A0A5K4ET53_SCHMA Loading...

Putative growth factor receptor-bound protein

AlphaFold DB , UniProt , Accession A0A5K4ET53, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 864 aa.

						>A0A5K4ET53_SCHMA|A0A5K4ET53
MIKDLHQTRASDDKTNQNAVNNNNSQPNNKSSVQYRYSAELVDATHQNTRTGYSTQRVDDSIQGNCYLPRTNLPHIQQAQHDSQLKKPQKTINFLNSTEARDTNNSQAIADIRNRKYQKHEYGIQSSKDNRSSYTLSCNNGSCIGRSVLENSVTNSNDINNFNYGLKNFKNKADYQTRTTSGKEQKSVHWSEDLDTSNSNRKQLTSDIATLNNNNKIIPTNFDSINTTIPTTTTNNIDSVTSNVNNNLVNSYGTGYPQFRRQQLSVRDVSNDNVTKAYSCSKNIEEFLRRRSLSSNPANASNQMIRSQSLYAYLSMRNESANNVAKTSANALANTTFSIKPDNSRNIVDVQPKLPLKQMAVTTSTTPNNNSNHRQSDNYSEYSIARRSVCSSVYGAESSISPNLSTELHLSSNRRSISPSFQRFSNQSETDGVVDKHQSNKTNLTVQIFLPDRTSIHIPVHSTTTTLQALQKLCSTNQKLLTMKHALVERIPVLHLERCLEDDEYLFNYLSSWKIGNENLIFLEERQDLYGLFESSKSWLGEHHSTFNINSNKNIFYRNENIPIPVHTDQLYLRIGQTKWKRRYCHLNSNGFYVSKQKIMNKSQLTRLNIFQPNLYLYITISDQNQTESPTPFGMVVRPHSTQQADSRLIIEMCAINEESWRKWYSLLRITLIGKRLYTNYIVRMDTVKIHRENFSHSDYSLRNSSRFNSLNDRPISSTVSELDSDHILGDLHSITPNYKTNSAKIEFPPKSGSYSVTDLTKPIQLDNHMINGRNQQSNEASSLTSLTLYPIQTPSQKSINRQSRLDKQNIKSVKKRIFGNGPSARRCTRSISHISSPFNISLPYWIRASYEDKMNETLNETVL
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.6	Very low	37.7	Very low	241 Å²	241	149.1 Å²	149.1	100%	1.187	76%	0.759	S	S	*	*				0	118.6	0	-73.1	170.9	170.2	0	0	107.1
2	I	37.3	Very low	37.6	Very low	149 Å²	149	147.8 Å²	147.8	76%	0.764	76%	0.756	S	S	*	*			cis	-141.4	114.9	-10.2	-69.2	-178.7	0	0	0	102.5
3	K	35.9	Very low	37.8	Very low	175 Å²	175	146.7 Å²	146.7	76%	0.761	75%	0.752	S	S	*	*				60.5	134.5	92.8	-88	-163.3	160.3	-144.1	0	113.2
4	D	41.1	Very low	37.9	Very low	108 Å²	108	148.3 Å²	148.3	58%	0.578	75%	0.751	S	S	*	*			cis	-136.3	159.9	9	-77	-57.6	0	0	0	109.2
5	L	38.4	Very low	38	Very low	119 Å²	119	145.9 Å²	145.9	62%	0.623	75%	0.747	S	S	*	*				58.6	131.4	61.8	-81.8	155.4	0	0	0	112.8
6	H	42.6	Very low	37.9	Very low	162 Å²	162	145.3 Å²	145.3	75%	0.75	75%	0.746	S	S	*	*			cis	-133.6	166.4	17.4	-65.5	-101.9	0	0	0	110.9
7	Q	37.8	Very low	37.9	Very low	143 Å²	143	145.2 Å²	145.2	67%	0.668	74%	0.742	S	S	*	*			cis	97.5	121.7	16.6	-166.5	177.9	17.9	0	0	117.2
8	T	35.2	Very low	37.9	Very low	120 Å²	120	144.8 Å²	144.8	74%	0.736	74%	0.742	S	S	*	*			trans	64.3	153.2	171.4	44.6	0	0	0	0	116.7
9	R	35.5	Very low	37.8	Very low	239 Å²	239	141.6 Å²	141.6	90%	0.902	74%	0.739	S	S	*	*			cis	-155	-162.8	18.5	-134.5	159.6	-176.3	172.3	-0.2	110.4
10	A	38.6	Very low	37.9	Very low	77 Å²	77	140.5 Å²	140.5	64%	0.636	74%	0.738	S	S	*	*				-155.6	171.1	-100.4	0	0	0	0	0	111.1
11	S	37.9	Very low	38	Very low	107 Å²	107	140.3 Å²	140.3	75%	0.748	74%	0.738	S	S	*	*			trans	62.1	152	165	42.1	0	0	0	0	118.3
12	D	36.3	Very low	38.2	Very low	134 Å²	134	134.5 Å²	134.5	72%	0.717	71%	0.711	S	S	*	*			cis	-163.4	-167.1	-21.9	-117.7	-67.2	0	0	0	109.7
13	D	40.2	Very low	38.3	Very low	133 Å²	133	133.1 Å²	133.1	71%	0.711	71%	0.706	S	S	*	*			trans	72.6	122.4	171.9	-64.3	-34.9	0	0	0	116.9
14	K	39.1	Very low	38.4	Very low	169 Å²	169	131.7 Å²	131.7	74%	0.735	71%	0.706	S	S	*	*			cis	66.2	123.9	46.8	-55.7	174.3	-177.4	161.9	0	111.4
15	T	40.1	Very low	38.2	Very low	113 Å²	113	131.6 Å²	131.6	69%	0.693	71%	0.714	S	S	*	*				-167.7	165.2	50.7	44.2	0	0	0	0	112.2
16	N	35.9	Very low	38.4	Very low	136 Å²	136	134.7 Å²	134.7	73%	0.727	73%	0.725	S	S	*	*			trans	67.1	161.8	146.7	-69.3	-7.9	0	0	0	119.9
17	Q	38.8	Very low	38.5	Very low	144 Å²	144	131.3 Å²	131.3	67%	0.673	72%	0.718	S	S	*	*			cis	-168.7	143.3	-46	-130.6	-170.8	33.5	0	0	108.8
18	N	37.8	Very low	38.4	Very low	138 Å²	138	131.4 Å²	131.4	74%	0.738	72%	0.723	S	S	*	*			trans	64.5	168	160.9	-47.5	-30.4	0	0	0	116.9
19	A	35.8	Very low	38.5	Very low	83 Å²	83	132.7 Å²	132.7	69%	0.686	73%	0.725	S	S	*	*			cis	-170.3	-175.9	-42.1	0	0	0	0	0	109.4
20	V	39.4	Very low	38.4	Very low	120 Å²	120	131 Å²	131	73%	0.727	72%	0.724	S	S	*	*			trans	80.5	106.3	155	-178.8	0	0	0	0	119.6
21	N	38.9	Very low	38.2	Very low	136 Å²	136	133.1 Å²	133.1	73%	0.727	74%	0.735	S	S	*	*			trans	65.4	162.2	139.9	-64.5	4.5	0	0	0	120.3
22	N	38.9	Very low	37.8	Very low	119 Å²	119	133.2 Å²	133.2	64%	0.636	74%	0.735	S	S	*	*			cis	-153.1	158.5	-2.4	-124.5	-8.4	0	0	0	112.2
23	N	39.7	Very low	37.7	Very low	121 Å²	121	132.7 Å²	132.7	65%	0.647	74%	0.737	S	S	*	*			trans	25.6	134.7	145.9	-50.7	-24.1	0	0	0	120.5
24	N	38.5	Very low	37.3	Very low	144 Å²	144	134.8 Å²	134.8	77%	0.77	74%	0.742	S	S	*	*				-174.3	155.6	70.6	-108.9	-34.2	0	0	0	114.8
25	S	37.8	Very low	36.7	Very low	106 Å²	106	137.8 Å²	137.8	74%	0.741	75%	0.75	S	S	*	*			trans	43.7	142.7	146.2	63.2	0	0	0	0	123.1
26	Q	41.6	Very low	36.3	Very low	185 Å²	185	144.2 Å²	144.2	86%	0.864	76%	0.762	S	S	*	*			cis	-162.3	-163.3	-21.7	-138	-159.6	1.8	0	0	108.7
27	P	44.1	Very low	36	Very low	91 Å²	91	148.4 Å²	148.4	59%	0.591	77%	0.769	S	S	*	*			trans	-119.5	173.1	-131.5	43.4	-27.7	0	0	0	116.5
28	N	36.5	Very low	35.6	Very low	144 Å²	144	147.7 Å²	147.7	77%	0.77	78%	0.78	S	S	*	*				-164.1	157.5	119.3	-110.1	-30.2	0	0	0	116.4
29	N	37.2	Very low	35.2	Very low	148 Å²	148	145.5 Å²	145.5	79%	0.791	78%	0.781	S	S	*	*			trans	62.4	108.2	162.3	-65.4	-12.8	0	0	0	121.5
30	K	33.5	Very low	34.9	Very low	203 Å²	203	149.9 Å²	149.9	88%	0.883	79%	0.788	S	S	*	*			trans	-63.2	165.1	156.5	-60	163.1	-175.7	171.9	0	109.2
31	S	34.7	Very low	34.5	Very low	122 Å²	122	150.8 Å²	150.8	85%	0.853	79%	0.787	S	S	*	*				-161.1	177.5	50	56.1	0	0	0	0	115.4
32	S	29.6	Very low	34.3	Very low	109 Å²	109	150 Å²	150	76%	0.762	79%	0.788	S	S	*	*			trans	-100.2	173.9	179.4	53.6	0	0	0	0	113.1
33	V	33	Very low	34	Very low	123 Å²	123	151.5 Å²	151.5	75%	0.745	80%	0.796	S	S	*	*			trans	142	110.3	160.1	159	0	0	0	0	107.5
34	Q	32.1	Very low	33.7	Very low	177 Å²	177	149.6 Å²	149.6	83%	0.827	80%	0.796	S	S	*	*				85.3	134.4	61.5	-168.6	-177.4	23.2	0	0	113.2
35	Y	27.4	Very low	33.6	Very low	231 Å²	231	148 Å²	148	91%	0.906	79%	0.792	S	S	*	*			trans	-59.1	143.2	-173	-76.2	-96.3	0	0	0	114.9
36	R	32.1	Very low	33.6	Very low	249 Å²	249	150.5 Å²	150.5	94%	0.94	79%	0.792	S	S	*	*			trans	-156.4	152.3	147.8	-110	164.6	-160.2	-165.2	4.1	113.3
37	Y	28.7	Very low	33.4	Very low	224 Å²	224	148.7 Å²	148.7	88%	0.878	78%	0.783	S	S	*	*			trans	-78.4	147.4	164.7	-104.2	-111.7	0	0	0	109.8
38	S	30.5	Very low	33.1	Very low	129 Å²	129	151 Å²	151	90%	0.902	79%	0.79	S	S	*	*			trans	-171.1	-179.9	141	-106.9	0	0	0	0	110.1
39	A	30	Very low	33.1	Very low	92 Å²	92	150 Å²	150	76%	0.76	79%	0.79	S	S	*	*			trans	-125.3	179.9	-166.7	0	0	0	0	0	113.9
40	E	29.8	Very low	32.9	Very low	175 Å²	175	154.3 Å²	154.3	82%	0.818	80%	0.795	S	S	*	*			trans	95.2	127	159	-55.5	-158	132.7	0	0	120.8
41	L	30.1	Very low	33.1	Very low	138 Å²	138	150.4 Å²	150.4	72%	0.723	79%	0.789	S	S	*	*			trans	59.4	119.8	144.7	-87.5	84.7	0	0	0	123.5
42	V	34.2	Very low	33.1	Very low	121 Å²	121	147.6 Å²	147.6	73%	0.733	78%	0.779	S	S	*	*				58.6	130.7	110.3	170.6	0	0	0	0	117.5
43	D	32.8	Very low	33.4	Very low	150 Å²	150	153.4 Å²	153.4	80%	0.802	79%	0.785	S	S	*	*			cis	-158.2	-172.5	20.1	-145.1	-19.6	0	0	0	114.5
44	A	33.1	Very low	33.4	Very low	80 Å²	80	152.1 Å²	152.1	66%	0.661	78%	0.782	S	S	*	*			trans	83	151.4	153.9	0	0	0	0	0	117.5
45	T	36.5	Very low	33.4	Very low	110 Å²	110	149.4 Å²	149.4	68%	0.675	78%	0.778	S	S	*	*			cis	-145.3	162.8	26.2	49.5	0	0	0	0	115.6
46	H	38.7	Very low	33.7	Very low	160 Å²	160	146.5 Å²	146.5	74%	0.741	77%	0.773	S	S	*	*			trans	72.8	142.9	157	-64.3	-45.1	0	0	0	119.4
47	Q	37.2	Very low	33.6	Very low	147 Å²	147	145.9 Å²	145.9	69%	0.687	77%	0.77	S	S	*	*			cis	-153.8	138.5	6.2	-130.2	174.8	50.8	0	0	113.4
48	N	37.2	Very low	33.7	Very low	138 Å²	138	140.8 Å²	140.8	74%	0.738	76%	0.762	S	S	*	*			trans	59.8	145.4	148.3	-64.5	-11.9	0	0	0	120.6
49	T	36	Very low	33.6	Very low	125 Å²	125	141.3 Å²	141.3	77%	0.767	76%	0.755	S	S	*	*			cis	-140.1	148.6	10.9	46.9	0	0	0	0	114.1
50	R	34.3	Very low	33.5	Very low	238 Å²	238	144.2 Å²	144.2	90%	0.898	76%	0.758	S	S	*	*			trans	24.3	137.9	139.6	-107.3	-179.6	167.7	172.5	-5.4	119.7
51	T	37.1	Very low	33.4	Very low	121 Å²	121	140.6 Å²	140.6	74%	0.742	75%	0.752	S	S	*	*			cis	-139.1	150.6	18	45.7	0	0	0	0	109.9
52	G	35.1	Very low	33.3	Very low	63 Å²	63	141 Å²	141	65%	0.649	75%	0.753	S	S	*	*				94.7	121.5	51	0	0	0	0	0	109.6
53	Y	36.1	Very low	33	Very low	230 Å²	230	144.1 Å²	144.1	90%	0.902	76%	0.76	S	S	*	*			cis	-153.8	158.6	18.4	-91.9	-94.1	0	0	0	114.6
54	S	32.7	Very low	32.8	Very low	96 Å²	96	140.2 Å²	140.2	67%	0.671	76%	0.755	S	S	*	*			trans	50.2	122.2	151.8	-139	0	0	0	0	119.9
55	T	32.1	Very low	32.6	Very low	121 Å²	121	143 Å²	143	74%	0.742	76%	0.759	S	S	*	*			cis	62	139.2	45	80.9	0	0	0	0	113.9
56	Q	33.3	Very low	32.2	Very low	170 Å²	170	144 Å²	144	79%	0.794	77%	0.769	S	S	*	*			cis	-131.4	159.2	28.8	-63.5	162.2	-37.3	0	0	113
57	R	29.7	Very low	31.9	Very low	235 Å²	235	146.8 Å²	146.8	89%	0.887	77%	0.774	S	S	*	*				41.4	146.4	99.9	-45.3	-174.2	178.2	178.2	-1.6	115.2
58	V	30.3	Very low	31.5	Very low	118 Å²	118	147.2 Å²	147.2	72%	0.715	78%	0.78	S	S	*	*			cis	-156.4	145.7	43.3	172.8	0	0	0	0	111.8
59	D	28.9	Very low	31.4	Very low	140 Å²	140	146.7 Å²	146.7	75%	0.749	78%	0.784	S	S	*	*			trans	33.3	141.7	153.6	-45.1	-14.6	0	0	0	126.2
60	D	28.6	Very low	31.1	Very low	152 Å²	152	152.1 Å²	152.1	81%	0.813	79%	0.791	S	S	*	*			trans	69.8	139.1	136.6	-76.7	-2.9	0	0	0	127.3
61	S	27.2	Very low	31.2	Very low	100 Å²	100	147.3 Å²	147.3	70%	0.699	79%	0.788	S	S	*	*			trans	89	111.1	150.2	75.8	0	0	0	0	121.9
62	I	27.8	Very low	31	Very low	146 Å²	146	148.9 Å²	148.9	75%	0.749	79%	0.792	S	S	*	*				74.5	131.1	128.7	-62.8	173.1	0	0	0	120.6
63	Q	27.8	Very low	30.9	Very low	187 Å²	187	154.1 Å²	154.1	87%	0.874	80%	0.804	S	S	*	*			trans	68.7	133	158.3	-79.5	164.8	-6.9	0	0	122.1
64	G	29.1	Very low	31.2	Very low	68 Å²	68	148.9 Å²	148.9	70%	0.701	80%	0.799	S	S	*	*			trans	87.6	148.8	153.5	0	0	0	0	0	116.5
65	N	29.9	Very low	31.5	Very low	139 Å²	139	152.1 Å²	152.1	74%	0.743	80%	0.803	S	S	*	*			cis	-154.6	146.6	-17.1	-121.5	-14.6	0	0	0	109.9	Y67	N65-Y67 HydrophobicContact CB-CE2 4.32Å; N65-Y67 PolarHBondContact O-N 3.5Å
66	C	26.9	Very low	31.6	Very low	131 Å²	131	152.2 Å²	152.2	89%	0.885	80%	0.798	S	S	*	*			trans	-77.5	114.9	174.9	-67.2	0	0	0	0	110.3	L68	C66-L68 PolarHBondContact O-N 3.34Å
67	Y	31.9	Very low	31.7	Very low	217 Å²	217	153.2 Å²	153.2	85%	0.851	80%	0.802	S	S	*	*			trans	-92.9	99	174.8	-82.2	-83.5	0	0	0	111.9	N65	N65-Y67 HydrophobicContact CB-CE2 4.32Å; N65-Y67 PolarHBondContact O-N 3.5Å
68	L	30.4	Very low	31.8	Very low	156 Å²	156	150.3 Å²	150.3	82%	0.817	80%	0.799	S	S	*	*			trans	-102.9	135	155	-82.2	167.9	0	0	0	108.4	C66	C66-L68 PolarHBondContact O-N 3.34Å
69	P	34.9	Very low	32	Very low	127 Å²	127	149 Å²	149	83%	0.825	80%	0.8	S	S	*	*			trans	-74.2	132	173.6	24.7	-22.7	0	0	0	110.4
70	R	29.3	Very low	32.2	Very low	240 Å²	240	150.1 Å²	150.1	91%	0.906	80%	0.801	S	S	*	*			trans	-129.6	133	176.2	-139.8	-174.7	-168.4	-160.8	4.1	108.8
71	T	36.2	Very low	32.5	Very low	137 Å²	137	149.8 Å²	149.8	84%	0.84	79%	0.794	S	S	*	*			trans	-115.9	95.3	177.8	49.6	0	0	0	0	111.1
72	N	33.1	Very low	32.7	Very low	154 Å²	154	151 Å²	151	82%	0.824	79%	0.792	S	S	*	*			trans	24.9	123.7	150	-55.5	-8.1	0	0	0	120.7
73	L	32.6	Very low	32.7	Very low	172 Å²	172	148.9 Å²	148.9	90%	0.901	79%	0.791	S	S	*	*			trans	-126.4	145.5	137.6	-123	83.8	0	0	0	107.8
74	P	43.4	Very low	32.8	Very low	121 Å²	121	147.5 Å²	147.5	79%	0.786	79%	0.785	S	S	*	*			trans	-91.8	171.8	-170.2	35.4	-35.7	0	0	0	116.2
75	H	38.3	Very low	32.7	Very low	163 Å²	163	150.4 Å²	150.4	76%	0.755	78%	0.783	S	S	*	*			trans	-50.8	147	-178.8	-83.4	-123.4	0	0	0	115.3
76	I	34.6	Very low	32.7	Very low	124 Å²	124	152.5 Å²	152.5	64%	0.636	79%	0.786	S	S	*	*				74.1	115.9	53.7	-63.2	169.1	0	0	0	113.9
77	Q	35.1	Very low	32.9	Very low	191 Å²	191	156 Å²	156	89%	0.893	79%	0.786	S	S	*	*				-154	174.8	127	-116.4	173	-2.6	0	0	111.8
78	Q	32.3	Very low	32.8	Very low	174 Å²	174	151.7 Å²	151.7	81%	0.813	78%	0.784	S	S	*	*			trans	-124.6	-174.1	-152.6	-61	166.4	-88.3	0	0	113.5
79	A	34.7	Very low	32.7	Very low	90 Å²	90	152.6 Å²	152.6	74%	0.744	79%	0.785	S	S	*	*			trans	86.6	148	162.7	0	0	0	0	0	117.4
80	Q	32.2	Very low	32.5	Very low	164 Å²	164	156 Å²	156	77%	0.766	79%	0.786	S	S	*	*			cis	-170.1	171.7	-34	-143.9	169.1	-37.6	0	0	108.1
81	H	34.9	Very low	32.4	Very low	144 Å²	144	150.2 Å²	150.2	67%	0.667	78%	0.778	S	S	*	*			trans	70.1	128	164.3	-86	-94.4	0	0	0	120.9
82	D	31.6	Very low	32.1	Very low	125 Å²	125	149.8 Å²	149.8	67%	0.668	77%	0.769	S	S	*	*			trans	65.5	92.1	130.9	-60.4	-5.2	0	0	0	123.8
83	S	28.2	Very low	32	Very low	102 Å²	102	148.3 Å²	148.3	71%	0.713	76%	0.761	S	S	*	*				99.2	149.7	101	84	0	0	0	0	121.1
84	Q	28.5	Very low	32	Very low	159 Å²	159	147.6 Å²	147.6	74%	0.743	75%	0.751	S	S	*	*			trans	72.1	133.8	153.2	-68	-65.4	5.6	0	0	122.3
85	L	27.9	Very low	31.6	Very low	128 Å²	128	148.9 Å²	148.9	67%	0.67	75%	0.751	S	S	*	*			trans	72.5	121.3	143.6	-67.7	164.8	0	0	0	122.9
86	K	29.6	Very low	31.3	Very low	183 Å²	183	147.5 Å²	147.5	80%	0.796	75%	0.749	S	S	*	*			trans	77.9	117.6	137.6	-70.4	169.9	174.2	170.7	0	120.7
87	K	30.6	Very low	31.3	Very low	205 Å²	205	146.5 Å²	146.5	89%	0.891	75%	0.753	S	S	*	*			trans	-58.8	154.9	146.7	-64.6	178.2	175.6	179.6	0	110.6
88	P	31.4	Very low	31.3	Very low	126 Å²	126	142.5 Å²	142.5	82%	0.818	74%	0.742	S	S	*	*				-139.1	-175.3	116.1	37.3	-24.7	0	0	0	114.3
89	Q	27.8	Very low	31.4	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.822	74%	0.743	S	S	*	*			trans	-102	152.7	-175.7	-57.6	151.1	-79	0	0	113.1
90	K	29.9	Very low	31.4	Very low	197 Å²	197	142.3 Å²	142.3	86%	0.857	74%	0.739	S	S	*	*			trans	173.7	135.5	146.1	-95.4	156.6	-177.9	-176.2	0	107.8
91	T	27.3	Very low	31.6	Very low	120 Å²	120	145 Å²	145	74%	0.736	74%	0.742	S	S	*	*			cis	92.7	145.7	16.3	-44.4	0	0	0	0	114.9
92	I	31.2	Very low	31.7	Very low	127 Å²	127	144 Å²	144	65%	0.651	74%	0.741	S	S	*	*			trans	89.9	108.7	179.1	-52.8	177.8	0	0	0	112.3	F94	I92-F94 HydrophobicContact CG2-CE2 4.01Å
93	N	30.7	Very low	31.8	Very low	124 Å²	124	142.9 Å²	142.9	66%	0.663	74%	0.74	S	S	*	*				80.7	158.6	61.8	-56.3	6.8	0	0	0	112.8
94	F	31.9	Very low	32.2	Very low	156 Å²	156	144.4 Å²	144.4	68%	0.684	74%	0.74	S	S	*	*			cis	-120.4	-156.3	5.3	-68	-94.6	0	0	0	109.7	I92	I92-F94 HydrophobicContact CG2-CE2 4.01Å
95	L	34.4	Very low	32.6	Very low	148 Å²	148	144.7 Å²	144.7	78%	0.775	75%	0.746	S	S	*	*			cis	-138.1	150.3	14.9	-91.1	95.1	0	0	0	109.2
96	N	32.4	Very low	32.7	Very low	135 Å²	135	143 Å²	143	72%	0.722	75%	0.745	S	S	*	*				64	125.5	74.8	-59.5	8.5	0	0	0	114.3
97	S	34.5	Very low	33	Very low	103 Å²	103	142.3 Å²	142.3	72%	0.72	75%	0.745	S	S	*	*			cis	-154.4	-165.1	0.6	57	0	0	0	0	109.8
98	T	34.9	Very low	33.2	Very low	107 Å²	107	136.1 Å²	136.1	66%	0.656	73%	0.732	S	S	*	*			cis	-156.5	168.3	14.9	-21.9	0	0	0	0	111.9
99	E	34	Very low	33.4	Very low	179 Å²	179	137.2 Å²	137.2	84%	0.836	73%	0.73	S	S	*	*			trans	11.1	147.1	147.7	-73	166.7	-147.4	0	0	123
100	A	36.3	Very low	33.4	Very low	80 Å²	80	133.6 Å²	133.6	66%	0.661	73%	0.729	S	S	*	*			cis	-168.7	159.7	-6.4	0	0	0	0	0	115.2
101	R	36.2	Very low	33.6	Very low	222 Å²	222	130.6 Å²	130.6	84%	0.838	72%	0.723	S	S	*	*			trans	78.7	128.8	146.8	-86.1	-180	-178.9	146.8	6	123.4
102	D	35.7	Very low	34	Very low	121 Å²	121	131.9 Å²	131.9	65%	0.647	72%	0.723	S	S	*	*			trans	72.9	146.6	133.5	-64.4	-32.7	0	0	0	122.8
103	T	33.7	Very low	34	Very low	103 Å²	103	136.3 Å²	136.3	63%	0.632	73%	0.732	S	S	*	*				-163.4	163.1	-50.1	14	0	0	0	0	109
104	N	36.7	Very low	34	Very low	134 Å²	134	137.1 Å²	137.1	72%	0.717	74%	0.736	S	S	*	*			trans	58	108.9	160.5	-53	-27.3	0	0	0	119.8
105	N	36.9	Very low	34.1	Very low	164 Å²	164	141 Å²	141	88%	0.877	75%	0.747	S	S	*	*				-170.2	159.8	93.2	-98.6	-37	0	0	0	113.2
106	S	31.5	Very low	34	Very low	93 Å²	93	142.7 Å²	142.7	65%	0.65	75%	0.748	S	S	*	*			trans	-126.3	-160.1	-170.7	50.4	0	0	0	0	112.1
107	Q	35.7	Very low	33.8	Very low	168 Å²	168	146.5 Å²	146.5	79%	0.785	75%	0.753	S	S	*	*			trans	74.8	142.3	-179.5	-85	80	-11.8	0	0	115
108	A	34.9	Very low	33.6	Very low	75 Å²	75	151.2 Å²	151.2	62%	0.62	76%	0.764	S	S	*	*			cis	-155.8	144	-7.1	0	0	0	0	0	113.8
109	I	34.2	Very low	33.3	Very low	150 Å²	150	152.8 Å²	152.8	77%	0.769	76%	0.762	S	S	*	*			trans	53.5	116.7	135	-58.4	166.1	0	0	0	118.5	D111	I109-D111 HydrophobicContact CG2-CB 4.31Å
110	A	29.3	Very low	33.1	Very low	99 Å²	99	153 Å²	153	82%	0.818	76%	0.762	S	S	*	*			trans	-90.4	144.2	153.9	0	0	0	0	0	109.7
111	D	33.8	Very low	32.7	Very low	135 Å²	135	155.7 Å²	155.7	72%	0.722	76%	0.761	S	S	*	*			trans	-156.1	148.9	168.5	-134.3	-12.1	0	0	0	117	I109	I109-D111 HydrophobicContact CG2-CB 4.31Å
112	I	35	Very low	32.3	Very low	146 Å²	146	155.8 Å²	155.8	75%	0.749	76%	0.763	S	S	*	*			trans	59.6	135.7	155.2	-73.3	150.9	0	0	0	122.1
113	R	32	Very low	32	Very low	221 Å²	221	153.9 Å²	153.9	83%	0.834	77%	0.772	S	S	*	*			trans	-80	172.3	174.6	-60.5	172	172.7	140.5	-4.8	113.3
114	N	29.3	Very low	31.5	Very low	140 Å²	140	156.9 Å²	156.9	75%	0.749	78%	0.782	S	S	*	*			trans	81.5	99	155.1	-58.2	-29.1	0	0	0	119.7
115	R	33.9	Very low	31.1	Very low	239 Å²	239	160.1 Å²	160.1	90%	0.902	79%	0.793	S	S	*	*				-162.8	108.6	125.3	-108.3	162.8	-81.5	-157.3	1.3	108
116	K	33.8	Very low	30.5	Very low	183 Å²	183	157.1 Å²	157.1	80%	0.796	79%	0.785	S	S	*	*				57.7	111.3	84.7	-84.1	-165.2	173.3	-176.9	0	114.2
117	Y	27	Very low	30.5	Very low	215 Å²	215	157.8 Å²	157.8	84%	0.843	79%	0.79	S	S	*	*			trans	37.3	114.1	148.4	-65.1	-88.7	0	0	0	119.2
118	Q	31.6	Very low	30.2	Very low	201 Å²	201	157.7 Å²	157.7	94%	0.939	79%	0.787	S	S	*	*				-125.6	153.7	129.6	-97.9	-175	-3.9	0	0	110.6
119	K	27.1	Very low	30.1	Very low	141 Å²	141	160.4 Å²	160.4	61%	0.613	79%	0.791	S	S	*	*			trans	-120	130.5	-164.7	-176.9	-160.8	-172.6	-152	0	107.6	E121	K119-E121 HydrophobicContact CD-CG 4.19Å; K119-E121 WeakPolarHBondContact CE-OE1 3.41Å; K119-E121 HydrophobicContact CG-CG 4.2Å; K119-E121 IonicContact NZ-OE1 2.86Å; K119-E121 PolarHBondContact NZ-OE1 3.41Å; K119-E121 IonicContact NZ-OE2 2.78Å; K119-E121 PolarHBondContact NZ-OE2 3.48Å
120	H	30.4	Very low	30	Very low	184 Å²	184	158.3 Å²	158.3	85%	0.852	78%	0.781	S	S	*	*			trans	-126.6	124.6	166	-93	27.8	0	0	0	108.9
121	E	27.1	Very low	30.1	Very low	135 Å²	135	163.9 Å²	163.9	63%	0.631	78%	0.781	S	S	*	*			trans	-106.5	134.9	-175.5	-65.3	172.7	113.1	0	0	109.2	K119	K119-E121 HydrophobicContact CD-CG 4.19Å; K119-E121 WeakPolarHBondContact CE-OE1 3.41Å; K119-E121 HydrophobicContact CG-CG 4.2Å; K119-E121 IonicContact NZ-OE1 2.86Å; K119-E121 PolarHBondContact NZ-OE1 3.41Å; K119-E121 IonicContact NZ-OE2 2.78Å; K119-E121 PolarHBondContact NZ-OE2 3.48Å
122	Y	29.8	Very low	29.9	Very low	224 Å²	224	162 Å²	162	88%	0.878	78%	0.779	S	S	*	*			trans	-141.5	115.5	161.3	-87.8	-72.1	0	0	0	111.9
123	G	28.3	Very low	29.4	Very low	81 Å²	81	160.3 Å²	160.3	84%	0.835	78%	0.78	S	S	*	*			trans	55.3	87.5	146.6	0	0	0	0	0	119.2
124	I	23.1	Very low	29.1	Very low	166 Å²	166	160.9 Å²	160.9	85%	0.851	78%	0.783	S	S	*	*			trans	-82	134.4	156	-62	171	0	0	0	109.1
125	Q	28.4	Very low	28.9	Very low	203 Å²	203	160.8 Å²	160.8	95%	0.949	79%	0.788	S	S	*	*			trans	-142	149.4	148.2	-151.4	141	18.1	0	0	110.7
126	S	24.4	Very low	28.5	Very low	100 Å²	100	157.6 Å²	157.6	70%	0.699	79%	0.788	S	S	*	*			trans	-128.9	140.1	-149.5	179.2	0	0	0	0	115.2
127	S	30.8	Very low	28.1	Very low	107 Å²	107	154 Å²	154	75%	0.748	79%	0.786	S	S	*	*			trans	-152.2	112	148.9	-171.9	0	0	0	0	106.1
128	K	30.7	Very low	28.3	Very low	166 Å²	166	149.7 Å²	149.7	72%	0.722	79%	0.786	S	S	*	*				47.2	117.4	85.8	-65.3	-172.7	177.3	-177.2	0	111.5
129	D	32.6	Very low	28.2	Very low	132 Å²	132	146.9 Å²	146.9	71%	0.706	78%	0.777	S	S	*	*			cis	-144.5	167.6	33.3	-98.8	-60	0	0	0	117.6
130	N	31.9	Very low	28.6	Very low	107 Å²	107	147.7 Å²	147.7	57%	0.572	79%	0.789	S	S	*	*			trans	-18.6	151.8	154.9	-63.1	-80.9	0	0	0	116.8
131	R	31.2	Very low	28.7	Very low	216 Å²	216	142.5 Å²	142.5	82%	0.815	78%	0.784	S	S	*	*			cis	-172.8	165.8	3.9	-106.8	168.6	-153.5	-168.7	6.3	106.8
132	S	29.6	Very low	28.8	Very low	96 Å²	96	141.5 Å²	141.5	67%	0.671	79%	0.792	S	S	*	*			cis	-175.5	145.2	-26.2	46.3	0	0	0	0	108.4
133	S	23.8	Very low	28.7	Very low	110 Å²	110	137 Å²	137	77%	0.769	79%	0.792	S	S	*	*			trans	-115.7	147.4	-177.3	42.1	0	0	0	0	113
134	Y	26.3	Very low	28.8	Very low	232 Å²	232	141.1 Å²	141.1	91%	0.91	79%	0.793	S	S	*	*			trans	-99	131.8	173.7	-71.8	-86.7	0	0	0	110.8
135	T	24.7	Very low	28.9	Very low	138 Å²	138	136.7 Å²	136.7	85%	0.847	79%	0.788	S	S	*	*			trans	-120.4	128.5	173.9	-23.9	0	0	0	0	108.8
136	L	26.4	Very low	28.9	Very low	172 Å²	172	138.9 Å²	138.9	90%	0.901	79%	0.788	S	S	*	*			trans	-113.6	119.4	176.2	-95.2	162.9	0	0	0	110.1
137	S	24.9	Very low	28.9	Very low	107 Å²	107	138.8 Å²	138.8	75%	0.748	79%	0.787	S	S	*	*			trans	-113.5	123.1	178.4	55.8	0	0	0	0	110.6
138	C	31.1	Very low	28.9	Very low	125 Å²	125	140.8 Å²	140.8	85%	0.845	80%	0.795	S	S	*	*			trans	-130.1	139.4	169.2	-73.6	0	0	0	0	109.9
139	N	30.3	Very low	28.7	Very low	142 Å²	142	139 Å²	139	76%	0.759	79%	0.793	S	S	*	*			trans	-98.4	155.6	-172.6	-77.7	-20.1	0	0	0	113.1
140	N	33.9	Very low	28.5	Very low	159 Å²	159	142 Å²	142	85%	0.85	80%	0.802	S	S	*	*			trans	55.2	129.4	150.5	-57.7	-8.7	0	0	0	119.8
141	G	32.8	Very low	28.3	Very low	74 Å²	74	142.6 Å²	142.6	76%	0.763	81%	0.805	S	S	*	*			trans	158.8	78.5	151.1	0	0	0	0	0	119.4
142	S	30.7	Very low	28.3	Very low	114 Å²	114	138 Å²	138	80%	0.797	81%	0.806	S	S	*	*			trans	67.5	138.8	153.8	-157.6	0	0	0	0	120.1
143	C	25.9	Very low	28.3	Very low	129 Å²	129	138.9 Å²	138.9	87%	0.872	81%	0.808	S	S	*	*			trans	-134.2	123.7	171.3	-61	0	0	0	0	109.3
144	I	31.2	Very low	28.7	Very low	168 Å²	168	139.3 Å²	139.3	86%	0.862	81%	0.806	S	S	*	*			trans	-135.3	127.3	158.7	-59.2	-178.3	0	0	0	107.1
145	G	25.7	Very low	28.9	Very low	73 Å²	73	134.6 Å²	134.6	75%	0.753	80%	0.796	S	S	*	*			trans	-122.5	178.8	178.5	0	0	0	0	0	112
146	R	27.3	Very low	29.2	Very low	249 Å²	249	132 Å²	132	94%	0.94	78%	0.784	S	S	*	*			trans	-149	127.1	164.5	-146.6	170.3	-170.9	163.7	2.1	109.8
147	S	25.8	Very low	29.4	Very low	98 Å²	98	130.2 Å²	130.2	69%	0.685	78%	0.775	S	S	*	*			trans	-96.6	158.9	173.5	50.9	0	0	0	0	110.7
148	V	29.2	Very low	29.8	Very low	150 Å²	150	133 Å²	133	91%	0.909	78%	0.782	S	S	*	*			trans	-124.9	126.3	153.4	179.3	0	0	0	0	106.2
149	L	27.1	Very low	29.7	Very low	128 Å²	128	134.1 Å²	134.1	67%	0.67	78%	0.778	S	S	*	*			trans	-108.7	146.4	173.3	-87.9	163.6	0	0	0	108.2
150	E	29.6	Very low	29.8	Very low	195 Å²	195	135 Å²	135	91%	0.911	78%	0.783	S	S	*	*			trans	-138.8	151	149.2	-111.4	179.1	-170.8	0	0	109.3
151	N	27.4	Very low	29.5	Very low	119 Å²	119	133.7 Å²	133.7	64%	0.636	78%	0.776	S	S	*	*			trans	-124.6	147.6	-150.1	-74.8	-39.5	0	0	0	114.5	V153	N151-V153 HydrophobicContact CB-CG2 4.17Å
152	S	30.4	Very low	29.4	Very low	119 Å²	119	137.8 Å²	137.8	83%	0.832	77%	0.773	S	S	*	*			trans	-158.7	118.2	138.9	-11.7	0	0	0	0	107.8
153	V	29.6	Very low	29.2	Very low	116 Å²	116	139.4 Å²	139.4	70%	0.703	77%	0.772	S	S	*	*			cis	68	113.2	38.6	-174.7	0	0	0	0	110.5	N151	N151-V153 HydrophobicContact CB-CG2 4.17Å
154	T	31.5	Very low	29.5	Very low	119 Å²	119	139.4 Å²	139.4	73%	0.73	76%	0.755	S	S	*	*			cis	-152.9	178.3	-2.7	8.3	0	0	0	0	108.4
155	N	32.1	Very low	29.3	Very low	132 Å²	132	134.8 Å²	134.8	71%	0.706	75%	0.748	S	S	*	*			cis	-129.3	-179.2	10	-108.4	-4.1	0	0	0	108.8
156	S	30.2	Very low	29.5	Very low	85 Å²	85	139 Å²	139	59%	0.594	75%	0.753	S	S	*	*			cis	76.8	131.6	34.4	121.8	0	0	0	0	114.6
157	N	30.7	Very low	29.7	Very low	134 Å²	134	136 Å²	136	72%	0.717	75%	0.746	S	S	*	*			cis	-123.2	144.1	5.7	-55.3	-34.1	0	0	0	111.7
158	D	34	Very low	29.8	Very low	166 Å²	166	138.2 Å²	138.2	89%	0.888	75%	0.751	S	S	*	*				-174.8	150.2	111.6	-96.6	-9.8	0	0	0	110.3
159	I	28.7	Very low	29.8	Very low	148 Å²	148	139.5 Å²	139.5	76%	0.759	75%	0.745	S	S	*	*			trans	-112.3	126.6	-162.7	-65.1	163.7	0	0	0	110.9
160	N	32.4	Very low	30	Very low	161 Å²	161	142.9 Å²	142.9	86%	0.861	75%	0.754	S	S	*	*				-165.1	129.4	129	-95.8	-33.3	0	0	0	110.5
161	N	28	Very low	30.1	Very low	131 Å²	131	140.5 Å²	140.5	70%	0.701	75%	0.747	S	S	*	*			trans	-87.8	139.6	-177.3	-66.6	-53.1	0	0	0	111.1
162	F	30.3	Very low	30.1	Very low	160 Å²	160	143.2 Å²	143.2	70%	0.702	75%	0.753	S	S	*	*			trans	-143.4	124.9	137.9	-98.7	-77.4	0	0	0	109.1	E861	F162-E861 WeakPolarHBondContact CZ-OE1 3.15Å
163	N	26.3	Very low	30.2	Very low	148 Å²	148	141.4 Å²	141.4	79%	0.791	75%	0.746	S	S	*	*			trans	-100.3	119.2	177.7	-79.8	-61.4	0	0	0	109.3
164	Y	31.4	Very low	30	Very low	129 Å²	129	142 Å²	142	51%	0.506	75%	0.745	S	S	.	*			trans	-120.7	133	163.7	-91	-78.2	0	0	0	111.1	E857 N860	Y164-E857 HydrophobicContact CD2-CG 4.4Å; Y164-E857 HydrophobicContact CE2-CG 3.79Å; Y164-N860 PolarHBondContact OH-ND2 3.48Å
165	G	27.9	Very low	30	Very low	70 Å²	70	146.5 Å²	146.5	72%	0.722	75%	0.75	S	S	*	*			trans	-94	132.5	-159.5	0	0	0	0	0	115.4	K167	G165-K167 PolarHBondContact O-N 3.34Å
166	L	29.7	Very low	30	Very low	162 Å²	162	149.3 Å²	149.3	85%	0.848	76%	0.759	S	S	*	*			trans	-66.8	97.5	170.6	-82.7	157.4	0	0	0	112	N168	L166-N168 PolarHBondContact O-N 3.13Å
167	K	30.7	Very low	29.8	Very low	185 Å²	185	151.9 Å²	151.9	80%	0.804	77%	0.771	S	S	*	*			trans	-76.8	95.6	167.8	-80.8	-177.1	175.9	173.4	0	111.2	G165 F169	G165-K167 PolarHBondContact O-N 3.34Å; K167-F169 HydrophobicContact CB-CE2 4.46Å; K167-F169 PolarHBondContact O-N 2.95Å
168	N	29.1	Very low	29.8	Very low	146 Å²	146	156.6 Å²	156.6	78%	0.781	78%	0.779	S	S	*	*			trans	-72.3	101.4	172.8	-79.7	-48.6	0	0	0	112.2	L166 K170	L166-N168 PolarHBondContact O-N 3.13Å; N168-K170 PolarHBondContact O-N 3.25Å
169	F	29.4	Very low	29.7	Very low	177 Å²	177	155 Å²	155	78%	0.776	78%	0.776	S	S	*	*			trans	-83.1	92.9	168.3	-83.7	-82.4	0	0	0	111.8	K167 N171	K167-F169 HydrophobicContact CB-CE2 4.46Å; K167-F169 PolarHBondContact O-N 2.95Å; F169-N171 PolarHBondContact O-N 3.37Å
170	K	31.4	Very low	30	Very low	198 Å²	198	154.3 Å²	154.3	86%	0.861	78%	0.778	S	S	*	*			trans	-81.8	84.8	166.1	-83.4	-174	173.2	177.9	0	110.8	N168 K172	N168-K170 PolarHBondContact O-N 3.25Å; K170-K172 PolarHBondContact O-N 3.22Å
171	N	30.5	Very low	30	Very low	145 Å²	145	152.9 Å²	152.9	78%	0.775	78%	0.781	S	S	*	*			trans	-75.6	102.6	163.3	-82.2	0	0	0	0	109.8	F169	F169-N171 PolarHBondContact O-N 3.37Å
172	K	27.1	Very low	30.2	Very low	176 Å²	176	150.3 Å²	150.3	77%	0.765	79%	0.786	S	S	*	*			trans	-64.1	129.7	154.8	-86.1	-170.1	167.6	-161.1	0	108.4	K170	K170-K172 PolarHBondContact O-N 3.22Å
173	A	32.2	Very low	30.1	Very low	81 Å²	81	153 Å²	153	67%	0.669	80%	0.797	S	S	*	*			trans	-123	88	162.9	0	0	0	0	0	107.5	Y175	A173-Y175 HydrophobicContact CB-CD2 4.45Å; A173-Y175 PolarHBondContact O-N 3.12Å
174	D	26.2	Very low	30.4	Very low	129 Å²	129	153.8 Å²	153.8	69%	0.69	80%	0.796	S	S	*	*			trans	-68.6	114.8	174.1	-66.8	-54.8	0	0	0	108.7
175	Y	31.4	Very low	30.1	Very low	214 Å²	214	156.7 Å²	156.7	84%	0.839	81%	0.814	S	S	*	*			trans	-121.2	105.4	170.5	-92.1	-82.5	0	0	0	110	A173 T177	A173-Y175 HydrophobicContact CB-CD2 4.45Å; A173-Y175 PolarHBondContact O-N 3.12Å; Y175-T177 PolarHBondContact O-N 3.39Å
176	Q	31.3	Very low	30.3	Very low	191 Å²	191	161.8 Å²	161.8	89%	0.893	82%	0.816	S	S	*	*			trans	-63	132.1	175.2	-70.5	178.8	-22.2	0	0	110.7	R178	Q176-R178 PolarHBondContact O-N 3.47Å
177	T	27.3	Very low	30.2	Very low	139 Å²	139	160 Å²	160	85%	0.853	82%	0.817	S	S	*	*			trans	-71.8	112.7	171.9	47.9	0	0	0	0	110.5	Y175	Y175-T177 PolarHBondContact O-N 3.39Å
178	R	30.4	Very low	30.2	Very low	232 Å²	232	156.5 Å²	156.5	88%	0.875	81%	0.811	S	S	*	*			trans	-116.3	102.4	164.5	-157.3	175.7	-166.5	-160.2	3.1	110.8	Q176	Q176-R178 PolarHBondContact O-N 3.47Å
179	T	32.6	Very low	30.2	Very low	133 Å²	133	157.2 Å²	157.2	82%	0.816	81%	0.81	S	S	*	*			trans	-74	122	175.4	47.2	0	0	0	0	111
180	T	34.7	Very low	30.2	Very low	133 Å²	133	159.7 Å²	159.7	82%	0.816	81%	0.814	S	S	*	*			trans	-138	140.6	159.2	45	0	0	0	0	109.1
181	S	31.6	Very low	30.2	Very low	131 Å²	131	154.1 Å²	154.1	92%	0.916	80%	0.8	S	S	*	*			trans	-103.7	133.1	-179.1	43	0	0	0	0	110.5
182	G	32.9	Very low	30.2	Very low	78 Å²	78	155.5 Å²	155.5	80%	0.804	80%	0.802	S	S	*	*			trans	-165.3	132.9	175.2	0	0	0	0	0	110.1
183	K	28.8	Very low	30.2	Very low	215 Å²	215	154.6 Å²	154.6	94%	0.935	81%	0.806	S	S	*	*			trans	-97.3	128	174.3	-63.3	173.8	-176.7	171.1	0	108.6
184	E	30.8	Very low	30.2	Very low	166 Å²	166	158.6 Å²	158.6	78%	0.776	82%	0.815	S	S	*	*			trans	-152.3	149.9	147.7	-136	178.9	-129.1	0	0	111	K186	E184-K186 IonicContact OE2-NZ 4Å
185	Q	26.6	Very low	30.3	Very low	189 Å²	189	159.7 Å²	159.7	88%	0.883	82%	0.821	S	S	*	*			trans	-102.6	119.3	179.7	-67	175.1	-49.7	0	0	109.8
186	K	32	Very low	30.4	Very low	177 Å²	177	155.7 Å²	155.7	77%	0.77	82%	0.819	S	S	*	*			trans	-135.1	125.5	158.8	-68.4	-173.7	-179.3	163.5	0	110.3	E184	E184-K186 IonicContact OE2-NZ 4Å
187	S	27.4	Very low	30.5	Very low	124 Å²	124	150.8 Å²	150.8	87%	0.867	81%	0.805	S	S	*	*			trans	-77.6	130.8	171.5	48.2	0	0	0	0	109.9
188	V	31.3	Very low	30.7	Very low	112 Å²	112	151.5 Å²	151.5	68%	0.679	80%	0.804	S	S	*	*			trans	-105.1	113.6	167.7	-179.1	0	0	0	0	108
189	H	28.8	Very low	30.9	Very low	162 Å²	162	145 Å²	145	75%	0.75	79%	0.794	S	S	*	*			trans	-82.3	133	168	-152.4	-86.2	0	0	0	107.6	S191	H189-S191 PolarHBondContact ND1-OG 3.4Å
190	W	29.7	Very low	31	Very low	228 Å²	228	145.4 Å²	145.4	86%	0.864	79%	0.792	S	S	*	*			trans	-105.6	121.1	166.7	-70.5	91.2	0	0	0	107.4
191	S	29.8	Very low	30.9	Very low	82 Å²	82	149.3 Å²	149.3	57%	0.573	79%	0.791	S	S	*	*			trans	-118.8	139.6	170.7	-59.5	0	0	0	0	107.3	H189 D193	H189-S191 PolarHBondContact ND1-OG 3.4Å; S191-D193 PolarHBondContact O-N 3.11Å
192	E	31	Very low	31.1	Very low	173 Å²	173	151.3 Å²	151.3	81%	0.808	78%	0.783	S	S	*	*			trans	-85.7	103.2	173.7	-68.3	175.5	115.4	0	0	109.4	L194	E192-L194 PolarHBondContact O-N 3.37Å
193	D	27.2	Very low	31	Very low	158 Å²	158	155.5 Å²	155.5	85%	0.845	78%	0.782	S	S	*	*			trans	-85	100	167.7	-72.8	-41.5	0	0	0	109.4	S191	S191-D193 PolarHBondContact O-N 3.11Å
194	L	32.9	Very low	31.2	Very low	164 Å²	164	153 Å²	153	86%	0.859	78%	0.778	S	S	*	*			trans	-92.2	102.5	169.5	-90.3	169.1	0	0	0	110.2	E192 T196	E192-L194 PolarHBondContact O-N 3.37Å; L194-T196 PolarHBondContact O-N 3.26Å
195	D	28.2	Very low	31.3	Very low	152 Å²	152	151 Å²	151	81%	0.813	78%	0.778	S	S	*	*			trans	-60.3	125.1	169.7	-97.7	-46.4	0	0	0	111.7
196	T	33.4	Very low	31.7	Very low	130 Å²	130	146.8 Å²	146.8	80%	0.798	77%	0.769	S	S	*	*				-172.5	96.2	125.3	19	0	0	0	0	114.1	L194	L194-T196 PolarHBondContact O-N 3.26Å
197	S	32.6	Very low	31.8	Very low	88 Å²	88	144.2 Å²	144.2	62%	0.615	76%	0.763	S	S	*	*			trans	54.7	128.9	134.7	71.6	0	0	0	0	122.3
198	N	32.1	Very low	32.2	Very low	154 Å²	154	145.8 Å²	145.8	82%	0.824	76%	0.76	S	S	*	*			trans	67.3	120.1	143.1	-66.3	-33.6	0	0	0	118.4
199	S	35.4	Very low	32.3	Very low	95 Å²	95	145 Å²	145	66%	0.664	77%	0.766	S	S	*	*			cis	-176.5	161.3	29.2	52.1	0	0	0	0	115.5
200	N	33.7	Very low	32.4	Very low	143 Å²	143	143.3 Å²	143.3	77%	0.765	77%	0.767	S	S	*	*			trans	68.6	94.2	142.3	-73.6	-31.6	0	0	0	121.6
201	R	32.7	Very low	32.6	Very low	214 Å²	214	140.3 Å²	140.3	81%	0.808	77%	0.767	S	S	*	*				118.3	135.6	95.8	-150.3	-174.6	-164.9	-177	5.9	117
202	K	35.4	Very low	32.9	Very low	173 Å²	173	142.4 Å²	142.4	75%	0.752	77%	0.772	S	S	*	*			trans	75.6	149.7	169.1	-57.2	-163.1	178.1	-168.8	0	116.9
203	Q	31	Very low	32.9	Very low	167 Å²	167	140.2 Å²	140.2	78%	0.78	77%	0.766	S	S	*	*			cis	176.9	125.6	-36.4	-123.1	176	-45.8	0	0	107.3
204	L	32.7	Very low	33.3	Very low	163 Å²	163	140 Å²	140	85%	0.853	77%	0.765	S	S	*	*			trans	164.6	102.4	161.7	-88.7	144.3	0	0	0	104.7
205	T	34.2	Very low	33.3	Very low	124 Å²	124	139.2 Å²	139.2	76%	0.761	76%	0.761	S	S	*	*				54.7	121.9	79.2	65.4	0	0	0	0	112.8
206	S	34.5	Very low	33.6	Very low	99 Å²	99	142 Å²	142	69%	0.692	77%	0.766	S	S	*	*			cis	-145	-171.5	4.7	49.8	0	0	0	0	109.2
207	D	33.9	Very low	33.3	Very low	124 Å²	124	143.2 Å²	143.2	66%	0.663	77%	0.766	S	S	*	*			cis	-142.8	178	15	-93.4	-58.9	0	0	0	109.3
208	I	34.8	Very low	33.4	Very low	156 Å²	156	146.9 Å²	146.9	80%	0.8	78%	0.777	S	S	*	*			cis	70.8	127.7	40.4	-53	-177.6	0	0	0	112.3
209	A	35.1	Very low	33.5	Very low	96 Å²	96	144.4 Å²	144.4	79%	0.793	77%	0.769	S	S	*	*			cis	-136.5	176.8	5	0	0	0	0	0	113.9
210	T	30	Very low	33.4	Very low	127 Å²	127	145.6 Å²	145.6	78%	0.779	77%	0.773	S	S	*	*			trans	-106.6	155	177.6	45.2	0	0	0	0	113.3
211	L	34	Very low	33.3	Very low	164 Å²	164	145.2 Å²	145.2	86%	0.859	77%	0.771	S	S	*	*			trans	164	177.2	134.5	-108.8	76.2	0	0	0	110.1
212	N	35.3	Very low	33.4	Very low	126 Å²	126	144.1 Å²	144.1	67%	0.674	77%	0.772	S	S	*	*				-176	133.6	-69.3	-175.5	19.9	0	0	0	107.6
213	N	32.5	Very low	33.4	Very low	128 Å²	128	142.3 Å²	142.3	68%	0.684	77%	0.771	S	S	*	*			trans	28.7	134	165.3	-63.8	-13.6	0	0	0	121.8
214	N	35	Very low	33.4	Very low	154 Å²	154	139.1 Å²	139.1	82%	0.824	77%	0.767	S	S	*	*				-176.3	154.9	107.6	-95.1	-44.7	0	0	0	116.5
215	N	32.5	Very low	33.6	Very low	147 Å²	147	138.9 Å²	138.9	79%	0.786	77%	0.765	S	S	*	*			trans	-63.6	156	-172.2	-50.1	-45.3	0	0	0	117
216	K	33.9	Very low	33.4	Very low	211 Å²	211	139.6 Å²	139.6	92%	0.917	76%	0.764	S	S	*	*				-163.4	158.9	126.5	-111.6	168.3	-175.1	178.8	0	113.8
217	I	28.6	Very low	33.4	Very low	155 Å²	155	141.1 Å²	141.1	80%	0.795	77%	0.769	S	S	*	*			trans	-129.9	146.1	-177.6	-63.4	164.5	0	0	0	107.8
218	I	33.9	Very low	33.3	Very low	165 Å²	165	140.5 Å²	140.5	85%	0.846	77%	0.77	S	S	*	*			trans	-169.6	152.1	148.3	-101.8	149.8	0	0	0	110.6
219	P	35.3	Very low	33.4	Very low	101 Å²	101	140.7 Å²	140.7	66%	0.656	77%	0.771	S	S	*	*			trans	-131.8	-168.5	-165.2	32.4	-8.7	0	0	0	116
220	T	33.6	Very low	33.4	Very low	121 Å²	121	141.9 Å²	141.9	74%	0.742	77%	0.771	S	S	*	*			trans	107	132.1	153.4	69.3	0	0	0	0	121.3
221	N	29.7	Very low	33.3	Very low	135 Å²	135	141.9 Å²	141.9	72%	0.722	77%	0.771	S	S	*	*			trans	50.4	130	146.2	-58.7	7	0	0	0	123
222	F	36.5	Very low	33.3	Very low	191 Å²	191	140.2 Å²	140.2	84%	0.838	77%	0.768	S	S	*	*				-163.2	132.4	109.1	-106.8	-73.1	0	0	0	112.1
223	D	34.4	Very low	33.1	Very low	134 Å²	134	140 Å²	140	72%	0.717	77%	0.771	S	S	*	*			trans	7	162.7	149.2	-56.1	-9	0	0	0	123
224	S	32.1	Very low	33.2	Very low	100 Å²	100	140.9 Å²	140.9	70%	0.699	78%	0.781	S	S	*	*			cis	-175.5	-173.8	-27.7	66.6	0	0	0	0	109.9
225	I	36.3	Very low	33	Very low	159 Å²	159	140.4 Å²	140.4	82%	0.815	78%	0.779	S	S	*	*			trans	118.8	136.2	164	-63	166.6	0	0	0	115.9
226	N	30	Very low	33.1	Very low	138 Å²	138	140.1 Å²	140.1	74%	0.738	78%	0.777	S	S	*	*			trans	-92.1	170.8	-172.2	-53.7	-54.1	0	0	0	111.9
227	T	33.3	Very low	33.1	Very low	131 Å²	131	136.5 Å²	136.5	80%	0.804	77%	0.766	S	S	*	*				-147.4	149.3	50.3	43.2	0	0	0	0	112.3
228	T	32	Very low	33.3	Very low	111 Å²	111	135.9 Å²	135.9	68%	0.681	77%	0.765	S	S	*	*				67.8	110.3	50.8	-23	0	0	0	0	113.3
229	I	37.7	Very low	33.2	Very low	161 Å²	161	132.2 Å²	132.2	83%	0.826	75%	0.753	S	S	*	*				-172.4	159.4	91	-93.4	175.2	0	0	0	109.9
230	P	35.2	Very low	33.1	Very low	121 Å²	121	133.5 Å²	133.5	79%	0.786	76%	0.759	S	S	*	*			trans	-119.4	-161.5	-142.1	45.1	-35.7	0	0	0	117.9
231	T	27.9	Very low	33	Very low	127 Å²	127	133.4 Å²	133.4	78%	0.779	76%	0.759	S	S	*	*			trans	-97.3	147	-171.3	51.4	0	0	0	0	116.2
232	T	34.4	Very low	33.2	Very low	129 Å²	129	131.5 Å²	131.5	79%	0.791	76%	0.756	S	S	*	*			trans	-150.7	127.8	153	47.9	0	0	0	0	107.8
233	T	29.5	Very low	32.9	Very low	121 Å²	121	129.5 Å²	129.5	74%	0.742	75%	0.754	S	S	*	*				64.2	103.8	52.2	68.5	0	0	0	0	116.2
234	T	35	Very low	33	Very low	147 Å²	147	128.1 Å²	128.1	90%	0.902	75%	0.75	S	S	*	*			trans	-164.4	163.8	134.7	18.3	0	0	0	0	111
235	N	31	Very low	33	Very low	144 Å²	144	129.8 Å²	129.8	77%	0.77	75%	0.751	S	S	*	*			trans	-106.2	-166.6	-171.6	-57.3	-39.1	0	0	0	112.1
236	N	34.5	Very low	32.9	Very low	141 Å²	141	128.6 Å²	128.6	75%	0.754	75%	0.747	S	S	*	*			trans	89.9	150.9	160.1	-58.2	-2.6	0	0	0	116.5
237	I	34.1	Very low	33.1	Very low	134 Å²	134	128 Å²	128	69%	0.687	74%	0.744	S	S	*	*			cis	-176.8	160.5	-37.4	-112.4	163.4	0	0	0	105.7
238	D	33.9	Very low	33.2	Very low	143 Å²	143	129.2 Å²	129.2	77%	0.765	74%	0.744	S	S	*	*			trans	64.3	168.6	170.5	-76.7	-44.2	0	0	0	118.4
239	S	30.8	Very low	33.2	Very low	87 Å²	87	129.2 Å²	129.2	61%	0.608	74%	0.744	S	S	*	*				-179.1	-163.8	-60	59.1	0	0	0	0	108
240	V	33.1	Very low	32.9	Very low	128 Å²	128	127.9 Å²	127.9	78%	0.776	74%	0.738	S	S	*	*			trans	79.5	145.3	169.4	-170.9	0	0	0	0	118.1
241	T	31.2	Very low	32.7	Very low	119 Å²	119	125.7 Å²	125.7	73%	0.73	73%	0.726	S	S	*	*			trans	-65.3	-171.3	-170.4	59.6	0	0	0	0	115.3
242	S	33.5	Very low	32.9	Very low	96 Å²	96	130.1 Å²	130.1	67%	0.671	73%	0.73	S	S	*	*			cis	-164.4	140.9	12.4	-3	0	0	0	0	108.2
243	N	30.9	Very low	32.8	Very low	149 Å²	149	127 Å²	127	80%	0.797	72%	0.723	S	S	*	*				78.8	154.5	80.2	-157.5	17.7	0	0	0	116
244	V	36.3	Very low	32.9	Very low	105 Å²	105	128.1 Å²	128.1	64%	0.636	73%	0.73	S	S	*	*			trans	90.3	90.9	166.9	-166.8	0	0	0	0	120.3
245	N	31.7	Very low	32.7	Very low	135 Å²	135	125 Å²	125	72%	0.722	73%	0.727	S	S	*	*				51.7	158	120	-56.6	-9	0	0	0	125.7
246	N	35.1	Very low	32.8	Very low	134 Å²	134	129.1 Å²	129.1	72%	0.717	73%	0.733	S	S	*	*			trans	89.2	150.3	152.3	-65	-36.2	0	0	0	118.9
247	N	33.2	Very low	33	Very low	126 Å²	126	127.6 Å²	127.6	67%	0.674	73%	0.732	S	S	*	*			cis	-178.2	176.1	-38.1	-120.6	-45.8	0	0	0	108
248	L	35.5	Very low	33	Very low	156 Å²	156	128.3 Å²	128.3	82%	0.817	73%	0.732	S	S	*	*			trans	74.8	156.9	166.9	-60.6	121.1	0	0	0	118.2
249	V	33.2	Very low	32.8	Very low	111 Å²	111	129.7 Å²	129.7	67%	0.673	73%	0.731	S	S	*	*			cis	177	161.2	-43.9	131.1	0	0	0	0	109.5
250	N	31.9	Very low	32.9	Very low	132 Å²	132	136.9 Å²	136.9	71%	0.706	75%	0.745	S	S	*	*			trans	75.5	152.9	165.1	-78.6	-20.5	0	0	0	119.5
251	S	30.7	Very low	32.6	Very low	76 Å²	76	140.1 Å²	140.1	53%	0.531	74%	0.743	S	S	.	*			cis	-176	172.3	-28.5	-105.3	0	0	0	0	113.3
252	Y	31.2	Very low	32.9	Very low	219 Å²	219	143.8 Å²	143.8	86%	0.859	75%	0.752	S	S	*	*			trans	80.2	149.9	155.5	-52.7	-56.5	0	0	0	121.9
253	G	33.1	Very low	32.7	Very low	63 Å²	63	145 Å²	145	65%	0.649	75%	0.748	S	S	*	*			trans	122.9	49	158.8	0	0	0	0	0	119
254	T	31.7	Very low	32.7	Very low	145 Å²	145	145 Å²	145	89%	0.89	75%	0.747	S	S	*	*				51.5	121.3	103.3	62.4	0	0	0	0	119.3
255	G	30.8	Very low	32.4	Very low	81 Å²	81	145.4 Å²	145.4	84%	0.835	75%	0.754	S	S	*	*			trans	158.9	102.6	157.1	0	0	0	0	0	118.3
256	Y	33.5	Very low	32.3	Very low	231 Å²	231	144.3 Å²	144.3	91%	0.906	75%	0.752	S	S	*	*			trans	-127.7	147.6	164.7	-94.5	-74.2	0	0	0	109.4
257	P	37.1	Very low	32.1	Very low	110 Å²	110	149.5 Å²	149.5	71%	0.714	76%	0.762	S	S	*	*				-131.5	153.8	110.5	6.6	16.4	0	0	0	112.3
258	Q	34	Very low	31.8	Very low	148 Å²	148	150.3 Å²	150.3	69%	0.692	77%	0.766	S	S	*	*				56.7	141.1	72.2	-64.8	-86.9	5.3	0	0	113.5
259	F	31.1	Very low	31.7	Very low	173 Å²	173	149.3 Å²	149.3	76%	0.759	77%	0.766	S	S	*	*			cis	-123.4	-158.6	14.9	-71	-85.2	0	0	0	110.7
260	R	31.2	Very low	31.4	Very low	237 Å²	237	148.5 Å²	148.5	89%	0.894	77%	0.765	S	S	*	*			cis	-153.5	-147.5	9	-148.7	170.2	-156.1	-176.8	6	110.9
261	R	28.4	Very low	31.3	Very low	196 Å²	196	148.5 Å²	148.5	74%	0.74	77%	0.765	S	S	*	*			trans	-150.8	156.3	178.4	-68.9	-175.2	-178.5	178.4	3.1	111.8	Q263	R261-Q263 VanDerWaalsContact NH1-OE1 3.13Å
262	Q	37	Very low	31.2	Very low	196 Å²	196	150.7 Å²	150.7	92%	0.916	77%	0.771	S	S	*	*			trans	-174.5	119	133.5	-99.9	164.3	10.7	0	0	106.5
263	Q	30.1	Very low	31.2	Very low	123 Å²	123	147.1 Å²	147.1	58%	0.575	77%	0.767	S	S	*	*			cis	102.2	111	12.8	-164.2	176.7	-16.9	0	0	115.2	R261	R261-Q263 VanDerWaalsContact NH1-OE1 3.13Å
264	L	29	Very low	31	Very low	149 Å²	149	149.6 Å²	149.6	78%	0.78	77%	0.769	S	S	*	*			trans	70.9	158.3	167	-67.5	162.9	0	0	0	116.3
265	S	31.2	Very low	30.8	Very low	113 Å²	113	148.6 Å²	148.6	79%	0.79	76%	0.763	S	S	*	*			cis	-141.5	179.4	17.1	65.8	0	0	0	0	115
266	V	28.3	Very low	30.9	Very low	112 Å²	112	154.6 Å²	154.6	68%	0.679	77%	0.766	S	S	*	*			trans	-104.6	149.8	-172.2	171.6	0	0	0	0	111.5
267	R	32.2	Very low	30.5	Very low	243 Å²	243	147.7 Å²	147.7	92%	0.917	76%	0.756	S	S	*	*			trans	-166.9	136.8	142.5	-106.6	158.5	-158.2	178.3	5.9	113.5
268	D	27.2	Very low	30.2	Very low	142 Å²	142	152.8 Å²	152.8	76%	0.759	76%	0.763	S	S	*	*			trans	-76.9	169.8	167.2	-45.5	-97.2	0	0	0	111.8
269	V	32.2	Very low	29.9	Very low	136 Å²	136	150.7 Å²	150.7	82%	0.824	77%	0.765	S	S	*	*				170.6	117.4	128.3	154.3	0	0	0	0	111.4
270	S	27.5	Very low	29.8	Very low	93 Å²	93	148.8 Å²	148.8	65%	0.65	77%	0.771	S	S	*	*			trans	2.2	142.7	160.6	64.4	0	0	0	0	124.4
271	N	28.9	Very low	29.8	Very low	132 Å²	132	142.8 Å²	142.8	71%	0.706	77%	0.766	S	S	*	*				86.6	144.8	127.9	-85.5	44.3	0	0	0	124
272	D	29.2	Very low	29.8	Very low	122 Å²	122	142.9 Å²	142.9	65%	0.652	77%	0.772	S	S	*	*			trans	50.7	106.7	150.7	-48.3	-32.5	0	0	0	118.5
273	N	32.2	Very low	29.8	Very low	144 Å²	144	139.5 Å²	139.5	77%	0.77	76%	0.76	S	S	*	*				-168.4	141.5	70.2	-93.9	-79.3	0	0	0	115.9
274	V	27.7	Very low	30.1	Very low	116 Å²	116	141 Å²	141	70%	0.703	77%	0.77	S	S	*	*			trans	22.6	135	131.2	-174	0	0	0	0	120.9
275	T	27.5	Very low	30.4	Very low	123 Å²	123	141.6 Å²	141.6	76%	0.755	77%	0.769	S	S	*	*			trans	66.6	106.5	163.3	49.6	0	0	0	0	120.8
276	K	33.2	Very low	30.5	Very low	208 Å²	208	140.8 Å²	140.8	90%	0.904	75%	0.752	S	S	*	*				-162.2	162.8	98.7	-102	157.7	-173.5	169	0	111.8
277	A	26.2	Very low	30.9	Very low	85 Å²	85	143.9 Å²	143.9	70%	0.702	76%	0.757	S	S	*	*			trans	-108.5	-155.2	-169.8	0	0	0	0	0	112.7
278	Y	30.5	Very low	31.1	Very low	217 Å²	217	139 Å²	139	85%	0.851	75%	0.749	S	S	*	*			trans	88.9	92.2	-176.6	-52.9	-65.2	0	0	0	114.4
279	S	26.6	Very low	31.5	Very low	105 Å²	105	141.6 Å²	141.6	73%	0.734	75%	0.748	S	S	*	*				79.1	109.9	58.1	81.1	0	0	0	0	114.7
280	C	29.4	Very low	31.8	Very low	132 Å²	132	144.7 Å²	144.7	89%	0.892	74%	0.744	S	S	*	*			trans	-138.9	65.4	165.6	-161.6	0	0	0	0	111
281	S	30.5	Very low	32.1	Very low	111 Å²	111	151.9 Å²	151.9	78%	0.776	76%	0.757	S	S	*	*			trans	-120.3	86.7	177.5	-58.1	0	0	0	0	110
282	K	30	Very low	32.1	Very low	199 Å²	199	150.1 Å²	150.1	87%	0.865	76%	0.755	S	S	*	*			trans	177.6	112.3	167	-98.2	147.1	-174.2	-178.4	0	110.5
283	N	35.6	Very low	32.2	Very low	125 Å²	125	153 Å²	153	67%	0.668	77%	0.77	S	S	*	*			trans	-169	-28.4	151.9	-130.1	-57.7	0	0	0	115.8	E285 E286	N283-E285 PolarHBondContact O-N 2.97Å; N283-E286 PolarHBondContact O-N 3Å; N283-E286 VanDerWaalsContact O-N 3.1Å
284	I	37.4	Very low	32.3	Very low	154 Å²	154	151.6 Å²	151.6	79%	0.79	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-25.8	-175.3	-81.5	174.2	0	0	0	113.7
285	E	35	Very low	32.6	Very low	161 Å²	161	150.6 Å²	150.6	75%	0.752	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-14.3	-177.6	-144.8	163.7	-157.6	0	0	114.2	N283	N283-E285 PolarHBondContact O-N 2.97Å
286	E	34.1	Very low	33	Very low	96 Å²	96	152 Å²	152	45%	0.449	77%	0.773	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.6	-32.1	178	-163.5	171.5	152	0	0	112.7	N283 L288 R289 R290	N283-E286 PolarHBondContact O-N 3Å; N283-E286 VanDerWaalsContact O-N 3.1Å; E286-L288 PolarHBondContact O-N 3.46Å; E286-L288 VanDerWaalsContact O-N 3.17Å; E286-R289 PolarHBondContact O-N 3.33Å; E286-R290 IonicContact OE1-CZ 3.08Å; E286-R290 VanDerWaalsContact OE1-CZ 3.3Å; E286-R290 IonicContact OE1-NE 2.57Å; E286-R290 PolarHBondContact OE1-NE 2.88Å; E286-R290 VanDerWaalsContact OE1-NE 3.08Å; E286-R290 IonicContact OE1-NH2 3.3Å; E286-R290 PolarHBondContact OE1-NH2 3.28Å
287	F	34.9	Very low	33	Very low	178 Å²	178	147.9 Å²	147.9	78%	0.781	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	-27.4	174.1	-163.8	-98.4	0	0	0	112.8
288	L	37.7	Very low	33.2	Very low	141 Å²	141	148.2 Å²	148.2	74%	0.738	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-9.2	176.9	-64.5	176.4	0	0	0	114.2	E286	E286-L288 PolarHBondContact O-N 3.46Å; E286-L288 VanDerWaalsContact O-N 3.17Å
289	R	35	Very low	33.3	Very low	196 Å²	196	146.3 Å²	146.3	74%	0.74	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	-13.7	-179.4	-86.2	-175.7	169.2	-179.9	-0.7	115	E286 R291	E286-R289 PolarHBondContact O-N 3.33Å; R289-R291 PolarHBondContact O-N 2.86Å
290	R	37.8	Very low	33.5	Very low	200 Å²	200	145.5 Å²	145.5	76%	0.755	77%	0.774	S	S	*	*	S	Bend	trans	-95.9	26.9	-176	-63.7	-172.2	178.9	-131.5	5	114.7	E286	E286-R290 IonicContact OE1-CZ 3.08Å; E286-R290 VanDerWaalsContact OE1-CZ 3.3Å; E286-R290 IonicContact OE1-NE 2.57Å; E286-R290 PolarHBondContact OE1-NE 2.88Å; E286-R290 VanDerWaalsContact OE1-NE 3.08Å; E286-R290 IonicContact OE1-NH2 3.3Å; E286-R290 PolarHBondContact OE1-NH2 3.28Å
291	R	35.1	Very low	33.4	Very low	244 Å²	244	144.3 Å²	144.3	92%	0.921	77%	0.767	S	S	*	*	S	Bend	trans	-133.6	39.3	-179.7	-140.3	178	-159	178.8	7.2	114.9	R289	R289-R291 PolarHBondContact O-N 2.86Å
292	S	28.8	Very low	33.4	Very low	95 Å²	95	145.8 Å²	145.8	66%	0.664	77%	0.766	S	S	*	*			trans	-145	89.6	177.4	54.1	0	0	0	0	110.9
293	L	31.5	Very low	33.5	Very low	182 Å²	182	144.4 Å²	144.4	95%	0.953	76%	0.763	S	S	*	*			trans	-178.9	88.8	163.6	-104.9	165.6	0	0	0	110.1
294	S	33.6	Very low	33	Very low	116 Å²	116	147.2 Å²	147.2	81%	0.811	77%	0.774	S	S	*	*			trans	-175.5	156.1	149	-159.6	0	0	0	0	110.6
295	S	34.4	Very low	32.7	Very low	95 Å²	95	147.5 Å²	147.5	66%	0.664	78%	0.776	S	S	*	*			trans	-52.7	162.3	-177	44.7	0	0	0	0	116.6
296	N	34.7	Very low	32.6	Very low	153 Å²	153	149.3 Å²	149.3	82%	0.818	78%	0.776	S	S	*	*			cis	-153.6	153.8	-5.8	-115	-4.7	0	0	0	110.7
297	P	33.5	Very low	32.5	Very low	121 Å²	121	150.2 Å²	150.2	79%	0.786	79%	0.793	S	S	*	*			trans	-100.2	118.3	-178	35.2	-29.7	0	0	0	113.9
298	A	31.5	Very low	32.9	Very low	92 Å²	92	149.6 Å²	149.6	76%	0.76	79%	0.792	S	S	*	*			trans	-155.7	59.5	177.1	0	0	0	0	0	116.1
299	N	32.4	Very low	33.2	Very low	177 Å²	177	147 Å²	147	95%	0.947	79%	0.786	S	S	*	*			trans	-174.4	151.4	133.5	-107	-49.6	0	0	0	112.1
300	A	29.7	Very low	33.3	Very low	87 Å²	87	143.6 Å²	143.6	72%	0.719	78%	0.782	S	S	*	*			trans	-115	-176.4	-167.1	0	0	0	0	0	114
301	S	27.4	Very low	33.2	Very low	107 Å²	107	142.7 Å²	142.7	75%	0.748	78%	0.78	S	S	*	*			trans	81.3	145.3	177.9	80.3	0	0	0	0	117.4
302	N	30.7	Very low	33.5	Very low	143 Å²	143	134 Å²	134	77%	0.765	76%	0.759	S	S	*	*			trans	69.4	59.9	171.1	-55.6	-45.3	0	0	0	118.9
303	Q	31.7	Very low	34	Very low	169 Å²	169	136.8 Å²	136.8	79%	0.79	76%	0.757	S	S	*	*			trans	-161	106.4	133.9	-115.5	154.8	109.4	0	0	113.8
304	M	25.5	Very low	34.3	Very low	185 Å²	185	132.3 Å²	132.3	91%	0.911	73%	0.733	S	S	*	*			trans	-126.3	167.8	157.1	-157.6	173.4	-175.3	0	0	106.8
305	I	32.1	Very low	34.7	Very low	160 Å²	160	131 Å²	131	82%	0.821	72%	0.724	S	S	*	*			trans	77.6	91.6	-165.9	-47.5	164.5	0	0	0	113
306	R	33.2	Very low	34.9	Very low	198 Å²	198	133.7 Å²	133.7	75%	0.747	73%	0.728	S	S	*	*			trans	-155.8	48.6	159.5	-132	172	-170	147.6	2.8	114.3	Q308	R306-Q308 PolarHBondContact O-N 2.64Å
307	S	31.8	Very low	35	Very low	116 Å²	116	134.6 Å²	134.6	81%	0.811	72%	0.72	S	S	*	*			trans	-94.9	46.6	-177.4	45.9	0	0	0	0	114.1
308	Q	42.8	Very low	35.1	Very low	165 Å²	165	135.9 Å²	135.9	77%	0.771	72%	0.72	S	S	*	*	S	Bend	trans	-135.1	-25	175	-70.7	-174.6	-8.2	0	0	114.5	R306 L310	R306-Q308 PolarHBondContact O-N 2.64Å; Q308-L310 VanDerWaalsContact C-N 3.26Å; Q308-L310 PolarHBondContact O-N 3.35Å
309	S	44.3	Very low	35.2	Very low	87 Å²	87	139.9 Å²	139.9	61%	0.608	72%	0.723	S	S	*	*	H	α-helix	trans	-71.2	-14.4	-174.9	47.1	0	0	0	0	115.1
310	L	37.7	Very low	35.1	Very low	123 Å²	123	136.4 Å²	136.4	64%	0.644	71%	0.712	S	S	*	*	H	α-helix	trans	-80.9	-33.4	-177.3	-126.9	163.6	0	0	0	112.5	Q308 Y313 L314	Q308-L310 VanDerWaalsContact C-N 3.26Å; Q308-L310 PolarHBondContact O-N 3.35Å; L310-Y313 PolarHBondContact O-N 3.39Å; L310-L314 HydrophobicContact CD2-CD1 4.02Å; L310-L314 HydrophobicContact CD2-CG 4.33Å; L310-L314 WeakPolarHBondContact O-CG 3.2Å; L310-L314 PolarHBondContact O-N 3.02Å
311	Y	35.7	Very low	35.2	Very low	182 Å²	182	136.3 Å²	136.3	71%	0.714	71%	0.712	S	S	*	*	H	α-helix	trans	-71	-41.5	-176.1	-127.7	-89.3	0	0	0	112.5	Y313 L314 S315	Y311-Y313 PolarHBondContact O-N 3.41Å; Y311-L314 PolarHBondContact O-N 3.23Å; Y311-L314 VanDerWaalsContact O-N 3.07Å; Y311-S315 PolarHBondContact O-N 3.12Å; Y311-S315 PolarHBondContact O-OG 3.37Å
312	A	41.3	Very low	35.4	Very low	60 Å²	60	139.2 Å²	139.2	50%	0.496	72%	0.719	S	S	.	*	H	α-helix	trans	-61.5	-32.8	175.6	0	0	0	0	0	112.9	L314	A312-L314 VanDerWaalsContact C-N 3.34Å
313	Y	37.6	Very low	35.4	Very low	154 Å²	154	140.1 Å²	140.1	60%	0.604	72%	0.724	S	S	*	*	H	α-helix	trans	-73.3	-26.2	176.1	-164	-98.2	0	0	0	112.9	L310 Y311	L310-Y313 PolarHBondContact O-N 3.39Å; Y311-Y313 PolarHBondContact O-N 3.41Å
314	L	38.8	Very low	35.4	Very low	89 Å²	89	139 Å²	139	47%	0.466	73%	0.728	S	S	.	*	H	α-helix	trans	-84.1	-37.2	176	-68.2	169.3	0	0	0	112.2	L310 Y311 A312 M316 R317	L310-L314 HydrophobicContact CD2-CD1 4.02Å; L310-L314 HydrophobicContact CD2-CG 4.33Å; L310-L314 WeakPolarHBondContact O-CG 3.2Å; L310-L314 PolarHBondContact O-N 3.02Å; Y311-L314 PolarHBondContact O-N 3.23Å; Y311-L314 VanDerWaalsContact O-N 3.07Å; A312-L314 VanDerWaalsContact C-N 3.34Å; L314-M316 PolarHBondContact O-N 3.06Å; L314-R317 WeakPolarHBondContact O-CB 3.44Å; L314-R317 PolarHBondContact O-N 3.36Å
315	S	41.5	Very low	35.8	Very low	87 Å²	87	134.3 Å²	134.3	61%	0.608	72%	0.719	S	S	*	*	H	α-helix	trans	-60.2	-30.4	176.7	-68.8	0	0	0	0	113.6	Y311 R317	Y311-S315 PolarHBondContact O-N 3.12Å; Y311-S315 PolarHBondContact O-OG 3.37Å; S315-R317 PolarHBondContact O-N 3.08Å
316	M	39.5	Very low	35.6	Very low	153 Å²	153	136.6 Å²	136.6	75%	0.754	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	2.8	174.9	-59.6	-160.4	-50.2	0	0	114.2	L314	L314-M316 PolarHBondContact O-N 3.06Å
317	R	37.1	Very low	35.6	Very low	172 Å²	172	133.2 Å²	133.2	65%	0.649	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.8	6.1	-169.8	-151.1	171.1	-178.7	169	0.4	115.2	L314 S315	L314-R317 WeakPolarHBondContact O-CB 3.44Å; L314-R317 PolarHBondContact O-N 3.36Å; S315-R317 PolarHBondContact O-N 3.08Å
318	N	35.1	Very low	35.8	Very low	148 Å²	148	133.4 Å²	133.4	79%	0.791	73%	0.726	S	S	*	*			trans	-102.8	-0.5	178.9	-85.1	9.6	0	0	0	115	S320	N318-S320 PolarHBondContact O-N 2.91Å
319	E	32.5	Very low	35.1	Very low	175 Å²	175	129.7 Å²	129.7	82%	0.818	72%	0.723	S	S	*	*			trans	-81.4	52.7	176.5	-64.5	-167.2	141.2	0	0	112.9
320	S	30.7	Very low	34.5	Very low	104 Å²	104	133.3 Å²	133.3	73%	0.727	74%	0.736	S	S	*	*			trans	-151.4	42.9	-178.5	76	0	0	0	0	116.8	N318	N318-S320 PolarHBondContact O-N 2.91Å
321	A	31.7	Very low	34.3	Very low	85 Å²	85	132.4 Å²	132.4	70%	0.702	75%	0.746	S	S	*	*			trans	-156.1	107.3	163.3	0	0	0	0	0	111.9
322	N	33.2	Very low	34	Very low	168 Å²	168	132.2 Å²	132.2	90%	0.898	76%	0.756	S	S	*	*			trans	163.5	71.2	147.4	-85.2	-16	0	0	0	111.7
323	N	29.9	Very low	33.7	Very low	163 Å²	163	133.9 Å²	133.9	87%	0.872	77%	0.77	S	S	*	*			trans	-112.6	113.2	158.2	-86.4	-33.6	0	0	0	107.5
324	V	32.4	Very low	33.3	Very low	146 Å²	146	134 Å²	134	89%	0.885	78%	0.781	S	S	*	*			trans	173.6	156	153.1	141.2	0	0	0	0	110
325	A	32.2	Very low	33	Very low	86 Å²	86	135.6 Å²	135.6	71%	0.711	80%	0.795	S	S	*	*			trans	64.2	87.2	167.2	0	0	0	0	0	118.6
326	K	29.2	Very low	32.4	Very low	207 Å²	207	137.2 Å²	137.2	90%	0.9	80%	0.801	S	S	*	*			trans	-85.9	113.4	140.4	-74.1	-180	177.2	179.9	0	108.8
327	T	32.8	Very low	32.3	Very low	128 Å²	128	139.2 Å²	139.2	79%	0.785	81%	0.806	S	S	*	*			trans	-168.6	160.5	153.9	11.2	0	0	0	0	112.4
328	S	34.7	Very low	32	Very low	119 Å²	119	136.3 Å²	136.3	83%	0.832	81%	0.812	S	S	*	*			trans	56.2	115.1	166.8	48.3	0	0	0	0	118.6
329	A	30.1	Very low	31.9	Very low	88 Å²	88	136.7 Å²	136.7	73%	0.727	81%	0.813	S	S	*	*			trans	-94.2	-179.6	157	0	0	0	0	0	110.6
330	N	31	Very low	31.9	Very low	163 Å²	163	137.7 Å²	137.7	87%	0.872	81%	0.814	S	S	*	*			trans	70.3	97.2	168.9	-56.7	-6.7	0	0	0	117.6
331	A	32.8	Very low	32.1	Very low	103 Å²	103	137.8 Å²	137.8	85%	0.851	81%	0.812	S	S	*	*			trans	-163.6	119.1	131.5	0	0	0	0	0	110.7
332	L	30.6	Very low	32.4	Very low	179 Å²	179	141.5 Å²	141.5	94%	0.937	82%	0.82	S	S	*	*			trans	-88.8	135	151.6	-84.5	73.4	0	0	0	107
333	A	33.7	Very low	32.2	Very low	94 Å²	94	140.9 Å²	140.9	78%	0.777	82%	0.817	S	S	*	*			trans	-171.5	132.1	140	0	0	0	0	0	112.3
334	N	29.5	Very low	32.5	Very low	158 Å²	158	139.2 Å²	139.2	85%	0.845	82%	0.818	S	S	*	*			trans	-29.2	134.9	163.1	-48.3	-23.9	0	0	0	116.4
335	T	33.4	Very low	32.6	Very low	121 Å²	121	143.1 Å²	143.1	74%	0.742	82%	0.817	S	S	*	*			trans	-140.7	97.8	149.5	-39.3	0	0	0	0	110.7	F337	T335-F337 HydrophobicContact CG2-CD2 4.19Å; T335-F337 HydrophobicContact CG2-CE2 4.05Å
336	T	29	Very low	32.5	Very low	122 Å²	122	146 Å²	146	75%	0.748	82%	0.821	S	S	*	*			trans	-76	141	170.7	-51.2	0	0	0	0	109.8
337	F	35.9	Very low	32.7	Very low	194 Å²	194	143.3 Å²	143.3	85%	0.851	82%	0.815	S	S	*	*			trans	-125.5	130.8	163.9	-101.2	-87.2	0	0	0	110.8	T335	T335-F337 HydrophobicContact CG2-CD2 4.19Å; T335-F337 HydrophobicContact CG2-CE2 4.05Å
338	S	31.6	Very low	32.8	Very low	112 Å²	112	143.5 Å²	143.5	78%	0.783	82%	0.815	S	S	*	*			trans	-86.8	150.5	-167.5	-59.1	0	0	0	0	113.9
339	I	32.5	Very low	32.5	Very low	156 Å²	156	144.5 Å²	144.5	80%	0.8	81%	0.811	S	S	*	*			trans	-74.2	143.6	170	-62.3	165	0	0	0	109.8
340	K	33.6	Very low	32.7	Very low	196 Å²	196	147.1 Å²	147.1	85%	0.852	82%	0.818	S	S	*	*			trans	-114.6	123.2	152.7	-81.9	-166.7	174	-169.8	0	109.3
341	P	33.8	Very low	32.8	Very low	106 Å²	106	146.6 Å²	146.6	69%	0.688	81%	0.81	S	S	*	*			trans	-88.2	154.2	162.5	36	-31.1	0	0	0	110.2
342	D	38.2	Very low	33	Very low	163 Å²	163	147.1 Å²	147.1	87%	0.872	81%	0.805	S	S	*	*			trans	-146.1	144.3	160.5	-116.6	-42.8	0	0	0	110.8
343	N	29.4	Very low	33.2	Very low	154 Å²	154	147 Å²	147	82%	0.824	80%	0.797	S	S	*	*			trans	-119.7	135.2	-176	-84.8	-62.7	0	0	0	110.5
344	S	36.7	Very low	33.1	Very low	129 Å²	129	149.5 Å²	149.5	90%	0.902	80%	0.796	S	S	*	*			trans	-160.3	167.7	152.2	37.6	0	0	0	0	111.2
345	R	34.2	Very low	33.4	Very low	227 Å²	227	147.8 Å²	147.8	86%	0.857	79%	0.794	S	S	*	*			trans	-126.8	147	-157.2	-70.6	173.6	168.1	148.1	-7.1	113.3
346	N	30.6	Very low	33.2	Very low	147 Å²	147	149.3 Å²	149.3	79%	0.786	80%	0.797	S	S	*	*			trans	67.2	161.3	158	-50.8	-12.9	0	0	0	114
347	I	32.3	Very low	33.5	Very low	151 Å²	151	153.4 Å²	153.4	77%	0.774	80%	0.804	S	S	*	*			cis	-155.9	136	43.2	-84.2	-178.5	0	0	0	112
348	V	35.3	Very low	33.2	Very low	132 Å²	132	152.9 Å²	152.9	80%	0.8	80%	0.804	S	S	*	*			trans	65.5	144.6	151	171.4	0	0	0	0	122.6
349	D	27.8	Very low	33.2	Very low	140 Å²	140	155.6 Å²	155.6	75%	0.749	81%	0.807	S	S	*	*			trans	-72.5	157.7	179.8	-49.4	-104.2	0	0	0	117.2
350	V	34.1	Very low	32.9	Very low	142 Å²	142	152.4 Å²	152.4	86%	0.861	80%	0.803	S	S	*	*				-146.3	140.1	123.6	177.1	0	0	0	0	109.8
351	Q	33	Very low	33	Very low	152 Å²	152	149.5 Å²	149.5	71%	0.71	80%	0.802	S	S	*	*			trans	-112	149.6	173.1	-104.2	-85.6	-17.2	0	0	110.4
352	P	37.2	Very low	32.9	Very low	115 Å²	115	150.7 Å²	150.7	75%	0.747	81%	0.808	S	S	*	*				-154.9	133.8	103.8	35.9	-16.1	0	0	0	118.8
353	K	35	Very low	32.4	Very low	175 Å²	175	149.2 Å²	149.2	76%	0.761	81%	0.805	S	S	*	*			trans	38.2	118.2	133.2	-70	179.3	176.2	174.9	0	121.8
354	L	32.3	Very low	32.6	Very low	147 Å²	147	147.5 Å²	147.5	77%	0.77	81%	0.805	S	S	*	*				47.7	150	115.2	-74.9	165.4	0	0	0	121.2	L356	L354-L356 HydrophobicContact CD2-CD1 4.09Å
355	P	35.9	Very low	32.4	Very low	122 Å²	122	147.3 Å²	147.3	79%	0.792	80%	0.798	S	S	*	*			cis	-143.2	-176.9	39	42	-22.1	0	0	0	117.8
356	L	29	Very low	32.5	Very low	153 Å²	153	142.6 Å²	142.6	80%	0.801	80%	0.795	S	S	*	*			trans	-71.3	160.6	174.2	-71.2	81.1	0	0	0	113	L354	L354-L356 HydrophobicContact CD2-CD1 4.09Å
357	K	34.8	Very low	32.9	Very low	208 Å²	208	141 Å²	141	90%	0.904	79%	0.792	S	S	*	*			trans	-120.6	127.1	159.9	-114.2	-179.7	-179.5	178	0	110.9
358	Q	29.9	Very low	33	Very low	184 Å²	184	140.5 Å²	140.5	86%	0.86	79%	0.791	S	S	*	*			trans	-116.3	142.6	173	-177.7	-179.5	7.4	0	0	107.9
359	M	32.4	Very low	33	Very low	168 Å²	168	140.2 Å²	140.2	83%	0.828	79%	0.785	S	S	*	*			trans	-135.4	119.3	171	-73.1	-169.4	71	0	0	111.1
360	A	25.8	Very low	33.3	Very low	89 Å²	89	140.3 Å²	140.3	74%	0.736	79%	0.786	S	S	*	*			trans	-137.1	140.5	161.4	0	0	0	0	0	106.6
361	V	35.5	Very low	33.5	Very low	136 Å²	136	139.3 Å²	139.3	82%	0.824	79%	0.785	S	S	*	*			trans	-137.3	145.3	178.8	-179.1	0	0	0	0	108.8
362	T	31.5	Very low	33.5	Very low	131 Å²	131	139 Å²	139	80%	0.804	79%	0.789	S	S	*	*			trans	-102.9	165.2	-156.5	-46	0	0	0	0	113.4
363	T	26.8	Very low	33.4	Very low	132 Å²	132	142.1 Å²	142.1	81%	0.81	79%	0.793	S	S	*	*			trans	-72.1	150.4	-177.5	52	0	0	0	0	115.8
364	S	34	Very low	33.2	Very low	118 Å²	118	144.5 Å²	144.5	83%	0.825	80%	0.797	S	S	*	*			trans	-153.4	155.5	147.3	59.7	0	0	0	0	113.8
365	T	32.8	Very low	33.4	Very low	125 Å²	125	145.6 Å²	145.6	77%	0.767	80%	0.798	S	S	*	*			trans	-67.7	174	177.2	49.4	0	0	0	0	113.2
366	T	36.8	Very low	33.3	Very low	127 Å²	127	144.2 Å²	144.2	78%	0.779	79%	0.791	S	S	*	*			cis	-164.1	167.5	19.6	-10	0	0	0	0	109.9
367	P	39.4	Very low	33.6	Very low	114 Å²	114	143.2 Å²	143.2	74%	0.74	79%	0.787	S	S	*	*			trans	-111.5	160.4	-175.6	39.6	-30.9	0	0	0	115.5
368	N	33.7	Very low	33.6	Very low	140 Å²	140	139 Å²	139	75%	0.749	77%	0.774	S	S	*	*			trans	-171.5	165.8	136.1	-134	-20.6	0	0	0	116.4
369	N	35.7	Very low	33.7	Very low	126 Å²	126	139.6 Å²	139.6	67%	0.674	77%	0.77	S	S	*	*			trans	65.7	136.2	159.8	-64.8	-31.9	0	0	0	119.4
370	N	33.4	Very low	33.8	Very low	142 Å²	142	136.3 Å²	136.3	76%	0.759	76%	0.764	S	S	*	*			cis	111.2	105.4	17.7	-81.8	-33.9	0	0	0	112.9
371	S	38.6	Very low	34.1	Very low	122 Å²	122	139.1 Å²	139.1	85%	0.853	76%	0.761	S	S	*	*			trans	-162.3	156.1	145.4	60.2	0	0	0	0	110.5
372	N	32.3	Very low	34	Very low	146 Å²	146	141.8 Å²	141.8	78%	0.781	76%	0.758	S	S	*	*			trans	-123	147.6	-172.3	-57.7	-85.5	0	0	0	111.4
373	H	35.4	Very low	34.1	Very low	180 Å²	180	139.6 Å²	139.6	83%	0.833	75%	0.748	S	S	*	*			trans	-163.2	127.2	144.2	-95.9	-82.9	0	0	0	106.9
374	R	31.2	Very low	34.5	Very low	225 Å²	225	140.2 Å²	140.2	85%	0.849	75%	0.745	S	S	*	*			cis	92.4	142.6	38.3	-89.4	-166.2	167.8	-172.1	-2.3	114.8
375	Q	37.3	Very low	34.4	Very low	170 Å²	170	139.4 Å²	139.4	79%	0.794	75%	0.745	S	S	*	*			trans	76	125.7	-173.8	-61.2	163.5	-66.3	0	0	112.7
376	S	32.9	Very low	34.6	Very low	92 Å²	92	145 Å²	145	64%	0.643	75%	0.752	S	S	*	*			cis	74.7	139.5	38.3	95.1	0	0	0	0	111.9
377	D	36.3	Very low	34.4	Very low	133 Å²	133	149.3 Å²	149.3	71%	0.711	75%	0.754	S	S	*	*			cis	-151.1	172	16.9	-92.5	-72.3	0	0	0	109.4
378	N	33.1	Very low	34.1	Very low	118 Å²	118	150 Å²	150	63%	0.631	76%	0.762	S	S	*	*			cis	-178.3	-174.4	-22	-160	-29.4	0	0	0	108.6
379	Y	34	Very low	34.2	Very low	197 Å²	197	149.3 Å²	149.3	77%	0.773	76%	0.762	S	S	*	*			trans	65.9	112.6	172.2	-68.8	-81.8	0	0	0	117.3
380	S	32.5	Very low	34	Very low	100 Å²	100	149.6 Å²	149.6	70%	0.699	77%	0.773	S	S	*	*				98.5	147.1	76.4	76.5	0	0	0	0	111.9
381	E	32.8	Very low	34	Very low	148 Å²	148	147.8 Å²	147.8	69%	0.692	77%	0.771	S	S	*	*			cis	-164.4	166.3	9.7	-142.6	-179.5	-177	0	0	112.1
382	Y	33.7	Very low	33.8	Very low	192 Å²	192	146.6 Å²	146.6	75%	0.753	76%	0.763	S	S	*	*			trans	54.4	142	168.9	-70	-87.5	0	0	0	120.7
383	S	33.8	Very low	34	Very low	84 Å²	84	146.3 Å²	146.3	59%	0.587	77%	0.766	S	S	*	*			cis	-165.5	145.2	-23.9	-122.6	0	0	0	0	114.7
384	I	33.9	Very low	33.9	Very low	146 Å²	146	148.4 Å²	148.4	75%	0.749	77%	0.768	S	S	*	*			trans	56.8	102	149.6	-53.4	162.8	0	0	0	118.8	R386	I384-R386 HydrophobicContact CG2-CG 4.34Å
385	A	33.3	Very low	34	Very low	101 Å²	101	141.5 Å²	141.5	84%	0.835	77%	0.767	S	S	*	*			trans	-122.5	120.3	147.5	0	0	0	0	0	109.7	R387	A385-R387 PolarHBondContact O-N 3.33Å
386	R	35.5	Very low	33.9	Very low	242 Å²	242	138 Å²	138	91%	0.913	77%	0.767	S	S	*	*			trans	-84.4	96.1	-176.2	-81.9	-170.3	173.2	-172.8	-1.4	113.2	I384	I384-R386 HydrophobicContact CG2-CG 4.34Å
387	R	34	Very low	34	Very low	218 Å²	218	143.1 Å²	143.1	82%	0.823	78%	0.781	S	S	*	*			trans	-133.8	125.2	145.2	-83.8	-173.1	168.9	-129.2	-4.3	108.4	A385	A385-R387 PolarHBondContact O-N 3.33Å
388	S	32.9	Very low	33.9	Very low	128 Å²	128	142.5 Å²	142.5	90%	0.895	79%	0.787	S	S	*	*			trans	-110.8	152.1	168	-169.6	0	0	0	0	109.5
389	V	35.3	Very low	34.1	Very low	125 Å²	125	142.2 Å²	142.2	76%	0.758	79%	0.794	S	S	*	*			trans	-114.6	140	-169.6	-178.1	0	0	0	0	108.9	S391	V389-S391 PolarHBondContact O-N 3.37Å
390	C	31.4	Very low	34.3	Very low	132 Å²	132	140.5 Å²	140.5	89%	0.892	80%	0.797	S	S	*	*			trans	-75.1	105.8	165.4	-69.5	0	0	0	0	108.6
391	S	34.4	Very low	34.4	Very low	105 Å²	105	140.8 Å²	140.8	73%	0.734	80%	0.799	S	S	*	*			trans	-77.3	142.2	162.7	-171.2	0	0	0	0	109.3	V389	V389-S391 PolarHBondContact O-N 3.37Å
392	S	33.7	Very low	34.7	Very low	97 Å²	97	139 Å²	139	68%	0.678	80%	0.8	S	S	*	*			trans	-68.5	154.6	162.4	46.5	0	0	0	0	110.6
393	V	36	Very low	34.5	Very low	139 Å²	139	136.9 Å²	136.9	84%	0.842	80%	0.802	S	S	*	*			trans	-130.7	126.4	164.4	-178.7	0	0	0	0	106.5
394	Y	34.2	Very low	34.5	Very low	225 Å²	225	140.8 Å²	140.8	88%	0.882	82%	0.815	S	S	*	*			trans	-79.9	132.1	171.2	-90	-94.5	0	0	0	109.6
395	G	33.8	Very low	34.2	Very low	79 Å²	79	138.4 Å²	138.4	81%	0.814	81%	0.812	S	S	*	*			trans	-124.5	131.4	160.3	0	0	0	0	0	107.5
396	A	33.8	Very low	34.2	Very low	98 Å²	98	140.1 Å²	140.1	81%	0.81	81%	0.812	S	S	*	*			trans	-112.8	136.7	-170.7	0	0	0	0	0	111.8
397	E	35	Very low	33.9	Very low	199 Å²	199	136.5 Å²	136.5	93%	0.93	81%	0.805	S	S	*	*			trans	-130.9	156	153.8	-70.8	-162.6	152.2	0	0	108.9
398	S	34.5	Very low	33.8	Very low	120 Å²	120	134.4 Å²	134.4	84%	0.839	81%	0.81	S	S	*	*			trans	-136.1	133.4	-154.8	53.5	0	0	0	0	114.1
399	S	37.7	Very low	33.6	Very low	112 Å²	112	136 Å²	136	78%	0.783	80%	0.802	S	S	*	*			trans	-162.4	102.6	154.3	59.6	0	0	0	0	113.8
400	I	37.5	Very low	33.4	Very low	160 Å²	160	137.4 Å²	137.4	82%	0.821	81%	0.805	S	S	*	*			trans	51.5	90.8	134.4	-49.7	171.5	0	0	0	118
401	S	35.8	Very low	33.2	Very low	106 Å²	106	135.9 Å²	135.9	74%	0.741	80%	0.796	S	S	*	*				25.6	158.4	113.7	-51.2	0	0	0	0	122.1
402	P	37.8	Very low	33.2	Very low	110 Å²	110	136.8 Å²	136.8	71%	0.714	80%	0.802	S	S	*	*			cis	-140.7	-179.9	-35	39.9	-22.2	0	0	0	114.5
403	N	30.9	Very low	33	Very low	149 Å²	149	140.4 Å²	140.4	80%	0.797	81%	0.814	S	S	*	*			trans	18.4	127.6	150.8	-58.8	-12.6	0	0	0	120.9
404	L	32.5	Very low	32.8	Very low	166 Å²	166	145 Å²	145	87%	0.869	82%	0.816	S	S	*	*				-163.8	165	90.8	-158.5	54.6	0	0	0	112
405	S	28.3	Very low	32.6	Very low	96 Å²	96	146.4 Å²	146.4	67%	0.671	82%	0.82	S	S	*	*			trans	-77	158.8	-179.7	53	0	0	0	0	115
406	T	33	Very low	32.4	Very low	137 Å²	137	146.9 Å²	146.9	84%	0.84	81%	0.811	S	S	*	*				-176.8	145.9	121	-81.1	0	0	0	0	110.1
407	E	28.5	Very low	32.4	Very low	165 Å²	165	150.5 Å²	150.5	77%	0.771	82%	0.815	S	S	*	*			trans	-73	150.9	176	-55.1	178.4	118.6	0	0	113
408	L	33.5	Very low	32.2	Very low	175 Å²	175	144.8 Å²	144.8	92%	0.916	80%	0.797	S	S	*	*			trans	-145.6	135.9	144.5	-83.8	-172.8	0	0	0	111.7
409	H	28.6	Very low	32.4	Very low	160 Å²	160	141.5 Å²	141.5	74%	0.741	77%	0.773	S	S	*	*			trans	-64.4	152.4	167.8	-80.1	-139.5	0	0	0	111.5
410	L	30.1	Very low	32.1	Very low	155 Å²	155	140.4 Å²	140.4	81%	0.812	77%	0.765	S	S	*	*				-179.9	141.7	96.3	-111.7	107.9	0	0	0	114.9
411	S	28.4	Very low	32.4	Very low	101 Å²	101	137.3 Å²	137.3	71%	0.706	75%	0.746	S	S	*	*			trans	42.7	116.9	150.6	62.1	0	0	0	0	121.2
412	S	33.9	Very low	32.3	Very low	124 Å²	124	138.1 Å²	138.1	87%	0.867	74%	0.738	S	S	*	*			trans	-150.1	118.3	143.1	-85.4	0	0	0	0	111.1	R414	S412-R414 PolarHBondContact O-N 2.94Å
413	N	28.7	Very low	32.1	Very low	173 Å²	173	141.3 Å²	141.3	93%	0.925	74%	0.735	S	S	*	*			trans	-71.5	119.8	179.8	-79.2	-39	0	0	0	111.5
414	R	32.7	Very low	32.2	Very low	236 Å²	236	141.4 Å²	141.4	89%	0.891	73%	0.729	S	S	*	*			trans	-134.1	130.9	155	-72.9	-167.7	-178.9	-129.2	1.7	109.8	S412 S416	S412-R414 PolarHBondContact O-N 2.94Å; R414-S416 PolarHBondContact O-N 2.89Å
415	R	28.4	Very low	32.2	Very low	253 Å²	253	138.6 Å²	138.6	96%	0.955	72%	0.723	S	S	*	*			trans	-84.8	86.3	171.5	-59.2	-178.5	-164.9	170.8	4.6	108.7
416	S	31.7	Very low	32.5	Very low	90 Å²	90	141 Å²	141	63%	0.629	73%	0.729	S	S	*	*			trans	-88.4	116.2	165.5	49.9	0	0	0	0	109	R414 S418	R414-S416 PolarHBondContact O-N 2.89Å; S416-S418 PolarHBondContact O-N 3.04Å
417	I	32.8	Very low	32.4	Very low	174 Å²	174	143.9 Å²	143.9	89%	0.892	73%	0.732	S	S	*	*			trans	-79.5	81.5	171.4	-56.6	177.1	0	0	0	107.3
418	S	31.7	Very low	32.9	Very low	78 Å²	78	141.3 Å²	141.3	55%	0.545	73%	0.733	S	S	.	*			trans	-89.4	132.1	173.8	-55.3	0	0	0	0	109.3	S416 S420	S416-S418 PolarHBondContact O-N 3.04Å; S418-S420 PolarHBondContact O-N 2.76Å
419	P	37.2	Very low	33	Very low	52 Å²	52	141.6 Å²	141.6	34%	0.338	73%	0.73	S	S	.	*			trans	-66.5	103.2	175.6	26.6	-32.8	0	0	0	109.8	F421	P419-F421 PolarHBondContact O-N 3.29Å
420	S	33	Very low	33.7	Very low	88 Å²	88	139.3 Å²	139.3	62%	0.615	73%	0.727	S	S	*	*			trans	-81.8	108.3	-171.9	57	0	0	0	0	112.1	S418 Q422	S418-S420 PolarHBondContact O-N 2.76Å; S420-Q422 VanDerWaalsContact C-N 3.33Å; S420-Q422 PolarHBondContact O-N 2.84Å
421	F	42.2	Very low	33.9	Very low	96 Å²	96	139.1 Å²	139.1	42%	0.421	73%	0.727	S	S	.	*			trans	-65.6	87.3	167.1	-80	-78.5	0	0	0	111.2	P419 R423 L444	P419-F421 PolarHBondContact O-N 3.29Å; F421-R423 PolarHBondContact O-N 3.32Å; F421-L444 HydrophobicContact CD1-CD1 3.79Å; F421-L444 HydrophobicContact CE1-CD1 3.68Å; F421-L444 HydrophobicContact CE1-CG 4.31Å
422	Q	34.7	Very low	34.3	Very low	123 Å²	123	136.6 Å²	136.6	58%	0.575	72%	0.717	S	S	*	*			trans	-81.1	99.7	171.8	-71.1	-173.5	-23.1	0	0	110.7	S420 F424	S420-Q422 VanDerWaalsContact C-N 3.33Å; S420-Q422 PolarHBondContact O-N 2.84Å; Q422-F424 HydrophobicContact CB-CD2 4.15Å; Q422-F424 HydrophobicContact CB-CE2 3.68Å; Q422-F424 HydrophobicContact CB-CZ 4.28Å; Q422-F424 HydrophobicContact CG-CE2 4.38Å; Q422-F424 PolarHBondContact O-N 2.98Å; Q422-F424 VanDerWaalsContact OE1-CE2 3.31Å
423	R	33.3	Very low	34.3	Very low	176 Å²	176	138 Å²	138	66%	0.664	72%	0.72	S	S	*	*			trans	-89.4	92.3	168.8	179.8	-177.2	-80.9	178.3	-5.8	109.2	F421	F421-R423 PolarHBondContact O-N 3.32Å
424	F	33.6	Very low	34.7	Very low	151 Å²	151	135.5 Å²	135.5	66%	0.662	71%	0.71	S	S	*	*			trans	-74.6	133.2	172	-69.7	-79.8	0	0	0	111.3	Q422	Q422-F424 HydrophobicContact CB-CD2 4.15Å; Q422-F424 HydrophobicContact CB-CE2 3.68Å; Q422-F424 HydrophobicContact CB-CZ 4.28Å; Q422-F424 HydrophobicContact CG-CE2 4.38Å; Q422-F424 PolarHBondContact O-N 2.98Å; Q422-F424 VanDerWaalsContact OE1-CE2 3.31Å
425	S	32.4	Very low	34.8	Very low	107 Å²	107	131.5 Å²	131.5	75%	0.748	71%	0.707	S	S	*	*			trans	-121.4	101.3	173.8	55.4	0	0	0	0	109.3
426	N	34.2	Very low	35.1	Very low	148 Å²	148	125.9 Å²	125.9	79%	0.791	69%	0.689	S	S	*	*			trans	-88.2	129.9	179.1	-65.8	11.7	0	0	0	109.8
427	Q	31.8	Very low	35.4	Very low	196 Å²	196	130.7 Å²	130.7	92%	0.916	70%	0.701	S	S	*	*			trans	-109.6	119.2	166.1	-71.5	-179.5	-14.4	0	0	108.4
428	S	38.1	Very low	35.6	Very low	111 Å²	111	131.1 Å²	131.1	78%	0.776	70%	0.7	S	S	*	*			trans	-164.1	125.2	165.7	55.5	0	0	0	0	109.2
429	E	36.1	Very low	35.7	Very low	182 Å²	182	131.1 Å²	131.1	85%	0.85	70%	0.7	S	S	*	*			trans	-67.7	165.9	162.9	-64.4	143.1	142.1	0	0	108.8
430	T	42.4	Very low	35.8	Very low	111 Å²	111	136.4 Å²	136.4	68%	0.681	73%	0.725	S	S	*	*			cis	-140.5	173.1	29.5	50.7	0	0	0	0	113.8
431	D	35.5	Very low	36.7	Very low	151 Å²	151	138.4 Å²	138.4	81%	0.807	72%	0.723	S	S	*	*			trans	34.3	122.5	146	-52.5	-26.5	0	0	0	121.4
432	G	36	Very low	37.3	Very low	49 Å²	49	136.9 Å²	136.9	51%	0.505	72%	0.722	S	S	.	*			trans	160.4	107.7	175	0	0	0	0	0	109.6	V434	G432-V434 PolarHBondContact O-N 3.39Å
433	V	33.3	Very low	39	Very low	152 Å²	152	135.6 Å²	135.6	92%	0.921	72%	0.719	S	S	*	*			trans	-91.4	90	-169.5	-177.4	0	0	0	0	111
434	V	38.7	Very low	41.6	Very low	121 Å²	121	128.3 Å²	128.3	73%	0.733	69%	0.693	S	S	*	*	S	Bend	trans	-143.9	139.3	159.9	-172.9	0	0	0	0	108.2	G432 K436	G432-V434 PolarHBondContact O-N 3.39Å; V434-K436 PolarHBondContact O-N 3.16Å
435	D	34.8	Very low	44.4	Very low	153 Å²	153	124 Å²	124	82%	0.818	68%	0.679	S	S	*	*			trans	-27.4	90.5	-172.6	-63.1	-51	0	0	0	117.6	H437	D435-H437 VanDerWaalsContact C-N 3.33Å; D435-H437 PolarHBondContact O-N 2.97Å
436	K	33.4	Very low	47.2	Very low	135 Å²	135	119.2 Å²	119.2	59%	0.587	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-81.4	4.6	-174.6	-99.9	169.6	178	163.6	0	116.1	V434 Q438 S439	V434-K436 PolarHBondContact O-N 3.16Å; K436-Q438 VanDerWaalsContact C-N 3.35Å; K436-Q438 PolarHBondContact O-N 2.73Å; K436-S439 PolarHBondContact O-OG 3.24Å
437	H	38.5	Very low	50.1	Low	190 Å²	190	114.7 Å²	114.7	88%	0.88	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-76.8	-7.1	-173.9	-77.2	-61.4	0	0	0	116.5	D435	D435-H437 VanDerWaalsContact C-N 3.33Å; D435-H437 PolarHBondContact O-N 2.97Å
438	Q	36.2	Very low	53.2	Low	183 Å²	183	105.3 Å²	105.3	86%	0.855	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-103	7.8	179	-138.7	75	38.2	0	0	114.4	K436	K436-Q438 VanDerWaalsContact C-N 3.35Å; K436-Q438 PolarHBondContact O-N 2.73Å
439	S	34.4	Very low	55.9	Low	78 Å²	78	102.4 Å²	102.4	55%	0.545	55%	0.549	S	S	.	.			trans	-97.6	3	-156.7	65.1	0	0	0	0	117.8	K436 K441	K436-S439 PolarHBondContact O-OG 3.24Å; S439-K441 PolarHBondContact O-N 3.2Å
440	N	39.4	Very low	58.7	Low	164 Å²	164	94.1 Å²	94.1	88%	0.877	51%	0.51	S	S	*	.			trans	-73.3	52.9	171.9	-78.7	-11.9	0	0	0	112.5	T442	N440-T442 PolarHBondContact O-N 3.4Å
441	K	51.1	Low	61	Low	129 Å²	129	93.6 Å²	93.6	56%	0.561	51%	0.509	S	S	*	.			trans	-64.7	103	176.2	-85.8	-170.1	174.8	-172.9	0	109.9	S439 N443 H461	S439-K441 PolarHBondContact O-N 3.2Å; K441-N443 PolarHBondContact O-N 2.92Å; K441-H461 PolarHBondContact NZ-NE2 2.9Å
442	T	56.2	Low	63.5	Low	65 Å²	65	90.2 Å²	90.2	40%	0.399	49%	0.491	S	S	.	.			trans	-71.1	85.6	162.6	41.5	0	0	0	0	108.7	N440 L444	N440-T442 PolarHBondContact O-N 3.4Å; T442-L444 PolarHBondContact O-N 3.48Å
443	N	69.6	Low	66.1	Low	96 Å²	96	97.7 Å²	97.7	51%	0.513	50%	0.504	S	S	.	.			trans	-59.4	104.8	179	-72	-30.8	0	0	0	109.8	K441	K441-N443 PolarHBondContact O-N 2.92Å
444	L	88.8	Confident	69	Low	23 Å²	23	94 Å²	94	12%	0.12	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	139.2	173.6	-161.9	69.4	0	0	0	107.8	F421 T442 P459 V460 F507 L510	F421-L444 HydrophobicContact CD1-CD1 3.79Å; F421-L444 HydrophobicContact CE1-CD1 3.68Å; F421-L444 HydrophobicContact CE1-CG 4.31Å; T442-L444 PolarHBondContact O-N 3.48Å; L444-P459 WeakPolarHBondContact O-CA 3.15Å; L444-V460 HydrophobicContact CB-CB 4.41Å; L444-V460 PolarHBondContact O-N 2.87Å; L444-F507 HydrophobicContact CB-CD2 4.26Å; L444-F507 HydrophobicContact CB-CE2 4.26Å; L444-F507 HydrophobicContact CD2-CD2 3.85Å; L444-F507 HydrophobicContact CD2-CE2 4.23Å; L444-L510 HydrophobicContact CD2-CB 3.65Å; L444-L510 HydrophobicContact CD2-CD1 4.06Å
445	T	91.1	Very high	71.6	Confident	61 Å²	61	90.2 Å²	90.2	37%	0.374	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	143.7	166.6	58.5	0	0	0	0	109	I458	T445-I458 CarbonylContact C-O 3.48Å; T445-I458 WeakPolarHBondContact CA-O 3.37Å
446	V	92.5	Very high	74.3	Confident	6 Å²	6	84.7 Å²	84.7	4%	0.036	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	131	173.4	66	0	0	0	0	108.8	I448 H457 I458 V460 L510 I521	V446-I448 HydrophobicContact CG1-CD1 3.9Å; V446-I448 HydrophobicContact CG1-CG1 3.95Å; V446-I448 HydrophobicContact CG2-CG1 4.17Å; V446-H457 CarbonylContact O-C 3.58Å; V446-H457 WeakPolarHBondContact O-CA 3.45Å; V446-I458 HydrophobicContact CG1-CB 4.15Å; V446-I458 PolarHBondContact N-O 2.89Å; V446-I458 PolarHBondContact O-N 3.19Å; V446-V460 HydrophobicContact CB-CG2 3.95Å; V446-V460 HydrophobicContact CG1-CG2 3.48Å; V446-V460 VanDerWaalsContact CG1-CG2 3.48Å; V446-L510 HydrophobicContact CB-CD1 3.76Å; V446-L510 HydrophobicContact CG2-CD1 3.84Å; V446-L510 HydrophobicContact CG2-CD2 3.95Å; V446-I521 HydrophobicContact CG2-CB 4.38Å; V446-I521 HydrophobicContact CG2-CG1 3.88Å
447	Q	94.7	Very high	77.2	Confident	52 Å²	52	83.4 Å²	83.4	24%	0.243	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	122.6	168.2	-172.8	174.5	7	0	0	107.9	F449 S455	Q447-F449 HydrophobicContact CG-CE1 4.46Å; Q447-F449 HydrophobicContact CG-CE2 4.13Å; Q447-F449 HydrophobicContact CG-CZ 3.96Å; Q447-S455 PolarHBondContact NE2-OG 3.13Å
448	I	95.6	Very high	79.7	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	125.4	178.6	-57.8	178	0	0	0	107.9	V446 L450 S455 I456 I458 L473 L487 I521 L523	V446-I448 HydrophobicContact CG1-CD1 3.9Å; V446-I448 HydrophobicContact CG1-CG1 3.95Å; V446-I448 HydrophobicContact CG2-CG1 4.17Å; I448-L450 WeakPolarHBondContact O-CD1 3.43Å; I448-S455 CarbonylContact O-C 3.48Å; I448-S455 WeakPolarHBondContact O-CA 3.39Å; I448-S455 WeakPolarHBondContact O-CB 3.36Å; I448-I456 PolarHBondContact N-O 3.36Å; I448-I456 PolarHBondContact O-N 3.42Å; I448-I458 HydrophobicContact CD1-CD1 4.44Å; I448-L473 HydrophobicContact CD1-CD1 3.83Å; I448-L473 HydrophobicContact CD1-CD2 4.45Å; I448-L473 HydrophobicContact CD1-CG 4.45Å; I448-L473 HydrophobicContact CG2-CD1 3.97Å; I448-L487 HydrophobicContact CD1-CD1 4.27Å; I448-L487 HydrophobicContact CD1-CD2 4.22Å; I448-L487 HydrophobicContact CG2-CD2 4.04Å; I448-I521 WeakPolarHBondContact CA-O 3.16Å; I448-I521 HydrophobicContact CD1-CG2 4.46Å; I448-I521 HydrophobicContact CG1-CB 4.29Å; I448-I521 HydrophobicContact CG1-CG2 4.04Å; I448-I521 HydrophobicContact CG2-CG2 4.25Å; I448-L523 HydrophobicContact CG2-CB 4.14Å
449	F	95.7	Very high	82.4	Confident	50 Å²	50	68.9 Å²	68.9	22%	0.219	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	138	-178.9	-64.3	-86.9	0	0	0	110.9	Q447 L520 I521 F522 L523	Q447-F449 HydrophobicContact CG-CE1 4.46Å; Q447-F449 HydrophobicContact CG-CE2 4.13Å; Q447-F449 HydrophobicContact CG-CZ 3.96Å; F449-L520 HydrophobicContact CD2-CB 4.43Å; F449-L520 HydrophobicContact CE2-CB 4.4Å; F449-L520 HydrophobicContact CE2-CD2 3.74Å; F449-L520 HydrophobicContact CZ-CD2 4.25Å; F449-I521 WeakPolarHBondContact CD2-O 3.33Å; F449-I521 PolarHBondContact N-O 2.97Å; F449-F522 HydrophobicContact CB-CD1 3.59Å; F449-F522 HydrophobicContact CB-CE1 3.66Å; F449-F522 HydrophobicContact CB-CG 4.18Å; F449-F522 HydrophobicContact CB-CZ 4.3Å; F449-F522 HydrophobicContact CG-CE1 4.3Å; F449-F522 CarbonylContact O-C 3.53Å; F449-F522 WeakPolarHBondContact O-CA 3.43Å; F449-L523 PolarHBondContact O-N 3Å
450	L	94.2	Very high	85.1	Confident	7 Å²	7	65.1 Å²	65.1	4%	0.037	34%	0.338	C	S	.	.			trans	-105.6	158.9	-175.7	-75.5	82.4	0	0	0	111.6	I448 D452 R453 T454 I456 L523	I448-L450 WeakPolarHBondContact O-CD1 3.43Å; L450-D452 WeakPolarHBondContact CB-OD1 3.16Å; L450-D452 PolarHBondContact O-N 3.08Å; L450-R453 PolarHBondContact O-N 3.19Å; L450-T454 PolarHBondContact N-O 2.61Å; L450-I456 HydrophobicContact CD1-CB 4.21Å; L450-I456 HydrophobicContact CD1-CD1 3.93Å; L450-I456 HydrophobicContact CD1-CG1 3.83Å; L450-I456 HydrophobicContact CD2-CD1 4.01Å; L450-L523 HydrophobicContact CG-CD2 4.33Å
451	P	90.4	Very high	87.6	Confident	100 Å²	100	60.4 Å²	60.4	65%	0.649	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.3	178.7	-24.1	35.5	0	0	0	114	R453 L523	P451-R453 PolarHBondContact O-N 3.47Å; P451-L523 VanDerWaalsContact CD-O 3.32Å; P451-L523 WeakPolarHBondContact CD-O 3.32Å; P451-L523 WeakPolarHBondContact CG-O 3.49Å
452	D	89.8	Confident	89.4	Confident	80 Å²	80	58 Å²	58	43%	0.428	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	8.9	174.6	48.4	50.3	0	0	0	113.6	L450 T454 K479	L450-D452 WeakPolarHBondContact CB-OD1 3.16Å; L450-D452 PolarHBondContact O-N 3.08Å; D452-T454 PolarHBondContact O-N 3Å; D452-T454 WeakPolarHBondContact OD1-CB 3.33Å; D452-T454 WeakPolarHBondContact OD1-CG2 3.32Å; D452-T454 PolarHBondContact OD1-N 2.98Å; D452-T454 PolarHBondContact OD1-OG1 2.99Å; D452-K479 IonicContact OD2-NZ 2.76Å; D452-K479 PolarHBondContact OD2-NZ 2.9Å
453	R	90	Very high	91.1	Very high	207 Å²	207	59.3 Å²	59.3	78%	0.781	32%	0.318	S	S	*	.	S	Bend	trans	65.9	7.6	-178.1	-50.4	179.7	-179	-127.6	-1.1	114.8	L450 P451	L450-R453 PolarHBondContact O-N 3.19Å; P451-R453 PolarHBondContact O-N 3.47Å
454	T	92.9	Very high	92.2	Very high	73 Å²	73	55.5 Å²	55.5	45%	0.448	30%	0.299	S	S	.	.			trans	-79.7	175	167.8	73.8	0	0	0	0	111.1	L450 D452	L450-T454 PolarHBondContact N-O 2.61Å; D452-T454 PolarHBondContact O-N 3Å; D452-T454 WeakPolarHBondContact OD1-CB 3.33Å; D452-T454 WeakPolarHBondContact OD1-CG2 3.32Å; D452-T454 PolarHBondContact OD1-N 2.98Å; D452-T454 PolarHBondContact OD1-OG1 2.99Å
455	S	93.9	Very high	92.6	Very high	43 Å²	43	55.4 Å²	55.4	30%	0.301	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	141.3	171.3	67.6	0	0	0	0	111.8	Q447 I448	Q447-S455 PolarHBondContact NE2-OG 3.13Å; I448-S455 CarbonylContact O-C 3.48Å; I448-S455 WeakPolarHBondContact O-CA 3.39Å; I448-S455 WeakPolarHBondContact O-CB 3.36Å
456	I	92.6	Very high	92.8	Very high	37 Å²	37	52.5 Å²	52.5	19%	0.19	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	135.7	-179.4	-66.2	171.4	0	0	0	109.6	I448 L450 I458 L473 N477	I448-I456 PolarHBondContact N-O 3.36Å; I448-I456 PolarHBondContact O-N 3.42Å; L450-I456 HydrophobicContact CD1-CB 4.21Å; L450-I456 HydrophobicContact CD1-CD1 3.93Å; L450-I456 HydrophobicContact CD1-CG1 3.83Å; L450-I456 HydrophobicContact CD2-CD1 4.01Å; I456-I458 HydrophobicContact CG2-CG1 4.25Å; I456-L473 HydrophobicContact CB-CD2 4.14Å; I456-L473 HydrophobicContact CD1-CD2 4.3Å; I456-L473 HydrophobicContact CG2-CD2 4.11Å; I456-N477 WeakPolarHBondContact CD1-ND2 3.49Å; I456-N477 VanDerWaalsContact CD1-OD1 3.23Å; I456-N477 WeakPolarHBondContact CD1-OD1 3.31Å
457	H	93.1	Very high	93.1	Very high	107 Å²	107	52.8 Å²	52.8	50%	0.495	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	120.4	174	-67.9	-100.6	0	0	0	110.1	V446	V446-H457 CarbonylContact O-C 3.58Å; V446-H457 WeakPolarHBondContact O-CA 3.45Å
458	I	91.8	Very high	93.1	Very high	4 Å²	4	54.8 Å²	54.8	2%	0.021	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	130.3	174.5	-74.6	-173.2	0	0	0	110	T445 V446 I448 I456 V460 K472 L473	T445-I458 CarbonylContact C-O 3.48Å; T445-I458 WeakPolarHBondContact CA-O 3.37Å; V446-I458 HydrophobicContact CG1-CB 4.15Å; V446-I458 PolarHBondContact N-O 2.89Å; V446-I458 PolarHBondContact O-N 3.19Å; I448-I458 HydrophobicContact CD1-CD1 4.44Å; I456-I458 HydrophobicContact CG2-CG1 4.25Å; I458-V460 PolarHBondContact O-N 2.77Å; I458-K472 HydrophobicContact CD1-CB 4.28Å; I458-K472 HydrophobicContact CD1-CD 4.22Å; I458-K472 HydrophobicContact CD1-CG 4.09Å; I458-K472 HydrophobicContact CG2-CD 4.32Å; I458-L473 HydrophobicContact CD1-CD2 3.61Å; I458-L473 HydrophobicContact CD1-CG 3.59Å; I458-L473 HydrophobicContact CG1-CD2 4.37Å
459	P	91.6	Very high	93.1	Very high	64 Å²	64	54.9 Å²	54.9	42%	0.416	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	126.6	166.7	28.9	-33	0	0	0	109.8	L444	L444-P459 WeakPolarHBondContact O-CA 3.15Å
460	V	92.2	Very high	93.1	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	128.3	-179.6	177.8	0	0	0	0	108.4	L444 V446 I458 L506 F507 L510	L444-V460 HydrophobicContact CB-CB 4.41Å; L444-V460 PolarHBondContact O-N 2.87Å; V446-V460 HydrophobicContact CB-CG2 3.95Å; V446-V460 HydrophobicContact CG1-CG2 3.48Å; V446-V460 VanDerWaalsContact CG1-CG2 3.48Å; I458-V460 PolarHBondContact O-N 2.77Å; V460-L506 HydrophobicContact CG1-CB 3.91Å; V460-L506 HydrophobicContact CG2-CD1 4.39Å; V460-F507 HydrophobicContact CG1-CB 4.04Å; V460-L510 HydrophobicContact CG2-CD1 4.2Å
461	H	90.7	Very high	93.1	Very high	65 Å²	65	55.4 Å²	55.4	30%	0.301	30%	0.295	S	S	.	.			trans	-103.9	163.9	168.3	-63.9	-23.7	0	0	0	109.7	K441 T463 T464	K441-H461 PolarHBondContact NZ-NE2 2.9Å; H461-T463 PolarHBondContact O-N 3.29Å; H461-T463 VanDerWaalsContact O-N 3.1Å; H461-T464 PolarHBondContact N-OG1 3.48Å; H461-T464 WeakPolarHBondContact O-CB 3.23Å; H461-T464 PolarHBondContact O-N 2.99Å; H461-T464 PolarHBondContact O-OG1 3.04Å
462	S	88.9	Confident	93.2	Very high	77 Å²	77	55.2 Å²	55.2	54%	0.538	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-24.1	177.8	48.3	0	0	0	0	113.6
463	T	91.9	Very high	93.3	Very high	93 Å²	93	51.4 Å²	51.4	57%	0.571	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-1.5	177.2	52.6	0	0	0	0	114.5	H461 T465 Q468 Y505	H461-T463 PolarHBondContact O-N 3.29Å; H461-T463 VanDerWaalsContact O-N 3.1Å; T463-T465 PolarHBondContact O-N 2.95Å; T463-Q468 PolarHBondContact O-OE1 3.01Å; T463-Y505 WeakPolarHBondContact O-CE1 3.24Å
464	T	94.2	Very high	93.4	Very high	17 Å²	17	41.7 Å²	41.7	10%	0.104	23%	0.227	C	C	.	.			trans	-76.9	112.3	-178.3	-56.6	0	0	0	0	110.9	H461 A469 Y505 L506	H461-T464 PolarHBondContact N-OG1 3.48Å; H461-T464 WeakPolarHBondContact O-CB 3.23Å; H461-T464 PolarHBondContact O-N 2.99Å; H461-T464 PolarHBondContact O-OG1 3.04Å; T464-A469 HydrophobicContact CG2-CB 4.31Å; T464-Y505 WeakPolarHBondContact O-CA 3.34Å; T464-L506 PolarHBondContact O-N 3.43Å; T464-L506 VanDerWaalsContact O-N 3.08Å
465	T	96.3	Very high	93.2	Very high	20 Å²	20	41.6 Å²	41.6	12%	0.123	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-82.1	161	174.1	69.3	0	0	0	0	112.3	T463 L467 Q468 A469 D502 E504 Y505	T463-T465 PolarHBondContact O-N 2.95Å; T465-L467 VanDerWaalsContact C-N 3.27Å; T465-L467 PolarHBondContact O-N 2.78Å; T465-Q468 PolarHBondContact O-N 2.91Å; T465-Q468 WeakPolarHBondContact OG1-CG 3.48Å; T465-Q468 PolarHBondContact OG1-N 3.23Å; T465-A469 PolarHBondContact O-N 3.26Å; T465-D502 WeakPolarHBondContact CB-O 3.43Å; T465-E504 CarbonylContact C-O 3.59Å; T465-E504 VanDerWaalsContact CA-O 3.3Å; T465-E504 WeakPolarHBondContact CA-O 3.32Å; T465-Y505 HydrophobicContact CG2-CD1 3.86Å; T465-Y505 HydrophobicContact CG2-CE1 3.63Å
466	T	96.8	Very high	92.9	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-48.8	-48.2	169.8	-55.8	0	0	0	0	111.6	Q468 A469 L470 L487 L500 E501 E504	T466-Q468 PolarHBondContact O-N 2.88Å; T466-A469 PolarHBondContact O-N 2.91Å; T466-L470 WeakPolarHBondContact O-CB 3.15Å; T466-L470 PolarHBondContact O-N 3.48Å; T466-L487 HydrophobicContact CG2-CB 4.13Å; T466-L487 HydrophobicContact CG2-CD1 4.1Å; T466-L487 HydrophobicContact CG2-CG 4.27Å; T466-L500 HydrophobicContact CG2-CB 3.72Å; T466-E501 WeakPolarHBondContact CB-O 3.42Å; T466-E501 PolarHBondContact OG1-O 3.12Å; T466-E504 PolarHBondContact N-O 3.21Å; T466-E504 PolarHBondContact OG1-O 3.3Å; T466-E504 VanDerWaalsContact OG1-O 3.11Å
467	L	96.8	Very high	92.7	Very high	12 Å²	12	44.1 Å²	44.1	6%	0.063	24%	0.244	C	C	.	.	H	α-helix	trans	-62.6	-43.2	-179.8	-177.8	58.5	0	0	0	112.6	T465 A469 L470 Q471 D502 V683 T687	T465-L467 VanDerWaalsContact C-N 3.27Å; T465-L467 PolarHBondContact O-N 2.78Å; L467-A469 PolarHBondContact O-N 2.82Å; L467-L470 PolarHBondContact O-N 3.27Å; L467-Q471 HydrophobicContact CD1-CG 4.42Å; L467-Q471 WeakPolarHBondContact O-CG 3.22Å; L467-Q471 PolarHBondContact O-N 3.26Å; L467-D502 HydrophobicContact CB-CB 3.91Å; L467-D502 WeakPolarHBondContact CB-O 3.41Å; L467-D502 PolarHBondContact N-O 3.45Å; L467-V683 HydrophobicContact CD2-CG1 3.75Å; L467-T687 HydrophobicContact CD1-CG2 4.28Å
468	Q	95.4	Very high	92.3	Very high	94 Å²	94	46.9 Å²	46.9	44%	0.439	26%	0.257	S	S	.	.	H	α-helix	trans	-64.2	-41.1	178.1	-71.7	172.4	-1.6	0	0	112.1	T463 T465 T466 L470 K472	T463-Q468 PolarHBondContact O-OE1 3.01Å; T465-Q468 PolarHBondContact O-N 2.91Å; T465-Q468 WeakPolarHBondContact OG1-CG 3.48Å; T465-Q468 PolarHBondContact OG1-N 3.23Å; T466-Q468 PolarHBondContact O-N 2.88Å; Q468-L470 VanDerWaalsContact C-N 3.3Å; Q468-K472 WeakPolarHBondContact O-CB 3.3Å; Q468-K472 PolarHBondContact O-N 2.99Å
469	A	95.3	Very high	92.2	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.008	27%	0.272	C	S	.	.	H	α-helix	trans	-64	-38.2	174.1	0	0	0	0	0	111.5	T464 T465 T466 L467 K472 L473 L487 L506	T464-A469 HydrophobicContact CG2-CB 4.31Å; T465-A469 PolarHBondContact O-N 3.26Å; T466-A469 PolarHBondContact O-N 2.91Å; L467-A469 PolarHBondContact O-N 2.82Å; A469-K472 PolarHBondContact O-N 3.12Å; A469-L473 WeakPolarHBondContact O-CG 3.38Å; A469-L473 PolarHBondContact O-N 2.7Å; A469-L487 HydrophobicContact CB-CD1 4.14Å; A469-L506 HydrophobicContact CB-CD1 3.49Å; A469-L506 VanDerWaalsContact CB-CD1 3.49Å
470	L	95.8	Very high	92.2	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-69.8	-44.1	178.4	-172.7	64.3	0	0	0	112.8	T466 L467 Q468 K472 L473 C474 L481 H485 L487 L523 R684	T466-L470 WeakPolarHBondContact O-CB 3.15Å; T466-L470 PolarHBondContact O-N 3.48Å; L467-L470 PolarHBondContact O-N 3.27Å; Q468-L470 VanDerWaalsContact C-N 3.3Å; L470-K472 VanDerWaalsContact C-N 3.26Å; L470-K472 PolarHBondContact O-N 3.48Å; L470-L473 HydrophobicContact CD1-CD1 4.47Å; L470-L473 PolarHBondContact O-N 2.94Å; L470-C474 PolarHBondContact O-N 3.33Å; L470-C474 PolarHBondContact O-SG 3.23Å; L470-L481 HydrophobicContact CD2-CD1 3.73Å; L470-L481 HydrophobicContact CG-CD1 3.72Å; L470-H485 HydrophobicContact CD1-CB 4.24Å; L470-H485 HydrophobicContact CD2-CB 4.07Å; L470-H485 WeakPolarHBondContact CD2-O 3.14Å; L470-L487 HydrophobicContact CD1-CD2 4.26Å; L470-L487 HydrophobicContact CD1-CG 4.45Å; L470-L523 HydrophobicContact CD1-CD1 3.26Å; L470-R684 VanDerWaalsContact CD2-CZ 3.48Å
471	Q	94.2	Very high	92.3	Very high	68 Å²	68	50.4 Å²	50.4	32%	0.318	27%	0.268	S	S	.	.	H	α-helix	trans	-54.9	-45.1	170.6	-72.5	173.1	-71.5	0	0	110.7	L467 C474 S475 L481 T687	L467-Q471 HydrophobicContact CD1-CG 4.42Å; L467-Q471 WeakPolarHBondContact O-CG 3.22Å; L467-Q471 PolarHBondContact O-N 3.26Å; Q471-C474 PolarHBondContact O-N 3.25Å; Q471-S475 PolarHBondContact O-N 3.46Å; Q471-S475 PolarHBondContact O-OG 3.14Å; Q471-L481 HydrophobicContact CG-CD2 4.19Å; Q471-T687 HydrophobicContact CG-CG2 3.82Å; Q471-T687 VanDerWaalsContact NE2-CG2 3.27Å
472	K	92.1	Very high	92.5	Very high	96 Å²	96	49.2 Å²	49.2	42%	0.417	27%	0.266	S	S	.	.	H	α-helix	trans	-62.5	-45.7	177.5	-176.4	169.5	179	170.6	0	112.1	I458 Q468 A469 L470 C474 T476	I458-K472 HydrophobicContact CD1-CB 4.28Å; I458-K472 HydrophobicContact CD1-CD 4.22Å; I458-K472 HydrophobicContact CD1-CG 4.09Å; I458-K472 HydrophobicContact CG2-CD 4.32Å; Q468-K472 WeakPolarHBondContact O-CB 3.3Å; Q468-K472 PolarHBondContact O-N 2.99Å; A469-K472 PolarHBondContact O-N 3.12Å; L470-K472 VanDerWaalsContact C-N 3.26Å; L470-K472 PolarHBondContact O-N 3.48Å; K472-C474 PolarHBondContact O-N 3.25Å; K472-T476 VanDerWaalsContact O-CB 3.3Å; K472-T476 WeakPolarHBondContact O-CB 3.32Å; K472-T476 PolarHBondContact O-N 3.02Å; K472-T476 PolarHBondContact O-OG1 2.84Å
473	L	93.5	Very high	92.8	Very high	1 Å²	1	47 Å²	47	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-57.7	-48.2	173.7	-73.5	168.8	0	0	0	111.9	I448 I456 I458 A469 L470 T476 N477 L487 L523	I448-L473 HydrophobicContact CD1-CD1 3.83Å; I448-L473 HydrophobicContact CD1-CD2 4.45Å; I448-L473 HydrophobicContact CD1-CG 4.45Å; I448-L473 HydrophobicContact CG2-CD1 3.97Å; I456-L473 HydrophobicContact CB-CD2 4.14Å; I456-L473 HydrophobicContact CD1-CD2 4.3Å; I456-L473 HydrophobicContact CG2-CD2 4.11Å; I458-L473 HydrophobicContact CD1-CD2 3.61Å; I458-L473 HydrophobicContact CD1-CG 3.59Å; I458-L473 HydrophobicContact CG1-CD2 4.37Å; A469-L473 WeakPolarHBondContact O-CG 3.38Å; A469-L473 PolarHBondContact O-N 2.7Å; L470-L473 HydrophobicContact CD1-CD1 4.47Å; L470-L473 PolarHBondContact O-N 2.94Å; L473-T476 PolarHBondContact O-N 2.84Å; L473-N477 WeakPolarHBondContact O-CB 3.3Å; L473-N477 PolarHBondContact O-N 2.9Å; L473-N477 PolarHBondContact O-ND2 3.22Å; L473-L487 HydrophobicContact CD1-CD2 3.68Å; L473-L523 HydrophobicContact CB-CD2 4.48Å; L473-L523 HydrophobicContact CD1-CD1 4.15Å; L473-L523 HydrophobicContact CD1-CD2 4.28Å
474	C	92.3	Very high	92.9	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.014	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-50.6	-177.5	-67.7	0	0	0	0	110.9	L470 Q471 K472 N477 Q478 K479 L481	L470-C474 PolarHBondContact O-N 3.33Å; L470-C474 PolarHBondContact O-SG 3.23Å; Q471-C474 PolarHBondContact O-N 3.25Å; K472-C474 PolarHBondContact O-N 3.25Å; C474-N477 PolarHBondContact O-N 2.95Å; C474-Q478 PolarHBondContact O-N 3.25Å; C474-Q478 VanDerWaalsContact O-N 3.13Å; C474-K479 CarbonylContact C-O 3.59Å; C474-K479 VanDerWaalsContact CB-O 3.29Å; C474-K479 WeakPolarHBondContact CB-O 3.47Å; C474-K479 PolarHBondContact O-N 2.99Å; C474-K479 VanDerWaalsContact O-O 3.12Å; C474-L481 HydrophobicContact CB-CB 4.24Å; C474-L481 VanDerWaalsContact SG-CD1 3.57Å
475	S	88.6	Confident	93	Very high	72 Å²	72	46.9 Å²	46.9	50%	0.503	24%	0.238	S	C	.	.	H	α-helix	trans	-65.5	-38.5	177.9	-60.9	0	0	0	0	113.6	Q471 N477 Q478 H691	Q471-S475 PolarHBondContact O-N 3.46Å; Q471-S475 PolarHBondContact O-OG 3.14Å; S475-N477 VanDerWaalsContact C-N 3.32Å; S475-N477 PolarHBondContact O-N 3.49Å; S475-Q478 PolarHBondContact O-N 3.39Å; S475-H691 PolarHBondContact OG-NE2 3.44Å
476	T	87.4	Confident	93	Very high	89 Å²	89	46 Å²	46	55%	0.546	23%	0.232	S	C	.	.	H	α-helix	trans	-66.4	-33.4	175.6	-65.8	0	0	0	0	112.4	K472 L473	K472-T476 VanDerWaalsContact O-CB 3.3Å; K472-T476 WeakPolarHBondContact O-CB 3.32Å; K472-T476 PolarHBondContact O-N 3.02Å; K472-T476 PolarHBondContact O-OG1 2.84Å; L473-T476 PolarHBondContact O-N 2.84Å
477	N	87	Confident	93	Very high	44 Å²	44	46 Å²	46	24%	0.235	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	1.9	179.8	-72.3	-67.2	0	0	0	114.5	I456 L473 C474 S475 K479	I456-N477 WeakPolarHBondContact CD1-ND2 3.49Å; I456-N477 VanDerWaalsContact CD1-OD1 3.23Å; I456-N477 WeakPolarHBondContact CD1-OD1 3.31Å; L473-N477 WeakPolarHBondContact O-CB 3.3Å; L473-N477 PolarHBondContact O-N 2.9Å; L473-N477 PolarHBondContact O-ND2 3.22Å; C474-N477 PolarHBondContact O-N 2.95Å; S475-N477 VanDerWaalsContact C-N 3.32Å; S475-N477 PolarHBondContact O-N 3.49Å; N477-K479 HydrophobicContact CB-CB 4.34Å; N477-K479 HydrophobicContact CB-CD 3.91Å; N477-K479 HydrophobicContact CB-CG 4.01Å; N477-K479 PolarHBondContact O-N 3.35Å
478	Q	86.4	Confident	93	Very high	165 Å²	165	45.4 Å²	45.4	77%	0.771	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	33.2	-171	-56.7	175.4	-7.6	0	0	112.6	C474 S475 F695	C474-Q478 PolarHBondContact O-N 3.25Å; C474-Q478 VanDerWaalsContact O-N 3.13Å; S475-Q478 PolarHBondContact O-N 3.39Å; Q478-F695 WeakPolarHBondContact O-CE2 3.32Å; Q478-F695 WeakPolarHBondContact O-CZ 3.31Å
479	K	88.6	Confident	93	Very high	77 Å²	77	41 Å²	41	34%	0.335	21%	0.209	S	C	.	.			trans	-104.6	134.7	177.7	-70.5	173.5	-175.4	171.5	0	109.3	D452 C474 N477 H691	D452-K479 IonicContact OD2-NZ 2.76Å; D452-K479 PolarHBondContact OD2-NZ 2.9Å; C474-K479 CarbonylContact C-O 3.59Å; C474-K479 VanDerWaalsContact CB-O 3.29Å; C474-K479 WeakPolarHBondContact CB-O 3.47Å; C474-K479 PolarHBondContact O-N 2.99Å; C474-K479 VanDerWaalsContact O-O 3.12Å; N477-K479 HydrophobicContact CB-CB 4.34Å; N477-K479 HydrophobicContact CB-CD 3.91Å; N477-K479 HydrophobicContact CB-CG 4.01Å; N477-K479 PolarHBondContact O-N 3.35Å; K479-H691 PolarHBondContact O-CE1 3.27Å
480	L	91.9	Very high	92.9	Very high	63 Å²	63	42.5 Å²	42.5	33%	0.33	21%	0.214	S	C	.	.			trans	-68.8	130.2	175.6	178.9	62.9	0	0	0	110.6	R692 F695	L480-R692 HydrophobicContact CD1-CB 3.87Å; L480-R692 HydrophobicContact CD1-CG 4.16Å; L480-R692 HydrophobicContact CD2-CG 4.32Å; L480-F695 HydrophobicContact CD1-CB 4.27Å; L480-F695 HydrophobicContact CD1-CG 4.45Å
481	L	94.7	Very high	92.7	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	22%	0.215	C	C	.	.			trans	-68	134	174.6	-178.4	67.6	0	0	0	110.5	L470 Q471 C474 H485 T687 V688 H691	L470-L481 HydrophobicContact CD2-CD1 3.73Å; L470-L481 HydrophobicContact CG-CD1 3.72Å; Q471-L481 HydrophobicContact CG-CD2 4.19Å; C474-L481 HydrophobicContact CB-CB 4.24Å; C474-L481 VanDerWaalsContact SG-CD1 3.57Å; L481-H485 HydrophobicContact CD1-CB 4.32Å; L481-T687 HydrophobicContact CD2-CG2 3.81Å; L481-V688 HydrophobicContact CD2-CG2 4.1Å; L481-V688 HydrophobicContact CG-CG2 3.93Å; L481-H691 HydrophobicContact CB-CB 4.15Å; L481-H691 WeakPolarHBondContact CB-ND1 3.34Å; L481-H691 PolarHBondContact N-ND1 2.98Å; L481-H691 VanDerWaalsContact N-ND1 3.13Å
482	T	94.3	Very high	92.5	Very high	40 Å²	40	41.6 Å²	41.6	25%	0.245	21%	0.214	C	C	.	.			trans	-123.9	166.9	177	77.6	0	0	0	0	111.8	K484 H485 R684	T482-K484 PolarHBondContact O-N 2.98Å; T482-K484 PolarHBondContact OG1-N 2.99Å; T482-H485 PolarHBondContact N-ND1 3.19Å; T482-H485 PolarHBondContact O-N 2.84Å; T482-H485 PolarHBondContact OG1-N 3.33Å; T482-H485 PolarHBondContact OG1-ND1 2.93Å; T482-R684 PolarHBondContact O-NH1 3.46Å
483	M	95.1	Very high	92.3	Very high	30 Å²	30	41.6 Å²	41.6	15%	0.148	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-28.5	173.1	-61.3	-54.8	-67.4	0	0	112.7	Y530 E534 Y681 R684 M685 V688	M483-Y530 HydrophobicContact CE-CD2 4.17Å; M483-Y530 WeakPolarHBondContact O-CD2 3.32Å; M483-E534 WeakPolarHBondContact CB-OE1 3.35Å; M483-Y681 HydrophobicContact CE-CD2 3.64Å; M483-Y681 HydrophobicContact CE-CE2 3.52Å; M483-R684 HydrophobicContact CE-CB 4.15Å; M483-R684 HydrophobicContact CE-CG 3.75Å; M483-R684 HydrophobicContact SD-CG 3.7Å; M483-M685 HydrophobicContact CE-CB 4.17Å; M483-M685 HydrophobicContact SD-CB 4.27Å; M483-V688 HydrophobicContact SD-CB 4.33Å; M483-V688 HydrophobicContact SD-CG2 3.93Å
484	K	95	Very high	92	Very high	83 Å²	83	45 Å²	45	36%	0.361	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-23.5	-176.5	-64.4	179.9	-178.4	175.8	0	113.4	T482 A486 E525 R526	T482-K484 PolarHBondContact O-N 2.98Å; T482-K484 PolarHBondContact OG1-N 2.99Å; K484-A486 PolarHBondContact O-N 3.38Å; K484-E525 HydrophobicContact CB-CB 4.09Å; K484-E525 HydrophobicContact CB-CG 4.29Å; K484-E525 CarbonylContact O-C 3.5Å; K484-E525 WeakPolarHBondContact O-CA 3.44Å; K484-R526 PolarHBondContact O-N 3.1Å
485	H	95.8	Very high	91.9	Very high	26 Å²	26	47.5 Å²	47.5	12%	0.12	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	127.2	-179.9	-82.4	88.9	0	0	0	111.6	L470 L481 T482 E524 R684	L470-H485 HydrophobicContact CD1-CB 4.24Å; L470-H485 HydrophobicContact CD2-CB 4.07Å; L470-H485 WeakPolarHBondContact CD2-O 3.14Å; L481-H485 HydrophobicContact CD1-CB 4.32Å; T482-H485 PolarHBondContact N-ND1 3.19Å; T482-H485 PolarHBondContact O-N 2.84Å; T482-H485 PolarHBondContact OG1-N 3.33Å; T482-H485 PolarHBondContact OG1-ND1 2.93Å; H485-E524 CarbonylContact C-O 3.37Å; H485-R684 VanDerWaalsContact O-CZ 3.31Å; H485-R684 PolarHBondContact O-NH1 2.96Å; H485-R684 PolarHBondContact O-NH2 2.94Å
486	A	96.9	Very high	92.1	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.008	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	153.1	177.8	0	0	0	0	0	111.2	K484 V488 E524 R526 L529	K484-A486 PolarHBondContact O-N 3.38Å; A486-V488 HydrophobicContact CB-CG2 4.41Å; A486-E524 PolarHBondContact N-O 2.81Å; A486-E524 PolarHBondContact O-N 3.45Å; A486-E524 VanDerWaalsContact O-N 3.08Å; A486-R526 HydrophobicContact CB-CB 3.79Å; A486-R526 HydrophobicContact CB-CG 3.65Å; A486-L529 HydrophobicContact CB-CD2 4.04Å
487	L	97.1	Very high	92.5	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	124.7	159.1	-63.7	-175.5	0	0	0	108.2	I448 T466 A469 L470 L473 L500 L506 I521 F522 L523	I448-L487 HydrophobicContact CD1-CD1 4.27Å; I448-L487 HydrophobicContact CD1-CD2 4.22Å; I448-L487 HydrophobicContact CG2-CD2 4.04Å; T466-L487 HydrophobicContact CG2-CB 4.13Å; T466-L487 HydrophobicContact CG2-CD1 4.1Å; T466-L487 HydrophobicContact CG2-CG 4.27Å; A469-L487 HydrophobicContact CB-CD1 4.14Å; L470-L487 HydrophobicContact CD1-CD2 4.26Å; L470-L487 HydrophobicContact CD1-CG 4.45Å; L473-L487 HydrophobicContact CD1-CD2 3.68Å; L487-L500 HydrophobicContact CB-CB 4.4Å; L487-L500 HydrophobicContact CB-CD1 4Å; L487-L500 HydrophobicContact CB-CG 4.37Å; L487-L500 PolarHBondContact O-N 3.06Å; L487-L506 HydrophobicContact CD1-CD1 4.37Å; L487-L506 HydrophobicContact CD1-CD2 4.45Å; L487-I521 HydrophobicContact CB-CG2 4.16Å; L487-I521 HydrophobicContact CD2-CG2 4.34Å; L487-F522 CarbonylContact C-O 3.6Å; L487-F522 WeakPolarHBondContact CA-O 3.43Å; L487-L523 HydrophobicContact CD2-CD1 4.12Å
488	V	96.3	Very high	92.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	116.9	-176.8	-179	0	0	0	0	109	A486 R490 E497 R498 I521 F522 E524 R526	A486-V488 HydrophobicContact CB-CG2 4.41Å; V488-R490 HydrophobicContact CG1-CG 4.26Å; V488-E497 HydrophobicContact CG1-CB 4.11Å; V488-R498 CarbonylContact C-O 3.57Å; V488-R498 WeakPolarHBondContact CA-O 3.4Å; V488-I521 WeakPolarHBondContact O-CA 3.48Å; V488-F522 HydrophobicContact CB-CB 4.42Å; V488-F522 PolarHBondContact N-O 3.16Å; V488-F522 PolarHBondContact O-N 3.33Å; V488-E524 HydrophobicContact CG2-CB 4.16Å; V488-E524 HydrophobicContact CG2-CG 4.44Å; V488-R526 HydrophobicContact CG2-CG 3.74Å
489	E	95.2	Very high	93.3	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	125.1	167.1	168.7	171.4	-149.3	0	0	108.9	I491 E497 R498 L500 W513 I521 H640	E489-I491 HydrophobicContact CG-CG1 4.17Å; E489-E497 CarbonylContact O-C 3.57Å; E489-E497 WeakPolarHBondContact O-CA 3.41Å; E489-E497 WeakPolarHBondContact O-CB 3.39Å; E489-R498 HydrophobicContact CB-CG 4.13Å; E489-R498 PolarHBondContact N-O 3.41Å; E489-R498 PolarHBondContact O-N 3.2Å; E489-R498 IonicContact OE2-CZ 3.7Å; E489-R498 VanDerWaalsContact OE2-CZ 3.24Å; E489-R498 IonicContact OE2-NE 3.01Å; E489-R498 PolarHBondContact OE2-NE 3.15Å; E489-R498 IonicContact OE2-NH2 2.88Å; E489-R498 PolarHBondContact OE2-NH2 2.65Å; E489-L500 HydrophobicContact CB-CD2 3.94Å; E489-W513 HydrophobicContact CG-CZ2 4.15Å; E489-W513 WeakPolarHBondContact OE1-CZ2 3.47Å; E489-W513 PolarHBondContact OE1-NE1 3.05Å; E489-I521 HydrophobicContact CB-CD1 4.08Å; E489-H640 IonicContact OE1-CD2 3.18Å; E489-H640 IonicContact OE1-NE2 3.89Å; E489-H640 PolarHBondContact OE1-NE2 2.87Å; E489-H640 VanDerWaalsContact OE1-NE2 3.16Å; E489-H640 IonicContact OE2-CD2 2.72Å; E489-H640 IonicContact OE2-NE2 2.74Å
490	R	93.6	Very high	93.7	Very high	32 Å²	32	27.7 Å²	27.7	12%	0.121	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	140.5	169.1	-66.6	-160.1	165.5	105.5	11.6	110.8	V488 E497 N519 L520 F522 E524	V488-R490 HydrophobicContact CG1-CG 4.26Å; R490-E497 HydrophobicContact CG-CB 3.91Å; R490-E497 IonicContact CZ-OE2 2.87Å; R490-E497 IonicContact NE-OE2 3.94Å; R490-E497 PolarHBondContact NE-OE2 2.95Å; R490-E497 IonicContact NH2-OE2 2.99Å; R490-E497 PolarHBondContact NH2-OE2 3.33Å; R490-N519 VanDerWaalsContact O-CA 3.32Å; R490-N519 WeakPolarHBondContact O-CA 3.49Å; R490-L520 HydrophobicContact CB-CB 4.48Å; R490-L520 PolarHBondContact N-O 3.08Å; R490-L520 PolarHBondContact O-N 2.75Å; R490-F522 HydrophobicContact CB-CD2 4.39Å; R490-F522 HydrophobicContact CB-CE2 4.29Å; R490-F522 HydrophobicContact CG-CD2 3.88Å; R490-F522 HydrophobicContact CG-CE2 4.07Å; R490-F522 VanDerWaalsContact NH1-CG 3.3Å; R490-E524 IonicContact CZ-OE1 3.47Å; R490-E524 IonicContact CZ-OE2 3.83Å; R490-E524 IonicContact NH1-OE1 3.8Å; R490-E524 PolarHBondContact NH1-OE1 3.11Å; R490-E524 IonicContact NH1-OE2 2.81Å; R490-E524 IonicContact NH2-OE1 2.8Å; R490-E524 PolarHBondContact NH2-OE1 3.05Å; R490-E524 IonicContact NH2-OE2 3.5Å; R490-E524 PolarHBondContact NH2-OE2 2.78Å
491	I	91.7	Very high	93.9	Very high	4 Å²	4	25.3 Å²	25.3	2%	0.021	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	83.2	177.9	-49.7	-175.3	0	0	0	107.7	E489 V493 L494 H495 L496 Y618	E489-I491 HydrophobicContact CG-CG1 4.17Å; I491-V493 PolarHBondContact O-N 3.25Å; I491-L494 HydrophobicContact CG2-CB 3.99Å; I491-L494 HydrophobicContact CG2-CD1 3.64Å; I491-L494 HydrophobicContact CG2-CG 4.27Å; I491-L494 CarbonylContact O-C 3.53Å; I491-L494 PolarHBondContact O-N 2.91Å; I491-L494 VanDerWaalsContact O-N 3.08Å; I491-H495 PolarHBondContact O-N 2.87Å; I491-H495 VanDerWaalsContact O-N 3.1Å; I491-L496 PolarHBondContact N-O 3.29Å; I491-L496 PolarHBondContact O-N 3.1Å; I491-Y618 HydrophobicContact CD1-CD1 4.35Å; I491-Y618 HydrophobicContact CD1-CE1 3.62Å; I491-Y618 HydrophobicContact CG1-CE1 4.47Å
492	P	89.7	Confident	94	Very high	45 Å²	45	25.4 Å²	25.4	29%	0.292	13%	0.132	S	C	.	.	G	3₁₀ helix	trans	-58.1	-43.2	-169.2	-26.8	36.2	0	0	0	113.9	L494 H495 E518 L520	P492-L494 PolarHBondContact O-N 3.25Å; P492-H495 PolarHBondContact O-N 3.05Å; P492-H495 PolarHBondContact O-ND1 2.97Å; P492-E518 WeakPolarHBondContact CD-O 3.19Å; P492-E518 WeakPolarHBondContact CG-O 3.1Å; P492-L520 HydrophobicContact CG-CD1 4.22Å; P492-L520 HydrophobicContact CG-CG 4.5Å
493	V	87.4	Confident	94	Very high	97 Å²	97	25.7 Å²	25.7	59%	0.588	13%	0.132	S	C	*	.	G	3₁₀ helix	trans	-56.5	-19	178.2	-177	0	0	0	0	113.7	I491 E518	I491-V493 PolarHBondContact O-N 3.25Å; V493-E518 HydrophobicContact CG2-CB 4.15Å; V493-E518 HydrophobicContact CG2-CG 4.34Å; V493-E518 WeakPolarHBondContact CG2-OE2 3.27Å
494	L	87.9	Confident	94	Very high	72 Å²	72	24.8 Å²	24.8	38%	0.377	13%	0.127	S	C	.	.	G	3₁₀ helix	trans	-120.4	1.7	-178.5	-72	153.9	0	0	0	112.1	I491 P492 L496 R638	I491-L494 HydrophobicContact CG2-CB 3.99Å; I491-L494 HydrophobicContact CG2-CD1 3.64Å; I491-L494 HydrophobicContact CG2-CG 4.27Å; I491-L494 CarbonylContact O-C 3.53Å; I491-L494 PolarHBondContact O-N 2.91Å; I491-L494 VanDerWaalsContact O-N 3.08Å; P492-L494 PolarHBondContact O-N 3.25Å; L494-L496 HydrophobicContact CB-CD1 4.47Å; L494-L496 HydrophobicContact CB-CG 4.26Å; L494-L496 WeakPolarHBondContact O-CG 3.32Å; L494-L496 PolarHBondContact O-N 3.05Å; L494-L496 VanDerWaalsContact O-N 3.16Å; L494-R638 VanDerWaalsContact CD1-NH1 3.31Å
495	H	90.2	Very high	93.9	Very high	54 Å²	54	26 Å²	26	25%	0.25	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.4	39.5	-174.9	-47.7	-71.5	0	0	0	113.5	I491 P492 I621 Q624 N625	I491-H495 PolarHBondContact O-N 2.87Å; I491-H495 VanDerWaalsContact O-N 3.1Å; P492-H495 PolarHBondContact O-N 3.05Å; P492-H495 PolarHBondContact O-ND1 2.97Å; H495-I621 PolarHBondContact O-N 3.2Å; H495-Q624 PolarHBondContact CE1-OE1 3.22Å; H495-Q624 VanDerWaalsContact CE1-OE1 3.27Å; H495-N625 WeakPolarHBondContact CB-ND2 3.29Å; H495-N625 PolarHBondContact O-ND2 3.1Å
496	L	92.9	Very high	93.8	Very high	10 Å²	10	25 Å²	25	5%	0.052	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	146.7	178.2	-64.2	-175.8	0	0	0	111.4	I491 L494 Y618 I619 T620 V636	I491-L496 PolarHBondContact N-O 3.29Å; I491-L496 PolarHBondContact O-N 3.1Å; L494-L496 HydrophobicContact CB-CD1 4.47Å; L494-L496 HydrophobicContact CB-CG 4.26Å; L494-L496 WeakPolarHBondContact O-CG 3.32Å; L494-L496 PolarHBondContact O-N 3.05Å; L494-L496 VanDerWaalsContact O-N 3.16Å; L496-Y618 HydrophobicContact CB-CD1 4.15Å; L496-Y618 HydrophobicContact CB-CG 4.36Å; L496-Y618 HydrophobicContact CD1-CG 4.19Å; L496-I619 WeakPolarHBondContact CA-O 3.23Å; L496-T620 HydrophobicContact CD2-CG2 4.24Å; L496-V636 HydrophobicContact CD1-CB 4.23Å; L496-V636 HydrophobicContact CD1-CG1 4.36Å; L496-V636 HydrophobicContact CD1-CG2 4.45Å; L496-V636 HydrophobicContact CD2-CB 4.16Å; L496-V636 HydrophobicContact CD2-CG2 3.64Å
497	E	94.7	Very high	93.5	Very high	6 Å²	6	26.9 Å²	26.9	3%	0.028	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	161.6	166.2	67.9	175.3	-153.2	0	0	112	V488 E489 R490 R526 Y618 I619 I621	V488-E497 HydrophobicContact CG1-CB 4.11Å; E489-E497 CarbonylContact O-C 3.57Å; E489-E497 WeakPolarHBondContact O-CA 3.41Å; E489-E497 WeakPolarHBondContact O-CB 3.39Å; R490-E497 HydrophobicContact CG-CB 3.91Å; R490-E497 IonicContact CZ-OE2 2.87Å; R490-E497 IonicContact NE-OE2 3.94Å; R490-E497 PolarHBondContact NE-OE2 2.95Å; R490-E497 IonicContact NH2-OE2 2.99Å; R490-E497 PolarHBondContact NH2-OE2 3.33Å; E497-R526 IonicContact OE1-CZ 2.88Å; E497-R526 IonicContact OE1-NH1 3.21Å; E497-R526 PolarHBondContact OE1-NH1 3.08Å; E497-R526 IonicContact OE1-NH2 3.97Å; E497-R526 PolarHBondContact OE1-NH2 2.83Å; E497-R526 IonicContact OE2-NH1 3.27Å; E497-Y618 CarbonylContact O-C 3.58Å; E497-Y618 WeakPolarHBondContact O-CA 3.28Å; E497-I619 HydrophobicContact CG-CD1 4.06Å; E497-I619 HydrophobicContact CG-CG1 3.6Å; E497-I619 PolarHBondContact N-O 2.93Å; E497-I619 PolarHBondContact O-N 3.39Å; E497-I621 HydrophobicContact CB-CD1 4.25Å; E497-I621 HydrophobicContact CB-CG1 4.07Å; E497-I621 HydrophobicContact CG-CG1 3.95Å
498	R	95.1	Very high	93	Very high	8 Å²	8	31 Å²	31	3%	0.03	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	154.3	167.4	67.6	174.6	-176.8	106.9	4	111.3	V488 E489 E504 Y509 L617 Y618	V488-R498 CarbonylContact C-O 3.57Å; V488-R498 WeakPolarHBondContact CA-O 3.4Å; E489-R498 HydrophobicContact CB-CG 4.13Å; E489-R498 PolarHBondContact N-O 3.41Å; E489-R498 PolarHBondContact O-N 3.2Å; E489-R498 IonicContact OE2-CZ 3.7Å; E489-R498 VanDerWaalsContact OE2-CZ 3.24Å; E489-R498 IonicContact OE2-NE 3.01Å; E489-R498 PolarHBondContact OE2-NE 3.15Å; E489-R498 IonicContact OE2-NH2 2.88Å; E489-R498 PolarHBondContact OE2-NH2 2.65Å; R498-E504 IonicContact CZ-OE2 3.21Å; R498-E504 IonicContact NH1-OE1 3.81Å; R498-E504 PolarHBondContact NH1-OE1 3.08Å; R498-E504 IonicContact NH1-OE2 2.63Å; R498-E504 PolarHBondContact NH1-OE2 3.32Å; R498-Y509 VanDerWaalsContact NH2-CE1 3.34Å; R498-L617 WeakPolarHBondContact CB-O 3.46Å; R498-Y618 HydrophobicContact CB-CD1 3.9Å; R498-Y618 HydrophobicContact CB-CE1 4.37Å; R498-Y618 HydrophobicContact CB-CG 4.39Å; R498-Y618 HydrophobicContact CG-CD1 3.83Å; R498-Y618 HydrophobicContact CG-CE1 3.78Å
499	C	96.3	Very high	92.4	Very high	3 Å²	3	32 Å²	32	2%	0.02	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	142.7	160	-64.2	0	0	0	0	109.9	L529	C499-L529 HydrophobicContact CB-CD1 3.81Å
500	L	95.8	Very high	92.1	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.021	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-82	138.7	163.6	-58.1	-175.2	0	0	0	108.8	T466 L487 E489 L506 I521	T466-L500 HydrophobicContact CG2-CB 3.72Å; L487-L500 HydrophobicContact CB-CB 4.4Å; L487-L500 HydrophobicContact CB-CD1 4Å; L487-L500 HydrophobicContact CB-CG 4.37Å; L487-L500 PolarHBondContact O-N 3.06Å; E489-L500 HydrophobicContact CB-CD2 3.94Å; L500-L506 HydrophobicContact CD1-CD2 3.48Å; L500-L506 VanDerWaalsContact CD1-CD2 3.48Å; L500-I521 HydrophobicContact CD1-CD1 4.37Å
501	E	95.5	Very high	91.7	Very high	13 Å²	13	34.2 Å²	34.2	6%	0.061	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-81.3	149	177.3	-51.1	-68.7	162.8	0	0	110.6	T466 D503 E504 R669 I673	T466-E501 WeakPolarHBondContact CB-O 3.42Å; T466-E501 PolarHBondContact OG1-O 3.12Å; E501-D503 VanDerWaalsContact C-N 3.26Å; E501-D503 PolarHBondContact O-N 2.99Å; E501-D503 VanDerWaalsContact O-N 3.16Å; E501-E504 HydrophobicContact CB-CG 3.99Å; E501-E504 PolarHBondContact N-OE2 3.46Å; E501-E504 WeakPolarHBondContact O-CB 3.44Å; E501-E504 PolarHBondContact O-N 2.98Å; E501-R669 VanDerWaalsContact CD-NH2 3.28Å; E501-R669 IonicContact OE1-CZ 2.85Å; E501-R669 VanDerWaalsContact OE1-CZ 3.27Å; E501-R669 IonicContact OE1-NE 2.82Å; E501-R669 PolarHBondContact OE1-NE 3.41Å; E501-R669 IonicContact OE1-NH2 2.69Å; E501-R669 PolarHBondContact OE1-NH2 3.05Å; E501-R669 IonicContact OE2-CZ 3.37Å; E501-R669 IonicContact OE2-NE 3.32Å; E501-R669 IonicContact OE2-NH2 3.56Å; E501-R669 PolarHBondContact OE2-NH2 2.8Å; E501-I673 HydrophobicContact CG-CD1 3.82Å; E501-I673 VanDerWaalsContact OE1-CD1 3.23Å; E501-I673 WeakPolarHBondContact OE1-CD1 3.34Å
502	D	96.9	Very high	91.3	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.021	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-27.9	-169	-88.6	-27.4	0	0	0	114.9	T465 L467 Y530 N680 R684	T465-D502 WeakPolarHBondContact CB-O 3.43Å; L467-D502 HydrophobicContact CB-CB 3.91Å; L467-D502 WeakPolarHBondContact CB-O 3.41Å; L467-D502 PolarHBondContact N-O 3.45Å; D502-Y530 WeakPolarHBondContact OD2-CE2 3.37Å; D502-Y530 PolarHBondContact OD2-OH 3.29Å; D502-N680 HydrophobicContact CB-CB 4.27Å; D502-R684 IonicContact OD1-CZ 3.24Å; D502-R684 IonicContact OD1-NE 3.51Å; D502-R684 PolarHBondContact OD1-NE 3.14Å; D502-R684 IonicContact OD1-NH2 3.4Å; D502-R684 PolarHBondContact OD1-NH2 3.29Å; D502-R684 IonicContact OD2-CZ 2.83Å; D502-R684 IonicContact OD2-NE 3.62Å; D502-R684 PolarHBondContact OD2-NE 3.32Å; D502-R684 IonicContact OD2-NH2 3.59Å; D502-R684 PolarHBondContact OD2-NH2 3.13Å; D502-R684 VanDerWaalsContact OD2-NH2 3.12Å
503	D	95.2	Very high	91.2	Very high	45 Å²	45	35.6 Å²	35.6	24%	0.241	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	0.5	176.7	73.6	-30.7	0	0	0	114.2	E501 R676 N680	E501-D503 VanDerWaalsContact C-N 3.26Å; E501-D503 PolarHBondContact O-N 2.99Å; E501-D503 VanDerWaalsContact O-N 3.16Å; D503-R676 IonicContact OD1-CZ 3.2Å; D503-R676 IonicContact OD1-NE 2.67Å; D503-R676 IonicContact OD1-NH2 3.88Å; D503-R676 PolarHBondContact OD1-NH2 3.08Å; D503-R676 IonicContact OD2-CZ 3.54Å; D503-R676 IonicContact OD2-NE 3.2Å; D503-R676 PolarHBondContact OD2-NE 2.86Å; D503-R676 IonicContact OD2-NH2 3.8Å; D503-R676 PolarHBondContact OD2-NH2 3.05Å; D503-N680 WeakPolarHBondContact CB-OD1 3.42Å; D503-N680 VanDerWaalsContact CG-OD1 3.27Å; D503-N680 PolarHBondContact OD1-ND2 3.1Å; D503-N680 PolarHBondContact OD1-OD1 3.4Å
504	E	94.3	Very high	91	Very high	11 Å²	11	35.7 Å²	35.7	5%	0.051	18%	0.179	C	C	.	.			trans	-71.8	129.3	175.4	-72.3	-169.8	126.5	0	0	111.7	T465 T466 R498 E501 L506 Y509 Y616	T465-E504 CarbonylContact C-O 3.59Å; T465-E504 VanDerWaalsContact CA-O 3.3Å; T465-E504 WeakPolarHBondContact CA-O 3.32Å; T466-E504 PolarHBondContact N-O 3.21Å; T466-E504 PolarHBondContact OG1-O 3.3Å; T466-E504 VanDerWaalsContact OG1-O 3.11Å; R498-E504 IonicContact CZ-OE2 3.21Å; R498-E504 IonicContact NH1-OE1 3.81Å; R498-E504 PolarHBondContact NH1-OE1 3.08Å; R498-E504 IonicContact NH1-OE2 2.63Å; R498-E504 PolarHBondContact NH1-OE2 3.32Å; E501-E504 HydrophobicContact CB-CG 3.99Å; E501-E504 PolarHBondContact N-OE2 3.46Å; E501-E504 WeakPolarHBondContact O-CB 3.44Å; E501-E504 PolarHBondContact O-N 2.98Å; E504-L506 PolarHBondContact O-N 3.3Å; E504-Y509 HydrophobicContact CB-CE2 3.7Å; E504-Y509 VanDerWaalsContact CD-CZ 3.49Å; E504-Y509 HydrophobicContact CG-CE2 4.23Å; E504-Y509 WeakPolarHBondContact CG-OH 3.39Å; E504-Y509 WeakPolarHBondContact OE1-CE1 3.39Å; E504-Y509 PolarHBondContact OE1-OH 2.76Å; E504-Y616 WeakPolarHBondContact OE1-CE1 3.43Å
505	Y	94	Very high	90.8	Very high	109 Å²	109	40.7 Å²	40.7	43%	0.427	20%	0.204	S	C	.	.	B	Isolated β-bridge	trans	-79.6	107.9	175.2	-65.7	-75.8	0	0	0	110.9	T463 T464 T465 F507 N508 Y509	T463-Y505 WeakPolarHBondContact O-CE1 3.24Å; T464-Y505 WeakPolarHBondContact O-CA 3.34Å; T465-Y505 HydrophobicContact CG2-CD1 3.86Å; T465-Y505 HydrophobicContact CG2-CE1 3.63Å; Y505-F507 PolarHBondContact O-N 3.39Å; Y505-N508 WeakPolarHBondContact O-CB 3.32Å; Y505-N508 PolarHBondContact O-N 3.37Å; Y505-Y509 WeakPolarHBondContact O-CD2 3.16Å; Y505-Y509 VanDerWaalsContact O-CE2 3.23Å; Y505-Y509 WeakPolarHBondContact O-CE2 3.48Å
506	L	93.3	Very high	90.4	Very high	6 Å²	6	41.6 Å²	41.6	3%	0.031	23%	0.228	C	C	.	.	H	α-helix	trans	-51.4	-35.1	-173.3	-64.8	-175	0	0	0	113.4	V460 T464 A469 L487 L500 E504 N508 Y509 L510	V460-L506 HydrophobicContact CG1-CB 3.91Å; V460-L506 HydrophobicContact CG2-CD1 4.39Å; T464-L506 PolarHBondContact O-N 3.43Å; T464-L506 VanDerWaalsContact O-N 3.08Å; A469-L506 HydrophobicContact CB-CD1 3.49Å; A469-L506 VanDerWaalsContact CB-CD1 3.49Å; L487-L506 HydrophobicContact CD1-CD1 4.37Å; L487-L506 HydrophobicContact CD1-CD2 4.45Å; L500-L506 HydrophobicContact CD1-CD2 3.48Å; L500-L506 VanDerWaalsContact CD1-CD2 3.48Å; E504-L506 PolarHBondContact O-N 3.3Å; L506-N508 VanDerWaalsContact C-N 3.28Å; L506-N508 PolarHBondContact O-N 2.8Å; L506-Y509 PolarHBondContact O-N 2.7Å; L506-L510 HydrophobicContact CB-CD1 4.22Å; L506-L510 VanDerWaalsContact O-CG 3.32Å; L506-L510 WeakPolarHBondContact O-CG 3.41Å; L506-L510 PolarHBondContact O-N 2.82Å; L506-L510 VanDerWaalsContact O-N 3.1Å
507	F	91.1	Very high	90.1	Very high	40 Å²	40	42.2 Å²	42.2	18%	0.175	23%	0.232	C	C	.	.	H	α-helix	trans	-56.4	-37.1	178.3	-170.3	-88.4	0	0	0	113.4	L444 V460 Y505 Y509 S511	L444-F507 HydrophobicContact CB-CD2 4.26Å; L444-F507 HydrophobicContact CB-CE2 4.26Å; L444-F507 HydrophobicContact CD2-CD2 3.85Å; L444-F507 HydrophobicContact CD2-CE2 4.23Å; V460-F507 HydrophobicContact CG1-CB 4.04Å; Y505-F507 PolarHBondContact O-N 3.39Å; F507-Y509 VanDerWaalsContact C-N 3.31Å; F507-Y509 PolarHBondContact O-N 3.44Å; F507-S511 WeakPolarHBondContact O-CB 3.19Å; F507-S511 PolarHBondContact O-N 2.84Å; F507-S511 PolarHBondContact O-OG 3.21Å
508	N	86.4	Confident	89.8	Confident	87 Å²	87	47.5 Å²	47.5	47%	0.465	26%	0.256	S	S	.	.	H	α-helix	trans	-67.5	-33.2	-176.4	-66.2	-11.9	0	0	0	112.4	Y505 L506 S511 S512	Y505-N508 WeakPolarHBondContact O-CB 3.32Å; Y505-N508 PolarHBondContact O-N 3.37Å; L506-N508 VanDerWaalsContact C-N 3.28Å; L506-N508 PolarHBondContact O-N 2.8Å; N508-S511 PolarHBondContact O-OG 2.88Å; N508-S512 PolarHBondContact O-OG 3.13Å; N508-S512 VanDerWaalsContact O-OG 3.05Å
509	Y	83.2	Confident	89.7	Confident	21 Å²	21	47.9 Å²	47.9	8%	0.082	26%	0.259	C	S	.	.	H	α-helix	trans	-78.2	-59.2	178.3	-53.2	-87.5	0	0	0	109	R498 E504 Y505 L506 F507 S511 S512 W513 Y616 H640	R498-Y509 VanDerWaalsContact NH2-CE1 3.34Å; E504-Y509 HydrophobicContact CB-CE2 3.7Å; E504-Y509 VanDerWaalsContact CD-CZ 3.49Å; E504-Y509 HydrophobicContact CG-CE2 4.23Å; E504-Y509 WeakPolarHBondContact CG-OH 3.39Å; E504-Y509 WeakPolarHBondContact OE1-CE1 3.39Å; E504-Y509 PolarHBondContact OE1-OH 2.76Å; Y505-Y509 WeakPolarHBondContact O-CD2 3.16Å; Y505-Y509 VanDerWaalsContact O-CE2 3.23Å; Y505-Y509 WeakPolarHBondContact O-CE2 3.48Å; L506-Y509 PolarHBondContact O-N 2.7Å; F507-Y509 VanDerWaalsContact C-N 3.31Å; F507-Y509 PolarHBondContact O-N 3.44Å; Y509-S511 PolarHBondContact O-N 2.88Å; Y509-S511 VanDerWaalsContact O-N 3.1Å; Y509-S512 PolarHBondContact O-N 3.43Å; Y509-S512 PolarHBondContact O-OG 3.18Å; Y509-S512 VanDerWaalsContact O-OG 3.05Å; Y509-W513 PolarHBondContact O-N 3.3Å; Y509-Y616 HydrophobicContact CE1-CD1 4.43Å; Y509-Y616 AromaticContact CE1-CE1 3.63Å; Y509-Y616 HydrophobicContact CE1-CE1 3.63Å; Y509-Y616 AromaticContact CE1-CZ 3.74Å; Y509-H640 AromaticContact CD1-CD2 3.99Å; Y509-H640 AromaticContact CD1-NE2 3.87Å; Y509-H640 PolarHBondContact O-CE1 2.69Å
510	L	88.9	Confident	89.6	Confident	10 Å²	10	49.8 Å²	49.8	5%	0.052	27%	0.269	C	S	.	.	H	α-helix	trans	-58.4	-31.4	-176.8	-61.8	168.9	0	0	0	113.3	L444 V446 V460 L506 S512 W513 I521	L444-L510 HydrophobicContact CD2-CB 3.65Å; L444-L510 HydrophobicContact CD2-CD1 4.06Å; V446-L510 HydrophobicContact CB-CD1 3.76Å; V446-L510 HydrophobicContact CG2-CD1 3.84Å; V446-L510 HydrophobicContact CG2-CD2 3.95Å; V460-L510 HydrophobicContact CG2-CD1 4.2Å; L506-L510 HydrophobicContact CB-CD1 4.22Å; L506-L510 VanDerWaalsContact O-CG 3.32Å; L506-L510 WeakPolarHBondContact O-CG 3.41Å; L506-L510 PolarHBondContact O-N 2.82Å; L506-L510 VanDerWaalsContact O-N 3.1Å; L510-S512 VanDerWaalsContact C-N 3.35Å; L510-W513 HydrophobicContact CD2-CD2 4.3Å; L510-W513 HydrophobicContact CD2-CE3 3.86Å; L510-W513 HydrophobicContact CD2-CH2 3.74Å; L510-W513 HydrophobicContact CD2-CZ2 4.14Å; L510-W513 HydrophobicContact CD2-CZ3 3.58Å; L510-I521 HydrophobicContact CD2-CG1 4.49Å
511	S	85.4	Confident	89.6	Confident	70 Å²	70	50 Å²	50	49%	0.49	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-11.3	175.5	63.1	0	0	0	0	115.2	F507 N508 Y509	F507-S511 WeakPolarHBondContact O-CB 3.19Å; F507-S511 PolarHBondContact O-N 2.84Å; F507-S511 PolarHBondContact O-OG 3.21Å; N508-S511 PolarHBondContact O-OG 2.88Å; Y509-S511 PolarHBondContact O-N 2.88Å; Y509-S511 VanDerWaalsContact O-N 3.1Å
512	S	82.8	Confident	89.6	Confident	50 Å²	50	51.5 Å²	51.5	35%	0.35	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-1.1	176	62.1	0	0	0	0	114.2	N508 Y509 L510 H640	N508-S512 PolarHBondContact O-OG 3.13Å; N508-S512 VanDerWaalsContact O-OG 3.05Å; Y509-S512 PolarHBondContact O-N 3.43Å; Y509-S512 PolarHBondContact O-OG 3.18Å; Y509-S512 VanDerWaalsContact O-OG 3.05Å; L510-S512 VanDerWaalsContact C-N 3.35Å; S512-H640 PolarHBondContact OG-CE1 2.74Å; S512-H640 VanDerWaalsContact OG-CE1 3.25Å; S512-H640 PolarHBondContact OG-ND1 3.17Å
513	W	87.5	Confident	89.6	Confident	28 Å²	28	51.7 Å²	51.7	11%	0.106	28%	0.277	C	S	.	.	S	Bend	trans	-66.2	150	160.9	-67.8	-7.1	0	0	0	110.8	E489 Y509 L510 N517 N519 I521 H640	E489-W513 HydrophobicContact CG-CZ2 4.15Å; E489-W513 WeakPolarHBondContact OE1-CZ2 3.47Å; E489-W513 PolarHBondContact OE1-NE1 3.05Å; Y509-W513 PolarHBondContact O-N 3.3Å; L510-W513 HydrophobicContact CD2-CD2 4.3Å; L510-W513 HydrophobicContact CD2-CE3 3.86Å; L510-W513 HydrophobicContact CD2-CH2 3.74Å; L510-W513 HydrophobicContact CD2-CZ2 4.14Å; L510-W513 HydrophobicContact CD2-CZ3 3.58Å; W513-N517 HydrophobicContact CB-CB 4.38Å; W513-N517 VanDerWaalsContact CE3-OD1 3.29Å; W513-N519 HydrophobicContact CD2-CB 3.75Å; W513-N519 HydrophobicContact CE3-CB 3.79Å; W513-N519 HydrophobicContact CH2-CB 3.5Å; W513-N519 HydrophobicContact CZ2-CB 3.48Å; W513-N519 VanDerWaalsContact CZ2-CB 3.48Å; W513-N519 HydrophobicContact CZ3-CB 3.66Å; W513-N519 PolarHBondContact NE1-ND2 2.89Å; W513-I521 HydrophobicContact CH2-CD1 3.59Å; W513-I521 HydrophobicContact CH2-CG1 3.89Å; W513-I521 HydrophobicContact CZ2-CD1 3.79Å; W513-H640 AromaticContact CD1-CE1 3.21Å; W513-H640 AromaticContact CD1-NE2 3.56Å; W513-H640 AromaticContact NE1-CE1 3.33Å; W513-H640 PolarHBondContact NE1-CE1 3.41Å; W513-H640 VanDerWaalsContact NE1-CE1 3.33Å; W513-H640 AromaticContact NE1-NE2 3.15Å; W513-H640 PolarHBondContact NE1-NE2 3.46Å; W513-H640 VanDerWaalsContact NE1-NE2 3.15Å
514	K	83	Confident	89.6	Confident	98 Å²	98	50.9 Å²	50.9	43%	0.426	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-68.9	151.4	175	-85.3	169.2	-173.1	169.9	0	111.3	G516 N517 T642	K514-G516 PolarHBondContact O-N 2.87Å; K514-N517 HydrophobicContact CB-CB 4.47Å; K514-N517 VanDerWaalsContact O-CB 3.3Å; K514-N517 WeakPolarHBondContact O-CB 3.41Å; K514-N517 PolarHBondContact O-N 3.09Å; K514-N517 VanDerWaalsContact O-N 3.12Å; K514-N517 PolarHBondContact O-ND2 3.36Å; K514-T642 VanDerWaalsContact CD-OG1 3.31Å; K514-T642 WeakPolarHBondContact CD-OG1 3.16Å; K514-T642 VanDerWaalsContact CE-O 3.24Å; K514-T642 WeakPolarHBondContact CE-O 3.34Å; K514-T642 WeakPolarHBondContact CE-OG1 3.3Å; K514-T642 VanDerWaalsContact CG-OG1 3.32Å; K514-T642 WeakPolarHBondContact CG-OG1 3.4Å; K514-T642 PolarHBondContact NZ-O 2.97Å
515	I	83.3	Confident	89.6	Confident	178 Å²	178	54.5 Å²	54.5	91%	0.913	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	129.5	161.6	-59.7	170.5	0	0	0	107.5
516	G	82.4	Confident	89.7	Confident	73 Å²	73	49.4 Å²	49.4	75%	0.753	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	26.4	-173.6	0	0	0	0	0	114.6	K514	K514-G516 PolarHBondContact O-N 2.87Å
517	N	86.8	Confident	89.7	Confident	22 Å²	22	53.4 Å²	53.4	12%	0.118	29%	0.287	C	S	.	.			trans	-69.5	161.4	167.8	75.2	90.4	0	0	0	111.8	W513 K514 N519	W513-N517 HydrophobicContact CB-CB 4.38Å; W513-N517 VanDerWaalsContact CE3-OD1 3.29Å; K514-N517 HydrophobicContact CB-CB 4.47Å; K514-N517 VanDerWaalsContact O-CB 3.3Å; K514-N517 WeakPolarHBondContact O-CB 3.41Å; K514-N517 PolarHBondContact O-N 3.09Å; K514-N517 VanDerWaalsContact O-N 3.12Å; K514-N517 PolarHBondContact O-ND2 3.36Å; N517-N519 WeakPolarHBondContact OD1-CB 3.47Å; N517-N519 PolarHBondContact OD1-N 2.93Å
518	E	89.6	Confident	89.7	Confident	118 Å²	118	52.1 Å²	52.1	55%	0.551	28%	0.282	S	S	*	.			trans	-110.4	17	176.8	-57.8	-178.3	171.5	0	0	111.8	P492 V493	P492-E518 WeakPolarHBondContact CD-O 3.19Å; P492-E518 WeakPolarHBondContact CG-O 3.1Å; V493-E518 HydrophobicContact CG2-CB 4.15Å; V493-E518 HydrophobicContact CG2-CG 4.34Å; V493-E518 WeakPolarHBondContact CG2-OE2 3.27Å
519	N	92.3	Very high	90.1	Very high	15 Å²	15	48 Å²	48	8%	0.08	26%	0.26	C	S	.	.			trans	-74.7	146.7	-178.1	-61.5	21.3	0	0	0	110.2	R490 W513 N517	R490-N519 VanDerWaalsContact O-CA 3.32Å; R490-N519 WeakPolarHBondContact O-CA 3.49Å; W513-N519 HydrophobicContact CD2-CB 3.75Å; W513-N519 HydrophobicContact CE3-CB 3.79Å; W513-N519 HydrophobicContact CH2-CB 3.5Å; W513-N519 HydrophobicContact CZ2-CB 3.48Å; W513-N519 VanDerWaalsContact CZ2-CB 3.48Å; W513-N519 HydrophobicContact CZ3-CB 3.66Å; W513-N519 PolarHBondContact NE1-ND2 2.89Å; N517-N519 WeakPolarHBondContact OD1-CB 3.47Å; N517-N519 PolarHBondContact OD1-N 2.93Å
520	L	93.9	Very high	90.6	Very high	44 Å²	44	47 Å²	47	23%	0.23	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	146.3	-172	-55.4	173.7	0	0	0	110.2	F449 R490 P492 F522	F449-L520 HydrophobicContact CD2-CB 4.43Å; F449-L520 HydrophobicContact CE2-CB 4.4Å; F449-L520 HydrophobicContact CE2-CD2 3.74Å; F449-L520 HydrophobicContact CZ-CD2 4.25Å; R490-L520 HydrophobicContact CB-CB 4.48Å; R490-L520 PolarHBondContact N-O 3.08Å; R490-L520 PolarHBondContact O-N 2.75Å; P492-L520 HydrophobicContact CG-CD1 4.22Å; P492-L520 HydrophobicContact CG-CG 4.5Å; L520-F522 HydrophobicContact CB-CD2 4.13Å; L520-F522 HydrophobicContact CB-CE2 3.57Å; L520-F522 HydrophobicContact CB-CZ 4.45Å; L520-F522 HydrophobicContact CD1-CE2 3.8Å; L520-F522 HydrophobicContact CD1-CZ 4.03Å; L520-F522 HydrophobicContact CG-CE2 4.35Å
521	I	96	Very high	90.7	Very high	8 Å²	8	46.6 Å²	46.6	4%	0.041	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.8	170	-53.8	-56.8	0	0	0	109	V446 I448 F449 L487 V488 E489 L500 L510 W513	V446-I521 HydrophobicContact CG2-CB 4.38Å; V446-I521 HydrophobicContact CG2-CG1 3.88Å; I448-I521 WeakPolarHBondContact CA-O 3.16Å; I448-I521 HydrophobicContact CD1-CG2 4.46Å; I448-I521 HydrophobicContact CG1-CB 4.29Å; I448-I521 HydrophobicContact CG1-CG2 4.04Å; I448-I521 HydrophobicContact CG2-CG2 4.25Å; F449-I521 WeakPolarHBondContact CD2-O 3.33Å; F449-I521 PolarHBondContact N-O 2.97Å; L487-I521 HydrophobicContact CB-CG2 4.16Å; L487-I521 HydrophobicContact CD2-CG2 4.34Å; V488-I521 WeakPolarHBondContact O-CA 3.48Å; E489-I521 HydrophobicContact CB-CD1 4.08Å; L500-I521 HydrophobicContact CD1-CD1 4.37Å; L510-I521 HydrophobicContact CD2-CG1 4.49Å; W513-I521 HydrophobicContact CH2-CD1 3.59Å; W513-I521 HydrophobicContact CH2-CG1 3.89Å; W513-I521 HydrophobicContact CZ2-CD1 3.79Å
522	F	95.9	Very high	90.9	Very high	45 Å²	45	43.6 Å²	43.6	20%	0.197	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	151.1	175.7	-71.9	-99.2	0	0	0	111.5	F449 L487 V488 R490 L520 E524	F449-F522 HydrophobicContact CB-CD1 3.59Å; F449-F522 HydrophobicContact CB-CE1 3.66Å; F449-F522 HydrophobicContact CB-CG 4.18Å; F449-F522 HydrophobicContact CB-CZ 4.3Å; F449-F522 HydrophobicContact CG-CE1 4.3Å; F449-F522 CarbonylContact O-C 3.53Å; F449-F522 WeakPolarHBondContact O-CA 3.43Å; L487-F522 CarbonylContact C-O 3.6Å; L487-F522 WeakPolarHBondContact CA-O 3.43Å; V488-F522 HydrophobicContact CB-CB 4.42Å; V488-F522 PolarHBondContact N-O 3.16Å; V488-F522 PolarHBondContact O-N 3.33Å; R490-F522 HydrophobicContact CB-CD2 4.39Å; R490-F522 HydrophobicContact CB-CE2 4.29Å; R490-F522 HydrophobicContact CG-CD2 3.88Å; R490-F522 HydrophobicContact CG-CE2 4.07Å; R490-F522 VanDerWaalsContact NH1-CG 3.3Å; L520-F522 HydrophobicContact CB-CD2 4.13Å; L520-F522 HydrophobicContact CB-CE2 3.57Å; L520-F522 HydrophobicContact CB-CZ 4.45Å; L520-F522 HydrophobicContact CD1-CE2 3.8Å; L520-F522 HydrophobicContact CD1-CZ 4.03Å; L520-F522 HydrophobicContact CG-CE2 4.35Å; F522-E524 HydrophobicContact CB-CG 4.04Å
523	L	96.3	Very high	91.2	Very high	7 Å²	7	41.2 Å²	41.2	4%	0.037	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	113.3	166.2	177.1	65.4	0	0	0	108.8	I448 F449 L450 P451 L470 L473 L487	I448-L523 HydrophobicContact CG2-CB 4.14Å; F449-L523 PolarHBondContact O-N 3Å; L450-L523 HydrophobicContact CG-CD2 4.33Å; P451-L523 VanDerWaalsContact CD-O 3.32Å; P451-L523 WeakPolarHBondContact CD-O 3.32Å; P451-L523 WeakPolarHBondContact CG-O 3.49Å; L470-L523 HydrophobicContact CD1-CD1 3.26Å; L473-L523 HydrophobicContact CB-CD2 4.48Å; L473-L523 HydrophobicContact CD1-CD1 4.15Å; L473-L523 HydrophobicContact CD1-CD2 4.28Å; L487-L523 HydrophobicContact CD2-CD1 4.12Å
524	E	94.8	Very high	91.2	Very high	29 Å²	29	44 Å²	44	14%	0.136	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	161.5	-176.1	-62.3	-170.4	162.8	0	0	112.5	H485 A486 V488 R490 F522 R526	H485-E524 CarbonylContact C-O 3.37Å; A486-E524 PolarHBondContact N-O 2.81Å; A486-E524 PolarHBondContact O-N 3.45Å; A486-E524 VanDerWaalsContact O-N 3.08Å; V488-E524 HydrophobicContact CG2-CB 4.16Å; V488-E524 HydrophobicContact CG2-CG 4.44Å; R490-E524 IonicContact CZ-OE1 3.47Å; R490-E524 IonicContact CZ-OE2 3.83Å; R490-E524 IonicContact NH1-OE1 3.8Å; R490-E524 PolarHBondContact NH1-OE1 3.11Å; R490-E524 IonicContact NH1-OE2 2.81Å; R490-E524 IonicContact NH2-OE1 2.8Å; R490-E524 PolarHBondContact NH2-OE1 3.05Å; R490-E524 IonicContact NH2-OE2 3.5Å; R490-E524 PolarHBondContact NH2-OE2 2.78Å; F522-E524 HydrophobicContact CB-CG 4.04Å; E524-R526 HydrophobicContact CB-CG 4.18Å; E524-R526 IonicContact OE2-NH1 3.47Å
525	E	95.3	Very high	91.4	Very high	86 Å²	86	41.5 Å²	41.5	40%	0.402	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	120.8	166.1	-68.8	-155.7	121.2	0	0	110.2	K484 W846	K484-E525 HydrophobicContact CB-CB 4.09Å; K484-E525 HydrophobicContact CB-CG 4.29Å; K484-E525 CarbonylContact O-C 3.5Å; K484-E525 WeakPolarHBondContact O-CA 3.44Å; E525-W846 VanDerWaalsContact O-CH2 3.24Å; E525-W846 WeakPolarHBondContact O-CH2 3.47Å; E525-W846 WeakPolarHBondContact O-CZ3 3.44Å
526	R	94.9	Very high	91.6	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.008	19%	0.185	C	C	.	.			trans	-130.2	106.5	-168.6	-65.3	-56.6	-61.4	-136.4	-5.1	111.5	K484 A486 V488 E497 E524 D528 L529	K484-R526 PolarHBondContact O-N 3.1Å; A486-R526 HydrophobicContact CB-CB 3.79Å; A486-R526 HydrophobicContact CB-CG 3.65Å; V488-R526 HydrophobicContact CG2-CG 3.74Å; E497-R526 IonicContact OE1-CZ 2.88Å; E497-R526 IonicContact OE1-NH1 3.21Å; E497-R526 PolarHBondContact OE1-NH1 3.08Å; E497-R526 IonicContact OE1-NH2 3.97Å; E497-R526 PolarHBondContact OE1-NH2 2.83Å; E497-R526 IonicContact OE2-NH1 3.27Å; E524-R526 HydrophobicContact CB-CG 4.18Å; E524-R526 IonicContact OE2-NH1 3.47Å; R526-D528 WeakPolarHBondContact CB-OD1 3.43Å; R526-D528 IonicContact CZ-OD1 3.8Å; R526-D528 IonicContact CZ-OD2 3.51Å; R526-D528 IonicContact NE-OD1 3.92Å; R526-D528 PolarHBondContact NE-OD1 3.16Å; R526-D528 IonicContact NE-OD2 2.75Å; R526-D528 IonicContact NH2-OD1 2.69Å; R526-D528 PolarHBondContact NH2-OD1 3.38Å; R526-D528 IonicContact NH2-OD2 3.21Å; R526-D528 PolarHBondContact NH2-OD2 2.87Å; R526-D528 PolarHBondContact O-N 2.85Å; R526-L529 HydrophobicContact CB-CB 4.39Å; R526-L529 PolarHBondContact O-N 3.49Å
527	Q	93.1	Very high	91.7	Very high	91 Å²	91	36.6 Å²	36.6	43%	0.425	18%	0.178	S	C	.	.	H	α-helix	trans	-67.1	-27.2	176.5	-59	-171.6	17.5	0	0	112.1	L529 G531 W539	Q527-L529 PolarHBondContact O-N 3.48Å; Q527-G531 VanDerWaalsContact O-CA 3.26Å; Q527-G531 WeakPolarHBondContact O-CA 3.14Å; Q527-G531 PolarHBondContact O-N 2.91Å; Q527-W539 HydrophobicContact CB-CZ2 4.14Å; Q527-W539 WeakPolarHBondContact O-CZ2 3.23Å
528	D	92.5	Very high	91.7	Very high	12 Å²	12	38.5 Å²	38.5	6%	0.064	19%	0.193	C	C	.	.	H	α-helix	trans	-69.9	-12.1	177.8	55.9	-50	0	0	0	114.2	R526 W539 Y665 R669	R526-D528 WeakPolarHBondContact CB-OD1 3.43Å; R526-D528 IonicContact CZ-OD1 3.8Å; R526-D528 IonicContact CZ-OD2 3.51Å; R526-D528 IonicContact NE-OD1 3.92Å; R526-D528 PolarHBondContact NE-OD1 3.16Å; R526-D528 IonicContact NE-OD2 2.75Å; R526-D528 IonicContact NH2-OD1 2.69Å; R526-D528 PolarHBondContact NH2-OD1 3.38Å; R526-D528 IonicContact NH2-OD2 3.21Å; R526-D528 PolarHBondContact NH2-OD2 2.87Å; R526-D528 PolarHBondContact O-N 2.85Å; D528-W539 HydrophobicContact CB-CH2 3.87Å; D528-W539 HydrophobicContact CB-CZ3 4.4Å; D528-Y665 HydrophobicContact CB-CE1 3.94Å; D528-R669 PolarHBondContact O-NH1 2.83Å
529	L	93.9	Very high	91.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-73.7	-53.2	174.5	-173.7	74.9	0	0	0	112	A486 C499 R526 Q527 R669	A486-L529 HydrophobicContact CB-CD2 4.04Å; C499-L529 HydrophobicContact CB-CD1 3.81Å; R526-L529 HydrophobicContact CB-CB 4.39Å; R526-L529 PolarHBondContact O-N 3.49Å; Q527-L529 PolarHBondContact O-N 3.48Å; L529-R669 PolarHBondContact O-NH1 2.8Å; L529-R669 PolarHBondContact O-NH2 3.36Å
530	Y	94.1	Very high	91.5	Very high	1 Å²	1	32.9 Å²	32.9	0%	0.004	17%	0.165	C	C	.	.	H	α-helix	trans	-133	-0.7	-174.1	-68.5	-49.8	0	0	0	116	M483 D502 L532 F533 E534 N680 Y681 R684	M483-Y530 HydrophobicContact CE-CD2 4.17Å; M483-Y530 WeakPolarHBondContact O-CD2 3.32Å; D502-Y530 WeakPolarHBondContact OD2-CE2 3.37Å; D502-Y530 PolarHBondContact OD2-OH 3.29Å; Y530-L532 PolarHBondContact O-N 3.16Å; Y530-F533 AromaticContact CD1-CD2 3.89Å; Y530-F533 HydrophobicContact CD1-CD2 3.89Å; Y530-F533 HydrophobicContact CD1-CE2 4.04Å; Y530-F533 PolarHBondContact O-N 3.11Å; Y530-E534 PolarHBondContact O-N 3.34Å; Y530-N680 HydrophobicContact CE1-CB 4.44Å; Y530-N680 WeakPolarHBondContact OH-CB 3.32Å; Y530-N680 PolarHBondContact OH-O 2.86Å; Y530-Y681 AromaticContact CD1-CD2 3.76Å; Y530-Y681 HydrophobicContact CD1-CD2 3.76Å; Y530-Y681 HydrophobicContact CD1-CG 4.3Å; Y530-Y681 HydrophobicContact CE1-CD2 4.43Å; Y530-Y681 AromaticContact CG-CD2 3.88Å; Y530-Y681 HydrophobicContact CG-CD2 3.88Å; Y530-R684 HydrophobicContact CD2-CG 4.27Å; Y530-R684 HydrophobicContact CE2-CB 3.85Å; Y530-R684 HydrophobicContact CE2-CG 3.74Å
531	G	90.7	Very high	91	Very high	2 Å²	2	31.5 Å²	31.5	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-57	-26.9	-179.9	0	0	0	0	0	114.3	Q527 F533 E534 S535 W539	Q527-G531 VanDerWaalsContact O-CA 3.26Å; Q527-G531 WeakPolarHBondContact O-CA 3.14Å; Q527-G531 PolarHBondContact O-N 2.91Å; G531-F533 VanDerWaalsContact C-N 3.27Å; G531-F533 PolarHBondContact O-N 3.46Å; G531-E534 PolarHBondContact O-N 2.83Å; G531-S535 CarbonylContact O-C 3.59Å; G531-S535 WeakPolarHBondContact O-CA 3.37Å; G531-S535 PolarHBondContact O-N 2.8Å; G531-S535 PolarHBondContact O-OG 3.35Å; G531-W539 VanDerWaalsContact C-NE1 3.27Å; G531-W539 PolarHBondContact O-NE1 3.35Å
532	L	90	Very high	89.7	Confident	6 Å²	6	38.1 Å²	38.1	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-55.1	-36.8	169.8	171.6	63.5	0	0	0	113.4	Y530 S536 W539 L540 I549 I670	Y530-L532 PolarHBondContact O-N 3.16Å; L532-S536 WeakPolarHBondContact O-CA 3.3Å; L532-S536 VanDerWaalsContact O-CB 3.32Å; L532-S536 WeakPolarHBondContact O-CB 3.11Å; L532-S536 PolarHBondContact O-N 3.29Å; L532-S536 VanDerWaalsContact O-N 3.1Å; L532-W539 HydrophobicContact CD1-CB 4.16Å; L532-L540 HydrophobicContact CD1-CD1 4.02Å; L532-L540 HydrophobicContact CD1-CD2 4.08Å; L532-L540 HydrophobicContact CD1-CG 3.86Å; L532-I549 HydrophobicContact CD1-CD1 3.84Å; L532-I549 HydrophobicContact CD2-CD1 4.28Å; L532-I549 HydrophobicContact CG-CD1 3.74Å; L532-I670 HydrophobicContact CD2-CD1 3.86Å; L532-I670 HydrophobicContact CD2-CG1 3.84Å
533	F	89.1	Confident	88.1	Confident	1 Å²	1	44.6 Å²	44.6	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-87.6	-39.7	179.2	-60.5	-77.3	0	0	0	111.7	Y530 G531 S535 I549 N550 L677 Y678 Y681	Y530-F533 AromaticContact CD1-CD2 3.89Å; Y530-F533 HydrophobicContact CD1-CD2 3.89Å; Y530-F533 HydrophobicContact CD1-CE2 4.04Å; Y530-F533 PolarHBondContact O-N 3.11Å; G531-F533 VanDerWaalsContact C-N 3.27Å; G531-F533 PolarHBondContact O-N 3.46Å; F533-S535 VanDerWaalsContact C-N 3.28Å; F533-S535 PolarHBondContact O-N 2.86Å; F533-I549 HydrophobicContact CD1-CB 4.37Å; F533-I549 HydrophobicContact CD1-CD1 4.04Å; F533-I549 HydrophobicContact CD1-CG2 3.58Å; F533-I549 HydrophobicContact CE1-CD1 4.11Å; F533-I549 HydrophobicContact CE1-CG2 3.74Å; F533-N550 PolarHBondContact O-ND2 3.44Å; F533-L677 HydrophobicContact CE2-CD1 4.48Å; F533-L677 HydrophobicContact CE2-CG 3.99Å; F533-L677 HydrophobicContact CZ-CD2 4.35Å; F533-L677 HydrophobicContact CZ-CG 3.87Å; F533-Y678 HydrophobicContact CD1-CD2 4.07Å; F533-Y678 AromaticContact CE1-CD2 3.72Å; F533-Y678 HydrophobicContact CE1-CD2 3.72Å; F533-Y678 HydrophobicContact CE1-CG 4.39Å; F533-Y681 HydrophobicContact CB-CD1 3.95Å; F533-Y681 HydrophobicContact CB-CD2 3.61Å; F533-Y681 HydrophobicContact CB-CE1 3.79Å; F533-Y681 HydrophobicContact CB-CE2 3.42Å; F533-Y681 VanDerWaalsContact CB-CE2 3.42Å; F533-Y681 HydrophobicContact CB-CG 3.86Å; F533-Y681 HydrophobicContact CD1-CD1 4.14Å; F533-Y681 HydrophobicContact CD1-CG 4.22Å; F533-Y681 HydrophobicContact CD2-CD1 4.42Å; F533-Y681 AromaticContact CD2-CD2 3.71Å; F533-Y681 HydrophobicContact CD2-CD2 3.71Å; F533-Y681 HydrophobicContact CD2-CE2 4.4Å; F533-Y681 AromaticContact CD2-CG 3.72Å; F533-Y681 HydrophobicContact CD2-CG 3.72Å; F533-Y681 HydrophobicContact CE2-CG 4.29Å; F533-Y681 AromaticContact CG-CD1 3.93Å; F533-Y681 HydrophobicContact CG-CD1 3.93Å; F533-Y681 AromaticContact CG-CD2 3.8Å; F533-Y681 HydrophobicContact CG-CD2 3.8Å; F533-Y681 HydrophobicContact CG-CE1 4.28Å; F533-Y681 HydrophobicContact CG-CE2 4.15Å; F533-Y681 AromaticContact CG-CG 3.67Å; F533-Y681 HydrophobicContact CG-CG 3.67Å
534	E	88.1	Confident	86.4	Confident	85 Å²	85	46 Å²	46	40%	0.397	23%	0.229	S	C	.	.	H	α-helix	trans	-61.2	-37.2	174.3	-60.5	179.8	158.1	0	0	111.6	M483 Y530 G531	M483-E534 WeakPolarHBondContact CB-OE1 3.35Å; Y530-E534 PolarHBondContact O-N 3.34Å; G531-E534 PolarHBondContact O-N 2.83Å
535	S	87.1	Confident	84.3	Confident	46 Å²	46	47 Å²	47	32%	0.322	24%	0.239	S	C	.	.			trans	-150.2	50.5	-167.6	58.3	0	0	0	0	113.6	G531 F533 K537 S538	G531-S535 CarbonylContact O-C 3.59Å; G531-S535 WeakPolarHBondContact O-CA 3.37Å; G531-S535 PolarHBondContact O-N 2.8Å; G531-S535 PolarHBondContact O-OG 3.35Å; F533-S535 VanDerWaalsContact C-N 3.28Å; F533-S535 PolarHBondContact O-N 2.86Å; S535-K537 PolarHBondContact O-N 3.23Å; S535-S538 WeakPolarHBondContact CB-OG 3.45Å; S535-S538 PolarHBondContact O-N 3.36Å; S535-S538 PolarHBondContact O-OG 3.43Å; S535-S538 PolarHBondContact OG-OG 2.83Å; S535-S538 VanDerWaalsContact OG-OG 3.05Å
536	S	86	Confident	82.1	Confident	8 Å²	8	48.4 Å²	48.4	6%	0.056	25%	0.254	C	S	.	.	H	α-helix	trans	-41.2	-40.4	-179.3	167.7	0	0	0	0	114.9	L532 S538 W539 L540 F547	L532-S536 WeakPolarHBondContact O-CA 3.3Å; L532-S536 VanDerWaalsContact O-CB 3.32Å; L532-S536 WeakPolarHBondContact O-CB 3.11Å; L532-S536 PolarHBondContact O-N 3.29Å; L532-S536 VanDerWaalsContact O-N 3.1Å; S536-S538 PolarHBondContact O-N 3.07Å; S536-W539 PolarHBondContact O-N 3.47Å; S536-L540 WeakPolarHBondContact O-CB 3.4Å; S536-L540 PolarHBondContact O-N 3.31Å; S536-F547 PolarHBondContact OG-O 3.17Å
537	K	85.2	Confident	80.4	Confident	141 Å²	141	48.7 Å²	48.7	61%	0.613	26%	0.255	S	S	*	.	H	α-helix	trans	-58.5	-35.9	175.7	-70.6	-169.3	177.2	-171	0	114.5	S535 G541	S535-K537 PolarHBondContact O-N 3.23Å; K537-G541 WeakPolarHBondContact O-CA 3.18Å; K537-G541 PolarHBondContact O-N 2.94Å
538	S	86.9	Confident	78.8	Confident	61 Å²	61	47.5 Å²	47.5	43%	0.427	25%	0.252	S	S	.	.	H	α-helix	trans	-84.3	-15.6	-179.3	68	0	0	0	0	113.9	S535 S536	S535-S538 WeakPolarHBondContact CB-OG 3.45Å; S535-S538 PolarHBondContact O-N 3.36Å; S535-S538 PolarHBondContact O-OG 3.43Å; S535-S538 PolarHBondContact OG-OG 2.83Å; S535-S538 VanDerWaalsContact OG-OG 3.05Å; S536-S538 PolarHBondContact O-N 3.07Å
539	W	89.8	Confident	77.3	Confident	15 Å²	15	47 Å²	47	6%	0.057	25%	0.249	C	C	.	.	H	α-helix	trans	-98.8	-34.6	178.6	-76	86.3	0	0	0	113	Q527 D528 G531 L532 S536 W661 R662 K663	Q527-W539 HydrophobicContact CB-CZ2 4.14Å; Q527-W539 WeakPolarHBondContact O-CZ2 3.23Å; D528-W539 HydrophobicContact CB-CH2 3.87Å; D528-W539 HydrophobicContact CB-CZ3 4.4Å; G531-W539 VanDerWaalsContact C-NE1 3.27Å; G531-W539 PolarHBondContact O-NE1 3.35Å; L532-W539 HydrophobicContact CD1-CB 4.16Å; S536-W539 PolarHBondContact O-N 3.47Å; W539-W661 HydrophobicContact CH2-CZ3 4.49Å; W539-W661 HydrophobicContact CZ3-CZ3 4.2Å; W539-R662 HydrophobicContact CE3-CB 3.79Å; W539-R662 HydrophobicContact CE3-CG 3.95Å; W539-R662 HydrophobicContact CZ3-CB 4.15Å; W539-R662 HydrophobicContact CZ3-CG 3.9Å; W539-R662 CarbonylContact O-C 3.56Å; W539-K663 WeakPolarHBondContact O-CA 3.39Å; W539-K663 WeakPolarHBondContact O-CG 3.41Å; W539-K663 PolarHBondContact O-N 2.91Å
540	L	87.7	Confident	75.6	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-105.9	-18.3	179.6	-57.8	-177.6	0	0	0	113.5	L532 S536 H544 F547 K663 L667	L532-L540 HydrophobicContact CD1-CD1 4.02Å; L532-L540 HydrophobicContact CD1-CD2 4.08Å; L532-L540 HydrophobicContact CD1-CG 3.86Å; S536-L540 WeakPolarHBondContact O-CB 3.4Å; S536-L540 PolarHBondContact O-N 3.31Å; L540-H544 HydrophobicContact CB-CB 3.85Å; L540-H544 PolarHBondContact O-CD2 3.07Å; L540-H544 VanDerWaalsContact O-CD2 3.3Å; L540-F547 HydrophobicContact CD1-CB 4.34Å; L540-F547 HydrophobicContact CD1-CD1 3.72Å; L540-F547 HydrophobicContact CD1-CG 4.47Å; L540-K663 WeakPolarHBondContact O-CE 3.13Å; L540-L667 HydrophobicContact CD2-CD2 3.99Å; L540-L667 HydrophobicContact CD2-CG 3.99Å
541	G	82.6	Confident	73.9	Confident	15 Å²	15	53 Å²	53	16%	0.155	29%	0.287	C	S	.	.			trans	77.8	164.9	-175.3	0	0	0	0	0	113.8	K537 H543 H544	K537-G541 WeakPolarHBondContact O-CA 3.18Å; K537-G541 PolarHBondContact O-N 2.94Å; G541-H543 PolarHBondContact O-N 3.14Å; G541-H544 PolarHBondContact O-N 3.38Å; G541-H544 VanDerWaalsContact O-N 3.16Å
542	E	70.5	Confident	72.4	Confident	147 Å²	147	54.4 Å²	54.4	69%	0.687	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-63.2	-38	-171	-59.1	-165	135.3	0	0	113.9	H544 S545	E542-H544 PolarHBondContact O-N 3.25Å; E542-H544 VanDerWaalsContact O-N 3.16Å; E542-S545 WeakPolarHBondContact O-CB 3.48Å; E542-S545 PolarHBondContact O-N 3.11Å; E542-S545 PolarHBondContact O-OG 3.24Å
543	H	62.2	Low	71.1	Confident	181 Å²	181	57.9 Å²	57.9	84%	0.838	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-64.7	-18.2	178.6	-63.9	-61.2	0	0	0	114.2	G541	G541-H543 PolarHBondContact O-N 3.14Å
544	H	59.9	Low	69.5	Low	37 Å²	37	62.6 Å²	62.6	17%	0.171	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-103.3	9.6	174.3	-67.2	-61.6	0	0	0	112.5	L540 G541 E542 T546 F547 P565 V566 H567	L540-H544 HydrophobicContact CB-CB 3.85Å; L540-H544 PolarHBondContact O-CD2 3.07Å; L540-H544 VanDerWaalsContact O-CD2 3.3Å; G541-H544 PolarHBondContact O-N 3.38Å; G541-H544 VanDerWaalsContact O-N 3.16Å; E542-H544 PolarHBondContact O-N 3.25Å; E542-H544 VanDerWaalsContact O-N 3.16Å; H544-T546 PolarHBondContact O-N 2.95Å; H544-T546 VanDerWaalsContact O-N 3.17Å; H544-F547 WeakPolarHBondContact O-CA 3.4Å; H544-F547 VanDerWaalsContact O-CB 3.3Å; H544-F547 WeakPolarHBondContact O-CB 3.23Å; H544-F547 PolarHBondContact O-N 2.93Å; H544-P565 WeakPolarHBondContact CE1-CB 3.24Å; H544-V566 VanDerWaalsContact NE2-C 3.32Å; H544-V566 PolarHBondContact NE2-O 3.46Å; H544-H567 AromaticContact NE2-ND1 3.95Å
545	S	50.1	Low	68.1	Low	49 Å²	49	60.7 Å²	60.7	34%	0.343	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-68.4	-9.6	-178.7	65.9	0	0	0	0	115.3	E542 F547 N548	E542-S545 WeakPolarHBondContact O-CB 3.48Å; E542-S545 PolarHBondContact O-N 3.11Å; E542-S545 PolarHBondContact O-OG 3.24Å; S545-F547 PolarHBondContact O-N 2.93Å; S545-N548 WeakPolarHBondContact O-CB 3.43Å; S545-N548 PolarHBondContact O-N 2.99Å
546	T	50.3	Low	67.1	Low	117 Å²	117	58.9 Å²	58.9	72%	0.718	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-63.1	-23.5	163.1	51.7	0	0	0	0	111.9	H544 N548 N552	H544-T546 PolarHBondContact O-N 2.95Å; H544-T546 VanDerWaalsContact O-N 3.17Å; T546-N548 PolarHBondContact O-N 3.48Å; T546-N552 PolarHBondContact O-ND2 2.83Å
547	F	58.4	Low	65.8	Low	7 Å²	7	65.4 Å²	65.4	3%	0.031	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-86.3	46	163.6	-155.1	-102.4	0	0	0	111.5	S536 L540 H544 S545 I549 F556 I562 P563 P565 I670	S536-F547 PolarHBondContact OG-O 3.17Å; L540-F547 HydrophobicContact CD1-CB 4.34Å; L540-F547 HydrophobicContact CD1-CD1 3.72Å; L540-F547 HydrophobicContact CD1-CG 4.47Å; H544-F547 WeakPolarHBondContact O-CA 3.4Å; H544-F547 VanDerWaalsContact O-CB 3.3Å; H544-F547 WeakPolarHBondContact O-CB 3.23Å; H544-F547 PolarHBondContact O-N 2.93Å; S545-F547 PolarHBondContact O-N 2.93Å; F547-I549 VanDerWaalsContact C-N 3.29Å; F547-I549 HydrophobicContact CD1-CD1 4.14Å; F547-I549 HydrophobicContact CD1-CG1 3.63Å; F547-I549 HydrophobicContact CE1-CD1 3.88Å; F547-I549 HydrophobicContact CE1-CG1 3.51Å; F547-I549 HydrophobicContact CZ-CG1 4.45Å; F547-I549 PolarHBondContact O-N 2.83Å; F547-F556 HydrophobicContact CE1-CE2 4.21Å; F547-F556 AromaticContact CE1-CZ 3.94Å; F547-F556 HydrophobicContact CE1-CZ 3.94Å; F547-F556 AromaticContact CZ-CE2 3.79Å; F547-F556 HydrophobicContact CZ-CE2 3.79Å; F547-F556 AromaticContact CZ-CZ 3.59Å; F547-F556 HydrophobicContact CZ-CZ 3.59Å; F547-I562 HydrophobicContact CE2-CG2 4.03Å; F547-I562 HydrophobicContact CZ-CG2 3.93Å; F547-P563 WeakPolarHBondContact CE2-O 3.39Å; F547-P565 HydrophobicContact CB-CG 3.44Å; F547-P565 VanDerWaalsContact CB-CG 3.44Å; F547-P565 HydrophobicContact CD1-CG 4.22Å; F547-P565 HydrophobicContact CD2-CG 3.64Å; F547-P565 HydrophobicContact CE2-CG 4.43Å; F547-P565 HydrophobicContact CG-CG 3.51Å; F547-I670 HydrophobicContact CE1-CD1 3.84Å; F547-I670 HydrophobicContact CZ-CD1 4.48Å
548	N	60	Low	64.4	Low	67 Å²	67	68.2 Å²	68.2	36%	0.358	34%	0.343	S	S	.	.			trans	-65.7	93.2	164.8	174.9	10.1	0	0	0	108.1	S545 T546 N550 S551 N552	S545-N548 WeakPolarHBondContact O-CB 3.43Å; S545-N548 PolarHBondContact O-N 2.99Å; T546-N548 PolarHBondContact O-N 3.48Å; N548-N550 PolarHBondContact O-N 3.09Å; N548-N550 WeakPolarHBondContact OD1-CB 3.25Å; N548-N550 PolarHBondContact OD1-N 2.78Å; N548-N550 VanDerWaalsContact OD1-N 3.14Å; N548-S551 WeakPolarHBondContact CB-OG 3.46Å; N548-S551 PolarHBondContact ND2-OG 2.92Å; N548-S551 PolarHBondContact O-N 2.88Å; N548-S551 PolarHBondContact O-OG 3.45Å; N548-S551 PolarHBondContact OD1-N 3.34Å; N548-N552 VanDerWaalsContact O-CB 3.26Å; N548-N552 WeakPolarHBondContact O-CB 3.32Å; N548-N552 VanDerWaalsContact O-CG 3.22Å; N548-N552 PolarHBondContact O-N 3.3Å; N548-N552 PolarHBondContact O-OD1 3Å
549	I	61.2	Low	63.1	Low	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-29.6	-178.1	-59.5	164.8	0	0	0	111.3	L532 F533 F547 N552 K553 F556 Y678	L532-I549 HydrophobicContact CD1-CD1 3.84Å; L532-I549 HydrophobicContact CD2-CD1 4.28Å; L532-I549 HydrophobicContact CG-CD1 3.74Å; F533-I549 HydrophobicContact CD1-CB 4.37Å; F533-I549 HydrophobicContact CD1-CD1 4.04Å; F533-I549 HydrophobicContact CD1-CG2 3.58Å; F533-I549 HydrophobicContact CE1-CD1 4.11Å; F533-I549 HydrophobicContact CE1-CG2 3.74Å; F547-I549 VanDerWaalsContact C-N 3.29Å; F547-I549 HydrophobicContact CD1-CD1 4.14Å; F547-I549 HydrophobicContact CD1-CG1 3.63Å; F547-I549 HydrophobicContact CE1-CD1 3.88Å; F547-I549 HydrophobicContact CE1-CG1 3.51Å; F547-I549 HydrophobicContact CZ-CG1 4.45Å; F547-I549 PolarHBondContact O-N 2.83Å; I549-N552 CarbonylContact O-C 3.58Å; I549-N552 PolarHBondContact O-N 2.78Å; I549-K553 WeakPolarHBondContact O-CG 3.33Å; I549-K553 PolarHBondContact O-N 2.83Å; I549-F556 HydrophobicContact CB-CE2 4.29Å; I549-F556 HydrophobicContact CG1-CE2 4.08Å; I549-F556 HydrophobicContact CG1-CZ 4.29Å; I549-F556 HydrophobicContact CG2-CD2 4.12Å; I549-F556 HydrophobicContact CG2-CE2 3.59Å; I549-F556 HydrophobicContact CG2-CZ 4.09Å; I549-Y678 HydrophobicContact CG2-CD2 4.15Å; I549-Y678 HydrophobicContact CG2-CE2 4.38Å
550	N	57.5	Low	61.7	Low	63 Å²	63	75.9 Å²	75.9	34%	0.337	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-20.6	-178.5	-67.5	-42.3	0	0	0	114.3	F533 N548 K553	F533-N550 PolarHBondContact O-ND2 3.44Å; N548-N550 PolarHBondContact O-N 3.09Å; N548-N550 WeakPolarHBondContact OD1-CB 3.25Å; N548-N550 PolarHBondContact OD1-N 2.78Å; N548-N550 VanDerWaalsContact OD1-N 3.14Å; N550-K553 WeakPolarHBondContact O-CE 3.43Å
551	S	58.7	Low	60.6	Low	65 Å²	65	82.5 Å²	82.5	46%	0.455	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-34.8	160.8	57.8	0	0	0	0	111.8	N548 K553	N548-S551 WeakPolarHBondContact CB-OG 3.46Å; N548-S551 PolarHBondContact ND2-OG 2.92Å; N548-S551 PolarHBondContact O-N 2.88Å; N548-S551 PolarHBondContact O-OG 3.45Å; N548-S551 PolarHBondContact OD1-N 3.34Å; S551-K553 PolarHBondContact O-N 3.09Å
552	N	58.6	Low	60.2	Low	31 Å²	31	82.3 Å²	82.3	17%	0.166	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	16.4	-173.6	-62.7	2.8	0	0	0	113.1	T546 N548 I549 N554 I555 F556	T546-N552 PolarHBondContact O-ND2 2.83Å; N548-N552 VanDerWaalsContact O-CB 3.26Å; N548-N552 WeakPolarHBondContact O-CB 3.32Å; N548-N552 VanDerWaalsContact O-CG 3.22Å; N548-N552 PolarHBondContact O-N 3.3Å; N548-N552 PolarHBondContact O-OD1 3Å; I549-N552 CarbonylContact O-C 3.58Å; I549-N552 PolarHBondContact O-N 2.78Å; N552-N554 PolarHBondContact O-N 3.19Å; N552-N554 VanDerWaalsContact O-N 3.16Å; N552-I555 HydrophobicContact CB-CB 4.38Å; N552-I555 HydrophobicContact CB-CD1 3.81Å; N552-I555 HydrophobicContact CB-CG1 4Å; N552-I555 WeakPolarHBondContact O-CA 3.47Å; N552-I555 VanDerWaalsContact O-CB 3.26Å; N552-I555 WeakPolarHBondContact O-CB 3.48Å; N552-I555 PolarHBondContact O-N 3.33Å; N552-F556 PolarHBondContact O-N 3.17Å
553	K	62.1	Low	60.4	Low	79 Å²	79	78.1 Å²	78.1	34%	0.343	39%	0.392	S	S	.	.	H	α-helix	trans	-48.9	-41.4	172.2	-60.1	-175.5	177.1	-173.2	0	111.2	I549 N550 S551 I555 F556 Y557 Y678	I549-K553 WeakPolarHBondContact O-CG 3.33Å; I549-K553 PolarHBondContact O-N 2.83Å; N550-K553 WeakPolarHBondContact O-CE 3.43Å; S551-K553 PolarHBondContact O-N 3.09Å; K553-I555 PolarHBondContact O-N 2.87Å; K553-F556 PolarHBondContact O-N 2.83Å; K553-Y557 HydrophobicContact CB-CD2 4.33Å; K553-Y557 HydrophobicContact CB-CE2 4.1Å; K553-Y557 WeakPolarHBondContact O-CD2 3.38Å; K553-Y557 PolarHBondContact O-N 3.22Å; K553-Y678 WeakPolarHBondContact CB-OH 3.41Å; K553-Y678 WeakPolarHBondContact CD-OH 3.48Å; K553-Y678 HydrophobicContact CG-CE2 4.27Å; K553-Y678 WeakPolarHBondContact CG-OH 3.47Å
554	N	55.8	Low	61.3	Low	100 Å²	100	70.2 Å²	70.2	54%	0.535	36%	0.356	S	S	.	.	H	α-helix	trans	-56.9	-30.9	174.3	-73.7	-29.6	0	0	0	114.2	N552 R558	N552-N554 PolarHBondContact O-N 3.19Å; N552-N554 VanDerWaalsContact O-N 3.16Å; N554-R558 VanDerWaalsContact O-CB 3.28Å; N554-R558 WeakPolarHBondContact O-CB 3.41Å; N554-R558 VanDerWaalsContact O-CG 3.29Å; N554-R558 WeakPolarHBondContact O-CG 3.48Å; N554-R558 PolarHBondContact O-N 3.5Å
555	I	59.2	Low	62.4	Low	45 Å²	45	69.2 Å²	69.2	23%	0.231	35%	0.352	C	S	.	.	H	α-helix	trans	-71.8	-45.3	177.7	-55.5	-170.7	0	0	0	110.1	N552 K553 Y557 R558 N559 P563	N552-I555 HydrophobicContact CB-CB 4.38Å; N552-I555 HydrophobicContact CB-CD1 3.81Å; N552-I555 HydrophobicContact CB-CG1 4Å; N552-I555 WeakPolarHBondContact O-CA 3.47Å; N552-I555 VanDerWaalsContact O-CB 3.26Å; N552-I555 WeakPolarHBondContact O-CB 3.48Å; N552-I555 PolarHBondContact O-N 3.33Å; K553-I555 PolarHBondContact O-N 2.87Å; I555-Y557 VanDerWaalsContact C-N 3.3Å; I555-Y557 PolarHBondContact O-N 3.04Å; I555-R558 PolarHBondContact O-N 2.91Å; I555-N559 WeakPolarHBondContact O-CB 3.35Å; I555-N559 PolarHBondContact O-N 2.87Å; I555-N559 VanDerWaalsContact O-N 3.09Å; I555-P563 HydrophobicContact CG2-CG 3.7Å
556	F	66.2	Low	64.2	Low	9 Å²	9	70.9 Å²	70.9	4%	0.039	36%	0.36	C	S	.	.	H	α-helix	trans	-66.3	-30	175.9	-73.1	-94.8	0	0	0	113	F547 I549 N552 K553 I562 Y678	F547-F556 HydrophobicContact CE1-CE2 4.21Å; F547-F556 AromaticContact CE1-CZ 3.94Å; F547-F556 HydrophobicContact CE1-CZ 3.94Å; F547-F556 AromaticContact CZ-CE2 3.79Å; F547-F556 HydrophobicContact CZ-CE2 3.79Å; F547-F556 AromaticContact CZ-CZ 3.59Å; F547-F556 HydrophobicContact CZ-CZ 3.59Å; I549-F556 HydrophobicContact CB-CE2 4.29Å; I549-F556 HydrophobicContact CG1-CE2 4.08Å; I549-F556 HydrophobicContact CG1-CZ 4.29Å; I549-F556 HydrophobicContact CG2-CD2 4.12Å; I549-F556 HydrophobicContact CG2-CE2 3.59Å; I549-F556 HydrophobicContact CG2-CZ 4.09Å; N552-F556 PolarHBondContact O-N 3.17Å; K553-F556 PolarHBondContact O-N 2.83Å; F556-I562 HydrophobicContact CD1-CD1 3.49Å; F556-I562 VanDerWaalsContact CD1-CD1 3.49Å; F556-I562 HydrophobicContact CD1-CG1 4.08Å; F556-I562 HydrophobicContact CE1-CD1 3.56Å; F556-I562 HydrophobicContact CE1-CG1 4.3Å; F556-I562 HydrophobicContact CE1-CG2 4.36Å; F556-I562 HydrophobicContact CG-CD1 4.44Å; F556-I562 HydrophobicContact CZ-CG2 4.32Å; F556-Y678 HydrophobicContact CB-CD1 3.55Å; F556-Y678 HydrophobicContact CB-CE1 4.12Å; F556-Y678 HydrophobicContact CB-CG 3.85Å; F556-Y678 HydrophobicContact CD1-CD1 4.45Å; F556-Y678 AromaticContact CD1-CG 3.96Å; F556-Y678 HydrophobicContact CD1-CG 3.96Å; F556-Y678 HydrophobicContact CG-CD1 4.13Å; F556-Y678 HydrophobicContact CG-CD2 4.43Å; F556-Y678 AromaticContact CG-CG 3.88Å; F556-Y678 HydrophobicContact CG-CG 3.88Å
557	Y	59.8	Low	66.2	Low	145 Å²	145	66.1 Å²	66.1	57%	0.569	33%	0.33	S	S	*	.	H	α-helix	trans	-80	-35.5	175.7	-72	-56.7	0	0	0	114.4	K553 I555 Y678	K553-Y557 HydrophobicContact CB-CD2 4.33Å; K553-Y557 HydrophobicContact CB-CE2 4.1Å; K553-Y557 WeakPolarHBondContact O-CD2 3.38Å; K553-Y557 PolarHBondContact O-N 3.22Å; I555-Y557 VanDerWaalsContact C-N 3.3Å; I555-Y557 PolarHBondContact O-N 3.04Å; Y557-Y678 HydrophobicContact CD1-CE1 4.48Å; Y557-Y678 HydrophobicContact CD2-CE1 4.46Å; Y557-Y678 AromaticContact CE1-CE1 3.93Å; Y557-Y678 HydrophobicContact CE1-CE1 3.93Å; Y557-Y678 AromaticContact CE2-CE1 3.9Å; Y557-Y678 HydrophobicContact CE2-CE1 3.9Å; Y557-Y678 AromaticContact CZ-CE1 3.6Å; Y557-Y678 PolarHBondContact OH-OH 2.89Å
558	R	54.7	Low	67.9	Low	200 Å²	200	68.5 Å²	68.5	76%	0.755	35%	0.345	S	S	*	.	H	α-helix	trans	-96	-29.5	-171.8	-67.4	-176.7	-174.7	-151.4	2.5	114.8	N554 I555	N554-R558 VanDerWaalsContact O-CB 3.28Å; N554-R558 WeakPolarHBondContact O-CB 3.41Å; N554-R558 VanDerWaalsContact O-CG 3.29Å; N554-R558 WeakPolarHBondContact O-CG 3.48Å; N554-R558 PolarHBondContact O-N 3.5Å; I555-R558 PolarHBondContact O-N 2.91Å
559	N	59.1	Low	69.5	Low	73 Å²	73	67.4 Å²	67.4	39%	0.39	34%	0.339	S	S	.	.			trans	-109.1	123.4	-169.1	-61.5	6.2	0	0	0	110.9	I555 N561	I555-N559 WeakPolarHBondContact O-CB 3.35Å; I555-N559 PolarHBondContact O-N 2.87Å; I555-N559 VanDerWaalsContact O-N 3.09Å; N559-N561 VanDerWaalsContact C-N 3.27Å; N559-N561 WeakPolarHBondContact CB-O 3.35Å; N559-N561 PolarHBondContact O-N 3.05Å
560	E	60.8	Low	71.1	Confident	163 Å²	163	69.1 Å²	69.1	76%	0.762	35%	0.347	S	S	*	.	S	Bend	trans	-61.5	-39.7	170.1	-57.9	-168.4	131.9	0	0	111.5
561	N	65.8	Low	72.9	Confident	140 Å²	140	66.1 Å²	66.1	75%	0.749	33%	0.331	S	S	*	.	S	Bend	trans	-96.8	104	173	-65.3	-53.7	0	0	0	109.8	N559 P563	N559-N561 VanDerWaalsContact C-N 3.27Å; N559-N561 WeakPolarHBondContact CB-O 3.35Å; N559-N561 PolarHBondContact O-N 3.05Å; N561-P563 WeakPolarHBondContact O-CD 3.45Å
562	I	73.3	Confident	74.6	Confident	11 Å²	11	65.7 Å²	65.7	6%	0.056	32%	0.32	C	S	.	.			trans	-69.3	123.6	174	-64	154.8	0	0	0	108.7	F547 F556 I564 I670 K675	F547-I562 HydrophobicContact CE2-CG2 4.03Å; F547-I562 HydrophobicContact CZ-CG2 3.93Å; F556-I562 HydrophobicContact CD1-CD1 3.49Å; F556-I562 VanDerWaalsContact CD1-CD1 3.49Å; F556-I562 HydrophobicContact CD1-CG1 4.08Å; F556-I562 HydrophobicContact CE1-CD1 3.56Å; F556-I562 HydrophobicContact CE1-CG1 4.3Å; F556-I562 HydrophobicContact CE1-CG2 4.36Å; F556-I562 HydrophobicContact CG-CD1 4.44Å; F556-I562 HydrophobicContact CZ-CG2 4.32Å; I562-I564 WeakPolarHBondContact O-CD1 3.42Å; I562-I564 PolarHBondContact O-N 3.23Å; I562-I670 HydrophobicContact CG2-CG2 4.49Å; I562-K675 HydrophobicContact CD1-CB 4.43Å
563	P	75.1	Confident	76.4	Confident	58 Å²	58	64.6 Å²	64.6	38%	0.377	31%	0.314	S	S	.	.			trans	-66.9	105.9	171.8	27.8	-33.5	0	0	0	109.8	F547 I555 N561	F547-P563 WeakPolarHBondContact CE2-O 3.39Å; I555-P563 HydrophobicContact CG2-CG 3.7Å; N561-P563 WeakPolarHBondContact O-CD 3.45Å
564	I	81.1	Confident	77.8	Confident	16 Å²	16	63.5 Å²	63.5	8%	0.082	31%	0.308	C	S	.	.			trans	-82.3	134.5	-179.7	-67.1	126.5	0	0	0	109.5	I562 V566 S589 L667 I670 T671	I562-I564 WeakPolarHBondContact O-CD1 3.42Å; I562-I564 PolarHBondContact O-N 3.23Å; I564-V566 PolarHBondContact O-N 2.79Å; I564-S589 PolarHBondContact N-OG 3.18Å; I564-S589 VanDerWaalsContact N-OG 3.13Å; I564-L667 HydrophobicContact CG2-CD2 4.11Å; I564-I670 HydrophobicContact CG1-CG2 4.08Å; I564-T671 HydrophobicContact CD1-CG2 3.67Å; I564-T671 WeakPolarHBondContact CD1-OG1 3.28Å
565	P	83.4	Confident	79.5	Confident	15 Å²	15	61.2 Å²	61.2	10%	0.097	30%	0.295	C	S	.	.			trans	-55.8	128.5	175.5	-27.6	37.2	0	0	0	111.8	H544 F547 H567 L667	H544-P565 WeakPolarHBondContact CE1-CB 3.24Å; F547-P565 HydrophobicContact CB-CG 3.44Å; F547-P565 VanDerWaalsContact CB-CG 3.44Å; F547-P565 HydrophobicContact CD1-CG 4.22Å; F547-P565 HydrophobicContact CD2-CG 3.64Å; F547-P565 HydrophobicContact CE2-CG 4.43Å; F547-P565 HydrophobicContact CG-CG 3.51Å; P565-H567 PolarHBondContact O-N 2.77Å; P565-H567 VanDerWaalsContact O-N 3.14Å; P565-L667 HydrophobicContact CB-CD2 4.35Å; P565-L667 HydrophobicContact CG-CD2 4.26Å
566	V	87.6	Confident	80.7	Confident	85 Å²	85	59.5 Å²	59.5	52%	0.515	29%	0.288	S	S	.	.			trans	-66.8	115.3	179.1	-179	0	0	0	0	109.1	H544 I564 H586 L587 N588	H544-V566 VanDerWaalsContact NE2-C 3.32Å; H544-V566 PolarHBondContact NE2-O 3.46Å; I564-V566 PolarHBondContact O-N 2.79Å; V566-H586 WeakPolarHBondContact CG1-CE1 3.38Å; V566-L587 WeakPolarHBondContact CA-O 3.36Å; V566-N588 HydrophobicContact CG2-CB 4.03Å
567	H	92.3	Very high	81.4	Confident	16 Å²	16	68 Å²	68	7%	0.074	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	138.8	-177	-173.6	72.1	0	0	0	110.5	H544 P565 H586 L587 W664 L667	H544-H567 AromaticContact NE2-ND1 3.95Å; P565-H567 PolarHBondContact O-N 2.77Å; P565-H567 VanDerWaalsContact O-N 3.14Å; H567-H586 WeakPolarHBondContact O-CA 3.44Å; H567-L587 PolarHBondContact N-O 3.32Å; H567-L587 PolarHBondContact O-N 3.33Å; H567-W664 AromaticContact CD2-CD2 3.9Å; H567-W664 AromaticContact CD2-CE2 3.58Å; H567-W664 AromaticContact CD2-CH2 3.78Å; H567-W664 AromaticContact CD2-CZ2 3.54Å; H567-W664 AromaticContact NE2-CE2 3.65Å; H567-W664 AromaticContact NE2-CZ2 3.9Å; H567-W664 AromaticContact NE2-NE1 3.67Å; H567-L667 HydrophobicContact CB-CD1 3.46Å; H567-L667 VanDerWaalsContact CB-CD1 3.46Å
568	T	93.2	Very high	82.7	Confident	57 Å²	57	64.1 Å²	64.1	35%	0.35	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	117.6	-178.8	-52.6	0	0	0	0	109.6	Y584 C585 H586 M600	T568-Y584 HydrophobicContact CG2-CD1 4.48Å; T568-C585 WeakPolarHBondContact CA-O 3.35Å; T568-H586 HydrophobicContact CG2-CB 4.38Å; T568-H586 PolarHBondContact OG1-ND1 3.46Å; T568-M600 HydrophobicContact CG2-SD 4.04Å
569	D	93.9	Very high	84.4	Confident	45 Å²	45	63.3 Å²	63.3	24%	0.241	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	173.9	-177.9	-173.4	23	0	0	0	109.7	C585 S660 W664	D569-C585 PolarHBondContact N-O 3.01Å; D569-C585 VanDerWaalsContact N-O 3.15Å; D569-C585 PolarHBondContact O-N 3.48Å; D569-S660 WeakPolarHBondContact OD2-CB 3.26Å; D569-S660 PolarHBondContact OD2-OG 3.17Å; D569-W664 HydrophobicContact CB-CZ2 3.92Å
570	Q	94.5	Very high	86	Confident	36 Å²	36	62.6 Å²	62.6	17%	0.168	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	128.7	176.9	-69.1	-178.7	-2.2	0	0	112.3	R583 Y584 I656	Q570-R583 CarbonylContact C-O 3.36Å; Q570-R583 VanDerWaalsContact CA-O 3.27Å; Q570-R583 WeakPolarHBondContact CA-O 3.4Å; Q570-Y584 HydrophobicContact CG-CD1 3.77Å; Q570-Y584 HydrophobicContact CG-CD2 4.03Å; Q570-Y584 HydrophobicContact CG-CE1 3.67Å; Q570-Y584 HydrophobicContact CG-CE2 3.95Å; Q570-Y584 HydrophobicContact CG-CG 3.96Å; Q570-Y584 PolarHBondContact NE2-OH 3.29Å; Q570-Y584 VanDerWaalsContact NE2-OH 3.16Å; Q570-I656 HydrophobicContact CB-CD1 3.7Å; Q570-I656 WeakPolarHBondContact O-CD1 3.47Å
571	L	95.8	Very high	87.6	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	149.9	168.8	-67.1	175.5	0	0	0	110.3	L573 R582 R583 C585 F592 M635 M653 A655 W664	L571-L573 HydrophobicContact CB-CD2 3.92Å; L571-L573 HydrophobicContact CB-CG 4.29Å; L571-L573 HydrophobicContact CD1-CD2 4.24Å; L571-R582 CarbonylContact O-C 3.58Å; L571-R582 WeakPolarHBondContact O-CA 3.38Å; L571-R583 PolarHBondContact N-O 3.48Å; L571-R583 PolarHBondContact O-N 2.91Å; L571-C585 HydrophobicContact CD1-CB 4.18Å; L571-C585 HydrophobicContact CG-CB 4.47Å; L571-F592 HydrophobicContact CD1-CE2 4.43Å; L571-F592 HydrophobicContact CD1-CZ 4.11Å; L571-M635 HydrophobicContact CD2-CE 4.49Å; L571-M653 HydrophobicContact CD1-CB 4.44Å; L571-M653 HydrophobicContact CD1-SD 4.34Å; L571-A655 HydrophobicContact CD2-CB 3.93Å; L571-W664 HydrophobicContact CD1-CD2 3.92Å; L571-W664 HydrophobicContact CD1-CE3 4.32Å; L571-W664 HydrophobicContact CD1-CG 4.27Å; L571-W664 HydrophobicContact CD1-CZ2 4.24Å; L571-W664 HydrophobicContact CD2-CD2 4.44Å; L571-W664 HydrophobicContact CD2-CG 4.09Å; L571-W664 HydrophobicContact CG-CD2 4.38Å; L571-W664 HydrophobicContact CG-CZ2 4.32Å
572	Y	95.3	Very high	89	Confident	56 Å²	56	57.7 Å²	57.7	22%	0.22	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	129.5	155.9	-59.8	-87.8	0	0	0	108	R582 P630 T631 M653 C654 I656	Y572-R582 HydrophobicContact CD1-CB 3.71Å; Y572-R582 HydrophobicContact CD1-CG 4.18Å; Y572-R582 HydrophobicContact CE1-CB 3.74Å; Y572-R582 HydrophobicContact CE1-CG 3.99Å; Y572-R582 HydrophobicContact CG-CB 4.49Å; Y572-R582 PolarHBondContact OH-NH1 3.47Å; Y572-P630 HydrophobicContact CD1-CB 3.96Å; Y572-P630 HydrophobicContact CD1-CG 4.2Å; Y572-P630 HydrophobicContact CD2-CB 4Å; Y572-P630 HydrophobicContact CE1-CB 4.29Å; Y572-P630 HydrophobicContact CE2-CB 4.32Å; Y572-P630 HydrophobicContact CG-CB 3.81Å; Y572-P630 HydrophobicContact CG-CG 4.09Å; Y572-T631 HydrophobicContact CD2-CG2 4.42Å; Y572-T631 HydrophobicContact CE2-CG2 4.12Å; Y572-M653 CarbonylContact O-C 3.52Å; Y572-M653 WeakPolarHBondContact O-CA 3.11Å; Y572-C654 HydrophobicContact CD2-CB 4.47Å; Y572-C654 PolarHBondContact N-O 3.01Å; Y572-C654 PolarHBondContact O-N 2.9Å; Y572-I656 HydrophobicContact CE2-CG1 4.29Å
573	L	94.6	Very high	89.9	Confident	8 Å²	8	59.8 Å²	59.8	4%	0.042	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	140.2	-178.4	-61.6	179.9	0	0	0	111.9	L571 W580 K581 R583 V594 E652 M653	L571-L573 HydrophobicContact CB-CD2 3.92Å; L571-L573 HydrophobicContact CB-CG 4.29Å; L571-L573 HydrophobicContact CD1-CD2 4.24Å; L573-W580 CarbonylContact O-C 3.58Å; L573-W580 WeakPolarHBondContact O-CA 2.83Å; L573-K581 PolarHBondContact N-O 3.44Å; L573-K581 PolarHBondContact O-N 2.72Å; L573-R583 HydrophobicContact CD1-CB 4.07Å; L573-R583 HydrophobicContact CD1-CG 4.04Å; L573-V594 HydrophobicContact CD1-CB 4.16Å; L573-V594 HydrophobicContact CD1-CG1 3.43Å; L573-V594 VanDerWaalsContact CD1-CG1 3.43Å; L573-V594 HydrophobicContact CD1-CG2 3.56Å; L573-E652 WeakPolarHBondContact CA-O 3.45Å; L573-M653 HydrophobicContact CD2-CB 4.11Å; L573-M653 HydrophobicContact CD2-CG 3.62Å; L573-M653 HydrophobicContact CD2-SD 4.27Å
574	R	92.1	Very high	90.8	Very high	55 Å²	55	60.2 Å²	60.2	21%	0.208	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	123.5	167.4	159.3	161.9	177	-147.3	25.6	107.9	G576 T578 W580 E628 E652	R574-G576 WeakPolarHBondContact CG-O 3.49Å; R574-T578 WeakPolarHBondContact CD-O 3.36Å; R574-T578 VanDerWaalsContact CG-O 3.24Å; R574-T578 WeakPolarHBondContact CG-O 3.46Å; R574-W580 HydrophobicContact CB-CD2 3.67Å; R574-W580 HydrophobicContact CB-CE3 3.64Å; R574-W580 HydrophobicContact CB-CG 4.26Å; R574-W580 HydrophobicContact CB-CH2 4.27Å; R574-W580 HydrophobicContact CB-CZ2 4.29Å; R574-W580 HydrophobicContact CB-CZ3 3.95Å; R574-E628 IonicContact CZ-OE2 3.78Å; R574-E628 IonicContact NH1-OE2 2.91Å; R574-E628 PolarHBondContact NH1-OE2 2.81Å; R574-E628 IonicContact NH2-OE2 3.06Å; R574-E628 PolarHBondContact NH2-OE2 3.39Å; R574-E652 HydrophobicContact CB-CB 3.99Å; R574-E652 WeakPolarHBondContact CD-OE2 3.36Å; R574-E652 HydrophobicContact CG-CB 4.2Å; R574-E652 WeakPolarHBondContact CG-OE2 3.33Å; R574-E652 IonicContact CZ-OE1 3.73Å; R574-E652 IonicContact CZ-OE2 2.8Å; R574-E652 PolarHBondContact N-O 3.2Å; R574-E652 IonicContact NE-OE1 3.16Å; R574-E652 IonicContact NE-OE2 3.74Å; R574-E652 PolarHBondContact NE-OE2 3.26Å; R574-E652 IonicContact NH1-OE1 2.78Å; R574-E652 IonicContact NH1-OE2 3.67Å; R574-E652 PolarHBondContact NH1-OE2 3Å; R574-E652 PolarHBondContact O-N 3.45Å
575	I	90.9	Very high	91.5	Very high	52 Å²	52	59.5 Å²	59.5	27%	0.267	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	109.4	-178.6	-56.3	179.5	0	0	0	106.7	Q577 T578 L608 I651	I575-Q577 PolarHBondContact O-N 2.85Å; I575-T578 PolarHBondContact N-OG1 2.82Å; I575-T578 WeakPolarHBondContact O-CB 3.33Å; I575-T578 WeakPolarHBondContact O-CG2 3.47Å; I575-T578 PolarHBondContact O-N 3.37Å; I575-T578 PolarHBondContact O-OG1 2.97Å; I575-L608 HydrophobicContact CD1-CD1 3.85Å; I575-L608 HydrophobicContact CD1-CD2 3.99Å; I575-I651 HydrophobicContact CG1-CG1 4.31Å; I575-I651 HydrophobicContact CG2-CG1 4.14Å
576	G	84.9	Confident	92	Very high	9 Å²	9	60.4 Å²	60.4	9%	0.093	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	-134	-167.6	0	0	0	0	0	112.5	R574 T578 S647 I650	R574-G576 WeakPolarHBondContact CG-O 3.49Å; G576-T578 PolarHBondContact O-N 2.69Å; G576-S647 WeakPolarHBondContact CA-O 3.05Å; G576-S647 PolarHBondContact N-O 3.21Å; G576-I650 PolarHBondContact N-O 2.69Å
577	Q	80.8	Confident	92.2	Very high	187 Å²	187	56.3 Å²	56.3	87%	0.874	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	19.1	-176.5	-64.3	173.2	-21.9	0	0	114.8	I575	I575-Q577 PolarHBondContact O-N 2.85Å
578	T	87.6	Confident	92	Very high	64 Å²	64	56.8 Å²	56.8	39%	0.393	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-86.1	142	178.4	56.5	0	0	0	0	112.3	R574 I575 G576	R574-T578 WeakPolarHBondContact CD-O 3.36Å; R574-T578 VanDerWaalsContact CG-O 3.24Å; R574-T578 WeakPolarHBondContact CG-O 3.46Å; I575-T578 PolarHBondContact N-OG1 2.82Å; I575-T578 WeakPolarHBondContact O-CB 3.33Å; I575-T578 WeakPolarHBondContact O-CG2 3.47Å; I575-T578 PolarHBondContact O-N 3.37Å; I575-T578 PolarHBondContact O-OG1 2.97Å; G576-T578 PolarHBondContact O-N 2.69Å
579	K	90.6	Very high	91.5	Very high	184 Å²	184	57 Å²	57	80%	0.8	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-61.9	141.5	172.7	-63.3	-166.9	177.6	-167.5	0	111.3
580	W	93.7	Very high	91	Very high	58 Å²	58	60.3 Å²	60.3	22%	0.22	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-47.4	132.9	176.3	-70.2	107.8	0	0	0	113.5	L573 R574 E628 P630 E652 C654	L573-W580 CarbonylContact O-C 3.58Å; L573-W580 WeakPolarHBondContact O-CA 2.83Å; R574-W580 HydrophobicContact CB-CD2 3.67Å; R574-W580 HydrophobicContact CB-CE3 3.64Å; R574-W580 HydrophobicContact CB-CG 4.26Å; R574-W580 HydrophobicContact CB-CH2 4.27Å; R574-W580 HydrophobicContact CB-CZ2 4.29Å; R574-W580 HydrophobicContact CB-CZ3 3.95Å; W580-E628 PolarHBondContact NE1-O 3.33Å; W580-P630 HydrophobicContact CB-CG 4.03Å; W580-P630 HydrophobicContact CD2-CG 3.77Å; W580-P630 VanDerWaalsContact CE2-CD 3.48Å; W580-P630 HydrophobicContact CE3-CG 4.13Å; W580-P630 HydrophobicContact CG-CG 3.74Å; W580-E652 HydrophobicContact CH2-CB 3.69Å; W580-E652 HydrophobicContact CZ2-CB 4.28Å; W580-E652 HydrophobicContact CZ3-CB 4.2Å; W580-C654 HydrophobicContact CH2-CB 4.29Å; W580-C654 VanDerWaalsContact CH2-SG 3.6Å; W580-C654 HydrophobicContact CZ3-CB 4.07Å
581	K	93.3	Very high	90.7	Very high	109 Å²	109	58.6 Å²	58.6	47%	0.474	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	124.3	177.7	-71.8	165.8	-169.2	174	0	110.5	L573 R583	L573-K581 PolarHBondContact N-O 3.44Å; L573-K581 PolarHBondContact O-N 2.72Å; K581-R583 HydrophobicContact CB-CG 4.48Å; K581-R583 PolarHBondContact O-N 3.41Å
582	R	94.5	Very high	90.6	Very high	90 Å²	90	58.6 Å²	58.6	34%	0.34	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	121.1	169.9	-166.4	169	170.6	160.3	-8.5	110	L571 Y572	L571-R582 CarbonylContact O-C 3.58Å; L571-R582 WeakPolarHBondContact O-CA 3.38Å; Y572-R582 HydrophobicContact CD1-CB 3.71Å; Y572-R582 HydrophobicContact CD1-CG 4.18Å; Y572-R582 HydrophobicContact CE1-CB 3.74Å; Y572-R582 HydrophobicContact CE1-CG 3.99Å; Y572-R582 HydrophobicContact CG-CB 4.49Å; Y572-R582 PolarHBondContact OH-NH1 3.47Å
583	R	93.8	Very high	90.6	Very high	56 Å²	56	58.3 Å²	58.3	21%	0.211	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	147.7	-176.1	-60	-55.3	-160.5	172	14.3	110.3	Q570 L571 L573 K581 V594 S595 K596 Q597	Q570-R583 CarbonylContact C-O 3.36Å; Q570-R583 VanDerWaalsContact CA-O 3.27Å; Q570-R583 WeakPolarHBondContact CA-O 3.4Å; L571-R583 PolarHBondContact N-O 3.48Å; L571-R583 PolarHBondContact O-N 2.91Å; L573-R583 HydrophobicContact CD1-CB 4.07Å; L573-R583 HydrophobicContact CD1-CG 4.04Å; K581-R583 HydrophobicContact CB-CG 4.48Å; K581-R583 PolarHBondContact O-N 3.41Å; R583-V594 HydrophobicContact CB-CG1 3.85Å; R583-V594 HydrophobicContact CG-CG1 3.82Å; R583-S595 WeakPolarHBondContact CD-O 3.48Å; R583-K596 VanDerWaalsContact CZ-O 3.22Å; R583-K596 PolarHBondContact NH1-O 2.81Å; R583-K596 PolarHBondContact NH2-O 3.49Å; R583-Q597 WeakPolarHBondContact CD-O 3.45Å; R583-Q597 VanDerWaalsContact NH1-CA 3.26Å; R583-Q597 PolarHBondContact NH1-O 2.59Å
584	Y	94.2	Very high	90.5	Very high	67 Å²	67	58.5 Å²	58.5	26%	0.263	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	131.5	156.2	-79.9	-85.4	0	0	0	109.7	T568 Q570 S595 K598 M600	T568-Y584 HydrophobicContact CG2-CD1 4.48Å; Q570-Y584 HydrophobicContact CG-CD1 3.77Å; Q570-Y584 HydrophobicContact CG-CD2 4.03Å; Q570-Y584 HydrophobicContact CG-CE1 3.67Å; Q570-Y584 HydrophobicContact CG-CE2 3.95Å; Q570-Y584 HydrophobicContact CG-CG 3.96Å; Q570-Y584 PolarHBondContact NE2-OH 3.29Å; Q570-Y584 VanDerWaalsContact NE2-OH 3.16Å; Y584-S595 WeakPolarHBondContact CA-OG 3.22Å; Y584-S595 WeakPolarHBondContact CB-OG 3.35Å; Y584-S595 PolarHBondContact N-OG 3.38Å; Y584-S595 WeakPolarHBondContact O-CB 3.4Å; Y584-S595 PolarHBondContact O-N 3.44Å; Y584-S595 PolarHBondContact O-OG 2.88Å; Y584-K598 VanDerWaalsContact CD2-O 3.24Å; Y584-K598 WeakPolarHBondContact CD2-O 3.44Å; Y584-K598 VanDerWaalsContact CE2-O 3.29Å; Y584-K598 WeakPolarHBondContact CE2-O 3.35Å; Y584-M600 HydrophobicContact CD1-CB 3.98Å; Y584-M600 HydrophobicContact CD1-CG 4.4Å; Y584-M600 HydrophobicContact CD2-CB 3.74Å; Y584-M600 HydrophobicContact CE1-CB 4.13Å; Y584-M600 HydrophobicContact CE2-CB 3.89Å; Y584-M600 HydrophobicContact CG-CB 3.77Å; Y584-M600 HydrophobicContact CG-CG 4.38Å
585	C	95	Very high	90.5	Very high	0 Å²	0	56 Å²	56	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	146.9	173.9	-57.6	0	0	0	0	108.7	T568 D569 L571 F592 Y593 W664	T568-C585 WeakPolarHBondContact CA-O 3.35Å; D569-C585 PolarHBondContact N-O 3.01Å; D569-C585 VanDerWaalsContact N-O 3.15Å; D569-C585 PolarHBondContact O-N 3.48Å; L571-C585 HydrophobicContact CD1-CB 4.18Å; L571-C585 HydrophobicContact CG-CB 4.47Å; C585-F592 HydrophobicContact CB-CE1 4.49Å; C585-F592 HydrophobicContact CB-CE2 4.26Å; C585-F592 HydrophobicContact CB-CZ 3.87Å; C585-Y593 CarbonylContact C-O 3.41Å; C585-Y593 VanDerWaalsContact CA-O 3.32Å; C585-Y593 WeakPolarHBondContact CA-O 3.21Å; C585-W664 HydrophobicContact CB-CH2 3.61Å; C585-W664 HydrophobicContact CB-CZ2 3.81Å; C585-W664 HydrophobicContact CB-CZ3 4.46Å
586	H	93.2	Very high	90.3	Very high	34 Å²	34	59.7 Å²	59.7	16%	0.157	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	124.9	-177.1	174.3	85.6	0	0	0	108.9	V566 H567 T568 N588 F592 Y593 L605	V566-H586 WeakPolarHBondContact CG1-CE1 3.38Å; H567-H586 WeakPolarHBondContact O-CA 3.44Å; T568-H586 HydrophobicContact CG2-CB 4.38Å; T568-H586 PolarHBondContact OG1-ND1 3.46Å; H586-N588 PolarHBondContact CD2-ND2 3.03Å; H586-N588 VanDerWaalsContact CD2-ND2 3.34Å; H586-N588 PolarHBondContact NE2-ND2 3.3Å; H586-F592 CarbonylContact O-C 3.47Å; H586-Y593 PolarHBondContact N-O 2.85Å; H586-Y593 PolarHBondContact O-N 2.83Å; H586-L605 HydrophobicContact CB-CD1 4.37Å
587	L	93.2	Very high	90.2	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	134	178.7	175	61.1	0	0	0	109.6	V566 H567 G591 F592 F611 W664 L667 L668 T671	V566-L587 WeakPolarHBondContact CA-O 3.36Å; H567-L587 PolarHBondContact N-O 3.32Å; H567-L587 PolarHBondContact O-N 3.33Å; L587-G591 WeakPolarHBondContact CA-O 3.47Å; L587-F592 HydrophobicContact CB-CD2 4.31Å; L587-F592 HydrophobicContact CD1-CB 4.24Å; L587-F592 HydrophobicContact CD1-CD2 4.47Å; L587-F611 HydrophobicContact CD1-CZ 3.96Å; L587-W664 HydrophobicContact CB-CH2 4.4Å; L587-W664 HydrophobicContact CB-CZ3 3.79Å; L587-W664 HydrophobicContact CD2-CZ3 4.29Å; L587-L667 HydrophobicContact CD2-CB 3.66Å; L587-L668 HydrophobicContact CD2-CD2 4.35Å; L587-T671 HydrophobicContact CD1-CG2 4.45Å
588	N	88.1	Confident	90.2	Very high	26 Å²	26	62.5 Å²	62.5	14%	0.139	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	173.9	173.5	62.8	50.4	0	0	0	108.8	V566 H586 N590 G591	V566-N588 HydrophobicContact CG2-CB 4.03Å; H586-N588 PolarHBondContact CD2-ND2 3.03Å; H586-N588 VanDerWaalsContact CD2-ND2 3.34Å; H586-N588 PolarHBondContact NE2-ND2 3.3Å; N588-N590 PolarHBondContact O-N 2.77Å; N588-N590 WeakPolarHBondContact OD1-CA 3.32Å; N588-N590 VanDerWaalsContact OD1-CB 3.31Å; N588-N590 WeakPolarHBondContact OD1-CB 3.39Å; N588-N590 PolarHBondContact OD1-N 2.73Å; N588-G591 PolarHBondContact N-O 3.12Å; N588-G591 VanDerWaalsContact N-O 3.08Å; N588-G591 PolarHBondContact O-N 3.3Å; N588-G591 PolarHBondContact OD1-N 2.77Å; N588-G591 VanDerWaalsContact OD1-N 3.15Å
589	S	82.6	Confident	89.7	Confident	60 Å²	60	65 Å²	65	42%	0.42	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-21.3	-179.5	-42.6	0	0	0	0	115.2	I564	I564-S589 PolarHBondContact N-OG 3.18Å; I564-S589 VanDerWaalsContact N-OG 3.13Å
590	N	83.4	Confident	89.1	Confident	115 Å²	115	60.9 Å²	60.9	62%	0.615	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-19.6	179.2	-59.4	-12.8	0	0	0	112.6	N588 R607	N588-N590 PolarHBondContact O-N 2.77Å; N588-N590 WeakPolarHBondContact OD1-CA 3.32Å; N588-N590 VanDerWaalsContact OD1-CB 3.31Å; N588-N590 WeakPolarHBondContact OD1-CB 3.39Å; N588-N590 PolarHBondContact OD1-N 2.73Å; N590-R607 VanDerWaalsContact O-CZ 3.28Å; N590-R607 PolarHBondContact O-NE 2.98Å; N590-R607 PolarHBondContact O-NH2 2.8Å
591	G	88	Confident	88.2	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.3	-179	176.6	0	0	0	0	0	116.8	L587 N588 Y593	L587-G591 WeakPolarHBondContact CA-O 3.47Å; N588-G591 PolarHBondContact N-O 3.12Å; N588-G591 VanDerWaalsContact N-O 3.08Å; N588-G591 PolarHBondContact O-N 3.3Å; N588-G591 PolarHBondContact OD1-N 2.77Å; N588-G591 VanDerWaalsContact OD1-N 3.15Å; G591-Y593 VanDerWaalsContact C-CE2 3.42Å; G591-Y593 VanDerWaalsContact O-CD2 3.25Å; G591-Y593 WeakPolarHBondContact O-CD2 3.31Å; G591-Y593 VanDerWaalsContact O-CE2 3.29Å; G591-Y593 WeakPolarHBondContact O-CE2 3.49Å
592	F	93.3	Very high	87.4	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	128.7	174.2	-176.8	-86.3	0	0	0	108.5	L571 C585 H586 L587 V594 R607 L608 I610 F611 M653 W664 L668	L571-F592 HydrophobicContact CD1-CE2 4.43Å; L571-F592 HydrophobicContact CD1-CZ 4.11Å; C585-F592 HydrophobicContact CB-CE1 4.49Å; C585-F592 HydrophobicContact CB-CE2 4.26Å; C585-F592 HydrophobicContact CB-CZ 3.87Å; H586-F592 CarbonylContact O-C 3.47Å; L587-F592 HydrophobicContact CB-CD2 4.31Å; L587-F592 HydrophobicContact CD1-CB 4.24Å; L587-F592 HydrophobicContact CD1-CD2 4.47Å; F592-V594 HydrophobicContact CD1-CG2 4.04Å; F592-V594 HydrophobicContact CE1-CG2 3.51Å; F592-V594 HydrophobicContact CZ-CG2 4.45Å; F592-R607 CarbonylContact O-C 3.52Å; F592-R607 WeakPolarHBondContact O-CA 3.32Å; F592-L608 HydrophobicContact CD1-CB 4.17Å; F592-L608 HydrophobicContact CD1-CD1 4.09Å; F592-L608 HydrophobicContact CD1-CG 4.23Å; F592-L608 HydrophobicContact CE1-CD1 3.96Å; F592-L608 PolarHBondContact O-N 2.87Å; F592-I610 HydrophobicContact CB-CD1 3.57Å; F592-I610 HydrophobicContact CB-CG1 3.96Å; F592-I610 HydrophobicContact CD1-CD1 4.32Å; F592-I610 HydrophobicContact CD2-CD1 4.03Å; F592-I610 HydrophobicContact CG-CD1 3.75Å; F592-I610 HydrophobicContact CG-CG1 4.49Å; F592-F611 HydrophobicContact CB-CE2 3.98Å; F592-F611 HydrophobicContact CB-CZ 4.09Å; F592-M653 HydrophobicContact CE2-SD 4.43Å; F592-M653 HydrophobicContact CZ-SD 3.94Å; F592-W664 AromaticContact CD2-CZ3 3.98Å; F592-W664 HydrophobicContact CD2-CZ3 3.98Å; F592-W664 AromaticContact CE2-CE3 3.98Å; F592-W664 HydrophobicContact CE2-CE3 3.98Å; F592-W664 HydrophobicContact CE2-CH2 4.13Å; F592-W664 AromaticContact CE2-CZ3 3.47Å; F592-W664 HydrophobicContact CE2-CZ3 3.47Å; F592-W664 VanDerWaalsContact CE2-CZ3 3.47Å; F592-L668 HydrophobicContact CD2-CD2 3.87Å; F592-L668 HydrophobicContact CE2-CD2 4.12Å
593	Y	94.2	Very high	86.3	Confident	49 Å²	49	63.1 Å²	63.1	19%	0.192	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	139	-168.7	-62.1	-99.8	0	0	0	110.6	C585 H586 G591 L605 T606 R607	C585-Y593 CarbonylContact C-O 3.41Å; C585-Y593 VanDerWaalsContact CA-O 3.32Å; C585-Y593 WeakPolarHBondContact CA-O 3.21Å; H586-Y593 PolarHBondContact N-O 2.85Å; H586-Y593 PolarHBondContact O-N 2.83Å; G591-Y593 VanDerWaalsContact C-CE2 3.42Å; G591-Y593 VanDerWaalsContact O-CD2 3.25Å; G591-Y593 WeakPolarHBondContact O-CD2 3.31Å; G591-Y593 VanDerWaalsContact O-CE2 3.29Å; G591-Y593 WeakPolarHBondContact O-CE2 3.49Å; Y593-L605 HydrophobicContact CD1-CB 4.48Å; Y593-T606 CarbonylContact C-O 3.59Å; Y593-T606 WeakPolarHBondContact CA-O 3.39Å; Y593-R607 HydrophobicContact CD1-CB 3.76Å; Y593-R607 HydrophobicContact CD1-CG 4.13Å; Y593-R607 HydrophobicContact CE1-CB 3.69Å; Y593-R607 HydrophobicContact CE1-CG 3.81Å
594	V	93.4	Very high	85.7	Confident	12 Å²	12	63.7 Å²	63.7	7%	0.073	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	131.8	-174.5	177	0	0	0	0	111	L573 R583 F592 T606 L608	L573-V594 HydrophobicContact CD1-CB 4.16Å; L573-V594 HydrophobicContact CD1-CG1 3.43Å; L573-V594 VanDerWaalsContact CD1-CG1 3.43Å; L573-V594 HydrophobicContact CD1-CG2 3.56Å; R583-V594 HydrophobicContact CB-CG1 3.85Å; R583-V594 HydrophobicContact CG-CG1 3.82Å; F592-V594 HydrophobicContact CD1-CG2 4.04Å; F592-V594 HydrophobicContact CE1-CG2 3.51Å; F592-V594 HydrophobicContact CZ-CG2 4.45Å; V594-T606 PolarHBondContact N-O 3.12Å; V594-T606 PolarHBondContact O-N 2.78Å; V594-L608 HydrophobicContact CG2-CD1 3.69Å; V594-L608 HydrophobicContact CG2-CG 3.89Å
595	S	93.1	Very high	85.4	Confident	2 Å²	2	63 Å²	63	1%	0.014	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	139.2	177	52.7	0	0	0	0	113.1	R583 Y584 Q597	R583-S595 WeakPolarHBondContact CD-O 3.48Å; Y584-S595 WeakPolarHBondContact CA-OG 3.22Å; Y584-S595 WeakPolarHBondContact CB-OG 3.35Å; Y584-S595 PolarHBondContact N-OG 3.38Å; Y584-S595 WeakPolarHBondContact O-CB 3.4Å; Y584-S595 PolarHBondContact O-N 3.44Å; Y584-S595 PolarHBondContact O-OG 2.88Å; S595-Q597 PolarHBondContact O-N 3.47Å; S595-Q597 PolarHBondContact OG-O 2.66Å
596	K	86.4	Confident	85.1	Confident	130 Å²	130	66 Å²	66	57%	0.565	33%	0.334	S	S	*	.	S	Bend	trans	-69.2	-17.8	175.2	-72.1	-179.7	179.3	176.1	0	114.1	R583 Q604	R583-K596 VanDerWaalsContact CZ-O 3.22Å; R583-K596 PolarHBondContact NH1-O 2.81Å; R583-K596 PolarHBondContact NH2-O 3.49Å; K596-Q604 HydrophobicContact CB-CB 4.36Å; K596-Q604 HydrophobicContact CD-CB 4.42Å; K596-Q604 PolarHBondContact N-O 2.76Å
597	Q	82.7	Confident	85	Confident	98 Å²	98	71 Å²	71	46%	0.458	35%	0.352	S	S	.	.	S	Bend	trans	-121.2	-169.5	-176.9	-62.4	-167.6	-4.3	0	0	111.9	R583 S595	R583-Q597 WeakPolarHBondContact CD-O 3.45Å; R583-Q597 VanDerWaalsContact NH1-CA 3.26Å; R583-Q597 PolarHBondContact NH1-O 2.59Å; S595-Q597 PolarHBondContact O-N 3.47Å; S595-Q597 PolarHBondContact OG-O 2.66Å
598	K	79.8	Confident	84.9	Confident	158 Å²	158	72.2 Å²	72.2	69%	0.687	36%	0.358	S	S	*	.	S	Bend	trans	-86.2	-16	169.5	-75.8	-173	176.9	-178.7	0	112.8	Y584	Y584-K598 VanDerWaalsContact CD2-O 3.24Å; Y584-K598 WeakPolarHBondContact CD2-O 3.44Å; Y584-K598 VanDerWaalsContact CE2-O 3.29Å; Y584-K598 WeakPolarHBondContact CE2-O 3.35Å
599	I	77.7	Confident	84.6	Confident	116 Å²	116	75.5 Å²	75.5	60%	0.595	38%	0.376	S	S	*	.	S	Bend	trans	-93.1	144.5	-176.6	-55.3	175.1	0	0	0	109.2	N601	I599-N601 PolarHBondContact O-N 3.22Å
600	M	77.3	Confident	84.7	Confident	97 Å²	97	72.7 Å²	72.7	48%	0.478	36%	0.356	S	S	.	.			trans	-71.2	93.5	173.4	-176.1	-173	64	0	0	109.8	T568 Y584	T568-M600 HydrophobicContact CG2-SD 4.04Å; Y584-M600 HydrophobicContact CD1-CB 3.98Å; Y584-M600 HydrophobicContact CD1-CG 4.4Å; Y584-M600 HydrophobicContact CD2-CB 3.74Å; Y584-M600 HydrophobicContact CE1-CB 4.13Å; Y584-M600 HydrophobicContact CE2-CB 3.89Å; Y584-M600 HydrophobicContact CG-CB 3.77Å; Y584-M600 HydrophobicContact CG-CG 4.38Å
601	N	75.9	Confident	84.7	Confident	49 Å²	49	70.4 Å²	70.4	26%	0.262	34%	0.341	S	S	.	.			trans	-111.9	107.5	169	-173.3	-3.8	0	0	0	110.1	I599 S603 Q604	I599-N601 PolarHBondContact O-N 3.22Å; N601-S603 PolarHBondContact ND2-OG 2.81Å; N601-S603 PolarHBondContact O-N 2.96Å; N601-S603 PolarHBondContact OD1-N 3.02Å; N601-S603 VanDerWaalsContact OD1-N 3.17Å; N601-S603 PolarHBondContact OD1-OG 3.47Å; N601-Q604 HydrophobicContact CB-CB 4.44Å; N601-Q604 PolarHBondContact O-N 3.48Å
602	K	75.1	Confident	84.3	Confident	155 Å²	155	74 Å²	74	67%	0.674	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-60.6	-28.8	-178.3	-68.8	-176.5	178.8	178.9	0	113	Q604	K602-Q604 VanDerWaalsContact C-N 3.27Å; K602-Q604 PolarHBondContact O-N 2.59Å
603	S	72.1	Confident	83.6	Confident	101 Å²	101	79.3 Å²	79.3	71%	0.706	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-78	-7.4	177.4	69.1	0	0	0	0	114.3	N601	N601-S603 PolarHBondContact ND2-OG 2.81Å; N601-S603 PolarHBondContact O-N 2.96Å; N601-S603 PolarHBondContact OD1-N 3.02Å; N601-S603 VanDerWaalsContact OD1-N 3.17Å; N601-S603 PolarHBondContact OD1-OG 3.47Å
604	Q	81.7	Confident	83.1	Confident	68 Å²	68	81.9 Å²	81.9	32%	0.318	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-121.3	35.4	-179.2	-61.5	-168.8	7.8	0	0	112.7	K596 N601 K602	K596-Q604 HydrophobicContact CB-CB 4.36Å; K596-Q604 HydrophobicContact CD-CB 4.42Å; K596-Q604 PolarHBondContact N-O 2.76Å; N601-Q604 HydrophobicContact CB-CB 4.44Å; N601-Q604 PolarHBondContact O-N 3.48Å; K602-Q604 VanDerWaalsContact C-N 3.27Å; K602-Q604 PolarHBondContact O-N 2.59Å
605	L	87.2	Confident	82.9	Confident	53 Å²	53	82.2 Å²	82.2	28%	0.277	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	134.2	172.9	-71.4	179.2	0	0	0	111.4	H586 Y593	H586-L605 HydrophobicContact CB-CD1 4.37Å; Y593-L605 HydrophobicContact CD1-CB 4.48Å
606	T	89.8	Confident	82.8	Confident	61 Å²	61	84.4 Å²	84.4	37%	0.374	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	119.2	177.4	-50.4	0	0	0	0	108.8	Y593 V594	Y593-T606 CarbonylContact C-O 3.59Å; Y593-T606 WeakPolarHBondContact CA-O 3.39Å; V594-T606 PolarHBondContact N-O 3.12Å; V594-T606 PolarHBondContact O-N 2.78Å
607	R	90.9	Very high	83.2	Confident	141 Å²	141	79.1 Å²	79.1	53%	0.532	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	134.5	177.9	-164.1	178.3	-178.2	-146.9	1.2	109.9	N590 F592 Y593	N590-R607 VanDerWaalsContact O-CZ 3.28Å; N590-R607 PolarHBondContact O-NE 2.98Å; N590-R607 PolarHBondContact O-NH2 2.8Å; F592-R607 CarbonylContact O-C 3.52Å; F592-R607 WeakPolarHBondContact O-CA 3.32Å; Y593-R607 HydrophobicContact CD1-CB 3.76Å; Y593-R607 HydrophobicContact CD1-CG 4.13Å; Y593-R607 HydrophobicContact CE1-CB 3.69Å; Y593-R607 HydrophobicContact CE1-CG 3.81Å
608	L	89.7	Confident	83.8	Confident	24 Å²	24	74.5 Å²	74.5	13%	0.126	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	144.4	169.7	-58.6	-169.6	0	0	0	110.5	I575 F592 V594 I610 I651	I575-L608 HydrophobicContact CD1-CD1 3.85Å; I575-L608 HydrophobicContact CD1-CD2 3.99Å; F592-L608 HydrophobicContact CD1-CB 4.17Å; F592-L608 HydrophobicContact CD1-CD1 4.09Å; F592-L608 HydrophobicContact CD1-CG 4.23Å; F592-L608 HydrophobicContact CE1-CD1 3.96Å; F592-L608 PolarHBondContact O-N 2.87Å; V594-L608 HydrophobicContact CG2-CD1 3.69Å; V594-L608 HydrophobicContact CG2-CG 3.89Å; L608-I610 VanDerWaalsContact C-N 3.27Å; L608-I610 HydrophobicContact CB-CG2 4.42Å; L608-I610 PolarHBondContact O-N 3.47Å; L608-I610 VanDerWaalsContact O-N 3.13Å; L608-I651 HydrophobicContact CB-CD1 4.27Å; L608-I651 HydrophobicContact CD1-CD1 4.02Å; L608-I651 HydrophobicContact CD1-CG2 4.21Å
609	N	83.3	Confident	84.5	Confident	96 Å²	96	67.5 Å²	67.5	51%	0.513	35%	0.345	S	S	.	.			trans	-89.6	51.6	-176.8	-66.2	-10.5	0	0	0	112	F611 Q612	N609-F611 VanDerWaalsContact C-N 3.28Å; N609-F611 PolarHBondContact O-N 2.92Å; N609-Q612 HydrophobicContact CB-CG 4.28Å; N609-Q612 WeakPolarHBondContact O-CG 3.45Å
610	I	84.4	Confident	85.3	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.321	C	S	.	.			trans	-73.1	-18.7	178.6	57.1	168.4	0	0	0	113.5	F592 L608 Q612 L615 V637 I651 L668 L672	F592-I610 HydrophobicContact CB-CD1 3.57Å; F592-I610 HydrophobicContact CB-CG1 3.96Å; F592-I610 HydrophobicContact CD1-CD1 4.32Å; F592-I610 HydrophobicContact CD2-CD1 4.03Å; F592-I610 HydrophobicContact CG-CD1 3.75Å; F592-I610 HydrophobicContact CG-CG1 4.49Å; L608-I610 VanDerWaalsContact C-N 3.27Å; L608-I610 HydrophobicContact CB-CG2 4.42Å; L608-I610 PolarHBondContact O-N 3.47Å; L608-I610 VanDerWaalsContact O-N 3.13Å; I610-Q612 VanDerWaalsContact C-N 3.28Å; I610-Q612 PolarHBondContact O-N 3.16Å; I610-L615 WeakPolarHBondContact O-CD1 3.11Å; I610-V637 HydrophobicContact CB-CG1 4.09Å; I610-V637 HydrophobicContact CG2-CB 4.28Å; I610-V637 HydrophobicContact CG2-CG1 4.13Å; I610-V637 HydrophobicContact CG2-CG2 4.42Å; I610-I651 HydrophobicContact CG2-CB 4.43Å; I610-I651 HydrophobicContact CG2-CD1 3.46Å; I610-I651 VanDerWaalsContact CG2-CD1 3.46Å; I610-I651 HydrophobicContact CG2-CG2 4.45Å; I610-L668 HydrophobicContact CD1-CD2 3.46Å; I610-L668 VanDerWaalsContact CD1-CD2 3.46Å; I610-L672 VanDerWaalsContact O-CD2 3.28Å; I610-L672 WeakPolarHBondContact O-CD2 3.32Å
611	F	82.1	Confident	85.8	Confident	68 Å²	68	59.5 Å²	59.5	30%	0.298	31%	0.305	S	S	.	.			trans	-92.8	38.9	-179	-47.5	-63.6	0	0	0	112.8	L587 F592 N609 T671 L672	L587-F611 HydrophobicContact CD1-CZ 3.96Å; F592-F611 HydrophobicContact CB-CE2 3.98Å; F592-F611 HydrophobicContact CB-CZ 4.09Å; N609-F611 VanDerWaalsContact C-N 3.28Å; N609-F611 PolarHBondContact O-N 2.92Å; F611-T671 HydrophobicContact CD1-CG2 3.81Å; F611-T671 HydrophobicContact CE1-CG2 3.25Å; F611-T671 HydrophobicContact CE2-CG2 4.11Å; F611-T671 HydrophobicContact CG-CG2 4.46Å; F611-T671 HydrophobicContact CZ-CG2 3.41Å; F611-T671 VanDerWaalsContact CZ-CG2 3.41Å; F611-L672 HydrophobicContact CD1-CD2 3.73Å; F611-L672 HydrophobicContact CD1-CG 4.09Å; F611-L672 HydrophobicContact CE1-CD2 4.17Å; F611-L672 HydrophobicContact CE1-CG 4.12Å
612	Q	79.9	Confident	85.5	Confident	75 Å²	75	59 Å²	59	35%	0.35	31%	0.306	S	S	.	.	S	Bend	trans	-87.4	147.1	170.7	-68.4	-176.2	-3.2	0	0	110.1	N609 I610 L615 L649	N609-Q612 HydrophobicContact CB-CG 4.28Å; N609-Q612 WeakPolarHBondContact O-CG 3.45Å; I610-Q612 VanDerWaalsContact C-N 3.28Å; I610-Q612 PolarHBondContact O-N 3.16Å; Q612-L615 HydrophobicContact CB-CD1 3.78Å; Q612-L615 HydrophobicContact CB-CG 4.08Å; Q612-L615 HydrophobicContact CG-CD1 4.49Å; Q612-L615 WeakPolarHBondContact O-CB 3.41Å; Q612-L615 PolarHBondContact O-N 3.07Å; Q612-L649 VanDerWaalsContact OE1-CD2 3.32Å
613	P	80	Confident	84.8	Confident	112 Å²	112	55.2 Å²	55.2	73%	0.727	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	148.5	173.3	26.4	-35	0	0	0	110.9	L615	P613-L615 PolarHBondContact O-N 3.39Å
614	N	82.2	Confident	83.9	Confident	104 Å²	104	55.8 Å²	55.8	56%	0.556	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	13.1	-177.6	-42	-32.6	0	0	0	115.2	Y616 P639	N614-Y616 WeakPolarHBondContact O-CD2 3.43Å; N614-Y616 VanDerWaalsContact O-CE2 3.32Å; N614-Y616 WeakPolarHBondContact O-CE2 3.46Å; N614-P639 WeakPolarHBondContact O-CA 3.38Å
615	L	88.6	Confident	82.7	Confident	18 Å²	18	53.7 Å²	53.7	9%	0.094	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	135.7	162.7	-62.1	-175.6	0	0	0	110	I610 Q612 P613 V637 P639 L649	I610-L615 WeakPolarHBondContact O-CD1 3.11Å; Q612-L615 HydrophobicContact CB-CD1 3.78Å; Q612-L615 HydrophobicContact CB-CG 4.08Å; Q612-L615 HydrophobicContact CG-CD1 4.49Å; Q612-L615 WeakPolarHBondContact O-CB 3.41Å; Q612-L615 PolarHBondContact O-N 3.07Å; P613-L615 PolarHBondContact O-N 3.39Å; L615-V637 HydrophobicContact CB-CG1 3.96Å; L615-V637 HydrophobicContact CD1-CG1 4.12Å; L615-P639 HydrophobicContact CD2-CB 4.41Å; L615-P639 HydrophobicContact CD2-CG 3.64Å; L615-L649 HydrophobicContact CD2-CB 4.31Å
616	Y	92.1	Very high	81.1	Confident	48 Å²	48	57.9 Å²	57.9	19%	0.188	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	148.7	-178.4	-59	-90.8	0	0	0	110.2	E504 Y509 N614 V637 R638 H640	E504-Y616 WeakPolarHBondContact OE1-CE1 3.43Å; Y509-Y616 HydrophobicContact CE1-CD1 4.43Å; Y509-Y616 AromaticContact CE1-CE1 3.63Å; Y509-Y616 HydrophobicContact CE1-CE1 3.63Å; Y509-Y616 AromaticContact CE1-CZ 3.74Å; N614-Y616 WeakPolarHBondContact O-CD2 3.43Å; N614-Y616 VanDerWaalsContact O-CE2 3.32Å; N614-Y616 WeakPolarHBondContact O-CE2 3.46Å; Y616-V637 WeakPolarHBondContact O-CA 3.37Å; Y616-R638 PolarHBondContact N-O 2.76Å; Y616-R638 PolarHBondContact O-N 2.74Å; Y616-R638 VanDerWaalsContact O-N 3.11Å; Y616-H640 HydrophobicContact CD2-CB 3.83Å; Y616-H640 HydrophobicContact CE2-CB 3.75Å
617	L	95.1	Very high	79.6	Confident	19 Å²	19	60.8 Å²	60.8	10%	0.099	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	120.3	176.6	-176	63.4	0	0	0	109.5	R498 M635 V637 M653 Y665 L668 R669 L672	R498-L617 WeakPolarHBondContact CB-O 3.46Å; L617-M635 HydrophobicContact CD1-CB 4.24Å; L617-V637 HydrophobicContact CD1-CG2 3.79Å; L617-M653 HydrophobicContact CD1-CE 4.49Å; L617-Y665 HydrophobicContact CD2-CD2 3.6Å; L617-Y665 HydrophobicContact CD2-CE2 3.63Å; L617-Y665 HydrophobicContact CD2-CG 4.43Å; L617-Y665 HydrophobicContact CG-CD2 4.12Å; L617-Y665 HydrophobicContact CG-CE2 3.93Å; L617-L668 HydrophobicContact CD2-CB 4.05Å; L617-R669 HydrophobicContact CD2-CB 4.11Å; L617-L672 HydrophobicContact CB-CD1 3.88Å; L617-L672 HydrophobicContact CD2-CD1 4.36Å
618	Y	94.8	Very high	79.1	Confident	1 Å²	1	59.4 Å²	59.4	0%	0.004	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	163.4	172.2	-60.9	-99.7	0	0	0	109.9	I491 L496 E497 R498 M635 V636 R638 H640	I491-Y618 HydrophobicContact CD1-CD1 4.35Å; I491-Y618 HydrophobicContact CD1-CE1 3.62Å; I491-Y618 HydrophobicContact CG1-CE1 4.47Å; L496-Y618 HydrophobicContact CB-CD1 4.15Å; L496-Y618 HydrophobicContact CB-CG 4.36Å; L496-Y618 HydrophobicContact CD1-CG 4.19Å; E497-Y618 CarbonylContact O-C 3.58Å; E497-Y618 WeakPolarHBondContact O-CA 3.28Å; R498-Y618 HydrophobicContact CB-CD1 3.9Å; R498-Y618 HydrophobicContact CB-CE1 4.37Å; R498-Y618 HydrophobicContact CB-CG 4.39Å; R498-Y618 HydrophobicContact CG-CD1 3.83Å; R498-Y618 HydrophobicContact CG-CE1 3.78Å; Y618-M635 CarbonylContact O-C 3.54Å; Y618-M635 VanDerWaalsContact O-CA 3.28Å; Y618-M635 WeakPolarHBondContact O-CA 3.41Å; Y618-V636 PolarHBondContact N-O 3.31Å; Y618-V636 PolarHBondContact O-N 2.96Å; Y618-R638 HydrophobicContact CD2-CG 3.53Å; Y618-R638 HydrophobicContact CE2-CG 3.5Å; Y618-R638 VanDerWaalsContact CE2-CG 3.5Å; Y618-H640 PolarHBondContact OH-CD2 3.24Å
619	I	95.3	Very high	78.9	Confident	12 Å²	12	59.1 Å²	59.1	6%	0.062	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	154.2	169.4	69.8	170.7	0	0	0	109.4	L496 E497 W661 Y665	L496-I619 WeakPolarHBondContact CA-O 3.23Å; E497-I619 HydrophobicContact CG-CD1 4.06Å; E497-I619 HydrophobicContact CG-CG1 3.6Å; E497-I619 PolarHBondContact N-O 2.93Å; E497-I619 PolarHBondContact O-N 3.39Å; I619-W661 HydrophobicContact CB-CZ2 4.4Å; I619-W661 HydrophobicContact CD1-CZ2 4.29Å; I619-W661 HydrophobicContact CG2-CZ2 3.88Å; I619-Y665 HydrophobicContact CG2-CD2 3.82Å; I619-Y665 HydrophobicContact CG2-CE2 3.46Å; I619-Y665 VanDerWaalsContact CG2-CE2 3.46Å
620	T	92.8	Very high	79.2	Confident	18 Å²	18	57.1 Å²	57.1	11%	0.11	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	130.3	177.5	50.9	0	0	0	0	110.8	L496 S622 G634 V636	L496-T620 HydrophobicContact CD2-CG2 4.24Å; T620-S622 PolarHBondContact O-N 3.27Å; T620-G634 PolarHBondContact N-O 3.07Å; T620-G634 WeakPolarHBondContact OG1-CA 3.29Å; T620-G634 PolarHBondContact OG1-N 2.98Å; T620-G634 PolarHBondContact OG1-O 3.26Å; T620-V636 HydrophobicContact CG2-CG2 4.45Å
621	I	88.1	Confident	79.6	Confident	26 Å²	26	58.2 Å²	58.2	13%	0.133	31%	0.31	C	S	.	.			trans	-70.6	128.2	170.6	-47.9	174.5	0	0	0	108	H495 E497 D623 N625	H495-I621 PolarHBondContact O-N 3.2Å; E497-I621 HydrophobicContact CB-CD1 4.25Å; E497-I621 HydrophobicContact CB-CG1 4.07Å; E497-I621 HydrophobicContact CG-CG1 3.95Å; I621-D623 VanDerWaalsContact C-N 3.32Å; I621-D623 WeakPolarHBondContact CG2-OD1 3.39Å; I621-D623 PolarHBondContact O-N 3.41Å; I621-N625 PolarHBondContact N-ND2 3.08Å; I621-N625 PolarHBondContact O-ND2 3.23Å
622	S	70.8	Confident	80	Confident	40 Å²	40	58.4 Å²	58.4	28%	0.28	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-3.1	-164.5	63.8	0	0	0	0	115.3	T620 Q626	T620-S622 PolarHBondContact O-N 3.27Å; S622-Q626 PolarHBondContact O-NE2 2.79Å
623	D	59	Low	80.7	Confident	74 Å²	74	57.5 Å²	57.5	40%	0.396	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-36	-172.9	64.4	-28.3	0	0	0	112.9	I621	I621-D623 VanDerWaalsContact C-N 3.32Å; I621-D623 WeakPolarHBondContact CG2-OD1 3.39Å; I621-D623 PolarHBondContact O-N 3.41Å
624	Q	54.2	Low	81.4	Confident	113 Å²	113	52.2 Å²	52.2	53%	0.528	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.7	-20.5	-171.8	-71.1	169.8	79.3	0	0	114.1	H495 Q626	H495-Q624 PolarHBondContact CE1-OE1 3.22Å; H495-Q624 VanDerWaalsContact CE1-OE1 3.27Å; Q624-Q626 VanDerWaalsContact C-N 3.27Å; Q624-Q626 PolarHBondContact O-N 3.06Å
625	N	56.2	Low	82	Confident	25 Å²	25	47.3 Å²	47.3	13%	0.134	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-74.1	-3.7	-175.8	-80.6	-54.5	0	0	0	116.2	H495 I621 T627 E628 S629	H495-N625 WeakPolarHBondContact CB-ND2 3.29Å; H495-N625 PolarHBondContact O-ND2 3.1Å; I621-N625 PolarHBondContact N-ND2 3.08Å; I621-N625 PolarHBondContact O-ND2 3.23Å; N625-T627 PolarHBondContact O-N 3.41Å; N625-E628 PolarHBondContact O-N 3.32Å; N625-S629 WeakPolarHBondContact O-CB 3.46Å; N625-S629 PolarHBondContact O-N 2.84Å; N625-S629 PolarHBondContact O-OG 2.8Å
626	Q	54.1	Low	82.3	Confident	140 Å²	140	46.8 Å²	46.8	65%	0.654	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-68	-17.2	-168.9	-62.7	-175.1	38.8	0	0	114.2	S622 Q624	S622-Q626 PolarHBondContact O-NE2 2.79Å; Q624-Q626 VanDerWaalsContact C-N 3.27Å; Q624-Q626 PolarHBondContact O-N 3.06Å
627	T	57.6	Low	82.4	Confident	122 Å²	122	44.5 Å²	44.5	75%	0.748	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-81	-31.7	177.3	50.8	0	0	0	0	113.5	N625	N625-T627 PolarHBondContact O-N 3.41Å
628	E	81.3	Confident	82.2	Confident	113 Å²	113	44.4 Å²	44.4	53%	0.528	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-29.1	178.2	-83	-155	-153.9	0	0	114.3	R574 W580 N625	R574-E628 IonicContact CZ-OE2 3.78Å; R574-E628 IonicContact NH1-OE2 2.91Å; R574-E628 PolarHBondContact NH1-OE2 2.81Å; R574-E628 IonicContact NH2-OE2 3.06Å; R574-E628 PolarHBondContact NH2-OE2 3.39Å; W580-E628 PolarHBondContact NE1-O 3.33Å; N625-E628 PolarHBondContact O-N 3.32Å
629	S	84.5	Confident	81.9	Confident	17 Å²	17	45.2 Å²	45.2	12%	0.119	25%	0.245	C	C	.	.			trans	-93.9	127.8	-171.1	-64.7	0	0	0	0	112.6	N625 T631	N625-S629 WeakPolarHBondContact O-CB 3.46Å; N625-S629 PolarHBondContact O-N 2.84Å; N625-S629 PolarHBondContact O-OG 2.8Å; S629-T631 PolarHBondContact O-N 2.8Å
630	P	91.2	Very high	81.2	Confident	55 Å²	55	45.2 Å²	45.2	36%	0.357	24%	0.244	S	C	.	.	S	Bend	trans	-61.6	-17.3	-177.8	-27.2	35.6	0	0	0	116.2	Y572 W580	Y572-P630 HydrophobicContact CD1-CB 3.96Å; Y572-P630 HydrophobicContact CD1-CG 4.2Å; Y572-P630 HydrophobicContact CD2-CB 4Å; Y572-P630 HydrophobicContact CE1-CB 4.29Å; Y572-P630 HydrophobicContact CE2-CB 4.32Å; Y572-P630 HydrophobicContact CG-CB 3.81Å; Y572-P630 HydrophobicContact CG-CG 4.09Å; W580-P630 HydrophobicContact CB-CG 4.03Å; W580-P630 HydrophobicContact CD2-CG 3.77Å; W580-P630 VanDerWaalsContact CE2-CD 3.48Å; W580-P630 HydrophobicContact CE3-CG 4.13Å; W580-P630 HydrophobicContact CG-CG 3.74Å
631	T	91.6	Very high	79.9	Confident	22 Å²	22	46.7 Å²	46.7	14%	0.135	26%	0.256	C	S	.	.	S	Bend	trans	-149.9	158	174	61.3	0	0	0	0	108.8	Y572 S629 F633 C654 A655	Y572-T631 HydrophobicContact CD2-CG2 4.42Å; Y572-T631 HydrophobicContact CE2-CG2 4.12Å; S629-T631 PolarHBondContact O-N 2.8Å; T631-F633 PolarHBondContact O-N 3.01Å; T631-C654 WeakPolarHBondContact OG1-CB 3.48Å; T631-A655 WeakPolarHBondContact CB-O 3.37Å; T631-A655 WeakPolarHBondContact CG2-O 3.24Å; T631-A655 PolarHBondContact OG1-O 2.82Å
632	P	91.5	Very high	78.3	Confident	72 Å²	72	47.5 Å²	47.5	47%	0.468	26%	0.262	S	S	.	.	S	Bend	trans	-69.6	-9.4	173.5	29.9	-36.9	0	0	0	113.4	G634	P632-G634 VanDerWaalsContact C-N 3.26Å; P632-G634 PolarHBondContact O-N 2.83Å; P632-G634 VanDerWaalsContact O-N 3.08Å
633	F	94	Very high	77.6	Confident	57 Å²	57	52.4 Å²	52.4	25%	0.25	28%	0.28	C	S	.	.			trans	-88	55.7	-174.8	-54.8	-63.6	0	0	0	111.9	T631 C654 A655 E658 W661	T631-F633 PolarHBondContact O-N 3.01Å; F633-C654 WeakPolarHBondContact O-CA 3.34Å; F633-A655 HydrophobicContact CB-CB 4.13Å; F633-A655 PolarHBondContact O-N 3.19Å; F633-E658 HydrophobicContact CD1-CB 4.17Å; F633-E658 HydrophobicContact CD1-CG 4.28Å; F633-E658 HydrophobicContact CE1-CB 3.56Å; F633-E658 HydrophobicContact CE1-CG 3.82Å; F633-E658 HydrophobicContact CZ-CB 3.93Å; F633-W661 HydrophobicContact CB-CB 3.97Å; F633-W661 HydrophobicContact CB-CG 4.06Å; F633-W661 HydrophobicContact CD1-CB 4.4Å; F633-W661 HydrophobicContact CG-CB 4.42Å
634	G	94.1	Very high	77.3	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	148.7	-176.6	0	0	0	0	0	114.5	T620 P632 M653 W661	T620-G634 PolarHBondContact N-O 3.07Å; T620-G634 WeakPolarHBondContact OG1-CA 3.29Å; T620-G634 PolarHBondContact OG1-N 2.98Å; T620-G634 PolarHBondContact OG1-O 3.26Å; P632-G634 VanDerWaalsContact C-N 3.26Å; P632-G634 PolarHBondContact O-N 2.83Å; P632-G634 VanDerWaalsContact O-N 3.08Å; G634-M653 CarbonylContact C-O 3.58Å; G634-M653 WeakPolarHBondContact CA-O 3.4Å; G634-W661 PolarHBondContact O-NE1 3.36Å
635	M	95.9	Very high	77.7	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	142.3	174.4	-61.5	168.9	-71.5	0	0	108.5	L571 L617 Y618 M653 W664 Y665 L668	L571-M635 HydrophobicContact CD2-CE 4.49Å; L617-M635 HydrophobicContact CD1-CB 4.24Å; Y618-M635 CarbonylContact O-C 3.54Å; Y618-M635 VanDerWaalsContact O-CA 3.28Å; Y618-M635 WeakPolarHBondContact O-CA 3.41Å; M635-M653 HydrophobicContact CB-CB 4.43Å; M635-M653 HydrophobicContact CB-CE 4.3Å; M635-M653 HydrophobicContact CE-CB 4.33Å; M635-M653 PolarHBondContact N-O 3.45Å; M635-M653 PolarHBondContact O-N 3.29Å; M635-M653 VanDerWaalsContact O-O 3.09Å; M635-W664 HydrophobicContact CE-CB 3.76Å; M635-W664 HydrophobicContact SD-CB 4.13Å; M635-Y665 HydrophobicContact CG-CD2 4.41Å; M635-Y665 HydrophobicContact SD-CD2 4.39Å; M635-L668 HydrophobicContact SD-CD1 4.25Å
636	V	94.3	Very high	78.6	Confident	8 Å²	8	56.3 Å²	56.3	5%	0.048	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	121.6	179	-173.8	0	0	0	0	110.2	L496 Y618 T620 R638 I650 I651 E652	L496-V636 HydrophobicContact CD1-CB 4.23Å; L496-V636 HydrophobicContact CD1-CG1 4.36Å; L496-V636 HydrophobicContact CD1-CG2 4.45Å; L496-V636 HydrophobicContact CD2-CB 4.16Å; L496-V636 HydrophobicContact CD2-CG2 3.64Å; Y618-V636 PolarHBondContact N-O 3.31Å; Y618-V636 PolarHBondContact O-N 2.96Å; T620-V636 HydrophobicContact CG2-CG2 4.45Å; V636-R638 HydrophobicContact CG1-CB 4.27Å; V636-R638 HydrophobicContact CG1-CG 4.15Å; V636-I650 HydrophobicContact CG1-CG2 4.2Å; V636-I651 WeakPolarHBondContact CA-O 3.48Å; V636-E652 HydrophobicContact CG1-CG 3.97Å; V636-E652 HydrophobicContact CG2-CB 4.37Å; V636-E652 HydrophobicContact CG2-CG 3.9Å
637	V	94.3	Very high	79.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	125	166.2	176.5	0	0	0	0	108.3	I610 L615 Y616 L617 I651 M653 L672	I610-V637 HydrophobicContact CB-CG1 4.09Å; I610-V637 HydrophobicContact CG2-CB 4.28Å; I610-V637 HydrophobicContact CG2-CG1 4.13Å; I610-V637 HydrophobicContact CG2-CG2 4.42Å; L615-V637 HydrophobicContact CB-CG1 3.96Å; L615-V637 HydrophobicContact CD1-CG1 4.12Å; Y616-V637 WeakPolarHBondContact O-CA 3.37Å; L617-V637 HydrophobicContact CD1-CG2 3.79Å; V637-I651 PolarHBondContact N-O 2.97Å; V637-I651 PolarHBondContact O-N 2.99Å; V637-M653 HydrophobicContact CG2-CE 3.81Å; V637-L672 HydrophobicContact CG2-CD1 4.44Å
638	R	91.5	Very high	81.1	Confident	17 Å²	17	53.5 Å²	53.5	6%	0.064	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	161.7	-178.2	56.5	166.6	-68.9	157.5	-3.5	113.1	L494 Y616 Y618 V636 I650	L494-R638 VanDerWaalsContact CD1-NH1 3.31Å; Y616-R638 PolarHBondContact N-O 2.76Å; Y616-R638 PolarHBondContact O-N 2.74Å; Y616-R638 VanDerWaalsContact O-N 3.11Å; Y618-R638 HydrophobicContact CD2-CG 3.53Å; Y618-R638 HydrophobicContact CE2-CG 3.5Å; Y618-R638 VanDerWaalsContact CE2-CG 3.5Å; V636-R638 HydrophobicContact CG1-CB 4.27Å; V636-R638 HydrophobicContact CG1-CG 4.15Å; R638-I650 HydrophobicContact CB-CG1 4.22Å; R638-I650 HydrophobicContact CB-CG2 4.47Å
639	P	88.3	Confident	81.3	Confident	17 Å²	17	50 Å²	50	11%	0.11	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	148.7	163.7	-19.6	32.5	0	0	0	112.5	N614 L615 A645 L649	N614-P639 WeakPolarHBondContact O-CA 3.38Å; L615-P639 HydrophobicContact CD2-CB 4.41Å; L615-P639 HydrophobicContact CD2-CG 3.64Å; P639-A645 HydrophobicContact CB-CB 4.37Å; P639-A645 HydrophobicContact CG-CB 4Å; P639-L649 HydrophobicContact CG-CB 4.22Å; P639-L649 HydrophobicContact CG-CD1 4.25Å
640	H	79.9	Confident	81.6	Confident	13 Å²	13	50.9 Å²	50.9	6%	0.06	27%	0.267	C	S	.	.	S	Bend	trans	-69.8	-35.1	171.3	-175.3	-95.1	0	0	0	112.3	E489 Y509 S512 W513 Y616 Y618 T642	E489-H640 IonicContact OE1-CD2 3.18Å; E489-H640 IonicContact OE1-NE2 3.89Å; E489-H640 PolarHBondContact OE1-NE2 2.87Å; E489-H640 VanDerWaalsContact OE1-NE2 3.16Å; E489-H640 IonicContact OE2-CD2 2.72Å; E489-H640 IonicContact OE2-NE2 2.74Å; Y509-H640 AromaticContact CD1-CD2 3.99Å; Y509-H640 AromaticContact CD1-NE2 3.87Å; Y509-H640 PolarHBondContact O-CE1 2.69Å; S512-H640 PolarHBondContact OG-CE1 2.74Å; S512-H640 VanDerWaalsContact OG-CE1 3.25Å; S512-H640 PolarHBondContact OG-ND1 3.17Å; W513-H640 AromaticContact CD1-CE1 3.21Å; W513-H640 AromaticContact CD1-NE2 3.56Å; W513-H640 AromaticContact NE1-CE1 3.33Å; W513-H640 PolarHBondContact NE1-CE1 3.41Å; W513-H640 VanDerWaalsContact NE1-CE1 3.33Å; W513-H640 AromaticContact NE1-NE2 3.15Å; W513-H640 PolarHBondContact NE1-NE2 3.46Å; W513-H640 VanDerWaalsContact NE1-NE2 3.15Å; Y616-H640 HydrophobicContact CD2-CB 3.83Å; Y616-H640 HydrophobicContact CE2-CB 3.75Å; Y618-H640 PolarHBondContact OH-CD2 3.24Å; H640-T642 PolarHBondContact O-N 2.72Å
641	S	66.1	Low	81.7	Confident	49 Å²	49	48.6 Å²	48.6	34%	0.343	25%	0.252	S	S	.	.			trans	-57.8	134.8	178.7	-180	0	0	0	0	112.6	Q643	S641-Q643 PolarHBondContact OG-N 3.47Å
642	T	55	Low	81.8	Confident	43 Å²	43	49.3 Å²	49.3	26%	0.264	25%	0.254	S	S	.	.			trans	-94.8	9.3	175.6	52.9	0	0	0	0	112.9	K514 H640	K514-T642 VanDerWaalsContact CD-OG1 3.31Å; K514-T642 WeakPolarHBondContact CD-OG1 3.16Å; K514-T642 VanDerWaalsContact CE-O 3.24Å; K514-T642 WeakPolarHBondContact CE-O 3.34Å; K514-T642 WeakPolarHBondContact CE-OG1 3.3Å; K514-T642 VanDerWaalsContact CG-OG1 3.32Å; K514-T642 WeakPolarHBondContact CG-OG1 3.4Å; K514-T642 PolarHBondContact NZ-O 2.97Å; H640-T642 PolarHBondContact O-N 2.72Å
643	Q	54.4	Low	82	Confident	143 Å²	143	45.9 Å²	45.9	67%	0.668	23%	0.232	S	C	*	.	S	Bend	trans	-106.9	115.9	175.3	-63.7	-176.1	3.3	0	0	110.4	S641 A645	S641-Q643 PolarHBondContact OG-N 3.47Å; Q643-A645 PolarHBondContact O-N 3.42Å
644	Q	54.1	Low	82.1	Confident	203 Å²	203	43.2 Å²	43.2	95%	0.949	22%	0.22	S	C	*	.			trans	39.8	43.4	168.3	-64.3	-175.3	-9.1	0	0	115.5	D646	Q644-D646 PolarHBondContact O-N 3.32Å; Q644-D646 VanDerWaalsContact O-N 3.14Å
645	A	63.1	Low	82.1	Confident	31 Å²	31	43.1 Å²	43.1	26%	0.256	22%	0.219	S	C	.	.			trans	-57.2	120.9	167.5	0	0	0	0	0	108.5	P639 Q643 S647 I650	P639-A645 HydrophobicContact CB-CB 4.37Å; P639-A645 HydrophobicContact CG-CB 4Å; Q643-A645 PolarHBondContact O-N 3.42Å; A645-S647 PolarHBondContact O-N 3.36Å; A645-I650 HydrophobicContact CB-CD1 4.45Å
646	D	74.9	Confident	82.1	Confident	59 Å²	59	46 Å²	46	32%	0.316	23%	0.234	S	C	.	.			trans	-52.2	117.8	173.8	176.5	-5	0	0	0	108.2	Q644 R648 L649	Q644-D646 PolarHBondContact O-N 3.32Å; Q644-D646 VanDerWaalsContact O-N 3.14Å; D646-R648 PolarHBondContact O-N 3.46Å; D646-R648 WeakPolarHBondContact OD1-CB 3.35Å; D646-R648 WeakPolarHBondContact OD1-CG 3.49Å; D646-R648 IonicContact OD1-CZ 2.73Å; D646-R648 PolarHBondContact OD1-N 3Å; D646-R648 VanDerWaalsContact OD1-N 3.16Å; D646-R648 IonicContact OD1-NE 4Å; D646-R648 PolarHBondContact OD1-NE 3.11Å; D646-R648 IonicContact OD1-NH2 3.74Å; D646-R648 IonicContact OD2-CZ 2.77Å; D646-R648 IonicContact OD2-NE 3.32Å; D646-R648 PolarHBondContact OD2-NE 3.34Å; D646-R648 IonicContact OD2-NH2 2.94Å; D646-R648 PolarHBondContact OD2-NH2 3.31Å; D646-L649 HydrophobicContact CB-CD1 4.11Å; D646-L649 HydrophobicContact CB-CG 4.13Å; D646-L649 VanDerWaalsContact O-CB 3.31Å; D646-L649 WeakPolarHBondContact O-CB 3.48Å; D646-L649 PolarHBondContact O-N 2.91Å
647	S	81.1	Confident	82.1	Confident	48 Å²	48	48.9 Å²	48.9	34%	0.336	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-61	-19	-170.7	62.2	0	0	0	0	112.5	G576 A645 L649 I650	G576-S647 WeakPolarHBondContact CA-O 3.05Å; G576-S647 PolarHBondContact N-O 3.21Å; A645-S647 PolarHBondContact O-N 3.36Å; S647-L649 PolarHBondContact O-N 3.48Å; S647-I650 PolarHBondContact O-N 2.85Å
648	R	82.8	Confident	82	Confident	155 Å²	155	52 Å²	52	59%	0.585	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-68.9	-15.5	173	-56.6	176.6	-66.4	159	-3.7	113.9	D646	D646-R648 PolarHBondContact O-N 3.46Å; D646-R648 WeakPolarHBondContact OD1-CB 3.35Å; D646-R648 WeakPolarHBondContact OD1-CG 3.49Å; D646-R648 IonicContact OD1-CZ 2.73Å; D646-R648 PolarHBondContact OD1-N 3Å; D646-R648 VanDerWaalsContact OD1-N 3.16Å; D646-R648 IonicContact OD1-NE 4Å; D646-R648 PolarHBondContact OD1-NE 3.11Å; D646-R648 IonicContact OD1-NH2 3.74Å; D646-R648 IonicContact OD2-CZ 2.77Å; D646-R648 IonicContact OD2-NE 3.32Å; D646-R648 PolarHBondContact OD2-NE 3.34Å; D646-R648 IonicContact OD2-NH2 2.94Å; D646-R648 PolarHBondContact OD2-NH2 3.31Å
649	L	85.8	Confident	82.1	Confident	41 Å²	41	56.4 Å²	56.4	22%	0.215	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-91.1	-9.9	173.6	-57.1	178.7	0	0	0	113	Q612 L615 P639 D646 S647	Q612-L649 VanDerWaalsContact OE1-CD2 3.32Å; L615-L649 HydrophobicContact CD2-CB 4.31Å; P639-L649 HydrophobicContact CG-CB 4.22Å; P639-L649 HydrophobicContact CG-CD1 4.25Å; D646-L649 HydrophobicContact CB-CD1 4.11Å; D646-L649 HydrophobicContact CB-CG 4.13Å; D646-L649 VanDerWaalsContact O-CB 3.31Å; D646-L649 WeakPolarHBondContact O-CB 3.48Å; D646-L649 PolarHBondContact O-N 2.91Å; S647-L649 PolarHBondContact O-N 3.48Å
650	I	90.3	Very high	82.4	Confident	34 Å²	34	55.9 Å²	55.9	17%	0.174	28%	0.281	C	S	.	.			trans	-93.2	112.1	175	-57.1	176.5	0	0	0	107.2	G576 V636 R638 A645 S647 E652	G576-I650 PolarHBondContact N-O 2.69Å; V636-I650 HydrophobicContact CG1-CG2 4.2Å; R638-I650 HydrophobicContact CB-CG1 4.22Å; R638-I650 HydrophobicContact CB-CG2 4.47Å; A645-I650 HydrophobicContact CB-CD1 4.45Å; S647-I650 PolarHBondContact O-N 2.85Å; I650-E652 HydrophobicContact CG2-CG 4.41Å
651	I	92.6	Very high	83.2	Confident	7 Å²	7	56.7 Å²	56.7	4%	0.036	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	101.2	-176.9	-67.7	162.3	0	0	0	107.7	I575 L608 I610 V636 V637 M653	I575-I651 HydrophobicContact CG1-CG1 4.31Å; I575-I651 HydrophobicContact CG2-CG1 4.14Å; L608-I651 HydrophobicContact CB-CD1 4.27Å; L608-I651 HydrophobicContact CD1-CD1 4.02Å; L608-I651 HydrophobicContact CD1-CG2 4.21Å; I610-I651 HydrophobicContact CG2-CB 4.43Å; I610-I651 HydrophobicContact CG2-CD1 3.46Å; I610-I651 VanDerWaalsContact CG2-CD1 3.46Å; I610-I651 HydrophobicContact CG2-CG2 4.45Å; V636-I651 WeakPolarHBondContact CA-O 3.48Å; V637-I651 PolarHBondContact N-O 2.97Å; V637-I651 PolarHBondContact O-N 2.99Å; I651-M653 HydrophobicContact CG2-CG 3.93Å; I651-M653 HydrophobicContact CG2-SD 4.11Å
652	E	93.9	Very high	84.5	Confident	37 Å²	37	57.9 Å²	57.9	17%	0.173	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	134.1	175.9	-65.5	163.9	-139	0	0	109.4	L573 R574 W580 V636 I650	L573-E652 WeakPolarHBondContact CA-O 3.45Å; R574-E652 HydrophobicContact CB-CB 3.99Å; R574-E652 WeakPolarHBondContact CD-OE2 3.36Å; R574-E652 HydrophobicContact CG-CB 4.2Å; R574-E652 WeakPolarHBondContact CG-OE2 3.33Å; R574-E652 IonicContact CZ-OE1 3.73Å; R574-E652 IonicContact CZ-OE2 2.8Å; R574-E652 PolarHBondContact N-O 3.2Å; R574-E652 IonicContact NE-OE1 3.16Å; R574-E652 IonicContact NE-OE2 3.74Å; R574-E652 PolarHBondContact NE-OE2 3.26Å; R574-E652 IonicContact NH1-OE1 2.78Å; R574-E652 IonicContact NH1-OE2 3.67Å; R574-E652 PolarHBondContact NH1-OE2 3Å; R574-E652 PolarHBondContact O-N 3.45Å; W580-E652 HydrophobicContact CH2-CB 3.69Å; W580-E652 HydrophobicContact CZ2-CB 4.28Å; W580-E652 HydrophobicContact CZ3-CB 4.2Å; V636-E652 HydrophobicContact CG1-CG 3.97Å; V636-E652 HydrophobicContact CG2-CB 4.37Å; V636-E652 HydrophobicContact CG2-CG 3.9Å; I650-E652 HydrophobicContact CG2-CG 4.41Å
653	M	95.7	Very high	86.3	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	135.9	-171.3	-54.7	-174.4	-78.3	0	0	109	L571 Y572 L573 F592 L617 G634 M635 V637 I651 L668	L571-M653 HydrophobicContact CD1-CB 4.44Å; L571-M653 HydrophobicContact CD1-SD 4.34Å; Y572-M653 CarbonylContact O-C 3.52Å; Y572-M653 WeakPolarHBondContact O-CA 3.11Å; L573-M653 HydrophobicContact CD2-CB 4.11Å; L573-M653 HydrophobicContact CD2-CG 3.62Å; L573-M653 HydrophobicContact CD2-SD 4.27Å; F592-M653 HydrophobicContact CE2-SD 4.43Å; F592-M653 HydrophobicContact CZ-SD 3.94Å; L617-M653 HydrophobicContact CD1-CE 4.49Å; G634-M653 CarbonylContact C-O 3.58Å; G634-M653 WeakPolarHBondContact CA-O 3.4Å; M635-M653 HydrophobicContact CB-CB 4.43Å; M635-M653 HydrophobicContact CB-CE 4.3Å; M635-M653 HydrophobicContact CE-CB 4.33Å; M635-M653 PolarHBondContact N-O 3.45Å; M635-M653 PolarHBondContact O-N 3.29Å; M635-M653 VanDerWaalsContact O-O 3.09Å; V637-M653 HydrophobicContact CG2-CE 3.81Å; I651-M653 HydrophobicContact CG2-CG 3.93Å; I651-M653 HydrophobicContact CG2-SD 4.11Å; M653-L668 HydrophobicContact CE-CD1 3.64Å; M653-L668 HydrophobicContact SD-CD1 4.35Å
654	C	95.3	Very high	88.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	122	176.7	-84.9	0	0	0	0	109.3	Y572 W580 T631 F633	Y572-C654 HydrophobicContact CD2-CB 4.47Å; Y572-C654 PolarHBondContact N-O 3.01Å; Y572-C654 PolarHBondContact O-N 2.9Å; W580-C654 HydrophobicContact CH2-CB 4.29Å; W580-C654 VanDerWaalsContact CH2-SG 3.6Å; W580-C654 HydrophobicContact CZ3-CB 4.07Å; T631-C654 WeakPolarHBondContact OG1-CB 3.48Å; F633-C654 WeakPolarHBondContact O-CA 3.34Å
655	A	96.1	Very high	90.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	154.1	179.8	0	0	0	0	0	111.5	L571 T631 F633 W661	L571-A655 HydrophobicContact CD2-CB 3.93Å; T631-A655 WeakPolarHBondContact CB-O 3.37Å; T631-A655 WeakPolarHBondContact CG2-O 3.24Å; T631-A655 PolarHBondContact OG1-O 2.82Å; F633-A655 HydrophobicContact CB-CB 4.13Å; F633-A655 PolarHBondContact O-N 3.19Å; A655-W661 HydrophobicContact CB-CB 3.83Å
656	I	94.1	Very high	91.7	Very high	60 Å²	60	40 Å²	40	31%	0.308	19%	0.189	S	C	.	.	S	Bend	trans	-70.4	-35.6	-174.6	-66.5	164.9	0	0	0	111.8	Q570 Y572	Q570-I656 HydrophobicContact CB-CD1 3.7Å; Q570-I656 WeakPolarHBondContact O-CD1 3.47Å; Y572-I656 HydrophobicContact CE2-CG1 4.29Å
657	N	94.1	Very high	92.5	Very high	69 Å²	69	37.1 Å²	37.1	37%	0.369	17%	0.174	S	C	.	.	S	Bend	trans	-148.4	173.8	178.9	66.6	3.4	0	0	0	110.6	E659 S660 W661	N657-E659 VanDerWaalsContact C-N 3.32Å; N657-E659 PolarHBondContact O-N 2.93Å; N657-S660 PolarHBondContact O-N 2.91Å; N657-S660 WeakPolarHBondContact OD1-CB 3.49Å; N657-S660 PolarHBondContact OD1-N 3.33Å; N657-W661 PolarHBondContact O-N 3.11Å
658	E	93.3	Very high	93.1	Very high	65 Å²	65	34.9 Å²	34.9	30%	0.304	16%	0.158	S	C	.	.	H	α-helix	trans	-63.1	-35.2	-178.9	-157.8	-167.4	153.9	0	0	113	F633 W661 R662	F633-E658 HydrophobicContact CD1-CB 4.17Å; F633-E658 HydrophobicContact CD1-CG 4.28Å; F633-E658 HydrophobicContact CE1-CB 3.56Å; F633-E658 HydrophobicContact CE1-CG 3.82Å; F633-E658 HydrophobicContact CZ-CB 3.93Å; E658-W661 WeakPolarHBondContact O-CB 3.39Å; E658-W661 PolarHBondContact O-N 3.2Å; E658-R662 WeakPolarHBondContact O-CG 3.38Å; E658-R662 PolarHBondContact O-N 2.84Å; E658-R662 IonicContact OE1-CZ 3.3Å; E658-R662 IonicContact OE1-NE 2.68Å; E658-R662 PolarHBondContact OE1-NE 3.47Å; E658-R662 IonicContact OE1-NH2 2.77Å; E658-R662 PolarHBondContact OE1-NH2 3.06Å; E658-R662 IonicContact OE2-NH2 3.81Å
659	E	93.5	Very high	93.5	Very high	110 Å²	110	27.9 Å²	27.9	51%	0.514	13%	0.131	S	C	.	.	H	α-helix	trans	-65.8	-44.7	179.6	-164.9	-160.4	158.5	0	0	111.9	N657 W661 K663	N657-E659 VanDerWaalsContact C-N 3.32Å; N657-E659 PolarHBondContact O-N 2.93Å; E659-W661 VanDerWaalsContact C-N 3.33Å; E659-K663 WeakPolarHBondContact O-CD 3.44Å; E659-K663 WeakPolarHBondContact O-CG 3.48Å; E659-K663 PolarHBondContact O-N 3.21Å; E659-K663 WeakPolarHBondContact OE1-CE 3.19Å; E659-K663 IonicContact OE1-NZ 3.12Å; E659-K663 PolarHBondContact OE1-NZ 3.03Å
660	S	94.6	Very high	93.7	Very high	5 Å²	5	26 Å²	26	4%	0.035	12%	0.122	C	C	.	.	H	α-helix	trans	-60.8	-43	171.4	177.9	0	0	0	0	110.3	D569 N657 K663 W664	D569-S660 WeakPolarHBondContact OD2-CB 3.26Å; D569-S660 PolarHBondContact OD2-OG 3.17Å; N657-S660 PolarHBondContact O-N 2.91Å; N657-S660 WeakPolarHBondContact OD1-CB 3.49Å; N657-S660 PolarHBondContact OD1-N 3.33Å; S660-K663 PolarHBondContact O-N 3.16Å; S660-W664 WeakPolarHBondContact O-CB 3.24Å; S660-W664 PolarHBondContact O-N 2.97Å; S660-W664 VanDerWaalsContact OG-CD1 3.32Å
661	W	95.5	Very high	93.6	Very high	31 Å²	31	25.8 Å²	25.8	12%	0.117	12%	0.121	C	C	.	.	H	α-helix	trans	-59.8	-50.4	176.4	-178.4	86.2	0	0	0	113.1	W539 I619 F633 G634 A655 N657 E658 E659 K663 W664 Y665	W539-W661 HydrophobicContact CH2-CZ3 4.49Å; W539-W661 HydrophobicContact CZ3-CZ3 4.2Å; I619-W661 HydrophobicContact CB-CZ2 4.4Å; I619-W661 HydrophobicContact CD1-CZ2 4.29Å; I619-W661 HydrophobicContact CG2-CZ2 3.88Å; F633-W661 HydrophobicContact CB-CB 3.97Å; F633-W661 HydrophobicContact CB-CG 4.06Å; F633-W661 HydrophobicContact CD1-CB 4.4Å; F633-W661 HydrophobicContact CG-CB 4.42Å; G634-W661 PolarHBondContact O-NE1 3.36Å; A655-W661 HydrophobicContact CB-CB 3.83Å; N657-W661 PolarHBondContact O-N 3.11Å; E658-W661 WeakPolarHBondContact O-CB 3.39Å; E658-W661 PolarHBondContact O-N 3.2Å; E659-W661 VanDerWaalsContact C-N 3.33Å; W661-K663 VanDerWaalsContact C-N 3.27Å; W661-K663 PolarHBondContact O-N 3.34Å; W661-W664 PolarHBondContact O-N 2.83Å; W661-Y665 VanDerWaalsContact O-CB 3.24Å; W661-Y665 WeakPolarHBondContact O-CB 3.16Å; W661-Y665 PolarHBondContact O-N 3.36Å
662	R	94	Very high	93.4	Very high	73 Å²	73	27.6 Å²	27.6	28%	0.275	13%	0.131	S	C	.	.	H	α-helix	trans	-58.4	-41	178.8	-70	-178.9	-169.2	-175.4	1	111.2	W539 E658 S666	W539-R662 HydrophobicContact CE3-CB 3.79Å; W539-R662 HydrophobicContact CE3-CG 3.95Å; W539-R662 HydrophobicContact CZ3-CB 4.15Å; W539-R662 HydrophobicContact CZ3-CG 3.9Å; W539-R662 CarbonylContact O-C 3.56Å; E658-R662 WeakPolarHBondContact O-CG 3.38Å; E658-R662 PolarHBondContact O-N 2.84Å; E658-R662 IonicContact OE1-CZ 3.3Å; E658-R662 IonicContact OE1-NE 2.68Å; E658-R662 PolarHBondContact OE1-NE 3.47Å; E658-R662 IonicContact OE1-NH2 2.77Å; E658-R662 PolarHBondContact OE1-NH2 3.06Å; E658-R662 IonicContact OE2-NH2 3.81Å; R662-S666 WeakPolarHBondContact O-CB 3.21Å; R662-S666 PolarHBondContact O-N 2.81Å; R662-S666 PolarHBondContact O-OG 2.72Å
663	K	93.9	Very high	93.2	Very high	34 Å²	34	27.3 Å²	27.3	15%	0.148	13%	0.13	C	C	.	.	H	α-helix	trans	-64.4	-53.9	175.9	-73	166.5	178.1	171.7	0	111.9	W539 L540 E659 S660 W661 S666 L667	W539-K663 WeakPolarHBondContact O-CA 3.39Å; W539-K663 WeakPolarHBondContact O-CG 3.41Å; W539-K663 PolarHBondContact O-N 2.91Å; L540-K663 WeakPolarHBondContact O-CE 3.13Å; E659-K663 WeakPolarHBondContact O-CD 3.44Å; E659-K663 WeakPolarHBondContact O-CG 3.48Å; E659-K663 PolarHBondContact O-N 3.21Å; E659-K663 WeakPolarHBondContact OE1-CE 3.19Å; E659-K663 IonicContact OE1-NZ 3.12Å; E659-K663 PolarHBondContact OE1-NZ 3.03Å; S660-K663 PolarHBondContact O-N 3.16Å; W661-K663 VanDerWaalsContact C-N 3.27Å; W661-K663 PolarHBondContact O-N 3.34Å; K663-S666 PolarHBondContact O-N 2.63Å; K663-L667 WeakPolarHBondContact O-CB 3.45Å; K663-L667 VanDerWaalsContact O-CG 3.27Å; K663-L667 WeakPolarHBondContact O-CG 3.37Å; K663-L667 PolarHBondContact O-N 3.36Å
664	W	95.5	Very high	92.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-62.1	-48.8	-179.5	-80.2	112.7	0	0	0	112.2	H567 D569 L571 C585 L587 F592 M635 S660 W661 S666 L667 L668	H567-W664 AromaticContact CD2-CD2 3.9Å; H567-W664 AromaticContact CD2-CE2 3.58Å; H567-W664 AromaticContact CD2-CH2 3.78Å; H567-W664 AromaticContact CD2-CZ2 3.54Å; H567-W664 AromaticContact NE2-CE2 3.65Å; H567-W664 AromaticContact NE2-CZ2 3.9Å; H567-W664 AromaticContact NE2-NE1 3.67Å; D569-W664 HydrophobicContact CB-CZ2 3.92Å; L571-W664 HydrophobicContact CD1-CD2 3.92Å; L571-W664 HydrophobicContact CD1-CE3 4.32Å; L571-W664 HydrophobicContact CD1-CG 4.27Å; L571-W664 HydrophobicContact CD1-CZ2 4.24Å; L571-W664 HydrophobicContact CD2-CD2 4.44Å; L571-W664 HydrophobicContact CD2-CG 4.09Å; L571-W664 HydrophobicContact CG-CD2 4.38Å; L571-W664 HydrophobicContact CG-CZ2 4.32Å; C585-W664 HydrophobicContact CB-CH2 3.61Å; C585-W664 HydrophobicContact CB-CZ2 3.81Å; C585-W664 HydrophobicContact CB-CZ3 4.46Å; L587-W664 HydrophobicContact CB-CH2 4.4Å; L587-W664 HydrophobicContact CB-CZ3 3.79Å; L587-W664 HydrophobicContact CD2-CZ3 4.29Å; F592-W664 AromaticContact CD2-CZ3 3.98Å; F592-W664 HydrophobicContact CD2-CZ3 3.98Å; F592-W664 AromaticContact CE2-CE3 3.98Å; F592-W664 HydrophobicContact CE2-CE3 3.98Å; F592-W664 HydrophobicContact CE2-CH2 4.13Å; F592-W664 AromaticContact CE2-CZ3 3.47Å; F592-W664 HydrophobicContact CE2-CZ3 3.47Å; F592-W664 VanDerWaalsContact CE2-CZ3 3.47Å; M635-W664 HydrophobicContact CE-CB 3.76Å; M635-W664 HydrophobicContact SD-CB 4.13Å; S660-W664 WeakPolarHBondContact O-CB 3.24Å; S660-W664 PolarHBondContact O-N 2.97Å; S660-W664 VanDerWaalsContact OG-CD1 3.32Å; W661-W664 PolarHBondContact O-N 2.83Å; W664-S666 VanDerWaalsContact C-N 3.35Å; W664-S666 PolarHBondContact O-N 2.94Å; W664-L667 PolarHBondContact O-N 3.06Å; W664-L668 HydrophobicContact CB-CD1 4.49Å; W664-L668 WeakPolarHBondContact O-CB 3.49Å; W664-L668 WeakPolarHBondContact O-CD1 3.36Å; W664-L668 WeakPolarHBondContact O-CG 3.28Å; W664-L668 PolarHBondContact O-N 2.67Å
665	Y	95	Very high	92.3	Very high	6 Å²	6	32.6 Å²	32.6	2%	0.024	16%	0.159	C	C	.	.	H	α-helix	trans	-56.9	-48.7	177.8	-176.6	-102.7	0	0	0	111	D528 L617 I619 M635 W661 R669	D528-Y665 HydrophobicContact CB-CE1 3.94Å; L617-Y665 HydrophobicContact CD2-CD2 3.6Å; L617-Y665 HydrophobicContact CD2-CE2 3.63Å; L617-Y665 HydrophobicContact CD2-CG 4.43Å; L617-Y665 HydrophobicContact CG-CD2 4.12Å; L617-Y665 HydrophobicContact CG-CE2 3.93Å; I619-Y665 HydrophobicContact CG2-CD2 3.82Å; I619-Y665 HydrophobicContact CG2-CE2 3.46Å; I619-Y665 VanDerWaalsContact CG2-CE2 3.46Å; M635-Y665 HydrophobicContact CG-CD2 4.41Å; M635-Y665 HydrophobicContact SD-CD2 4.39Å; W661-Y665 VanDerWaalsContact O-CB 3.24Å; W661-Y665 WeakPolarHBondContact O-CB 3.16Å; W661-Y665 PolarHBondContact O-N 3.36Å; Y665-R669 WeakPolarHBondContact O-CB 3.44Å; Y665-R669 PolarHBondContact O-N 3.42Å
666	S	93.3	Very high	92.1	Very high	4 Å²	4	37.7 Å²	37.7	3%	0.028	18%	0.179	C	C	.	.	H	α-helix	trans	-60.1	-52	178.4	-59.3	0	0	0	0	112.4	R662 K663 W664 R669 I670	R662-S666 WeakPolarHBondContact O-CB 3.21Å; R662-S666 PolarHBondContact O-N 2.81Å; R662-S666 PolarHBondContact O-OG 2.72Å; K663-S666 PolarHBondContact O-N 2.63Å; W664-S666 VanDerWaalsContact C-N 3.35Å; W664-S666 PolarHBondContact O-N 2.94Å; S666-R669 PolarHBondContact O-N 3.39Å; S666-I670 WeakPolarHBondContact O-CD1 3.47Å; S666-I670 VanDerWaalsContact O-CG1 3.23Å; S666-I670 WeakPolarHBondContact O-CG1 3.23Å; S666-I670 PolarHBondContact O-N 2.69Å
667	L	92.4	Very high	92	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-68.1	-37.3	-176.7	-65.9	169.1	0	0	0	112.1	L540 I564 P565 H567 L587 K663 W664 I670 T671	L540-L667 HydrophobicContact CD2-CD2 3.99Å; L540-L667 HydrophobicContact CD2-CG 3.99Å; I564-L667 HydrophobicContact CG2-CD2 4.11Å; P565-L667 HydrophobicContact CB-CD2 4.35Å; P565-L667 HydrophobicContact CG-CD2 4.26Å; H567-L667 HydrophobicContact CB-CD1 3.46Å; H567-L667 VanDerWaalsContact CB-CD1 3.46Å; L587-L667 HydrophobicContact CD2-CB 3.66Å; K663-L667 WeakPolarHBondContact O-CB 3.45Å; K663-L667 VanDerWaalsContact O-CG 3.27Å; K663-L667 WeakPolarHBondContact O-CG 3.37Å; K663-L667 PolarHBondContact O-N 3.36Å; W664-L667 PolarHBondContact O-N 3.06Å; L667-I670 HydrophobicContact CD2-CD1 4.43Å; L667-T671 WeakPolarHBondContact O-CB 3.32Å; L667-T671 PolarHBondContact O-N 3.23Å; L667-T671 PolarHBondContact O-OG1 2.9Å
668	L	93.6	Very high	91.8	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.6	-46	172.7	-72.1	168.7	0	0	0	111.1	L587 F592 I610 L617 M635 M653 W664 T671 L672	L587-L668 HydrophobicContact CD2-CD2 4.35Å; F592-L668 HydrophobicContact CD2-CD2 3.87Å; F592-L668 HydrophobicContact CE2-CD2 4.12Å; I610-L668 HydrophobicContact CD1-CD2 3.46Å; I610-L668 VanDerWaalsContact CD1-CD2 3.46Å; L617-L668 HydrophobicContact CD2-CB 4.05Å; M635-L668 HydrophobicContact SD-CD1 4.25Å; M653-L668 HydrophobicContact CE-CD1 3.64Å; M653-L668 HydrophobicContact SD-CD1 4.35Å; W664-L668 HydrophobicContact CB-CD1 4.49Å; W664-L668 WeakPolarHBondContact O-CB 3.49Å; W664-L668 WeakPolarHBondContact O-CD1 3.36Å; W664-L668 WeakPolarHBondContact O-CG 3.28Å; W664-L668 PolarHBondContact O-N 2.67Å; L668-T671 PolarHBondContact O-N 2.84Å; L668-T671 VanDerWaalsContact O-N 3.15Å; L668-L672 WeakPolarHBondContact O-CB 3.5Å; L668-L672 WeakPolarHBondContact O-CD1 3.13Å; L668-L672 VanDerWaalsContact O-CG 3.28Å; L668-L672 WeakPolarHBondContact O-CG 3.42Å; L668-L672 PolarHBondContact O-N 2.99Å
669	R	91.9	Very high	91.7	Very high	9 Å²	9	32.2 Å²	32.2	3%	0.034	16%	0.155	C	C	.	.	H	α-helix	trans	-66	-40.7	-179.7	-168.9	163.5	164.4	-108.7	-9.6	112.3	E501 D528 L529 L617 Y665 S666 T671 L672 I673 L677	E501-R669 VanDerWaalsContact CD-NH2 3.28Å; E501-R669 IonicContact OE1-CZ 2.85Å; E501-R669 VanDerWaalsContact OE1-CZ 3.27Å; E501-R669 IonicContact OE1-NE 2.82Å; E501-R669 PolarHBondContact OE1-NE 3.41Å; E501-R669 IonicContact OE1-NH2 2.69Å; E501-R669 PolarHBondContact OE1-NH2 3.05Å; E501-R669 IonicContact OE2-CZ 3.37Å; E501-R669 IonicContact OE2-NE 3.32Å; E501-R669 IonicContact OE2-NH2 3.56Å; E501-R669 PolarHBondContact OE2-NH2 2.8Å; D528-R669 PolarHBondContact O-NH1 2.83Å; L529-R669 PolarHBondContact O-NH1 2.8Å; L529-R669 PolarHBondContact O-NH2 3.36Å; L617-R669 HydrophobicContact CD2-CB 4.11Å; Y665-R669 WeakPolarHBondContact O-CB 3.44Å; Y665-R669 PolarHBondContact O-N 3.42Å; S666-R669 PolarHBondContact O-N 3.39Å; R669-T671 VanDerWaalsContact C-N 3.34Å; R669-T671 PolarHBondContact O-N 3Å; R669-L672 PolarHBondContact O-N 2.84Å; R669-I673 HydrophobicContact CG-CD1 3.57Å; R669-I673 WeakPolarHBondContact O-CB 3.42Å; R669-I673 WeakPolarHBondContact O-CG1 3.47Å; R669-I673 PolarHBondContact O-N 3.07Å; R669-I673 VanDerWaalsContact O-N 3.1Å; R669-L677 HydrophobicContact CG-CD2 4.15Å; R669-L677 VanDerWaalsContact NH2-CD1 3.34Å
670	I	89.4	Confident	91.8	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-56.8	-47	168.6	-65.9	158.7	0	0	0	110.7	L532 F547 I562 I564 S666 L667 G674 L677	L532-I670 HydrophobicContact CD2-CD1 3.86Å; L532-I670 HydrophobicContact CD2-CG1 3.84Å; F547-I670 HydrophobicContact CE1-CD1 3.84Å; F547-I670 HydrophobicContact CZ-CD1 4.48Å; I562-I670 HydrophobicContact CG2-CG2 4.49Å; I564-I670 HydrophobicContact CG1-CG2 4.08Å; S666-I670 WeakPolarHBondContact O-CD1 3.47Å; S666-I670 VanDerWaalsContact O-CG1 3.23Å; S666-I670 WeakPolarHBondContact O-CG1 3.23Å; S666-I670 PolarHBondContact O-N 2.69Å; L667-I670 HydrophobicContact CD2-CD1 4.43Å; I670-G674 VanDerWaalsContact O-CA 3.32Å; I670-G674 WeakPolarHBondContact O-CA 3.43Å; I670-G674 PolarHBondContact O-N 3.43Å; I670-L677 HydrophobicContact CG1-CD2 4.17Å
671	T	88.3	Confident	91.8	Very high	28 Å²	28	28.4 Å²	28.4	17%	0.172	14%	0.136	C	C	.	.	H	α-helix	trans	-74.1	-30.3	-174.8	-46.7	0	0	0	0	113	I564 L587 F611 L667 L668 R669	I564-T671 HydrophobicContact CD1-CG2 3.67Å; I564-T671 WeakPolarHBondContact CD1-OG1 3.28Å; L587-T671 HydrophobicContact CD1-CG2 4.45Å; F611-T671 HydrophobicContact CD1-CG2 3.81Å; F611-T671 HydrophobicContact CE1-CG2 3.25Å; F611-T671 HydrophobicContact CE2-CG2 4.11Å; F611-T671 HydrophobicContact CG-CG2 4.46Å; F611-T671 HydrophobicContact CZ-CG2 3.41Å; F611-T671 VanDerWaalsContact CZ-CG2 3.41Å; L667-T671 WeakPolarHBondContact O-CB 3.32Å; L667-T671 PolarHBondContact O-N 3.23Å; L667-T671 PolarHBondContact O-OG1 2.9Å; L668-T671 PolarHBondContact O-N 2.84Å; L668-T671 VanDerWaalsContact O-N 3.15Å; R669-T671 VanDerWaalsContact C-N 3.34Å; R669-T671 PolarHBondContact O-N 3Å
672	L	89	Confident	91.7	Very high	45 Å²	45	28.2 Å²	28.2	24%	0.236	14%	0.136	C	C	.	.	H	α-helix	trans	-77.9	-36.5	178.7	-75.5	163.1	0	0	0	113	I610 F611 L617 V637 L668 R669	I610-L672 VanDerWaalsContact O-CD2 3.28Å; I610-L672 WeakPolarHBondContact O-CD2 3.32Å; F611-L672 HydrophobicContact CD1-CD2 3.73Å; F611-L672 HydrophobicContact CD1-CG 4.09Å; F611-L672 HydrophobicContact CE1-CD2 4.17Å; F611-L672 HydrophobicContact CE1-CG 4.12Å; L617-L672 HydrophobicContact CB-CD1 3.88Å; L617-L672 HydrophobicContact CD2-CD1 4.36Å; V637-L672 HydrophobicContact CG2-CD1 4.44Å; L668-L672 WeakPolarHBondContact O-CB 3.5Å; L668-L672 WeakPolarHBondContact O-CD1 3.13Å; L668-L672 VanDerWaalsContact O-CG 3.28Å; L668-L672 WeakPolarHBondContact O-CG 3.42Å; L668-L672 PolarHBondContact O-N 2.99Å; R669-L672 PolarHBondContact O-N 2.84Å
673	I	88.7	Confident	91.7	Very high	31 Å²	31	27.9 Å²	27.9	16%	0.159	14%	0.143	C	C	.	.	H	α-helix	trans	-101.7	-28.5	-172.8	-57.4	169.7	0	0	0	111.8	E501 R669 R676 L677	E501-I673 HydrophobicContact CG-CD1 3.82Å; E501-I673 VanDerWaalsContact OE1-CD1 3.23Å; E501-I673 WeakPolarHBondContact OE1-CD1 3.34Å; R669-I673 HydrophobicContact CG-CD1 3.57Å; R669-I673 WeakPolarHBondContact O-CB 3.42Å; R669-I673 WeakPolarHBondContact O-CG1 3.47Å; R669-I673 PolarHBondContact O-N 3.07Å; R669-I673 VanDerWaalsContact O-N 3.1Å; I673-R676 HydrophobicContact CG2-CB 3.82Å; I673-L677 HydrophobicContact CB-CB 4.11Å; I673-L677 HydrophobicContact CD1-CD1 4.1Å; I673-L677 HydrophobicContact CG2-CB 3.76Å
674	G	86.6	Confident	91.8	Very high	21 Å²	21	26.3 Å²	26.3	22%	0.216	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.3	-144.3	179.7	0	0	0	0	0	113.1	I670 R676 L677	I670-G674 VanDerWaalsContact O-CA 3.32Å; I670-G674 WeakPolarHBondContact O-CA 3.43Å; I670-G674 PolarHBondContact O-N 3.43Å; G674-R676 PolarHBondContact O-N 2.63Å; G674-R676 VanDerWaalsContact O-N 3.1Å; G674-L677 PolarHBondContact O-N 3.25Å; G674-L677 VanDerWaalsContact O-N 3.13Å
675	K	86.2	Confident	91.8	Very high	92 Å²	92	30 Å²	30	40%	0.4	15%	0.154	S	C	.	.	H	α-helix	trans	-53.8	-32.8	-175.3	66	177.9	-175.3	174.7	0	114.1	I562 L677 Y678 T679	I562-K675 HydrophobicContact CD1-CB 4.43Å; K675-L677 PolarHBondContact O-N 2.88Å; K675-Y678 PolarHBondContact O-N 2.9Å; K675-Y678 VanDerWaalsContact O-N 3.14Å; K675-T679 PolarHBondContact O-N 2.9Å; K675-T679 VanDerWaalsContact O-N 3.14Å; K675-T679 PolarHBondContact O-OG1 3.29Å
676	R	90.6	Very high	91.8	Very high	106 Å²	106	33.5 Å²	33.5	40%	0.4	17%	0.173	S	C	.	.	H	α-helix	trans	-54.4	-36.5	179.2	-70.6	170.4	59	-142.2	-8.8	112.7	D503 I673 G674 Y678 T679 N680	D503-R676 IonicContact OD1-CZ 3.2Å; D503-R676 IonicContact OD1-NE 2.67Å; D503-R676 IonicContact OD1-NH2 3.88Å; D503-R676 PolarHBondContact OD1-NH2 3.08Å; D503-R676 IonicContact OD2-CZ 3.54Å; D503-R676 IonicContact OD2-NE 3.2Å; D503-R676 PolarHBondContact OD2-NE 2.86Å; D503-R676 IonicContact OD2-NH2 3.8Å; D503-R676 PolarHBondContact OD2-NH2 3.05Å; I673-R676 HydrophobicContact CG2-CB 3.82Å; G674-R676 PolarHBondContact O-N 2.63Å; G674-R676 VanDerWaalsContact O-N 3.1Å; R676-Y678 VanDerWaalsContact C-N 3.3Å; R676-Y678 PolarHBondContact O-N 3.32Å; R676-T679 WeakPolarHBondContact O-CB 3.33Å; R676-T679 PolarHBondContact O-N 2.81Å; R676-N680 WeakPolarHBondContact O-CB 3.42Å; R676-N680 PolarHBondContact O-N 3.31Å; R676-N680 PolarHBondContact O-OD1 3.23Å
677	L	91.8	Very high	91.9	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-63	-36.1	-178.2	-174.4	61.2	0	0	0	112.6	F533 R669 I670 I673 G674 K675 Y681	F533-L677 HydrophobicContact CE2-CD1 4.48Å; F533-L677 HydrophobicContact CE2-CG 3.99Å; F533-L677 HydrophobicContact CZ-CD2 4.35Å; F533-L677 HydrophobicContact CZ-CG 3.87Å; R669-L677 HydrophobicContact CG-CD2 4.15Å; R669-L677 VanDerWaalsContact NH2-CD1 3.34Å; I670-L677 HydrophobicContact CG1-CD2 4.17Å; I673-L677 HydrophobicContact CB-CB 4.11Å; I673-L677 HydrophobicContact CD1-CD1 4.1Å; I673-L677 HydrophobicContact CG2-CB 3.76Å; G674-L677 PolarHBondContact O-N 3.25Å; G674-L677 VanDerWaalsContact O-N 3.13Å; K675-L677 PolarHBondContact O-N 2.88Å; L677-Y681 PolarHBondContact O-N 2.83Å
678	Y	90.1	Very high	92	Very high	4 Å²	4	35.7 Å²	35.7	2%	0.016	19%	0.186	C	C	.	.	H	α-helix	trans	-80.9	-35.4	175.3	175.8	-100	0	0	0	112	F533 I549 K553 F556 Y557 K675 R676 N680 Y681 I682	F533-Y678 HydrophobicContact CD1-CD2 4.07Å; F533-Y678 AromaticContact CE1-CD2 3.72Å; F533-Y678 HydrophobicContact CE1-CD2 3.72Å; F533-Y678 HydrophobicContact CE1-CG 4.39Å; I549-Y678 HydrophobicContact CG2-CD2 4.15Å; I549-Y678 HydrophobicContact CG2-CE2 4.38Å; K553-Y678 WeakPolarHBondContact CB-OH 3.41Å; K553-Y678 WeakPolarHBondContact CD-OH 3.48Å; K553-Y678 HydrophobicContact CG-CE2 4.27Å; K553-Y678 WeakPolarHBondContact CG-OH 3.47Å; F556-Y678 HydrophobicContact CB-CD1 3.55Å; F556-Y678 HydrophobicContact CB-CE1 4.12Å; F556-Y678 HydrophobicContact CB-CG 3.85Å; F556-Y678 HydrophobicContact CD1-CD1 4.45Å; F556-Y678 AromaticContact CD1-CG 3.96Å; F556-Y678 HydrophobicContact CD1-CG 3.96Å; F556-Y678 HydrophobicContact CG-CD1 4.13Å; F556-Y678 HydrophobicContact CG-CD2 4.43Å; F556-Y678 AromaticContact CG-CG 3.88Å; F556-Y678 HydrophobicContact CG-CG 3.88Å; Y557-Y678 HydrophobicContact CD1-CE1 4.48Å; Y557-Y678 HydrophobicContact CD2-CE1 4.46Å; Y557-Y678 AromaticContact CE1-CE1 3.93Å; Y557-Y678 HydrophobicContact CE1-CE1 3.93Å; Y557-Y678 AromaticContact CE2-CE1 3.9Å; Y557-Y678 HydrophobicContact CE2-CE1 3.9Å; Y557-Y678 AromaticContact CZ-CE1 3.6Å; Y557-Y678 PolarHBondContact OH-OH 2.89Å; K675-Y678 PolarHBondContact O-N 2.9Å; K675-Y678 VanDerWaalsContact O-N 3.14Å; R676-Y678 VanDerWaalsContact C-N 3.3Å; R676-Y678 PolarHBondContact O-N 3.32Å; Y678-N680 VanDerWaalsContact C-N 3.33Å; Y678-N680 PolarHBondContact O-N 3.43Å; Y678-Y681 HydrophobicContact CD2-CD1 4.41Å; Y678-Y681 HydrophobicContact CE2-CD1 4.41Å; Y678-Y681 PolarHBondContact O-N 3.49Å; Y678-I682 HydrophobicContact CD1-CG1 4.4Å; Y678-I682 HydrophobicContact CE1-CG1 3.88Å; Y678-I682 HydrophobicContact CE2-CD1 4.05Å; Y678-I682 HydrophobicContact CE2-CG1 4.02Å; Y678-I682 WeakPolarHBondContact O-CG1 3.49Å; Y678-I682 PolarHBondContact O-N 3.47Å; Y678-I682 VanDerWaalsContact O-N 3.07Å
679	T	92.2	Very high	92	Very high	75 Å²	75	41.7 Å²	41.7	46%	0.46	21%	0.212	S	C	.	.	H	α-helix	trans	-56.5	-48.2	170.1	-53.8	0	0	0	0	110.9	K675 R676 Y681 I682 V683	K675-T679 PolarHBondContact O-N 2.9Å; K675-T679 VanDerWaalsContact O-N 3.14Å; K675-T679 PolarHBondContact O-OG1 3.29Å; R676-T679 WeakPolarHBondContact O-CB 3.33Å; R676-T679 PolarHBondContact O-N 2.81Å; T679-Y681 PolarHBondContact O-N 3.15Å; T679-I682 PolarHBondContact O-N 3.14Å; T679-V683 HydrophobicContact CG2-CG2 4.26Å; T679-V683 WeakPolarHBondContact O-CG2 3.27Å; T679-V683 PolarHBondContact O-N 3.13Å
680	N	95.1	Very high	92	Very high	8 Å²	8	45.8 Å²	45.8	4%	0.043	23%	0.234	C	C	.	.	H	α-helix	trans	-58	-45.2	178.1	-70	0.4	0	0	0	111.7	D502 D503 Y530 R676 Y678 I682 V683 R684	D502-N680 HydrophobicContact CB-CB 4.27Å; D503-N680 WeakPolarHBondContact CB-OD1 3.42Å; D503-N680 VanDerWaalsContact CG-OD1 3.27Å; D503-N680 PolarHBondContact OD1-ND2 3.1Å; D503-N680 PolarHBondContact OD1-OD1 3.4Å; Y530-N680 HydrophobicContact CE1-CB 4.44Å; Y530-N680 WeakPolarHBondContact OH-CB 3.32Å; Y530-N680 PolarHBondContact OH-O 2.86Å; R676-N680 WeakPolarHBondContact O-CB 3.42Å; R676-N680 PolarHBondContact O-N 3.31Å; R676-N680 PolarHBondContact O-OD1 3.23Å; Y678-N680 VanDerWaalsContact C-N 3.33Å; Y678-N680 PolarHBondContact O-N 3.43Å; N680-I682 PolarHBondContact O-N 3.39Å; N680-V683 PolarHBondContact O-N 2.91Å; N680-R684 VanDerWaalsContact O-CB 3.29Å; N680-R684 WeakPolarHBondContact O-CB 3.32Å; N680-R684 PolarHBondContact O-N 3.07Å
681	Y	94.4	Very high	92.1	Very high	27 Å²	27	46.6 Å²	46.6	11%	0.106	24%	0.238	C	C	.	.	H	α-helix	trans	-58.6	-46	175.6	172.6	-104.4	0	0	0	113.1	M483 Y530 F533 L677 Y678 T679 R684 M685	M483-Y681 HydrophobicContact CE-CD2 3.64Å; M483-Y681 HydrophobicContact CE-CE2 3.52Å; Y530-Y681 AromaticContact CD1-CD2 3.76Å; Y530-Y681 HydrophobicContact CD1-CD2 3.76Å; Y530-Y681 HydrophobicContact CD1-CG 4.3Å; Y530-Y681 HydrophobicContact CE1-CD2 4.43Å; Y530-Y681 AromaticContact CG-CD2 3.88Å; Y530-Y681 HydrophobicContact CG-CD2 3.88Å; F533-Y681 HydrophobicContact CB-CD1 3.95Å; F533-Y681 HydrophobicContact CB-CD2 3.61Å; F533-Y681 HydrophobicContact CB-CE1 3.79Å; F533-Y681 HydrophobicContact CB-CE2 3.42Å; F533-Y681 VanDerWaalsContact CB-CE2 3.42Å; F533-Y681 HydrophobicContact CB-CG 3.86Å; F533-Y681 HydrophobicContact CD1-CD1 4.14Å; F533-Y681 HydrophobicContact CD1-CG 4.22Å; F533-Y681 HydrophobicContact CD2-CD1 4.42Å; F533-Y681 AromaticContact CD2-CD2 3.71Å; F533-Y681 HydrophobicContact CD2-CD2 3.71Å; F533-Y681 HydrophobicContact CD2-CE2 4.4Å; F533-Y681 AromaticContact CD2-CG 3.72Å; F533-Y681 HydrophobicContact CD2-CG 3.72Å; F533-Y681 HydrophobicContact CE2-CG 4.29Å; F533-Y681 AromaticContact CG-CD1 3.93Å; F533-Y681 HydrophobicContact CG-CD1 3.93Å; F533-Y681 AromaticContact CG-CD2 3.8Å; F533-Y681 HydrophobicContact CG-CD2 3.8Å; F533-Y681 HydrophobicContact CG-CE1 4.28Å; F533-Y681 HydrophobicContact CG-CE2 4.15Å; F533-Y681 AromaticContact CG-CG 3.67Å; F533-Y681 HydrophobicContact CG-CG 3.67Å; L677-Y681 PolarHBondContact O-N 2.83Å; Y678-Y681 HydrophobicContact CD2-CD1 4.41Å; Y678-Y681 HydrophobicContact CE2-CD1 4.41Å; Y678-Y681 PolarHBondContact O-N 3.49Å; T679-Y681 PolarHBondContact O-N 3.15Å; Y681-R684 PolarHBondContact O-N 3.1Å; Y681-M685 WeakPolarHBondContact O-CB 3.11Å; Y681-M685 PolarHBondContact O-N 2.88Å
682	I	92.9	Very high	92.3	Very high	26 Å²	26	53 Å²	53	13%	0.133	26%	0.258	C	S	.	.	H	α-helix	trans	-67.8	-46.9	179	-64.1	-62.2	0	0	0	111.1	Y678 T679 N680 R684 M685 D686	Y678-I682 HydrophobicContact CD1-CG1 4.4Å; Y678-I682 HydrophobicContact CE1-CG1 3.88Å; Y678-I682 HydrophobicContact CE2-CD1 4.05Å; Y678-I682 HydrophobicContact CE2-CG1 4.02Å; Y678-I682 WeakPolarHBondContact O-CG1 3.49Å; Y678-I682 PolarHBondContact O-N 3.47Å; Y678-I682 VanDerWaalsContact O-N 3.07Å; T679-I682 PolarHBondContact O-N 3.14Å; N680-I682 PolarHBondContact O-N 3.39Å; I682-R684 VanDerWaalsContact C-N 3.28Å; I682-R684 PolarHBondContact O-N 3.19Å; I682-M685 HydrophobicContact CD1-CE 4.1Å; I682-M685 WeakPolarHBondContact O-CB 3.5Å; I682-M685 PolarHBondContact O-N 3.22Å; I682-M685 VanDerWaalsContact O-N 3.11Å; I682-D686 PolarHBondContact O-N 3.49Å
683	V	95.6	Very high	92.3	Very high	67 Å²	67	55 Å²	55	41%	0.406	27%	0.267	S	S	.	.	H	α-helix	trans	-60.5	-38.8	177.1	173.7	0	0	0	0	111	L467 T679 N680 T687	L467-V683 HydrophobicContact CD2-CG1 3.75Å; T679-V683 HydrophobicContact CG2-CG2 4.26Å; T679-V683 WeakPolarHBondContact O-CG2 3.27Å; T679-V683 PolarHBondContact O-N 3.13Å; N680-V683 PolarHBondContact O-N 2.91Å; V683-T687 WeakPolarHBondContact O-CB 3.35Å; V683-T687 PolarHBondContact O-N 3.01Å; V683-T687 PolarHBondContact O-OG1 3.19Å
684	R	95.9	Very high	92.2	Very high	1 Å²	1	58.2 Å²	58.2	0%	0.004	28%	0.284	C	S	.	.	H	α-helix	trans	-62.9	-46.9	172.9	177.7	67	80.9	96.9	5.5	111.8	L470 T482 M483 H485 D502 Y530 N680 Y681 I682 D686 T687 V688	L470-R684 VanDerWaalsContact CD2-CZ 3.48Å; T482-R684 PolarHBondContact O-NH1 3.46Å; M483-R684 HydrophobicContact CE-CB 4.15Å; M483-R684 HydrophobicContact CE-CG 3.75Å; M483-R684 HydrophobicContact SD-CG 3.7Å; H485-R684 VanDerWaalsContact O-CZ 3.31Å; H485-R684 PolarHBondContact O-NH1 2.96Å; H485-R684 PolarHBondContact O-NH2 2.94Å; D502-R684 IonicContact OD1-CZ 3.24Å; D502-R684 IonicContact OD1-NE 3.51Å; D502-R684 PolarHBondContact OD1-NE 3.14Å; D502-R684 IonicContact OD1-NH2 3.4Å; D502-R684 PolarHBondContact OD1-NH2 3.29Å; D502-R684 IonicContact OD2-CZ 2.83Å; D502-R684 IonicContact OD2-NE 3.62Å; D502-R684 PolarHBondContact OD2-NE 3.32Å; D502-R684 IonicContact OD2-NH2 3.59Å; D502-R684 PolarHBondContact OD2-NH2 3.13Å; D502-R684 VanDerWaalsContact OD2-NH2 3.12Å; Y530-R684 HydrophobicContact CD2-CG 4.27Å; Y530-R684 HydrophobicContact CE2-CB 3.85Å; Y530-R684 HydrophobicContact CE2-CG 3.74Å; N680-R684 VanDerWaalsContact O-CB 3.29Å; N680-R684 WeakPolarHBondContact O-CB 3.32Å; N680-R684 PolarHBondContact O-N 3.07Å; Y681-R684 PolarHBondContact O-N 3.1Å; I682-R684 VanDerWaalsContact C-N 3.28Å; I682-R684 PolarHBondContact O-N 3.19Å; R684-D686 PolarHBondContact O-N 3.1Å; R684-T687 PolarHBondContact O-N 3.2Å; R684-V688 HydrophobicContact CG-CG2 4.23Å; R684-V688 WeakPolarHBondContact O-CB 3.4Å; R684-V688 WeakPolarHBondContact O-CG2 3.36Å; R684-V688 PolarHBondContact O-N 3.01Å
685	M	94.5	Very high	92	Very high	78 Å²	78	59.9 Å²	59.9	38%	0.384	29%	0.285	S	S	.	.	H	α-helix	trans	-58.7	-47.4	-179	-176.8	-171.2	70	0	0	111.5	M483 Y681 I682 V688 K689	M483-M685 HydrophobicContact CE-CB 4.17Å; M483-M685 HydrophobicContact SD-CB 4.27Å; Y681-M685 WeakPolarHBondContact O-CB 3.11Å; Y681-M685 PolarHBondContact O-N 2.88Å; I682-M685 HydrophobicContact CD1-CE 4.1Å; I682-M685 WeakPolarHBondContact O-CB 3.5Å; I682-M685 PolarHBondContact O-N 3.22Å; I682-M685 VanDerWaalsContact O-N 3.11Å; M685-V688 PolarHBondContact O-N 2.89Å; M685-K689 PolarHBondContact O-N 3.26Å; M685-K689 VanDerWaalsContact O-N 3.12Å
686	D	95.4	Very high	91.6	Very high	79 Å²	79	57.8 Å²	57.8	42%	0.422	28%	0.283	S	S	.	.	H	α-helix	trans	-65.8	-40	176.4	-65.7	-26.6	0	0	0	111.3	I682 R684 V688 K689 I690	I682-D686 PolarHBondContact O-N 3.49Å; R684-D686 PolarHBondContact O-N 3.1Å; D686-V688 PolarHBondContact O-N 3.18Å; D686-K689 PolarHBondContact O-N 2.96Å; D686-I690 WeakPolarHBondContact O-CG1 3.32Å; D686-I690 PolarHBondContact O-N 2.81Å
687	T	95.4	Very high	90.7	Very high	21 Å²	21	59 Å²	59	13%	0.129	29%	0.292	C	S	.	.	H	α-helix	trans	-64.1	-40	176.6	-60.2	0	0	0	0	112.5	L467 Q471 L481 V683 R684 I690 H691	L467-T687 HydrophobicContact CD1-CG2 4.28Å; Q471-T687 HydrophobicContact CG-CG2 3.82Å; Q471-T687 VanDerWaalsContact NE2-CG2 3.27Å; L481-T687 HydrophobicContact CD2-CG2 3.81Å; V683-T687 WeakPolarHBondContact O-CB 3.35Å; V683-T687 PolarHBondContact O-N 3.01Å; V683-T687 PolarHBondContact O-OG1 3.19Å; R684-T687 PolarHBondContact O-N 3.2Å; T687-I690 PolarHBondContact O-N 2.92Å; T687-H691 VanDerWaalsContact O-CB 3.32Å; T687-H691 WeakPolarHBondContact O-CB 3.48Å; T687-H691 PolarHBondContact O-N 2.93Å
688	V	95	Very high	89.4	Confident	28 Å²	28	61.5 Å²	61.5	17%	0.17	31%	0.31	C	S	.	.	H	α-helix	trans	-63.9	-41.9	175.4	163.8	0	0	0	0	110.8	L481 M483 R684 M685 D686 H691 R692	L481-V688 HydrophobicContact CD2-CG2 4.1Å; L481-V688 HydrophobicContact CG-CG2 3.93Å; M483-V688 HydrophobicContact SD-CB 4.33Å; M483-V688 HydrophobicContact SD-CG2 3.93Å; R684-V688 HydrophobicContact CG-CG2 4.23Å; R684-V688 WeakPolarHBondContact O-CB 3.4Å; R684-V688 WeakPolarHBondContact O-CG2 3.36Å; R684-V688 PolarHBondContact O-N 3.01Å; M685-V688 PolarHBondContact O-N 2.89Å; D686-V688 PolarHBondContact O-N 3.18Å; V688-H691 PolarHBondContact O-N 2.62Å; V688-R692 WeakPolarHBondContact O-CB 3.4Å; V688-R692 PolarHBondContact O-N 2.95Å
689	K	93.7	Very high	87.9	Confident	127 Å²	127	64.8 Å²	64.8	55%	0.552	33%	0.328	S	S	*	.	H	α-helix	trans	-59.8	-53.1	175	-178.2	-175.3	166.1	-175.9	0	111.2	M685 D686 H691 R692 E693	M685-K689 PolarHBondContact O-N 3.26Å; M685-K689 VanDerWaalsContact O-N 3.12Å; D686-K689 PolarHBondContact O-N 2.96Å; K689-H691 VanDerWaalsContact C-N 3.31Å; K689-H691 PolarHBondContact O-N 2.89Å; K689-R692 PolarHBondContact O-N 3.43Å; K689-R692 VanDerWaalsContact O-N 3.16Å; K689-E693 WeakPolarHBondContact CE-OE1 3.43Å; K689-E693 IonicContact NZ-OE1 3.16Å; K689-E693 WeakPolarHBondContact O-CG 3.42Å; K689-E693 PolarHBondContact O-N 3.34Å
690	I	92.2	Very high	86.3	Confident	94 Å²	94	68.6 Å²	68.6	48%	0.482	34%	0.335	S	S	.	.	H	α-helix	trans	-62.1	-38.1	-180	-65.9	164.3	0	0	0	111.2	D686 T687 N694	D686-I690 WeakPolarHBondContact O-CG1 3.32Å; D686-I690 PolarHBondContact O-N 2.81Å; T687-I690 PolarHBondContact O-N 2.92Å; I690-N694 WeakPolarHBondContact CG2-ND2 3.45Å; I690-N694 PolarHBondContact O-N 3.1Å; I690-N694 VanDerWaalsContact O-N 3.11Å; I690-N694 PolarHBondContact O-ND2 3.42Å
691	H	91.3	Very high	84.5	Confident	20 Å²	20	72.1 Å²	72.1	9%	0.093	36%	0.36	C	S	.	.	H	α-helix	trans	-64.4	-41.9	176.2	-163.6	-103.5	0	0	0	111.4	S475 K479 L481 T687 V688 K689 N694 F695	S475-H691 PolarHBondContact OG-NE2 3.44Å; K479-H691 PolarHBondContact O-CE1 3.27Å; L481-H691 HydrophobicContact CB-CB 4.15Å; L481-H691 WeakPolarHBondContact CB-ND1 3.34Å; L481-H691 PolarHBondContact N-ND1 2.98Å; L481-H691 VanDerWaalsContact N-ND1 3.13Å; T687-H691 VanDerWaalsContact O-CB 3.32Å; T687-H691 WeakPolarHBondContact O-CB 3.48Å; T687-H691 PolarHBondContact O-N 2.93Å; V688-H691 PolarHBondContact O-N 2.62Å; K689-H691 VanDerWaalsContact C-N 3.31Å; K689-H691 PolarHBondContact O-N 2.89Å; H691-N694 PolarHBondContact O-N 3.36Å; H691-F695 VanDerWaalsContact O-CB 3.27Å; H691-F695 WeakPolarHBondContact O-CB 3.11Å; H691-F695 PolarHBondContact O-N 2.89Å
692	R	91.3	Very high	82.6	Confident	162 Å²	162	76.6 Å²	76.6	61%	0.611	39%	0.385	S	S	*	.	H	α-helix	trans	-64.8	-40.5	177.2	-169.8	176.7	180	176.9	-0.3	113.4	L480 V688 K689 S696	L480-R692 HydrophobicContact CD1-CB 3.87Å; L480-R692 HydrophobicContact CD1-CG 4.16Å; L480-R692 HydrophobicContact CD2-CG 4.32Å; V688-R692 WeakPolarHBondContact O-CB 3.4Å; V688-R692 PolarHBondContact O-N 2.95Å; K689-R692 PolarHBondContact O-N 3.43Å; K689-R692 VanDerWaalsContact O-N 3.16Å; R692-S696 WeakPolarHBondContact O-CB 3.39Å; R692-S696 PolarHBondContact O-N 2.83Å; R692-S696 PolarHBondContact O-OG 2.78Å
693	E	89.8	Confident	80.8	Confident	88 Å²	88	83.7 Å²	83.7	41%	0.411	41%	0.41	S	S	.	.	H	α-helix	trans	-62.2	-51	176.2	-72	166.4	170.1	0	0	110.1	K689 F695 S696 H697	K689-E693 WeakPolarHBondContact CE-OE1 3.43Å; K689-E693 IonicContact NZ-OE1 3.16Å; K689-E693 WeakPolarHBondContact O-CG 3.42Å; K689-E693 PolarHBondContact O-N 3.34Å; E693-F695 PolarHBondContact O-N 2.93Å; E693-S696 WeakPolarHBondContact O-CB 3.41Å; E693-S696 PolarHBondContact O-N 3.33Å; E693-H697 PolarHBondContact O-CD2 3.3Å; E693-H697 PolarHBondContact O-N 2.68Å
694	N	86.3	Confident	78.7	Confident	98 Å²	98	84.6 Å²	84.6	52%	0.524	41%	0.413	S	S	.	.	H	α-helix	trans	-61.4	-43	176.5	-73.6	-58.7	0	0	0	113.2	I690 H691 S696 H697 S698	I690-N694 WeakPolarHBondContact CG2-ND2 3.45Å; I690-N694 PolarHBondContact O-N 3.1Å; I690-N694 VanDerWaalsContact O-N 3.11Å; I690-N694 PolarHBondContact O-ND2 3.42Å; H691-N694 PolarHBondContact O-N 3.36Å; N694-S696 VanDerWaalsContact C-N 3.31Å; N694-S696 PolarHBondContact O-N 3.03Å; N694-H697 PolarHBondContact O-N 3.03Å; N694-H697 VanDerWaalsContact O-N 3.17Å; N694-S698 PolarHBondContact O-N 3Å; N694-S698 VanDerWaalsContact O-N 3.14Å; N694-S698 PolarHBondContact O-OG 2.7Å
695	F	82.8	Confident	76.9	Confident	55 Å²	55	87.5 Å²	87.5	24%	0.241	43%	0.433	C	S	.	.	H	α-helix	trans	-60	-42	178.3	-164.5	-80.5	0	0	0	111.6	Q478 L480 H691 E693 H697 S698 D699	Q478-F695 WeakPolarHBondContact O-CE2 3.32Å; Q478-F695 WeakPolarHBondContact O-CZ 3.31Å; L480-F695 HydrophobicContact CD1-CB 4.27Å; L480-F695 HydrophobicContact CD1-CG 4.45Å; H691-F695 VanDerWaalsContact O-CB 3.27Å; H691-F695 WeakPolarHBondContact O-CB 3.11Å; H691-F695 PolarHBondContact O-N 2.89Å; E693-F695 PolarHBondContact O-N 2.93Å; F695-H697 VanDerWaalsContact C-N 3.34Å; F695-H697 PolarHBondContact O-N 3.43Å; F695-S698 WeakPolarHBondContact CA-OG 3.44Å; F695-S698 PolarHBondContact O-N 3.44Å; F695-S698 PolarHBondContact O-OG 3.17Å; F695-D699 PolarHBondContact O-N 3.04Å
696	S	77.8	Confident	75	Confident	49 Å²	49	87.4 Å²	87.4	34%	0.343	44%	0.44	S	S	.	.	H	α-helix	trans	-61.4	-41.8	175.9	-53.6	0	0	0	0	111.6	R692 E693 N694 S698 D699 Y700	R692-S696 WeakPolarHBondContact O-CB 3.39Å; R692-S696 PolarHBondContact O-N 2.83Å; R692-S696 PolarHBondContact O-OG 2.78Å; E693-S696 WeakPolarHBondContact O-CB 3.41Å; E693-S696 PolarHBondContact O-N 3.33Å; N694-S696 VanDerWaalsContact C-N 3.31Å; N694-S696 PolarHBondContact O-N 3.03Å; S696-S698 PolarHBondContact O-N 2.86Å; S696-D699 PolarHBondContact O-N 3.1Å; S696-Y700 WeakPolarHBondContact O-CD2 3.13Å; S696-Y700 PolarHBondContact O-N 2.68Å; S696-Y700 VanDerWaalsContact O-N 3.12Å
697	H	70.7	Confident	72.8	Confident	130 Å²	130	92.2 Å²	92.2	60%	0.602	45%	0.453	S	S	*	.	H	α-helix	trans	-64.7	-34.6	177	-71.5	-62.3	0	0	0	113.3	E693 N694 F695 S701	E693-H697 PolarHBondContact O-CD2 3.3Å; E693-H697 PolarHBondContact O-N 2.68Å; N694-H697 PolarHBondContact O-N 3.03Å; N694-H697 VanDerWaalsContact O-N 3.17Å; F695-H697 VanDerWaalsContact C-N 3.34Å; F695-H697 PolarHBondContact O-N 3.43Å; H697-S701 WeakPolarHBondContact O-CB 3.27Å; H697-S701 PolarHBondContact O-N 3.2Å
698	S	64.5	Low	70.7	Confident	54 Å²	54	98.2 Å²	98.2	38%	0.378	48%	0.477	S	S	.	.	H	α-helix	trans	-63.4	-42.2	171.7	30.1	0	0	0	0	112.8	N694 F695 S696 Y700 S701 L702	N694-S698 PolarHBondContact O-N 3Å; N694-S698 VanDerWaalsContact O-N 3.14Å; N694-S698 PolarHBondContact O-OG 2.7Å; F695-S698 WeakPolarHBondContact CA-OG 3.44Å; F695-S698 PolarHBondContact O-N 3.44Å; F695-S698 PolarHBondContact O-OG 3.17Å; S696-S698 PolarHBondContact O-N 2.86Å; S698-Y700 PolarHBondContact O-N 3.08Å; S698-S701 PolarHBondContact O-N 3.45Å; S698-L702 WeakPolarHBondContact O-CG 3.3Å; S698-L702 PolarHBondContact O-N 3.24Å
699	D	59.6	Low	68.6	Low	73 Å²	73	102 Å²	102	39%	0.39	50%	0.496	S	S	.	.	H	α-helix	trans	-64.1	-40.1	178	-75.3	-23.9	0	0	0	112.3	F695 S696 R703	F695-D699 PolarHBondContact O-N 3.04Å; S696-D699 PolarHBondContact O-N 3.1Å; D699-R703 WeakPolarHBondContact O-CB 3.2Å; D699-R703 VanDerWaalsContact O-CG 3.31Å; D699-R703 WeakPolarHBondContact O-CG 3.43Å; D699-R703 PolarHBondContact O-N 3.28Å; D699-R703 VanDerWaalsContact O-N 3.08Å
700	Y	57.5	Low	66.5	Low	156 Å²	156	100.2 Å²	100.2	61%	0.612	50%	0.5	S	S	*	.	H	α-helix	trans	-65.6	-40.2	173.8	-74.5	-64.5	0	0	0	112.4	S696 S698 R703 N704	S696-Y700 WeakPolarHBondContact O-CD2 3.13Å; S696-Y700 PolarHBondContact O-N 2.68Å; S696-Y700 VanDerWaalsContact O-N 3.12Å; S698-Y700 PolarHBondContact O-N 3.08Å; Y700-R703 PolarHBondContact O-N 2.57Å; Y700-N704 WeakPolarHBondContact O-CB 3.4Å; Y700-N704 PolarHBondContact O-N 3.35Å
701	S	57	Low	64.5	Low	82 Å²	82	102.1 Å²	102.1	57%	0.573	51%	0.51	S	S	*	.	H	α-helix	trans	-61.9	-47.5	177.5	-171.6	0	0	0	0	111.8	H697 S698 N704 S705	H697-S701 WeakPolarHBondContact O-CB 3.27Å; H697-S701 PolarHBondContact O-N 3.2Å; S698-S701 PolarHBondContact O-N 3.45Å; S701-N704 PolarHBondContact O-N 3.16Å; S701-S705 WeakPolarHBondContact O-CB 3.33Å; S701-S705 PolarHBondContact O-N 3.16Å
702	L	56.4	Low	62.6	Low	120 Å²	120	107.5 Å²	107.5	63%	0.628	54%	0.54	S	S	*	.	H	α-helix	trans	-61.1	-46.3	177.2	-71.3	166.9	0	0	0	112	S698 N704 S705 S706	S698-L702 WeakPolarHBondContact O-CG 3.3Å; S698-L702 PolarHBondContact O-N 3.24Å; L702-N704 PolarHBondContact O-N 2.95Å; L702-S705 PolarHBondContact O-N 3.3Å; L702-S706 PolarHBondContact O-N 3.17Å
703	R	55	Low	60.4	Low	176 Å²	176	107 Å²	107	66%	0.664	55%	0.549	S	S	*	.	H	α-helix	trans	-63.6	-40.5	178	-72	177.3	-175.5	-132.5	1.3	112.3	D699 Y700 S706 R707	D699-R703 WeakPolarHBondContact O-CB 3.2Å; D699-R703 VanDerWaalsContact O-CG 3.31Å; D699-R703 WeakPolarHBondContact O-CG 3.43Å; D699-R703 PolarHBondContact O-N 3.28Å; D699-R703 VanDerWaalsContact O-N 3.08Å; Y700-R703 PolarHBondContact O-N 2.57Å; R703-S706 PolarHBondContact O-OG 2.89Å; R703-R707 PolarHBondContact O-N 3.02Å
704	N	51.3	Low	58.3	Low	86 Å²	86	113.2 Å²	113.2	46%	0.46	57%	0.569	S	S	.	*	H	α-helix	trans	-69.9	-41.6	177	-77.9	-4.5	0	0	0	112.1	Y700 S701 L702 S706 R707 F708	Y700-N704 WeakPolarHBondContact O-CB 3.4Å; Y700-N704 PolarHBondContact O-N 3.35Å; S701-N704 PolarHBondContact O-N 3.16Å; L702-N704 PolarHBondContact O-N 2.95Å; N704-S706 VanDerWaalsContact C-N 3.31Å; N704-S706 PolarHBondContact O-N 2.86Å; N704-R707 PolarHBondContact O-N 3.24Å; N704-F708 WeakPolarHBondContact O-CD2 3.35Å; N704-F708 PolarHBondContact O-N 3.48Å; N704-F708 VanDerWaalsContact O-N 3.08Å
705	S	56.8	Low	56.1	Low	62 Å²	62	115 Å²	115	43%	0.434	59%	0.586	S	S	.	*	H	α-helix	trans	-57.2	-43.1	174.8	179.6	0	0	0	0	111.9	S701 L702 R707 F708 N709	S701-S705 WeakPolarHBondContact O-CB 3.33Å; S701-S705 PolarHBondContact O-N 3.16Å; L702-S705 PolarHBondContact O-N 3.3Å; S705-R707 PolarHBondContact O-N 3.2Å; S705-F708 PolarHBondContact O-N 3.04Å; S705-N709 PolarHBondContact O-N 3.14Å; S705-N709 VanDerWaalsContact O-N 3.12Å
706	S	54.6	Low	54.1	Low	75 Å²	75	120.2 Å²	120.2	52%	0.524	62%	0.615	S	S	.	*	H	α-helix	trans	-62.9	-24.4	175.6	66.7	0	0	0	0	114.7	L702 R703 N704	L702-S706 PolarHBondContact O-N 3.17Å; R703-S706 PolarHBondContact O-OG 2.89Å; N704-S706 VanDerWaalsContact C-N 3.31Å; N704-S706 PolarHBondContact O-N 2.86Å
707	R	49.3	Very low	52.1	Low	181 Å²	181	123.2 Å²	123.2	68%	0.683	64%	0.635	S	S	*	*	H	α-helix	trans	-86.4	-34	178.3	-76.1	-179	171.6	-174.1	-3.4	113.4	R703 N704 S705	R703-R707 PolarHBondContact O-N 3.02Å; N704-R707 PolarHBondContact O-N 3.24Å; S705-R707 PolarHBondContact O-N 3.2Å
708	F	51.3	Low	50.4	Low	146 Å²	146	121.9 Å²	121.9	64%	0.64	64%	0.641	S	S	*	*	H	α-helix	trans	-72.9	-34.4	174.6	-78.8	-72.2	0	0	0	112.1	N704 S705 S710 L711	N704-F708 WeakPolarHBondContact O-CD2 3.35Å; N704-F708 PolarHBondContact O-N 3.48Å; N704-F708 VanDerWaalsContact O-N 3.08Å; S705-F708 PolarHBondContact O-N 3.04Å; F708-S710 VanDerWaalsContact C-N 3.3Å; F708-S710 PolarHBondContact O-N 3.31Å; F708-L711 PolarHBondContact O-N 2.97Å
709	N	51.6	Low	49.1	Very low	107 Å²	107	125.7 Å²	125.7	57%	0.572	66%	0.662	S	S	*	*	H	α-helix	trans	-68.2	-25.2	179.1	-70.5	2.9	0	0	0	113.5	S705 L711	S705-N709 PolarHBondContact O-N 3.14Å; S705-N709 VanDerWaalsContact O-N 3.12Å; N709-L711 VanDerWaalsContact C-N 3.29Å; N709-L711 PolarHBondContact O-N 3.05Å
710	S	50.4	Low	47.9	Very low	90 Å²	90	128.9 Å²	128.9	63%	0.629	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	12	179.9	82.4	0	0	0	0	114.8	F708	F708-S710 VanDerWaalsContact C-N 3.3Å; F708-S710 PolarHBondContact O-N 3.31Å
711	L	49.9	Very low	47	Very low	134 Å²	134	126.6 Å²	126.6	70%	0.702	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	-10.1	-178.3	-81.4	165.5	0	0	0	114.2	F708 N709	F708-L711 PolarHBondContact O-N 2.97Å; N709-L711 VanDerWaalsContact C-N 3.29Å; N709-L711 PolarHBondContact O-N 3.05Å
712	N	51.6	Low	45.9	Very low	134 Å²	134	130.8 Å²	130.8	72%	0.717	70%	0.701	S	S	*	*	S	Bend	trans	-95.2	-14.4	-177.5	-68.8	-15.1	0	0	0	114.1	R714	N712-R714 PolarHBondContact O-N 3.42Å
713	D	44.2	Very low	45	Very low	151 Å²	151	132.2 Å²	132.2	81%	0.807	71%	0.709	S	S	*	*			trans	-82.1	56.2	-178.1	-69.8	-30	0	0	0	113.1
714	R	45	Very low	44.2	Very low	219 Å²	219	130.3 Å²	130.3	83%	0.826	71%	0.712	S	S	*	*			trans	-133.9	112	167.3	-82.9	-170.3	169.8	-170	-3.4	111.2	N712 I716	N712-R714 PolarHBondContact O-N 3.42Å; R714-I716 PolarHBondContact O-N 2.75Å
715	P	40.5	Very low	43.6	Very low	136 Å²	136	131.1 Å²	131.1	88%	0.883	72%	0.724	S	S	*	*			trans	-72.3	115.3	176.6	29.2	-32.9	0	0	0	110.4	S717	P715-S717 PolarHBondContact O-N 2.96Å
716	I	40.6	Very low	42.6	Very low	164 Å²	164	135.1 Å²	135.1	84%	0.841	74%	0.741	S	S	*	*			trans	-83.1	107.5	170.1	-61	177.7	0	0	0	107.6	R714 S718	R714-I716 PolarHBondContact O-N 2.75Å; I716-S718 PolarHBondContact O-N 2.96Å
717	S	36.9	Very low	41.9	Very low	111 Å²	111	139.8 Å²	139.8	78%	0.776	75%	0.754	S	S	*	*			trans	-71.6	124.3	173.5	-170.4	0	0	0	0	110	P715	P715-S717 PolarHBondContact O-N 2.96Å
718	S	34	Very low	41.4	Very low	103 Å²	103	138.1 Å²	138.1	72%	0.72	76%	0.757	S	S	*	*			trans	-89.5	118.4	-178.7	56.6	0	0	0	0	112	I716	I716-S718 PolarHBondContact O-N 2.96Å
719	T	38.3	Very low	40.6	Very low	133 Å²	133	139.2 Å²	139.2	82%	0.816	77%	0.768	S	S	*	*			trans	-129	119.9	161.6	46.5	0	0	0	0	108.7
720	V	33.7	Very low	39.9	Very low	140 Å²	140	137.3 Å²	137.3	85%	0.848	78%	0.775	S	S	*	*			trans	-109.5	137.6	179.6	178.4	0	0	0	0	108.7
721	S	38	Very low	39.4	Very low	109 Å²	109	140.3 Å²	140.3	76%	0.762	78%	0.784	S	S	*	*			trans	-153.4	135.8	168	52.5	0	0	0	0	108.5
722	E	34.3	Very low	38.6	Very low	169 Å²	169	141 Å²	141	79%	0.79	79%	0.787	S	S	*	*			trans	-77.7	163.3	-169.9	-56.4	111.8	133.9	0	0	114.5
723	L	37.8	Very low	37.9	Very low	150 Å²	150	142.5 Å²	142.5	79%	0.785	79%	0.789	S	S	*	*				172.4	127	112.6	-87.2	161.3	0	0	0	113.9
724	D	37.4	Very low	37.4	Very low	137 Å²	137	140.1 Å²	140.1	73%	0.733	79%	0.785	S	S	*	*			trans	63.1	125.5	136.3	-67.6	7.6	0	0	0	126.7
725	S	38.6	Very low	37.1	Very low	102 Å²	102	137.5 Å²	137.5	71%	0.713	79%	0.785	S	S	*	*			trans	87.2	95	131	-62.1	0	0	0	0	122.9
726	D	37.5	Very low	36.8	Very low	147 Å²	147	137 Å²	137	79%	0.786	78%	0.78	S	S	*	*				37.4	130.7	119.8	-62.9	-1.8	0	0	0	122.8
727	H	39.6	Very low	36.6	Very low	172 Å²	172	134 Å²	134	80%	0.796	77%	0.771	S	S	*	*				-168.4	125	114.7	-97.4	-19.1	0	0	0	115.9
728	I	38.6	Very low	36.5	Very low	146 Å²	146	135.9 Å²	135.9	75%	0.749	77%	0.772	S	S	*	*			trans	66.7	97.3	135.5	-55.8	173.2	0	0	0	120.9
729	L	35.2	Very low	36.4	Very low	169 Å²	169	140.1 Å²	140.1	89%	0.885	77%	0.774	S	S	*	*			trans	-6.3	147.3	135.4	-166	70.6	0	0	0	120.4
730	G	35.5	Very low	36.3	Very low	68 Å²	68	142.9 Å²	142.9	70%	0.701	78%	0.775	S	S	*	*			trans	-168.6	87.5	167.2	0	0	0	0	0	116.3
731	D	39.2	Very low	36.4	Very low	153 Å²	153	141.6 Å²	141.6	82%	0.818	77%	0.767	S	S	*	*			trans	55.4	125.2	154.3	-58.2	-14.9	0	0	0	124.3
732	L	34.1	Very low	36.2	Very low	148 Å²	148	143.2 Å²	143.2	78%	0.775	77%	0.768	S	S	*	*			trans	-91.7	163.4	155.1	-72	74.2	0	0	0	109.8
733	H	37.8	Very low	36.2	Very low	165 Å²	165	140.3 Å²	140.3	76%	0.764	77%	0.766	S	S	*	*				170	131.4	108	-96.9	-69.4	0	0	0	116.5
734	S	33.2	Very low	36.1	Very low	102 Å²	102	137.3 Å²	137.3	71%	0.713	76%	0.763	S	S	*	*			trans	65.9	161.8	144.1	-49.3	0	0	0	0	117.4
735	I	37.7	Very low	35.8	Very low	163 Å²	163	140.2 Å²	140.2	84%	0.836	77%	0.769	S	S	*	*			cis	-135	161.5	20.5	-70.1	171.6	0	0	0	111.2
736	T	34.5	Very low	35.5	Very low	127 Å²	127	141.8 Å²	141.8	78%	0.779	77%	0.768	S	S	*	*			trans	-79.6	164.3	-175.2	27.9	0	0	0	0	116.9
737	P	36.1	Very low	35.2	Very low	99 Å²	99	143 Å²	143	64%	0.643	77%	0.769	S	S	*	*			trans	-93.7	172.6	-174.2	38.7	-37.8	0	0	0	114.9
738	N	35.6	Very low	34.7	Very low	151 Å²	151	144.7 Å²	144.7	81%	0.807	77%	0.774	S	S	*	*			trans	-150.7	167.5	168.1	-114.9	-50.3	0	0	0	113.3
739	Y	32.7	Very low	34.7	Very low	192 Å²	192	142.9 Å²	142.9	75%	0.753	77%	0.772	S	S	*	*			trans	-119.8	152.4	-154.5	-33.8	-98.4	0	0	0	114.8
740	K	36	Very low	34.8	Very low	192 Å²	192	139.5 Å²	139.5	84%	0.835	76%	0.76	S	S	*	*				177.5	114.3	127.8	-99.6	163.2	-176.2	176.8	0	117.5
741	T	34.3	Very low	34.8	Very low	112 Å²	112	145.2 Å²	145.2	69%	0.687	77%	0.766	S	S	*	*				43.9	135.2	126.9	60.4	0	0	0	0	124.2
742	N	35.6	Very low	34.3	Very low	144 Å²	144	143.8 Å²	143.8	77%	0.77	77%	0.768	S	S	*	*			trans	111.8	102.9	151.5	-64.5	-11.8	0	0	0	115.1
743	S	34.3	Very low	34.3	Very low	107 Å²	107	139.6 Å²	139.6	75%	0.748	76%	0.76	S	S	*	*				80.9	131.1	71.9	76.1	0	0	0	0	113.4
744	A	35.7	Very low	33.9	Very low	88 Å²	88	137.3 Å²	137.3	73%	0.727	76%	0.763	S	S	*	*			cis	-165.2	171.2	-2.8	0	0	0	0	0	110.9
745	K	31.1	Very low	33.9	Very low	197 Å²	197	143 Å²	143	86%	0.857	77%	0.77	S	S	*	*			trans	67.3	146.9	174.1	-76.3	176.3	175.8	177.5	0	114.2
746	I	31.1	Very low	33.7	Very low	136 Å²	136	140.3 Å²	140.3	70%	0.697	77%	0.766	S	S	*	*			cis	-150.9	166.6	22.4	-125.2	147.6	0	0	0	110.9
747	E	31.1	Very low	33.5	Very low	172 Å²	172	141.3 Å²	141.3	80%	0.804	77%	0.771	S	S	*	*			trans	59.9	121.8	165.2	-80.1	165.4	164.9	0	0	122.3
748	F	28.8	Very low	33.4	Very low	207 Å²	207	141.7 Å²	141.7	91%	0.908	77%	0.772	S	S	*	*			trans	-107.6	131.4	148.3	-73.5	-89	0	0	0	108
749	P	39	Very low	33.3	Very low	108 Å²	108	141.7 Å²	141.7	70%	0.701	77%	0.772	S	S	*	*				-125.1	-171	101.5	40.6	-33.8	0	0	0	109.1
750	P	38.4	Very low	33.2	Very low	99 Å²	99	140.1 Å²	140.1	64%	0.643	78%	0.776	S	S	*	*			cis	-152.3	-156.2	18.2	44.8	-21.7	0	0	0	116.4
751	K	34.6	Very low	32.9	Very low	187 Å²	187	137.1 Å²	137.1	81%	0.813	77%	0.774	S	S	*	*			trans	69.3	115.9	150.3	-73.6	168.8	-163.1	173.8	0	119.5
752	S	29.3	Very low	32.9	Very low	124 Å²	124	141.6 Å²	141.6	87%	0.867	78%	0.784	S	S	*	*			trans	-37.4	135.6	143.5	50.4	0	0	0	0	114.2
753	G	33.5	Very low	32.6	Very low	59 Å²	59	139.9 Å²	139.9	61%	0.608	78%	0.78	S	S	*	*			trans	-153.2	114.4	166.8	0	0	0	0	0	110.7
754	S	28.9	Very low	32.4	Very low	118 Å²	118	141.6 Å²	141.6	83%	0.825	78%	0.78	S	S	*	*			trans	-78.5	135.7	173.2	52.1	0	0	0	0	110.7
755	Y	34.7	Very low	32.3	Very low	222 Å²	222	146 Å²	146	87%	0.871	79%	0.785	S	S	*	*			trans	-131	140	170.8	-75.2	-78.8	0	0	0	111.9
756	S	32.6	Very low	32.2	Very low	106 Å²	106	143.1 Å²	143.1	74%	0.741	78%	0.779	S	S	*	*			trans	-89.1	167.2	-178.1	48.6	0	0	0	0	112.6
757	V	29.8	Very low	32.3	Very low	147 Å²	147	144.3 Å²	144.3	89%	0.891	79%	0.787	S	S	*	*			trans	-94.6	112.5	-178.1	178.6	0	0	0	0	111.7
758	T	34.3	Very low	32.4	Very low	108 Å²	108	142.5 Å²	142.5	66%	0.663	78%	0.782	S	S	*	*			trans	-163	141.1	165.1	31.4	0	0	0	0	105.4
759	D	34.5	Very low	32.7	Very low	150 Å²	150	142.2 Å²	142.2	80%	0.802	78%	0.783	S	S	*	*			cis	-137.7	174.6	11.2	-83.9	-52.7	0	0	0	112.8
760	L	28.7	Very low	32.3	Very low	159 Å²	159	144.2 Å²	144.2	83%	0.832	79%	0.785	S	S	*	*			trans	-99.4	175.4	170.4	-85.2	166	0	0	0	112.2
761	T	31.4	Very low	32.3	Very low	130 Å²	130	147.6 Å²	147.6	80%	0.798	80%	0.796	S	S	*	*			trans	87.7	107.8	165.6	75.1	0	0	0	0	118.6
762	K	33.5	Very low	32.2	Very low	205 Å²	205	145.8 Å²	145.8	89%	0.891	80%	0.795	S	S	*	*			trans	-172.3	119.4	131.1	-103.2	167.8	-175.4	-179.7	0	109.6
763	P	30	Very low	32.5	Very low	108 Å²	108	143.6 Å²	143.6	70%	0.701	79%	0.792	S	S	*	*			trans	-99.8	-169.4	175.8	38.6	-32.9	0	0	0	112.2
764	I	30.2	Very low	32.5	Very low	143 Å²	143	152 Å²	152	73%	0.733	81%	0.806	S	S	*	*			trans	79.2	141.3	171.9	-53.8	153.2	0	0	0	111.7
765	Q	32.5	Very low	32.7	Very low	181 Å²	181	152.2 Å²	152.2	85%	0.846	80%	0.798	S	S	*	*			cis	-134.7	174.8	15.2	-146.1	135	17.9	0	0	113
766	L	28.4	Very low	32.7	Very low	137 Å²	137	149.1 Å²	149.1	72%	0.717	79%	0.791	S	S	*	*			trans	-133.9	129.7	173.3	-174.4	87	0	0	0	109
767	D	34.8	Very low	32.8	Very low	161 Å²	161	152.1 Å²	152.1	86%	0.861	79%	0.793	S	S	*	*			trans	-104.8	137.5	170.9	-88.8	-42.9	0	0	0	111.3
768	N	32.1	Very low	32.9	Very low	134 Å²	134	149.5 Å²	149.5	72%	0.717	78%	0.781	S	S	*	*			trans	-121.9	133.7	175.8	-80.7	-51.3	0	0	0	109.9
769	H	35.7	Very low	32.8	Very low	200 Å²	200	152 Å²	152	93%	0.926	79%	0.791	S	S	*	*			trans	-117.7	131.8	160.7	-108.5	-75.6	0	0	0	110.5
770	M	30.7	Very low	32.6	Very low	151 Å²	151	154 Å²	154	74%	0.744	80%	0.795	S	S	*	*			trans	-79.9	154.8	-172	-58.8	167.3	63.1	0	0	113.1
771	I	37.5	Very low	32.8	Very low	170 Å²	170	150.5 Å²	150.5	87%	0.872	79%	0.79	S	S	*	*			trans	-156.2	147.5	135.5	-103.2	150.9	0	0	0	108.9
772	N	33.8	Very low	32.8	Very low	149 Å²	149	149.4 Å²	149.4	80%	0.797	79%	0.787	S	S	*	*			trans	-82.8	142.5	-166.6	-67	-55.1	0	0	0	114.3
773	G	34.4	Very low	32.7	Very low	78 Å²	78	144.9 Å²	144.9	80%	0.804	78%	0.781	S	S	*	*			trans	-154.8	128.4	167.7	0	0	0	0	0	110.8
774	R	33.3	Very low	32.9	Very low	236 Å²	236	147.8 Å²	147.8	89%	0.891	79%	0.79	S	S	*	*			trans	-92.3	147.7	-165.3	-107.7	-179	178	154.4	-1.9	114.7
775	N	33.6	Very low	33	Very low	122 Å²	122	148.1 Å²	148.1	65%	0.652	80%	0.799	S	S	*	*			trans	85.1	114.3	143	-71.3	3.8	0	0	0	122.2
776	Q	35.4	Very low	33	Very low	157 Å²	157	144 Å²	144	73%	0.734	79%	0.79	S	S	*	*				101.4	114.5	127.1	-72.7	173.5	16.4	0	0	121.5
777	Q	34.3	Very low	33.1	Very low	168 Å²	168	146.1 Å²	146.1	79%	0.785	80%	0.801	S	S	*	*			trans	77	76.5	139	-66.3	-178.4	-10.4	0	0	120.7
778	S	31.9	Very low	33.1	Very low	92 Å²	92	143.3 Å²	143.3	64%	0.643	79%	0.79	S	S	*	*				44.9	104.4	111.7	65.6	0	0	0	0	119.4
779	N	32.2	Very low	33.1	Very low	161 Å²	161	145.3 Å²	145.3	86%	0.861	80%	0.8	S	S	*	*				-175.8	151.5	88.4	-90.2	-29.2	0	0	0	111.8
780	E	29.4	Very low	32.9	Very low	192 Å²	192	145.7 Å²	145.7	90%	0.897	79%	0.794	S	S	*	*			trans	-106.5	-176.3	-173.9	-58.9	-173.6	119.1	0	0	113.4
781	A	33	Very low	33	Very low	86 Å²	86	143.7 Å²	143.7	71%	0.711	79%	0.793	S	S	*	*			trans	82	99.7	146.7	0	0	0	0	0	120
782	S	32.6	Very low	32.6	Very low	106 Å²	106	143.4 Å²	143.4	74%	0.741	79%	0.791	S	S	*	*				55.2	101.9	109.4	-52.1	0	0	0	0	120.3
783	S	31	Very low	32.6	Very low	110 Å²	110	144.9 Å²	144.9	77%	0.769	79%	0.793	S	S	*	*				36.1	102.8	127.2	62.8	0	0	0	0	119.7
784	L	33.8	Very low	32.4	Very low	169 Å²	169	147.1 Å²	147.1	89%	0.885	79%	0.792	S	S	*	*			trans	-135.5	127.2	144.6	-79.6	-178.5	0	0	0	111.2	S786	L784-S786 PolarHBondContact O-N 3.15Å
785	T	32.2	Very low	32.6	Very low	150 Å²	150	142 Å²	142	92%	0.92	79%	0.789	S	S	*	*			trans	-71.8	115	165.1	41.1	0	0	0	0	109.5
786	S	33.5	Very low	32.7	Very low	96 Å²	96	141.7 Å²	141.7	67%	0.671	80%	0.797	S	S	*	*			trans	-123.4	124.7	176.4	-177.8	0	0	0	0	110.9	L784 T788	L784-S786 PolarHBondContact O-N 3.15Å; S786-T788 PolarHBondContact O-N 2.83Å
787	L	29.7	Very low	32.5	Very low	180 Å²	180	143.5 Å²	143.5	94%	0.942	81%	0.805	S	S	*	*			trans	-75	118.8	173	-72.6	167	0	0	0	109.4
788	T	35	Very low	32.5	Very low	102 Å²	102	145.5 Å²	145.5	63%	0.626	81%	0.811	S	S	*	*			trans	-119.8	107	171.8	33.5	0	0	0	0	111	S786 Y790	S786-T788 PolarHBondContact O-N 2.83Å; T788-Y790 PolarHBondContact O-N 2.89Å
789	L	31.9	Very low	32.4	Very low	176 Å²	176	146.5 Å²	146.5	92%	0.921	82%	0.818	S	S	*	*			trans	-68.2	113.8	165.1	-82.5	158.1	0	0	0	108.7	P791	L789-P791 WeakPolarHBondContact O-CD 3.24Å
790	Y	31	Very low	32.6	Very low	208 Å²	208	146.6 Å²	146.6	82%	0.816	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-80.4	119.7	171.1	-86.9	-95.1	0	0	0	110.4	T788	T788-Y790 PolarHBondContact O-N 2.89Å
791	P	32.8	Very low	32.5	Very low	109 Å²	109	144.3 Å²	144.3	71%	0.708	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-75.2	152.6	173.8	32	-34.5	0	0	0	111.3	L789	L789-P791 WeakPolarHBondContact O-CD 3.24Å
792	I	29	Very low	32.6	Very low	164 Å²	164	152.1 Å²	152.1	84%	0.841	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-77.3	124.5	175.2	-61.3	167.8	0	0	0	109.2
793	Q	34.2	Very low	32.6	Very low	180 Å²	180	156 Å²	156	84%	0.841	83%	0.828	S	S	*	*			trans	-128.3	133	163.5	-81.1	-173.6	-29.8	0	0	111.1
794	T	31.1	Very low	32.8	Very low	126 Å²	126	156 Å²	156	77%	0.773	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-90.3	128.5	180	43.7	0	0	0	0	110.8	S796	T794-S796 PolarHBondContact O-N 3.14Å
795	P	37.7	Very low	32.7	Very low	128 Å²	128	159.4 Å²	159.4	83%	0.831	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-73.3	128.5	170.5	29.4	-32.2	0	0	0	110.1
796	S	34.5	Very low	32.9	Very low	116 Å²	116	159.5 Å²	159.5	81%	0.811	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-84.8	159.5	176.5	58.1	0	0	0	0	112.3	T794	T794-S796 PolarHBondContact O-N 3.14Å
797	Q	31.5	Very low	33	Very low	194 Å²	194	162 Å²	162	91%	0.907	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-66.7	133.7	-179.1	-62.6	173.5	-14.9	0	0	112.2
798	K	34.9	Very low	33.1	Very low	210 Å²	210	162.5 Å²	162.5	91%	0.913	82%	0.824	S	S	*	*			trans	-138.4	138.9	145	-76.7	-164.2	176.6	178.7	0	110.6
799	S	28.9	Very low	33.2	Very low	113 Å²	113	166.1 Å²	166.1	79%	0.79	83%	0.834	S	S	*	*			trans	-95.1	143.5	-176	48	0	0	0	0	112.1
800	I	36.5	Very low	33.3	Very low	163 Å²	163	163.3 Å²	163.3	84%	0.836	82%	0.82	S	S	*	*			trans	-136	123.1	162.1	-61.8	-176.7	0	0	0	108.4
801	N	28.9	Very low	33.5	Very low	145 Å²	145	159.6 Å²	159.6	78%	0.775	81%	0.813	S	S	*	*			trans	-82.6	138	174.8	-72.6	-35	0	0	0	111.2
802	R	35.1	Very low	33.5	Very low	250 Å²	250	163.1 Å²	163.1	94%	0.943	82%	0.817	S	S	*	*			trans	-140.7	147.6	147.1	-75.4	-161.5	170.7	-175	-2.7	109.4
803	Q	30.9	Very low	33.7	Very low	186 Å²	186	160.9 Å²	160.9	87%	0.869	82%	0.816	S	S	*	*			trans	-149.2	118.1	-157.7	-167.4	165.6	12.9	0	0	114
804	S	36.1	Very low	33.6	Very low	112 Å²	112	158.3 Å²	158.3	78%	0.783	81%	0.812	S	S	*	*			trans	-160	106.1	170.5	48.4	0	0	0	0	106.5
805	R	32.1	Very low	33.7	Very low	240 Å²	240	161.8 Å²	161.8	91%	0.906	82%	0.817	S	S	*	*			cis	82.5	145.5	49.5	-154.7	-177.5	-152	-169.6	7.7	111.1
806	L	36.4	Very low	33.5	Very low	151 Å²	151	164.9 Å²	164.9	79%	0.791	82%	0.817	S	S	*	*			trans	80.3	124.3	-152.4	-53.3	168.5	0	0	0	110.9
807	D	35.1	Very low	33.5	Very low	150 Å²	150	170.5 Å²	170.5	80%	0.802	82%	0.82	S	S	*	*			cis	-140.5	173.5	-2.4	-103	-43.9	0	0	0	114.3
808	K	32.4	Very low	33.8	Very low	190 Å²	190	168.4 Å²	168.4	83%	0.826	81%	0.814	S	S	*	*			trans	-123.5	145.4	-173.4	-77.6	-177.9	173.3	-178.3	0	113.5
809	Q	35.9	Very low	33.8	Very low	177 Å²	177	168 Å²	168	83%	0.827	81%	0.812	S	S	*	*			trans	136.6	141.4	160.6	-80.7	167.5	69.9	0	0	108.7
810	N	34.1	Very low	34.1	Very low	117 Å²	117	166.1 Å²	166.1	63%	0.626	81%	0.811	S	S	*	*			cis	-144.6	129	-3	-95.6	-32.8	0	0	0	108.9
811	I	35.4	Very low	34.1	Very low	131 Å²	131	166 Å²	166	67%	0.672	81%	0.812	S	S	*	*				79.7	101.9	93.2	-66.7	-177.2	0	0	0	116.8
812	K	32.7	Very low	34.4	Very low	183 Å²	183	162.5 Å²	162.5	80%	0.796	81%	0.81	S	S	*	*			trans	67.8	137.7	140.8	-62.4	174.1	-169.8	173.6	0	123.5
813	S	34.1	Very low	34.4	Very low	117 Å²	117	156.7 Å²	156.7	82%	0.818	80%	0.804	S	S	*	*			trans	72	152.1	164.3	79.7	0	0	0	0	115.4
814	V	31.7	Very low	34.7	Very low	126 Å²	126	154 Å²	154	76%	0.764	81%	0.806	S	S	*	*			cis	-127.8	154.1	25.2	170.8	0	0	0	0	113.4
815	K	32.3	Very low	34.7	Very low	199 Å²	199	153.3 Å²	153.3	87%	0.865	81%	0.807	S	S	*	*			trans	-125.3	148.7	170.2	-169.5	177.2	-175.1	178.1	0	108.7
816	K	34.5	Very low	35	Very low	192 Å²	192	153.8 Å²	153.8	84%	0.835	81%	0.809	S	S	*	*			trans	76.4	113.5	-170.9	-60.1	-178.9	175.1	-179.9	0	116.5
817	R	34.5	Very low	35.1	Very low	235 Å²	235	157.6 Å²	157.6	89%	0.887	81%	0.813	S	S	*	*				178.2	148.1	120	-96	-173.5	-78.7	-174.1	-3	107.4
818	I	37.8	Very low	35	Very low	149 Å²	149	155.7 Å²	155.7	76%	0.764	81%	0.81	S	S	*	*			cis	-152.9	161	-26	-122.9	171.7	0	0	0	105.6	G820	I818-G820 PolarHBondContact O-N 2.96Å
819	F	34.7	Very low	35.4	Very low	202 Å²	202	152.8 Å²	152.8	89%	0.886	81%	0.808	S	S	*	*			trans	-67.7	123.5	173.6	-76.4	-97	0	0	0	110.8
820	G	35.6	Very low	35.6	Very low	74 Å²	74	155.2 Å²	155.2	76%	0.763	81%	0.81	S	S	*	*			trans	-115.2	117.5	172	0	0	0	0	0	110.5	I818	I818-G820 PolarHBondContact O-N 2.96Å
821	N	36.2	Very low	35.8	Very low	161 Å²	161	154.3 Å²	154.3	86%	0.861	81%	0.813	S	S	*	*			trans	-87.5	130	-175.1	-67.5	-31.7	0	0	0	111.7
822	G	35.3	Very low	35.9	Very low	70 Å²	70	155.6 Å²	155.6	72%	0.722	82%	0.819	S	S	*	*			trans	-141.2	115.2	174.5	0	0	0	0	0	111.1
823	P	33.7	Very low	36.3	Very low	128 Å²	128	150.2 Å²	150.2	83%	0.831	81%	0.805	S	S	*	*			trans	-98.7	99.7	-164.1	35.2	-33.8	0	0	0	114.7
824	S	37.5	Very low	36.4	Very low	129 Å²	129	152.7 Å²	152.7	90%	0.902	80%	0.803	S	S	*	*			trans	-168.9	73	148.5	-88.2	0	0	0	0	113.2
825	A	35.9	Very low	36.6	Very low	98 Å²	98	154 Å²	154	81%	0.81	81%	0.805	S	S	*	*			trans	-136.3	73	170.6	0	0	0	0	0	110.8	R827	A825-R827 PolarHBondContact O-N 2.87Å; A825-R827 VanDerWaalsContact O-N 3.12Å
826	R	39.5	Very low	36.7	Very low	251 Å²	251	149.8 Å²	149.8	95%	0.947	80%	0.8	S	S	*	*			trans	-71.9	104.4	172.7	-69	-168	-175.7	-158.9	4.7	109.3	C828	R826-C828 PolarHBondContact O-N 3.01Å
827	R	37.3	Very low	36.8	Very low	231 Å²	231	145.7 Å²	145.7	87%	0.872	80%	0.795	S	S	*	*			trans	-52.7	122	166.5	-78.7	-179.2	168.9	-175.5	-3.5	109.3	A825	A825-R827 PolarHBondContact O-N 2.87Å; A825-R827 VanDerWaalsContact O-N 3.12Å
828	C	34.7	Very low	37	Very low	110 Å²	110	140.1 Å²	140.1	74%	0.743	79%	0.79	S	S	*	*			trans	-103.2	100	161.6	-165.8	0	0	0	0	108.4	R826 R830	R826-C828 PolarHBondContact O-N 3.01Å; C828-R830 PolarHBondContact O-N 3.17Å
829	T	40	Very low	37.2	Very low	128 Å²	128	142.1 Å²	142.1	79%	0.785	79%	0.793	S	S	*	*			trans	-84.9	98.1	175.8	47	0	0	0	0	109.6
830	R	41	Very low	37.3	Very low	228 Å²	228	140.1 Å²	140.1	86%	0.86	79%	0.792	S	S	*	*			trans	-126.6	150.3	165.7	-76.4	-167.6	170	-142.8	-2.3	110.5	C828	C828-R830 PolarHBondContact O-N 3.17Å
831	S	36.5	Very low	37.9	Very low	98 Å²	98	142.4 Å²	142.4	69%	0.685	79%	0.785	S	S	*	*			trans	-72.3	147.3	-170	47	0	0	0	0	113.6	S833	S831-S833 PolarHBondContact O-N 3.28Å; S831-S833 VanDerWaalsContact O-N 3.13Å
832	I	38.1	Very low	38.5	Very low	158 Å²	158	138.3 Å²	138.3	81%	0.81	77%	0.769	S	S	*	*	S	Bend	trans	-79.5	91.3	171.2	-58.4	171.7	0	0	0	107.9	I835	I832-I835 HydrophobicContact CG2-CD1 4.29Å
833	S	41.4	Very low	39.4	Very low	70 Å²	70	139 Å²	139	49%	0.49	76%	0.756	S	S	.	*			trans	-144.1	7.3	-178.7	60.1	0	0	0	0	115.5	S831	S831-S833 PolarHBondContact O-N 3.28Å; S831-S833 VanDerWaalsContact O-N 3.13Å
834	H	36.6	Very low	40.3	Very low	169 Å²	169	134.1 Å²	134.1	78%	0.782	72%	0.724	S	S	*	*			trans	-132.4	12	-178	-68.7	-76.6	0	0	0	114.8	S836	H834-S836 VanDerWaalsContact C-N 3.27Å; H834-S836 PolarHBondContact O-N 2.83Å; H834-S836 VanDerWaalsContact O-N 3.11Å
835	I	35.9	Very low	41.3	Very low	155 Å²	155	136.4 Å²	136.4	80%	0.795	71%	0.714	S	S	*	*			trans	-89.3	64.1	178.7	-47.7	-178.6	0	0	0	109.8	I832	I832-I835 HydrophobicContact CG2-CD1 4.29Å
836	S	34.2	Very low	42.5	Very low	109 Å²	109	135.8 Å²	135.8	76%	0.762	69%	0.691	S	S	*	*			trans	-158.8	58.3	179.8	63.9	0	0	0	0	113.7	H834	H834-S836 VanDerWaalsContact C-N 3.27Å; H834-S836 PolarHBondContact O-N 2.83Å; H834-S836 VanDerWaalsContact O-N 3.11Å
837	S	35.8	Very low	43.8	Very low	106 Å²	106	125.6 Å²	125.6	74%	0.741	66%	0.655	S	S	*	*			trans	-121.1	121	159.9	58.7	0	0	0	0	109.1
838	P	39.7	Very low	45.1	Very low	119 Å²	119	121.3 Å²	121.3	77%	0.773	64%	0.639	S	S	*	*			trans	-70.2	152.6	177.7	30.1	-34.4	0	0	0	111.1	N840	P838-N840 PolarHBondContact O-N 3.44Å; P838-N840 VanDerWaalsContact O-N 3.16Å
839	F	41.4	Very low	46.7	Very low	191 Å²	191	117.4 Å²	117.4	84%	0.838	61%	0.614	S	S	*	*			trans	-57.2	117.6	-179.6	-55.2	-85.3	0	0	0	111.2	I841	F839-I841 VanDerWaalsContact C-N 3.32Å; F839-I841 PolarHBondContact O-N 3.36Å
840	N	37.7	Very low	47.8	Very low	159 Å²	159	113.3 Å²	113.3	85%	0.85	59%	0.591	S	S	*	*			trans	-84.4	73.7	-171.2	-157.9	4	0	0	0	110.9	P838 S842	P838-N840 PolarHBondContact O-N 3.44Å; P838-N840 VanDerWaalsContact O-N 3.16Å; N840-S842 PolarHBondContact O-N 3.06Å
841	I	47	Very low	48.9	Very low	123 Å²	123	108.8 Å²	108.8	63%	0.631	58%	0.575	S	S	*	*			trans	-70.3	96.2	179.5	-57.9	170.5	0	0	0	108.9	F839	F839-I841 VanDerWaalsContact C-N 3.32Å; F839-I841 PolarHBondContact O-N 3.36Å
842	S	49.9	Very low	50.4	Low	75 Å²	75	108.6 Å²	108.6	52%	0.524	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-76.4	128.9	172.5	57.4	0	0	0	0	111	N840	N840-S842 PolarHBondContact O-N 3.06Å
843	L	54.3	Low	51.8	Low	83 Å²	83	105.7 Å²	105.7	44%	0.435	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-64.2	135.2	174.9	-62.3	172.8	0	0	0	110.4	I847 Y851	L843-I847 HydrophobicContact CB-CB 4.2Å; L843-I847 HydrophobicContact CB-CG2 4.13Å; L843-I847 HydrophobicContact CD1-CG2 4.1Å; L843-I847 HydrophobicContact CD2-CG2 4.15Å; L843-I847 HydrophobicContact CG-CG2 4.35Å; L843-Y851 HydrophobicContact CD1-CD2 4.28Å; L843-Y851 HydrophobicContact CD1-CG 4.49Å
844	P	53	Low	52.7	Low	27 Å²	27	107.7 Å²	107.7	18%	0.175	55%	0.549	C	S	.	.	P	Polyproline II helix	trans	-49.5	147.2	171.6	-28.8	34.6	0	0	0	112.4	W846 I847 R848	P844-W846 VanDerWaalsContact C-N 3.26Å; P844-W846 PolarHBondContact O-N 2.81Å; P844-I847 HydrophobicContact CB-CG1 4.47Å; P844-I847 HydrophobicContact CG-CD1 4.32Å; P844-I847 WeakPolarHBondContact O-CA 3.33Å; P844-I847 PolarHBondContact O-N 2.83Å; P844-R848 PolarHBondContact O-N 2.82Å
845	Y	58.4	Low	53.9	Low	176 Å²	176	104.3 Å²	104.3	69%	0.69	54%	0.535	S	S	*	.	H	α-helix	trans	-50.2	-40.8	-170.4	175.5	-99.2	0	0	0	114.3	R848 A849	Y845-R848 PolarHBondContact O-N 2.78Å; Y845-A849 WeakPolarHBondContact O-CB 3.45Å; Y845-A849 PolarHBondContact O-N 3.06Å
846	W	60.6	Low	55.1	Low	85 Å²	85	101.2 Å²	101.2	32%	0.322	52%	0.52	S	S	.	.	H	α-helix	trans	-72.3	-31.6	178.7	64.5	-91.6	0	0	0	113.5	E525 P844 S850	E525-W846 VanDerWaalsContact O-CH2 3.24Å; E525-W846 WeakPolarHBondContact O-CH2 3.47Å; E525-W846 WeakPolarHBondContact O-CZ3 3.44Å; P844-W846 VanDerWaalsContact C-N 3.26Å; P844-W846 PolarHBondContact O-N 2.81Å; W846-S850 WeakPolarHBondContact O-CB 3.32Å; W846-S850 PolarHBondContact O-N 3.17Å
847	I	66.3	Low	56.3	Low	37 Å²	37	99.7 Å²	99.7	19%	0.19	50%	0.501	C	S	.	.	H	α-helix	trans	-70.2	-43.7	169.8	-56.8	-171.8	0	0	0	109.1	L843 P844 S850 Y851	L843-I847 HydrophobicContact CB-CB 4.2Å; L843-I847 HydrophobicContact CB-CG2 4.13Å; L843-I847 HydrophobicContact CD1-CG2 4.1Å; L843-I847 HydrophobicContact CD2-CG2 4.15Å; L843-I847 HydrophobicContact CG-CG2 4.35Å; P844-I847 HydrophobicContact CB-CG1 4.47Å; P844-I847 HydrophobicContact CG-CD1 4.32Å; P844-I847 WeakPolarHBondContact O-CA 3.33Å; P844-I847 PolarHBondContact O-N 2.83Å; I847-S850 CarbonylContact O-C 3.52Å; I847-S850 PolarHBondContact O-N 3.45Å; I847-Y851 WeakPolarHBondContact O-CB 3Å; I847-Y851 PolarHBondContact O-N 3.22Å
848	R	65.2	Low	57	Low	142 Å²	142	97.8 Å²	97.8	54%	0.536	49%	0.485	S	S	.	.	H	α-helix	trans	-58.3	-49.5	177.7	-174.7	178.3	-174.4	134.2	10.3	111.5	P844 Y845 S850 Y851 E852	P844-R848 PolarHBondContact O-N 2.82Å; Y845-R848 PolarHBondContact O-N 2.78Å; R848-S850 PolarHBondContact O-N 3.08Å; R848-Y851 WeakPolarHBondContact O-CB 3.34Å; R848-Y851 PolarHBondContact O-N 3.13Å; R848-Y851 VanDerWaalsContact O-N 3.09Å; R848-E852 HydrophobicContact CG-CG 4.46Å; R848-E852 WeakPolarHBondContact CG-OE1 3.42Å; R848-E852 IonicContact CZ-OE1 2.72Å; R848-E852 IonicContact NE-OE1 2.81Å; R848-E852 PolarHBondContact NE-OE1 3.15Å; R848-E852 IonicContact NH2-OE1 2.64Å; R848-E852 WeakPolarHBondContact O-CB 3.26Å; R848-E852 WeakPolarHBondContact O-CG 3.49Å; R848-E852 PolarHBondContact O-N 3Å
849	A	68	Low	57.4	Low	27 Å²	27	97.1 Å²	97.1	22%	0.223	47%	0.474	C	S	.	.	H	α-helix	trans	-57.3	-49	173.6	0	0	0	0	0	111.2	Y845 Y851 E852 D853	Y845-A849 WeakPolarHBondContact O-CB 3.45Å; Y845-A849 PolarHBondContact O-N 3.06Å; A849-Y851 PolarHBondContact O-N 2.81Å; A849-E852 PolarHBondContact O-N 3.16Å; A849-D853 WeakPolarHBondContact O-CB 3.26Å; A849-D853 VanDerWaalsContact O-CG 3.28Å; A849-D853 PolarHBondContact O-N 2.97Å
850	S	63	Low	57.8	Low	43 Å²	43	91.7 Å²	91.7	30%	0.301	45%	0.454	S	S	.	.	H	α-helix	trans	-64.5	-20.3	176.5	-175.7	0	0	0	0	114.4	W846 I847 R848 K854	W846-S850 WeakPolarHBondContact O-CB 3.32Å; W846-S850 PolarHBondContact O-N 3.17Å; I847-S850 CarbonylContact O-C 3.52Å; I847-S850 PolarHBondContact O-N 3.45Å; R848-S850 PolarHBondContact O-N 3.08Å; S850-K854 WeakPolarHBondContact O-CB 3.28Å; S850-K854 WeakPolarHBondContact O-CG 3.41Å; S850-K854 PolarHBondContact O-N 2.87Å
851	Y	63.5	Low	58.3	Low	133 Å²	133	89.5 Å²	89.5	52%	0.522	44%	0.438	S	S	.	.	H	α-helix	trans	-85.2	-40.4	174.4	-134.4	-90.4	0	0	0	111.1	L843 I847 R848 A849 K854 M855	L843-Y851 HydrophobicContact CD1-CD2 4.28Å; L843-Y851 HydrophobicContact CD1-CG 4.49Å; I847-Y851 WeakPolarHBondContact O-CB 3Å; I847-Y851 PolarHBondContact O-N 3.22Å; R848-Y851 WeakPolarHBondContact O-CB 3.34Å; R848-Y851 PolarHBondContact O-N 3.13Å; R848-Y851 VanDerWaalsContact O-N 3.09Å; A849-Y851 PolarHBondContact O-N 2.81Å; Y851-K854 PolarHBondContact O-N 2.98Å; Y851-M855 HydrophobicContact CD1-CE 4.07Å; Y851-M855 HydrophobicContact CD1-CG 4.3Å; Y851-M855 HydrophobicContact CE1-CE 3.64Å; Y851-M855 VanDerWaalsContact O-CB 3.3Å; Y851-M855 WeakPolarHBondContact O-CB 3.29Å; Y851-M855 WeakPolarHBondContact O-CG 3.25Å; Y851-M855 PolarHBondContact O-N 3.09Å
852	E	68.9	Low	58.7	Low	93 Å²	93	89.2 Å²	89.2	44%	0.435	44%	0.443	S	S	.	.	H	α-helix	trans	-65.6	-40	173.8	-71.9	170.4	-174.7	0	0	110.2	R848 A849 M855 N856	R848-E852 HydrophobicContact CG-CG 4.46Å; R848-E852 WeakPolarHBondContact CG-OE1 3.42Å; R848-E852 IonicContact CZ-OE1 2.72Å; R848-E852 IonicContact NE-OE1 2.81Å; R848-E852 PolarHBondContact NE-OE1 3.15Å; R848-E852 IonicContact NH2-OE1 2.64Å; R848-E852 WeakPolarHBondContact O-CB 3.26Å; R848-E852 WeakPolarHBondContact O-CG 3.49Å; R848-E852 PolarHBondContact O-N 3Å; A849-E852 PolarHBondContact O-N 3.16Å; E852-M855 PolarHBondContact O-N 3.49Å; E852-N856 WeakPolarHBondContact O-CB 3.31Å; E852-N856 PolarHBondContact O-N 2.97Å; E852-N856 PolarHBondContact O-ND2 3.35Å
853	D	66.9	Low	58.8	Low	98 Å²	98	91.4 Å²	91.4	52%	0.524	45%	0.453	S	S	.	.	H	α-helix	trans	-59.9	-53.2	170.4	-71.3	-29.5	0	0	0	111.5	A849 M855 N856 E857	A849-D853 WeakPolarHBondContact O-CB 3.26Å; A849-D853 VanDerWaalsContact O-CG 3.28Å; A849-D853 PolarHBondContact O-N 2.97Å; D853-M855 VanDerWaalsContact C-N 3.3Å; D853-M855 PolarHBondContact O-N 3.18Å; D853-N856 CarbonylContact O-C 3.58Å; D853-N856 WeakPolarHBondContact O-CB 3.38Å; D853-N856 PolarHBondContact O-N 3.16Å; D853-E857 WeakPolarHBondContact O-CG 3.45Å; D853-E857 PolarHBondContact O-N 2.97Å
854	K	61.6	Low	58.1	Low	112 Å²	112	97.3 Å²	97.3	49%	0.487	48%	0.483	S	S	.	.	H	α-helix	trans	-62.2	-34.1	178	-80.5	179.3	175.4	178.4	0	113.5	S850 Y851 T858	S850-K854 WeakPolarHBondContact O-CB 3.28Å; S850-K854 WeakPolarHBondContact O-CG 3.41Å; S850-K854 PolarHBondContact O-N 2.87Å; Y851-K854 PolarHBondContact O-N 2.98Å; K854-T858 PolarHBondContact O-N 2.83Å; K854-T858 PolarHBondContact O-OG1 3.26Å
855	M	61.5	Low	58.4	Low	98 Å²	98	100.8 Å²	100.8	48%	0.483	50%	0.499	S	S	.	.	H	α-helix	trans	-69.2	-36.4	173.8	-74.7	-72.5	172.2	0	0	111.4	Y851 E852 D853 T858 L859	Y851-M855 HydrophobicContact CD1-CE 4.07Å; Y851-M855 HydrophobicContact CD1-CG 4.3Å; Y851-M855 HydrophobicContact CE1-CE 3.64Å; Y851-M855 VanDerWaalsContact O-CB 3.3Å; Y851-M855 WeakPolarHBondContact O-CB 3.29Å; Y851-M855 WeakPolarHBondContact O-CG 3.25Å; Y851-M855 PolarHBondContact O-N 3.09Å; E852-M855 PolarHBondContact O-N 3.49Å; D853-M855 VanDerWaalsContact C-N 3.3Å; D853-M855 PolarHBondContact O-N 3.18Å; M855-T858 PolarHBondContact O-OG1 3.06Å; M855-L859 VanDerWaalsContact O-CB 3.25Å; M855-L859 WeakPolarHBondContact O-CB 3.29Å; M855-L859 WeakPolarHBondContact O-CG 3.45Å; M855-L859 PolarHBondContact O-N 3.26Å
856	N	61	Low	58.4	Low	89 Å²	89	96.8 Å²	96.8	48%	0.476	49%	0.489	S	S	.	.	H	α-helix	trans	-70.4	-39.6	173.2	-69.8	-39.1	0	0	0	112.1	E852 D853 N860	E852-N856 WeakPolarHBondContact O-CB 3.31Å; E852-N856 PolarHBondContact O-N 2.97Å; E852-N856 PolarHBondContact O-ND2 3.35Å; D853-N856 CarbonylContact O-C 3.58Å; D853-N856 WeakPolarHBondContact O-CB 3.38Å; D853-N856 PolarHBondContact O-N 3.16Å; N856-N860 WeakPolarHBondContact O-CB 3.46Å; N856-N860 PolarHBondContact O-N 3.4Å; N856-N860 PolarHBondContact O-ND2 2.66Å; N856-N860 VanDerWaalsContact O-ND2 3.09Å
857	E	58	Low	58.2	Low	77 Å²	77	97.5 Å²	97.5	36%	0.36	50%	0.498	S	S	.	.	H	α-helix	trans	-59	-53.1	173.3	-72.3	-179.5	141.3	0	0	110.7	Y164 D853 L859 N860 E861	Y164-E857 HydrophobicContact CD2-CG 4.4Å; Y164-E857 HydrophobicContact CE2-CG 3.79Å; D853-E857 WeakPolarHBondContact O-CG 3.45Å; D853-E857 PolarHBondContact O-N 2.97Å; E857-L859 PolarHBondContact O-N 2.93Å; E857-N860 PolarHBondContact O-N 3.29Å; E857-E861 PolarHBondContact O-N 2.98Å
858	T	51.2	Low	57.8	Low	67 Å²	67	101.1 Å²	101.1	41%	0.411	52%	0.516	S	S	.	.	H	α-helix	trans	-68	-33.2	-179.8	47.8	0	0	0	0	113.8	K854 M855 E861 T862	K854-T858 PolarHBondContact O-N 2.83Å; K854-T858 PolarHBondContact O-OG1 3.26Å; M855-T858 PolarHBondContact O-OG1 3.06Å; T858-E861 PolarHBondContact O-N 2.47Å; T858-T862 WeakPolarHBondContact O-CB 3.29Å; T858-T862 PolarHBondContact O-N 3.49Å; T858-T862 VanDerWaalsContact O-N 3.08Å; T858-T862 PolarHBondContact O-OG1 3.3Å
859	L	47.9	Very low	57.3	Low	104 Å²	104	98.5 Å²	98.5	55%	0.545	52%	0.515	S	S	.	.	H	α-helix	trans	-64.6	-40.2	170.1	-87.5	162.3	0	0	0	111.9	M855 E857 T862 V863	M855-L859 VanDerWaalsContact O-CB 3.25Å; M855-L859 WeakPolarHBondContact O-CB 3.29Å; M855-L859 WeakPolarHBondContact O-CG 3.45Å; M855-L859 PolarHBondContact O-N 3.26Å; E857-L859 PolarHBondContact O-N 2.93Å; L859-T862 PolarHBondContact O-N 2.94Å; L859-V863 WeakPolarHBondContact O-CB 3.38Å; L859-V863 VanDerWaalsContact O-CG2 3.23Å; L859-V863 WeakPolarHBondContact O-CG2 3.37Å; L859-V863 PolarHBondContact O-N 3.34Å
860	N	50.4	Low	56.6	Low	77 Å²	77	103.3 Å²	103.3	41%	0.412	53%	0.534	S	S	.	.	H	α-helix	trans	-67.3	-40.5	175.6	-68.4	-29.4	0	0	0	111.8	Y164 N856 E857 T862 V863 L864	Y164-N860 PolarHBondContact OH-ND2 3.48Å; N856-N860 WeakPolarHBondContact O-CB 3.46Å; N856-N860 PolarHBondContact O-N 3.4Å; N856-N860 PolarHBondContact O-ND2 2.66Å; N856-N860 VanDerWaalsContact O-ND2 3.09Å; E857-N860 PolarHBondContact O-N 3.29Å; N860-T862 PolarHBondContact O-N 3.17Å; N860-V863 PolarHBondContact O-N 3.48Å; N860-L864 PolarHBondContact O-N 3.38Å; N860-L864 VanDerWaalsContact O-N 3.11Å
861	E	47.7	Very low	56.1	Low	113 Å²	113	107.6 Å²	107.6	53%	0.528	55%	0.551	S	S	.	*	H	α-helix	trans	-70.1	-10.6	175	-70.6	-171.6	143.8	0	0	114.3	F162 E857 T858	F162-E861 WeakPolarHBondContact CZ-OE1 3.15Å; E857-E861 PolarHBondContact O-N 2.98Å; T858-E861 PolarHBondContact O-N 2.47Å
862	T	55.2	Low	55.6	Low	117 Å²	117	105.6 Å²	105.6	72%	0.718	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.3	2.5	174.5	-41.3	0	0	0	0	112.4	T858 L859 N860	T858-T862 WeakPolarHBondContact O-CB 3.29Å; T858-T862 PolarHBondContact O-N 3.49Å; T858-T862 VanDerWaalsContact O-N 3.08Å; T858-T862 PolarHBondContact O-OG1 3.3Å; L859-T862 PolarHBondContact O-N 2.94Å; N860-T862 PolarHBondContact O-N 3.17Å
863	V	51.9	Low	54.4	Low	121 Å²	121	106.7 Å²	106.7	73%	0.733	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.1	-9.7	-178.6	172.6	0	0	0	0	112.4	L859 N860	L859-V863 WeakPolarHBondContact O-CB 3.38Å; L859-V863 VanDerWaalsContact O-CG2 3.23Å; L859-V863 WeakPolarHBondContact O-CG2 3.37Å; L859-V863 PolarHBondContact O-N 3.34Å; N860-V863 PolarHBondContact O-N 3.48Å
864	L	40.1	Very low	53.3	Low	207 Å²	207	107.5 Å²	107.5	100%	1.084	57%	0.567	S	S	*	*			trans	-95.1	0	167	-72.5	169.4	0	0	0	111.6	N860	N860-L864 PolarHBondContact O-N 3.38Å; N860-L864 VanDerWaalsContact O-N 3.11Å

Retrieved 864 of 864 residues in 1129.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).