A0A087YMD5_POEFO Loading...

Teashirt zinc finger homeobox 1

AlphaFold DB , UniProt , Accession A0A087YMD5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,191 aa.

						>A0A087YMD5_POEFO|A0A087YMD5
MPRRKQQEPRRSAAYMPEDELKATSHDEEEHLQDDGLSLDGQDTEFLCNDEEEDADGGQPPSYRDSPLSNGTNPDAGYGSPLSDASDRLADIKSTSSRDGQEREGSAPPYRPNNGLSFQDSLAQMKAVYANLISDASWSSITMDIMKSKPAAAGSVNTAHTTPEPVSAVSVSPTTTTNKSSVVNMANSHHNGRSSTNTVNHTGNASANTNGMTTSSASSHSATSSSGSSAGGASNGSGVAYDWHQAALAKTLQQTPYHLLPEPSLFSTVQLYRQNNKLYGSVFTGASKFRCKDCSAAYDTLVGLTVHMNETGHYRDDNKDKEEDQGKRWSKPRKRSLMEMEGKEDAQKVLKCMYCGHSFESLQDLSVHMIKTKHYQKVPLKEPVPALATKLVPTSAKKRAIQDVIVSPCSPDSIHAGSGGGGSVSLGDMGKDSKATANPYVTPNNRYGYQNGASYTWQFEARKAQILKCMECGSSHDTLQQLTAHMMVTGHFLKVTNSASKKGKQLVFDPVVEEKIQSIPLPPTTTRLPVPSTVKSQPVSPALSSGSEDKREVLEDEKLEGCEPIEKKIKEEKDDASEKSETDTTSYKYLREEDLEETPKEGLDILKSLENTVSSAISKAQTGTPTWGGYPSIHAAYQLQGAIKSSATVLPPTVQSVQMQPMFNSGLRSLVSDSNSVIHSPRSPSSPTLLRSNVTAMEELVEKVTGKTATVKKEKEEKLVSLERCRPPSLVKSPSPALREQREQLPSPNDLSVGKLSGLRSISPGSVDSELICKKEPKESLLDGHSNTSKNGSEASQSPVTNGNSLGIITDHSPESPFINPLSALQSIMNTHLGKASKPVSPAADPLSMLYKISNSMMDKPAFTPTPQSKATEPVNHFQLYESNDQPIDLSKNKATTNSSTNTNSNSVLLTNNSVNGNKPLISLPESVSSPLRENALMDISDMVKNLTGRLTPKSSTPSSISEKSDADGSAFEDALEDLSPVQKRKGRQSNWNPQHLLILQAQFASSLRETPEGRYAMTDLGPQERVHICKFTGLSMTTISHWLANVKYQLRRTGGTKFLKNMDSCQPVFLCGDCASQFRTPSSYISHLESHLGFSLKDLSKLSAEHLREQQAASKVITDKMTFGSPLSALTTPEDDTGSVYQCRLCNRTFVSKHAVKLHLSKTHGKSPEDHLVFVTALEKLEKLDKMEKV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.6	Very low	33.7	Very low	241 Å²	241	197.5 Å²	197.5	100%	1.187	88%	0.882	S	S	*	*				0	163	0	-65.4	164.5	71.3	0	0	108.1
2	P	38.3	Very low	33.2	Very low	97 Å²	97	190.7 Å²	190.7	63%	0.63	88%	0.876	S	S	*	*			cis	-117.5	170.7	-15.6	39.3	-27.3	0	0	0	112.4	R4	P2-R4 HydrophobicContact CG-CB 4.36Å; P2-R4 PolarHBondContact O-N 3.13Å
3	R	33.6	Very low	32.9	Very low	261 Å²	261	183.2 Å²	183.2	99%	0.985	87%	0.868	S	S	*	*			trans	-78.8	95.5	156	-117.7	-178.1	179.3	162.5	-0.2	107.5
4	R	37.4	Very low	32.4	Very low	226 Å²	226	177.4 Å²	177.4	85%	0.853	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-93.6	146.5	168.6	-123.9	174.9	-176.4	156.6	1	109.7	P2	P2-R4 HydrophobicContact CG-CB 4.36Å; P2-R4 PolarHBondContact O-N 3.13Å
5	K	41.8	Very low	32.2	Very low	202 Å²	202	178.9 Å²	178.9	88%	0.878	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-55.4	134.5	-170.9	-54.2	169.3	-177.9	178.6	0	110.9
6	Q	32.9	Very low	31.9	Very low	196 Å²	196	178.5 Å²	178.5	92%	0.916	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-85.8	133.5	145.7	-105.8	-175.5	-12.9	0	0	108.1
7	Q	32.9	Very low	32.1	Very low	178 Å²	178	172.8 Å²	172.8	83%	0.832	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-94.2	167.5	172.6	-168.9	163.3	-34.9	0	0	108.1
8	E	30.7	Very low	32	Very low	161 Å²	161	174 Å²	174	75%	0.752	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-61.8	140	-175.5	-60.1	166.3	133.7	0	0	112.1	R10	E8-R10 PolarHBondContact O-N 3.39Å
9	P	29.7	Very low	32	Very low	133 Å²	133	173.5 Å²	173.5	86%	0.864	85%	0.846	S	S	*	*			trans	-68.9	104.5	168.6	-12.1	27.3	0	0	0	109.3
10	R	31.5	Very low	32	Very low	234 Å²	234	174.5 Å²	174.5	88%	0.883	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-77.4	145.3	163.5	-77.3	-169.7	170.5	-165.5	-4.2	109.6	E8	E8-R10 PolarHBondContact O-N 3.39Å
11	R	32	Very low	32.1	Very low	243 Å²	243	173.5 Å²	173.5	92%	0.917	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-70.7	151.8	-174.3	-66.2	175.7	175.4	169.8	-4.5	111.5
12	S	28.3	Very low	32.1	Very low	116 Å²	116	171.1 Å²	171.1	81%	0.811	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-60	131.7	160	48.2	0	0	0	0	111.4
13	A	28.6	Very low	31.6	Very low	94 Å²	94	170.3 Å²	170.3	78%	0.777	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-96.3	118.1	143.8	0	0	0	0	0	104.9
14	A	27.2	Very low	31.4	Very low	101 Å²	101	163.9 Å²	163.9	84%	0.835	82%	0.821	S	S	*	*				82.2	110.3	85.4	0	0	0	0	0	110.6
15	Y	28.1	Very low	30.9	Very low	201 Å²	201	158.3 Å²	158.3	79%	0.788	82%	0.817	S	S	*	*			trans	-112.2	134.1	173.6	-163.8	-81.2	0	0	0	106.8	P17	Y15-P17 HydrophobicContact CE1-CB 4.36Å
16	M	28	Very low	30.1	Very low	172 Å²	172	156.7 Å²	156.7	85%	0.847	81%	0.812	S	S	*	*			trans	-137.6	129.6	160.1	-84.6	-74.2	94.7	0	0	107.1
17	P	35.7	Very low	29.8	Very low	81 Å²	81	152.8 Å²	152.8	53%	0.526	80%	0.797	S	S	.	*			trans	-80.2	166	168.6	35.7	-33.1	0	0	0	110.4	Y15	Y15-P17 HydrophobicContact CE1-CB 4.36Å
18	E	30	Very low	29.6	Very low	195 Å²	195	152.8 Å²	152.8	91%	0.911	80%	0.798	S	S	*	*			trans	-121	152.3	159.1	-67.1	-169.3	151.7	0	0	108.6
19	D	32.8	Very low	29.5	Very low	164 Å²	164	153.9 Å²	153.9	88%	0.877	80%	0.802	S	S	*	*			trans	-84.7	165.6	-157.2	-67.6	-65.5	0	0	0	115.8
20	E	31.7	Very low	29.5	Very low	193 Å²	193	155.4 Å²	155.4	90%	0.902	80%	0.798	S	S	*	*			trans	-86.4	-175.8	-177.8	-140.1	-177.1	157.4	0	0	113.9
21	L	32.6	Very low	29.4	Very low	155 Å²	155	151 Å²	151	81%	0.812	79%	0.787	S	S	*	*			trans	-91.7	129	-160.4	-69.6	164.6	0	0	0	114.5
22	K	29.7	Very low	29.3	Very low	191 Å²	191	144.6 Å²	144.6	83%	0.83	77%	0.771	S	S	*	*				63.2	106.6	123.2	-168	-179.4	179.4	-176.9	0	119.7
23	A	29.6	Very low	29.3	Very low	80 Å²	80	147.1 Å²	147.1	66%	0.661	77%	0.77	S	S	*	*			trans	97.5	132.9	136.3	0	0	0	0	0	122.3
24	T	27.8	Very low	29.2	Very low	126 Å²	126	149.3 Å²	149.3	77%	0.773	77%	0.768	S	S	*	*			trans	60.1	84.6	142.8	52.7	0	0	0	0	121.5
25	S	27.3	Very low	29.2	Very low	109 Å²	109	151.8 Å²	151.8	76%	0.762	77%	0.767	S	S	*	*				56.1	122.6	116.6	64.2	0	0	0	0	123
26	H	25.6	Very low	29.3	Very low	167 Å²	167	145.8 Å²	145.8	77%	0.773	77%	0.767	S	S	*	*			trans	88.4	108	140.5	-117.6	-99.4	0	0	0	120.3
27	D	26	Very low	29.3	Very low	114 Å²	114	145.3 Å²	145.3	61%	0.61	77%	0.767	S	S	*	*				86.6	121.3	129.5	-82.2	20	0	0	0	125.5
28	E	29.8	Very low	28.9	Very low	179 Å²	179	146.5 Å²	146.5	84%	0.836	78%	0.777	S	S	*	*			trans	79.7	149.1	134.3	-51.7	-101.9	92.7	0	0	121.2
29	E	28.6	Very low	28.9	Very low	183 Å²	183	144.2 Å²	144.2	86%	0.855	77%	0.771	S	S	*	*			trans	74.6	97.6	159	-144.8	158.9	-139.6	0	0	121.6
30	E	28.3	Very low	28.6	Very low	165 Å²	165	143 Å²	143	77%	0.771	76%	0.764	S	S	*	*			trans	39.2	147.1	134.2	-137.4	-174.2	111.3	0	0	124.7
31	H	29.9	Very low	28.6	Very low	141 Å²	141	136.7 Å²	136.7	65%	0.653	75%	0.75	S	S	*	*			trans	115.4	101	132.9	-138.4	84.7	0	0	0	120.2
32	L	29.1	Very low	28.5	Very low	109 Å²	109	137.3 Å²	137.3	57%	0.571	75%	0.749	S	S	*	*			trans	55.2	152	146.3	-61.2	-172.1	0	0	0	124.2
33	Q	29	Very low	28.5	Very low	170 Å²	170	134.5 Å²	134.5	79%	0.794	74%	0.743	S	S	*	*			trans	71.7	153.6	148.2	-83.3	164.9	33.7	0	0	118
34	D	25.5	Very low	28.6	Very low	140 Å²	140	136 Å²	136	75%	0.749	74%	0.744	S	S	*	*			cis	-158.4	-174.8	-16.4	-161.2	10.2	0	0	0	110.1
35	D	27.8	Very low	28.6	Very low	152 Å²	152	138.2 Å²	138.2	81%	0.813	75%	0.746	S	S	*	*			trans	-20.1	140.2	168.6	-95.8	-22.6	0	0	0	119.5
36	G	30.2	Very low	28.6	Very low	75 Å²	75	142.2 Å²	142.2	77%	0.773	75%	0.75	S	S	*	*			trans	-169.6	122.8	167.5	0	0	0	0	0	114.6
37	L	27.7	Very low	28.8	Very low	162 Å²	162	142 Å²	142	85%	0.848	75%	0.754	S	S	*	*			trans	-119.1	160	-176.2	-66.6	170	0	0	0	112.6
38	S	27.5	Very low	28.6	Very low	107 Å²	107	141.7 Å²	141.7	75%	0.748	76%	0.759	S	S	*	*			trans	72.4	160.9	155.7	-56.7	0	0	0	0	117
39	L	29.6	Very low	28.5	Very low	147 Å²	147	139.6 Å²	139.6	77%	0.77	75%	0.753	S	S	*	*			cis	-157	149.7	-10.9	-142.7	78.5	0	0	0	110.8
40	D	27	Very low	28.6	Very low	139 Å²	139	136.5 Å²	136.5	74%	0.743	74%	0.743	S	S	*	*			trans	53.8	173.2	143.4	-125	98.4	0	0	0	123.8
41	G	32.8	Very low	28.9	Very low	59 Å²	59	136.9 Å²	136.9	61%	0.608	74%	0.744	S	S	*	*			trans	92.4	117.5	-177.5	0	0	0	0	0	113.3
42	Q	30.6	Very low	29.3	Very low	168 Å²	168	139.1 Å²	139.1	79%	0.785	76%	0.755	S	S	*	*			cis	60.8	127.3	42.9	-57.7	-176.5	10.7	0	0	113
43	D	28.4	Very low	29.5	Very low	133 Å²	133	142.8 Å²	142.8	71%	0.711	77%	0.77	S	S	*	*			cis	-162.9	-152.6	-3.7	-121.6	-37.3	0	0	0	109.2
44	T	31.5	Very low	29.7	Very low	112 Å²	112	142.1 Å²	142.1	69%	0.687	77%	0.771	S	S	*	*			trans	89.8	109.7	150	55.3	0	0	0	0	123.1
45	E	29.3	Very low	30	Very low	171 Å²	171	139.6 Å²	139.6	80%	0.799	77%	0.77	S	S	*	*			trans	36.2	119.6	133.2	35.4	-167.2	172.1	0	0	122.7
46	F	27	Very low	29.9	Very low	194 Å²	194	140.5 Å²	140.5	85%	0.851	78%	0.775	S	S	*	*				91.9	109.5	70	-117.3	-79.1	0	0	0	114.9
47	L	28.6	Very low	30	Very low	163 Å²	163	140 Å²	140	85%	0.853	77%	0.77	S	S	*	*				169.6	176	125.5	-91	165.4	0	0	0	113.2
48	C	22.3	Very low	29.9	Very low	106 Å²	106	136 Å²	136	72%	0.716	77%	0.768	S	S	*	*			trans	-124.5	-172.7	-161.7	-58.5	0	0	0	0	114.2
49	N	27.8	Very low	30	Very low	135 Å²	135	139.7 Å²	139.7	72%	0.722	77%	0.773	S	S	*	*			trans	86.7	148.5	165.1	-55.6	54.7	0	0	0	116.9
50	D	31.2	Very low	31.1	Very low	118 Å²	118	137.2 Å²	137.2	63%	0.631	77%	0.766	S	S	*	*			cis	-167.5	166.2	-27	-94.1	-29	0	0	0	109.5
51	E	33.5	Very low	31.9	Very low	173 Å²	173	136.6 Å²	136.6	81%	0.808	77%	0.769	S	S	*	*			trans	33.3	118.1	149.6	-59.7	166.8	141.9	0	0	119.6
52	E	38.5	Very low	31.7	Very low	188 Å²	188	138.5 Å²	138.5	88%	0.879	77%	0.773	S	S	*	*				78.1	104.2	59.4	-169.9	174	-168.3	0	0	116.2
53	E	34.2	Very low	31.5	Very low	187 Å²	187	139.9 Å²	139.9	87%	0.874	77%	0.773	S	S	*	*			trans	-167	119.7	155.3	-118	-170.1	78.2	0	0	116
54	D	32.8	Very low	31.7	Very low	155 Å²	155	141.7 Å²	141.7	83%	0.829	77%	0.77	S	S	*	*			trans	57.9	169.2	130.4	-106.9	-60.5	0	0	0	129.9
55	A	31.5	Very low	31.4	Very low	87 Å²	87	142 Å²	142	72%	0.719	77%	0.767	S	S	*	*			trans	83.9	115.4	175.5	0	0	0	0	0	118.5
56	D	26.7	Very low	31.4	Very low	171 Å²	171	139.4 Å²	139.4	91%	0.914	77%	0.768	S	S	*	*				81.9	135.7	59.1	-168.4	62.2	0	0	0	114.2
57	G	30.6	Very low	32.6	Very low	65 Å²	65	135.1 Å²	135.1	67%	0.67	76%	0.759	S	S	*	*			cis	167.7	158.9	-7.6	0	0	0	0	0	111.5
58	G	25.8	Very low	32.5	Very low	78 Å²	78	134.8 Å²	134.8	80%	0.804	76%	0.758	S	S	*	*			trans	175.4	87.7	179.2	0	0	0	0	0	123.4
59	Q	30.2	Very low	32.7	Very low	184 Å²	184	134 Å²	134	86%	0.86	75%	0.753	S	S	*	*			trans	59.2	162.2	137.7	-75.9	-67.6	-82	0	0	122.6
60	P	53.6	Low	32.7	Very low	96 Å²	96	135.3 Å²	135.3	62%	0.623	76%	0.76	S	S	*	*			trans	-129.4	178.2	-136.7	47.2	-33.5	0	0	0	116.3
61	P	42.3	Very low	32.5	Very low	125 Å²	125	133.1 Å²	133.1	81%	0.812	77%	0.765	S	S	*	*				-150.2	-174.8	95.9	39.5	-22.6	0	0	0	114.7
62	S	28.9	Very low	32.4	Very low	99 Å²	99	131.7 Å²	131.7	69%	0.692	77%	0.769	S	S	*	*			cis	-175.4	154.8	-45.4	-170.9	0	0	0	0	110.5
63	Y	27.7	Very low	31.8	Very low	198 Å²	198	129.7 Å²	129.7	78%	0.776	76%	0.764	S	S	*	*			trans	64.2	141.7	172	-100.7	-128.6	0	0	0	118.7
64	R	30.9	Very low	32.4	Very low	171 Å²	171	126.1 Å²	126.1	65%	0.645	76%	0.757	S	S	*	*			cis	-166.3	162	-24.8	-128.5	-167.1	-172.4	-100.1	5.2	112.6
65	D	25.3	Very low	32	Very low	119 Å²	119	125.8 Å²	125.8	64%	0.636	76%	0.755	S	S	*	*			trans	69.1	126.4	151.5	-63	-9.5	0	0	0	123.7
66	S	30.4	Very low	32.1	Very low	115 Å²	115	125.7 Å²	125.7	80%	0.804	75%	0.754	S	S	*	*			trans	-104.9	-143.7	157.5	-49.8	0	0	0	0	107.4
67	P	51.8	Low	32.1	Very low	104 Å²	104	121 Å²	121	68%	0.675	75%	0.746	S	S	*	*			cis	-144.6	-165.5	-2	40	-16.5	0	0	0	116.3
68	L	26.3	Very low	31.9	Very low	157 Å²	157	124.9 Å²	124.9	82%	0.822	74%	0.742	S	S	*	*			trans	73.3	151.7	156.7	-64.1	172.4	0	0	0	119
69	S	27.7	Very low	32	Very low	89 Å²	89	122.7 Å²	122.7	62%	0.622	72%	0.719	S	S	*	*			cis	-168.1	164.2	-12.6	49.2	0	0	0	0	115.1
70	N	26	Very low	32.3	Very low	163 Å²	163	117.8 Å²	117.8	87%	0.872	71%	0.705	S	S	*	*			trans	69.7	134.2	149.3	-74.1	16.5	0	0	0	124.4
71	G	28.2	Very low	31.7	Very low	71 Å²	71	117.1 Å²	117.1	73%	0.732	70%	0.701	S	S	*	*			trans	90.6	150.1	151.1	0	0	0	0	0	117.3
72	T	30.1	Very low	31.1	Very low	144 Å²	144	119 Å²	119	88%	0.883	70%	0.703	S	S	*	*			cis	-159	160.3	-9.8	-44.7	0	0	0	0	109
73	N	27	Very low	31.2	Very low	145 Å²	145	120.2 Å²	120.2	78%	0.775	71%	0.712	S	S	*	*			trans	-70.1	171	163.1	-128.7	5	0	0	0	110.3
74	P	45.9	Very low	31.1	Very low	113 Å²	113	118 Å²	118	73%	0.734	71%	0.714	S	S	*	*			cis	-143.2	174.6	24.4	43.6	-23.4	0	0	0	119.3
75	D	25.3	Very low	30.9	Very low	148 Å²	148	114 Å²	114	79%	0.791	72%	0.717	S	S	*	*			trans	2.2	159.5	146.4	-159.5	27.1	0	0	0	124.7
76	A	32.5	Very low	31.1	Very low	84 Å²	84	113.3 Å²	113.3	69%	0.694	72%	0.722	S	S	*	*			trans	80.7	123.6	149.1	0	0	0	0	0	123.5
77	G	27.5	Very low	31.2	Very low	72 Å²	72	113.2 Å²	113.2	74%	0.742	71%	0.712	S	S	*	*			trans	90.3	155.6	153.7	0	0	0	0	0	117
78	Y	27.2	Very low	30.1	Very low	147 Å²	147	114.8 Å²	114.8	58%	0.576	70%	0.704	S	S	*	*			cis	-160.2	160.2	-10.8	-140.6	-86.7	0	0	0	108.4	T688 L689 L690	Y78-T688 VanDerWaalsContact O-CB 3.27Å; Y78-T688 WeakPolarHBondContact O-CB 3.47Å; Y78-T688 WeakPolarHBondContact O-CG2 3.38Å; Y78-L689 HydrophobicContact CD1-CD2 3.45Å; Y78-L689 VanDerWaalsContact CD1-CD2 3.45Å; Y78-L689 HydrophobicContact CE1-CD2 4.31Å; Y78-L689 HydrophobicContact CG-CD2 3.91Å; Y78-L690 HydrophobicContact CD1-CD1 3.85Å; Y78-L690 HydrophobicContact CE1-CD1 4.18Å
79	G	27.4	Very low	30.5	Very low	32 Å²	32	113.3 Å²	113.3	33%	0.33	70%	0.697	S	S	.	*			trans	-78.1	-176.1	-163.6	0	0	0	0	0	119.4	T688 L689 L690	G79-T688 WeakPolarHBondContact O-CB 3.35Å; G79-T688 VanDerWaalsContact O-CG2 3.32Å; G79-T688 WeakPolarHBondContact O-CG2 3.16Å; G79-L689 VanDerWaalsContact O-CA 3.25Å; G79-L689 WeakPolarHBondContact O-CA 3.47Å; G79-L690 VanDerWaalsContact CA-CD1 3.5Å; G79-L690 WeakPolarHBondContact O-CD1 3.24Å
80	S	36	Very low	30.7	Very low	81 Å²	81	113.2 Å²	113.2	57%	0.566	70%	0.701	S	S	*	*			trans	-57.8	174.9	-163.8	-38.9	0	0	0	0	119.8	L689 L690	S80-L689 CarbonylContact O-C 3.28Å; S80-L689 VanDerWaalsContact O-C 3.28Å; S80-L690 PolarHBondContact O-N 3.34Å
81	P	40.8	Very low	30.8	Very low	83 Å²	83	112.6 Å²	112.6	54%	0.539	70%	0.698	S	S	.	*				-126.9	-178.8	129	41.4	-33.8	0	0	0	112.9	T688	P81-T688 VanDerWaalsContact CD-CA 3.48Å
82	L	29.6	Very low	31.2	Very low	163 Å²	163	116.1 Å²	116.1	85%	0.853	70%	0.698	S	S	*	*			trans	-124.3	154.6	-179.5	-64	166.6	0	0	0	110.2
83	S	32	Very low	31.3	Very low	125 Å²	125	118.3 Å²	118.3	87%	0.874	70%	0.696	S	S	*	*			trans	170.8	161.6	141.7	-75.2	0	0	0	0	109.2
84	D	25.7	Very low	32.2	Very low	153 Å²	153	116.5 Å²	116.5	82%	0.818	70%	0.695	S	S	*	*			cis	-174	170.6	-36.9	-174.8	25.1	0	0	0	106.1
85	A	26.6	Very low	31.3	Very low	87 Å²	87	117.9 Å²	117.9	72%	0.719	70%	0.701	S	S	*	*			trans	67.6	151.2	170.8	0	0	0	0	0	117.7
86	S	29.7	Very low	31.5	Very low	104 Å²	104	116.3 Å²	116.3	73%	0.727	70%	0.701	S	S	*	*			cis	-161.7	170.6	-24.1	-167.5	0	0	0	0	110.7
87	D	32.5	Very low	31.1	Very low	113 Å²	113	117.8 Å²	117.8	60%	0.604	71%	0.707	S	S	*	*			trans	-58.1	143.6	-172.6	-76.8	-55.4	0	0	0	118	F118	D87-F118 HydrophobicContact CB-CB 3.64Å; D87-F118 HydrophobicContact CB-CD2 3.95Å; D87-F118 HydrophobicContact CB-CG 4.07Å
88	R	29	Very low	31.2	Very low	136 Å²	136	123.4 Å²	123.4	51%	0.513	71%	0.706	S	S	.	*				-158.9	132.8	115.1	-105.2	-89.1	145.9	174	-27.1	115	L116 S117 F118	R88-L116 PolarHBondContact NH1-O 3.43Å; R88-S117 VanDerWaalsContact CZ-O 3.28Å; R88-S117 VanDerWaalsContact NE-C 3.3Å; R88-S117 VanDerWaalsContact NH2-C 3.26Å; R88-S117 PolarHBondContact NH2-O 3.41Å; R88-F118 HydrophobicContact CB-CD2 4.33Å; R88-F118 HydrophobicContact CG-CB 4.19Å; R88-F118 HydrophobicContact CG-CD2 3.69Å; R88-F118 HydrophobicContact CG-CG 4.4Å; R88-F118 VanDerWaalsContact NH2-CD2 3.32Å
89	L	34.2	Very low	31.2	Very low	126 Å²	126	124.2 Å²	124.2	66%	0.66	72%	0.72	S	S	*	*			trans	-81.4	151.4	166.7	-50.5	172.8	0	0	0	111.3	F118	L89-F118 HydrophobicContact CB-CE2 3.87Å; L89-F118 HydrophobicContact CB-CZ 4.49Å; L89-F118 HydrophobicContact CD1-CE2 3.97Å; L89-F118 HydrophobicContact CD1-CZ 3.88Å; L89-F118 HydrophobicContact CG-CE2 3.74Å; L89-F118 HydrophobicContact CG-CZ 4.19Å
90	A	31.5	Very low	31.5	Very low	87 Å²	87	125.1 Å²	125.1	72%	0.719	73%	0.729	S	S	*	*				168.8	128.7	117.4	0	0	0	0	0	114.8
91	D	27.7	Very low	31.2	Very low	150 Å²	150	127.4 Å²	127.4	80%	0.802	73%	0.731	S	S	*	*			trans	53.9	97.1	136.5	-55.3	-18.3	0	0	0	124.2
92	I	37.3	Very low	30.6	Very low	145 Å²	145	129.5 Å²	129.5	74%	0.744	73%	0.734	S	S	*	*			trans	-19.2	127.7	135.2	44.9	158.3	0	0	0	119.6
93	K	31.8	Very low	30.8	Very low	191 Å²	191	130.4 Å²	130.4	83%	0.83	73%	0.725	S	S	*	*				177.3	123.7	119.2	-95.5	168.1	178.9	176.3	0	109.4
94	S	45.9	Very low	30.6	Very low	107 Å²	107	131.3 Å²	131.3	75%	0.748	72%	0.716	S	S	*	*				88	109	53.1	-63.2	0	0	0	0	114.2
95	T	26.7	Very low	30.7	Very low	142 Å²	142	126.4 Å²	126.4	87%	0.871	70%	0.702	S	S	*	*			trans	-152	165.1	161.5	49.7	0	0	0	0	108.8
96	S	30.6	Very low	30.6	Very low	114 Å²	114	127.9 Å²	127.9	80%	0.797	71%	0.707	S	S	*	*			cis	167.7	132.7	-33.9	179.7	0	0	0	0	106.7
97	S	24	Very low	30.6	Very low	115 Å²	115	127.6 Å²	127.6	80%	0.804	71%	0.711	S	S	*	*			trans	-173.4	140	167	-167.9	0	0	0	0	109.5
98	R	28.9	Very low	31	Very low	191 Å²	191	128 Å²	128	72%	0.721	72%	0.719	S	S	*	*			cis	-169.4	141	-19.6	159.5	179.8	169.3	-170.1	-1.7	106.3
99	D	28.5	Very low	31.7	Very low	163 Å²	163	126.2 Å²	126.2	87%	0.872	73%	0.725	S	S	*	*			trans	-147.3	164.1	141.2	-138.6	-34.7	0	0	0	110.4
100	G	32.9	Very low	31.3	Very low	51 Å²	51	131 Å²	131	53%	0.526	74%	0.736	S	S	.	*			trans	-125.5	-156.8	-171.9	0	0	0	0	0	113.7
101	Q	30.5	Very low	31.5	Very low	130 Å²	130	136.7 Å²	136.7	61%	0.607	74%	0.739	S	S	*	*			cis	-166.3	155.5	-10.9	-122.8	178.1	-97.3	0	0	106.7
102	E	27.3	Very low	31.8	Very low	127 Å²	127	135.3 Å²	135.3	59%	0.593	74%	0.738	S	S	*	*			cis	-111.6	-111	3.4	-52.4	-165.5	106	0	0	109.6
103	R	34.2	Very low	31.6	Very low	181 Å²	181	134.7 Å²	134.7	68%	0.683	74%	0.737	S	S	*	*			cis	-157.9	165.5	-39.4	-126.8	176	-133.6	-84.4	-7.6	104.9
104	E	26.7	Very low	31.7	Very low	144 Å²	144	130.8 Å²	130.8	67%	0.673	73%	0.725	S	S	*	*			cis	-156.8	150.6	-1.4	-171.3	66	-79.8	0	0	104.8
105	G	28.2	Very low	31.4	Very low	51 Å²	51	128.1 Å²	128.1	53%	0.526	71%	0.714	S	S	.	*			cis	174.2	-139.6	1.5	0	0	0	0	0	111.2
106	S	25.3	Very low	31.8	Very low	118 Å²	118	128.4 Å²	128.4	83%	0.825	71%	0.71	S	S	*	*			trans	35	80.9	169.4	69.1	0	0	0	0	120.2
107	A	28.4	Very low	32.3	Very low	98 Å²	98	127.3 Å²	127.3	81%	0.81	70%	0.702	S	S	*	*				88.1	151.7	128.5	0	0	0	0	0	122.1
108	P	41.3	Very low	33.2	Very low	120 Å²	120	124.7 Å²	124.7	78%	0.779	68%	0.676	S	S	*	*			trans	-131.6	-147.9	-153.1	41.9	-19	0	0	0	112.2
109	P	43.1	Very low	34.1	Very low	99 Å²	99	124.1 Å²	124.1	64%	0.643	68%	0.682	S	S	*	*			cis	-142.7	-169.5	-3.2	26.8	1.6	0	0	0	118.3
110	Y	26.5	Very low	35.6	Very low	227 Å²	227	121.3 Å²	121.3	89%	0.89	67%	0.667	S	S	*	*			trans	93.2	146.4	160.4	-74.8	-79	0	0	0	122.9
111	R	36.5	Very low	36.9	Very low	206 Å²	206	121.2 Å²	121.2	78%	0.777	66%	0.658	S	S	*	*			trans	-163.9	146.2	176.6	-168.6	-132.4	-88.8	-155.5	-5.4	112.5
112	P	33.6	Very low	38.5	Very low	121 Å²	121	120.4 Å²	120.4	79%	0.786	66%	0.657	S	S	*	*			trans	-143.2	-163.8	135.4	33.9	-14.3	0	0	0	115.2
113	N	32.4	Very low	40.2	Very low	132 Å²	132	116.9 Å²	116.9	71%	0.706	65%	0.65	S	S	*	*			trans	-104	-167.8	-169.5	-59.5	1.2	0	0	0	113
114	N	34.9	Very low	41.6	Very low	110 Å²	110	114 Å²	114	59%	0.588	64%	0.644	S	S	*	*			cis	-160.1	-173.1	22.3	-172.2	28.8	0	0	0	112.7	S676	N114-S676 PolarHBondContact ND2-OG 3.42Å
115	G	38.8	Very low	43.6	Very low	51 Å²	51	112.9 Å²	112.9	53%	0.526	64%	0.64	S	S	.	*			trans	-150	-173.3	-178.2	0	0	0	0	0	118.6
116	L	35.9	Very low	45.4	Very low	148 Å²	148	117.4 Å²	117.4	78%	0.775	65%	0.646	S	S	*	*			trans	-149.7	170.1	-168.7	-74	178.1	0	0	0	117.7	R88	R88-L116 PolarHBondContact NH1-O 3.43Å
117	S	39.6	Very low	47.4	Very low	90 Å²	90	114 Å²	114	63%	0.629	63%	0.625	S	S	*	*			trans	93.1	83.3	149.5	73.1	0	0	0	0	125	R88 Q119	R88-S117 VanDerWaalsContact CZ-O 3.28Å; R88-S117 VanDerWaalsContact NE-C 3.3Å; R88-S117 VanDerWaalsContact NH2-C 3.26Å; R88-S117 PolarHBondContact NH2-O 3.41Å; S117-Q119 VanDerWaalsContact C-N 3.34Å; S117-Q119 PolarHBondContact O-N 3.43Å
118	F	44.3	Very low	49.3	Very low	61 Å²	61	113.6 Å²	113.6	27%	0.268	61%	0.612	S	S	.	*			trans	-29.1	-50.9	151.9	-76.3	-63.1	0	0	0	119.1	D87 R88 L89 D120	D87-F118 HydrophobicContact CB-CB 3.64Å; D87-F118 HydrophobicContact CB-CD2 3.95Å; D87-F118 HydrophobicContact CB-CG 4.07Å; R88-F118 HydrophobicContact CB-CD2 4.33Å; R88-F118 HydrophobicContact CG-CB 4.19Å; R88-F118 HydrophobicContact CG-CD2 3.69Å; R88-F118 HydrophobicContact CG-CG 4.4Å; R88-F118 VanDerWaalsContact NH2-CD2 3.32Å; L89-F118 HydrophobicContact CB-CE2 3.87Å; L89-F118 HydrophobicContact CB-CZ 4.49Å; L89-F118 HydrophobicContact CD1-CE2 3.97Å; L89-F118 HydrophobicContact CD1-CZ 3.88Å; L89-F118 HydrophobicContact CG-CE2 3.74Å; L89-F118 HydrophobicContact CG-CZ 4.19Å; F118-D120 PolarHBondContact O-N 3.25Å; F118-D120 VanDerWaalsContact O-N 3.15Å
119	Q	46.7	Very low	50.2	Low	178 Å²	178	114.8 Å²	114.8	83%	0.832	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn		-88.9	-5.4	-126	-145.1	143.7	20.2	0	0	115.9	S117	S117-Q119 VanDerWaalsContact C-N 3.34Å; S117-Q119 PolarHBondContact O-N 3.43Å
120	D	60.4	Low	51.2	Low	105 Å²	105	112.3 Å²	112.3	56%	0.561	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-25.3	-175.6	-158	13.6	0	0	0	113.3	F118 L122 A123 Q124	F118-D120 PolarHBondContact O-N 3.25Å; F118-D120 VanDerWaalsContact O-N 3.15Å; D120-L122 PolarHBondContact O-N 3.15Å; D120-L122 VanDerWaalsContact O-N 3.07Å; D120-A123 PolarHBondContact O-N 3.11Å; D120-Q124 WeakPolarHBondContact O-CB 3.34Å; D120-Q124 PolarHBondContact O-N 3.49Å
121	S	59.6	Low	53	Low	49 Å²	49	106.5 Å²	106.5	34%	0.343	57%	0.574	S	S	.	*	H	α-helix	trans	-59.7	-30.5	-172.2	-55.3	0	0	0	0	114.2	M125	S121-M125 WeakPolarHBondContact O-CB 3.48Å; S121-M125 PolarHBondContact O-N 2.92Å
122	L	65.2	Low	54.3	Low	112 Å²	112	101.4 Å²	101.4	59%	0.586	56%	0.562	S	S	*	*	H	α-helix	trans	-81.3	-31.7	177.5	-157.6	153.8	0	0	0	112	D120 K126	D120-L122 PolarHBondContact O-N 3.15Å; D120-L122 VanDerWaalsContact O-N 3.07Å; L122-K126 HydrophobicContact CD2-CD 3.86Å; L122-K126 VanDerWaalsContact CD2-CE 3.45Å; L122-K126 HydrophobicContact CD2-CG 4.33Å; L122-K126 WeakPolarHBondContact O-CB 3.32Å; L122-K126 WeakPolarHBondContact O-CG 3.36Å; L122-K126 PolarHBondContact O-N 3.36Å
123	A	62.3	Low	55.6	Low	54 Å²	54	101.6 Å²	101.6	45%	0.446	56%	0.555	S	S	.	*	H	α-helix	trans	-69.3	-46.1	171.1	0	0	0	0	0	110.6	D120 K126 A127	D120-A123 PolarHBondContact O-N 3.11Å; A123-K126 CarbonylContact O-C 3.59Å; A123-K126 PolarHBondContact O-N 3.18Å; A123-A127 WeakPolarHBondContact O-CB 3.47Å; A123-A127 PolarHBondContact O-N 3.38Å
124	Q	63.1	Low	56.6	Low	120 Å²	120	99.8 Å²	99.8	56%	0.561	55%	0.553	S	S	*	*	H	α-helix	trans	-61.6	-42.2	174.4	-167.1	175.1	65.4	0	0	112	D120 A127 V128	D120-Q124 WeakPolarHBondContact O-CB 3.34Å; D120-Q124 PolarHBondContact O-N 3.49Å; Q124-A127 PolarHBondContact O-N 3.18Å; Q124-V128 WeakPolarHBondContact O-CG2 3.47Å; Q124-V128 PolarHBondContact O-N 3.34Å
125	M	69.8	Low	57.2	Low	120 Å²	120	98.6 Å²	98.6	59%	0.591	55%	0.546	S	S	*	.	H	α-helix	trans	-66.7	-37.1	174.6	-170.8	-176.5	-59.8	0	0	112.5	S121 V128 Y129	S121-M125 WeakPolarHBondContact O-CB 3.48Å; S121-M125 PolarHBondContact O-N 2.92Å; M125-V128 PolarHBondContact O-N 3.34Å; M125-Y129 HydrophobicContact CG-CD2 4.35Å; M125-Y129 PolarHBondContact O-N 3.34Å
126	K	66.1	Low	57.8	Low	146 Å²	146	99.7 Å²	99.7	64%	0.635	55%	0.551	S	S	*	*	H	α-helix	trans	-65.5	-37.2	170.5	-80.6	174.9	176.2	169.8	0	112.2	L122 A123 Y129 A130	L122-K126 HydrophobicContact CD2-CD 3.86Å; L122-K126 VanDerWaalsContact CD2-CE 3.45Å; L122-K126 HydrophobicContact CD2-CG 4.33Å; L122-K126 WeakPolarHBondContact O-CB 3.32Å; L122-K126 WeakPolarHBondContact O-CG 3.36Å; L122-K126 PolarHBondContact O-N 3.36Å; A123-K126 CarbonylContact O-C 3.59Å; A123-K126 PolarHBondContact O-N 3.18Å; K126-Y129 PolarHBondContact O-N 2.8Å; K126-A130 WeakPolarHBondContact O-CB 3.45Å; K126-A130 PolarHBondContact O-N 2.85Å
127	A	66.9	Low	58.8	Low	47 Å²	47	96.8 Å²	96.8	39%	0.388	54%	0.542	S	S	.	.	H	α-helix	trans	-68.9	-38.1	175	0	0	0	0	0	112	A123 Q124 A130 N131	A123-A127 WeakPolarHBondContact O-CB 3.47Å; A123-A127 PolarHBondContact O-N 3.38Å; Q124-A127 PolarHBondContact O-N 3.18Å; A127-A130 PolarHBondContact O-N 3.35Å; A127-N131 WeakPolarHBondContact O-CB 3.37Å; A127-N131 VanDerWaalsContact O-CG 3.27Å; A127-N131 PolarHBondContact O-N 2.72Å
128	V	68.7	Low	59.1	Low	90 Å²	90	100.4 Å²	100.4	55%	0.545	54%	0.542	S	S	.	.	H	α-helix	trans	-64.2	-44.7	172.5	168.2	0	0	0	0	111.1	Q124 M125 N131 L132	Q124-V128 WeakPolarHBondContact O-CG2 3.47Å; Q124-V128 PolarHBondContact O-N 3.34Å; M125-V128 PolarHBondContact O-N 3.34Å; V128-N131 PolarHBondContact O-N 2.95Å; V128-L132 VanDerWaalsContact O-CB 3.29Å; V128-L132 WeakPolarHBondContact O-CB 3.16Å; V128-L132 PolarHBondContact O-N 2.7Å
129	Y	60.1	Low	59.3	Low	145 Å²	145	101.3 Å²	101.3	57%	0.569	56%	0.556	S	S	*	*	H	α-helix	trans	-65.5	-39.7	172.9	-97	-79	0	0	0	112.6	M125 K126 N131 L132 I133	M125-Y129 HydrophobicContact CG-CD2 4.35Å; M125-Y129 PolarHBondContact O-N 3.34Å; K126-Y129 PolarHBondContact O-N 2.8Å; Y129-N131 VanDerWaalsContact C-N 3.35Å; Y129-L132 PolarHBondContact O-N 3.1Å; Y129-I133 HydrophobicContact CD1-CD1 4.26Å; Y129-I133 WeakPolarHBondContact O-CB 3.45Å; Y129-I133 WeakPolarHBondContact O-CD1 3.26Å; Y129-I133 WeakPolarHBondContact O-CG1 3.41Å; Y129-I133 PolarHBondContact O-N 3.3Å
130	A	64.8	Low	59.3	Low	47 Å²	47	96.3 Å²	96.3	39%	0.388	54%	0.541	S	S	.	.	H	α-helix	trans	-63	-41.4	176.2	0	0	0	0	0	111.4	K126 A127 I133 S134	K126-A130 WeakPolarHBondContact O-CB 3.45Å; K126-A130 PolarHBondContact O-N 2.85Å; A127-A130 PolarHBondContact O-N 3.35Å; A130-I133 PolarHBondContact O-N 3.22Å; A130-S134 WeakPolarHBondContact O-CB 3.35Å; A130-S134 PolarHBondContact O-N 3.14Å; A130-S134 PolarHBondContact O-OG 3.16Å
131	N	62.6	Low	58.8	Low	105 Å²	105	95.6 Å²	95.6	56%	0.561	54%	0.536	S	S	*	.	H	α-helix	trans	-66.1	-47.4	173.6	-72.4	-9.8	0	0	0	111.3	A127 V128 Y129 I133 S134 D135	A127-N131 WeakPolarHBondContact O-CB 3.37Å; A127-N131 VanDerWaalsContact O-CG 3.27Å; A127-N131 PolarHBondContact O-N 2.72Å; V128-N131 PolarHBondContact O-N 2.95Å; Y129-N131 VanDerWaalsContact C-N 3.35Å; N131-I133 PolarHBondContact O-N 2.98Å; N131-I133 VanDerWaalsContact O-N 3.16Å; N131-S134 CarbonylContact O-C 3.56Å; N131-S134 PolarHBondContact O-N 3.06Å; N131-D135 PolarHBondContact O-N 2.86Å
132	L	65.1	Low	58.1	Low	98 Å²	98	97.3 Å²	97.3	51%	0.513	55%	0.545	S	S	.	.	H	α-helix	trans	-61.6	-25.7	178.8	-168.3	70.7	0	0	0	113.7	V128 Y129	V128-L132 VanDerWaalsContact O-CB 3.29Å; V128-L132 WeakPolarHBondContact O-CB 3.16Å; V128-L132 PolarHBondContact O-N 2.7Å; Y129-L132 PolarHBondContact O-N 3.1Å
133	I	60.8	Low	57.5	Low	126 Å²	126	98.6 Å²	98.6	65%	0.646	55%	0.549	S	S	*	.	H	α-helix	trans	-92.2	-25.8	175.9	-64.9	166.1	0	0	0	111.7	Y129 A130 N131	Y129-I133 HydrophobicContact CD1-CD1 4.26Å; Y129-I133 WeakPolarHBondContact O-CB 3.45Å; Y129-I133 WeakPolarHBondContact O-CD1 3.26Å; Y129-I133 WeakPolarHBondContact O-CG1 3.41Å; Y129-I133 PolarHBondContact O-N 3.3Å; A130-I133 PolarHBondContact O-N 3.22Å; N131-I133 PolarHBondContact O-N 2.98Å; N131-I133 VanDerWaalsContact O-N 3.16Å
134	S	53.5	Low	56.8	Low	93 Å²	93	101 Å²	101	65%	0.65	56%	0.555	S	S	*	*	H	α-helix	trans	-91.4	-9.9	176.7	-53.1	0	0	0	0	113.4	A130 N131 A136	A130-S134 WeakPolarHBondContact O-CB 3.35Å; A130-S134 PolarHBondContact O-N 3.14Å; A130-S134 PolarHBondContact O-OG 3.16Å; N131-S134 CarbonylContact O-C 3.56Å; N131-S134 PolarHBondContact O-N 3.06Å; S134-A136 PolarHBondContact O-N 3.06Å; S134-A136 VanDerWaalsContact O-N 3.1Å
135	D	47.3	Very low	56.3	Low	85 Å²	85	101.5 Å²	101.5	46%	0.455	56%	0.56	S	S	.	*			trans	-58.2	111.9	170.1	-87.8	-31.6	0	0	0	109.2	N131 S137	N131-D135 PolarHBondContact O-N 2.86Å; D135-S137 PolarHBondContact O-N 3.27Å
136	A	52.1	Low	55.2	Low	75 Å²	75	103.2 Å²	103.2	62%	0.62	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-5.1	-173.1	0	0	0	0	0	114.6	S134 W138 S139	S134-A136 PolarHBondContact O-N 3.06Å; S134-A136 VanDerWaalsContact O-N 3.1Å; A136-W138 PolarHBondContact O-N 2.64Å; A136-S139 VanDerWaalsContact O-CB 3.31Å; A136-S139 WeakPolarHBondContact O-CB 3.23Å; A136-S139 PolarHBondContact O-N 2.9Å; A136-S139 PolarHBondContact O-OG 3.23Å
137	S	55.1	Low	54.2	Low	86 Å²	86	105.2 Å²	105.2	60%	0.601	58%	0.577	S	S	*	*	H	α-helix	trans	-46.8	-38.7	172.2	-53.2	0	0	0	0	113.6	D135 S139 S140	D135-S137 PolarHBondContact O-N 3.27Å; S137-S139 VanDerWaalsContact C-N 3.28Å; S137-S139 PolarHBondContact O-N 3.32Å; S137-S140 PolarHBondContact O-N 3.2Å
138	W	46.4	Very low	52.7	Low	166 Å²	166	107.4 Å²	107.4	63%	0.629	59%	0.589	S	S	*	*	H	α-helix	trans	-73.8	-16.2	-179.5	-66.3	103.5	0	0	0	114.1	A136 I141 T142	A136-W138 PolarHBondContact O-N 2.64Å; W138-I141 HydrophobicContact CZ3-CD1 4.46Å; W138-T142 PolarHBondContact O-OG1 2.91Å; W138-T142 VanDerWaalsContact O-OG1 3.1Å
139	S	48.5	Very low	51.1	Low	80 Å²	80	112.8 Å²	112.8	56%	0.559	61%	0.606	S	S	*	*	H	α-helix	trans	-73.8	-23.7	175.5	-54.3	0	0	0	0	113.2	A136 S137	A136-S139 VanDerWaalsContact O-CB 3.31Å; A136-S139 WeakPolarHBondContact O-CB 3.23Å; A136-S139 PolarHBondContact O-N 2.9Å; A136-S139 PolarHBondContact O-OG 3.23Å; S137-S139 VanDerWaalsContact C-N 3.28Å; S137-S139 PolarHBondContact O-N 3.32Å
140	S	48	Very low	50.5	Low	73 Å²	73	111.7 Å²	111.7	51%	0.51	62%	0.616	S	S	.	*	H	α-helix	trans	-76.1	-50.7	-179.7	-162.1	0	0	0	0	112.5	S137 T142 M143 D144	S137-S140 PolarHBondContact O-N 3.2Å; S140-T142 PolarHBondContact O-N 2.79Å; S140-T142 VanDerWaalsContact O-N 3.14Å; S140-M143 WeakPolarHBondContact O-CB 3.37Å; S140-M143 PolarHBondContact O-N 2.99Å; S140-D144 PolarHBondContact O-N 3.36Å; S140-D144 VanDerWaalsContact O-N 3.1Å
141	I	48.8	Very low	48.9	Very low	91 Å²	91	114.5 Å²	114.5	47%	0.467	64%	0.64	S	S	.	*	H	α-helix	trans	-55.2	-37.7	-178.6	-75.6	174	0	0	0	111.5	W138 D144 I145	W138-I141 HydrophobicContact CZ3-CD1 4.46Å; I141-D144 PolarHBondContact O-N 3.38Å; I141-I145 HydrophobicContact CG2-CD1 3.93Å; I141-I145 WeakPolarHBondContact O-CG1 3.32Å; I141-I145 PolarHBondContact O-N 2.82Å
142	T	45.7	Very low	47.5	Very low	85 Å²	85	114.4 Å²	114.4	52%	0.521	65%	0.653	S	S	.	*	H	α-helix	trans	-69.2	-34.3	179.4	-45.3	0	0	0	0	112.1	W138 S140 M146	W138-T142 PolarHBondContact O-OG1 2.91Å; W138-T142 VanDerWaalsContact O-OG1 3.1Å; S140-T142 PolarHBondContact O-N 2.79Å; S140-T142 VanDerWaalsContact O-N 3.14Å; T142-M146 VanDerWaalsContact O-CG 3.29Å; T142-M146 WeakPolarHBondContact O-CG 3.48Å; T142-M146 PolarHBondContact O-N 3.49Å
143	M	52.3	Low	46	Very low	138 Å²	138	113.5 Å²	113.5	68%	0.68	66%	0.66	S	S	*	*	H	α-helix	trans	-70.7	-40.9	174.9	-75.9	-72.2	-171.3	0	0	112.7	S140 M146	S140-M143 WeakPolarHBondContact O-CB 3.37Å; S140-M143 PolarHBondContact O-N 2.99Å; M143-M146 PolarHBondContact O-N 2.95Å
144	D	47.5	Very low	44.6	Very low	106 Å²	106	111.2 Å²	111.2	57%	0.567	67%	0.668	S	S	*	*	H	α-helix	trans	-67	-38.6	-178.6	-71.6	-48.8	0	0	0	112.4	S140 I141 M146 K147	S140-D144 PolarHBondContact O-N 3.36Å; S140-D144 VanDerWaalsContact O-N 3.1Å; I141-D144 PolarHBondContact O-N 3.38Å; D144-M146 VanDerWaalsContact C-N 3.27Å; D144-M146 PolarHBondContact O-N 2.98Å; D144-K147 PolarHBondContact O-N 2.96Å
145	I	53.1	Low	43.5	Very low	129 Å²	129	112 Å²	112	66%	0.662	67%	0.673	S	S	*	*	H	α-helix	trans	-63.8	-33.1	174.9	-68.3	168.8	0	0	0	111.4	I141 K147	I141-I145 HydrophobicContact CG2-CD1 3.93Å; I141-I145 WeakPolarHBondContact O-CG1 3.32Å; I141-I145 PolarHBondContact O-N 2.82Å; I145-K147 VanDerWaalsContact C-N 3.25Å; I145-K147 PolarHBondContact O-N 3.3Å
146	M	46.2	Very low	42.8	Very low	156 Å²	156	113.5 Å²	113.5	77%	0.768	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-1.6	178.9	-66.9	-179.6	85.7	0	0	114	T142 M143 D144	T142-M146 VanDerWaalsContact O-CG 3.29Å; T142-M146 WeakPolarHBondContact O-CG 3.48Å; T142-M146 PolarHBondContact O-N 3.49Å; M143-M146 PolarHBondContact O-N 2.95Å; D144-M146 VanDerWaalsContact C-N 3.27Å; D144-M146 PolarHBondContact O-N 2.98Å
147	K	44.6	Very low	41.9	Very low	189 Å²	189	116.6 Å²	116.6	82%	0.822	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.5	19.7	-169.3	-151.7	151.3	-175.8	173.1	0	116.4	D144 I145	D144-K147 PolarHBondContact O-N 2.96Å; I145-K147 VanDerWaalsContact C-N 3.25Å; I145-K147 PolarHBondContact O-N 3.3Å
148	S	36.7	Very low	40.6	Very low	92 Å²	92	118.9 Å²	118.9	64%	0.643	70%	0.702	S	S	*	*			trans	-141.4	85.4	177.3	52.7	0	0	0	0	116.4
149	K	33.2	Very low	39.7	Very low	204 Å²	204	115.8 Å²	115.8	89%	0.887	71%	0.712	S	S	*	*			trans	-151.9	165.8	158.8	-130.1	104.4	-178.3	174	0	109.1
150	P	48.3	Very low	38.7	Very low	121 Å²	121	120.4 Å²	120.4	79%	0.786	72%	0.724	S	S	*	*				-128.4	172.6	-129.6	28.7	-3.9	0	0	0	116.2
151	A	30.3	Very low	37.7	Very low	107 Å²	107	123.8 Å²	123.8	88%	0.884	74%	0.741	S	S	*	*			trans	-156.6	168	164.8	0	0	0	0	0	110.5
152	A	33.2	Very low	36.8	Very low	102 Å²	102	125.2 Å²	125.2	84%	0.843	76%	0.755	S	S	*	*			trans	-153.6	172.2	-166.5	0	0	0	0	0	116.7
153	A	35.3	Very low	36.5	Very low	79 Å²	79	127 Å²	127	65%	0.653	77%	0.767	S	S	*	*			trans	98.4	129.2	151.9	0	0	0	0	0	122.3
154	G	29.6	Very low	35.3	Very low	79 Å²	79	127.9 Å²	127.9	81%	0.814	77%	0.77	S	S	*	*			trans	92.7	147.3	155.9	0	0	0	0	0	119.1
155	S	32.2	Very low	35	Very low	108 Å²	108	127.8 Å²	127.8	76%	0.755	78%	0.775	S	S	*	*			cis	-168.5	154.7	-20.9	-155	0	0	0	0	113.7
156	V	32.3	Very low	33.8	Very low	118 Å²	118	127 Å²	127	72%	0.715	78%	0.777	S	S	*	*			trans	56.6	126.6	156.8	-72.1	0	0	0	0	126.9
157	N	32.2	Very low	32.9	Very low	140 Å²	140	125 Å²	125	75%	0.749	78%	0.778	S	S	*	*				88.1	107.9	128.6	-65.9	4	0	0	0	126.6
158	T	28.2	Very low	32.1	Very low	134 Å²	134	120.4 Å²	120.4	82%	0.822	78%	0.775	S	S	*	*				63.2	119.8	116.1	-43.1	0	0	0	0	124.1
159	A	27.8	Very low	31.7	Very low	101 Å²	101	122.3 Å²	122.3	84%	0.835	78%	0.782	S	S	*	*				177.1	161.6	126.5	0	0	0	0	0	115.1
160	H	26.9	Very low	31.3	Very low	177 Å²	177	117.3 Å²	117.3	82%	0.819	77%	0.773	S	S	*	*			trans	-79	158.1	179.7	-91.2	-105.7	0	0	0	115.3
161	T	27.7	Very low	30.4	Very low	143 Å²	143	117.8 Å²	117.8	88%	0.877	77%	0.773	S	S	*	*				-172.6	147.9	108.1	30.7	0	0	0	0	113.9
162	T	29.1	Very low	30.1	Very low	121 Å²	121	117.6 Å²	117.6	74%	0.742	77%	0.765	S	S	*	*			trans	-86.3	166	171.3	-14	0	0	0	0	111.2
163	P	39.4	Very low	30.5	Very low	122 Å²	122	117.7 Å²	117.7	79%	0.792	76%	0.758	S	S	*	*				-148.7	168.4	78.2	40.2	-21.2	0	0	0	118.1
164	E	27.6	Very low	30.1	Very low	157 Å²	157	119.8 Å²	119.8	73%	0.734	76%	0.762	S	S	*	*			trans	-56.4	169.8	156.5	-91.6	-87.1	132.5	0	0	112.4	V166	E164-V166 PolarHBondContact OE2-N 3.09Å
165	P	41.3	Very low	29.9	Very low	105 Å²	105	121.6 Å²	121.6	68%	0.682	76%	0.758	S	S	*	*			cis	-147.7	171.7	33.5	39.1	-16.3	0	0	0	121.4
166	V	27.8	Very low	29.5	Very low	113 Å²	113	122 Å²	122	69%	0.685	76%	0.756	S	S	*	*			trans	63.9	115.7	153.2	-70.2	0	0	0	0	123.4	E164	E164-V166 PolarHBondContact OE2-N 3.09Å
167	S	28.1	Very low	29.2	Very low	114 Å²	114	122 Å²	122	80%	0.797	76%	0.757	S	S	*	*				53	114.8	124.5	-51.9	0	0	0	0	121.9
168	A	26.9	Very low	28.9	Very low	91 Å²	91	121.9 Å²	121.9	75%	0.752	76%	0.756	S	S	*	*				167.4	136.3	98.2	0	0	0	0	0	115.8
169	V	27.5	Very low	28.8	Very low	132 Å²	132	124.5 Å²	124.5	80%	0.8	76%	0.756	S	S	*	*			trans	58.7	110.5	132.8	179.9	0	0	0	0	121.4
170	S	26.5	Very low	28.7	Very low	100 Å²	100	125.1 Å²	125.1	70%	0.699	75%	0.754	S	S	*	*			trans	74.2	123.4	137.3	-66.4	0	0	0	0	125.2
171	V	28.6	Very low	28.6	Very low	130 Å²	130	121.2 Å²	121.2	79%	0.788	75%	0.746	S	S	*	*				55.9	127.9	121.4	-165.7	0	0	0	0	121
172	S	24.1	Very low	28.5	Very low	103 Å²	103	120.2 Å²	120.2	72%	0.72	74%	0.74	S	S	*	*			trans	-26.1	166.7	152.8	-41.8	0	0	0	0	117.5
173	P	42.3	Very low	28.5	Very low	105 Å²	105	119 Å²	119	68%	0.682	73%	0.732	S	S	*	*			cis	-150	176.1	24.5	39.4	-16.4	0	0	0	119.8
174	T	25.2	Very low	27.9	Very low	122 Å²	122	118.9 Å²	118.9	75%	0.748	73%	0.725	S	S	*	*			trans	72.6	145.7	145.3	36.6	0	0	0	0	123.5
175	T	25.4	Very low	27.9	Very low	118 Å²	118	117.8 Å²	117.8	72%	0.724	72%	0.721	S	S	*	*			trans	84.6	126	148.7	34.3	0	0	0	0	122.5
176	T	25	Very low	27.2	Very low	116 Å²	116	116 Å²	116	71%	0.712	72%	0.715	S	S	*	*			trans	78.4	114.6	143.9	44.6	0	0	0	0	122.8
177	T	24.9	Very low	27.2	Very low	119 Å²	119	117.9 Å²	117.9	73%	0.73	72%	0.722	S	S	*	*			trans	87.9	136.9	131.6	52.3	0	0	0	0	122.8
178	N	26.3	Very low	27.2	Very low	137 Å²	137	116.5 Å²	116.5	73%	0.733	71%	0.712	S	S	*	*			trans	77.6	106.9	150.6	-66.2	-22.4	0	0	0	121
179	K	26.5	Very low	27.3	Very low	189 Å²	189	120.1 Å²	120.1	82%	0.822	71%	0.713	S	S	*	*				37.4	142.7	112	-73.6	-178.3	174.1	177.2	0	118.8
180	S	25.2	Very low	27.7	Very low	114 Å²	114	121.9 Å²	121.9	80%	0.797	71%	0.712	S	S	*	*			trans	70.5	152.1	164.7	81.2	0	0	0	0	114.5
181	S	25.6	Very low	27.9	Very low	94 Å²	94	124.7 Å²	124.7	66%	0.657	72%	0.719	S	S	*	*			cis	-160.3	153.6	-18.6	38.1	0	0	0	0	110.8
182	V	26.4	Very low	27.8	Very low	122 Å²	122	121.4 Å²	121.4	74%	0.739	71%	0.711	S	S	*	*				35.8	141	124.1	-170.4	0	0	0	0	119.6
183	V	27.8	Very low	28	Very low	95 Å²	95	127.8 Å²	127.8	58%	0.576	72%	0.719	S	S	*	*			trans	62.1	121	175.4	-70.5	0	0	0	0	116.4
184	N	27.1	Very low	27.3	Very low	120 Å²	120	127.4 Å²	127.4	64%	0.642	72%	0.72	S	S	*	*				66.7	122.9	62	-79.6	-8.1	0	0	0	114.6
185	M	28.1	Very low	27.7	Very low	135 Å²	135	126.6 Å²	126.6	67%	0.665	72%	0.719	S	S	*	*			trans	67.2	160.7	161.7	-55.2	-60.5	175.5	0	0	114.8	P736	M185-P736 HydrophobicContact CB-CG 4.5Å
186	A	26.4	Very low	28	Very low	67 Å²	67	126.5 Å²	126.5	55%	0.554	72%	0.718	S	S	*	*			cis	-145.4	178.5	6.6	0	0	0	0	0	111.1
187	N	26.4	Very low	28.3	Very low	153 Å²	153	127.9 Å²	127.9	82%	0.818	72%	0.721	S	S	*	*			trans	69.3	160.7	149.4	-93.9	9.4	0	0	0	117.9
188	S	29.5	Very low	28.5	Very low	84 Å²	84	128 Å²	128	59%	0.587	72%	0.722	S	S	*	*			cis	-149.5	170.3	-14	-150.4	0	0	0	0	112.4
189	H	29.4	Very low	28.9	Very low	167 Å²	167	127 Å²	127	77%	0.773	72%	0.72	S	S	*	*			trans	-42.4	150.6	155.8	-56.4	-101.2	0	0	0	113.8
190	H	34.8	Very low	29.2	Very low	170 Å²	170	123.5 Å²	123.5	79%	0.787	71%	0.711	S	S	*	*				173.7	158.6	110.1	72.5	-64.4	0	0	0	108.8
191	N	30.2	Very low	29.8	Very low	159 Å²	159	126 Å²	126	85%	0.85	71%	0.709	S	S	*	*			cis	-157.3	170.3	-12	-131.1	-24.2	0	0	0	109.4
192	G	26.3	Very low	30.1	Very low	60 Å²	60	128.1 Å²	128.1	62%	0.619	72%	0.719	S	S	*	*			trans	128.2	77	139.7	0	0	0	0	0	122
193	R	29	Very low	30.3	Very low	237 Å²	237	125.2 Å²	125.2	89%	0.894	71%	0.714	S	S	*	*			trans	71.9	136.2	132	-59	171.1	91.9	-170.6	7.9	122.5
194	S	28.7	Very low	30.6	Very low	98 Å²	98	129 Å²	129	69%	0.685	73%	0.731	S	S	*	*			trans	77.1	123	146.4	-64.7	0	0	0	0	118.5
195	S	32.8	Very low	30.7	Very low	104 Å²	104	127.9 Å²	127.9	73%	0.727	74%	0.738	S	S	*	*				79.9	133.1	56.5	-60.4	0	0	0	0	112.3
196	T	31.5	Very low	30.8	Very low	117 Å²	117	127.3 Å²	127.3	72%	0.718	75%	0.748	S	S	*	*			cis	-170.1	171.9	5	10.7	0	0	0	0	110.6
197	N	30.4	Very low	31.1	Very low	145 Å²	145	128.7 Å²	128.7	78%	0.775	76%	0.759	S	S	*	*			trans	71.2	161.3	161.6	-66.9	1.1	0	0	0	116.3
198	T	30.1	Very low	31.4	Very low	121 Å²	121	128.3 Å²	128.3	74%	0.742	76%	0.757	S	S	*	*			cis	-171.1	160.4	6.8	11.6	0	0	0	0	108
199	V	34.4	Very low	31.5	Very low	115 Å²	115	129.6 Å²	129.6	70%	0.697	76%	0.761	S	S	*	*			cis	-171.4	155.1	-13.4	94.4	0	0	0	0	113
200	N	33.6	Very low	31.7	Very low	116 Å²	116	129.3 Å²	129.3	62%	0.62	77%	0.765	S	S	*	*			trans	55.1	131.9	151.9	-64.8	-3.2	0	0	0	128.3
201	H	36.7	Very low	31.4	Very low	166 Å²	166	125.2 Å²	125.2	77%	0.769	77%	0.769	S	S	*	*			trans	55.5	150.2	132.8	-51.6	-39.7	0	0	0	122.1
202	T	32.3	Very low	31.4	Very low	139 Å²	139	125.8 Å²	125.8	85%	0.853	77%	0.768	S	S	*	*			cis	-135.5	173.7	10.5	47.4	0	0	0	0	111.6
203	G	30.5	Very low	31.6	Very low	62 Å²	62	127.9 Å²	127.9	64%	0.639	77%	0.769	S	S	*	*			cis	144.6	131.1	-8.7	0	0	0	0	0	115.1
204	N	34.2	Very low	31.8	Very low	174 Å²	174	122.7 Å²	122.7	93%	0.93	76%	0.764	S	S	*	*			trans	72.7	154	162.6	-61.5	17	0	0	0	118.9
205	A	29.9	Very low	31.9	Very low	96 Å²	96	122.9 Å²	122.9	79%	0.793	77%	0.766	S	S	*	*			cis	-137.9	-178.9	13.2	0	0	0	0	0	114.7
206	S	30	Very low	31.8	Very low	124 Å²	124	123.8 Å²	123.8	87%	0.867	77%	0.772	S	S	*	*			trans	-137.8	159.5	-171.6	-44.1	0	0	0	0	112.8
207	A	31.8	Very low	31.7	Very low	95 Å²	95	123.2 Å²	123.2	79%	0.785	78%	0.779	S	S	*	*			trans	-177.8	113.5	143.5	0	0	0	0	0	116.3
208	N	32.5	Very low	31.7	Very low	146 Å²	146	121.7 Å²	121.7	78%	0.781	78%	0.78	S	S	*	*				50.2	135	126.6	-75.6	20.1	0	0	0	127.3
209	T	32.1	Very low	31.7	Very low	110 Å²	110	120.6 Å²	120.6	68%	0.675	78%	0.777	S	S	*	*			trans	88.1	123	131.7	47.7	0	0	0	0	124.4
210	N	32.9	Very low	31.6	Very low	162 Å²	162	123.7 Å²	123.7	87%	0.866	78%	0.783	S	S	*	*			trans	63	120.4	135.9	-57.4	-1.7	0	0	0	121.4
211	G	28.8	Very low	31.4	Very low	83 Å²	83	123.3 Å²	123.3	86%	0.856	79%	0.79	S	S	*	*			trans	-171.5	151	165.2	0	0	0	0	0	110.9
212	M	30.7	Very low	31.2	Very low	171 Å²	171	119.6 Å²	119.6	84%	0.842	79%	0.788	S	S	*	*			trans	-137.1	138.3	-166.4	-172.1	168.5	167.6	0	0	113.4
213	T	31	Very low	31	Very low	104 Å²	104	119.4 Å²	119.4	64%	0.638	79%	0.787	S	S	*	*			trans	58.8	120.9	159	48.3	0	0	0	0	122.3
214	T	32.4	Very low	31.1	Very low	128 Å²	128	121.2 Å²	121.2	79%	0.785	79%	0.789	S	S	*	*			trans	76.2	148.6	131.7	59.6	0	0	0	0	123.1
215	S	31.4	Very low	31	Very low	103 Å²	103	118.2 Å²	118.2	72%	0.72	78%	0.782	S	S	*	*			trans	107.7	96.6	147.2	-56.1	0	0	0	0	119.4
216	S	31.3	Very low	31.2	Very low	123 Å²	123	119.2 Å²	119.2	86%	0.86	78%	0.784	S	S	*	*				20.3	128.3	126.2	-43.4	0	0	0	0	121.1
217	A	29.3	Very low	31.1	Very low	105 Å²	105	116.8 Å²	116.8	87%	0.868	78%	0.778	S	S	*	*				-169.8	164.9	128.4	0	0	0	0	0	112.7
218	S	30.2	Very low	31.4	Very low	112 Å²	112	117.7 Å²	117.7	78%	0.783	78%	0.778	S	S	*	*			trans	-89.7	-173.7	-168.6	-51.7	0	0	0	0	116
219	S	30.3	Very low	31.7	Very low	98 Å²	98	116.7 Å²	116.7	69%	0.685	78%	0.783	S	S	*	*			trans	91.5	110.5	142.5	31.2	0	0	0	0	122.4
220	H	32.7	Very low	31.9	Very low	180 Å²	180	116.2 Å²	116.2	83%	0.833	79%	0.79	S	S	*	*				73	139.4	129.2	-65.7	-58.7	0	0	0	123.8
221	S	28.2	Very low	31.7	Very low	109 Å²	109	112.4 Å²	112.4	76%	0.762	79%	0.789	S	S	*	*			trans	80.6	93.1	142.8	-64.5	0	0	0	0	122
222	A	32	Very low	31.8	Very low	88 Å²	88	112.4 Å²	112.4	73%	0.727	79%	0.789	S	S	*	*				69.2	177.2	110.8	0	0	0	0	0	120.5
223	T	29.6	Very low	32	Very low	135 Å²	135	108.7 Å²	108.7	83%	0.828	79%	0.786	S	S	*	*			trans	68.8	153	178.8	69.9	0	0	0	0	116.8
224	S	32.1	Very low	32	Very low	99 Å²	99	109 Å²	109	69%	0.692	79%	0.792	S	S	*	*				179.8	-177.4	-55.3	49	0	0	0	0	108
225	S	32	Very low	32	Very low	111 Å²	111	110.5 Å²	110.5	78%	0.776	80%	0.795	S	S	*	*			trans	72.1	158.3	177.1	80.3	0	0	0	0	116.1
226	S	33.6	Very low	32.1	Very low	118 Å²	118	109.7 Å²	109.7	83%	0.825	80%	0.803	S	S	*	*				164.5	134.9	-52.7	53.9	0	0	0	0	108.5
227	G	28.5	Very low	32.1	Very low	72 Å²	72	109.3 Å²	109.3	74%	0.742	80%	0.8	S	S	*	*			trans	-169.1	148.6	175.5	0	0	0	0	0	111.6
228	S	38.5	Very low	32.8	Very low	114 Å²	114	108.1 Å²	108.1	80%	0.797	80%	0.798	S	S	*	*			trans	-152.9	176.9	-166.9	-58.5	0	0	0	0	113.6
229	S	37.3	Very low	33.1	Very low	125 Å²	125	109.4 Å²	109.4	87%	0.874	80%	0.801	S	S	*	*			trans	75.9	151.2	177.6	78.6	0	0	0	0	116.4
230	A	36.8	Very low	33.7	Very low	100 Å²	100	109 Å²	109	83%	0.826	80%	0.804	S	S	*	*			cis	-168.9	164.8	-24.6	0	0	0	0	0	108.4
231	G	29.3	Very low	34.2	Very low	83 Å²	83	109 Å²	109	86%	0.856	80%	0.798	S	S	*	*			cis	133.1	106.1	-7.3	0	0	0	0	0	113.9
232	G	30.7	Very low	35.3	Very low	82 Å²	82	108.2 Å²	108.2	85%	0.845	79%	0.786	S	S	*	*			trans	-178.2	148.9	175.4	0	0	0	0	0	119
233	A	34.2	Very low	36.1	Very low	94 Å²	94	113.1 Å²	113.1	78%	0.777	79%	0.785	S	S	*	*			trans	73	94.7	154.2	0	0	0	0	0	123.8
234	S	32.1	Very low	37.1	Very low	109 Å²	109	114 Å²	114	76%	0.762	78%	0.779	S	S	*	*				85.2	142.6	123.7	73.7	0	0	0	0	124
235	N	32.5	Very low	37.8	Very low	160 Å²	160	116.7 Å²	116.7	86%	0.856	78%	0.781	S	S	*	*			trans	70.1	90.4	156.9	-64.8	-1.5	0	0	0	121.4
236	G	32.2	Very low	39	Very low	86 Å²	86	113.8 Å²	113.8	89%	0.887	76%	0.764	S	S	*	*				84.5	59.7	106.3	0	0	0	0	0	119.1
237	S	31.6	Very low	39.7	Very low	115 Å²	115	112 Å²	112	80%	0.804	76%	0.756	S	S	*	*			trans	-142.5	162.2	155.5	-166.4	0	0	0	0	110.7	V239	S237-V239 PolarHBondContact O-N 3.14Å
238	G	45.4	Very low	40.4	Very low	80 Å²	80	115.6 Å²	115.6	83%	0.825	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-67.9	119.8	-173.7	0	0	0	0	0	112.7
239	V	36.5	Very low	40.7	Very low	139 Å²	139	114 Å²	114	84%	0.842	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-99.9	132.4	176.6	-170.9	0	0	0	0	109.3	S237	S237-V239 PolarHBondContact O-N 3.14Å
240	A	42.6	Very low	41	Very low	91 Å²	91	117.6 Å²	117.6	75%	0.752	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-66.3	144.8	176	0	0	0	0	0	111.4	D242	A240-D242 PolarHBondContact O-N 3.43Å; A240-D242 VanDerWaalsContact O-N 3.14Å
241	Y	42.8	Very low	41.2	Very low	178 Å²	178	119 Å²	119	70%	0.698	75%	0.75	S	S	*	*			trans	-75.6	100.2	-178	-175.6	-87	0	0	0	110.9	W243	Y241-W243 AromaticContact CD1-CD1 3.7Å; Y241-W243 AromaticContact CD1-NE1 3.87Å; Y241-W243 AromaticContact CE1-CD1 3.63Å; Y241-W243 HydrophobicContact CE1-CD2 4.4Å; Y241-W243 HydrophobicContact CE1-CG 4.14Å; Y241-W243 AromaticContact CE1-NE1 3.59Å
242	D	51.8	Low	41.2	Very low	94 Å²	94	122.8 Å²	122.8	50%	0.503	75%	0.749	S	S	.	*			trans	-82.7	120	172.8	-179.4	13.5	0	0	0	111.4	A240 H244	A240-D242 PolarHBondContact O-N 3.43Å; A240-D242 VanDerWaalsContact O-N 3.14Å; D242-H244 PolarHBondContact OD1-N 3.48Å; D242-H244 IonicContact OD1-ND1 2.67Å
243	W	49.1	Very low	41.3	Very low	191 Å²	191	127.6 Å²	127.6	72%	0.723	75%	0.75	S	S	*	*	H	α-helix	trans	-68.2	-29	177.2	-93.1	78.7	0	0	0	113.8	Y241 Q245 A246 A247	Y241-W243 AromaticContact CD1-CD1 3.7Å; Y241-W243 AromaticContact CD1-NE1 3.87Å; Y241-W243 AromaticContact CE1-CD1 3.63Å; Y241-W243 HydrophobicContact CE1-CD2 4.4Å; Y241-W243 HydrophobicContact CE1-CG 4.14Å; Y241-W243 AromaticContact CE1-NE1 3.59Å; W243-Q245 PolarHBondContact O-N 3.5Å; W243-A246 PolarHBondContact O-N 3.36Å; W243-A247 PolarHBondContact O-N 2.9Å
244	H	50.6	Low	41.2	Very low	152 Å²	152	131.6 Å²	131.6	70%	0.704	75%	0.752	S	S	*	*	H	α-helix	trans	-69.9	-35.8	-173.5	-83.1	90.9	0	0	0	112.8	D242 A246 A247	D242-H244 PolarHBondContact OD1-N 3.48Å; D242-H244 IonicContact OD1-ND1 2.67Å; H244-A246 VanDerWaalsContact C-N 3.34Å; H244-A246 PolarHBondContact O-N 3.5Å; H244-A247 PolarHBondContact O-N 2.68Å
245	Q	46.2	Very low	40.9	Very low	157 Å²	157	132.6 Å²	132.6	73%	0.734	75%	0.754	S	S	*	*	H	α-helix	trans	-72.5	-27.5	177.8	-163.3	168.7	8	0	0	112.9	W243	W243-Q245 PolarHBondContact O-N 3.5Å
246	A	56.4	Low	41.3	Very low	50 Å²	50	129.5 Å²	129.5	41%	0.413	74%	0.743	S	S	.	*	H	α-helix	trans	-73.7	-30.7	176.1	0	0	0	0	0	113.1	W243 H244 L248 A249	W243-A246 PolarHBondContact O-N 3.36Å; H244-A246 VanDerWaalsContact C-N 3.34Å; H244-A246 PolarHBondContact O-N 3.5Å; A246-L248 VanDerWaalsContact C-N 3.33Å; A246-L248 PolarHBondContact O-N 3.33Å; A246-A249 PolarHBondContact O-N 3.31Å
247	A	49.4	Very low	41	Very low	79 Å²	79	135.6 Å²	135.6	65%	0.653	74%	0.741	S	S	*	*	H	α-helix	trans	-67.4	-30.1	-177.5	0	0	0	0	0	113.7	W243 H244	W243-A247 PolarHBondContact O-N 2.9Å; H244-A247 PolarHBondContact O-N 2.68Å
248	L	43.5	Very low	40.9	Very low	149 Å²	149	137.7 Å²	137.7	78%	0.78	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-7.3	-178.1	-63.5	176.7	0	0	0	113.9	A246 K250	A246-L248 VanDerWaalsContact C-N 3.33Å; A246-L248 PolarHBondContact O-N 3.33Å; L248-K250 VanDerWaalsContact C-N 3.34Å; L248-K250 PolarHBondContact O-N 3.43Å
249	A	43.6	Very low	40.1	Very low	80 Å²	80	141 Å²	141	66%	0.661	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	18.1	-170.4	0	0	0	0	0	115.2	A246	A246-A249 PolarHBondContact O-N 3.31Å
250	K	43.5	Very low	39.6	Very low	201 Å²	201	141.6 Å²	141.6	87%	0.874	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137	22.7	-171.5	-114.5	178.4	-176	178.8	0	117.7	L248	L248-K250 VanDerWaalsContact C-N 3.34Å; L248-K250 PolarHBondContact O-N 3.43Å
251	T	40.5	Very low	39.5	Very low	130 Å²	130	143 Å²	143	80%	0.798	73%	0.734	S	S	*	*	S	Bend	trans	-131.2	157.6	160	50.7	0	0	0	0	110.4
252	L	31	Very low	38.8	Very low	161 Å²	161	142.3 Å²	142.3	84%	0.843	74%	0.738	S	S	*	*			trans	75.4	60.2	173.8	-152.7	78.3	0	0	0	119.1
253	Q	33	Very low	38.4	Very low	183 Å²	183	143.2 Å²	143.2	86%	0.855	75%	0.749	S	S	*	*				-133	139.8	118.7	-62.9	-168.8	5.4	0	0	105.8
254	Q	31	Very low	37.3	Very low	178 Å²	178	138.6 Å²	138.6	83%	0.832	75%	0.745	S	S	*	*			cis	-138.3	171.7	26.9	-61.4	168.2	-16.6	0	0	113.1
255	T	26.4	Very low	36.3	Very low	131 Å²	131	138.2 Å²	138.2	80%	0.804	75%	0.748	S	S	*	*			trans	-140.9	170.5	160.9	30	0	0	0	0	107.4
256	P	40.5	Very low	35.4	Very low	95 Å²	95	139.6 Å²	139.6	62%	0.617	75%	0.752	S	S	*	*			cis	-132.1	-172.4	0.9	17.1	10.3	0	0	0	115.1
257	Y	25.8	Very low	34	Very low	214 Å²	214	142.1 Å²	142.1	84%	0.839	77%	0.766	S	S	*	*			trans	111.1	134.3	150.2	-66	-69.1	0	0	0	121.4
258	H	28.5	Very low	33.1	Very low	159 Å²	159	143.9 Å²	143.9	74%	0.736	77%	0.769	S	S	*	*			trans	91.6	96.1	148.1	-121.2	-120	0	0	0	122.1
259	L	29.3	Very low	32.6	Very low	149 Å²	149	142.2 Å²	142.2	78%	0.78	77%	0.765	S	S	*	*			trans	73.9	134.3	143.6	-60.7	-177.1	0	0	0	123.1
260	L	25.7	Very low	32	Very low	152 Å²	152	148 Å²	148	80%	0.796	78%	0.778	S	S	*	*			trans	-71.8	163.9	152.6	-90.5	162.8	0	0	0	110.4
261	P	41.8	Very low	31.4	Very low	120 Å²	120	145.8 Å²	145.8	78%	0.779	78%	0.775	S	S	*	*			cis	-139.6	-176.6	36	38.9	-18.1	0	0	0	117.7
262	E	27.5	Very low	30.7	Very low	164 Å²	164	149.1 Å²	149.1	77%	0.766	77%	0.774	S	S	*	*			trans	-68.7	-171.2	164.1	-45.7	-165.1	134	0	0	112.1
263	P	42.1	Very low	30.9	Very low	113 Å²	113	151.2 Å²	151.2	73%	0.734	77%	0.771	S	S	*	*			cis	-142.1	-163.9	0.6	37.8	-14.5	0	0	0	116.4
264	S	26.2	Very low	30.8	Very low	94 Å²	94	151.8 Å²	151.8	66%	0.657	77%	0.774	S	S	*	*			trans	87.6	97.7	138	-171.5	0	0	0	0	121.9
265	L	30.7	Very low	30.5	Very low	143 Å²	143	150.8 Å²	150.8	75%	0.749	77%	0.774	S	S	*	*				52.8	139.3	119.5	-58.8	172.9	0	0	0	123.7
266	F	26	Very low	31.4	Very low	186 Å²	186	151.3 Å²	151.3	82%	0.816	77%	0.772	S	S	*	*			trans	77.7	130.3	149.8	-79.8	-63.3	0	0	0	122.6
267	S	28.1	Very low	31.3	Very low	104 Å²	104	156.1 Å²	156.1	73%	0.727	78%	0.783	S	S	*	*			trans	72.9	155	148.1	-84.4	0	0	0	0	120.9
268	T	30.7	Very low	31.8	Very low	116 Å²	116	153.6 Å²	153.6	71%	0.712	78%	0.783	S	S	*	*			cis	-169.7	150.1	-26.7	-97.5	0	0	0	0	108.3
269	V	32.1	Very low	32.2	Very low	114 Å²	114	157.2 Å²	157.2	69%	0.691	79%	0.792	S	S	*	*			trans	66.3	122.9	-177.7	-158.4	0	0	0	0	116.6
270	Q	32.3	Very low	32.3	Very low	200 Å²	200	153.4 Å²	153.4	94%	0.935	79%	0.789	S	S	*	*			trans	-152.7	158	134.5	-117.8	161.4	14.3	0	0	112.7
271	L	29.8	Very low	33.2	Very low	155 Å²	155	150.4 Å²	150.4	81%	0.812	78%	0.78	S	S	*	*			trans	-105	147.3	-162.6	-71.1	165.5	0	0	0	112.8
272	Y	27	Very low	33.3	Very low	200 Å²	200	151.2 Å²	151.2	78%	0.784	78%	0.783	S	S	*	*			trans	47.9	104.4	136.7	-154.6	-89.5	0	0	0	119.9
273	R	34.4	Very low	33.7	Very low	206 Å²	206	153.4 Å²	153.4	78%	0.777	79%	0.79	S	S	*	*			trans	38.4	114.4	152	-66.1	-178.9	172.5	-104.9	3.1	118.8
274	Q	30.9	Very low	34.1	Very low	195 Å²	195	154 Å²	154	91%	0.911	79%	0.792	S	S	*	*				-167	128.6	116	-108.7	177.8	31.3	0	0	114.6
275	N	25.5	Very low	34.9	Very low	157 Å²	157	152.9 Å²	152.9	84%	0.84	80%	0.795	S	S	*	*			trans	54.1	158.3	149.5	-136.9	-15	0	0	0	122.6
276	N	43.8	Very low	35.7	Very low	141 Å²	141	151 Å²	151	75%	0.754	80%	0.8	S	S	*	*			trans	-78.3	147.1	-179.7	-69	-19.4	0	0	0	113.4
277	K	39.7	Very low	37.5	Very low	196 Å²	196	143.1 Å²	143.1	85%	0.852	77%	0.768	S	S	*	*				175.7	157.3	123.4	-95.3	158.9	-176.3	179.8	0	111.9
278	L	36.2	Very low	39.5	Very low	161 Å²	161	146.5 Å²	146.5	84%	0.843	77%	0.77	S	S	*	*	S	Bend	trans	66	127.5	174.7	-42.8	179.9	0	0	0	114.8
279	Y	37	Very low	41.8	Very low	236 Å²	236	143.6 Å²	143.6	93%	0.925	75%	0.747	S	S	*	*			cis	-99.5	162.2	-0.9	-88.1	-106.1	0	0	0	112.5
280	G	31.6	Very low	44.3	Very low	68 Å²	68	145.4 Å²	145.4	70%	0.701	74%	0.742	S	S	*	*			trans	-138.6	160.3	174.9	0	0	0	0	0	113.7
281	S	44.5	Very low	46.9	Very low	89 Å²	89	136 Å²	136	62%	0.622	70%	0.698	S	S	*	*			trans	55.9	91.3	155.7	-176.7	0	0	0	0	119.1
282	V	42.4	Very low	49.5	Very low	137 Å²	137	135.6 Å²	135.6	83%	0.83	69%	0.69	S	S	*	*	S	Bend		-142.7	60.4	129.8	-158.3	0	0	0	0	111.7
283	F	37.4	Very low	52.2	Low	211 Å²	211	129.4 Å²	129.4	93%	0.925	67%	0.67	S	S	*	*			trans	-169.3	54.1	157.5	-105.7	-61.6	0	0	0	111.9	G285	F283-G285 PolarHBondContact O-N 3.42Å
284	T	49.1	Very low	54.7	Low	125 Å²	125	122 Å²	122	77%	0.767	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	116.8	175.4	48.5	0	0	0	0	111
285	G	44.1	Very low	57.2	Low	70 Å²	70	115.7 Å²	115.7	72%	0.722	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	169	-35.8	173	0	0	0	0	0	115.5	F283 S287	F283-G285 PolarHBondContact O-N 3.42Å; G285-S287 PolarHBondContact O-N 2.85Å
286	A	46.6	Very low	60.1	Low	103 Å²	103	109.9 Å²	109.9	85%	0.851	60%	0.601	S	S	*	*			trans	-83	35.1	-175.5	0	0	0	0	0	114.5	K288	A286-K288 PolarHBondContact O-N 2.76Å
287	S	63.9	Low	62.2	Low	22 Å²	22	105.7 Å²	105.7	15%	0.154	59%	0.586	C	S	.	*			trans	-69.9	119.7	177	-172.8	0	0	0	0	110	G285 F289 Y298 D299	G285-S287 PolarHBondContact O-N 2.85Å; S287-F289 VanDerWaalsContact C-N 3.3Å; S287-F289 PolarHBondContact O-N 3.47Å; S287-Y298 PolarHBondContact OG-N 3.15Å; S287-Y298 PolarHBondContact OG-O 3.07Å; S287-D299 WeakPolarHBondContact CB-OD1 3.41Å; S287-D299 PolarHBondContact OG-N 3.17Å; S287-D299 PolarHBondContact OG-OD1 3.4Å
288	K	70.9	Confident	64.4	Low	174 Å²	174	99.2 Å²	99.2	76%	0.757	56%	0.556	S	S	*	*	S	Bend	trans	-69.6	-23.4	-161	-177.3	173.2	177.6	179.5	0	114.4	A286	A286-K288 PolarHBondContact O-N 2.76Å
289	F	78.6	Confident	66.8	Low	55 Å²	55	98 Å²	98	24%	0.241	55%	0.551	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.8	128	-177.8	-51.4	-82.4	0	0	0	108.8	S287 A297 Y298 L301 L304	S287-F289 VanDerWaalsContact C-N 3.3Å; S287-F289 PolarHBondContact O-N 3.47Å; F289-A297 WeakPolarHBondContact O-CA 3.5Å; F289-Y298 WeakPolarHBondContact CB-O 3.4Å; F289-Y298 PolarHBondContact N-O 3.45Å; F289-Y298 PolarHBondContact O-N 3.22Å; F289-L301 HydrophobicContact CD1-CB 4.07Å; F289-L301 HydrophobicContact CD1-CD1 3.81Å; F289-L301 HydrophobicContact CD1-CG 4.49Å; F289-L301 HydrophobicContact CD2-CB 4.33Å; F289-L301 VanDerWaalsContact CD2-N 3.34Å; F289-L301 HydrophobicContact CE1-CB 3.82Å; F289-L301 HydrophobicContact CE1-CD1 4.01Å; F289-L301 HydrophobicContact CE1-CG 4.33Å; F289-L301 HydrophobicContact CE2-CB 4.1Å; F289-L301 HydrophobicContact CG-CB 4.31Å; F289-L301 HydrophobicContact CG-CD1 4.49Å; F289-L301 HydrophobicContact CZ-CB 3.83Å; F289-L304 HydrophobicContact CB-CB 4.06Å; F289-L304 HydrophobicContact CB-CD2 3.81Å
290	R	83.9	Confident	69.3	Low	152 Å²	152	90.6 Å²	90.6	57%	0.574	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.6	138.6	176.9	-63.6	-171.2	67.5	-161.6	5.9	109.6	S295 A296 A297	R290-S295 VanDerWaalsContact CZ-O 3.24Å; R290-S295 PolarHBondContact NE-O 3.46Å; R290-S295 VanDerWaalsContact NH2-CB 3.33Å; R290-S295 PolarHBondContact NH2-O 3.3Å; R290-S295 PolarHBondContact NH2-OG 3.37Å; R290-A296 CarbonylContact C-O 3.56Å; R290-A296 VanDerWaalsContact CA-O 3.32Å; R290-A296 WeakPolarHBondContact CA-O 3.38Å; R290-A297 HydrophobicContact CG-CB 3.89Å
291	C	88.3	Confident	72	Confident	3 Å²	3	91.8 Å²	91.8	2%	0.02	52%	0.52	C	S	.	.			trans	-67.1	133.4	171.1	-176.1	0	0	0	0	109.5	D293 C294 S295 A296 Y298 L304 H307	C291-D293 VanDerWaalsContact C-N 3.3Å; C291-D293 PolarHBondContact O-N 3.28Å; C291-C294 WeakPolarHBondContact CB-SG 3.48Å; C291-C294 VanDerWaalsContact SG-SG 3.66Å; C291-S295 WeakPolarHBondContact O-CA 3.32Å; C291-S295 PolarHBondContact O-N 3.13Å; C291-A296 PolarHBondContact N-O 3.04Å; C291-Y298 HydrophobicContact CB-CE2 4.29Å; C291-L304 VanDerWaalsContact CA-CD1 3.49Å; C291-L304 HydrophobicContact CB-CD1 3.71Å; C291-H307 WeakPolarHBondContact CB-NE2 3.11Å; C291-H307 PolarHBondContact SG-NE2 2.92Å
292	K	83	Confident	74.2	Confident	146 Å²	146	92.6 Å²	92.6	64%	0.635	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-35.9	-177.4	-178	-170.4	166.8	-157	0	111.9	D317	K292-D317 IonicContact NZ-OD2 2.99Å
293	D	84.2	Confident	76.3	Confident	70 Å²	70	87.2 Å²	87.2	37%	0.374	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-36.2	-163.6	-65.8	4.5	0	0	0	112.6	C291 H313	C291-D293 VanDerWaalsContact C-N 3.3Å; C291-D293 PolarHBondContact O-N 3.28Å; D293-H313 HydrophobicContact CB-CB 4.1Å
294	C	87.8	Confident	78.8	Confident	50 Å²	50	78.1 Å²	78.1	34%	0.338	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-6.8	173.5	73.4	0	0	0	0	114.2	C291 A296 H307	C291-C294 WeakPolarHBondContact CB-SG 3.48Å; C291-C294 VanDerWaalsContact SG-SG 3.66Å; C294-A296 PolarHBondContact O-N 3.46Å; C294-A296 VanDerWaalsContact SG-CB 3.52Å; C294-A296 PolarHBondContact SG-N 3.46Å; C294-H307 VanDerWaalsContact SG-CE1 3.59Å; C294-H307 PolarHBondContact SG-NE2 3.07Å
295	S	82.6	Confident	80.5	Confident	64 Å²	64	75.4 Å²	75.4	45%	0.448	44%	0.437	S	S	.	.			trans	64.1	-0.8	-176.8	91.3	0	0	0	0	116.7	R290 C291	R290-S295 VanDerWaalsContact CZ-O 3.24Å; R290-S295 PolarHBondContact NE-O 3.46Å; R290-S295 VanDerWaalsContact NH2-CB 3.33Å; R290-S295 PolarHBondContact NH2-O 3.3Å; R290-S295 PolarHBondContact NH2-OG 3.37Å; C291-S295 WeakPolarHBondContact O-CA 3.32Å; C291-S295 PolarHBondContact O-N 3.13Å
296	A	86.4	Confident	82.7	Confident	35 Å²	35	75.1 Å²	75.1	29%	0.289	42%	0.421	S	S	.	.			trans	-58.3	146.8	176.4	0	0	0	0	0	111.6	R290 C291 C294 Y298	R290-A296 CarbonylContact C-O 3.56Å; R290-A296 VanDerWaalsContact CA-O 3.32Å; R290-A296 WeakPolarHBondContact CA-O 3.38Å; C291-A296 PolarHBondContact N-O 3.04Å; C294-A296 PolarHBondContact O-N 3.46Å; C294-A296 VanDerWaalsContact SG-CB 3.52Å; C294-A296 PolarHBondContact SG-N 3.46Å; A296-Y298 HydrophobicContact CB-CE2 3.71Å; A296-Y298 WeakPolarHBondContact CB-OH 3.4Å; A296-Y298 WeakPolarHBondContact O-CE2 3.12Å
297	A	88.3	Confident	84.8	Confident	52 Å²	52	70.9 Å²	70.9	43%	0.43	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	137.5	-169.3	0	0	0	0	0	111.5	F289 R290	F289-A297 WeakPolarHBondContact O-CA 3.5Å; R290-A297 HydrophobicContact CG-CB 3.89Å
298	Y	85.9	Confident	86	Confident	60 Å²	60	71.8 Å²	71.8	24%	0.235	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	122.5	-169.6	-61.4	-84.6	0	0	0	110	S287 F289 C291 A296 T300 L304 H307	S287-Y298 PolarHBondContact OG-N 3.15Å; S287-Y298 PolarHBondContact OG-O 3.07Å; F289-Y298 WeakPolarHBondContact CB-O 3.4Å; F289-Y298 PolarHBondContact N-O 3.45Å; F289-Y298 PolarHBondContact O-N 3.22Å; C291-Y298 HydrophobicContact CB-CE2 4.29Å; A296-Y298 HydrophobicContact CB-CE2 3.71Å; A296-Y298 WeakPolarHBondContact CB-OH 3.4Å; A296-Y298 WeakPolarHBondContact O-CE2 3.12Å; Y298-T300 PolarHBondContact O-N 3.35Å; Y298-T300 VanDerWaalsContact O-N 3.15Å; Y298-L304 HydrophobicContact CD2-CB 4.15Å; Y298-L304 HydrophobicContact CD2-CD1 3.87Å; Y298-L304 HydrophobicContact CE2-CD1 4.3Å; Y298-L304 HydrophobicContact CG-CB 4.24Å; Y298-H307 HydrophobicContact CD1-CB 4.46Å; Y298-H307 HydrophobicContact CE1-CB 3.78Å; Y298-H307 HydrophobicContact CE2-CB 4.06Å; Y298-H307 AromaticContact CE2-CD2 3.4Å; Y298-H307 WeakPolarHBondContact CE2-CD2 3.29Å; Y298-H307 AromaticContact CE2-CG 3.69Å; Y298-H307 AromaticContact CZ-CD2 3.57Å; Y298-H307 AromaticContact CZ-CG 3.35Å; Y298-H307 AromaticContact CZ-ND1 3.87Å; Y298-H307 PolarHBondContact OH-CD2 3.07Å; Y298-H307 PolarHBondContact OH-CE1 3.48Å; Y298-H307 PolarHBondContact OH-ND1 3.4Å; Y298-H307 VanDerWaalsContact OH-ND1 3.13Å
299	D	86.6	Confident	86.6	Confident	135 Å²	135	68.3 Å²	68.3	72%	0.722	38%	0.376	S	S	*	.	S	Bend	trans	-71.2	-14.1	-173.8	-56.5	-41	0	0	0	113.1	S287	S287-D299 WeakPolarHBondContact CB-OD1 3.41Å; S287-D299 PolarHBondContact OG-N 3.17Å; S287-D299 PolarHBondContact OG-OD1 3.4Å
300	T	89	Confident	86.7	Confident	81 Å²	81	73 Å²	73	50%	0.497	40%	0.399	S	S	.	.	S	Bend	trans	-124.4	145.9	172.3	68.8	0	0	0	0	111.4	Y298 V302 G303 L304	Y298-T300 PolarHBondContact O-N 3.35Å; Y298-T300 VanDerWaalsContact O-N 3.15Å; T300-V302 PolarHBondContact O-N 2.87Å; T300-G303 PolarHBondContact O-N 2.68Å; T300-G303 VanDerWaalsContact O-N 3.15Å; T300-G303 PolarHBondContact OG1-N 2.88Å; T300-L304 PolarHBondContact O-N 3.29Å; T300-L304 VanDerWaalsContact O-N 3.12Å
301	L	88.5	Confident	86.6	Confident	94 Å²	94	68.9 Å²	68.9	49%	0.492	39%	0.39	S	S	.	.	H	α-helix	trans	-59.3	-34.8	172.4	-179.8	59.7	0	0	0	111.5	F289 L304 T305	F289-L301 HydrophobicContact CD1-CB 4.07Å; F289-L301 HydrophobicContact CD1-CD1 3.81Å; F289-L301 HydrophobicContact CD1-CG 4.49Å; F289-L301 HydrophobicContact CD2-CB 4.33Å; F289-L301 VanDerWaalsContact CD2-N 3.34Å; F289-L301 HydrophobicContact CE1-CB 3.82Å; F289-L301 HydrophobicContact CE1-CD1 4.01Å; F289-L301 HydrophobicContact CE1-CG 4.33Å; F289-L301 HydrophobicContact CE2-CB 4.1Å; F289-L301 HydrophobicContact CG-CB 4.31Å; F289-L301 HydrophobicContact CG-CD1 4.49Å; F289-L301 HydrophobicContact CZ-CB 3.83Å; L301-L304 PolarHBondContact O-N 3.34Å; L301-T305 PolarHBondContact O-N 3.01Å; L301-T305 PolarHBondContact O-OG1 3.22Å; L301-T305 VanDerWaalsContact O-OG1 3.12Å
302	V	90.1	Very high	86	Confident	106 Å²	106	71.7 Å²	71.7	64%	0.642	42%	0.419	S	S	*	.	H	α-helix	trans	-62.9	-44.6	175.8	-177.8	0	0	0	0	110.7	T300 L304 T305 V306	T300-V302 PolarHBondContact O-N 2.87Å; V302-L304 VanDerWaalsContact C-N 3.33Å; V302-L304 PolarHBondContact O-N 3.34Å; V302-T305 PolarHBondContact O-N 2.87Å; V302-V306 HydrophobicContact CG1-CG2 4.24Å; V302-V306 WeakPolarHBondContact O-CB 3.07Å; V302-V306 VanDerWaalsContact O-CG2 3.31Å; V302-V306 WeakPolarHBondContact O-CG2 3.4Å; V302-V306 PolarHBondContact O-N 3.44Å
303	G	87.8	Confident	85.8	Confident	23 Å²	23	67.1 Å²	67.1	24%	0.237	40%	0.4	C	S	.	.	H	α-helix	trans	-59.2	-41.8	174.2	0	0	0	0	0	112.7	T300 H307	T300-G303 PolarHBondContact O-N 2.68Å; T300-G303 VanDerWaalsContact O-N 3.15Å; T300-G303 PolarHBondContact OG1-N 2.88Å; G303-H307 VanDerWaalsContact O-CB 3.29Å; G303-H307 WeakPolarHBondContact O-CB 3.49Å; G303-H307 PolarHBondContact O-N 3.11Å
304	L	88.9	Confident	85.1	Confident	20 Å²	20	72.1 Å²	72.1	11%	0.105	42%	0.415	C	S	.	.	H	α-helix	trans	-62.8	-47.9	172.7	174.3	59.8	0	0	0	111.9	F289 C291 Y298 T300 L301 V302 H307 M308	F289-L304 HydrophobicContact CB-CB 4.06Å; F289-L304 HydrophobicContact CB-CD2 3.81Å; C291-L304 VanDerWaalsContact CA-CD1 3.49Å; C291-L304 HydrophobicContact CB-CD1 3.71Å; Y298-L304 HydrophobicContact CD2-CB 4.15Å; Y298-L304 HydrophobicContact CD2-CD1 3.87Å; Y298-L304 HydrophobicContact CE2-CD1 4.3Å; Y298-L304 HydrophobicContact CG-CB 4.24Å; T300-L304 PolarHBondContact O-N 3.29Å; T300-L304 VanDerWaalsContact O-N 3.12Å; L301-L304 PolarHBondContact O-N 3.34Å; V302-L304 VanDerWaalsContact C-N 3.33Å; V302-L304 PolarHBondContact O-N 3.34Å; L304-H307 PolarHBondContact O-N 2.9Å; L304-M308 HydrophobicContact CD1-CG 3.75Å; L304-M308 HydrophobicContact CD1-SD 3.84Å; L304-M308 HydrophobicContact CG-CG 4.35Å; L304-M308 HydrophobicContact CG-SD 4.18Å; L304-M308 WeakPolarHBondContact O-CG 3.34Å; L304-M308 PolarHBondContact O-N 3.28Å
305	T	85.3	Confident	83.9	Confident	69 Å²	69	77.4 Å²	77.4	42%	0.423	43%	0.428	S	S	.	.	H	α-helix	trans	-64.7	-42.1	-178.3	-62.6	0	0	0	0	112.1	L301 V302 M308 N309	L301-T305 PolarHBondContact O-N 3.01Å; L301-T305 PolarHBondContact O-OG1 3.22Å; L301-T305 VanDerWaalsContact O-OG1 3.12Å; V302-T305 PolarHBondContact O-N 2.87Å; T305-M308 PolarHBondContact O-N 2.8Å; T305-N309 VanDerWaalsContact O-CG 3.26Å; T305-N309 PolarHBondContact O-N 3.3Å; T305-N309 VanDerWaalsContact O-N 3.11Å; T305-N309 PolarHBondContact O-ND2 3.13Å; T305-N309 VanDerWaalsContact O-ND2 3.17Å
306	V	90.4	Very high	82.5	Confident	63 Å²	63	77.9 Å²	77.9	38%	0.382	43%	0.426	S	S	.	.	H	α-helix	trans	-58.7	-52.2	173.1	168.6	0	0	0	0	109.8	V302 M308 N309 E310	V302-V306 HydrophobicContact CG1-CG2 4.24Å; V302-V306 WeakPolarHBondContact O-CB 3.07Å; V302-V306 VanDerWaalsContact O-CG2 3.31Å; V302-V306 WeakPolarHBondContact O-CG2 3.4Å; V302-V306 PolarHBondContact O-N 3.44Å; V306-M308 PolarHBondContact O-N 3.01Å; V306-N309 PolarHBondContact O-N 3.46Å; V306-N309 VanDerWaalsContact O-N 3.13Å; V306-E310 VanDerWaalsContact CG1-CD 3.41Å; V306-E310 HydrophobicContact CG1-CG 4.14Å; V306-E310 VanDerWaalsContact CG1-OE1 3.29Å; V306-E310 WeakPolarHBondContact CG1-OE1 3.49Å; V306-E310 WeakPolarHBondContact O-CB 3.29Å; V306-E310 WeakPolarHBondContact O-CG 3.37Å; V306-E310 PolarHBondContact O-N 3.48Å
307	H	90.9	Very high	81	Confident	14 Å²	14	80.8 Å²	80.8	7%	0.065	44%	0.436	C	S	.	.	H	α-helix	trans	-56.3	-45.7	176.7	161.5	65.3	0	0	0	113.4	C291 C294 Y298 G303 L304 N309 E310 T311 H313	C291-H307 WeakPolarHBondContact CB-NE2 3.11Å; C291-H307 PolarHBondContact SG-NE2 2.92Å; C294-H307 VanDerWaalsContact SG-CE1 3.59Å; C294-H307 PolarHBondContact SG-NE2 3.07Å; Y298-H307 HydrophobicContact CD1-CB 4.46Å; Y298-H307 HydrophobicContact CE1-CB 3.78Å; Y298-H307 HydrophobicContact CE2-CB 4.06Å; Y298-H307 AromaticContact CE2-CD2 3.4Å; Y298-H307 WeakPolarHBondContact CE2-CD2 3.29Å; Y298-H307 AromaticContact CE2-CG 3.69Å; Y298-H307 AromaticContact CZ-CD2 3.57Å; Y298-H307 AromaticContact CZ-CG 3.35Å; Y298-H307 AromaticContact CZ-ND1 3.87Å; Y298-H307 PolarHBondContact OH-CD2 3.07Å; Y298-H307 PolarHBondContact OH-CE1 3.48Å; Y298-H307 PolarHBondContact OH-ND1 3.4Å; Y298-H307 VanDerWaalsContact OH-ND1 3.13Å; G303-H307 VanDerWaalsContact O-CB 3.29Å; G303-H307 WeakPolarHBondContact O-CB 3.49Å; G303-H307 PolarHBondContact O-N 3.11Å; L304-H307 PolarHBondContact O-N 2.9Å; H307-N309 PolarHBondContact O-N 3.4Å; H307-E310 PolarHBondContact O-N 3.05Å; H307-T311 PolarHBondContact CE1-OG1 3.36Å; H307-T311 WeakPolarHBondContact ND1-CG2 3.46Å; H307-T311 PolarHBondContact ND1-OG1 3.36Å; H307-T311 WeakPolarHBondContact O-CB 3.44Å; H307-T311 PolarHBondContact O-N 2.87Å; H307-T311 PolarHBondContact O-OG1 2.85Å; H307-H313 AromaticContact CE1-CD2 3.85Å; H307-H313 AromaticContact NE2-CD2 3.63Å
308	M	87.9	Confident	79.3	Confident	41 Å²	41	84.8 Å²	84.8	20%	0.202	45%	0.451	C	S	.	.	H	α-helix	trans	-67.3	-25.5	-179.2	-70.1	-166.3	75.9	0	0	113	L304 T305 V306 G312 H313	L304-M308 HydrophobicContact CD1-CG 3.75Å; L304-M308 HydrophobicContact CD1-SD 3.84Å; L304-M308 HydrophobicContact CG-CG 4.35Å; L304-M308 HydrophobicContact CG-SD 4.18Å; L304-M308 WeakPolarHBondContact O-CG 3.34Å; L304-M308 PolarHBondContact O-N 3.28Å; T305-M308 PolarHBondContact O-N 2.8Å; V306-M308 PolarHBondContact O-N 3.01Å; M308-G312 PolarHBondContact O-N 3.42Å; M308-H313 HydrophobicContact CE-CB 4.03Å; M308-H313 WeakPolarHBondContact CE-O 3.18Å; M308-H313 PolarHBondContact O-N 2.96Å
309	N	83.9	Confident	77.5	Confident	102 Å²	102	89.6 Å²	89.6	55%	0.545	47%	0.473	S	S	.	.	H	α-helix	trans	-77.8	-47	170.4	-66.4	-28.5	0	0	0	111.6	T305 V306 H307 T311 G312	T305-N309 VanDerWaalsContact O-CG 3.26Å; T305-N309 PolarHBondContact O-N 3.3Å; T305-N309 VanDerWaalsContact O-N 3.11Å; T305-N309 PolarHBondContact O-ND2 3.13Å; T305-N309 VanDerWaalsContact O-ND2 3.17Å; V306-N309 PolarHBondContact O-N 3.46Å; V306-N309 VanDerWaalsContact O-N 3.13Å; H307-N309 PolarHBondContact O-N 3.4Å; N309-T311 PolarHBondContact O-N 3.43Å; N309-G312 PolarHBondContact O-N 3.02Å
310	E	81.6	Confident	75.7	Confident	154 Å²	154	87.9 Å²	87.9	72%	0.72	46%	0.463	S	S	*	.	H	α-helix	trans	-66.2	-35.3	-177.8	-72.8	174.8	163.9	0	0	113.3	V306 H307	V306-E310 VanDerWaalsContact CG1-CD 3.41Å; V306-E310 HydrophobicContact CG1-CG 4.14Å; V306-E310 VanDerWaalsContact CG1-OE1 3.29Å; V306-E310 WeakPolarHBondContact CG1-OE1 3.49Å; V306-E310 WeakPolarHBondContact O-CB 3.29Å; V306-E310 WeakPolarHBondContact O-CG 3.37Å; V306-E310 PolarHBondContact O-N 3.48Å; H307-E310 PolarHBondContact O-N 3.05Å
311	T	82.2	Confident	73.4	Confident	65 Å²	65	92.7 Å²	92.7	40%	0.399	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	3.7	-178.7	60.9	0	0	0	0	113.9	H307 N309 H313	H307-T311 PolarHBondContact CE1-OG1 3.36Å; H307-T311 WeakPolarHBondContact ND1-CG2 3.46Å; H307-T311 PolarHBondContact ND1-OG1 3.36Å; H307-T311 WeakPolarHBondContact O-CB 3.44Å; H307-T311 PolarHBondContact O-N 2.87Å; H307-T311 PolarHBondContact O-OG1 2.85Å; N309-T311 PolarHBondContact O-N 3.43Å; T311-H313 PolarHBondContact O-N 3.47Å; T311-H313 PolarHBondContact OG1-CD2 2.8Å
312	G	74.4	Confident	71.5	Confident	61 Å²	61	96.9 Å²	96.9	63%	0.629	49%	0.494	S	S	*	.			trans	67	16.8	174.8	0	0	0	0	0	115.4	M308 N309 Y314	M308-G312 PolarHBondContact O-N 3.42Å; N309-G312 PolarHBondContact O-N 3.02Å; G312-Y314 PolarHBondContact O-N 3.22Å
313	H	79	Confident	69.4	Low	51 Å²	51	98 Å²	98	24%	0.236	49%	0.493	C	S	.	.			trans	-72.2	23.6	177.6	-65.3	-35.1	0	0	0	113.9	D293 H307 M308 T311 R315	D293-H313 HydrophobicContact CB-CB 4.1Å; H307-H313 AromaticContact CE1-CD2 3.85Å; H307-H313 AromaticContact NE2-CD2 3.63Å; M308-H313 HydrophobicContact CE-CB 4.03Å; M308-H313 WeakPolarHBondContact CE-O 3.18Å; M308-H313 PolarHBondContact O-N 2.96Å; T311-H313 PolarHBondContact O-N 3.47Å; T311-H313 PolarHBondContact OG1-CD2 2.8Å; H313-R315 PolarHBondContact O-N 2.6Å; H313-R315 VanDerWaalsContact O-N 3.15Å
314	Y	69.6	Low	67	Low	174 Å²	174	104 Å²	104	68%	0.682	52%	0.519	S	S	*	.			trans	-87.3	79.2	-177.4	-155.5	-80.6	0	0	0	111.4	G312 D316	G312-Y314 PolarHBondContact O-N 3.22Å; Y314-D316 PolarHBondContact O-N 3.26Å
315	R	63.2	Low	64.6	Low	161 Å²	161	112.1 Å²	112.1	61%	0.608	56%	0.557	S	S	*	*			trans	-68.9	107.4	169.5	-78.5	-77.5	-176.8	-179.9	-4.8	111	H313 D317 D320	H313-R315 PolarHBondContact O-N 2.6Å; H313-R315 VanDerWaalsContact O-N 3.15Å; R315-D317 VanDerWaalsContact C-N 3.26Å; R315-D317 PolarHBondContact O-N 3.15Å; R315-D320 IonicContact NH1-OD2 2.64Å; R315-D320 PolarHBondContact NH1-OD2 3.25Å
316	D	51.9	Low	62.6	Low	75 Å²	75	111.9 Å²	111.9	40%	0.401	57%	0.568	S	S	.	*			trans	-75.1	80.8	163.9	-174.7	18.4	0	0	0	110.4	Y314 N318 K319	Y314-D316 PolarHBondContact O-N 3.26Å; D316-N318 PolarHBondContact O-N 3.27Å; D316-N318 WeakPolarHBondContact OD1-CB 3.48Å; D316-N318 PolarHBondContact OD1-ND2 3.28Å; D316-K319 PolarHBondContact O-N 2.79Å
317	D	55	Low	60.1	Low	95 Å²	95	115.8 Å²	115.8	51%	0.508	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.6	7.4	178.3	-114.4	-45.3	0	0	0	114.1	K292 R315	K292-D317 IonicContact NZ-OD2 2.99Å; R315-D317 VanDerWaalsContact C-N 3.26Å; R315-D317 PolarHBondContact O-N 3.15Å
318	N	52.8	Low	57.6	Low	137 Å²	137	126.5 Å²	126.5	73%	0.733	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	-22.6	175.6	-62.6	-72.5	0	0	0	114.9	D316	D316-N318 PolarHBondContact O-N 3.27Å; D316-N318 WeakPolarHBondContact OD1-CB 3.48Å; D316-N318 PolarHBondContact OD1-ND2 3.28Å
319	K	49.2	Very low	54.9	Low	161 Å²	161	137 Å²	137	70%	0.7	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-35.9	-176.5	-72.1	-166.3	175.4	-173.1	0	114.7	D316 K321	D316-K319 PolarHBondContact O-N 2.79Å; K319-K321 PolarHBondContact O-N 3.44Å
320	D	47.3	Very low	52.7	Low	98 Å²	98	136.6 Å²	136.6	52%	0.524	66%	0.663	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.4	13.7	-174.1	-65.9	-4.8	0	0	0	114.8	R315	R315-D320 IonicContact NH1-OD2 2.64Å; R315-D320 PolarHBondContact NH1-OD2 3.25Å
321	K	41.4	Very low	50.6	Low	182 Å²	182	138.6 Å²	138.6	79%	0.791	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	-11.8	-176	-92.6	-163.5	169.2	-162.5	0	116.9	K319	K319-K321 PolarHBondContact O-N 3.44Å
322	E	48.8	Very low	48.9	Very low	182 Å²	182	141.7 Å²	141.7	85%	0.85	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.5	-17.2	-179.8	-62	-169.2	153.3	0	0	112.9
323	E	45.2	Very low	46.9	Very low	130 Å²	130	150.3 Å²	150.3	61%	0.607	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-82.3	-21.1	-175.1	-141.5	-166.5	124.6	0	0	115	Q325 G326 K327	E323-Q325 VanDerWaalsContact C-N 3.3Å; E323-Q325 PolarHBondContact O-N 3.12Å; E323-G326 PolarHBondContact O-N 2.97Å; E323-K327 IonicContact OE1-NZ 2.72Å; E323-K327 PolarHBondContact OE1-NZ 2.77Å
324	D	38.4	Very low	45.1	Very low	148 Å²	148	157.1 Å²	157.1	79%	0.791	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-86.6	8.6	-167.8	-150.7	32.8	0	0	0	114.5
325	Q	38.2	Very low	43.7	Very low	192 Å²	192	160.5 Å²	160.5	90%	0.897	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-101.3	-2.6	171.8	-72.4	-87.7	-54.3	0	0	112.8	E323	E323-Q325 VanDerWaalsContact C-N 3.3Å; E323-Q325 PolarHBondContact O-N 3.12Å
326	G	42.8	Very low	42.3	Very low	64 Å²	64	158.2 Å²	158.2	66%	0.66	75%	0.752	S	S	*	*			trans	-119.8	30.3	-157.5	0	0	0	0	0	118.1	E323	E323-G326 PolarHBondContact O-N 2.97Å
327	K	38.5	Very low	42.2	Very low	145 Å²	145	162.7 Å²	162.7	63%	0.63	78%	0.776	S	S	*	*			trans	-132.6	66.2	-172.4	-55.8	-169.6	-160.3	-58.4	0	116	E323	E323-K327 IonicContact OE1-NZ 2.72Å; E323-K327 PolarHBondContact OE1-NZ 2.77Å
328	R	39.6	Very low	41.7	Very low	238 Å²	238	165.9 Å²	165.9	90%	0.898	79%	0.789	S	S	*	*			trans	-151.9	59.7	160.6	-126.5	-174	-164.3	-131.2	3.3	117
329	W	30.4	Very low	41.6	Very low	262 Å²	262	167.1 Å²	167.1	99%	0.992	79%	0.791	S	S	*	*			trans	-145.1	160.4	141.2	-118.5	-76.4	0	0	0	110
330	S	38	Very low	41.4	Very low	94 Å²	94	166.9 Å²	166.9	66%	0.657	79%	0.794	S	S	*	*			trans	-135.5	154.6	-164.6	68.9	0	0	0	0	114.5
331	K	36.8	Very low	41.7	Very low	196 Å²	196	169.2 Å²	169.2	85%	0.852	80%	0.802	S	S	*	*			trans	83	123.5	171.6	-58.2	176.3	-179.9	176.4	0	116.4
332	P	47.5	Very low	42.2	Very low	129 Å²	129	164.3 Å²	164.3	84%	0.838	80%	0.803	S	S	*	*			trans	-90.5	145.9	177.8	35.6	-34	0	0	0	112.6
333	R	31.6	Very low	42.3	Very low	242 Å²	242	162.2 Å²	162.2	91%	0.913	79%	0.791	S	S	*	*			trans	-155.1	99.9	166.3	-161.3	167.7	-174.9	150.9	0.1	113.5
334	K	41.7	Very low	42.7	Very low	194 Å²	194	159.4 Å²	159.4	84%	0.843	78%	0.778	S	S	*	*			trans	23.9	133.3	158.4	-60.8	-171.8	176.2	-171.4	0	120.3
335	R	39.3	Very low	43.5	Very low	246 Å²	246	158 Å²	158	93%	0.928	77%	0.771	S	S	*	*			trans	78.9	145.4	173.9	92.4	-141.6	168.3	89	0.2	114.3
336	S	34.6	Very low	44.2	Very low	112 Å²	112	151.6 Å²	151.6	78%	0.783	75%	0.75	S	S	*	*			cis	-120.3	172.8	17.9	-157.4	0	0	0	0	115.5	M338	S336-M338 PolarHBondContact O-N 3.25Å
337	L	49.9	Very low	44.9	Very low	170 Å²	170	152.2 Å²	152.2	89%	0.89	74%	0.736	S	S	*	*			trans	-88	41.5	-171	-177.6	120.4	0	0	0	113.3
338	M	44.1	Very low	45.8	Very low	161 Å²	161	150.2 Å²	150.2	79%	0.793	73%	0.727	S	S	*	*			trans	-133.9	53.4	-166.9	-152.4	74.2	151.9	0	0	113.7	S336	S336-M338 PolarHBondContact O-N 3.25Å
339	E	51.3	Low	46.9	Very low	163 Å²	163	144.2 Å²	144.2	76%	0.762	72%	0.717	S	S	*	*			trans	-149.5	60.3	176.1	-157.5	-170.5	162.4	0	0	112.8
340	M	44.6	Very low	49.2	Very low	156 Å²	156	133.5 Å²	133.5	77%	0.768	68%	0.678	S	S	*	*	S	Bend	trans	-118.8	-35.3	169	-65.6	-148.4	-60.8	0	0	114.3	G342 K343	M340-G342 PolarHBondContact O-N 3.23Å; M340-K343 PolarHBondContact O-N 3.01Å; M340-K343 VanDerWaalsContact O-N 3.07Å
341	E	52.3	Low	51.5	Low	148 Å²	148	134.2 Å²	134.2	69%	0.692	67%	0.67	S	S	*	*	H	α-helix	trans	-54	-32.3	-177.7	-69.5	178.2	103.8	0	0	113.7	K343 E344	E341-K343 PolarHBondContact O-N 2.84Å; E341-K343 VanDerWaalsContact O-N 3.11Å; E341-E344 PolarHBondContact O-N 2.86Å
342	G	52.5	Low	53.8	Low	79 Å²	79	124.9 Å²	124.9	81%	0.814	63%	0.629	S	S	*	*	H	α-helix	trans	-67.5	-5.7	179.9	0	0	0	0	0	116.2	M340	M340-G342 PolarHBondContact O-N 3.23Å
343	K	50.4	Low	55.5	Low	137 Å²	137	126.6 Å²	126.6	60%	0.596	63%	0.628	S	S	*	*	H	α-helix	trans	-108.7	-23.2	179.5	-62.9	179.4	-174.5	170.5	0	113.3	M340 E341 D345 A346	M340-K343 PolarHBondContact O-N 3.01Å; M340-K343 VanDerWaalsContact O-N 3.07Å; E341-K343 PolarHBondContact O-N 2.84Å; E341-K343 VanDerWaalsContact O-N 3.11Å; K343-D345 PolarHBondContact O-N 3.17Å; K343-A346 PolarHBondContact O-N 3.21Å
344	E	54.1	Low	57.9	Low	72 Å²	72	118.9 Å²	118.9	34%	0.336	60%	0.599	S	S	.	*	H	α-helix	trans	-62.8	-30.1	-177.3	-58.1	177.4	-155.4	0	0	112.8	E341 A346 Q347 K348	E341-E344 PolarHBondContact O-N 2.86Å; E344-A346 PolarHBondContact O-N 3.07Å; E344-Q347 CarbonylContact O-C 3.51Å; E344-Q347 PolarHBondContact O-N 3.4Å; E344-Q347 VanDerWaalsContact O-N 3.07Å; E344-K348 HydrophobicContact CB-CD 4.22Å; E344-K348 WeakPolarHBondContact O-CB 3.31Å; E344-K348 VanDerWaalsContact O-CG 3.25Å; E344-K348 WeakPolarHBondContact O-CG 3.38Å; E344-K348 PolarHBondContact O-N 3.27Å; E344-K348 VanDerWaalsContact OE2-CE 3.31Å; E344-K348 WeakPolarHBondContact OE2-CE 3.39Å; E344-K348 IonicContact OE2-NZ 2.61Å; E344-K348 PolarHBondContact OE2-NZ 3.04Å
345	D	55.3	Low	60.1	Low	119 Å²	119	111.8 Å²	111.8	64%	0.636	57%	0.574	S	S	*	*	H	α-helix	trans	-69.9	-21.3	-174.7	-135.3	41.7	0	0	0	113	K343 V349	K343-D345 PolarHBondContact O-N 3.17Å; D345-V349 WeakPolarHBondContact O-CG2 3.37Å
346	A	54	Low	62.3	Low	56 Å²	56	102.4 Å²	102.4	46%	0.463	55%	0.554	S	S	.	*	H	α-helix	trans	-74.1	-46.1	166.5	0	0	0	0	0	111.5	K343 E344 K348 V349	K343-A346 PolarHBondContact O-N 3.21Å; E344-A346 PolarHBondContact O-N 3.07Å; A346-K348 VanDerWaalsContact C-N 3.34Å; A346-K348 PolarHBondContact O-N 2.81Å; A346-V349 PolarHBondContact O-N 2.93Å
347	Q	55.9	Low	64.7	Low	78 Å²	78	102.4 Å²	102.4	36%	0.364	54%	0.541	S	S	.	.	H	α-helix	trans	-65.5	-34.9	-179.2	-63.4	178.7	-10.3	0	0	112.6	E344 V349 L350 S358 E360	E344-Q347 CarbonylContact O-C 3.51Å; E344-Q347 PolarHBondContact O-N 3.4Å; E344-Q347 VanDerWaalsContact O-N 3.07Å; Q347-V349 VanDerWaalsContact C-N 3.27Å; Q347-V349 PolarHBondContact O-N 3.43Å; Q347-L350 PolarHBondContact O-N 3.45Å; Q347-S358 WeakPolarHBondContact O-CB 3.41Å; Q347-E360 VanDerWaalsContact CG-OE2 3.26Å; Q347-E360 WeakPolarHBondContact CG-OE2 3.42Å; Q347-E360 PolarHBondContact NE2-OE2 3.12Å
348	K	57.3	Low	66.3	Low	103 Å²	103	97.2 Å²	97.2	45%	0.448	52%	0.519	S	S	.	.	H	α-helix	trans	-64.3	-28.1	179.8	-76.4	163.2	-175.9	163.1	0	112.8	E344 A346	E344-K348 HydrophobicContact CB-CD 4.22Å; E344-K348 WeakPolarHBondContact O-CB 3.31Å; E344-K348 VanDerWaalsContact O-CG 3.25Å; E344-K348 WeakPolarHBondContact O-CG 3.38Å; E344-K348 PolarHBondContact O-N 3.27Å; E344-K348 VanDerWaalsContact OE2-CE 3.31Å; E344-K348 WeakPolarHBondContact OE2-CE 3.39Å; E344-K348 IonicContact OE2-NZ 2.61Å; E344-K348 PolarHBondContact OE2-NZ 3.04Å; A346-K348 VanDerWaalsContact C-N 3.34Å; A346-K348 PolarHBondContact O-N 2.81Å
349	V	63.5	Low	68.2	Low	112 Å²	112	91.4 Å²	91.4	68%	0.679	49%	0.489	S	S	*	.	H	α-helix	trans	-80.9	-26.9	-176.8	173.9	0	0	0	0	113.2	D345 A346 Q347	D345-V349 WeakPolarHBondContact O-CG2 3.37Å; A346-V349 PolarHBondContact O-N 2.93Å; Q347-V349 VanDerWaalsContact C-N 3.27Å; Q347-V349 PolarHBondContact O-N 3.43Å
350	L	78.6	Confident	69.8	Low	36 Å²	36	89.4 Å²	89.4	19%	0.188	48%	0.48	C	S	.	.			trans	-109.3	59.9	-168.9	-62	-177.4	0	0	0	112.8	Q347 F359 L362 L365	Q347-L350 PolarHBondContact O-N 3.45Å; L350-F359 WeakPolarHBondContact CB-O 3.32Å; L350-F359 PolarHBondContact O-N 2.84Å; L350-L362 HydrophobicContact CD1-CB 4.49Å; L350-L362 HydrophobicContact CD1-CG 3.99Å; L350-L362 HydrophobicContact CD2-CD1 4.5Å; L350-L362 HydrophobicContact CD2-CD2 3.7Å; L350-L362 HydrophobicContact CD2-CG 3.69Å; L350-L365 HydrophobicContact CB-CD2 4.32Å
351	K	86.1	Confident	71.6	Confident	110 Å²	110	84 Å²	84	48%	0.478	46%	0.457	S	S	.	.	B	Isolated β-bridge	trans	-92.6	143.6	177.6	-63.7	-177.6	-179.6	-174.5	0	112.6	M353 H357 S358	K351-M353 PolarHBondContact O-N 3.4Å; K351-H357 CarbonylContact C-O 3.6Å; K351-H357 VanDerWaalsContact CA-O 3.27Å; K351-H357 WeakPolarHBondContact CA-O 3.46Å; K351-S358 WeakPolarHBondContact CE-OG 3.43Å
352	C	86.3	Confident	73.3	Confident	0 Å²	0	82.4 Å²	82.4	0%	0	45%	0.453	C	S	.	.			trans	-76.2	117.1	170.2	-174.5	0	0	0	0	111	Y354 C355 G356 H357 F359 L365 H368 H374	C352-Y354 PolarHBondContact O-N 3.42Å; C352-C355 PolarHBondContact O-N 3.38Å; C352-C355 VanDerWaalsContact O-N 3.12Å; C352-G356 PolarHBondContact O-N 3Å; C352-H357 PolarHBondContact N-O 3.46Å; C352-F359 HydrophobicContact CB-CE2 3.9Å; C352-L365 HydrophobicContact CB-CD1 3.62Å; C352-H368 VanDerWaalsContact SG-CD2 3.58Å; C352-H368 PolarHBondContact SG-NE2 3.17Å; C352-H374 PolarHBondContact SG-ND1 3.4Å
353	M	82.3	Confident	75	Confident	164 Å²	164	85 Å²	85	81%	0.808	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-12.1	-175.2	-166.2	141.3	60.7	0	0	115.4	K351	K351-M353 PolarHBondContact O-N 3.4Å
354	Y	82.8	Confident	76.8	Confident	81 Å²	81	82.6 Å²	82.6	32%	0.318	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-11.5	-179.1	-70.1	-85.1	0	0	0	114.8	C352 H374 K377 V378	C352-Y354 PolarHBondContact O-N 3.42Å; Y354-H374 HydrophobicContact CD2-CB 3.9Å; Y354-H374 WeakPolarHBondContact CD2-O 3.33Å; Y354-H374 WeakPolarHBondContact CE2-O 3.42Å; Y354-H374 HydrophobicContact CG-CB 4.04Å; Y354-K377 HydrophobicContact CD1-CB 4.07Å; Y354-K377 HydrophobicContact CE1-CB 3.61Å; Y354-K377 VanDerWaalsContact OH-C 3.23Å; Y354-K377 PolarHBondContact OH-O 3.42Å; Y354-V378 HydrophobicContact CE2-CG2 3.74Å; Y354-V378 WeakPolarHBondContact OH-CA 3.37Å; Y354-V378 PolarHBondContact OH-N 3.38Å
355	C	87.3	Confident	78.5	Confident	45 Å²	45	80 Å²	80	30%	0.304	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.7	10.6	-176.1	66.8	0	0	0	0	114.5	C352 H357 H368 H374	C352-C355 PolarHBondContact O-N 3.38Å; C352-C355 VanDerWaalsContact O-N 3.12Å; C355-H357 PolarHBondContact O-N 3.31Å; C355-H357 PolarHBondContact SG-CD2 3.32Å; C355-H368 PolarHBondContact SG-NE2 3.38Å; C355-H374 VanDerWaalsContact SG-CE1 3.54Å
356	G	84.6	Confident	80	Confident	49 Å²	49	76.5 Å²	76.5	51%	0.505	41%	0.411	S	S	.	.			trans	71.1	-22.3	171.8	0	0	0	0	0	116.8	C352 S358	C352-G356 PolarHBondContact O-N 3Å; G356-S358 PolarHBondContact O-N 3.15Å
357	H	85	Confident	81.8	Confident	112 Å²	112	77.8 Å²	77.8	52%	0.519	41%	0.413	S	S	.	.			trans	-51.1	126.2	-178.6	-62.6	-39.9	0	0	0	112.2	K351 C352 C355 F359	K351-H357 CarbonylContact C-O 3.6Å; K351-H357 VanDerWaalsContact CA-O 3.27Å; K351-H357 WeakPolarHBondContact CA-O 3.46Å; C352-H357 PolarHBondContact N-O 3.46Å; C355-H357 PolarHBondContact O-N 3.31Å; C355-H357 PolarHBondContact SG-CD2 3.32Å; H357-F359 HydrophobicContact CB-CE2 3.74Å; H357-F359 HydrophobicContact CB-CZ 3.78Å; H357-F359 VanDerWaalsContact O-CD2 3.32Å; H357-F359 WeakPolarHBondContact O-CD2 3.26Å; H357-F359 WeakPolarHBondContact O-CE2 3.31Å
358	S	84.7	Confident	83.4	Confident	61 Å²	61	75.3 Å²	75.3	43%	0.427	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-75.8	146.6	169.2	-52.8	0	0	0	0	110.9	Q347 K351 G356	Q347-S358 WeakPolarHBondContact O-CB 3.41Å; K351-S358 WeakPolarHBondContact CE-OG 3.43Å; G356-S358 PolarHBondContact O-N 3.15Å
359	F	82.8	Confident	84.9	Confident	39 Å²	39	72.7 Å²	72.7	17%	0.171	39%	0.391	C	S	.	.			trans	-129.8	141.7	173.5	-62.7	-87.3	0	0	0	110.3	L350 C352 H357 S361 D364 L365 H368	L350-F359 WeakPolarHBondContact CB-O 3.32Å; L350-F359 PolarHBondContact O-N 2.84Å; C352-F359 HydrophobicContact CB-CE2 3.9Å; H357-F359 HydrophobicContact CB-CE2 3.74Å; H357-F359 HydrophobicContact CB-CZ 3.78Å; H357-F359 VanDerWaalsContact O-CD2 3.32Å; H357-F359 WeakPolarHBondContact O-CD2 3.26Å; H357-F359 WeakPolarHBondContact O-CE2 3.31Å; F359-S361 PolarHBondContact O-N 3.11Å; F359-D364 HydrophobicContact CB-CB 4.36Å; F359-D364 HydrophobicContact CD1-CB 4.19Å; F359-L365 HydrophobicContact CB-CB 4.02Å; F359-L365 HydrophobicContact CD2-CB 3.96Å; F359-L365 HydrophobicContact CD2-CD1 3.7Å; F359-L365 HydrophobicContact CD2-CG 4.39Å; F359-L365 HydrophobicContact CE2-CD1 3.97Å; F359-L365 HydrophobicContact CG-CB 4.07Å; F359-H368 HydrophobicContact CD1-CB 4.39Å; F359-H368 HydrophobicContact CE1-CB 3.64Å; F359-H368 AromaticContact CE1-CG 3.81Å; F359-H368 HydrophobicContact CE2-CB 4.18Å; F359-H368 AromaticContact CE2-CD2 3.81Å; F359-H368 AromaticContact CE2-CG 3.84Å; F359-H368 HydrophobicContact CZ-CB 3.54Å; F359-H368 AromaticContact CZ-CD2 3.62Å; F359-H368 AromaticContact CZ-CE1 3.91Å; F359-H368 AromaticContact CZ-CG 3.21Å; F359-H368 AromaticContact CZ-ND1 3.43Å; F359-H368 WeakPolarHBondContact CZ-ND1 3.49Å
360	E	84.8	Confident	86.1	Confident	120 Å²	120	72.5 Å²	72.5	56%	0.561	39%	0.385	S	S	*	.	S	Bend	trans	-63.4	-26.8	177.2	-173.3	63.3	-154.7	0	0	112.4	Q347	Q347-E360 VanDerWaalsContact CG-OE2 3.26Å; Q347-E360 WeakPolarHBondContact CG-OE2 3.42Å; Q347-E360 PolarHBondContact NE2-OE2 3.12Å
361	S	84.2	Confident	86.6	Confident	43 Å²	43	79.5 Å²	79.5	30%	0.301	41%	0.414	S	S	.	.			trans	-136	145.9	-173.6	-177.9	0	0	0	0	112.7	F359 Q363 D364 L365	F359-S361 PolarHBondContact O-N 3.11Å; S361-Q363 PolarHBondContact O-N 3.34Å; S361-Q363 WeakPolarHBondContact OG-CB 3.36Å; S361-Q363 PolarHBondContact OG-N 3.42Å; S361-Q363 VanDerWaalsContact OG-N 3.11Å; S361-D364 WeakPolarHBondContact CB-OD2 3.37Å; S361-D364 PolarHBondContact O-N 3.24Å; S361-D364 VanDerWaalsContact O-N 3.15Å; S361-L365 PolarHBondContact O-N 3.29Å
362	L	87.4	Confident	86.3	Confident	115 Å²	115	76.9 Å²	76.9	60%	0.602	41%	0.407	S	S	*	.	H	α-helix	trans	-58.4	-30.6	168	-93.8	170.6	0	0	0	111.5	L350 L365 S366	L350-L362 HydrophobicContact CD1-CB 4.49Å; L350-L362 HydrophobicContact CD1-CG 3.99Å; L350-L362 HydrophobicContact CD2-CD1 4.5Å; L350-L362 HydrophobicContact CD2-CD2 3.7Å; L350-L362 HydrophobicContact CD2-CG 3.69Å; L362-L365 HydrophobicContact CD2-CD2 4.46Å; L362-S366 WeakPolarHBondContact O-CB 3.42Å; L362-S366 PolarHBondContact O-N 2.74Å; L362-S366 PolarHBondContact O-OG 3.37Å
363	Q	86.8	Confident	86.1	Confident	134 Å²	134	83.7 Å²	83.7	63%	0.626	44%	0.437	S	S	*	.	H	α-helix	trans	-65.3	-47.6	176.7	-141.1	69.8	15.1	0	0	110.2	S361 S366 V367	S361-Q363 PolarHBondContact O-N 3.34Å; S361-Q363 WeakPolarHBondContact OG-CB 3.36Å; S361-Q363 PolarHBondContact OG-N 3.42Å; S361-Q363 VanDerWaalsContact OG-N 3.11Å; Q363-S366 PolarHBondContact O-N 2.66Å; Q363-S366 PolarHBondContact O-OG 2.95Å; Q363-V367 WeakPolarHBondContact O-CG2 3.29Å; Q363-V367 PolarHBondContact O-N 3.47Å
364	D	89.7	Confident	86	Confident	85 Å²	85	77.9 Å²	77.9	46%	0.455	41%	0.408	S	S	.	.	H	α-helix	trans	-70.1	-38.3	-179.4	-59.1	-38.9	0	0	0	112.1	F359 S361 S366 V367 H368	F359-D364 HydrophobicContact CB-CB 4.36Å; F359-D364 HydrophobicContact CD1-CB 4.19Å; S361-D364 WeakPolarHBondContact CB-OD2 3.37Å; S361-D364 PolarHBondContact O-N 3.24Å; S361-D364 VanDerWaalsContact O-N 3.15Å; D364-S366 VanDerWaalsContact C-N 3.32Å; D364-S366 PolarHBondContact O-N 2.88Å; D364-V367 PolarHBondContact O-N 3.29Å; D364-H368 VanDerWaalsContact O-CB 3.24Å; D364-H368 WeakPolarHBondContact O-CB 3.49Å; D364-H368 PolarHBondContact O-N 3.11Å
365	L	89.6	Confident	85.5	Confident	18 Å²	18	78.9 Å²	78.9	9%	0.094	41%	0.412	C	S	.	.	H	α-helix	trans	-58.9	-42.5	169.4	173.2	57.1	0	0	0	111.5	L350 C352 F359 S361 L362 H368 M369	L350-L365 HydrophobicContact CB-CD2 4.32Å; C352-L365 HydrophobicContact CB-CD1 3.62Å; F359-L365 HydrophobicContact CB-CB 4.02Å; F359-L365 HydrophobicContact CD2-CB 3.96Å; F359-L365 HydrophobicContact CD2-CD1 3.7Å; F359-L365 HydrophobicContact CD2-CG 4.39Å; F359-L365 HydrophobicContact CE2-CD1 3.97Å; F359-L365 HydrophobicContact CG-CB 4.07Å; S361-L365 PolarHBondContact O-N 3.29Å; L362-L365 HydrophobicContact CD2-CD2 4.46Å; L365-H368 PolarHBondContact O-N 3.39Å; L365-M369 HydrophobicContact CD1-CG 4.03Å; L365-M369 HydrophobicContact CD1-SD 4.17Å; L365-M369 HydrophobicContact CG-SD 4.43Å; L365-M369 WeakPolarHBondContact O-CB 3.37Å; L365-M369 WeakPolarHBondContact O-CG 3.17Å; L365-M369 PolarHBondContact O-N 2.77Å
366	S	86.7	Confident	84.7	Confident	46 Å²	46	82.9 Å²	82.9	32%	0.322	43%	0.426	S	S	.	.	H	α-helix	trans	-67.6	-43	178.2	77.7	0	0	0	0	112.3	L362 Q363 D364 M369 I370	L362-S366 WeakPolarHBondContact O-CB 3.42Å; L362-S366 PolarHBondContact O-N 2.74Å; L362-S366 PolarHBondContact O-OG 3.37Å; Q363-S366 PolarHBondContact O-N 2.66Å; Q363-S366 PolarHBondContact O-OG 2.95Å; D364-S366 VanDerWaalsContact C-N 3.32Å; D364-S366 PolarHBondContact O-N 2.88Å; S366-M369 PolarHBondContact O-N 3.04Å; S366-I370 WeakPolarHBondContact O-CB 3.3Å; S366-I370 WeakPolarHBondContact O-CD1 3.39Å; S366-I370 VanDerWaalsContact O-CG1 3.24Å; S366-I370 WeakPolarHBondContact O-CG1 3.37Å; S366-I370 PolarHBondContact O-N 2.77Å
367	V	91.4	Very high	83.4	Confident	82 Å²	82	88.1 Å²	88.1	50%	0.497	44%	0.435	S	S	.	.	H	α-helix	trans	-63.9	-42.3	175.5	169.8	0	0	0	0	110.4	Q363 D364 I370 K371	Q363-V367 WeakPolarHBondContact O-CG2 3.29Å; Q363-V367 PolarHBondContact O-N 3.47Å; D364-V367 PolarHBondContact O-N 3.29Å; V367-I370 PolarHBondContact O-N 2.9Å; V367-K371 WeakPolarHBondContact O-CB 3.5Å; V367-K371 PolarHBondContact O-N 3.4Å
368	H	90.6	Very high	81.8	Confident	27 Å²	27	85.2 Å²	85.2	13%	0.125	43%	0.425	C	S	.	.	H	α-helix	trans	-58.4	-56	172.5	167.8	84.3	0	0	0	110.8	C352 C355 F359 D364 L365 I370 K371 T372 H374	C352-H368 VanDerWaalsContact SG-CD2 3.58Å; C352-H368 PolarHBondContact SG-NE2 3.17Å; C355-H368 PolarHBondContact SG-NE2 3.38Å; F359-H368 HydrophobicContact CD1-CB 4.39Å; F359-H368 HydrophobicContact CE1-CB 3.64Å; F359-H368 AromaticContact CE1-CG 3.81Å; F359-H368 HydrophobicContact CE2-CB 4.18Å; F359-H368 AromaticContact CE2-CD2 3.81Å; F359-H368 AromaticContact CE2-CG 3.84Å; F359-H368 HydrophobicContact CZ-CB 3.54Å; F359-H368 AromaticContact CZ-CD2 3.62Å; F359-H368 AromaticContact CZ-CE1 3.91Å; F359-H368 AromaticContact CZ-CG 3.21Å; F359-H368 AromaticContact CZ-ND1 3.43Å; F359-H368 WeakPolarHBondContact CZ-ND1 3.49Å; D364-H368 VanDerWaalsContact O-CB 3.24Å; D364-H368 WeakPolarHBondContact O-CB 3.49Å; D364-H368 PolarHBondContact O-N 3.11Å; L365-H368 PolarHBondContact O-N 3.39Å; H368-I370 PolarHBondContact O-N 3.27Å; H368-K371 PolarHBondContact O-N 3.34Å; H368-T372 VanDerWaalsContact CE1-CG2 3.43Å; H368-T372 WeakPolarHBondContact CE1-CG2 3.24Å; H368-T372 PolarHBondContact O-N 3.05Å; H368-T372 PolarHBondContact O-OG1 3.01Å; H368-H374 AromaticContact NE2-CE1 3.79Å; H368-H374 AromaticContact NE2-ND1 3.32Å; H368-H374 PolarHBondContact NE2-ND1 3.01Å
369	M	89.1	Confident	80.2	Confident	47 Å²	47	87.8 Å²	87.8	23%	0.232	44%	0.44	C	S	.	.	H	α-helix	trans	-56.1	-38.7	-178.1	-79.2	-174.9	74.8	0	0	112.4	L365 S366 K373 H374 Y375	L365-M369 HydrophobicContact CD1-CG 4.03Å; L365-M369 HydrophobicContact CD1-SD 4.17Å; L365-M369 HydrophobicContact CG-SD 4.43Å; L365-M369 WeakPolarHBondContact O-CB 3.37Å; L365-M369 WeakPolarHBondContact O-CG 3.17Å; L365-M369 PolarHBondContact O-N 2.77Å; S366-M369 PolarHBondContact O-N 3.04Å; M369-K373 CarbonylContact O-C 3.46Å; M369-K373 WeakPolarHBondContact O-CA 3.23Å; M369-K373 PolarHBondContact O-N 3.16Å; M369-H374 HydrophobicContact CG-CB 4.46Å; M369-H374 PolarHBondContact O-N 2.87Å; M369-Y375 WeakPolarHBondContact O-CD1 3.43Å; M369-Y375 PolarHBondContact O-N 3.26Å
370	I	88.4	Confident	78.4	Confident	109 Å²	109	92.5 Å²	92.5	56%	0.559	47%	0.466	S	S	*	.	H	α-helix	trans	-67.3	-51.8	174.5	-67.9	165.3	0	0	0	110.8	S366 V367 H368 T372 K373 Y375	S366-I370 WeakPolarHBondContact O-CB 3.3Å; S366-I370 WeakPolarHBondContact O-CD1 3.39Å; S366-I370 VanDerWaalsContact O-CG1 3.24Å; S366-I370 WeakPolarHBondContact O-CG1 3.37Å; S366-I370 PolarHBondContact O-N 2.77Å; V367-I370 PolarHBondContact O-N 2.9Å; H368-I370 PolarHBondContact O-N 3.27Å; I370-T372 PolarHBondContact O-N 3.14Å; I370-K373 PolarHBondContact O-N 3.34Å; I370-K373 VanDerWaalsContact O-N 3.13Å; I370-Y375 HydrophobicContact CG1-CD1 4.46Å
371	K	88.1	Confident	76.4	Confident	183 Å²	183	96.7 Å²	96.7	80%	0.796	48%	0.483	S	S	*	.	H	α-helix	trans	-63.2	-37.9	-176.5	-174	177.7	180	-177.7	0	113	V367 H368	V367-K371 WeakPolarHBondContact O-CB 3.5Å; V367-K371 PolarHBondContact O-N 3.4Å; H368-K371 PolarHBondContact O-N 3.34Å
372	T	80.9	Confident	74	Confident	55 Å²	55	102.4 Å²	102.4	34%	0.337	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-1.2	176.6	60	0	0	0	0	113.7	H368 I370 H374	H368-T372 VanDerWaalsContact CE1-CG2 3.43Å; H368-T372 WeakPolarHBondContact CE1-CG2 3.24Å; H368-T372 PolarHBondContact O-N 3.05Å; H368-T372 PolarHBondContact O-OG1 3.01Å; I370-T372 PolarHBondContact O-N 3.14Å; T372-H374 PolarHBondContact O-CD2 3.36Å; T372-H374 PolarHBondContact O-N 2.84Å; T372-H374 VanDerWaalsContact O-N 3.16Å; T372-H374 PolarHBondContact OG1-CD2 3.01Å; T372-H374 PolarHBondContact OG1-CE1 3.08Å; T372-H374 PolarHBondContact OG1-ND1 2.97Å; T372-H374 VanDerWaalsContact OG1-ND1 3.13Å
373	K	80.3	Confident	71.7	Confident	143 Å²	143	103 Å²	103	62%	0.622	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	20.1	-173.3	-56	-178.5	179.8	178.4	0	114.4	M369 I370 Y375 Q376	M369-K373 CarbonylContact O-C 3.46Å; M369-K373 WeakPolarHBondContact O-CA 3.23Å; M369-K373 PolarHBondContact O-N 3.16Å; I370-K373 PolarHBondContact O-N 3.34Å; I370-K373 VanDerWaalsContact O-N 3.13Å; K373-Y375 HydrophobicContact CB-CE1 4.3Å; K373-Y375 HydrophobicContact CG-CE1 4.4Å; K373-Y375 PolarHBondContact O-N 3.26Å; K373-Q376 HydrophobicContact CB-CB 4.47Å; K373-Q376 VanDerWaalsContact O-CB 3.25Å; K373-Q376 WeakPolarHBondContact O-CB 3.15Å; K373-Q376 PolarHBondContact O-N 3.31Å
374	H	80.9	Confident	69.1	Low	41 Å²	41	102.4 Å²	102.4	19%	0.19	52%	0.521	C	S	.	.	G	3₁₀ helix	trans	-62.1	-22.3	176.2	-69.1	173.8	0	0	0	112.8	C352 Y354 C355 H368 M369 T372 Q376	C352-H374 PolarHBondContact SG-ND1 3.4Å; Y354-H374 HydrophobicContact CD2-CB 3.9Å; Y354-H374 WeakPolarHBondContact CD2-O 3.33Å; Y354-H374 WeakPolarHBondContact CE2-O 3.42Å; Y354-H374 HydrophobicContact CG-CB 4.04Å; C355-H374 VanDerWaalsContact SG-CE1 3.54Å; H368-H374 AromaticContact NE2-CE1 3.79Å; H368-H374 AromaticContact NE2-ND1 3.32Å; H368-H374 PolarHBondContact NE2-ND1 3.01Å; M369-H374 HydrophobicContact CG-CB 4.46Å; M369-H374 PolarHBondContact O-N 2.87Å; T372-H374 PolarHBondContact O-CD2 3.36Å; T372-H374 PolarHBondContact O-N 2.84Å; T372-H374 VanDerWaalsContact O-N 3.16Å; T372-H374 PolarHBondContact OG1-CD2 3.01Å; T372-H374 PolarHBondContact OG1-CE1 3.08Å; T372-H374 PolarHBondContact OG1-ND1 2.97Å; T372-H374 VanDerWaalsContact OG1-ND1 3.13Å; H374-Q376 PolarHBondContact O-N 2.7Å
375	Y	73.1	Confident	67	Low	103 Å²	103	104.3 Å²	104.3	40%	0.404	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-61	-29.9	168.8	73.9	-90.3	0	0	0	113.4	M369 I370 K373 K377 V378	M369-Y375 WeakPolarHBondContact O-CD1 3.43Å; M369-Y375 PolarHBondContact O-N 3.26Å; I370-Y375 HydrophobicContact CG1-CD1 4.46Å; K373-Y375 HydrophobicContact CB-CE1 4.3Å; K373-Y375 HydrophobicContact CG-CE1 4.4Å; K373-Y375 PolarHBondContact O-N 3.26Å; Y375-K377 VanDerWaalsContact C-N 3.3Å; Y375-K377 PolarHBondContact O-N 3.36Å; Y375-V378 WeakPolarHBondContact O-CB 3.43Å; Y375-V378 WeakPolarHBondContact O-CG2 3.25Å; Y375-V378 PolarHBondContact O-N 3.44Å
376	Q	69.3	Low	64.1	Low	128 Å²	128	108.3 Å²	108.3	60%	0.598	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-76.9	-17.5	-171.6	-165.9	62.9	69.1	0	0	112.9	K373 H374	K373-Q376 HydrophobicContact CB-CB 4.47Å; K373-Q376 VanDerWaalsContact O-CB 3.25Å; K373-Q376 WeakPolarHBondContact O-CB 3.15Å; K373-Q376 PolarHBondContact O-N 3.31Å; H374-Q376 PolarHBondContact O-N 2.7Å
377	K	57.7	Low	61.5	Low	159 Å²	159	114.4 Å²	114.4	69%	0.691	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-95.6	7	175.9	-68	-172.4	176.6	-176.9	0	113.3	Y354 Y375 P379	Y354-K377 HydrophobicContact CD1-CB 4.07Å; Y354-K377 HydrophobicContact CE1-CB 3.61Å; Y354-K377 VanDerWaalsContact OH-C 3.23Å; Y354-K377 PolarHBondContact OH-O 3.42Å; Y375-K377 VanDerWaalsContact C-N 3.3Å; Y375-K377 PolarHBondContact O-N 3.36Å; K377-P379 WeakPolarHBondContact O-CD 3.42Å
378	V	51.8	Low	58.5	Low	52 Å²	52	115 Å²	115	32%	0.315	62%	0.615	S	S	.	*	S	Bend	trans	-75.5	121.3	169	-179.1	0	0	0	0	109	Y354 Y375 L380	Y354-V378 HydrophobicContact CE2-CG2 3.74Å; Y354-V378 WeakPolarHBondContact OH-CA 3.37Å; Y354-V378 PolarHBondContact OH-N 3.38Å; Y375-V378 WeakPolarHBondContact O-CB 3.43Å; Y375-V378 WeakPolarHBondContact O-CG2 3.25Å; Y375-V378 PolarHBondContact O-N 3.44Å; V378-L380 HydrophobicContact CG1-CD2 4.45Å; V378-L380 PolarHBondContact O-N 2.89Å
379	P	51.2	Low	55.7	Low	115 Å²	115	120.7 Å²	120.7	75%	0.747	65%	0.652	S	S	*	*			trans	-68.8	88.9	178.7	-22.2	35.9	0	0	0	112.2	K377 K381	K377-P379 WeakPolarHBondContact O-CD 3.42Å; P379-K381 PolarHBondContact O-N 3.18Å
380	L	45.3	Very low	52.9	Low	137 Å²	137	127.6 Å²	127.6	72%	0.717	68%	0.68	S	S	*	*			trans	-72.7	89.7	175.5	-65.8	176.2	0	0	0	110.6	V378 E382	V378-L380 HydrophobicContact CG1-CD2 4.45Å; V378-L380 PolarHBondContact O-N 2.89Å; L380-E382 VanDerWaalsContact C-N 3.3Å; L380-E382 PolarHBondContact O-N 3.45Å
381	K	41.2	Very low	50.1	Low	209 Å²	209	130.6 Å²	130.6	91%	0.909	70%	0.697	S	S	*	*			trans	-74.2	83.8	164.7	-89.6	-162.6	171.5	-175.2	0	110.8	P379	P379-K381 PolarHBondContact O-N 3.18Å
382	E	34.7	Very low	47.3	Very low	162 Å²	162	127.9 Å²	127.9	76%	0.757	70%	0.695	S	S	*	*			trans	-82.4	138.5	161.8	-65.7	-164.4	132.7	0	0	111.3	L380	L380-E382 VanDerWaalsContact C-N 3.3Å; L380-E382 PolarHBondContact O-N 3.45Å
383	P	39.8	Very low	45.7	Very low	127 Å²	127	130.2 Å²	130.2	83%	0.825	71%	0.711	S	S	*	*			trans	-113	100.9	163	34	-22.4	0	0	0	110.7
384	V	31.8	Very low	43.1	Very low	123 Å²	123	130 Å²	130	75%	0.745	72%	0.722	S	S	*	*			trans	-131.3	134.6	172.8	-179.4	0	0	0	0	108.4
385	P	44.8	Very low	40.6	Very low	125 Å²	125	133 Å²	133	81%	0.812	75%	0.748	S	S	*	*			trans	-91.4	158.6	-165	35.7	-36.7	0	0	0	114.3
386	A	29.3	Very low	38.7	Very low	101 Å²	101	132.9 Å²	132.9	84%	0.835	77%	0.768	S	S	*	*			trans	-139.4	150.5	167.1	0	0	0	0	0	111.2
387	L	31.5	Very low	36.9	Very low	174 Å²	174	136.1 Å²	136.1	91%	0.911	78%	0.78	S	S	*	*			trans	-107.6	147.2	175.6	-70.8	171.7	0	0	0	111.3
388	A	28.9	Very low	35.7	Very low	95 Å²	95	136.1 Å²	136.1	79%	0.785	78%	0.78	S	S	*	*			trans	53.6	111.3	154.7	0	0	0	0	0	119.8
389	T	30.7	Very low	34.6	Very low	146 Å²	146	144.2 Å²	144.2	90%	0.896	81%	0.805	S	S	*	*			trans	-148.3	147	131.3	-70.3	0	0	0	0	108.2
390	K	30.5	Very low	33.4	Very low	192 Å²	192	142.4 Å²	142.4	84%	0.835	80%	0.799	S	S	*	*			trans	-95.2	147.1	-179.6	-66.2	-173.7	176.5	-174.6	0	111.3
391	L	30.6	Very low	32.6	Very low	173 Å²	173	143 Å²	143	91%	0.906	80%	0.802	S	S	*	*			trans	-168	138.3	132.5	-101.4	170.8	0	0	0	110.1
392	V	30	Very low	31.9	Very low	126 Å²	126	140.2 Å²	140.2	76%	0.764	79%	0.792	S	S	*	*			trans	-167.3	158.1	-158.6	172.5	0	0	0	0	107.3
393	P	46	Very low	31.4	Very low	104 Å²	104	138.3 Å²	138.3	68%	0.675	79%	0.787	S	S	*	*			cis	-127.4	177.6	-16	35.7	-19.4	0	0	0	115.2
394	T	26.8	Very low	30.7	Very low	138 Å²	138	138.3 Å²	138.3	85%	0.847	78%	0.784	S	S	*	*			trans	-128.4	173.5	134.9	54.8	0	0	0	0	110.2
395	S	28.1	Very low	30.6	Very low	105 Å²	105	139.5 Å²	139.5	73%	0.734	79%	0.785	S	S	*	*				-167.6	152.2	-92.4	47.7	0	0	0	0	112.5
396	A	33.3	Very low	29.8	Very low	100 Å²	100	140.4 Å²	140.4	83%	0.826	79%	0.788	S	S	*	*			cis	-174.4	147.4	-21.5	0	0	0	0	0	108.5
397	K	30.2	Very low	29.5	Very low	195 Å²	195	140.5 Å²	140.5	85%	0.848	78%	0.783	S	S	*	*			trans	-144.3	91.9	171.4	-156.9	169.1	-174.4	175.9	0	116.2
398	K	33	Very low	30	Very low	159 Å²	159	137.6 Å²	137.6	69%	0.691	77%	0.774	S	S	*	*			trans	62.9	110.2	146.5	-65.1	-171	176.2	-175.2	0	121.4
399	R	29.4	Very low	29.6	Very low	223 Å²	223	138.9 Å²	138.9	84%	0.842	78%	0.776	S	S	*	*			trans	77.8	145.4	137.6	-63.2	-175.8	-67.1	-158.5	5.2	118.9
400	A	25.8	Very low	29.3	Very low	76 Å²	76	136.9 Å²	136.9	63%	0.628	77%	0.768	S	S	*	*			cis	-170.6	140.4	-19	0	0	0	0	0	112.5
401	I	28.4	Very low	29.9	Very low	151 Å²	151	133 Å²	133	77%	0.774	76%	0.762	S	S	*	*				58.5	131.6	127.7	-63.5	173.8	0	0	0	118.9
402	Q	25.9	Very low	29.4	Very low	150 Å²	150	132 Å²	132	70%	0.701	76%	0.758	S	S	*	*			cis	-161.1	166.1	-1.5	-125.6	179.7	-62.5	0	0	112.6
403	D	24.1	Very low	29.2	Very low	122 Å²	122	131 Å²	131	65%	0.652	76%	0.757	S	S	*	*			trans	29	131.7	140.6	-65.7	-17.9	0	0	0	122.1
404	V	25.9	Very low	28.2	Very low	126 Å²	126	134 Å²	134	76%	0.764	77%	0.765	S	S	*	*			cis	108.1	160	40.6	161.5	0	0	0	0	111
405	I	28.9	Very low	28.3	Very low	149 Å²	149	136.6 Å²	136.6	76%	0.764	77%	0.767	S	S	*	*			trans	105.2	102.6	171	-56	-169.7	0	0	0	118.2
406	V	28.1	Very low	28.2	Very low	144 Å²	144	136.5 Å²	136.5	87%	0.873	77%	0.773	S	S	*	*			trans	79.8	158	138.4	166.8	0	0	0	0	122.2
407	S	24.4	Very low	27.8	Very low	103 Å²	103	135.4 Å²	135.4	72%	0.72	77%	0.771	S	S	*	*			trans	-103.8	-178.6	179.9	-145	0	0	0	0	110.1
408	P	41.4	Very low	27.7	Very low	112 Å²	112	132.6 Å²	132.6	73%	0.727	78%	0.776	S	S	*	*			cis	-138.4	-162.9	2.1	41.6	-20.7	0	0	0	114.7
409	C	20.7	Very low	27.3	Very low	123 Å²	123	128.8 Å²	128.8	83%	0.831	78%	0.782	S	S	*	*			trans	80.5	159.3	152.6	-146.7	0	0	0	0	120.3
410	S	23.6	Very low	27.2	Very low	104 Å²	104	122 Å²	122	73%	0.727	78%	0.781	S	S	*	*			trans	-113.2	179.6	170.8	-47.1	0	0	0	0	108.7
411	P	42.5	Very low	27.2	Very low	109 Å²	109	122.4 Å²	122.4	71%	0.708	79%	0.794	S	S	*	*			cis	-137.6	-172.8	5.7	44	-25.4	0	0	0	115.9
412	D	21.6	Very low	27.1	Very low	153 Å²	153	118.3 Å²	118.3	82%	0.818	79%	0.789	S	S	*	*			trans	41.9	127.2	152.7	-70	-55.2	0	0	0	124.7
413	S	26	Very low	27.2	Very low	106 Å²	106	117 Å²	117	74%	0.741	80%	0.796	S	S	*	*			trans	62.6	120	141.2	-160.3	0	0	0	0	121.3
414	I	23.4	Very low	27.3	Very low	167 Å²	167	117.8 Å²	117.8	86%	0.856	81%	0.805	S	S	*	*				-174.3	165.5	102.4	48	172	0	0	0	114.3
415	H	29.8	Very low	27.3	Very low	191 Å²	191	117.2 Å²	117.2	88%	0.884	81%	0.806	S	S	*	*			trans	-58.6	137.6	-179	-126.3	-109.5	0	0	0	118
416	A	25.3	Very low	27.2	Very low	103 Å²	103	118.3 Å²	118.3	85%	0.851	81%	0.813	S	S	*	*			trans	-173.5	148.5	145.7	0	0	0	0	0	109.3
417	G	25.2	Very low	27	Very low	77 Å²	77	114.7 Å²	114.7	79%	0.794	80%	0.804	S	S	*	*			cis	-160.2	169.5	-5.1	0	0	0	0	0	110
418	S	28.6	Very low	27	Very low	136 Å²	136	116.4 Å²	116.4	95%	0.951	81%	0.806	S	S	*	*			trans	-93.7	157	-167.6	-171.5	0	0	0	0	114.9
419	G	25.1	Very low	26.4	Very low	79 Å²	79	118.9 Å²	118.9	81%	0.814	81%	0.81	S	S	*	*			trans	-176.3	103.1	167.9	0	0	0	0	0	116
420	G	26.6	Very low	26.7	Very low	80 Å²	80	115.7 Å²	115.7	83%	0.825	80%	0.798	S	S	*	*			trans	117.5	76.8	151.3	0	0	0	0	0	120
421	G	25.2	Very low	27	Very low	86 Å²	86	119.9 Å²	119.9	89%	0.887	80%	0.802	S	S	*	*			trans	60.2	139.3	145.6	0	0	0	0	0	121.6
422	G	26.2	Very low	26.3	Very low	65 Å²	65	121.2 Å²	121.2	67%	0.67	80%	0.804	S	S	*	*			cis	161.5	131.2	-10.6	0	0	0	0	0	114.3
423	S	27.8	Very low	26.7	Very low	122 Å²	122	119 Å²	119	85%	0.853	80%	0.8	S	S	*	*			trans	60.7	141.4	167.8	70.6	0	0	0	0	117.8
424	V	27.1	Very low	27	Very low	139 Å²	139	123.2 Å²	123.2	84%	0.842	81%	0.805	S	S	*	*			cis	-124.1	-167.4	5.7	-69.7	0	0	0	0	109.3
425	S	26.3	Very low	27.4	Very low	113 Å²	113	119.1 Å²	119.1	79%	0.79	80%	0.796	S	S	*	*			cis	-154.7	-168.7	7	-157.4	0	0	0	0	111.1
426	L	25.6	Very low	27.5	Very low	172 Å²	172	116.4 Å²	116.4	90%	0.901	79%	0.793	S	S	*	*			trans	-147.4	146.3	177.4	-179.6	66.1	0	0	0	112.2
427	G	24.9	Very low	27.6	Very low	68 Å²	68	115.9 Å²	115.9	70%	0.701	79%	0.789	S	S	*	*			trans	88.5	159.9	168	0	0	0	0	0	116
428	D	25.1	Very low	28.1	Very low	139 Å²	139	119.5 Å²	119.5	74%	0.743	79%	0.79	S	S	*	*			cis	-161.9	164	-9.3	-174.7	32.4	0	0	0	110.8
429	M	27.3	Very low	29	Very low	165 Å²	165	116.6 Å²	116.6	81%	0.813	77%	0.768	S	S	*	*			trans	38.6	141.2	165.5	-76	-64.1	106.2	0	0	121.7
430	G	27.8	Very low	28.8	Very low	56 Å²	56	120.5 Å²	120.5	58%	0.577	76%	0.759	S	S	*	*			cis	160.4	169	-1.3	0	0	0	0	0	112.3
431	K	29.3	Very low	28.9	Very low	191 Å²	191	120.6 Å²	120.6	83%	0.83	74%	0.744	S	S	*	*			trans	69.7	149.1	175.1	-69.7	-175.7	167.8	-164.3	0	117.1
432	D	27.3	Very low	29.2	Very low	137 Å²	137	122.8 Å²	122.8	73%	0.733	74%	0.74	S	S	*	*			cis	-143	-169.7	1.4	-110.7	-29.6	0	0	0	113.3
433	S	30.8	Very low	30	Very low	106 Å²	106	125 Å²	125	74%	0.741	74%	0.743	S	S	*	*			trans	-73.4	123.7	-154	55.9	0	0	0	0	122
434	K	32.3	Very low	29.9	Very low	195 Å²	195	125.8 Å²	125.8	85%	0.848	74%	0.737	S	S	*	*				47.1	124.3	115	-175.1	176.4	176.7	-176.4	0	123.2
435	A	32.3	Very low	30.5	Very low	81 Å²	81	126.3 Å²	126.3	67%	0.669	74%	0.736	S	S	*	*			trans	73.3	155.7	146.8	0	0	0	0	0	120.6
436	T	30.7	Very low	30.6	Very low	135 Å²	135	133.1 Å²	133.1	83%	0.828	74%	0.744	S	S	*	*			cis	-173	133.7	-21.5	-88.3	0	0	0	0	110.1
437	A	27.5	Very low	31	Very low	92 Å²	92	135.2 Å²	135.2	76%	0.76	74%	0.741	S	S	*	*			trans	-175.3	162.9	151.6	0	0	0	0	0	113.9
438	N	35.8	Very low	31	Very low	153 Å²	153	135.4 Å²	135.4	82%	0.818	74%	0.743	S	S	*	*			trans	-127.2	-179.9	174.1	-81.5	-65.4	0	0	0	108.5
439	P	47.3	Very low	31.7	Very low	75 Å²	75	138 Å²	138	49%	0.487	74%	0.744	S	S	.	*			cis	-150.9	-156.8	19.3	43.9	-20.1	0	0	0	117.4	V694	P439-V694 VanDerWaalsContact CD-CG2 3.43Å; P439-V694 HydrophobicContact CG-CG2 3.63Å
440	Y	22.3	Very low	31.8	Very low	160 Å²	160	138.2 Å²	138.2	63%	0.627	74%	0.743	S	S	*	*			trans	110.6	144.8	144.9	-130.3	-108.8	0	0	0	121.9	N693	Y440-N693 HydrophobicContact CD1-CB 4Å; Y440-N693 VanDerWaalsContact CD1-ND2 3.33Å; Y440-N693 WeakPolarHBondContact CD1-ND2 3.27Å; Y440-N693 WeakPolarHBondContact CE1-ND2 3.49Å; Y440-N693 HydrophobicContact CG-CB 4.4Å
441	V	27.2	Very low	31.9	Very low	83 Å²	83	142.8 Å²	142.8	50%	0.503	75%	0.754	S	S	.	*			trans	88.1	135.9	170.5	-174	0	0	0	0	121.7	S692	V441-S692 WeakPolarHBondContact CG2-OG 3.36Å
442	T	32.6	Very low	31.9	Very low	131 Å²	131	137.3 Å²	137.3	80%	0.804	75%	0.752	S	S	*	*			trans	-155.4	136	166	-70.7	0	0	0	0	104.2
443	P	41.8	Very low	31.9	Very low	113 Å²	113	135.6 Å²	135.6	73%	0.734	76%	0.757	S	S	*	*				-166.1	171.1	88.7	45.7	-24	0	0	0	121
444	N	27.3	Very low	32.1	Very low	137 Å²	137	135.2 Å²	135.2	73%	0.733	75%	0.754	S	S	*	*			trans	88.9	103.5	138.1	-138.9	14.8	0	0	0	123.7
445	N	38.8	Very low	32.2	Very low	151 Å²	151	136.1 Å²	136.1	81%	0.807	75%	0.754	S	S	*	*			trans	39.3	131.2	135.1	-68.4	-29.8	0	0	0	124.1
446	R	29	Very low	32	Very low	256 Å²	256	137.8 Å²	137.8	97%	0.966	76%	0.755	S	S	*	*			trans	-147	162.1	135.1	-130	-178.8	-161.1	-140.6	4	112.2
447	Y	32.8	Very low	32.3	Very low	216 Å²	216	142.7 Å²	142.7	85%	0.847	76%	0.759	S	S	*	*			trans	-113.8	145.2	-173.9	-151.7	-91.5	0	0	0	110.2
448	G	26	Very low	32.7	Very low	71 Å²	71	147.2 Å²	147.2	73%	0.732	77%	0.765	S	S	*	*			trans	-172.6	145.3	177.8	0	0	0	0	0	112.4
449	Y	39.4	Very low	32.6	Very low	194 Å²	194	148.9 Å²	148.9	76%	0.761	77%	0.765	S	S	*	*			trans	-144.2	124.5	-171.8	-135.4	-75.2	0	0	0	109.5
450	Q	29.2	Very low	32.6	Very low	169 Å²	169	155 Å²	155	79%	0.79	79%	0.787	S	S	*	*			trans	-146.1	162	161.6	-76.3	-158.4	-16.3	0	0	109.5
451	N	29.1	Very low	33.8	Very low	152 Å²	152	150.4 Å²	150.4	81%	0.813	78%	0.782	S	S	*	*			trans	-121.7	155.3	-165.7	-51.6	-61.8	0	0	0	112.1
452	G	30	Very low	34.6	Very low	76 Å²	76	157.3 Å²	157.3	78%	0.784	80%	0.799	S	S	*	*			trans	149.6	114.4	158.1	0	0	0	0	0	115
453	A	27.5	Very low	34.9	Very low	101 Å²	101	161.2 Å²	161.2	84%	0.835	81%	0.805	S	S	*	*			trans	17.6	140.9	152.8	0	0	0	0	0	120.7
454	S	35.6	Very low	35.2	Very low	99 Å²	99	158.4 Å²	158.4	69%	0.692	79%	0.791	S	S	*	*			cis	-152.2	153.6	30.1	-90.2	0	0	0	0	114.1
455	Y	33.5	Very low	36.5	Very low	214 Å²	214	160.1 Å²	160.1	84%	0.839	80%	0.795	S	S	*	*			trans	11.6	130.9	149.6	-59.9	-91.7	0	0	0	119.2
456	T	29.6	Very low	37.8	Very low	115 Å²	115	157.3 Å²	157.3	71%	0.706	78%	0.779	S	S	*	*				-164.9	156.3	64.9	30.3	0	0	0	0	113.9
457	W	35.2	Very low	40.4	Very low	238 Å²	238	148.1 Å²	148.1	90%	0.902	75%	0.749	S	S	*	*			trans	28.6	98.7	156.8	-54.2	113.6	0	0	0	121
458	Q	37.6	Very low	42.9	Very low	188 Å²	188	144.8 Å²	144.8	88%	0.879	74%	0.738	S	S	*	*				176.6	93.2	121.1	-97.9	179.9	22.2	0	0	111
459	F	33	Very low	45.8	Very low	187 Å²	187	141.6 Å²	141.6	82%	0.82	71%	0.705	S	S	*	*			trans	-145.9	39.6	170.7	-113.8	-72.2	0	0	0	113.9	A461	F459-A461 VanDerWaalsContact C-N 3.26Å; F459-A461 PolarHBondContact O-N 2.95Å
460	E	46.9	Very low	48	Very low	205 Å²	205	140.5 Å²	140.5	96%	0.958	71%	0.708	S	S	*	*			trans	-92.4	45.1	172.1	-168.5	146.7	-150.4	0	0	112.1
461	A	47.4	Very low	50.6	Low	63 Å²	63	135.1 Å²	135.1	52%	0.521	68%	0.683	S	S	.	*	S	Bend	trans	-158.1	156.7	168.1	0	0	0	0	0	110.8	F459	F459-A461 VanDerWaalsContact C-N 3.26Å; F459-A461 PolarHBondContact O-N 2.95Å
462	R	43.7	Very low	53.3	Low	227 Å²	227	131 Å²	131	86%	0.857	67%	0.666	S	S	*	*			trans	64.8	53.2	171.8	-61.3	-177	-73.1	169	-5	116.6
463	K	39.5	Very low	55.9	Low	213 Å²	213	129.6 Å²	129.6	93%	0.926	65%	0.651	S	S	*	*			trans	-105.1	16.8	144.3	-106.9	-178.9	-178.4	174.1	0	113.4	Q465	K463-Q465 PolarHBondContact O-N 2.96Å; K463-Q465 VanDerWaalsContact O-N 3.16Å
464	A	47.7	Very low	58.7	Low	54 Å²	54	126.4 Å²	126.4	45%	0.446	62%	0.623	S	S	.	*			trans	-70.2	104.4	173	0	0	0	0	0	110.7	I466	A464-I466 PolarHBondContact O-N 2.79Å
465	Q	54.1	Low	61.1	Low	174 Å²	174	124.9 Å²	124.9	81%	0.813	61%	0.613	S	S	*	*			trans	-71	108.6	153.4	-72.5	-174.6	-57.4	0	0	106.6	K463 L467	K463-Q465 PolarHBondContact O-N 2.96Å; K463-Q465 VanDerWaalsContact O-N 3.16Å; Q465-L467 PolarHBondContact O-N 3.15Å
466	I	68	Low	63.5	Low	91 Å²	91	116.4 Å²	116.4	47%	0.467	58%	0.581	S	S	.	*			trans	-64.5	112.7	-175.1	-38.6	177	0	0	0	109.2	A464 K468 H476	A464-I466 PolarHBondContact O-N 2.79Å; I466-K468 PolarHBondContact O-N 2.96Å; I466-H476 CarbonylContact C-O 3.56Å; I466-H476 WeakPolarHBondContact CG2-O 3.43Å
467	L	81.6	Confident	66.2	Low	64 Å²	64	115.4 Å²	115.4	34%	0.335	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.1	114	-172.5	-69.6	171.2	0	0	0	109.8	Q465 H476 L479 L482	Q465-L467 PolarHBondContact O-N 3.15Å; L467-H476 PolarHBondContact N-O 2.88Å; L467-H476 PolarHBondContact O-N 3.35Å; L467-L479 VanDerWaalsContact CD1-CA 3.45Å; L467-L479 HydrophobicContact CD1-CB 3.67Å; L467-L479 HydrophobicContact CD1-CD1 3.99Å; L467-L479 HydrophobicContact CD1-CG 4.43Å; L467-L482 HydrophobicContact CB-CB 4.37Å; L467-L482 HydrophobicContact CB-CD2 3.86Å
468	K	86.5	Confident	68.8	Low	146 Å²	146	107.5 Å²	107.5	64%	0.635	55%	0.549	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	133.8	-177.9	-59.5	-169.2	178.9	-174.1	0	111.4	I466 M470 S474	I466-K468 PolarHBondContact O-N 2.96Å; K468-M470 PolarHBondContact O-N 3.07Å; K468-S474 CarbonylContact C-O 3.56Å; K468-S474 VanDerWaalsContact CA-O 3.31Å; K468-S474 WeakPolarHBondContact CA-O 3.27Å
469	C	86.6	Confident	71.2	Confident	3 Å²	3	104 Å²	104	2%	0.02	54%	0.536	C	S	.	.			trans	-65.8	124.6	167.8	-174.2	0	0	0	0	109.4	E471 G473 S474 L482 H485	C469-E471 PolarHBondContact O-N 2.82Å; C469-G473 VanDerWaalsContact O-CA 3.24Å; C469-G473 WeakPolarHBondContact O-CA 3.32Å; C469-G473 PolarHBondContact O-N 3.24Å; C469-S474 PolarHBondContact N-O 3.48Å; C469-L482 HydrophobicContact CB-CD1 3.67Å; C469-H485 WeakPolarHBondContact CB-NE2 3.43Å; C469-H485 PolarHBondContact SG-NE2 3.34Å; C469-H485 VanDerWaalsContact SG-NE2 3.42Å
470	M	85.2	Confident	73.8	Confident	171 Å²	171	102.9 Å²	102.9	84%	0.842	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-17.4	-178.5	-165.7	168.8	66.7	0	0	113.2	K468	K468-M470 PolarHBondContact O-N 3.07Å
471	E	83.8	Confident	75.8	Confident	56 Å²	56	97.3 Å²	97.3	26%	0.262	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-33.7	-177.3	-161	73.9	-128.6	0	0	113	C469 H491 K494 V495	C469-E471 PolarHBondContact O-N 2.82Å; E471-H491 HydrophobicContact CB-CB 3.75Å; E471-H491 HydrophobicContact CG-CB 3.88Å; E471-K494 HydrophobicContact CG-CD 4.48Å; E471-K494 WeakPolarHBondContact OE1-CD 3.29Å; E471-K494 WeakPolarHBondContact OE1-CG 3.12Å; E471-K494 IonicContact OE1-NZ 3.95Å; E471-K494 PolarHBondContact OE1-NZ 3.28Å; E471-V495 WeakPolarHBondContact OE2-CG2 3.48Å
472	C	86.9	Confident	77.8	Confident	65 Å²	65	95.3 Å²	95.3	44%	0.439	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.4	3.1	-174.3	71.3	0	0	0	0	115.1	S474 H485 H491	C472-S474 PolarHBondContact O-N 2.87Å; C472-S474 VanDerWaalsContact O-N 3.08Å; C472-S474 PolarHBondContact SG-OG 3.07Å; C472-H485 VanDerWaalsContact SG-CE1 3.57Å; C472-H485 PolarHBondContact SG-NE2 2.94Å; C472-H491 PolarHBondContact SG-CE1 2.87Å
473	G	84	Confident	79.9	Confident	47 Å²	47	87.5 Å²	87.5	49%	0.485	47%	0.465	S	S	.	.			trans	74.2	-11.3	178.4	0	0	0	0	0	116.5	C469 S475	C469-G473 VanDerWaalsContact O-CA 3.24Å; C469-G473 WeakPolarHBondContact O-CA 3.32Å; C469-G473 PolarHBondContact O-N 3.24Å; G473-S475 PolarHBondContact O-N 2.86Å
474	S	86.6	Confident	82.3	Confident	35 Å²	35	79.8 Å²	79.8	25%	0.245	44%	0.441	C	S	.	.			trans	-55.7	133	-178.1	66.2	0	0	0	0	112.1	K468 C469 C472 H476 H485	K468-S474 CarbonylContact C-O 3.56Å; K468-S474 VanDerWaalsContact CA-O 3.31Å; K468-S474 WeakPolarHBondContact CA-O 3.27Å; C469-S474 PolarHBondContact N-O 3.48Å; C472-S474 PolarHBondContact O-N 2.87Å; C472-S474 VanDerWaalsContact O-N 3.08Å; C472-S474 PolarHBondContact SG-OG 3.07Å; S474-H476 WeakPolarHBondContact CB-NE2 3.4Å; S474-H476 PolarHBondContact O-CD2 3.36Å; S474-H476 VanDerWaalsContact O-CD2 3.32Å; S474-H476 PolarHBondContact O-NE2 2.85Å; S474-H476 VanDerWaalsContact O-NE2 3.16Å; S474-H476 PolarHBondContact OG-NE2 3.47Å; S474-H485 PolarHBondContact OG-CE1 3.49Å; S474-H485 PolarHBondContact OG-NE2 2.89Å
475	S	85.2	Confident	84.4	Confident	67 Å²	67	78.5 Å²	78.5	47%	0.469	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	125.6	-171.7	61.5	0	0	0	0	111.4	G473	G473-S475 PolarHBondContact O-N 2.86Å
476	H	85.2	Confident	86.1	Confident	36 Å²	36	72.5 Å²	72.5	17%	0.167	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	138.7	-175.1	-56.6	-84.9	0	0	0	111	I466 L467 S474 T478 Q481 L482 H485	I466-H476 CarbonylContact C-O 3.56Å; I466-H476 WeakPolarHBondContact CG2-O 3.43Å; L467-H476 PolarHBondContact N-O 2.88Å; L467-H476 PolarHBondContact O-N 3.35Å; S474-H476 WeakPolarHBondContact CB-NE2 3.4Å; S474-H476 PolarHBondContact O-CD2 3.36Å; S474-H476 VanDerWaalsContact O-CD2 3.32Å; S474-H476 PolarHBondContact O-NE2 2.85Å; S474-H476 VanDerWaalsContact O-NE2 3.16Å; S474-H476 PolarHBondContact OG-NE2 3.47Å; H476-T478 VanDerWaalsContact C-N 3.3Å; H476-T478 PolarHBondContact O-N 3.2Å; H476-Q481 HydrophobicContact CB-CB 4.11Å; H476-Q481 HydrophobicContact CB-CG 4.06Å; H476-L482 HydrophobicContact CB-CB 4.05Å; H476-H485 WeakPolarHBondContact CE1-CB 3.22Å; H476-H485 AromaticContact CE1-CG 3.3Å; H476-H485 AromaticContact CE1-ND1 3.25Å; H476-H485 PolarHBondContact CE1-ND1 2.94Å; H476-H485 AromaticContact NE2-CD2 3.09Å; H476-H485 PolarHBondContact NE2-CD2 3.43Å; H476-H485 AromaticContact NE2-CE1 3.45Å; H476-H485 PolarHBondContact NE2-CE1 2.89Å; H476-H485 AromaticContact NE2-CG 3.05Å; H476-H485 AromaticContact NE2-ND1 3.29Å; H476-H485 PolarHBondContact NE2-ND1 3.12Å; H476-H485 AromaticContact NE2-NE2 3.36Å; H476-H485 PolarHBondContact NE2-NE2 2.56Å
477	D	85.9	Confident	87.1	Confident	93 Å²	93	73.7 Å²	73.7	50%	0.497	40%	0.403	S	S	.	.	S	Bend	trans	-78.7	-14.9	-172.4	-62.2	-59.1	0	0	0	113.5
478	T	89.3	Confident	87.5	Confident	73 Å²	73	76.9 Å²	76.9	45%	0.448	43%	0.425	S	S	.	.	S	Bend	trans	-134.2	154.6	176.2	70.6	0	0	0	0	112.6	H476 Q480 Q481 L482	H476-T478 VanDerWaalsContact C-N 3.3Å; H476-T478 PolarHBondContact O-N 3.2Å; T478-Q480 PolarHBondContact O-N 2.85Å; T478-Q481 PolarHBondContact O-N 3.29Å; T478-Q481 VanDerWaalsContact OG1-CB 3.22Å; T478-Q481 WeakPolarHBondContact OG1-CB 3.29Å; T478-Q481 PolarHBondContact OG1-N 2.91Å; T478-Q481 VanDerWaalsContact OG1-N 3.1Å; T478-L482 PolarHBondContact O-N 3.43Å
479	L	87.1	Confident	87.5	Confident	115 Å²	115	72.8 Å²	72.8	60%	0.602	41%	0.412	S	S	*	.	H	α-helix	trans	-63.5	-33.1	176.2	-179	61.2	0	0	0	111.7	L467 L482 T483	L467-L479 VanDerWaalsContact CD1-CA 3.45Å; L467-L479 HydrophobicContact CD1-CB 3.67Å; L467-L479 HydrophobicContact CD1-CD1 3.99Å; L467-L479 HydrophobicContact CD1-CG 4.43Å; L479-L482 PolarHBondContact O-N 3.48Å; L479-T483 VanDerWaalsContact O-CB 3.31Å; L479-T483 WeakPolarHBondContact O-CB 3.36Å; L479-T483 PolarHBondContact O-N 3.28Å; L479-T483 PolarHBondContact O-OG1 3.09Å
480	Q	88.2	Confident	87.4	Confident	162 Å²	162	74 Å²	74	76%	0.757	43%	0.425	S	S	*	.	H	α-helix	trans	-67.8	-38.9	176.6	-170.3	172.3	3.2	0	0	111.6	T478 T483 A484	T478-Q480 PolarHBondContact O-N 2.85Å; Q480-T483 PolarHBondContact O-N 3.44Å; Q480-A484 VanDerWaalsContact O-CB 3.31Å; Q480-A484 WeakPolarHBondContact O-CB 3.24Å; Q480-A484 PolarHBondContact O-N 3.16Å
481	Q	88.3	Confident	87.3	Confident	89 Å²	89	67.7 Å²	67.7	42%	0.416	39%	0.393	S	S	.	.	H	α-helix	trans	-68.8	-41.1	174.8	-169	-176.1	22.9	0	0	111.8	H476 T478 T483 H485	H476-Q481 HydrophobicContact CB-CB 4.11Å; H476-Q481 HydrophobicContact CB-CG 4.06Å; T478-Q481 PolarHBondContact O-N 3.29Å; T478-Q481 VanDerWaalsContact OG1-CB 3.22Å; T478-Q481 WeakPolarHBondContact OG1-CB 3.29Å; T478-Q481 PolarHBondContact OG1-N 2.91Å; T478-Q481 VanDerWaalsContact OG1-N 3.1Å; Q481-T483 VanDerWaalsContact C-N 3.33Å; Q481-T483 PolarHBondContact O-N 2.83Å; Q481-H485 VanDerWaalsContact O-CB 3.27Å; Q481-H485 WeakPolarHBondContact O-CB 3.49Å; Q481-H485 PolarHBondContact O-N 3.05Å
482	L	89.4	Confident	86.8	Confident	20 Å²	20	69.1 Å²	69.1	11%	0.105	40%	0.399	C	S	.	.	H	α-helix	trans	-61	-41.4	169.4	173.3	60.2	0	0	0	111.7	L467 C469 H476 T478 L479 H485 M486	L467-L482 HydrophobicContact CB-CB 4.37Å; L467-L482 HydrophobicContact CB-CD2 3.86Å; C469-L482 HydrophobicContact CB-CD1 3.67Å; H476-L482 HydrophobicContact CB-CB 4.05Å; T478-L482 PolarHBondContact O-N 3.43Å; L479-L482 PolarHBondContact O-N 3.48Å; L482-H485 WeakPolarHBondContact O-CB 3.46Å; L482-H485 PolarHBondContact O-N 3.32Å; L482-M486 HydrophobicContact CD1-CG 3.95Å; L482-M486 HydrophobicContact CD1-SD 4.02Å; L482-M486 HydrophobicContact CG-CG 4.43Å; L482-M486 HydrophobicContact CG-SD 4.11Å; L482-M486 WeakPolarHBondContact O-CB 3.41Å; L482-M486 WeakPolarHBondContact O-CG 3.28Å; L482-M486 PolarHBondContact O-N 2.89Å
483	T	88.1	Confident	86.2	Confident	64 Å²	64	71 Å²	71	39%	0.393	40%	0.404	S	S	.	.	H	α-helix	trans	-67.1	-46.4	-179.8	-57.3	0	0	0	0	110.9	L479 Q480 Q481 H485 M486 M487	L479-T483 VanDerWaalsContact O-CB 3.31Å; L479-T483 WeakPolarHBondContact O-CB 3.36Å; L479-T483 PolarHBondContact O-N 3.28Å; L479-T483 PolarHBondContact O-OG1 3.09Å; Q480-T483 PolarHBondContact O-N 3.44Å; Q481-T483 VanDerWaalsContact C-N 3.33Å; Q481-T483 PolarHBondContact O-N 2.83Å; T483-H485 PolarHBondContact O-N 2.9Å; T483-M486 PolarHBondContact O-N 3.02Å; T483-M487 HydrophobicContact CG2-SD 4.03Å; T483-M487 WeakPolarHBondContact O-CB 3.18Å; T483-M487 VanDerWaalsContact O-CG 3.32Å; T483-M487 WeakPolarHBondContact O-CG 3.48Å; T483-M487 PolarHBondContact O-N 3.43Å
484	A	91.1	Very high	85	Confident	50 Å²	50	74.7 Å²	74.7	41%	0.413	41%	0.407	S	S	.	.	H	α-helix	trans	-59.8	-45.4	174.1	0	0	0	0	0	111.3	Q480 M486 M487 V488	Q480-A484 VanDerWaalsContact O-CB 3.31Å; Q480-A484 WeakPolarHBondContact O-CB 3.24Å; Q480-A484 PolarHBondContact O-N 3.16Å; A484-M486 PolarHBondContact O-N 3.45Å; A484-M487 PolarHBondContact O-N 2.82Å; A484-V488 WeakPolarHBondContact O-CB 3.29Å; A484-V488 VanDerWaalsContact O-CG2 3.27Å; A484-V488 WeakPolarHBondContact O-CG2 3.3Å; A484-V488 PolarHBondContact O-N 2.81Å
485	H	91.2	Very high	83.5	Confident	27 Å²	27	75.8 Å²	75.8	13%	0.125	41%	0.412	C	S	.	.	H	α-helix	trans	-55.4	-52.4	171.4	163.8	78.8	0	0	0	111.6	C469 C472 S474 H476 Q481 L482 T483 M487 V488 T489 H491	C469-H485 WeakPolarHBondContact CB-NE2 3.43Å; C469-H485 PolarHBondContact SG-NE2 3.34Å; C469-H485 VanDerWaalsContact SG-NE2 3.42Å; C472-H485 VanDerWaalsContact SG-CE1 3.57Å; C472-H485 PolarHBondContact SG-NE2 2.94Å; S474-H485 PolarHBondContact OG-CE1 3.49Å; S474-H485 PolarHBondContact OG-NE2 2.89Å; H476-H485 WeakPolarHBondContact CE1-CB 3.22Å; H476-H485 AromaticContact CE1-CG 3.3Å; H476-H485 AromaticContact CE1-ND1 3.25Å; H476-H485 PolarHBondContact CE1-ND1 2.94Å; H476-H485 AromaticContact NE2-CD2 3.09Å; H476-H485 PolarHBondContact NE2-CD2 3.43Å; H476-H485 AromaticContact NE2-CE1 3.45Å; H476-H485 PolarHBondContact NE2-CE1 2.89Å; H476-H485 AromaticContact NE2-CG 3.05Å; H476-H485 AromaticContact NE2-ND1 3.29Å; H476-H485 PolarHBondContact NE2-ND1 3.12Å; H476-H485 AromaticContact NE2-NE2 3.36Å; H476-H485 PolarHBondContact NE2-NE2 2.56Å; Q481-H485 VanDerWaalsContact O-CB 3.27Å; Q481-H485 WeakPolarHBondContact O-CB 3.49Å; Q481-H485 PolarHBondContact O-N 3.05Å; L482-H485 WeakPolarHBondContact O-CB 3.46Å; L482-H485 PolarHBondContact O-N 3.32Å; T483-H485 PolarHBondContact O-N 2.9Å; H485-M487 VanDerWaalsContact C-N 3.29Å; H485-M487 PolarHBondContact O-N 3.37Å; H485-V488 PolarHBondContact O-N 3.23Å; H485-T489 WeakPolarHBondContact O-CB 3.07Å; H485-T489 WeakPolarHBondContact O-CG2 3.19Å; H485-T489 PolarHBondContact O-N 3.49Å; H485-T489 PolarHBondContact O-OG1 3.24Å; H485-H491 AromaticContact CE1-CE1 3.88Å; H485-H491 AromaticContact CE1-ND1 3.75Å; H485-H491 AromaticContact NE2-CE1 3.71Å; H485-H491 AromaticContact NE2-ND1 3.16Å; H485-H491 PolarHBondContact NE2-ND1 2.9Å; H485-H491 VanDerWaalsContact NE2-ND1 3.16Å
486	M	90.6	Very high	81.9	Confident	49 Å²	49	76.9 Å²	76.9	24%	0.241	42%	0.416	C	S	.	.	H	α-helix	trans	-61.4	-36.4	-178.6	-78.3	-178.8	64.4	0	0	112.5	L482 T483 A484 G490 H491 F492	L482-M486 HydrophobicContact CD1-CG 3.95Å; L482-M486 HydrophobicContact CD1-SD 4.02Å; L482-M486 HydrophobicContact CG-CG 4.43Å; L482-M486 HydrophobicContact CG-SD 4.11Å; L482-M486 WeakPolarHBondContact O-CB 3.41Å; L482-M486 WeakPolarHBondContact O-CG 3.28Å; L482-M486 PolarHBondContact O-N 2.89Å; T483-M486 PolarHBondContact O-N 3.02Å; A484-M486 PolarHBondContact O-N 3.45Å; M486-G490 CarbonylContact O-C 3.53Å; M486-G490 PolarHBondContact O-N 2.55Å; M486-H491 HydrophobicContact CG-CB 4.42Å; M486-H491 PolarHBondContact O-N 3.09Å; M486-F492 HydrophobicContact CB-CB 4.37Å; M486-F492 HydrophobicContact CE-CB 3.98Å; M486-F492 WeakPolarHBondContact O-CD1 3.46Å; M486-F492 PolarHBondContact O-N 3.39Å
487	M	88.2	Confident	80.1	Confident	116 Å²	116	79.1 Å²	79.1	57%	0.571	43%	0.429	S	S	*	.	H	α-helix	trans	-70.3	-50.3	176	-71.2	174.7	69.8	0	0	111.9	T483 A484 H485 T489 G490	T483-M487 HydrophobicContact CG2-SD 4.03Å; T483-M487 WeakPolarHBondContact O-CB 3.18Å; T483-M487 VanDerWaalsContact O-CG 3.32Å; T483-M487 WeakPolarHBondContact O-CG 3.48Å; T483-M487 PolarHBondContact O-N 3.43Å; A484-M487 PolarHBondContact O-N 2.82Å; H485-M487 VanDerWaalsContact C-N 3.29Å; H485-M487 PolarHBondContact O-N 3.37Å; M487-T489 VanDerWaalsContact C-N 3.35Å; M487-T489 PolarHBondContact O-N 3.13Å; M487-G490 PolarHBondContact O-N 3.44Å
488	V	89.9	Confident	78.2	Confident	130 Å²	130	79.5 Å²	79.5	79%	0.788	44%	0.439	S	S	*	.	H	α-helix	trans	-66.1	-35.1	-178.2	171.1	0	0	0	0	112.2	A484 H485	A484-V488 WeakPolarHBondContact O-CB 3.29Å; A484-V488 VanDerWaalsContact O-CG2 3.27Å; A484-V488 WeakPolarHBondContact O-CG2 3.3Å; A484-V488 PolarHBondContact O-N 2.81Å; H485-V488 PolarHBondContact O-N 3.23Å
489	T	85.9	Confident	75.9	Confident	61 Å²	61	80.4 Å²	80.4	37%	0.374	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-3	177.6	57.8	0	0	0	0	114.1	H485 M487 H491	H485-T489 WeakPolarHBondContact O-CB 3.07Å; H485-T489 WeakPolarHBondContact O-CG2 3.19Å; H485-T489 PolarHBondContact O-N 3.49Å; H485-T489 PolarHBondContact O-OG1 3.24Å; M487-T489 VanDerWaalsContact C-N 3.35Å; M487-T489 PolarHBondContact O-N 3.13Å; T489-H491 PolarHBondContact O-N 2.81Å; T489-H491 VanDerWaalsContact O-N 3.13Å; T489-H491 PolarHBondContact OG1-CE1 2.85Å; T489-H491 PolarHBondContact OG1-ND1 3.04Å
490	G	85.3	Confident	74.1	Confident	28 Å²	28	78.5 Å²	78.5	29%	0.289	45%	0.45	S	S	.	.			trans	67.6	4.2	-176.3	0	0	0	0	0	115.2	M486 M487 F492 L493 K494	M486-G490 CarbonylContact O-C 3.53Å; M486-G490 PolarHBondContact O-N 2.55Å; M487-G490 PolarHBondContact O-N 3.44Å; G490-F492 PolarHBondContact O-N 3.16Å; G490-F492 VanDerWaalsContact O-N 3.12Å; G490-L493 WeakPolarHBondContact O-CB 3.34Å; G490-L493 PolarHBondContact O-N 3.31Å; G490-K494 PolarHBondContact O-N 2.88Å
491	H	83.5	Confident	71.9	Confident	38 Å²	38	77.5 Å²	77.5	18%	0.176	44%	0.443	C	S	.	.	H	α-helix	trans	-57.8	-28.9	-178.6	-66	161.1	0	0	0	113.1	E471 C472 H485 M486 T489 L493 K494 V495	E471-H491 HydrophobicContact CB-CB 3.75Å; E471-H491 HydrophobicContact CG-CB 3.88Å; C472-H491 PolarHBondContact SG-CE1 2.87Å; H485-H491 AromaticContact CE1-CE1 3.88Å; H485-H491 AromaticContact CE1-ND1 3.75Å; H485-H491 AromaticContact NE2-CE1 3.71Å; H485-H491 AromaticContact NE2-ND1 3.16Å; H485-H491 PolarHBondContact NE2-ND1 2.9Å; H485-H491 VanDerWaalsContact NE2-ND1 3.16Å; M486-H491 HydrophobicContact CG-CB 4.42Å; M486-H491 PolarHBondContact O-N 3.09Å; T489-H491 PolarHBondContact O-N 2.81Å; T489-H491 VanDerWaalsContact O-N 3.13Å; T489-H491 PolarHBondContact OG1-CE1 2.85Å; T489-H491 PolarHBondContact OG1-ND1 3.04Å; H491-L493 VanDerWaalsContact C-N 3.32Å; H491-L493 PolarHBondContact O-N 2.73Å; H491-K494 PolarHBondContact O-N 2.72Å; H491-K494 VanDerWaalsContact O-N 3.16Å; H491-V495 PolarHBondContact O-N 2.94Å; H491-V495 VanDerWaalsContact O-N 3.12Å
492	F	73.8	Confident	69.7	Low	87 Å²	87	84.1 Å²	84.1	38%	0.382	47%	0.471	S	S	.	.	H	α-helix	trans	-61.9	-33.8	171.9	78.3	-61.5	0	0	0	114.2	M486 G490 K494 T496	M486-F492 HydrophobicContact CB-CB 4.37Å; M486-F492 HydrophobicContact CE-CB 3.98Å; M486-F492 WeakPolarHBondContact O-CD1 3.46Å; M486-F492 PolarHBondContact O-N 3.39Å; G490-F492 PolarHBondContact O-N 3.16Å; G490-F492 VanDerWaalsContact O-N 3.12Å; F492-K494 VanDerWaalsContact C-N 3.34Å; F492-T496 WeakPolarHBondContact O-CG2 3.45Å; F492-T496 PolarHBondContact O-N 3.03Å; F492-T496 PolarHBondContact O-OG1 2.97Å
493	L	73.1	Confident	67.1	Low	105 Å²	105	85.4 Å²	85.4	55%	0.55	49%	0.489	S	S	.	.	H	α-helix	trans	-69	-34.2	174.1	-108.5	68.5	0	0	0	111.4	G490 H491 T496 N497	G490-L493 WeakPolarHBondContact O-CB 3.34Å; G490-L493 PolarHBondContact O-N 3.31Å; H491-L493 VanDerWaalsContact C-N 3.32Å; H491-L493 PolarHBondContact O-N 2.73Å; L493-T496 WeakPolarHBondContact CA-OG1 3.34Å; L493-T496 PolarHBondContact O-N 3.35Å; L493-T496 PolarHBondContact O-OG1 2.89Å; L493-T496 VanDerWaalsContact O-OG1 3.13Å; L493-N497 WeakPolarHBondContact O-CB 3.49Å; L493-N497 PolarHBondContact O-N 3.32Å
494	K	59.5	Low	64.9	Low	123 Å²	123	92.5 Å²	92.5	54%	0.535	51%	0.514	S	S	.	.	H	α-helix	trans	-76	-38.4	-177.5	-163.3	154.8	171.3	-92.6	0	112.2	E471 G490 H491 F492 S498	E471-K494 HydrophobicContact CG-CD 4.48Å; E471-K494 WeakPolarHBondContact OE1-CD 3.29Å; E471-K494 WeakPolarHBondContact OE1-CG 3.12Å; E471-K494 IonicContact OE1-NZ 3.95Å; E471-K494 PolarHBondContact OE1-NZ 3.28Å; G490-K494 PolarHBondContact O-N 2.88Å; H491-K494 PolarHBondContact O-N 2.72Å; H491-K494 VanDerWaalsContact O-N 3.16Å; F492-K494 VanDerWaalsContact C-N 3.34Å; K494-S498 WeakPolarHBondContact O-CB 3.36Å; K494-S498 PolarHBondContact O-N 2.75Å; K494-S498 PolarHBondContact O-OG 2.81Å
495	V	54.1	Low	62.1	Low	59 Å²	59	97.2 Å²	97.2	36%	0.358	53%	0.528	S	S	.	.	H	α-helix	trans	-62.9	-40.1	169.6	177.5	0	0	0	0	111.9	E471 H491	E471-V495 WeakPolarHBondContact OE2-CG2 3.48Å; H491-V495 PolarHBondContact O-N 2.94Å; H491-V495 VanDerWaalsContact O-N 3.12Å
496	T	52.2	Low	59.2	Low	89 Å²	89	103.2 Å²	103.2	55%	0.546	56%	0.56	S	S	.	*	H	α-helix	trans	-77.6	-33.7	178.9	49.5	0	0	0	0	113.5	F492 L493 S498 A499 S500	F492-T496 WeakPolarHBondContact O-CG2 3.45Å; F492-T496 PolarHBondContact O-N 3.03Å; F492-T496 PolarHBondContact O-OG1 2.97Å; L493-T496 WeakPolarHBondContact CA-OG1 3.34Å; L493-T496 PolarHBondContact O-N 3.35Å; L493-T496 PolarHBondContact O-OG1 2.89Å; L493-T496 VanDerWaalsContact O-OG1 3.13Å; T496-S498 VanDerWaalsContact C-N 3.3Å; T496-S498 PolarHBondContact O-N 3.39Å; T496-A499 PolarHBondContact O-N 2.69Å; T496-S500 PolarHBondContact O-OG 3.17Å
497	N	48.5	Very low	56.2	Low	84 Å²	84	105.6 Å²	105.6	45%	0.449	58%	0.577	S	S	.	*	H	α-helix	trans	-70.2	-26.4	173.2	-157.3	-104.2	0	0	0	112.6	L493 A499 S500	L493-N497 WeakPolarHBondContact O-CB 3.49Å; L493-N497 PolarHBondContact O-N 3.32Å; N497-A499 PolarHBondContact O-N 3.47Å; N497-A499 VanDerWaalsContact O-N 3.1Å; N497-S500 WeakPolarHBondContact CA-OG 3.19Å; N497-S500 CarbonylContact O-C 3.48Å; N497-S500 PolarHBondContact O-N 2.99Å; N497-S500 PolarHBondContact O-OG 3.4Å
498	S	46.1	Very low	53.3	Low	100 Å²	100	109 Å²	109	70%	0.699	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-14.2	175	-64.2	0	0	0	0	114	K494 T496	K494-S498 WeakPolarHBondContact O-CB 3.36Å; K494-S498 PolarHBondContact O-N 2.75Å; K494-S498 PolarHBondContact O-OG 2.81Å; T496-S498 VanDerWaalsContact C-N 3.3Å; T496-S498 PolarHBondContact O-N 3.39Å
499	A	40.3	Very low	50.2	Low	93 Å²	93	109.8 Å²	109.8	77%	0.769	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-1.7	170.8	0	0	0	0	0	114	T496 N497	T496-A499 PolarHBondContact O-N 2.69Å; N497-A499 PolarHBondContact O-N 3.47Å; N497-A499 VanDerWaalsContact O-N 3.1Å
500	S	48.2	Very low	48.5	Very low	74 Å²	74	111.7 Å²	111.7	52%	0.517	60%	0.602	S	S	.	*			trans	-145.9	56	-162.3	51.6	0	0	0	0	115.3	T496 N497	T496-S500 PolarHBondContact O-OG 3.17Å; N497-S500 WeakPolarHBondContact CA-OG 3.19Å; N497-S500 CarbonylContact O-C 3.48Å; N497-S500 PolarHBondContact O-N 2.99Å; N497-S500 PolarHBondContact O-OG 3.4Å
501	K	42.8	Very low	45.7	Very low	142 Å²	142	116.8 Å²	116.8	62%	0.617	63%	0.627	S	S	*	*			trans	-141.6	87.7	165.9	-146.5	158.7	-166.7	168.1	0	117.2	G503	K501-G503 WeakPolarHBondContact CE-O 3.24Å; K501-G503 WeakPolarHBondContact CG-O 3.33Å
502	K	42.2	Very low	43.1	Very low	227 Å²	227	121.8 Å²	121.8	99%	0.987	66%	0.66	S	S	*	*	S	Bend	trans	-116.5	80.3	130.9	-171.2	164.6	-176.3	171.6	0	108.7
503	G	34.4	Very low	41.2	Very low	47 Å²	47	125.7 Å²	125.7	49%	0.485	68%	0.68	S	S	.	*	S	Bend	trans	-158.5	140.4	178.6	0	0	0	0	0	108.3	K501	K501-G503 WeakPolarHBondContact CE-O 3.24Å; K501-G503 WeakPolarHBondContact CG-O 3.33Å
504	K	42.8	Very low	39.4	Very low	213 Å²	213	129.9 Å²	129.9	93%	0.926	70%	0.697	S	S	*	*			trans	-77.1	174.6	-169.9	-70.9	-171.1	177.8	-175.6	0	112.6
505	Q	32.3	Very low	38	Very low	149 Å²	149	131.9 Å²	131.9	70%	0.696	71%	0.705	S	S	*	*			trans	-84.9	142.8	-172.9	173.1	176.9	-7.2	0	0	111.9	V507	Q505-V507 HydrophobicContact CG-CG2 3.9Å
506	L	29.2	Very low	37	Very low	154 Å²	154	136.3 Å²	136.3	81%	0.806	73%	0.725	S	S	*	*			trans	-125.2	145.7	145.3	-83.9	175.6	0	0	0	107.6
507	V	28.2	Very low	35.8	Very low	99 Å²	99	139.9 Å²	139.9	60%	0.6	74%	0.736	S	S	*	*			trans	-114.3	145.9	174.7	176.8	0	0	0	0	106.5	Q505	Q505-V507 HydrophobicContact CG-CG2 3.9Å
508	F	27.1	Very low	34.7	Very low	188 Å²	188	141.7 Å²	141.7	83%	0.825	76%	0.755	S	S	*	*			trans	-133.8	127.9	163.8	-81.1	-74	0	0	0	109.4
509	D	25.8	Very low	33.9	Very low	146 Å²	146	144.3 Å²	144.3	78%	0.781	76%	0.76	S	S	*	*			trans	-155.7	167.7	160.3	-136.6	9.2	0	0	0	106
510	P	49.1	Very low	34.1	Very low	101 Å²	101	145.1 Å²	145.1	66%	0.656	76%	0.757	S	S	*	*				-125.2	-165.7	-103.4	38.3	-22.4	0	0	0	114.4
511	V	26.3	Very low	33	Very low	135 Å²	135	149.7 Å²	149.7	82%	0.818	77%	0.774	S	S	*	*			trans	83.2	105.5	174.6	-171.2	0	0	0	0	116.4
512	V	30.3	Very low	32.7	Very low	143 Å²	143	148 Å²	148	87%	0.867	78%	0.778	S	S	*	*				-157.4	152.6	115.6	141.4	0	0	0	0	108.1
513	E	33.5	Very low	32.9	Very low	169 Å²	169	142.3 Å²	142.3	79%	0.79	77%	0.765	S	S	*	*			trans	-109.7	131.9	-169.7	175.5	-178.5	-170	0	0	111.5
514	E	33.9	Very low	32.5	Very low	193 Å²	193	145.6 Å²	145.6	90%	0.902	78%	0.775	S	S	*	*			trans	-154.9	158.3	155.6	-133.7	177.8	-175.9	0	0	112.6
515	K	30.2	Very low	31.7	Very low	164 Å²	164	141.2 Å²	141.2	71%	0.713	77%	0.767	S	S	*	*			trans	-153	97.1	-146.5	176.5	-159.5	170.8	-175.2	0	114.7
516	I	33.2	Very low	31.4	Very low	152 Å²	152	139.3 Å²	139.3	78%	0.779	77%	0.765	S	S	*	*			trans	-147.5	120.7	160.7	-52.2	88	0	0	0	106
517	Q	27	Very low	31.3	Very low	165 Å²	165	143.2 Å²	143.2	77%	0.771	77%	0.769	S	S	*	*			cis	89	92.1	34.4	-168	174.1	-4	0	0	115.3
518	S	25.8	Very low	31.1	Very low	121 Å²	121	145.2 Å²	145.2	85%	0.846	78%	0.776	S	S	*	*			trans	-156	161	160	58.7	0	0	0	0	112.5
519	I	29.2	Very low	31.4	Very low	156 Å²	156	142.3 Å²	142.3	80%	0.8	78%	0.776	S	S	*	*			trans	-122.2	153.7	-166.5	-76.8	172.6	0	0	0	109.7
520	P	45.3	Very low	31.4	Very low	110 Å²	110	141 Å²	141	71%	0.714	77%	0.773	S	S	*	*			trans	-96.9	170.2	-162.9	38.3	-37.4	0	0	0	115.5
521	L	24.1	Very low	30.8	Very low	169 Å²	169	141.7 Å²	141.7	89%	0.885	78%	0.777	S	S	*	*			trans	175.6	161.8	139.3	-93.2	164.5	0	0	0	112.4
522	P	36.9	Very low	30.7	Very low	108 Å²	108	139.8 Å²	139.8	70%	0.701	77%	0.77	S	S	*	*			trans	-110.4	-150.7	174.4	45.7	-35.4	0	0	0	110.6
523	P	47.2	Very low	30.4	Very low	107 Å²	107	140 Å²	140	70%	0.695	77%	0.772	S	S	*	*			cis	-134	-153.1	-18.1	35.3	-12.5	0	0	0	114.3
524	T	25.5	Very low	30.3	Very low	116 Å²	116	138.9 Å²	138.9	71%	0.712	78%	0.776	S	S	*	*			trans	101	107.9	141.7	7.1	0	0	0	0	124.9
525	T	25.9	Very low	29.8	Very low	121 Å²	121	138.6 Å²	138.6	74%	0.742	77%	0.772	S	S	*	*				67.2	141.7	127	-158.9	0	0	0	0	126.6
526	T	25.4	Very low	29.5	Very low	108 Å²	108	136.1 Å²	136.1	66%	0.663	78%	0.775	S	S	*	*				140.2	112.7	120.2	-71.6	0	0	0	0	119.8
527	R	27.3	Very low	29.1	Very low	236 Å²	236	137.5 Å²	137.5	89%	0.891	78%	0.778	S	S	*	*			trans	78.9	157.1	145.4	-93.9	-178.9	166.7	-111.6	-0.6	126
528	L	24.4	Very low	29.7	Very low	142 Å²	142	134.6 Å²	134.6	74%	0.743	77%	0.774	S	S	*	*			trans	-111.7	-179.5	-177.8	-56.8	166.3	0	0	0	111
529	P	33.5	Very low	29.7	Very low	127 Å²	127	135.3 Å²	135.3	83%	0.825	77%	0.773	S	S	*	*				-141.2	176.3	101.5	38.5	-25.3	0	0	0	116.2
530	V	26.2	Very low	29.6	Very low	118 Å²	118	133.3 Å²	133.3	72%	0.715	77%	0.773	S	S	*	*			trans	-145.6	133	-175.4	167.3	0	0	0	0	109.7
531	P	35.9	Very low	29.2	Very low	115 Å²	115	134 Å²	134	75%	0.747	78%	0.777	S	S	*	*				-141.9	153.6	112.7	25	-4.6	0	0	0	112.6
532	S	24.5	Very low	29.1	Very low	95 Å²	95	130.6 Å²	130.6	66%	0.664	77%	0.773	S	S	*	*			cis	87.6	110.2	29.3	83.1	0	0	0	0	116.7
533	T	24.4	Very low	28.6	Very low	149 Å²	149	132.7 Å²	132.7	91%	0.914	78%	0.778	S	S	*	*			trans	-169.2	160.4	151.5	17.9	0	0	0	0	112.4
534	V	29.7	Very low	28.3	Very low	144 Å²	144	132.5 Å²	132.5	87%	0.873	78%	0.779	S	S	*	*			trans	-148.6	147.1	179.3	171.1	0	0	0	0	108.6
535	K	25	Very low	28.4	Very low	188 Å²	188	133 Å²	133	82%	0.817	79%	0.787	S	S	*	*			trans	152.8	139.8	132.1	-158.6	179.1	-173.5	-180	0	115.4
536	S	24.2	Very low	28.3	Very low	111 Å²	111	129.7 Å²	129.7	78%	0.776	78%	0.777	S	S	*	*			trans	69	136.9	152.2	45.3	0	0	0	0	124.6
537	Q	23.4	Very low	28.4	Very low	182 Å²	182	129.5 Å²	129.5	85%	0.85	78%	0.78	S	S	*	*			trans	-68.4	-175.2	165.8	-108.8	-177.8	-6.6	0	0	114.8
538	P	40.9	Very low	28.4	Very low	104 Å²	104	127.5 Å²	127.5	68%	0.675	78%	0.781	S	S	*	*			cis	-136.1	-158.1	-11.5	31.6	-7.9	0	0	0	114.5
539	V	24.4	Very low	28.6	Very low	136 Å²	136	127.3 Å²	127.3	82%	0.824	78%	0.78	S	S	*	*			trans	104.7	128.3	164	-175.4	0	0	0	0	117
540	S	27.9	Very low	28.2	Very low	114 Å²	114	130.5 Å²	130.5	80%	0.797	78%	0.782	S	S	*	*			trans	-162.8	159.3	173.7	-61.8	0	0	0	0	110.2
541	P	35.6	Very low	28.6	Very low	125 Å²	125	134.6 Å²	134.6	81%	0.812	78%	0.784	S	S	*	*				-151.7	174.7	106.4	39.6	-22.5	0	0	0	116.7
542	A	22.9	Very low	27.9	Very low	96 Å²	96	137.2 Å²	137.2	79%	0.793	79%	0.786	S	S	*	*			trans	66.8	138.7	-178.2	0	0	0	0	0	114.8
543	L	25.9	Very low	27.8	Very low	153 Å²	153	139.3 Å²	139.3	80%	0.801	80%	0.795	S	S	*	*			cis	-128.8	159.4	15.9	-74.5	168.1	0	0	0	108.9
544	S	42.4	Very low	27.9	Very low	102 Å²	102	138.3 Å²	138.3	71%	0.713	78%	0.783	S	S	*	*			cis	57.4	75.4	31.7	-159.8	0	0	0	0	114.9
545	S	27	Very low	27.6	Very low	127 Å²	127	138.5 Å²	138.5	89%	0.888	77%	0.774	S	S	*	*	S	Bend	cis	-55.5	136.1	26.9	-175.3	0	0	0	0	117.6
546	G	22.5	Very low	27.7	Very low	52 Å²	52	136.3 Å²	136.3	54%	0.536	77%	0.772	S	S	.	*	S	Bend	trans	116.4	107.6	164.4	0	0	0	0	0	115.6
547	S	29.1	Very low	28	Very low	104 Å²	104	137.6 Å²	137.6	73%	0.727	77%	0.766	S	S	*	*			trans	50.7	127.6	141.2	68.9	0	0	0	0	121.5
548	E	26.1	Very low	28	Very low	193 Å²	193	135.6 Å²	135.6	90%	0.902	75%	0.754	S	S	*	*			trans	58.5	138.7	151.5	-2.1	-167.5	131.5	0	0	117.6
549	D	29.4	Very low	27.2	Very low	138 Å²	138	136.7 Å²	136.7	74%	0.738	75%	0.753	S	S	*	*			cis	-149.8	158.3	7.8	-173.4	2.1	0	0	0	108.3
550	K	24.7	Very low	27	Very low	195 Å²	195	138.9 Å²	138.9	85%	0.848	76%	0.755	S	S	*	*			trans	-154.8	117.8	166.1	-164.6	-178.8	-178.8	-170.9	0	111.8
551	R	33.9	Very low	26.8	Very low	203 Å²	203	136.9 Å²	136.9	77%	0.766	75%	0.752	S	S	*	*			trans	-105.8	172.3	172.4	-149	-172.3	-63	-177.8	2.1	110.9
552	E	22.1	Very low	26	Very low	170 Å²	170	136.8 Å²	136.8	79%	0.794	75%	0.753	S	S	*	*			trans	79.7	161.2	168.5	-56.3	-175.4	175.4	0	0	117.8
553	V	21.9	Very low	25.8	Very low	139 Å²	139	139.9 Å²	139.9	84%	0.842	75%	0.751	S	S	*	*			trans	72.3	115.2	-162.8	-176.8	0	0	0	0	110.7
554	L	26.6	Very low	26.3	Very low	128 Å²	128	137 Å²	137	67%	0.67	74%	0.741	S	S	*	*			cis	-160.3	113.3	16.4	-163.5	65.7	0	0	0	108.1
555	E	23.5	Very low	25.3	Very low	148 Å²	148	138.3 Å²	138.3	69%	0.692	74%	0.739	S	S	*	*				102.4	160.6	89.4	103.2	-169	138.6	0	0	114
556	D	28.4	Very low	25.1	Very low	143 Å²	143	139 Å²	139	77%	0.765	73%	0.729	S	S	*	*			trans	61.9	147.9	-175	-65.5	-14.6	0	0	0	117.2
557	E	29.1	Very low	25.4	Very low	138 Å²	138	143.7 Å²	143.7	65%	0.645	73%	0.734	S	S	*	*			cis	-169.2	160	-2.5	-105.3	-97.2	133.3	0	0	107.4
558	K	23.9	Very low	25.2	Very low	139 Å²	139	147.6 Å²	147.6	60%	0.604	74%	0.738	S	S	*	*			cis	-165.8	144.5	-35.7	174.7	172.5	77.3	-86.7	0	110
559	L	23.8	Very low	25.1	Very low	127 Å²	127	145.1 Å²	145.1	67%	0.665	73%	0.73	S	S	*	*			trans	62	122	162.6	-77.2	169.1	0	0	0	122.2
560	E	20.8	Very low	25	Very low	182 Å²	182	145.9 Å²	145.9	85%	0.85	73%	0.726	S	S	*	*				48.8	144.4	112.3	-166.2	171.1	-114.2	0	0	122.5
561	G	22.9	Very low	24.9	Very low	72 Å²	72	143.3 Å²	143.3	74%	0.742	72%	0.717	S	S	*	*			trans	138.3	126.6	146.4	0	0	0	0	0	116.9
562	C	19.1	Very low	24.5	Very low	124 Å²	124	140.7 Å²	140.7	84%	0.838	71%	0.714	S	S	*	*			trans	-76.5	160.2	167.6	-61.3	0	0	0	0	112.3
563	E	19.9	Very low	24.7	Very low	161 Å²	161	138.9 Å²	138.9	75%	0.752	70%	0.703	S	S	*	*			trans	68.3	165.4	146.9	-73.4	-70.5	86	0	0	117.2
564	P	35	Very low	24.8	Very low	91 Å²	91	137.9 Å²	137.9	59%	0.591	69%	0.693	S	S	*	*			cis	-145.6	-176.9	-35.9	42.1	-25.5	0	0	0	115.6
565	I	22.4	Very low	24.6	Very low	131 Å²	131	138.6 Å²	138.6	67%	0.672	70%	0.698	S	S	*	*				49.3	135.6	129.3	-70.7	167	0	0	0	121.8
566	E	22.7	Very low	24.7	Very low	141 Å²	141	135.3 Å²	135.3	66%	0.659	70%	0.696	S	S	*	*			trans	96.7	156.3	142.4	-103.1	172.2	152.9	0	0	125
567	K	29.3	Very low	24.5	Very low	150 Å²	150	133.6 Å²	133.6	65%	0.652	70%	0.695	S	S	*	*			trans	71.9	106.3	157	-70.3	144	-170.7	149.3	0	115.9
568	K	23.3	Very low	24.5	Very low	187 Å²	187	133.8 Å²	133.8	81%	0.813	70%	0.696	S	S	*	*			cis	66.9	156.3	37.1	-152.9	-169.3	178.8	178.2	0	111.6
569	I	24.6	Very low	24.9	Very low	141 Å²	141	134.3 Å²	134.3	72%	0.723	70%	0.698	S	S	*	*			trans	77.6	134	170.9	-69.4	163.3	0	0	0	113
570	K	26.8	Very low	25	Very low	154 Å²	154	132.9 Å²	132.9	67%	0.67	70%	0.699	S	S	*	*			cis	-169.6	-177	-2.3	170.7	171.6	178.5	-168.1	0	111.3
571	E	23.8	Very low	25.2	Very low	141 Å²	141	132.5 Å²	132.5	66%	0.659	70%	0.697	S	S	*	*			trans	-29.8	165	159.5	-54.1	137.5	-136.5	0	0	115.5
572	E	24.8	Very low	25.3	Very low	147 Å²	147	135 Å²	135	69%	0.687	70%	0.698	S	S	*	*			cis	-139.2	160.7	36.3	-78.5	-170.7	94.3	0	0	113.1
573	K	26.1	Very low	25.6	Very low	132 Å²	132	135.8 Å²	135.8	57%	0.574	69%	0.694	S	S	*	*			cis	86.1	143.9	34.1	162.3	-172	168.5	-75.4	0	114.2
574	D	23.9	Very low	26	Very low	118 Å²	118	133.6 Å²	133.6	63%	0.631	69%	0.692	S	S	*	*			trans	64.9	151.4	170.4	-69.9	3.2	0	0	0	118.9
575	D	22.9	Very low	25.6	Very low	144 Å²	144	135.1 Å²	135.1	77%	0.77	70%	0.699	S	S	*	*			cis	-165	-169.3	-28.2	-161.4	-100.7	0	0	0	108.8
576	A	26.1	Very low	26	Very low	78 Å²	78	133 Å²	133	65%	0.645	70%	0.697	S	S	*	*			trans	88.8	81.9	139.5	0	0	0	0	0	121.5
577	S	23.8	Very low	26.1	Very low	107 Å²	107	137.3 Å²	137.3	75%	0.748	71%	0.708	S	S	*	*				89.5	159	104.4	-152.6	0	0	0	0	122.3
578	E	29.5	Very low	26	Very low	143 Å²	143	136.6 Å²	136.6	67%	0.668	71%	0.705	S	S	*	*			trans	79.7	132.5	162.3	-48.5	-149.1	166.6	0	0	119.5
579	K	30.9	Very low	26.3	Very low	150 Å²	150	135.9 Å²	135.9	65%	0.652	70%	0.698	S	S	*	*			cis	-166.1	173	-10	-120.6	170.3	-158.8	153.2	0	111.7
580	S	26.4	Very low	26.5	Very low	97 Å²	97	135.6 Å²	135.6	68%	0.678	70%	0.698	S	S	*	*			trans	65	124.7	167	44.7	0	0	0	0	118.1
581	E	25.4	Very low	26.9	Very low	173 Å²	173	135.2 Å²	135.2	81%	0.808	69%	0.692	S	S	*	*			cis	76.4	141.2	48.8	-65.6	168.8	-148.8	0	0	113.2
582	T	24	Very low	27.6	Very low	126 Å²	126	136.5 Å²	136.5	77%	0.773	70%	0.698	S	S	*	*			cis	-163.9	170	-12.5	28.8	0	0	0	0	107.4
583	D	26.2	Very low	28.3	Very low	139 Å²	139	133 Å²	133	74%	0.743	68%	0.682	S	S	*	*			cis	-170.1	-155.7	-31.4	-168.8	-105.2	0	0	0	107.5
584	T	27.3	Very low	28.9	Very low	116 Å²	116	129.3 Å²	129.3	71%	0.712	67%	0.669	S	S	*	*			trans	75.1	128.3	171.8	70.5	0	0	0	0	117.7
585	T	27.2	Very low	29.5	Very low	122 Å²	122	131 Å²	131	75%	0.748	68%	0.676	S	S	*	*			cis	-160.8	144.5	-1.9	13.7	0	0	0	0	109.2
586	S	31	Very low	30.1	Very low	88 Å²	88	131 Å²	131	62%	0.615	67%	0.672	S	S	*	*			cis	-174.8	161.4	-13.6	46.2	0	0	0	0	113.4
587	Y	24.6	Very low	30.4	Very low	231 Å²	231	135.4 Å²	135.4	91%	0.906	68%	0.679	S	S	*	*			trans	66.2	152.6	171.2	-71.2	-89.2	0	0	0	118.8
588	K	27.7	Very low	30.8	Very low	134 Å²	134	135.3 Å²	135.3	58%	0.583	67%	0.674	S	S	*	*			cis	-127.4	149.8	-42.7	-172.6	-138.7	158.7	-140.1	0	105.6	D594	K588-D594 IonicContact NZ-OD1 2.67Å; K588-D594 PolarHBondContact NZ-OD1 3.16Å; K588-D594 IonicContact NZ-OD2 2.72Å; K588-D594 PolarHBondContact NZ-OD2 3.5Å
589	Y	28.8	Very low	31.2	Very low	172 Å²	172	134.2 Å²	134.2	68%	0.675	68%	0.68	S	S	*	*			trans	-64.9	159.4	163.1	-81.1	-96.2	0	0	0	112.4	R591	Y589-R591 HydrophobicContact CD1-CB 4.45Å
590	L	30	Very low	31.8	Very low	136 Å²	136	136 Å²	136	71%	0.712	69%	0.687	S	S	*	*				-98.6	136.2	121.9	-61.9	-31.2	0	0	0	106.5	D594	L590-D594 WeakPolarHBondContact CA-OD2 3.46Å; L590-D594 HydrophobicContact CB-CB 3.9Å; L590-D594 HydrophobicContact CD1-CB 4.5Å; L590-D594 HydrophobicContact CD2-CB 4.03Å; L590-D594 HydrophobicContact CG-CB 4.34Å
591	R	35.4	Very low	32.5	Very low	145 Å²	145	138.7 Å²	138.7	55%	0.547	69%	0.689	S	S	.	*			trans	-119.5	-178.9	-174.1	179	155.8	55.5	142.9	8.9	109.1	Y589 E593 D594	Y589-R591 HydrophobicContact CD1-CB 4.45Å; R591-E593 HydrophobicContact CB-CG 3.99Å; R591-E593 HydrophobicContact CG-CG 4.34Å; R591-E593 IonicContact CZ-OE1 3.18Å; R591-E593 IonicContact CZ-OE2 2.96Å; R591-E593 IonicContact NE-OE1 2.85Å; R591-E593 PolarHBondContact NE-OE1 3.46Å; R591-E593 IonicContact NE-OE2 2.8Å; R591-E593 PolarHBondContact NE-OE2 3.49Å; R591-E593 IonicContact NH1-OE2 3.84Å; R591-E593 VanDerWaalsContact NH2-CD 3.25Å; R591-E593 IonicContact NH2-OE1 2.66Å; R591-E593 PolarHBondContact NH2-OE1 2.89Å; R591-E593 IonicContact NH2-OE2 2.68Å; R591-E593 PolarHBondContact NH2-OE2 2.68Å; R591-E593 PolarHBondContact O-N 3.37Å; R591-D594 PolarHBondContact N-OD2 2.94Å; R591-D594 WeakPolarHBondContact O-CB 3.32Å; R591-D594 PolarHBondContact O-N 3.13Å
592	E	37.2	Very low	33.5	Very low	169 Å²	169	134.6 Å²	134.6	79%	0.79	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-58.9	-29.1	-179.5	-64.7	173.8	170.9	0	0	111.7	D594 L595	E592-D594 VanDerWaalsContact C-N 3.28Å; E592-D594 PolarHBondContact O-N 3.39Å; E592-L595 WeakPolarHBondContact O-CB 3.18Å; E592-L595 PolarHBondContact O-N 3.13Å
593	E	41	Very low	34.6	Very low	73 Å²	73	134 Å²	134	34%	0.341	69%	0.685	S	S	.	*	G	3₁₀ helix	trans	-62.9	-20.1	169.2	68.4	-140.5	-162.6	0	0	115.8	R591 L595 E596 E597	R591-E593 HydrophobicContact CB-CG 3.99Å; R591-E593 HydrophobicContact CG-CG 4.34Å; R591-E593 IonicContact CZ-OE1 3.18Å; R591-E593 IonicContact CZ-OE2 2.96Å; R591-E593 IonicContact NE-OE1 2.85Å; R591-E593 PolarHBondContact NE-OE1 3.46Å; R591-E593 IonicContact NE-OE2 2.8Å; R591-E593 PolarHBondContact NE-OE2 3.49Å; R591-E593 IonicContact NH1-OE2 3.84Å; R591-E593 VanDerWaalsContact NH2-CD 3.25Å; R591-E593 IonicContact NH2-OE1 2.66Å; R591-E593 PolarHBondContact NH2-OE1 2.89Å; R591-E593 IonicContact NH2-OE2 2.68Å; R591-E593 PolarHBondContact NH2-OE2 2.68Å; R591-E593 PolarHBondContact O-N 3.37Å; E593-L595 PolarHBondContact O-N 3.42Å; E593-E596 WeakPolarHBondContact CA-OE2 3.17Å; E593-E596 WeakPolarHBondContact O-CA 3.41Å; E593-E596 WeakPolarHBondContact O-CB 3.44Å; E593-E596 PolarHBondContact O-N 3.12Å; E593-E597 PolarHBondContact O-N 2.92Å
594	D	37.8	Very low	35.8	Very low	55 Å²	55	130.1 Å²	130.1	29%	0.294	66%	0.664	S	S	.	*	G	3₁₀ helix	trans	-83.1	4.2	173.2	-63	-93.3	0	0	0	111.7	K588 L590 R591 E592	K588-D594 IonicContact NZ-OD1 2.67Å; K588-D594 PolarHBondContact NZ-OD1 3.16Å; K588-D594 IonicContact NZ-OD2 2.72Å; K588-D594 PolarHBondContact NZ-OD2 3.5Å; L590-D594 WeakPolarHBondContact CA-OD2 3.46Å; L590-D594 HydrophobicContact CB-CB 3.9Å; L590-D594 HydrophobicContact CD1-CB 4.5Å; L590-D594 HydrophobicContact CD2-CB 4.03Å; L590-D594 HydrophobicContact CG-CB 4.34Å; R591-D594 PolarHBondContact N-OD2 2.94Å; R591-D594 WeakPolarHBondContact O-CB 3.32Å; R591-D594 PolarHBondContact O-N 3.13Å; E592-D594 VanDerWaalsContact C-N 3.28Å; E592-D594 PolarHBondContact O-N 3.39Å
595	L	36.8	Very low	37.3	Very low	152 Å²	152	131.4 Å²	131.4	80%	0.796	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-97.5	-2.8	156.1	-76	167	0	0	0	112.5	E592 E593	E592-L595 WeakPolarHBondContact O-CB 3.18Å; E592-L595 PolarHBondContact O-N 3.13Å; E593-L595 PolarHBondContact O-N 3.42Å
596	E	34.2	Very low	38.5	Very low	146 Å²	146	132 Å²	132	68%	0.682	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	-13.5	-178.2	-57.3	-179.7	145.1	0	0	112.7	E593 T598	E593-E596 WeakPolarHBondContact CA-OE2 3.17Å; E593-E596 WeakPolarHBondContact O-CA 3.41Å; E593-E596 WeakPolarHBondContact O-CB 3.44Å; E593-E596 PolarHBondContact O-N 3.12Å; E596-T598 PolarHBondContact O-N 3.42Å
597	E	32.8	Very low	39.9	Very low	170 Å²	170	133.7 Å²	133.7	79%	0.794	66%	0.659	S	S	*	*			trans	-75.3	65.2	166.4	-164.8	171.8	-135.3	0	0	111.5	E593 P599	E593-E597 PolarHBondContact O-N 2.92Å; E597-P599 WeakPolarHBondContact O-CD 3.48Å
598	T	33.5	Very low	41.7	Very low	104 Å²	104	126.4 Å²	126.4	64%	0.638	64%	0.642	S	S	*	*			trans	-87.7	106.2	158.8	56	0	0	0	0	109.5	E596 K600	E596-T598 PolarHBondContact O-N 3.42Å; T598-K600 PolarHBondContact O-N 3.34Å
599	P	36.3	Very low	43.5	Very low	121 Å²	121	124.8 Å²	124.8	79%	0.786	64%	0.639	S	S	*	*			trans	-72.6	62	158.5	32.7	-35.2	0	0	0	110.1	E597	E597-P599 WeakPolarHBondContact O-CD 3.48Å
600	K	45.4	Very low	45.5	Very low	186 Å²	186	122 Å²	122	81%	0.809	63%	0.633	S	S	*	*	S	Bend	trans	70.8	175.2	171.4	-52.3	175.6	-177.5	179.2	0	116.2	T598	T598-K600 PolarHBondContact O-N 3.34Å
601	E	40.1	Very low	47.4	Very low	154 Å²	154	121.1 Å²	121.1	72%	0.72	63%	0.628	S	S	*	*			trans	65.3	56.7	168.2	-142.3	131.6	-128.2	0	0	115.4	L603	E601-L603 HydrophobicContact CG-CB 4.05Å; E601-L603 PolarHBondContact O-N 3.36Å; E601-L603 VanDerWaalsContact O-O 3.13Å
602	G	46.7	Very low	49.6	Very low	87 Å²	87	118.6 Å²	118.6	90%	0.897	63%	0.629	S	S	*	*			trans	-66.1	42.6	148.8	0	0	0	0	0	112.8
603	L	47.8	Very low	51.4	Low	115 Å²	115	113.9 Å²	113.9	60%	0.602	61%	0.612	S	S	*	*			trans	-130.9	130.7	169.8	-52.2	170.5	0	0	0	103	E601	E601-L603 HydrophobicContact CG-CB 4.05Å; E601-L603 PolarHBondContact O-N 3.36Å; E601-L603 VanDerWaalsContact O-O 3.13Å
604	D	50.2	Low	53	Low	57 Å²	57	113.1 Å²	113.1	31%	0.305	62%	0.615	S	S	.	*			cis	-165.1	106	31	178.8	-10.9	0	0	0	108	L606 K607 S608	D604-L606 PolarHBondContact O-N 3.36Å; D604-L606 WeakPolarHBondContact OD1-CA 3.38Å; D604-L606 VanDerWaalsContact OD1-CB 3.32Å; D604-L606 WeakPolarHBondContact OD1-CB 3.31Å; D604-L606 PolarHBondContact OD1-N 3.25Å; D604-K607 HydrophobicContact CB-CB 3.82Å; D604-K607 HydrophobicContact CB-CD 4.37Å; D604-K607 HydrophobicContact CB-CG 4.32Å; D604-K607 VanDerWaalsContact CG-N 3.25Å; D604-K607 PolarHBondContact O-N 3.13Å; D604-K607 PolarHBondContact OD1-N 3.06Å; D604-K607 WeakPolarHBondContact OD2-CB 3.45Å; D604-K607 WeakPolarHBondContact OD2-CD 3.5Å; D604-K607 WeakPolarHBondContact OD2-CG 3.48Å; D604-K607 IonicContact OD2-NZ 3.18Å; D604-K607 PolarHBondContact OD2-NZ 3.42Å; D604-S608 PolarHBondContact O-N 3.46Å
605	I	58.2	Low	54.4	Low	143 Å²	143	112.7 Å²	112.7	73%	0.733	62%	0.616	S	S	*	*	H	α-helix	trans	-66.4	-27.3	178.6	-62.8	176.1	0	0	0	110.4	S608 L609	I605-S608 WeakPolarHBondContact O-CB 3.34Å; I605-S608 PolarHBondContact O-N 3.25Å; I605-L609 PolarHBondContact O-N 3.26Å
606	L	53.4	Low	55.9	Low	134 Å²	134	108.1 Å²	108.1	70%	0.702	60%	0.6	S	S	*	*	H	α-helix	trans	-71	-41.4	173.7	-69.6	168.4	0	0	0	110.8	D604 S608 L609 E610	D604-L606 PolarHBondContact O-N 3.36Å; D604-L606 WeakPolarHBondContact OD1-CA 3.38Å; D604-L606 VanDerWaalsContact OD1-CB 3.32Å; D604-L606 WeakPolarHBondContact OD1-CB 3.31Å; D604-L606 PolarHBondContact OD1-N 3.25Å; L606-S608 VanDerWaalsContact C-N 3.33Å; L606-S608 PolarHBondContact O-N 2.83Å; L606-L609 CarbonylContact O-C 3.59Å; L606-L609 PolarHBondContact O-N 3.5Å; L606-E610 WeakPolarHBondContact O-CB 3.15Å; L606-E610 PolarHBondContact O-N 3.35Å
607	K	59.8	Low	57.6	Low	123 Å²	123	104.8 Å²	104.8	54%	0.535	59%	0.586	S	S	.	*	H	α-helix	trans	-64.5	-32.3	166.6	-88.7	-179.8	-160.5	77.1	0	113.4	D604 L609 E610 N611	D604-K607 HydrophobicContact CB-CB 3.82Å; D604-K607 HydrophobicContact CB-CD 4.37Å; D604-K607 HydrophobicContact CB-CG 4.32Å; D604-K607 VanDerWaalsContact CG-N 3.25Å; D604-K607 PolarHBondContact O-N 3.13Å; D604-K607 PolarHBondContact OD1-N 3.06Å; D604-K607 WeakPolarHBondContact OD2-CB 3.45Å; D604-K607 WeakPolarHBondContact OD2-CD 3.5Å; D604-K607 WeakPolarHBondContact OD2-CG 3.48Å; D604-K607 IonicContact OD2-NZ 3.18Å; D604-K607 PolarHBondContact OD2-NZ 3.42Å; K607-L609 VanDerWaalsContact C-N 3.32Å; K607-E610 PolarHBondContact O-N 2.92Å; K607-N611 WeakPolarHBondContact O-CB 3.32Å; K607-N611 PolarHBondContact O-N 3.45Å
608	S	63.4	Low	58.9	Low	78 Å²	78	99.2 Å²	99.2	55%	0.545	57%	0.566	S	S	.	*	H	α-helix	trans	-64.3	-41.9	174.9	-162.9	0	0	0	0	110.7	D604 I605 L606 T612	D604-S608 PolarHBondContact O-N 3.46Å; I605-S608 WeakPolarHBondContact O-CB 3.34Å; I605-S608 PolarHBondContact O-N 3.25Å; L606-S608 VanDerWaalsContact C-N 3.33Å; L606-S608 PolarHBondContact O-N 2.83Å; S608-T612 VanDerWaalsContact O-CB 3.29Å; S608-T612 WeakPolarHBondContact O-CB 3.13Å; S608-T612 PolarHBondContact O-N 3.3Å; S608-T612 PolarHBondContact O-OG1 3.31Å
609	L	65.8	Low	60.5	Low	100 Å²	100	101 Å²	101	52%	0.524	57%	0.565	S	S	.	*	H	α-helix	trans	-67.4	-44.7	170.2	-94.4	158.9	0	0	0	112.6	I605 L606 K607 T612 V613	I605-L609 PolarHBondContact O-N 3.26Å; L606-L609 CarbonylContact O-C 3.59Å; L606-L609 PolarHBondContact O-N 3.5Å; K607-L609 VanDerWaalsContact C-N 3.32Å; L609-T612 CarbonylContact O-C 3.53Å; L609-T612 WeakPolarHBondContact O-CB 3.38Å; L609-T612 PolarHBondContact O-N 3.48Å; L609-V613 VanDerWaalsContact O-CB 3.24Å; L609-V613 WeakPolarHBondContact O-CB 3.47Å; L609-V613 WeakPolarHBondContact O-CG2 3.43Å; L609-V613 PolarHBondContact O-N 3.45Å
610	E	70.3	Confident	61.5	Low	115 Å²	115	98.8 Å²	98.8	54%	0.537	56%	0.557	S	S	.	*	H	α-helix	trans	-68.1	-34.8	-178.6	-173.4	-175.7	-152	0	0	111.9	L606 K607 V613 S614	L606-E610 WeakPolarHBondContact O-CB 3.15Å; L606-E610 PolarHBondContact O-N 3.35Å; K607-E610 PolarHBondContact O-N 2.92Å; E610-V613 CarbonylContact O-C 3.58Å; E610-S614 WeakPolarHBondContact O-CA 3.19Å; E610-S614 WeakPolarHBondContact O-CB 3.2Å; E610-S614 PolarHBondContact O-N 2.95Å; E610-S614 PolarHBondContact O-OG 3.01Å
611	N	69.8	Low	61.8	Low	116 Å²	116	96.9 Å²	96.9	62%	0.62	55%	0.551	S	S	*	*	H	α-helix	trans	-76.7	-33.7	173.6	-165.4	-3.8	0	0	0	110.6	K607 S615	K607-N611 WeakPolarHBondContact O-CB 3.32Å; K607-N611 PolarHBondContact O-N 3.45Å; N611-S615 WeakPolarHBondContact O-CB 3.44Å; N611-S615 PolarHBondContact O-N 3.38Å
612	T	81.2	Confident	62.4	Low	92 Å²	92	95 Å²	95	56%	0.564	55%	0.55	S	S	*	*	H	α-helix	trans	-64.9	-42.8	168.4	-61.2	0	0	0	0	111.5	S608 L609 S615 A616	S608-T612 VanDerWaalsContact O-CB 3.29Å; S608-T612 WeakPolarHBondContact O-CB 3.13Å; S608-T612 PolarHBondContact O-N 3.3Å; S608-T612 PolarHBondContact O-OG1 3.31Å; L609-T612 CarbonylContact O-C 3.53Å; L609-T612 WeakPolarHBondContact O-CB 3.38Å; L609-T612 PolarHBondContact O-N 3.48Å; T612-S615 PolarHBondContact O-N 3.47Å; T612-A616 WeakPolarHBondContact O-CB 3.47Å; T612-A616 PolarHBondContact O-N 2.97Å
613	V	75.4	Confident	62.4	Low	71 Å²	71	93 Å²	93	43%	0.43	53%	0.529	S	S	.	.	H	α-helix	trans	-70	-38.6	176.9	165.3	0	0	0	0	110.6	L609 E610 A616 I617	L609-V613 VanDerWaalsContact O-CB 3.24Å; L609-V613 WeakPolarHBondContact O-CB 3.47Å; L609-V613 WeakPolarHBondContact O-CG2 3.43Å; L609-V613 PolarHBondContact O-N 3.45Å; E610-V613 CarbonylContact O-C 3.58Å; V613-A616 CarbonylContact O-C 3.36Å; V613-A616 WeakPolarHBondContact O-CA 3.06Å; V613-A616 WeakPolarHBondContact O-CB 3.47Å; V613-A616 PolarHBondContact O-N 3.48Å; V613-A616 VanDerWaalsContact O-N 3.16Å; V613-I617 HydrophobicContact CG1-CD1 3.58Å; V613-I617 HydrophobicContact CG1-CG1 4.25Å; V613-I617 WeakPolarHBondContact O-CB 3.37Å; V613-I617 VanDerWaalsContact O-CG1 3.23Å; V613-I617 WeakPolarHBondContact O-CG1 3.47Å; V613-I617 PolarHBondContact O-N 3.42Å
614	S	73.3	Confident	61.9	Low	56 Å²	56	93.4 Å²	93.4	39%	0.392	54%	0.537	S	S	.	.	H	α-helix	trans	-71.5	-32.1	174	-64.6	0	0	0	0	111.9	E610 A616 S618	E610-S614 WeakPolarHBondContact O-CA 3.19Å; E610-S614 WeakPolarHBondContact O-CB 3.2Å; E610-S614 PolarHBondContact O-N 2.95Å; E610-S614 PolarHBondContact O-OG 3.01Å; S614-A616 VanDerWaalsContact C-N 3.32Å; S614-S618 WeakPolarHBondContact O-CB 3.21Å; S614-S618 PolarHBondContact O-N 3.23Å; S614-S618 PolarHBondContact O-OG 2.83Å
615	S	68.1	Low	61.5	Low	46 Å²	46	95 Å²	95	32%	0.322	55%	0.55	S	S	.	.	H	α-helix	trans	-68.8	-31.5	168.5	-165.7	0	0	0	0	111.7	N611 T612 S618 K619	N611-S615 WeakPolarHBondContact O-CB 3.44Å; N611-S615 PolarHBondContact O-N 3.38Å; T612-S615 PolarHBondContact O-N 3.47Å; S615-S618 WeakPolarHBondContact CA-OG 3.24Å; S615-S618 PolarHBondContact O-OG 2.89Å; S615-K619 VanDerWaalsContact O-CB 3.31Å; S615-K619 WeakPolarHBondContact O-CB 3.5Å; S615-K619 WeakPolarHBondContact O-CD 3.42Å; S615-K619 WeakPolarHBondContact O-CG 3.49Å; S615-K619 PolarHBondContact O-N 3.39Å
616	A	69.1	Low	60.2	Low	56 Å²	56	95.3 Å²	95.3	46%	0.463	56%	0.559	S	S	.	*	H	α-helix	trans	-75.7	-41.2	172.8	0	0	0	0	0	112.6	T612 V613 S614 K619 A620	T612-A616 WeakPolarHBondContact O-CB 3.47Å; T612-A616 PolarHBondContact O-N 2.97Å; V613-A616 CarbonylContact O-C 3.36Å; V613-A616 WeakPolarHBondContact O-CA 3.06Å; V613-A616 WeakPolarHBondContact O-CB 3.47Å; V613-A616 PolarHBondContact O-N 3.48Å; V613-A616 VanDerWaalsContact O-N 3.16Å; S614-A616 VanDerWaalsContact C-N 3.32Å; A616-K619 PolarHBondContact O-N 3.34Å; A616-A620 WeakPolarHBondContact O-CB 3.25Å; A616-A620 PolarHBondContact O-N 2.88Å
617	I	69.5	Low	59.2	Low	77 Å²	77	100.3 Å²	100.3	40%	0.395	57%	0.569	S	S	.	*	H	α-helix	trans	-68.3	-46.4	177.7	-73	169.1	0	0	0	110.2	V613 K619 A620 Q621	V613-I617 HydrophobicContact CG1-CD1 3.58Å; V613-I617 HydrophobicContact CG1-CG1 4.25Å; V613-I617 WeakPolarHBondContact O-CB 3.37Å; V613-I617 VanDerWaalsContact O-CG1 3.23Å; V613-I617 WeakPolarHBondContact O-CG1 3.47Å; V613-I617 PolarHBondContact O-N 3.42Å; I617-K619 VanDerWaalsContact C-N 3.31Å; I617-K619 PolarHBondContact O-N 3.48Å; I617-A620 CarbonylContact O-C 3.49Å; I617-A620 WeakPolarHBondContact O-CA 3.43Å; I617-A620 WeakPolarHBondContact O-CB 3.37Å; I617-A620 PolarHBondContact O-N 2.71Å; I617-Q621 VanDerWaalsContact CG2-CD 3.47Å; I617-Q621 HydrophobicContact CG2-CG 4.17Å; I617-Q621 WeakPolarHBondContact O-CB 3.41Å; I617-Q621 VanDerWaalsContact O-CG 3.32Å; I617-Q621 WeakPolarHBondContact O-CG 3.43Å; I617-Q621 PolarHBondContact O-N 3.25Å
618	S	59.6	Low	58.2	Low	52 Å²	52	98.3 Å²	98.3	36%	0.364	58%	0.583	S	S	.	*	H	α-helix	trans	-63	-35.4	174.1	56.5	0	0	0	0	112.3	S614 S615 Q621 T622	S614-S618 WeakPolarHBondContact O-CB 3.21Å; S614-S618 PolarHBondContact O-N 3.23Å; S614-S618 PolarHBondContact O-OG 2.83Å; S615-S618 WeakPolarHBondContact CA-OG 3.24Å; S615-S618 PolarHBondContact O-OG 2.89Å; S618-Q621 PolarHBondContact O-N 3.42Å; S618-T622 WeakPolarHBondContact O-CB 3.34Å; S618-T622 PolarHBondContact O-N 3.28Å; S618-T622 PolarHBondContact O-OG1 2.89Å
619	K	67	Low	56.4	Low	141 Å²	141	98.1 Å²	98.1	61%	0.613	59%	0.594	S	S	*	*	H	α-helix	trans	-66	-33	168.7	-80.9	170.6	-178	143.1	0	113.3	S615 A616 I617 G623	S615-K619 VanDerWaalsContact O-CB 3.31Å; S615-K619 WeakPolarHBondContact O-CB 3.5Å; S615-K619 WeakPolarHBondContact O-CD 3.42Å; S615-K619 WeakPolarHBondContact O-CG 3.49Å; S615-K619 PolarHBondContact O-N 3.39Å; A616-K619 PolarHBondContact O-N 3.34Å; I617-K619 VanDerWaalsContact C-N 3.31Å; I617-K619 PolarHBondContact O-N 3.48Å; K619-G623 VanDerWaalsContact O-CA 3.31Å; K619-G623 WeakPolarHBondContact O-CA 3.37Å; K619-G623 PolarHBondContact O-N 2.86Å
620	A	57.3	Low	54.7	Low	76 Å²	76	104.3 Å²	104.3	63%	0.628	61%	0.612	S	S	*	*	H	α-helix	trans	-76.5	-31	174.8	0	0	0	0	0	113.1	A616 I617	A616-A620 WeakPolarHBondContact O-CB 3.25Å; A616-A620 PolarHBondContact O-N 2.88Å; I617-A620 CarbonylContact O-C 3.49Å; I617-A620 WeakPolarHBondContact O-CA 3.43Å; I617-A620 WeakPolarHBondContact O-CB 3.37Å; I617-A620 PolarHBondContact O-N 2.71Å
621	Q	52.8	Low	53.3	Low	146 Å²	146	104.8 Å²	104.8	68%	0.682	62%	0.624	S	S	*	*	H	α-helix	trans	-85.7	-36	-178.6	-72.7	171.8	-20.5	0	0	112.8	I617 S618	I617-Q621 VanDerWaalsContact CG2-CD 3.47Å; I617-Q621 HydrophobicContact CG2-CG 4.17Å; I617-Q621 WeakPolarHBondContact O-CB 3.41Å; I617-Q621 VanDerWaalsContact O-CG 3.32Å; I617-Q621 WeakPolarHBondContact O-CG 3.43Å; I617-Q621 PolarHBondContact O-N 3.25Å; S618-Q621 PolarHBondContact O-N 3.42Å
622	T	51.3	Low	51.7	Low	115 Å²	115	105 Å²	105	71%	0.706	64%	0.635	S	S	*	*	H	α-helix	trans	-86.8	-23.6	173.3	59.1	0	0	0	0	112.9	S618 T624	S618-T622 WeakPolarHBondContact O-CB 3.34Å; S618-T622 PolarHBondContact O-N 3.28Å; S618-T622 PolarHBondContact O-OG1 2.89Å; T622-T624 PolarHBondContact O-N 2.78Å
623	G	47.9	Very low	49.4	Very low	44 Å²	44	107.6 Å²	107.6	45%	0.454	64%	0.644	S	S	.	*			trans	-80.6	70.3	177.6	0	0	0	0	0	113.5	K619 P625	K619-G623 VanDerWaalsContact O-CA 3.31Å; K619-G623 WeakPolarHBondContact O-CA 3.37Å; K619-G623 PolarHBondContact O-N 2.86Å; G623-P625 VanDerWaalsContact O-CD 3.25Å; G623-P625 WeakPolarHBondContact O-CD 3.42Å
624	T	36.2	Very low	47.5	Very low	124 Å²	124	112 Å²	112	76%	0.761	66%	0.659	S	S	*	*			trans	-79.6	115.8	169.1	32.9	0	0	0	0	111.3	T622	T622-T624 PolarHBondContact O-N 2.78Å
625	P	41.6	Very low	45.5	Very low	89 Å²	89	114.3 Å²	114.3	58%	0.578	68%	0.682	S	S	*	*			trans	-84	124.1	174.2	31.7	-30.9	0	0	0	110.9	G623 W627	G623-P625 VanDerWaalsContact O-CD 3.25Å; G623-P625 WeakPolarHBondContact O-CD 3.42Å; P625-W627 PolarHBondContact O-N 2.73Å
626	T	31	Very low	43.6	Very low	151 Å²	151	116.8 Å²	116.8	93%	0.926	71%	0.706	S	S	*	*			trans	-72.8	84.3	179.5	-25.3	0	0	0	0	111.7
627	W	33.8	Very low	41.7	Very low	238 Å²	238	124.1 Å²	124.1	90%	0.902	72%	0.723	S	S	*	*			trans	-81.8	121.7	174.6	-76.1	91.7	0	0	0	111.8	P625	P625-W627 PolarHBondContact O-N 2.73Å
628	G	37.6	Very low	39.9	Very low	81 Å²	81	128 Å²	128	84%	0.835	74%	0.739	S	S	*	*			trans	179.5	109.7	173.2	0	0	0	0	0	113.3
629	G	26.4	Very low	38.4	Very low	75 Å²	75	132.7 Å²	132.7	77%	0.773	76%	0.76	S	S	*	*			cis	177.3	174.1	-7.3	0	0	0	0	0	114.3
630	Y	29.2	Very low	36.5	Very low	230 Å²	230	134.7 Å²	134.7	90%	0.902	77%	0.771	S	S	*	*			trans	-108.5	127.1	157.5	-117.2	-93.3	0	0	0	106.6
631	P	40.8	Very low	35.1	Very low	124 Å²	124	134.8 Å²	134.8	81%	0.805	78%	0.779	S	S	*	*			trans	-66.5	142.9	172.3	-19.9	33.1	0	0	0	111.4
632	S	37.3	Very low	34	Very low	120 Å²	120	132.1 Å²	132.1	84%	0.839	78%	0.782	S	S	*	*			trans	-89.9	176.6	-175.1	57	0	0	0	0	113.4
633	I	33.1	Very low	33	Very low	147 Å²	147	133.4 Å²	133.4	75%	0.754	78%	0.783	S	S	*	*	S	Bend	trans	-107.7	123.7	-178.2	-66.6	174.7	0	0	0	110.1
634	H	34.2	Very low	32.2	Very low	163 Å²	163	139.4 Å²	139.4	76%	0.755	80%	0.797	S	S	*	*			trans	65.4	92.5	164.1	-63.5	-44.4	0	0	0	120.8
635	A	31.7	Very low	31.7	Very low	105 Å²	105	138.3 Å²	138.3	87%	0.868	79%	0.794	S	S	*	*				-162.4	145.7	125.6	0	0	0	0	0	107.6
636	A	27.6	Very low	30.9	Very low	99 Å²	99	139.8 Å²	139.8	82%	0.818	81%	0.807	S	S	*	*			cis	-140.7	-168.2	-7	0	0	0	0	0	109.9
637	Y	30.7	Very low	30.8	Very low	209 Å²	209	136.7 Å²	136.7	82%	0.82	80%	0.796	S	S	*	*			trans	-79.8	165	173.7	-95.1	-115.6	0	0	0	112.7
638	Q	31.9	Very low	30.5	Very low	160 Å²	160	130.9 Å²	130.9	75%	0.748	79%	0.788	S	S	*	*			trans	65.4	135.5	168.9	-101.4	88.4	15.1	0	0	115.6
639	L	28	Very low	30.1	Very low	150 Å²	150	133.2 Å²	133.2	79%	0.785	79%	0.785	S	S	*	*			cis	-151.5	174.4	16.7	-97.2	169.5	0	0	0	112.5
640	Q	26.9	Very low	30.2	Very low	183 Å²	183	137.3 Å²	137.3	86%	0.855	79%	0.788	S	S	*	*			trans	-66.1	154.7	166.9	-79.9	94.5	-30.3	0	0	114.4
641	G	28.3	Very low	31.1	Very low	78 Å²	78	131.2 Å²	131.2	80%	0.804	78%	0.777	S	S	*	*			trans	-168.3	140.2	159.7	0	0	0	0	0	110.3
642	A	29.5	Very low	31.3	Very low	90 Å²	90	130.6 Å²	130.6	74%	0.744	77%	0.773	S	S	*	*			trans	-146.2	168.2	-171.2	0	0	0	0	0	114.2
643	I	29.9	Very low	30.9	Very low	141 Å²	141	130.6 Å²	130.6	72%	0.723	77%	0.768	S	S	*	*			trans	65.4	118	158.5	59.1	164.4	0	0	0	122.2
644	K	30.1	Very low	30.6	Very low	171 Å²	171	128.8 Å²	128.8	74%	0.743	76%	0.764	S	S	*	*				79.4	107.5	126.8	-67.7	171.3	-170.3	174.7	0	122.2
645	S	25.5	Very low	30.5	Very low	100 Å²	100	129.4 Å²	129.4	70%	0.699	77%	0.767	S	S	*	*				83.9	137.2	114	-55.8	0	0	0	0	122.9
646	S	25.6	Very low	30.4	Very low	120 Å²	120	129.2 Å²	129.2	84%	0.839	76%	0.759	S	S	*	*			trans	63.4	150.4	144.7	47.7	0	0	0	0	119.9
647	A	29.5	Very low	30.4	Very low	86 Å²	86	130.6 Å²	130.6	71%	0.711	76%	0.757	S	S	*	*			cis	-165.6	174.3	-16.3	0	0	0	0	0	107.9
648	T	27.1	Very low	30.1	Very low	117 Å²	117	129.3 Å²	129.3	72%	0.718	76%	0.759	S	S	*	*				161.1	169.7	96.7	-59.1	0	0	0	0	109.9
649	V	28.6	Very low	29.7	Very low	130 Å²	130	129.2 Å²	129.2	79%	0.788	76%	0.76	S	S	*	*			trans	78	95.9	170.9	-164.5	0	0	0	0	114.9
650	L	29.7	Very low	29.6	Very low	160 Å²	160	129.1 Å²	129.1	84%	0.838	76%	0.756	S	S	*	*			cis	95.5	149.2	33.5	-66.1	175.2	0	0	0	116.2
651	P	47.9	Very low	30.2	Very low	103 Å²	103	124.8 Å²	124.8	67%	0.669	74%	0.744	S	S	*	*			trans	-119.9	-165.9	-148.7	44.9	-31.8	0	0	0	114.8
652	P	43.8	Very low	30	Very low	111 Å²	111	128.3 Å²	128.3	72%	0.721	74%	0.741	S	S	*	*				-135.6	153.2	89.3	12.3	12.4	0	0	0	114.1
653	T	29.4	Very low	29.9	Very low	119 Å²	119	132.5 Å²	132.5	73%	0.73	74%	0.743	S	S	*	*				61.9	148.3	72.3	71.1	0	0	0	0	116.1
654	V	27.5	Very low	29.7	Very low	109 Å²	109	133.4 Å²	133.4	66%	0.661	75%	0.749	S	S	*	*			cis	-157.4	153.9	26.2	-131.2	0	0	0	0	115
655	Q	30.8	Very low	29.5	Very low	176 Å²	176	131.2 Å²	131.2	82%	0.822	76%	0.755	S	S	*	*			trans	56.9	158.3	142.6	-78.4	165.1	-5.4	0	0	122.9
656	S	29.6	Very low	29.6	Very low	102 Å²	102	130 Å²	130	71%	0.713	76%	0.758	S	S	*	*			cis	-177.1	-170.4	-22.7	60	0	0	0	0	108.9
657	V	27.6	Very low	30.1	Very low	128 Å²	128	132.5 Å²	132.5	78%	0.776	76%	0.761	S	S	*	*			cis	-162	162.9	2	75.5	0	0	0	0	109.8
658	Q	25.7	Very low	30.3	Very low	182 Å²	182	139.5 Å²	139.5	85%	0.85	77%	0.769	S	S	*	*				166.6	164.3	127.3	-163.8	150.5	12.4	0	0	112.8
659	M	23.6	Very low	30.4	Very low	158 Å²	158	139.1 Å²	139.1	78%	0.778	77%	0.772	S	S	*	*			trans	-162.2	158	-158.2	-128.6	-164.5	-170.9	0	0	114.2
660	Q	24.8	Very low	30.5	Very low	148 Å²	148	140.2 Å²	140.2	69%	0.692	77%	0.772	S	S	*	*			trans	69.2	173.2	149.5	-67.4	-58.5	-11.2	0	0	120.3
661	P	40.5	Very low	30.4	Very low	92 Å²	92	138.8 Å²	138.8	60%	0.597	77%	0.77	S	S	*	*			cis	-140.7	168.4	-31.6	32.9	-13.7	0	0	0	117.2
662	M	24.2	Very low	29.4	Very low	152 Å²	152	138.2 Å²	138.2	75%	0.749	77%	0.768	S	S	*	*			trans	59.3	162.1	140.6	-72.2	168.1	175.6	0	0	121.4
663	F	27.1	Very low	28.6	Very low	177 Å²	177	139.3 Å²	139.3	78%	0.776	77%	0.768	S	S	*	*			cis	-161.4	-173.7	-6	-119.4	-35.9	0	0	0	112.7
664	N	24.1	Very low	28.7	Very low	161 Å²	161	137.9 Å²	137.9	86%	0.861	76%	0.763	S	S	*	*			trans	96	168.7	160.6	-91.6	7.7	0	0	0	122.5
665	S	26.6	Very low	28.8	Very low	124 Å²	124	139 Å²	139	87%	0.867	77%	0.765	S	S	*	*			trans	-147.6	154.1	-142.3	176.9	0	0	0	0	115.5
666	G	28.1	Very low	28.9	Very low	74 Å²	74	133.9 Å²	133.9	76%	0.763	75%	0.749	S	S	*	*			trans	174.4	126.7	170	0	0	0	0	0	118
667	L	36.1	Very low	29.1	Very low	173 Å²	173	134.8 Å²	134.8	91%	0.906	75%	0.749	S	S	*	*			trans	-60.8	166.1	-179.3	-59.5	159.5	0	0	0	116
668	R	33.7	Very low	29.1	Very low	233 Å²	233	134.8 Å²	134.8	88%	0.879	74%	0.744	S	S	*	*			cis	-152.2	160.2	24.8	-77.8	-163.7	-70.7	-163.2	1.6	114.3
669	S	29.9	Very low	29.1	Very low	110 Å²	110	134.3 Å²	134.3	77%	0.769	74%	0.741	S	S	*	*			trans	111.7	107.1	136.8	-157.7	0	0	0	0	121.5
670	L	30.4	Very low	29.1	Very low	153 Å²	153	132 Å²	132	80%	0.801	74%	0.74	S	S	*	*			trans	60.6	109.1	155.8	-94.7	75.2	0	0	0	122.9
671	V	27.1	Very low	29.8	Very low	129 Å²	129	130.7 Å²	130.7	78%	0.782	75%	0.745	S	S	*	*				53.5	129.2	120.5	176	0	0	0	0	118.9
672	S	26.1	Very low	29	Very low	91 Å²	91	137.8 Å²	137.8	64%	0.636	76%	0.76	S	S	*	*			cis	175.9	-179.3	-4.7	-93.8	0	0	0	0	107.8
673	D	27.2	Very low	28.8	Very low	135 Å²	135	135.6 Å²	135.6	72%	0.722	76%	0.76	S	S	*	*			cis	-177.3	159.8	-40	-93.6	-63.2	0	0	0	107.1
674	S	33.1	Very low	29	Very low	88 Å²	88	132.7 Å²	132.7	62%	0.615	76%	0.758	S	S	*	*			cis	-173.1	152.2	-29.6	-99.1	0	0	0	0	110.9
675	N	29.3	Very low	28.9	Very low	134 Å²	134	130.1 Å²	130.1	72%	0.717	75%	0.753	S	S	*	*			trans	83.4	173.1	152.7	-73.7	-30.6	0	0	0	124.2
676	S	31.7	Very low	28.8	Very low	67 Å²	67	129.4 Å²	129.4	47%	0.469	75%	0.748	S	S	.	*			trans	-167.8	-179	-133.3	-42.1	0	0	0	0	114	N114	N114-S676 PolarHBondContact ND2-OG 3.42Å
677	V	33.5	Very low	29	Very low	121 Å²	121	130.9 Å²	130.9	73%	0.733	74%	0.744	S	S	*	*			trans	95.5	110.2	137.4	153.4	0	0	0	0	123
678	I	29.3	Very low	28.6	Very low	129 Å²	129	126 Å²	126	66%	0.662	72%	0.722	S	S	*	*			trans	41.6	130.3	134	-25.1	160	0	0	0	123.3
679	H	25.5	Very low	28.2	Very low	172 Å²	172	119.6 Å²	119.6	80%	0.796	71%	0.705	S	S	*	*				151.8	149.5	120	-86.6	-71	0	0	0	116.2
680	S	22.1	Very low	28.2	Very low	108 Å²	108	118.4 Å²	118.4	76%	0.755	69%	0.689	S	S	*	*			trans	-90.6	-173.5	176.6	-26.9	0	0	0	0	112
681	P	39.5	Very low	28.2	Very low	122 Å²	122	121.8 Å²	121.8	79%	0.792	69%	0.691	S	S	*	*			cis	-135.6	-158.4	-8.6	41.8	-22.7	0	0	0	113.7
682	R	23.8	Very low	28.4	Very low	240 Å²	240	117.7 Å²	117.7	91%	0.906	67%	0.668	S	S	*	*			trans	103.8	136.8	152.8	-153.5	177.6	-167.3	167.3	2.9	118.2
683	S	21.1	Very low	29	Very low	107 Å²	107	118.3 Å²	118.3	75%	0.748	66%	0.664	S	S	*	*			trans	-77	176.1	177.6	-20.4	0	0	0	0	112.8
684	P	30.1	Very low	29.1	Very low	115 Å²	115	116.3 Å²	116.3	75%	0.747	66%	0.657	S	S	*	*			cis	-143.7	-154.3	19.8	44.4	-22.9	0	0	0	116.1
685	S	22.2	Very low	29.2	Very low	108 Å²	108	118.1 Å²	118.1	76%	0.755	66%	0.664	S	S	*	*			trans	72.1	108.2	157.5	47.2	0	0	0	0	121.2
686	S	25	Very low	29.4	Very low	109 Å²	109	115.8 Å²	115.8	76%	0.762	66%	0.663	S	S	*	*			trans	-61.4	162.6	142.5	-27.9	0	0	0	0	110.6
687	P	32.3	Very low	29.7	Very low	105 Å²	105	121.7 Å²	121.7	68%	0.682	69%	0.686	S	S	*	*				-136.8	165.8	71.3	13.7	11.2	0	0	0	118
688	T	26.8	Very low	29.6	Very low	69 Å²	69	124.7 Å²	124.7	42%	0.423	69%	0.692	S	S	.	*			trans	-9.8	139	138.6	55.7	0	0	0	0	116	Y78 G79 P81	Y78-T688 VanDerWaalsContact O-CB 3.27Å; Y78-T688 WeakPolarHBondContact O-CB 3.47Å; Y78-T688 WeakPolarHBondContact O-CG2 3.38Å; G79-T688 WeakPolarHBondContact O-CB 3.35Å; G79-T688 VanDerWaalsContact O-CG2 3.32Å; G79-T688 WeakPolarHBondContact O-CG2 3.16Å; P81-T688 VanDerWaalsContact CD-CA 3.48Å
689	L	26.6	Very low	29.8	Very low	100 Å²	100	125.5 Å²	125.5	52%	0.524	69%	0.693	S	S	.	*				-159.1	156.6	68.7	-129.1	163.3	0	0	0	117.7	Y78 G79 S80	Y78-L689 HydrophobicContact CD1-CD2 3.45Å; Y78-L689 VanDerWaalsContact CD1-CD2 3.45Å; Y78-L689 HydrophobicContact CE1-CD2 4.31Å; Y78-L689 HydrophobicContact CG-CD2 3.91Å; G79-L689 VanDerWaalsContact O-CA 3.25Å; G79-L689 WeakPolarHBondContact O-CA 3.47Å; S80-L689 CarbonylContact O-C 3.28Å; S80-L689 VanDerWaalsContact O-C 3.28Å
690	L	30.2	Very low	30.6	Very low	85 Å²	85	126 Å²	126	45%	0.445	70%	0.701	S	S	.	*			trans	-65.4	151.2	172.8	-71.9	103.7	0	0	0	115.8	Y78 G79 S80	Y78-L690 HydrophobicContact CD1-CD1 3.85Å; Y78-L690 HydrophobicContact CE1-CD1 4.18Å; G79-L690 VanDerWaalsContact CA-CD1 3.5Å; G79-L690 WeakPolarHBondContact O-CD1 3.24Å; S80-L690 PolarHBondContact O-N 3.34Å
691	R	29.8	Very low	30.9	Very low	224 Å²	224	124 Å²	124	85%	0.845	68%	0.684	S	S	*	*				-165	173.2	104.6	-117.6	-171.5	-179.2	-166.3	0.9	114.4
692	S	31.7	Very low	30.9	Very low	42 Å²	42	127 Å²	127	29%	0.294	69%	0.687	S	S	.	*			trans	-118.5	152.6	-175	60	0	0	0	0	112.5	V441	V441-S692 WeakPolarHBondContact CG2-OG 3.36Å
693	N	37.6	Very low	31.6	Very low	105 Å²	105	123.4 Å²	123.4	56%	0.561	68%	0.678	S	S	*	*			trans	40.3	122.9	139.7	-51.4	-1.4	0	0	0	118.8	Y440	Y440-N693 HydrophobicContact CD1-CB 4Å; Y440-N693 VanDerWaalsContact CD1-ND2 3.33Å; Y440-N693 WeakPolarHBondContact CD1-ND2 3.27Å; Y440-N693 WeakPolarHBondContact CE1-ND2 3.49Å; Y440-N693 HydrophobicContact CG-CB 4.4Å
694	V	30.8	Very low	32.1	Very low	93 Å²	93	124.7 Å²	124.7	56%	0.564	68%	0.681	S	S	*	*				-156	161	97.2	119.9	0	0	0	0	114.9	P439	P439-V694 VanDerWaalsContact CD-CG2 3.43Å; P439-V694 HydrophobicContact CG-CG2 3.63Å
695	T	35	Very low	32.1	Very low	126 Å²	126	125.1 Å²	125.1	77%	0.773	68%	0.682	S	S	*	*			trans	-57.8	160.5	177.6	-29.5	0	0	0	0	115.3
696	A	32.7	Very low	32.5	Very low	84 Å²	84	122.7 Å²	122.7	69%	0.694	67%	0.674	S	S	*	*			trans	80.2	86.3	151.5	0	0	0	0	0	119.4
697	M	38.1	Very low	33.1	Very low	192 Å²	192	126.9 Å²	126.9	95%	0.946	68%	0.678	S	S	*	*			trans	62.3	86.1	133	-64.1	176.2	60.5	0	0	119
698	E	31.9	Very low	32.9	Very low	184 Å²	184	128.1 Å²	128.1	86%	0.86	68%	0.684	S	S	*	*			trans	-111.1	106.8	143.4	-164.3	164.3	-158.4	0	0	105.3
699	E	33.7	Very low	33.1	Very low	145 Å²	145	128.8 Å²	128.8	68%	0.678	70%	0.696	S	S	*	*				54.2	81.8	101.2	-164	168.2	167.3	0	0	111.7	V701	E699-V701 HydrophobicContact CG-CB 3.9Å; E699-V701 HydrophobicContact CG-CG2 3.62Å; E699-V701 PolarHBondContact O-N 3.41Å; E699-V701 WeakPolarHBondContact OE1-CG2 3.42Å
700	L	42.9	Very low	33.1	Very low	183 Å²	183	129.9 Å²	129.9	96%	0.958	71%	0.708	S	S	*	*				50	14.7	64.4	-86.7	-178	0	0	0	116.5
701	V	28.2	Very low	33	Very low	67 Å²	67	132 Å²	132	41%	0.406	72%	0.724	S	S	.	*			trans	-131.9	90.1	166.8	179.8	0	0	0	0	113	E699 K703	E699-V701 HydrophobicContact CG-CB 3.9Å; E699-V701 HydrophobicContact CG-CG2 3.62Å; E699-V701 PolarHBondContact O-N 3.41Å; E699-V701 WeakPolarHBondContact OE1-CG2 3.42Å; V701-K703 HydrophobicContact CG1-CD 4.06Å; V701-K703 VanDerWaalsContact CG1-NZ 3.31Å
702	E	39.4	Very low	32.8	Very low	185 Å²	185	129.3 Å²	129.3	86%	0.864	72%	0.718	S	S	*	*				-165.1	104.6	128.2	-104.6	-177.1	155.4	0	0	106.6
703	K	38	Very low	32.7	Very low	164 Å²	164	134.7 Å²	134.7	71%	0.713	74%	0.736	S	S	*	*				46.6	104.9	73.8	-59.4	166.4	-176.6	158	0	108.8	V701	V701-K703 HydrophobicContact CG1-CD 4.06Å; V701-K703 VanDerWaalsContact CG1-NZ 3.31Å
704	V	31.2	Very low	32.1	Very low	134 Å²	134	136.2 Å²	136.2	81%	0.812	74%	0.74	S	S	*	*			cis	-158.4	138.7	45.7	162.7	0	0	0	0	107.6
705	T	29.8	Very low	32.1	Very low	124 Å²	124	138.4 Å²	138.4	76%	0.761	74%	0.742	S	S	*	*			cis	-145.4	170.4	13.2	-9.3	0	0	0	0	107.6
706	G	31.7	Very low	31.6	Very low	57 Å²	57	139.1 Å²	139.1	59%	0.588	74%	0.737	S	S	*	*			cis	109.7	147.8	4.1	0	0	0	0	0	113.8
707	K	36.2	Very low	31.1	Very low	197 Å²	197	141.6 Å²	141.6	86%	0.857	73%	0.734	S	S	*	*			trans	86.2	132.6	-165.2	-56.1	166.7	-174.8	172.6	0	112.9
708	T	28.4	Very low	30.4	Very low	130 Å²	130	140.1 Å²	140.1	80%	0.798	72%	0.722	S	S	*	*			cis	-156.2	143.9	3	-0.2	0	0	0	0	112.1
709	A	30.9	Very low	30	Very low	83 Å²	83	138.2 Å²	138.2	69%	0.686	72%	0.717	S	S	*	*			trans	46.3	141.9	139.9	0	0	0	0	0	121.9
710	T	27.7	Very low	29.6	Very low	124 Å²	124	137.5 Å²	137.5	76%	0.761	72%	0.722	S	S	*	*			cis	-173	163.3	-3.6	17.5	0	0	0	0	110.2
711	V	26.8	Very low	28.6	Very low	129 Å²	129	134.9 Å²	134.9	78%	0.782	72%	0.719	S	S	*	*			trans	72	140.8	147.6	152.7	0	0	0	0	118.3
712	K	26.8	Very low	28.6	Very low	168 Å²	168	139.1 Å²	139.1	73%	0.73	74%	0.739	S	S	*	*			cis	-177.5	155.1	-26.2	-134.5	-177.8	-167.4	172.9	0	108.6
713	K	28.7	Very low	27.9	Very low	155 Å²	155	136.9 Å²	136.9	67%	0.674	73%	0.728	S	S	*	*			trans	64.5	163.1	158.3	-68.6	-179.7	149.6	-117.4	0	115.8
714	E	25.1	Very low	27.4	Very low	137 Å²	137	138.2 Å²	138.2	64%	0.64	73%	0.729	S	S	*	*			cis	-170.2	175.5	-18.5	-103	163.5	-179.5	0	0	106.5
715	K	30.6	Very low	27	Very low	138 Å²	138	137.1 Å²	137.1	60%	0.6	73%	0.726	S	S	*	*			cis	171.4	146.9	-32	170.2	178.3	176.1	-101.7	0	106.7
716	E	24	Very low	26.8	Very low	142 Å²	142	142.6 Å²	142.6	66%	0.664	73%	0.733	S	S	*	*			trans	62.3	169.1	168.8	-80.8	159.8	171.2	0	0	116.3
717	E	23.9	Very low	27	Very low	135 Å²	135	144.9 Å²	144.9	63%	0.631	74%	0.737	S	S	*	*			cis	-161.3	157.7	-45.6	-145.7	-173.4	-120.3	0	0	108.8
718	K	23.2	Very low	27.1	Very low	161 Å²	161	141.2 Å²	141.2	70%	0.7	73%	0.734	S	S	*	*			trans	67.4	156.6	149.9	-106.5	-179	-164.3	117	0	121.9
719	L	22	Very low	27	Very low	144 Å²	144	140.3 Å²	140.3	75%	0.754	73%	0.732	S	S	*	*			trans	58.5	109.6	158.8	-60.9	165.9	0	0	0	116.5
720	V	26	Very low	26.7	Very low	130 Å²	130	144.5 Å²	144.5	79%	0.788	74%	0.743	S	S	*	*				62.8	104.6	60.6	-174.7	0	0	0	0	113.3
721	S	23	Very low	26.6	Very low	129 Å²	129	144 Å²	144	90%	0.902	74%	0.739	S	S	*	*			trans	-158.5	142.4	150.1	-76.9	0	0	0	0	109.7
722	L	27.8	Very low	26.6	Very low	155 Å²	155	146.4 Å²	146.4	81%	0.812	74%	0.739	S	S	*	*			trans	-100.9	138.2	-176.5	167.5	73.5	0	0	0	110.2
723	E	24.8	Very low	26.8	Very low	138 Å²	138	143.7 Å²	143.7	65%	0.645	74%	0.741	S	S	*	*			trans	171	157	138.5	-102.1	-169	146.3	0	0	112.8
724	R	26.2	Very low	27	Very low	193 Å²	193	141.1 Å²	141.1	73%	0.728	74%	0.74	S	S	*	*			cis	-148	164.7	-1.4	-170.9	173	-81.8	154.9	-4.3	110.5
725	C	23.5	Very low	27.2	Very low	111 Å²	111	138 Å²	138	75%	0.75	73%	0.734	S	S	*	*			trans	-56.4	173.9	169.5	-39.9	0	0	0	0	114.1
726	R	26.1	Very low	27.5	Very low	239 Å²	239	134.7 Å²	134.7	90%	0.902	73%	0.726	S	S	*	*			cis	-159	177.6	33.6	-117	-152.7	166.7	137.6	-2.8	113.1
727	P	36.6	Very low	27.4	Very low	104 Å²	104	132.2 Å²	132.2	68%	0.675	73%	0.73	S	S	*	*			trans	-105.7	-143.3	-172.4	46.5	-39.5	0	0	0	111.3
728	P	36.8	Very low	27.5	Very low	121 Å²	121	133.1 Å²	133.1	79%	0.786	74%	0.738	S	S	*	*			cis	-132.8	-150.9	-14.7	40.7	-19.3	0	0	0	113.9
729	S	26.4	Very low	27.6	Very low	110 Å²	110	134.4 Å²	134.4	77%	0.769	74%	0.739	S	S	*	*			trans	-94	148.4	-170.7	51.9	0	0	0	0	116.8
730	L	24.9	Very low	27.6	Very low	172 Å²	172	133.9 Å²	133.9	90%	0.901	73%	0.732	S	S	*	*			trans	-160.2	167.9	160.9	-154	69.6	0	0	0	110.6
731	V	26.1	Very low	27.6	Very low	114 Å²	114	134.9 Å²	134.9	69%	0.691	73%	0.729	S	S	*	*				-145.3	148	-90.1	102.3	0	0	0	0	113.1
732	K	27.4	Very low	27.7	Very low	178 Å²	178	137.3 Å²	137.3	77%	0.774	72%	0.718	S	S	*	*			trans	56.3	121.3	168.4	-96	106	171.1	-172.4	0	120.9
733	S	29.1	Very low	27.6	Very low	111 Å²	111	136 Å²	136	78%	0.776	71%	0.707	S	S	*	*			trans	61.1	164.8	130.1	-49.7	0	0	0	0	121.5
734	P	33.8	Very low	27.6	Very low	102 Å²	102	136.7 Å²	136.7	66%	0.662	71%	0.711	S	S	*	*			cis	-110	-169.6	-48.2	39.4	-27	0	0	0	110.5
735	S	30	Very low	27.5	Very low	71 Å²	71	134.9 Å²	134.9	50%	0.497	72%	0.715	S	S	.	*			trans	-75.6	150.8	158.2	38	0	0	0	0	110.3
736	P	36.3	Very low	27.7	Very low	68 Å²	68	135.3 Å²	135.3	44%	0.442	72%	0.716	S	S	.	*			cis	-144	166.9	39.2	42.3	-23.2	0	0	0	119.5	M185	M185-P736 HydrophobicContact CB-CG 4.5Å
737	A	22.6	Very low	27.6	Very low	90 Å²	90	129.4 Å²	129.4	74%	0.744	71%	0.711	S	S	*	*			trans	62.1	133.4	139	0	0	0	0	0	125.2
738	L	25.1	Very low	27.7	Very low	154 Å²	154	129.3 Å²	129.3	81%	0.806	71%	0.711	S	S	*	*			trans	84.4	157.2	134.6	-105.6	174.6	0	0	0	122.1
739	R	24.5	Very low	27.2	Very low	189 Å²	189	130.3 Å²	130.3	71%	0.713	71%	0.71	S	S	*	*			trans	70.7	135.6	177	-54.5	-74.6	170.9	155.7	1.9	113.6
740	E	23.8	Very low	27.2	Very low	132 Å²	132	131 Å²	131	62%	0.617	71%	0.705	S	S	*	*			cis	-161.9	166.9	-7.4	-128.6	159.7	-176.6	0	0	107.2
741	Q	24.2	Very low	27.6	Very low	152 Å²	152	130.1 Å²	130.1	71%	0.71	70%	0.7	S	S	*	*			cis	-163.4	178.1	15.8	-162.1	172.8	25.8	0	0	109
742	R	26	Very low	27.7	Very low	180 Å²	180	129.2 Å²	129.2	68%	0.679	70%	0.699	S	S	*	*			trans	86.5	112.8	137.3	-159.8	165.8	-169.7	124.6	29.1	121
743	E	25	Very low	27.7	Very low	126 Å²	126	127.7 Å²	127.7	59%	0.589	70%	0.704	S	S	*	*			trans	66.1	163.6	141.9	-71.4	162.6	-167.7	0	0	119.9
744	Q	25	Very low	27.7	Very low	153 Å²	153	126 Å²	126	72%	0.715	70%	0.704	S	S	*	*			cis	-177	151.4	-41.6	-111	170.8	21.8	0	0	108.9
745	L	24.8	Very low	27.5	Very low	155 Å²	155	130.8 Å²	130.8	81%	0.812	71%	0.714	S	S	*	*			trans	70	-179.5	157.7	-58.5	163.4	0	0	0	116.7
746	P	27.6	Very low	27.6	Very low	121 Å²	121	135.1 Å²	135.1	79%	0.786	73%	0.731	S	S	*	*				-135.8	-165.8	-95.6	40.5	-18.9	0	0	0	114.8
747	S	23	Very low	27.4	Very low	114 Å²	114	137.9 Å²	137.9	80%	0.797	75%	0.752	S	S	*	*			trans	-155.9	132.9	176.7	-174.8	0	0	0	0	114.6
748	P	39.2	Very low	27.9	Very low	103 Å²	103	137 Å²	137	67%	0.669	75%	0.753	S	S	*	*			trans	-138.2	144.4	171.7	38.4	-22	0	0	0	117.5
749	N	26.4	Very low	28.6	Very low	141 Å²	141	136.7 Å²	136.7	75%	0.754	75%	0.751	S	S	*	*			trans	68	158.5	139.5	-69.2	40.8	0	0	0	120.7
750	D	27.5	Very low	29.3	Very low	126 Å²	126	138.3 Å²	138.3	67%	0.674	76%	0.757	S	S	*	*			cis	-157.6	177.5	4.8	-135.8	-47.2	0	0	0	114.6
751	L	31.8	Very low	30.2	Very low	152 Å²	152	137 Å²	137	80%	0.796	76%	0.762	S	S	*	*			trans	77.2	122.5	151	-74.1	165.2	0	0	0	124.9
752	S	29	Very low	31.4	Very low	96 Å²	96	137 Å²	137	67%	0.671	77%	0.765	S	S	*	*				71	110.1	123.8	-169.6	0	0	0	0	124.6
753	V	26.9	Very low	32.2	Very low	145 Å²	145	133.6 Å²	133.6	88%	0.879	77%	0.769	S	S	*	*				29.2	118.6	128.9	-170.4	0	0	0	0	120.1
754	G	30	Very low	33.5	Very low	75 Å²	75	133.7 Å²	133.7	77%	0.773	78%	0.781	S	S	*	*			trans	-175.3	135.8	161.3	0	0	0	0	0	114.8
755	K	28.3	Very low	34.4	Very low	203 Å²	203	130.2 Å²	130.2	88%	0.883	79%	0.786	S	S	*	*			trans	-92.8	145.4	-177.9	-72.5	177	177.7	174.3	0	113.3
756	L	32	Very low	35.2	Very low	163 Å²	163	128.1 Å²	128.1	85%	0.853	79%	0.785	S	S	*	*			trans	72.9	121.8	158	-98	115	0	0	0	121.2
757	S	32.4	Very low	36.1	Very low	125 Å²	125	129 Å²	129	87%	0.874	79%	0.788	S	S	*	*			trans	75.4	115.1	143.2	-150.3	0	0	0	0	121.3
758	G	33.4	Very low	36.5	Very low	73 Å²	73	131.1 Å²	131.1	75%	0.753	79%	0.79	S	S	*	*			trans	145.8	133	153.9	0	0	0	0	0	119.3
759	L	39.6	Very low	36.8	Very low	147 Å²	147	131.2 Å²	131.2	77%	0.77	79%	0.793	S	S	*	*			trans	46.9	125.4	142.2	-135.6	76.9	0	0	0	124.7
760	R	38.8	Very low	36.8	Very low	223 Å²	223	132.9 Å²	132.9	84%	0.842	80%	0.796	S	S	*	*			trans	64.1	125.7	145.4	-94.7	-167.8	-77.9	-155.9	-1.3	123.9
761	S	42.8	Very low	37.1	Very low	104 Å²	104	132.8 Å²	132.8	73%	0.727	80%	0.795	S	S	*	*			trans	98.2	109.4	133.8	-156.3	0	0	0	0	124.2
762	I	49.2	Very low	37	Very low	151 Å²	151	133 Å²	133	77%	0.774	80%	0.796	S	S	*	*			trans	50	113.6	136.3	-51	176.7	0	0	0	123.5
763	S	43.7	Very low	36.6	Very low	110 Å²	110	133.8 Å²	133.8	77%	0.769	80%	0.8	S	S	*	*			trans	63.8	176.1	149.1	-63.9	0	0	0	0	121.9
764	P	52.7	Low	36.4	Very low	128 Å²	128	136.4 Å²	136.4	83%	0.831	80%	0.799	S	S	*	*				-140.2	160.4	-58.5	41.6	-25.2	0	0	0	118.3
765	G	42.4	Very low	36.1	Very low	80 Å²	80	140.3 Å²	140.3	83%	0.825	80%	0.795	S	S	*	*			trans	82.7	107	139.5	0	0	0	0	0	127.9
766	S	43.2	Very low	36	Very low	111 Å²	111	137.7 Å²	137.7	78%	0.776	79%	0.786	S	S	*	*			trans	64.6	118.6	131.1	-151	0	0	0	0	129.1
767	V	46.3	Very low	36.2	Very low	140 Å²	140	135 Å²	135	85%	0.848	78%	0.778	S	S	*	*			trans	56.7	141.8	145.1	-55.7	0	0	0	0	127.8
768	D	30.4	Very low	36.1	Very low	157 Å²	157	136.6 Å²	136.6	84%	0.84	77%	0.769	S	S	*	*				-177	-168.2	122.5	-145.4	-17.4	0	0	0	115.7
769	S	45.1	Very low	36.1	Very low	106 Å²	106	140.2 Å²	140.2	74%	0.741	77%	0.767	S	S	*	*			trans	-151.8	160.6	-167.4	-61.7	0	0	0	0	119.8
770	E	26.7	Very low	35.5	Very low	175 Å²	175	139 Å²	139	82%	0.818	77%	0.771	S	S	*	*			trans	-177.2	174.1	165.3	-109.3	-149.8	169.4	0	0	112.4
771	L	34	Very low	35.1	Very low	125 Å²	125	135.8 Å²	135.8	65%	0.654	77%	0.769	S	S	*	*			cis	-164.9	176.5	-24.3	-133.1	-165.7	0	0	0	112.4
772	I	29.8	Very low	34.6	Very low	157 Å²	157	137.7 Å²	137.7	81%	0.805	77%	0.77	S	S	*	*			trans	77.5	147.5	158.1	-69.9	174.9	0	0	0	122.6
773	C	21.3	Very low	33.5	Very low	112 Å²	112	138.2 Å²	138.2	76%	0.757	78%	0.775	S	S	*	*			trans	-160	150.5	-176.3	166.1	0	0	0	0	114.1
774	K	23.2	Very low	32.7	Very low	200 Å²	200	136.6 Å²	136.6	87%	0.87	78%	0.775	S	S	*	*			trans	177.2	129.2	142.7	-102.1	162.2	-174.9	174.5	0	119.3
775	K	23	Very low	31.6	Very low	157 Å²	157	139.3 Å²	139.3	68%	0.683	78%	0.776	S	S	*	*			trans	65.2	117.7	139.4	-96.2	-173.6	173.8	-78.8	0	126.2
776	E	24.9	Very low	30.8	Very low	148 Å²	148	139.9 Å²	139.9	69%	0.692	77%	0.768	S	S	*	*				66.6	162.3	124	-96.7	159.7	-122.1	0	0	123.6
777	P	37.2	Very low	29.8	Very low	107 Å²	107	141.6 Å²	141.6	70%	0.695	77%	0.768	S	S	*	*			cis	-137.5	-178	-4.2	41.6	-23.4	0	0	0	118.2
778	K	29.8	Very low	28.8	Very low	157 Å²	157	141.1 Å²	141.1	68%	0.683	77%	0.766	S	S	*	*			trans	79.7	111.1	153.4	-84.3	-169.2	169.1	-74.3	0	124
779	E	33.3	Very low	28.4	Very low	150 Å²	150	139 Å²	139	70%	0.701	76%	0.763	S	S	*	*				66	118.6	124.1	-71.3	155.8	-148.9	0	0	124.5
780	S	27.6	Very low	27.5	Very low	122 Å²	122	142.9 Å²	142.9	85%	0.853	77%	0.767	S	S	*	*			trans	96.6	125.4	146.7	75.9	0	0	0	0	123.3
781	L	30.2	Very low	27.4	Very low	154 Å²	154	142.3 Å²	142.3	81%	0.806	77%	0.769	S	S	*	*			trans	64.2	107	142.8	-155.6	71.4	0	0	0	124
782	L	32.1	Very low	27	Very low	144 Å²	144	140.2 Å²	140.2	75%	0.754	78%	0.778	S	S	*	*			trans	69.7	145.3	149.3	-67.9	172.4	0	0	0	123.2
783	D	25.7	Very low	27	Very low	163 Å²	163	138 Å²	138	87%	0.872	78%	0.777	S	S	*	*			trans	58.4	150.9	160.8	-78.2	-57.2	0	0	0	122.5
784	G	27.4	Very low	27.1	Very low	75 Å²	75	141.8 Å²	141.8	77%	0.773	78%	0.783	S	S	*	*			trans	151.3	119.4	163.3	0	0	0	0	0	119.5
785	H	29	Very low	27.1	Very low	186 Å²	186	136.2 Å²	136.2	86%	0.861	77%	0.774	S	S	*	*			trans	-64.3	145.5	-177.7	-80	-95.1	0	0	0	120.2
786	S	26.1	Very low	27.1	Very low	92 Å²	92	133.8 Å²	133.8	64%	0.643	78%	0.777	S	S	*	*			trans	60.5	138.1	131.1	81.4	0	0	0	0	125.2
787	N	23.5	Very low	27	Very low	146 Å²	146	135.2 Å²	135.2	78%	0.781	78%	0.784	S	S	*	*			trans	82.3	142.5	140.1	-68.9	-24.6	0	0	0	123.1
788	T	23.7	Very low	26.5	Very low	130 Å²	130	134.9 Å²	134.9	80%	0.798	78%	0.784	S	S	*	*			trans	73.9	100.7	156.8	46.4	0	0	0	0	123.1
789	S	23.6	Very low	27.2	Very low	112 Å²	112	132.6 Å²	132.6	78%	0.783	79%	0.785	S	S	*	*				93.4	134.1	123.1	80.5	0	0	0	0	123.1
790	K	25.2	Very low	26.8	Very low	188 Å²	188	131.2 Å²	131.2	82%	0.817	79%	0.787	S	S	*	*			trans	66.5	124	153.9	-73.2	-173.3	174.6	-176.6	0	122.2
791	N	24.7	Very low	26.6	Very low	163 Å²	163	130.9 Å²	130.9	87%	0.872	78%	0.779	S	S	*	*			trans	63.1	147	153.7	-67	18.2	0	0	0	118.8
792	G	25.2	Very low	26.4	Very low	82 Å²	82	131.3 Å²	131.3	85%	0.845	78%	0.783	S	S	*	*			trans	137.9	90.1	175.7	0	0	0	0	0	112.2
793	S	29.5	Very low	26.1	Very low	110 Å²	110	128.1 Å²	128.1	77%	0.769	78%	0.784	S	S	*	*			trans	-79.1	146.9	-175	48.5	0	0	0	0	115.1
794	E	24.1	Very low	26.1	Very low	192 Å²	192	128.6 Å²	128.6	90%	0.897	79%	0.787	S	S	*	*			trans	81.6	155	146.4	-80.1	-175.6	-170.3	0	0	122.9
795	A	24.5	Very low	26	Very low	82 Å²	82	130.9 Å²	130.9	68%	0.678	79%	0.791	S	S	*	*			trans	72.7	85.5	155	0	0	0	0	0	120.7
796	S	22.5	Very low	26.2	Very low	106 Å²	106	130.9 Å²	130.9	74%	0.741	80%	0.797	S	S	*	*				75.3	167.4	126.8	80.7	0	0	0	0	117.8
797	Q	22.9	Very low	26.2	Very low	178 Å²	178	129.9 Å²	129.9	83%	0.832	80%	0.801	S	S	*	*			cis	-131.9	168.8	7.8	-61.8	-177.1	7.4	0	0	112.4
798	S	26.3	Very low	26.6	Very low	100 Å²	100	130.8 Å²	130.8	70%	0.699	80%	0.804	S	S	*	*			trans	-72.4	172.4	156.8	63.7	0	0	0	0	111.2
799	P	44.4	Very low	27	Very low	109 Å²	109	132.1 Å²	132.1	71%	0.708	81%	0.805	S	S	*	*			cis	-144.9	-166.2	15.5	31.7	-5.4	0	0	0	116.7
800	V	24.2	Very low	27.4	Very low	122 Å²	122	132.2 Å²	132.2	74%	0.739	80%	0.801	S	S	*	*			trans	85.6	133.3	153.1	-137.5	0	0	0	0	121.6
801	T	24.2	Very low	27.5	Very low	114 Å²	114	129.2 Å²	129.2	70%	0.699	79%	0.794	S	S	*	*			trans	95.9	117.6	141.7	6.6	0	0	0	0	122.3
802	N	26.1	Very low	27.7	Very low	163 Å²	163	129.7 Å²	129.7	87%	0.872	79%	0.791	S	S	*	*			trans	41.5	136	140	-64.9	-3.2	0	0	0	123
803	G	25.5	Very low	27.7	Very low	77 Å²	77	131 Å²	131	79%	0.794	79%	0.786	S	S	*	*			trans	147	121.4	145.8	0	0	0	0	0	115.3
804	N	25	Very low	27.8	Very low	174 Å²	174	131.7 Å²	131.7	93%	0.93	79%	0.789	S	S	*	*			trans	-80.9	139.9	171	-71	-8.9	0	0	0	111.5
805	S	24.8	Very low	28.1	Very low	123 Å²	123	131.3 Å²	131.3	86%	0.86	79%	0.787	S	S	*	*			trans	-160.8	166	145.6	53	0	0	0	0	111
806	L	33.8	Very low	28.5	Very low	185 Å²	185	131.9 Å²	131.9	97%	0.969	79%	0.786	S	S	*	*			trans	-98.3	143.8	-165.2	-66.7	162.5	0	0	0	112.8
807	G	26.5	Very low	29.2	Very low	72 Å²	72	132.3 Å²	132.3	74%	0.742	79%	0.786	S	S	*	*			trans	-167.8	96.8	176.7	0	0	0	0	0	115.8
808	I	31.7	Very low	29.9	Very low	164 Å²	164	133.7 Å²	133.7	84%	0.841	79%	0.789	S	S	*	*			trans	8.9	129.9	150.4	-26.1	178.2	0	0	0	119.3
809	I	31.6	Very low	30.7	Very low	159 Å²	159	135.2 Å²	135.2	82%	0.815	79%	0.789	S	S	*	*				165.2	148.8	122.3	-84.5	166.9	0	0	0	112.2
810	T	32.3	Very low	31.2	Very low	114 Å²	114	134.6 Å²	134.6	70%	0.699	78%	0.779	S	S	*	*			trans	-60.2	170.4	179.6	-42.3	0	0	0	0	115.8
811	D	27.4	Very low	32.4	Very low	125 Å²	125	133.6 Å²	133.6	67%	0.668	78%	0.775	S	S	*	*			trans	-34.4	155.3	168.2	-54.8	-99.1	0	0	0	116.4
812	H	29.5	Very low	33.8	Very low	173 Å²	173	134.2 Å²	134.2	80%	0.801	77%	0.774	S	S	*	*			cis	-153.3	161.9	39.9	-69	-90.4	0	0	0	116.1
813	S	24.6	Very low	35.1	Very low	108 Å²	108	129.9 Å²	129.9	76%	0.755	76%	0.756	S	S	*	*			trans	69.4	99.5	144.9	-167.9	0	0	0	0	119.9
814	P	32.9	Very low	36.3	Very low	126 Å²	126	128.3 Å²	128.3	82%	0.818	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-80.1	134.5	163.7	32.9	-32.4	0	0	0	112.5
815	E	28.6	Very low	37.3	Very low	184 Å²	184	125 Å²	125	86%	0.86	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-78.8	160	170.6	-162	171.2	158.7	0	0	111.7
816	S	33.6	Very low	38.5	Very low	94 Å²	94	124 Å²	124	66%	0.657	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-75.5	125.1	-167.9	56	0	0	0	0	114.5
817	P	36.6	Very low	39.2	Very low	115 Å²	115	118.4 Å²	118.4	75%	0.747	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-75.3	129.7	169.7	30.1	-33	0	0	0	111.6	I819	P817-I819 PolarHBondContact O-N 3.18Å
818	F	37.8	Very low	40.4	Very low	206 Å²	206	119.3 Å²	119.3	90%	0.904	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-61.9	127.8	172.9	-91.8	-111	0	0	0	111.3
819	I	44.5	Very low	41.3	Very low	133 Å²	133	116.3 Å²	116.3	68%	0.682	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-86.2	120.9	174.4	-60.5	176.2	0	0	0	109.4	P817 A824	P817-I819 PolarHBondContact O-N 3.18Å; I819-A824 HydrophobicContact CG2-CB 4.47Å
820	N	53.1	Low	42.4	Very low	96 Å²	96	113.8 Å²	113.8	51%	0.513	63%	0.634	S	S	.	*	P	Polyproline II helix	trans	-61.4	126	173.4	178.4	-20	0	0	0	110.2	L822 S823 A824	N820-L822 PolarHBondContact O-N 3.03Å; N820-L822 VanDerWaalsContact O-N 3.16Å; N820-L822 PolarHBondContact OD1-N 3.42Å; N820-L822 VanDerWaalsContact OD1-N 3.09Å; N820-S823 WeakPolarHBondContact O-CA 3.32Å; N820-S823 VanDerWaalsContact O-CB 3.29Å; N820-S823 WeakPolarHBondContact O-CB 3.35Å; N820-S823 PolarHBondContact O-N 2.63Å; N820-A824 PolarHBondContact O-N 2.91Å
821	P	50.4	Low	43.5	Very low	101 Å²	101	113.4 Å²	113.4	66%	0.656	63%	0.632	S	S	*	*	H	α-helix	trans	-61	-26.6	-174.6	23.2	-34.3	0	0	0	114.3	S823 A824 L825	P821-S823 VanDerWaalsContact C-N 3.34Å; P821-A824 PolarHBondContact O-N 3.33Å; P821-L825 PolarHBondContact O-N 3.17Å
822	L	52.6	Low	44.4	Very low	127 Å²	127	115 Å²	115	67%	0.665	64%	0.635	S	S	*	*	H	α-helix	trans	-70.2	-31.3	173.4	-71.8	168.7	0	0	0	112.3	N820 L825 Q826	N820-L822 PolarHBondContact O-N 3.03Å; N820-L822 VanDerWaalsContact O-N 3.16Å; N820-L822 PolarHBondContact OD1-N 3.42Å; N820-L822 VanDerWaalsContact OD1-N 3.09Å; L822-L825 PolarHBondContact O-N 3.21Å; L822-Q826 WeakPolarHBondContact O-CB 3.47Å; L822-Q826 PolarHBondContact O-N 3.15Å
823	S	54.9	Low	45.1	Very low	72 Å²	72	113.3 Å²	113.3	50%	0.503	63%	0.631	S	S	.	*	H	α-helix	trans	-70.4	-36.1	173.2	-167.3	0	0	0	0	111.5	N820 P821 Q826 S827	N820-S823 WeakPolarHBondContact O-CA 3.32Å; N820-S823 VanDerWaalsContact O-CB 3.29Å; N820-S823 WeakPolarHBondContact O-CB 3.35Å; N820-S823 PolarHBondContact O-N 2.63Å; P821-S823 VanDerWaalsContact C-N 3.34Å; S823-Q826 PolarHBondContact O-N 2.88Å; S823-S827 WeakPolarHBondContact O-CB 3.08Å; S823-S827 PolarHBondContact O-N 2.85Å
824	A	50.8	Low	45.7	Very low	43 Å²	43	112 Å²	112	36%	0.355	63%	0.634	S	S	.	*	H	α-helix	trans	-62.7	-42.1	170.8	0	0	0	0	0	111.8	I819 N820 P821 S827 I828	I819-A824 HydrophobicContact CG2-CB 4.47Å; N820-A824 PolarHBondContact O-N 2.91Å; P821-A824 PolarHBondContact O-N 3.33Å; A824-S827 WeakPolarHBondContact O-CB 3.44Å; A824-S827 PolarHBondContact O-N 3.05Å; A824-I828 WeakPolarHBondContact O-CG1 3.46Å; A824-I828 PolarHBondContact O-N 3.48Å
825	L	46.3	Very low	46.1	Very low	104 Å²	104	116 Å²	116	55%	0.545	64%	0.639	S	S	.	*	H	α-helix	trans	-65.1	-40.9	175.7	-139.8	77.9	0	0	0	112.4	P821 L822 S827 I828 M829	P821-L825 PolarHBondContact O-N 3.17Å; L822-L825 PolarHBondContact O-N 3.21Å; L825-S827 VanDerWaalsContact C-N 3.32Å; L825-S827 PolarHBondContact O-N 3.15Å; L825-I828 PolarHBondContact O-N 3.14Å; L825-M829 PolarHBondContact O-N 3.05Å
826	Q	48.3	Very low	46.1	Very low	102 Å²	102	112.2 Å²	112.2	48%	0.477	64%	0.639	S	S	.	*	H	α-helix	trans	-64.2	-36.9	174.6	-161.3	68.3	37.6	0	0	112	L822 S823 M829 N830	L822-Q826 WeakPolarHBondContact O-CB 3.47Å; L822-Q826 PolarHBondContact O-N 3.15Å; S823-Q826 PolarHBondContact O-N 2.88Å; Q826-M829 PolarHBondContact O-N 3.48Å; Q826-N830 WeakPolarHBondContact O-CB 3.11Å; Q826-N830 VanDerWaalsContact O-CG 3.3Å; Q826-N830 PolarHBondContact O-N 3.4Å
827	S	48.6	Very low	46.1	Very low	69 Å²	69	113 Å²	113	48%	0.483	65%	0.645	S	S	.	*	H	α-helix	trans	-64.9	-39.1	174.2	-170.5	0	0	0	0	112.4	S823 A824 L825 N830 T831	S823-S827 WeakPolarHBondContact O-CB 3.08Å; S823-S827 PolarHBondContact O-N 2.85Å; A824-S827 WeakPolarHBondContact O-CB 3.44Å; A824-S827 PolarHBondContact O-N 3.05Å; L825-S827 VanDerWaalsContact C-N 3.32Å; L825-S827 PolarHBondContact O-N 3.15Å; S827-N830 PolarHBondContact O-N 3.44Å; S827-T831 WeakPolarHBondContact O-CG2 3.35Å; S827-T831 PolarHBondContact O-N 2.85Å; S827-T831 PolarHBondContact O-OG1 3.05Å
828	I	52.9	Low	46.1	Very low	91 Å²	91	117 Å²	117	47%	0.467	65%	0.651	S	S	.	*	H	α-helix	trans	-63	-47.7	173.4	-68.6	163.1	0	0	0	110.5	A824 L825 N830 T831 H832	A824-I828 WeakPolarHBondContact O-CG1 3.46Å; A824-I828 PolarHBondContact O-N 3.48Å; L825-I828 PolarHBondContact O-N 3.14Å; I828-N830 VanDerWaalsContact C-N 3.34Å; I828-N830 PolarHBondContact O-N 2.85Å; I828-T831 WeakPolarHBondContact CA-OG1 3.35Å; I828-T831 PolarHBondContact O-N 3.34Å; I828-T831 PolarHBondContact O-OG1 3.47Å; I828-H832 PolarHBondContact O-CD2 3.31Å; I828-H832 VanDerWaalsContact O-CD2 3.27Å; I828-H832 PolarHBondContact O-N 3.18Å
829	M	49.4	Very low	45.9	Very low	100 Å²	100	113.1 Å²	113.1	49%	0.493	65%	0.646	S	S	.	*	H	α-helix	trans	-61.9	-40.3	176.4	-66.9	-170.2	-66.1	0	0	112.5	L825 Q826 T831 H832	L825-M829 PolarHBondContact O-N 3.05Å; Q826-M829 PolarHBondContact O-N 3.48Å; M829-T831 VanDerWaalsContact C-N 3.29Å; M829-T831 PolarHBondContact O-N 2.88Å; M829-H832 PolarHBondContact O-N 3.36Å
830	N	54.5	Low	45.4	Very low	106 Å²	106	113.4 Å²	113.4	57%	0.567	65%	0.653	S	S	*	*	H	α-helix	trans	-70.7	-18.8	177.2	-74.9	-8.8	0	0	0	114.1	Q826 S827 I828	Q826-N830 WeakPolarHBondContact O-CB 3.11Å; Q826-N830 VanDerWaalsContact O-CG 3.3Å; Q826-N830 PolarHBondContact O-N 3.4Å; S827-N830 PolarHBondContact O-N 3.44Å; I828-N830 VanDerWaalsContact C-N 3.34Å; I828-N830 PolarHBondContact O-N 2.85Å
831	T	55.4	Low	44.3	Very low	106 Å²	106	113.8 Å²	113.8	65%	0.65	66%	0.664	S	S	*	*	H	α-helix	trans	-91	-11.6	177.9	40.2	0	0	0	0	113.7	S827 I828 M829	S827-T831 WeakPolarHBondContact O-CG2 3.35Å; S827-T831 PolarHBondContact O-N 2.85Å; S827-T831 PolarHBondContact O-OG1 3.05Å; I828-T831 WeakPolarHBondContact CA-OG1 3.35Å; I828-T831 PolarHBondContact O-N 3.34Å; I828-T831 PolarHBondContact O-OG1 3.47Å; M829-T831 VanDerWaalsContact C-N 3.29Å; M829-T831 PolarHBondContact O-N 2.88Å
832	H	47.7	Very low	43.8	Very low	158 Å²	158	115 Å²	115	73%	0.731	67%	0.671	S	S	*	*	S	Bend	trans	-86.9	-4.7	170.8	-77.5	-69.3	0	0	0	114.3	I828 M829	I828-H832 PolarHBondContact O-CD2 3.31Å; I828-H832 VanDerWaalsContact O-CD2 3.27Å; I828-H832 PolarHBondContact O-N 3.18Å; M829-H832 PolarHBondContact O-N 3.36Å
833	L	44	Very low	43	Very low	138 Å²	138	114 Å²	114	72%	0.723	68%	0.681	S	S	*	*	S	Bend	trans	-111.2	121.1	175.1	-65.4	177.6	0	0	0	111.2	K835	L833-K835 PolarHBondContact O-N 2.91Å
834	G	37.7	Very low	42.2	Very low	80 Å²	80	115.1 Å²	115.1	83%	0.825	70%	0.696	S	S	*	*			trans	-81	106.5	-166.7	0	0	0	0	0	115.4
835	K	40	Very low	41.7	Very low	210 Å²	210	116.8 Å²	116.8	91%	0.913	70%	0.699	S	S	*	*			trans	60.4	107.9	154.3	-57.8	173.8	-177.3	171	0	117.7	L833	L833-K835 PolarHBondContact O-N 2.91Å
836	A	28.2	Very low	41.6	Very low	105 Å²	105	116.8 Å²	116.8	87%	0.868	71%	0.705	S	S	*	*			trans	-122.3	162.8	147.1	0	0	0	0	0	110
837	S	34.8	Very low	41.5	Very low	112 Å²	112	117.6 Å²	117.6	78%	0.783	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-75.4	158	-173.7	47.3	0	0	0	0	114.4
838	K	35.9	Very low	41.4	Very low	199 Å²	199	117.6 Å²	117.6	87%	0.865	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-54.5	136.4	171.8	-57.5	176.8	-179.2	-179.9	0	111.5
839	P	34.1	Very low	41	Very low	124 Å²	124	119.6 Å²	119.6	81%	0.805	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-94.9	127	153.6	32.9	-27.1	0	0	0	110.6
840	V	33.6	Very low	40.9	Very low	138 Å²	138	120.7 Å²	120.7	84%	0.836	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-95.7	132	148.3	171.2	0	0	0	0	105.7
841	S	31.2	Very low	40.4	Very low	105 Å²	105	125 Å²	125	73%	0.734	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-97.4	144.3	167.4	60.2	0	0	0	0	109.2
842	P	38.9	Very low	39.8	Very low	125 Å²	125	128.2 Å²	128.2	81%	0.812	74%	0.743	S	S	*	*				-132.8	172	79.3	38.2	-26.8	0	0	0	115.5
843	A	36.3	Very low	39.8	Very low	106 Å²	106	126.9 Å²	126.9	88%	0.876	74%	0.74	S	S	*	*			trans	-38.3	134.2	-173.4	0	0	0	0	0	119.2
844	A	37	Very low	39.5	Very low	97 Å²	97	124.9 Å²	124.9	80%	0.802	74%	0.737	S	S	*	*			trans	-155.7	156	147	0	0	0	0	0	109.8
845	D	41.2	Very low	39.6	Very low	78 Å²	78	128.2 Å²	128.2	42%	0.417	74%	0.736	S	S	.	*			trans	-72.1	137.1	-177.4	146.5	68.5	0	0	0	113	L847 S848	D845-L847 PolarHBondContact O-N 3.46Å; D845-L847 PolarHBondContact OD1-N 2.89Å; D845-L847 PolarHBondContact OD2-N 2.99Å; D845-S848 WeakPolarHBondContact O-CB 3.24Å; D845-S848 PolarHBondContact O-N 3.36Å; D845-S848 PolarHBondContact OD2-N 3.31Å; D845-S848 PolarHBondContact OD2-OG 3.3Å
846	P	43.9	Very low	39.3	Very low	103 Å²	103	123.2 Å²	123.2	67%	0.669	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-27.2	-177.7	25.1	-35.4	0	0	0	115.7	S848 M849	P846-S848 PolarHBondContact O-N 2.9Å; P846-M849 PolarHBondContact O-N 3.47Å
847	L	46.4	Very low	39.6	Very low	119 Å²	119	127.1 Å²	127.1	62%	0.623	73%	0.73	S	S	*	*	H	α-helix	trans	-66.8	-28.1	179.3	-74.8	167.7	0	0	0	112.2	D845 M849 L850	D845-L847 PolarHBondContact O-N 3.46Å; D845-L847 PolarHBondContact OD1-N 2.89Å; D845-L847 PolarHBondContact OD2-N 2.99Å; L847-M849 PolarHBondContact O-N 3.4Å; L847-L850 PolarHBondContact O-N 3.29Å
848	S	47.4	Very low	39.7	Very low	70 Å²	70	131.1 Å²	131.1	49%	0.49	74%	0.739	S	S	.	*	H	α-helix	trans	-64.7	-20.3	178.3	-61.7	0	0	0	0	114.7	D845 P846	D845-S848 WeakPolarHBondContact O-CB 3.24Å; D845-S848 PolarHBondContact O-N 3.36Å; D845-S848 PolarHBondContact OD2-N 3.31Å; D845-S848 PolarHBondContact OD2-OG 3.3Å; P846-S848 PolarHBondContact O-N 2.9Å
849	M	42.7	Very low	39.4	Very low	133 Å²	133	127.4 Å²	127.4	66%	0.655	73%	0.728	S	S	*	*	H	α-helix	trans	-84.9	-39.2	177.6	-72.6	-118.3	-71.1	0	0	113	P846 L847 Y851 K852 I853	P846-M849 PolarHBondContact O-N 3.47Å; L847-M849 PolarHBondContact O-N 3.4Å; M849-Y851 PolarHBondContact O-N 3.42Å; M849-K852 PolarHBondContact O-N 2.76Å; M849-K852 VanDerWaalsContact O-N 3.11Å; M849-I853 WeakPolarHBondContact O-CG1 3.43Å; M849-I853 PolarHBondContact O-N 3.09Å; M849-I853 VanDerWaalsContact O-N 3.15Å
850	L	48.7	Very low	39.4	Very low	123 Å²	123	129.8 Å²	129.8	64%	0.644	73%	0.726	S	S	*	*	H	α-helix	trans	-64	-40.2	-176.5	-72.8	165.4	0	0	0	111.8	L847 K852 I853 S854	L847-L850 PolarHBondContact O-N 3.29Å; L850-K852 VanDerWaalsContact C-N 3.32Å; L850-K852 PolarHBondContact O-N 2.72Å; L850-I853 PolarHBondContact O-N 3.04Å; L850-S854 PolarHBondContact O-N 2.77Å
851	Y	42.9	Very low	39.7	Very low	197 Å²	197	128.8 Å²	128.8	77%	0.773	72%	0.722	S	S	*	*	H	α-helix	trans	-66	-29	174	-97.3	-84.4	0	0	0	114.1	M849	M849-Y851 PolarHBondContact O-N 3.42Å
852	K	43.3	Very low	39.4	Very low	173 Å²	173	127.8 Å²	127.8	75%	0.752	72%	0.72	S	S	*	*	H	α-helix	trans	-79.3	-28.4	178	-80.4	-172.9	173.4	-178.7	0	113.7	M849 L850 S854	M849-K852 PolarHBondContact O-N 2.76Å; M849-K852 VanDerWaalsContact O-N 3.11Å; L850-K852 VanDerWaalsContact C-N 3.32Å; L850-K852 PolarHBondContact O-N 2.72Å; K852-S854 VanDerWaalsContact C-N 3.35Å
853	I	48	Very low	39	Very low	130 Å²	130	131.6 Å²	131.6	67%	0.667	73%	0.725	S	S	*	*	H	α-helix	trans	-74.4	-29.4	176.7	-65.9	165.3	0	0	0	110.9	M849 L850 N855	M849-I853 WeakPolarHBondContact O-CG1 3.43Å; M849-I853 PolarHBondContact O-N 3.09Å; M849-I853 VanDerWaalsContact O-N 3.15Å; L850-I853 PolarHBondContact O-N 3.04Å; I853-N855 VanDerWaalsContact C-N 3.25Å; I853-N855 PolarHBondContact O-N 3.38Å; I853-N855 VanDerWaalsContact O-N 3.13Å
854	S	37.9	Very low	38.4	Very low	95 Å²	95	132.6 Å²	132.6	66%	0.664	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	2.8	-174	-166.4	0	0	0	0	116.4	L850 K852	L850-S854 PolarHBondContact O-N 2.77Å; K852-S854 VanDerWaalsContact C-N 3.35Å
855	N	39.9	Very low	38.4	Very low	150 Å²	150	133.6 Å²	133.6	80%	0.802	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.6	29.9	-165.4	-112.3	-16.6	0	0	0	115.9	I853	I853-N855 VanDerWaalsContact C-N 3.25Å; I853-N855 PolarHBondContact O-N 3.38Å; I853-N855 VanDerWaalsContact O-N 3.13Å
856	S	33.1	Very low	37.6	Very low	106 Å²	106	136 Å²	136	74%	0.741	74%	0.736	S	S	*	*			trans	-131	62.1	-175	-178.4	0	0	0	0	114.4
857	M	34.8	Very low	37.3	Very low	187 Å²	187	136 Å²	136	92%	0.921	74%	0.736	S	S	*	*			trans	-156.2	68.3	172.8	48.5	-158.2	-74.5	0	0	114.5
858	M	36.4	Very low	36.4	Very low	196 Å²	196	138.6 Å²	138.6	97%	0.966	75%	0.745	S	S	*	*			trans	-153.4	172.4	153.6	-135.4	176.3	76.3	0	0	111.7
859	D	30.7	Very low	35.4	Very low	120 Å²	120	140.7 Å²	140.7	64%	0.642	76%	0.759	S	S	*	*			trans	-100.6	-177	-160.9	-136.7	-60.3	0	0	0	114.9
860	K	34	Very low	34.7	Very low	174 Å²	174	144 Å²	144	76%	0.757	77%	0.77	S	S	*	*			trans	-49.9	172.5	-179.1	-58	157.5	-162.7	83.3	0	115.1
861	P	39.6	Very low	33.5	Very low	118 Å²	118	142.3 Å²	142.3	77%	0.766	77%	0.774	S	S	*	*			cis	-145.4	173.9	13.4	44.5	-25.5	0	0	0	119.3
862	A	25.3	Very low	32.6	Very low	83 Å²	83	139 Å²	139	69%	0.686	78%	0.775	S	S	*	*			trans	62.9	151	141	0	0	0	0	0	125.1
863	F	28.7	Very low	31.6	Very low	206 Å²	206	138.9 Å²	138.9	90%	0.904	78%	0.776	S	S	*	*			trans	70.8	146	163.7	-79.1	-76.8	0	0	0	122.3
864	T	24.6	Very low	31.2	Very low	126 Å²	126	137.6 Å²	137.6	77%	0.773	78%	0.776	S	S	*	*			trans	-105.2	169.1	168.5	46.2	0	0	0	0	108.9
865	P	36.8	Very low	30.7	Very low	119 Å²	119	138.4 Å²	138.4	77%	0.773	78%	0.777	S	S	*	*			cis	-138	-157.3	23.7	43.5	-22.6	0	0	0	116.3
866	T	24.6	Very low	30.1	Very low	128 Å²	128	138 Å²	138	79%	0.785	78%	0.775	S	S	*	*			trans	-87.8	-167.5	-174	59.9	0	0	0	0	112.3
867	P	38.3	Very low	29.8	Very low	103 Å²	103	139.9 Å²	139.9	67%	0.669	77%	0.772	S	S	*	*			cis	-138.8	-174.4	-6.2	26.3	-0.1	0	0	0	116.4
868	Q	26.8	Very low	29.3	Very low	174 Å²	174	137.8 Å²	137.8	81%	0.813	76%	0.758	S	S	*	*			trans	117.2	142.1	139.7	-60.3	-151.1	5.2	0	0	121.4
869	S	27.4	Very low	28.8	Very low	114 Å²	114	135.5 Å²	135.5	80%	0.797	75%	0.745	S	S	*	*			trans	69.7	160.2	160.5	74.9	0	0	0	0	119.3
870	K	26.6	Very low	28.6	Very low	202 Å²	202	136.2 Å²	136.2	88%	0.878	75%	0.748	S	S	*	*				-176.2	134.2	-62.6	-109.6	-175.7	176.9	-176.2	0	108.9
871	A	24.2	Very low	28.3	Very low	87 Å²	87	136.7 Å²	136.7	72%	0.719	75%	0.746	S	S	*	*			trans	65.1	112.2	150	0	0	0	0	0	121.9
872	T	24.6	Very low	27.9	Very low	129 Å²	129	137.3 Å²	137.3	79%	0.791	74%	0.739	S	S	*	*				77.3	116.3	119.4	-48.9	0	0	0	0	121.5
873	E	22.4	Very low	28	Very low	169 Å²	169	137.5 Å²	137.5	79%	0.79	74%	0.735	S	S	*	*				24.8	160.3	121.1	-99.3	-156.8	113.3	0	0	122.3
874	P	38.3	Very low	28	Very low	103 Å²	103	134.7 Å²	134.7	67%	0.669	73%	0.73	S	S	*	*			cis	-146.6	179.3	18.9	40.4	-18.8	0	0	0	119.7
875	V	27.8	Very low	28.2	Very low	112 Å²	112	136.3 Å²	136.3	68%	0.679	73%	0.733	S	S	*	*			trans	81.4	121.4	136.2	140.7	0	0	0	0	124.9
876	N	27.2	Very low	28	Very low	142 Å²	142	138.9 Å²	138.9	76%	0.759	74%	0.735	S	S	*	*			trans	58	153.7	152.2	-63.1	-39.7	0	0	0	120.6
877	H	27.1	Very low	29.1	Very low	146 Å²	146	138.3 Å²	138.3	68%	0.676	73%	0.734	S	S	*	*			cis	-166.7	136.7	37.3	-167.7	76.5	0	0	0	115
878	F	25.1	Very low	28.8	Very low	142 Å²	142	141.6 Å²	141.6	62%	0.623	74%	0.744	S	S	*	*			trans	70.1	128.9	145.9	-85.2	-143	0	0	0	126.4
879	Q	24.7	Very low	28.9	Very low	149 Å²	149	140.3 Å²	140.3	70%	0.696	74%	0.742	S	S	*	*				53.3	153.7	125.7	-59.3	-177.9	-8.8	0	0	121.6
880	L	26.8	Very low	29.2	Very low	134 Å²	134	141.8 Å²	141.8	70%	0.702	74%	0.741	S	S	*	*			cis	-161.5	156.1	13.8	-158	76.5	0	0	0	112.5
881	Y	28.4	Very low	29.3	Very low	184 Å²	184	136 Å²	136	72%	0.722	73%	0.726	S	S	*	*			trans	61.8	160.6	149.5	-108.9	-122.7	0	0	0	121.8
882	E	29.8	Very low	29.4	Very low	132 Å²	132	140.7 Å²	140.7	62%	0.617	73%	0.73	S	S	*	*			cis	-165.9	155.9	-42	177.3	166.8	-98.4	0	0	111.2
883	S	27.4	Very low	29.6	Very low	87 Å²	87	141.3 Å²	141.3	61%	0.608	73%	0.729	S	S	*	*			trans	69	107.8	157.2	-85.2	0	0	0	0	125.5
884	N	28.8	Very low	29.9	Very low	146 Å²	146	142.5 Å²	142.5	78%	0.781	73%	0.731	S	S	*	*				68.7	151.7	109.3	-69.2	-54.3	0	0	0	126.3
885	D	28.6	Very low	29.6	Very low	160 Å²	160	141.9 Å²	141.9	86%	0.856	74%	0.735	S	S	*	*			trans	97.8	149.5	152.3	-88.3	-56.1	0	0	0	124.3
886	Q	34.1	Very low	29.6	Very low	174 Å²	174	142.3 Å²	142.3	81%	0.813	74%	0.738	S	S	*	*			trans	-117.1	-173.1	-168.5	-71.2	-171.2	-16	0	0	112
887	P	45.9	Very low	30.1	Very low	116 Å²	116	140.9 Å²	140.9	75%	0.753	73%	0.734	S	S	*	*			cis	-122.5	-168	-28.5	21.3	2.5	0	0	0	111.9
888	I	32.9	Very low	30.5	Very low	171 Å²	171	141.2 Å²	141.2	88%	0.877	74%	0.741	S	S	*	*			trans	-114.9	141.2	177.2	-72.6	175.4	0	0	0	112.4
889	D	28.9	Very low	30.9	Very low	147 Å²	147	139.2 Å²	139.2	79%	0.786	75%	0.745	S	S	*	*			trans	-97.5	179.7	179.8	-169.9	23.2	0	0	0	113.4
890	L	33.5	Very low	31.5	Very low	145 Å²	145	137 Å²	137	76%	0.759	75%	0.745	S	S	*	*			trans	-104.1	156.8	-154.9	-63.3	167.1	0	0	0	116.9
891	S	28.4	Very low	32.1	Very low	82 Å²	82	136.2 Å²	136.2	57%	0.573	75%	0.746	S	S	*	*			trans	96.7	144.3	140	83.7	0	0	0	0	120.7
892	K	26.4	Very low	32.5	Very low	185 Å²	185	133.9 Å²	133.9	80%	0.804	75%	0.747	S	S	*	*			trans	73.6	157.8	159.1	-62.3	153.1	-165.9	144.7	0	114.9
893	N	29.1	Very low	32.9	Very low	142 Å²	142	132.7 Å²	132.7	76%	0.759	75%	0.748	S	S	*	*			cis	-165.8	159.4	-13	45.1	17.8	0	0	0	113.7
894	K	27.9	Very low	33.3	Very low	194 Å²	194	135.7 Å²	135.7	84%	0.843	76%	0.758	S	S	*	*			trans	57.2	98.3	140	-167.1	179.5	176.4	-173.8	0	123.5
895	A	32.5	Very low	33.8	Very low	90 Å²	90	132.8 Å²	132.8	74%	0.744	75%	0.749	S	S	*	*				72.5	173.2	125.7	0	0	0	0	0	125
896	T	28.7	Very low	34.2	Very low	121 Å²	121	132.4 Å²	132.4	74%	0.742	75%	0.747	S	S	*	*			trans	93.4	91.9	157.8	21.1	0	0	0	0	124.1
897	T	37.6	Very low	34.4	Very low	112 Å²	112	129.3 Å²	129.3	69%	0.687	74%	0.744	S	S	*	*				66.3	149	121.6	53.3	0	0	0	0	126.4
898	N	34	Very low	33.8	Very low	153 Å²	153	129.7 Å²	129.7	82%	0.818	74%	0.744	S	S	*	*			trans	86.4	145.5	156	-63	-14.3	0	0	0	118.5
899	S	34.8	Very low	33.9	Very low	100 Å²	100	128.2 Å²	128.2	70%	0.699	74%	0.737	S	S	*	*			cis	-158.5	158.4	0.5	-155.9	0	0	0	0	115.6
900	S	35.9	Very low	34.3	Very low	101 Å²	101	127.6 Å²	127.6	71%	0.706	73%	0.733	S	S	*	*			trans	68.7	-178.9	157.4	-46.4	0	0	0	0	116.9
901	T	39.7	Very low	34.4	Very low	118 Å²	118	126 Å²	126	72%	0.724	73%	0.73	S	S	*	*			cis	-170.3	173.5	0.8	3.4	0	0	0	0	106.2
902	N	36.7	Very low	34.8	Very low	136 Å²	136	128.3 Å²	128.3	73%	0.727	74%	0.736	S	S	*	*			cis	-178.9	164.8	-25.2	-100.9	27.4	0	0	0	106.7
903	T	39.8	Very low	35.2	Very low	106 Å²	106	126 Å²	126	65%	0.65	73%	0.732	S	S	*	*			cis	-170	169.1	-15.9	26.2	0	0	0	0	109.5
904	N	36	Very low	35.4	Very low	151 Å²	151	123.6 Å²	123.6	81%	0.807	73%	0.727	S	S	*	*			trans	71.1	144.5	170.6	-65.3	5.5	0	0	0	117.6
905	S	38.3	Very low	35.6	Very low	85 Å²	85	120 Å²	120	59%	0.594	72%	0.72	S	S	*	*			cis	-173	149.8	-9.6	-95.6	0	0	0	0	109
906	N	37.7	Very low	35.5	Very low	152 Å²	152	123.5 Å²	123.5	81%	0.813	73%	0.726	S	S	*	*			cis	-130.9	-100.7	-11.4	-76.2	-37.1	0	0	0	110.8
907	S	36.8	Very low	35.4	Very low	109 Å²	109	120.9 Å²	120.9	76%	0.762	72%	0.724	S	S	*	*			cis	-141.1	-111.1	-0.5	61.4	0	0	0	0	114.3
908	V	34	Very low	35	Very low	124 Å²	124	123.7 Å²	123.7	75%	0.752	73%	0.734	S	S	*	*			trans	-159.8	151	-144.5	154	0	0	0	0	109.9
909	L	35	Very low	35	Very low	140 Å²	140	125.1 Å²	125.1	73%	0.733	73%	0.733	S	S	*	*			cis	-170	159.3	-24.3	-86.7	-178.7	0	0	0	105
910	L	37	Very low	35.2	Very low	134 Å²	134	125.9 Å²	125.9	70%	0.702	74%	0.736	S	S	*	*			cis	-126.2	-129.4	-8.2	-108.8	164.1	0	0	0	106.3
911	T	35.6	Very low	34.7	Very low	111 Å²	111	127.6 Å²	127.6	68%	0.681	74%	0.737	S	S	*	*			cis	-169.7	138.9	-13.2	2.6	0	0	0	0	103.8
912	N	36.4	Very low	34.3	Very low	131 Å²	131	129.2 Å²	129.2	70%	0.701	74%	0.739	S	S	*	*			cis	-148.5	-161.4	-16.5	-89	-14.1	0	0	0	104.7
913	N	35.3	Very low	33.6	Very low	136 Å²	136	128.3 Å²	128.3	73%	0.727	74%	0.744	S	S	*	*			cis	-159.2	169.3	9.7	-158.4	3.9	0	0	0	111.5
914	S	33.1	Very low	33.3	Very low	92 Å²	92	131.2 Å²	131.2	64%	0.643	75%	0.754	S	S	*	*			trans	4.2	132.5	143.7	-65.7	0	0	0	0	119.7
915	V	33.2	Very low	33.3	Very low	117 Å²	117	129.2 Å²	129.2	71%	0.709	75%	0.75	S	S	*	*			cis	-149.4	146	5.2	-174.3	0	0	0	0	110.5
916	N	30	Very low	32.6	Very low	164 Å²	164	133.1 Å²	133.1	88%	0.877	76%	0.758	S	S	*	*			trans	33.6	137	160.6	-57.2	-8.9	0	0	0	121.5
917	G	27	Very low	32.4	Very low	66 Å²	66	130.3 Å²	130.3	68%	0.68	75%	0.751	S	S	*	*			cis	170.1	169.3	-2.1	0	0	0	0	0	113.8
918	N	28.8	Very low	31.9	Very low	171 Å²	171	131.3 Å²	131.3	91%	0.914	75%	0.752	S	S	*	*			trans	74.6	124.8	170.2	-56.2	-9.5	0	0	0	119.3
919	K	35	Very low	31.6	Very low	183 Å²	183	130.5 Å²	130.5	80%	0.796	75%	0.752	S	S	*	*			trans	-125.3	168.2	163.4	-65.5	-176.9	178.3	178.5	0	108.3
920	P	37.8	Very low	31.3	Very low	117 Å²	117	128.4 Å²	128.4	76%	0.76	75%	0.749	S	S	*	*				-122.2	143.4	85.8	-2.6	24.8	0	0	0	113.5
921	L	26.3	Very low	31.4	Very low	137 Å²	137	128.1 Å²	128.1	72%	0.717	76%	0.755	S	S	*	*				65.2	110.8	87.7	-58	178.2	0	0	0	113.4
922	I	30.1	Very low	31.6	Very low	151 Å²	151	130.2 Å²	130.2	77%	0.774	76%	0.761	S	S	*	*				87.6	118.5	53.9	-70.3	176.5	0	0	0	114.2
923	S	22.8	Very low	31.9	Very low	118 Å²	118	134.2 Å²	134.2	83%	0.825	77%	0.767	S	S	*	*			trans	-170.9	135.2	145.7	59.7	0	0	0	0	112.6
924	L	32.5	Very low	32.5	Very low	167 Å²	167	135.2 Å²	135.2	87%	0.874	77%	0.767	S	S	*	*			trans	-155.8	134.3	165	179.8	68.2	0	0	0	108.8
925	P	36.6	Very low	33.2	Very low	109 Å²	109	136.8 Å²	136.8	71%	0.708	77%	0.768	S	S	*	*			trans	-148.5	160	130.3	37	-20.6	0	0	0	115.9
926	E	24.4	Very low	34.1	Very low	166 Å²	166	133.5 Å²	133.5	78%	0.776	75%	0.753	S	S	*	*			trans	36	125.6	150.4	-111.2	49.6	-144.5	0	0	124.9
927	S	32.6	Very low	35.3	Very low	93 Å²	93	131 Å²	131	65%	0.65	74%	0.739	S	S	*	*			trans	32.6	136.8	135.3	79.9	0	0	0	0	121
928	V	26.5	Very low	37	Very low	130 Å²	130	133.4 Å²	133.4	79%	0.788	73%	0.734	S	S	*	*			cis	-164.8	164.9	45.7	-85.3	0	0	0	0	112.8
929	S	27.3	Very low	38.5	Very low	107 Å²	107	130.3 Å²	130.3	75%	0.748	72%	0.717	S	S	*	*			trans	128.5	125.2	135.1	73.4	0	0	0	0	120.4
930	S	28.4	Very low	39.9	Very low	96 Å²	96	125.9 Å²	125.9	67%	0.671	70%	0.702	S	S	*	*			trans	61.7	115.5	151.9	68	0	0	0	0	122.2	L932	S930-L932 PolarHBondContact O-N 2.94Å
931	P	40	Very low	41.4	Very low	128 Å²	128	123.1 Å²	123.1	83%	0.831	69%	0.685	S	S	*	*	S	Bend	trans	-99.8	57.9	173.2	39.9	-34.7	0	0	0	113.1
932	L	39.3	Very low	43.2	Very low	156 Å²	156	120.1 Å²	120.1	82%	0.817	67%	0.67	S	S	*	*			trans	-126.5	5.2	-172	-71.9	176.3	0	0	0	116.1	S930	S930-L932 PolarHBondContact O-N 2.94Å
933	R	43.3	Very low	45.2	Very low	215 Å²	215	118.1 Å²	118.1	81%	0.811	66%	0.659	S	S	*	*	S	Bend	trans	-108.3	-13.5	-172.6	-154.7	169.2	-173.3	-94.8	-0.4	115.8
934	E	47.2	Very low	47.2	Very low	156 Å²	156	116.4 Å²	116.4	73%	0.729	64%	0.643	S	S	*	*	S	Bend	trans	-82.2	-43.9	-173.2	-165.1	166.5	-175.9	0	0	113	A936 L937	E934-A936 PolarHBondContact O-N 3.49Å; E934-A936 VanDerWaalsContact O-N 3.16Å; E934-L937 PolarHBondContact O-N 3.32Å
935	N	48.4	Very low	48.6	Very low	125 Å²	125	114.7 Å²	114.7	67%	0.668	63%	0.628	S	S	*	*	H	α-helix	trans	-56.1	-34.1	177.6	-81.6	28.6	0	0	0	113.4	L937 M938 D939	N935-L937 VanDerWaalsContact C-N 3.28Å; N935-L937 PolarHBondContact O-N 3.42Å; N935-M938 WeakPolarHBondContact O-CA 3.35Å; N935-M938 VanDerWaalsContact O-CB 3.32Å; N935-M938 WeakPolarHBondContact O-CB 3.22Å; N935-M938 PolarHBondContact O-N 2.72Å; N935-D939 PolarHBondContact O-N 3.24Å
936	A	52.6	Low	49.2	Very low	48 Å²	48	115 Å²	115	40%	0.397	62%	0.624	S	S	.	*	H	α-helix	trans	-61.1	-35.2	-177.3	0	0	0	0	0	112.9	E934 I940	E934-A936 PolarHBondContact O-N 3.49Å; E934-A936 VanDerWaalsContact O-N 3.16Å; A936-I940 WeakPolarHBondContact O-CB 3.31Å; A936-I940 WeakPolarHBondContact O-CD1 3.5Å; A936-I940 WeakPolarHBondContact O-CG1 3.44Å; A936-I940 PolarHBondContact O-N 3.03Å
937	L	54.3	Low	50	Low	113 Å²	113	113 Å²	113	59%	0.592	62%	0.618	S	S	*	*	H	α-helix	trans	-76.8	-27.4	176.9	-63.7	176.8	0	0	0	112	E934 N935 S941	E934-L937 PolarHBondContact O-N 3.32Å; N935-L937 VanDerWaalsContact C-N 3.28Å; N935-L937 PolarHBondContact O-N 3.42Å; L937-S941 WeakPolarHBondContact O-CB 3.46Å; L937-S941 PolarHBondContact O-N 2.88Å; L937-S941 VanDerWaalsContact O-N 3.1Å; L937-S941 PolarHBondContact O-OG 3.16Å
938	M	63.1	Low	50.7	Low	116 Å²	116	114.1 Å²	114.1	57%	0.571	62%	0.621	S	S	*	*	H	α-helix	trans	-68.7	-50.4	171.1	-148.4	85.5	73.3	0	0	110.8	N935 I940 S941 D942	N935-M938 WeakPolarHBondContact O-CA 3.35Å; N935-M938 VanDerWaalsContact O-CB 3.32Å; N935-M938 WeakPolarHBondContact O-CB 3.22Å; N935-M938 PolarHBondContact O-N 2.72Å; M938-I940 PolarHBondContact O-N 2.67Å; M938-S941 WeakPolarHBondContact O-CB 3.23Å; M938-S941 PolarHBondContact O-N 3.24Å; M938-S941 VanDerWaalsContact O-N 3.14Å; M938-D942 PolarHBondContact O-N 2.93Å
939	D	60.7	Low	51.6	Low	105 Å²	105	111 Å²	111	56%	0.561	61%	0.614	S	S	*	*	H	α-helix	trans	-60.6	-44.4	177.1	-97.1	-15.4	0	0	0	111.8	N935 S941 D942 M943	N935-D939 PolarHBondContact O-N 3.24Å; D939-S941 VanDerWaalsContact C-N 3.3Å; D939-S941 PolarHBondContact O-N 2.89Å; D939-D942 PolarHBondContact O-N 3.22Å; D939-M943 HydrophobicContact CB-CE 4.47Å; D939-M943 WeakPolarHBondContact O-CB 3.34Å; D939-M943 VanDerWaalsContact O-CG 3.32Å; D939-M943 WeakPolarHBondContact O-CG 3.43Å; D939-M943 PolarHBondContact O-N 2.72Å
940	I	63.6	Low	52.5	Low	91 Å²	91	116 Å²	116	47%	0.467	62%	0.617	S	S	.	*	H	α-helix	trans	-61.9	-40.5	175.3	-70.9	165.2	0	0	0	110.6	A936 M938 D942 M943 V944	A936-I940 WeakPolarHBondContact O-CB 3.31Å; A936-I940 WeakPolarHBondContact O-CD1 3.5Å; A936-I940 WeakPolarHBondContact O-CG1 3.44Å; A936-I940 PolarHBondContact O-N 3.03Å; M938-I940 PolarHBondContact O-N 2.67Å; I940-D942 PolarHBondContact O-N 3.31Å; I940-M943 HydrophobicContact CG1-CE 4.2Å; I940-V944 HydrophobicContact CG2-CG2 4.43Å; I940-V944 WeakPolarHBondContact O-CB 3.21Å; I940-V944 VanDerWaalsContact O-CG2 3.26Å; I940-V944 WeakPolarHBondContact O-CG2 3.08Å; I940-V944 PolarHBondContact O-N 2.66Å
941	S	68.9	Low	52.7	Low	59 Å²	59	119 Å²	119	41%	0.413	63%	0.625	S	S	.	*	H	α-helix	trans	-62.8	-42.2	176.8	-62.8	0	0	0	0	112.2	L937 M938 D939 K945	L937-S941 WeakPolarHBondContact O-CB 3.46Å; L937-S941 PolarHBondContact O-N 2.88Å; L937-S941 VanDerWaalsContact O-N 3.1Å; L937-S941 PolarHBondContact O-OG 3.16Å; M938-S941 WeakPolarHBondContact O-CB 3.23Å; M938-S941 PolarHBondContact O-N 3.24Å; M938-S941 VanDerWaalsContact O-N 3.14Å; D939-S941 VanDerWaalsContact C-N 3.3Å; D939-S941 PolarHBondContact O-N 2.89Å; S941-K945 VanDerWaalsContact O-CG 3.23Å; S941-K945 WeakPolarHBondContact O-CG 3.43Å; S941-K945 PolarHBondContact O-N 3.4Å; S941-K945 VanDerWaalsContact O-N 3.09Å
942	D	65.3	Low	52.3	Low	73 Å²	73	119.5 Å²	119.5	39%	0.39	63%	0.626	S	S	.	*	H	α-helix	trans	-79.9	-31.3	-179	-76.6	-3	0	0	0	112.9	M938 D939 I940 K945 N946	M938-D942 PolarHBondContact O-N 2.93Å; D939-D942 PolarHBondContact O-N 3.22Å; I940-D942 PolarHBondContact O-N 3.31Å; D942-K945 WeakPolarHBondContact OD1-CD 3.36Å; D942-K945 WeakPolarHBondContact OD1-CE 3.2Å; D942-K945 IonicContact OD1-NZ 2.95Å; D942-K945 PolarHBondContact OD1-NZ 2.86Å; D942-N946 WeakPolarHBondContact O-CB 3.31Å; D942-N946 PolarHBondContact O-N 2.8Å; D942-N946 PolarHBondContact O-ND2 2.59Å
943	M	71.6	Confident	52	Low	110 Å²	110	117.9 Å²	117.9	54%	0.542	63%	0.625	S	S	.	*	H	α-helix	trans	-62.5	-44.7	168.3	-75.3	-169.1	-69.1	0	0	111.6	D939 I940 N946 L947	D939-M943 HydrophobicContact CB-CE 4.47Å; D939-M943 WeakPolarHBondContact O-CB 3.34Å; D939-M943 VanDerWaalsContact O-CG 3.32Å; D939-M943 WeakPolarHBondContact O-CG 3.43Å; D939-M943 PolarHBondContact O-N 2.72Å; I940-M943 HydrophobicContact CG1-CE 4.2Å; M943-N946 PolarHBondContact O-N 2.82Å; M943-L947 WeakPolarHBondContact O-CB 3.46Å; M943-L947 WeakPolarHBondContact O-CG 3.19Å; M943-L947 PolarHBondContact O-N 3.29Å
944	V	64.8	Low	51.5	Low	81 Å²	81	117.6 Å²	117.6	49%	0.491	63%	0.629	S	S	.	*	H	α-helix	trans	-65.5	-40.7	178	170.3	0	0	0	0	111.8	I940 N946 L947 T948	I940-V944 HydrophobicContact CG2-CG2 4.43Å; I940-V944 WeakPolarHBondContact O-CB 3.21Å; I940-V944 VanDerWaalsContact O-CG2 3.26Å; I940-V944 WeakPolarHBondContact O-CG2 3.08Å; I940-V944 PolarHBondContact O-N 2.66Å; V944-N946 PolarHBondContact O-N 2.68Å; V944-L947 PolarHBondContact O-N 3.29Å; V944-T948 PolarHBondContact O-N 2.89Å; V944-T948 PolarHBondContact O-OG1 3.08Å
945	K	61.2	Low	50.5	Low	132 Å²	132	115.8 Å²	115.8	57%	0.574	63%	0.634	S	S	*	*	H	α-helix	trans	-59.5	-44.3	172.5	-71.2	167.2	-154.5	162.3	0	111.9	S941 D942 T948 G949	S941-K945 VanDerWaalsContact O-CG 3.23Å; S941-K945 WeakPolarHBondContact O-CG 3.43Å; S941-K945 PolarHBondContact O-N 3.4Å; S941-K945 VanDerWaalsContact O-N 3.09Å; D942-K945 WeakPolarHBondContact OD1-CD 3.36Å; D942-K945 WeakPolarHBondContact OD1-CE 3.2Å; D942-K945 IonicContact OD1-NZ 2.95Å; D942-K945 PolarHBondContact OD1-NZ 2.86Å; K945-T948 PolarHBondContact O-N 3.01Å; K945-G949 PolarHBondContact O-N 3.25Å
946	N	49.3	Very low	49.5	Very low	115 Å²	115	115.4 Å²	115.4	62%	0.615	64%	0.641	S	S	*	*	H	α-helix	trans	-69.4	-33	179.3	-82.5	-81.2	0	0	0	113.2	D942 M943 V944	D942-N946 WeakPolarHBondContact O-CB 3.31Å; D942-N946 PolarHBondContact O-N 2.8Å; D942-N946 PolarHBondContact O-ND2 2.59Å; M943-N946 PolarHBondContact O-N 2.82Å; V944-N946 PolarHBondContact O-N 2.68Å
947	L	42.5	Very low	48.3	Very low	125 Å²	125	118.7 Å²	118.7	65%	0.654	66%	0.656	S	S	*	*	H	α-helix	trans	-68	-37.6	174.1	-76.4	164.7	0	0	0	112.4	M943 V944 G949	M943-L947 WeakPolarHBondContact O-CB 3.46Å; M943-L947 WeakPolarHBondContact O-CG 3.19Å; M943-L947 PolarHBondContact O-N 3.29Å; V944-L947 PolarHBondContact O-N 3.29Å; L947-G949 VanDerWaalsContact C-N 3.27Å; L947-G949 PolarHBondContact O-N 3.19Å
948	T	46.7	Very low	47.7	Very low	116 Å²	116	118.9 Å²	118.9	71%	0.712	66%	0.664	S	S	*	*	H	α-helix	trans	-67.7	-26.7	-180	-52	0	0	0	0	112.4	V944 K945 R950	V944-T948 PolarHBondContact O-N 2.89Å; V944-T948 PolarHBondContact O-OG1 3.08Å; K945-T948 PolarHBondContact O-N 3.01Å; T948-R950 PolarHBondContact O-N 3.2Å
949	G	45.8	Very low	45.8	Very low	63 Å²	63	119.1 Å²	119.1	65%	0.649	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	3.9	-173.7	0	0	0	0	0	117.5	K945 L947	K945-G949 PolarHBondContact O-N 3.25Å; L947-G949 VanDerWaalsContact C-N 3.27Å; L947-G949 PolarHBondContact O-N 3.19Å
950	R	44.9	Very low	44.3	Very low	214 Å²	214	118.5 Å²	118.5	81%	0.808	68%	0.681	S	S	*	*	S	Bend	trans	-139.2	36.5	-167.7	-68.8	-166.3	174	-80.8	-1.1	117.2	T948	T948-R950 PolarHBondContact O-N 3.2Å
951	L	32.7	Very low	42.6	Very low	159 Å²	159	121.7 Å²	121.7	83%	0.832	70%	0.698	S	S	*	*			trans	-129.9	55.5	179.9	-71.3	177.6	0	0	0	116.5
952	T	32.2	Very low	40.7	Very low	138 Å²	138	124 Å²	124	85%	0.847	71%	0.714	S	S	*	*			trans	-145.9	129.6	155.4	46	0	0	0	0	111.6
953	P	33.6	Very low	38.9	Very low	122 Å²	122	127 Å²	127	79%	0.792	73%	0.725	S	S	*	*			trans	-102.7	123.5	-175.6	35.1	-31.6	0	0	0	115.6
954	K	32.2	Very low	37.2	Very low	208 Å²	208	129.7 Å²	129.7	90%	0.904	73%	0.734	S	S	*	*			trans	42.6	130.2	142.8	-58.1	177.6	-179.1	175.7	0	121
955	S	26.2	Very low	35.6	Very low	119 Å²	119	131.2 Å²	131.2	83%	0.832	75%	0.749	S	S	*	*				-152.9	160.6	122.5	75	0	0	0	0	112
956	S	28.3	Very low	34.1	Very low	117 Å²	117	132.7 Å²	132.7	82%	0.818	76%	0.762	S	S	*	*			trans	-161.4	117.8	175.2	-50.7	0	0	0	0	111.4
957	T	27.4	Very low	33.2	Very low	117 Å²	117	131.7 Å²	131.7	72%	0.718	77%	0.771	S	S	*	*			trans	-160.5	136.5	164.5	-53.2	0	0	0	0	110
958	P	40.8	Very low	32.6	Very low	116 Å²	116	134 Å²	134	75%	0.753	78%	0.783	S	S	*	*			trans	-111.2	143.1	-174.8	38.4	-31.7	0	0	0	116
959	S	23.9	Very low	31.8	Very low	121 Å²	121	131.4 Å²	131.4	85%	0.846	78%	0.78	S	S	*	*			trans	175.5	154.5	159.5	-83.1	0	0	0	0	109.6
960	S	28.8	Very low	31	Very low	93 Å²	93	134.5 Å²	134.5	65%	0.65	79%	0.791	S	S	*	*			cis	-167.7	167.9	-15.2	53.9	0	0	0	0	111
961	I	28.2	Very low	30.1	Very low	158 Å²	158	128.6 Å²	128.6	81%	0.81	79%	0.788	S	S	*	*			trans	66.9	154.9	164.2	78.8	161.2	0	0	0	122.2
962	S	28.8	Very low	29.9	Very low	107 Å²	107	129.5 Å²	129.5	75%	0.748	79%	0.786	S	S	*	*			trans	74.4	147.7	153.4	-156.3	0	0	0	0	119.3
963	E	28.1	Very low	29.8	Very low	136 Å²	136	131.5 Å²	131.5	64%	0.636	79%	0.786	S	S	*	*			cis	-165.2	138.3	-36.6	-174.5	-178.5	109.3	0	0	108.7
964	K	35.4	Very low	29.7	Very low	166 Å²	166	131.8 Å²	131.8	72%	0.722	78%	0.781	S	S	*	*			trans	50.6	155.6	160.1	76.5	-167.8	166.1	-147.1	0	123.7
965	S	30.8	Very low	29.9	Very low	114 Å²	114	126 Å²	126	80%	0.797	77%	0.771	S	S	*	*			trans	102.6	151.9	150	72.9	0	0	0	0	119.8
966	D	28.7	Very low	30.2	Very low	162 Å²	162	128.1 Å²	128.1	87%	0.866	77%	0.772	S	S	*	*			trans	-103.3	-176	-158.4	-64.3	-96.5	0	0	0	114.2
967	A	31.7	Very low	30.2	Very low	95 Å²	95	131.7 Å²	131.7	79%	0.785	78%	0.776	S	S	*	*			trans	92	97.8	159.3	0	0	0	0	0	119.5
968	D	30	Very low	30.7	Very low	172 Å²	172	133.3 Å²	133.3	92%	0.92	78%	0.781	S	S	*	*				65.2	155.3	128.7	-145	-1.9	0	0	0	121.5
969	G	29.9	Very low	30.3	Very low	62 Å²	62	135.2 Å²	135.2	64%	0.639	78%	0.784	S	S	*	*			trans	101.2	80.6	158.1	0	0	0	0	0	120.4
970	S	27.5	Very low	30.3	Very low	128 Å²	128	135 Å²	135	90%	0.895	78%	0.782	S	S	*	*			trans	51.8	159.9	132.4	-154.3	0	0	0	0	124
971	A	27.6	Very low	30.7	Very low	90 Å²	90	136.2 Å²	136.2	74%	0.744	79%	0.788	S	S	*	*			trans	70.9	125.3	179	0	0	0	0	0	115.2
972	F	27.9	Very low	30.9	Very low	178 Å²	178	134.9 Å²	134.9	78%	0.781	79%	0.787	S	S	*	*			cis	83.3	102.1	48.7	-169.1	-84.1	0	0	0	113.2	D974	F972-D974 HydrophobicContact CE2-CB 4.32Å; F972-D974 HydrophobicContact CZ-CB 4.05Å
973	E	30.2	Very low	31.4	Very low	181 Å²	181	139.5 Å²	139.5	85%	0.846	80%	0.796	S	S	*	*			trans	-147	138.4	155.6	-105	-82.5	79.7	0	0	105.1
974	D	30.8	Very low	31.7	Very low	128 Å²	128	142.5 Å²	142.5	68%	0.684	81%	0.807	S	S	*	*			trans	-143.4	161.6	-176.3	-173.6	20.5	0	0	0	109.1	F972	F972-D974 HydrophobicContact CE2-CB 4.32Å; F972-D974 HydrophobicContact CZ-CB 4.05Å
975	A	36.1	Very low	31.7	Very low	85 Å²	85	145.8 Å²	145.8	70%	0.702	82%	0.815	S	S	*	*			trans	65.8	72.5	171.5	0	0	0	0	0	118.3
976	L	33.4	Very low	32.1	Very low	164 Å²	164	149.7 Å²	149.7	86%	0.859	82%	0.818	S	S	*	*				-154.7	91.3	127.3	-160.3	99	0	0	0	113.5
977	E	29.2	Very low	32.1	Very low	193 Å²	193	144.3 Å²	144.3	90%	0.902	80%	0.801	S	S	*	*			trans	177.5	106.5	140.7	-101.4	167.4	-179.2	0	0	110.1
978	D	37.6	Very low	32.2	Very low	151 Å²	151	151.6 Å²	151.6	81%	0.807	81%	0.808	S	S	*	*			trans	-109.2	171.4	175.2	-167.3	8.9	0	0	0	110.2
979	L	31.9	Very low	32.7	Very low	156 Å²	156	150.1 Å²	150.1	82%	0.817	80%	0.796	S	S	*	*			trans	80.6	81.3	173.1	-46.9	-176.7	0	0	0	117
980	S	23	Very low	33.8	Very low	116 Å²	116	150.1 Å²	150.1	81%	0.811	79%	0.786	S	S	*	*			trans	-134.9	147.8	138.8	69	0	0	0	0	110.9
981	P	38.3	Very low	35.1	Very low	119 Å²	119	152 Å²	152	77%	0.773	79%	0.786	S	S	*	*			trans	-96.8	168.4	-157.5	37.6	-38.2	0	0	0	115.7
982	V	31.6	Very low	37.5	Very low	130 Å²	130	151.3 Å²	151.3	79%	0.788	76%	0.764	S	S	*	*			trans	80.5	107.3	165	-168.8	0	0	0	0	117.3
983	Q	39.1	Very low	40.2	Very low	203 Å²	203	145.6 Å²	145.6	95%	0.949	74%	0.741	S	S	*	*			trans	-138.9	82.8	152.8	-138.6	173.5	30.4	0	0	112.1
984	K	35.4	Very low	42.8	Very low	199 Å²	199	140.7 Å²	140.7	87%	0.865	73%	0.725	S	S	*	*			trans	-93.7	162.3	169.9	-80.2	-177.1	176.3	175.1	0	111.7
985	R	35.6	Very low	45.6	Very low	236 Å²	236	139.7 Å²	139.7	89%	0.891	72%	0.717	S	S	*	*			trans	-62.4	150.7	-152	-61.3	176.8	-173.4	157	1.9	115.7	G987	R985-G987 PolarHBondContact O-N 3.17Å
986	K	39.4	Very low	48.2	Very low	195 Å²	195	137.5 Å²	137.5	85%	0.848	69%	0.692	S	S	*	*			trans	-65.7	80.3	-177.3	-169.3	94.6	167	-169	0	113.4
987	G	28.9	Very low	51	Low	50 Å²	50	131.3 Å²	131.3	52%	0.515	66%	0.659	S	S	.	*			trans	-58.6	155.8	152.4	0	0	0	0	0	110.2	R985 Q989	R985-G987 PolarHBondContact O-N 3.17Å; G987-Q989 PolarHBondContact O-N 2.96Å
988	R	33.5	Very low	54	Low	248 Å²	248	122.6 Å²	122.6	94%	0.936	62%	0.619	S	S	*	*			trans	-61.2	104.3	171.9	-73	-176.6	-178.8	-92.5	-1	108.4	S990	R988-S990 PolarHBondContact O-N 2.95Å
989	Q	39.1	Very low	56.6	Low	141 Å²	141	115.4 Å²	115.4	66%	0.659	58%	0.581	S	S	*	*			trans	-61.5	132.4	172.6	-65.7	-66.1	15.7	0	0	108.2	G987 N991	G987-Q989 PolarHBondContact O-N 2.96Å; Q989-N991 PolarHBondContact O-N 2.9Å
990	S	53.6	Low	59.5	Low	61 Å²	61	108.1 Å²	108.1	43%	0.427	54%	0.542	S	S	.	.			trans	-66.9	123.8	173.9	40.8	0	0	0	0	108.6	R988 W992	R988-S990 PolarHBondContact O-N 2.95Å; S990-W992 PolarHBondContact O-N 2.99Å
991	N	55.1	Low	62.9	Low	167 Å²	167	103.8 Å²	103.8	89%	0.893	51%	0.509	S	S	*	.			trans	-69.2	33.2	175	-63.2	-10.3	0	0	0	113	Q989	Q989-N991 PolarHBondContact O-N 2.9Å
992	W	76.9	Confident	65.5	Low	76 Å²	76	98.1 Å²	98.1	29%	0.288	47%	0.472	S	S	.	.	S	Bend	trans	-101.4	138.3	-177.7	-71.8	55.6	0	0	0	107.7	S990 L997 L1000 L1035 T1039 W1043	S990-W992 PolarHBondContact O-N 2.99Å; W992-L997 HydrophobicContact CB-CD1 4Å; W992-L997 HydrophobicContact CB-CD2 4.19Å; W992-L997 HydrophobicContact CB-CG 3.96Å; W992-L997 HydrophobicContact CD2-CD2 4.39Å; W992-L997 HydrophobicContact CE3-CD2 4.07Å; W992-L997 HydrophobicContact CG-CD2 4.47Å; W992-L1000 HydrophobicContact CE3-CD1 4.14Å; W992-L1000 HydrophobicContact CZ3-CD1 3.63Å; W992-L1035 HydrophobicContact CE3-CD1 3.93Å; W992-L1035 HydrophobicContact CE3-CD2 4.1Å; W992-L1035 HydrophobicContact CH2-CD1 4.48Å; W992-L1035 HydrophobicContact CH2-CD2 4.41Å; W992-L1035 HydrophobicContact CZ3-CD1 3.53Å; W992-L1035 HydrophobicContact CZ3-CD2 3.94Å; W992-L1035 HydrophobicContact CZ3-CG 4.37Å; W992-T1039 HydrophobicContact CH2-CG2 3.51Å; W992-T1039 HydrophobicContact CZ2-CG2 3.51Å; W992-W1043 HydrophobicContact CH2-CB 4.11Å; W992-W1043 HydrophobicContact CH2-CG 4.46Å
993	N	84.9	Confident	68.3	Low	58 Å²	58	93.2 Å²	93.2	31%	0.31	44%	0.441	S	S	.	.			trans	-55.2	125.3	172.7	177.2	-1.4	0	0	0	108.9	Q995 H996 L997	N993-Q995 PolarHBondContact ND2-OE1 3.33Å; N993-Q995 PolarHBondContact O-N 3.46Å; N993-Q995 WeakPolarHBondContact OD1-CB 3.46Å; N993-Q995 PolarHBondContact OD1-N 2.85Å; N993-H996 HydrophobicContact CB-CB 4.29Å; N993-H996 PolarHBondContact ND2-CD2 3.21Å; N993-H996 PolarHBondContact ND2-NE2 3.47Å; N993-H996 WeakPolarHBondContact O-CB 3.18Å; N993-H996 PolarHBondContact O-N 3.26Å; N993-L997 PolarHBondContact O-N 3Å; N993-L997 VanDerWaalsContact O-N 3.17Å
994	P	86.4	Confident	70.8	Confident	78 Å²	78	83.9 Å²	83.9	51%	0.506	40%	0.397	S	S	.	.	H	α-helix	trans	-53.5	-37.6	177.7	20.4	-33.1	0	0	0	112.2	H996 L997 L998	P994-H996 VanDerWaalsContact C-N 3.3Å; P994-H996 PolarHBondContact O-N 3.49Å; P994-L997 CarbonylContact O-C 3.49Å; P994-L997 WeakPolarHBondContact O-CA 3.49Å; P994-L997 WeakPolarHBondContact O-CB 3.44Å; P994-L997 PolarHBondContact O-N 2.95Å; P994-L998 WeakPolarHBondContact O-CG 3.25Å; P994-L998 PolarHBondContact O-N 3.37Å
995	Q	88.1	Confident	73.5	Confident	108 Å²	108	74.4 Å²	74.4	51%	0.505	36%	0.356	S	S	.	.	H	α-helix	trans	-59.6	-38.8	176	-62.1	171	-34.1	0	0	112.5	N993 L997 L998 I999 L1093	N993-Q995 PolarHBondContact ND2-OE1 3.33Å; N993-Q995 PolarHBondContact O-N 3.46Å; N993-Q995 WeakPolarHBondContact OD1-CB 3.46Å; N993-Q995 PolarHBondContact OD1-N 2.85Å; Q995-L997 VanDerWaalsContact C-N 3.33Å; Q995-L998 PolarHBondContact O-N 3.44Å; Q995-I999 WeakPolarHBondContact O-CD1 3.42Å; Q995-I999 VanDerWaalsContact O-CG1 3.28Å; Q995-I999 WeakPolarHBondContact O-CG1 3.29Å; Q995-I999 PolarHBondContact O-N 2.98Å; Q995-L1093 HydrophobicContact CB-CD2 4.19Å
996	H	91.5	Very high	76.1	Confident	39 Å²	39	66.2 Å²	66.2	18%	0.181	34%	0.335	C	S	.	.	H	α-helix	trans	-70.5	-33.7	177.5	-58.1	-176.8	0	0	0	110.8	N993 P994 L1000 T1033 L1035	N993-H996 HydrophobicContact CB-CB 4.29Å; N993-H996 PolarHBondContact ND2-CD2 3.21Å; N993-H996 PolarHBondContact ND2-NE2 3.47Å; N993-H996 WeakPolarHBondContact O-CB 3.18Å; N993-H996 PolarHBondContact O-N 3.26Å; P994-H996 VanDerWaalsContact C-N 3.3Å; P994-H996 PolarHBondContact O-N 3.49Å; H996-L1000 WeakPolarHBondContact O-CB 3.45Å; H996-L1000 WeakPolarHBondContact O-CD1 3.33Å; H996-L1000 VanDerWaalsContact O-CG 3.25Å; H996-L1000 WeakPolarHBondContact O-CG 3.28Å; H996-L1000 PolarHBondContact O-N 3.33Å; H996-T1033 HydrophobicContact CB-CG2 4.02Å; H996-T1033 PolarHBondContact CE1-O 2.88Å; H996-T1033 PolarHBondContact ND1-O 3.25Å; H996-L1035 HydrophobicContact CB-CD1 4.09Å
997	L	91.8	Very high	78.5	Confident	33 Å²	33	57.5 Å²	57.5	17%	0.173	30%	0.299	C	S	.	.	H	α-helix	trans	-68.6	-38.3	172.7	-69.3	173.1	0	0	0	112.1	W992 N993 P994 Q995 L1000 Q1001	W992-L997 HydrophobicContact CB-CD1 4Å; W992-L997 HydrophobicContact CB-CD2 4.19Å; W992-L997 HydrophobicContact CB-CG 3.96Å; W992-L997 HydrophobicContact CD2-CD2 4.39Å; W992-L997 HydrophobicContact CE3-CD2 4.07Å; W992-L997 HydrophobicContact CG-CD2 4.47Å; N993-L997 PolarHBondContact O-N 3Å; N993-L997 VanDerWaalsContact O-N 3.17Å; P994-L997 CarbonylContact O-C 3.49Å; P994-L997 WeakPolarHBondContact O-CA 3.49Å; P994-L997 WeakPolarHBondContact O-CB 3.44Å; P994-L997 PolarHBondContact O-N 2.95Å; Q995-L997 VanDerWaalsContact C-N 3.33Å; L997-L1000 PolarHBondContact O-N 3.1Å; L997-Q1001 VanDerWaalsContact C-NE2 3.28Å; L997-Q1001 WeakPolarHBondContact O-CB 3.45Å; L997-Q1001 VanDerWaalsContact O-CG 3.24Å; L997-Q1001 WeakPolarHBondContact O-CG 3.44Å; L997-Q1001 PolarHBondContact O-N 3.04Å; L997-Q1001 PolarHBondContact O-NE2 2.88Å
998	L	92.1	Very high	81.4	Confident	10 Å²	10	55.7 Å²	55.7	5%	0.052	28%	0.277	C	S	.	.	H	α-helix	trans	-63.4	-46	174.3	-65.3	169.4	0	0	0	110.7	P994 Q995 L1000 Q1001 A1002 L1089 H1092 L1093	P994-L998 WeakPolarHBondContact O-CG 3.25Å; P994-L998 PolarHBondContact O-N 3.37Å; Q995-L998 PolarHBondContact O-N 3.44Å; L998-L1000 PolarHBondContact O-N 2.77Å; L998-Q1001 PolarHBondContact O-N 3.39Å; L998-A1002 WeakPolarHBondContact O-CB 3.42Å; L998-A1002 PolarHBondContact O-N 2.67Å; L998-L1089 HydrophobicContact CD2-CD2 3.56Å; L998-H1092 HydrophobicContact CD1-CB 4.03Å; L998-L1093 HydrophobicContact CB-CD2 4.11Å; L998-L1093 HydrophobicContact CB-CG 4.35Å; L998-L1093 HydrophobicContact CD1-CD2 4.32Å
999	I	92.3	Very high	83.8	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-58.9	-47.2	174.9	-68.7	162.1	0	0	0	111.1	Q995 A1002 Q1003 F1032 T1033 L1093 F1095 L1097 L1100	Q995-I999 WeakPolarHBondContact O-CD1 3.42Å; Q995-I999 VanDerWaalsContact O-CG1 3.28Å; Q995-I999 WeakPolarHBondContact O-CG1 3.29Å; Q995-I999 PolarHBondContact O-N 2.98Å; I999-A1002 PolarHBondContact O-N 3.01Å; I999-Q1003 HydrophobicContact CG2-CG 4.23Å; I999-Q1003 VanDerWaalsContact O-CB 3.29Å; I999-Q1003 WeakPolarHBondContact O-CB 3.35Å; I999-Q1003 WeakPolarHBondContact O-CG 3.17Å; I999-Q1003 PolarHBondContact O-N 3Å; I999-F1032 HydrophobicContact CD1-CD1 3.65Å; I999-F1032 HydrophobicContact CD1-CE1 3.47Å; I999-F1032 VanDerWaalsContact CD1-CE1 3.47Å; I999-T1033 HydrophobicContact CD1-CG2 4.23Å; I999-T1033 HydrophobicContact CG2-CG2 4.39Å; I999-L1093 HydrophobicContact CD1-CD2 4.28Å; I999-L1093 HydrophobicContact CG1-CD1 3.69Å; I999-L1093 HydrophobicContact CG1-CD2 3.92Å; I999-L1093 HydrophobicContact CG1-CG 4.49Å; I999-F1095 HydrophobicContact CD1-CZ 4.28Å; I999-L1097 HydrophobicContact CG1-CD2 4.28Å; I999-L1097 HydrophobicContact CG2-CD2 4.49Å; I999-L1100 HydrophobicContact CD1-CD2 4.5Å; I999-L1100 HydrophobicContact CG2-CD1 3.99Å
1000	L	93.6	Very high	86	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-63.8	-40.1	178.1	-77.7	165.9	0	0	0	112.9	W992 H996 L997 L998 F1004 I1029 L1035 I1040 W1043	W992-L1000 HydrophobicContact CE3-CD1 4.14Å; W992-L1000 HydrophobicContact CZ3-CD1 3.63Å; H996-L1000 WeakPolarHBondContact O-CB 3.45Å; H996-L1000 WeakPolarHBondContact O-CD1 3.33Å; H996-L1000 VanDerWaalsContact O-CG 3.25Å; H996-L1000 WeakPolarHBondContact O-CG 3.28Å; H996-L1000 PolarHBondContact O-N 3.33Å; L997-L1000 PolarHBondContact O-N 3.1Å; L998-L1000 PolarHBondContact O-N 2.77Å; L1000-F1004 VanDerWaalsContact O-CB 3.27Å; L1000-F1004 WeakPolarHBondContact O-CB 3.32Å; L1000-F1004 PolarHBondContact O-N 2.95Å; L1000-I1029 HydrophobicContact CD2-CG2 3.91Å; L1000-I1029 HydrophobicContact CG-CG2 4.45Å; L1000-L1035 HydrophobicContact CD1-CD1 3.87Å; L1000-I1040 HydrophobicContact CD2-CG1 4.49Å; L1000-I1040 HydrophobicContact CD2-CG2 4.02Å; L1000-W1043 HydrophobicContact CB-CD2 4.24Å; L1000-W1043 HydrophobicContact CB-CE3 4.02Å; L1000-W1043 HydrophobicContact CB-CH2 3.7Å; L1000-W1043 HydrophobicContact CB-CZ2 3.89Å; L1000-W1043 HydrophobicContact CB-CZ3 3.75Å; L1000-W1043 HydrophobicContact CD1-CD2 4.15Å; L1000-W1043 HydrophobicContact CD1-CE3 4.47Å; L1000-W1043 HydrophobicContact CD1-CG 4.32Å; L1000-W1043 HydrophobicContact CD2-CE3 4.03Å; L1000-W1043 HydrophobicContact CD2-CZ3 4.33Å; L1000-W1043 HydrophobicContact CG-CE3 4.41Å; L1000-W1043 WeakPolarHBondContact O-CH2 3.3Å; L1000-W1043 WeakPolarHBondContact O-CZ3 3.46Å
1001	Q	93.2	Very high	87.4	Confident	26 Å²	26	48.8 Å²	48.8	12%	0.121	24%	0.244	C	C	.	.	H	α-helix	trans	-64.4	-42.8	175	-77.4	166.4	95.5	0	0	112	L997 L998 A1005 W1043 F1059 Y1085 L1089	L997-Q1001 VanDerWaalsContact C-NE2 3.28Å; L997-Q1001 WeakPolarHBondContact O-CB 3.45Å; L997-Q1001 VanDerWaalsContact O-CG 3.24Å; L997-Q1001 WeakPolarHBondContact O-CG 3.44Å; L997-Q1001 PolarHBondContact O-N 3.04Å; L997-Q1001 PolarHBondContact O-NE2 2.88Å; L998-Q1001 PolarHBondContact O-N 3.39Å; Q1001-A1005 WeakPolarHBondContact O-CB 3.38Å; Q1001-A1005 PolarHBondContact O-N 3.34Å; Q1001-W1043 HydrophobicContact CG-CH2 4.33Å; Q1001-W1043 HydrophobicContact CG-CZ2 4.21Å; Q1001-F1059 HydrophobicContact CB-CD2 4.3Å; Q1001-F1059 HydrophobicContact CB-CE2 4.35Å; Q1001-F1059 HydrophobicContact CG-CB 4.43Å; Q1001-F1059 HydrophobicContact CG-CD1 3.75Å; Q1001-F1059 HydrophobicContact CG-CD2 3.95Å; Q1001-F1059 HydrophobicContact CG-CE1 3.91Å; Q1001-F1059 HydrophobicContact CG-CE2 4.11Å; Q1001-F1059 HydrophobicContact CG-CG 3.78Å; Q1001-F1059 HydrophobicContact CG-CZ 4.09Å; Q1001-Y1085 PolarHBondContact OE1-OH 3.43Å; Q1001-L1089 HydrophobicContact CB-CD1 4.09Å
1002	A	92.6	Very high	88.4	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-70.6	-42.4	180	0	0	0	0	0	112.3	L998 I999 F1004 A1005 S1006 L1089 L1097	L998-A1002 WeakPolarHBondContact O-CB 3.42Å; L998-A1002 PolarHBondContact O-N 2.67Å; I999-A1002 PolarHBondContact O-N 3.01Å; A1002-F1004 VanDerWaalsContact C-N 3.32Å; A1002-F1004 PolarHBondContact O-N 3.01Å; A1002-A1005 PolarHBondContact O-N 2.84Å; A1002-A1005 VanDerWaalsContact O-N 3.15Å; A1002-S1006 PolarHBondContact O-N 3.04Å; A1002-S1006 PolarHBondContact O-OG 2.67Å; A1002-L1089 HydrophobicContact CB-CB 4.12Å; A1002-L1089 HydrophobicContact CB-CD1 3.55Å; A1002-L1089 HydrophobicContact CB-CG 4.5Å; A1002-L1097 HydrophobicContact CB-CD1 3.24Å; A1002-L1097 HydrophobicContact CB-CD2 4.13Å; A1002-L1097 HydrophobicContact CB-CG 4.32Å
1003	Q	91.4	Very high	88.1	Confident	26 Å²	26	48.7 Å²	48.7	12%	0.121	25%	0.253	C	S	.	.	H	α-helix	trans	-64.3	-36.3	175.8	-71.5	-75.1	-39.2	0	0	111.9	I999 S1006 S1007 L1021 I1029	I999-Q1003 HydrophobicContact CG2-CG 4.23Å; I999-Q1003 VanDerWaalsContact O-CB 3.29Å; I999-Q1003 WeakPolarHBondContact O-CB 3.35Å; I999-Q1003 WeakPolarHBondContact O-CG 3.17Å; I999-Q1003 PolarHBondContact O-N 3Å; Q1003-S1006 WeakPolarHBondContact CA-OG 3.2Å; Q1003-S1006 PolarHBondContact O-OG 3.49Å; Q1003-S1007 PolarHBondContact O-N 3.25Å; Q1003-L1021 HydrophobicContact CB-CD2 4.2Å; Q1003-I1029 HydrophobicContact CB-CD1 3.78Å; Q1003-I1029 HydrophobicContact CG-CD1 3.79Å; Q1003-I1029 HydrophobicContact CG-CG1 4.03Å
1004	F	92.1	Very high	87.4	Confident	7 Å²	7	46.9 Å²	46.9	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-66.4	-44.2	169.5	178.9	-91.7	0	0	0	111.8	L1000 A1002 S1006 S1007 L1008 M1018 W1043 L1044 V1047 L1051 F1059 L1060	L1000-F1004 VanDerWaalsContact O-CB 3.27Å; L1000-F1004 WeakPolarHBondContact O-CB 3.32Å; L1000-F1004 PolarHBondContact O-N 2.95Å; A1002-F1004 VanDerWaalsContact C-N 3.32Å; A1002-F1004 PolarHBondContact O-N 3.01Å; F1004-S1006 VanDerWaalsContact C-N 3.28Å; F1004-S1006 PolarHBondContact O-N 2.97Å; F1004-S1007 PolarHBondContact O-N 3.46Å; F1004-S1007 VanDerWaalsContact O-N 3.09Å; F1004-S1007 PolarHBondContact O-OG 3.23Å; F1004-L1008 HydrophobicContact CE1-CD1 4.24Å; F1004-L1008 HydrophobicContact CE1-CD2 3.93Å; F1004-L1008 HydrophobicContact CE1-CG 4.25Å; F1004-L1008 HydrophobicContact CZ-CD2 3.97Å; F1004-L1008 PolarHBondContact O-N 2.78Å; F1004-M1018 HydrophobicContact CE2-CG 4.37Å; F1004-M1018 HydrophobicContact CE2-SD 4.24Å; F1004-M1018 HydrophobicContact CZ-CG 3.95Å; F1004-M1018 HydrophobicContact CZ-SD 3.9Å; F1004-W1043 HydrophobicContact CB-CH2 4.33Å; F1004-W1043 HydrophobicContact CB-CZ3 4.18Å; F1004-L1044 HydrophobicContact CD2-CD2 3.94Å; F1004-V1047 HydrophobicContact CD1-CG1 4.22Å; F1004-V1047 HydrophobicContact CD2-CG1 3.89Å; F1004-V1047 HydrophobicContact CE1-CG1 3.96Å; F1004-V1047 HydrophobicContact CE2-CG1 3.6Å; F1004-V1047 HydrophobicContact CG-CG1 4.19Å; F1004-V1047 HydrophobicContact CZ-CG1 3.65Å; F1004-L1051 HydrophobicContact CE1-CD1 3.82Å; F1004-L1051 HydrophobicContact CE2-CD1 4.39Å; F1004-L1051 HydrophobicContact CZ-CD1 3.38Å; F1004-F1059 AromaticContact CD1-CE2 3.83Å; F1004-F1059 HydrophobicContact CD1-CE2 3.83Å; F1004-F1059 AromaticContact CD1-CZ 3.83Å; F1004-F1059 HydrophobicContact CD1-CZ 3.83Å; F1004-F1059 HydrophobicContact CE1-CE2 4.37Å; F1004-F1059 HydrophobicContact CE1-CZ 4.32Å; F1004-F1059 HydrophobicContact CG-CZ 4.42Å; F1004-L1060 HydrophobicContact CE1-CD2 3.96Å
1005	A	91.9	Very high	87.1	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.4	-33.9	177.5	0	0	0	0	0	112.6	Q1001 A1002 S1007 L1008 F1070 Y1085 I1086	Q1001-A1005 WeakPolarHBondContact O-CB 3.38Å; Q1001-A1005 PolarHBondContact O-N 3.34Å; A1002-A1005 PolarHBondContact O-N 2.84Å; A1002-A1005 VanDerWaalsContact O-N 3.15Å; A1005-S1007 VanDerWaalsContact C-N 3.33Å; A1005-L1008 PolarHBondContact O-N 3.21Å; A1005-F1070 HydrophobicContact CB-CE1 4.11Å; A1005-Y1085 HydrophobicContact CB-CD1 3.91Å; A1005-Y1085 HydrophobicContact CB-CE1 4.27Å; A1005-I1086 HydrophobicContact CB-CD1 4.15Å; A1005-I1086 HydrophobicContact CB-CG1 3.88Å
1006	S	90.4	Very high	86.9	Confident	65 Å²	65	45 Å²	45	46%	0.455	23%	0.226	S	C	.	.	H	α-helix	trans	-74	-18.6	174.3	51.6	0	0	0	0	114.2	A1002 Q1003 F1004	A1002-S1006 PolarHBondContact O-N 3.04Å; A1002-S1006 PolarHBondContact O-OG 2.67Å; Q1003-S1006 WeakPolarHBondContact CA-OG 3.2Å; Q1003-S1006 PolarHBondContact O-OG 3.49Å; F1004-S1006 VanDerWaalsContact C-N 3.28Å; F1004-S1006 PolarHBondContact O-N 2.97Å
1007	S	89.3	Confident	86.6	Confident	12 Å²	12	45.2 Å²	45.2	8%	0.084	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-2.4	174.9	91.8	0	0	0	0	113.4	Q1003 F1004 A1005 T1019	Q1003-S1007 PolarHBondContact O-N 3.25Å; F1004-S1007 PolarHBondContact O-N 3.46Å; F1004-S1007 VanDerWaalsContact O-N 3.09Å; F1004-S1007 PolarHBondContact O-OG 3.23Å; A1005-S1007 VanDerWaalsContact C-N 3.33Å; S1007-T1019 WeakPolarHBondContact CB-O 3.31Å; S1007-T1019 WeakPolarHBondContact O-CA 3.39Å; S1007-T1019 WeakPolarHBondContact O-CB 3.4Å; S1007-T1019 PolarHBondContact O-N 2.94Å; S1007-T1019 PolarHBondContact O-OG1 3.47Å; S1007-T1019 PolarHBondContact OG-O 3.44Å
1008	L	89.3	Confident	86.1	Confident	12 Å²	12	45.3 Å²	45.3	6%	0.063	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	122.4	168.7	-61.7	175	0	0	0	109.9	F1004 A1005 Y1016 A1017 M1018 L1060 M1063 F1070	F1004-L1008 HydrophobicContact CE1-CD1 4.24Å; F1004-L1008 HydrophobicContact CE1-CD2 3.93Å; F1004-L1008 HydrophobicContact CE1-CG 4.25Å; F1004-L1008 HydrophobicContact CZ-CD2 3.97Å; F1004-L1008 PolarHBondContact O-N 2.78Å; A1005-L1008 PolarHBondContact O-N 3.21Å; L1008-Y1016 HydrophobicContact CB-CD1 4.08Å; L1008-A1017 WeakPolarHBondContact CA-O 3.41Å; L1008-M1018 HydrophobicContact CD2-CB 4.47Å; L1008-M1018 HydrophobicContact CD2-CG 3.81Å; L1008-L1060 HydrophobicContact CD1-CD2 3.79Å; L1008-M1063 HydrophobicContact CD2-SD 4.32Å; L1008-F1070 HydrophobicContact CD1-CE1 3.65Å; L1008-F1070 HydrophobicContact CD1-CZ 3.6Å
1009	R	83.9	Confident	85.6	Confident	160 Å²	160	47.8 Å²	47.8	60%	0.604	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	134.4	172.8	-77.3	-177.1	64.4	-103	-7.3	110.2	A1017 T1019	R1009-A1017 PolarHBondContact N-O 3.48Å; R1009-A1017 PolarHBondContact O-N 3.34Å; R1009-T1019 WeakPolarHBondContact CD-OG1 3.47Å; R1009-T1019 WeakPolarHBondContact CG-OG1 3.45Å
1010	E	85.8	Confident	85	Confident	111 Å²	111	52.3 Å²	52.3	52%	0.519	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	130.1	170.1	-156	164.3	154.4	0	0	109.2	R1015 Y1016	E1010-R1015 CarbonylContact C-O 3.51Å; E1010-R1015 WeakPolarHBondContact CA-O 3.48Å; E1010-Y1016 HydrophobicContact CB-CD1 4.28Å; E1010-Y1016 HydrophobicContact CB-CE1 3.84Å; E1010-Y1016 HydrophobicContact CG-CE1 4.15Å; E1010-Y1016 HydrophobicContact CG-CE2 4.13Å; E1010-Y1016 PolarHBondContact OE2-OH 3.23Å
1011	T	81.8	Confident	84.6	Confident	33 Å²	33	52.5 Å²	52.5	20%	0.202	28%	0.275	C	S	.	.			trans	-88.4	158.2	172.2	73.1	0	0	0	0	109	E1013 G1014 R1015 A1017	T1011-E1013 WeakPolarHBondContact CB-OE2 3.13Å; T1011-E1013 PolarHBondContact O-N 2.85Å; T1011-E1013 PolarHBondContact OG1-OE2 3.28Å; T1011-G1014 PolarHBondContact O-N 3.31Å; T1011-R1015 PolarHBondContact N-O 2.89Å; T1011-R1015 PolarHBondContact OG1-O 2.94Å; T1011-A1017 HydrophobicContact CG2-CB 3.59Å
1012	P	76.2	Confident	84.2	Confident	130 Å²	130	52.3 Å²	52.3	84%	0.844	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-14	-176.9	24.5	-32.8	0	0	0	113.9	G1014	P1012-G1014 VanDerWaalsContact C-N 3.25Å; P1012-G1014 PolarHBondContact O-N 3.11Å
1013	E	71.3	Confident	83.9	Confident	111 Å²	111	57.2 Å²	57.2	52%	0.519	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	10.7	171.3	-42.7	76	-164	0	0	113.5	T1011 R1015 C1066	T1011-E1013 WeakPolarHBondContact CB-OE2 3.13Å; T1011-E1013 PolarHBondContact O-N 2.85Å; T1011-E1013 PolarHBondContact OG1-OE2 3.28Å; E1013-R1015 VanDerWaalsContact C-N 3.28Å; E1013-R1015 PolarHBondContact O-N 3.11Å; E1013-C1066 PolarHBondContact O-SG 3.19Å; E1013-C1066 VanDerWaalsContact O-SG 3.36Å
1014	G	71.4	Confident	83.6	Confident	20 Å²	20	61.4 Å²	61.4	21%	0.206	33%	0.332	C	S	.	.	S	Bend	trans	69.6	19.4	179.2	0	0	0	0	0	114.6	T1011 P1012 C1066	T1011-G1014 PolarHBondContact O-N 3.31Å; P1012-G1014 VanDerWaalsContact C-N 3.25Å; P1012-G1014 PolarHBondContact O-N 3.11Å; G1014-C1066 VanDerWaalsContact O-CA 3.29Å; G1014-C1066 WeakPolarHBondContact O-CA 3.35Å
1015	R	79.7	Confident	83.4	Confident	121 Å²	121	64.9 Å²	64.9	46%	0.457	35%	0.348	S	S	.	.			trans	-102.4	155.3	176	-64.8	-171.7	-67.9	173.8	-2.2	110.3	E1010 T1011 E1013 D1064	E1010-R1015 CarbonylContact C-O 3.51Å; E1010-R1015 WeakPolarHBondContact CA-O 3.48Å; T1011-R1015 PolarHBondContact N-O 2.89Å; T1011-R1015 PolarHBondContact OG1-O 2.94Å; E1013-R1015 VanDerWaalsContact C-N 3.28Å; E1013-R1015 PolarHBondContact O-N 3.11Å; R1015-D1064 VanDerWaalsContact CD-O 3.23Å; R1015-D1064 WeakPolarHBondContact CD-O 3.16Å
1016	Y	84	Confident	83.3	Confident	26 Å²	26	67.4 Å²	67.4	10%	0.102	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	109.7	-179.2	-77.5	-90.8	0	0	0	111.7	L1008 E1010 M1063 P1068 P1082	L1008-Y1016 HydrophobicContact CB-CD1 4.08Å; E1010-Y1016 HydrophobicContact CB-CD1 4.28Å; E1010-Y1016 HydrophobicContact CB-CE1 3.84Å; E1010-Y1016 HydrophobicContact CG-CE1 4.15Å; E1010-Y1016 HydrophobicContact CG-CE2 4.13Å; E1010-Y1016 PolarHBondContact OE2-OH 3.23Å; Y1016-M1063 WeakPolarHBondContact O-CG 3.3Å; Y1016-P1068 HydrophobicContact CD2-CB 4.45Å; Y1016-P1068 HydrophobicContact CD2-CG 3.58Å; Y1016-P1068 HydrophobicContact CE2-CG 3.64Å; Y1016-P1068 HydrophobicContact CG-CG 4.49Å; Y1016-P1082 HydrophobicContact CD1-CG 4.04Å; Y1016-P1082 HydrophobicContact CE1-CG 3.48Å; Y1016-P1082 VanDerWaalsContact CE1-CG 3.48Å
1017	A	83.6	Confident	83.3	Confident	43 Å²	43	66.4 Å²	66.4	36%	0.355	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	137.9	173.6	0	0	0	0	0	111.2	L1008 R1009 T1011 T1019	L1008-A1017 WeakPolarHBondContact CA-O 3.41Å; R1009-A1017 PolarHBondContact N-O 3.48Å; R1009-A1017 PolarHBondContact O-N 3.34Å; T1011-A1017 HydrophobicContact CG2-CB 3.59Å; A1017-T1019 PolarHBondContact O-N 2.64Å
1018	M	82.8	Confident	83.3	Confident	36 Å²	36	68.5 Å²	68.5	18%	0.177	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	102.9	172.4	-64.5	177.7	-71.5	0	0	110.5	F1004 L1008 K1048 L1051 R1052 M1063	F1004-M1018 HydrophobicContact CE2-CG 4.37Å; F1004-M1018 HydrophobicContact CE2-SD 4.24Å; F1004-M1018 HydrophobicContact CZ-CG 3.95Å; F1004-M1018 HydrophobicContact CZ-SD 3.9Å; L1008-M1018 HydrophobicContact CD2-CB 4.47Å; L1008-M1018 HydrophobicContact CD2-CG 3.81Å; M1018-K1048 HydrophobicContact CE-CG 3.76Å; M1018-K1048 HydrophobicContact SD-CB 4.21Å; M1018-K1048 HydrophobicContact SD-CG 3.86Å; M1018-L1051 HydrophobicContact CE-CB 4.47Å; M1018-L1051 HydrophobicContact SD-CB 4.22Å; M1018-L1051 HydrophobicContact SD-CD1 3.63Å; M1018-R1052 HydrophobicContact CE-CG 4.2Å; M1018-M1063 HydrophobicContact CE-CE 3.92Å; M1018-M1063 HydrophobicContact CE-SD 4.47Å; M1018-M1063 HydrophobicContact CG-CE 4.28Å; M1018-M1063 HydrophobicContact CG-SD 3.7Å; M1018-M1063 HydrophobicContact SD-CE 4.24Å; M1018-M1063 HydrophobicContact SD-SD 4.03Å
1019	T	81.3	Confident	83.3	Confident	62 Å²	62	68 Å²	68	38%	0.38	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-76.4	132.1	161.9	-21.1	0	0	0	0	107.8	S1007 R1009 A1017 L1021	S1007-T1019 WeakPolarHBondContact CB-O 3.31Å; S1007-T1019 WeakPolarHBondContact O-CA 3.39Å; S1007-T1019 WeakPolarHBondContact O-CB 3.4Å; S1007-T1019 PolarHBondContact O-N 2.94Å; S1007-T1019 PolarHBondContact O-OG1 3.47Å; S1007-T1019 PolarHBondContact OG-O 3.44Å; R1009-T1019 WeakPolarHBondContact CD-OG1 3.47Å; R1009-T1019 WeakPolarHBondContact CG-OG1 3.45Å; A1017-T1019 PolarHBondContact O-N 2.64Å; T1019-L1021 PolarHBondContact O-N 2.95Å
1020	D	79.2	Confident	83.7	Confident	96 Å²	96	62.1 Å²	62.1	51%	0.513	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-73	124.4	178.4	-79.5	-47.7	0	0	0	110.7	G1022 K1048	D1020-G1022 PolarHBondContact O-N 3.14Å; D1020-K1048 IonicContact OD1-NZ 3.46Å; D1020-K1048 PolarHBondContact OD1-NZ 3.36Å; D1020-K1048 IonicContact OD2-NZ 2.91Å; D1020-K1048 PolarHBondContact OD2-NZ 3.27Å
1021	L	84.9	Confident	83.8	Confident	5 Å²	5	61.8 Å²	61.8	3%	0.026	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-48.1	126.2	171.3	-85.4	141.5	0	0	0	110.6	Q1003 T1019 E1025 R1026 I1029 L1044	Q1003-L1021 HydrophobicContact CB-CD2 4.2Å; T1019-L1021 PolarHBondContact O-N 2.95Å; L1021-E1025 WeakPolarHBondContact CA-OE2 3.38Å; L1021-E1025 HydrophobicContact CD2-CB 3.77Å; L1021-E1025 HydrophobicContact CD2-CG 4.47Å; L1021-R1026 HydrophobicContact CB-CG 4.25Å; L1021-R1026 VanDerWaalsContact O-CZ 3.22Å; L1021-R1026 PolarHBondContact O-NE 3.22Å; L1021-R1026 PolarHBondContact O-NH2 2.72Å; L1021-I1029 HydrophobicContact CD2-CD1 4.44Å; L1021-L1044 HydrophobicContact CB-CD1 4.13Å; L1021-L1044 HydrophobicContact CD1-CD1 3.84Å; L1021-L1044 HydrophobicContact CD1-CD2 3.48Å; L1021-L1044 VanDerWaalsContact CD1-CD2 3.48Å; L1021-L1044 HydrophobicContact CD1-CG 4.31Å
1022	G	84.9	Confident	84	Confident	23 Å²	23	63.3 Å²	63.3	24%	0.237	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-67.3	160.2	-176.9	0	0	0	0	0	112.8	D1020 Q1024 E1025 R1026	D1020-G1022 PolarHBondContact O-N 3.14Å; G1022-Q1024 PolarHBondContact O-N 3.18Å; G1022-E1025 PolarHBondContact N-OE2 3.45Å; G1022-E1025 PolarHBondContact O-N 3.07Å; G1022-R1026 WeakPolarHBondContact O-CG 3.36Å; G1022-R1026 PolarHBondContact O-N 3.11Å; G1022-R1026 VanDerWaalsContact O-N 3.11Å
1023	P	86.2	Confident	84.6	Confident	102 Å²	102	57.6 Å²	57.6	66%	0.662	30%	0.301	S	S	*	.	H	α-helix	trans	-54.3	-39.5	177.5	-26.6	35.3	0	0	0	112.9	R1026 V1027	P1023-R1026 PolarHBondContact O-N 2.8Å; P1023-V1027 VanDerWaalsContact O-CG2 3.32Å; P1023-V1027 WeakPolarHBondContact O-CG2 3.37Å; P1023-V1027 PolarHBondContact O-N 2.79Å
1024	Q	85.9	Confident	85.5	Confident	115 Å²	115	55.7 Å²	55.7	54%	0.537	31%	0.311	S	S	.	.	H	α-helix	trans	-64.7	-41.6	179.6	-169.9	64.9	21.1	0	0	112.9	G1022 V1027 H1028	G1022-Q1024 PolarHBondContact O-N 3.18Å; Q1024-V1027 WeakPolarHBondContact O-CB 3.3Å; Q1024-V1027 PolarHBondContact O-N 3.36Å; Q1024-H1028 PolarHBondContact NE2-NE2 2.91Å; Q1024-H1028 PolarHBondContact O-N 2.93Å
1025	E	86.6	Confident	86.5	Confident	80 Å²	80	56.1 Å²	56.1	37%	0.374	31%	0.308	S	S	.	.	H	α-helix	trans	-67	-43.8	178.8	-60.3	172.1	133.1	0	0	110.4	L1021 G1022 V1027 H1028 I1029	L1021-E1025 WeakPolarHBondContact CA-OE2 3.38Å; L1021-E1025 HydrophobicContact CD2-CB 3.77Å; L1021-E1025 HydrophobicContact CD2-CG 4.47Å; G1022-E1025 PolarHBondContact N-OE2 3.45Å; G1022-E1025 PolarHBondContact O-N 3.07Å; E1025-V1027 VanDerWaalsContact C-N 3.27Å; E1025-V1027 PolarHBondContact O-N 3.13Å; E1025-H1028 PolarHBondContact O-N 2.82Å; E1025-H1028 VanDerWaalsContact O-N 3.14Å; E1025-I1029 WeakPolarHBondContact O-CG1 3.36Å; E1025-I1029 PolarHBondContact O-N 3.36Å
1026	R	90.8	Very high	87.1	Confident	53 Å²	53	52.6 Å²	52.6	20%	0.2	30%	0.302	C	S	.	.	H	α-helix	trans	-60.7	-36.1	172	-61	-178.1	-150.6	-170.3	6.8	111.8	L1021 G1022 P1023 I1029 C1030 M1037 I1040 S1041 L1044	L1021-R1026 HydrophobicContact CB-CG 4.25Å; L1021-R1026 VanDerWaalsContact O-CZ 3.22Å; L1021-R1026 PolarHBondContact O-NE 3.22Å; L1021-R1026 PolarHBondContact O-NH2 2.72Å; G1022-R1026 WeakPolarHBondContact O-CG 3.36Å; G1022-R1026 PolarHBondContact O-N 3.11Å; G1022-R1026 VanDerWaalsContact O-N 3.11Å; P1023-R1026 PolarHBondContact O-N 2.8Å; R1026-I1029 PolarHBondContact O-N 3.12Å; R1026-C1030 WeakPolarHBondContact O-CB 3.34Å; R1026-C1030 PolarHBondContact O-N 2.72Å; R1026-M1037 HydrophobicContact CB-CE 3.7Å; R1026-M1037 HydrophobicContact CB-SD 3.56Å; R1026-M1037 VanDerWaalsContact CB-SD 3.56Å; R1026-I1040 HydrophobicContact CB-CG2 4.34Å; R1026-I1040 HydrophobicContact CG-CG2 4.17Å; R1026-S1041 PolarHBondContact NH1-OG 3.24Å; R1026-L1044 HydrophobicContact CG-CD1 4.3Å
1027	V	90.8	Very high	87.4	Confident	43 Å²	43	54.3 Å²	54.3	26%	0.261	31%	0.312	S	S	.	.	H	α-helix	trans	-67.1	-39.1	173.9	165.4	0	0	0	0	111.8	P1023 Q1024 E1025 C1030 K1031 M1037	P1023-V1027 VanDerWaalsContact O-CG2 3.32Å; P1023-V1027 WeakPolarHBondContact O-CG2 3.37Å; P1023-V1027 PolarHBondContact O-N 2.79Å; Q1024-V1027 WeakPolarHBondContact O-CB 3.3Å; Q1024-V1027 PolarHBondContact O-N 3.36Å; E1025-V1027 VanDerWaalsContact C-N 3.27Å; E1025-V1027 PolarHBondContact O-N 3.13Å; V1027-C1030 WeakPolarHBondContact O-CB 3.44Å; V1027-C1030 PolarHBondContact O-N 2.71Å; V1027-K1031 HydrophobicContact CG1-CD 4.32Å; V1027-K1031 WeakPolarHBondContact O-CG 3.35Å; V1027-K1031 PolarHBondContact O-N 3.03Å; V1027-M1037 HydrophobicContact CB-SD 4.35Å; V1027-M1037 HydrophobicContact CG2-CE 3.82Å; V1027-M1037 HydrophobicContact CG2-CG 4.49Å; V1027-M1037 HydrophobicContact CG2-SD 3.63Å; V1027-M1037 PolarHBondContact N-SD 3.07Å; V1027-M1037 VanDerWaalsContact N-SD 3.45Å
1028	H	87.9	Confident	87.8	Confident	57 Å²	57	56.5 Å²	56.5	26%	0.264	32%	0.321	S	S	.	.	H	α-helix	trans	-64	-44.7	174	-64.2	164.2	0	0	0	111.6	Q1024 E1025 C1030 K1031 F1032	Q1024-H1028 PolarHBondContact NE2-NE2 2.91Å; Q1024-H1028 PolarHBondContact O-N 2.93Å; E1025-H1028 PolarHBondContact O-N 2.82Å; E1025-H1028 VanDerWaalsContact O-N 3.14Å; H1028-C1030 VanDerWaalsContact C-N 3.33Å; H1028-C1030 PolarHBondContact O-N 3.12Å; H1028-K1031 PolarHBondContact O-N 3.48Å; H1028-F1032 PolarHBondContact O-N 2.82Å
1029	I	90.4	Very high	88.3	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-61.5	-42.9	174	-61.2	162.6	0	0	0	110.4	L1000 Q1003 L1021 E1025 R1026 K1031 F1032 T1033 I1040	L1000-I1029 HydrophobicContact CD2-CG2 3.91Å; L1000-I1029 HydrophobicContact CG-CG2 4.45Å; Q1003-I1029 HydrophobicContact CB-CD1 3.78Å; Q1003-I1029 HydrophobicContact CG-CD1 3.79Å; Q1003-I1029 HydrophobicContact CG-CG1 4.03Å; L1021-I1029 HydrophobicContact CD2-CD1 4.44Å; E1025-I1029 WeakPolarHBondContact O-CG1 3.36Å; E1025-I1029 PolarHBondContact O-N 3.36Å; R1026-I1029 PolarHBondContact O-N 3.12Å; I1029-K1031 PolarHBondContact O-N 2.82Å; I1029-F1032 PolarHBondContact O-N 2.74Å; I1029-T1033 HydrophobicContact CG2-CG2 4.07Å; I1029-T1033 WeakPolarHBondContact O-CB 3.49Å; I1029-T1033 PolarHBondContact O-N 3.12Å; I1029-T1033 PolarHBondContact O-OG1 2.97Å; I1029-I1040 HydrophobicContact CB-CD1 4.08Å; I1029-I1040 HydrophobicContact CG2-CD1 3.77Å; I1029-I1040 HydrophobicContact CG2-CG1 4.21Å
1030	C	91.3	Very high	88.9	Confident	35 Å²	35	54.3 Å²	54.3	24%	0.236	31%	0.31	C	S	.	.	H	α-helix	trans	-58.6	-46	177.2	-178.9	0	0	0	0	112	R1026 V1027 H1028 G1034 L1035 M1037 I1040	R1026-C1030 WeakPolarHBondContact O-CB 3.34Å; R1026-C1030 PolarHBondContact O-N 2.72Å; V1027-C1030 WeakPolarHBondContact O-CB 3.44Å; V1027-C1030 PolarHBondContact O-N 2.71Å; H1028-C1030 VanDerWaalsContact C-N 3.33Å; H1028-C1030 PolarHBondContact O-N 3.12Å; C1030-G1034 WeakPolarHBondContact O-CA 3.44Å; C1030-G1034 PolarHBondContact O-N 3.13Å; C1030-L1035 VanDerWaalsContact CA-O 3.31Å; C1030-L1035 WeakPolarHBondContact CA-O 3.49Å; C1030-L1035 WeakPolarHBondContact CB-O 3.2Å; C1030-L1035 PolarHBondContact SG-O 3.2Å; C1030-M1037 HydrophobicContact CB-CG 4.37Å; C1030-M1037 HydrophobicContact CB-SD 4.22Å; C1030-I1040 HydrophobicContact CB-CD1 3.83Å
1031	K	88.4	Confident	89.5	Confident	105 Å²	105	51.2 Å²	51.2	46%	0.457	30%	0.295	S	S	.	.	H	α-helix	trans	-64.9	-41	177.9	-72.7	175.6	-177.7	-180	0	112.7	V1027 H1028 I1029 S1104	V1027-K1031 HydrophobicContact CG1-CD 4.32Å; V1027-K1031 WeakPolarHBondContact O-CG 3.35Å; V1027-K1031 PolarHBondContact O-N 3.03Å; H1028-K1031 PolarHBondContact O-N 3.48Å; I1029-K1031 PolarHBondContact O-N 2.82Å; K1031-S1104 VanDerWaalsContact CB-OG 3.3Å; K1031-S1104 WeakPolarHBondContact CB-OG 3.36Å; K1031-S1104 VanDerWaalsContact CD-OG 3.24Å; K1031-S1104 WeakPolarHBondContact CD-OG 3.34Å
1032	F	86.7	Confident	90	Very high	65 Å²	65	57.4 Å²	57.4	29%	0.285	32%	0.324	S	S	.	.	H	α-helix	trans	-78.5	-39.9	-177	-170.2	-84.9	0	0	0	113.3	I999 H1028 I1029 F1095 L1100 L1103	I999-F1032 HydrophobicContact CD1-CD1 3.65Å; I999-F1032 HydrophobicContact CD1-CE1 3.47Å; I999-F1032 VanDerWaalsContact CD1-CE1 3.47Å; H1028-F1032 PolarHBondContact O-N 2.82Å; I1029-F1032 PolarHBondContact O-N 2.74Å; F1032-F1095 AromaticContact CE1-CZ 3.9Å; F1032-F1095 HydrophobicContact CE1-CZ 3.9Å; F1032-F1095 HydrophobicContact CE2-CZ 4.4Å; F1032-F1095 HydrophobicContact CZ-CE1 4.04Å; F1032-F1095 HydrophobicContact CZ-CE2 4.12Å; F1032-F1095 AromaticContact CZ-CZ 3.52Å; F1032-F1095 HydrophobicContact CZ-CZ 3.52Å; F1032-L1100 HydrophobicContact CB-CD2 4.16Å; F1032-L1100 HydrophobicContact CD1-CD2 3.67Å; F1032-L1100 HydrophobicContact CD2-CD2 3.41Å; F1032-L1100 VanDerWaalsContact CD2-CD2 3.41Å; F1032-L1100 HydrophobicContact CE1-CD2 3.85Å; F1032-L1100 HydrophobicContact CE2-CD2 3.59Å; F1032-L1100 HydrophobicContact CG-CD2 3.45Å; F1032-L1100 VanDerWaalsContact CG-CD2 3.45Å; F1032-L1100 HydrophobicContact CZ-CD2 3.81Å; F1032-L1103 HydrophobicContact CD2-CB 4.36Å; F1032-L1103 HydrophobicContact CE2-CB 4.02Å; F1032-L1103 HydrophobicContact CE2-CD1 4.11Å
1033	T	89.2	Confident	90.4	Very high	9 Å²	9	58.2 Å²	58.2	6%	0.055	32%	0.32	C	S	.	.	H	α-helix	trans	-96.5	-8.8	-173.4	64	0	0	0	0	114.1	H996 I999 I1029 L1035	H996-T1033 HydrophobicContact CB-CG2 4.02Å; H996-T1033 PolarHBondContact CE1-O 2.88Å; H996-T1033 PolarHBondContact ND1-O 3.25Å; I999-T1033 HydrophobicContact CD1-CG2 4.23Å; I999-T1033 HydrophobicContact CG2-CG2 4.39Å; I1029-T1033 HydrophobicContact CG2-CG2 4.07Å; I1029-T1033 WeakPolarHBondContact O-CB 3.49Å; I1029-T1033 PolarHBondContact O-N 3.12Å; I1029-T1033 PolarHBondContact O-OG1 2.97Å; T1033-L1035 HydrophobicContact CG2-CD1 4.47Å; T1033-L1035 PolarHBondContact O-N 3.48Å; T1033-L1035 WeakPolarHBondContact OG1-CB 3.31Å; T1033-L1035 WeakPolarHBondContact OG1-CD1 3.26Å; T1033-L1035 WeakPolarHBondContact OG1-CG 3.44Å; T1033-L1035 PolarHBondContact OG1-N 2.8Å
1034	G	89.8	Confident	90.7	Very high	71 Å²	71	54 Å²	54	73%	0.732	29%	0.292	S	S	*	.			trans	65.4	1.8	-171.4	0	0	0	0	0	114.7	C1030	C1030-G1034 WeakPolarHBondContact O-CA 3.44Å; C1030-G1034 PolarHBondContact O-N 3.13Å
1035	L	91.9	Very high	91	Very high	29 Å²	29	51.2 Å²	51.2	15%	0.152	29%	0.289	C	S	.	.			trans	-75.6	131.8	178.8	-63.1	170.6	0	0	0	110	W992 H996 L1000 C1030 T1033 I1040	W992-L1035 HydrophobicContact CE3-CD1 3.93Å; W992-L1035 HydrophobicContact CE3-CD2 4.1Å; W992-L1035 HydrophobicContact CH2-CD1 4.48Å; W992-L1035 HydrophobicContact CH2-CD2 4.41Å; W992-L1035 HydrophobicContact CZ3-CD1 3.53Å; W992-L1035 HydrophobicContact CZ3-CD2 3.94Å; W992-L1035 HydrophobicContact CZ3-CG 4.37Å; H996-L1035 HydrophobicContact CB-CD1 4.09Å; L1000-L1035 HydrophobicContact CD1-CD1 3.87Å; C1030-L1035 VanDerWaalsContact CA-O 3.31Å; C1030-L1035 WeakPolarHBondContact CA-O 3.49Å; C1030-L1035 WeakPolarHBondContact CB-O 3.2Å; C1030-L1035 PolarHBondContact SG-O 3.2Å; T1033-L1035 HydrophobicContact CG2-CD1 4.47Å; T1033-L1035 PolarHBondContact O-N 3.48Å; T1033-L1035 WeakPolarHBondContact OG1-CB 3.31Å; T1033-L1035 WeakPolarHBondContact OG1-CD1 3.26Å; T1033-L1035 WeakPolarHBondContact OG1-CG 3.44Å; T1033-L1035 PolarHBondContact OG1-N 2.8Å; L1035-I1040 HydrophobicContact CB-CD1 4.12Å; L1035-I1040 HydrophobicContact CB-CG1 3.85Å; L1035-I1040 WeakPolarHBondContact O-CD1 3.38Å
1036	S	91.9	Very high	91.3	Very high	47 Å²	47	52.1 Å²	52.1	33%	0.329	30%	0.296	S	S	.	.			trans	-63.2	149.9	178.2	74.9	0	0	0	0	112.3	T1038 T1039 I1040	S1036-T1038 PolarHBondContact O-N 3.35Å; S1036-T1038 VanDerWaalsContact O-N 3.12Å; S1036-T1038 PolarHBondContact OG-OG1 3.04Å; S1036-T1039 PolarHBondContact O-N 3.38Å; S1036-T1039 PolarHBondContact OG-N 3.49Å; S1036-T1039 VanDerWaalsContact OG-N 3.12Å; S1036-T1039 PolarHBondContact OG-OG1 3.23Å; S1036-I1040 WeakPolarHBondContact O-CG1 3.42Å; S1036-I1040 PolarHBondContact O-N 2.95Å
1037	M	91.4	Very high	91.4	Very high	63 Å²	63	50.1 Å²	50.1	31%	0.31	29%	0.29	S	S	.	.	H	α-helix	trans	-48.3	-38.2	171.9	-74.4	-69.5	-73.5	0	0	113.4	R1026 V1027 C1030 S1041	R1026-M1037 HydrophobicContact CB-CE 3.7Å; R1026-M1037 HydrophobicContact CB-SD 3.56Å; R1026-M1037 VanDerWaalsContact CB-SD 3.56Å; V1027-M1037 HydrophobicContact CB-SD 4.35Å; V1027-M1037 HydrophobicContact CG2-CE 3.82Å; V1027-M1037 HydrophobicContact CG2-CG 4.49Å; V1027-M1037 HydrophobicContact CG2-SD 3.63Å; V1027-M1037 PolarHBondContact N-SD 3.07Å; V1027-M1037 VanDerWaalsContact N-SD 3.45Å; C1030-M1037 HydrophobicContact CB-CG 4.37Å; C1030-M1037 HydrophobicContact CB-SD 4.22Å; M1037-S1041 VanDerWaalsContact O-CB 3.26Å; M1037-S1041 WeakPolarHBondContact O-CB 3.46Å; M1037-S1041 PolarHBondContact O-N 3.14Å; M1037-S1041 PolarHBondContact O-OG 2.89Å
1038	T	92.1	Very high	91.3	Very high	88 Å²	88	50.2 Å²	50.2	54%	0.54	29%	0.287	S	S	.	.	H	α-helix	trans	-68.2	-42.5	175.6	47.2	0	0	0	0	112.1	S1036 S1041 H1042	S1036-T1038 PolarHBondContact O-N 3.35Å; S1036-T1038 VanDerWaalsContact O-N 3.12Å; S1036-T1038 PolarHBondContact OG-OG1 3.04Å; T1038-S1041 PolarHBondContact O-N 3.48Å; T1038-H1042 WeakPolarHBondContact O-CB 3.19Å; T1038-H1042 PolarHBondContact O-N 2.89Å; T1038-H1042 PolarHBondContact O-ND1 3.2Å
1039	T	93.5	Very high	91.5	Very high	52 Å²	52	53.3 Å²	53.3	32%	0.319	30%	0.297	S	S	.	.	H	α-helix	trans	-70.1	-38.7	179.9	-43.2	0	0	0	0	111.6	W992 S1036 H1042 W1043	W992-T1039 HydrophobicContact CH2-CG2 3.51Å; W992-T1039 HydrophobicContact CZ2-CG2 3.51Å; S1036-T1039 PolarHBondContact O-N 3.38Å; S1036-T1039 PolarHBondContact OG-N 3.49Å; S1036-T1039 VanDerWaalsContact OG-N 3.12Å; S1036-T1039 PolarHBondContact OG-OG1 3.23Å; T1039-H1042 PolarHBondContact O-N 3.1Å; T1039-W1043 PolarHBondContact O-N 3.4Å
1040	I	93	Very high	91.5	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61	-47.7	171.2	-65.1	162.6	0	0	0	110.1	L1000 R1026 I1029 C1030 L1035 S1036 H1042 W1043 L1044	L1000-I1040 HydrophobicContact CD2-CG1 4.49Å; L1000-I1040 HydrophobicContact CD2-CG2 4.02Å; R1026-I1040 HydrophobicContact CB-CG2 4.34Å; R1026-I1040 HydrophobicContact CG-CG2 4.17Å; I1029-I1040 HydrophobicContact CB-CD1 4.08Å; I1029-I1040 HydrophobicContact CG2-CD1 3.77Å; I1029-I1040 HydrophobicContact CG2-CG1 4.21Å; C1030-I1040 HydrophobicContact CB-CD1 3.83Å; L1035-I1040 HydrophobicContact CB-CD1 4.12Å; L1035-I1040 HydrophobicContact CB-CG1 3.85Å; L1035-I1040 WeakPolarHBondContact O-CD1 3.38Å; S1036-I1040 WeakPolarHBondContact O-CG1 3.42Å; S1036-I1040 PolarHBondContact O-N 2.95Å; I1040-H1042 PolarHBondContact O-N 2.83Å; I1040-W1043 PolarHBondContact O-N 3.1Å; I1040-L1044 HydrophobicContact CG2-CD1 4.07Å; I1040-L1044 WeakPolarHBondContact O-CG 3.44Å; I1040-L1044 PolarHBondContact O-N 3.14Å
1041	S	92.7	Very high	91.4	Very high	31 Å²	31	55 Å²	55	22%	0.217	30%	0.301	C	S	.	.	H	α-helix	trans	-66.5	-35.6	-179.5	-59.5	0	0	0	0	112.7	R1026 M1037 T1038 L1044 A1045	R1026-S1041 PolarHBondContact NH1-OG 3.24Å; M1037-S1041 VanDerWaalsContact O-CB 3.26Å; M1037-S1041 WeakPolarHBondContact O-CB 3.46Å; M1037-S1041 PolarHBondContact O-N 3.14Å; M1037-S1041 PolarHBondContact O-OG 2.89Å; T1038-S1041 PolarHBondContact O-N 3.48Å; S1041-L1044 PolarHBondContact O-N 2.97Å; S1041-A1045 VanDerWaalsContact O-CB 3.3Å; S1041-A1045 WeakPolarHBondContact O-CB 3.25Å; S1041-A1045 PolarHBondContact O-N 3.12Å
1042	H	93.7	Very high	91.4	Very high	136 Å²	136	59 Å²	59	63%	0.63	31%	0.314	S	S	*	.	H	α-helix	trans	-67.3	-37.1	172.1	-68.2	158.8	0	0	0	112.8	T1038 T1039 I1040 N1046	T1038-H1042 WeakPolarHBondContact O-CB 3.19Å; T1038-H1042 PolarHBondContact O-N 2.89Å; T1038-H1042 PolarHBondContact O-ND1 3.2Å; T1039-H1042 PolarHBondContact O-N 3.1Å; I1040-H1042 PolarHBondContact O-N 2.83Å; H1042-N1046 WeakPolarHBondContact O-CB 3.34Å; H1042-N1046 PolarHBondContact O-N 3.07Å
1043	W	94.2	Very high	91.4	Very high	39 Å²	39	64.5 Å²	64.5	15%	0.148	33%	0.332	C	S	.	.	H	α-helix	trans	-63.9	-47.3	173.6	-177.5	93.7	0	0	0	111	W992 L1000 Q1001 F1004 T1039 I1040 A1045 N1046 V1047 F1059	W992-W1043 HydrophobicContact CH2-CB 4.11Å; W992-W1043 HydrophobicContact CH2-CG 4.46Å; L1000-W1043 HydrophobicContact CB-CD2 4.24Å; L1000-W1043 HydrophobicContact CB-CE3 4.02Å; L1000-W1043 HydrophobicContact CB-CH2 3.7Å; L1000-W1043 HydrophobicContact CB-CZ2 3.89Å; L1000-W1043 HydrophobicContact CB-CZ3 3.75Å; L1000-W1043 HydrophobicContact CD1-CD2 4.15Å; L1000-W1043 HydrophobicContact CD1-CE3 4.47Å; L1000-W1043 HydrophobicContact CD1-CG 4.32Å; L1000-W1043 HydrophobicContact CD2-CE3 4.03Å; L1000-W1043 HydrophobicContact CD2-CZ3 4.33Å; L1000-W1043 HydrophobicContact CG-CE3 4.41Å; L1000-W1043 WeakPolarHBondContact O-CH2 3.3Å; L1000-W1043 WeakPolarHBondContact O-CZ3 3.46Å; Q1001-W1043 HydrophobicContact CG-CH2 4.33Å; Q1001-W1043 HydrophobicContact CG-CZ2 4.21Å; F1004-W1043 HydrophobicContact CB-CH2 4.33Å; F1004-W1043 HydrophobicContact CB-CZ3 4.18Å; T1039-W1043 PolarHBondContact O-N 3.4Å; I1040-W1043 PolarHBondContact O-N 3.1Å; W1043-A1045 PolarHBondContact O-N 2.93Å; W1043-N1046 PolarHBondContact O-N 3.33Å; W1043-V1047 HydrophobicContact CD2-CG2 4.06Å; W1043-V1047 HydrophobicContact CE3-CG2 4.12Å; W1043-V1047 HydrophobicContact CH2-CG2 3.86Å; W1043-V1047 HydrophobicContact CZ2-CG2 3.81Å; W1043-V1047 HydrophobicContact CZ3-CG2 4.02Å; W1043-V1047 WeakPolarHBondContact O-CG2 3.33Å; W1043-V1047 PolarHBondContact O-N 2.77Å; W1043-F1059 HydrophobicContact CH2-CE1 4.27Å; W1043-F1059 HydrophobicContact CH2-CZ 4.18Å; W1043-F1059 HydrophobicContact CZ2-CE1 4.21Å
1044	L	92.6	Very high	91.2	Very high	14 Å²	14	68.3 Å²	68.3	7%	0.073	36%	0.356	C	S	.	.	H	α-helix	trans	-60.8	-44.4	175.9	-71	171.2	0	0	0	112.3	F1004 L1021 R1026 I1040 S1041 N1046 V1047 K1048	F1004-L1044 HydrophobicContact CD2-CD2 3.94Å; L1021-L1044 HydrophobicContact CB-CD1 4.13Å; L1021-L1044 HydrophobicContact CD1-CD1 3.84Å; L1021-L1044 HydrophobicContact CD1-CD2 3.48Å; L1021-L1044 VanDerWaalsContact CD1-CD2 3.48Å; L1021-L1044 HydrophobicContact CD1-CG 4.31Å; R1026-L1044 HydrophobicContact CG-CD1 4.3Å; I1040-L1044 HydrophobicContact CG2-CD1 4.07Å; I1040-L1044 WeakPolarHBondContact O-CG 3.44Å; I1040-L1044 PolarHBondContact O-N 3.14Å; S1041-L1044 PolarHBondContact O-N 2.97Å; L1044-N1046 VanDerWaalsContact C-N 3.31Å; L1044-N1046 PolarHBondContact O-N 3.41Å; L1044-V1047 PolarHBondContact O-N 2.97Å; L1044-K1048 VanDerWaalsContact O-CB 3.24Å; L1044-K1048 WeakPolarHBondContact O-CB 3.31Å; L1044-K1048 PolarHBondContact O-N 3.17Å
1045	A	92.1	Very high	90.8	Very high	57 Å²	57	66.3 Å²	66.3	47%	0.471	34%	0.335	S	S	.	.	H	α-helix	trans	-61.2	-39.8	176.5	0	0	0	0	0	112.1	S1041 W1043 Y1049	S1041-A1045 VanDerWaalsContact O-CB 3.3Å; S1041-A1045 WeakPolarHBondContact O-CB 3.25Å; S1041-A1045 PolarHBondContact O-N 3.12Å; W1043-A1045 PolarHBondContact O-N 2.93Å; A1045-Y1049 WeakPolarHBondContact O-CB 3.27Å; A1045-Y1049 PolarHBondContact O-N 3.06Å
1046	N	93.1	Very high	90.6	Very high	99 Å²	99	65.4 Å²	65.4	53%	0.529	33%	0.332	S	S	.	.	H	α-helix	trans	-66.4	-45.9	175.9	-169.9	-21.6	0	0	0	111.6	H1042 W1043 L1044 K1048 Y1049 Q1050	H1042-N1046 WeakPolarHBondContact O-CB 3.34Å; H1042-N1046 PolarHBondContact O-N 3.07Å; W1043-N1046 PolarHBondContact O-N 3.33Å; L1044-N1046 VanDerWaalsContact C-N 3.31Å; L1044-N1046 PolarHBondContact O-N 3.41Å; N1046-K1048 PolarHBondContact O-N 3.29Å; N1046-Y1049 PolarHBondContact O-N 3.5Å; N1046-Q1050 WeakPolarHBondContact O-CB 3.46Å; N1046-Q1050 VanDerWaalsContact O-CG 3.32Å; N1046-Q1050 WeakPolarHBondContact O-CG 3.39Å; N1046-Q1050 PolarHBondContact O-N 3.47Å
1047	V	92.6	Very high	90.6	Very high	11 Å²	11	64.1 Å²	64.1	7%	0.067	32%	0.323	C	S	.	.	H	α-helix	trans	-57.7	-48.9	173.8	165.3	0	0	0	0	111.4	F1004 W1043 L1044 Y1049 Q1050 L1051 T1057 F1059	F1004-V1047 HydrophobicContact CD1-CG1 4.22Å; F1004-V1047 HydrophobicContact CD2-CG1 3.89Å; F1004-V1047 HydrophobicContact CE1-CG1 3.96Å; F1004-V1047 HydrophobicContact CE2-CG1 3.6Å; F1004-V1047 HydrophobicContact CG-CG1 4.19Å; F1004-V1047 HydrophobicContact CZ-CG1 3.65Å; W1043-V1047 HydrophobicContact CD2-CG2 4.06Å; W1043-V1047 HydrophobicContact CE3-CG2 4.12Å; W1043-V1047 HydrophobicContact CH2-CG2 3.86Å; W1043-V1047 HydrophobicContact CZ2-CG2 3.81Å; W1043-V1047 HydrophobicContact CZ3-CG2 4.02Å; W1043-V1047 WeakPolarHBondContact O-CG2 3.33Å; W1043-V1047 PolarHBondContact O-N 2.77Å; L1044-V1047 PolarHBondContact O-N 2.97Å; V1047-Y1049 VanDerWaalsContact C-N 3.33Å; V1047-Y1049 PolarHBondContact O-N 2.87Å; V1047-Q1050 PolarHBondContact O-N 2.81Å; V1047-L1051 HydrophobicContact CG1-CD1 3.87Å; V1047-L1051 WeakPolarHBondContact O-CG 3.21Å; V1047-L1051 PolarHBondContact O-N 3.07Å; V1047-T1057 HydrophobicContact CG1-CG2 4.12Å; V1047-F1059 HydrophobicContact CG1-CE1 4.38Å; V1047-F1059 HydrophobicContact CG1-CZ 4.01Å; V1047-F1059 HydrophobicContact CG2-CE1 4.11Å; V1047-F1059 HydrophobicContact CG2-CZ 4.43Å
1048	K	89.7	Confident	90.5	Very high	45 Å²	45	70 Å²	70	20%	0.196	35%	0.346	C	S	.	.	H	α-helix	trans	-61.9	-37.4	178.1	-171.4	170.6	-167.4	174.7	0	112.6	M1018 D1020 L1044 N1046 R1052	M1018-K1048 HydrophobicContact CE-CG 3.76Å; M1018-K1048 HydrophobicContact SD-CB 4.21Å; M1018-K1048 HydrophobicContact SD-CG 3.86Å; D1020-K1048 IonicContact OD1-NZ 3.46Å; D1020-K1048 PolarHBondContact OD1-NZ 3.36Å; D1020-K1048 IonicContact OD2-NZ 2.91Å; D1020-K1048 PolarHBondContact OD2-NZ 3.27Å; L1044-K1048 VanDerWaalsContact O-CB 3.24Å; L1044-K1048 WeakPolarHBondContact O-CB 3.31Å; L1044-K1048 PolarHBondContact O-N 3.17Å; N1046-K1048 PolarHBondContact O-N 3.29Å; K1048-R1052 WeakPolarHBondContact O-CG 3.32Å; K1048-R1052 PolarHBondContact O-N 3.47Å; K1048-R1052 VanDerWaalsContact O-N 3.16Å
1049	Y	91.5	Very high	90.6	Very high	122 Å²	122	66.3 Å²	66.3	48%	0.478	32%	0.323	S	S	.	.	H	α-helix	trans	-69.5	-46.5	175.6	-178.9	-94.7	0	0	0	112.3	A1045 N1046 V1047 L1051 R1052 R1053	A1045-Y1049 WeakPolarHBondContact O-CB 3.27Å; A1045-Y1049 PolarHBondContact O-N 3.06Å; N1046-Y1049 PolarHBondContact O-N 3.5Å; V1047-Y1049 VanDerWaalsContact C-N 3.33Å; V1047-Y1049 PolarHBondContact O-N 2.87Å; Y1049-L1051 PolarHBondContact O-N 3.35Å; Y1049-R1052 PolarHBondContact O-N 2.97Å; Y1049-R1053 WeakPolarHBondContact O-CB 3.46Å; Y1049-R1053 PolarHBondContact O-N 2.91Å; Y1049-R1053 WeakPolarHBondContact OH-CD 3.33Å; Y1049-R1053 PolarHBondContact OH-NH1 3.34Å
1050	Q	89.9	Confident	90.5	Very high	73 Å²	73	63.9 Å²	63.9	34%	0.341	31%	0.308	S	S	.	.	H	α-helix	trans	-61.3	-42.4	176.4	-72.5	-69.6	108.5	0	0	111.6	N1046 V1047 R1053 T1054 T1057	N1046-Q1050 WeakPolarHBondContact O-CB 3.46Å; N1046-Q1050 VanDerWaalsContact O-CG 3.32Å; N1046-Q1050 WeakPolarHBondContact O-CG 3.39Å; N1046-Q1050 PolarHBondContact O-N 3.47Å; V1047-Q1050 PolarHBondContact O-N 2.81Å; Q1050-R1053 PolarHBondContact O-N 3.41Å; Q1050-T1054 PolarHBondContact O-N 3.2Å; Q1050-T1054 PolarHBondContact O-OG1 3.45Å; Q1050-T1057 HydrophobicContact CB-CG2 4.19Å
1051	L	89.8	Confident	90.4	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-59.8	-51.2	174.8	-72.5	160.5	0	0	0	111.1	F1004 M1018 V1047 Y1049 R1053 G1055 T1057 L1060 M1063	F1004-L1051 HydrophobicContact CE1-CD1 3.82Å; F1004-L1051 HydrophobicContact CE2-CD1 4.39Å; F1004-L1051 HydrophobicContact CZ-CD1 3.38Å; M1018-L1051 HydrophobicContact CE-CB 4.47Å; M1018-L1051 HydrophobicContact SD-CB 4.22Å; M1018-L1051 HydrophobicContact SD-CD1 3.63Å; V1047-L1051 HydrophobicContact CG1-CD1 3.87Å; V1047-L1051 WeakPolarHBondContact O-CG 3.21Å; V1047-L1051 PolarHBondContact O-N 3.07Å; Y1049-L1051 PolarHBondContact O-N 3.35Å; L1051-R1053 VanDerWaalsContact C-N 3.34Å; L1051-R1053 PolarHBondContact O-N 2.94Å; L1051-G1055 VanDerWaalsContact O-CA 3.3Å; L1051-G1055 WeakPolarHBondContact O-CA 3.4Å; L1051-G1055 PolarHBondContact O-N 2.92Å; L1051-T1057 HydrophobicContact CD1-CG2 4.2Å; L1051-T1057 HydrophobicContact CD2-CG2 4.02Å; L1051-T1057 HydrophobicContact CG-CG2 3.73Å; L1051-L1060 HydrophobicContact CD1-CD2 4.3Å; L1051-L1060 HydrophobicContact CD2-CB 4.5Å; L1051-L1060 HydrophobicContact CD2-CD2 3.95Å; L1051-L1060 HydrophobicContact CD2-CG 4.04Å; L1051-M1063 HydrophobicContact CB-CE 4.02Å; L1051-M1063 HydrophobicContact CB-SD 4.28Å; L1051-M1063 HydrophobicContact CD1-SD 3.89Å; L1051-M1063 HydrophobicContact CD2-CB 4.15Å; L1051-M1063 HydrophobicContact CD2-CE 4.5Å; L1051-M1063 HydrophobicContact CD2-SD 3.97Å; L1051-M1063 HydrophobicContact CG-SD 4.26Å
1052	R	87.8	Confident	90	Very high	189 Å²	189	71 Å²	71	71%	0.713	34%	0.339	S	S	*	.	H	α-helix	trans	-63.8	-30.2	178.5	-76.3	-179.8	171	-170.5	-4.3	115	M1018 K1048 Y1049	M1018-R1052 HydrophobicContact CE-CG 4.2Å; K1048-R1052 WeakPolarHBondContact O-CG 3.32Å; K1048-R1052 PolarHBondContact O-N 3.47Å; K1048-R1052 VanDerWaalsContact O-N 3.16Å; Y1049-R1052 PolarHBondContact O-N 2.97Å
1053	R	86.5	Confident	89.5	Confident	180 Å²	180	64.7 Å²	64.7	68%	0.679	31%	0.31	S	S	*	.	H	α-helix	trans	-101.1	-24.4	-173.3	-158.7	174.4	-169.3	-159.1	-2.1	114.4	Y1049 Q1050 L1051	Y1049-R1053 WeakPolarHBondContact O-CB 3.46Å; Y1049-R1053 PolarHBondContact O-N 2.91Å; Y1049-R1053 WeakPolarHBondContact OH-CD 3.33Å; Y1049-R1053 PolarHBondContact OH-NH1 3.34Å; Q1050-R1053 PolarHBondContact O-N 3.41Å; L1051-R1053 VanDerWaalsContact C-N 3.34Å; L1051-R1053 PolarHBondContact O-N 2.94Å
1054	T	85.8	Confident	88.7	Confident	89 Å²	89	67 Å²	67	55%	0.546	33%	0.325	S	S	.	.	H	α-helix	trans	-130.3	10.8	-177.9	58.9	0	0	0	0	114.2	Q1050 G1056	Q1050-T1054 PolarHBondContact O-N 3.2Å; Q1050-T1054 PolarHBondContact O-OG1 3.45Å; T1054-G1056 PolarHBondContact O-N 3.04Å; T1054-G1056 VanDerWaalsContact O-N 3.08Å; T1054-G1056 PolarHBondContact OG1-O 2.61Å; T1054-G1056 VanDerWaalsContact OG1-O 3.04Å
1055	G	82.1	Confident	87.9	Confident	29 Å²	29	68.6 Å²	68.6	30%	0.299	34%	0.338	S	S	.	.	S	Bend	trans	64	12.8	178.7	0	0	0	0	0	114.7	L1051 N1062	L1051-G1055 VanDerWaalsContact O-CA 3.3Å; L1051-G1055 WeakPolarHBondContact O-CA 3.4Å; L1051-G1055 PolarHBondContact O-N 2.92Å; G1055-N1062 PolarHBondContact O-N 3.41Å
1056	G	87.9	Confident	86.9	Confident	9 Å²	9	70 Å²	70	9%	0.093	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	176.9	157.7	-170.6	0	0	0	0	0	115.3	T1054 L1060	T1054-G1056 PolarHBondContact O-N 3.04Å; T1054-G1056 VanDerWaalsContact O-N 3.08Å; T1054-G1056 PolarHBondContact OG1-O 2.61Å; T1054-G1056 VanDerWaalsContact OG1-O 3.04Å; G1056-L1060 CarbonylContact C-O 3.48Å; G1056-L1060 WeakPolarHBondContact CA-O 3.24Å
1057	T	91.6	Very high	86.2	Confident	21 Å²	21	70.7 Å²	70.7	13%	0.129	34%	0.343	C	S	.	.			trans	-111.7	-169.5	165.5	75.8	0	0	0	0	110.2	V1047 Q1050 L1051 F1059 L1060	V1047-T1057 HydrophobicContact CG1-CG2 4.12Å; Q1050-T1057 HydrophobicContact CB-CG2 4.19Å; L1051-T1057 HydrophobicContact CD1-CG2 4.2Å; L1051-T1057 HydrophobicContact CD2-CG2 4.02Å; L1051-T1057 HydrophobicContact CG-CG2 3.73Å; T1057-F1059 VanDerWaalsContact C-N 3.25Å; T1057-F1059 HydrophobicContact CG2-CE1 4.27Å; T1057-F1059 PolarHBondContact O-N 3.16Å; T1057-F1059 WeakPolarHBondContact OG1-CD1 3.5Å; T1057-F1059 WeakPolarHBondContact OG1-CE1 3.45Å; T1057-F1059 PolarHBondContact OG1-N 3.48Å; T1057-F1059 VanDerWaalsContact OG1-N 3.09Å; T1057-L1060 PolarHBondContact N-O 2.9Å; T1057-L1060 PolarHBondContact OG1-N 3.41Å; T1057-L1060 VanDerWaalsContact OG1-N 3.13Å
1058	K	88.8	Confident	86	Confident	185 Å²	185	70.4 Å²	70.4	80%	0.804	34%	0.341	S	S	*	.	S	Bend	trans	-64.9	-27.2	170.8	-64	-175.5	179	-178.3	0	113.6
1059	F	92.9	Very high	86.1	Confident	12 Å²	12	68.7 Å²	68.7	5%	0.053	33%	0.334	C	S	.	.	S	Bend	trans	-118.8	-10.6	-167.9	72.6	-95.6	0	0	0	114.2	Q1001 F1004 W1043 V1047 T1057 F1070 L1071 Y1085	Q1001-F1059 HydrophobicContact CB-CD2 4.3Å; Q1001-F1059 HydrophobicContact CB-CE2 4.35Å; Q1001-F1059 HydrophobicContact CG-CB 4.43Å; Q1001-F1059 HydrophobicContact CG-CD1 3.75Å; Q1001-F1059 HydrophobicContact CG-CD2 3.95Å; Q1001-F1059 HydrophobicContact CG-CE1 3.91Å; Q1001-F1059 HydrophobicContact CG-CE2 4.11Å; Q1001-F1059 HydrophobicContact CG-CG 3.78Å; Q1001-F1059 HydrophobicContact CG-CZ 4.09Å; F1004-F1059 AromaticContact CD1-CE2 3.83Å; F1004-F1059 HydrophobicContact CD1-CE2 3.83Å; F1004-F1059 AromaticContact CD1-CZ 3.83Å; F1004-F1059 HydrophobicContact CD1-CZ 3.83Å; F1004-F1059 HydrophobicContact CE1-CE2 4.37Å; F1004-F1059 HydrophobicContact CE1-CZ 4.32Å; F1004-F1059 HydrophobicContact CG-CZ 4.42Å; W1043-F1059 HydrophobicContact CH2-CE1 4.27Å; W1043-F1059 HydrophobicContact CH2-CZ 4.18Å; W1043-F1059 HydrophobicContact CZ2-CE1 4.21Å; V1047-F1059 HydrophobicContact CG1-CE1 4.38Å; V1047-F1059 HydrophobicContact CG1-CZ 4.01Å; V1047-F1059 HydrophobicContact CG2-CE1 4.11Å; V1047-F1059 HydrophobicContact CG2-CZ 4.43Å; T1057-F1059 VanDerWaalsContact C-N 3.25Å; T1057-F1059 HydrophobicContact CG2-CE1 4.27Å; T1057-F1059 PolarHBondContact O-N 3.16Å; T1057-F1059 WeakPolarHBondContact OG1-CD1 3.5Å; T1057-F1059 WeakPolarHBondContact OG1-CE1 3.45Å; T1057-F1059 PolarHBondContact OG1-N 3.48Å; T1057-F1059 VanDerWaalsContact OG1-N 3.09Å; F1059-F1070 CarbonylContact O-C 3.59Å; F1059-F1070 VanDerWaalsContact O-CA 3.29Å; F1059-F1070 WeakPolarHBondContact O-CA 3.46Å; F1059-L1071 PolarHBondContact O-N 3.08Å; F1059-Y1085 HydrophobicContact CD2-CE1 4.26Å
1060	L	92.1	Very high	86.2	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	126.2	174.4	170.8	59	0	0	0	109.1	F1004 L1008 L1051 G1056 T1057 M1063 P1068 V1069 F1070	F1004-L1060 HydrophobicContact CE1-CD2 3.96Å; L1008-L1060 HydrophobicContact CD1-CD2 3.79Å; L1051-L1060 HydrophobicContact CD1-CD2 4.3Å; L1051-L1060 HydrophobicContact CD2-CB 4.5Å; L1051-L1060 HydrophobicContact CD2-CD2 3.95Å; L1051-L1060 HydrophobicContact CD2-CG 4.04Å; G1056-L1060 CarbonylContact C-O 3.48Å; G1056-L1060 WeakPolarHBondContact CA-O 3.24Å; T1057-L1060 PolarHBondContact N-O 2.9Å; T1057-L1060 PolarHBondContact OG1-N 3.41Å; T1057-L1060 VanDerWaalsContact OG1-N 3.13Å; L1060-M1063 HydrophobicContact CD2-CB 4.25Å; L1060-M1063 HydrophobicContact CD2-CG 4.18Å; L1060-M1063 HydrophobicContact CD2-SD 4.25Å; L1060-M1063 HydrophobicContact CG-CB 4.36Å; L1060-P1068 HydrophobicContact CD1-CB 3.98Å; L1060-V1069 CarbonylContact C-O 3.55Å; L1060-V1069 VanDerWaalsContact CA-O 3.3Å; L1060-V1069 WeakPolarHBondContact CA-O 3.44Å; L1060-F1070 HydrophobicContact CB-CD1 4.44Å; L1060-F1070 HydrophobicContact CD1-CD1 3.93Å; L1060-F1070 HydrophobicContact CD1-CD2 4.37Å; L1060-F1070 HydrophobicContact CD1-CE1 3.74Å; L1060-F1070 HydrophobicContact CD1-CE2 4.19Å; L1060-F1070 HydrophobicContact CD1-CG 4.24Å; L1060-F1070 HydrophobicContact CD1-CZ 3.86Å; L1060-F1070 HydrophobicContact CD2-CE1 4.21Å; L1060-F1070 HydrophobicContact CG-CE1 4.4Å
1061	K	90.4	Very high	86.4	Confident	97 Å²	97	61.2 Å²	61.2	42%	0.422	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	161.4	173	-58.4	178.6	-178.5	177.4	0	110.6	M1063 V1069 L1071	K1061-M1063 PolarHBondContact O-N 3.12Å; K1061-V1069 HydrophobicContact CB-CB 4.22Å; K1061-V1069 PolarHBondContact N-O 3.1Å; K1061-V1069 PolarHBondContact O-N 3.1Å; K1061-L1071 HydrophobicContact CD-CD1 3.98Å; K1061-L1071 HydrophobicContact CG-CD1 4.31Å
1062	N	84.8	Confident	86.5	Confident	83 Å²	83	61.4 Å²	61.4	44%	0.444	31%	0.306	S	S	.	.			trans	61.9	28.5	170.4	-50.2	1.1	0	0	0	113.6	G1055 D1064 S1065	G1055-N1062 PolarHBondContact O-N 3.41Å; N1062-D1064 VanDerWaalsContact C-N 3.28Å; N1062-D1064 PolarHBondContact O-N 2.89Å; N1062-S1065 WeakPolarHBondContact CB-OG 3.19Å; N1062-S1065 PolarHBondContact O-N 3.42Å; N1062-S1065 VanDerWaalsContact O-N 3.14Å; N1062-S1065 PolarHBondContact O-OG 2.99Å
1063	M	82.8	Confident	86.5	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.02	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-36.1	-176.1	-176.8	-165.1	71.7	0	0	112.9	L1008 Y1016 M1018 L1051 L1060 K1061 S1065	L1008-M1063 HydrophobicContact CD2-SD 4.32Å; Y1016-M1063 WeakPolarHBondContact O-CG 3.3Å; M1018-M1063 HydrophobicContact CE-CE 3.92Å; M1018-M1063 HydrophobicContact CE-SD 4.47Å; M1018-M1063 HydrophobicContact CG-CE 4.28Å; M1018-M1063 HydrophobicContact CG-SD 3.7Å; M1018-M1063 HydrophobicContact SD-CE 4.24Å; M1018-M1063 HydrophobicContact SD-SD 4.03Å; L1051-M1063 HydrophobicContact CB-CE 4.02Å; L1051-M1063 HydrophobicContact CB-SD 4.28Å; L1051-M1063 HydrophobicContact CD1-SD 3.89Å; L1051-M1063 HydrophobicContact CD2-CB 4.15Å; L1051-M1063 HydrophobicContact CD2-CE 4.5Å; L1051-M1063 HydrophobicContact CD2-SD 3.97Å; L1051-M1063 HydrophobicContact CG-SD 4.26Å; L1060-M1063 HydrophobicContact CD2-CB 4.25Å; L1060-M1063 HydrophobicContact CD2-CG 4.18Å; L1060-M1063 HydrophobicContact CD2-SD 4.25Å; L1060-M1063 HydrophobicContact CG-CB 4.36Å; K1061-M1063 PolarHBondContact O-N 3.12Å; M1063-S1065 VanDerWaalsContact C-N 3.28Å; M1063-S1065 PolarHBondContact O-N 3.38Å
1064	D	77.1	Confident	86.5	Confident	88 Å²	88	51.7 Å²	51.7	47%	0.471	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-8.8	-178.9	-46.7	-79	0	0	0	113.2	R1015 N1062	R1015-D1064 VanDerWaalsContact CD-O 3.23Å; R1015-D1064 WeakPolarHBondContact CD-O 3.16Å; N1062-D1064 VanDerWaalsContact C-N 3.28Å; N1062-D1064 PolarHBondContact O-N 2.89Å
1065	S	76.9	Confident	86.8	Confident	48 Å²	48	50.8 Å²	50.8	34%	0.336	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	157.6	167.7	81	0	0	0	0	110.3	N1062 M1063 Q1067	N1062-S1065 WeakPolarHBondContact CB-OG 3.19Å; N1062-S1065 PolarHBondContact O-N 3.42Å; N1062-S1065 VanDerWaalsContact O-N 3.14Å; N1062-S1065 PolarHBondContact O-OG 2.99Å; M1063-S1065 VanDerWaalsContact C-N 3.28Å; M1063-S1065 PolarHBondContact O-N 3.38Å; S1065-Q1067 PolarHBondContact O-N 3.48Å; S1065-Q1067 PolarHBondContact OG-N 2.85Å
1066	C	71.3	Confident	87.1	Confident	86 Å²	86	53.3 Å²	53.3	58%	0.581	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	23.4	176.6	-47.7	0	0	0	0	114.1	E1013 G1014	E1013-C1066 PolarHBondContact O-SG 3.19Å; E1013-C1066 VanDerWaalsContact O-SG 3.36Å; G1014-C1066 VanDerWaalsContact O-CA 3.29Å; G1014-C1066 WeakPolarHBondContact O-CA 3.35Å
1067	Q	79.1	Confident	87.2	Confident	113 Å²	113	55 Å²	55	53%	0.528	32%	0.323	S	S	.	.	S	Bend	trans	-151.8	69.1	-178.8	-145	-163.5	56.3	0	0	112	S1065 R1080	S1065-Q1067 PolarHBondContact O-N 3.48Å; S1065-Q1067 PolarHBondContact OG-N 2.85Å; Q1067-R1080 VanDerWaalsContact CD-NH1 3.3Å; Q1067-R1080 VanDerWaalsContact CG-NH1 3.3Å; Q1067-R1080 PolarHBondContact O-NH1 3.29Å
1068	P	88.3	Confident	87.3	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.032	34%	0.342	C	S	.	.			trans	-58.5	160.2	179	28.9	-38.7	0	0	0	112.4	Y1016 L1060 F1070 R1080	Y1016-P1068 HydrophobicContact CD2-CB 4.45Å; Y1016-P1068 HydrophobicContact CD2-CG 3.58Å; Y1016-P1068 HydrophobicContact CE2-CG 3.64Å; Y1016-P1068 HydrophobicContact CG-CG 4.49Å; L1060-P1068 HydrophobicContact CD1-CB 3.98Å; P1068-F1070 HydrophobicContact CB-CE2 4.04Å; P1068-F1070 HydrophobicContact CG-CE2 4.12Å; P1068-R1080 WeakPolarHBondContact O-CD 3.29Å; P1068-R1080 PolarHBondContact O-NH1 3.23Å; P1068-R1080 VanDerWaalsContact O-NH1 3.16Å
1069	V	90.8	Very high	87.5	Confident	9 Å²	9	52.1 Å²	52.1	6%	0.055	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	101	-180	167.1	0	0	0	0	108.3	L1060 K1061 L1071 Q1078	L1060-V1069 CarbonylContact C-O 3.55Å; L1060-V1069 VanDerWaalsContact CA-O 3.3Å; L1060-V1069 WeakPolarHBondContact CA-O 3.44Å; K1061-V1069 HydrophobicContact CB-CB 4.22Å; K1061-V1069 PolarHBondContact N-O 3.1Å; K1061-V1069 PolarHBondContact O-N 3.1Å; V1069-L1071 HydrophobicContact CG1-CD1 4.11Å; V1069-L1071 HydrophobicContact CG1-CD2 4.21Å; V1069-L1071 HydrophobicContact CG1-CG 3.91Å; V1069-Q1078 HydrophobicContact CG1-CG 3.87Å; V1069-Q1078 VanDerWaalsContact CG1-NE2 3.25Å
1070	F	93.3	Very high	87.4	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	143.4	169.4	-59.6	-93.1	0	0	0	109.5	A1005 L1008 F1059 L1060 P1068 Q1078 F1079 P1082 Y1085	A1005-F1070 HydrophobicContact CB-CE1 4.11Å; L1008-F1070 HydrophobicContact CD1-CE1 3.65Å; L1008-F1070 HydrophobicContact CD1-CZ 3.6Å; F1059-F1070 CarbonylContact O-C 3.59Å; F1059-F1070 VanDerWaalsContact O-CA 3.29Å; F1059-F1070 WeakPolarHBondContact O-CA 3.46Å; L1060-F1070 HydrophobicContact CB-CD1 4.44Å; L1060-F1070 HydrophobicContact CD1-CD1 3.93Å; L1060-F1070 HydrophobicContact CD1-CD2 4.37Å; L1060-F1070 HydrophobicContact CD1-CE1 3.74Å; L1060-F1070 HydrophobicContact CD1-CE2 4.19Å; L1060-F1070 HydrophobicContact CD1-CG 4.24Å; L1060-F1070 HydrophobicContact CD1-CZ 3.86Å; L1060-F1070 HydrophobicContact CD2-CE1 4.21Å; L1060-F1070 HydrophobicContact CG-CE1 4.4Å; P1068-F1070 HydrophobicContact CB-CE2 4.04Å; P1068-F1070 HydrophobicContact CG-CE2 4.12Å; F1070-Q1078 WeakPolarHBondContact O-CA 3.41Å; F1070-F1079 HydrophobicContact CB-CB 4.19Å; F1070-F1079 PolarHBondContact N-O 3.27Å; F1070-F1079 PolarHBondContact O-N 2.86Å; F1070-P1082 HydrophobicContact CE2-CB 4.4Å; F1070-P1082 HydrophobicContact CE2-CG 4.02Å; F1070-P1082 HydrophobicContact CZ-CB 4.01Å; F1070-P1082 HydrophobicContact CZ-CG 3.77Å; F1070-Y1085 HydrophobicContact CB-CD1 3.87Å; F1070-Y1085 HydrophobicContact CB-CD2 3.75Å; F1070-Y1085 HydrophobicContact CB-CE1 4.32Å; F1070-Y1085 HydrophobicContact CB-CE2 4.21Å; F1070-Y1085 HydrophobicContact CB-CG 3.54Å; F1070-Y1085 AromaticContact CD1-CD1 3.42Å; F1070-Y1085 HydrophobicContact CD1-CD1 3.42Å; F1070-Y1085 VanDerWaalsContact CD1-CD1 3.42Å; F1070-Y1085 AromaticContact CD1-CE1 3.83Å; F1070-Y1085 HydrophobicContact CD1-CE1 3.83Å; F1070-Y1085 AromaticContact CD1-CG 3.97Å; F1070-Y1085 HydrophobicContact CD1-CG 3.97Å; F1070-Y1085 HydrophobicContact CE1-CD1 4.24Å; F1070-Y1085 AromaticContact CG-CD1 3.88Å; F1070-Y1085 HydrophobicContact CG-CD1 3.88Å; F1070-Y1085 HydrophobicContact CG-CE1 4.49Å; F1070-Y1085 AromaticContact CG-CG 3.92Å; F1070-Y1085 HydrophobicContact CG-CG 3.92Å
1071	L	93.6	Very high	87.2	Confident	38 Å²	38	59.5 Å²	59.5	20%	0.199	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	120.8	-174.7	-70.1	163.5	0	0	0	109.2	F1059 K1061 V1069 S1077 Q1078 Y1085	F1059-L1071 PolarHBondContact O-N 3.08Å; K1061-L1071 HydrophobicContact CD-CD1 3.98Å; K1061-L1071 HydrophobicContact CG-CD1 4.31Å; V1069-L1071 HydrophobicContact CG1-CD1 4.11Å; V1069-L1071 HydrophobicContact CG1-CD2 4.21Å; V1069-L1071 HydrophobicContact CG1-CG 3.91Å; L1071-S1077 WeakPolarHBondContact CA-O 3.32Å; L1071-Q1078 HydrophobicContact CD2-CB 4.08Å; L1071-Q1078 HydrophobicContact CD2-CG 3.98Å; L1071-Y1085 PolarHBondContact O-OH 2.82Å
1072	C	93.1	Very high	87.2	Confident	4 Å²	4	55.5 Å²	55.5	3%	0.027	33%	0.329	C	S	.	.			trans	-78.5	129	170.4	-174.3	0	0	0	0	109.9	D1074 A1076 S1077 F1079 Y1085 H1088	C1072-D1074 VanDerWaalsContact C-N 3.29Å; C1072-D1074 PolarHBondContact O-N 2.78Å; C1072-D1074 PolarHBondContact SG-N 3.49Å; C1072-A1076 WeakPolarHBondContact O-CA 3.36Å; C1072-A1076 PolarHBondContact O-N 3.01Å; C1072-A1076 VanDerWaalsContact O-N 3.12Å; C1072-S1077 PolarHBondContact N-O 3.16Å; C1072-F1079 HydrophobicContact CB-CE2 4.4Å; C1072-Y1085 HydrophobicContact CB-CE2 4.43Å; C1072-H1088 WeakPolarHBondContact CB-NE2 3.39Å; C1072-H1088 PolarHBondContact SG-NE2 3.04Å
1073	G	87.4	Confident	87.5	Confident	69 Å²	69	55.5 Å²	55.5	71%	0.711	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-27.2	176.3	0	0	0	0	0	113.6
1074	D	87.1	Confident	87.9	Confident	96 Å²	96	58 Å²	58	51%	0.513	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-38	-168.4	-60.5	-11.2	0	0	0	112.2	C1072	C1072-D1074 VanDerWaalsContact C-N 3.29Å; C1072-D1074 PolarHBondContact O-N 2.78Å; C1072-D1074 PolarHBondContact SG-N 3.49Å
1075	C	90.9	Very high	88.7	Confident	71 Å²	71	53.8 Å²	53.8	48%	0.48	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-1.8	175.6	-80.2	0	0	0	0	114.5	S1077 H1092	C1075-S1077 WeakPolarHBondContact CB-OG 3.42Å; C1075-S1077 PolarHBondContact O-N 2.87Å; C1075-S1077 PolarHBondContact O-OG 3.09Å; C1075-H1092 PolarHBondContact SG-CE1 2.9Å; C1075-H1092 PolarHBondContact SG-NE2 2.79Å
1076	A	88.9	Confident	89.5	Confident	82 Å²	82	52.8 Å²	52.8	68%	0.678	32%	0.321	S	S	*	.			trans	55.7	5.4	-168.6	0	0	0	0	0	115.6	C1072	C1072-A1076 WeakPolarHBondContact O-CA 3.36Å; C1072-A1076 PolarHBondContact O-N 3.01Å; C1072-A1076 VanDerWaalsContact O-N 3.12Å
1077	S	90.9	Very high	90.5	Very high	44 Å²	44	52 Å²	52	31%	0.308	32%	0.317	S	S	.	.			trans	-65.5	140.4	-175.5	-52.9	0	0	0	0	112.8	L1071 C1072 C1075 F1079	L1071-S1077 WeakPolarHBondContact CA-O 3.32Å; C1072-S1077 PolarHBondContact N-O 3.16Å; C1075-S1077 WeakPolarHBondContact CB-OG 3.42Å; C1075-S1077 PolarHBondContact O-N 2.87Å; C1075-S1077 PolarHBondContact O-OG 3.09Å; S1077-F1079 VanDerWaalsContact CB-CE2 3.48Å; S1077-F1079 WeakPolarHBondContact O-CE2 3.35Å
1078	Q	93.1	Very high	91.3	Very high	112 Å²	112	48 Å²	48	52%	0.523	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	132.4	-178.9	-168.5	-173.7	8.6	0	0	111.2	V1069 F1070 L1071	V1069-Q1078 HydrophobicContact CG1-CG 3.87Å; V1069-Q1078 VanDerWaalsContact CG1-NE2 3.25Å; F1070-Q1078 WeakPolarHBondContact O-CA 3.41Å; L1071-Q1078 HydrophobicContact CD2-CB 4.08Å; L1071-Q1078 HydrophobicContact CD2-CG 3.98Å
1079	F	92.6	Very high	91.5	Very high	33 Å²	33	47.8 Å²	47.8	15%	0.145	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	153.9	179	-51.3	-93.7	0	0	0	111	F1070 C1072 S1077 S1084 Y1085 H1088	F1070-F1079 HydrophobicContact CB-CB 4.19Å; F1070-F1079 PolarHBondContact N-O 3.27Å; F1070-F1079 PolarHBondContact O-N 2.86Å; C1072-F1079 HydrophobicContact CB-CE2 4.4Å; S1077-F1079 VanDerWaalsContact CB-CE2 3.48Å; S1077-F1079 WeakPolarHBondContact O-CE2 3.35Å; F1079-S1084 WeakPolarHBondContact CD1-OG 3.43Å; F1079-Y1085 AromaticContact CD2-CD2 3.67Å; F1079-Y1085 HydrophobicContact CD2-CD2 3.67Å; F1079-Y1085 HydrophobicContact CD2-CG 4.47Å; F1079-Y1085 HydrophobicContact CE2-CD2 4.17Å; F1079-Y1085 HydrophobicContact CG-CD2 4.39Å; F1079-H1088 HydrophobicContact CE1-CB 3.91Å; F1079-H1088 HydrophobicContact CE2-CB 4.16Å; F1079-H1088 AromaticContact CE2-CD2 3.22Å; F1079-H1088 WeakPolarHBondContact CE2-CD2 3.21Å; F1079-H1088 AromaticContact CE2-CG 3.79Å; F1079-H1088 AromaticContact CE2-NE2 3.78Å; F1079-H1088 HydrophobicContact CZ-CB 3.57Å; F1079-H1088 AromaticContact CZ-CD2 3.24Å; F1079-H1088 WeakPolarHBondContact CZ-CD2 3.31Å; F1079-H1088 AromaticContact CZ-CG 3.31Å; F1079-H1088 AromaticContact CZ-ND1 3.9Å; F1079-H1088 AromaticContact CZ-NE2 3.78Å
1080	R	89.9	Confident	91.6	Very high	105 Å²	105	49.1 Å²	49.1	40%	0.396	30%	0.303	S	S	.	.	S	Bend	trans	-110.3	-19.6	-178	-63.8	-54.7	-160.6	136	14.6	114.5	Q1067 P1068	Q1067-R1080 VanDerWaalsContact CD-NH1 3.3Å; Q1067-R1080 VanDerWaalsContact CG-NH1 3.3Å; Q1067-R1080 PolarHBondContact O-NH1 3.29Å; P1068-R1080 WeakPolarHBondContact O-CD 3.29Å; P1068-R1080 PolarHBondContact O-NH1 3.23Å; P1068-R1080 VanDerWaalsContact O-NH1 3.16Å
1081	T	88.4	Confident	91.5	Very high	62 Å²	62	53.3 Å²	53.3	38%	0.38	33%	0.332	S	S	.	.	S	Bend	trans	-114.5	143.8	176.8	56.1	0	0	0	0	110.3	S1083 S1084 Y1085	T1081-S1083 VanDerWaalsContact C-N 3.28Å; T1081-S1083 PolarHBondContact O-N 2.9Å; T1081-S1084 PolarHBondContact O-N 3.11Å; T1081-S1084 VanDerWaalsContact OG1-CB 3.28Å; T1081-S1084 WeakPolarHBondContact OG1-CB 3.4Å; T1081-Y1085 PolarHBondContact O-N 3.37Å
1082	P	90.3	Very high	91.3	Very high	14 Å²	14	54.4 Å²	54.4	9%	0.091	34%	0.336	C	S	.	.	H	α-helix	trans	-59.8	-40.1	176.4	-18.5	27.5	0	0	0	111.9	Y1016 F1070 S1084 Y1085 I1086	Y1016-P1082 HydrophobicContact CD1-CG 4.04Å; Y1016-P1082 HydrophobicContact CE1-CG 3.48Å; Y1016-P1082 VanDerWaalsContact CE1-CG 3.48Å; F1070-P1082 HydrophobicContact CE2-CB 4.4Å; F1070-P1082 HydrophobicContact CE2-CG 4.02Å; F1070-P1082 HydrophobicContact CZ-CB 4.01Å; F1070-P1082 HydrophobicContact CZ-CG 3.77Å; P1082-S1084 PolarHBondContact O-N 3.18Å; P1082-Y1085 PolarHBondContact O-N 3.11Å; P1082-I1086 HydrophobicContact CB-CD1 4.34Å; P1082-I1086 WeakPolarHBondContact O-CB 3.44Å; P1082-I1086 VanDerWaalsContact O-CD1 3.31Å; P1082-I1086 WeakPolarHBondContact O-CD1 3.36Å; P1082-I1086 WeakPolarHBondContact O-CG1 3.37Å; P1082-I1086 PolarHBondContact O-N 2.95Å
1083	S	90.6	Very high	91.1	Very high	83 Å²	83	55.2 Å²	55.2	58%	0.58	34%	0.34	S	S	*	.	H	α-helix	trans	-60.2	-43.9	-178.4	51.5	0	0	0	0	113.6	T1081 I1086 S1087	T1081-S1083 VanDerWaalsContact C-N 3.28Å; T1081-S1083 PolarHBondContact O-N 2.9Å; S1083-I1086 PolarHBondContact O-N 3.36Å; S1083-S1087 PolarHBondContact O-N 2.95Å
1084	S	92.7	Very high	91.1	Very high	55 Å²	55	55.4 Å²	55.4	39%	0.385	34%	0.342	S	S	.	.	H	α-helix	trans	-68.5	-39	177.5	-176.9	0	0	0	0	111.6	F1079 T1081 P1082 S1087 H1088	F1079-S1084 WeakPolarHBondContact CD1-OG 3.43Å; T1081-S1084 PolarHBondContact O-N 3.11Å; T1081-S1084 VanDerWaalsContact OG1-CB 3.28Å; T1081-S1084 WeakPolarHBondContact OG1-CB 3.4Å; P1082-S1084 PolarHBondContact O-N 3.18Å; S1084-S1087 PolarHBondContact O-N 2.8Å; S1084-H1088 WeakPolarHBondContact O-CB 3.47Å; S1084-H1088 PolarHBondContact O-N 2.99Å
1085	Y	94.4	Very high	91.2	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-63.5	-45.3	173.7	-179.8	-122.9	0	0	0	112.2	Q1001 A1005 F1059 F1070 L1071 C1072 F1079 T1081 P1082 H1088 L1089	Q1001-Y1085 PolarHBondContact OE1-OH 3.43Å; A1005-Y1085 HydrophobicContact CB-CD1 3.91Å; A1005-Y1085 HydrophobicContact CB-CE1 4.27Å; F1059-Y1085 HydrophobicContact CD2-CE1 4.26Å; F1070-Y1085 HydrophobicContact CB-CD1 3.87Å; F1070-Y1085 HydrophobicContact CB-CD2 3.75Å; F1070-Y1085 HydrophobicContact CB-CE1 4.32Å; F1070-Y1085 HydrophobicContact CB-CE2 4.21Å; F1070-Y1085 HydrophobicContact CB-CG 3.54Å; F1070-Y1085 AromaticContact CD1-CD1 3.42Å; F1070-Y1085 HydrophobicContact CD1-CD1 3.42Å; F1070-Y1085 VanDerWaalsContact CD1-CD1 3.42Å; F1070-Y1085 AromaticContact CD1-CE1 3.83Å; F1070-Y1085 HydrophobicContact CD1-CE1 3.83Å; F1070-Y1085 AromaticContact CD1-CG 3.97Å; F1070-Y1085 HydrophobicContact CD1-CG 3.97Å; F1070-Y1085 HydrophobicContact CE1-CD1 4.24Å; F1070-Y1085 AromaticContact CG-CD1 3.88Å; F1070-Y1085 HydrophobicContact CG-CD1 3.88Å; F1070-Y1085 HydrophobicContact CG-CE1 4.49Å; F1070-Y1085 AromaticContact CG-CG 3.92Å; F1070-Y1085 HydrophobicContact CG-CG 3.92Å; L1071-Y1085 PolarHBondContact O-OH 2.82Å; C1072-Y1085 HydrophobicContact CB-CE2 4.43Å; F1079-Y1085 AromaticContact CD2-CD2 3.67Å; F1079-Y1085 HydrophobicContact CD2-CD2 3.67Å; F1079-Y1085 HydrophobicContact CD2-CG 4.47Å; F1079-Y1085 HydrophobicContact CE2-CD2 4.17Å; F1079-Y1085 HydrophobicContact CG-CD2 4.39Å; T1081-Y1085 PolarHBondContact O-N 3.37Å; P1082-Y1085 PolarHBondContact O-N 3.11Å; Y1085-H1088 WeakPolarHBondContact O-CB 3.43Å; Y1085-H1088 PolarHBondContact O-N 2.96Å; Y1085-L1089 HydrophobicContact CD1-CD1 4.03Å; Y1085-L1089 HydrophobicContact CD2-CG 4.4Å; Y1085-L1089 HydrophobicContact CE1-CD1 3.56Å; Y1085-L1089 HydrophobicContact CE1-CG 4.39Å; Y1085-L1089 HydrophobicContact CE2-CD1 4.14Å; Y1085-L1089 HydrophobicContact CE2-CD2 4.14Å; Y1085-L1089 HydrophobicContact CE2-CG 4.13Å; Y1085-L1089 WeakPolarHBondContact O-CG 3.35Å; Y1085-L1089 PolarHBondContact O-N 2.81Å
1086	I	93.4	Very high	91	Very high	27 Å²	27	51.5 Å²	51.5	14%	0.138	32%	0.316	C	S	.	.	H	α-helix	trans	-59.2	-48.6	176.9	-69.4	159	0	0	0	110.5	A1005 P1082 S1083 H1088 L1089 E1090 L1097	A1005-I1086 HydrophobicContact CB-CD1 4.15Å; A1005-I1086 HydrophobicContact CB-CG1 3.88Å; P1082-I1086 HydrophobicContact CB-CD1 4.34Å; P1082-I1086 WeakPolarHBondContact O-CB 3.44Å; P1082-I1086 VanDerWaalsContact O-CD1 3.31Å; P1082-I1086 WeakPolarHBondContact O-CD1 3.36Å; P1082-I1086 WeakPolarHBondContact O-CG1 3.37Å; P1082-I1086 PolarHBondContact O-N 2.95Å; S1083-I1086 PolarHBondContact O-N 3.36Å; I1086-H1088 VanDerWaalsContact C-N 3.29Å; I1086-H1088 PolarHBondContact O-N 3.35Å; I1086-L1089 CarbonylContact O-C 3.57Å; I1086-L1089 WeakPolarHBondContact O-CA 3.47Å; I1086-L1089 PolarHBondContact O-N 2.86Å; I1086-E1090 WeakPolarHBondContact O-CG 3.24Å; I1086-E1090 PolarHBondContact O-N 3.46Å; I1086-L1097 HydrophobicContact CG2-CD1 3.72Å
1087	S	92.4	Very high	90.8	Very high	71 Å²	71	48.2 Å²	48.2	50%	0.497	29%	0.287	S	S	.	.	H	α-helix	trans	-61.9	-35.8	178.6	-176.8	0	0	0	0	112.6	S1083 S1084 E1090 S1091	S1083-S1087 PolarHBondContact O-N 2.95Å; S1084-S1087 PolarHBondContact O-N 2.8Å; S1087-E1090 WeakPolarHBondContact O-CB 3.39Å; S1087-E1090 PolarHBondContact O-N 2.84Å; S1087-S1091 PolarHBondContact O-N 3.05Å
1088	H	94.2	Very high	90.4	Very high	28 Å²	28	54 Å²	54	13%	0.13	31%	0.306	C	S	.	.	H	α-helix	trans	-66	-41.3	171.2	172.6	61.4	0	0	0	112.4	C1072 F1079 S1084 Y1085 I1086 E1090 S1091 H1092	C1072-H1088 WeakPolarHBondContact CB-NE2 3.39Å; C1072-H1088 PolarHBondContact SG-NE2 3.04Å; F1079-H1088 HydrophobicContact CE1-CB 3.91Å; F1079-H1088 HydrophobicContact CE2-CB 4.16Å; F1079-H1088 AromaticContact CE2-CD2 3.22Å; F1079-H1088 WeakPolarHBondContact CE2-CD2 3.21Å; F1079-H1088 AromaticContact CE2-CG 3.79Å; F1079-H1088 AromaticContact CE2-NE2 3.78Å; F1079-H1088 HydrophobicContact CZ-CB 3.57Å; F1079-H1088 AromaticContact CZ-CD2 3.24Å; F1079-H1088 WeakPolarHBondContact CZ-CD2 3.31Å; F1079-H1088 AromaticContact CZ-CG 3.31Å; F1079-H1088 AromaticContact CZ-ND1 3.9Å; F1079-H1088 AromaticContact CZ-NE2 3.78Å; S1084-H1088 WeakPolarHBondContact O-CB 3.47Å; S1084-H1088 PolarHBondContact O-N 2.99Å; Y1085-H1088 WeakPolarHBondContact O-CB 3.43Å; Y1085-H1088 PolarHBondContact O-N 2.96Å; I1086-H1088 VanDerWaalsContact C-N 3.29Å; I1086-H1088 PolarHBondContact O-N 3.35Å; H1088-E1090 VanDerWaalsContact C-N 3.34Å; H1088-E1090 PolarHBondContact O-N 3.42Å; H1088-S1091 WeakPolarHBondContact O-CB 3.3Å; H1088-S1091 PolarHBondContact O-N 3.45Å; H1088-S1091 VanDerWaalsContact O-N 3.14Å; H1088-S1091 PolarHBondContact O-OG 3.39Å; H1088-H1092 AromaticContact CE1-CD2 3.46Å; H1088-H1092 PolarHBondContact CE1-CD2 3.42Å; H1088-H1092 VanDerWaalsContact CE1-CD2 3.46Å; H1088-H1092 AromaticContact CE1-NE2 3.13Å; H1088-H1092 PolarHBondContact CE1-NE2 3.36Å; H1088-H1092 AromaticContact ND1-CD2 3.89Å; H1088-H1092 AromaticContact ND1-NE2 3.97Å; H1088-H1092 AromaticContact NE2-CD2 3.66Å; H1088-H1092 AromaticContact NE2-NE2 3.36Å; H1088-H1092 PolarHBondContact NE2-NE2 2.82Å; H1088-H1092 PolarHBondContact O-CD2 3.31Å; H1088-H1092 PolarHBondContact O-N 3.45Å; H1088-H1092 VanDerWaalsContact O-N 3.15Å
1089	L	93.4	Very high	89.8	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65.6	-34.6	174.1	-64.9	179.4	0	0	0	112.4	L998 Q1001 A1002 Y1085 I1086 S1091 H1092 L1093	L998-L1089 HydrophobicContact CD2-CD2 3.56Å; Q1001-L1089 HydrophobicContact CB-CD1 4.09Å; A1002-L1089 HydrophobicContact CB-CB 4.12Å; A1002-L1089 HydrophobicContact CB-CD1 3.55Å; A1002-L1089 HydrophobicContact CB-CG 4.5Å; Y1085-L1089 HydrophobicContact CD1-CD1 4.03Å; Y1085-L1089 HydrophobicContact CD2-CG 4.4Å; Y1085-L1089 HydrophobicContact CE1-CD1 3.56Å; Y1085-L1089 HydrophobicContact CE1-CG 4.39Å; Y1085-L1089 HydrophobicContact CE2-CD1 4.14Å; Y1085-L1089 HydrophobicContact CE2-CD2 4.14Å; Y1085-L1089 HydrophobicContact CE2-CG 4.13Å; Y1085-L1089 WeakPolarHBondContact O-CG 3.35Å; Y1085-L1089 PolarHBondContact O-N 2.81Å; I1086-L1089 CarbonylContact O-C 3.57Å; I1086-L1089 WeakPolarHBondContact O-CA 3.47Å; I1086-L1089 PolarHBondContact O-N 2.86Å; L1089-S1091 VanDerWaalsContact C-N 3.31Å; L1089-S1091 PolarHBondContact O-N 3.13Å; L1089-H1092 PolarHBondContact O-N 2.98Å; L1089-L1093 WeakPolarHBondContact O-CG 3.38Å; L1089-L1093 PolarHBondContact O-N 3.25Å
1090	E	92.3	Very high	89	Confident	38 Å²	38	49.8 Å²	49.8	18%	0.178	29%	0.289	C	S	.	.	H	α-helix	trans	-61	-39.1	170.1	-68.6	178.1	134	0	0	111.5	I1086 S1087 H1088 H1092 L1093 G1094 S1096 L1097	I1086-E1090 WeakPolarHBondContact O-CG 3.24Å; I1086-E1090 PolarHBondContact O-N 3.46Å; S1087-E1090 WeakPolarHBondContact O-CB 3.39Å; S1087-E1090 PolarHBondContact O-N 2.84Å; H1088-E1090 VanDerWaalsContact C-N 3.34Å; H1088-E1090 PolarHBondContact O-N 3.42Å; E1090-H1092 VanDerWaalsContact C-N 3.32Å; E1090-H1092 PolarHBondContact O-N 3.16Å; E1090-L1093 PolarHBondContact O-N 3.18Å; E1090-L1093 VanDerWaalsContact O-N 3.17Å; E1090-G1094 PolarHBondContact O-N 2.57Å; E1090-S1096 WeakPolarHBondContact OE1-CA 3.38Å; E1090-S1096 VanDerWaalsContact OE1-CB 3.31Å; E1090-S1096 WeakPolarHBondContact OE1-CB 3.33Å; E1090-S1096 PolarHBondContact OE1-OG 2.6Å; E1090-L1097 HydrophobicContact CG-CB 4.44Å; E1090-L1097 HydrophobicContact CG-CD1 3.59Å; E1090-L1097 HydrophobicContact CG-CG 3.82Å; E1090-L1097 PolarHBondContact OE1-N 3.5Å
1091	S	91.4	Very high	88	Confident	87 Å²	87	47.7 Å²	47.7	61%	0.608	29%	0.29	S	S	*	.	H	α-helix	trans	-65.5	-31	174.7	79.5	0	0	0	0	113.7	S1087 H1088 L1089	S1087-S1091 PolarHBondContact O-N 3.05Å; H1088-S1091 WeakPolarHBondContact O-CB 3.3Å; H1088-S1091 PolarHBondContact O-N 3.45Å; H1088-S1091 VanDerWaalsContact O-N 3.14Å; H1088-S1091 PolarHBondContact O-OG 3.39Å; L1089-S1091 VanDerWaalsContact C-N 3.31Å; L1089-S1091 PolarHBondContact O-N 3.13Å
1092	H	89.2	Confident	87.2	Confident	62 Å²	62	51 Å²	51	29%	0.287	30%	0.3	S	S	.	.	H	α-helix	trans	-74.8	-27.9	171.9	-84	-82	0	0	0	113.5	L998 C1075 H1088 L1089 E1090	L998-H1092 HydrophobicContact CD1-CB 4.03Å; C1075-H1092 PolarHBondContact SG-CE1 2.9Å; C1075-H1092 PolarHBondContact SG-NE2 2.79Å; H1088-H1092 AromaticContact CE1-CD2 3.46Å; H1088-H1092 PolarHBondContact CE1-CD2 3.42Å; H1088-H1092 VanDerWaalsContact CE1-CD2 3.46Å; H1088-H1092 AromaticContact CE1-NE2 3.13Å; H1088-H1092 PolarHBondContact CE1-NE2 3.36Å; H1088-H1092 AromaticContact ND1-CD2 3.89Å; H1088-H1092 AromaticContact ND1-NE2 3.97Å; H1088-H1092 AromaticContact NE2-CD2 3.66Å; H1088-H1092 AromaticContact NE2-NE2 3.36Å; H1088-H1092 PolarHBondContact NE2-NE2 2.82Å; H1088-H1092 PolarHBondContact O-CD2 3.31Å; H1088-H1092 PolarHBondContact O-N 3.45Å; H1088-H1092 VanDerWaalsContact O-N 3.15Å; L1089-H1092 PolarHBondContact O-N 2.98Å; E1090-H1092 VanDerWaalsContact C-N 3.32Å; E1090-H1092 PolarHBondContact O-N 3.16Å
1093	L	90.1	Very high	85.7	Confident	20 Å²	20	53.4 Å²	53.4	11%	0.105	31%	0.311	C	S	.	.	H	α-helix	trans	-86.7	-25.3	179.4	-71	169.5	0	0	0	113	Q995 L998 I999 L1089 E1090 F1095 L1097	Q995-L1093 HydrophobicContact CB-CD2 4.19Å; L998-L1093 HydrophobicContact CB-CD2 4.11Å; L998-L1093 HydrophobicContact CB-CG 4.35Å; L998-L1093 HydrophobicContact CD1-CD2 4.32Å; I999-L1093 HydrophobicContact CD1-CD2 4.28Å; I999-L1093 HydrophobicContact CG1-CD1 3.69Å; I999-L1093 HydrophobicContact CG1-CD2 3.92Å; I999-L1093 HydrophobicContact CG1-CG 4.49Å; L1089-L1093 WeakPolarHBondContact O-CG 3.38Å; L1089-L1093 PolarHBondContact O-N 3.25Å; E1090-L1093 PolarHBondContact O-N 3.18Å; E1090-L1093 VanDerWaalsContact O-N 3.17Å; L1093-F1095 VanDerWaalsContact C-N 3.31Å; L1093-F1095 HydrophobicContact CB-CD1 4.13Å; L1093-F1095 HydrophobicContact CB-CE1 3.83Å; L1093-F1095 HydrophobicContact CB-CE2 4.45Å; L1093-F1095 HydrophobicContact CB-CZ 4Å; L1093-F1095 HydrophobicContact CD1-CE2 4.49Å; L1093-F1095 HydrophobicContact CD1-CZ 4.31Å; L1093-F1095 HydrophobicContact CD2-CE1 4.41Å; L1093-F1095 HydrophobicContact CD2-CZ 4.26Å; L1093-F1095 HydrophobicContact CG-CZ 4.43Å; L1093-F1095 WeakPolarHBondContact O-CD1 3.22Å; L1093-F1095 WeakPolarHBondContact O-CE1 3.48Å; L1093-L1097 HydrophobicContact CD1-CD2 3.73Å; L1093-L1097 HydrophobicContact CD1-CG 4.36Å
1094	G	87.3	Confident	84.3	Confident	73 Å²	73	49.9 Å²	49.9	75%	0.753	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	8.4	-177.7	0	0	0	0	0	114.5	E1090	E1090-G1094 PolarHBondContact O-N 2.57Å
1095	F	88.2	Confident	82.7	Confident	55 Å²	55	49.5 Å²	49.5	24%	0.241	29%	0.287	C	S	.	.	S	Bend	trans	-150.9	155.8	178.1	61.2	-95.3	0	0	0	110.7	I999 F1032 L1093 L1100 L1103	I999-F1095 HydrophobicContact CD1-CZ 4.28Å; F1032-F1095 AromaticContact CE1-CZ 3.9Å; F1032-F1095 HydrophobicContact CE1-CZ 3.9Å; F1032-F1095 HydrophobicContact CE2-CZ 4.4Å; F1032-F1095 HydrophobicContact CZ-CE1 4.04Å; F1032-F1095 HydrophobicContact CZ-CE2 4.12Å; F1032-F1095 AromaticContact CZ-CZ 3.52Å; F1032-F1095 HydrophobicContact CZ-CZ 3.52Å; L1093-F1095 VanDerWaalsContact C-N 3.31Å; L1093-F1095 HydrophobicContact CB-CD1 4.13Å; L1093-F1095 HydrophobicContact CB-CE1 3.83Å; L1093-F1095 HydrophobicContact CB-CE2 4.45Å; L1093-F1095 HydrophobicContact CB-CZ 4Å; L1093-F1095 HydrophobicContact CD1-CE2 4.49Å; L1093-F1095 HydrophobicContact CD1-CZ 4.31Å; L1093-F1095 HydrophobicContact CD2-CE1 4.41Å; L1093-F1095 HydrophobicContact CD2-CZ 4.26Å; L1093-F1095 HydrophobicContact CG-CZ 4.43Å; L1093-F1095 WeakPolarHBondContact O-CD1 3.22Å; L1093-F1095 WeakPolarHBondContact O-CE1 3.48Å; F1095-L1100 HydrophobicContact CE2-CD2 3.61Å; F1095-L1100 HydrophobicContact CE2-CG 4.05Å; F1095-L1100 HydrophobicContact CZ-CD2 4.15Å; F1095-L1103 HydrophobicContact CB-CD1 4.47Å; F1095-L1103 HydrophobicContact CD2-CD1 4Å; F1095-L1103 HydrophobicContact CE2-CD1 4.49Å; F1095-L1103 HydrophobicContact CG-CD1 4.17Å
1096	S	86.4	Confident	81	Confident	30 Å²	30	53.9 Å²	53.9	21%	0.21	31%	0.308	C	S	.	.			trans	-76.1	139.5	175.2	179	0	0	0	0	111.5	E1090 K1098 D1099	E1090-S1096 WeakPolarHBondContact OE1-CA 3.38Å; E1090-S1096 VanDerWaalsContact OE1-CB 3.31Å; E1090-S1096 WeakPolarHBondContact OE1-CB 3.33Å; E1090-S1096 PolarHBondContact OE1-OG 2.6Å; S1096-K1098 PolarHBondContact O-N 3.45Å; S1096-K1098 PolarHBondContact OG-N 2.9Å; S1096-D1099 WeakPolarHBondContact O-CA 3.4Å; S1096-D1099 WeakPolarHBondContact O-CB 3.49Å; S1096-D1099 PolarHBondContact O-N 3.07Å
1097	L	84.9	Confident	79.3	Confident	13 Å²	13	57.3 Å²	57.3	7%	0.068	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-66.1	-21.1	176.8	-65.6	151.4	0	0	0	112.1	I999 A1002 I1086 E1090 L1093 D1099 L1100	I999-L1097 HydrophobicContact CG1-CD2 4.28Å; I999-L1097 HydrophobicContact CG2-CD2 4.49Å; A1002-L1097 HydrophobicContact CB-CD1 3.24Å; A1002-L1097 HydrophobicContact CB-CD2 4.13Å; A1002-L1097 HydrophobicContact CB-CG 4.32Å; I1086-L1097 HydrophobicContact CG2-CD1 3.72Å; E1090-L1097 HydrophobicContact CG-CB 4.44Å; E1090-L1097 HydrophobicContact CG-CD1 3.59Å; E1090-L1097 HydrophobicContact CG-CG 3.82Å; E1090-L1097 PolarHBondContact OE1-N 3.5Å; L1093-L1097 HydrophobicContact CD1-CD2 3.73Å; L1093-L1097 HydrophobicContact CD1-CG 4.36Å; L1097-D1099 PolarHBondContact O-N 2.82Å; L1097-L1100 HydrophobicContact CB-CD1 4.22Å; L1097-L1100 HydrophobicContact CD2-CD1 3.65Å; L1097-L1100 HydrophobicContact CD2-CG 4.44Å; L1097-L1100 VanDerWaalsContact O-CB 3.3Å; L1097-L1100 WeakPolarHBondContact O-CB 3.13Å; L1097-L1100 WeakPolarHBondContact O-CG 3.38Å; L1097-L1100 PolarHBondContact O-N 3.34Å
1098	K	83.8	Confident	77.4	Confident	166 Å²	166	57.4 Å²	57.4	72%	0.722	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-61.5	-36.2	170	-62.4	174.3	-177.6	174.4	0	110.9	S1096 L1100 S1101	S1096-K1098 PolarHBondContact O-N 3.45Å; S1096-K1098 PolarHBondContact OG-N 2.9Å; K1098-L1100 VanDerWaalsContact C-N 3.32Å; K1098-L1100 PolarHBondContact O-N 3.49Å; K1098-S1101 PolarHBondContact O-OG 3.2Å
1099	D	79.9	Confident	75.7	Confident	50 Å²	50	62.7 Å²	62.7	27%	0.267	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-79.5	-7.8	179.7	-59.3	-45.6	0	0	0	113.4	S1096 L1097 S1101 K1102 L1103	S1096-D1099 WeakPolarHBondContact O-CA 3.4Å; S1096-D1099 WeakPolarHBondContact O-CB 3.49Å; S1096-D1099 PolarHBondContact O-N 3.07Å; L1097-D1099 PolarHBondContact O-N 2.82Å; D1099-S1101 PolarHBondContact O-N 3.44Å; D1099-S1101 VanDerWaalsContact O-N 3.14Å; D1099-K1102 CarbonylContact O-C 3.55Å; D1099-K1102 WeakPolarHBondContact O-CA 3.32Å; D1099-K1102 PolarHBondContact O-N 2.88Å; D1099-K1102 VanDerWaalsContact OD1-CD 3.31Å; D1099-K1102 WeakPolarHBondContact OD1-CD 3.48Å; D1099-K1102 WeakPolarHBondContact OD1-CE 3.31Å; D1099-K1102 IonicContact OD1-NZ 3.83Å; D1099-K1102 PolarHBondContact OD1-NZ 2.88Å; D1099-L1103 WeakPolarHBondContact O-CB 3.31Å; D1099-L1103 WeakPolarHBondContact O-CG 3.19Å; D1099-L1103 PolarHBondContact O-N 2.83Å
1100	L	75.4	Confident	74	Confident	6 Å²	6	67.5 Å²	67.5	3%	0.031	36%	0.359	C	S	.	.	H	α-helix	trans	-53.1	-34.8	169.1	-75.4	171.8	0	0	0	112.1	I999 F1032 F1095 L1097 K1098 S1104	I999-L1100 HydrophobicContact CD1-CD2 4.5Å; I999-L1100 HydrophobicContact CG2-CD1 3.99Å; F1032-L1100 HydrophobicContact CB-CD2 4.16Å; F1032-L1100 HydrophobicContact CD1-CD2 3.67Å; F1032-L1100 HydrophobicContact CD2-CD2 3.41Å; F1032-L1100 VanDerWaalsContact CD2-CD2 3.41Å; F1032-L1100 HydrophobicContact CE1-CD2 3.85Å; F1032-L1100 HydrophobicContact CE2-CD2 3.59Å; F1032-L1100 HydrophobicContact CG-CD2 3.45Å; F1032-L1100 VanDerWaalsContact CG-CD2 3.45Å; F1032-L1100 HydrophobicContact CZ-CD2 3.81Å; F1095-L1100 HydrophobicContact CE2-CD2 3.61Å; F1095-L1100 HydrophobicContact CE2-CG 4.05Å; F1095-L1100 HydrophobicContact CZ-CD2 4.15Å; L1097-L1100 HydrophobicContact CB-CD1 4.22Å; L1097-L1100 HydrophobicContact CD2-CD1 3.65Å; L1097-L1100 HydrophobicContact CD2-CG 4.44Å; L1097-L1100 VanDerWaalsContact O-CB 3.3Å; L1097-L1100 WeakPolarHBondContact O-CB 3.13Å; L1097-L1100 WeakPolarHBondContact O-CG 3.38Å; L1097-L1100 PolarHBondContact O-N 3.34Å; K1098-L1100 VanDerWaalsContact C-N 3.32Å; K1098-L1100 PolarHBondContact O-N 3.49Å; L1100-S1104 WeakPolarHBondContact O-CB 3.33Å; L1100-S1104 PolarHBondContact O-N 3.04Å
1101	S	70	Confident	72.2	Confident	61 Å²	61	71 Å²	71	43%	0.427	38%	0.375	S	S	.	.	H	α-helix	trans	-62.5	-44.6	175.1	62	0	0	0	0	112.2	K1098 D1099 A1105	K1098-S1101 PolarHBondContact O-OG 3.2Å; D1099-S1101 PolarHBondContact O-N 3.44Å; D1099-S1101 VanDerWaalsContact O-N 3.14Å; S1101-A1105 PolarHBondContact O-N 2.69Å
1102	K	70.1	Confident	70.4	Confident	132 Å²	132	71.6 Å²	71.6	57%	0.574	37%	0.368	S	S	*	.	H	α-helix	trans	-72.4	-48.2	178.7	-54.3	177.7	-167.7	160.4	0	111.1	D1099 S1104 A1105 E1106	D1099-K1102 CarbonylContact O-C 3.55Å; D1099-K1102 WeakPolarHBondContact O-CA 3.32Å; D1099-K1102 PolarHBondContact O-N 2.88Å; D1099-K1102 VanDerWaalsContact OD1-CD 3.31Å; D1099-K1102 WeakPolarHBondContact OD1-CD 3.48Å; D1099-K1102 WeakPolarHBondContact OD1-CE 3.31Å; D1099-K1102 IonicContact OD1-NZ 3.83Å; D1099-K1102 PolarHBondContact OD1-NZ 2.88Å; K1102-S1104 VanDerWaalsContact C-N 3.28Å; K1102-S1104 PolarHBondContact O-N 3.48Å; K1102-A1105 CarbonylContact O-C 3.55Å; K1102-A1105 WeakPolarHBondContact O-CA 3.29Å; K1102-A1105 WeakPolarHBondContact O-CB 3.26Å; K1102-A1105 PolarHBondContact O-N 3.32Å; K1102-E1106 PolarHBondContact O-N 3.16Å
1103	L	59.6	Low	68.6	Low	64 Å²	64	71 Å²	71	34%	0.335	37%	0.374	S	S	.	.	H	α-helix	trans	-62.3	-32.9	176.9	-66.3	173.3	0	0	0	112	F1032 F1095 D1099 A1105 E1106 H1107	F1032-L1103 HydrophobicContact CD2-CB 4.36Å; F1032-L1103 HydrophobicContact CE2-CB 4.02Å; F1032-L1103 HydrophobicContact CE2-CD1 4.11Å; F1095-L1103 HydrophobicContact CB-CD1 4.47Å; F1095-L1103 HydrophobicContact CD2-CD1 4Å; F1095-L1103 HydrophobicContact CE2-CD1 4.49Å; F1095-L1103 HydrophobicContact CG-CD1 4.17Å; D1099-L1103 WeakPolarHBondContact O-CB 3.31Å; D1099-L1103 WeakPolarHBondContact O-CG 3.19Å; D1099-L1103 PolarHBondContact O-N 2.83Å; L1103-A1105 VanDerWaalsContact C-N 3.29Å; L1103-A1105 PolarHBondContact O-N 3.48Å; L1103-E1106 PolarHBondContact O-N 3.49Å; L1103-H1107 WeakPolarHBondContact O-CB 3.4Å; L1103-H1107 PolarHBondContact O-N 2.75Å
1104	S	60.5	Low	66.7	Low	10 Å²	10	71.8 Å²	71.8	7%	0.07	38%	0.383	C	S	.	.	H	α-helix	trans	-67.6	-28.3	171.2	178	0	0	0	0	112.9	K1031 L1100 K1102 L1108	K1031-S1104 VanDerWaalsContact CB-OG 3.3Å; K1031-S1104 WeakPolarHBondContact CB-OG 3.36Å; K1031-S1104 VanDerWaalsContact CD-OG 3.24Å; K1031-S1104 WeakPolarHBondContact CD-OG 3.34Å; L1100-S1104 WeakPolarHBondContact O-CB 3.33Å; L1100-S1104 PolarHBondContact O-N 3.04Å; K1102-S1104 VanDerWaalsContact C-N 3.28Å; K1102-S1104 PolarHBondContact O-N 3.48Å; S1104-L1108 VanDerWaalsContact O-CB 3.3Å; S1104-L1108 WeakPolarHBondContact O-CB 3.21Å; S1104-L1108 PolarHBondContact O-N 3.49Å
1105	A	59.6	Low	64.7	Low	47 Å²	47	71.6 Å²	71.6	39%	0.388	37%	0.37	S	S	.	.	H	α-helix	trans	-80.7	-41	172.5	0	0	0	0	0	111	S1101 K1102 L1103 L1108 R1109	S1101-A1105 PolarHBondContact O-N 2.69Å; K1102-A1105 CarbonylContact O-C 3.55Å; K1102-A1105 WeakPolarHBondContact O-CA 3.29Å; K1102-A1105 WeakPolarHBondContact O-CB 3.26Å; K1102-A1105 PolarHBondContact O-N 3.32Å; L1103-A1105 VanDerWaalsContact C-N 3.29Å; L1103-A1105 PolarHBondContact O-N 3.48Å; A1105-L1108 PolarHBondContact O-N 2.95Å; A1105-R1109 WeakPolarHBondContact O-CG 3.27Å; A1105-R1109 PolarHBondContact O-N 2.84Å
1106	E	58.4	Low	62.7	Low	92 Å²	92	75.2 Å²	75.2	43%	0.43	39%	0.386	S	S	.	.	H	α-helix	trans	-59.8	-51.6	175.8	-155.8	63.5	-123.4	0	0	111.4	K1102 L1103 L1108 R1109 E1110	K1102-E1106 PolarHBondContact O-N 3.16Å; L1103-E1106 PolarHBondContact O-N 3.49Å; E1106-L1108 VanDerWaalsContact C-N 3.31Å; E1106-L1108 PolarHBondContact O-N 2.96Å; E1106-R1109 CarbonylContact O-C 3.44Å; E1106-R1109 WeakPolarHBondContact O-CB 3.41Å; E1106-R1109 PolarHBondContact O-N 3.37Å; E1106-R1109 VanDerWaalsContact O-N 3.11Å; E1106-R1109 IonicContact OE1-CZ 3.74Å; E1106-R1109 IonicContact OE1-NE 2.64Å; E1106-R1109 IonicContact OE1-NH2 3.59Å; E1106-R1109 PolarHBondContact OE1-NH2 2.76Å; E1106-R1109 IonicContact OE2-CZ 2.67Å; E1106-R1109 IonicContact OE2-NH1 2.65Å; E1106-R1109 IonicContact OE2-NH2 3.22Å; E1106-R1109 PolarHBondContact OE2-NH2 2.67Å; E1106-E1110 PolarHBondContact O-N 2.88Å
1107	H	57.7	Low	61.1	Low	98 Å²	98	77.6 Å²	77.6	45%	0.454	40%	0.399	S	S	.	.	H	α-helix	trans	-63.6	-35.4	177.8	-172	69.1	0	0	0	112.3	L1103 E1110 Q1111	L1103-H1107 WeakPolarHBondContact O-CB 3.4Å; L1103-H1107 PolarHBondContact O-N 2.75Å; H1107-E1110 PolarHBondContact O-N 3.43Å; H1107-Q1111 PolarHBondContact NE2-NE2 2.64Å; H1107-Q1111 WeakPolarHBondContact O-CB 3.23Å; H1107-Q1111 WeakPolarHBondContact O-CG 3.35Å; H1107-Q1111 PolarHBondContact O-N 2.83Å
1108	L	53.9	Low	59.5	Low	73 Å²	73	82.3 Å²	82.3	38%	0.382	42%	0.423	S	S	.	.	H	α-helix	trans	-70.3	-37.2	173.9	-174	62.1	0	0	0	111.6	S1104 A1105 E1106 Q1112	S1104-L1108 VanDerWaalsContact O-CB 3.3Å; S1104-L1108 WeakPolarHBondContact O-CB 3.21Å; S1104-L1108 PolarHBondContact O-N 3.49Å; A1105-L1108 PolarHBondContact O-N 2.95Å; E1106-L1108 VanDerWaalsContact C-N 3.31Å; E1106-L1108 PolarHBondContact O-N 2.96Å; L1108-Q1112 VanDerWaalsContact O-CB 3.27Å; L1108-Q1112 WeakPolarHBondContact O-CB 3.29Å; L1108-Q1112 WeakPolarHBondContact O-CG 3.38Å; L1108-Q1112 PolarHBondContact O-N 3.19Å
1109	R	56.7	Low	57.6	Low	139 Å²	139	78 Å²	78	53%	0.525	41%	0.411	S	S	.	.	H	α-helix	trans	-65	-41.6	171	-72.7	-156.1	-49.6	-96.9	6.5	111.8	A1105 E1106 Q1112 A1113	A1105-R1109 WeakPolarHBondContact O-CG 3.27Å; A1105-R1109 PolarHBondContact O-N 2.84Å; E1106-R1109 CarbonylContact O-C 3.44Å; E1106-R1109 WeakPolarHBondContact O-CB 3.41Å; E1106-R1109 PolarHBondContact O-N 3.37Å; E1106-R1109 VanDerWaalsContact O-N 3.11Å; E1106-R1109 IonicContact OE1-CZ 3.74Å; E1106-R1109 IonicContact OE1-NE 2.64Å; E1106-R1109 IonicContact OE1-NH2 3.59Å; E1106-R1109 PolarHBondContact OE1-NH2 2.76Å; E1106-R1109 IonicContact OE2-CZ 2.67Å; E1106-R1109 IonicContact OE2-NH1 2.65Å; E1106-R1109 IonicContact OE2-NH2 3.22Å; E1106-R1109 PolarHBondContact OE2-NH2 2.67Å; R1109-Q1112 CarbonylContact O-C 3.57Å; R1109-Q1112 PolarHBondContact O-N 2.96Å; R1109-A1113 VanDerWaalsContact O-CB 3.27Å; R1109-A1113 WeakPolarHBondContact O-CB 3.19Å; R1109-A1113 PolarHBondContact O-N 2.99Å
1110	E	58.3	Low	55.6	Low	102 Å²	102	80.9 Å²	80.9	48%	0.477	43%	0.426	S	S	.	.	H	α-helix	trans	-72.8	-36.6	-179.9	-165.7	169.2	-157.6	0	0	111.8	E1106 H1107 A1113 A1114 R1145	E1106-E1110 PolarHBondContact O-N 2.88Å; H1107-E1110 PolarHBondContact O-N 3.43Å; E1110-A1113 PolarHBondContact O-N 2.65Å; E1110-A1114 WeakPolarHBondContact O-CB 3.27Å; E1110-A1114 PolarHBondContact O-N 3.2Å; E1110-R1145 IonicContact OE1-NH1 3.46Å; E1110-R1145 PolarHBondContact OE1-NH1 3.36Å
1111	Q	54.3	Low	54.3	Low	110 Å²	110	88 Å²	88	51%	0.514	46%	0.457	S	S	.	.	H	α-helix	trans	-61.6	-42.7	167	-78.4	-168.3	-4.7	0	0	112	H1107 S1115	H1107-Q1111 PolarHBondContact NE2-NE2 2.64Å; H1107-Q1111 WeakPolarHBondContact O-CB 3.23Å; H1107-Q1111 WeakPolarHBondContact O-CG 3.35Å; H1107-Q1111 PolarHBondContact O-N 2.83Å; Q1111-S1115 WeakPolarHBondContact O-CB 3.49Å; Q1111-S1115 PolarHBondContact O-N 2.83Å
1112	Q	53.3	Low	53.1	Low	101 Å²	101	93.1 Å²	93.1	47%	0.472	48%	0.476	S	S	.	.	H	α-helix	trans	-68.4	-33.6	176	-75.5	176.3	0.6	0	0	112.4	L1108 R1109 K1116	L1108-Q1112 VanDerWaalsContact O-CB 3.27Å; L1108-Q1112 WeakPolarHBondContact O-CB 3.29Å; L1108-Q1112 WeakPolarHBondContact O-CG 3.38Å; L1108-Q1112 PolarHBondContact O-N 3.19Å; R1109-Q1112 CarbonylContact O-C 3.57Å; R1109-Q1112 PolarHBondContact O-N 2.96Å; Q1112-K1116 WeakPolarHBondContact O-CB 3.32Å; Q1112-K1116 WeakPolarHBondContact O-CG 3.21Å; Q1112-K1116 PolarHBondContact O-N 2.91Å
1113	A	53.3	Low	51.5	Low	49 Å²	49	91.8 Å²	91.8	41%	0.405	48%	0.479	S	S	.	.	H	α-helix	trans	-69.8	-45.1	174.7	0	0	0	0	0	111.1	R1109 E1110 S1115 K1116 V1117	R1109-A1113 VanDerWaalsContact O-CB 3.27Å; R1109-A1113 WeakPolarHBondContact O-CB 3.19Å; R1109-A1113 PolarHBondContact O-N 2.99Å; E1110-A1113 PolarHBondContact O-N 2.65Å; A1113-S1115 VanDerWaalsContact C-N 3.34Å; A1113-S1115 PolarHBondContact O-N 2.83Å; A1113-K1116 PolarHBondContact O-N 2.88Å; A1113-V1117 WeakPolarHBondContact O-CB 3.36Å; A1113-V1117 VanDerWaalsContact O-CG2 3.29Å; A1113-V1117 WeakPolarHBondContact O-CG2 3.45Å; A1113-V1117 PolarHBondContact O-N 2.75Å
1114	A	48.5	Very low	50.4	Low	37 Å²	37	98 Å²	98	31%	0.306	50%	0.504	S	S	.	.	H	α-helix	trans	-60.6	-43.3	173.1	0	0	0	0	0	111.6	E1110 V1117 I1118	E1110-A1114 WeakPolarHBondContact O-CB 3.27Å; E1110-A1114 PolarHBondContact O-N 3.2Å; A1114-V1117 PolarHBondContact O-N 2.84Å; A1114-I1118 WeakPolarHBondContact O-CD1 2.87Å; A1114-I1118 VanDerWaalsContact O-CG1 3.29Å; A1114-I1118 WeakPolarHBondContact O-CG1 3.24Å; A1114-I1118 PolarHBondContact O-N 3.08Å
1115	S	45.9	Very low	49.3	Very low	69 Å²	69	101.3 Å²	101.3	48%	0.483	54%	0.54	S	S	.	.	H	α-helix	trans	-63.8	-40.3	175.9	-172.3	0	0	0	0	112.5	Q1111 A1113 I1118 T1119	Q1111-S1115 WeakPolarHBondContact O-CB 3.49Å; Q1111-S1115 PolarHBondContact O-N 2.83Å; A1113-S1115 VanDerWaalsContact C-N 3.34Å; A1113-S1115 PolarHBondContact O-N 2.83Å; S1115-I1118 PolarHBondContact O-N 3.19Å; S1115-T1119 PolarHBondContact O-N 3.34Å; S1115-T1119 PolarHBondContact O-OG1 3.31Å
1116	K	46	Very low	47.8	Very low	130 Å²	130	104.7 Å²	104.7	57%	0.565	56%	0.561	S	S	*	*	H	α-helix	trans	-63.2	-47.8	171.9	-76.2	172	179.6	-173	0	111.7	Q1112 A1113 I1118 T1119 D1120	Q1112-K1116 WeakPolarHBondContact O-CB 3.32Å; Q1112-K1116 WeakPolarHBondContact O-CG 3.21Å; Q1112-K1116 PolarHBondContact O-N 2.91Å; A1113-K1116 PolarHBondContact O-N 2.88Å; K1116-I1118 PolarHBondContact O-N 3.34Å; K1116-I1118 VanDerWaalsContact O-N 3.15Å; K1116-T1119 CarbonylContact O-C 3.59Å; K1116-T1119 WeakPolarHBondContact O-CA 3.31Å; K1116-T1119 PolarHBondContact O-N 2.74Å; K1116-D1120 WeakPolarHBondContact O-CB 3.33Å; K1116-D1120 VanDerWaalsContact O-CG 3.23Å; K1116-D1120 PolarHBondContact O-N 3.36Å
1117	V	52.3	Low	46.8	Very low	80 Å²	80	105.5 Å²	105.5	49%	0.485	57%	0.574	S	S	.	*	H	α-helix	trans	-62.2	-22.9	176.6	170.4	0	0	0	0	113.2	A1113 A1114 K1121	A1113-V1117 WeakPolarHBondContact O-CB 3.36Å; A1113-V1117 VanDerWaalsContact O-CG2 3.29Å; A1113-V1117 WeakPolarHBondContact O-CG2 3.45Å; A1113-V1117 PolarHBondContact O-N 2.75Å; A1114-V1117 PolarHBondContact O-N 2.84Å; V1117-K1121 VanDerWaalsContact O-CD 3.31Å; V1117-K1121 WeakPolarHBondContact O-CD 3.38Å; V1117-K1121 VanDerWaalsContact O-CG 3.27Å; V1117-K1121 WeakPolarHBondContact O-CG 3.27Å
1118	I	52.5	Low	45.5	Very low	112 Å²	112	109.3 Å²	109.3	57%	0.574	60%	0.597	S	S	*	*	H	α-helix	trans	-80	-42.2	169.5	-68.5	162.3	0	0	0	111	A1114 S1115 K1116 K1121	A1114-I1118 WeakPolarHBondContact O-CD1 2.87Å; A1114-I1118 VanDerWaalsContact O-CG1 3.29Å; A1114-I1118 WeakPolarHBondContact O-CG1 3.24Å; A1114-I1118 PolarHBondContact O-N 3.08Å; S1115-I1118 PolarHBondContact O-N 3.19Å; K1116-I1118 PolarHBondContact O-N 3.34Å; K1116-I1118 VanDerWaalsContact O-N 3.15Å; I1118-K1121 PolarHBondContact O-N 3.19Å
1119	T	43.5	Very low	44.5	Very low	76 Å²	76	111.5 Å²	111.5	47%	0.466	62%	0.618	S	S	.	*	H	α-helix	trans	-68.3	-46.7	-178.6	-51.8	0	0	0	0	112	S1115 K1116 K1121 M1122 T1123	S1115-T1119 PolarHBondContact O-N 3.34Å; S1115-T1119 PolarHBondContact O-OG1 3.31Å; K1116-T1119 CarbonylContact O-C 3.59Å; K1116-T1119 WeakPolarHBondContact O-CA 3.31Å; K1116-T1119 PolarHBondContact O-N 2.74Å; T1119-K1121 PolarHBondContact O-N 3.45Å; T1119-K1121 VanDerWaalsContact O-N 3.08Å; T1119-M1122 PolarHBondContact O-N 3.16Å; T1119-T1123 PolarHBondContact O-OG1 1.92Å
1120	D	38.6	Very low	43.4	Very low	110 Å²	110	109.3 Å²	109.3	59%	0.588	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-21.9	179	-63.4	-31.1	0	0	0	112.2	K1116	K1116-D1120 WeakPolarHBondContact O-CB 3.33Å; K1116-D1120 VanDerWaalsContact O-CG 3.23Å; K1116-D1120 PolarHBondContact O-N 3.36Å
1121	K	48.5	Very low	41.9	Very low	157 Å²	157	111.3 Å²	111.3	68%	0.683	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-0.9	175.6	-69.3	-177.9	-176.3	-173.3	0	114.6	V1117 I1118 T1119	V1117-K1121 VanDerWaalsContact O-CD 3.31Å; V1117-K1121 WeakPolarHBondContact O-CD 3.38Å; V1117-K1121 VanDerWaalsContact O-CG 3.27Å; V1117-K1121 WeakPolarHBondContact O-CG 3.27Å; I1118-K1121 PolarHBondContact O-N 3.19Å; T1119-K1121 PolarHBondContact O-N 3.45Å; T1119-K1121 VanDerWaalsContact O-N 3.08Å
1122	M	42.8	Very low	41	Very low	168 Å²	168	113 Å²	113	83%	0.828	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	-7.4	173.3	-79.8	-173.4	158.3	0	0	113.7	T1119	T1119-M1122 PolarHBondContact O-N 3.16Å
1123	T	38	Very low	39.8	Very low	104 Å²	104	111.8 Å²	111.8	64%	0.638	66%	0.66	S	S	*	*	S	Bend	trans	-99.9	-10.8	-171.8	-46.8	0	0	0	0	114.7	T1119	T1119-T1123 PolarHBondContact O-OG1 1.92Å
1124	F	36.3	Very low	39.5	Very low	193 Å²	193	115.4 Å²	115.4	85%	0.846	68%	0.68	S	S	*	*	S	Bend	trans	-120.1	118.4	165.4	-76.6	-87.7	0	0	0	109.1
1125	G	36.9	Very low	38.9	Very low	80 Å²	80	120.5 Å²	120.5	83%	0.825	70%	0.697	S	S	*	*			trans	-155.9	139	-173.9	0	0	0	0	0	116
1126	S	28.1	Very low	38.7	Very low	119 Å²	119	123.5 Å²	123.5	83%	0.832	71%	0.708	S	S	*	*			trans	-162.9	168.1	153.8	-140.1	0	0	0	0	108.8
1127	P	38.4	Very low	38.7	Very low	108 Å²	108	122.2 Å²	122.2	70%	0.701	71%	0.707	S	S	*	*				-92.7	135.4	-96.1	35.1	-31	0	0	0	112.9	S1129	P1127-S1129 PolarHBondContact O-N 3.43Å
1128	L	29.9	Very low	38.6	Very low	179 Å²	179	124.3 Å²	124.3	94%	0.937	72%	0.72	S	S	*	*			trans	-86.6	58.7	-177.4	-137.9	163.6	0	0	0	112.1
1129	S	32.3	Very low	38.6	Very low	118 Å²	118	120.6 Å²	120.6	83%	0.825	71%	0.71	S	S	*	*			trans	-131	33.4	178.4	-66.7	0	0	0	0	113.6	P1127	P1127-S1129 PolarHBondContact O-N 3.43Å
1130	A	33.1	Very low	40.1	Very low	94 Å²	94	118.6 Å²	118.6	78%	0.777	70%	0.699	S	S	*	*			trans	-163.6	98.1	162.1	0	0	0	0	0	111.4
1131	L	27.8	Very low	42.2	Very low	143 Å²	143	115 Å²	115	75%	0.749	68%	0.681	S	S	*	*				-169	103.9	126.2	-160.6	63.9	0	0	0	111.5	T1133	L1131-T1133 HydrophobicContact CD1-CG2 4.33Å; L1131-T1133 VanDerWaalsContact CD1-OG1 3.27Å; L1131-T1133 WeakPolarHBondContact CD1-OG1 3.31Å; L1131-T1133 VanDerWaalsContact CG-OG1 3.28Å; L1131-T1133 WeakPolarHBondContact CG-OG1 3.27Å
1132	T	35.4	Very low	44	Very low	145 Å²	145	108.5 Å²	108.5	89%	0.89	65%	0.653	S	S	*	*			trans	-108.6	73.9	164.9	49.7	0	0	0	0	109.5
1133	T	28.5	Very low	46.1	Very low	76 Å²	76	103 Å²	103	47%	0.466	63%	0.625	S	S	.	*			trans	-142.5	130.8	172.1	54.2	0	0	0	0	110.4	L1131 E1135	L1131-T1133 HydrophobicContact CD1-CG2 4.33Å; L1131-T1133 VanDerWaalsContact CD1-OG1 3.27Å; L1131-T1133 WeakPolarHBondContact CD1-OG1 3.31Å; L1131-T1133 VanDerWaalsContact CG-OG1 3.28Å; L1131-T1133 WeakPolarHBondContact CG-OG1 3.27Å; T1133-E1135 WeakPolarHBondContact CB-OE1 3.22Å; T1133-E1135 PolarHBondContact O-N 3.16Å
1134	P	46.9	Very low	48.6	Very low	126 Å²	126	98.1 Å²	98.1	82%	0.818	60%	0.595	S	S	*	*			trans	-95.2	74.2	-176.6	38.2	-36.4	0	0	0	113.7
1135	E	34.8	Very low	50.8	Low	143 Å²	143	94.9 Å²	94.9	67%	0.668	58%	0.577	S	S	*	*			trans	-114.9	130	-175.4	-31.3	-59.5	128.5	0	0	113.1	T1133	T1133-E1135 WeakPolarHBondContact CB-OE1 3.22Å; T1133-E1135 PolarHBondContact O-N 3.16Å
1136	D	42.9	Very low	53	Low	133 Å²	133	94.5 Å²	94.5	71%	0.711	56%	0.555	S	S	*	*			trans	16	112.4	169.5	-88.5	-79.7	0	0	0	123.1	T1138	D1136-T1138 WeakPolarHBondContact OD1-CB 3.44Å; D1136-T1138 WeakPolarHBondContact OD1-CG2 3.38Å; D1136-T1138 PolarHBondContact OD1-OG1 3.29Å
1137	D	44.6	Very low	55.7	Low	102 Å²	102	91 Å²	91	55%	0.545	53%	0.53	S	S	.	.			trans	-116.6	53.5	161.9	-167.7	-12.2	0	0	0	109.9	G1139 S1140 Y1142	D1137-G1139 VanDerWaalsContact C-N 3.32Å; D1137-G1139 PolarHBondContact O-N 3.25Å; D1137-S1140 WeakPolarHBondContact OD1-CB 3.21Å; D1137-S1140 PolarHBondContact OD1-OG 3.32Å; D1137-Y1142 PolarHBondContact OD2-OH 3.34Å; D1137-Y1142 VanDerWaalsContact OD2-OH 3.12Å
1138	T	50.1	Low	57.9	Low	124 Å²	124	91 Å²	91	76%	0.761	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	9.8	-161.4	8.4	0	0	0	0	116.6	D1136	D1136-T1138 WeakPolarHBondContact OD1-CB 3.44Å; D1136-T1138 WeakPolarHBondContact OD1-CG2 3.38Å; D1136-T1138 PolarHBondContact OD1-OG1 3.29Å
1139	G	54	Low	60.6	Low	35 Å²	35	90 Å²	90	36%	0.361	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.4	-11.6	-173.9	0	0	0	0	0	116.7	D1137	D1137-G1139 VanDerWaalsContact C-N 3.32Å; D1137-G1139 PolarHBondContact O-N 3.25Å
1140	S	74.3	Confident	63.2	Low	34 Å²	34	88.4 Å²	88.4	24%	0.238	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	114.6	-166.2	-59.6	0	0	0	0	113.1	D1137 Y1142	D1137-S1140 WeakPolarHBondContact OD1-CB 3.21Å; D1137-S1140 PolarHBondContact OD1-OG 3.32Å; S1140-Y1142 VanDerWaalsContact CB-OH 3.25Å; S1140-Y1142 WeakPolarHBondContact CB-OH 3.15Å; S1140-Y1142 WeakPolarHBondContact O-CD2 3.38Å; S1140-Y1142 VanDerWaalsContact O-CE2 3.23Å; S1140-Y1142 WeakPolarHBondContact O-CE2 3.34Å
1141	V	83	Confident	65.8	Low	34 Å²	34	85.8 Å²	85.8	21%	0.206	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	116.9	175	-179.6	0	0	0	0	110	T1150 L1179 K1181	V1141-T1150 HydrophobicContact CG1-CG2 4.11Å; V1141-L1179 PolarHBondContact N-O 3.25Å; V1141-L1179 WeakPolarHBondContact O-CA 3.08Å; V1141-L1179 WeakPolarHBondContact O-CB 3.4Å; V1141-L1179 PolarHBondContact O-N 3.36Å; V1141-K1181 HydrophobicContact CG2-CG 4.46Å
1142	Y	86.6	Confident	68.4	Low	21 Å²	21	85.3 Å²	85.3	8%	0.082	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124.9	-173.8	-57.6	-86.8	0	0	0	111.7	D1137 S1140 T1150 F1151 K1154 V1157 V1176 A1178	D1137-Y1142 PolarHBondContact OD2-OH 3.34Å; D1137-Y1142 VanDerWaalsContact OD2-OH 3.12Å; S1140-Y1142 VanDerWaalsContact CB-OH 3.25Å; S1140-Y1142 WeakPolarHBondContact CB-OH 3.15Å; S1140-Y1142 WeakPolarHBondContact O-CD2 3.38Å; S1140-Y1142 VanDerWaalsContact O-CE2 3.23Å; S1140-Y1142 WeakPolarHBondContact O-CE2 3.34Å; Y1142-T1150 CarbonylContact O-C 3.48Å; Y1142-T1150 WeakPolarHBondContact O-CA 3.44Å; Y1142-F1151 PolarHBondContact N-O 3.16Å; Y1142-F1151 PolarHBondContact O-N 3.36Å; Y1142-K1154 HydrophobicContact CD2-CB 4.32Å; Y1142-K1154 VanDerWaalsContact CD2-N 3.27Å; Y1142-K1154 HydrophobicContact CE1-CB 4.23Å; Y1142-K1154 HydrophobicContact CE1-CG 4.27Å; Y1142-K1154 HydrophobicContact CE2-CB 3.76Å; Y1142-V1157 HydrophobicContact CG-CG1 4.19Å; Y1142-V1176 HydrophobicContact CD1-CG1 3.84Å; Y1142-V1176 HydrophobicContact CG-CG1 4.24Å; Y1142-A1178 HydrophobicContact CD1-CB 4Å; Y1142-A1178 HydrophobicContact CE1-CB 4.03Å
1143	Q	86.8	Confident	70.7	Confident	53 Å²	53	80.9 Å²	80.9	25%	0.248	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	128.3	177.6	-164.9	176.1	29.4	0	0	111.6	R1145 N1148 R1149 T1150 V1176 T1177 L1179	Q1143-R1145 PolarHBondContact O-N 2.88Å; Q1143-N1148 PolarHBondContact NE2-O 3.1Å; Q1143-R1149 WeakPolarHBondContact CA-O 3.29Å; Q1143-T1150 HydrophobicContact CB-CG2 4.05Å; Q1143-T1150 HydrophobicContact CG-CG2 3.95Å; Q1143-V1176 WeakPolarHBondContact O-CA 3.37Å; Q1143-T1177 PolarHBondContact N-O 3.09Å; Q1143-T1177 PolarHBondContact O-N 3.39Å; Q1143-L1179 HydrophobicContact CB-CD1 4.29Å
1144	C	89.6	Confident	73.4	Confident	0 Å²	0	82.1 Å²	82.1	0%	0	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	117.4	172.2	178.6	0	0	0	0	110.5	L1146 C1147 N1148 R1149 F1151 V1157 L1161	C1144-L1146 PolarHBondContact O-N 2.78Å; C1144-L1146 VanDerWaalsContact O-N 3.1Å; C1144-C1147 PolarHBondContact O-N 3.31Å; C1144-C1147 VanDerWaalsContact SG-SG 3.7Å; C1144-N1148 WeakPolarHBondContact O-CA 3.25Å; C1144-N1148 PolarHBondContact O-N 2.99Å; C1144-R1149 PolarHBondContact N-O 3.22Å; C1144-F1151 HydrophobicContact CB-CE2 4.03Å; C1144-V1157 HydrophobicContact CB-CG2 4.02Å; C1144-L1161 VanDerWaalsContact SG-CD2 3.59Å
1145	R	83.2	Confident	75.1	Confident	126 Å²	126	82.4 Å²	82.4	48%	0.475	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-12	-178.8	-67.9	-174.9	172.3	-159	-1.3	114.8	E1110 Q1143 F1175 T1177	E1110-R1145 IonicContact OE1-NH1 3.46Å; E1110-R1145 PolarHBondContact OE1-NH1 3.36Å; Q1143-R1145 PolarHBondContact O-N 2.88Å; R1145-F1175 PolarHBondContact N-O 3.42Å; R1145-T1177 PolarHBondContact NE-OG1 3.05Å
1146	L	82.6	Confident	77.7	Confident	71 Å²	71	77.3 Å²	77.3	37%	0.372	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-14	-174.9	-56.7	173.1	0	0	0	113.8	C1144 L1161 H1165 K1167 F1175	C1144-L1146 PolarHBondContact O-N 2.78Å; C1144-L1146 VanDerWaalsContact O-N 3.1Å; L1146-L1161 HydrophobicContact CD1-CD2 3.67Å; L1146-L1161 HydrophobicContact CG-CD2 4.5Å; L1146-H1165 HydrophobicContact CD1-CB 3.73Å; L1146-K1167 HydrophobicContact CD1-CD 3.7Å; L1146-K1167 HydrophobicContact CD1-CG 4.42Å; L1146-F1175 HydrophobicContact CD1-CB 4.4Å; L1146-F1175 HydrophobicContact CD1-CD1 4.18Å; L1146-F1175 HydrophobicContact CD1-CG 4.39Å; L1146-F1175 HydrophobicContact CD2-CD1 3.98Å; L1146-F1175 HydrophobicContact CG-CD1 4.23Å
1147	C	85.8	Confident	79.8	Confident	45 Å²	45	71 Å²	71	30%	0.304	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.9	0.2	-177.5	67.2	0	0	0	0	113.3	C1144 R1149 H1160	C1144-C1147 PolarHBondContact O-N 3.31Å; C1144-C1147 VanDerWaalsContact SG-SG 3.7Å; C1147-R1149 HydrophobicContact CB-CG 4.39Å; C1147-R1149 PolarHBondContact O-N 2.86Å; C1147-H1160 PolarHBondContact SG-NE2 2.82Å
1148	N	84.3	Confident	81.8	Confident	110 Å²	110	69.1 Å²	69.1	59%	0.588	37%	0.367	S	S	*	.			trans	55.6	13.7	-177.3	-61.3	-21.3	0	0	0	116.1	Q1143 C1144	Q1143-N1148 PolarHBondContact NE2-O 3.1Å; C1144-N1148 WeakPolarHBondContact O-CA 3.25Å; C1144-N1148 PolarHBondContact O-N 2.99Å
1149	R	85.9	Confident	83.5	Confident	158 Å²	158	67.7 Å²	67.7	60%	0.596	35%	0.354	S	S	*	.			trans	-71	137.4	174	-64.6	179.9	-177.6	-161.3	0.6	111	Q1143 C1144 C1147 F1151	Q1143-R1149 WeakPolarHBondContact CA-O 3.29Å; C1144-R1149 PolarHBondContact N-O 3.22Å; C1147-R1149 HydrophobicContact CB-CG 4.39Å; C1147-R1149 PolarHBondContact O-N 2.86Å; R1149-F1151 HydrophobicContact CB-CE2 3.68Å; R1149-F1151 HydrophobicContact CB-CZ 3.75Å; R1149-F1151 WeakPolarHBondContact O-CD2 3.27Å; R1149-F1151 VanDerWaalsContact O-CE2 3.27Å; R1149-F1151 WeakPolarHBondContact O-CE2 3.48Å
1150	T	87.5	Confident	85.1	Confident	83 Å²	83	66.9 Å²	66.9	51%	0.509	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	148.8	176	45.2	0	0	0	0	111.6	V1141 Y1142 Q1143 L1179	V1141-T1150 HydrophobicContact CG1-CG2 4.11Å; Y1142-T1150 CarbonylContact O-C 3.48Å; Y1142-T1150 WeakPolarHBondContact O-CA 3.44Å; Q1143-T1150 HydrophobicContact CB-CG2 4.05Å; Q1143-T1150 HydrophobicContact CG-CG2 3.95Å; T1150-L1179 HydrophobicContact CG2-CD1 4.46Å
1151	F	87.3	Confident	85.8	Confident	39 Å²	39	65.3 Å²	65.3	17%	0.171	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	131.4	-175.3	-60.9	-86.4	0	0	0	110	Y1142 C1144 R1149 S1153 A1156 V1157 H1160	Y1142-F1151 PolarHBondContact N-O 3.16Å; Y1142-F1151 PolarHBondContact O-N 3.36Å; C1144-F1151 HydrophobicContact CB-CE2 4.03Å; R1149-F1151 HydrophobicContact CB-CE2 3.68Å; R1149-F1151 HydrophobicContact CB-CZ 3.75Å; R1149-F1151 WeakPolarHBondContact O-CD2 3.27Å; R1149-F1151 VanDerWaalsContact O-CE2 3.27Å; R1149-F1151 WeakPolarHBondContact O-CE2 3.48Å; F1151-S1153 PolarHBondContact O-N 2.66Å; F1151-S1153 VanDerWaalsContact O-N 3.08Å; F1151-A1156 HydrophobicContact CB-CB 4.11Å; F1151-A1156 HydrophobicContact CD1-CB 4.1Å; F1151-A1156 HydrophobicContact CG-CB 4.47Å; F1151-V1157 HydrophobicContact CB-CB 3.98Å; F1151-V1157 HydrophobicContact CD2-CB 3.66Å; F1151-V1157 HydrophobicContact CD2-CG2 3.6Å; F1151-V1157 HydrophobicContact CE2-CB 4.44Å; F1151-V1157 HydrophobicContact CE2-CG2 4.06Å; F1151-V1157 HydrophobicContact CG-CB 3.92Å; F1151-V1157 HydrophobicContact CG-CG2 4.37Å; F1151-H1160 HydrophobicContact CE1-CB 3.83Å; F1151-H1160 AromaticContact CE1-CG 3.89Å; F1151-H1160 HydrophobicContact CE2-CB 4.14Å; F1151-H1160 AromaticContact CE2-CD2 3.53Å; F1151-H1160 AromaticContact CE2-CG 3.84Å; F1151-H1160 HydrophobicContact CZ-CB 3.59Å; F1151-H1160 AromaticContact CZ-CD2 3.33Å; F1151-H1160 WeakPolarHBondContact CZ-CD2 3.29Å; F1151-H1160 AromaticContact CZ-CE1 3.92Å; F1151-H1160 AromaticContact CZ-CG 3.22Å; F1151-H1160 AromaticContact CZ-ND1 3.61Å; F1151-H1160 AromaticContact CZ-NE2 3.77Å
1152	V	83.4	Confident	85.9	Confident	134 Å²	134	65.9 Å²	65.9	81%	0.812	34%	0.336	S	S	*	.	S	Bend	trans	-76.9	14.7	-179.9	-60.5	0	0	0	0	114.2
1153	S	83.8	Confident	85.9	Confident	51 Å²	51	73.3 Å²	73.3	36%	0.357	37%	0.368	S	S	.	.	S	Bend	trans	-158.8	140.5	179.7	174.6	0	0	0	0	111.9	F1151 H1155 A1156 V1157	F1151-S1153 PolarHBondContact O-N 2.66Å; F1151-S1153 VanDerWaalsContact O-N 3.08Å; S1153-H1155 PolarHBondContact O-N 3.44Å; S1153-H1155 PolarHBondContact OG-N 2.83Å; S1153-A1156 PolarHBondContact O-N 3.17Å; S1153-A1156 VanDerWaalsContact O-N 3.09Å; S1153-V1157 PolarHBondContact O-N 2.79Å; S1153-V1157 VanDerWaalsContact O-N 3.16Å
1154	K	83.6	Confident	85.8	Confident	102 Å²	102	74.5 Å²	74.5	44%	0.443	38%	0.38	S	S	.	.	H	α-helix	trans	-57.8	-33.6	173.2	-164.7	175.2	-177.7	177.1	0	112	Y1142 V1157 K1158	Y1142-K1154 HydrophobicContact CD2-CB 4.32Å; Y1142-K1154 VanDerWaalsContact CD2-N 3.27Å; Y1142-K1154 HydrophobicContact CE1-CB 4.23Å; Y1142-K1154 HydrophobicContact CE1-CG 4.27Å; Y1142-K1154 HydrophobicContact CE2-CB 3.76Å; K1154-V1157 WeakPolarHBondContact O-CG1 3.27Å; K1154-K1158 WeakPolarHBondContact O-CB 3.22Å; K1154-K1158 PolarHBondContact O-N 2.81Å
1155	H	83.1	Confident	85.4	Confident	132 Å²	132	77.5 Å²	77.5	61%	0.611	39%	0.393	S	S	*	.	H	α-helix	trans	-71.2	-41.3	175.6	-173.6	-111.5	0	0	0	111.7	S1153 K1158 L1159	S1153-H1155 PolarHBondContact O-N 3.44Å; S1153-H1155 PolarHBondContact OG-N 2.83Å; H1155-K1158 PolarHBondContact O-N 3.36Å; H1155-L1159 WeakPolarHBondContact O-CB 3.38Å; H1155-L1159 PolarHBondContact O-N 2.81Å
1156	A	88.7	Confident	85.2	Confident	37 Å²	37	74.8 Å²	74.8	31%	0.306	41%	0.405	S	S	.	.	H	α-helix	trans	-64.4	-42.3	-179.8	0	0	0	0	0	112.7	F1151 S1153 H1160	F1151-A1156 HydrophobicContact CB-CB 4.11Å; F1151-A1156 HydrophobicContact CD1-CB 4.1Å; F1151-A1156 HydrophobicContact CG-CB 4.47Å; S1153-A1156 PolarHBondContact O-N 3.17Å; S1153-A1156 VanDerWaalsContact O-N 3.09Å; A1156-H1160 WeakPolarHBondContact O-CB 3.45Å; A1156-H1160 PolarHBondContact O-N 2.99Å
1157	V	87.9	Confident	85.1	Confident	0 Å²	0	75 Å²	75	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-69.4	-33.7	174.9	70.2	0	0	0	0	112.6	Y1142 C1144 F1151 S1153 K1154 H1160 L1161 V1176	Y1142-V1157 HydrophobicContact CG-CG1 4.19Å; C1144-V1157 HydrophobicContact CB-CG2 4.02Å; F1151-V1157 HydrophobicContact CB-CB 3.98Å; F1151-V1157 HydrophobicContact CD2-CB 3.66Å; F1151-V1157 HydrophobicContact CD2-CG2 3.6Å; F1151-V1157 HydrophobicContact CE2-CB 4.44Å; F1151-V1157 HydrophobicContact CE2-CG2 4.06Å; F1151-V1157 HydrophobicContact CG-CB 3.92Å; F1151-V1157 HydrophobicContact CG-CG2 4.37Å; S1153-V1157 PolarHBondContact O-N 2.79Å; S1153-V1157 VanDerWaalsContact O-N 3.16Å; K1154-V1157 WeakPolarHBondContact O-CG1 3.27Å; V1157-H1160 WeakPolarHBondContact O-CB 3.27Å; V1157-H1160 PolarHBondContact O-N 2.91Å; V1157-L1161 WeakPolarHBondContact O-CG 3.31Å; V1157-L1161 PolarHBondContact O-N 3.22Å; V1157-V1176 HydrophobicContact CB-CG2 4.34Å; V1157-V1176 HydrophobicContact CG1-CG1 4.02Å; V1157-V1176 HydrophobicContact CG1-CG2 3.79Å; V1157-V1176 HydrophobicContact CG2-CG1 4.31Å; V1157-V1176 HydrophobicContact CG2-CG2 3.59Å
1158	K	86.1	Confident	84.1	Confident	63 Å²	63	75.9 Å²	75.9	27%	0.274	41%	0.409	S	S	.	.	H	α-helix	trans	-69.8	-40.4	177.4	179.7	162.4	161.7	132	0	111.7	K1154 H1155 L1161 S1162 P1169	K1154-K1158 WeakPolarHBondContact O-CB 3.22Å; K1154-K1158 PolarHBondContact O-N 2.81Å; H1155-K1158 PolarHBondContact O-N 3.36Å; K1158-L1161 PolarHBondContact O-N 2.81Å; K1158-S1162 PolarHBondContact O-N 3.21Å; K1158-S1162 PolarHBondContact O-OG 2.67Å; K1158-P1169 HydrophobicContact CD-CB 4.17Å; K1158-P1169 WeakPolarHBondContact CD-O 3.45Å; K1158-P1169 VanDerWaalsContact CE-CB 3.48Å; K1158-P1169 VanDerWaalsContact CE-O 3.27Å; K1158-P1169 WeakPolarHBondContact CE-O 3.49Å; K1158-P1169 HydrophobicContact CG-CB 3.81Å; K1158-P1169 PolarHBondContact NZ-O 3.07Å
1159	L	86.5	Confident	83	Confident	93 Å²	93	72.7 Å²	72.7	49%	0.487	39%	0.394	S	S	.	.	H	α-helix	trans	-66.8	-34.9	170.4	-178.9	62.6	0	0	0	112.2	H1155 S1162 K1163	H1155-L1159 WeakPolarHBondContact O-CB 3.38Å; H1155-L1159 PolarHBondContact O-N 2.81Å; L1159-S1162 PolarHBondContact O-OG 3.12Å; L1159-S1162 VanDerWaalsContact O-OG 3.12Å; L1159-K1163 WeakPolarHBondContact O-CB 3.33Å; L1159-K1163 PolarHBondContact O-N 3.24Å
1160	H	88.4	Confident	82	Confident	18 Å²	18	70.8 Å²	70.8	8%	0.083	39%	0.392	C	S	.	.	H	α-helix	trans	-65.2	-48.9	173.6	178	68.8	0	0	0	111.6	C1147 F1151 A1156 V1157 S1162 K1163 T1164 H1165	C1147-H1160 PolarHBondContact SG-NE2 2.82Å; F1151-H1160 HydrophobicContact CE1-CB 3.83Å; F1151-H1160 AromaticContact CE1-CG 3.89Å; F1151-H1160 HydrophobicContact CE2-CB 4.14Å; F1151-H1160 AromaticContact CE2-CD2 3.53Å; F1151-H1160 AromaticContact CE2-CG 3.84Å; F1151-H1160 HydrophobicContact CZ-CB 3.59Å; F1151-H1160 AromaticContact CZ-CD2 3.33Å; F1151-H1160 WeakPolarHBondContact CZ-CD2 3.29Å; F1151-H1160 AromaticContact CZ-CE1 3.92Å; F1151-H1160 AromaticContact CZ-CG 3.22Å; F1151-H1160 AromaticContact CZ-ND1 3.61Å; F1151-H1160 AromaticContact CZ-NE2 3.77Å; A1156-H1160 WeakPolarHBondContact O-CB 3.45Å; A1156-H1160 PolarHBondContact O-N 2.99Å; V1157-H1160 WeakPolarHBondContact O-CB 3.27Å; V1157-H1160 PolarHBondContact O-N 2.91Å; H1160-S1162 VanDerWaalsContact C-N 3.3Å; H1160-S1162 PolarHBondContact O-N 2.8Å; H1160-K1163 PolarHBondContact O-N 2.98Å; H1160-T1164 PolarHBondContact CE1-OG1 2.86Å; H1160-T1164 PolarHBondContact ND1-OG1 3.34Å; H1160-T1164 PolarHBondContact NE2-OG1 3.3Å; H1160-T1164 PolarHBondContact O-N 3.15Å; H1160-T1164 PolarHBondContact O-OG1 3.31Å; H1160-H1165 AromaticContact NE2-CD2 3.83Å; H1160-H1165 AromaticContact NE2-NE2 3.49Å; H1160-H1165 PolarHBondContact NE2-NE2 2.78Å
1161	L	86.9	Confident	80.9	Confident	2 Å²	2	71.3 Å²	71.3	1%	0.01	39%	0.392	C	S	.	.	H	α-helix	trans	-56.8	-39.6	178.6	-80.8	169.3	0	0	0	113.4	C1144 L1146 V1157 K1158 H1165 G1166 K1167 H1172 F1175 V1176	C1144-L1161 VanDerWaalsContact SG-CD2 3.59Å; L1146-L1161 HydrophobicContact CD1-CD2 3.67Å; L1146-L1161 HydrophobicContact CG-CD2 4.5Å; V1157-L1161 WeakPolarHBondContact O-CG 3.31Å; V1157-L1161 PolarHBondContact O-N 3.22Å; K1158-L1161 PolarHBondContact O-N 2.81Å; L1161-H1165 CarbonylContact O-C 3.56Å; L1161-H1165 WeakPolarHBondContact O-CA 3.05Å; L1161-H1165 WeakPolarHBondContact O-CB 3.44Å; L1161-H1165 PolarHBondContact O-N 2.9Å; L1161-G1166 PolarHBondContact O-N 2.93Å; L1161-G1166 VanDerWaalsContact O-N 3.11Å; L1161-K1167 PolarHBondContact O-N 2.6Å; L1161-H1172 HydrophobicContact CD1-CB 4.21Å; L1161-F1175 HydrophobicContact CD1-CB 3.97Å; L1161-F1175 HydrophobicContact CD2-CB 3.71Å; L1161-V1176 HydrophobicContact CD1-CG2 3.57Å
1162	S	85.8	Confident	79.9	Confident	46 Å²	46	70.7 Å²	70.7	32%	0.322	39%	0.39	S	S	.	.	H	α-helix	trans	-74.5	-43.3	174.5	60.9	0	0	0	0	112.4	K1158 L1159 H1160 G1166 K1167	K1158-S1162 PolarHBondContact O-N 3.21Å; K1158-S1162 PolarHBondContact O-OG 2.67Å; L1159-S1162 PolarHBondContact O-OG 3.12Å; L1159-S1162 VanDerWaalsContact O-OG 3.12Å; H1160-S1162 VanDerWaalsContact C-N 3.3Å; H1160-S1162 PolarHBondContact O-N 2.8Å; S1162-G1166 WeakPolarHBondContact O-CA 3.15Å; S1162-G1166 PolarHBondContact O-N 3.49Å; S1162-K1167 WeakPolarHBondContact CA-O 3.28Å
1163	K	86.6	Confident	79.3	Confident	176 Å²	176	70.4 Å²	70.4	77%	0.765	38%	0.383	S	S	*	.	H	α-helix	trans	-79.2	-28.9	-173.1	-167.3	171.5	-177.9	177.9	0	115.2	L1159 H1160	L1159-K1163 WeakPolarHBondContact O-CB 3.33Å; L1159-K1163 PolarHBondContact O-N 3.24Å; H1160-K1163 PolarHBondContact O-N 2.98Å
1164	T	84.1	Confident	78.9	Confident	79 Å²	79	71.3 Å²	71.3	49%	0.485	39%	0.386	S	S	.	.	H	α-helix	trans	-114.6	-22.2	-179.3	65.4	0	0	0	0	114.6	H1160	H1160-T1164 PolarHBondContact CE1-OG1 2.86Å; H1160-T1164 PolarHBondContact ND1-OG1 3.34Å; H1160-T1164 PolarHBondContact NE2-OG1 3.3Å; H1160-T1164 PolarHBondContact O-N 3.15Å; H1160-T1164 PolarHBondContact O-OG1 3.31Å
1165	H	82.7	Confident	78.6	Confident	63 Å²	63	68.6 Å²	68.6	29%	0.292	37%	0.374	S	S	.	.	H	α-helix	trans	-116.1	-2	-179.4	-62	-68.4	0	0	0	113.6	L1146 H1160 L1161 K1167	L1146-H1165 HydrophobicContact CD1-CB 3.73Å; H1160-H1165 AromaticContact NE2-CD2 3.83Å; H1160-H1165 AromaticContact NE2-NE2 3.49Å; H1160-H1165 PolarHBondContact NE2-NE2 2.78Å; L1161-H1165 CarbonylContact O-C 3.56Å; L1161-H1165 WeakPolarHBondContact O-CA 3.05Å; L1161-H1165 WeakPolarHBondContact O-CB 3.44Å; L1161-H1165 PolarHBondContact O-N 2.9Å; H1165-K1167 HydrophobicContact CB-CG 4.31Å; H1165-K1167 PolarHBondContact O-N 3.48Å; H1165-K1167 VanDerWaalsContact O-N 3.11Å
1166	G	78.8	Confident	78.7	Confident	69 Å²	69	63.2 Å²	63.2	71%	0.711	35%	0.351	S	S	*	.			trans	60.4	19.6	178.2	0	0	0	0	0	114.3	L1161 S1162	L1161-G1166 PolarHBondContact O-N 2.93Å; L1161-G1166 VanDerWaalsContact O-N 3.11Å; S1162-G1166 WeakPolarHBondContact O-CA 3.15Å; S1162-G1166 PolarHBondContact O-N 3.49Å
1167	K	80.5	Confident	78.3	Confident	74 Å²	74	63.4 Å²	63.4	32%	0.322	35%	0.348	S	S	.	.			trans	-89.5	146	-176.9	-67.8	-159.2	-179.4	-70	0	111.3	L1146 L1161 S1162 H1165 F1175	L1146-K1167 HydrophobicContact CD1-CD 3.7Å; L1146-K1167 HydrophobicContact CD1-CG 4.42Å; L1161-K1167 PolarHBondContact O-N 2.6Å; S1162-K1167 WeakPolarHBondContact CA-O 3.28Å; H1165-K1167 HydrophobicContact CB-CG 4.31Å; H1165-K1167 PolarHBondContact O-N 3.48Å; H1165-K1167 VanDerWaalsContact O-N 3.11Å; K1167-F1175 HydrophobicContact CD-CD1 3.94Å; K1167-F1175 HydrophobicContact CD-CD2 3.57Å; K1167-F1175 HydrophobicContact CD-CE1 3.93Å; K1167-F1175 HydrophobicContact CD-CE2 3.55Å; K1167-F1175 HydrophobicContact CD-CG 3.78Å; K1167-F1175 HydrophobicContact CD-CZ 3.74Å
1168	S	65.1	Low	77.8	Confident	65 Å²	65	66.5 Å²	66.5	46%	0.455	37%	0.374	S	S	.	.			trans	-61.7	135.5	-179.4	-138.7	0	0	0	0	110.3	E1170 D1171	S1168-E1170 WeakPolarHBondContact CB-OE2 3.32Å; S1168-E1170 PolarHBondContact O-N 3.15Å; S1168-E1170 PolarHBondContact OG-OE2 3.26Å; S1168-D1171 PolarHBondContact O-N 2.99Å
1169	P	61.4	Low	77	Confident	42 Å²	42	67.1 Å²	67.1	27%	0.273	38%	0.38	S	S	.	.	S	Bend	trans	-62.8	-13.1	-178.5	-20.7	32	0	0	0	114.4	K1158 H1172	K1158-P1169 HydrophobicContact CD-CB 4.17Å; K1158-P1169 WeakPolarHBondContact CD-O 3.45Å; K1158-P1169 VanDerWaalsContact CE-CB 3.48Å; K1158-P1169 VanDerWaalsContact CE-O 3.27Å; K1158-P1169 WeakPolarHBondContact CE-O 3.49Å; K1158-P1169 HydrophobicContact CG-CB 3.81Å; K1158-P1169 PolarHBondContact NZ-O 3.07Å; P1169-H1172 PolarHBondContact O-ND1 2.79Å
1170	E	64.6	Low	75.9	Confident	118 Å²	118	71 Å²	71	55%	0.551	40%	0.396	S	S	*	.	S	Bend	trans	-74.3	-50.4	-178.2	-63.4	60.9	-121.6	0	0	110.8	S1168 H1172	S1168-E1170 WeakPolarHBondContact CB-OE2 3.32Å; S1168-E1170 PolarHBondContact O-N 3.15Å; S1168-E1170 PolarHBondContact OG-OE2 3.26Å; E1170-H1172 PolarHBondContact O-N 3.42Å; E1170-H1172 PolarHBondContact O-ND1 2.94Å
1171	D	62.7	Low	74.1	Confident	94 Å²	94	75.9 Å²	75.9	50%	0.503	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	9.9	-175.8	-63.5	-31.4	0	0	0	114.5	S1168 L1173 V1174 F1175	S1168-D1171 PolarHBondContact O-N 2.99Å; D1171-L1173 PolarHBondContact O-N 3.01Å; D1171-V1174 PolarHBondContact O-N 3.44Å; D1171-F1175 HydrophobicContact CB-CD2 4.39Å; D1171-F1175 HydrophobicContact CB-CE2 4.03Å; D1171-F1175 WeakPolarHBondContact O-CD2 3.08Å
1172	H	66.3	Low	72.1	Confident	26 Å²	26	84.4 Å²	84.4	12%	0.12	46%	0.461	C	S	.	.	H	α-helix	trans	-49.8	-32.6	-175.5	68.7	-57.6	0	0	0	114.2	L1161 P1169 E1170 V1174 F1175 V1176	L1161-H1172 HydrophobicContact CD1-CB 4.21Å; P1169-H1172 PolarHBondContact O-ND1 2.79Å; E1170-H1172 PolarHBondContact O-N 3.42Å; E1170-H1172 PolarHBondContact O-ND1 2.94Å; H1172-V1174 PolarHBondContact O-N 3.08Å; H1172-F1175 PolarHBondContact O-N 3.33Å; H1172-F1175 VanDerWaalsContact O-N 3.11Å; H1172-V1176 HydrophobicContact CB-CG2 4.39Å; H1172-V1176 VanDerWaalsContact O-CB 3.29Å; H1172-V1176 WeakPolarHBondContact O-CB 3.13Å; H1172-V1176 VanDerWaalsContact O-CG2 3.24Å; H1172-V1176 WeakPolarHBondContact O-CG2 3.27Å; H1172-V1176 PolarHBondContact O-N 2.9Å
1173	L	71.3	Confident	70.3	Confident	129 Å²	129	88.7 Å²	88.7	68%	0.675	48%	0.476	S	S	*	.	H	α-helix	trans	-62.6	-21.2	178.5	-60.7	179.8	0	0	0	114.5	D1171	D1171-L1173 PolarHBondContact O-N 3.01Å
1174	V	75.9	Confident	68.3	Low	69 Å²	69	90.2 Å²	90.2	42%	0.418	48%	0.483	S	S	.	.	H	α-helix	trans	-84.1	-29.3	176.3	-176.9	0	0	0	0	111.5	D1171 H1172	D1171-V1174 PolarHBondContact O-N 3.44Å; H1172-V1174 PolarHBondContact O-N 3.08Å
1175	F	77	Confident	66.2	Low	45 Å²	45	94.8 Å²	94.8	20%	0.197	50%	0.503	C	S	.	.	H	α-helix	trans	-109.1	1.8	-171.9	-54	-69.8	0	0	0	113.9	R1145 L1146 L1161 K1167 D1171 H1172	R1145-F1175 PolarHBondContact N-O 3.42Å; L1146-F1175 HydrophobicContact CD1-CB 4.4Å; L1146-F1175 HydrophobicContact CD1-CD1 4.18Å; L1146-F1175 HydrophobicContact CD1-CG 4.39Å; L1146-F1175 HydrophobicContact CD2-CD1 3.98Å; L1146-F1175 HydrophobicContact CG-CD1 4.23Å; L1161-F1175 HydrophobicContact CD1-CB 3.97Å; L1161-F1175 HydrophobicContact CD2-CB 3.71Å; K1167-F1175 HydrophobicContact CD-CD1 3.94Å; K1167-F1175 HydrophobicContact CD-CD2 3.57Å; K1167-F1175 HydrophobicContact CD-CE1 3.93Å; K1167-F1175 HydrophobicContact CD-CE2 3.55Å; K1167-F1175 HydrophobicContact CD-CG 3.78Å; K1167-F1175 HydrophobicContact CD-CZ 3.74Å; D1171-F1175 HydrophobicContact CB-CD2 4.39Å; D1171-F1175 HydrophobicContact CB-CE2 4.03Å; D1171-F1175 WeakPolarHBondContact O-CD2 3.08Å; H1172-F1175 PolarHBondContact O-N 3.33Å; H1172-F1175 VanDerWaalsContact O-N 3.11Å
1176	V	85.5	Confident	64.2	Low	19 Å²	19	99.3 Å²	99.3	12%	0.115	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	126.2	177.8	179.5	0	0	0	0	110.5	Y1142 Q1143 V1157 L1161 H1172	Y1142-V1176 HydrophobicContact CD1-CG1 3.84Å; Y1142-V1176 HydrophobicContact CG-CG1 4.24Å; Q1143-V1176 WeakPolarHBondContact O-CA 3.37Å; V1157-V1176 HydrophobicContact CB-CG2 4.34Å; V1157-V1176 HydrophobicContact CG1-CG1 4.02Å; V1157-V1176 HydrophobicContact CG1-CG2 3.79Å; V1157-V1176 HydrophobicContact CG2-CG1 4.31Å; V1157-V1176 HydrophobicContact CG2-CG2 3.59Å; L1161-V1176 HydrophobicContact CD1-CG2 3.57Å; H1172-V1176 HydrophobicContact CB-CG2 4.39Å; H1172-V1176 VanDerWaalsContact O-CB 3.29Å; H1172-V1176 WeakPolarHBondContact O-CB 3.13Å; H1172-V1176 VanDerWaalsContact O-CG2 3.24Å; H1172-V1176 WeakPolarHBondContact O-CG2 3.27Å; H1172-V1176 PolarHBondContact O-N 2.9Å
1177	T	81.4	Confident	62.6	Low	41 Å²	41	105.9 Å²	105.9	25%	0.252	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	124.4	162.6	-58.8	0	0	0	0	108.3	Q1143 R1145 L1179	Q1143-T1177 PolarHBondContact N-O 3.09Å; Q1143-T1177 PolarHBondContact O-N 3.39Å; R1145-T1177 PolarHBondContact NE-OG1 3.05Å; T1177-L1179 HydrophobicContact CG2-CD2 4.03Å
1178	A	77.2	Confident	60.7	Low	65 Å²	65	111.7 Å²	111.7	54%	0.537	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.4	126.5	167	0	0	0	0	0	109.1	Y1142	Y1142-A1178 HydrophobicContact CD1-CB 4Å; Y1142-A1178 HydrophobicContact CE1-CB 4.03Å
1179	L	69.5	Low	59.7	Low	77 Å²	77	117.2 Å²	117.2	40%	0.403	59%	0.588	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106	105.4	169.7	-57.7	175.7	0	0	0	106.9	V1141 Q1143 T1150 T1177	V1141-L1179 PolarHBondContact N-O 3.25Å; V1141-L1179 WeakPolarHBondContact O-CA 3.08Å; V1141-L1179 WeakPolarHBondContact O-CB 3.4Å; V1141-L1179 PolarHBondContact O-N 3.36Å; Q1143-L1179 HydrophobicContact CB-CD1 4.29Å; T1150-L1179 HydrophobicContact CG2-CD1 4.46Å; T1177-L1179 HydrophobicContact CG2-CD2 4.03Å
1180	E	63	Low	58.7	Low	175 Å²	175	125 Å²	125	82%	0.818	62%	0.617	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-72.1	129.7	173.6	-172.4	171.4	-173.3	0	0	109.4	L1182	E1180-L1182 PolarHBondContact O-N 3.19Å
1181	K	50	Low	57.4	Low	120 Å²	120	129.9 Å²	129.9	52%	0.522	66%	0.655	S	S	.	*			trans	-69.2	110.4	172.3	-95.4	-174.8	144.3	-151.8	0	109.5	V1141 E1183	V1141-K1181 HydrophobicContact CG2-CG 4.46Å; K1181-E1183 HydrophobicContact CB-CB 4.28Å; K1181-E1183 VanDerWaalsContact CD-OE2 3.31Å; K1181-E1183 WeakPolarHBondContact CD-OE2 3.25Å; K1181-E1183 VanDerWaalsContact CE-OE2 3.26Å; K1181-E1183 WeakPolarHBondContact CE-OE2 3.21Å; K1181-E1183 IonicContact NZ-OE1 3.74Å; K1181-E1183 IonicContact NZ-OE2 2.68Å; K1181-E1183 PolarHBondContact NZ-OE2 2.97Å; K1181-E1183 PolarHBondContact O-N 3.24Å
1182	L	45.1	Very low	57.1	Low	181 Å²	181	131.7 Å²	131.7	95%	0.948	66%	0.662	S	S	*	*			trans	-73.3	62.1	171.6	-160.6	80.9	0	0	0	111.3	E1180	E1180-L1182 PolarHBondContact O-N 3.19Å
1183	E	47.8	Very low	56.6	Low	135 Å²	135	137.2 Å²	137.2	63%	0.631	69%	0.691	S	S	*	*			trans	-124.1	36.8	-169.5	-157.1	173.8	-162.5	0	0	112	K1181	K1181-E1183 HydrophobicContact CB-CB 4.28Å; K1181-E1183 VanDerWaalsContact CD-OE2 3.31Å; K1181-E1183 WeakPolarHBondContact CD-OE2 3.25Å; K1181-E1183 VanDerWaalsContact CE-OE2 3.26Å; K1181-E1183 WeakPolarHBondContact CE-OE2 3.21Å; K1181-E1183 IonicContact NZ-OE1 3.74Å; K1181-E1183 IonicContact NZ-OE2 2.68Å; K1181-E1183 PolarHBondContact NZ-OE2 2.97Å; K1181-E1183 PolarHBondContact O-N 3.24Å
1184	K	45.1	Very low	55.8	Low	209 Å²	209	137.7 Å²	137.7	91%	0.909	69%	0.692	S	S	*	*			trans	-136	65	171.1	-78.2	-171.4	177.2	174.4	0	111.7
1185	L	40.3	Very low	54.6	Low	174 Å²	174	141.7 Å²	141.7	91%	0.911	71%	0.708	S	S	*	*	S	Bend	trans	-142.2	25	167.9	-124.1	176.2	0	0	0	113.5
1186	D	40.7	Very low	53.2	Low	158 Å²	158	147.8 Å²	147.8	85%	0.845	74%	0.739	S	S	*	*	S	Bend	trans	-140	25.1	-173.7	-159.8	27.2	0	0	0	112.9
1187	K	43.4	Very low	51.1	Low	207 Å²	207	156.3 Å²	156.3	90%	0.9	78%	0.781	S	S	*	*	S	Bend	trans	-141.9	33.4	-179.5	-78.3	-163.3	173.9	-179.9	0	114.6
1188	M	41.3	Very low	48.9	Very low	196 Å²	196	164.6 Å²	164.6	97%	0.966	82%	0.819	S	S	*	*	S	Bend	trans	-133	35.8	169.1	-72	-171.8	172.4	0	0	112.7
1189	E	43.4	Very low	46.7	Very low	182 Å²	182	172.2 Å²	172.2	85%	0.85	84%	0.841	S	S	*	*	S	Bend	trans	-129.6	61.1	166.7	-162.5	-174.7	146.2	0	0	110.4
1190	K	41.8	Very low	44.9	Very low	204 Å²	204	180.2 Å²	180.2	89%	0.887	88%	0.877	S	S	*	*			trans	-177.6	71	161.6	-108.1	165.6	-175.6	173.6	0	113.9
1191	V	36.3	Very low	43.2	Very low	221 Å²	221	180.6 Å²	180.6	100%	1.339	88%	0.882	S	S	*	*			trans	-141.8	0	139.3	-179	0	0	0	0	106.3

Retrieved 1,191 of 1,191 residues in 820.8 ms (Link to these results)

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