolarHBondContact O-N 2.67Å; H521-L545 HydrophobicContact CB-CD1 3.58Å; H521-L545 VanDerWaalsContact CG-CD1 3.45Å
522	S	59.2	Low	81.3	Confident	43 Å²	43	58.7 Å²	58.7	30%	0.301	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	3	-165.4	-166.9	0	0	0	0	115.5	T524 K525	S522-T524 VanDerWaalsContact C-N 3.33Å; S522-T524 PolarHBondContact O-N 3.01Å; S522-K525 WeakPolarHBondContact OG-CD 3.48Å; S522-K525 VanDerWaalsContact OG-CE 3.28Å; S522-K525 WeakPolarHBondContact OG-CE 2.88Å; S522-K525 PolarHBondContact OG-NZ 3.02Å
523	I	57.2	Low	81.1	Confident	17 Å²	17	59.6 Å²	59.6	9%	0.087	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-8	-155.3	-52	-163.2	0	0	0	113.8	H521 L540 L545	H521-I523 PolarHBondContact O-N 2.67Å; I523-L540 HydrophobicContact CG2-CD2 3.62Å; I523-L545 HydrophobicContact CD1-CD1 3.28Å; I523-L545 HydrophobicContact CD1-CG 3.78Å; I523-L545 HydrophobicContact CG1-CD1 4.04Å
524	T	58.5	Low	80.8	Confident	3 Å²	3	56 Å²	56	2%	0.018	29%	0.285	C	S	.	.			trans	-133.5	79.5	178.9	50.8	0	0	0	0	112.5	I496 S522 L540	I496-T524 HydrophobicContact CD1-CG2 4.16Å; S522-T524 VanDerWaalsContact C-N 3.33Å; S522-T524 PolarHBondContact O-N 3.01Å; T524-L540 HydrophobicContact CG2-CD2 3.87Å
525	K	62.2	Low	80.5	Confident	63 Å²	63	56.4 Å²	56.4	27%	0.274	29%	0.288	S	S	.	.			trans	-118.9	66.1	-171.5	-76.2	-178.9	174.2	171.8	0	115.9	Y519 S522 Q537	Y519-K525 VanDerWaalsContact CE2-NZ 3.3Å; Y519-K525 VanDerWaalsContact CZ-NZ 3.3Å; Y519-K525 PolarHBondContact OH-NZ 2.97Å; S522-K525 WeakPolarHBondContact OG-CD 3.48Å; S522-K525 VanDerWaalsContact OG-CE 3.28Å; S522-K525 WeakPolarHBondContact OG-CE 2.88Å; S522-K525 PolarHBondContact OG-NZ 3.02Å; K525-Q537 PolarHBondContact O-OE1 3.06Å
526	L	68.6	Low	80.2	Confident	87 Å²	87	48.5 Å²	48.5	46%	0.455	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	101.6	148.4	-167.7	74.7	0	0	0	110.2	I535	L526-I535 HydrophobicContact CB-CB 4.18Å; L526-I535 HydrophobicContact CD2-CB 4.44Å; L526-I535 HydrophobicContact CD2-CD1 3.99Å; L526-I535 PolarHBondContact N-O 3.43Å; L526-I535 PolarHBondContact O-N 2.97Å
527	L	86.7	Confident	79.8	Confident	26 Å²	26	51.5 Å²	51.5	14%	0.136	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	118.3	164.6	177.5	64.8	0	0	0	107.7	F499 I516 S529 E533 L534 I556	F499-L527 HydrophobicContact CD2-CD1 3.82Å; F499-L527 HydrophobicContact CE2-CD1 3.88Å; I516-L527 HydrophobicContact CD1-CB 3.96Å; I516-L527 HydrophobicContact CG1-CB 3.82Å; I516-L527 HydrophobicContact CG1-CD2 3.75Å; I516-L527 HydrophobicContact CG1-CG 4.45Å; L527-S529 PolarHBondContact O-N 3.25Å; L527-E533 WeakPolarHBondContact CA-O 3.36Å; L527-L534 HydrophobicContact CB-CD1 4.35Å; L527-L534 HydrophobicContact CD1-CB 4.45Å; L527-I556 HydrophobicContact CD2-CD1 4.29Å; L527-I556 HydrophobicContact CD2-CG2 4.2Å
528	N	90.7	Very high	79.4	Confident	54 Å²	54	54.2 Å²	54.2	29%	0.289	28%	0.279	S	S	.	.			trans	-70.2	115.5	171.8	-175	-25.8	0	0	0	109	T530 T531 G532 E533	N528-T530 PolarHBondContact O-N 3.09Å; N528-T530 PolarHBondContact OD1-N 3.32Å; N528-T530 VanDerWaalsContact OD1-N 3.15Å; N528-T530 PolarHBondContact OD1-OG1 2.87Å; N528-T530 VanDerWaalsContact OD1-OG1 3.07Å; N528-T531 WeakPolarHBondContact CB-OG1 3.3Å; N528-T531 PolarHBondContact ND2-OG1 3.07Å; N528-T531 VanDerWaalsContact ND2-OG1 3.09Å; N528-T531 PolarHBondContact OD1-N 3.45Å; N528-G532 WeakPolarHBondContact O-CA 3.46Å; N528-G532 PolarHBondContact O-N 3.29Å; N528-E533 HydrophobicContact CB-CB 4.29Å; N528-E533 PolarHBondContact N-O 3.41Å
529	S	92.2	Very high	79.3	Confident	53 Å²	53	52.4 Å²	52.4	37%	0.371	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-23.4	-172.4	62	0	0	0	0	113.8	Q513 Y514 L527	Q513-S529 CarbonylContact C-O 3.58Å; Q513-S529 VanDerWaalsContact CA-O 3.3Å; Q513-S529 WeakPolarHBondContact CA-O 3.41Å; Y514-S529 WeakPolarHBondContact CD2-O 3.18Å; Y514-S529 PolarHBondContact N-O 3.05Å; Y514-S529 WeakPolarHBondContact O-CA 3.12Å; Y514-S529 WeakPolarHBondContact O-CB 3.49Å; L527-S529 PolarHBondContact O-N 3.25Å
530	T	91.6	Very high	79.4	Confident	97 Å²	97	47 Å²	47	60%	0.595	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-39.5	-179.5	57.7	0	0	0	0	112.2	N528	N528-T530 PolarHBondContact O-N 3.09Å; N528-T530 PolarHBondContact OD1-N 3.32Å; N528-T530 VanDerWaalsContact OD1-N 3.15Å; N528-T530 PolarHBondContact OD1-OG1 2.87Å; N528-T530 VanDerWaalsContact OD1-OG1 3.07Å
531	T	91.4	Very high	80	Confident	44 Å²	44	45.9 Å²	45.9	27%	0.27	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-18.3	-177.6	70.1	0	0	0	0	113.5	K498 N528 E533	K498-T531 WeakPolarHBondContact CE-O 3.38Å; K498-T531 WeakPolarHBondContact CG-O 3.24Å; N528-T531 WeakPolarHBondContact CB-OG1 3.3Å; N528-T531 PolarHBondContact ND2-OG1 3.07Å; N528-T531 VanDerWaalsContact ND2-OG1 3.09Å; N528-T531 PolarHBondContact OD1-N 3.45Å; T531-E533 PolarHBondContact O-N 3.5Å; T531-E533 WeakPolarHBondContact OG1-CB 3.46Å; T531-E533 WeakPolarHBondContact OG1-CG 3.04Å; T531-E533 PolarHBondContact OG1-N 2.77Å; T531-E533 PolarHBondContact OG1-OE2 3.49Å
532	G	91.7	Very high	80.8	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.254	C	S	.	.			trans	73.2	13.3	-174.5	0	0	0	0	0	113.8	K498 F499 Y514 N528	K498-G532 WeakPolarHBondContact CA-O 3.42Å; F499-G532 WeakPolarHBondContact CD2-O 3.37Å; F499-G532 PolarHBondContact N-O 3.05Å; Y514-G532 VanDerWaalsContact CD2-CA 3.44Å; N528-G532 WeakPolarHBondContact O-CA 3.46Å; N528-G532 PolarHBondContact O-N 3.29Å
533	E	92.2	Very high	81.8	Confident	46 Å²	46	47.9 Å²	47.9	22%	0.215	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	122	-179.5	-72	158.1	-177.6	0	0	111.3	V495 K498 L527 N528 T531 I535	V495-E533 HydrophobicContact CG1-CB 4.24Å; V495-E533 HydrophobicContact CG1-CG 4.29Å; K498-E533 HydrophobicContact CB-CG 3.99Å; K498-E533 HydrophobicContact CD-CG 3.84Å; K498-E533 HydrophobicContact CG-CG 3.81Å; K498-E533 IonicContact NZ-OE1 3.01Å; K498-E533 PolarHBondContact NZ-OE1 2.9Å; L527-E533 WeakPolarHBondContact CA-O 3.36Å; N528-E533 HydrophobicContact CB-CB 4.29Å; N528-E533 PolarHBondContact N-O 3.41Å; T531-E533 PolarHBondContact O-N 3.5Å; T531-E533 WeakPolarHBondContact OG1-CB 3.46Å; T531-E533 WeakPolarHBondContact OG1-CG 3.04Å; T531-E533 PolarHBondContact OG1-N 2.77Å; T531-E533 PolarHBondContact OG1-OE2 3.49Å; E533-I535 HydrophobicContact CB-CD1 4.45Å; E533-I535 HydrophobicContact CB-CG1 4.37Å
534	L	89.9	Confident	82.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	114.5	172.4	-173.8	66.9	0	0	0	109.7	V495 I496 T497 F499 I516 L527 M572 I574	V495-L534 WeakPolarHBondContact CA-O 3.49Å; I496-L534 HydrophobicContact CD1-CD2 4.33Å; I496-L534 HydrophobicContact CD1-CG 4.48Å; I496-L534 PolarHBondContact N-O 3.21Å; T497-L534 HydrophobicContact CG2-CB 4.05Å; T497-L534 HydrophobicContact CG2-CD2 4.3Å; T497-L534 PolarHBondContact O-N 3.36Å; F499-L534 HydrophobicContact CE2-CB 4Å; F499-L534 HydrophobicContact CZ-CD2 4.41Å; I516-L534 HydrophobicContact CD1-CD1 4.11Å; L527-L534 HydrophobicContact CB-CD1 4.35Å; L527-L534 HydrophobicContact CD1-CB 4.45Å; L534-M572 HydrophobicContact CD2-SD 3.8Å; L534-I574 HydrophobicContact CD2-CD1 3.92Å
535	I	88.3	Confident	82.9	Confident	27 Å²	27	53.5 Å²	53.5	14%	0.138	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	140.1	-170.8	-59.7	161	0	0	0	110.3	Q494 V495 L526 E533 Q537	Q494-I535 WeakPolarHBondContact O-CA 3.16Å; V495-I535 HydrophobicContact CG2-CG1 4.01Å; L526-I535 HydrophobicContact CB-CB 4.18Å; L526-I535 HydrophobicContact CD2-CB 4.44Å; L526-I535 HydrophobicContact CD2-CD1 3.99Å; L526-I535 PolarHBondContact N-O 3.43Å; L526-I535 PolarHBondContact O-N 2.97Å; E533-I535 HydrophobicContact CB-CD1 4.45Å; E533-I535 HydrophobicContact CB-CG1 4.37Å; I535-Q537 PolarHBondContact O-N 3.06Å
536	I	85.6	Confident	82.6	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	29%	0.291	C	S	.	.			trans	-73.5	116.5	173.7	-68.7	167.7	0	0	0	109.3	V486 V490 G493 Q494 I496 Q538 L540	V486-I536 HydrophobicContact CG1-CD1 4.27Å; V490-I536 HydrophobicContact CB-CD1 3.86Å; V490-I536 HydrophobicContact CG1-CD1 3.14Å; G493-I536 PolarHBondContact N-O 2.94Å; Q494-I536 PolarHBondContact O-N 3.31Å; I496-I536 HydrophobicContact CD1-CD1 4.05Å; I496-I536 HydrophobicContact CD1-CG1 3.62Å; I496-I536 HydrophobicContact CG1-CD1 3.81Å; I496-I536 HydrophobicContact CG1-CG1 3.68Å; I536-Q538 WeakPolarHBondContact CG2-O 2.98Å; I536-L540 HydrophobicContact CD1-CD1 3.85Å; I536-L540 HydrophobicContact CG1-CD1 4.39Å; I536-L540 HydrophobicContact CG2-CD2 4.31Å; I536-L540 HydrophobicContact CG2-CG 4.33Å
537	Q	82.1	Confident	81.9	Confident	96 Å²	96	53.2 Å²	53.2	45%	0.449	29%	0.287	S	S	.	.			trans	-95.8	-25.4	-178.6	-162	-168.5	17.7	0	0	112.8	V492 K525 I535	V492-Q537 WeakPolarHBondContact CG1-O 3.04Å; K525-Q537 PolarHBondContact O-OE1 3.06Å; I535-Q537 PolarHBondContact O-N 3.06Å
538	Q	80.9	Confident	80.7	Confident	105 Å²	105	52.7 Å²	52.7	49%	0.491	29%	0.286	S	S	.	.	S	Bend	trans	-135.7	154	-177.7	-65.2	-179.8	4.6	0	0	109	I536 L540	I536-Q538 WeakPolarHBondContact CG2-O 2.98Å; Q538-L540 PolarHBondContact O-N 2.87Å
539	S	81.4	Confident	79.7	Confident	90 Å²	90	53 Å²	53	63%	0.629	29%	0.287	S	S	*	.			trans	-56.9	138.4	174.3	45.9	0	0	0	0	109.8
540	L	83.5	Confident	78.8	Confident	9 Å²	9	50.5 Å²	50.5	5%	0.047	27%	0.27	C	S	.	.			trans	-89.2	143	176.5	-49.4	177.4	0	0	0	107.4	V486 E488 V490 I523 T524 I536 Q538 I576	V486-L540 HydrophobicContact CG1-CD1 3.69Å; E488-L540 HydrophobicContact CB-CB 4.34Å; E488-L540 VanDerWaalsContact O-O 3.06Å; V490-L540 HydrophobicContact CB-CD1 4.49Å; I523-L540 HydrophobicContact CG2-CD2 3.62Å; T524-L540 HydrophobicContact CG2-CD2 3.87Å; I536-L540 HydrophobicContact CD1-CD1 3.85Å; I536-L540 HydrophobicContact CG1-CD1 4.39Å; I536-L540 HydrophobicContact CG2-CD2 4.31Å; I536-L540 HydrophobicContact CG2-CG 4.33Å; Q538-L540 PolarHBondContact O-N 2.87Å; L540-I576 HydrophobicContact CB-CD1 4.47Å; L540-I576 HydrophobicContact CD1-CD1 3.78Å; L540-I576 HydrophobicContact CG-CD1 4.48Å
541	D	82	Confident	78.4	Confident	48 Å²	48	47 Å²	47	26%	0.257	25%	0.248	S	C	.	.			trans	-149.1	116.8	177.6	174.4	-32	0	0	0	105.3	E543 L544	D541-E543 VanDerWaalsContact C-N 3.32Å; D541-E543 WeakPolarHBondContact OD1-CA 3.29Å; D541-E543 WeakPolarHBondContact OD1-CB 3.33Å; D541-E543 PolarHBondContact OD1-N 2.96Å; D541-L544 HydrophobicContact CB-CB 4.26Å; D541-L544 HydrophobicContact CB-CD1 3.7Å; D541-L544 HydrophobicContact CB-CG 3.9Å; D541-L544 VanDerWaalsContact CG-CG 3.49Å; D541-L544 PolarHBondContact OD1-N 3.46Å; D541-L544 WeakPolarHBondContact OD2-CG 3.49Å
542	R	82	Confident	77.9	Confident	82 Å²	82	45.1 Å²	45.1	31%	0.309	24%	0.236	S	C	.	.	S	Bend	trans	-70.5	-34.6	-176.4	-171.6	-161.5	68.4	155.9	-8.4	110.4	E488 I576 D578	E488-R542 WeakPolarHBondContact OE2-CB 3.28Å; E488-R542 PolarHBondContact OE2-N 2.83Å; R542-I576 HydrophobicContact CB-CG2 3.99Å; R542-I576 HydrophobicContact CG-CG2 4.5Å; R542-D578 VanDerWaalsContact CZ-CB 3.45Å; R542-D578 IonicContact CZ-OD1 2.81Å; R542-D578 VanDerWaalsContact CZ-OD1 3.28Å; R542-D578 IonicContact CZ-OD2 3.83Å; R542-D578 IonicContact NE-OD1 2.82Å; R542-D578 IonicContact NE-OD2 3.28Å; R542-D578 VanDerWaalsContact NH1-CB 3.27Å; R542-D578 IonicContact NH1-OD1 2.88Å; R542-D578 IonicContact NH1-OD2 3.79Å; R542-D578 PolarHBondContact NH1-OD2 2.8Å; R542-D578 IonicContact NH2-OD1 3.01Å; R542-D578 PolarHBondContact NH2-OD1 3.07Å; R542-D578 IonicContact NH2-OD2 3.82Å; R542-D578 PolarHBondContact NH2-OD2 3.11Å
543	E	80.1	Confident	77.6	Confident	58 Å²	58	50 Å²	50	27%	0.271	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-28.3	-176.5	-72.1	61.6	-130.8	0	0	112.7	D541 L545 P546	D541-E543 VanDerWaalsContact C-N 3.32Å; D541-E543 WeakPolarHBondContact OD1-CA 3.29Å; D541-E543 WeakPolarHBondContact OD1-CB 3.33Å; D541-E543 PolarHBondContact OD1-N 2.96Å; E543-L545 PolarHBondContact O-N 2.77Å; E543-P546 VanDerWaalsContact O-CD 3.28Å; E543-P546 WeakPolarHBondContact O-CD 3.26Å
544	L	72.2	Confident	77.4	Confident	119 Å²	119	48.2 Å²	48.2	62%	0.623	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-29.4	177	-81.9	177.1	0	0	0	113.5	D541 P546	D541-L544 HydrophobicContact CB-CB 4.26Å; D541-L544 HydrophobicContact CB-CD1 3.7Å; D541-L544 HydrophobicContact CB-CG 3.9Å; D541-L544 VanDerWaalsContact CG-CG 3.49Å; D541-L544 PolarHBondContact OD1-N 3.46Å; D541-L544 WeakPolarHBondContact OD2-CG 3.49Å; L544-P546 WeakPolarHBondContact O-CD 3.45Å
545	L	65.1	Low	77.4	Confident	18 Å²	18	48.7 Å²	48.7	9%	0.094	25%	0.25	C	C	.	.			trans	-117.7	69.5	176.9	-66.8	178.5	0	0	0	111.3	H521 I523 E543 L547 S548 N549	H521-L545 HydrophobicContact CB-CD1 3.58Å; H521-L545 VanDerWaalsContact CG-CD1 3.45Å; I523-L545 HydrophobicContact CD1-CD1 3.28Å; I523-L545 HydrophobicContact CD1-CG 3.78Å; I523-L545 HydrophobicContact CG1-CD1 4.04Å; E543-L545 PolarHBondContact O-N 2.77Å; L545-L547 PolarHBondContact O-N 2.9Å; L545-S548 WeakPolarHBondContact CB-OG 3.3Å; L545-S548 PolarHBondContact O-N 2.58Å; L545-S548 PolarHBondContact O-OG 2.78Å; L545-S548 VanDerWaalsContact O-OG 3.12Å; L545-N549 PolarHBondContact O-N 3.01Å
546	P	56.5	Low	77.6	Confident	72 Å²	72	47.4 Å²	47.4	47%	0.468	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-12.7	-177.6	28.4	-32.1	0	0	0	112.2	E543 L544 N549	E543-P546 VanDerWaalsContact O-CD 3.28Å; E543-P546 WeakPolarHBondContact O-CD 3.26Å; L544-P546 WeakPolarHBondContact O-CD 3.45Å; P546-N549 PolarHBondContact O-OD1 2.82Å
547	L	53.3	Low	78	Confident	72 Å²	72	47.4 Å²	47.4	38%	0.377	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-25.8	175.3	-75.9	171.6	0	0	0	113.7	L545 Y975 M1002	L545-L547 PolarHBondContact O-N 2.9Å; L547-Y975 HydrophobicContact CD1-CE2 4.04Å; L547-Y975 WeakPolarHBondContact CD1-OH 3.37Å; L547-M1002 HydrophobicContact CD1-CE 4.38Å; L547-M1002 HydrophobicContact CD1-SD 4.18Å
548	S	61.1	Low	78.6	Confident	16 Å²	16	42.8 Å²	42.8	11%	0.112	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	-8.3	-179.4	66	0	0	0	0	113.2	L545 G550 L551	L545-S548 WeakPolarHBondContact CB-OG 3.3Å; L545-S548 PolarHBondContact O-N 2.58Å; L545-S548 PolarHBondContact O-OG 2.78Å; L545-S548 VanDerWaalsContact O-OG 3.12Å; S548-G550 PolarHBondContact O-N 2.96Å; S548-L551 VanDerWaalsContact CB-O 3.31Å; S548-L551 WeakPolarHBondContact CB-O 2.99Å; S548-L551 VanDerWaalsContact O-CB 3.28Å; S548-L551 WeakPolarHBondContact O-CB 3.13Å; S548-L551 PolarHBondContact O-N 2.98Å
549	N	70.1	Confident	79.4	Confident	59 Å²	59	40.4 Å²	40.4	32%	0.316	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	36.7	-171.9	-67.5	-12.7	0	0	0	112.2	L545 P546 L551 N1151	L545-N549 PolarHBondContact O-N 3.01Å; P546-N549 PolarHBondContact O-OD1 2.82Å; N549-L551 VanDerWaalsContact C-N 3.33Å; N549-L551 PolarHBondContact O-N 2.96Å; N549-N1151 PolarHBondContact ND2-ND2 3.45Å
550	G	74.8	Confident	80.1	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.01	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	3.9	-175.4	0	0	0	0	0	115.4	S548 H552 I576	S548-G550 PolarHBondContact O-N 2.96Å; G550-H552 PolarHBondContact O-CD2 3.12Å; G550-I576 WeakPolarHBondContact O-CG1 3.38Å; G550-I576 PolarHBondContact O-N 3.13Å
551	L	82.3	Confident	80.7	Confident	23 Å²	23	38.1 Å²	38.1	12%	0.12	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	124.7	-179.9	-63.3	171.9	0	0	0	112.6	Y483 S548 N549 Y553 I573 I574 N575	Y483-L551 HydrophobicContact CE2-CD2 4.48Å; S548-L551 VanDerWaalsContact CB-O 3.31Å; S548-L551 WeakPolarHBondContact CB-O 2.99Å; S548-L551 VanDerWaalsContact O-CB 3.28Å; S548-L551 WeakPolarHBondContact O-CB 3.13Å; S548-L551 PolarHBondContact O-N 2.98Å; N549-L551 VanDerWaalsContact C-N 3.33Å; N549-L551 PolarHBondContact O-N 2.96Å; L551-Y553 HydrophobicContact CB-CE2 4.16Å; L551-I573 HydrophobicContact CD2-CG2 3.98Å; L551-I574 CarbonylContact C-O 3.6Å; L551-I574 WeakPolarHBondContact CA-O 3.48Å; L551-N575 HydrophobicContact CD2-CB 3.85Å; L551-N575 WeakPolarHBondContact CD2-OD1 3.23Å
552	H	81.6	Confident	81.2	Confident	5 Å²	5	36.1 Å²	36.1	2%	0.023	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	123.4	173.7	-60.5	-99.5	0	0	0	109.9	G550 I573 I574	G550-H552 PolarHBondContact O-CD2 3.12Å; H552-I573 CarbonylContact O-C 3.54Å; H552-I573 WeakPolarHBondContact O-CA 3.18Å; H552-I574 HydrophobicContact CB-CB 4.23Å; H552-I574 PolarHBondContact N-O 2.96Å; H552-I574 PolarHBondContact O-N 2.7Å
553	Y	85.7	Confident	81.6	Confident	104 Å²	104	39.8 Å²	39.8	41%	0.408	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	129	176.6	-59.1	-93.1	0	0	0	108.8	Y519 T520 L551 M572 I573	Y519-Y553 CarbonylContact C-O 3.18Å; Y519-Y553 VanDerWaalsContact CA-O 3.24Å; Y519-Y553 WeakPolarHBondContact CA-O 3.46Å; T520-Y553 HydrophobicContact CG2-CD2 3.88Å; T520-Y553 HydrophobicContact CG2-CG 4.25Å; T520-Y553 PolarHBondContact N-O 2.76Å; T520-Y553 VanDerWaalsContact N-O 3.07Å; T520-Y553 PolarHBondContact OG1-N 3.23Å; L551-Y553 HydrophobicContact CB-CE2 4.16Å; Y553-M572 WeakPolarHBondContact CA-O 3.42Å; Y553-I573 HydrophobicContact CD1-CD1 4.17Å; Y553-I573 HydrophobicContact CD1-CG1 3.74Å; Y553-I573 HydrophobicContact CE1-CD1 3.78Å; Y553-I573 HydrophobicContact CE1-CG1 3.83Å; Y553-I573 HydrophobicContact CE1-CG2 4.28Å
554	L	87.9	Confident	82.2	Confident	7 Å²	7	41.7 Å²	41.7	4%	0.037	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	146.4	176	-60.7	117.2	0	0	0	109.9	I516 Q518 I556 M572 I574	I516-L554 HydrophobicContact CD1-CD2 4.14Å; I516-L554 HydrophobicContact CG2-CD2 3.99Å; Q518-L554 CarbonylContact O-C 3.58Å; Q518-L554 WeakPolarHBondContact O-CA 3.31Å; L554-I556 HydrophobicContact CB-CD1 4.45Å; L554-M572 HydrophobicContact CB-CB 4.21Å; L554-M572 HydrophobicContact CB-CG 4.47Å; L554-M572 HydrophobicContact CD1-CG 4.2Å; L554-M572 HydrophobicContact CD1-SD 4.05Å; L554-M572 PolarHBondContact N-O 3.1Å; L554-M572 PolarHBondContact O-N 3.24Å; L554-I574 HydrophobicContact CD1-CD1 3.36Å; L554-I574 HydrophobicContact CD1-CG1 3.68Å
555	T	89.9	Confident	83.3	Confident	10 Å²	10	41.1 Å²	41.1	6%	0.061	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	118.3	165.4	-55.4	0	0	0	0	107.9	S517 Q518 N569 F571	S517-T555 PolarHBondContact N-O 2.87Å; S517-T555 WeakPolarHBondContact OG-CB 3.3Å; S517-T555 VanDerWaalsContact OG-CG2 3.32Å; S517-T555 WeakPolarHBondContact OG-CG2 3.3Å; S517-T555 PolarHBondContact OG-O 3.13Å; Q518-T555 PolarHBondContact O-N 2.89Å; T555-N569 HydrophobicContact CG2-CB 3.98Å; T555-F571 HydrophobicContact CG2-CD1 4.19Å; T555-F571 HydrophobicContact CG2-CE1 4.06Å
556	I	91.6	Very high	84.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	125.7	177.5	-51.4	-61.8	0	0	0	107.2	F457 F499 I516 L527 L554 N569 L570	F457-I556 HydrophobicContact CE1-CG2 4.25Å; F457-I556 HydrophobicContact CZ-CG2 4.09Å; F499-I556 HydrophobicContact CD2-CG1 4.42Å; F499-I556 HydrophobicContact CD2-CG2 3.82Å; F499-I556 HydrophobicContact CE1-CG1 4.08Å; F499-I556 HydrophobicContact CE2-CB 4.41Å; F499-I556 HydrophobicContact CE2-CD1 3.83Å; F499-I556 HydrophobicContact CE2-CG1 3.72Å; F499-I556 HydrophobicContact CE2-CG2 3.95Å; F499-I556 HydrophobicContact CG-CG2 4.16Å; F499-I556 HydrophobicContact CZ-CB 4.43Å; F499-I556 HydrophobicContact CZ-CD1 3.98Å; F499-I556 HydrophobicContact CZ-CG1 3.53Å; F499-I556 HydrophobicContact CZ-CG2 4.4Å; I516-I556 HydrophobicContact CG1-CD1 3.95Å; L527-I556 HydrophobicContact CD2-CD1 4.29Å; L527-I556 HydrophobicContact CD2-CG2 4.2Å; L554-I556 HydrophobicContact CB-CD1 4.45Å; I556-N569 CarbonylContact O-C 3.51Å; I556-N569 WeakPolarHBondContact O-CA 3.3Å; I556-L570 HydrophobicContact CB-CB 4.42Å; I556-L570 PolarHBondContact N-O 3.5Å; I556-L570 PolarHBondContact O-N 2.85Å
557	T	93.9	Very high	86.7	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	127.4	177.8	-50.3	0	0	0	0	109.3	Y514 R515 S517 Y559 S568 N569	Y514-T557 WeakPolarHBondContact CA-O 3.12Å; R515-T557 PolarHBondContact N-O 2.85Å; R515-T557 PolarHBondContact O-N 2.88Å; S517-T557 WeakPolarHBondContact CB-OG1 3.49Å; S517-T557 PolarHBondContact OG-OG1 2.9Å; T557-Y559 VanDerWaalsContact CB-CE2 3.45Å; T557-Y559 HydrophobicContact CG2-CD1 4.39Å; T557-Y559 HydrophobicContact CG2-CD2 3.87Å; T557-Y559 HydrophobicContact CG2-CE1 3.81Å; T557-Y559 HydrophobicContact CG2-CE2 3.23Å; T557-Y559 HydrophobicContact CG2-CG 4.4Å; T557-Y559 VanDerWaalsContact CG2-OH 3.31Å; T557-Y559 WeakPolarHBondContact CG2-OH 3.31Å; T557-S568 CarbonylContact C-O 3.59Å; T557-S568 VanDerWaalsContact CA-O 3.26Å; T557-S568 WeakPolarHBondContact CA-O 3.38Å; T557-S568 VanDerWaalsContact CG2-O 3.3Å; T557-S568 WeakPolarHBondContact CG2-O 3.28Å; T557-N569 WeakPolarHBondContact CB-OD1 3.36Å; T557-N569 WeakPolarHBondContact CG2-OD1 3.38Å; T557-N569 PolarHBondContact OG1-OD1 2.95Å
558	A	95.9	Very high	88.6	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	132.2	168.2	0	0	0	0	0	108.4	P455 F457 A501 I512 Q513 Y514 S567 S568	P455-A558 HydrophobicContact CB-CB 3.93Å; F457-A558 HydrophobicContact CE1-CB 4.11Å; F457-A558 HydrophobicContact CE2-CB 3.9Å; F457-A558 HydrophobicContact CZ-CB 3.55Å; A501-A558 HydrophobicContact CB-CB 3.71Å; I512-A558 HydrophobicContact CG2-CB 4.02Å; Q513-A558 WeakPolarHBondContact O-CA 3.26Å; Y514-A558 HydrophobicContact CD1-CB 4.09Å; Y514-A558 HydrophobicContact CE1-CB 4.09Å; A558-S567 CarbonylContact O-C 3.52Å; A558-S567 WeakPolarHBondContact O-CA 3.45Å; A558-S567 VanDerWaalsContact O-CB 3.31Å; A558-S567 WeakPolarHBondContact O-CB 3.19Å; A558-S568 PolarHBondContact N-O 3.09Å; A558-S568 PolarHBondContact O-N 3.26Å
559	Y	96.1	Very high	90.1	Very high	55 Å²	55	44.1 Å²	44.1	22%	0.216	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	141.8	176.1	-57.1	-99.9	0	0	0	109	I512 Q513 R515 T557 Q565 R566	I512-Y559 CarbonylContact C-O 3.6Å; I512-Y559 VanDerWaalsContact CA-O 3.29Å; I512-Y559 WeakPolarHBondContact CA-O 3.35Å; Q513-Y559 PolarHBondContact N-O 3.21Å; Q513-Y559 PolarHBondContact O-N 3.35Å; R515-Y559 HydrophobicContact CB-CE2 4.08Å; T557-Y559 VanDerWaalsContact CB-CE2 3.45Å; T557-Y559 HydrophobicContact CG2-CD1 4.39Å; T557-Y559 HydrophobicContact CG2-CD2 3.87Å; T557-Y559 HydrophobicContact CG2-CE1 3.81Å; T557-Y559 HydrophobicContact CG2-CE2 3.23Å; T557-Y559 HydrophobicContact CG2-CG 4.4Å; T557-Y559 VanDerWaalsContact CG2-OH 3.31Å; T557-Y559 WeakPolarHBondContact CG2-OH 3.31Å; Y559-Q565 HydrophobicContact CD1-CG 4.19Å; Y559-R566 VanDerWaalsContact CA-O 3.3Å; Y559-R566 WeakPolarHBondContact CA-O 3.45Å
560	D	97	Very high	91	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.21	C	C	.	.			trans	-73.8	180	161.8	61.7	51.4	0	0	0	110.5	N451 P455 N509 E511 G562 Q565 R566	N451-D560 VanDerWaalsContact ND2-CG 3.26Å; N451-D560 PolarHBondContact ND2-OD1 3.22Å; N451-D560 VanDerWaalsContact ND2-OD1 3.13Å; N451-D560 PolarHBondContact ND2-OD2 2.81Å; N451-D560 PolarHBondContact OD1-OD2 3.4Å; P455-D560 HydrophobicContact CG-CB 4.14Å; N509-D560 WeakPolarHBondContact O-CB 3.42Å; E511-D560 CarbonylContact O-C 3.57Å; E511-D560 WeakPolarHBondContact O-CA 3.43Å; D560-G562 PolarHBondContact OD1-N 2.75Å; D560-Q565 WeakPolarHBondContact O-CG 3.42Å; D560-Q565 PolarHBondContact O-NE2 2.88Å; D560-Q565 VanDerWaalsContact OD1-CA 3.3Å; D560-Q565 WeakPolarHBondContact OD1-CA 3.25Å; D560-R566 PolarHBondContact N-O 2.97Å; D560-R566 VanDerWaalsContact N-O 3.12Å; D560-R566 PolarHBondContact OD1-N 2.93Å; D560-R566 VanDerWaalsContact OD1-N 3.1Å; D560-R566 VanDerWaalsContact OD2-CA 3.26Å; D560-R566 WeakPolarHBondContact OD2-CA 3.29Å; D560-R566 WeakPolarHBondContact OD2-CB 3.3Å; D560-R566 PolarHBondContact OD2-N 2.88Å
561	Q	95.2	Very high	91.7	Very high	51 Å²	51	44.5 Å²	44.5	24%	0.238	22%	0.224	C	C	.	.	S	Bend	trans	-110.8	20.9	171.3	-67.7	-179.5	41	0	0	112.1	K508 E511 Q513	K508-Q561 HydrophobicContact CB-CB 4.29Å; K508-Q561 CarbonylContact O-C 3.59Å; K508-Q561 VanDerWaalsContact O-CA 3.26Å; K508-Q561 WeakPolarHBondContact O-CA 3.16Å; K508-Q561 WeakPolarHBondContact O-CB 3.44Å; K508-Q561 PolarHBondContact O-N 2.92Å; E511-Q561 HydrophobicContact CB-CB 4.3Å; E511-Q561 HydrophobicContact CB-CG 4.31Å; E511-Q561 VanDerWaalsContact CD-CD 3.48Å; E511-Q561 VanDerWaalsContact CG-NE2 3.34Å; E511-Q561 WeakPolarHBondContact O-CG 3.38Å; E511-Q561 PolarHBondContact O-N 3.14Å; E511-Q561 VanDerWaalsContact O-N 3.14Å; E511-Q561 PolarHBondContact OE1-NE2 2.79Å; Q513-Q561 HydrophobicContact CG-CG 4.23Å
562	G	92.9	Very high	91.9	Very high	6 Å²	6	43.5 Å²	43.5	6%	0.062	22%	0.219	C	C	.	.	S	Bend	trans	-78.4	176.3	-178.6	0	0	0	0	0	113.5	K508 N509 D560 P564 Q565	K508-G562 PolarHBondContact O-N 2.83Å; N509-G562 WeakPolarHBondContact OD1-CA 3.09Å; D560-G562 PolarHBondContact OD1-N 2.75Å; G562-P564 CarbonylContact O-C 3.55Å; G562-Q565 VanDerWaalsContact O-CA 3.31Å; G562-Q565 WeakPolarHBondContact O-CA 3.26Å; G562-Q565 PolarHBondContact O-N 3.4Å; G562-Q565 VanDerWaalsContact O-N 3.13Å
563	I	91	Very high	92.2	Very high	159 Å²	159	45 Å²	45	82%	0.815	23%	0.226	S	C	*	.	S	Bend	trans	-129.7	113.9	176.2	-58.1	176.5	0	0	0	108.5
564	P	93.2	Very high	92.3	Very high	98 Å²	98	40.1 Å²	40.1	64%	0.636	21%	0.207	S	C	*	.	S	Bend	cis	-69.5	144.9	-3.8	31.4	-35.2	0	0	0	111.5	N451 G562	N451-P564 PolarHBondContact ND2-O 3.45Å; G562-P564 CarbonylContact O-C 3.55Å
565	Q	95.1	Very high	92.3	Very high	106 Å²	106	41 Å²	41	50%	0.495	21%	0.212	S	C	.	.			trans	-66.5	135	177.3	177	175.5	63.7	0	0	111	Y559 D560 G562	Y559-Q565 HydrophobicContact CD1-CG 4.19Å; D560-Q565 WeakPolarHBondContact O-CG 3.42Å; D560-Q565 PolarHBondContact O-NE2 2.88Å; D560-Q565 VanDerWaalsContact OD1-CA 3.3Å; D560-Q565 WeakPolarHBondContact OD1-CA 3.25Å; G562-Q565 VanDerWaalsContact O-CA 3.31Å; G562-Q565 WeakPolarHBondContact O-CA 3.26Å; G562-Q565 PolarHBondContact O-N 3.4Å; G562-Q565 VanDerWaalsContact O-N 3.13Å
566	R	95.9	Very high	92.2	Very high	83 Å²	83	40.7 Å²	40.7	31%	0.313	21%	0.21	S	C	.	.			trans	-115	159.7	177.1	-53.2	172.8	51	148.7	-9.7	110.5	N451 D452 C453 K454 Y559 D560	N451-R566 WeakPolarHBondContact O-CD 3.42Å; N451-R566 PolarHBondContact O-NH1 3.33Å; D452-R566 VanDerWaalsContact C-CZ 3.41Å; D452-R566 PolarHBondContact O-NH1 3.07Å; D452-R566 PolarHBondContact O-NH2 3.15Å; C453-R566 WeakPolarHBondContact O-CD 3.41Å; C453-R566 PolarHBondContact O-NE 2.81Å; K454-R566 HydrophobicContact CB-CB 3.86Å; Y559-R566 VanDerWaalsContact CA-O 3.3Å; Y559-R566 WeakPolarHBondContact CA-O 3.45Å; D560-R566 PolarHBondContact N-O 2.97Å; D560-R566 VanDerWaalsContact N-O 3.12Å; D560-R566 PolarHBondContact OD1-N 2.93Å; D560-R566 VanDerWaalsContact OD1-N 3.1Å; D560-R566 VanDerWaalsContact OD2-CA 3.26Å; D560-R566 WeakPolarHBondContact OD2-CA 3.29Å; D560-R566 WeakPolarHBondContact OD2-CB 3.3Å; D560-R566 PolarHBondContact OD2-N 2.88Å
567	S	95.5	Very high	91.9	Very high	54 Å²	54	43.7 Å²	43.7	38%	0.378	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	157.1	-172	66.4	0	0	0	0	114.2	A558	A558-S567 CarbonylContact O-C 3.52Å; A558-S567 WeakPolarHBondContact O-CA 3.45Å; A558-S567 VanDerWaalsContact O-CB 3.31Å; A558-S567 WeakPolarHBondContact O-CB 3.19Å
568	S	94.3	Very high	91.4	Very high	18 Å²	18	47.7 Å²	47.7	13%	0.126	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	155.5	170.1	66	0	0	0	0	111.4	P455 F457 T557 A558	P455-S568 WeakPolarHBondContact O-CB 3.36Å; P455-S568 PolarHBondContact O-OG 2.93Å; F457-S568 WeakPolarHBondContact CE2-O 3.44Å; F457-S568 WeakPolarHBondContact CE2-OG 3.19Å; T557-S568 CarbonylContact C-O 3.59Å; T557-S568 VanDerWaalsContact CA-O 3.26Å; T557-S568 WeakPolarHBondContact CA-O 3.38Å; T557-S568 VanDerWaalsContact CG2-O 3.3Å; T557-S568 WeakPolarHBondContact CG2-O 3.28Å; A558-S568 PolarHBondContact N-O 3.09Å; A558-S568 PolarHBondContact O-N 3.26Å
569	N	92.4	Very high	90.7	Very high	87 Å²	87	50 Å²	50	47%	0.465	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	137.5	-177.2	-66.7	-37.2	0	0	0	110.8	T555 I556 T557	T555-N569 HydrophobicContact CG2-CB 3.98Å; I556-N569 CarbonylContact O-C 3.51Å; I556-N569 WeakPolarHBondContact O-CA 3.3Å; T557-N569 WeakPolarHBondContact CB-OD1 3.36Å; T557-N569 WeakPolarHBondContact CG2-OD1 3.38Å; T557-N569 PolarHBondContact OG1-OD1 2.95Å
570	L	89.8	Confident	89.8	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	123.5	166.8	176.8	65.5	0	0	0	108.8	F457 L459 F499 I556	F457-L570 HydrophobicContact CD1-CB 4.13Å; F457-L570 HydrophobicContact CD1-CD2 4.03Å; F457-L570 HydrophobicContact CD2-CB 3.71Å; F457-L570 HydrophobicContact CE1-CB 4.09Å; F457-L570 HydrophobicContact CE1-CD2 4.3Å; F457-L570 HydrophobicContact CE2-CB 3.66Å; F457-L570 HydrophobicContact CG-CB 3.94Å; F457-L570 HydrophobicContact CG-CD2 4.35Å; F457-L570 HydrophobicContact CZ-CB 3.85Å; L459-L570 HydrophobicContact CD2-CD1 3.57Å; F499-L570 HydrophobicContact CD1-CD2 3.61Å; F499-L570 HydrophobicContact CE1-CD2 3.72Å; I556-L570 HydrophobicContact CB-CB 4.42Å; I556-L570 PolarHBondContact N-O 3.5Å; I556-L570 PolarHBondContact O-N 2.85Å
571	F	88.9	Confident	88.7	Confident	66 Å²	66	52.6 Å²	52.6	29%	0.289	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	136.7	176.1	-62.1	-76.9	0	0	0	109.9	N479 E480 T481 L482 T555	N479-F571 HydrophobicContact CB-CD2 4.36Å; N479-F571 HydrophobicContact CB-CE2 4.22Å; E480-F571 PolarHBondContact O-N 2.88Å; T481-F571 CarbonylContact C-O 3.57Å; T481-F571 VanDerWaalsContact CA-O 3.28Å; T481-F571 WeakPolarHBondContact CA-O 3.08Å; T481-F571 HydrophobicContact CG2-CB 4.24Å; L482-F571 PolarHBondContact N-O 2.88Å; T555-F571 HydrophobicContact CG2-CD1 4.19Å; T555-F571 HydrophobicContact CG2-CE1 4.06Å
572	M	87.3	Confident	87.4	Confident	3 Å²	3	53.8 Å²	53.8	2%	0.015	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	141.7	-177.5	169.9	174.2	-73.3	0	0	111.4	L482 I484 T497 F499 L534 Y553 L554 I574	L482-M572 HydrophobicContact CB-CE 4.47Å; L482-M572 HydrophobicContact CD2-CE 3.62Å; L482-M572 HydrophobicContact CG-CE 4.24Å; L482-M572 CarbonylContact O-C 3.55Å; L482-M572 VanDerWaalsContact O-CA 3.26Å; L482-M572 WeakPolarHBondContact O-CA 3.41Å; I484-M572 HydrophobicContact CD1-CE 3.53Å; I484-M572 HydrophobicContact CD1-SD 4.29Å; I484-M572 HydrophobicContact CG1-CE 4.29Å; T497-M572 HydrophobicContact CG2-CE 3.92Å; F499-M572 HydrophobicContact CE1-CE 3.35Å; F499-M572 HydrophobicContact CZ-CE 3.28Å; F499-M572 HydrophobicContact CZ-SD 4.08Å; L534-M572 HydrophobicContact CD2-SD 3.8Å; Y553-M572 WeakPolarHBondContact CA-O 3.42Å; L554-M572 HydrophobicContact CB-CB 4.21Å; L554-M572 HydrophobicContact CB-CG 4.47Å; L554-M572 HydrophobicContact CD1-CG 4.2Å; L554-M572 HydrophobicContact CD1-SD 4.05Å; L554-M572 PolarHBondContact N-O 3.1Å; L554-M572 PolarHBondContact O-N 3.24Å; M572-I574 HydrophobicContact CG-CG1 3.95Å; M572-I574 HydrophobicContact SD-CD1 3.92Å; M572-I574 HydrophobicContact SD-CG1 3.77Å
573	I	87.3	Confident	86	Confident	37 Å²	37	57.1 Å²	57.1	19%	0.19	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	118.5	170	-54.8	177.2	0	0	0	107.2	T481 L482 Y483 I484 L551 H552 Y553	T481-I573 HydrophobicContact CG2-CD1 3.89Å; T481-I573 HydrophobicContact CG2-CG1 3.91Å; L482-I573 PolarHBondContact O-N 2.82Å; Y483-I573 CarbonylContact C-O 3.56Å; Y483-I573 WeakPolarHBondContact CA-O 3.39Å; Y483-I573 HydrophobicContact CD2-CB 3.84Å; Y483-I573 HydrophobicContact CD2-CG2 3.77Å; Y483-I573 HydrophobicContact CE2-CB 4.45Å; Y483-I573 HydrophobicContact CE2-CG2 3.87Å; I484-I573 PolarHBondContact N-O 3.47Å; L551-I573 HydrophobicContact CD2-CG2 3.98Å; H552-I573 CarbonylContact O-C 3.54Å; H552-I573 WeakPolarHBondContact O-CA 3.18Å; Y553-I573 HydrophobicContact CD1-CD1 4.17Å; Y553-I573 HydrophobicContact CD1-CG1 3.74Å; Y553-I573 HydrophobicContact CE1-CD1 3.78Å; Y553-I573 HydrophobicContact CE1-CG1 3.83Å; Y553-I573 HydrophobicContact CE1-CG2 4.28Å
574	I	87.5	Confident	84.4	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	123.7	170.5	-56.8	179.9	0	0	0	107.3	I484 V486 I496 L534 L551 H552 L554 M572 I576	I484-I574 CarbonylContact O-C 3.5Å; I484-I574 WeakPolarHBondContact O-CA 3.29Å; V486-I574 HydrophobicContact CB-CG2 4.23Å; V486-I574 HydrophobicContact CG2-CG2 3.78Å; I496-I574 HydrophobicContact CD1-CD1 4.09Å; L534-I574 HydrophobicContact CD2-CD1 3.92Å; L551-I574 CarbonylContact C-O 3.6Å; L551-I574 WeakPolarHBondContact CA-O 3.48Å; H552-I574 HydrophobicContact CB-CB 4.23Å; H552-I574 PolarHBondContact N-O 2.96Å; H552-I574 PolarHBondContact O-N 2.7Å; L554-I574 HydrophobicContact CD1-CD1 3.36Å; L554-I574 HydrophobicContact CD1-CG1 3.68Å; M572-I574 HydrophobicContact CG-CG1 3.95Å; M572-I574 HydrophobicContact SD-CD1 3.92Å; M572-I574 HydrophobicContact SD-CG1 3.77Å; I574-I576 HydrophobicContact CG2-CD1 3.91Å
575	N	87.5	Confident	82.6	Confident	25 Å²	25	52.1 Å²	52.1	13%	0.134	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	114.5	173.9	-177.7	39.1	0	0	0	109.4	Y483 I484 E485 V486 L551 L577	Y483-N575 HydrophobicContact CE1-CB 4.38Å; Y483-N575 HydrophobicContact CE2-CB 4.19Å; Y483-N575 WeakPolarHBondContact OH-CB 3.46Å; Y483-N575 PolarHBondContact OH-ND2 3.32Å; I484-N575 PolarHBondContact O-N 2.84Å; E485-N575 CarbonylContact C-O 3.58Å; E485-N575 WeakPolarHBondContact CA-O 3.23Å; E485-N575 HydrophobicContact CG-CB 4.38Å; V486-N575 PolarHBondContact N-O 3.42Å; L551-N575 HydrophobicContact CD2-CB 3.85Å; L551-N575 WeakPolarHBondContact CD2-OD1 3.23Å; N575-L577 PolarHBondContact O-N 3.49Å
576	I	87.7	Confident	80.6	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.021	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	116.1	174.5	-54.9	-49.8	0	0	0	108.8	V486 E488 L540 R542 G550 I574	V486-I576 HydrophobicContact CB-CD1 4.27Å; V486-I576 CarbonylContact O-C 3.37Å; V486-I576 WeakPolarHBondContact O-CA 3.17Å; E488-I576 HydrophobicContact CB-CG2 3.59Å; L540-I576 HydrophobicContact CB-CD1 4.47Å; L540-I576 HydrophobicContact CD1-CD1 3.78Å; L540-I576 HydrophobicContact CG-CD1 4.48Å; R542-I576 HydrophobicContact CB-CG2 3.99Å; R542-I576 HydrophobicContact CG-CG2 4.5Å; G550-I576 WeakPolarHBondContact O-CG1 3.38Å; G550-I576 PolarHBondContact O-N 3.13Å; I574-I576 HydrophobicContact CG2-CD1 3.91Å
577	L	86.5	Confident	78.5	Confident	63 Å²	63	52.5 Å²	52.5	33%	0.33	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	130.3	177.3	-58.5	178.1	0	0	0	110.1	E485 V486 E488 N575	E485-L577 HydrophobicContact CB-CD1 3.9Å; E485-L577 HydrophobicContact CB-CD2 4.04Å; E485-L577 HydrophobicContact CB-CG 3.97Å; E485-L577 HydrophobicContact CG-CD2 4.37Å; V486-L577 PolarHBondContact O-N 2.84Å; E488-L577 PolarHBondContact N-O 3.48Å; E488-L577 VanDerWaalsContact N-O 3.16Å; N575-L577 PolarHBondContact O-N 3.49Å
578	D	82.5	Confident	76.5	Confident	86 Å²	86	54 Å²	54	46%	0.46	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-59.8	130.7	174.4	-169.5	11.3	0	0	0	112.1	R542	R542-D578 VanDerWaalsContact CZ-CB 3.45Å; R542-D578 IonicContact CZ-OD1 2.81Å; R542-D578 VanDerWaalsContact CZ-OD1 3.28Å; R542-D578 IonicContact CZ-OD2 3.83Å; R542-D578 IonicContact NE-OD1 2.82Å; R542-D578 IonicContact NE-OD2 3.28Å; R542-D578 VanDerWaalsContact NH1-CB 3.27Å; R542-D578 IonicContact NH1-OD1 2.88Å; R542-D578 IonicContact NH1-OD2 3.79Å; R542-D578 PolarHBondContact NH1-OD2 2.8Å; R542-D578 IonicContact NH2-OD1 3.01Å; R542-D578 PolarHBondContact NH2-OD1 3.07Å; R542-D578 IonicContact NH2-OD2 3.82Å; R542-D578 PolarHBondContact NH2-OD2 3.11Å
579	I	80.6	Confident	74.6	Confident	49 Å²	49	60 Å²	60	25%	0.251	30%	0.304	S	S	.	.			trans	-122.9	132	168.8	-65.8	-176.3	0	0	0	106.2	P487 E488 N489 D581	P487-I579 HydrophobicContact CB-CD1 3.62Å; P487-I579 HydrophobicContact CB-CG1 4.39Å; E488-I579 HydrophobicContact CG-CB 4.1Å; E488-I579 HydrophobicContact CG-CG1 4.4Å; E488-I579 VanDerWaalsContact OE1-CA 3.31Å; E488-I579 WeakPolarHBondContact OE1-CA 3.2Å; E488-I579 WeakPolarHBondContact OE1-CB 3.22Å; E488-I579 PolarHBondContact OE1-N 2.83Å; N489-I579 HydrophobicContact CB-CD1 3.65Å; N489-I579 VanDerWaalsContact ND2-CD1 3.33Å; N489-I579 WeakPolarHBondContact ND2-CD1 3.28Å; N489-I579 WeakPolarHBondContact OD1-CD1 3.24Å; I579-D581 PolarHBondContact O-N 2.78Å
580	N	77.6	Confident	72.6	Confident	35 Å²	35	61.6 Å²	61.6	19%	0.187	31%	0.313	C	S	.	.			trans	-70.2	81.4	-178.1	-172.1	32.4	0	0	0	111.7	N582 M659 Q663 M665	N580-N582 PolarHBondContact OD1-O 2.74Å; N580-M659 WeakPolarHBondContact OD1-CE 3.38Å; N580-Q663 PolarHBondContact ND2-O 3.34Å; N580-M665 WeakPolarHBondContact O-CE 3.28Å
581	D	73.4	Confident	70.5	Confident	73 Å²	73	66.1 Å²	66.1	39%	0.39	33%	0.334	S	S	.	.			trans	-105.7	-8.9	-179.1	70.5	-18.1	0	0	0	112.8	I579	I579-D581 PolarHBondContact O-N 2.78Å
582	N	68.4	Low	68.2	Low	76 Å²	76	66.7 Å²	66.7	41%	0.406	34%	0.343	S	S	.	.	S	Bend	trans	-102	124.3	179.1	-76.5	-78.3	0	0	0	112.1	N580	N580-N582 PolarHBondContact OD1-O 2.74Å
583	F	63.4	Low	65.9	Low	77 Å²	77	74.5 Å²	74.5	34%	0.338	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-74.1	145.5	171.7	-64.6	-87.4	0	0	0	111.1	M585 M665	F583-M585 PolarHBondContact O-N 3.29Å; F583-M665 HydrophobicContact CD1-CB 3.79Å; F583-M665 HydrophobicContact CD1-CG 4.22Å; F583-M665 HydrophobicContact CD1-SD 3.87Å; F583-M665 HydrophobicContact CE1-CB 4.14Å; F583-M665 HydrophobicContact CE1-CE 4.47Å; F583-M665 HydrophobicContact CE1-CG 4.22Å; F583-M665 HydrophobicContact CE1-SD 3.28Å; F583-M665 WeakPolarHBondContact CE1-SD 3.21Å; F583-M665 HydrophobicContact CE2-SD 4.38Å; F583-M665 HydrophobicContact CZ-CE 4.22Å; F583-M665 HydrophobicContact CZ-SD 3.57Å; F583-M665 VanDerWaalsContact CZ-SD 3.57Å
584	P	58.2	Low	63.8	Low	25 Å²	25	80 Å²	80	16%	0.162	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-63.1	127.9	177	18.5	-24	0	0	0	111.5	M659 T667	P584-M659 HydrophobicContact CB-CG 4.11Å; P584-M659 HydrophobicContact CG-CG 4.01Å; P584-T667 VanDerWaalsContact CD-OG1 3.23Å; P584-T667 WeakPolarHBondContact CD-OG1 3.25Å; P584-T667 VanDerWaalsContact CG-OG1 3.3Å; P584-T667 WeakPolarHBondContact CG-OG1 3.43Å; P584-T667 VanDerWaalsContact O-CB 3.23Å; P584-T667 WeakPolarHBondContact O-CB 3.39Å; P584-T667 WeakPolarHBondContact O-CG2 3.4Å; P584-T667 PolarHBondContact O-OG1 2.84Å
585	M	55	Low	61.4	Low	126 Å²	126	84 Å²	84	62%	0.621	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-90.9	133	176.5	-71.1	-157.4	-103.2	0	0	111.8	F583 P727	F583-M585 PolarHBondContact O-N 3.29Å; M585-P727 HydrophobicContact CG-CG 4.16Å; M585-P727 HydrophobicContact SD-CG 3.84Å
586	I	53.2	Low	59.2	Low	45 Å²	45	91.1 Å²	91.1	23%	0.231	45%	0.449	C	S	.	.			trans	-102.4	113	174.7	-53.2	-163.1	0	0	0	109	L588 I655 T657 T667 V669	I586-L588 HydrophobicContact CG2-CD2 4.48Å; I586-I655 HydrophobicContact CD1-CG2 4.13Å; I586-T657 HydrophobicContact CD1-CG2 3.71Å; I586-T657 HydrophobicContact CG1-CG2 4.32Å; I586-T667 HydrophobicContact CG1-CG2 4.36Å; I586-V669 HydrophobicContact CB-CG2 4.16Å; I586-V669 HydrophobicContact CD1-CB 4.01Å; I586-V669 HydrophobicContact CD1-CG2 3.47Å; I586-V669 VanDerWaalsContact CD1-CG2 3.47Å; I586-V669 HydrophobicContact CG1-CG2 4Å
587	H	51.5	Low	57	Low	152 Å²	152	100 Å²	100	70%	0.704	49%	0.488	S	S	*	.			trans	-92.4	119.6	172.4	-65.2	-68.1	0	0	0	110.4
588	L	54	Low	54.9	Low	87 Å²	87	100 Å²	100	46%	0.455	49%	0.493	S	S	.	.			trans	-91.7	115	169.4	-62.3	171.3	0	0	0	108.2	I586 I689	I586-L588 HydrophobicContact CG2-CD2 4.48Å; L588-I689 HydrophobicContact CD1-CD1 3.24Å; L588-I689 HydrophobicContact CD1-CG1 3.55Å
589	I	53	Low	52.8	Low	143 Å²	143	102.5 Å²	102.5	73%	0.733	51%	0.506	S	S	*	.			trans	-93.2	115.5	175.7	-57.1	172.6	0	0	0	107.2	E591	I589-E591 HydrophobicContact CG2-CG 4.1Å; I589-E591 PolarHBondContact O-N 2.8Å
590	D	51.4	Low	50.8	Low	121 Å²	121	106.5 Å²	106.5	65%	0.647	53%	0.533	S	S	*	.			trans	-76.5	105.6	170.8	-170.8	-5.2	0	0	0	109.6	T592	D590-T592 WeakPolarHBondContact OD1-CB 3.27Å; D590-T592 WeakPolarHBondContact OD1-CG2 3.35Å; D590-T592 PolarHBondContact OD1-N 3.14Å; D590-T592 PolarHBondContact OD1-OG1 3.35Å; D590-T592 PolarHBondContact OD2-OG1 3.08Å
591	E	46.4	Very low	49	Very low	95 Å²	95	113.2 Å²	113.2	44%	0.444	56%	0.563	S	S	.	*			trans	-93.1	17.2	174.6	-68.5	-156.7	137.7	0	0	113.5	I589 E593 K594 F595	I589-E591 HydrophobicContact CG2-CG 4.1Å; I589-E591 PolarHBondContact O-N 2.8Å; E591-E593 PolarHBondContact O-N 3.22Å; E591-K594 PolarHBondContact O-N 3Å; E591-K594 IonicContact OE1-NZ 3.97Å; E591-F595 PolarHBondContact O-N 3.36Å
592	T	40	Very low	47.3	Very low	78 Å²	78	115.9 Å²	115.9	48%	0.479	57%	0.573	S	S	.	*	H	α-helix	trans	-54.2	-29.7	-176.1	47	0	0	0	0	114.4	D590 K596	D590-T592 WeakPolarHBondContact OD1-CB 3.27Å; D590-T592 WeakPolarHBondContact OD1-CG2 3.35Å; D590-T592 PolarHBondContact OD1-N 3.14Å; D590-T592 PolarHBondContact OD1-OG1 3.35Å; D590-T592 PolarHBondContact OD2-OG1 3.08Å; T592-K596 PolarHBondContact O-N 2.94Å
593	E	39.9	Very low	46.2	Very low	168 Å²	168	113.9 Å²	113.9	79%	0.785	57%	0.565	S	S	*	*	H	α-helix	trans	-78.4	-30.8	176.4	-71.8	-139.3	155.6	0	0	114.8	E591	E591-E593 PolarHBondContact O-N 3.22Å
594	K	42.5	Very low	44.9	Very low	151 Å²	151	114.6 Å²	114.6	66%	0.657	58%	0.578	S	S	*	*	H	α-helix	trans	-75.7	-30.4	177.1	-81.6	179	-179	170.1	0	111.8	E591	E591-K594 PolarHBondContact O-N 3Å; E591-K594 IonicContact OE1-NZ 3.97Å
595	F	37.8	Very low	44.2	Very low	85 Å²	85	121.3 Å²	121.3	37%	0.373	60%	0.6	S	S	.	*	H	α-helix	trans	-77.4	-30.7	179.2	-109.8	-89.5	0	0	0	113.6	E591 K597 S598	E591-F595 PolarHBondContact O-N 3.36Å; F595-K597 PolarHBondContact O-N 3.29Å; F595-K597 VanDerWaalsContact O-N 3.14Å; F595-S598 PolarHBondContact O-N 3.24Å; F595-S598 PolarHBondContact O-OG 2.94Å
596	K	39.4	Very low	43.5	Very low	174 Å²	174	119.2 Å²	119.2	76%	0.757	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-17.3	175	-80.7	178.7	177.5	176.2	0	114	T592	T592-K596 PolarHBondContact O-N 2.94Å
597	K	42	Very low	43	Very low	191 Å²	191	123 Å²	123	83%	0.83	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	-4.8	-179.6	-79.5	178.1	177	171	0	115.2	F595	F595-K597 PolarHBondContact O-N 3.29Å; F595-K597 VanDerWaalsContact O-N 3.14Å
598	S	42.9	Very low	42.3	Very low	62 Å²	62	120.7 Å²	120.7	43%	0.434	60%	0.596	S	S	.	*			trans	-103.9	4.7	-175.7	61.6	0	0	0	0	115.3	F595 T600	F595-S598 PolarHBondContact O-N 3.24Å; F595-S598 PolarHBondContact O-OG 2.94Å; S598-T600 PolarHBondContact O-N 3.32Å
599	N	38.1	Very low	41.8	Very low	139 Å²	139	121 Å²	121	74%	0.743	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	29	-175.2	-92.8	-4.9	0	0	0	116.6
600	T	39	Very low	41.3	Very low	133 Å²	133	121.1 Å²	121.1	82%	0.816	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128	10.8	179.4	55.1	0	0	0	0	116.2	S598	S598-T600 PolarHBondContact O-N 3.32Å
601	Q	38.9	Very low	41	Very low	177 Å²	177	119 Å²	119	83%	0.827	59%	0.59	S	S	*	*	S	Bend	trans	-137.1	120.2	170.5	-84	178	-26.2	0	0	111.6	S603	Q601-S603 PolarHBondContact O-N 3.15Å
602	Q	38.9	Very low	40.9	Very low	128 Å²	128	120.1 Å²	120.1	60%	0.598	60%	0.599	S	S	*	*			trans	-54.3	123.5	171.3	-80.3	-179	-22.4	0	0	109.5
603	S	44.5	Very low	41	Very low	34 Å²	34	122.7 Å²	122.7	24%	0.238	61%	0.61	C	S	.	*			trans	-74.4	154.6	-178.7	71.2	0	0	0	0	110.8	Q601 W605 Q606	Q601-S603 PolarHBondContact O-N 3.15Å; S603-W605 PolarHBondContact O-N 2.96Å; S603-Q606 PolarHBondContact O-N 2.94Å
604	P	37.4	Very low	41.3	Very low	93 Å²	93	121.6 Å²	121.6	60%	0.604	61%	0.609	S	S	*	*	H	α-helix	trans	-51.3	-21.3	171.9	-27.9	34.9	0	0	0	114.4	M608	P604-M608 WeakPolarHBondContact O-CE 3.19Å; P604-M608 PolarHBondContact O-N 2.77Å
605	W	41.8	Very low	41.3	Very low	165 Å²	165	121.3 Å²	121.3	63%	0.625	62%	0.615	S	S	*	*	H	α-helix	trans	-72.5	-33.3	175.9	-68.9	99.8	0	0	0	113.8	S603 M608 I609	S603-W605 PolarHBondContact O-N 2.96Å; W605-M608 HydrophobicContact CE3-CE 4.44Å; W605-I609 WeakPolarHBondContact O-CD1 3.13Å; W605-I609 WeakPolarHBondContact O-CG1 3.07Å; W605-I609 PolarHBondContact O-N 3.42Å
606	Q	40	Very low	41.3	Very low	82 Å²	82	124 Å²	124	38%	0.383	63%	0.633	S	S	.	*	H	α-helix	trans	-74.1	-30.1	177.7	-76.4	174.1	-35.9	0	0	112.6	S603 Q610	S603-Q606 PolarHBondContact O-N 2.94Å; Q606-Q610 PolarHBondContact O-N 2.75Å
607	Q	44	Very low	41.3	Very low	124 Å²	124	124.2 Å²	124.2	58%	0.579	64%	0.636	S	S	*	*	H	α-helix	trans	-73.3	-32.9	175.8	-69.9	179.7	-6	0	0	112.7	S611	Q607-S611 PolarHBondContact O-N 2.81Å
608	M	36.6	Very low	41.3	Very low	104 Å²	104	120.1 Å²	120.1	51%	0.512	62%	0.624	S	S	.	*	H	α-helix	trans	-78.3	-26.3	178.5	-80.1	-171.7	-72.4	0	0	114.5	P604 W605 S611	P604-M608 WeakPolarHBondContact O-CE 3.19Å; P604-M608 PolarHBondContact O-N 2.77Å; W605-M608 HydrophobicContact CE3-CE 4.44Å; M608-S611 PolarHBondContact O-OG 3.34Å
609	I	42.8	Very low	41.3	Very low	94 Å²	94	121.7 Å²	121.7	48%	0.482	63%	0.627	S	S	.	*	H	α-helix	trans	-78.3	-33.2	177.4	-66.8	168.5	0	0	0	110.9	W605	W605-I609 WeakPolarHBondContact O-CD1 3.13Å; W605-I609 WeakPolarHBondContact O-CG1 3.07Å; W605-I609 PolarHBondContact O-N 3.42Å
610	Q	43.3	Very low	41.2	Very low	145 Å²	145	120.4 Å²	120.4	68%	0.678	62%	0.624	S	S	*	*	H	α-helix	trans	-75.8	-23.6	177.2	-72.7	-179.3	-6.7	0	0	113.5	Q606 N612	Q606-Q610 PolarHBondContact O-N 2.75Å; Q610-N612 PolarHBondContact O-N 2.81Å
611	S	44.5	Very low	41	Very low	77 Å²	77	119.8 Å²	119.8	54%	0.538	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.5	-10.3	-178.5	68.3	0	0	0	0	114.9	Q607 M608	Q607-S611 PolarHBondContact O-N 2.81Å; M608-S611 PolarHBondContact O-OG 3.34Å
612	N	44.8	Very low	40.9	Very low	119 Å²	119	117 Å²	117	64%	0.636	60%	0.6	S	S	*	*	S	Bend	trans	-119.6	5.2	-168.1	-77.9	-28.8	0	0	0	115.8	Q610 N614	Q610-N612 PolarHBondContact O-N 2.81Å; N612-N614 PolarHBondContact O-N 3.26Å; N612-N614 VanDerWaalsContact O-N 3.1Å
613	N	43	Very low	40.8	Very low	132 Å²	132	115.5 Å²	115.5	71%	0.706	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	14.4	-179	-85.4	-14.2	0	0	0	115.6
614	N	45.3	Very low	40.5	Very low	145 Å²	145	119.3 Å²	119.3	78%	0.775	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	1.9	-171.5	-78.4	-6.1	0	0	0	116.7	N612	N612-N614 PolarHBondContact O-N 3.26Å; N612-N614 VanDerWaalsContact O-N 3.1Å
615	N	42.4	Very low	40.6	Very low	145 Å²	145	120.3 Å²	120.3	78%	0.775	61%	0.61	S	S	*	*			trans	-142.2	98.3	177.1	-77.7	-44.3	0	0	0	112.5
616	N	38.8	Very low	40.6	Very low	141 Å²	141	119 Å²	119	75%	0.754	61%	0.606	S	S	*	*			trans	-66.6	145.8	167	-75.6	-30	0	0	0	110.4
617	H	39.2	Very low	40.5	Very low	179 Å²	179	118.4 Å²	118.4	83%	0.829	60%	0.604	S	S	*	*	S	Bend	trans	84.7	67	-174.3	-57.7	-50.7	0	0	0	116.2
618	N	42.3	Very low	40.6	Very low	105 Å²	105	117.1 Å²	117.1	56%	0.561	60%	0.6	S	S	*	*			trans	-172	26.4	140.1	-91.8	-23	0	0	0	113.2	T620 K622	N618-T620 PolarHBondContact O-N 2.83Å; N618-K622 PolarHBondContact O-N 3.2Å
619	N	41.3	Very low	41	Very low	94 Å²	94	117 Å²	117	50%	0.503	60%	0.598	S	S	.	*	H	α-helix	trans	-77	-22.6	-166.6	-71.2	-6.3	0	0	0	114.8	N623	N619-N623 WeakPolarHBondContact O-CB 3.05Å; N619-N623 PolarHBondContact O-N 2.9Å; N619-N623 PolarHBondContact O-ND2 3.44Å; N619-N623 PolarHBondContact O-OD1 3.41Å
620	T	35.8	Very low	41.1	Very low	113 Å²	113	116.2 Å²	116.2	69%	0.693	60%	0.595	S	S	*	*	H	α-helix	trans	-78.5	-38.9	-178.3	30.7	0	0	0	0	113.8	N618 N624	N618-T620 PolarHBondContact O-N 2.83Å; T620-N624 PolarHBondContact O-N 3.04Å
621	I	36	Very low	41.2	Very low	119 Å²	119	116.4 Å²	116.4	61%	0.61	59%	0.59	S	S	*	*	H	α-helix	trans	-75.2	-38.9	176.1	-61.2	174.2	0	0	0	110.1	N624 Q625	I621-N624 PolarHBondContact O-N 2.94Å; I621-Q625 WeakPolarHBondContact O-CB 3.35Å; I621-Q625 PolarHBondContact O-N 3.37Å
622	K	36.1	Very low	41.1	Very low	119 Å²	119	118.6 Å²	118.6	52%	0.517	59%	0.591	S	S	.	*	H	α-helix	trans	-64.5	-42	173	-74.9	-178.1	177.1	-179	0	111.6	N618 N624 Q625 Y626	N618-K622 PolarHBondContact O-N 3.2Å; K622-N624 PolarHBondContact O-N 2.86Å; K622-Q625 PolarHBondContact O-N 3.12Å; K622-Y626 HydrophobicContact CB-CD2 4.25Å; K622-Y626 HydrophobicContact CB-CE2 4.36Å; K622-Y626 WeakPolarHBondContact O-CB 3.07Å; K622-Y626 WeakPolarHBondContact O-CD2 3.41Å; K622-Y626 PolarHBondContact O-N 2.89Å
623	N	36.8	Very low	41	Very low	96 Å²	96	114.6 Å²	114.6	51%	0.513	57%	0.572	S	S	.	*	H	α-helix	trans	-63.5	-38.5	177.4	-79.5	-3.6	0	0	0	113.1	N619 M627	N619-N623 WeakPolarHBondContact O-CB 3.05Å; N619-N623 PolarHBondContact O-N 2.9Å; N619-N623 PolarHBondContact O-ND2 3.44Å; N619-N623 PolarHBondContact O-OD1 3.41Å; N623-M627 WeakPolarHBondContact O-CB 3.17Å; N623-M627 WeakPolarHBondContact O-CG 3.49Å; N623-M627 PolarHBondContact O-N 3.36Å
624	N	38.7	Very low	41.2	Very low	114 Å²	114	111.4 Å²	111.4	61%	0.61	56%	0.555	S	S	*	*	H	α-helix	trans	-69.2	-37	174.6	-83.9	-11.9	0	0	0	112.4	T620 I621 K622 M627 I628	T620-N624 PolarHBondContact O-N 3.04Å; I621-N624 PolarHBondContact O-N 2.94Å; K622-N624 PolarHBondContact O-N 2.86Å; N624-M627 PolarHBondContact O-N 3.41Å; N624-I628 WeakPolarHBondContact O-CD1 3.18Å; N624-I628 WeakPolarHBondContact O-CG1 3.5Å; N624-I628 PolarHBondContact O-N 3.49Å
625	Q	39.5	Very low	41	Very low	114 Å²	114	108.3 Å²	108.3	53%	0.533	54%	0.544	S	S	.	.	H	α-helix	trans	-69.2	-39.8	175.6	-161.7	161.7	-9.4	0	0	111.6	I621 K622 I628 E629	I621-Q625 WeakPolarHBondContact O-CB 3.35Å; I621-Q625 PolarHBondContact O-N 3.37Å; K622-Q625 PolarHBondContact O-N 3.12Å; Q625-I628 PolarHBondContact O-N 2.8Å; Q625-E629 WeakPolarHBondContact O-CB 3.23Å; Q625-E629 WeakPolarHBondContact O-CG 3.47Å; Q625-E629 PolarHBondContact O-N 3.25Å
626	Y	42	Very low	41	Very low	137 Å²	137	105 Å²	105	54%	0.537	53%	0.527	S	S	.	.	H	α-helix	trans	-62.2	-39.4	170.4	-87.7	-67.7	0	0	0	112.1	K622 E629 L630	K622-Y626 HydrophobicContact CB-CD2 4.25Å; K622-Y626 HydrophobicContact CB-CE2 4.36Å; K622-Y626 WeakPolarHBondContact O-CB 3.07Å; K622-Y626 WeakPolarHBondContact O-CD2 3.41Å; K622-Y626 PolarHBondContact O-N 2.89Å; Y626-E629 PolarHBondContact O-N 3.43Å; Y626-L630 VanDerWaalsContact O-CB 3.31Å; Y626-L630 WeakPolarHBondContact O-CB 3.07Å; Y626-L630 PolarHBondContact O-N 3.27Å
627	M	38.5	Very low	41.5	Very low	70 Å²	70	107.1 Å²	107.1	35%	0.345	53%	0.532	S	S	.	.	H	α-helix	trans	-69.3	-36.9	175.2	-75.5	-63.3	-70.2	0	0	112.2	N623 N624 L630 W631	N623-M627 WeakPolarHBondContact O-CB 3.17Å; N623-M627 WeakPolarHBondContact O-CG 3.49Å; N623-M627 PolarHBondContact O-N 3.36Å; N624-M627 PolarHBondContact O-N 3.41Å; M627-L630 WeakPolarHBondContact O-CB 3.11Å; M627-L630 PolarHBondContact O-N 3.08Å; M627-W631 WeakPolarHBondContact O-CB 3.22Å; M627-W631 VanDerWaalsContact O-CD1 3.26Å; M627-W631 PolarHBondContact O-N 3.4Å
628	I	44.9	Very low	41.7	Very low	97 Å²	97	104.1 Å²	104.1	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-65.6	-43.6	173	-70	162.9	0	0	0	110.2	N624 Q625 L630 W631 Q632	N624-I628 WeakPolarHBondContact O-CD1 3.18Å; N624-I628 WeakPolarHBondContact O-CG1 3.5Å; N624-I628 PolarHBondContact O-N 3.49Å; Q625-I628 PolarHBondContact O-N 2.8Å; I628-L630 VanDerWaalsContact C-N 3.32Å; I628-L630 PolarHBondContact O-N 3.28Å; I628-W631 PolarHBondContact O-N 3.23Å; I628-Q632 HydrophobicContact CG2-CG 4.32Å; I628-Q632 VanDerWaalsContact O-CB 3.29Å; I628-Q632 WeakPolarHBondContact O-CB 3.48Å; I628-Q632 VanDerWaalsContact O-CG 3.22Å; I628-Q632 WeakPolarHBondContact O-CG 3.42Å; I628-Q632 PolarHBondContact O-N 3.34Å
629	E	45.6	Very low	41.7	Very low	101 Å²	101	105.2 Å²	105.2	47%	0.472	52%	0.522	S	S	.	.	H	α-helix	trans	-63.5	-37.5	173.9	-74.4	175.1	-170.3	0	0	111.6	Q625 Y626 S633	Q625-E629 WeakPolarHBondContact O-CB 3.23Å; Q625-E629 WeakPolarHBondContact O-CG 3.47Å; Q625-E629 PolarHBondContact O-N 3.25Å; Y626-E629 PolarHBondContact O-N 3.43Å; E629-S633 VanDerWaalsContact O-CB 3.27Å; E629-S633 WeakPolarHBondContact O-CB 3.25Å; E629-S633 PolarHBondContact O-N 2.69Å
630	L	45.2	Very low	41.9	Very low	78 Å²	78	106.4 Å²	106.4	41%	0.408	54%	0.538	S	S	.	.	H	α-helix	trans	-64.6	-46.7	174.4	-147.9	102	0	0	0	111	Y626 M627 I628 S633 I634	Y626-L630 VanDerWaalsContact O-CB 3.31Å; Y626-L630 WeakPolarHBondContact O-CB 3.07Å; Y626-L630 PolarHBondContact O-N 3.27Å; M627-L630 WeakPolarHBondContact O-CB 3.11Å; M627-L630 PolarHBondContact O-N 3.08Å; I628-L630 VanDerWaalsContact C-N 3.32Å; I628-L630 PolarHBondContact O-N 3.28Å; L630-S633 CarbonylContact O-C 3.59Å; L630-S633 WeakPolarHBondContact O-CA 3.44Å; L630-S633 VanDerWaalsContact O-CB 3.32Å; L630-S633 WeakPolarHBondContact O-CB 3.19Å; L630-S633 PolarHBondContact O-N 3.21Å; L630-S633 VanDerWaalsContact O-N 3.11Å; L630-S633 PolarHBondContact O-OG 3.09Å; L630-I634 HydrophobicContact CD2-CD1 4.18Å; L630-I634 WeakPolarHBondContact O-CD1 3.38Å; L630-I634 VanDerWaalsContact O-CG1 3.24Å; L630-I634 WeakPolarHBondContact O-CG1 3.42Å; L630-I634 PolarHBondContact O-N 2.85Å
631	W	44.5	Very low	42.5	Very low	150 Å²	150	104.9 Å²	104.9	57%	0.568	52%	0.524	S	S	*	.	H	α-helix	trans	-67.6	-39.3	177.6	-90	101.2	0	0	0	113	M627 I628 S633 I634 S635	M627-W631 WeakPolarHBondContact O-CB 3.22Å; M627-W631 VanDerWaalsContact O-CD1 3.26Å; M627-W631 PolarHBondContact O-N 3.4Å; I628-W631 PolarHBondContact O-N 3.23Å; W631-S633 PolarHBondContact O-N 3.25Å; W631-I634 PolarHBondContact O-N 3.17Å; W631-I634 VanDerWaalsContact O-N 3.17Å; W631-S635 PolarHBondContact O-N 2.75Å
632	Q	41.9	Very low	42.9	Very low	123 Å²	123	102.7 Å²	102.7	58%	0.575	51%	0.514	S	S	*	.	H	α-helix	trans	-66.1	-25.5	170.3	-73.3	176.2	-8.2	0	0	111.8	I628 S635	I628-Q632 HydrophobicContact CG2-CG 4.32Å; I628-Q632 VanDerWaalsContact O-CB 3.29Å; I628-Q632 WeakPolarHBondContact O-CB 3.48Å; I628-Q632 VanDerWaalsContact O-CG 3.22Å; I628-Q632 WeakPolarHBondContact O-CG 3.42Å; I628-Q632 PolarHBondContact O-N 3.34Å; Q632-S635 PolarHBondContact O-OG 3.3Å; Q632-S635 VanDerWaalsContact O-OG 3.1Å
633	S	43	Very low	43.4	Very low	34 Å²	34	99.6 Å²	99.6	24%	0.238	50%	0.502	C	S	.	.	H	α-helix	trans	-76	-33.3	172.1	93.5	0	0	0	0	112.4	E629 L630 W631 K639	E629-S633 VanDerWaalsContact O-CB 3.27Å; E629-S633 WeakPolarHBondContact O-CB 3.25Å; E629-S633 PolarHBondContact O-N 2.69Å; L630-S633 CarbonylContact O-C 3.59Å; L630-S633 WeakPolarHBondContact O-CA 3.44Å; L630-S633 VanDerWaalsContact O-CB 3.32Å; L630-S633 WeakPolarHBondContact O-CB 3.19Å; L630-S633 PolarHBondContact O-N 3.21Å; L630-S633 VanDerWaalsContact O-N 3.11Å; L630-S633 PolarHBondContact O-OG 3.09Å; W631-S633 PolarHBondContact O-N 3.25Å; S633-K639 WeakPolarHBondContact O-CD 3.43Å
634	I	46.9	Very low	43.7	Very low	65 Å²	65	100.1 Å²	100.1	33%	0.333	50%	0.501	S	S	.	.	H	α-helix	trans	-75.3	-30.2	178.4	-68	161.4	0	0	0	111.4	L630 W631 N636 I641	L630-I634 HydrophobicContact CD2-CD1 4.18Å; L630-I634 WeakPolarHBondContact O-CD1 3.38Å; L630-I634 VanDerWaalsContact O-CG1 3.24Å; L630-I634 WeakPolarHBondContact O-CG1 3.42Å; L630-I634 PolarHBondContact O-N 2.85Å; W631-I634 PolarHBondContact O-N 3.17Å; W631-I634 VanDerWaalsContact O-N 3.17Å; I634-N636 PolarHBondContact O-N 2.69Å; I634-N636 VanDerWaalsContact O-N 3.12Å; I634-I641 HydrophobicContact CD1-CD1 4.49Å; I634-I641 HydrophobicContact CG1-CD1 4.4Å
635	S	42.3	Very low	43.9	Very low	80 Å²	80	100.2 Å²	100.2	56%	0.559	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-8.1	178.3	75.5	0	0	0	0	114.4	W631 Q632	W631-S635 PolarHBondContact O-N 2.75Å; Q632-S635 PolarHBondContact O-OG 3.3Å; Q632-S635 VanDerWaalsContact O-OG 3.1Å
636	N	42.6	Very low	44.2	Very low	76 Å²	76	97.8 Å²	97.8	41%	0.406	48%	0.484	S	S	.	.	S	Bend	trans	-89.2	109.5	169.4	-80	-26.1	0	0	0	108.6	I634 N638 K639	I634-N636 PolarHBondContact O-N 2.69Å; I634-N636 VanDerWaalsContact O-N 3.12Å; N636-N638 PolarHBondContact O-N 3.23Å; N636-K639 PolarHBondContact O-N 2.76Å
637	H	47.4	Very low	44.1	Very low	185 Å²	185	92.8 Å²	92.8	86%	0.856	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	12.5	-170.7	-72.7	-72.1	0	0	0	118.8
638	N	44	Very low	44.2	Very low	117 Å²	117	95.4 Å²	95.4	63%	0.626	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.8	24.2	-171.6	-81.9	-34.4	0	0	0	115.2	N636	N636-N638 PolarHBondContact O-N 3.23Å
639	K	43.6	Very low	44	Very low	127 Å²	127	98.7 Å²	98.7	55%	0.552	50%	0.495	S	S	*	.			trans	-105.2	122.3	174.5	-69.4	-166.3	-171.8	169.4	0	112.7	S633 N636	S633-K639 WeakPolarHBondContact O-CD 3.43Å; N636-K639 PolarHBondContact O-N 2.76Å
640	S	44.8	Very low	43.5	Very low	120 Å²	120	98 Å²	98	84%	0.839	49%	0.494	S	S	*	.			trans	-66.9	126.2	168.9	55.2	0	0	0	0	110.4
641	I	47.7	Very low	43.2	Very low	81 Å²	81	101.3 Å²	101.3	42%	0.415	51%	0.512	S	S	.	.			trans	-84.5	115.9	173.6	-60.5	173.1	0	0	0	107.8	I634 I643 I646	I634-I641 HydrophobicContact CD1-CD1 4.49Å; I634-I641 HydrophobicContact CG1-CD1 4.4Å; I641-I643 HydrophobicContact CG2-CG1 4.01Å; I641-I643 PolarHBondContact O-N 3.28Å; I641-I643 VanDerWaalsContact O-N 3.12Å; I641-I646 HydrophobicContact CG2-CD1 3.6Å
642	N	45.4	Very low	43.1	Very low	72 Å²	72	99.1 Å²	99.1	39%	0.385	51%	0.512	S	S	.	.			trans	-78.3	94.5	167.6	-170.3	-33.7	0	0	0	108.5	H644 Y645	N642-H644 PolarHBondContact O-N 3.21Å; N642-H644 VanDerWaalsContact OD1-CB 3.31Å; N642-H644 WeakPolarHBondContact OD1-CB 3.5Å; N642-H644 PolarHBondContact OD1-N 3.45Å; N642-H644 VanDerWaalsContact OD1-N 3.12Å; N642-Y645 PolarHBondContact O-N 3.16Å
643	I	47	Very low	43.2	Very low	55 Å²	55	98 Å²	98	28%	0.282	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-63.1	-26	-175.9	-58.5	176.1	0	0	0	110.8	I641 Y645 I646 I647	I641-I643 HydrophobicContact CG2-CG1 4.01Å; I641-I643 PolarHBondContact O-N 3.28Å; I641-I643 VanDerWaalsContact O-N 3.12Å; I643-Y645 VanDerWaalsContact C-N 3.28Å; I643-Y645 PolarHBondContact O-N 2.81Å; I643-I646 WeakPolarHBondContact O-CB 3.35Å; I643-I646 PolarHBondContact O-N 2.89Å; I643-I647 HydrophobicContact CB-CD1 4.37Å; I643-I647 HydrophobicContact CG2-CD1 3.66Å; I643-I647 HydrophobicContact CG2-CG1 3.88Å; I643-I647 WeakPolarHBondContact O-CD1 3.35Å; I643-I647 WeakPolarHBondContact O-CG1 3.2Å; I643-I647 PolarHBondContact O-N 2.83Å
644	H	41.8	Very low	42.9	Very low	106 Å²	106	99 Å²	99	49%	0.491	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-64.3	-24.9	-176.4	-160.5	73	0	0	0	114.5	N642	N642-H644 PolarHBondContact O-N 3.21Å; N642-H644 VanDerWaalsContact OD1-CB 3.31Å; N642-H644 WeakPolarHBondContact OD1-CB 3.5Å; N642-H644 PolarHBondContact OD1-N 3.45Å; N642-H644 VanDerWaalsContact OD1-N 3.12Å
645	Y	42.7	Very low	42.8	Very low	116 Å²	116	98.4 Å²	98.4	46%	0.455	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-87.6	-14.8	173.8	-98.9	-88.2	0	0	0	114	N642 I643	N642-Y645 PolarHBondContact O-N 3.16Å; I643-Y645 VanDerWaalsContact C-N 3.28Å; I643-Y645 PolarHBondContact O-N 2.81Å
646	I	45.6	Very low	42.8	Very low	64 Å²	64	99 Å²	99	33%	0.328	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-27.1	173.1	-57.6	175	0	0	0	110	I641 I643 N648 Y653	I641-I646 HydrophobicContact CG2-CD1 3.6Å; I643-I646 WeakPolarHBondContact O-CB 3.35Å; I643-I646 PolarHBondContact O-N 2.89Å; I646-N648 VanDerWaalsContact C-N 3.27Å; I646-N648 PolarHBondContact O-N 2.57Å; I646-Y653 HydrophobicContact CG2-CE2 4.36Å
647	I	41.4	Very low	42.8	Very low	31 Å²	31	97.4 Å²	97.4	16%	0.159	49%	0.493	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-20.4	-175.6	-80.9	165.4	0	0	0	114.7	I643 I673	I643-I647 HydrophobicContact CB-CD1 4.37Å; I643-I647 HydrophobicContact CG2-CD1 3.66Å; I643-I647 HydrophobicContact CG2-CG1 3.88Å; I643-I647 WeakPolarHBondContact O-CD1 3.35Å; I643-I647 WeakPolarHBondContact O-CG1 3.2Å; I643-I647 PolarHBondContact O-N 2.83Å; I647-I673 HydrophobicContact CG1-CD1 4.19Å
648	N	40.3	Very low	42.5	Very low	125 Å²	125	93.5 Å²	93.5	67%	0.668	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	6.6	-174.1	-83.6	-12.7	0	0	0	116.2	I646	I646-N648 VanDerWaalsContact C-N 3.27Å; I646-N648 PolarHBondContact O-N 2.57Å
649	Q	41.1	Very low	42.3	Very low	167 Å²	167	91.7 Å²	91.7	78%	0.78	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.2	-11.9	-176.9	-74.7	-65.5	-65.9	0	0	117.1
650	L	34.7	Very low	42.4	Very low	85 Å²	85	94.1 Å²	94.1	45%	0.445	49%	0.485	S	S	.	.			trans	-148.5	114.9	-163.8	-69.4	156.9	0	0	0	112.8	Y653	L650-Y653 HydrophobicContact CB-CD2 4.37Å; L650-Y653 HydrophobicContact CB-CE2 3.37Å; L650-Y653 HydrophobicContact CD1-CE2 3.87Å; L650-Y653 WeakPolarHBondContact CD1-OH 3.21Å; L650-Y653 HydrophobicContact CG-CE2 4.11Å; L650-Y653 WeakPolarHBondContact CG-OH 3.32Å
651	N	37.6	Very low	42.4	Very low	148 Å²	148	90.2 Å²	90.2	79%	0.791	46%	0.463	S	S	*	.	S	Bend	trans	-74.1	134.5	172.4	-77.5	-15.4	0	0	0	110.9
652	N	43.5	Very low	42.2	Very low	104 Å²	104	94.9 Å²	94.9	56%	0.556	49%	0.489	S	S	*	.			trans	60.7	106.2	171.5	-63.2	-17.7	0	0	0	116.7
653	Y	43.1	Very low	42.4	Very low	101 Å²	101	97.9 Å²	97.9	40%	0.396	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	136.2	166.6	-80.4	-70.5	0	0	0	111.9	I646 L650 I671	I646-Y653 HydrophobicContact CG2-CE2 4.36Å; L650-Y653 HydrophobicContact CB-CD2 4.37Å; L650-Y653 HydrophobicContact CB-CE2 3.37Å; L650-Y653 HydrophobicContact CD1-CE2 3.87Å; L650-Y653 WeakPolarHBondContact CD1-OH 3.21Å; L650-Y653 HydrophobicContact CG-CE2 4.11Å; L650-Y653 WeakPolarHBondContact CG-OH 3.32Å; Y653-I671 PolarHBondContact O-N 2.69Å
654	S	37.5	Very low	42.5	Very low	53 Å²	53	99.2 Å²	99.2	37%	0.371	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	127.3	162.2	54.2	0	0	0	0	109.2	H656	S654-H656 WeakPolarHBondContact CB-NE2 3.2Å; S654-H656 PolarHBondContact OG-CD2 3.16Å; S654-H656 PolarHBondContact OG-NE2 2.93Å
655	I	45.5	Very low	42.8	Very low	53 Å²	53	96.5 Å²	96.5	27%	0.272	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	116.3	169.4	-59.4	-177.1	0	0	0	107.2	I586 T657 V669 I671	I586-I655 HydrophobicContact CD1-CG2 4.13Å; I655-T657 HydrophobicContact CG2-CG2 4.2Å; I655-V669 PolarHBondContact N-O 3.25Å; I655-V669 PolarHBondContact O-N 2.78Å; I655-V669 VanDerWaalsContact O-N 3.08Å; I655-I671 HydrophobicContact CD1-CD1 3.54Å; I655-I671 HydrophobicContact CG1-CD1 4.04Å
656	H	41.2	Very low	42.8	Very low	93 Å²	93	94.9 Å²	94.9	43%	0.431	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	119.9	173.2	-66.2	-99.3	0	0	0	108.5	S654	S654-H656 WeakPolarHBondContact CB-NE2 3.2Å; S654-H656 PolarHBondContact OG-CD2 3.16Å; S654-H656 PolarHBondContact OG-NE2 2.93Å
657	T	43.3	Very low	42.7	Very low	42 Å²	42	93.1 Å²	93.1	26%	0.258	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	124	168.8	58.8	0	0	0	0	108.5	I586 I655 T667	I586-T657 HydrophobicContact CD1-CG2 3.71Å; I586-T657 HydrophobicContact CG1-CG2 4.32Å; I655-T657 HydrophobicContact CG2-CG2 4.2Å; T657-T667 PolarHBondContact N-O 3.36Å; T657-T667 VanDerWaalsContact N-O 3.16Å; T657-T667 PolarHBondContact O-N 3.43Å; T657-T667 PolarHBondContact OG1-O 3.43Å
658	N	40.6	Very low	42.8	Very low	103 Å²	103	95.1 Å²	95.1	55%	0.551	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.1	176.6	-65.9	4.5	0	0	0	107.9	N666	N658-N666 PolarHBondContact OD1-OD1 2.85Å
659	M	39.9	Very low	42.9	Very low	79 Å²	79	89.8 Å²	89.8	39%	0.389	48%	0.475	S	S	.	.			trans	-81.4	129.1	163.5	-70	-124	-65.4	0	0	109.3	N580 P584 G661	N580-M659 WeakPolarHBondContact OD1-CE 3.38Å; P584-M659 HydrophobicContact CB-CG 4.11Å; P584-M659 HydrophobicContact CG-CG 4.01Å; M659-G661 PolarHBondContact O-N 3.04Å; M659-G661 VanDerWaalsContact O-N 3.15Å
660	I	45.2	Very low	42.8	Very low	179 Å²	179	85 Å²	85	92%	0.918	46%	0.455	S	S	*	.			trans	-75.8	102.3	172.7	-58.8	172.3	0	0	0	107.1
661	G	44.8	Very low	43.2	Very low	37 Å²	37	82.2 Å²	82.2	38%	0.381	44%	0.44	S	S	.	.	S	Bend	trans	-151.5	169.4	176.2	0	0	0	0	0	111.3	M659 Q663	M659-G661 PolarHBondContact O-N 3.04Å; M659-G661 VanDerWaalsContact O-N 3.15Å; G661-Q663 PolarHBondContact O-N 3.38Å; G661-Q663 VanDerWaalsContact O-N 3.13Å
662	N	44.6	Very low	43.2	Very low	179 Å²	179	77.8 Å²	77.8	96%	0.957	42%	0.416	S	S	*	.	S	Bend	trans	-62.3	-19.5	179.8	-73.9	-11.7	0	0	0	113.1
663	Q	48.2	Very low	43	Very low	136 Å²	136	75 Å²	75	64%	0.636	40%	0.4	S	S	*	.	S	Bend	trans	-132.2	101	166.4	-69	-172.7	-20.5	0	0	108	N580 G661 M665	N580-Q663 PolarHBondContact ND2-O 3.34Å; G661-Q663 PolarHBondContact O-N 3.38Å; G661-Q663 VanDerWaalsContact O-N 3.13Å; Q663-M665 PolarHBondContact O-N 3.4Å
664	P	49.5	Very low	42.7	Very low	83 Å²	83	72.9 Å²	72.9	54%	0.539	40%	0.395	S	S	.	.			trans	-69.1	117.1	-178.6	26	-31.9	0	0	0	110.2
665	M	47.8	Very low	42.7	Very low	48 Å²	48	75 Å²	75	24%	0.236	40%	0.402	C	S	.	.			trans	-86.2	126.3	166.5	-69.5	-70.1	-164.1	0	0	107.9	N580 F583 Q663	N580-M665 WeakPolarHBondContact O-CE 3.28Å; F583-M665 HydrophobicContact CD1-CB 3.79Å; F583-M665 HydrophobicContact CD1-CG 4.22Å; F583-M665 HydrophobicContact CD1-SD 3.87Å; F583-M665 HydrophobicContact CE1-CB 4.14Å; F583-M665 HydrophobicContact CE1-CE 4.47Å; F583-M665 HydrophobicContact CE1-CG 4.22Å; F583-M665 HydrophobicContact CE1-SD 3.28Å; F583-M665 WeakPolarHBondContact CE1-SD 3.21Å; F583-M665 HydrophobicContact CE2-SD 4.38Å; F583-M665 HydrophobicContact CZ-CE 4.22Å; F583-M665 HydrophobicContact CZ-SD 3.57Å; F583-M665 VanDerWaalsContact CZ-SD 3.57Å; Q663-M665 PolarHBondContact O-N 3.4Å
666	N	44.1	Very low	42.3	Very low	82 Å²	82	75.1 Å²	75.1	44%	0.439	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	129.8	-178.4	-65.1	-17.6	0	0	0	110	N658	N658-N666 PolarHBondContact OD1-OD1 2.85Å
667	T	43.1	Very low	42	Very low	28 Å²	28	75.6 Å²	75.6	17%	0.172	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	118.9	164.1	-59.2	0	0	0	0	108.5	P584 I586 T657 V669	P584-T667 VanDerWaalsContact CD-OG1 3.23Å; P584-T667 WeakPolarHBondContact CD-OG1 3.25Å; P584-T667 VanDerWaalsContact CG-OG1 3.3Å; P584-T667 WeakPolarHBondContact CG-OG1 3.43Å; P584-T667 VanDerWaalsContact O-CB 3.23Å; P584-T667 WeakPolarHBondContact O-CB 3.39Å; P584-T667 WeakPolarHBondContact O-CG2 3.4Å; P584-T667 PolarHBondContact O-OG1 2.84Å; I586-T667 HydrophobicContact CG1-CG2 4.36Å; T657-T667 PolarHBondContact N-O 3.36Å; T657-T667 VanDerWaalsContact N-O 3.16Å; T657-T667 PolarHBondContact O-N 3.43Å; T657-T667 PolarHBondContact OG1-O 3.43Å; T667-V669 HydrophobicContact CG2-CG2 4.25Å
668	I	42.3	Very low	41.9	Very low	73 Å²	73	80.4 Å²	80.4	37%	0.374	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	118.7	174.5	-57.2	175.5	0	0	0	107.5	N691	I668-N691 PolarHBondContact O-ND2 2.82Å; I668-N691 VanDerWaalsContact O-ND2 3.08Å
669	V	43.1	Very low	41.9	Very low	13 Å²	13	80.4 Å²	80.4	8%	0.079	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	113.4	168.6	175.6	0	0	0	0	108.6	I586 I655 T667 I671 I689	I586-V669 HydrophobicContact CB-CG2 4.16Å; I586-V669 HydrophobicContact CD1-CB 4.01Å; I586-V669 HydrophobicContact CD1-CG2 3.47Å; I586-V669 VanDerWaalsContact CD1-CG2 3.47Å; I586-V669 HydrophobicContact CG1-CG2 4Å; I655-V669 PolarHBondContact N-O 3.25Å; I655-V669 PolarHBondContact O-N 2.78Å; I655-V669 VanDerWaalsContact O-N 3.08Å; T667-V669 HydrophobicContact CG2-CG2 4.25Å; V669-I671 HydrophobicContact CG1-CG1 3.95Å; V669-I689 HydrophobicContact CG1-CG2 4.09Å
670	N	39.5	Very low	41.8	Very low	67 Å²	67	78.8 Å²	78.8	36%	0.358	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	109.1	172.4	-71.8	-22.9	0	0	0	108.1	K690	N670-K690 HydrophobicContact CB-CB 3.95Å; N670-K690 PolarHBondContact O-N 3.4Å
671	I	42.7	Very low	41.4	Very low	25 Å²	25	79.1 Å²	79.1	13%	0.128	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	108.1	175.9	-55.9	179.4	0	0	0	107.4	Y653 I655 V669 I673	Y653-I671 PolarHBondContact O-N 2.69Å; I655-I671 HydrophobicContact CD1-CD1 3.54Å; I655-I671 HydrophobicContact CG1-CD1 4.04Å; V669-I671 HydrophobicContact CG1-CG1 3.95Å; I671-I673 HydrophobicContact CG2-CG1 3.96Å
672	L	36.9	Very low	40.9	Very low	55 Å²	55	84.3 Å²	84.3	29%	0.288	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	113.1	170.8	-160.4	91.2	0	0	0	107.9	I674 F688	L672-I674 HydrophobicContact CD2-CD1 3.87Å; L672-I674 HydrophobicContact CD2-CG1 3.67Å; L672-I674 HydrophobicContact CG-CG1 4.32Å; L672-F688 PolarHBondContact N-O 3.3Å; L672-F688 PolarHBondContact O-N 3.08Å; L672-F688 VanDerWaalsContact O-N 3.15Å
673	I	40.3	Very low	40.3	Very low	45 Å²	45	78.9 Å²	78.9	23%	0.231	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	105.2	174.2	-56.1	176	0	0	0	106.8	I647 I671 N675 V685	I647-I673 HydrophobicContact CG1-CD1 4.19Å; I671-I673 HydrophobicContact CG2-CG1 3.96Å; I673-N675 PolarHBondContact O-N 3.36Å; I673-V685 HydrophobicContact CG2-CG1 4Å
674	I	37	Very low	39.3	Very low	57 Å²	57	76.2 Å²	76.2	29%	0.292	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	100.8	174.4	-55	-177	0	0	0	107.5	L672 D676 F688	L672-I674 HydrophobicContact CD2-CD1 3.87Å; L672-I674 HydrophobicContact CD2-CG1 3.67Å; L672-I674 HydrophobicContact CG-CG1 4.32Å; I674-D676 VanDerWaalsContact C-N 3.29Å; I674-D676 HydrophobicContact CG2-CB 3.95Å; I674-D676 PolarHBondContact O-N 3.12Å; I674-F688 HydrophobicContact CD1-CD2 3.58Å; I674-F688 HydrophobicContact CD1-CE2 3.75Å; I674-F688 HydrophobicContact CD1-CG 4.48Å; I674-F688 HydrophobicContact CG1-CD2 4Å; I674-F688 HydrophobicContact CG1-CE2 4.41Å
675	N	36.8	Very low	38.5	Very low	97 Å²	97	74.9 Å²	74.9	52%	0.519	42%	0.418	S	S	.	.			trans	-82.6	79.5	163.8	-85	-12.8	0	0	0	108.1	I673 P677	I673-N675 PolarHBondContact O-N 3.36Å; N675-P677 VanDerWaalsContact O-CD 3.26Å; N675-P677 WeakPolarHBondContact O-CD 3.01Å
676	D	36.7	Very low	37.8	Very low	56 Å²	56	77.2 Å²	77.2	30%	0.299	43%	0.428	S	S	.	.			trans	-89.2	107.4	169.5	-168.8	-15.8	0	0	0	109	I674 D678 L679 N680	I674-D676 VanDerWaalsContact C-N 3.29Å; I674-D676 HydrophobicContact CG2-CB 3.95Å; I674-D676 PolarHBondContact O-N 3.12Å; D676-D678 PolarHBondContact O-N 3.18Å; D676-D678 WeakPolarHBondContact OD1-CB 3.19Å; D676-D678 PolarHBondContact OD1-N 3.47Å; D676-L679 HydrophobicContact CB-CB 4.15Å; D676-L679 HydrophobicContact CB-CD1 3.89Å; D676-L679 HydrophobicContact CB-CG 4.24Å; D676-L679 PolarHBondContact O-N 2.77Å; D676-L679 WeakPolarHBondContact OD2-CD1 3.38Å; D676-N680 WeakPolarHBondContact O-CB 3.41Å; D676-N680 VanDerWaalsContact O-CG 3.3Å; D676-N680 PolarHBondContact O-ND2 2.68Å
677	P	36.7	Very low	37.2	Very low	103 Å²	103	76.4 Å²	76.4	67%	0.669	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-21	177.8	25.1	-32.2	0	0	0	113.1	N675	N675-P677 VanDerWaalsContact O-CD 3.26Å; N675-P677 WeakPolarHBondContact O-CD 3.01Å
678	D	39.9	Very low	36.8	Very low	144 Å²	144	78.5 Å²	78.5	77%	0.77	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-17.4	-178.6	-65.9	-20.6	0	0	0	113	D676	D676-D678 PolarHBondContact O-N 3.18Å; D676-D678 WeakPolarHBondContact OD1-CB 3.19Å; D676-D678 PolarHBondContact OD1-N 3.47Å
679	L	41.6	Very low	36.4	Very low	102 Å²	102	76.8 Å²	76.8	53%	0.534	43%	0.426	S	S	.	.	S	Bend	trans	-93.2	-0.5	172.7	-71.7	166.7	0	0	0	113	D676	D676-L679 HydrophobicContact CB-CB 4.15Å; D676-L679 HydrophobicContact CB-CD1 3.89Å; D676-L679 HydrophobicContact CB-CG 4.24Å; D676-L679 PolarHBondContact O-N 2.77Å; D676-L679 WeakPolarHBondContact OD2-CD1 3.38Å
680	N	37.2	Very low	36	Very low	45 Å²	45	80 Å²	80	24%	0.241	44%	0.439	C	S	.	.			trans	-104	31.7	-164.6	-91.8	-36.8	0	0	0	115.1	D676 N682 G683 T684	D676-N680 WeakPolarHBondContact O-CB 3.41Å; D676-N680 VanDerWaalsContact O-CG 3.3Å; D676-N680 PolarHBondContact O-ND2 2.68Å; N680-N682 PolarHBondContact O-N 3.12Å; N680-G683 PolarHBondContact O-N 2.76Å; N680-T684 PolarHBondContact OD1-O 2.95Å
681	E	36	Very low	35.8	Very low	187 Å²	187	81 Å²	81	87%	0.874	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-12.9	177.6	-71.2	-168.3	159.3	0	0	114.1
682	N	34.7	Very low	35.3	Very low	145 Å²	145	83.8 Å²	83.8	78%	0.775	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.6	15.9	178.5	-74.8	-43	0	0	0	115.4	N680 T684	N680-N682 PolarHBondContact O-N 3.12Å; N682-T684 HydrophobicContact CB-CG2 4.49Å; N682-T684 PolarHBondContact O-N 3.13Å
683	G	32	Very low	34.9	Very low	65 Å²	65	85.6 Å²	85.6	67%	0.67	47%	0.466	S	S	*	.			trans	65.1	23.3	179.6	0	0	0	0	0	114.5	N680 V685	N680-G683 PolarHBondContact O-N 2.76Å; G683-V685 PolarHBondContact O-N 3.18Å
684	T	28	Very low	34.4	Very low	80 Å²	80	86.9 Å²	86.9	49%	0.491	47%	0.473	S	S	.	.			trans	-89.4	96	179.2	45.6	0	0	0	0	110.7	N680 N682 Q686	N680-T684 PolarHBondContact OD1-O 2.95Å; N682-T684 HydrophobicContact CB-CG2 4.49Å; N682-T684 PolarHBondContact O-N 3.13Å; T684-Q686 PolarHBondContact O-N 3.34Å; T684-Q686 VanDerWaalsContact O-N 3.17Å
685	V	31.4	Very low	34	Very low	56 Å²	56	86.7 Å²	86.7	34%	0.339	47%	0.472	S	S	.	.			trans	-61.2	113.4	168.7	179.7	0	0	0	0	109.2	I673 G683	I673-V685 HydrophobicContact CG2-CG1 4Å; G683-V685 PolarHBondContact O-N 3.18Å
686	Q	33.2	Very low	33.6	Very low	97 Å²	97	89.7 Å²	89.7	45%	0.453	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	108	171.5	-75.2	-178.2	-15.1	0	0	109.5	T684 F688	T684-Q686 PolarHBondContact O-N 3.34Å; T684-Q686 VanDerWaalsContact O-N 3.17Å; Q686-F688 HydrophobicContact CB-CE2 3.94Å
687	C	31.5	Very low	33.1	Very low	64 Å²	64	92 Å²	92	43%	0.432	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	122.3	170.1	-82.7	0	0	0	0	109.9
688	F	35.3	Very low	32.7	Very low	73 Å²	73	96.6 Å²	96.6	32%	0.32	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.9	171.4	-70.5	-87.8	0	0	0	110.2	L672 I674 Q686	L672-F688 PolarHBondContact N-O 3.3Å; L672-F688 PolarHBondContact O-N 3.08Å; L672-F688 VanDerWaalsContact O-N 3.15Å; I674-F688 HydrophobicContact CD1-CD2 3.58Å; I674-F688 HydrophobicContact CD1-CE2 3.75Å; I674-F688 HydrophobicContact CD1-CG 4.48Å; I674-F688 HydrophobicContact CG1-CD2 4Å; I674-F688 HydrophobicContact CG1-CE2 4.41Å; Q686-F688 HydrophobicContact CB-CE2 3.94Å
689	I	34.7	Very low	32.1	Very low	36 Å²	36	97.5 Å²	97.5	19%	0.185	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	107.2	179.4	-53.1	153.6	0	0	0	108.1	L588 V669 N691	L588-I689 HydrophobicContact CD1-CD1 3.24Å; L588-I689 HydrophobicContact CD1-CG1 3.55Å; V669-I689 HydrophobicContact CG1-CG2 4.09Å; I689-N691 PolarHBondContact O-N 2.96Å; I689-N691 VanDerWaalsContact O-N 3.08Å
690	K	33.5	Very low	31.6	Very low	82 Å²	82	101.8 Å²	101.8	36%	0.357	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	103.2	167.5	-92.8	179.3	175.1	176.4	0	107.9	N670 S835	N670-K690 HydrophobicContact CB-CB 3.95Å; N670-K690 PolarHBondContact O-N 3.4Å; K690-S835 PolarHBondContact NZ-OG 3.31Å
691	N	36.5	Very low	31.3	Very low	87 Å²	87	106.3 Å²	106.3	47%	0.465	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	139.5	8.8	169.4	-73.6	-12.6	0	0	0	114.4	I668 I689	I668-N691 PolarHBondContact O-ND2 2.82Å; I668-N691 VanDerWaalsContact O-ND2 3.08Å; I689-N691 PolarHBondContact O-N 2.96Å; I689-N691 VanDerWaalsContact O-N 3.08Å
692	Q	31.2	Very low	30.9	Very low	84 Å²	84	105 Å²	105	39%	0.393	54%	0.536	S	S	.	.			trans	-126.8	128.1	169.9	-71.5	179.4	-20.6	0	0	109.8	L694	Q692-L694 PolarHBondContact O-N 3.34Å
693	L	29.2	Very low	30.7	Very low	92 Å²	92	101.7 Å²	101.7	48%	0.482	54%	0.536	S	S	.	.			trans	-82.8	104.8	173.6	-155.8	130.5	0	0	0	107.9	I695 F728	L693-I695 HydrophobicContact CD2-CD1 4.21Å; L693-I695 HydrophobicContact CD2-CG1 3.72Å; L693-I695 PolarHBondContact O-N 3.34Å; L693-F728 HydrophobicContact CB-CE2 4.42Å; L693-F728 HydrophobicContact CB-CZ 4.07Å
694	L	29.3	Very low	30.5	Very low	73 Å²	73	102.4 Å²	102.4	38%	0.382	54%	0.544	S	S	.	.			trans	-81.6	110.9	175.4	-83.8	150.2	0	0	0	109.1	Q692 F722	Q692-L694 PolarHBondContact O-N 3.34Å; L694-F722 HydrophobicContact CD2-CD1 4.16Å
695	I	29.2	Very low	30.5	Very low	52 Å²	52	106 Å²	106	27%	0.267	56%	0.56	S	S	.	*			trans	-93.1	125.6	172.8	-56.8	176.8	0	0	0	108.7	L693 M725	L693-I695 HydrophobicContact CD2-CD1 4.21Å; L693-I695 HydrophobicContact CD2-CG1 3.72Å; L693-I695 PolarHBondContact O-N 3.34Å; I695-M725 HydrophobicContact CD1-CE 3.97Å; I695-M725 HydrophobicContact CD1-SD 4.05Å
696	Y	27.6	Very low	30.4	Very low	160 Å²	160	111 Å²	111	63%	0.627	59%	0.585	S	S	*	*			trans	-90.1	124.9	174.1	-64.3	-88.8	0	0	0	110.1
697	L	26.3	Very low	30.2	Very low	104 Å²	104	115.1 Å²	115.1	55%	0.545	60%	0.603	S	S	.	*			trans	-106.4	125.2	172.6	-77	166.4	0	0	0	110.2	I723	L697-I723 HydrophobicContact CD1-CD1 3.36Å; L697-I723 HydrophobicContact CD1-CG1 4.21Å
698	K	28	Very low	30	Very low	201 Å²	201	116.9 Å²	116.9	87%	0.874	62%	0.616	S	S	*	*			trans	-104.3	101.5	170	-167	176.6	-175.8	177.4	0	109
699	Q	28.6	Very low	29.7	Very low	162 Å²	162	120.5 Å²	120.5	76%	0.757	64%	0.639	S	S	*	*			trans	-75.3	129.2	173.8	-88.4	-176.9	-10.6	0	0	111.1	N701	Q699-N701 PolarHBondContact O-N 2.69Å
700	K	29.4	Very low	29.3	Very low	192 Å²	192	126.1 Å²	126.1	84%	0.835	67%	0.669	S	S	*	*			trans	-82.2	106.1	170.8	-126.9	179.4	-176.4	175.8	0	108.7	N702	K700-N702 PolarHBondContact O-N 2.72Å; K700-N702 VanDerWaalsContact O-N 3.12Å
701	N	31	Very low	29	Very low	141 Å²	141	129.6 Å²	129.6	75%	0.754	69%	0.692	S	S	*	*			trans	-71	101.6	168.5	-85	-23.3	0	0	0	109.6	Q699 G703	Q699-N701 PolarHBondContact O-N 2.69Å; N701-G703 PolarHBondContact O-N 3.2Å
702	N	28.2	Very low	28.4	Very low	159 Å²	159	132.4 Å²	132.4	85%	0.85	71%	0.707	S	S	*	*			trans	-78	102.1	168	-81.7	-17.7	0	0	0	109.3	K700	K700-N702 PolarHBondContact O-N 2.72Å; K700-N702 VanDerWaalsContact O-N 3.12Å
703	G	29.5	Very low	28.1	Very low	76 Å²	76	135.5 Å²	135.5	78%	0.784	73%	0.727	S	S	*	*			trans	-159.9	93.3	175.9	0	0	0	0	0	113.3	N701	N701-G703 PolarHBondContact O-N 3.2Å
704	G	28.4	Very low	27.9	Very low	80 Å²	80	142.4 Å²	142.4	83%	0.825	75%	0.748	S	S	*	*			trans	64.7	100	140.7	0	0	0	0	0	119.9
705	N	28.1	Very low	27.7	Very low	155 Å²	155	145.6 Å²	145.6	83%	0.829	77%	0.765	S	S	*	*			trans	-15.3	125.9	155.1	-65.8	-21.7	0	0	0	117.2
706	N	30.1	Very low	27.6	Very low	162 Å²	162	151.8 Å²	151.8	87%	0.866	80%	0.798	S	S	*	*				-168.7	139	114.4	-94.3	-24.5	0	0	0	112.4
707	H	28.8	Very low	27.6	Very low	182 Å²	182	148.7 Å²	148.7	84%	0.843	80%	0.8	S	S	*	*			trans	-52.2	138.4	-178.3	-75.9	-71.5	0	0	0	115.2
708	S	28	Very low	27.6	Very low	101 Å²	101	150.1 Å²	150.1	71%	0.706	81%	0.808	S	S	*	*				142.1	135.2	110.4	65.2	0	0	0	0	113.2
709	N	28.7	Very low	27.6	Very low	149 Å²	149	150.3 Å²	150.3	80%	0.797	81%	0.809	S	S	*	*			trans	72.8	98	154.2	-64.3	-11.3	0	0	0	119.6	N711	N709-N711 PolarHBondContact O-N 2.68Å
710	N	25.6	Very low	27.6	Very low	154 Å²	154	149.2 Å²	149.2	82%	0.824	81%	0.807	S	S	*	*				10.9	101.4	127	-71.5	-7.3	0	0	0	115.3
711	N	26.8	Very low	27.4	Very low	155 Å²	155	147.5 Å²	147.5	83%	0.829	80%	0.802	S	S	*	*			trans	-167.4	138.8	131.6	-95.5	-24.3	0	0	0	110.1	N709 N713	N709-N711 PolarHBondContact O-N 2.68Å; N711-N713 PolarHBondContact O-N 3.48Å
712	N	24.5	Very low	27.2	Very low	146 Å²	146	148.3 Å²	148.3	78%	0.781	80%	0.799	S	S	*	*			trans	-30.1	118.6	170	-60.8	-30.1	0	0	0	113.5
713	N	24.7	Very low	27.2	Very low	150 Å²	150	145.2 Å²	145.2	80%	0.802	78%	0.782	S	S	*	*			trans	176.1	98.4	146.2	-88.6	-18.7	0	0	0	108.1	N711 N715	N711-N713 PolarHBondContact O-N 3.48Å; N713-N715 PolarHBondContact O-N 3.43Å; N713-N715 VanDerWaalsContact O-N 3.09Å
714	Y	25.8	Very low	27	Very low	236 Å²	236	147 Å²	147	93%	0.925	78%	0.782	S	S	*	*			trans	-70.9	102.8	169.9	-75.8	-80	0	0	0	108.5	L716	Y714-L716 PolarHBondContact O-N 3.22Å
715	N	25	Very low	27	Very low	140 Å²	140	148 Å²	148	75%	0.749	77%	0.767	S	S	*	*			trans	-69.2	125.1	172.6	-92.7	-22.7	0	0	0	110.2	N713 S717	N713-N715 PolarHBondContact O-N 3.43Å; N713-N715 VanDerWaalsContact O-N 3.09Å; N715-S717 VanDerWaalsContact C-N 3.29Å; N715-S717 PolarHBondContact O-N 2.96Å
716	L	27.1	Very low	26.8	Very low	183 Å²	183	149.3 Å²	149.3	96%	0.958	77%	0.768	S	S	*	*	S	Bend	trans	-80.6	61.3	-174.5	-141.1	103	0	0	0	111.3	Y714	Y714-L716 PolarHBondContact O-N 3.22Å
717	S	26.3	Very low	26.8	Very low	95 Å²	95	144.8 Å²	144.8	66%	0.664	75%	0.747	S	S	*	*			trans	-124.9	8.2	-178.1	61.2	0	0	0	0	116.1	N715	N715-S717 VanDerWaalsContact C-N 3.29Å; N715-S717 PolarHBondContact O-N 2.96Å
718	D	27.9	Very low	26.8	Very low	133 Å²	133	140.7 Å²	140.7	71%	0.711	73%	0.727	S	S	*	*			trans	-89.7	110.8	179.3	-67.3	-22.1	0	0	0	111.2	L720	D718-L720 PolarHBondContact O-N 3.05Å
719	K	27.6	Very low	26.8	Very low	206 Å²	206	142.5 Å²	142.5	90%	0.896	73%	0.729	S	S	*	*			trans	-67.5	107.8	177.8	-81.4	178.8	173.5	177.9	0	110.8
720	L	28	Very low	26.7	Very low	139 Å²	139	142.7 Å²	142.7	73%	0.728	72%	0.723	S	S	*	*			trans	-74.1	124.9	164.9	-71.7	155.7	0	0	0	109.5	D718	D718-L720 PolarHBondContact O-N 3.05Å
721	Q	25.4	Very low	26.9	Very low	155 Å²	155	140.6 Å²	140.6	72%	0.724	71%	0.71	S	S	*	*			trans	-105.4	125.6	172.5	-104.1	-178.6	-20	0	0	110.1
722	F	27.4	Very low	27.1	Very low	159 Å²	159	137.7 Å²	137.7	70%	0.697	70%	0.695	S	S	*	*			trans	-88.3	126.2	172	-64.2	-87.3	0	0	0	109.5	L694	L694-F722 HydrophobicContact CD2-CD1 4.16Å
723	I	27	Very low	27.4	Very low	93 Å²	93	132.9 Å²	132.9	48%	0.477	67%	0.672	S	S	.	*			trans	-93.7	111	166.7	-60.4	-177.7	0	0	0	107.5	L697 M725	L697-I723 HydrophobicContact CD1-CD1 3.36Å; L697-I723 HydrophobicContact CD1-CG1 4.21Å; I723-M725 HydrophobicContact CG2-CG 4.46Å
724	S	26.8	Very low	27.7	Very low	114 Å²	114	131.9 Å²	131.9	80%	0.797	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-72.8	121.8	167.1	163.3	0	0	0	0	108.6
725	M	27.2	Very low	28.2	Very low	102 Å²	102	124.5 Å²	124.5	50%	0.502	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-99.8	149.9	169.1	-70.3	-166.9	148.5	0	0	110.5	I695 I723	I695-M725 HydrophobicContact CD1-CE 3.97Å; I695-M725 HydrophobicContact CD1-SD 4.05Å; I723-M725 HydrophobicContact CG2-CG 4.46Å
726	E	25.1	Very low	28.9	Very low	182 Å²	182	122.4 Å²	122.4	85%	0.85	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-63.7	149.5	176.4	-71.6	-176.6	163.1	0	0	111.8
727	P	28.4	Very low	29.4	Very low	67 Å²	67	119.7 Å²	119.7	44%	0.435	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-63.3	146.7	-179.3	-14.5	27.9	0	0	0	112.8	M585	M585-P727 HydrophobicContact CG-CG 4.16Å; M585-P727 HydrophobicContact SD-CG 3.84Å
728	F	29.3	Very low	30.1	Very low	96 Å²	96	120.3 Å²	120.3	42%	0.421	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-63.9	129	177.9	-66.7	-91.1	0	0	0	113	L693 F730	L693-F728 HydrophobicContact CB-CE2 4.42Å; L693-F728 HydrophobicContact CB-CZ 4.07Å; F728-F730 HydrophobicContact CB-CE2 4.46Å; F728-F730 PolarHBondContact O-N 2.96Å
729	N	27.4	Very low	30.7	Very low	138 Å²	138	118.9 Å²	118.9	74%	0.738	58%	0.583	S	S	*	*			trans	-78.6	107.6	168.1	-79.1	-16.4	0	0	0	110.6	I731	N729-I731 PolarHBondContact O-N 2.96Å
730	F	27.6	Very low	31.6	Very low	154 Å²	154	112.7 Å²	112.7	68%	0.675	56%	0.557	S	S	*	*			trans	-80.6	112.5	166.8	-78.6	-88.2	0	0	0	109.6	F728	F728-F730 HydrophobicContact CB-CE2 4.46Å; F728-F730 PolarHBondContact O-N 2.96Å
731	I	28.9	Very low	32.6	Very low	109 Å²	109	111.6 Å²	111.6	56%	0.559	55%	0.548	S	S	*	.			trans	-83.9	124.4	173.3	-60	174.6	0	0	0	108.8	N729 P733 Y736	N729-I731 PolarHBondContact O-N 2.96Å; I731-P733 VanDerWaalsContact O-CD 3.3Å; I731-P733 WeakPolarHBondContact O-CD 3.4Å; I731-Y736 HydrophobicContact CG2-CD2 3.73Å; I731-Y736 HydrophobicContact CG2-CG 3.72Å
732	D	31.2	Very low	33.7	Very low	94 Å²	94	108.4 Å²	108.4	50%	0.503	53%	0.534	S	S	.	.			trans	-64.7	114.4	171.7	-172.4	-5.5	0	0	0	110.7	L734 N735 Y736	D732-L734 PolarHBondContact O-N 3.32Å; D732-L734 PolarHBondContact OD1-N 3.27Å; D732-N735 HydrophobicContact CB-CB 4.35Å; D732-N735 PolarHBondContact O-N 3.29Å; D732-Y736 WeakPolarHBondContact O-CB 3.39Å; D732-Y736 PolarHBondContact O-N 3.38Å
733	P	30.9	Very low	34.6	Very low	45 Å²	45	106.4 Å²	106.4	29%	0.292	53%	0.527	S	S	.	.	H	α-helix	trans	-64.2	-25	-172.8	-19.2	30.3	0	0	0	114.1	I731 R737 Y812	I731-P733 VanDerWaalsContact O-CD 3.3Å; I731-P733 WeakPolarHBondContact O-CD 3.4Å; P733-R737 WeakPolarHBondContact O-CB 3.14Å; P733-R737 WeakPolarHBondContact O-CG 3.18Å; P733-R737 PolarHBondContact O-N 3.34Å; P733-R737 VanDerWaalsContact O-N 3.07Å; P733-Y812 HydrophobicContact CG-CD1 3.86Å; P733-Y812 HydrophobicContact CG-CE1 3.71Å
734	L	32.5	Very low	35.8	Very low	130 Å²	130	107.6 Å²	107.6	68%	0.681	53%	0.53	S	S	*	.	H	α-helix	trans	-75.4	-41.7	179.9	-90.5	150.2	0	0	0	111.6	D732 Q738	D732-L734 PolarHBondContact O-N 3.32Å; D732-L734 PolarHBondContact OD1-N 3.27Å; L734-Q738 WeakPolarHBondContact O-CG 3.27Å; L734-Q738 PolarHBondContact O-N 3.48Å; L734-Q738 VanDerWaalsContact O-N 3.15Å
735	N	35.6	Very low	37	Very low	81 Å²	81	107.7 Å²	107.7	43%	0.433	52%	0.518	S	S	.	.	H	α-helix	trans	-75.5	-35.8	178.7	-141.7	-2.8	0	0	0	111.1	D732 Q738 Q739	D732-N735 HydrophobicContact CB-CB 4.35Å; D732-N735 PolarHBondContact O-N 3.29Å; N735-Q738 PolarHBondContact O-N 3.03Å; N735-Q739 WeakPolarHBondContact O-CB 3.45Å; N735-Q739 WeakPolarHBondContact O-CG 3Å; N735-Q739 PolarHBondContact O-N 2.78Å
736	Y	39.6	Very low	38.2	Very low	95 Å²	95	107.7 Å²	107.7	37%	0.373	52%	0.517	S	S	.	.	H	α-helix	trans	-68.8	-37.8	174.6	-169.7	-106.8	0	0	0	113.1	I731 D732 Q739 Q740	I731-Y736 HydrophobicContact CG2-CD2 3.73Å; I731-Y736 HydrophobicContact CG2-CG 3.72Å; D732-Y736 WeakPolarHBondContact O-CB 3.39Å; D732-Y736 PolarHBondContact O-N 3.38Å; Y736-Q739 PolarHBondContact O-N 3.04Å; Y736-Q740 HydrophobicContact CD1-CG 4.27Å; Y736-Q740 HydrophobicContact CE1-CG 4.02Å; Y736-Q740 WeakPolarHBondContact O-CB 3.18Å; Y736-Q740 WeakPolarHBondContact O-CG 3.29Å; Y736-Q740 PolarHBondContact O-N 2.86Å; Y736-Q740 PolarHBondContact OH-NE2 3.12Å
737	R	36.6	Very low	39.6	Very low	126 Å²	126	105.1 Å²	105.1	48%	0.475	50%	0.504	S	S	.	.	H	α-helix	trans	-67.2	-38.7	171.8	-82.2	-173.5	-159.4	-179.1	6.3	112.5	P733 Q739 Q740 Q741	P733-R737 WeakPolarHBondContact O-CB 3.14Å; P733-R737 WeakPolarHBondContact O-CG 3.18Å; P733-R737 PolarHBondContact O-N 3.34Å; P733-R737 VanDerWaalsContact O-N 3.07Å; R737-Q739 VanDerWaalsContact C-N 3.35Å; R737-Q740 PolarHBondContact O-N 3.11Å; R737-Q741 VanDerWaalsContact O-CB 3.27Å; R737-Q741 WeakPolarHBondContact O-CB 3.49Å; R737-Q741 VanDerWaalsContact O-CG 3.3Å; R737-Q741 WeakPolarHBondContact O-CG 3.06Å; R737-Q741 PolarHBondContact O-N 3.19Å
738	Q	41	Very low	40.9	Very low	108 Å²	108	107.8 Å²	107.8	51%	0.505	51%	0.511	S	S	.	.	H	α-helix	trans	-65.8	-39.5	173.9	-76	-176	2.3	0	0	111.4	L734 N735 Q742	L734-Q738 WeakPolarHBondContact O-CG 3.27Å; L734-Q738 PolarHBondContact O-N 3.48Å; L734-Q738 VanDerWaalsContact O-N 3.15Å; N735-Q738 PolarHBondContact O-N 3.03Å; Q738-Q742 VanDerWaalsContact O-CB 3.22Å; Q738-Q742 WeakPolarHBondContact O-CB 3.45Å; Q738-Q742 WeakPolarHBondContact O-CG 3.32Å; Q738-Q742 PolarHBondContact O-N 3.3Å
739	Q	42	Very low	42.2	Very low	103 Å²	103	107.5 Å²	107.5	48%	0.481	51%	0.511	S	S	.	.	H	α-helix	trans	-66.3	-40.9	173.8	-76.4	179.1	-3.4	0	0	112.7	N735 Y736 R737 Q743	N735-Q739 WeakPolarHBondContact O-CB 3.45Å; N735-Q739 WeakPolarHBondContact O-CG 3Å; N735-Q739 PolarHBondContact O-N 2.78Å; Y736-Q739 PolarHBondContact O-N 3.04Å; R737-Q739 VanDerWaalsContact C-N 3.35Å; Q739-Q743 VanDerWaalsContact O-CB 3.29Å; Q739-Q743 WeakPolarHBondContact O-CB 3.45Å; Q739-Q743 WeakPolarHBondContact O-CG 3.41Å; Q739-Q743 PolarHBondContact O-N 3.08Å
740	Q	46.8	Very low	43.3	Very low	76 Å²	76	107.6 Å²	107.6	36%	0.355	51%	0.505	S	S	.	.	H	α-helix	trans	-70.6	-39.6	175.7	-77.2	-159	-10.6	0	0	112.9	Y736 R737 Q743 Q744	Y736-Q740 HydrophobicContact CD1-CG 4.27Å; Y736-Q740 HydrophobicContact CE1-CG 4.02Å; Y736-Q740 WeakPolarHBondContact O-CB 3.18Å; Y736-Q740 WeakPolarHBondContact O-CG 3.29Å; Y736-Q740 PolarHBondContact O-N 2.86Å; Y736-Q740 PolarHBondContact OH-NE2 3.12Å; R737-Q740 PolarHBondContact O-N 3.11Å; Q740-Q743 PolarHBondContact O-N 2.82Å; Q740-Q744 WeakPolarHBondContact O-CB 3.39Å; Q740-Q744 WeakPolarHBondContact O-CG 3.32Å; Q740-Q744 PolarHBondContact O-N 3.22Å
741	Q	48.5	Very low	44.8	Very low	116 Å²	116	106.6 Å²	106.6	54%	0.542	50%	0.502	S	S	.	.	H	α-helix	trans	-67	-39.4	174.2	-76.3	-179.9	-5	0	0	111.3	R737 Q745	R737-Q741 VanDerWaalsContact O-CB 3.27Å; R737-Q741 WeakPolarHBondContact O-CB 3.49Å; R737-Q741 VanDerWaalsContact O-CG 3.3Å; R737-Q741 WeakPolarHBondContact O-CG 3.06Å; R737-Q741 PolarHBondContact O-N 3.19Å; Q741-Q745 WeakPolarHBondContact O-CB 2.97Å; Q741-Q745 VanDerWaalsContact O-CG 3.3Å; Q741-Q745 WeakPolarHBondContact O-CG 3.2Å; Q741-Q745 PolarHBondContact O-N 2.92Å
742	Q	47.3	Very low	46.5	Very low	88 Å²	88	107.6 Å²	107.6	41%	0.411	51%	0.505	S	S	.	.	H	α-helix	trans	-66.5	-40.2	172.4	-75.9	-179.7	19.1	0	0	111.7	Q738 H746	Q738-Q742 VanDerWaalsContact O-CB 3.22Å; Q738-Q742 WeakPolarHBondContact O-CB 3.45Å; Q738-Q742 WeakPolarHBondContact O-CG 3.32Å; Q738-Q742 PolarHBondContact O-N 3.3Å; Q742-H746 VanDerWaalsContact O-CB 3.28Å; Q742-H746 WeakPolarHBondContact O-CB 3.06Å; Q742-H746 PolarHBondContact O-N 3.28Å
743	Q	47.8	Very low	47.5	Very low	118 Å²	118	110.7 Å²	110.7	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-65.5	-44.1	175.1	-87.1	176.1	-16.9	0	0	112.1	Q739 Q740 H746 E747	Q739-Q743 VanDerWaalsContact O-CB 3.29Å; Q739-Q743 WeakPolarHBondContact O-CB 3.45Å; Q739-Q743 WeakPolarHBondContact O-CG 3.41Å; Q739-Q743 PolarHBondContact O-N 3.08Å; Q740-Q743 PolarHBondContact O-N 2.82Å; Q743-H746 CarbonylContact O-C 3.56Å; Q743-H746 PolarHBondContact O-N 3.14Å; Q743-E747 WeakPolarHBondContact O-CB 3.33Å; Q743-E747 WeakPolarHBondContact O-CG 3.43Å; Q743-E747 PolarHBondContact O-N 2.82Å
744	Q	51	Low	48.8	Very low	117 Å²	117	112 Å²	112	55%	0.547	51%	0.513	S	S	.	.	H	α-helix	trans	-65.4	-39.9	176.1	-77.2	179.6	-6	0	0	112.2	Q740 H746 E747 Q748	Q740-Q744 WeakPolarHBondContact O-CB 3.39Å; Q740-Q744 WeakPolarHBondContact O-CG 3.32Å; Q740-Q744 PolarHBondContact O-N 3.22Å; Q744-H746 VanDerWaalsContact C-N 3.35Å; Q744-E747 PolarHBondContact O-N 3.18Å; Q744-Q748 WeakPolarHBondContact O-CB 3.14Å; Q744-Q748 WeakPolarHBondContact O-CG 3.23Å; Q744-Q748 PolarHBondContact O-N 3.36Å
745	Q	53	Low	50.4	Low	117 Å²	117	109.2 Å²	109.2	55%	0.547	50%	0.501	S	S	.	.	H	α-helix	trans	-65.5	-38.5	171.7	-76.3	-179.9	-0.5	0	0	111.6	Q741 Q749	Q741-Q745 WeakPolarHBondContact O-CB 2.97Å; Q741-Q745 VanDerWaalsContact O-CG 3.3Å; Q741-Q745 WeakPolarHBondContact O-CG 3.2Å; Q741-Q745 PolarHBondContact O-N 2.92Å; Q745-Q749 WeakPolarHBondContact O-CB 3.31Å; Q745-Q749 VanDerWaalsContact O-CG 3.28Å; Q745-Q749 WeakPolarHBondContact O-CG 3.17Å; Q745-Q749 PolarHBondContact O-N 2.75Å
746	H	52.6	Low	51.6	Low	102 Å²	102	111.6 Å²	111.6	47%	0.472	51%	0.51	S	S	.	.	H	α-helix	trans	-68.3	-37.7	176.8	-130.4	-63.4	0	0	0	112.1	Q742 Q743 Q744 K750	Q742-H746 VanDerWaalsContact O-CB 3.28Å; Q742-H746 WeakPolarHBondContact O-CB 3.06Å; Q742-H746 PolarHBondContact O-N 3.28Å; Q743-H746 CarbonylContact O-C 3.56Å; Q743-H746 PolarHBondContact O-N 3.14Å; Q744-H746 VanDerWaalsContact C-N 3.35Å; H746-K750 VanDerWaalsContact O-CB 3.31Å; H746-K750 WeakPolarHBondContact O-CB 3.23Å; H746-K750 PolarHBondContact O-N 3.43Å
747	E	53.7	Low	52.2	Low	127 Å²	127	112 Å²	112	59%	0.593	52%	0.518	S	S	*	.	H	α-helix	trans	-70.7	-42.7	175.7	-78.4	-175.9	162.5	0	0	111.6	Q743 Q744 Q749 K750 E751	Q743-E747 WeakPolarHBondContact O-CB 3.33Å; Q743-E747 WeakPolarHBondContact O-CG 3.43Å; Q743-E747 PolarHBondContact O-N 2.82Å; Q744-E747 PolarHBondContact O-N 3.18Å; E747-Q749 PolarHBondContact O-N 2.92Å; E747-K750 CarbonylContact O-C 3.54Å; E747-K750 WeakPolarHBondContact O-CB 3.25Å; E747-K750 PolarHBondContact O-N 2.9Å; E747-K750 VanDerWaalsContact O-N 3.11Å; E747-E751 PolarHBondContact O-N 2.96Å
748	Q	56.5	Low	53	Low	124 Å²	124	113.7 Å²	113.7	58%	0.579	53%	0.525	S	S	*	.	H	α-helix	trans	-60.3	-44.3	171.6	-79.9	-179.3	-14.3	0	0	111.7	Q744 K750 E751 E752	Q744-Q748 WeakPolarHBondContact O-CB 3.14Å; Q744-Q748 WeakPolarHBondContact O-CG 3.23Å; Q744-Q748 PolarHBondContact O-N 3.36Å; Q748-K750 VanDerWaalsContact C-N 3.31Å; Q748-K750 PolarHBondContact O-N 3.19Å; Q748-E751 PolarHBondContact O-N 2.85Å; Q748-E752 WeakPolarHBondContact O-CB 3.36Å; Q748-E752 WeakPolarHBondContact O-CG 3.37Å; Q748-E752 PolarHBondContact O-N 3.35Å
749	Q	55.4	Low	54	Low	89 Å²	89	115.4 Å²	115.4	42%	0.416	53%	0.531	S	S	.	.	H	α-helix	trans	-66.3	-31.3	173.9	-73.8	-179.4	14.8	0	0	112.7	Q745 E747 R753	Q745-Q749 WeakPolarHBondContact O-CB 3.31Å; Q745-Q749 VanDerWaalsContact O-CG 3.28Å; Q745-Q749 WeakPolarHBondContact O-CG 3.17Å; Q745-Q749 PolarHBondContact O-N 2.75Å; E747-Q749 PolarHBondContact O-N 2.92Å; Q749-R753 WeakPolarHBondContact O-CB 3.3Å; Q749-R753 VanDerWaalsContact O-CG 3.3Å; Q749-R753 WeakPolarHBondContact O-CG 2.97Å; Q749-R753 PolarHBondContact O-N 3.48Å
750	K	51.5	Low	54.4	Low	141 Å²	141	116.6 Å²	116.6	61%	0.613	54%	0.535	S	S	*	.	H	α-helix	trans	-70.4	-42.6	175.2	-139.5	175.3	-176.6	-179	0	110.5	H746 E747 Q748 R753 I754	H746-K750 VanDerWaalsContact O-CB 3.31Å; H746-K750 WeakPolarHBondContact O-CB 3.23Å; H746-K750 PolarHBondContact O-N 3.43Å; E747-K750 CarbonylContact O-C 3.54Å; E747-K750 WeakPolarHBondContact O-CB 3.25Å; E747-K750 PolarHBondContact O-N 2.9Å; E747-K750 VanDerWaalsContact O-N 3.11Å; Q748-K750 VanDerWaalsContact C-N 3.31Å; Q748-K750 PolarHBondContact O-N 3.19Å; K750-R753 PolarHBondContact O-N 3.04Å; K750-I754 WeakPolarHBondContact O-CB 3.44Å; K750-I754 WeakPolarHBondContact O-CD1 3.4Å; K750-I754 WeakPolarHBondContact O-CG1 3.25Å; K750-I754 PolarHBondContact O-N 2.87Å
751	E	58.7	Low	54.3	Low	133 Å²	133	118.6 Å²	118.6	62%	0.621	54%	0.544	S	S	*	.	H	α-helix	trans	-66.1	-42.7	174.6	-75.1	-169	154.8	0	0	111.7	E747 Q748 I754 V755	E747-E751 PolarHBondContact O-N 2.96Å; Q748-E751 PolarHBondContact O-N 2.85Å; E751-I754 PolarHBondContact O-N 2.94Å; E751-V755 WeakPolarHBondContact O-CB 3.46Å; E751-V755 VanDerWaalsContact O-CG2 3.24Å; E751-V755 WeakPolarHBondContact O-CG2 3.3Å; E751-V755 PolarHBondContact O-N 2.64Å
752	E	63.5	Low	54.4	Low	130 Å²	130	117.8 Å²	117.8	61%	0.607	54%	0.543	S	S	*	.	H	α-helix	trans	-61.9	-44.2	173.8	-76.6	-178.5	166.1	0	0	111.8	Q748 I754 V755 E756	Q748-E752 WeakPolarHBondContact O-CB 3.36Å; Q748-E752 WeakPolarHBondContact O-CG 3.37Å; Q748-E752 PolarHBondContact O-N 3.35Å; E752-I754 PolarHBondContact O-N 3.45Å; E752-V755 PolarHBondContact O-N 3.49Å; E752-E756 WeakPolarHBondContact O-CB 3.34Å; E752-E756 PolarHBondContact O-N 3.19Å
753	R	53.8	Low	54.4	Low	158 Å²	158	120.7 Å²	120.7	60%	0.596	56%	0.555	S	S	*	*	H	α-helix	trans	-66.1	-34.6	173.6	-75.8	-174.9	-147.9	-168.2	7.1	112.9	Q749 K750 N757	Q749-R753 WeakPolarHBondContact O-CB 3.3Å; Q749-R753 VanDerWaalsContact O-CG 3.3Å; Q749-R753 WeakPolarHBondContact O-CG 2.97Å; Q749-R753 PolarHBondContact O-N 3.48Å; K750-R753 PolarHBondContact O-N 3.04Å; R753-N757 WeakPolarHBondContact O-CB 3.35Å; R753-N757 PolarHBondContact O-N 2.97Å
754	I	57.6	Low	54.2	Low	73 Å²	73	120 Å²	120	37%	0.374	55%	0.553	S	S	.	*	H	α-helix	trans	-69.5	-38.5	174.5	-72.3	163.6	0	0	0	110.2	K750 E751 E752 R758	K750-I754 WeakPolarHBondContact O-CB 3.44Å; K750-I754 WeakPolarHBondContact O-CD1 3.4Å; K750-I754 WeakPolarHBondContact O-CG1 3.25Å; K750-I754 PolarHBondContact O-N 2.87Å; E751-I754 PolarHBondContact O-N 2.94Å; E752-I754 PolarHBondContact O-N 3.45Å; I754-R758 VanDerWaalsContact O-CB 3.28Å; I754-R758 WeakPolarHBondContact O-CB 3.47Å; I754-R758 VanDerWaalsContact O-CG 3.23Å; I754-R758 WeakPolarHBondContact O-CG 3.2Å; I754-R758 PolarHBondContact O-N 2.9Å
755	V	65.5	Low	53.9	Low	72 Å²	72	118.4 Å²	118.4	44%	0.436	55%	0.548	S	S	.	.	H	α-helix	trans	-70.7	-40	175.9	171.4	0	0	0	0	111.1	E751 E752 R758 K759	E751-V755 WeakPolarHBondContact O-CB 3.46Å; E751-V755 VanDerWaalsContact O-CG2 3.24Å; E751-V755 WeakPolarHBondContact O-CG2 3.3Å; E751-V755 PolarHBondContact O-N 2.64Å; E752-V755 PolarHBondContact O-N 3.49Å; V755-R758 PolarHBondContact O-N 2.86Å; V755-K759 HydrophobicContact CG1-CD 4.33Å; V755-K759 WeakPolarHBondContact O-CB 3.42Å; V755-K759 VanDerWaalsContact O-CG 3.28Å; V755-K759 WeakPolarHBondContact O-CG 3.02Å; V755-K759 PolarHBondContact O-N 3.25Å
756	E	60.7	Low	53.5	Low	131 Å²	131	117.6 Å²	117.6	61%	0.612	55%	0.546	S	S	*	.	H	α-helix	trans	-66.6	-44.2	172.6	-81.6	-168	149.2	0	0	112.1	E752 R758 K759 F760	E752-E756 WeakPolarHBondContact O-CB 3.34Å; E752-E756 PolarHBondContact O-N 3.19Å; E756-R758 PolarHBondContact O-N 2.83Å; E756-K759 CarbonylContact O-C 3.6Å; E756-K759 WeakPolarHBondContact O-CB 3.5Å; E756-K759 PolarHBondContact O-N 3Å; E756-K759 VanDerWaalsContact O-N 3.16Å; E756-F760 WeakPolarHBondContact O-CB 3.18Å; E756-F760 PolarHBondContact O-N 3.36Å
757	N	52.4	Low	53	Low	103 Å²	103	117.5 Å²	117.5	55%	0.551	55%	0.549	S	S	*	.	H	α-helix	trans	-64.7	-37.7	174.3	-83.6	-17.5	0	0	0	111.7	R753 F760 Q761	R753-N757 WeakPolarHBondContact O-CB 3.35Å; R753-N757 PolarHBondContact O-N 2.97Å; N757-F760 PolarHBondContact O-N 3.34Å; N757-Q761 VanDerWaalsContact O-CB 3.29Å; N757-Q761 WeakPolarHBondContact O-CB 3.46Å; N757-Q761 PolarHBondContact O-N 3.11Å
758	R	54.3	Low	52.3	Low	162 Å²	162	115.7 Å²	115.7	61%	0.611	54%	0.543	S	S	*	.	H	α-helix	trans	-67.7	-34.8	171.4	-76.2	-179.2	-156.3	179.7	8.7	112.3	I754 V755 E756 N762	I754-R758 VanDerWaalsContact O-CB 3.28Å; I754-R758 WeakPolarHBondContact O-CB 3.47Å; I754-R758 VanDerWaalsContact O-CG 3.23Å; I754-R758 WeakPolarHBondContact O-CG 3.2Å; I754-R758 PolarHBondContact O-N 2.9Å; V755-R758 PolarHBondContact O-N 2.86Å; E756-R758 PolarHBondContact O-N 2.83Å; R758-N762 WeakPolarHBondContact O-CB 3.44Å; R758-N762 PolarHBondContact O-N 2.83Å; R758-N762 PolarHBondContact O-ND2 2.8Å
759	K	61.3	Low	51.3	Low	143 Å²	143	113.2 Å²	113.2	62%	0.622	54%	0.536	S	S	*	.	H	α-helix	trans	-68.3	-37.1	172.3	-78.1	173.9	-177.7	174.5	0	111.5	V755 E756 K763	V755-K759 HydrophobicContact CG1-CD 4.33Å; V755-K759 WeakPolarHBondContact O-CB 3.42Å; V755-K759 VanDerWaalsContact O-CG 3.28Å; V755-K759 WeakPolarHBondContact O-CG 3.02Å; V755-K759 PolarHBondContact O-N 3.25Å; E756-K759 CarbonylContact O-C 3.6Å; E756-K759 WeakPolarHBondContact O-CB 3.5Å; E756-K759 PolarHBondContact O-N 3Å; E756-K759 VanDerWaalsContact O-N 3.16Å; K759-K763 WeakPolarHBondContact O-CB 3.46Å; K759-K763 PolarHBondContact O-N 2.86Å
760	F	50.1	Low	50.3	Low	129 Å²	129	115.9 Å²	115.9	57%	0.566	55%	0.55	S	S	*	*	H	α-helix	trans	-75.6	-40.7	178.4	-156	-88.6	0	0	0	111.9	E756 N757 K763 M764	E756-F760 WeakPolarHBondContact O-CB 3.18Å; E756-F760 PolarHBondContact O-N 3.36Å; N757-F760 PolarHBondContact O-N 3.34Å; F760-K763 CarbonylContact O-C 3.56Å; F760-K763 PolarHBondContact O-N 3.31Å; F760-M764 HydrophobicContact CD1-CG 4.41Å; F760-M764 HydrophobicContact CD1-SD 4.41Å; F760-M764 HydrophobicContact CE1-CE 4.01Å; F760-M764 HydrophobicContact CE1-CG 4.29Å; F760-M764 HydrophobicContact CE1-SD 4.16Å; F760-M764 WeakPolarHBondContact O-CB 3.41Å; F760-M764 PolarHBondContact O-N 2.82Å
761	Q	45.5	Very low	49.5	Very low	118 Å²	118	119 Å²	119	55%	0.551	56%	0.558	S	S	*	*	H	α-helix	trans	-63.5	-45.3	168.8	-95.9	165.7	-41.3	0	0	110.9	N757 K763 M764 D765	N757-Q761 VanDerWaalsContact O-CB 3.29Å; N757-Q761 WeakPolarHBondContact O-CB 3.46Å; N757-Q761 PolarHBondContact O-N 3.11Å; Q761-K763 VanDerWaalsContact C-N 3.27Å; Q761-K763 PolarHBondContact O-N 2.84Å; Q761-M764 CarbonylContact O-C 3.57Å; Q761-M764 PolarHBondContact O-N 3.16Å; Q761-D765 WeakPolarHBondContact O-CB 3.19Å; Q761-D765 PolarHBondContact O-N 3.41Å
762	N	50.1	Low	48.3	Very low	99 Å²	99	119.3 Å²	119.3	53%	0.529	56%	0.56	S	S	.	*	H	α-helix	trans	-62.5	-33.2	172.7	-76.4	-20.8	0	0	0	112.1	R758 I766	R758-N762 WeakPolarHBondContact O-CB 3.44Å; R758-N762 PolarHBondContact O-N 2.83Å; R758-N762 PolarHBondContact O-ND2 2.8Å; N762-I766 WeakPolarHBondContact O-CB 3.25Å; N762-I766 WeakPolarHBondContact O-CD1 3.28Å; N762-I766 WeakPolarHBondContact O-CG1 3.25Å; N762-I766 PolarHBondContact O-N 2.86Å
763	K	48.3	Very low	46.7	Very low	149 Å²	149	120 Å²	120	65%	0.648	57%	0.568	S	S	*	*	H	α-helix	trans	-72	-37.5	173.3	-117.5	178.3	177.5	178.9	0	112.9	K759 F760 Q761 N767	K759-K763 WeakPolarHBondContact O-CB 3.46Å; K759-K763 PolarHBondContact O-N 2.86Å; F760-K763 CarbonylContact O-C 3.56Å; F760-K763 PolarHBondContact O-N 3.31Å; Q761-K763 VanDerWaalsContact C-N 3.27Å; Q761-K763 PolarHBondContact O-N 2.84Å; K763-N767 VanDerWaalsContact O-CB 3.32Å; K763-N767 WeakPolarHBondContact O-CB 3.46Å; K763-N767 PolarHBondContact O-N 3.46Å; K763-N767 PolarHBondContact O-ND2 3.06Å
764	M	43.9	Very low	45.7	Very low	104 Å²	104	116.9 Å²	116.9	51%	0.512	57%	0.57	S	S	.	*	H	α-helix	trans	-71.5	-41.7	175.1	-97.2	-168.5	167.6	0	0	110.9	F760 Q761 N767 L768	F760-M764 HydrophobicContact CD1-CG 4.41Å; F760-M764 HydrophobicContact CD1-SD 4.41Å; F760-M764 HydrophobicContact CE1-CE 4.01Å; F760-M764 HydrophobicContact CE1-CG 4.29Å; F760-M764 HydrophobicContact CE1-SD 4.16Å; F760-M764 WeakPolarHBondContact O-CB 3.41Å; F760-M764 PolarHBondContact O-N 2.82Å; Q761-M764 CarbonylContact O-C 3.57Å; Q761-M764 PolarHBondContact O-N 3.16Å; M764-N767 CarbonylContact O-C 3.5Å; M764-N767 PolarHBondContact O-N 2.88Å; M764-N767 VanDerWaalsContact O-N 3.16Å; M764-L768 HydrophobicContact CB-CD1 4.42Å; M764-L768 WeakPolarHBondContact O-CB 3.42Å; M764-L768 WeakPolarHBondContact O-CD1 3.49Å; M764-L768 VanDerWaalsContact O-CG 3.25Å; M764-L768 WeakPolarHBondContact O-CG 3.42Å; M764-L768 PolarHBondContact O-N 2.94Å
765	D	42.9	Very low	44.3	Very low	83 Å²	83	121.5 Å²	121.5	44%	0.444	59%	0.592	S	S	.	*	H	α-helix	trans	-67.5	-35.8	175.1	-69.1	-21.1	0	0	0	110.5	Q761 T769	Q761-D765 WeakPolarHBondContact O-CB 3.19Å; Q761-D765 PolarHBondContact O-N 3.41Å; D765-T769 WeakPolarHBondContact O-CB 3.14Å; D765-T769 WeakPolarHBondContact O-CG2 3.4Å; D765-T769 PolarHBondContact O-N 2.95Å; D765-T769 PolarHBondContact O-OG1 2.87Å
766	I	45.9	Very low	42.5	Very low	99 Å²	99	124 Å²	124	51%	0.508	61%	0.613	S	S	.	*	H	α-helix	trans	-68.2	-36.2	169.9	-70.9	164.2	0	0	0	111.4	N762 T769 M770	N762-I766 WeakPolarHBondContact O-CB 3.25Å; N762-I766 WeakPolarHBondContact O-CD1 3.28Å; N762-I766 WeakPolarHBondContact O-CG1 3.25Å; N762-I766 PolarHBondContact O-N 2.86Å; I766-T769 WeakPolarHBondContact CA-OG1 3.43Å; I766-T769 PolarHBondContact O-OG1 2.84Å; I766-M770 HydrophobicContact CG2-CG 4.46Å; I766-M770 WeakPolarHBondContact O-CB 3.1Å; I766-M770 WeakPolarHBondContact O-CG 3.27Å; I766-M770 PolarHBondContact O-N 3.21Å
767	N	41.4	Very low	40.9	Very low	101 Å²	101	122.8 Å²	122.8	54%	0.54	62%	0.619	S	S	.	*	H	α-helix	trans	-79	-29	177.1	-79.8	-27.6	0	0	0	113.8	K763 M764 R771	K763-N767 VanDerWaalsContact O-CB 3.32Å; K763-N767 WeakPolarHBondContact O-CB 3.46Å; K763-N767 PolarHBondContact O-N 3.46Å; K763-N767 PolarHBondContact O-ND2 3.06Å; M764-N767 CarbonylContact O-C 3.5Å; M764-N767 PolarHBondContact O-N 2.88Å; M764-N767 VanDerWaalsContact O-N 3.16Å; N767-R771 WeakPolarHBondContact O-CB 3.31Å; N767-R771 PolarHBondContact O-N 2.95Å
768	L	38.5	Very low	39.7	Very low	88 Å²	88	127 Å²	127	46%	0.461	63%	0.632	S	S	.	*	H	α-helix	trans	-77.4	-40.2	173.7	-76.6	159.7	0	0	0	109.8	M764 M770 R771 E772	M764-L768 HydrophobicContact CB-CD1 4.42Å; M764-L768 WeakPolarHBondContact O-CB 3.42Å; M764-L768 WeakPolarHBondContact O-CD1 3.49Å; M764-L768 VanDerWaalsContact O-CG 3.25Å; M764-L768 WeakPolarHBondContact O-CG 3.42Å; M764-L768 PolarHBondContact O-N 2.94Å; L768-M770 VanDerWaalsContact C-N 3.33Å; L768-M770 PolarHBondContact O-N 3.1Å; L768-R771 PolarHBondContact O-N 3.4Å; L768-E772 VanDerWaalsContact O-CB 3.32Å; L768-E772 WeakPolarHBondContact O-CB 3.35Å; L768-E772 WeakPolarHBondContact O-CG 3.47Å; L768-E772 PolarHBondContact O-N 2.84Å
769	T	36.7	Very low	38.6	Very low	72 Å²	72	128.6 Å²	128.6	44%	0.442	64%	0.644	S	S	.	*	H	α-helix	trans	-72.3	-21.2	170.8	55.7	0	0	0	0	113.6	D765 I766 N773	D765-T769 WeakPolarHBondContact O-CB 3.14Å; D765-T769 WeakPolarHBondContact O-CG2 3.4Å; D765-T769 PolarHBondContact O-N 2.95Å; D765-T769 PolarHBondContact O-OG1 2.87Å; I766-T769 WeakPolarHBondContact CA-OG1 3.43Å; I766-T769 PolarHBondContact O-OG1 2.84Å; T769-N773 WeakPolarHBondContact O-CB 3.07Å; T769-N773 PolarHBondContact O-ND2 3.33Å
770	M	34.8	Very low	36.9	Very low	145 Å²	145	133.1 Å²	133.1	71%	0.714	66%	0.657	S	S	*	*	H	α-helix	trans	-82.6	-23.1	168.7	-72.3	-93.7	-103.4	0	0	113.1	I766 L768	I766-M770 HydrophobicContact CG2-CG 4.46Å; I766-M770 WeakPolarHBondContact O-CB 3.1Å; I766-M770 WeakPolarHBondContact O-CG 3.27Å; I766-M770 PolarHBondContact O-N 3.21Å; L768-M770 VanDerWaalsContact C-N 3.33Å; L768-M770 PolarHBondContact O-N 3.1Å
771	R	33.4	Very low	35.7	Very low	206 Å²	206	136.3 Å²	136.3	78%	0.777	67%	0.671	S	S	*	*	H	α-helix	trans	-88.3	-30.6	174.4	-95.4	177.8	164.2	156.5	-3.8	113.6	N767 L768 S774	N767-R771 WeakPolarHBondContact O-CB 3.31Å; N767-R771 PolarHBondContact O-N 2.95Å; L768-R771 PolarHBondContact O-N 3.4Å; R771-S774 PolarHBondContact O-OG 2.88Å
772	E	33.6	Very low	34.8	Very low	140 Å²	140	139.6 Å²	139.6	65%	0.654	68%	0.683	S	S	*	*	H	α-helix	trans	-84.5	-14.6	179.2	-70.6	179.5	163.9	0	0	113.6	L768 S774	L768-E772 VanDerWaalsContact O-CB 3.32Å; L768-E772 WeakPolarHBondContact O-CB 3.35Å; L768-E772 WeakPolarHBondContact O-CG 3.47Å; L768-E772 PolarHBondContact O-N 2.84Å; E772-S774 PolarHBondContact O-N 2.75Å
773	N	31.1	Very low	33.9	Very low	145 Å²	145	143.7 Å²	143.7	78%	0.775	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	16.2	172.9	-80.3	-40.8	0	0	0	114.6	T769	T769-N773 WeakPolarHBondContact O-CB 3.07Å; T769-N773 PolarHBondContact O-ND2 3.33Å
774	S	30.9	Very low	32.9	Very low	92 Å²	92	141.4 Å²	141.4	64%	0.643	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	-2.7	177.4	68.4	0	0	0	0	115.4	R771 E772	R771-S774 PolarHBondContact O-OG 2.88Å; E772-S774 PolarHBondContact O-N 2.75Å
775	M	28.2	Very low	31.9	Very low	171 Å²	171	147.7 Å²	147.7	84%	0.842	72%	0.72	S	S	*	*	S	Bend	trans	-147.9	77.1	173.7	-74.6	-150.9	-69.7	0	0	113.1
776	S	29.1	Very low	31.2	Very low	125 Å²	125	152.4 Å²	152.4	87%	0.874	74%	0.741	S	S	*	*			trans	171.7	117.4	134.9	53.4	0	0	0	0	111
777	S	26.9	Very low	30.4	Very low	104 Å²	104	153 Å²	153	73%	0.727	75%	0.754	S	S	*	*			trans	-91.8	146.2	-170.8	62.8	0	0	0	0	113.4
778	K	27.3	Very low	29.7	Very low	193 Å²	193	157.5 Å²	157.5	84%	0.839	77%	0.769	S	S	*	*			trans	73	103.4	149.8	-65.3	168.3	178.7	173.9	0	119
779	K	30.4	Very low	29.2	Very low	195 Å²	195	163 Å²	163	85%	0.848	79%	0.789	S	S	*	*				151	104.2	124.6	-85.4	171.3	176.7	177.5	0	110.6
780	R	26.6	Very low	28.7	Very low	238 Å²	238	167.8 Å²	167.8	90%	0.898	81%	0.806	S	S	*	*				66.2	107.3	106.1	-75.4	-176	175.9	177.9	-0.9	114
781	K	25.3	Very low	28.3	Very low	196 Å²	196	168.1 Å²	168.1	85%	0.852	81%	0.811	S	S	*	*				90.4	132.8	70.3	-103.8	-172.5	179.4	178.5	0	113.7
782	K	26.2	Very low	28	Very low	187 Å²	187	164.4 Å²	164.4	81%	0.813	81%	0.811	S	S	*	*			trans	89.8	126.2	165.2	-62.4	177.2	175.9	-173.4	0	113.9
783	E	30.9	Very low	28.1	Very low	184 Å²	184	165.4 Å²	165.4	86%	0.86	82%	0.82	S	S	*	*			cis	-153.2	138.5	38	-113.5	140.7	-145	0	0	112.8
784	S	26.1	Very low	28	Very low	102 Å²	102	164.6 Å²	164.6	71%	0.713	82%	0.823	S	S	*	*			trans	-118.1	145.6	163.9	52.9	0	0	0	0	107.9
785	R	24.8	Very low	27.6	Very low	235 Å²	235	163.2 Å²	163.2	89%	0.887	82%	0.823	S	S	*	*			trans	157.3	146.4	134.5	-86.5	165.1	179	-166.4	-1.1	114.6
786	M	27.4	Very low	27.5	Very low	183 Å²	183	162.3 Å²	162.3	90%	0.901	82%	0.821	S	S	*	*			trans	113.8	121	163	-65.5	-158.9	-61.6	0	0	112.1
787	S	29.3	Very low	27.2	Very low	110 Å²	110	163.1 Å²	163.1	77%	0.769	82%	0.816	S	S	*	*			cis	-172.5	119.1	11.9	40.5	0	0	0	0	108.4
788	K	25.8	Very low	27.1	Very low	197 Å²	197	164 Å²	164	86%	0.857	82%	0.817	S	S	*	*				34.1	118	103.7	-84.8	-170.2	175.9	-173.8	0	119.1
789	K	28.2	Very low	27	Very low	202 Å²	202	161.5 Å²	161.5	88%	0.878	81%	0.813	S	S	*	*				165.5	105.5	128.1	-92	178.4	177.4	-171.9	0	108.3
790	Q	26.7	Very low	26.8	Very low	173 Å²	173	159.9 Å²	159.9	81%	0.808	81%	0.814	S	S	*	*				53.6	113.2	74.2	-93.1	178.8	-27.3	0	0	115.3
791	D	27.3	Very low	26.6	Very low	153 Å²	153	153 Å²	153	82%	0.818	80%	0.802	S	S	*	*				-165.7	111.1	127.8	-81.5	-27.3	0	0	0	107.5
792	V	26.1	Very low	26.6	Very low	128 Å²	128	149.9 Å²	149.9	78%	0.776	80%	0.795	S	S	*	*				106.3	112.1	74.8	165.1	0	0	0	0	110.8
793	L	34.9	Very low	26.4	Very low	161 Å²	161	147.4 Å²	147.4	84%	0.843	79%	0.789	S	S	*	*			trans	-75.1	160.7	162.2	-82.4	149.6	0	0	0	110.3
794	P	29	Very low	26.1	Very low	128 Å²	128	145.8 Å²	145.8	83%	0.831	79%	0.786	S	S	*	*				-146.3	166.2	96.2	33.8	-14.9	0	0	0	111.7
795	G	24.1	Very low	25.9	Very low	62 Å²	62	145.3 Å²	145.3	64%	0.639	78%	0.783	S	S	*	*			cis	140	149.3	20.8	0	0	0	0	0	108.5
796	N	24.5	Very low	25.8	Very low	153 Å²	153	142 Å²	142	82%	0.818	78%	0.782	S	S	*	*			trans	83.3	108.1	163	-58.6	-18.3	0	0	0	118
797	N	24.8	Very low	25.5	Very low	141 Å²	141	138.1 Å²	138.1	75%	0.754	77%	0.773	S	S	*	*				61.2	113.8	77.7	-76.3	-13.6	0	0	0	112.9
798	T	23.7	Very low	25.3	Very low	124 Å²	124	140.5 Å²	140.5	76%	0.761	78%	0.777	S	S	*	*				173.7	136	110.9	33.3	0	0	0	0	113.3
799	N	25.1	Very low	25.2	Very low	139 Å²	139	138.3 Å²	138.3	74%	0.743	77%	0.769	S	S	*	*			trans	83.5	93.6	144	-58.5	-8.8	0	0	0	120.8
800	N	26	Very low	25	Very low	162 Å²	162	134.6 Å²	134.6	87%	0.866	76%	0.759	S	S	*	*				-45.6	131.3	125.3	-77.9	-23	0	0	0	110.5
801	S	23.3	Very low	25	Very low	92 Å²	92	130.6 Å²	130.6	64%	0.643	75%	0.75	S	S	*	*				164.8	147.2	127.5	48.9	0	0	0	0	111.8
802	N	24.9	Very low	24.9	Very low	132 Å²	132	131.7 Å²	131.7	71%	0.706	74%	0.744	S	S	*	*			trans	90.6	99.5	161.8	-52.3	-22.1	0	0	0	115.3
803	I	22.7	Very low	24.8	Very low	135 Å²	135	133.4 Å²	133.4	69%	0.692	74%	0.744	S	S	*	*				82.3	133.1	71.6	-71.1	165.8	0	0	0	110
804	D	23.5	Very low	24.3	Very low	149 Å²	149	131.9 Å²	131.9	80%	0.797	74%	0.736	S	S	*	*			trans	79.9	135.3	175.2	-52.1	-31.1	0	0	0	116.1
805	S	22.6	Very low	24.1	Very low	93 Å²	93	135.9 Å²	135.9	65%	0.65	73%	0.734	S	S	*	*			cis	-176.8	148.6	-13.1	51.5	0	0	0	0	104.7
806	L	21.8	Very low	24.2	Very low	165 Å²	165	136.9 Å²	136.9	86%	0.864	73%	0.728	S	S	*	*			trans	34.4	112.2	155.7	-76	85.7	0	0	0	119.4
807	S	22.7	Very low	24.3	Very low	102 Å²	102	136 Å²	136	71%	0.713	72%	0.723	S	S	*	*				172	136.4	106.7	50.5	0	0	0	0	112.7	H809	S807-H809 PolarHBondContact O-N 2.61Å
808	N	23.1	Very low	24.4	Very low	160 Å²	160	134 Å²	134	86%	0.856	71%	0.711	S	S	*	*			trans	-63	108.8	173.3	-71.2	-38.1	0	0	0	111
809	H	25.1	Very low	24.6	Very low	150 Å²	150	135.1 Å²	135.1	69%	0.694	71%	0.711	S	S	*	*			trans	-142.5	127.8	163	-78.7	-63.9	0	0	0	113.3	S807 S811	S807-H809 PolarHBondContact O-N 2.61Å; H809-S811 PolarHBondContact O-N 3.18Å
810	N	23.8	Very low	24.9	Very low	125 Å²	125	133.2 Å²	133.2	67%	0.668	70%	0.696	S	S	*	*			trans	-65.9	114.6	176.4	-68.1	-35.7	0	0	0	110.4
811	S	26	Very low	25.1	Very low	89 Å²	89	129.4 Å²	129.4	62%	0.622	68%	0.676	S	S	*	*			trans	-99.3	123.9	172	50.6	0	0	0	0	111.4	H809	H809-S811 PolarHBondContact O-N 3.18Å
812	Y	25.3	Very low	25.5	Very low	175 Å²	175	129 Å²	129	69%	0.686	67%	0.671	S	S	*	*			trans	-88.2	131.1	172.5	-69.4	-91.8	0	0	0	109.3	P733	P733-Y812 HydrophobicContact CG-CD1 3.86Å; P733-Y812 HydrophobicContact CG-CE1 3.71Å
813	Q	23.9	Very low	25.8	Very low	164 Å²	164	129.9 Å²	129.9	77%	0.766	68%	0.675	S	S	*	*			trans	-107.7	120.6	172.2	-76.7	-174.7	-13.8	0	0	110
814	L	25.4	Very low	26.2	Very low	130 Å²	130	130.5 Å²	130.5	68%	0.681	68%	0.675	S	S	*	*			trans	-92.5	119.9	166.1	-96.5	146.9	0	0	0	108.4	M845	L814-M845 HydrophobicContact CD1-CE 4.1Å
815	R	23.8	Very low	26.6	Very low	211 Å²	211	127.3 Å²	127.3	80%	0.796	66%	0.657	S	S	*	*			trans	-120.4	120.3	167.5	-80	-174.4	178.2	178.5	-0.3	108.8
816	T	27.2	Very low	26.9	Very low	83 Å²	83	127.5 Å²	127.5	51%	0.509	66%	0.659	S	S	.	*			trans	-125.9	132.3	167.5	54.7	0	0	0	0	108.4
817	N	25.5	Very low	27.3	Very low	134 Å²	134	123.6 Å²	123.6	72%	0.717	64%	0.639	S	S	*	*			trans	-95.1	106.9	172.6	-68.8	-18.6	0	0	0	106.8
818	M	28.1	Very low	27.6	Very low	101 Å²	101	123 Å²	123	50%	0.498	63%	0.627	S	S	.	*			trans	-99.5	121.1	173.8	-66.6	-175.8	-87.3	0	0	109	F820	M818-F820 HydrophobicContact CB-CD2 3.96Å; M818-F820 HydrophobicContact CB-CE2 3.4Å; M818-F820 VanDerWaalsContact CB-CE2 3.4Å; M818-F820 HydrophobicContact CB-CZ 3.93Å; M818-F820 HydrophobicContact CG-CE2 4.09Å; M818-F820 HydrophobicContact CG-CZ 4.26Å; M818-F820 HydrophobicContact SD-CE2 3.7Å; M818-F820 HydrophobicContact SD-CZ 3.67Å
819	I	26.8	Very low	27.9	Very low	147 Å²	147	123.3 Å²	123.3	75%	0.754	62%	0.617	S	S	*	*			trans	-99.7	111.6	171.3	-58.6	174.8	0	0	0	106.5
820	F	31.3	Very low	27.9	Very low	98 Å²	98	120.3 Å²	120.3	43%	0.43	61%	0.606	S	S	.	*			trans	-112.2	143	173.7	-67	-68.6	0	0	0	109.8	M818 P822 I825	M818-F820 HydrophobicContact CB-CD2 3.96Å; M818-F820 HydrophobicContact CB-CE2 3.4Å; M818-F820 VanDerWaalsContact CB-CE2 3.4Å; M818-F820 HydrophobicContact CB-CZ 3.93Å; M818-F820 HydrophobicContact CG-CE2 4.09Å; M818-F820 HydrophobicContact CG-CZ 4.26Å; M818-F820 HydrophobicContact SD-CE2 3.7Å; M818-F820 HydrophobicContact SD-CZ 3.67Å; F820-P822 WeakPolarHBondContact O-CD 3.38Å; F820-I825 HydrophobicContact CB-CD1 3.62Å; F820-I825 HydrophobicContact CD1-CD1 3.72Å; F820-I825 HydrophobicContact CG-CD1 3.72Å
821	D	31.4	Very low	28.1	Very low	83 Å²	83	121.3 Å²	121.3	44%	0.444	61%	0.611	S	S	.	*			trans	-79.2	109.2	166.7	-168.3	-0	0	0	0	108.1	D823 Q824	D821-D823 PolarHBondContact O-N 2.82Å; D821-D823 VanDerWaalsContact O-N 3.12Å; D821-Q824 PolarHBondContact O-N 2.94Å
822	P	30.2	Very low	28.2	Very low	84 Å²	84	123 Å²	123	55%	0.545	61%	0.612	S	S	.	*	G	3₁₀ helix	trans	-64.3	-16.8	-172.1	24.7	-32.5	0	0	0	113.4	F820 Q824	F820-P822 WeakPolarHBondContact O-CD 3.38Å; P822-Q824 VanDerWaalsContact C-N 3.3Å; P822-Q824 PolarHBondContact O-N 3.44Å
823	D	32.2	Very low	28.2	Very low	149 Å²	149	120.9 Å²	120.9	80%	0.797	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-81.2	-3.9	-179.4	-67.9	-17.6	0	0	0	113.7	D821	D821-D823 PolarHBondContact O-N 2.82Å; D821-D823 VanDerWaalsContact O-N 3.12Å
824	Q	31.3	Very low	28.2	Very low	149 Å²	149	118.8 Å²	118.8	70%	0.696	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-118.4	4.1	-173.3	-61.5	-157.6	6.2	0	0	116.2	D821 P822	D821-Q824 PolarHBondContact O-N 2.94Å; P822-Q824 VanDerWaalsContact C-N 3.3Å; P822-Q824 PolarHBondContact O-N 3.44Å
825	I	30.8	Very low	28.3	Very low	81 Å²	81	116 Å²	116	42%	0.415	60%	0.602	S	S	.	*			trans	-113.4	113.7	-174	-58.7	177.2	0	0	0	110	F820	F820-I825 HydrophobicContact CB-CD1 3.62Å; F820-I825 HydrophobicContact CD1-CD1 3.72Å; F820-I825 HydrophobicContact CG-CD1 3.72Å
826	S	29.8	Very low	28.3	Very low	98 Å²	98	113.3 Å²	113.3	69%	0.685	60%	0.603	S	S	*	*	S	Bend	trans	-92.5	-36.4	171.4	69.1	0	0	0	0	113.2
827	D	29.2	Very low	28.2	Very low	82 Å²	82	120.1 Å²	120.1	44%	0.439	62%	0.621	S	S	.	*			trans	-153.2	143.1	-178.2	-61.1	-69	0	0	0	111.2	Y829	D827-Y829 HydrophobicContact CB-CE2 3.91Å
828	L	29.8	Very low	28.1	Very low	90 Å²	90	117.9 Å²	117.9	47%	0.471	63%	0.63	S	S	.	*			trans	-120.8	118.6	175.5	-174.4	84.6	0	0	0	109.5
829	Y	28	Very low	28	Very low	166 Å²	166	120.1 Å²	120.1	65%	0.651	64%	0.643	S	S	*	*			trans	-106.1	132.3	175.7	-64.1	-83.6	0	0	0	110.9	D827	D827-Y829 HydrophobicContact CB-CE2 3.91Å
830	L	27	Very low	27.9	Very low	87 Å²	87	118.5 Å²	118.5	46%	0.455	64%	0.642	S	S	.	*			trans	-128.7	115	-179.3	-145.1	141.7	0	0	0	109	I832	L830-I832 HydrophobicContact CD2-CD1 3.86Å; L830-I832 HydrophobicContact CD2-CG1 3.78Å
831	L	27.4	Very low	27.6	Very low	147 Å²	147	117.9 Å²	117.9	77%	0.77	65%	0.65	S	S	*	*			trans	-103.4	123.3	-177.4	-151.9	112.7	0	0	0	109.5
832	I	27	Very low	27.4	Very low	125 Å²	125	121.1 Å²	121.1	64%	0.641	67%	0.666	S	S	*	*			trans	-126.1	113.9	178.1	-54.6	176.5	0	0	0	108.3	L830	L830-I832 HydrophobicContact CD2-CD1 3.86Å; L830-I832 HydrophobicContact CD2-CG1 3.78Å
833	E	25.1	Very low	27.2	Very low	130 Å²	130	121 Å²	121	61%	0.607	66%	0.664	S	S	*	*			trans	-116.2	124.5	171.5	-87.8	-172.4	155	0	0	111.3
834	C	25	Very low	26.9	Very low	120 Å²	120	118 Å²	118	81%	0.811	65%	0.651	S	S	*	*			trans	-94.7	130.4	175.4	-65.5	0	0	0	0	110
835	S	26.6	Very low	26.7	Very low	72 Å²	72	116.1 Å²	116.1	50%	0.503	64%	0.644	S	S	.	*			trans	-142.7	132.7	175.9	70.1	0	0	0	0	112.4	K690 Y837	K690-S835 PolarHBondContact NZ-OG 3.31Å; S835-Y837 PolarHBondContact O-N 3.45Å
836	D	23.9	Very low	26.4	Very low	154 Å²	154	118.6 Å²	118.6	82%	0.824	65%	0.654	S	S	*	*			trans	-71.3	81.5	-166.2	-63.2	-49.5	0	0	0	116.7
837	Y	25.6	Very low	26.2	Very low	225 Å²	225	119 Å²	119	88%	0.882	65%	0.652	S	S	*	*	S	Bend	trans	-151.7	105.7	160.2	-74.2	-75	0	0	0	112.2	S835	S835-Y837 PolarHBondContact O-N 3.45Å
838	G	24.6	Very low	26.2	Very low	88 Å²	88	120.7 Å²	120.7	91%	0.907	66%	0.66	S	S	*	*	S	Bend	trans	86.7	18.5	138.9	0	0	0	0	0	122
839	L	25.7	Very low	26	Very low	147 Å²	147	123.6 Å²	123.6	77%	0.77	67%	0.671	S	S	*	*	S	Bend	trans	-118.5	146.5	163.9	-87.9	146.1	0	0	0	109.5	S841	L839-S841 PolarHBondContact O-N 2.81Å
840	P	24.3	Very low	26	Very low	114 Å²	114	122.4 Å²	122.4	74%	0.74	67%	0.669	S	S	*	*	S	Bend	trans	-59.8	115.6	-172.7	24.4	-31	0	0	0	110.6
841	S	24.4	Very low	25.8	Very low	85 Å²	85	124.2 Å²	124.2	59%	0.594	68%	0.679	S	S	*	*			trans	17.6	100	165.8	60.9	0	0	0	0	117	L839 T843	L839-S841 PolarHBondContact O-N 2.81Å; S841-T843 PolarHBondContact O-N 2.89Å
842	L	27.4	Very low	25.8	Very low	151 Å²	151	124.3 Å²	124.3	79%	0.791	68%	0.679	S	S	*	*			trans	-69.2	30.9	169.5	-101.9	141.1	0	0	0	113.9	T844	L842-T844 PolarHBondContact O-N 3.14Å
843	T	25.8	Very low	25.7	Very low	82 Å²	82	124 Å²	124	50%	0.503	68%	0.678	S	S	.	*			trans	-95	20.1	-170.9	53.6	0	0	0	0	114.3	S841 Y884	S841-T843 PolarHBondContact O-N 2.89Å; T843-Y884 WeakPolarHBondContact O-CE2 3.12Å; T843-Y884 VanDerWaalsContact O-CZ 3.27Å; T843-Y884 PolarHBondContact O-OH 2.9Å
844	T	26.2	Very low	25.7	Very low	85 Å²	85	126.2 Å²	126.2	52%	0.521	69%	0.688	S	S	.	*			trans	-142.5	24.3	-173.5	56.7	0	0	0	0	115.5	L842 E846 Y884	L842-T844 PolarHBondContact O-N 3.14Å; T844-E846 PolarHBondContact O-N 2.84Å; T844-Y884 WeakPolarHBondContact CA-OH 3.28Å
845	M	26.6	Very low	25.8	Very low	109 Å²	109	125.7 Å²	125.7	54%	0.537	68%	0.683	S	S	.	*			trans	-86.3	97.8	169.3	-95.3	-160.5	170.2	0	0	110.7	L814	L814-M845 HydrophobicContact CD1-CE 4.1Å
846	E	26.1	Very low	25.7	Very low	133 Å²	133	130.2 Å²	130.2	62%	0.621	70%	0.701	S	S	*	*			trans	-90	-15.3	-177.7	-73	-178.3	156	0	0	114.7	T844	T844-E846 PolarHBondContact O-N 2.84Å
847	T	25	Very low	25.9	Very low	107 Å²	107	130.2 Å²	130.2	66%	0.656	70%	0.7	S	S	*	*			trans	-160.2	132.1	177.8	39.7	0	0	0	0	113.4
848	I	28.1	Very low	25.8	Very low	118 Å²	118	128.4 Å²	128.4	61%	0.605	70%	0.699	S	S	*	*			trans	-100.2	111.8	162.7	-61.6	173.8	0	0	0	106.9	F850	I848-F850 HydrophobicContact CG2-CD2 4.24Å; I848-F850 HydrophobicContact CG2-CE2 3.74Å; I848-F850 HydrophobicContact CG2-CZ 3.93Å
849	H	26.7	Very low	25.8	Very low	151 Å²	151	129 Å²	129	70%	0.699	69%	0.689	S	S	*	*			trans	-94.7	114.6	176.2	-101.8	-84.4	0	0	0	110.6
850	F	27.2	Very low	25.8	Very low	141 Å²	141	129.7 Å²	129.7	62%	0.618	69%	0.692	S	S	*	*			trans	-90.2	115.6	164.7	-63.7	-83.2	0	0	0	108.8	I848	I848-F850 HydrophobicContact CG2-CD2 4.24Å; I848-F850 HydrophobicContact CG2-CE2 3.74Å; I848-F850 HydrophobicContact CG2-CZ 3.93Å
851	N	24	Very low	25.8	Very low	124 Å²	124	128.9 Å²	128.9	66%	0.663	69%	0.689	S	S	*	*			trans	-109.5	109.9	169.7	-88.8	0.3	0	0	0	109.3	I853	N851-I853 PolarHBondContact O-N 3.07Å
852	I	26.2	Very low	25.9	Very low	149 Å²	149	132.6 Å²	132.6	76%	0.764	70%	0.702	S	S	*	*			trans	-80.1	108.2	167.1	-59.7	171.3	0	0	0	106.5
853	I	25.5	Very low	25.8	Very low	120 Å²	120	133.8 Å²	133.8	62%	0.615	70%	0.704	S	S	*	*			trans	-93.2	103.6	178.1	-57.2	175.8	0	0	0	108.1	N851	N851-I853 PolarHBondContact O-N 3.07Å
854	Q	25.8	Very low	25.8	Very low	176 Å²	176	136.6 Å²	136.6	82%	0.822	72%	0.715	S	S	*	*			trans	-70.8	128.4	166	-91	179.1	-33.2	0	0	109.8
855	P	26.8	Very low	25.8	Very low	108 Å²	108	140.2 Å²	140.2	70%	0.701	73%	0.726	S	S	*	*			trans	-78.8	117.7	165	30.3	-27.2	0	0	0	109.4	I857	P855-I857 PolarHBondContact O-N 2.88Å; P855-I857 VanDerWaalsContact O-N 3.15Å
856	D	25	Very low	25.8	Very low	167 Å²	167	144.2 Å²	144.2	89%	0.893	74%	0.741	S	S	*	*	S	Bend	trans	-1.5	90	167.8	-64.4	-35.2	0	0	0	117.7
857	I	26.5	Very low	25.8	Very low	155 Å²	155	141.3 Å²	141.3	80%	0.795	74%	0.735	S	S	*	*			trans	-135.4	108.9	154.6	-60	179.4	0	0	0	107.7	P855 S859	P855-I857 PolarHBondContact O-N 2.88Å; P855-I857 VanDerWaalsContact O-N 3.15Å; I857-S859 PolarHBondContact O-N 2.85Å
858	H	24.4	Very low	25.9	Very low	187 Å²	187	143.2 Å²	143.2	87%	0.866	74%	0.736	S	S	*	*			trans	-58.1	133.1	167.9	-88.3	-72.7	0	0	0	110
859	S	24.1	Very low	25.8	Very low	100 Å²	100	144.6 Å²	144.6	70%	0.699	74%	0.744	S	S	*	*			trans	93.5	132.2	163.5	78.1	0	0	0	0	118.4	I857	I857-S859 PolarHBondContact O-N 2.85Å
860	I	26	Very low	25.7	Very low	161 Å²	161	145.3 Å²	145.3	83%	0.826	75%	0.747	S	S	*	*			trans	100	93	164.7	-49.1	167.8	0	0	0	114.9
861	S	23.6	Very low	25.7	Very low	97 Å²	97	146.2 Å²	146.2	68%	0.678	76%	0.757	S	S	*	*			trans	-55.3	138.3	163.3	48.7	0	0	0	0	113.7
862	N	26.8	Very low	25.8	Very low	163 Å²	163	147.9 Å²	147.9	87%	0.872	77%	0.765	S	S	*	*			trans	-172.5	139.5	131	-86.8	-16.7	0	0	0	110.8
863	E	26.5	Very low	25.9	Very low	177 Å²	177	144.3 Å²	144.3	83%	0.827	75%	0.748	S	S	*	*			trans	-76.2	136.4	-166.5	-63	168	145.4	0	0	113.8
864	L	25.2	Very low	25.9	Very low	141 Å²	141	143.2 Å²	143.2	74%	0.738	75%	0.748	S	S	*	*			trans	-98.5	111.7	166.5	-100.7	153.1	0	0	0	109.3
865	H	26.7	Very low	26.2	Very low	161 Å²	161	143 Å²	143	75%	0.745	75%	0.747	S	S	*	*			trans	-76.8	121.3	179.3	-102.5	-85.8	0	0	0	111.8	S867	H865-S867 PolarHBondContact O-N 2.92Å; H865-S867 VanDerWaalsContact O-N 3.13Å
866	F	26.6	Very low	26.4	Very low	193 Å²	193	144.8 Å²	144.8	85%	0.846	75%	0.749	S	S	*	*			trans	-79.9	81.9	167.8	-78.9	-89.3	0	0	0	110.6
867	S	25.1	Very low	26.7	Very low	72 Å²	72	143.2 Å²	143.2	50%	0.503	74%	0.739	S	S	.	*			trans	-109.9	131.4	164.6	51.8	0	0	0	0	108.4	H865	H865-S867 PolarHBondContact O-N 2.92Å; H865-S867 VanDerWaalsContact O-N 3.13Å
868	H	27.4	Very low	26.7	Very low	147 Å²	147	142.9 Å²	142.9	68%	0.681	74%	0.739	S	S	*	*			trans	103.2	59.6	176.2	-44	-43.9	0	0	0	116.6
869	L	25.8	Very low	27	Very low	147 Å²	147	140 Å²	140	77%	0.77	73%	0.73	S	S	*	*			trans	-101.6	107.4	157.2	-121.7	150.3	0	0	0	107.9
870	Q	24.6	Very low	27.3	Very low	165 Å²	165	143 Å²	143	77%	0.771	74%	0.738	S	S	*	*			trans	-109.5	121.6	175.1	-96.8	-178	-21.6	0	0	110.1
871	I	28.3	Very low	27.6	Very low	161 Å²	161	143.5 Å²	143.5	83%	0.826	74%	0.737	S	S	*	*			trans	-87.4	112	175.1	-60.7	172.6	0	0	0	108.2	N873	I871-N873 PolarHBondContact O-N 2.72Å
872	L	26	Very low	27.9	Very low	158 Å²	158	143.3 Å²	143.3	83%	0.827	74%	0.735	S	S	*	*			trans	-95.1	75.3	178	-81.9	156.5	0	0	0	110.5
873	N	26.8	Very low	28	Very low	75 Å²	75	143.5 Å²	143.5	40%	0.401	74%	0.735	S	S	.	*			trans	-165.3	108.9	150.2	-147.6	-25.9	0	0	0	113	I871 H875	I871-N873 PolarHBondContact O-N 2.72Å; N873-H875 VanDerWaalsContact C-N 3.31Å; N873-H875 PolarHBondContact O-N 3.13Å
874	P	26.7	Very low	28.1	Very low	97 Å²	97	139.8 Å²	139.8	63%	0.63	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	3.3	-176.8	-12.5	28.3	0	0	0	116.5
875	H	30.8	Very low	28.4	Very low	171 Å²	171	141.2 Å²	141.2	79%	0.792	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	4.6	-169.2	-78.1	-66.7	0	0	0	116.5	N873	N873-H875 VanDerWaalsContact C-N 3.31Å; N873-H875 PolarHBondContact O-N 3.13Å
876	I	32.1	Very low	28.4	Very low	145 Å²	145	139.1 Å²	139.1	74%	0.744	71%	0.709	S	S	*	*			trans	-106.7	30.8	-179.1	-47.7	176	0	0	0	111
877	I	30.1	Very low	28.5	Very low	134 Å²	134	137.5 Å²	137.5	69%	0.687	70%	0.698	S	S	*	*	S	Bend	trans	-99	-1.9	-170.3	-66.9	177.1	0	0	0	113.4
878	N	27.9	Very low	28.8	Very low	148 Å²	148	141.4 Å²	141.4	79%	0.791	71%	0.706	S	S	*	*			trans	-132	16.3	-169.8	-87.9	-13.6	0	0	0	117.4
879	D	29.1	Very low	28.9	Very low	126 Å²	126	141.4 Å²	141.4	67%	0.674	71%	0.707	S	S	*	*			trans	-97.9	105.9	-178.9	-140.2	-21.6	0	0	0	113.4	H881	D879-H881 PolarHBondContact O-N 3.39Å
880	N	30.8	Very low	29.2	Very low	164 Å²	164	141.9 Å²	141.9	88%	0.877	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	14.2	-176.1	-76.4	-33.8	0	0	0	114.6
881	H	31.9	Very low	29.4	Very low	171 Å²	171	139.4 Å²	139.4	79%	0.792	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	2.3	-177.5	-82	-69.7	0	0	0	114.9	D879	D879-H881 PolarHBondContact O-N 3.39Å
882	C	30	Very low	29.5	Very low	94 Å²	94	140.3 Å²	140.3	64%	0.635	70%	0.695	S	S	*	*			trans	-101.9	86.2	-177.5	-137.2	0	0	0	0	112.6	Y884	C882-Y884 PolarHBondContact O-N 2.92Å
883	L	29.2	Very low	29.5	Very low	167 Å²	167	140.6 Å²	140.6	87%	0.874	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	4.8	177.6	-87	160.4	0	0	0	115.1
884	Y	29.7	Very low	29.5	Very low	99 Å²	99	144.4 Å²	144.4	39%	0.388	72%	0.717	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.9	-11.6	-174.6	-109.4	-94	0	0	0	114.9	T843 T844 C882	T843-Y884 WeakPolarHBondContact O-CE2 3.12Å; T843-Y884 VanDerWaalsContact O-CZ 3.27Å; T843-Y884 PolarHBondContact O-OH 2.9Å; T844-Y884 WeakPolarHBondContact CA-OH 3.28Å; C882-Y884 PolarHBondContact O-N 2.92Å
885	F	30.1	Very low	29.3	Very low	170 Å²	170	151 Å²	151	75%	0.746	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-17.4	-174.5	-136	-94.3	0	0	0	114.4
886	N	28	Very low	29.1	Very low	118 Å²	118	147.3 Å²	147.3	63%	0.631	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-16.3	178.5	-86.6	-26.1	0	0	0	114.4
887	Y	29.3	Very low	28.7	Very low	158 Å²	158	147.6 Å²	147.6	62%	0.62	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-29.7	-177.5	-149	-96.1	0	0	0	112.5	Q889	Y887-Q889 VanDerWaalsContact C-N 3.33Å
888	F	29.8	Very low	28.4	Very low	155 Å²	155	150.6 Å²	150.6	68%	0.68	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-19	176.5	-123.8	-92.2	0	0	0	113.2
889	Q	30.5	Very low	28.2	Very low	147 Å²	147	150.4 Å²	150.4	69%	0.687	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-12	-179.4	-132.2	178.6	4	0	0	113.8	Y887	Y887-Q889 VanDerWaalsContact C-N 3.33Å
890	Q	30.9	Very low	28	Very low	157 Å²	157	151 Å²	151	73%	0.734	73%	0.733	S	S	*	*	S	Bend	trans	-100.3	-12.9	-174.5	-74.3	-176.5	-10.8	0	0	114.9
891	N	30	Very low	27.6	Very low	113 Å²	113	148 Å²	148	60%	0.604	73%	0.726	S	S	*	*	S	Bend	trans	-115.1	0.3	-169	-76.9	-32.3	0	0	0	116.8
892	F	29.3	Very low	27.2	Very low	179 Å²	179	145.1 Å²	145.1	79%	0.785	73%	0.725	S	S	*	*	S	Bend	trans	-133.4	119.6	171.2	-86.2	-85.8	0	0	0	112.5	I894	F892-I894 PolarHBondContact O-N 2.87Å
893	N	26.3	Very low	27.1	Very low	164 Å²	164	145.7 Å²	145.7	88%	0.877	73%	0.73	S	S	*	*			trans	-59.8	93.4	177.6	-92.2	-34	0	0	0	111.7
894	I	27.1	Very low	26.9	Very low	156 Å²	156	142.5 Å²	142.5	80%	0.8	72%	0.721	S	S	*	*			trans	-117.9	74.1	162.4	-53.8	-179.8	0	0	0	107.6	F892	F892-I894 PolarHBondContact O-N 2.87Å
895	R	23.2	Very low	26.6	Very low	234 Å²	234	142.8 Å²	142.8	88%	0.883	74%	0.738	S	S	*	*			trans	-105.8	86.9	170.3	-117	-174	-178.3	177.4	1.6	107.9
896	S	26.5	Very low	26.4	Very low	94 Å²	94	139.7 Å²	139.7	66%	0.657	74%	0.737	S	S	*	*			trans	148	139.1	156.2	52.7	0	0	0	0	108.9
897	L	24	Very low	26.2	Very low	151 Å²	151	140.6 Å²	140.6	79%	0.791	74%	0.741	S	S	*	*			cis	-166.3	123.7	-17.5	-114.7	147.8	0	0	0	102.2
898	F	22.1	Very low	25.9	Very low	198 Å²	198	140.2 Å²	140.2	87%	0.868	75%	0.749	S	S	*	*			trans	-44.8	140.5	153.8	-76.5	-102.6	0	0	0	109.1
899	I	25.7	Very low	25.8	Very low	143 Å²	143	139 Å²	139	73%	0.733	75%	0.749	S	S	*	*			trans	164.4	111.9	135.4	-80.7	152	0	0	0	109.8
900	N	23.9	Very low	25.6	Very low	138 Å²	138	137.1 Å²	137.1	74%	0.738	75%	0.748	S	S	*	*			trans	45.9	116	137	-62.8	-13.8	0	0	0	121.8
901	S	22.9	Very low	25.5	Very low	103 Å²	103	140.3 Å²	140.3	72%	0.72	76%	0.76	S	S	*	*				37.6	137.2	124.3	64.2	0	0	0	0	121
902	S	23.6	Very low	25.3	Very low	110 Å²	110	138 Å²	138	77%	0.769	76%	0.763	S	S	*	*			trans	100.2	146.5	146.2	77.2	0	0	0	0	118.6
903	S	27.1	Very low	25.1	Very low	106 Å²	106	138 Å²	138	74%	0.741	76%	0.764	S	S	*	*			trans	85.5	98.2	168	73.3	0	0	0	0	116.5
904	S	25	Very low	25.3	Very low	99 Å²	99	136.7 Å²	136.7	69%	0.692	76%	0.758	S	S	*	*				76.4	100.6	84	70.6	0	0	0	0	112.6
905	S	23.5	Very low	25.3	Very low	106 Å²	106	136.1 Å²	136.1	74%	0.741	76%	0.756	S	S	*	*				71.7	143.7	94.8	72.6	0	0	0	0	115.8
906	S	25.8	Very low	25.5	Very low	105 Å²	105	132.8 Å²	132.8	73%	0.734	76%	0.756	S	S	*	*			trans	90.4	139.3	166.1	91.5	0	0	0	0	113.3
907	I	24.8	Very low	25.5	Very low	136 Å²	136	135.6 Å²	135.6	70%	0.697	76%	0.763	S	S	*	*			cis	-167.4	129.8	14.6	-99.1	146	0	0	0	104
908	L	22.9	Very low	25.5	Very low	151 Å²	151	133.7 Å²	133.7	79%	0.791	76%	0.762	S	S	*	*				55.1	144.4	95.5	-107.9	141.6	0	0	0	116.3
909	D	27.2	Very low	25.7	Very low	128 Å²	128	131.9 Å²	131.9	68%	0.684	76%	0.761	S	S	*	*			trans	105.4	90.7	168.8	-59.1	-10.7	0	0	0	115.7
910	T	25.1	Very low	25.6	Very low	109 Å²	109	136.8 Å²	136.8	67%	0.669	77%	0.77	S	S	*	*				71.3	109.1	84.3	56.5	0	0	0	0	115.1
911	F	29.3	Very low	25.7	Very low	224 Å²	224	138.3 Å²	138.3	98%	0.982	77%	0.77	S	S	*	*			trans	-170.1	119	140.3	-81.4	-71.3	0	0	0	104.7
912	G	25.7	Very low	25.8	Very low	64 Å²	64	144.1 Å²	144.1	66%	0.66	78%	0.776	S	S	*	*			cis	120.4	107.5	18.8	0	0	0	0	0	108.9
913	H	26.2	Very low	25.8	Very low	178 Å²	178	146.3 Å²	146.3	82%	0.824	78%	0.778	S	S	*	*			trans	64.2	141.4	153	-78.6	-69.8	0	0	0	117.9
914	D	30	Very low	25.7	Very low	137 Å²	137	151.7 Å²	151.7	73%	0.733	78%	0.783	S	S	*	*			cis	-158.6	163.2	28	-93.1	-37.6	0	0	0	111.9
915	D	26.4	Very low	25.6	Very low	144 Å²	144	152.5 Å²	152.5	77%	0.77	79%	0.786	S	S	*	*			trans	-51.4	145.7	168.6	-59.2	-57.4	0	0	0	114.4
916	D	28.3	Very low	25.8	Very low	164 Å²	164	154.2 Å²	154.2	88%	0.877	79%	0.792	S	S	*	*				-168.9	140.1	119	-124.7	-23.4	0	0	0	115.5
917	L	25.5	Very low	25.6	Very low	154 Å²	154	161.1 Å²	161.1	81%	0.806	80%	0.802	S	S	*	*			trans	-76.3	153.7	176.6	-110.2	82	0	0	0	111.7
918	S	24.5	Very low	25.6	Very low	111 Å²	111	159.5 Å²	159.5	78%	0.776	80%	0.803	S	S	*	*			trans	84.4	101.4	153	80.2	0	0	0	0	119.2
919	L	27.1	Very low	25.7	Very low	160 Å²	160	157.7 Å²	157.7	84%	0.838	80%	0.803	S	S	*	*			trans	-153.1	90.7	147.6	-107.5	149.6	0	0	0	110.4	K921	L919-K921 PolarHBondContact O-N 2.83Å
920	R	22.9	Very low	25.6	Very low	246 Å²	246	157.8 Å²	157.8	93%	0.928	81%	0.808	S	S	*	*			trans	-64.2	120.4	165.5	-71.7	179.7	-179.8	-166.8	0	109.8
921	K	25.8	Very low	25.5	Very low	170 Å²	170	158.3 Å²	158.3	74%	0.739	81%	0.814	S	S	*	*			trans	173.1	130.2	166.1	-101.4	160.9	-169.8	178.5	0	105.6	L919	L919-K921 PolarHBondContact O-N 2.83Å
922	R	25.6	Very low	25.2	Very low	224 Å²	224	154.6 Å²	154.6	85%	0.845	80%	0.804	S	S	*	*			cis	-156.3	143.3	15.5	-81.4	164.6	-177.8	177.8	-0.2	107.2
923	I	23.2	Very low	25.1	Very low	157 Å²	157	157.4 Å²	157.4	81%	0.805	80%	0.803	S	S	*	*			trans	-87.9	125.4	171.4	-66.4	165.3	0	0	0	108.4
924	Y	24.6	Very low	25	Very low	219 Å²	219	156.8 Å²	156.8	86%	0.859	81%	0.805	S	S	*	*			trans	-148.3	140.1	146.6	-88.6	-75.3	0	0	0	109.3
925	P	24	Very low	24.7	Very low	115 Å²	115	156.8 Å²	156.8	75%	0.747	80%	0.802	S	S	*	*			trans	-95.2	134.9	-164.8	35.6	-29.5	0	0	0	112.3
926	T	26.7	Very low	24.5	Very low	142 Å²	142	153.9 Å²	153.9	87%	0.871	80%	0.798	S	S	*	*			trans	-132.2	120.4	165.6	47.3	0	0	0	0	110
927	R	22.9	Very low	24.3	Very low	251 Å²	251	154 Å²	154	95%	0.947	80%	0.799	S	S	*	*			trans	-79.2	117.3	180	-70.2	171.8	164.6	173.7	-6.1	110.3
928	S	24.2	Very low	24.4	Very low	101 Å²	101	152.3 Å²	152.3	71%	0.706	79%	0.789	S	S	*	*			trans	-176.9	127.8	149.5	54.4	0	0	0	0	111.2
929	S	24.1	Very low	24.4	Very low	114 Å²	114	156.2 Å²	156.2	80%	0.797	80%	0.795	S	S	*	*			trans	46.2	88.6	149.3	56.8	0	0	0	0	118.3
930	V	24.7	Very low	24.4	Very low	130 Å²	130	154.4 Å²	154.4	79%	0.788	79%	0.785	S	S	*	*			trans	-101.5	105.3	155.4	176.5	0	0	0	0	107.8	L932	V930-L932 PolarHBondContact O-N 2.89Å
931	C	23.2	Very low	24.7	Very low	119 Å²	119	151.9 Å²	151.9	80%	0.804	78%	0.777	S	S	*	*			trans	-56.5	120.1	163.3	-119.4	0	0	0	0	109
932	L	24.1	Very low	24.8	Very low	147 Å²	147	150.9 Å²	150.9	77%	0.77	78%	0.775	S	S	*	*			trans	-121	99.4	168.8	-119.2	151.3	0	0	0	108.5	V930 L934	V930-L932 PolarHBondContact O-N 2.89Å; L932-L934 PolarHBondContact O-N 2.85Å
933	I	22.5	Very low	25	Very low	122 Å²	122	144.4 Å²	144.4	63%	0.626	76%	0.762	S	S	*	*			trans	-55.6	119.5	168.8	-64.1	160.2	0	0	0	108.3
934	L	25	Very low	25.3	Very low	165 Å²	165	141.6 Å²	141.6	86%	0.864	75%	0.748	S	S	*	*			trans	-131.3	108.9	162.6	-89	169.3	0	0	0	109.4	L932	L932-L934 PolarHBondContact O-N 2.85Å
935	M	24.1	Very low	25.6	Very low	138 Å²	138	137.9 Å²	137.9	68%	0.68	74%	0.736	S	S	*	*			trans	-58.9	147.9	177.6	-64.9	-163.3	179	0	0	112.8
936	A	22.6	Very low	25.9	Very low	83 Å²	83	137.5 Å²	137.5	69%	0.686	73%	0.728	S	S	*	*	S	Bend	trans	-53.3	145.8	164.8	0	0	0	0	0	112.4
937	N	24	Very low	25.9	Very low	167 Å²	167	136.2 Å²	136.2	89%	0.893	71%	0.714	S	S	*	*			trans	47.7	73.9	156.9	-67.1	-22.9	0	0	0	116.8
938	I	26.6	Very low	26.3	Very low	117 Å²	117	130.2 Å²	130.2	60%	0.6	70%	0.699	S	S	*	*			trans	-115	108.9	160.1	-50	-177.7	0	0	0	110	I940	I938-I940 HydrophobicContact CB-CD1 4.49Å; I938-I940 HydrophobicContact CB-CG1 4.09Å; I938-I940 HydrophobicContact CG2-CD1 3.96Å; I938-I940 HydrophobicContact CG2-CG1 3.3Å; I938-I940 PolarHBondContact O-N 3.49Å
939	Q	24.2	Very low	26.7	Very low	194 Å²	194	131.1 Å²	131.1	91%	0.907	70%	0.695	S	S	*	*			trans	-67	97.9	158	-72.5	176.6	-24.3	0	0	108.2
940	I	27.6	Very low	27.1	Very low	122 Å²	122	132.3 Å²	132.3	63%	0.626	69%	0.692	S	S	*	*			trans	-95.1	124.6	173.7	-58	-177.2	0	0	0	110	I938 L944	I938-I940 HydrophobicContact CB-CD1 4.49Å; I938-I940 HydrophobicContact CB-CG1 4.09Å; I938-I940 HydrophobicContact CG2-CD1 3.96Å; I938-I940 HydrophobicContact CG2-CG1 3.3Å; I938-I940 PolarHBondContact O-N 3.49Å; I940-L944 HydrophobicContact CG2-CB 4.5Å
941	Y	28.4	Very low	27.4	Very low	193 Å²	193	132.5 Å²	132.5	76%	0.757	69%	0.687	S	S	*	*			trans	-49.2	133.3	179.9	-95.1	-108.3	0	0	0	114.7	P943 L944	Y941-P943 VanDerWaalsContact C-N 3.35Å; Y941-P943 VanDerWaalsContact O-CD 3.26Å; Y941-P943 WeakPolarHBondContact O-CD 3.23Å; Y941-P943 VanDerWaalsContact O-N 3.13Å; Y941-L944 PolarHBondContact O-N 2.88Å
942	E	27.7	Very low	27.8	Very low	148 Å²	148	133.7 Å²	133.7	69%	0.692	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46.8	-25.2	178.7	-157.8	170.4	177.7	0	0	118.1
943	P	30.2	Very low	28.1	Very low	89 Å²	89	134.6 Å²	134.6	58%	0.578	69%	0.686	S	S	*	*	H	α-helix	trans	-74.8	-23.4	177.6	-18	33.3	0	0	0	115.3	Y941	Y941-P943 VanDerWaalsContact C-N 3.35Å; Y941-P943 VanDerWaalsContact O-CD 3.26Å; Y941-P943 WeakPolarHBondContact O-CD 3.23Å; Y941-P943 VanDerWaalsContact O-N 3.13Å
944	L	29.6	Very low	28.7	Very low	97 Å²	97	138.3 Å²	138.3	51%	0.508	70%	0.698	S	S	.	*	H	α-helix	trans	-76	-29.8	-174.3	-136.9	119	0	0	0	112.4	I940 Y941 M947	I940-L944 HydrophobicContact CG2-CB 4.5Å; Y941-L944 PolarHBondContact O-N 2.88Å; L944-M947 HydrophobicContact CG-CE 4.12Å; L944-M947 PolarHBondContact O-N 3.14Å
945	F	31	Very low	29.2	Very low	141 Å²	141	139.3 Å²	139.3	62%	0.618	69%	0.69	S	S	*	*	H	α-helix	trans	-70	-31.9	176.9	-164	-99	0	0	0	112.4	M947 I949	F945-M947 VanDerWaalsContact C-N 3.29Å; F945-M947 PolarHBondContact O-N 3.36Å; F945-I949 HydrophobicContact CD1-CD1 4.2Å; F945-I949 HydrophobicContact CE1-CD1 3.83Å; F945-I949 HydrophobicContact CZ-CD1 4.49Å
946	N	30.1	Very low	29.6	Very low	107 Å²	107	139.2 Å²	139.2	57%	0.572	69%	0.686	S	S	*	*	H	α-helix	trans	-73.6	-18.3	174.8	-78.1	-25.8	0	0	0	113.6
947	M	27.8	Very low	30.2	Very low	115 Å²	115	143.6 Å²	143.6	57%	0.567	69%	0.692	S	S	*	*	H	α-helix	trans	-83.3	-29.1	178.6	-164.5	169.1	45.4	0	0	112.4	L944 F945	L944-M947 HydrophobicContact CG-CE 4.12Å; L944-M947 PolarHBondContact O-N 3.14Å; F945-M947 VanDerWaalsContact C-N 3.29Å; F945-M947 PolarHBondContact O-N 3.36Å
948	I	31.3	Very low	30.7	Very low	126 Å²	126	142.6 Å²	142.6	65%	0.646	68%	0.682	S	S	*	*	H	α-helix	trans	-76.5	-27.6	-179.7	-64.5	173	0	0	0	111.9	N950	I948-N950 VanDerWaalsContact C-N 3.33Å; I948-N950 PolarHBondContact O-N 2.89Å
949	I	32.6	Very low	31.1	Very low	120 Å²	120	141.3 Å²	141.3	62%	0.615	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-13.4	-179.5	-67.6	-180	0	0	0	112.8	F945	F945-I949 HydrophobicContact CD1-CD1 4.2Å; F945-I949 HydrophobicContact CE1-CD1 3.83Å; F945-I949 HydrophobicContact CZ-CD1 4.49Å
950	N	31.9	Very low	31.5	Very low	138 Å²	138	137.4 Å²	137.4	74%	0.738	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	12	-171.2	-89.6	-21.3	0	0	0	116.4	I948	I948-N950 VanDerWaalsContact C-N 3.33Å; I948-N950 PolarHBondContact O-N 2.89Å
951	I	31.6	Very low	31.7	Very low	134 Å²	134	138.5 Å²	138.5	69%	0.687	66%	0.659	S	S	*	*	S	Bend	trans	-103.1	103.4	-176	-59.1	177.8	0	0	0	112.5
952	N	30.5	Very low	31.9	Very low	144 Å²	144	134.1 Å²	134.1	77%	0.77	65%	0.648	S	S	*	*			trans	60.4	105.6	156.9	-83.9	-27.4	0	0	0	120.3	K954	N952-K954 PolarHBondContact O-N 3.09Å
953	E	31.8	Very low	32.2	Very low	166 Å²	166	131.1 Å²	131.1	78%	0.776	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	11.7	176.8	-63.9	-170.9	121.9	0	0	117.4
954	K	33.8	Very low	32.2	Very low	201 Å²	201	132.4 Å²	132.4	87%	0.874	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.4	2.2	-170.4	-79.2	-174.9	176.4	178.2	0	117.1	N952	N952-K954 PolarHBondContact O-N 3.09Å
955	R	36.2	Very low	32.2	Very low	185 Å²	185	134.5 Å²	134.5	70%	0.698	64%	0.635	S	S	*	*			trans	-138.4	45.5	179.2	-66.8	-169	-178.8	175.6	1.5	114.3	E957	R955-E957 PolarHBondContact O-N 3.2Å
956	K	32.9	Very low	32.2	Very low	137 Å²	137	132.8 Å²	132.8	60%	0.596	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-12.6	-173.9	-77.9	-179.5	177	171.4	0	116	F960	K956-F960 WeakPolarHBondContact O-CD2 3.26Å
957	E	33.5	Very low	32.3	Very low	175 Å²	175	132.6 Å²	132.6	82%	0.818	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	-36.3	-178.4	-79	-177.9	146.7	0	0	114.6	R955	R955-E957 PolarHBondContact O-N 3.2Å
958	E	35.9	Very low	32.4	Very low	146 Å²	146	134.6 Å²	134.6	68%	0.682	64%	0.637	S	S	*	*	H	α-helix	trans	-76.6	-35	179.9	-73.8	-179.4	152.6	0	0	112.9	F960 Q961	E958-F960 VanDerWaalsContact C-N 3.31Å; E958-F960 PolarHBondContact O-N 2.79Å; E958-Q961 PolarHBondContact O-N 2.74Å
959	N	33.8	Very low	32.3	Very low	90 Å²	90	136.1 Å²	136.1	48%	0.481	64%	0.642	S	S	.	*	H	α-helix	trans	-71.2	-26.2	176.8	-74.5	-10.6	0	0	0	112.4	I962 I963	N959-I962 PolarHBondContact O-N 2.99Å; N959-I963 VanDerWaalsContact O-CG1 3.32Å; N959-I963 WeakPolarHBondContact O-CG1 3.5Å; N959-I963 PolarHBondContact O-N 3.14Å; N959-I963 VanDerWaalsContact O-N 3.12Å
960	F	33.1	Very low	32.2	Very low	111 Å²	111	133.6 Å²	133.6	49%	0.487	63%	0.629	S	S	.	*	H	α-helix	trans	-72.3	-31.2	177.9	-98.3	-97	0	0	0	113.1	K956 E958 Y964	K956-F960 WeakPolarHBondContact O-CD2 3.26Å; E958-F960 VanDerWaalsContact C-N 3.31Å; E958-F960 PolarHBondContact O-N 2.79Å; F960-Y964 WeakPolarHBondContact O-CB 3.06Å; F960-Y964 PolarHBondContact O-N 2.02Å
961	Q	32.2	Very low	31.9	Very low	145 Å²	145	130.9 Å²	130.9	68%	0.678	62%	0.619	S	S	*	*	H	α-helix	trans	-71.6	-32.3	174	-78	-135.5	-10.4	0	0	113	E958 K965	E958-Q961 PolarHBondContact O-N 2.74Å; Q961-K965 PolarHBondContact O-N 2.7Å
962	I	32.8	Very low	31.8	Very low	101 Å²	101	132.5 Å²	132.5	52%	0.518	63%	0.629	S	S	.	*	H	α-helix	trans	-69.7	-42	175.1	-62.8	170.5	0	0	0	109.8	N959 K965 L966	N959-I962 PolarHBondContact O-N 2.99Å; I962-K965 PolarHBondContact O-N 3.35Å; I962-L966 HydrophobicContact CG2-CD1 3.86Å; I962-L966 WeakPolarHBondContact O-CB 3.34Å; I962-L966 WeakPolarHBondContact O-CD1 2.9Å; I962-L966 VanDerWaalsContact O-CG 3.29Å; I962-L966 WeakPolarHBondContact O-CG 2.82Å; I962-L966 PolarHBondContact O-N 3Å
963	I	32.9	Very low	31.8	Very low	86 Å²	86	130 Å²	130	44%	0.441	61%	0.612	S	S	.	*	H	α-helix	trans	-67	-39.2	175.4	-66.3	168	0	0	0	111.5	N959 L966 I967	N959-I963 VanDerWaalsContact O-CG1 3.32Å; N959-I963 WeakPolarHBondContact O-CG1 3.5Å; N959-I963 PolarHBondContact O-N 3.14Å; N959-I963 VanDerWaalsContact O-N 3.12Å; I963-L966 PolarHBondContact O-N 3.5Å; I963-I967 HydrophobicContact CG2-CD1 3.68Å; I963-I967 HydrophobicContact CG2-CG1 4.4Å; I963-I967 VanDerWaalsContact O-CG1 3.25Å; I963-I967 WeakPolarHBondContact O-CG1 3.5Å; I963-I967 PolarHBondContact O-N 3.36Å
964	Y	31	Very low	31.7	Very low	115 Å²	115	128 Å²	128	45%	0.451	61%	0.607	S	S	.	*	H	α-helix	trans	-62.8	-42.6	174.9	-113.5	-86.5	0	0	0	112.5	F960 I967 E968	F960-Y964 WeakPolarHBondContact O-CB 3.06Å; F960-Y964 PolarHBondContact O-N 2.02Å; Y964-I967 PolarHBondContact O-N 3.41Å; Y964-E968 PolarHBondContact O-N 3.09Å
965	K	30.4	Very low	31.5	Very low	141 Å²	141	124.8 Å²	124.8	61%	0.613	59%	0.59	S	S	*	*	H	α-helix	trans	-66.7	-38.2	174.3	-90.1	-177.2	172.3	179.1	0	112.8	Q961 I962 I967 E968 E969	Q961-K965 PolarHBondContact O-N 2.7Å; I962-K965 PolarHBondContact O-N 3.35Å; K965-I967 VanDerWaalsContact C-N 3.28Å; K965-I967 PolarHBondContact O-N 2.88Å; K965-E968 PolarHBondContact O-N 2.91Å; K965-E969 PolarHBondContact O-N 3.32Å
966	L	30.5	Very low	31	Very low	105 Å²	105	124.2 Å²	124.2	55%	0.55	59%	0.593	S	S	.	*	H	α-helix	trans	-66.4	-29.4	175.8	-78.9	163.2	0	0	0	112.5	I962 I963 I970	I962-L966 HydrophobicContact CG2-CD1 3.86Å; I962-L966 WeakPolarHBondContact O-CB 3.34Å; I962-L966 WeakPolarHBondContact O-CD1 2.9Å; I962-L966 VanDerWaalsContact O-CG 3.29Å; I962-L966 WeakPolarHBondContact O-CG 2.82Å; I962-L966 PolarHBondContact O-N 3Å; I963-L966 PolarHBondContact O-N 3.5Å; L966-I970 WeakPolarHBondContact O-CG1 3.42Å
967	I	31.1	Very low	30.7	Very low	104 Å²	104	121.9 Å²	121.9	53%	0.533	59%	0.591	S	S	.	*	H	α-helix	trans	-84	-34.1	178.1	-67.2	168.3	0	0	0	111.8	I963 Y964 K965 E969 I970	I963-I967 HydrophobicContact CG2-CD1 3.68Å; I963-I967 HydrophobicContact CG2-CG1 4.4Å; I963-I967 VanDerWaalsContact O-CG1 3.25Å; I963-I967 WeakPolarHBondContact O-CG1 3.5Å; I963-I967 PolarHBondContact O-N 3.36Å; Y964-I967 PolarHBondContact O-N 3.41Å; K965-I967 VanDerWaalsContact C-N 3.28Å; K965-I967 PolarHBondContact O-N 2.88Å; I967-E969 VanDerWaalsContact C-N 3.27Å; I967-E969 PolarHBondContact O-N 3.23Å; I967-I970 PolarHBondContact O-N 3.05Å
968	E	30.1	Very low	30.4	Very low	156 Å²	156	118.1 Å²	118.1	73%	0.729	58%	0.575	S	S	*	*	H	α-helix	trans	-68.5	-23.6	173.8	-83.7	-172.9	156.7	0	0	113.4	Y964 K965	Y964-E968 PolarHBondContact O-N 3.09Å; K965-E968 PolarHBondContact O-N 2.91Å
969	E	30	Very low	30	Very low	158 Å²	158	118.4 Å²	118.4	74%	0.738	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-1.2	177.5	-72.1	-173.5	176.4	0	0	113.9	K965 I967 P971	K965-E969 PolarHBondContact O-N 3.32Å; I967-E969 VanDerWaalsContact C-N 3.27Å; I967-E969 PolarHBondContact O-N 3.23Å; E969-P971 WeakPolarHBondContact O-CD 3.3Å
970	I	29.7	Very low	29.9	Very low	67 Å²	67	116.3 Å²	116.3	34%	0.344	57%	0.574	S	S	.	*	S	Bend	trans	-80.1	118.4	175.4	-64.2	169	0	0	0	109.1	L966 I967 N972	L966-I970 WeakPolarHBondContact O-CG1 3.42Å; I967-I970 PolarHBondContact O-N 3.05Å; I970-N972 PolarHBondContact O-N 2.84Å
971	P	26.5	Very low	29.8	Very low	82 Å²	82	116.9 Å²	116.9	53%	0.532	59%	0.586	S	S	.	*			trans	-57.9	138.5	170.4	-15.5	28.3	0	0	0	109.1	E969 E973	E969-P971 WeakPolarHBondContact O-CD 3.3Å; P971-E973 PolarHBondContact O-N 2.64Å
972	N	30.3	Very low	29.7	Very low	168 Å²	168	115.2 Å²	115.2	90%	0.898	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	14.4	-179.7	-80.9	-25.1	0	0	0	115.5	I970	I970-N972 PolarHBondContact O-N 2.84Å
973	E	29.9	Very low	29.6	Very low	90 Å²	90	111.5 Å²	111.5	42%	0.421	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.3	-1.8	-168.9	-68.2	176.8	177.1	0	0	113.8	P971	P971-E973 PolarHBondContact O-N 2.64Å
974	N	28.5	Very low	29.4	Very low	125 Å²	125	111.4 Å²	111.4	67%	0.668	57%	0.573	S	S	*	*			trans	-107.8	108.8	177.5	-73.5	-18.9	0	0	0	113.3
975	Y	30.2	Very low	29.4	Very low	133 Å²	133	110.8 Å²	110.8	52%	0.522	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-80.8	119.9	-180	-67.7	-89.8	0	0	0	112.2	L547 M1002	L547-Y975 HydrophobicContact CD1-CE2 4.04Å; L547-Y975 WeakPolarHBondContact CD1-OH 3.37Å; Y975-M1002 HydrophobicContact CE1-CB 4.49Å; Y975-M1002 HydrophobicContact CE1-CE 3.89Å; Y975-M1002 HydrophobicContact CE1-SD 3.59Å; Y975-M1002 VanDerWaalsContact CE1-SD 3.59Å; Y975-M1002 WeakPolarHBondContact OH-CE 3.3Å
976	F	26	Very low	29.3	Very low	173 Å²	173	107.9 Å²	107.9	76%	0.759	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-70.9	131.4	169	-87.3	-92	0	0	0	112
977	T	26.7	Very low	29.3	Very low	88 Å²	88	106.6 Å²	106.6	54%	0.54	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-102.7	116.5	164.6	31.8	0	0	0	0	110.3	K1007	T977-K1007 HydrophobicContact CG2-CD 4.13Å
978	I	27	Very low	29.2	Very low	96 Å²	96	107.1 Å²	107.1	49%	0.492	57%	0.573	S	S	.	*			trans	-111.8	109.8	172.9	-58.8	174.9	0	0	0	108.2
979	N	27.6	Very low	29.3	Very low	153 Å²	153	108.2 Å²	108.2	82%	0.818	58%	0.576	S	S	*	*			trans	-97.4	76.4	178.4	-79.5	-11	0	0	0	110.7
980	S	32.1	Very low	29.5	Very low	45 Å²	45	108 Å²	108	32%	0.315	58%	0.575	S	S	.	*			trans	-176.4	133.8	149.9	58.4	0	0	0	0	110	T982 G983	S980-T982 PolarHBondContact O-N 2.93Å; S980-T982 VanDerWaalsContact O-N 3.1Å; S980-G983 PolarHBondContact O-N 3.29Å
981	T	29.5	Very low	29.7	Very low	123 Å²	123	112.1 Å²	112.1	76%	0.755	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-10.2	179.9	40.6	0	0	0	0	113.6
982	T	31.7	Very low	29.9	Very low	110 Å²	110	115 Å²	115	68%	0.675	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-26.2	-179.4	44.4	0	0	0	0	114	S980	S980-T982 PolarHBondContact O-N 2.93Å; S980-T982 VanDerWaalsContact O-N 3.1Å
983	G	29.4	Very low	30	Very low	24 Å²	24	115.7 Å²	115.7	25%	0.247	60%	0.596	C	S	.	*	H	α-helix	trans	-72.8	-29.9	-178.7	0	0	0	0	0	114.8	S980 V985 S986 L987	S980-G983 PolarHBondContact O-N 3.29Å; G983-V985 PolarHBondContact O-N 3.43Å; G983-S986 PolarHBondContact O-N 3.15Å; G983-L987 PolarHBondContact O-N 2.79Å
984	I	29.4	Very low	29.9	Very low	83 Å²	83	117.5 Å²	117.5	43%	0.426	62%	0.616	S	S	.	*	H	α-helix	trans	-72.8	-28.9	-173.2	-65.6	174.1	0	0	0	112.3	M988	I984-M988 HydrophobicContact CG2-CE 3.74Å
985	V	30.1	Very low	30.1	Very low	103 Å²	103	116.2 Å²	116.2	62%	0.624	61%	0.613	S	S	*	*	H	α-helix	trans	-76.9	-24.8	179.8	-179.4	0	0	0	0	112.2	G983	G983-V985 PolarHBondContact O-N 3.43Å
986	S	29.7	Very low	30	Very low	80 Å²	80	118.3 Å²	118.3	56%	0.559	63%	0.633	S	S	*	*	H	α-helix	trans	-84.6	-36.5	177.2	-173.4	0	0	0	0	112.8	G983	G983-S986 PolarHBondContact O-N 3.15Å
987	L	29	Very low	30.2	Very low	77 Å²	77	116 Å²	116	40%	0.403	63%	0.627	S	S	.	*	H	α-helix	trans	-68.8	-35.8	-179.5	-96.5	145.8	0	0	0	112.8	G983 K989 F991	G983-L987 PolarHBondContact O-N 2.79Å; L987-K989 VanDerWaalsContact C-N 3.26Å; L987-K989 PolarHBondContact O-N 2.98Å; L987-F991 HydrophobicContact CB-CE2 4.44Å; L987-F991 HydrophobicContact CD2-CE2 3.72Å; L987-F991 HydrophobicContact CD2-CZ 3.86Å; L987-F991 WeakPolarHBondContact O-CD2 3.31Å; L987-F991 WeakPolarHBondContact O-CE2 3.45Å
988	M	29.6	Very low	30.3	Very low	115 Å²	115	115.9 Å²	115.9	57%	0.567	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-8.5	-177	-71.1	-154.5	-88.7	0	0	115.1	I984	I984-M988 HydrophobicContact CG2-CE 3.74Å
989	K	32.1	Very low	30.6	Very low	180 Å²	180	119.7 Å²	119.7	78%	0.783	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-7	177.7	-84.8	-177	174.8	178.7	0	115.2	L987	L987-K989 VanDerWaalsContact C-N 3.26Å; L987-K989 PolarHBondContact O-N 2.98Å
990	Q	35.5	Very low	30.7	Very low	154 Å²	154	118.3 Å²	118.3	72%	0.72	63%	0.628	S	S	*	*	S	Bend	trans	-117.9	0.8	-169.5	-75.4	-178	-11	0	0	116.3	N992	Q990-N992 PolarHBondContact O-N 3.29Å
991	F	33.6	Very low	30.8	Very low	153 Å²	153	120.5 Å²	120.5	67%	0.671	64%	0.636	S	S	*	*			trans	-92.5	91.8	-179.2	-69.7	-77	0	0	0	113	L987	L987-F991 HydrophobicContact CB-CE2 4.44Å; L987-F991 HydrophobicContact CD2-CE2 3.72Å; L987-F991 HydrophobicContact CD2-CZ 3.86Å; L987-F991 WeakPolarHBondContact O-CD2 3.31Å; L987-F991 WeakPolarHBondContact O-CE2 3.45Å
992	N	29.3	Very low	30.8	Very low	143 Å²	143	118.4 Å²	118.4	77%	0.765	62%	0.618	S	S	*	*			trans	-109.2	96.2	173.6	-84.8	-19.5	0	0	0	111.4	Q990	Q990-N992 PolarHBondContact O-N 3.29Å
993	K	32.5	Very low	31	Very low	182 Å²	182	115.7 Å²	115.7	79%	0.791	60%	0.599	S	S	*	*			trans	170.3	136.7	146.9	-97.7	169.2	-176.7	-179.3	0	110.8
994	P	29.2	Very low	31	Very low	128 Å²	128	117.2 Å²	117.2	83%	0.831	60%	0.599	S	S	*	*			trans	-91	130.9	-172	34.3	-30.5	0	0	0	112.9
995	T	33	Very low	31.1	Very low	98 Å²	98	114.3 Å²	114.3	60%	0.601	59%	0.588	S	S	*	*			trans	-121.8	140.2	156.5	48.1	0	0	0	0	108.5	I997	T995-I997 VanDerWaalsContact C-N 3.28Å; T995-I997 PolarHBondContact O-N 3.49Å
996	N	28	Very low	31.2	Very low	177 Å²	177	111.1 Å²	111.1	95%	0.947	57%	0.57	S	S	*	*			trans	-64.2	65.4	-171.4	-91.8	-15.7	0	0	0	114.5
997	I	30.2	Very low	31.3	Very low	124 Å²	124	111.3 Å²	111.3	64%	0.636	56%	0.561	S	S	*	*			trans	-121.1	115.8	-179	-58.6	173.9	0	0	0	109.7	T995 K999	T995-I997 VanDerWaalsContact C-N 3.28Å; T995-I997 PolarHBondContact O-N 3.49Å; I997-K999 PolarHBondContact O-N 2.83Å; I997-K999 VanDerWaalsContact O-N 3.08Å
998	T	27.7	Very low	31.7	Very low	85 Å²	85	109.7 Å²	109.7	52%	0.521	55%	0.552	S	S	.	*			trans	-44	111.5	162.7	16.1	0	0	0	0	110.2	Q1000	T998-Q1000 PolarHBondContact O-N 3.41Å
999	K	32.6	Very low	31.8	Very low	176 Å²	176	105.4 Å²	105.4	77%	0.765	54%	0.537	S	S	*	.			trans	-73	105.4	178.9	-72.9	-179.9	176.6	177.9	0	110.4	I997	I997-K999 PolarHBondContact O-N 2.83Å; I997-K999 VanDerWaalsContact O-N 3.08Å
1000	Q	30.1	Very low	31.8	Very low	125 Å²	125	100.2 Å²	100.2	58%	0.584	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	125	165.9	-72.3	-178.1	-7.9	0	0	109.7	T998	T998-Q1000 PolarHBondContact O-N 3.41Å
1001	L	33.6	Very low	31.6	Very low	91 Å²	91	97.6 Å²	97.6	48%	0.476	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	109.8	173.1	-110	153.5	0	0	0	108.1	I1059	L1001-I1059 PolarHBondContact N-O 3.46Å
1002	M	29.8	Very low	31.6	Very low	78 Å²	78	96.4 Å²	96.4	38%	0.384	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	113.9	178.9	-145.5	-171.3	-74.9	0	0	109.6	L547 Y975 Y1061	L547-M1002 HydrophobicContact CD1-CE 4.38Å; L547-M1002 HydrophobicContact CD1-SD 4.18Å; Y975-M1002 HydrophobicContact CE1-CB 4.49Å; Y975-M1002 HydrophobicContact CE1-CE 3.89Å; Y975-M1002 HydrophobicContact CE1-SD 3.59Å; Y975-M1002 VanDerWaalsContact CE1-SD 3.59Å; Y975-M1002 WeakPolarHBondContact OH-CE 3.3Å; M1002-Y1061 HydrophobicContact CG-CD2 4.32Å; M1002-Y1061 HydrophobicContact CG-CG 4.34Å
1003	I	36.9	Very low	31.7	Very low	54 Å²	54	93 Å²	93	28%	0.277	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	112.4	177.2	-56.9	176.8	0	0	0	108.3	A1005 I1008 I1026	I1003-A1005 PolarHBondContact O-N 3.02Å; I1003-I1008 HydrophobicContact CG2-CD1 3.52Å; I1003-I1008 HydrophobicContact CG2-CG1 4.14Å; I1003-I1026 HydrophobicContact CD1-CD1 4.37Å
1004	Q	30.2	Very low	31.6	Very low	55 Å²	55	92.8 Å²	92.8	26%	0.257	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	115.7	175.2	-83.4	-177.9	-37.7	0	0	110.2	S1006 K1007 I1008	Q1004-S1006 PolarHBondContact O-N 3.09Å; Q1004-K1007 HydrophobicContact CB-CB 4.47Å; Q1004-K1007 HydrophobicContact CB-CD 4.28Å; Q1004-K1007 HydrophobicContact CB-CG 4.31Å; Q1004-K1007 PolarHBondContact O-N 2.99Å; Q1004-I1008 PolarHBondContact O-N 2.78Å
1005	A	30.8	Very low	31.9	Very low	22 Å²	22	87.3 Å²	87.3	18%	0.182	45%	0.446	C	S	.	.	H	α-helix	trans	-67.4	-18.4	177.1	0	0	0	0	0	112.3	I1003 K1007 I1008 G1009 R1063	I1003-A1005 PolarHBondContact O-N 3.02Å; A1005-K1007 VanDerWaalsContact C-N 3.28Å; A1005-K1007 PolarHBondContact O-N 3.41Å; A1005-I1008 PolarHBondContact O-N 2.94Å; A1005-G1009 PolarHBondContact O-N 2.79Å; A1005-R1063 WeakPolarHBondContact CA-O 3.32Å; A1005-R1063 WeakPolarHBondContact CB-O 3.39Å; A1005-R1063 PolarHBondContact N-O 3.09Å
1006	S	31.1	Very low	31.8	Very low	36 Å²	36	89.6 Å²	89.6	25%	0.252	45%	0.447	S	S	.	.	H	α-helix	trans	-60.3	-36.6	168.5	58.1	0	0	0	0	112.9	Q1004 G1009 T1010 N1065	Q1004-S1006 PolarHBondContact O-N 3.09Å; S1006-G1009 PolarHBondContact O-N 2.91Å; S1006-T1010 PolarHBondContact O-N 3.22Å; S1006-T1010 PolarHBondContact O-OG1 3.18Å; S1006-N1065 WeakPolarHBondContact CB-ND2 3.08Å
1007	K	32.2	Very low	32.1	Very low	84 Å²	84	88.2 Å²	88.2	37%	0.365	44%	0.44	S	S	.	.	H	α-helix	trans	-76.9	-28.5	175.8	-70.2	175.9	175.6	153.4	0	112.2	T977 Q1004 A1005 T1010 L1011	T977-K1007 HydrophobicContact CG2-CD 4.13Å; Q1004-K1007 HydrophobicContact CB-CB 4.47Å; Q1004-K1007 HydrophobicContact CB-CD 4.28Å; Q1004-K1007 HydrophobicContact CB-CG 4.31Å; Q1004-K1007 PolarHBondContact O-N 2.99Å; A1005-K1007 VanDerWaalsContact C-N 3.28Å; A1005-K1007 PolarHBondContact O-N 3.41Å; K1007-T1010 VanDerWaalsContact CA-OG1 3.31Å; K1007-T1010 WeakPolarHBondContact CA-OG1 3.13Å; K1007-T1010 PolarHBondContact O-OG1 3.25Å; K1007-L1011 PolarHBondContact O-N 3.28Å
1008	I	37.9	Very low	32.1	Very low	43 Å²	43	87.5 Å²	87.5	22%	0.221	44%	0.437	C	S	.	.	H	α-helix	trans	-69.7	-39.9	170	-63.7	171.4	0	0	0	110.7	I1003 Q1004 A1005 T1010 L1011 Y1012 I1024	I1003-I1008 HydrophobicContact CG2-CD1 3.52Å; I1003-I1008 HydrophobicContact CG2-CG1 4.14Å; Q1004-I1008 PolarHBondContact O-N 2.78Å; A1005-I1008 PolarHBondContact O-N 2.94Å; I1008-T1010 PolarHBondContact O-N 3.38Å; I1008-L1011 WeakPolarHBondContact O-CB 3.42Å; I1008-L1011 PolarHBondContact O-N 3.24Å; I1008-Y1012 PolarHBondContact O-N 3.48Å; I1008-I1024 HydrophobicContact CD1-CD1 4.31Å; I1008-I1024 HydrophobicContact CG1-CD1 4.33Å; I1008-I1024 HydrophobicContact CG2-CD1 4.02Å
1009	G	32.3	Very low	32	Very low	25 Å²	25	91.2 Å²	91.2	26%	0.258	45%	0.453	S	S	.	.	H	α-helix	trans	-61.9	-41.3	175.6	0	0	0	0	0	112.7	A1005 S1006 L1011 Y1012 D1013	A1005-G1009 PolarHBondContact O-N 2.79Å; S1006-G1009 PolarHBondContact O-N 2.91Å; G1009-L1011 PolarHBondContact O-N 2.05Å; G1009-Y1012 WeakPolarHBondContact O-CB 3.46Å; G1009-Y1012 PolarHBondContact O-N 2.86Å; G1009-D1013 PolarHBondContact O-N 3.17Å
1010	T	31.7	Very low	31.7	Very low	71 Å²	71	91.3 Å²	91.3	44%	0.436	45%	0.45	S	S	.	.	H	α-helix	trans	-66.3	-34.3	173.7	45.9	0	0	0	0	113.3	S1006 K1007 I1008 Y1014	S1006-T1010 PolarHBondContact O-N 3.22Å; S1006-T1010 PolarHBondContact O-OG1 3.18Å; K1007-T1010 VanDerWaalsContact CA-OG1 3.31Å; K1007-T1010 WeakPolarHBondContact CA-OG1 3.13Å; K1007-T1010 PolarHBondContact O-OG1 3.25Å; I1008-T1010 PolarHBondContact O-N 3.38Å; T1010-Y1014 PolarHBondContact O-N 2.69Å
1011	L	31.8	Very low	31.4	Very low	99 Å²	99	94.9 Å²	94.9	52%	0.518	46%	0.464	S	S	.	.	H	α-helix	trans	-67.5	-37.3	171.7	-84.3	158.2	0	0	0	111.4	K1007 I1008 G1009 Y1014 S1015 I1022	K1007-L1011 PolarHBondContact O-N 3.28Å; I1008-L1011 WeakPolarHBondContact O-CB 3.42Å; I1008-L1011 PolarHBondContact O-N 3.24Å; G1009-L1011 PolarHBondContact O-N 2.05Å; L1011-Y1014 PolarHBondContact O-N 2.82Å; L1011-S1015 PolarHBondContact O-N 3.17Å; L1011-I1022 HydrophobicContact CB-CD1 4.32Å; L1011-I1022 WeakPolarHBondContact O-CD1 3.15Å
1012	Y	32.8	Very low	31.1	Very low	129 Å²	129	94 Å²	94	51%	0.506	46%	0.459	S	S	.	.	H	α-helix	trans	-66.4	-44.6	176.6	-163.8	-98.8	0	0	0	112.2	I1008 G1009 Y1014 S1015 K1016	I1008-Y1012 PolarHBondContact O-N 3.48Å; G1009-Y1012 WeakPolarHBondContact O-CB 3.46Å; G1009-Y1012 PolarHBondContact O-N 2.86Å; Y1012-Y1014 VanDerWaalsContact C-N 3.27Å; Y1012-Y1014 PolarHBondContact O-N 3.34Å; Y1012-S1015 WeakPolarHBondContact CA-OG 3.42Å; Y1012-S1015 PolarHBondContact O-N 3.14Å; Y1012-S1015 VanDerWaalsContact O-N 3.09Å; Y1012-S1015 PolarHBondContact O-OG 3.29Å; Y1012-K1016 HydrophobicContact CE1-CD 4.28Å; Y1012-K1016 PolarHBondContact O-N 3.29Å
1013	D	32	Very low	30.9	Very low	72 Å²	72	97.4 Å²	97.4	39%	0.385	47%	0.473	S	S	.	.	H	α-helix	trans	-60.9	-34.9	174.5	-80.6	-20.6	0	0	0	112.2	G1009	G1009-D1013 PolarHBondContact O-N 3.17Å
1014	Y	30.6	Very low	30.5	Very low	177 Å²	177	99 Å²	99	69%	0.694	48%	0.482	S	S	*	.	H	α-helix	trans	-69.6	-38.8	171.4	-99.3	-85.7	0	0	0	113	T1010 L1011 Y1012 N1017	T1010-Y1014 PolarHBondContact O-N 2.69Å; L1011-Y1014 PolarHBondContact O-N 2.82Å; Y1012-Y1014 VanDerWaalsContact C-N 3.27Å; Y1012-Y1014 PolarHBondContact O-N 3.34Å; Y1014-N1017 PolarHBondContact O-N 3.07Å
1015	S	34.7	Very low	30.3	Very low	13 Å²	13	101.6 Å²	101.6	9%	0.091	50%	0.497	C	S	.	.	H	α-helix	trans	-73.5	-27.8	179.1	68.3	0	0	0	0	114.5	L1011 Y1012 N1017 L1018 N1019 Y1020 I1022	L1011-S1015 PolarHBondContact O-N 3.17Å; Y1012-S1015 WeakPolarHBondContact CA-OG 3.42Å; Y1012-S1015 PolarHBondContact O-N 3.14Å; Y1012-S1015 VanDerWaalsContact O-N 3.09Å; Y1012-S1015 PolarHBondContact O-OG 3.29Å; S1015-N1017 VanDerWaalsContact C-N 3.26Å; S1015-N1017 PolarHBondContact O-N 2.81Å; S1015-L1018 CarbonylContact O-C 3.54Å; S1015-L1018 WeakPolarHBondContact O-CA 3.2Å; S1015-L1018 PolarHBondContact O-N 3.25Å; S1015-N1019 PolarHBondContact O-N 3.27Å; S1015-Y1020 PolarHBondContact O-N 3.35Å; S1015-I1022 VanDerWaalsContact CB-CD1 3.48Å; S1015-I1022 VanDerWaalsContact OG-CD1 3.24Å; S1015-I1022 WeakPolarHBondContact OG-CD1 3.38Å; S1015-I1022 WeakPolarHBondContact OG-CG1 3.41Å
1016	K	32	Very low	30.3	Very low	146 Å²	146	105.5 Å²	105.5	64%	0.635	51%	0.514	S	S	*	.	H	α-helix	trans	-68.4	-28.6	176.7	-133.3	-179.3	-176.3	-178.1	0	111.9	Y1012 L1018	Y1012-K1016 HydrophobicContact CE1-CD 4.28Å; Y1012-K1016 PolarHBondContact O-N 3.29Å; K1016-L1018 VanDerWaalsContact C-N 3.26Å; K1016-L1018 PolarHBondContact O-N 3.17Å
1017	N	33.4	Very low	30	Very low	148 Å²	148	107.8 Å²	107.8	79%	0.791	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-6.7	169.9	-78.1	-19.5	0	0	0	113.4	Y1014 S1015	Y1014-N1017 PolarHBondContact O-N 3.07Å; S1015-N1017 VanDerWaalsContact C-N 3.26Å; S1015-N1017 PolarHBondContact O-N 2.81Å
1018	L	30.4	Very low	29.8	Very low	109 Å²	109	107.9 Å²	107.9	57%	0.571	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.8	7.5	-175.4	-71.7	164.4	0	0	0	114.7	S1015 K1016 Y1020	S1015-L1018 CarbonylContact O-C 3.54Å; S1015-L1018 WeakPolarHBondContact O-CA 3.2Å; S1015-L1018 PolarHBondContact O-N 3.25Å; K1016-L1018 VanDerWaalsContact C-N 3.26Å; K1016-L1018 PolarHBondContact O-N 3.17Å; L1018-Y1020 HydrophobicContact CB-CD2 3.78Å; L1018-Y1020 HydrophobicContact CB-CE2 4.26Å; L1018-Y1020 WeakPolarHBondContact O-CD2 3.46Å; L1018-Y1020 WeakPolarHBondContact O-CE2 3.09Å; L1018-Y1020 PolarHBondContact O-N 3.1Å; L1018-Y1020 VanDerWaalsContact O-N 3.14Å
1019	N	25.4	Very low	29.2	Very low	163 Å²	163	110.8 Å²	110.8	87%	0.872	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	21.7	179.7	-89	-11.1	0	0	0	115.8	S1015	S1015-N1019 PolarHBondContact O-N 3.27Å
1020	Y	26.2	Very low	29	Very low	177 Å²	177	112.6 Å²	112.6	69%	0.694	55%	0.549	S	S	*	.			trans	-93.9	130.3	178.4	-75.6	-82.5	0	0	0	112.4	S1015 L1018 I1022	S1015-Y1020 PolarHBondContact O-N 3.35Å; L1018-Y1020 HydrophobicContact CB-CD2 3.78Å; L1018-Y1020 HydrophobicContact CB-CE2 4.26Å; L1018-Y1020 WeakPolarHBondContact O-CD2 3.46Å; L1018-Y1020 WeakPolarHBondContact O-CE2 3.09Å; L1018-Y1020 PolarHBondContact O-N 3.1Å; L1018-Y1020 VanDerWaalsContact O-N 3.14Å; Y1020-I1022 PolarHBondContact O-N 3.06Å
1021	K	23.3	Very low	28.7	Very low	201 Å²	201	116.1 Å²	116.1	87%	0.874	56%	0.564	S	S	*	*			trans	-69.7	106.9	165.3	-140.5	-177.7	-173.4	-171.5	0	107.4	Q1023	K1021-Q1023 PolarHBondContact O-N 2.94Å
1022	I	26.8	Very low	28.4	Very low	73 Å²	73	115.4 Å²	115.4	37%	0.374	56%	0.561	S	S	.	*			trans	-74.1	107.6	173.9	-59.6	-178.9	0	0	0	108.3	L1011 S1015 Y1020 I1024	L1011-I1022 HydrophobicContact CB-CD1 4.32Å; L1011-I1022 WeakPolarHBondContact O-CD1 3.15Å; S1015-I1022 VanDerWaalsContact CB-CD1 3.48Å; S1015-I1022 VanDerWaalsContact OG-CD1 3.24Å; S1015-I1022 WeakPolarHBondContact OG-CD1 3.38Å; S1015-I1022 WeakPolarHBondContact OG-CG1 3.41Å; Y1020-I1022 PolarHBondContact O-N 3.06Å; I1022-I1024 HydrophobicContact CG2-CG1 3.76Å
1023	Q	26.3	Very low	28.1	Very low	148 Å²	148	118.1 Å²	118.1	69%	0.692	58%	0.576	S	S	*	*			trans	-88.8	116.8	157.9	-89.3	176.3	-34.7	0	0	108.5	K1021 L1025	K1021-Q1023 PolarHBondContact O-N 2.94Å; Q1023-L1025 PolarHBondContact O-N 3.18Å
1024	I	29.4	Very low	27.8	Very low	89 Å²	89	124.4 Å²	124.4	46%	0.456	60%	0.6	S	S	.	*			trans	-89.3	98.8	168.6	-58.1	-179	0	0	0	107.4	I1008 I1022 I1026	I1008-I1024 HydrophobicContact CD1-CD1 4.31Å; I1008-I1024 HydrophobicContact CG1-CD1 4.33Å; I1008-I1024 HydrophobicContact CG2-CD1 4.02Å; I1022-I1024 HydrophobicContact CG2-CG1 3.76Å; I1024-I1026 HydrophobicContact CG2-CG1 4.21Å; I1024-I1026 PolarHBondContact O-N 3.07Å
1025	L	26	Very low	27.6	Very low	108 Å²	108	124.2 Å²	124.2	57%	0.565	61%	0.605	S	S	*	*			trans	-89.1	102.5	-179.9	-134.3	137.7	0	0	0	109.3	Q1023 N1027	Q1023-L1025 PolarHBondContact O-N 3.18Å; L1025-N1027 PolarHBondContact O-N 3.08Å
1026	I	29.6	Very low	27.2	Very low	105 Å²	105	129.5 Å²	129.5	54%	0.538	64%	0.641	S	S	.	*			trans	-89.7	88.6	172.8	-55.7	178.6	0	0	0	108.3	I1003 I1024 M1028	I1003-I1026 HydrophobicContact CD1-CD1 4.37Å; I1024-I1026 HydrophobicContact CG2-CG1 4.21Å; I1024-I1026 PolarHBondContact O-N 3.07Å; I1026-M1028 HydrophobicContact CG2-CG 3.99Å; I1026-M1028 PolarHBondContact O-N 2.87Å
1027	N	26	Very low	26.8	Very low	84 Å²	84	130.4 Å²	130.4	45%	0.449	65%	0.646	S	S	.	*			trans	-78.1	104.5	172.1	-100.2	-9.6	0	0	0	110.3	L1025	L1025-N1027 PolarHBondContact O-N 3.08Å
1028	M	26.9	Very low	26.4	Very low	85 Å²	85	131.5 Å²	131.5	42%	0.419	65%	0.648	S	S	.	*			trans	-99.1	87.7	171.5	-74.5	-103.3	-77.5	0	0	109.8	I1026 V1058	I1026-M1028 HydrophobicContact CG2-CG 3.99Å; I1026-M1028 PolarHBondContact O-N 2.87Å; M1028-V1058 HydrophobicContact CE-CG1 4.09Å; M1028-V1058 HydrophobicContact CE-CG2 4.05Å
1029	T	25.9	Very low	26.1	Very low	104 Å²	104	133.7 Å²	133.7	64%	0.638	66%	0.656	S	S	*	*			trans	-82.6	113.2	172.1	42.7	0	0	0	0	110.8
1030	I	28.4	Very low	26.1	Very low	64 Å²	64	132.1 Å²	132.1	33%	0.328	65%	0.652	S	S	.	*			trans	-93.9	106.2	171.6	-60.7	173.7	0	0	0	107.8	I1087 S1089 V1094	I1030-I1087 HydrophobicContact CD1-CG2 4.49Å; I1030-S1089 WeakPolarHBondContact O-CB 3.49Å; I1030-V1094 HydrophobicContact CD1-CG2 3.34Å
1031	L	25.7	Very low	26.1	Very low	144 Å²	144	128.9 Å²	128.9	75%	0.754	66%	0.655	S	S	*	*			trans	-89.5	118.3	179.1	-87.1	155.1	0	0	0	111.2
1032	N	25.6	Very low	26.3	Very low	85 Å²	85	124.9 Å²	124.9	46%	0.455	65%	0.653	S	S	.	*			trans	-66.6	132.5	169.7	-85.8	-15.3	0	0	0	111.9	G1090	N1032-G1090 WeakPolarHBondContact ND2-CA 3.29Å; N1032-G1090 PolarHBondContact ND2-N 2.9Å; N1032-G1090 PolarHBondContact ND2-O 3.27Å; N1032-G1090 PolarHBondContact OD1-O 2.78Å
1033	F	26.3	Very low	26.2	Very low	185 Å²	185	133 Å²	133	81%	0.811	68%	0.679	S	S	*	*			trans	-133.5	115.2	162	-91.9	-84.3	0	0	0	112.1
1034	K	25.6	Very low	26.3	Very low	205 Å²	205	131.3 Å²	131.3	89%	0.891	68%	0.683	S	S	*	*			trans	-72.5	146.2	171.6	-84.6	176.5	172.4	174.5	0	111.4
1035	H	25.6	Very low	26.1	Very low	173 Å²	173	132.5 Å²	132.5	80%	0.801	70%	0.699	S	S	*	*			trans	-14.6	132.6	165.4	-90.4	-85.8	0	0	0	118.7
1036	S	26.5	Very low	26.1	Very low	123 Å²	123	133 Å²	133	86%	0.86	71%	0.712	S	S	*	*			trans	-138.2	113.8	146.3	59.2	0	0	0	0	110.7
1037	F	22.8	Very low	25.9	Very low	166 Å²	166	133.6 Å²	133.6	73%	0.728	73%	0.725	S	S	*	*			trans	-61.8	154.5	175	-105.7	-111.1	0	0	0	114.2
1038	M	25.4	Very low	25.9	Very low	171 Å²	171	138.8 Å²	138.8	84%	0.842	75%	0.747	S	S	*	*				-174.7	100.8	124	-98.7	-174.9	173.3	0	0	108.6
1039	E	23.9	Very low	25.9	Very low	155 Å²	155	146.8 Å²	146.8	72%	0.724	77%	0.772	S	S	*	*				69.9	113.1	106.6	-71.5	-175.7	169.2	0	0	113
1040	T	26.3	Very low	25.8	Very low	129 Å²	129	148 Å²	148	79%	0.791	78%	0.78	S	S	*	*				-146.8	126.8	79	48.8	0	0	0	0	115
1041	S	25.7	Very low	25.8	Very low	110 Å²	110	150.8 Å²	150.8	77%	0.769	80%	0.802	S	S	*	*			trans	18.3	136	143.5	57.9	0	0	0	0	120.3
1042	S	27.9	Very low	25.9	Very low	117 Å²	117	154.4 Å²	154.4	82%	0.818	81%	0.807	S	S	*	*			cis	-162.9	131.7	42.7	40.4	0	0	0	0	115.1
1043	R	25.5	Very low	26.2	Very low	244 Å²	244	157.4 Å²	157.4	92%	0.921	82%	0.823	S	S	*	*			trans	1.6	128.8	154.3	-69.9	171.7	172	167	-2.9	122.8
1044	S	27	Very low	26.6	Very low	111 Å²	111	154.1 Å²	154.1	78%	0.776	81%	0.814	S	S	*	*				158.8	98.1	109.3	48.9	0	0	0	0	110.1
1045	S	24.7	Very low	27.2	Very low	115 Å²	115	148.4 Å²	148.4	80%	0.804	79%	0.793	S	S	*	*				75.2	96.6	89.7	68.6	0	0	0	0	116.7
1046	S	27.7	Very low	27.7	Very low	118 Å²	118	146.3 Å²	146.3	83%	0.825	79%	0.788	S	S	*	*				174.4	105.2	125.6	56.2	0	0	0	0	112.8
1047	S	24.4	Very low	28.3	Very low	117 Å²	117	145.9 Å²	145.9	82%	0.818	77%	0.768	S	S	*	*			trans	18	116	150.2	58	0	0	0	0	122.6
1048	E	26.7	Very low	29	Very low	194 Å²	194	139.3 Å²	139.3	91%	0.907	74%	0.741	S	S	*	*			trans	-151.7	128.9	134.5	-106.3	176	-165.5	0	0	108.8
1049	R	27	Very low	29.6	Very low	253 Å²	253	132.4 Å²	132.4	96%	0.955	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-77.1	121.1	-176.2	-70.6	179.1	-174.3	179.4	1.5	110
1050	T	23.9	Very low	30.4	Very low	130 Å²	130	126.8 Å²	126.8	80%	0.798	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-77.9	134.4	171.8	46.3	0	0	0	0	111.4
1051	P	27.7	Very low	30.8	Very low	122 Å²	122	123.2 Å²	123.2	79%	0.792	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-79.6	142.8	171.7	28.7	-25.4	0	0	0	111.3
1052	Y	27.2	Very low	31.2	Very low	219 Å²	219	118.8 Å²	118.8	86%	0.859	62%	0.622	S	S	*	*			trans	-45.3	138.3	-176.2	-76.4	-99.2	0	0	0	116	N1054	Y1052-N1054 PolarHBondContact O-N 3Å
1053	N	32.8	Very low	31.7	Very low	148 Å²	148	115.7 Å²	115.7	79%	0.791	59%	0.592	S	S	*	*			trans	-62.6	124	168.6	-101.6	-8.4	0	0	0	111	D1055	N1053-D1055 PolarHBondContact O-N 3.22Å
1054	N	33.6	Very low	32.1	Very low	117 Å²	117	107.9 Å²	107.9	63%	0.626	57%	0.567	S	S	*	*			trans	-88.7	15.3	-176.3	-96.8	-40.1	0	0	0	114.6	Y1052	Y1052-N1054 PolarHBondContact O-N 3Å
1055	D	38.2	Very low	32.3	Very low	85 Å²	85	105.3 Å²	105.3	46%	0.455	55%	0.545	S	S	.	.			trans	-100.9	3.4	-164	-80	-36.1	0	0	0	117.1	N1053 R1057	N1053-D1055 PolarHBondContact O-N 3.22Å; D1055-R1057 VanDerWaalsContact C-N 3.33Å; D1055-R1057 PolarHBondContact O-N 3.27Å; D1055-R1057 IonicContact OD1-CZ 2.61Å; D1055-R1057 IonicContact OD1-NE 3.65Å; D1055-R1057 IonicContact OD1-NH2 3.14Å; D1055-R1057 PolarHBondContact OD1-NH2 3.35Å
1056	D	36	Very low	32.7	Very low	128 Å²	128	103.6 Å²	103.6	68%	0.684	53%	0.532	S	S	*	.			trans	-77.4	83.2	169.7	-69.9	-22.8	0	0	0	110.6
1057	R	40.3	Very low	32.8	Very low	115 Å²	115	101.5 Å²	101.5	43%	0.434	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	129.3	173.2	-58.6	177.6	-130.7	179.1	5.4	109.7	D1055 N1096	D1055-R1057 VanDerWaalsContact C-N 3.33Å; D1055-R1057 PolarHBondContact O-N 3.27Å; D1055-R1057 IonicContact OD1-CZ 2.61Å; D1055-R1057 IonicContact OD1-NE 3.65Å; D1055-R1057 IonicContact OD1-NH2 3.14Å; D1055-R1057 PolarHBondContact OD1-NH2 3.35Å; R1057-N1096 HydrophobicContact CG-CB 4.42Å
1058	V	38.1	Very low	33	Very low	28 Å²	28	101.4 Å²	101.4	17%	0.17	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115.9	167.8	179.9	0	0	0	0	107.8	M1028 I1060 V1094 N1096 I1097 I1098	M1028-V1058 HydrophobicContact CE-CG1 4.09Å; M1028-V1058 HydrophobicContact CE-CG2 4.05Å; V1058-I1060 HydrophobicContact CG1-CG1 4.46Å; V1058-V1094 HydrophobicContact CG2-CG1 4.46Å; V1058-N1096 PolarHBondContact N-O 3.45Å; V1058-I1097 HydrophobicContact CB-CG1 4.48Å; V1058-I1097 WeakPolarHBondContact O-CA 3.21Å; V1058-I1098 PolarHBondContact O-N 3.49Å
1059	I	37.5	Very low	33	Very low	25 Å²	25	96.7 Å²	96.7	13%	0.128	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	124.3	179.2	-54.7	176	0	0	0	108.9	L1001 Y1061 I1098 Y1100	L1001-I1059 PolarHBondContact N-O 3.46Å; I1059-Y1061 HydrophobicContact CB-CE2 4.35Å; I1059-Y1061 HydrophobicContact CG2-CD2 3.91Å; I1059-Y1061 HydrophobicContact CG2-CE2 3.4Å; I1059-I1098 WeakPolarHBondContact CA-O 3.48Å; I1059-Y1100 HydrophobicContact CG2-CD2 3.61Å; I1059-Y1100 HydrophobicContact CG2-CE2 3.59Å
1060	I	39.5	Very low	33	Very low	38 Å²	38	92 Å²	92	20%	0.195	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	117.3	176.9	-56.6	175.6	0	0	0	108.1	V1058 L1062 I1097 I1098 V1099 Y1100	V1058-I1060 HydrophobicContact CG1-CG1 4.46Å; I1060-L1062 HydrophobicContact CG2-CD2 4.5Å; I1060-L1062 HydrophobicContact CG2-CG 4.45Å; I1060-I1097 HydrophobicContact CD1-CG2 3.94Å; I1060-I1098 PolarHBondContact N-O 3.38Å; I1060-V1099 HydrophobicContact CB-CG2 4.33Å; I1060-V1099 HydrophobicContact CD1-CG2 4.44Å; I1060-V1099 CarbonylContact O-C 3.46Å; I1060-V1099 VanDerWaalsContact O-CA 3.3Å; I1060-V1099 WeakPolarHBondContact O-CA 3.45Å; I1060-Y1100 PolarHBondContact O-N 2.87Å
1061	Y	35.3	Very low	33.1	Very low	53 Å²	53	89.8 Å²	89.8	21%	0.208	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	121.5	171.6	-71	-89.9	0	0	0	110	M1002 I1059 Y1100 I1102	M1002-Y1061 HydrophobicContact CG-CD2 4.32Å; M1002-Y1061 HydrophobicContact CG-CG 4.34Å; I1059-Y1061 HydrophobicContact CB-CE2 4.35Å; I1059-Y1061 HydrophobicContact CG2-CD2 3.91Å; I1059-Y1061 HydrophobicContact CG2-CE2 3.4Å; Y1061-Y1100 HydrophobicContact CD1-CD2 4.14Å; Y1061-Y1100 HydrophobicContact CD1-CG 4.06Å; Y1061-Y1100 HydrophobicContact CE1-CD1 4.5Å; Y1061-Y1100 AromaticContact CE1-CD2 3.76Å; Y1061-Y1100 HydrophobicContact CE1-CD2 3.76Å; Y1061-Y1100 HydrophobicContact CE1-CE2 4.37Å; Y1061-Y1100 AromaticContact CE1-CG 3.84Å; Y1061-Y1100 HydrophobicContact CE1-CG 3.84Å; Y1061-I1102 HydrophobicContact CD1-CD1 4.3Å
1062	L	35.2	Very low	32.9	Very low	18 Å²	18	91.4 Å²	91.4	9%	0.094	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	96.3	169.5	-66.5	176.2	0	0	0	108.7	I1060 F1081 V1099 Y1100	I1060-L1062 HydrophobicContact CG2-CD2 4.5Å; I1060-L1062 HydrophobicContact CG2-CG 4.45Å; L1062-F1081 HydrophobicContact CD1-CE2 4.1Å; L1062-F1081 HydrophobicContact CD1-CZ 4.06Å; L1062-F1081 HydrophobicContact CD2-CE1 4.01Å; L1062-F1081 HydrophobicContact CD2-CZ 3.97Å; L1062-V1099 HydrophobicContact CD1-CG1 3.64Å; L1062-V1099 HydrophobicContact CG-CG1 4.06Å; L1062-Y1100 PolarHBondContact N-O 3.11Å
1063	R	36.5	Very low	32.8	Very low	52 Å²	52	85.4 Å²	85.4	20%	0.196	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	103.3	178.6	-177.4	178.8	175	169.5	4.4	110.9	A1005 N1065	A1005-R1063 WeakPolarHBondContact CA-O 3.32Å; A1005-R1063 WeakPolarHBondContact CB-O 3.39Å; A1005-R1063 PolarHBondContact N-O 3.09Å; R1063-N1065 PolarHBondContact NE-OD1 2.97Å; R1063-N1065 VanDerWaalsContact NE-OD1 3.12Å; R1063-N1065 PolarHBondContact O-N 2.73Å
1064	M	35.3	Very low	32.4	Very low	79 Å²	79	86.4 Å²	86.4	39%	0.389	45%	0.447	S	S	.	.			trans	-81.7	110.2	169.1	-61.8	-119.8	-77.8	0	0	108.7
1065	N	31.3	Very low	32.2	Very low	58 Å²	58	84.7 Å²	84.7	31%	0.31	44%	0.444	S	S	.	.			trans	-75.3	129.7	174	-96.4	3.9	0	0	0	110	S1006 R1063 S1067	S1006-N1065 WeakPolarHBondContact CB-ND2 3.08Å; R1063-N1065 PolarHBondContact NE-OD1 2.97Å; R1063-N1065 VanDerWaalsContact NE-OD1 3.12Å; R1063-N1065 PolarHBondContact O-N 2.73Å; N1065-S1067 PolarHBondContact O-N 2.84Å
1066	S	32	Very low	31.6	Very low	78 Å²	78	88.4 Å²	88.4	55%	0.545	46%	0.464	S	S	.	.	S	Bend	trans	-80.2	7.1	167.6	48.4	0	0	0	0	113.4
1067	S	30.2	Very low	31.2	Very low	75 Å²	75	91.6 Å²	91.6	52%	0.524	47%	0.468	S	S	.	.			trans	-110.7	76.2	-179.1	47.8	0	0	0	0	111.4	N1065	N1065-S1067 PolarHBondContact O-N 2.84Å
1068	N	27.9	Very low	30.6	Very low	114 Å²	114	89.9 Å²	89.9	61%	0.61	47%	0.47	S	S	*	.			trans	-167.7	85.3	149.6	-97.6	-9	0	0	0	107.1	L1070 I1071	N1068-L1070 PolarHBondContact O-N 2.91Å; N1068-I1071 PolarHBondContact O-N 3.18Å
1069	S	27.4	Very low	30.2	Very low	96 Å²	96	94.9 Å²	94.9	67%	0.671	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	20.6	176.3	46.2	0	0	0	0	114.3
1070	L	26.7	Very low	29.8	Very low	154 Å²	154	100.2 Å²	100.2	81%	0.806	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.3	-3.7	179.1	-84	158.7	0	0	0	114.5	N1068 K1072	N1068-L1070 PolarHBondContact O-N 2.91Å; L1070-K1072 PolarHBondContact O-N 2.84Å
1071	I	26	Very low	29.4	Very low	84 Å²	84	102.2 Å²	102.2	43%	0.431	52%	0.519	S	S	.	.			trans	-88.1	87.8	172.3	-53.4	178.2	0	0	0	109.1	N1068 T1073	N1068-I1071 PolarHBondContact O-N 3.18Å; I1071-T1073 VanDerWaalsContact C-N 3.35Å; I1071-T1073 HydrophobicContact CG2-CG2 4.26Å; I1071-T1073 PolarHBondContact O-N 3.47Å
1072	K	23.8	Very low	29.2	Very low	155 Å²	155	104.1 Å²	104.1	67%	0.674	53%	0.533	S	S	*	.			trans	-56.2	97.1	160.1	-85.4	167	157.1	-167.1	0	108.5	L1070 Y1074	L1070-K1072 PolarHBondContact O-N 2.84Å; K1072-Y1074 HydrophobicContact CB-CD2 3.81Å; K1072-Y1074 HydrophobicContact CB-CE2 3.74Å; K1072-Y1074 HydrophobicContact CD-CE2 3.61Å; K1072-Y1074 HydrophobicContact CG-CE2 4.12Å; K1072-Y1074 PolarHBondContact NZ-OH 2.71Å; K1072-Y1074 VanDerWaalsContact NZ-OH 3.08Å; K1072-Y1074 PolarHBondContact O-N 2.97Å
1073	T	25.9	Very low	29	Very low	93 Å²	93	108.8 Å²	108.8	57%	0.571	56%	0.557	S	S	*	*			trans	-73.5	80.1	164	53.2	0	0	0	0	108.1	I1071 S1075	I1071-T1073 VanDerWaalsContact C-N 3.35Å; I1071-T1073 HydrophobicContact CG2-CG2 4.26Å; I1071-T1073 PolarHBondContact O-N 3.47Å; T1073-S1075 PolarHBondContact O-N 3.21Å
1074	Y	24.7	Very low	28.5	Very low	170 Å²	170	110.2 Å²	110.2	67%	0.667	57%	0.571	S	S	*	*			trans	-64	121.3	156.3	-73	-78.2	0	0	0	107.2	K1072	K1072-Y1074 HydrophobicContact CB-CD2 3.81Å; K1072-Y1074 HydrophobicContact CB-CE2 3.74Å; K1072-Y1074 HydrophobicContact CD-CE2 3.61Å; K1072-Y1074 HydrophobicContact CG-CE2 4.12Å; K1072-Y1074 PolarHBondContact NZ-OH 2.71Å; K1072-Y1074 VanDerWaalsContact NZ-OH 3.08Å; K1072-Y1074 PolarHBondContact O-N 2.97Å
1075	S	28.3	Very low	28.2	Very low	81 Å²	81	114.5 Å²	114.5	57%	0.566	59%	0.59	S	S	*	*	S	Bend	trans	75.5	136.8	170.7	68.3	0	0	0	0	119	T1073 Y1077	T1073-S1075 PolarHBondContact O-N 3.21Å; S1075-Y1077 PolarHBondContact O-N 3.2Å; S1075-Y1077 WeakPolarHBondContact OG-CD2 3.47Å; S1075-Y1077 WeakPolarHBondContact OG-CE2 3.4Å
1076	N	25.4	Very low	28	Very low	163 Å²	163	115 Å²	115	87%	0.872	60%	0.597	S	S	*	*			trans	-55.6	92.7	175	-63.6	-26.6	0	0	0	112.4
1077	Y	28.8	Very low	27.8	Very low	195 Å²	195	117 Å²	117	77%	0.765	60%	0.601	S	S	*	*			trans	-137.1	129.9	168.7	-68.1	-71.3	0	0	0	111.6	S1075	S1075-Y1077 PolarHBondContact O-N 3.2Å; S1075-Y1077 WeakPolarHBondContact OG-CD2 3.47Å; S1075-Y1077 WeakPolarHBondContact OG-CE2 3.4Å
1078	T	27.5	Very low	27.7	Very low	79 Å²	79	121.6 Å²	121.6	49%	0.485	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-70.5	143	177.1	34.6	0	0	0	0	110.6	E1118	T1078-E1118 HydrophobicContact CG2-CB 4.38Å; T1078-E1118 VanDerWaalsContact CG2-OE2 3.24Å; T1078-E1118 WeakPolarHBondContact CG2-OE2 3.12Å
1079	Y	30	Very low	27.8	Very low	132 Å²	132	117.3 Å²	117.3	52%	0.518	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-79.7	118.3	170.6	-67.5	-83.1	0	0	0	108.8
1080	E	28.8	Very low	27.9	Very low	138 Å²	138	114.7 Å²	114.7	65%	0.645	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-94.6	129.1	176.7	-116.7	175.2	174.2	0	0	110.4
1081	F	31.2	Very low	27.9	Very low	80 Å²	80	115.7 Å²	115.7	35%	0.351	59%	0.587	S	S	.	*			trans	-116.1	108	172.7	-73.2	-89.1	0	0	0	109.5	L1062	L1062-F1081 HydrophobicContact CD1-CE2 4.1Å; L1062-F1081 HydrophobicContact CD1-CZ 4.06Å; L1062-F1081 HydrophobicContact CD2-CE1 4.01Å; L1062-F1081 HydrophobicContact CD2-CZ 3.97Å
1082	D	29.4	Very low	28.3	Very low	93 Å²	93	114.8 Å²	114.8	50%	0.497	59%	0.588	S	S	.	*			trans	-87.9	115.3	178.1	-75.6	-26.9	0	0	0	111.5	T1084	D1082-T1084 HydrophobicContact CB-CG2 4.44Å
1083	I	31.1	Very low	28.7	Very low	116 Å²	116	112 Å²	112	60%	0.595	59%	0.585	S	S	*	*			trans	-99.8	94.3	164.2	-54.6	174.5	0	0	0	106.9
1084	T	26.9	Very low	29.3	Very low	81 Å²	81	110.3 Å²	110.3	50%	0.497	57%	0.574	S	S	.	*			trans	-119.4	136.1	-179.6	51.1	0	0	0	0	111.8	D1082	D1082-T1084 HydrophobicContact CB-CG2 4.44Å
1085	H	28	Very low	29.9	Very low	170 Å²	170	105.3 Å²	105.3	79%	0.787	56%	0.562	S	S	*	*	S	Bend	trans	71.8	118.6	172.9	-67.7	-44.8	0	0	0	121.2
1086	S	28.5	Very low	30.5	Very low	67 Å²	67	102.3 Å²	102.3	47%	0.469	54%	0.539	S	S	.	.			trans	71.2	75.5	151	64	0	0	0	0	119.7	Q1088	S1086-Q1088 PolarHBondContact O-N 2.86Å; S1086-Q1088 VanDerWaalsContact O-N 3.16Å
1087	I	28.1	Very low	31.1	Very low	121 Å²	121	98.5 Å²	98.5	62%	0.621	52%	0.518	S	S	*	.			trans	-77	80.9	140.2	-54.9	174.6	0	0	0	106.3	I1030	I1030-I1087 HydrophobicContact CD1-CG2 4.49Å
1088	Q	26.7	Very low	31.6	Very low	172 Å²	172	91.2 Å²	91.2	80%	0.804	49%	0.492	S	S	*	.			trans	-97.2	95	166.1	-83.3	-174	-20.2	0	0	108.1	S1086	S1086-Q1088 PolarHBondContact O-N 2.86Å; S1086-Q1088 VanDerWaalsContact O-N 3.16Å
1089	S	31.2	Very low	32.2	Very low	23 Å²	23	87.9 Å²	87.9	16%	0.161	47%	0.472	C	S	.	.			trans	-132.6	119.7	159.1	56	0	0	0	0	108.2	I1030 D1091	I1030-S1089 WeakPolarHBondContact O-CB 3.49Å; S1089-D1091 PolarHBondContact O-N 3.47Å
1090	G	28.8	Very low	32.6	Very low	41 Å²	41	84.5 Å²	84.5	42%	0.423	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	134.4	175.8	0	0	0	0	0	110.9	N1032 S1092	N1032-G1090 WeakPolarHBondContact ND2-CA 3.29Å; N1032-G1090 PolarHBondContact ND2-N 2.9Å; N1032-G1090 PolarHBondContact ND2-O 3.27Å; N1032-G1090 PolarHBondContact OD1-O 2.78Å; G1090-S1092 VanDerWaalsContact C-N 3.34Å; G1090-S1092 PolarHBondContact O-N 3.45Å; G1090-S1092 VanDerWaalsContact O-N 3.09Å
1091	D	27.7	Very low	33	Very low	175 Å²	175	78.7 Å²	78.7	94%	0.936	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	14.5	163.1	-53.7	-22.9	0	0	0	119.8	S1089	S1089-D1091 PolarHBondContact O-N 3.47Å
1092	S	33.4	Very low	33.2	Very low	65 Å²	65	78.1 Å²	78.1	46%	0.455	43%	0.433	S	S	.	.			trans	-142.4	120.7	168.1	53.8	0	0	0	0	113.6	G1090	G1090-S1092 VanDerWaalsContact C-N 3.34Å; G1090-S1092 PolarHBondContact O-N 3.45Å; G1090-S1092 VanDerWaalsContact O-N 3.09Å
1093	V	33.2	Very low	33.5	Very low	98 Å²	98	80 Å²	80	59%	0.594	44%	0.436	S	S	*	.			trans	-83.8	122	-178.5	177.1	0	0	0	0	109.6	P1095	V1093-P1095 VanDerWaalsContact O-CD 3.25Å; V1093-P1095 WeakPolarHBondContact O-CD 3.43Å; V1093-P1095 WeakPolarHBondContact O-CG 3.29Å
1094	V	37.7	Very low	33.4	Very low	56 Å²	56	79 Å²	79	34%	0.339	43%	0.426	S	S	.	.			trans	-75.3	113.8	166.9	-180	0	0	0	0	108.7	I1030 V1058	I1030-V1094 HydrophobicContact CD1-CG2 3.34Å; V1058-V1094 HydrophobicContact CG2-CG1 4.46Å
1095	P	37.5	Very low	33.7	Very low	65 Å²	65	77.2 Å²	77.2	42%	0.422	42%	0.415	S	S	.	.			trans	-89.2	-11.6	-163.9	-7.3	25.6	0	0	0	116.4	V1093	V1093-P1095 VanDerWaalsContact O-CD 3.25Å; V1093-P1095 WeakPolarHBondContact O-CD 3.43Å; V1093-P1095 WeakPolarHBondContact O-CG 3.29Å
1096	N	41	Very low	33.8	Very low	18 Å²	18	75.6 Å²	75.6	10%	0.096	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	111.9	-174.1	-52.6	-70.9	0	0	0	114.7	R1057 V1058 K1142	R1057-N1096 HydrophobicContact CG-CB 4.42Å; V1058-N1096 PolarHBondContact N-O 3.45Å; N1096-K1142 PolarHBondContact ND2-NZ 2.94Å; N1096-K1142 WeakPolarHBondContact OD1-CD 3.31Å; N1096-K1142 WeakPolarHBondContact OD1-CE 3.47Å; N1096-K1142 PolarHBondContact OD1-NZ 2.92Å
1097	I	38.7	Very low	33.8	Very low	84 Å²	84	79.6 Å²	79.6	43%	0.431	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	127.8	162.9	-59.1	173.8	0	0	0	108.4	V1058 I1060 V1099	V1058-I1097 HydrophobicContact CB-CG1 4.48Å; V1058-I1097 WeakPolarHBondContact O-CA 3.21Å; I1060-I1097 HydrophobicContact CD1-CG2 3.94Å; I1097-V1099 HydrophobicContact CG2-CG2 4.47Å
1098	I	39.4	Very low	33.7	Very low	41 Å²	41	83.7 Å²	83.7	21%	0.21	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	125.7	178	-56.8	175.9	0	0	0	109.1	V1058 I1059 I1060 Y1100	V1058-I1098 PolarHBondContact O-N 3.49Å; I1059-I1098 WeakPolarHBondContact CA-O 3.48Å; I1060-I1098 PolarHBondContact N-O 3.38Å; I1098-Y1100 HydrophobicContact CB-CE2 4.47Å; I1098-Y1100 HydrophobicContact CG2-CD2 3.97Å; I1098-Y1100 HydrophobicContact CG2-CE2 3.48Å; I1098-Y1100 VanDerWaalsContact CG2-CE2 3.48Å
1099	V	39.2	Very low	33.9	Very low	10 Å²	10	81.9 Å²	81.9	6%	0.061	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	121	177.9	-174.6	0	0	0	0	110.2	I1060 L1062 I1097 I1144	I1060-V1099 HydrophobicContact CB-CG2 4.33Å; I1060-V1099 HydrophobicContact CD1-CG2 4.44Å; I1060-V1099 CarbonylContact O-C 3.46Å; I1060-V1099 VanDerWaalsContact O-CA 3.3Å; I1060-V1099 WeakPolarHBondContact O-CA 3.45Å; L1062-V1099 HydrophobicContact CD1-CG1 3.64Å; L1062-V1099 HydrophobicContact CG-CG1 4.06Å; I1097-V1099 HydrophobicContact CG2-CG2 4.47Å; V1099-I1144 HydrophobicContact CB-CG2 4.38Å
1100	Y	37.6	Very low	33.6	Very low	61 Å²	61	88.8 Å²	88.8	24%	0.239	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	121.4	176	-74.8	-88.3	0	0	0	111.1	I1059 I1060 Y1061 L1062 I1098 L1147	I1059-Y1100 HydrophobicContact CG2-CD2 3.61Å; I1059-Y1100 HydrophobicContact CG2-CE2 3.59Å; I1060-Y1100 PolarHBondContact O-N 2.87Å; Y1061-Y1100 HydrophobicContact CD1-CD2 4.14Å; Y1061-Y1100 HydrophobicContact CD1-CG 4.06Å; Y1061-Y1100 HydrophobicContact CE1-CD1 4.5Å; Y1061-Y1100 AromaticContact CE1-CD2 3.76Å; Y1061-Y1100 HydrophobicContact CE1-CD2 3.76Å; Y1061-Y1100 HydrophobicContact CE1-CE2 4.37Å; Y1061-Y1100 AromaticContact CE1-CG 3.84Å; Y1061-Y1100 HydrophobicContact CE1-CG 3.84Å; L1062-Y1100 PolarHBondContact N-O 3.11Å; I1098-Y1100 HydrophobicContact CB-CE2 4.47Å; I1098-Y1100 HydrophobicContact CG2-CD2 3.97Å; I1098-Y1100 HydrophobicContact CG2-CE2 3.48Å; I1098-Y1100 VanDerWaalsContact CG2-CE2 3.48Å; Y1100-L1147 HydrophobicContact CD1-CB 4.39Å; Y1100-L1147 HydrophobicContact CE1-CB 4.34Å; Y1100-L1147 HydrophobicContact CE1-CD1 3.7Å
1101	C	36.9	Very low	33.5	Very low	15 Å²	15	93.3 Å²	93.3	10%	0.101	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	116.4	167.9	-68.5	0	0	0	0	109.8	F1146	C1101-F1146 HydrophobicContact CB-CD1 4.45Å
1102	I	36.3	Very low	33.6	Very low	68 Å²	68	96.5 Å²	96.5	35%	0.349	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	126.9	-174.4	-55	173.6	0	0	0	109.9	Y1061	Y1061-I1102 HydrophobicContact CD1-CD1 4.3Å
1103	K	34.8	Very low	33.4	Very low	133 Å²	133	99.1 Å²	99.1	58%	0.578	48%	0.483	S	S	*	.			trans	-108	138.8	175.3	-171.9	-179.4	-178.6	-179.5	0	110
1104	Y	30.4	Very low	33.2	Very low	96 Å²	96	100.3 Å²	100.3	38%	0.376	49%	0.486	S	S	.	.			trans	-90.7	137.7	170	-99.1	-89.2	0	0	0	111.5
1105	P	32.9	Very low	33	Very low	42 Å²	42	105.9 Å²	105.9	27%	0.273	51%	0.508	S	S	.	.			trans	-81.3	114.1	165	28.9	-24.5	0	0	0	109.8	N1151	P1105-N1151 HydrophobicContact CG-CB 3.95Å
1106	L	29.3	Very low	32.7	Very low	137 Å²	137	106.9 Å²	106.9	72%	0.717	51%	0.507	S	S	*	.			trans	-74.8	119.5	161.1	-89.7	151.7	0	0	0	108.1
1107	F	28.1	Very low	32.2	Very low	151 Å²	151	109 Å²	109	66%	0.662	52%	0.522	S	S	*	.	S	Bend	trans	-68.2	131.2	158.8	-86.8	-92.3	0	0	0	108.1
1108	Y	27	Very low	31.7	Very low	207 Å²	207	109.6 Å²	109.6	81%	0.812	52%	0.523	S	S	*	.	S	Bend	trans	64	101.5	178.8	-66.4	-87	0	0	0	116.1
1109	I	30.4	Very low	31.3	Very low	133 Å²	133	110 Å²	110	68%	0.682	53%	0.525	S	S	*	.			trans	174.7	110.3	130.4	-82.7	149.8	0	0	0	105.5
1110	E	25.7	Very low	30.8	Very low	168 Å²	168	111.9 Å²	111.9	79%	0.785	54%	0.537	S	S	*	.			trans	-64.6	146.1	167.8	-67.6	179.6	148.2	0	0	109.7
1111	N	26.9	Very low	30.2	Very low	137 Å²	137	113.8 Å²	113.8	73%	0.733	55%	0.55	S	S	*	.			trans	80.9	86.3	176.8	-50.5	-33.3	0	0	0	116
1112	Y	30.1	Very low	29.7	Very low	242 Å²	242	122.2 Å²	122.2	95%	0.949	58%	0.581	S	S	*	*			trans	-170.7	133.6	131.4	-84.8	-63.8	0	0	0	109.8
1113	T	28.4	Very low	29.3	Very low	119 Å²	119	125 Å²	125	73%	0.73	60%	0.597	S	S	*	*			trans	-88.5	142.2	-168.6	46.1	0	0	0	0	114.1
1114	N	28.4	Very low	28.9	Very low	123 Å²	123	127.1 Å²	127.1	66%	0.658	61%	0.608	S	S	*	*			trans	48.2	104.7	154.7	-59.2	-10.3	0	0	0	119.9
1115	H	33.3	Very low	28.7	Very low	174 Å²	174	130 Å²	130	81%	0.806	63%	0.627	S	S	*	*			trans	-107.3	123	155.6	-69	-53	0	0	0	109.9
1116	H	31.6	Very low	28.3	Very low	86 Å²	86	135.4 Å²	135.4	40%	0.398	65%	0.654	S	S	.	*			trans	-94.4	134.5	-178.5	-79.1	-78	0	0	0	111.7
1117	C	30.5	Very low	28.2	Very low	62 Å²	62	134.3 Å²	134.3	42%	0.419	65%	0.653	S	S	.	*			trans	-102.4	126.8	157.4	-80.5	0	0	0	0	107.9
1118	E	29.2	Very low	28.1	Very low	96 Å²	96	136.2 Å²	136.2	45%	0.449	66%	0.661	S	S	.	*			trans	-120.2	136.8	179	-153.7	170.1	-154.7	0	0	108.7	T1078	T1078-E1118 HydrophobicContact CG2-CB 4.38Å; T1078-E1118 VanDerWaalsContact CG2-OE2 3.24Å; T1078-E1118 WeakPolarHBondContact CG2-OE2 3.12Å
1119	L	29.7	Very low	28	Very low	49 Å²	49	134.5 Å²	134.5	26%	0.257	66%	0.662	S	S	.	*			trans	-127	108.5	173.9	-168.4	111.4	0	0	0	108.2	I1144 F1146	L1119-I1144 HydrophobicContact CD2-CD1 3.62Å; L1119-F1146 HydrophobicContact CB-CZ 4.07Å
1120	T	28.8	Very low	27.7	Very low	51 Å²	51	133.7 Å²	133.7	31%	0.313	67%	0.669	S	S	.	*			trans	-99.2	125.1	-179	1.2	0	0	0	0	109.6
1121	M	26.5	Very low	27.8	Very low	101 Å²	101	129 Å²	129	50%	0.498	67%	0.665	S	S	.	*			trans	-108.6	115.6	173.4	-82.6	-150.1	60.5	0	0	110.7
1122	Y	26	Very low	27.8	Very low	191 Å²	191	129.9 Å²	129.9	75%	0.749	67%	0.67	S	S	*	*			trans	-99.9	113.9	168.6	-77.1	-86.1	0	0	0	109.6
1123	N	28.5	Very low	27.8	Very low	128 Å²	128	128.2 Å²	128.2	68%	0.684	67%	0.668	S	S	*	*			trans	-117	116.4	160.2	-92.2	-2	0	0	0	108.2	M1125	N1123-M1125 PolarHBondContact O-N 2.97Å
1124	E	26	Very low	28	Very low	177 Å²	177	131.3 Å²	131.3	83%	0.827	67%	0.674	S	S	*	*			trans	-63.3	100.3	160.6	-67.7	179.5	158.2	0	0	107.8	D1126	E1124-D1126 VanDerWaalsContact C-N 3.27Å; E1124-D1126 PolarHBondContact O-N 3.41Å
1125	M	25.1	Very low	28	Very low	156 Å²	156	131.9 Å²	131.9	77%	0.768	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	7.4	-175.6	-102.9	-154.6	-179.9	0	0	114.8	N1123	N1123-M1125 PolarHBondContact O-N 2.97Å
1126	D	24.7	Very low	27.7	Very low	156 Å²	156	129.5 Å²	129.5	83%	0.834	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-7.3	-171.1	-74.4	-25.4	0	0	0	115.3	E1124	E1124-D1126 VanDerWaalsContact C-N 3.27Å; E1124-D1126 PolarHBondContact O-N 3.41Å
1127	T	27.7	Very low	27.6	Very low	113 Å²	113	132 Å²	132	69%	0.693	68%	0.684	S	S	*	*	S	Bend	trans	-104.2	-2.1	-173.8	47	0	0	0	0	116.2
1128	F	25.8	Very low	27.4	Very low	192 Å²	192	136.5 Å²	136.5	84%	0.842	70%	0.698	S	S	*	*			trans	-103.6	9.3	-177	-89.4	-87.6	0	0	0	115.3	S1130	F1128-S1130 VanDerWaalsContact C-N 3.35Å; F1128-S1130 PolarHBondContact O-N 2.76Å
1129	M	23.9	Very low	27.2	Very low	170 Å²	170	140.3 Å²	140.3	84%	0.837	71%	0.714	S	S	*	*			trans	-86.2	20.2	-172.9	-76.7	-70.8	-126.3	0	0	116.2
1130	S	26.1	Very low	27	Very low	117 Å²	117	144.1 Å²	144.1	82%	0.818	73%	0.734	S	S	*	*	S	Bend	trans	-141.8	81.9	177	63	0	0	0	0	112.5	F1128	F1128-S1130 VanDerWaalsContact C-N 3.35Å; F1128-S1130 PolarHBondContact O-N 2.76Å
1131	G	26.1	Very low	26.9	Very low	69 Å²	69	149.3 Å²	149.3	71%	0.711	76%	0.759	S	S	*	*	S	Bend	trans	167.7	110.6	172.1	0	0	0	0	0	112.4
1132	D	28.4	Very low	27	Very low	155 Å²	155	150.4 Å²	150.4	83%	0.829	76%	0.761	S	S	*	*			trans	49.1	98.3	167	-63.8	-20	0	0	0	120.1	Q1134	D1132-Q1134 PolarHBondContact O-N 3.48Å
1133	K	29	Very low	27	Very low	208 Å²	208	145.6 Å²	145.6	90%	0.904	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	10.7	176.1	-81.6	177.9	172.6	174.7	0	116.5
1134	Q	32.5	Very low	27.2	Very low	183 Å²	183	142.5 Å²	142.5	86%	0.855	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	-5.3	-168.2	-74	-172.8	-10.8	0	0	116.9	D1132	D1132-Q1134 PolarHBondContact O-N 3.48Å
1135	N	29.7	Very low	27.5	Very low	136 Å²	136	140.7 Å²	140.7	73%	0.727	73%	0.725	S	S	*	*			trans	-121.5	19.6	-174.9	-89.4	-16.2	0	0	0	116.1	D1137	N1135-D1137 VanDerWaalsContact C-N 3.3Å; N1135-D1137 PolarHBondContact O-N 3.02Å
1136	M	26.6	Very low	27.8	Very low	123 Å²	123	136.1 Å²	136.1	61%	0.606	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-73.9	-7.8	-173.2	-77.6	-69.1	-156.2	0	0	116.1	H1138	M1136-H1138 VanDerWaalsContact C-N 3.3Å; M1136-H1138 PolarHBondContact O-N 3.27Å
1137	D	28	Very low	28.1	Very low	138 Å²	138	133.3 Å²	133.3	74%	0.738	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-77.4	-9	-174.7	-70.9	-21.9	0	0	0	114.4	N1135	N1135-D1137 VanDerWaalsContact C-N 3.3Å; N1135-D1137 PolarHBondContact O-N 3.02Å
1138	H	27.4	Very low	28.4	Very low	157 Å²	157	129.6 Å²	129.6	73%	0.727	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-103.2	-1	-176.9	-75.7	-60.6	0	0	0	115.6	M1136 L1140	M1136-H1138 VanDerWaalsContact C-N 3.3Å; M1136-H1138 PolarHBondContact O-N 3.27Å; H1138-L1140 PolarHBondContact O-N 2.87Å
1139	F	25.2	Very low	28.8	Very low	176 Å²	176	125.3 Å²	125.3	77%	0.772	65%	0.646	S	S	*	*			trans	-83.5	75.2	176.8	-101.8	-89.7	0	0	0	111.9
1140	L	25.6	Very low	29.4	Very low	129 Å²	129	120 Å²	120	68%	0.675	62%	0.621	S	S	*	*			trans	-113.1	100.5	168.4	-100.6	152.3	0	0	0	108.8	H1138 K1142	H1138-L1140 PolarHBondContact O-N 2.87Å; L1140-K1142 VanDerWaalsContact C-N 3.35Å; L1140-K1142 PolarHBondContact O-N 3.06Å
1141	L	26.7	Very low	29.9	Very low	160 Å²	160	118 Å²	118	84%	0.838	60%	0.602	S	S	*	*			trans	-55.3	100.7	161.4	-84.4	159.7	0	0	0	107.6
1142	K	27.5	Very low	30.4	Very low	125 Å²	125	120.5 Å²	120.5	54%	0.543	60%	0.598	S	S	.	*			trans	-63.6	135.9	167.2	-69.1	-163.3	-160.1	152.7	0	107.3	N1096 L1140 I1144	N1096-K1142 PolarHBondContact ND2-NZ 2.94Å; N1096-K1142 WeakPolarHBondContact OD1-CD 3.31Å; N1096-K1142 WeakPolarHBondContact OD1-CE 3.47Å; N1096-K1142 PolarHBondContact OD1-NZ 2.92Å; L1140-K1142 VanDerWaalsContact C-N 3.35Å; L1140-K1142 PolarHBondContact O-N 3.06Å; K1142-I1144 PolarHBondContact O-N 3.13Å
1143	P	27	Very low	30.6	Very low	90 Å²	90	117.4 Å²	117.4	58%	0.584	58%	0.579	S	S	*	*			trans	-56.7	127.7	-177.9	22.5	-31.7	0	0	0	109.3	K1145	P1143-K1145 PolarHBondContact O-N 3.32Å
1144	I	32.9	Very low	30.6	Very low	62 Å²	62	112.3 Å²	112.3	32%	0.318	57%	0.57	S	S	.	*			trans	-57.3	106.2	167.2	-61.2	172.1	0	0	0	106	V1099 L1119 K1142 F1146	V1099-I1144 HydrophobicContact CB-CG2 4.38Å; L1119-I1144 HydrophobicContact CD2-CD1 3.62Å; K1142-I1144 PolarHBondContact O-N 3.13Å; I1144-F1146 HydrophobicContact CB-CE2 4.32Å; I1144-F1146 HydrophobicContact CG2-CD2 4Å; I1144-F1146 HydrophobicContact CG2-CE2 3.56Å; I1144-F1146 HydrophobicContact CG2-CZ 4.02Å; I1144-F1146 PolarHBondContact O-N 2.8Å
1145	K	30.7	Very low	30.5	Very low	140 Å²	140	109.5 Å²	109.5	61%	0.609	56%	0.56	S	S	*	*			trans	-80.2	102.7	178.9	-81.9	-174.4	175.6	-178.3	0	108.9	P1143 L1147	P1143-K1145 PolarHBondContact O-N 3.32Å; K1145-L1147 PolarHBondContact O-N 3.26Å
1146	F	31.8	Very low	30.6	Very low	59 Å²	59	106 Å²	106	26%	0.259	54%	0.544	S	S	.	.			trans	-79.6	111.8	163.3	-71.3	-87.4	0	0	0	109.1	C1101 L1119 I1144 Y1161	C1101-F1146 HydrophobicContact CB-CD1 4.45Å; L1119-F1146 HydrophobicContact CB-CZ 4.07Å; I1144-F1146 HydrophobicContact CB-CE2 4.32Å; I1144-F1146 HydrophobicContact CG2-CD2 4Å; I1144-F1146 HydrophobicContact CG2-CE2 3.56Å; I1144-F1146 HydrophobicContact CG2-CZ 4.02Å; I1144-F1146 PolarHBondContact O-N 2.8Å; F1146-Y1161 WeakPolarHBondContact CD2-OH 3.3Å; F1146-Y1161 WeakPolarHBondContact CE2-OH 3.4Å
1147	L	32.5	Very low	30.8	Very low	98 Å²	98	105.6 Å²	105.6	51%	0.513	54%	0.544	S	S	.	.			trans	-103.8	108.5	174.1	-80.1	156.5	0	0	0	108.8	Y1100 K1145	Y1100-L1147 HydrophobicContact CD1-CB 4.39Å; Y1100-L1147 HydrophobicContact CE1-CB 4.34Å; Y1100-L1147 HydrophobicContact CE1-CD1 3.7Å; K1145-L1147 PolarHBondContact O-N 3.26Å
1148	C	32.5	Very low	30.8	Very low	35 Å²	35	102.2 Å²	102.2	24%	0.236	53%	0.53	C	S	.	.			trans	-90.3	113.8	169.4	-69	0	0	0	0	109.1	C1158	C1148-C1158 HydrophobicContact CB-CB 4.14Å; C1148-C1158 WeakPolarHBondContact CB-SG 3.31Å; C1148-C1158 WeakPolarHBondContact SG-CB 3.46Å; C1148-C1158 CovalentContact SG-SG 2.03Å; C1148-C1158 PolarHBondContact SG-SG 3.15Å
1149	H	35.4	Very low	30.9	Very low	102 Å²	102	101.7 Å²	101.7	47%	0.472	53%	0.532	S	S	.	.			trans	-85.7	124.7	173.3	-144.8	57.2	0	0	0	108.9	N1151	H1149-N1151 PolarHBondContact CD2-OD1 3.21Å
1150	N	35.6	Very low	31	Very low	57 Å²	57	94.8 Å²	94.8	31%	0.305	51%	0.511	S	S	.	.			trans	-127.4	115.1	170.9	-131.6	13.7	0	0	0	105.9	N1152 Q1153 V1156	N1150-N1152 PolarHBondContact O-N 3.39Å; N1150-Q1153 PolarHBondContact O-N 3.47Å; N1150-V1156 HydrophobicContact CB-CG2 4.41Å
1151	N	37.2	Very low	31.1	Very low	77 Å²	77	96.7 Å²	96.7	41%	0.412	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	13.9	-163.4	-72.8	-2.9	0	0	0	117.1	N549 P1105 H1149	N549-N1151 PolarHBondContact ND2-ND2 3.45Å; P1105-N1151 HydrophobicContact CG-CB 3.95Å; H1149-N1151 PolarHBondContact CD2-OD1 3.21Å
1152	N	36.7	Very low	31	Very low	120 Å²	120	93.8 Å²	93.8	64%	0.642	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.2	17.2	179.2	-90.3	-27.4	0	0	0	114.5	N1150	N1150-N1152 PolarHBondContact O-N 3.39Å
1153	Q	31.7	Very low	30.9	Very low	91 Å²	91	94.1 Å²	94.1	43%	0.425	51%	0.506	S	S	.	.			trans	-171.5	120.7	165.7	-109.9	164	13.9	0	0	110.3	N1150 N1155	N1150-Q1153 PolarHBondContact O-N 3.47Å; Q1153-N1155 PolarHBondContact O-N 2.77Å
1154	S	29.5	Very low	30.9	Very low	101 Å²	101	97.6 Å²	97.6	71%	0.706	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	128.9	164.2	47.6	0	0	0	0	109
1155	N	30.2	Very low	30.5	Very low	123 Å²	123	105.6 Å²	105.6	66%	0.658	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	92	38.5	175.5	-46.7	-29.4	0	0	0	118.8	Q1153 L1157	Q1153-N1155 PolarHBondContact O-N 2.77Å; N1155-L1157 PolarHBondContact O-N 3.21Å; N1155-L1157 VanDerWaalsContact O-N 3.17Å
1156	V	31.4	Very low	30.3	Very low	64 Å²	64	106 Å²	106	39%	0.388	55%	0.549	S	S	.	.			trans	-79.1	95	156.3	-174.4	0	0	0	0	108.7	N1150 C1158	N1150-V1156 HydrophobicContact CB-CG2 4.41Å; V1156-C1158 PolarHBondContact O-N 2.78Å; V1156-C1158 VanDerWaalsContact O-N 3.15Å
1157	L	30.5	Very low	30.2	Very low	114 Å²	114	110.9 Å²	110.9	60%	0.597	57%	0.572	S	S	*	*			trans	-50.6	118	155.2	-96.1	143.8	0	0	0	106.9	N1155 N1159	N1155-L1157 PolarHBondContact O-N 3.21Å; N1155-L1157 VanDerWaalsContact O-N 3.17Å; L1157-N1159 PolarHBondContact O-N 3.09Å
1158	C	29.1	Very low	29.9	Very low	67 Å²	67	111.1 Å²	111.1	45%	0.453	57%	0.573	S	S	.	*			trans	-56.6	106.8	168	-94.6	0	0	0	0	107.9	C1148 V1156 G1160	C1148-C1158 HydrophobicContact CB-CB 4.14Å; C1148-C1158 WeakPolarHBondContact CB-SG 3.31Å; C1148-C1158 WeakPolarHBondContact SG-CB 3.46Å; C1148-C1158 CovalentContact SG-SG 2.03Å; C1148-C1158 PolarHBondContact SG-SG 3.15Å; V1156-C1158 PolarHBondContact O-N 2.78Å; V1156-C1158 VanDerWaalsContact O-N 3.15Å; C1158-G1160 PolarHBondContact O-N 3.05Å
1159	N	30.3	Very low	29.9	Very low	145 Å²	145	115 Å²	115	78%	0.775	59%	0.591	S	S	*	*	S	Bend	trans	-61.3	100.5	173	-79.7	-20.5	0	0	0	108	L1157	L1157-N1159 PolarHBondContact O-N 3.09Å
1160	G	26.8	Very low	29.7	Very low	31 Å²	31	117.8 Å²	117.8	32%	0.32	60%	0.602	S	S	.	*			trans	174.4	39.5	-178.5	0	0	0	0	0	114.5	C1158	C1158-G1160 PolarHBondContact O-N 3.05Å
1161	Y	26.3	Very low	29.6	Very low	170 Å²	170	119.7 Å²	119.7	67%	0.667	61%	0.609	S	S	*	*			trans	-110.5	92	155.2	-82.5	-83.4	0	0	0	108.4	F1146 I1163	F1146-Y1161 WeakPolarHBondContact CD2-OH 3.3Å; F1146-Y1161 WeakPolarHBondContact CE2-OH 3.4Å; Y1161-I1163 VanDerWaalsContact C-N 3.32Å; Y1161-I1163 PolarHBondContact O-N 3.33Å
1162	T	24.4	Very low	29.3	Very low	98 Å²	98	123.4 Å²	123.4	60%	0.601	62%	0.624	S	S	*	*			trans	-74	94.9	146.2	35.4	0	0	0	0	106.6	H1164	T1162-H1164 PolarHBondContact O-N 3.16Å
1163	I	26.7	Very low	29.1	Very low	132 Å²	132	120.2 Å²	120.2	68%	0.677	61%	0.606	S	S	*	*			trans	-68.6	88.4	164.6	-59	175.6	0	0	0	106.1	Y1161 R1165	Y1161-I1163 VanDerWaalsContact C-N 3.32Å; Y1161-I1163 PolarHBondContact O-N 3.33Å; I1163-R1165 PolarHBondContact O-N 3Å
1164	H	26.6	Very low	29.3	Very low	163 Å²	163	123.4 Å²	123.4	76%	0.755	62%	0.618	S	S	*	*			trans	-66.7	128.9	164.7	-103.2	-87.3	0	0	0	108.4	T1162 N1166	T1162-H1164 PolarHBondContact O-N 3.16Å; H1164-N1166 PolarHBondContact O-N 3.34Å
1165	R	25.6	Very low	29.7	Very low	230 Å²	230	125.4 Å²	125.4	87%	0.868	62%	0.621	S	S	*	*	S	Bend	trans	-34.8	112.1	-175.3	-74.2	168.5	167.9	161.3	-3.5	115	I1163	I1163-R1165 PolarHBondContact O-N 3Å
1166	N	25.4	Very low	30.2	Very low	148 Å²	148	123.9 Å²	123.9	79%	0.791	61%	0.606	S	S	*	*			trans	160.9	2.9	134.5	-85.4	-11.8	0	0	0	115.2	H1164 L1168	H1164-N1166 PolarHBondContact O-N 3.34Å; N1166-L1168 PolarHBondContact O-N 3.03Å
1167	H	29.5	Very low	30.6	Very low	163 Å²	163	123 Å²	123	76%	0.755	60%	0.596	S	S	*	*			trans	-70.9	96.6	174.9	-82.2	-76.9	0	0	0	112	L1169	H1167-L1169 PolarHBondContact O-N 2.92Å
1168	L	27.7	Very low	31	Very low	103 Å²	103	119.8 Å²	119.8	54%	0.539	58%	0.579	S	S	.	*			trans	-54	108.2	161.6	-97.6	91.1	0	0	0	108.5	N1166 K1170 I1178	N1166-L1168 PolarHBondContact O-N 3.03Å; L1168-K1170 HydrophobicContact CB-CB 4.5Å; L1168-K1170 HydrophobicContact CD2-CD 4.26Å; L1168-K1170 HydrophobicContact CD2-CG 3.96Å; L1168-K1170 PolarHBondContact O-N 3.23Å; L1168-I1178 HydrophobicContact CG-CG2 4.48Å
1169	L	31.4	Very low	31.3	Very low	115 Å²	115	118 Å²	118	60%	0.602	57%	0.565	S	S	*	*			trans	-67	80.6	149.5	-99	154.5	0	0	0	106.6	H1167 H1171	H1167-L1169 PolarHBondContact O-N 2.92Å; L1169-H1171 PolarHBondContact O-N 3.27Å
1170	K	30.5	Very low	31.8	Very low	162 Å²	162	113.5 Å²	113.5	70%	0.704	54%	0.543	S	S	*	.			trans	-73	65.4	167	-128.2	-179.3	-171.7	-175.4	0	107	L1168 Q1172	L1168-K1170 HydrophobicContact CB-CB 4.5Å; L1168-K1170 HydrophobicContact CD2-CD 4.26Å; L1168-K1170 HydrophobicContact CD2-CG 3.96Å; L1168-K1170 PolarHBondContact O-N 3.23Å; K1170-Q1172 PolarHBondContact O-N 3.27Å
1171	H	34.5	Very low	32.5	Very low	96 Å²	96	115.3 Å²	115.3	44%	0.444	55%	0.545	S	S	.	.			trans	-61	129.8	156.9	-117.2	-73	0	0	0	105.4	L1169 L1173	L1169-H1171 PolarHBondContact O-N 3.27Å; H1171-L1173 HydrophobicContact CB-CG 4.43Å; H1171-L1173 PolarHBondContact O-N 3.06Å
1172	Q	30.5	Very low	33.3	Very low	156 Å²	156	110.9 Å²	110.9	73%	0.729	54%	0.535	S	S	*	.			trans	-61.9	70.7	170.2	-79.6	175.3	-28.9	0	0	109.9	K1170 K1174	K1170-Q1172 PolarHBondContact O-N 3.27Å; Q1172-K1174 PolarHBondContact O-N 3.28Å; Q1172-K1174 VanDerWaalsContact O-N 3.12Å
1173	L	33.1	Very low	34	Very low	52 Å²	52	110 Å²	110	27%	0.272	53%	0.534	S	S	.	.	S	Bend	trans	-81.5	67.5	159.3	-68	166.2	0	0	0	105.8	H1171 D1175 R1176 Y1177 F1226	H1171-L1173 HydrophobicContact CB-CG 4.43Å; H1171-L1173 PolarHBondContact O-N 3.06Å; L1173-D1175 PolarHBondContact O-N 3.02Å; L1173-D1175 VanDerWaalsContact O-N 3.07Å; L1173-R1176 PolarHBondContact O-N 3.1Å; L1173-Y1177 HydrophobicContact CB-CD2 4.44Å; L1173-F1226 HydrophobicContact CD1-CZ 4.17Å; L1173-F1226 HydrophobicContact CD2-CE2 3.92Å; L1173-F1226 HydrophobicContact CD2-CZ 4.17Å
1174	K	35.1	Very low	34.6	Very low	158 Å²	158	107 Å²	107	69%	0.687	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	25.8	69.7	177.9	-76.3	-172.6	171.7	179.8	0	113.2	Q1172 R1176	Q1172-K1174 PolarHBondContact O-N 3.28Å; Q1172-K1174 VanDerWaalsContact O-N 3.12Å; K1174-R1176 WeakPolarHBondContact O-CA 3.39Å; K1174-R1176 WeakPolarHBondContact O-CB 3.36Å; K1174-R1176 WeakPolarHBondContact O-CG 3.43Å; K1174-R1176 PolarHBondContact O-N 3.23Å; K1174-R1176 PolarHBondContact O-NE 3.21Å
1175	D	38.2	Very low	35.2	Very low	143 Å²	143	103.5 Å²	103.5	77%	0.765	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.8	5.8	177.4	-68.5	-35.6	0	0	0	118.9	L1173	L1173-D1175 PolarHBondContact O-N 3.02Å; L1173-D1175 VanDerWaalsContact O-N 3.07Å
1176	R	40.7	Very low	35.7	Very low	91 Å²	91	96.4 Å²	96.4	34%	0.343	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-21.3	-159.2	-82.3	-176.7	-79.6	-179.2	-5.7	114	L1173 K1174 K1210 Y1214	L1173-R1176 PolarHBondContact O-N 3.1Å; K1174-R1176 WeakPolarHBondContact O-CA 3.39Å; K1174-R1176 WeakPolarHBondContact O-CB 3.36Å; K1174-R1176 WeakPolarHBondContact O-CG 3.43Å; K1174-R1176 PolarHBondContact O-N 3.23Å; K1174-R1176 PolarHBondContact O-NE 3.21Å; R1176-K1210 PolarHBondContact O-N 3.29Å; R1176-Y1214 PolarHBondContact NH1-OH 3.34Å
1177	Y	39.3	Very low	36.1	Very low	46 Å²	46	94.5 Å²	94.5	18%	0.18	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	137.3	-175.1	-55.3	-81.6	0	0	0	113.8	L1173 Y1208 I1209 F1226	L1173-Y1177 HydrophobicContact CB-CD2 4.44Å; Y1177-Y1208 CarbonylContact C-O 3.41Å; Y1177-Y1208 WeakPolarHBondContact CA-O 3.35Å; Y1177-I1209 HydrophobicContact CD1-CG1 4.09Å; Y1177-I1209 HydrophobicContact CE1-CD1 4.35Å; Y1177-I1209 HydrophobicContact CE1-CG1 3.85Å; Y1177-F1226 HydrophobicContact CD1-CE1 4.38Å; Y1177-F1226 HydrophobicContact CD1-CZ 4.31Å; Y1177-F1226 HydrophobicContact CD2-CD2 4.34Å; Y1177-F1226 HydrophobicContact CD2-CE1 4.43Å; Y1177-F1226 AromaticContact CD2-CE2 3.6Å; Y1177-F1226 HydrophobicContact CD2-CE2 3.6Å; Y1177-F1226 AromaticContact CD2-CZ 3.67Å; Y1177-F1226 HydrophobicContact CD2-CZ 3.67Å; Y1177-F1226 HydrophobicContact CE2-CD2 4.1Å; Y1177-F1226 AromaticContact CE2-CE2 3.83Å; Y1177-F1226 HydrophobicContact CE2-CE2 3.83Å; Y1177-F1226 HydrophobicContact CE2-CZ 4.17Å; Y1177-F1226 HydrophobicContact CG-CE1 4.26Å; Y1177-F1226 HydrophobicContact CG-CE2 4.18Å; Y1177-F1226 AromaticContact CG-CZ 3.75Å; Y1177-F1226 HydrophobicContact CG-CZ 3.75Å
1178	I	39.3	Very low	36.1	Very low	46 Å²	46	96.1 Å²	96.1	24%	0.236	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	128.5	165.3	-51.9	169	0	0	0	108.2	L1168 L1207 Y1208	L1168-I1178 HydrophobicContact CG-CG2 4.48Å; I1178-L1207 CarbonylContact O-C 3.54Å; I1178-L1207 WeakPolarHBondContact O-CA 3.21Å; I1178-Y1208 HydrophobicContact CB-CD2 3.71Å; I1178-Y1208 HydrophobicContact CB-CG 4.18Å; I1178-Y1208 HydrophobicContact CG2-CD2 3.9Å; I1178-Y1208 HydrophobicContact CG2-CE2 4.48Å; I1178-Y1208 PolarHBondContact N-O 3.26Å; I1178-Y1208 WeakPolarHBondContact O-CD2 3.17Å; I1178-Y1208 PolarHBondContact O-N 3.07Å
1179	L	36.5	Very low	36.2	Very low	30 Å²	30	96.5 Å²	96.5	16%	0.157	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	129.7	-179.1	179.9	69.3	0	0	0	110.6	I1181 I1205 L1207	L1179-I1181 HydrophobicContact CD2-CD1 4.25Å; L1179-I1181 HydrophobicContact CD2-CG1 4.46Å; L1179-I1181 HydrophobicContact CG-CG1 4.3Å; L1179-I1205 HydrophobicContact CD1-CG2 3.56Å; L1179-L1207 HydrophobicContact CD1-CD2 4.07Å
1180	T	39.3	Very low	36.2	Very low	51 Å²	51	96.3 Å²	96.3	31%	0.313	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.1	171.4	-8.4	0	0	0	0	109.8	I1205 I1206 Y1208	T1180-I1205 CarbonylContact O-C 3.49Å; T1180-I1205 VanDerWaalsContact O-CA 3.31Å; T1180-I1205 WeakPolarHBondContact O-CA 3.1Å; T1180-I1206 PolarHBondContact N-O 3.34Å; T1180-I1206 PolarHBondContact O-N 3.29Å; T1180-I1206 PolarHBondContact OG1-O 3.3Å; T1180-Y1208 VanDerWaalsContact OG1-CE2 3.23Å; T1180-Y1208 WeakPolarHBondContact OG1-CE2 3.46Å
1181	I	42.5	Very low	36.2	Very low	69 Å²	69	97.9 Å²	97.9	35%	0.354	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	123.3	177.2	-56.8	175.1	0	0	0	108	L1179 I1203 K1204 F1234	L1179-I1181 HydrophobicContact CD2-CD1 4.25Å; L1179-I1181 HydrophobicContact CD2-CG1 4.46Å; L1179-I1181 HydrophobicContact CG-CG1 4.3Å; I1181-I1203 HydrophobicContact CG2-CG2 4.06Å; I1181-K1204 WeakPolarHBondContact CA-O 3.49Å; I1181-F1234 HydrophobicContact CD1-CE1 4.11Å; I1181-F1234 HydrophobicContact CD1-CZ 4.4Å
1182	T	42.7	Very low	35.8	Very low	76 Å²	76	96.7 Å²	96.7	47%	0.466	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	130.4	171.7	59.6	0	0	0	0	110.3	I1203 K1204	T1182-I1203 WeakPolarHBondContact O-CA 3.26Å; T1182-K1204 PolarHBondContact N-O 2.95Å; T1182-K1204 PolarHBondContact O-N 3.4Å; T1182-K1204 WeakPolarHBondContact OG1-CB 3.5Å
1183	S	38.7	Very low	35.6	Very low	81 Å²	81	96.6 Å²	96.6	57%	0.566	55%	0.547	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	147.3	174.7	57	0	0	0	0	111.7	S1202	S1183-S1202 VanDerWaalsContact CA-O 3.26Å; S1183-S1202 WeakPolarHBondContact CA-O 3.38Å
1184	T	40.2	Very low	35.3	Very low	68 Å²	68	102.3 Å²	102.3	42%	0.417	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.5	135.9	167	57.9	0	0	0	0	109.7	I1200 S1201 S1202	T1184-I1200 CarbonylContact O-C 3.53Å; T1184-S1201 PolarHBondContact O-N 3.01Å; T1184-S1201 PolarHBondContact O-OG 3.04Å; T1184-S1201 PolarHBondContact OG1-OG 2.82Å; T1184-S1202 PolarHBondContact N-O 2.79Å; T1184-S1202 VanDerWaalsContact N-O 3.07Å; T1184-S1202 WeakPolarHBondContact OG1-CB 3.49Å; T1184-S1202 PolarHBondContact OG1-N 2.79Å; T1184-S1202 PolarHBondContact OG1-OG 3.4Å
1185	T	39.6	Very low	35	Very low	90 Å²	90	99.4 Å²	99.4	55%	0.552	58%	0.576	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.1	135	169.2	46.8	0	0	0	0	108.9
1186	T	34.7	Very low	34.7	Very low	81 Å²	81	99.2 Å²	99.2	50%	0.497	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.6	113.8	169.9	44.2	0	0	0	0	108.3
1187	S	34	Very low	34.3	Very low	108 Å²	108	101.1 Å²	101.1	76%	0.755	59%	0.585	S	S	*	*			trans	-90.2	110.8	166	53.3	0	0	0	0	108.7
1188	E	30	Very low	34.2	Very low	197 Å²	197	103.1 Å²	103.1	92%	0.921	61%	0.606	S	S	*	*			trans	-82.8	114.2	164.5	-75.7	176.9	173.3	0	0	107.8
1189	S	30.2	Very low	34.1	Very low	111 Å²	111	106.6 Å²	106.6	78%	0.776	62%	0.619	S	S	*	*			trans	-120.3	112.9	175	59.4	0	0	0	0	109.9
1190	S	31.4	Very low	34.4	Very low	110 Å²	110	106.3 Å²	106.3	77%	0.769	62%	0.618	S	S	*	*			trans	-150.4	107.2	156.6	57.5	0	0	0	0	108.7
1191	H	29.9	Very low	34.5	Very low	195 Å²	195	104.5 Å²	104.5	90%	0.903	61%	0.607	S	S	*	*	S	Bend	trans	62.2	111.2	172.7	-63	-61.6	0	0	0	119.2
1192	G	25.4	Very low	34.5	Very low	72 Å²	72	102.6 Å²	102.6	74%	0.742	60%	0.6	S	S	*	*	S	Bend	trans	76.1	121.3	157.3	0	0	0	0	0	115.7
1193	N	27	Very low	34.7	Very low	154 Å²	154	99.1 Å²	99.1	82%	0.824	58%	0.579	S	S	*	*			trans	68.1	104.9	173.9	-59.9	-24	0	0	0	115.7	S1195	N1193-S1195 VanDerWaalsContact C-N 3.29Å; N1193-S1195 PolarHBondContact O-N 3.06Å
1194	I	27.4	Very low	35	Very low	171 Å²	171	99.8 Å²	99.8	88%	0.877	57%	0.571	S	S	*	*			trans	-60.7	92.5	165.7	-62.1	168.2	0	0	0	107.8
1195	S	28.9	Very low	35.3	Very low	97 Å²	97	97 Å²	97	68%	0.678	55%	0.553	S	S	*	*			trans	-70.1	131.3	171.6	70.6	0	0	0	0	109.2	N1193 N1197	N1193-S1195 VanDerWaalsContact C-N 3.29Å; N1193-S1195 PolarHBondContact O-N 3.06Å; S1195-N1197 PolarHBondContact O-N 3.05Å
1196	K	30.3	Very low	35.7	Very low	140 Å²	140	94.1 Å²	94.1	61%	0.609	53%	0.534	S	S	*	.	S	Bend	trans	-72.2	40.8	-170	-74.7	156	149.3	-169.5	0	114.5
1197	N	33.6	Very low	36.1	Very low	130 Å²	130	91 Å²	91	70%	0.695	52%	0.515	S	S	*	.			trans	-128.2	68.3	-176.8	-77.1	-20.8	0	0	0	112.5	S1195 K1199	S1195-N1197 PolarHBondContact O-N 3.05Å; N1197-K1199 PolarHBondContact O-N 3.33Å
1198	S	36	Very low	36.6	Very low	88 Å²	88	88 Å²	88	62%	0.615	49%	0.487	S	S	*	.			trans	-70.4	100	164.2	57	0	0	0	0	109.6
1199	K	37.2	Very low	37.4	Very low	120 Å²	120	80.4 Å²	80.4	52%	0.522	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	127.2	172.6	-74	175.6	177.9	172.6	0	109.6	N1197 S1201 C1248	N1197-K1199 PolarHBondContact O-N 3.33Å; K1199-S1201 PolarHBondContact O-N 3.23Å; K1199-S1201 VanDerWaalsContact O-N 3.07Å; K1199-C1248 HydrophobicContact CD-CB 4.06Å; K1199-C1248 HydrophobicContact CG-CB 4.31Å
1200	I	44.2	Very low	38.2	Very low	23 Å²	23	81.3 Å²	81.3	12%	0.118	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	101	166.6	-62.6	172	0	0	0	106.9	T1184 I1203 L1243 Y1247 I1249	T1184-I1200 CarbonylContact O-C 3.53Å; I1200-I1203 HydrophobicContact CG2-CD1 4.39Å; I1200-I1203 HydrophobicContact CG2-CG1 3.91Å; I1200-L1243 HydrophobicContact CD1-CD1 4.08Å; I1200-L1243 HydrophobicContact CD1-CD2 3.95Å; I1200-Y1247 HydrophobicContact CD1-CD1 4.37Å; I1200-I1249 WeakPolarHBondContact O-CA 3.38Å
1201	S	40.5	Very low	38.8	Very low	14 Å²	14	81.8 Å²	81.8	10%	0.098	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-30.8	-174.8	59.4	0	0	0	0	112.7	T1184 K1199 T1250 N1251	T1184-S1201 PolarHBondContact O-N 3.01Å; T1184-S1201 PolarHBondContact O-OG 3.04Å; T1184-S1201 PolarHBondContact OG1-OG 2.82Å; K1199-S1201 PolarHBondContact O-N 3.23Å; K1199-S1201 VanDerWaalsContact O-N 3.07Å; S1201-T1250 CarbonylContact O-C 3.51Å; S1201-T1250 PolarHBondContact O-N 3.23Å; S1201-T1250 PolarHBondContact O-OG1 2.88Å; S1201-N1251 PolarHBondContact O-N 3.25Å
1202	S	43.4	Very low	39.2	Very low	28 Å²	28	79.3 Å²	79.3	20%	0.196	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	150.3	174.6	80.6	0	0	0	0	114.2	S1183 T1184 N1251	S1183-S1202 VanDerWaalsContact CA-O 3.26Å; S1183-S1202 WeakPolarHBondContact CA-O 3.38Å; T1184-S1202 PolarHBondContact N-O 2.79Å; T1184-S1202 VanDerWaalsContact N-O 3.07Å; T1184-S1202 WeakPolarHBondContact OG1-CB 3.49Å; T1184-S1202 PolarHBondContact OG1-N 2.79Å; T1184-S1202 PolarHBondContact OG1-OG 3.4Å; S1202-N1251 CarbonylContact C-O 3.48Å; S1202-N1251 WeakPolarHBondContact CA-O 3.2Å; S1202-N1251 WeakPolarHBondContact CB-O 3.49Å
1203	I	46.4	Very low	39.8	Very low	4 Å²	4	84.6 Å²	84.6	2%	0.021	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	125.1	170.1	-61	-178.5	0	0	0	107.8	I1181 T1182 I1200 I1205 F1238 I1249 N1251 L1252 S1253	I1181-I1203 HydrophobicContact CG2-CG2 4.06Å; T1182-I1203 WeakPolarHBondContact O-CA 3.26Å; I1200-I1203 HydrophobicContact CG2-CD1 4.39Å; I1200-I1203 HydrophobicContact CG2-CG1 3.91Å; I1203-I1205 HydrophobicContact CG2-CG1 4.21Å; I1203-F1238 HydrophobicContact CD1-CE1 3.74Å; I1203-F1238 HydrophobicContact CD1-CZ 3.62Å; I1203-I1249 HydrophobicContact CD1-CD1 3.59Å; I1203-I1249 HydrophobicContact CD1-CG1 4.04Å; I1203-I1249 HydrophobicContact CD1-CG2 4.48Å; I1203-I1249 HydrophobicContact CG1-CG2 4.32Å; I1203-N1251 PolarHBondContact N-O 3.33Å; I1203-L1252 HydrophobicContact CB-CD1 3.94Å; I1203-L1252 HydrophobicContact CG2-CD1 4.03Å; I1203-L1252 WeakPolarHBondContact O-CA 3.44Å; I1203-S1253 PolarHBondContact O-N 3.49Å
1204	K	43.9	Very low	40.4	Very low	94 Å²	94	81.1 Å²	81.1	41%	0.409	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.9	173.4	-175.9	172.1	-173.4	176.2	0	110.5	I1181 T1182 I1206 S1253	I1181-K1204 WeakPolarHBondContact CA-O 3.49Å; T1182-K1204 PolarHBondContact N-O 2.95Å; T1182-K1204 PolarHBondContact O-N 3.4Å; T1182-K1204 WeakPolarHBondContact OG1-CB 3.5Å; K1204-I1206 HydrophobicContact CG-CG1 4.29Å; K1204-S1253 CarbonylContact C-O 3.57Å; K1204-S1253 WeakPolarHBondContact CA-O 3.48Å; K1204-S1253 WeakPolarHBondContact CA-OG 3.42Å; K1204-S1253 VanDerWaalsContact CB-OG 3.3Å; K1204-S1253 WeakPolarHBondContact CB-OG 3.36Å; K1204-S1253 VanDerWaalsContact CG-OG 3.31Å; K1204-S1253 WeakPolarHBondContact CG-OG 3.33Å
1205	I	47.6	Very low	41	Very low	9 Å²	9	80.7 Å²	80.7	5%	0.046	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	122.5	179.7	-61.1	162.6	0	0	0	107.8	L1179 T1180 I1203 F1234 L1252 S1253 I1254 S1255	L1179-I1205 HydrophobicContact CD1-CG2 3.56Å; T1180-I1205 CarbonylContact O-C 3.49Å; T1180-I1205 VanDerWaalsContact O-CA 3.31Å; T1180-I1205 WeakPolarHBondContact O-CA 3.1Å; I1203-I1205 HydrophobicContact CG2-CG1 4.21Å; I1205-F1234 HydrophobicContact CD1-CE1 3.97Å; I1205-F1234 HydrophobicContact CD1-CE2 3.65Å; I1205-F1234 HydrophobicContact CD1-CZ 3.2Å; I1205-F1234 HydrophobicContact CG1-CE1 4.46Å; I1205-F1234 HydrophobicContact CG1-CZ 3.75Å; I1205-L1252 HydrophobicContact CD1-CD1 3.96Å; I1205-S1253 PolarHBondContact N-O 3.48Å; I1205-I1254 HydrophobicContact CB-CG1 4.26Å; I1205-I1254 HydrophobicContact CD1-CG1 3.97Å; I1205-S1255 PolarHBondContact O-N 3.35Å; I1205-S1255 PolarHBondContact O-OG 3.24Å
1206	I	47	Very low	41.3	Very low	30 Å²	30	85.2 Å²	85.2	15%	0.154	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	121.1	175.4	-46.9	-177	0	0	0	109.3	T1180 K1204 Y1208 S1255 K1257	T1180-I1206 PolarHBondContact N-O 3.34Å; T1180-I1206 PolarHBondContact O-N 3.29Å; T1180-I1206 PolarHBondContact OG1-O 3.3Å; K1204-I1206 HydrophobicContact CG-CG1 4.29Å; I1206-Y1208 HydrophobicContact CB-CE2 4.49Å; I1206-Y1208 HydrophobicContact CG2-CD2 4.47Å; I1206-Y1208 HydrophobicContact CG2-CE1 4.38Å; I1206-Y1208 HydrophobicContact CG2-CE2 4.03Å; I1206-S1255 CarbonylContact C-O 3.49Å; I1206-S1255 VanDerWaalsContact CA-O 3.29Å; I1206-S1255 WeakPolarHBondContact CA-O 3.43Å; I1206-K1257 HydrophobicContact CG2-CB 4.43Å
1207	L	44.1	Very low	41.7	Very low	16 Å²	16	85.6 Å²	85.6	8%	0.084	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	119.3	175	-70.3	167.3	0	0	0	110.4	I1178 L1179 F1226 S1255 Y1256 K1257	I1178-L1207 CarbonylContact O-C 3.54Å; I1178-L1207 WeakPolarHBondContact O-CA 3.21Å; L1179-L1207 HydrophobicContact CD1-CD2 4.07Å; L1207-F1226 HydrophobicContact CD1-CD1 4.1Å; L1207-F1226 HydrophobicContact CD1-CE1 3.67Å; L1207-F1226 HydrophobicContact CD2-CE1 3.55Å; L1207-F1226 HydrophobicContact CD2-CZ 4.04Å; L1207-F1226 HydrophobicContact CG-CE1 4.23Å; L1207-S1255 PolarHBondContact N-O 3.49Å; L1207-Y1256 CarbonylContact O-C 3.51Å; L1207-Y1256 VanDerWaalsContact O-CA 3.27Å; L1207-Y1256 WeakPolarHBondContact O-CA 3.43Å; L1207-K1257 PolarHBondContact O-N 3.32Å
1208	Y	44	Very low	41.9	Very low	44 Å²	44	84.5 Å²	84.5	17%	0.173	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.9	172.2	-56.2	-93	0	0	0	111.7	Y1177 I1178 T1180 I1206 K1257 Y1259	Y1177-Y1208 CarbonylContact C-O 3.41Å; Y1177-Y1208 WeakPolarHBondContact CA-O 3.35Å; I1178-Y1208 HydrophobicContact CB-CD2 3.71Å; I1178-Y1208 HydrophobicContact CB-CG 4.18Å; I1178-Y1208 HydrophobicContact CG2-CD2 3.9Å; I1178-Y1208 HydrophobicContact CG2-CE2 4.48Å; I1178-Y1208 PolarHBondContact N-O 3.26Å; I1178-Y1208 WeakPolarHBondContact O-CD2 3.17Å; I1178-Y1208 PolarHBondContact O-N 3.07Å; T1180-Y1208 VanDerWaalsContact OG1-CE2 3.23Å; T1180-Y1208 WeakPolarHBondContact OG1-CE2 3.46Å; I1206-Y1208 HydrophobicContact CB-CE2 4.49Å; I1206-Y1208 HydrophobicContact CG2-CD2 4.47Å; I1206-Y1208 HydrophobicContact CG2-CE1 4.38Å; I1206-Y1208 HydrophobicContact CG2-CE2 4.03Å; Y1208-K1257 VanDerWaalsContact CA-O 3.26Å; Y1208-K1257 WeakPolarHBondContact CA-O 3.27Å; Y1208-K1257 HydrophobicContact CD1-CB 3.8Å; Y1208-K1257 HydrophobicContact CE1-CB 3.91Å; Y1208-K1257 HydrophobicContact CE1-CD 4.05Å; Y1208-Y1259 AromaticContact CD1-CD2 3.7Å; Y1208-Y1259 HydrophobicContact CD1-CD2 3.7Å; Y1208-Y1259 AromaticContact CD1-CE2 3.37Å; Y1208-Y1259 HydrophobicContact CD1-CE2 3.37Å; Y1208-Y1259 HydrophobicContact CE1-CD2 4.48Å; Y1208-Y1259 AromaticContact CE1-CE2 3.81Å; Y1208-Y1259 HydrophobicContact CE1-CE2 3.81Å; Y1208-Y1259 HydrophobicContact CG-CD2 4.32Å; Y1208-Y1259 HydrophobicContact CG-CE2 4.05Å
1209	I	46.5	Very low	41.9	Very low	39 Å²	39	84.9 Å²	84.9	20%	0.2	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	127.6	174.6	-58.4	179.9	0	0	0	109.4	Y1177 F1219 K1257 V1258	Y1177-I1209 HydrophobicContact CD1-CG1 4.09Å; Y1177-I1209 HydrophobicContact CE1-CD1 4.35Å; Y1177-I1209 HydrophobicContact CE1-CG1 3.85Å; I1209-F1219 HydrophobicContact CD1-CE1 4.25Å; I1209-F1219 HydrophobicContact CD1-CZ 4.13Å; I1209-K1257 PolarHBondContact N-O 3.48Å; I1209-V1258 HydrophobicContact CD1-CG2 4.37Å
1210	K	47.3	Very low	42	Very low	130 Å²	130	85.8 Å²	85.8	57%	0.565	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-81.5	127.9	165.6	-103.8	-176.1	169.9	-170	0	109.4	R1176	R1176-K1210 PolarHBondContact O-N 3.29Å
1211	E	44.7	Very low	41.6	Very low	119 Å²	119	92.5 Å²	92.5	56%	0.556	44%	0.437	S	S	*	.	S	Bend	trans	-37.8	143.2	-166.5	-72.2	164.2	158.4	0	0	121
1212	N	38.2	Very low	41.3	Very low	144 Å²	144	95.5 Å²	95.5	77%	0.77	45%	0.449	S	S	*	.			trans	68.5	49.6	135.4	-64.6	-8.6	0	0	0	124.5
1213	Q	37.9	Very low	40.8	Very low	182 Å²	182	96.8 Å²	96.8	85%	0.85	46%	0.457	S	S	*	.			trans	-129.5	16.4	165.1	-76.9	-150.5	-18.6	0	0	118.2
1214	Y	39.2	Very low	40.3	Very low	81 Å²	81	104.7 Å²	104.7	32%	0.318	49%	0.491	S	S	.	.			trans	-118.7	129.4	-177.7	-72.8	-85.3	0	0	0	114.5	R1176 Q1218 E1222	R1176-Y1214 PolarHBondContact NH1-OH 3.34Å; Y1214-Q1218 HydrophobicContact CD1-CB 3.95Å; Y1214-E1222 VanDerWaalsContact CE1-OE2 3.27Å; Y1214-E1222 WeakPolarHBondContact CE1-OE2 3.31Å; Y1214-E1222 PolarHBondContact OH-OE1 3.48Å; Y1214-E1222 PolarHBondContact OH-OE2 2.98Å
1215	Q	39.3	Very low	39.8	Very low	162 Å²	162	108.9 Å²	108.9	76%	0.757	51%	0.506	S	S	*	.			trans	-64.7	142.3	165.4	-75.6	-178.8	-17.9	0	0	110.1	D1217 Q1218	Q1215-D1217 PolarHBondContact O-N 3.44Å; Q1215-Q1218 PolarHBondContact O-N 3.36Å
1216	K	36.3	Very low	39.3	Very low	192 Å²	192	109.7 Å²	109.7	84%	0.835	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.8	-24.3	-170.4	-87.4	175.6	171.9	174.5	0	116.2
1217	D	38.8	Very low	38.7	Very low	148 Å²	148	112 Å²	112	79%	0.791	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-12.5	-174.3	-59.8	-31.2	0	0	0	115	Q1215 F1219	Q1215-D1217 PolarHBondContact O-N 3.44Å; D1217-F1219 VanDerWaalsContact C-N 3.32Å
1218	Q	37.1	Very low	38.2	Very low	107 Å²	107	117.8 Å²	117.8	50%	0.5	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-78.8	-18.4	172.8	-86.4	179.9	-22.2	0	0	112.9	Y1214 Q1215 I1220 K1221	Y1214-Q1218 HydrophobicContact CD1-CB 3.95Å; Q1215-Q1218 PolarHBondContact O-N 3.36Å; Q1218-I1220 PolarHBondContact O-N 2.72Å; Q1218-I1220 VanDerWaalsContact O-N 3.08Å; Q1218-K1221 PolarHBondContact O-N 3.3Å
1219	F	37	Very low	37.8	Very low	96 Å²	96	118.9 Å²	118.9	42%	0.421	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-61.9	-19.5	-172.5	-129.1	-91.5	0	0	0	114.7	I1209 D1217 P1223	I1209-F1219 HydrophobicContact CD1-CE1 4.25Å; I1209-F1219 HydrophobicContact CD1-CZ 4.13Å; D1217-F1219 VanDerWaalsContact C-N 3.32Å; F1219-P1223 VanDerWaalsContact O-CD 3.25Å; F1219-P1223 WeakPolarHBondContact O-CD 3.49Å; F1219-P1223 VanDerWaalsContact O-CG 3.27Å; F1219-P1223 WeakPolarHBondContact O-CG 3.43Å
1220	I	38.2	Very low	37.4	Very low	140 Å²	140	118.3 Å²	118.3	72%	0.718	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-93.1	-22.1	-173.8	-60.8	174.8	0	0	0	112.7	Q1218	Q1218-I1220 PolarHBondContact O-N 2.72Å; Q1218-I1220 VanDerWaalsContact O-N 3.08Å
1221	K	35.3	Very low	36.8	Very low	164 Å²	164	116.8 Å²	116.8	71%	0.713	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-38.8	-174.4	-79.1	179.6	178	173.7	0	114.2	Q1218	Q1218-K1221 PolarHBondContact O-N 3.3Å
1222	E	35.6	Very low	36.5	Very low	76 Å²	76	118 Å²	118	36%	0.355	56%	0.56	S	S	.	*	H	α-helix	trans	-70.9	-37	-175.4	-72.5	-165.1	159.5	0	0	115.4	Y1214 F1224 Y1225 F1226	Y1214-E1222 VanDerWaalsContact CE1-OE2 3.27Å; Y1214-E1222 WeakPolarHBondContact CE1-OE2 3.31Å; Y1214-E1222 PolarHBondContact OH-OE1 3.48Å; Y1214-E1222 PolarHBondContact OH-OE2 2.98Å; E1222-F1224 PolarHBondContact O-N 3.28Å; E1222-Y1225 PolarHBondContact O-N 3.2Å; E1222-F1226 WeakPolarHBondContact O-CB 3.45Å; E1222-F1226 PolarHBondContact O-N 3.25Å
1223	P	31.7	Very low	36.5	Very low	56 Å²	56	113.9 Å²	113.9	36%	0.364	54%	0.541	S	S	.	.	H	α-helix	trans	-62.7	-29.1	178.2	-21.4	32.1	0	0	0	113.2	F1219 F1226 I1227	F1219-P1223 VanDerWaalsContact O-CD 3.25Å; F1219-P1223 WeakPolarHBondContact O-CD 3.49Å; F1219-P1223 VanDerWaalsContact O-CG 3.27Å; F1219-P1223 WeakPolarHBondContact O-CG 3.43Å; P1223-F1226 WeakPolarHBondContact O-CB 3.38Å; P1223-F1226 PolarHBondContact O-N 2.81Å; P1223-I1227 WeakPolarHBondContact O-CG1 3.16Å; P1223-I1227 PolarHBondContact O-N 3.46Å
1224	F	35.6	Very low	36.8	Very low	169 Å²	169	106.1 Å²	106.1	74%	0.741	51%	0.505	S	S	*	.	H	α-helix	trans	-71.4	-37.9	179.6	-129.2	-85	0	0	0	112.2	E1222 K1228	E1222-F1224 PolarHBondContact O-N 3.28Å; F1224-K1228 PolarHBondContact O-N 3.49Å
1225	Y	34.2	Very low	36.9	Very low	182 Å²	182	109 Å²	109	71%	0.714	52%	0.519	S	S	*	.	H	α-helix	trans	-69.9	-36.9	171	-84	-81.5	0	0	0	111.5	E1222 K1228 S1229	E1222-Y1225 PolarHBondContact O-N 3.2Å; Y1225-K1228 PolarHBondContact O-N 2.9Å; Y1225-S1229 PolarHBondContact O-N 3.41Å
1226	F	36.4	Very low	37.1	Very low	26 Å²	26	103.7 Å²	103.7	11%	0.114	50%	0.5	C	S	.	.	H	α-helix	trans	-61.1	-48.2	175.8	-173.1	-109.9	0	0	0	111.8	L1173 Y1177 L1207 E1222 P1223 K1228 S1229 I1230	L1173-F1226 HydrophobicContact CD1-CZ 4.17Å; L1173-F1226 HydrophobicContact CD2-CE2 3.92Å; L1173-F1226 HydrophobicContact CD2-CZ 4.17Å; Y1177-F1226 HydrophobicContact CD1-CE1 4.38Å; Y1177-F1226 HydrophobicContact CD1-CZ 4.31Å; Y1177-F1226 HydrophobicContact CD2-CD2 4.34Å; Y1177-F1226 HydrophobicContact CD2-CE1 4.43Å; Y1177-F1226 AromaticContact CD2-CE2 3.6Å; Y1177-F1226 HydrophobicContact CD2-CE2 3.6Å; Y1177-F1226 AromaticContact CD2-CZ 3.67Å; Y1177-F1226 HydrophobicContact CD2-CZ 3.67Å; Y1177-F1226 HydrophobicContact CE2-CD2 4.1Å; Y1177-F1226 AromaticContact CE2-CE2 3.83Å; Y1177-F1226 HydrophobicContact CE2-CE2 3.83Å; Y1177-F1226 HydrophobicContact CE2-CZ 4.17Å; Y1177-F1226 HydrophobicContact CG-CE1 4.26Å; Y1177-F1226 HydrophobicContact CG-CE2 4.18Å; Y1177-F1226 AromaticContact CG-CZ 3.75Å; Y1177-F1226 HydrophobicContact CG-CZ 3.75Å; L1207-F1226 HydrophobicContact CD1-CD1 4.1Å; L1207-F1226 HydrophobicContact CD1-CE1 3.67Å; L1207-F1226 HydrophobicContact CD2-CE1 3.55Å; L1207-F1226 HydrophobicContact CD2-CZ 4.04Å; L1207-F1226 HydrophobicContact CG-CE1 4.23Å; E1222-F1226 WeakPolarHBondContact O-CB 3.45Å; E1222-F1226 PolarHBondContact O-N 3.25Å; P1223-F1226 WeakPolarHBondContact O-CB 3.38Å; P1223-F1226 PolarHBondContact O-N 2.81Å; F1226-K1228 VanDerWaalsContact C-N 3.29Å; F1226-K1228 PolarHBondContact O-N 2.95Å; F1226-S1229 WeakPolarHBondContact CA-OG 3.37Å; F1226-S1229 CarbonylContact O-C 3.6Å; F1226-S1229 PolarHBondContact O-N 3.27Å; F1226-S1229 VanDerWaalsContact O-N 3.09Å; F1226-S1229 PolarHBondContact O-OG 3.42Å; F1226-I1230 HydrophobicContact CD1-CD1 3.3Å; F1226-I1230 HydrophobicContact CD1-CG1 4.34Å; F1226-I1230 HydrophobicContact CD2-CD1 4.5Å; F1226-I1230 HydrophobicContact CE1-CD1 3.18Å; F1226-I1230 HydrophobicContact CE1-CG1 4.17Å; F1226-I1230 HydrophobicContact CE2-CD1 4.42Å; F1226-I1230 HydrophobicContact CG-CD1 3.98Å; F1226-I1230 HydrophobicContact CZ-CD1 3.79Å; F1226-I1230 HydrophobicContact CZ-CG1 4.33Å; F1226-I1230 WeakPolarHBondContact O-CB 3.5Å; F1226-I1230 WeakPolarHBondContact O-CD1 3.33Å; F1226-I1230 WeakPolarHBondContact O-CG1 3.23Å; F1226-I1230 PolarHBondContact O-N 2.98Å
1227	I	34.7	Very low	37.5	Very low	79 Å²	79	96.1 Å²	96.1	41%	0.405	47%	0.468	S	S	.	.	H	α-helix	trans	-61.5	-36.4	176.6	-67.7	168.1	0	0	0	111.8	P1223 I1230	P1223-I1227 WeakPolarHBondContact O-CG1 3.16Å; P1223-I1227 PolarHBondContact O-N 3.46Å; I1227-I1230 WeakPolarHBondContact O-CB 3.44Å; I1227-I1230 PolarHBondContact O-N 3.47Å
1228	K	33.4	Very low	37.9	Very low	138 Å²	138	91.3 Å²	91.3	60%	0.6	44%	0.44	S	S	*	.	H	α-helix	trans	-68.3	-36.4	175.7	-153.6	179.1	-174.8	-174.4	0	112	F1224 Y1225 F1226 I1230	F1224-K1228 PolarHBondContact O-N 3.49Å; Y1225-K1228 PolarHBondContact O-N 2.9Å; F1226-K1228 VanDerWaalsContact C-N 3.29Å; F1226-K1228 PolarHBondContact O-N 2.95Å; K1228-I1230 PolarHBondContact O-N 3.38Å
1229	S	37.2	Very low	38.4	Very low	66 Å²	66	91 Å²	91	46%	0.462	44%	0.442	S	S	.	.	H	α-helix	trans	-72.2	-16.1	174.5	75	0	0	0	0	113.8	Y1225 F1226 P1233	Y1225-S1229 PolarHBondContact O-N 3.41Å; F1226-S1229 WeakPolarHBondContact CA-OG 3.37Å; F1226-S1229 CarbonylContact O-C 3.6Å; F1226-S1229 PolarHBondContact O-N 3.27Å; F1226-S1229 VanDerWaalsContact O-N 3.09Å; F1226-S1229 PolarHBondContact O-OG 3.42Å; S1229-P1233 WeakPolarHBondContact O-CD 3.37Å; S1229-P1233 VanDerWaalsContact O-CG 3.24Å; S1229-P1233 WeakPolarHBondContact O-CG 3.24Å
1230	I	37.3	Very low	38.5	Very low	28 Å²	28	92.8 Å²	92.8	14%	0.144	45%	0.449	C	S	.	.	H	α-helix	trans	-85.3	-22.9	-178.2	-77.9	163.8	0	0	0	112.9	F1226 I1227 K1228 E1232 P1233 F1234	F1226-I1230 HydrophobicContact CD1-CD1 3.3Å; F1226-I1230 HydrophobicContact CD1-CG1 4.34Å; F1226-I1230 HydrophobicContact CD2-CD1 4.5Å; F1226-I1230 HydrophobicContact CE1-CD1 3.18Å; F1226-I1230 HydrophobicContact CE1-CG1 4.17Å; F1226-I1230 HydrophobicContact CE2-CD1 4.42Å; F1226-I1230 HydrophobicContact CG-CD1 3.98Å; F1226-I1230 HydrophobicContact CZ-CD1 3.79Å; F1226-I1230 HydrophobicContact CZ-CG1 4.33Å; F1226-I1230 WeakPolarHBondContact O-CB 3.5Å; F1226-I1230 WeakPolarHBondContact O-CD1 3.33Å; F1226-I1230 WeakPolarHBondContact O-CG1 3.23Å; F1226-I1230 PolarHBondContact O-N 2.98Å; I1227-I1230 WeakPolarHBondContact O-CB 3.44Å; I1227-I1230 PolarHBondContact O-N 3.47Å; K1228-I1230 PolarHBondContact O-N 3.38Å; I1230-E1232 PolarHBondContact O-N 3.39Å; I1230-P1233 VanDerWaalsContact O-CD 3.3Å; I1230-P1233 WeakPolarHBondContact O-CD 3.48Å; I1230-F1234 HydrophobicContact CG2-CD2 3.16Å; I1230-F1234 HydrophobicContact CG2-CE2 3.2Å; I1230-F1234 HydrophobicContact CG2-CG 4.47Å; I1230-F1234 WeakPolarHBondContact O-CD2 3.32Å; I1230-F1234 PolarHBondContact O-N 2.83Å
1231	N	35.5	Very low	38.6	Very low	97 Å²	97	90.6 Å²	90.6	52%	0.519	44%	0.439	S	S	.	.	H	α-helix	trans	-64.2	-38.9	179.7	-101	-0.9	0	0	0	113.9	F1234 K1235	N1231-F1234 PolarHBondContact O-N 3.45Å; N1231-K1235 PolarHBondContact O-N 2.72Å
1232	E	37.8	Very low	38.6	Very low	144 Å²	144	85.1 Å²	85.1	67%	0.673	43%	0.429	S	S	*	.	H	α-helix	trans	-64.9	-49.3	175.6	-80.1	-67.5	149	0	0	111.8	I1230 F1234 K1235 S1236	I1230-E1232 PolarHBondContact O-N 3.39Å; E1232-F1234 VanDerWaalsContact C-N 3.34Å; E1232-F1234 PolarHBondContact O-N 2.75Å; E1232-K1235 PolarHBondContact O-N 3.44Å; E1232-S1236 PolarHBondContact O-N 3.11Å
1233	P	38.6	Very low	38.8	Very low	58 Å²	58	82.7 Å²	82.7	38%	0.377	42%	0.418	S	S	.	.	H	α-helix	trans	-56.8	-40	168.4	-25	29.8	0	0	0	113.5	S1229 I1230 K1235 S1236 I1237	S1229-P1233 WeakPolarHBondContact O-CD 3.37Å; S1229-P1233 VanDerWaalsContact O-CG 3.24Å; S1229-P1233 WeakPolarHBondContact O-CG 3.24Å; I1230-P1233 VanDerWaalsContact O-CD 3.3Å; I1230-P1233 WeakPolarHBondContact O-CD 3.48Å; P1233-K1235 PolarHBondContact O-N 3.09Å; P1233-S1236 CarbonylContact O-C 3.58Å; P1233-S1236 WeakPolarHBondContact O-CA 3.19Å; P1233-S1236 WeakPolarHBondContact O-CB 3.17Å; P1233-S1236 PolarHBondContact O-N 3.39Å; P1233-I1237 HydrophobicContact CB-CD1 4.31Å; P1233-I1237 VanDerWaalsContact O-CB 3.26Å; P1233-I1237 WeakPolarHBondContact O-CB 3.49Å; P1233-I1237 WeakPolarHBondContact O-CD1 3.41Å; P1233-I1237 WeakPolarHBondContact O-CG1 3.31Å; P1233-I1237 PolarHBondContact O-N 2.93Å
1234	F	44.6	Very low	39.2	Very low	20 Å²	20	84.7 Å²	84.7	9%	0.088	42%	0.421	C	S	.	.	H	α-helix	trans	-65.2	-40	178.3	-97.7	-70.8	0	0	0	112.3	I1181 I1205 I1230 N1231 E1232 S1236 I1237 F1238	I1181-F1234 HydrophobicContact CD1-CE1 4.11Å; I1181-F1234 HydrophobicContact CD1-CZ 4.4Å; I1205-F1234 HydrophobicContact CD1-CE1 3.97Å; I1205-F1234 HydrophobicContact CD1-CE2 3.65Å; I1205-F1234 HydrophobicContact CD1-CZ 3.2Å; I1205-F1234 HydrophobicContact CG1-CE1 4.46Å; I1205-F1234 HydrophobicContact CG1-CZ 3.75Å; I1230-F1234 HydrophobicContact CG2-CD2 3.16Å; I1230-F1234 HydrophobicContact CG2-CE2 3.2Å; I1230-F1234 HydrophobicContact CG2-CG 4.47Å; I1230-F1234 WeakPolarHBondContact O-CD2 3.32Å; I1230-F1234 PolarHBondContact O-N 2.83Å; N1231-F1234 PolarHBondContact O-N 3.45Å; E1232-F1234 VanDerWaalsContact C-N 3.34Å; E1232-F1234 PolarHBondContact O-N 2.75Å; F1234-S1236 VanDerWaalsContact C-N 3.31Å; F1234-S1236 PolarHBondContact O-N 3.09Å; F1234-I1237 PolarHBondContact O-N 3.19Å; F1234-F1238 HydrophobicContact CB-CD2 4.26Å; F1234-F1238 HydrophobicContact CB-CE2 4.15Å; F1234-F1238 HydrophobicContact CD1-CD2 4.18Å; F1234-F1238 AromaticContact CD1-CE2 3.54Å; F1234-F1238 HydrophobicContact CD1-CE2 3.54Å; F1234-F1238 AromaticContact CD1-CZ 3.94Å; F1234-F1238 HydrophobicContact CD1-CZ 3.94Å; F1234-F1238 HydrophobicContact CE1-CE2 4.43Å; F1234-F1238 HydrophobicContact CE1-CZ 4.43Å; F1234-F1238 HydrophobicContact CG-CE2 4.21Å; F1234-F1238 WeakPolarHBondContact O-CB 3.15Å; F1234-F1238 WeakPolarHBondContact O-CD2 3.26Å; F1234-F1238 WeakPolarHBondContact O-CG 3.48Å; F1234-F1238 PolarHBondContact O-N 2.79Å
1235	K	39.9	Very low	39	Very low	141 Å²	141	81.6 Å²	81.6	61%	0.613	42%	0.418	S	S	*	.	H	α-helix	trans	-63.3	-41.4	173.6	-150.4	177.3	-175.7	-175.3	0	110.5	N1231 E1232 P1233 N1239	N1231-K1235 PolarHBondContact O-N 2.72Å; E1232-K1235 PolarHBondContact O-N 3.44Å; P1233-K1235 PolarHBondContact O-N 3.09Å; K1235-N1239 WeakPolarHBondContact O-CB 3.37Å; K1235-N1239 PolarHBondContact O-N 3.21Å; K1235-N1239 PolarHBondContact O-ND2 3.08Å
1236	S	44.9	Very low	39.1	Very low	50 Å²	50	79 Å²	79	35%	0.35	42%	0.424	S	S	.	.	H	α-helix	trans	-63.1	-39.6	172.1	-169.9	0	0	0	0	112.8	E1232 P1233 F1234 K1240	E1232-S1236 PolarHBondContact O-N 3.11Å; P1233-S1236 CarbonylContact O-C 3.58Å; P1233-S1236 WeakPolarHBondContact O-CA 3.19Å; P1233-S1236 WeakPolarHBondContact O-CB 3.17Å; P1233-S1236 PolarHBondContact O-N 3.39Å; F1234-S1236 VanDerWaalsContact C-N 3.31Å; F1234-S1236 PolarHBondContact O-N 3.09Å; S1236-K1240 WeakPolarHBondContact O-CB 3.48Å; S1236-K1240 WeakPolarHBondContact O-CD 3.4Å; S1236-K1240 WeakPolarHBondContact O-CG 3.06Å; S1236-K1240 PolarHBondContact O-N 3.19Å
1237	I	44.2	Very low	39.3	Very low	33 Å²	33	82 Å²	82	17%	0.169	44%	0.435	C	S	.	.	H	α-helix	trans	-72.3	-46.8	-179.3	-72.5	161.7	0	0	0	109.9	P1233 F1234 K1240 L1241	P1233-I1237 HydrophobicContact CB-CD1 4.31Å; P1233-I1237 VanDerWaalsContact O-CB 3.26Å; P1233-I1237 WeakPolarHBondContact O-CB 3.49Å; P1233-I1237 WeakPolarHBondContact O-CD1 3.41Å; P1233-I1237 WeakPolarHBondContact O-CG1 3.31Å; P1233-I1237 PolarHBondContact O-N 2.93Å; F1234-I1237 PolarHBondContact O-N 3.19Å; I1237-K1240 CarbonylContact O-C 3.56Å; I1237-K1240 PolarHBondContact O-N 2.81Å; I1237-L1241 HydrophobicContact CG2-CD1 3.66Å; I1237-L1241 HydrophobicContact CG2-CG 4.24Å; I1237-L1241 VanDerWaalsContact O-CB 3.27Å; I1237-L1241 WeakPolarHBondContact O-CB 3.35Å; I1237-L1241 WeakPolarHBondContact O-CG 3.29Å; I1237-L1241 PolarHBondContact O-N 2.99Å
1238	F	47.3	Very low	39	Very low	48 Å²	48	81.4 Å²	81.4	21%	0.211	44%	0.437	C	S	.	.	H	α-helix	trans	-62.7	-43.1	174.6	-72.7	-57.4	0	0	0	111.1	I1203 F1234 K1240 L1241 G1242 L1243 I1249	I1203-F1238 HydrophobicContact CD1-CE1 3.74Å; I1203-F1238 HydrophobicContact CD1-CZ 3.62Å; F1234-F1238 HydrophobicContact CB-CD2 4.26Å; F1234-F1238 HydrophobicContact CB-CE2 4.15Å; F1234-F1238 HydrophobicContact CD1-CD2 4.18Å; F1234-F1238 AromaticContact CD1-CE2 3.54Å; F1234-F1238 HydrophobicContact CD1-CE2 3.54Å; F1234-F1238 AromaticContact CD1-CZ 3.94Å; F1234-F1238 HydrophobicContact CD1-CZ 3.94Å; F1234-F1238 HydrophobicContact CE1-CE2 4.43Å; F1234-F1238 HydrophobicContact CE1-CZ 4.43Å; F1234-F1238 HydrophobicContact CG-CE2 4.21Å; F1234-F1238 WeakPolarHBondContact O-CB 3.15Å; F1234-F1238 WeakPolarHBondContact O-CD2 3.26Å; F1234-F1238 WeakPolarHBondContact O-CG 3.48Å; F1234-F1238 PolarHBondContact O-N 2.79Å; F1238-K1240 VanDerWaalsContact C-N 3.34Å; F1238-K1240 PolarHBondContact O-N 3.2Å; F1238-L1241 PolarHBondContact O-N 2.95Å; F1238-G1242 PolarHBondContact O-N 3.13Å; F1238-L1243 HydrophobicContact CB-CB 4.32Å; F1238-L1243 HydrophobicContact CD1-CB 4.17Å; F1238-L1243 HydrophobicContact CD1-CD1 3.74Å; F1238-L1243 HydrophobicContact CE1-CD1 4.19Å; F1238-L1243 WeakPolarHBondContact O-CA 3.33Å; F1238-L1243 WeakPolarHBondContact O-CB 3.45Å; F1238-L1243 PolarHBondContact O-N 2.95Å; F1238-I1249 HydrophobicContact CZ-CD1 4.46Å
1239	N	46.4	Very low	39.3	Very low	99 Å²	99	77.9 Å²	77.9	53%	0.529	42%	0.424	S	S	.	.	H	α-helix	trans	-63.8	-37.3	173.9	-71.8	-10.2	0	0	0	112.3	K1235 G1242	K1235-N1239 WeakPolarHBondContact O-CB 3.37Å; K1235-N1239 PolarHBondContact O-N 3.21Å; K1235-N1239 PolarHBondContact O-ND2 3.08Å; N1239-G1242 PolarHBondContact O-N 2.97Å
1240	K	40.7	Very low	39.1	Very low	134 Å²	134	79.4 Å²	79.4	58%	0.583	43%	0.431	S	S	*	.	H	α-helix	trans	-73.1	-29.1	175.6	-80	171.8	179.1	177.2	0	113.1	S1236 I1237 F1238 G1242	S1236-K1240 WeakPolarHBondContact O-CB 3.48Å; S1236-K1240 WeakPolarHBondContact O-CD 3.4Å; S1236-K1240 WeakPolarHBondContact O-CG 3.06Å; S1236-K1240 PolarHBondContact O-N 3.19Å; I1237-K1240 CarbonylContact O-C 3.56Å; I1237-K1240 PolarHBondContact O-N 2.81Å; F1238-K1240 VanDerWaalsContact C-N 3.34Å; F1238-K1240 PolarHBondContact O-N 3.2Å; K1240-G1242 PolarHBondContact O-N 3.44Å
1241	L	40.3	Very low	39	Very low	95 Å²	95	83.5 Å²	83.5	50%	0.497	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	3.4	174.1	-71.9	171.5	0	0	0	112.8	I1237 F1238 L1243	I1237-L1241 HydrophobicContact CG2-CD1 3.66Å; I1237-L1241 HydrophobicContact CG2-CG 4.24Å; I1237-L1241 VanDerWaalsContact O-CB 3.27Å; I1237-L1241 WeakPolarHBondContact O-CB 3.35Å; I1237-L1241 WeakPolarHBondContact O-CG 3.29Å; I1237-L1241 PolarHBondContact O-N 2.99Å; F1238-L1241 PolarHBondContact O-N 2.95Å; L1241-L1243 HydrophobicContact CB-CD1 4.08Å; L1241-L1243 HydrophobicContact CB-CG 4.16Å; L1241-L1243 HydrophobicContact CD1-CD1 4.35Å; L1241-L1243 PolarHBondContact O-N 2.9Å
1242	G	35.2	Very low	39.3	Very low	48 Å²	48	84 Å²	84	50%	0.495	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.9	13.7	-177.1	0	0	0	0	0	113.4	F1238 N1239 K1240 K1244	F1238-G1242 PolarHBondContact O-N 3.13Å; N1239-G1242 PolarHBondContact O-N 2.97Å; K1240-G1242 PolarHBondContact O-N 3.44Å; G1242-K1244 PolarHBondContact O-N 2.81Å
1243	L	38.8	Very low	39.5	Very low	26 Å²	26	79.5 Å²	79.5	14%	0.136	44%	0.439	C	S	.	.			trans	-86.5	93.3	-179.3	-70	172.6	0	0	0	109.1	I1200 F1238 L1241 Y1247	I1200-L1243 HydrophobicContact CD1-CD1 4.08Å; I1200-L1243 HydrophobicContact CD1-CD2 3.95Å; F1238-L1243 HydrophobicContact CB-CB 4.32Å; F1238-L1243 HydrophobicContact CD1-CB 4.17Å; F1238-L1243 HydrophobicContact CD1-CD1 3.74Å; F1238-L1243 HydrophobicContact CE1-CD1 4.19Å; F1238-L1243 WeakPolarHBondContact O-CA 3.33Å; F1238-L1243 WeakPolarHBondContact O-CB 3.45Å; F1238-L1243 PolarHBondContact O-N 2.95Å; L1241-L1243 HydrophobicContact CB-CD1 4.08Å; L1241-L1243 HydrophobicContact CB-CG 4.16Å; L1241-L1243 HydrophobicContact CD1-CD1 4.35Å; L1241-L1243 PolarHBondContact O-N 2.9Å; L1243-Y1247 WeakPolarHBondContact CA-OH 3.38Å; L1243-Y1247 HydrophobicContact CB-CD2 4.24Å; L1243-Y1247 HydrophobicContact CB-CE2 3.41Å; L1243-Y1247 VanDerWaalsContact CB-CE2 3.41Å; L1243-Y1247 HydrophobicContact CD2-CD1 4.33Å; L1243-Y1247 HydrophobicContact CD2-CE1 3.58Å; L1243-Y1247 HydrophobicContact CD2-CE2 3.99Å; L1243-Y1247 VanDerWaalsContact CD2-CZ 3.41Å; L1243-Y1247 HydrophobicContact CG-CE2 4.26Å
1244	K	39.8	Very low	39.8	Very low	97 Å²	97	81 Å²	81	42%	0.422	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-84.5	125.9	170.9	-72.3	-175.2	177.2	-178.7	0	111.9	G1242 Y1247	G1242-K1244 PolarHBondContact O-N 2.81Å; K1244-Y1247 PolarHBondContact N-OH 2.86Å; K1244-Y1247 WeakPolarHBondContact O-CE2 3.11Å; K1244-Y1247 PolarHBondContact O-OH 2.74Å; K1244-Y1247 VanDerWaalsContact O-OH 3.06Å
1245	P	31.9	Very low	39.7	Very low	105 Å²	105	82.1 Å²	82.1	68%	0.682	45%	0.453	S	S	*	.	S	Bend	trans	-58.2	152.2	177	22.7	-31.5	0	0	0	112.8
1246	P	36.4	Very low	39.8	Very low	128 Å²	128	83.7 Å²	83.7	83%	0.831	46%	0.457	S	S	*	.	P	Polyproline II helix	cis	-98.6	121.4	14	35.1	-27.6	0	0	0	113.1
1247	Y	40.9	Very low	39.6	Very low	87 Å²	87	87.5 Å²	87.5	34%	0.341	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-92.7	131.1	165.5	-63.9	-75.1	0	0	0	110.1	I1200 L1243 K1244 I1249	I1200-Y1247 HydrophobicContact CD1-CD1 4.37Å; L1243-Y1247 WeakPolarHBondContact CA-OH 3.38Å; L1243-Y1247 HydrophobicContact CB-CD2 4.24Å; L1243-Y1247 HydrophobicContact CB-CE2 3.41Å; L1243-Y1247 VanDerWaalsContact CB-CE2 3.41Å; L1243-Y1247 HydrophobicContact CD2-CD1 4.33Å; L1243-Y1247 HydrophobicContact CD2-CE1 3.58Å; L1243-Y1247 HydrophobicContact CD2-CE2 3.99Å; L1243-Y1247 VanDerWaalsContact CD2-CZ 3.41Å; L1243-Y1247 HydrophobicContact CG-CE2 4.26Å; K1244-Y1247 PolarHBondContact N-OH 2.86Å; K1244-Y1247 WeakPolarHBondContact O-CE2 3.11Å; K1244-Y1247 PolarHBondContact O-OH 2.74Å; K1244-Y1247 VanDerWaalsContact O-OH 3.06Å; Y1247-I1249 PolarHBondContact O-N 3.19Å
1248	C	28.7	Very low	39.5	Very low	67 Å²	67	90 Å²	90	45%	0.453	48%	0.483	S	S	.	.			trans	-75.7	73.4	167.2	-69.5	0	0	0	0	109.9	K1199 T1250	K1199-C1248 HydrophobicContact CD-CB 4.06Å; K1199-C1248 HydrophobicContact CG-CB 4.31Å; C1248-T1250 PolarHBondContact O-N 3.43Å; C1248-T1250 VanDerWaalsContact O-N 3.15Å
1249	I	38.2	Very low	39.1	Very low	64 Å²	64	94 Å²	94	33%	0.328	50%	0.498	S	S	.	.			trans	-73.6	100.5	167.9	-59.6	163.4	0	0	0	106.8	I1200 I1203 F1238 Y1247 L1252	I1200-I1249 WeakPolarHBondContact O-CA 3.38Å; I1203-I1249 HydrophobicContact CD1-CD1 3.59Å; I1203-I1249 HydrophobicContact CD1-CG1 4.04Å; I1203-I1249 HydrophobicContact CD1-CG2 4.48Å; I1203-I1249 HydrophobicContact CG1-CG2 4.32Å; F1238-I1249 HydrophobicContact CZ-CD1 4.46Å; Y1247-I1249 PolarHBondContact O-N 3.19Å; I1249-L1252 HydrophobicContact CG2-CB 4.47Å
1250	T	34	Very low	38.2	Very low	99 Å²	99	96.3 Å²	96.3	61%	0.607	50%	0.504	S	S	*	.			trans	-79.8	-18.4	-178.6	54.8	0	0	0	0	112.8	S1201 C1248	S1201-T1250 CarbonylContact O-C 3.51Å; S1201-T1250 PolarHBondContact O-N 3.23Å; S1201-T1250 PolarHBondContact O-OG1 2.88Å; C1248-T1250 PolarHBondContact O-N 3.43Å; C1248-T1250 VanDerWaalsContact O-N 3.15Å
1251	N	35.6	Very low	37.5	Very low	113 Å²	113	96.4 Å²	96.4	60%	0.604	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.5	116.7	174.2	-92.4	-32.1	0	0	0	113	S1201 S1202 I1203	S1201-N1251 PolarHBondContact O-N 3.25Å; S1202-N1251 CarbonylContact C-O 3.48Å; S1202-N1251 WeakPolarHBondContact CA-O 3.2Å; S1202-N1251 WeakPolarHBondContact CB-O 3.49Å; I1203-N1251 PolarHBondContact N-O 3.33Å
1252	L	41	Very low	36.8	Very low	108 Å²	108	102.7 Å²	102.7	57%	0.565	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	120.9	166.5	-177.8	73.6	0	0	0	108.6	I1203 I1205 I1249	I1203-L1252 HydrophobicContact CB-CD1 3.94Å; I1203-L1252 HydrophobicContact CG2-CD1 4.03Å; I1203-L1252 WeakPolarHBondContact O-CA 3.44Å; I1205-L1252 HydrophobicContact CD1-CD1 3.96Å; I1249-L1252 HydrophobicContact CG2-CB 4.47Å
1253	S	41.7	Very low	36.3	Very low	49 Å²	49	106.7 Å²	106.7	34%	0.343	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	125.2	175	59.3	0	0	0	0	110.8	I1203 K1204 I1205	I1203-S1253 PolarHBondContact O-N 3.49Å; K1204-S1253 CarbonylContact C-O 3.57Å; K1204-S1253 WeakPolarHBondContact CA-O 3.48Å; K1204-S1253 WeakPolarHBondContact CA-OG 3.42Å; K1204-S1253 VanDerWaalsContact CB-OG 3.3Å; K1204-S1253 WeakPolarHBondContact CB-OG 3.36Å; K1204-S1253 VanDerWaalsContact CG-OG 3.31Å; K1204-S1253 WeakPolarHBondContact CG-OG 3.33Å; I1205-S1253 PolarHBondContact N-O 3.48Å
1254	I	44.8	Very low	35.6	Very low	91 Å²	91	113 Å²	113	47%	0.467	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.2	126.2	173.7	-60.7	166.3	0	0	0	106.9	I1205	I1205-I1254 HydrophobicContact CB-CG1 4.26Å; I1205-I1254 HydrophobicContact CD1-CG1 3.97Å
1255	S	43.7	Very low	34.8	Very low	42 Å²	42	117.1 Å²	117.1	29%	0.294	60%	0.599	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-132.3	149.7	176.4	55	0	0	0	0	109.9	I1205 I1206 L1207	I1205-S1255 PolarHBondContact O-N 3.35Å; I1205-S1255 PolarHBondContact O-OG 3.24Å; I1206-S1255 CarbonylContact C-O 3.49Å; I1206-S1255 VanDerWaalsContact CA-O 3.29Å; I1206-S1255 WeakPolarHBondContact CA-O 3.43Å; L1207-S1255 PolarHBondContact N-O 3.49Å
1256	Y	41.3	Very low	34.4	Very low	175 Å²	175	120 Å²	120	69%	0.686	60%	0.601	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-117.4	144.7	172.7	62.6	-86.7	0	0	0	109	L1207	L1207-Y1256 CarbonylContact O-C 3.51Å; L1207-Y1256 VanDerWaalsContact O-CA 3.27Å; L1207-Y1256 WeakPolarHBondContact O-CA 3.43Å
1257	K	41.5	Very low	33.9	Very low	130 Å²	130	122.3 Å²	122.3	57%	0.565	61%	0.605	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-128.7	123.5	174.4	-106.8	-175.7	172.9	-175.1	0	108.7	I1206 L1207 Y1208 I1209	I1206-K1257 HydrophobicContact CG2-CB 4.43Å; L1207-K1257 PolarHBondContact O-N 3.32Å; Y1208-K1257 VanDerWaalsContact CA-O 3.26Å; Y1208-K1257 WeakPolarHBondContact CA-O 3.27Å; Y1208-K1257 HydrophobicContact CD1-CB 3.8Å; Y1208-K1257 HydrophobicContact CE1-CB 3.91Å; Y1208-K1257 HydrophobicContact CE1-CD 4.05Å; I1209-K1257 PolarHBondContact N-O 3.48Å
1258	V	41	Very low	33.2	Very low	84 Å²	84	123.5 Å²	123.5	51%	0.509	62%	0.617	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.7	129.4	172.7	-175.7	0	0	0	0	107.7	I1209	I1209-V1258 HydrophobicContact CD1-CG2 4.37Å
1259	Y	38.6	Very low	33	Very low	133 Å²	133	125.3 Å²	125.3	52%	0.522	63%	0.631	S	S	.	*			trans	-76.8	126.5	174.6	-103.1	-84.7	0	0	0	110.1	Y1208	Y1208-Y1259 AromaticContact CD1-CD2 3.7Å; Y1208-Y1259 HydrophobicContact CD1-CD2 3.7Å; Y1208-Y1259 AromaticContact CD1-CE2 3.37Å; Y1208-Y1259 HydrophobicContact CD1-CE2 3.37Å; Y1208-Y1259 HydrophobicContact CE1-CD2 4.48Å; Y1208-Y1259 AromaticContact CE1-CE2 3.81Å; Y1208-Y1259 HydrophobicContact CE1-CE2 3.81Å; Y1208-Y1259 HydrophobicContact CG-CD2 4.32Å; Y1208-Y1259 HydrophobicContact CG-CE2 4.05Å
1260	K	28.7	Very low	32.5	Very low	148 Å²	148	131.7 Å²	131.7	64%	0.643	66%	0.656	S	S	*	*	S	Bend	trans	74.6	120.5	167.3	-73.6	-175.1	174.3	-177.8	0	121.3
1261	D	25.1	Very low	32.2	Very low	135 Å²	135	135.2 Å²	135.2	72%	0.722	67%	0.671	S	S	*	*			trans	52.4	60.6	145.8	-53.1	-17.9	0	0	0	119.2
1262	Y	26.4	Very low	31.7	Very low	227 Å²	227	138.6 Å²	138.6	89%	0.89	68%	0.683	S	S	*	*			trans	-138.6	139.7	150.2	-81.7	-77.1	0	0	0	113.2
1263	V	25.1	Very low	31.1	Very low	132 Å²	132	142.7 Å²	142.7	80%	0.8	70%	0.697	S	S	*	*			trans	-53.9	139.1	-168.7	174.4	0	0	0	0	113.5	M1265	V1263-M1265 PolarHBondContact O-N 3.41Å; V1263-M1265 VanDerWaalsContact O-N 3.11Å
1264	I	22.3	Very low	30.4	Very low	158 Å²	158	148 Å²	148	81%	0.81	72%	0.721	S	S	*	*			trans	-40.1	109	167.5	-60.2	163.8	0	0	0	110.8
1265	M	24.7	Very low	29.6	Very low	185 Å²	185	151.6 Å²	151.6	91%	0.911	74%	0.739	S	S	*	*			trans	-108.3	104.3	156.9	-98.3	-170.4	170.6	0	0	109.7	V1263 L1267	V1263-M1265 PolarHBondContact O-N 3.41Å; V1263-M1265 VanDerWaalsContact O-N 3.11Å; M1265-L1267 PolarHBondContact O-N 3.35Å
1266	K	23.6	Very low	28.7	Very low	166 Å²	166	158.6 Å²	158.6	72%	0.722	77%	0.765	S	S	*	*			trans	-70	94.6	172.4	-164.7	-179.5	-168.9	177.8	0	108.6	N1268	K1266-N1268 VanDerWaalsContact C-N 3.29Å; K1266-N1268 PolarHBondContact O-N 3.02Å; K1266-N1268 VanDerWaalsContact O-N 3.14Å
1267	L	26.1	Very low	28	Very low	175 Å²	175	157.7 Å²	157.7	92%	0.916	77%	0.772	S	S	*	*			trans	-82.6	85.2	163.2	-86.8	163.7	0	0	0	108.5	M1265	M1265-L1267 PolarHBondContact O-N 3.35Å
1268	N	26.1	Very low	27.4	Very low	113 Å²	113	160.7 Å²	160.7	60%	0.604	79%	0.785	S	S	*	*			trans	-57.9	140.9	163	-93.3	-10.1	0	0	0	110.3	K1266 K1270	K1266-N1268 VanDerWaalsContact C-N 3.29Å; K1266-N1268 PolarHBondContact O-N 3.02Å; K1266-N1268 VanDerWaalsContact O-N 3.14Å; N1268-K1270 PolarHBondContact O-N 2.86Å
1269	S	24.4	Very low	26.6	Very low	105 Å²	105	166 Å²	166	73%	0.734	80%	0.801	S	S	*	*	S	Bend	trans	-22.6	118.8	158.6	46.7	0	0	0	0	115
1270	K	26.9	Very low	26	Very low	198 Å²	198	167.1 Å²	167.1	86%	0.861	81%	0.814	S	S	*	*			trans	-177.3	2.9	146.5	-105.9	168	-174.1	-173.5	0	119.3	N1268	N1268-K1270 PolarHBondContact O-N 2.86Å
1271	N	27.6	Very low	25.9	Very low	173 Å²	173	168 Å²	168	93%	0.925	82%	0.818	S	S	*	*			trans	-117.7	57.3	178	-77	-13.3	0	0	0	113.7
1272	E	25.4	Very low	25.9	Very low	184 Å²	184	171.7 Å²	171.7	86%	0.86	82%	0.822	S	S	*	*			trans	-76.5	113	149.5	-74.2	-178.7	154.3	0	0	107.8
1273	K	27.3	Very low	25.9	Very low	194 Å²	194	168.2 Å²	168.2	84%	0.843	82%	0.818	S	S	*	*	S	Bend	trans	176.2	-12.2	144.6	-98.2	164.3	-175	-177.1	0	117.9
1274	N	27.8	Very low	25.9	Very low	160 Å²	160	171.6 Å²	171.6	86%	0.856	82%	0.817	S	S	*	*			trans	-123.6	35.4	-165.5	-83.3	-8.2	0	0	0	118.3
1275	I	27.6	Very low	26	Very low	166 Å²	166	172.6 Å²	172.6	85%	0.851	82%	0.818	S	S	*	*			trans	-131.4	61.5	165.3	-48.3	177.6	0	0	0	109.8
1276	K	25.7	Very low	26.2	Very low	190 Å²	190	171 Å²	171	83%	0.826	81%	0.811	S	S	*	*			trans	-85.1	135.2	154.7	-76.2	179.2	175.6	179.1	0	106.7
1277	N	26.4	Very low	26.3	Very low	156 Å²	156	173.8 Å²	173.8	83%	0.834	82%	0.817	S	S	*	*			trans	86.1	72.3	176.7	-51.7	-16.7	0	0	0	116.6
1278	K	27.8	Very low	26.2	Very low	193 Å²	193	173.2 Å²	173.2	84%	0.839	81%	0.814	S	S	*	*	S	Bend	trans	-160.3	110.5	141.6	-107.1	163	-171.2	-179.7	0	110.4	I1280	K1278-I1280 PolarHBondContact O-N 3.09Å
1279	K	25.2	Very low	26.3	Very low	194 Å²	194	174.8 Å²	174.8	84%	0.843	82%	0.822	S	S	*	*			trans	5.8	90.5	169.1	-67.2	179.5	176.7	-179.7	0	116.4	F1281	K1279-F1281 PolarHBondContact O-N 3.12Å
1280	I	25.6	Very low	26.3	Very low	158 Å²	158	175.1 Å²	175.1	81%	0.81	82%	0.824	S	S	*	*			trans	-76.3	109.4	159.8	-64.4	172.3	0	0	0	107.2	K1278 R1282	K1278-I1280 PolarHBondContact O-N 3.09Å; I1280-R1282 PolarHBondContact O-N 2.8Å; I1280-R1282 VanDerWaalsContact O-N 3.14Å
1281	F	25.9	Very low	26.3	Very low	166 Å²	166	175.1 Å²	175.1	73%	0.728	82%	0.824	S	S	*	*			trans	-65.8	105.4	165.8	-87.3	-93.9	0	0	0	108.3	K1279 L1283	K1279-F1281 PolarHBondContact O-N 3.12Å; F1281-L1283 PolarHBondContact O-N 3.49Å
1282	R	25.2	Very low	26.3	Very low	213 Å²	213	172.5 Å²	172.5	80%	0.804	82%	0.819	S	S	*	*			trans	-68.8	109.6	167.1	-93.3	179.5	166.9	164.5	-4.7	108.7	I1280 R1284	I1280-R1282 PolarHBondContact O-N 2.8Å; I1280-R1282 VanDerWaalsContact O-N 3.14Å; R1282-R1284 PolarHBondContact O-N 2.85Å; R1282-R1284 VanDerWaalsContact O-N 3.12Å
1283	L	26.3	Very low	26.4	Very low	153 Å²	153	170.7 Å²	170.7	80%	0.801	82%	0.815	S	S	*	*			trans	-65.4	99.1	156.5	-80.7	154	0	0	0	107.5	F1281	F1281-L1283 PolarHBondContact O-N 3.49Å
1284	R	25.3	Very low	26.4	Very low	204 Å²	204	168.8 Å²	168.8	77%	0.77	81%	0.814	S	S	*	*			trans	-78.4	153.7	162.5	-85.6	178.6	165.1	166.4	-5.8	108.2	R1282	R1282-R1284 PolarHBondContact O-N 2.85Å; R1282-R1284 VanDerWaalsContact O-N 3.12Å
1285	H	24.9	Very low	26.4	Very low	179 Å²	179	168.7 Å²	168.7	83%	0.829	81%	0.81	S	S	*	*			trans	89.2	56.2	-170	-55	-102.1	0	0	0	115.6
1286	I	28.6	Very low	26.3	Very low	150 Å²	150	167.9 Å²	167.9	77%	0.769	81%	0.807	S	S	*	*			trans	-122.2	112.2	143.2	-64.7	176.4	0	0	0	105.6	L1288	I1286-L1288 PolarHBondContact O-N 3.13Å
1287	W	26.4	Very low	26.5	Very low	225 Å²	225	163.9 Å²	163.9	85%	0.852	80%	0.803	S	S	*	*			trans	-70.5	115	168.2	-93.6	49.1	0	0	0	108.4	L1289	W1287-L1289 HydrophobicContact CE3-CD1 4.18Å; W1287-L1289 HydrophobicContact CZ3-CD1 4.34Å
1288	L	24.6	Very low	26.5	Very low	164 Å²	164	163.1 Å²	163.1	86%	0.859	80%	0.799	S	S	*	*			trans	-91	116.2	164	-80.8	158	0	0	0	107.2	I1286	I1286-L1288 PolarHBondContact O-N 3.13Å
1289	L	26.6	Very low	26.7	Very low	146 Å²	146	161.9 Å²	161.9	76%	0.764	80%	0.796	S	S	*	*			trans	-109.4	141.1	159.8	-99.1	157.8	0	0	0	108.8	W1287	W1287-L1289 HydrophobicContact CE3-CD1 4.18Å; W1287-L1289 HydrophobicContact CZ3-CD1 4.34Å
1290	S	26.1	Very low	26.8	Very low	111 Å²	111	161.6 Å²	161.6	78%	0.776	79%	0.791	S	S	*	*			trans	-71.6	146.7	-157.8	53.8	0	0	0	0	115.7
1291	K	25.2	Very low	26.7	Very low	199 Å²	199	160 Å²	160	87%	0.865	78%	0.784	S	S	*	*			trans	-55.9	130.5	164.5	-120.2	172.3	176.6	178.1	0	112.4
1292	S	28.5	Very low	26.7	Very low	118 Å²	118	158.1 Å²	158.1	83%	0.825	78%	0.782	S	S	*	*			trans	-141	83.5	143.7	61.7	0	0	0	0	109.2
1293	N	26.8	Very low	26.8	Very low	145 Å²	145	155.8 Å²	155.8	78%	0.775	78%	0.78	S	S	*	*			trans	-112.6	123.8	164.7	-89.2	-1.3	0	0	0	107.2
1294	L	27.9	Very low	26.7	Very low	154 Å²	154	156.6 Å²	156.6	81%	0.806	78%	0.779	S	S	*	*			trans	-167.8	122.9	159.8	-90.2	142.2	0	0	0	102.8
1295	M	28.3	Very low	26.5	Very low	159 Å²	159	153.3 Å²	153.3	78%	0.783	77%	0.774	S	S	*	*			cis	-159.1	149.5	17.7	-86.8	-100.7	-161.5	0	0	108.6
1296	N	25.4	Very low	26.6	Very low	149 Å²	149	152.1 Å²	152.1	80%	0.797	77%	0.767	S	S	*	*			trans	-24.4	152.8	151.5	-64.7	-24.1	0	0	0	114.6
1297	S	30.4	Very low	26.5	Very low	105 Å²	105	151.2 Å²	151.2	73%	0.734	76%	0.762	S	S	*	*			cis	-174.9	143.8	43.8	42.1	0	0	0	0	111.5
1298	N	26.3	Very low	26.4	Very low	141 Å²	141	150.6 Å²	150.6	75%	0.754	76%	0.76	S	S	*	*			trans	8	126	142.8	-56.2	-17.2	0	0	0	119.1
1299	H	30.4	Very low	26.5	Very low	166 Å²	166	148.3 Å²	148.3	77%	0.769	75%	0.749	S	S	*	*				178.7	119.9	110.6	-101.9	-69.8	0	0	0	112.9
1300	Y	27.1	Very low	26.7	Very low	189 Å²	189	145.1 Å²	145.1	74%	0.741	75%	0.751	S	S	*	*			trans	39.6	125.2	133.7	-81.1	-96.6	0	0	0	122.7
1301	N	25.3	Very low	26.8	Very low	123 Å²	123	147.3 Å²	147.3	66%	0.658	75%	0.752	S	S	*	*			trans	77.2	123.7	132.1	-73.6	6.8	0	0	0	122.7
1302	N	25.1	Very low	27	Very low	128 Å²	128	142.8 Å²	142.8	68%	0.684	74%	0.743	S	S	*	*			trans	71.7	137.3	134.6	-73	6.5	0	0	0	120.6
1303	E	27.4	Very low	26.7	Very low	163 Å²	163	146.7 Å²	146.7	76%	0.762	75%	0.746	S	S	*	*			trans	80	104.7	151.2	-71.7	164.7	-152.5	0	0	117.6
1304	E	23.7	Very low	26.7	Very low	170 Å²	170	146.6 Å²	146.6	79%	0.794	74%	0.744	S	S	*	*				60.5	141.7	126.9	-64.9	-165	161.3	0	0	121.1
1305	M	21.9	Very low	26.5	Very low	135 Å²	135	145.2 Å²	145.2	67%	0.665	74%	0.742	S	S	*	*			trans	84.2	108.7	152.2	-74.9	-161.5	177	0	0	119.6
1306	K	25.9	Very low	26.3	Very low	154 Å²	154	145.5 Å²	145.5	67%	0.67	75%	0.746	S	S	*	*				89.8	113	115.9	-73.9	177.7	179.5	167.6	0	119.4
1307	I	26.1	Very low	26.3	Very low	132 Å²	132	144.3 Å²	144.3	68%	0.677	74%	0.74	S	S	*	*				90.8	111.7	116.9	-69.7	173	0	0	0	118.5
1308	W	25.1	Very low	26.2	Very low	212 Å²	212	144.8 Å²	144.8	80%	0.803	74%	0.74	S	S	*	*			trans	97.8	111.1	130.1	-84.8	28.4	0	0	0	122.9
1309	N	27.6	Very low	26.2	Very low	116 Å²	116	147.5 Å²	147.5	62%	0.62	74%	0.741	S	S	*	*				102.9	120.7	114.1	-75.7	10.2	0	0	0	121.5
1310	G	29.8	Very low	26.3	Very low	79 Å²	79	146.7 Å²	146.7	81%	0.814	75%	0.748	S	S	*	*			trans	164.7	59	161.3	0	0	0	0	0	116.2
1311	I	28.5	Very low	26.2	Very low	156 Å²	156	141 Å²	141	80%	0.8	75%	0.747	S	S	*	*			trans	-70.5	163.9	176.1	-72.1	168	0	0	0	111.6
1312	P	28.5	Very low	26.4	Very low	104 Å²	104	143.4 Å²	143.4	68%	0.675	76%	0.758	S	S	*	*			cis	-131.5	146.4	15.7	17.5	8.5	0	0	0	118.8
1313	F	23.9	Very low	26.5	Very low	200 Å²	200	144.7 Å²	144.7	88%	0.877	76%	0.764	S	S	*	*			trans	-71.9	131.5	144.6	-90.5	-107.2	0	0	0	109.5
1314	I	25.9	Very low	26.3	Very low	143 Å²	143	141.8 Å²	141.8	73%	0.733	76%	0.762	S	S	*	*			trans	-96.9	104	161.2	-66.2	174.6	0	0	0	107.5	L1316	I1314-L1316 HydrophobicContact CG2-CD1 4.1Å; I1314-L1316 HydrophobicContact CG2-CG 4.15Å
1315	T	23.7	Very low	26.5	Very low	125 Å²	125	140.8 Å²	140.8	77%	0.767	76%	0.76	S	S	*	*			trans	-72	129	159.3	45.9	0	0	0	0	109.2
1316	L	25.4	Very low	26.7	Very low	165 Å²	165	141 Å²	141	86%	0.864	76%	0.763	S	S	*	*			trans	-126.2	118.2	164.3	-89.6	162.3	0	0	0	110.8	I1314	I1314-L1316 HydrophobicContact CG2-CD1 4.1Å; I1314-L1316 HydrophobicContact CG2-CG 4.15Å
1317	N	25.2	Very low	26.6	Very low	125 Å²	125	145.2 Å²	145.2	67%	0.668	77%	0.774	S	S	*	*			trans	-63.3	138.8	179.8	-174.4	5.5	0	0	0	112.3	Y1319	N1317-Y1319 VanDerWaalsContact C-N 3.32Å; N1317-Y1319 PolarHBondContact O-N 3.34Å; N1317-Y1319 VanDerWaalsContact O-N 3.12Å
1318	P	26.8	Very low	26.6	Very low	114 Å²	114	147.4 Å²	147.4	74%	0.74	78%	0.782	S	S	*	*	S	Bend	trans	-87.9	64.7	177.6	36.9	-33.7	0	0	0	111.2
1319	Y	26.9	Very low	26.8	Very low	199 Å²	199	146.3 Å²	146.3	78%	0.78	79%	0.79	S	S	*	*			trans	-156	102.4	165.2	-86.6	-78.5	0	0	0	109.8	N1317	N1317-Y1319 VanDerWaalsContact C-N 3.32Å; N1317-Y1319 PolarHBondContact O-N 3.34Å; N1317-Y1319 VanDerWaalsContact O-N 3.12Å
1320	T	32.5	Very low	26.7	Very low	149 Å²	149	148.1 Å²	148.1	91%	0.914	80%	0.799	S	S	*	*			trans	152.8	121.8	144.6	47.8	0	0	0	0	109.7
1321	G	25.5	Very low	26.5	Very low	69 Å²	69	151.8 Å²	151.8	71%	0.711	80%	0.799	S	S	*	*			trans	-78.7	166.7	-179.4	0	0	0	0	0	114.5
1322	I	29.5	Very low	26.5	Very low	174 Å²	174	154 Å²	154	89%	0.892	80%	0.803	S	S	*	*			trans	-177.7	140.8	131.5	-90	153.9	0	0	0	109.4
1323	L	25.9	Very low	26.5	Very low	154 Å²	154	156.1 Å²	156.1	81%	0.806	81%	0.809	S	S	*	*			trans	-45.9	151.1	176.2	-100.3	77.3	0	0	0	117.5
1324	S	24.8	Very low	26.9	Very low	103 Å²	103	153 Å²	153	72%	0.72	81%	0.806	S	S	*	*			trans	81	118.1	140.6	79.7	0	0	0	0	119.7
1325	I	27.4	Very low	26.9	Very low	149 Å²	149	149 Å²	149	76%	0.764	80%	0.8	S	S	*	*				178.9	95.3	128	-85.1	154	0	0	0	105.8
1326	I	26.1	Very low	27	Very low	140 Å²	140	150.9 Å²	150.9	72%	0.718	81%	0.805	S	S	*	*				72.5	101.2	109.9	-62.5	162	0	0	0	111.5
1327	R	23.5	Very low	27.1	Very low	241 Å²	241	148.3 Å²	148.3	91%	0.909	80%	0.796	S	S	*	*				58.6	69.9	75.1	-159.8	-175.3	-167.4	174.2	4.2	112.5
1328	E	27.2	Very low	27.4	Very low	179 Å²	179	152 Å²	152	84%	0.836	81%	0.807	S	S	*	*			trans	-173.2	43.5	164.7	-102.3	-113.2	148.8	0	0	116.1
1329	L	28.1	Very low	27.5	Very low	188 Å²	188	159.5 Å²	159.5	98%	0.984	83%	0.832	S	S	*	*			trans	-142.5	74.7	161.2	-77.7	178.2	0	0	0	111.2
1330	L	25.7	Very low	27.5	Very low	155 Å²	155	157.6 Å²	157.6	81%	0.812	84%	0.835	S	S	*	*			trans	-103.7	143.8	167.4	-104.8	165.6	0	0	0	108.3
1331	L	26.4	Very low	27.3	Very low	155 Å²	155	158 Å²	158	81%	0.812	83%	0.83	S	S	*	*			trans	82.3	100.9	158.4	-56.7	155.9	0	0	0	118.4
1332	K	28.7	Very low	27.4	Very low	203 Å²	203	162.9 Å²	162.9	88%	0.883	84%	0.837	S	S	*	*				-175.8	132.1	117.7	-105.8	174.4	178.9	178.1	0	113.8
1333	D	27.6	Very low	27.3	Very low	149 Å²	149	162.3 Å²	162.3	80%	0.797	83%	0.834	S	S	*	*			trans	-25.6	133.4	163.7	-56.1	-50.3	0	0	0	116.8
1334	V	32.5	Very low	27.3	Very low	135 Å²	135	162.8 Å²	162.8	82%	0.818	84%	0.836	S	S	*	*			trans	-145	96.7	137.7	-176.3	0	0	0	0	108.1
1335	G	24.9	Very low	27.5	Very low	59 Å²	59	166.8 Å²	166.8	61%	0.608	84%	0.843	S	S	*	*			trans	-74.8	165	151.5	0	0	0	0	0	110.5
1336	D	25.7	Very low	27.5	Very low	164 Å²	164	168.1 Å²	168.1	88%	0.877	85%	0.849	S	S	*	*			trans	72.5	62.4	165.7	-55.7	-18.2	0	0	0	118.2
1337	V	29	Very low	27.6	Very low	111 Å²	111	170.2 Å²	170.2	67%	0.673	86%	0.859	S	S	*	*			trans	-146.2	102.1	143.9	-164.2	0	0	0	0	109.3
1338	F	31	Very low	28	Very low	201 Å²	201	164.3 Å²	164.3	88%	0.882	86%	0.855	S	S	*	*			trans	151	106.6	136.2	-88.6	-75.6	0	0	0	109.8
1339	Q	28.9	Very low	28	Very low	273 Å²	273	163 Å²	163	100%	1.276	86%	0.856	S	S	*	*			trans	-51.3	0	172.5	-87.4	-179.6	-29.5	0	0	114.1

Retrieved 1,339 of 1,339 residues in 649.1 ms (Link to these results)

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