A0A3Q0KLT0_SCHMA Loading...

Eukaryotic release factor 3-related (Erfs) (Hbs1-like)

AlphaFold DB , UniProt , Accession A0A3Q0KLT0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 871 aa.

						>A0A3Q0KLT0_SCHMA|A0A3Q0KLT0
MSRHRNVRALYDDDVDTYDEAFASSVDDDYTISPNTSERYIFNPDSVFKQDISVSLTNVKPLSFTAEDFPANDSENFKPEDSPGVVSGRIGSYQGFDFSVPRNNEVTNQNDSVHGSDEVFGNSDLFDSSNFKPLNTSVVGGDKLVDSTISVNKSRVEELDFELLDRLTSQSPSTQQSFQKPAKTTVSIQDTTSRLKSKSTNLHFLSKTTSLFSSNCSISKLAGITAYDMPIKTVDSTGCLIGYKTPSFFGLLMSSYTANKSKGFDGMLSRFSNIIVRTRSPIYNYLFAPRTVSGFVFDIPEPKTFERCGSKLASVTTRPCSQRKVTAHALGVPQARPTEEVNRADTSLLNLSLSQKLTISSHSDERSNFLRTPGNNSATPSKPIDRHSLVSEYSKLHKESAEKQIINLIVMGHVDAGKSTLMGNLLCLLGHVSSKQLAKYQWDAQKLGKASFAYAWILDQTSEERNRGVTMDIAQTSFETKSKRVALMDAPGHKDFVPQVIGGATQADAALLVINATRGEFETGIGAGGQTREHARLARLLGVSRLIVAVNKMDTVEWCQSRFNEIQTQISSFLKSMNFSGVMYCPVSGLVGANLVPQNLSSSSKNASDTSSNLFTWYTGPSLLELIDSIPPPERTVDGPFRFVVSDIFKPAGSSVPMVAGRVISGAISSGVNIPTSKVICLPSDVRTCVKSIRSLCNTRTSQNDAEGDLGGKLLDQVVKFAFSGDQVALMLTDIDPFQTLIPGDLLTDPDNPIQPSTCISAKLLVFSIQQPITKGYPVIYYYNCANVAATITKLKSMTHRENKIEKVVRKPRCLLGNCTANVELTFERPICIEVYEKCKPLGRFMLRVGGESIAGGTVTKIIPSKKESSS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.9	Very low	37.4	Very low	243 Å²	243	182.5 Å²	182.5	100%	1.197	88%	0.875	S	S	*	*				0	120.7	0	-54.1	172.6	105.7	0	0	105.5
2	S	37.6	Very low	37.3	Very low	116 Å²	116	177.8 Å²	177.8	81%	0.811	86%	0.859	S	S	*	*			cis	-146.2	-173.1	33.2	-62.6	0	0	0	0	112.2
3	R	38.5	Very low	37.3	Very low	247 Å²	247	175.6 Å²	175.6	93%	0.932	85%	0.854	S	S	*	*			trans	89	58	177.8	-56	-177.1	174.6	176.7	-1.8	117.8
4	H	35.8	Very low	37.2	Very low	193 Å²	193	174 Å²	174	89%	0.894	85%	0.851	S	S	*	*			trans	-116.9	115.1	141.1	-95.2	-46.9	0	0	0	108.9
5	R	42.7	Very low	37.4	Very low	233 Å²	233	171.5 Å²	171.5	88%	0.879	85%	0.85	S	S	*	*			trans	161.6	140.8	173.8	-97.6	167	-172	-172.1	3.5	105.3
6	N	37.4	Very low	37.2	Very low	136 Å²	136	169.9 Å²	169.9	73%	0.727	85%	0.845	S	S	*	*			cis	-156.8	126.1	-3.7	-135.8	15.7	0	0	0	106.9
7	V	36.8	Very low	37.1	Very low	153 Å²	153	167.4 Å²	167.4	93%	0.927	84%	0.842	S	S	*	*			trans	-124.4	120.2	167.4	-177.4	0	0	0	0	107.2
8	R	38.1	Very low	37.1	Very low	228 Å²	228	168.5 Å²	168.5	86%	0.86	84%	0.836	S	S	*	*			trans	-117.1	134.9	-179.4	-131.3	177.9	-174.8	167	0	107.3
9	A	33.3	Very low	37.1	Very low	86 Å²	86	167.2 Å²	167.2	71%	0.711	83%	0.832	S	S	*	*			trans	-66	144.4	-177.3	0	0	0	0	0	112.2
10	L	38.7	Very low	37	Very low	174 Å²	174	168.3 Å²	168.3	91%	0.911	84%	0.835	S	S	*	*			trans	-121.3	147.7	150.4	-78.2	168.2	0	0	0	106.6
11	Y	36.4	Very low	37	Very low	198 Å²	198	164.5 Å²	164.5	78%	0.776	83%	0.83	S	S	*	*			trans	-93.3	159	-176	-82.7	-100.7	0	0	0	111.4
12	D	36.3	Very low	36.8	Very low	127 Å²	127	163.2 Å²	163.2	68%	0.679	82%	0.818	S	S	*	*			trans	12.3	121.5	142.3	-43.4	-26.1	0	0	0	117.3
13	D	37.9	Very low	36.8	Very low	149 Å²	149	162.3 Å²	162.3	80%	0.797	82%	0.818	S	S	*	*				-173.2	130.5	102.9	-88.4	-23.9	0	0	0	111.9
14	D	34.9	Very low	36.4	Very low	153 Å²	153	156.2 Å²	156.2	82%	0.818	81%	0.813	S	S	*	*			trans	58.5	163.4	154.3	-71.8	-21	0	0	0	124.1
15	V	41.2	Very low	36.5	Very low	137 Å²	137	151.3 Å²	151.3	83%	0.83	80%	0.8	S	S	*	*			trans	87.6	106.5	166.1	-167.8	0	0	0	0	117.8
16	D	34.3	Very low	36.2	Very low	145 Å²	145	145.6 Å²	145.6	78%	0.775	79%	0.791	S	S	*	*			trans	-68.6	159	170.5	-57	-86.1	0	0	0	114.5
17	T	34.3	Very low	36.4	Very low	128 Å²	128	145.4 Å²	145.4	79%	0.785	79%	0.79	S	S	*	*			trans	68.2	83.5	156.7	-41	0	0	0	0	117.1
18	Y	37.7	Very low	36.4	Very low	187 Å²	187	144.5 Å²	144.5	73%	0.733	78%	0.78	S	S	*	*			trans	-146.6	109.9	150.6	-108.1	-74.3	0	0	0	113.5
19	D	37.6	Very low	36.8	Very low	143 Å²	143	140.7 Å²	140.7	77%	0.765	78%	0.776	S	S	*	*			trans	49.7	164.2	142.2	-60	-10.8	0	0	0	123.1
20	E	35.7	Very low	37.3	Very low	190 Å²	190	146.4 Å²	146.4	89%	0.888	78%	0.781	S	S	*	*			trans	-80	174.4	-173	-56.6	175.9	133.4	0	0	113.5
21	A	35.1	Very low	37.5	Very low	88 Å²	88	145 Å²	145	73%	0.727	78%	0.78	S	S	*	*			trans	69.5	87.5	166.7	0	0	0	0	0	117.9
22	F	33.4	Very low	38	Very low	217 Å²	217	140.4 Å²	140.4	95%	0.952	77%	0.768	S	S	*	*			trans	-149.6	155.6	136.3	-99.2	-67.6	0	0	0	111.8
23	A	36	Very low	38.3	Very low	97 Å²	97	137.3 Å²	137.3	80%	0.802	76%	0.756	S	S	*	*			trans	62.1	65.2	168.4	0	0	0	0	0	117.9	S25	A23-S25 PolarHBondContact O-N 3.38Å
24	S	31.9	Very low	38.7	Very low	119 Å²	119	135.3 Å²	135.3	83%	0.832	75%	0.751	S	S	*	*			trans	-71.1	102.7	143.7	53.9	0	0	0	0	109.1
25	S	36.3	Very low	39.4	Very low	90 Å²	90	134.7 Å²	134.7	63%	0.629	75%	0.748	S	S	*	*			trans	-75.7	129.6	165.6	54.5	0	0	0	0	109.5	A23 D27	A23-S25 PolarHBondContact O-N 3.38Å; S25-D27 PolarHBondContact OG-OD1 2.78Å
26	V	36.4	Very low	40	Very low	113 Å²	113	130.7 Å²	130.7	69%	0.685	72%	0.724	S	S	*	*			trans	-88	108.7	166	-179.6	0	0	0	0	106.2	D28	V26-D28 PolarHBondContact O-N 3.16Å; V26-D28 VanDerWaalsContact O-N 3.13Å
27	D	42.7	Very low	40.4	Very low	131 Å²	131	126.5 Å²	126.5	70%	0.701	71%	0.706	S	S	*	*			trans	-84.7	82.5	-179.6	-64.3	-27.7	0	0	0	109.3	S25 D29	S25-D27 PolarHBondContact OG-OD1 2.78Å; D27-D29 VanDerWaalsContact C-N 3.31Å; D27-D29 PolarHBondContact O-N 3.28Å
28	D	37.3	Very low	41.2	Very low	135 Å²	135	128 Å²	128	72%	0.722	70%	0.704	S	S	*	*			trans	-70.3	75.7	-179.6	-78.3	-38.1	0	0	0	112.6	V26 Y30	V26-D28 PolarHBondContact O-N 3.16Å; V26-D28 VanDerWaalsContact O-N 3.13Å; D28-Y30 PolarHBondContact O-N 3.18Å
29	D	44.8	Very low	41.8	Very low	147 Å²	147	129.1 Å²	129.1	79%	0.786	71%	0.707	S	S	*	*			trans	-78.3	34	-168.6	-130.2	4.5	0	0	0	115.2	D27	D27-D29 VanDerWaalsContact C-N 3.31Å; D27-D29 PolarHBondContact O-N 3.28Å
30	Y	45.7	Very low	42.2	Very low	207 Å²	207	130.7 Å²	130.7	81%	0.812	70%	0.703	S	S	*	*			trans	-134.4	58.2	-176.3	-74.1	-72.5	0	0	0	115.3	D28 I32	D28-Y30 PolarHBondContact O-N 3.18Å; Y30-I32 PolarHBondContact O-N 3.34Å
31	T	42.6	Very low	42.5	Very low	144 Å²	144	128 Å²	128	88%	0.883	69%	0.693	S	S	*	*			trans	-90.8	75.2	170.4	46.4	0	0	0	0	113.2	S33	T31-S33 PolarHBondContact O-N 2.98Å
32	I	46.1	Very low	42.5	Very low	102 Å²	102	132.9 Å²	132.9	52%	0.523	70%	0.698	S	S	.	*			trans	-65.2	131	171.9	-62.7	178.7	0	0	0	110	Y30 T36	Y30-I32 PolarHBondContact O-N 3.34Å; I32-T36 HydrophobicContact CG2-CG2 3.9Å
33	S	43.5	Very low	43	Very low	61 Å²	61	127.1 Å²	127.1	43%	0.427	68%	0.678	S	S	.	*			trans	-68.6	148	-179.3	79.6	0	0	0	0	112.5	T31 N35 T36 S37	T31-S33 PolarHBondContact O-N 2.98Å; S33-N35 PolarHBondContact O-N 3.1Å; S33-T36 WeakPolarHBondContact O-CB 3.37Å; S33-T36 PolarHBondContact O-N 3.27Å; S33-T36 PolarHBondContact OG-OG1 3.38Å; S33-S37 PolarHBondContact O-N 2.92Å
34	P	45.6	Very low	43.4	Very low	107 Å²	107	126.9 Å²	126.9	70%	0.695	67%	0.668	S	S	*	*	H	α-helix	trans	-58.5	-21.9	-176.6	-28	36.1	0	0	0	115.8	T36 S37	P34-T36 VanDerWaalsContact C-N 3.29Å; P34-S37 PolarHBondContact O-OG 3.07Å; P34-S37 VanDerWaalsContact O-OG 3.11Å
35	N	49.2	Very low	43.9	Very low	141 Å²	141	128.2 Å²	128.2	75%	0.754	67%	0.666	S	S	*	*	H	α-helix	trans	-87.1	2.2	176.2	-64.7	3.9	0	0	0	113	S33	S33-N35 PolarHBondContact O-N 3.1Å
36	T	54.8	Low	43.8	Very low	53 Å²	53	128.1 Å²	128.1	33%	0.325	67%	0.665	S	S	.	*	H	α-helix	trans	-113.7	-28.9	-177.1	-53.4	0	0	0	0	112	I32 S33 P34 E38 R39 Y40	I32-T36 HydrophobicContact CG2-CG2 3.9Å; S33-T36 WeakPolarHBondContact O-CB 3.37Å; S33-T36 PolarHBondContact O-N 3.27Å; S33-T36 PolarHBondContact OG-OG1 3.38Å; P34-T36 VanDerWaalsContact C-N 3.29Å; T36-E38 VanDerWaalsContact C-N 3.32Å; T36-E38 PolarHBondContact O-N 3.42Å; T36-R39 WeakPolarHBondContact O-CB 3.35Å; T36-R39 PolarHBondContact O-N 2.9Å; T36-R39 VanDerWaalsContact O-N 3.13Å; T36-Y40 HydrophobicContact CG2-CD2 4.48Å; T36-Y40 HydrophobicContact CG2-CE2 4.08Å; T36-Y40 WeakPolarHBondContact O-CD2 3.4Å
37	S	42.1	Very low	43.7	Very low	56 Å²	56	128.7 Å²	128.7	39%	0.392	67%	0.668	S	S	.	*	H	α-helix	trans	-58.5	-38.1	177.7	46.8	0	0	0	0	113.4	S33 P34 R39 Y40	S33-S37 PolarHBondContact O-N 2.92Å; P34-S37 PolarHBondContact O-OG 3.07Å; P34-S37 VanDerWaalsContact O-OG 3.11Å; S37-R39 PolarHBondContact O-N 3Å; S37-Y40 PolarHBondContact O-N 2.96Å
38	E	50.4	Low	43	Very low	159 Å²	159	131 Å²	131	74%	0.743	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	-15.8	176.8	-64.8	-172	153.7	0	0	114.1	T36	T36-E38 VanDerWaalsContact C-N 3.32Å; T36-E38 PolarHBondContact O-N 3.42Å
39	R	49.7	Very low	42.6	Very low	212 Å²	212	132.5 Å²	132.5	80%	0.8	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-5.8	176.6	-62.2	-175.8	177.3	-179.1	-1.2	114.4	T36 S37	T36-R39 WeakPolarHBondContact O-CB 3.35Å; T36-R39 PolarHBondContact O-N 2.9Å; T36-R39 VanDerWaalsContact O-N 3.13Å; S37-R39 PolarHBondContact O-N 3Å
40	Y	46.7	Very low	42	Very low	176 Å²	176	134.4 Å²	134.4	69%	0.69	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.7	3.3	-176.4	-71.3	-79.5	0	0	0	113.8	T36 S37 F42	T36-Y40 HydrophobicContact CG2-CD2 4.48Å; T36-Y40 HydrophobicContact CG2-CE2 4.08Å; T36-Y40 WeakPolarHBondContact O-CD2 3.4Å; S37-Y40 PolarHBondContact O-N 2.96Å; Y40-F42 PolarHBondContact O-N 3.09Å
41	I	42.4	Very low	41.2	Very low	132 Å²	132	131.6 Å²	131.6	68%	0.677	68%	0.676	S	S	*	*			trans	-73.8	98	170.9	-59.3	176.3	0	0	0	108.5	N43	I41-N43 PolarHBondContact O-N 3.18Å; I41-N43 VanDerWaalsContact O-N 3.15Å
42	F	34.9	Very low	40.7	Very low	191 Å²	191	132.2 Å²	132.2	84%	0.838	67%	0.672	S	S	*	*			trans	-72.2	102.6	176.2	-172.2	-89.8	0	0	0	110	Y40	Y40-F42 PolarHBondContact O-N 3.09Å
43	N	44.1	Very low	39.7	Very low	97 Å²	97	133 Å²	133	52%	0.519	69%	0.687	S	S	.	*			trans	-105.8	112.7	179.5	-165.9	0.1	0	0	0	109.6	I41 D45 S46	I41-N43 PolarHBondContact O-N 3.18Å; I41-N43 VanDerWaalsContact O-N 3.15Å; N43-D45 VanDerWaalsContact C-N 3.26Å; N43-D45 PolarHBondContact O-N 3.32Å; N43-S46 PolarHBondContact O-OG 3.24Å
44	P	45.2	Very low	39	Very low	92 Å²	92	135.8 Å²	135.8	60%	0.597	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-21.6	-167.3	24.7	-34.6	0	0	0	114.8
45	D	42.2	Very low	38	Very low	146 Å²	146	136 Å²	136	78%	0.781	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-10.1	-171.8	-62.7	-44.7	0	0	0	114.8	N43 V47	N43-D45 VanDerWaalsContact C-N 3.26Å; N43-D45 PolarHBondContact O-N 3.32Å; D45-V47 VanDerWaalsContact C-N 3.34Å; D45-V47 PolarHBondContact O-N 3.27Å
46	S	33.6	Very low	37.1	Very low	89 Å²	89	136.1 Å²	136.1	62%	0.622	71%	0.705	S	S	*	*			trans	-89	49.4	-167.9	66.5	0	0	0	0	115.1	N43 F48	N43-S46 PolarHBondContact O-OG 3.24Å; S46-F48 PolarHBondContact O-N 3.37Å
47	V	33.4	Very low	35.7	Very low	124 Å²	124	139.7 Å²	139.7	75%	0.752	73%	0.727	S	S	*	*			trans	-94.2	64.3	-179.4	-168.4	0	0	0	0	112	D45	D45-V47 VanDerWaalsContact C-N 3.34Å; D45-V47 PolarHBondContact O-N 3.27Å
48	F	29	Very low	34.9	Very low	180 Å²	180	144 Å²	144	79%	0.789	75%	0.746	S	S	*	*			trans	-144.8	109.4	173	-104.8	-82.3	0	0	0	115.1	S46	S46-F48 PolarHBondContact O-N 3.37Å
49	K	29.7	Very low	34	Very low	166 Å²	166	142.8 Å²	142.8	72%	0.722	75%	0.749	S	S	*	*			trans	41.2	99.5	151.3	-62.7	-178.6	179.7	179.9	0	119
50	Q	30.5	Very low	33	Very low	188 Å²	188	140.2 Å²	140.2	88%	0.879	74%	0.743	S	S	*	*			trans	-134.2	89	139.2	-75.3	-161.3	-7.8	0	0	110.8	I52	Q50-I52 PolarHBondContact O-N 3.3Å
51	D	28.6	Very low	32.5	Very low	148 Å²	148	137.9 Å²	137.9	79%	0.791	75%	0.75	S	S	*	*			trans	-74.5	112	172.1	-68.4	-72.4	0	0	0	110.9
52	I	33.1	Very low	32.1	Very low	156 Å²	156	134.5 Å²	134.5	80%	0.8	73%	0.733	S	S	*	*			trans	-106.8	107.6	161	-62.2	-178.4	0	0	0	107.6	Q50 V54	Q50-I52 PolarHBondContact O-N 3.3Å; I52-V54 PolarHBondContact O-N 3.48Å; I52-V54 VanDerWaalsContact O-N 3.17Å
53	S	25.9	Very low	32.3	Very low	119 Å²	119	129.7 Å²	129.7	83%	0.832	72%	0.723	S	S	*	*			trans	-79.8	98.7	-164.6	42.4	0	0	0	0	113.9
54	V	27.9	Very low	32.5	Very low	120 Å²	120	126.3 Å²	126.3	73%	0.727	70%	0.704	S	S	*	*			trans	-118.5	113.5	156.7	-178.4	0	0	0	0	108.7	I52 L56	I52-V54 PolarHBondContact O-N 3.48Å; I52-V54 VanDerWaalsContact O-N 3.17Å; V54-L56 PolarHBondContact O-N 3.25Å
55	S	24.3	Very low	32.5	Very low	112 Å²	112	124.5 Å²	124.5	78%	0.783	69%	0.691	S	S	*	*			trans	-76.2	88.7	-169.8	54.2	0	0	0	0	113.2
56	L	30.1	Very low	32.6	Very low	142 Å²	142	120 Å²	120	74%	0.743	67%	0.674	S	S	*	*			trans	-125.3	29.9	171.8	-81.1	169.4	0	0	0	113.3	V54 N58	V54-L56 PolarHBondContact O-N 3.25Å; L56-N58 VanDerWaalsContact C-N 3.34Å; L56-N58 PolarHBondContact O-N 3.33Å
57	T	25.3	Very low	33.3	Very low	129 Å²	129	121.8 Å²	121.8	79%	0.791	67%	0.673	S	S	*	*			trans	-78	69	179.6	40.5	0	0	0	0	113.3
58	N	26.6	Very low	34.2	Very low	146 Å²	146	116.4 Å²	116.4	78%	0.781	64%	0.64	S	S	*	*			trans	-178.4	70.1	154.2	-100.8	-48.6	0	0	0	112.9	L56 K60	L56-N58 VanDerWaalsContact C-N 3.34Å; L56-N58 PolarHBondContact O-N 3.33Å; N58-K60 PolarHBondContact O-N 3.45Å
59	V	31.4	Very low	35.6	Very low	134 Å²	134	108.2 Å²	108.2	81%	0.812	60%	0.604	S	S	*	*			trans	-97.4	81.9	169.9	-172.6	0	0	0	0	110
60	K	28.4	Very low	36.8	Very low	157 Å²	157	100.9 Å²	100.9	68%	0.683	57%	0.573	S	S	*	*			trans	-69.1	143.3	162.6	-73.3	-176.4	177.6	179.5	0	109.1	N58 L62	N58-K60 PolarHBondContact O-N 3.45Å; K60-L62 PolarHBondContact O-N 3.3Å
61	P	35	Very low	37.4	Very low	128 Å²	128	94 Å²	94	83%	0.831	55%	0.548	S	S	*	.			trans	-63.8	111.4	173.4	26.1	-33	0	0	0	109.7	S63	P61-S63 PolarHBondContact O-N 3.16Å
62	L	34.5	Very low	38.3	Very low	60 Å²	60	89 Å²	89	31%	0.314	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-74	126.1	179.8	-70.2	173.5	0	0	0	111	K60	K60-L62 PolarHBondContact O-N 3.3Å
63	S	40.1	Very low	38.4	Very low	91 Å²	91	86.9 Å²	86.9	64%	0.636	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-82.5	120	174.3	55.8	0	0	0	0	111.1	P61	P61-S63 PolarHBondContact O-N 3.16Å
64	F	48	Very low	39	Very low	25 Å²	25	84.8 Å²	84.8	11%	0.11	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-68.5	133.8	166.4	-57.6	-74.9	0	0	0	109.7	D68 F69 R536 N578 L765 N818	F64-D68 WeakPolarHBondContact CA-OD2 3.38Å; F64-D68 HydrophobicContact CB-CB 4.08Å; F64-D68 HydrophobicContact CD1-CB 4.23Å; F64-F69 HydrophobicContact CB-CD2 4.34Å; F64-F69 HydrophobicContact CB-CE2 3.64Å; F64-F69 HydrophobicContact CB-CZ 4.4Å; F64-F69 HydrophobicContact CG-CE2 4.32Å; F64-R536 VanDerWaalsContact CE2-NH2 3.25Å; F64-N578 PolarHBondContact O-ND2 2.82Å; F64-L765 HydrophobicContact CD1-CD1 3.55Å; F64-L765 HydrophobicContact CD1-CG 4.41Å; F64-L765 HydrophobicContact CE1-CD1 3.53Å; F64-L765 HydrophobicContact CE1-CG 4.18Å; F64-L765 HydrophobicContact CG-CD1 4.47Å; F64-L765 HydrophobicContact CZ-CD1 4.46Å; F64-N818 HydrophobicContact CE1-CB 4.09Å; F64-N818 HydrophobicContact CZ-CB 3.8Å; F64-N818 WeakPolarHBondContact CZ-OD1 3.34Å
65	T	45.7	Very low	39.2	Very low	54 Å²	54	84.3 Å²	84.3	33%	0.331	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-90.1	171.2	172.4	92.5	0	0	0	0	110.4	E67 D68 N578 R801	T65-E67 PolarHBondContact O-N 3.31Å; T65-E67 PolarHBondContact OG1-N 2.86Å; T65-E67 PolarHBondContact OG1-OE2 3.08Å; T65-D68 PolarHBondContact N-OD2 2.9Å; T65-D68 WeakPolarHBondContact O-CB 3.45Å; T65-D68 PolarHBondContact O-N 3.1Å; T65-N578 VanDerWaalsContact C-ND2 3.32Å; T65-N578 PolarHBondContact O-ND2 3.12Å; T65-R801 PolarHBondContact OG1-NH1 2.8Å
66	A	43.4	Very low	39.3	Very low	52 Å²	52	86.9 Å²	86.9	43%	0.43	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-27.7	179.9	0	0	0	0	0	113.9	F69 N578	A66-F69 PolarHBondContact O-N 2.88Å; A66-N578 HydrophobicContact CB-CB 4.15Å; A66-N578 VanDerWaalsContact N-CG 3.3Å; A66-N578 PolarHBondContact N-OD1 3.1Å
67	E	47.4	Very low	39.2	Very low	127 Å²	127	89.5 Å²	89.5	59%	0.593	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-18.1	-179.1	-54.1	158.3	137.5	0	0	113.8	T65 K763 R801	T65-E67 PolarHBondContact O-N 3.31Å; T65-E67 PolarHBondContact OG1-N 2.86Å; T65-E67 PolarHBondContact OG1-OE2 3.08Å; E67-K763 PolarHBondContact O-NZ 3.15Å; E67-R801 IonicContact OE2-CZ 3.68Å; E67-R801 IonicContact OE2-NH1 2.8Å; E67-R801 IonicContact OE2-NH2 3.35Å; E67-R801 PolarHBondContact OE2-NH2 2.98Å
68	D	53.4	Low	39.3	Very low	11 Å²	11	90.5 Å²	90.5	6%	0.059	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-33	174.6	-75.4	-52.7	0	0	0	111.3	F64 T65 L765 R801 T820	F64-D68 WeakPolarHBondContact CA-OD2 3.38Å; F64-D68 HydrophobicContact CB-CB 4.08Å; F64-D68 HydrophobicContact CD1-CB 4.23Å; T65-D68 PolarHBondContact N-OD2 2.9Å; T65-D68 WeakPolarHBondContact O-CB 3.45Å; T65-D68 PolarHBondContact O-N 3.1Å; D68-L765 HydrophobicContact CB-CD1 3.81Å; D68-R801 WeakPolarHBondContact OD1-CD 3.43Å; D68-R801 IonicContact OD1-CZ 3.5Å; D68-R801 IonicContact OD1-NE 2.8Å; D68-R801 PolarHBondContact OD1-NE 3.01Å; D68-R801 IonicContact OD1-NH1 3.43Å; D68-R801 PolarHBondContact OD1-NH1 2.82Å; D68-R801 VanDerWaalsContact OD2-CD 3.3Å; D68-R801 WeakPolarHBondContact OD2-CD 3.49Å; D68-R801 IonicContact OD2-CZ 2.98Å; D68-R801 IonicContact OD2-NE 3.21Å; D68-R801 IonicContact OD2-NH1 3.72Å; D68-R801 PolarHBondContact OD2-NH1 3.46Å; D68-T820 HydrophobicContact CB-CG2 4.18Å; D68-T820 WeakPolarHBondContact OD1-CG2 3.43Å
69	F	57.6	Low	39.4	Very low	7 Å²	7	89.5 Å²	89.5	3%	0.031	49%	0.493	C	S	.	.	S	Bend	trans	-84.2	160.5	176.8	-71.9	-85.2	0	0	0	111.9	F64 A66 A71 R539 L540 M577 N578 L765	F64-F69 HydrophobicContact CB-CD2 4.34Å; F64-F69 HydrophobicContact CB-CE2 3.64Å; F64-F69 HydrophobicContact CB-CZ 4.4Å; F64-F69 HydrophobicContact CG-CE2 4.32Å; A66-F69 PolarHBondContact O-N 2.88Å; F69-A71 PolarHBondContact O-N 2.96Å; F69-R539 HydrophobicContact CD1-CB 4.45Å; F69-R539 HydrophobicContact CD1-CG 3.62Å; F69-R539 HydrophobicContact CE1-CB 4.31Å; F69-R539 HydrophobicContact CE1-CG 3.79Å; F69-R539 HydrophobicContact CG-CG 4.25Å; F69-L540 HydrophobicContact CD1-CD2 3.71Å; F69-L540 HydrophobicContact CD1-CG 4.32Å; F69-L540 HydrophobicContact CE1-CD2 3.96Å; F69-L540 HydrophobicContact CE1-CG 4.26Å; F69-M577 HydrophobicContact CZ-CB 4.4Å; F69-N578 HydrophobicContact CD2-CB 4.49Å; F69-N578 WeakPolarHBondContact CE2-ND2 3.36Å; F69-L765 HydrophobicContact CD1-CD2 3.92Å; F69-L765 HydrophobicContact CE1-CD2 3.74Å; F69-L765 HydrophobicContact CE2-CD2 4.47Å; F69-L765 HydrophobicContact CG-CD2 4.36Å; F69-L765 HydrophobicContact CZ-CD2 4.04Å
70	P	55	Low	39.4	Very low	13 Å²	13	90.2 Å²	90.2	8%	0.084	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-58.1	122	162.8	23.3	-31.7	0	0	0	110	N72 R539 Y836 T858	P70-N72 PolarHBondContact O-N 3.19Å; P70-R539 PolarHBondContact O-NH1 3.32Å; P70-R539 VanDerWaalsContact O-NH1 3.12Å; P70-Y836 HydrophobicContact CB-CE1 4.37Å; P70-Y836 HydrophobicContact CB-CE2 4.22Å; P70-T858 HydrophobicContact CB-CG2 3.92Å
71	A	44.3	Very low	39.6	Very low	42 Å²	42	90.6 Å²	90.6	35%	0.347	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-64.2	124.8	173.8	0	0	0	0	0	109.8	F69 D73 Y836	F69-A71 PolarHBondContact O-N 2.96Å; A71-D73 VanDerWaalsContact CB-OD1 3.3Å; A71-D73 WeakPolarHBondContact CB-OD1 3.38Å; A71-Y836 PolarHBondContact O-OH 2.82Å
72	N	46.8	Very low	39.6	Very low	45 Å²	45	89.9 Å²	89.9	24%	0.241	50%	0.495	C	S	.	.			trans	-94.4	84.8	164.2	-87.1	-9.5	0	0	0	105.9	P70 S74 G542 V543 R844	P70-N72 PolarHBondContact O-N 3.19Å; N72-S74 VanDerWaalsContact C-N 3.29Å; N72-S74 PolarHBondContact O-N 3.17Å; N72-G542 PolarHBondContact ND2-O 3.43Å; N72-V543 PolarHBondContact ND2-O 2.91Å; N72-R844 PolarHBondContact OD1-NH2 3.38Å
73	D	35.8	Very low	39.8	Very low	111 Å²	111	93.2 Å²	93.2	59%	0.594	52%	0.52	S	S	*	.			trans	-69.6	85.1	-178.5	-40.4	-76.6	0	0	0	109.9	A71 K840	A71-D73 VanDerWaalsContact CB-OD1 3.3Å; A71-D73 WeakPolarHBondContact CB-OD1 3.38Å; D73-K840 IonicContact OD2-NZ 2.88Å; D73-K840 PolarHBondContact OD2-NZ 2.96Å
74	S	38	Very low	39.6	Very low	75 Å²	75	92.2 Å²	92.2	52%	0.524	53%	0.525	S	S	.	.			trans	-140.5	12.1	178.1	66.4	0	0	0	0	113.4	N72	N72-S74 VanDerWaalsContact C-N 3.29Å; N72-S74 PolarHBondContact O-N 3.17Å
75	E	32.1	Very low	39	Very low	109 Å²	109	97.6 Å²	97.6	51%	0.509	56%	0.559	S	S	.	*			trans	-130.6	49.1	-179.5	-69.5	-177.5	-172.6	0	0	110.7	F77 R545 S580	E75-F77 VanDerWaalsContact C-N 3.29Å; E75-F77 PolarHBondContact O-N 3.44Å; E75-R545 IonicContact OE1-CZ 2.67Å; E75-R545 IonicContact OE1-NH1 2.93Å; E75-R545 PolarHBondContact OE1-NH1 3.06Å; E75-R545 IonicContact OE1-NH2 3.31Å; E75-R545 PolarHBondContact OE1-NH2 3.46Å; E75-S580 PolarHBondContact OE1-OG 2.88Å; E75-S580 WeakPolarHBondContact OE2-CB 3.24Å; E75-S580 PolarHBondContact OE2-OG 3.42Å
76	N	27	Very low	38.5	Very low	166 Å²	166	101.3 Å²	101.3	89%	0.888	58%	0.582	S	S	*	*			trans	-96.2	52.6	170.9	-135.6	2.9	0	0	0	110.3	K78	N76-K78 PolarHBondContact O-N 3.25Å; N76-K78 VanDerWaalsContact O-N 3.15Å
77	F	27.6	Very low	38.1	Very low	197 Å²	197	104.6 Å²	104.6	86%	0.864	60%	0.601	S	S	*	*			trans	-75.8	99.2	-179.9	-117.1	-84.2	0	0	0	109.9	E75	E75-F77 VanDerWaalsContact C-N 3.29Å; E75-F77 PolarHBondContact O-N 3.44Å
78	K	27.3	Very low	37.5	Very low	150 Å²	150	101.6 Å²	101.6	65%	0.652	60%	0.604	S	S	*	*			trans	-70.8	128.8	160.4	-80.3	-171.9	156.9	-149.7	0	109.6	N76 E80	N76-K78 PolarHBondContact O-N 3.25Å; N76-K78 VanDerWaalsContact O-N 3.15Å; K78-E80 IonicContact NZ-OE2 2.75Å; K78-E80 PolarHBondContact NZ-OE2 3.02Å; K78-E80 PolarHBondContact O-N 2.78Å
79	P	28.2	Very low	36.5	Very low	126 Å²	126	112.3 Å²	112.3	82%	0.818	64%	0.644	S	S	*	*			trans	-88.4	87.2	165.6	33.9	-29.1	0	0	0	109.5
80	E	32.3	Very low	35.4	Very low	148 Å²	148	119.6 Å²	119.6	69%	0.692	68%	0.682	S	S	*	*			trans	-128.2	107.4	172.4	-74.4	-178.1	150.8	0	0	111.1	K78	K78-E80 IonicContact NZ-OE2 2.75Å; K78-E80 PolarHBondContact NZ-OE2 3.02Å; K78-E80 PolarHBondContact O-N 2.78Å
81	D	31.9	Very low	34.3	Very low	165 Å²	165	122.5 Å²	122.5	88%	0.882	71%	0.714	S	S	*	*			trans	-18.7	142	172.2	-54.7	-35.4	0	0	0	121.1
82	S	35.3	Very low	33.6	Very low	114 Å²	114	125.5 Å²	125.5	80%	0.797	73%	0.733	S	S	*	*			trans	-160.9	159.7	141.9	65.9	0	0	0	0	111
83	P	38.8	Very low	33	Very low	129 Å²	129	134.3 Å²	134.3	84%	0.838	76%	0.764	S	S	*	*				-135.2	153.9	-64.1	36.6	-22	0	0	0	113.6
84	G	36.8	Very low	32.9	Very low	71 Å²	71	137.1 Å²	137.1	73%	0.732	77%	0.774	S	S	*	*			trans	-179.9	125.6	169.9	0	0	0	0	0	119.5
85	V	34	Very low	32.6	Very low	138 Å²	138	137.1 Å²	137.1	84%	0.836	79%	0.786	S	S	*	*			trans	73.1	90.8	144.5	-167.4	0	0	0	0	120.5
86	V	35.3	Very low	32.5	Very low	132 Å²	132	142.4 Å²	142.4	80%	0.8	81%	0.807	S	S	*	*				63.7	109.3	126.6	-177.2	0	0	0	0	121.8
87	S	35.3	Very low	32.8	Very low	121 Å²	121	141.2 Å²	141.2	85%	0.846	80%	0.801	S	S	*	*			trans	80.1	133.9	137.7	-161.7	0	0	0	0	122.7
88	G	34.6	Very low	32.7	Very low	64 Å²	64	140.8 Å²	140.8	66%	0.66	80%	0.799	S	S	*	*			trans	108.9	101.4	170.3	0	0	0	0	0	113
89	R	31.7	Very low	33	Very low	235 Å²	235	139.3 Å²	139.3	89%	0.887	81%	0.808	S	S	*	*				44.4	122.6	65.3	-74.9	-169.9	172	-177.4	-1.4	112.6
90	I	34.7	Very low	33.2	Very low	160 Å²	160	139.6 Å²	139.6	82%	0.821	81%	0.807	S	S	*	*			cis	-154.8	157.2	6.9	-92.1	147.8	0	0	0	107.8
91	G	33.6	Very low	33.4	Very low	75 Å²	75	138.5 Å²	138.5	77%	0.773	81%	0.813	S	S	*	*			trans	123.8	112.1	149.7	0	0	0	0	0	116.3
92	S	29.4	Very low	33.3	Very low	105 Å²	105	142 Å²	142	73%	0.734	81%	0.814	S	S	*	*			trans	-91.4	140.8	169.6	54	0	0	0	0	111.5
93	Y	33.8	Very low	33	Very low	229 Å²	229	143.6 Å²	143.6	90%	0.898	81%	0.813	S	S	*	*			trans	-147.4	158	143	-104	-69.4	0	0	0	112.2
94	Q	34.2	Very low	32.7	Very low	170 Å²	170	144 Å²	144	79%	0.794	81%	0.808	S	S	*	*			trans	-80.8	162.5	-166	-67.4	152.6	-55.6	0	0	113.2
95	G	31.2	Very low	32.5	Very low	76 Å²	76	148.4 Å²	148.4	78%	0.784	81%	0.81	S	S	*	*			trans	-63.6	175.8	-174.4	0	0	0	0	0	116.9
96	F	29.8	Very low	32.5	Very low	219 Å²	219	147 Å²	147	96%	0.961	80%	0.802	S	S	*	*			trans	-120.4	149.9	171.6	-103.4	-89.6	0	0	0	111.1
97	D	32.8	Very low	32.4	Very low	142 Å²	142	145.8 Å²	145.8	76%	0.759	79%	0.794	S	S	*	*			trans	-113.5	-179.8	-171.4	-148.8	-21.3	0	0	0	111
98	F	27.1	Very low	32.3	Very low	187 Å²	187	146.1 Å²	146.1	82%	0.82	79%	0.786	S	S	*	*			trans	-52.3	144	-178.8	-79.3	-113.9	0	0	0	114.6
99	S	32.8	Very low	32.4	Very low	119 Å²	119	150 Å²	150	83%	0.832	79%	0.788	S	S	*	*				170.8	171.3	114.2	51.9	0	0	0	0	114.8
100	V	32.5	Very low	32.5	Very low	133 Å²	133	144.7 Å²	144.7	81%	0.806	78%	0.777	S	S	*	*			trans	-118.1	136.9	-176.6	167	0	0	0	0	107.4
101	P	36.3	Very low	32.5	Very low	124 Å²	124	144 Å²	144	81%	0.805	78%	0.775	S	S	*	*				-155.1	-175.1	109.4	40.8	-20.5	0	0	0	118.2
102	R	30.3	Very low	32.6	Very low	240 Å²	240	145.2 Å²	145.2	91%	0.906	77%	0.771	S	S	*	*			trans	-64.8	168.6	-169.5	-60.4	165.5	175.8	160.5	-2.8	117.4
103	N	29	Very low	33	Very low	146 Å²	146	145.5 Å²	145.5	78%	0.781	77%	0.768	S	S	*	*			trans	-50.7	168.2	176.7	-49.1	5.4	0	0	0	117.9
104	N	31.2	Very low	33.2	Very low	137 Å²	137	143.5 Å²	143.5	73%	0.733	77%	0.767	S	S	*	*			trans	73.4	136.8	159.6	-71.3	20.8	0	0	0	115.5
105	E	32.5	Very low	33.3	Very low	164 Å²	164	139 Å²	139	77%	0.766	77%	0.765	S	S	*	*			cis	-163.1	170.5	30.3	-132.7	165.3	-130.2	0	0	113.9
106	V	34.9	Very low	33.6	Very low	110 Å²	110	140 Å²	140	67%	0.667	76%	0.76	S	S	*	*			trans	76.4	95.4	143.3	160.2	0	0	0	0	122.6
107	T	32.4	Very low	34.1	Very low	106 Å²	106	136.3 Å²	136.3	65%	0.65	75%	0.751	S	S	*	*				84.5	145.6	126.8	66.8	0	0	0	0	125.5
108	N	33.8	Very low	34.3	Very low	127 Å²	127	137.8 Å²	137.8	68%	0.679	75%	0.753	S	S	*	*			trans	75.1	138	151.2	-62.2	-19.8	0	0	0	119.1
109	Q	35.8	Very low	34.9	Very low	147 Å²	147	134 Å²	134	69%	0.687	75%	0.746	S	S	*	*			cis	-158.8	152.4	-6.5	-119.7	170.5	13	0	0	112.7
110	N	34.8	Very low	34.8	Very low	123 Å²	123	137.6 Å²	137.6	66%	0.658	75%	0.746	S	S	*	*			trans	74.4	136	148.4	-68	7.4	0	0	0	123.7
111	D	35.7	Very low	34.9	Very low	145 Å²	145	134.2 Å²	134.2	78%	0.775	74%	0.738	S	S	*	*			trans	70.6	134.8	147.3	-53.1	-23.6	0	0	0	123
112	S	35.3	Very low	34.6	Very low	100 Å²	100	135.6 Å²	135.6	70%	0.699	74%	0.739	S	S	*	*			cis	-169.1	164	-19.8	59.5	0	0	0	0	113
113	V	38.1	Very low	34.6	Very low	111 Å²	111	128.2 Å²	128.2	67%	0.673	72%	0.724	S	S	*	*			trans	79.8	118.2	156.8	-176.1	0	0	0	0	121.4
114	H	37.1	Very low	34.8	Very low	188 Å²	188	128 Å²	128	87%	0.87	72%	0.723	S	S	*	*			trans	57	142.4	160	-57.3	-32.6	0	0	0	119.9
115	G	36.1	Very low	34.6	Very low	74 Å²	74	127.7 Å²	127.7	76%	0.763	72%	0.72	S	S	*	*			cis	141.2	144.7	-0	0	0	0	0	0	110.7
116	S	38.5	Very low	34.4	Very low	97 Å²	97	128.3 Å²	128.3	68%	0.678	72%	0.721	S	S	*	*			cis	-157.6	171.2	-2.5	54.3	0	0	0	0	110.5
117	D	38.6	Very low	34.1	Very low	143 Å²	143	129.6 Å²	129.6	77%	0.765	72%	0.724	S	S	*	*			trans	64.6	147	159.9	-39.5	-44.2	0	0	0	117.9
118	E	38.5	Very low	33.9	Very low	172 Å²	172	128.8 Å²	128.8	80%	0.804	72%	0.723	S	S	*	*			cis	-162.2	160.9	-17	-119.4	-153.8	144.8	0	0	106.7
119	V	38.2	Very low	33.7	Very low	109 Å²	109	127.6 Å²	127.6	66%	0.661	72%	0.724	S	S	*	*			cis	-154.6	-172.7	-3.8	74.8	0	0	0	0	109.4
120	F	32.4	Very low	33.3	Very low	194 Å²	194	127 Å²	127	85%	0.851	73%	0.726	S	S	*	*			trans	-67.6	164.2	176.9	-65.6	-101.1	0	0	0	114.6
121	G	32.5	Very low	33.1	Very low	61 Å²	61	129.1 Å²	129.1	63%	0.629	73%	0.73	S	S	*	*			cis	156.6	164.5	-5.9	0	0	0	0	0	113.5
122	N	30.3	Very low	32.7	Very low	154 Å²	154	130.8 Å²	130.8	82%	0.824	73%	0.73	S	S	*	*			trans	30.7	144.9	135	-64.3	7.9	0	0	0	121.3
123	S	31.8	Very low	32.5	Very low	85 Å²	85	131.6 Å²	131.6	59%	0.594	73%	0.733	S	S	*	*			cis	178	162.1	-3	48.3	0	0	0	0	109.9
124	D	31.5	Very low	32.1	Very low	141 Å²	141	134.9 Å²	134.9	75%	0.754	75%	0.746	S	S	*	*			trans	64.3	158.2	142.7	-68.5	11.3	0	0	0	120
125	L	28.9	Very low	31.6	Very low	130 Å²	130	132.5 Å²	132.5	68%	0.681	74%	0.74	S	S	*	*			cis	-156.2	154.9	-30.2	-139.1	89	0	0	0	108.2
126	F	28.3	Very low	31.2	Very low	177 Å²	177	134.6 Å²	134.6	78%	0.776	74%	0.737	S	S	*	*			trans	57.4	111.6	150.3	-90.7	-125.8	0	0	0	123.2
127	D	27.4	Very low	30.9	Very low	137 Å²	137	135.8 Å²	135.8	73%	0.733	75%	0.746	S	S	*	*				96.2	145.8	107.2	-151.2	13.9	0	0	0	122.5
128	S	28.7	Very low	30.4	Very low	90 Å²	90	135.4 Å²	135.4	63%	0.629	75%	0.748	S	S	*	*			trans	72.2	85	154.8	71.6	0	0	0	0	122
129	S	29.8	Very low	30.2	Very low	101 Å²	101	134.3 Å²	134.3	71%	0.706	75%	0.753	S	S	*	*				81.6	150.9	128.7	84.2	0	0	0	0	122.5
130	N	27.7	Very low	29.8	Very low	136 Å²	136	132.6 Å²	132.6	73%	0.727	76%	0.758	S	S	*	*			trans	81.9	128.4	150.1	-74.8	-50.2	0	0	0	122.6
131	F	29.2	Very low	29.9	Very low	166 Å²	166	127 Å²	127	73%	0.728	76%	0.755	S	S	*	*			trans	78.1	93.7	150.5	-87.8	-112.7	0	0	0	122.6
132	K	28.8	Very low	29.8	Very low	180 Å²	180	131.4 Å²	131.4	78%	0.783	76%	0.764	S	S	*	*				74.3	159.1	122.2	-82.4	-170	176.2	-178.5	0	120.1
133	P	29.9	Very low	30	Very low	118 Å²	118	133 Å²	133	77%	0.766	76%	0.763	S	S	*	*			trans	-98.6	164.9	-157.3	38.7	-36.5	0	0	0	114.5
134	L	30.1	Very low	29.9	Very low	180 Å²	180	135.9 Å²	135.9	94%	0.942	77%	0.771	S	S	*	*			trans	-114.9	164.9	167.3	-96.7	165.2	0	0	0	111.9
135	N	26.1	Very low	29.8	Very low	138 Å²	138	135 Å²	135	74%	0.738	77%	0.771	S	S	*	*			trans	-141.5	171.1	-153.4	-155.9	-0.5	0	0	0	111.7
136	T	29.2	Very low	30	Very low	117 Å²	117	136.2 Å²	136.2	72%	0.718	78%	0.778	S	S	*	*			trans	55.5	120.9	159.9	52.3	0	0	0	0	120.3
137	S	30.3	Very low	29.8	Very low	123 Å²	123	132.2 Å²	132.2	86%	0.86	77%	0.772	S	S	*	*				-143.1	148.1	119.2	61.3	0	0	0	0	109.2
138	V	28.2	Very low	29.9	Very low	134 Å²	134	132.4 Å²	132.4	81%	0.812	78%	0.778	S	S	*	*			trans	-134.5	128.4	-174.3	174.5	0	0	0	0	109.6
139	V	35.6	Very low	29.8	Very low	150 Å²	150	135.4 Å²	135.4	91%	0.909	79%	0.785	S	S	*	*			trans	-139.4	132.6	160.3	-176.6	0	0	0	0	106.9
140	G	28.8	Very low	29.6	Very low	73 Å²	73	136.1 Å²	136.1	75%	0.753	79%	0.791	S	S	*	*			trans	-106.1	166.8	-176.4	0	0	0	0	0	113.9
141	G	35.1	Very low	29.7	Very low	76 Å²	76	135 Å²	135	78%	0.784	79%	0.789	S	S	*	*			trans	179.7	115.7	173.3	0	0	0	0	0	111.3
142	D	31.3	Very low	29.5	Very low	153 Å²	153	134.7 Å²	134.7	82%	0.818	80%	0.795	S	S	*	*			trans	-79.9	142.1	-172	-51.7	-73.4	0	0	0	113.7
143	K	33.5	Very low	29.5	Very low	187 Å²	187	135.4 Å²	135.4	81%	0.813	80%	0.798	S	S	*	*				176.6	129.5	102.6	-94.5	163.5	-171.2	175.5	0	115.4
144	L	30.5	Very low	29.4	Very low	147 Å²	147	134.8 Å²	134.8	77%	0.77	80%	0.796	S	S	*	*			trans	51.6	101.8	138.4	-65.8	165.8	0	0	0	120.4
145	V	29.4	Very low	29.1	Very low	122 Å²	122	135.8 Å²	135.8	74%	0.739	79%	0.787	S	S	*	*				49	108	118.9	-178.1	0	0	0	0	117.4
146	D	31.2	Very low	29.4	Very low	156 Å²	156	135.8 Å²	135.8	83%	0.834	79%	0.792	S	S	*	*				-144.9	161.1	101.7	-132.8	-30.8	0	0	0	111.4
147	S	25.8	Very low	29.4	Very low	93 Å²	93	136.1 Å²	136.1	65%	0.65	79%	0.785	S	S	*	*			trans	-112	116.8	-156.9	56	0	0	0	0	116.2
148	T	29.1	Very low	29.3	Very low	141 Å²	141	139.3 Å²	139.3	87%	0.865	79%	0.787	S	S	*	*			trans	-151.3	106.4	157.5	-50	0	0	0	0	109.4
149	I	26.6	Very low	29.5	Very low	152 Å²	152	140 Å²	140	78%	0.779	79%	0.785	S	S	*	*			trans	-93.6	112.2	-172.7	-64.4	177.4	0	0	0	110.1	V151	I149-V151 HydrophobicContact CG2-CG2 3.55Å
150	S	24.9	Very low	29.4	Very low	117 Å²	117	139.6 Å²	139.6	82%	0.818	78%	0.778	S	S	*	*			trans	-101.5	114.8	164.7	52.1	0	0	0	0	109.3
151	V	29.7	Very low	29.8	Very low	112 Å²	112	144.7 Å²	144.7	68%	0.679	78%	0.779	S	S	*	*			trans	-121.9	109	178.7	167.9	0	0	0	0	110	I149	I149-V151 HydrophobicContact CG2-CG2 3.55Å
152	N	25.4	Very low	29.9	Very low	160 Å²	160	149.1 Å²	149.1	86%	0.856	78%	0.78	S	S	*	*			trans	-72.1	121.3	155.3	-77.7	-33.7	0	0	0	108.6
153	K	29.7	Very low	30.2	Very low	195 Å²	195	148.2 Å²	148.2	85%	0.848	77%	0.774	S	S	*	*			trans	-162	139.3	145.7	-113	157.1	-170.4	175	0	114.2
154	S	25.8	Very low	30.4	Very low	105 Å²	105	145.2 Å²	145.2	73%	0.734	77%	0.767	S	S	*	*			trans	-57	162.2	168.1	52.8	0	0	0	0	114.5
155	R	25.4	Very low	30.7	Very low	200 Å²	200	144.3 Å²	144.3	76%	0.755	76%	0.762	S	S	*	*			trans	82.6	104.3	-179.7	-60.9	175.7	113.6	151.3	0.5	114.7	E157	R155-E157 IonicContact CZ-OE1 2.7Å; R155-E157 IonicContact NE-OE1 3.69Å; R155-E157 PolarHBondContact NE-OE1 3.33Å; R155-E157 IonicContact NH2-OE1 2.72Å; R155-E157 PolarHBondContact NH2-OE1 3.45Å
156	V	31.8	Very low	31.1	Very low	138 Å²	138	148.1 Å²	148.1	84%	0.836	76%	0.764	S	S	*	*			trans	-118.7	119.5	138.2	177.2	0	0	0	0	104.6
157	E	30.1	Very low	31.3	Very low	124 Å²	124	148.1 Å²	148.1	58%	0.579	76%	0.763	S	S	*	*			trans	-90.7	-178.4	174.3	-74.2	160.8	170.7	0	0	108.6	R155	R155-E157 IonicContact CZ-OE1 2.7Å; R155-E157 IonicContact NE-OE1 3.69Å; R155-E157 PolarHBondContact NE-OE1 3.33Å; R155-E157 IonicContact NH2-OE1 2.72Å; R155-E157 PolarHBondContact NH2-OE1 3.45Å
158	E	28.1	Very low	31.8	Very low	191 Å²	191	148.7 Å²	148.7	89%	0.893	76%	0.762	S	S	*	*			trans	-59.6	150.2	-170.5	-68.4	142.1	132.4	0	0	113.6
159	L	31.8	Very low	31.9	Very low	149 Å²	149	146.4 Å²	146.4	78%	0.78	75%	0.752	S	S	*	*			trans	-125.4	118	173.8	-92.8	169.7	0	0	0	109.9
160	D	33.7	Very low	32.3	Very low	140 Å²	140	148.6 Å²	148.6	75%	0.749	76%	0.759	S	S	*	*			trans	-66.8	138.1	-178	-63.1	-62.8	0	0	0	112.9	E162	D160-E162 VanDerWaalsContact C-N 3.28Å; D160-E162 PolarHBondContact O-N 3.1Å
161	F	36.5	Very low	32.7	Very low	180 Å²	180	148.6 Å²	148.6	79%	0.789	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-75.9	-9.8	177.8	-91.3	-99.4	0	0	0	114.1	L163 L164	F161-L163 PolarHBondContact O-N 3.47Å; F161-L163 VanDerWaalsContact O-N 3.09Å; F161-L164 PolarHBondContact O-N 2.71Å
162	E	38.1	Very low	33.1	Very low	169 Å²	169	149 Å²	149	79%	0.79	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-67.8	-8.1	-174.1	-68	-159.3	128.3	0	0	115.7	D160	D160-E162 VanDerWaalsContact C-N 3.28Å; D160-E162 PolarHBondContact O-N 3.1Å
163	L	37.8	Very low	33.4	Very low	135 Å²	135	146.7 Å²	146.7	71%	0.707	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-93.3	-10.7	178.8	-83.9	171.7	0	0	0	115	F161	F161-L163 PolarHBondContact O-N 3.47Å; F161-L163 VanDerWaalsContact O-N 3.09Å
164	L	36.7	Very low	33.5	Very low	124 Å²	124	143.6 Å²	143.6	65%	0.649	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-37.6	-177.1	-146.2	70.5	0	0	0	112.9	F161 R166 L167	F161-L164 PolarHBondContact O-N 2.71Å; L164-R166 PolarHBondContact O-N 2.81Å; L164-L167 PolarHBondContact O-N 3.5Å
165	D	36.8	Very low	33.7	Very low	127 Å²	127	146.6 Å²	146.6	68%	0.679	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-4.6	-178.4	-84.1	-28.4	0	0	0	114.9	L167 T168	D165-L167 VanDerWaalsContact C-N 3.35Å; D165-T168 PolarHBondContact O-OG1 3.16Å
166	R	37.3	Very low	34.1	Very low	203 Å²	203	145 Å²	145	77%	0.766	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-1	173.4	-73.5	-173	175.4	164.4	4.7	114.3	L164	L164-R166 PolarHBondContact O-N 2.81Å
167	L	35.8	Very low	34	Very low	155 Å²	155	143 Å²	143	81%	0.812	75%	0.754	S	S	*	*	S	Bend	trans	-110.2	-2	179.8	-67	174	0	0	0	113.9	L164 D165	L164-L167 PolarHBondContact O-N 3.5Å; D165-L167 VanDerWaalsContact C-N 3.35Å
168	T	37.7	Very low	33.9	Very low	105 Å²	105	145.5 Å²	145.5	64%	0.644	76%	0.763	S	S	*	*	S	Bend	trans	-106.8	-6.4	-172.8	50.1	0	0	0	0	114.2	D165	D165-T168 PolarHBondContact O-OG1 3.16Å
169	S	29.7	Very low	34.2	Very low	93 Å²	93	144.1 Å²	144.1	65%	0.65	76%	0.756	S	S	*	*			trans	-116.5	66.8	-166.2	71.7	0	0	0	0	115.4
170	Q	35.8	Very low	34.2	Very low	198 Å²	198	145.7 Å²	145.7	93%	0.925	76%	0.757	S	S	*	*			trans	-132.9	141.7	156.4	-71.6	-162.2	4.9	0	0	111.1
171	S	34	Very low	34.2	Very low	117 Å²	117	145 Å²	145	82%	0.818	76%	0.76	S	S	*	*			trans	-128.9	-170.6	-160.5	67.6	0	0	0	0	111.6
172	P	36.8	Very low	34	Very low	120 Å²	120	141.2 Å²	141.2	78%	0.779	76%	0.762	S	S	*	*				-124.6	173.9	-106.4	36.8	-19.2	0	0	0	114.3
173	S	32.6	Very low	33.5	Very low	112 Å²	112	143 Å²	143	78%	0.783	77%	0.767	S	S	*	*			trans	-168.1	157.9	148.9	55.1	0	0	0	0	114.9
174	T	31.8	Very low	33.1	Very low	130 Å²	130	142.8 Å²	142.8	80%	0.798	77%	0.771	S	S	*	*			trans	77.3	90.5	154.7	-39.2	0	0	0	0	119.8
175	Q	30.4	Very low	32.6	Very low	169 Å²	169	143.5 Å²	143.5	79%	0.79	78%	0.781	S	S	*	*			trans	-12.8	154.4	140.8	-49.6	169.9	-9.2	0	0	116.7
176	Q	33	Very low	32.2	Very low	166 Å²	166	143 Å²	143	78%	0.776	78%	0.783	S	S	*	*				-161.7	156.2	51.2	-67.7	178.2	-15.8	0	0	113.8
177	S	29	Very low	31.6	Very low	96 Å²	96	138.8 Å²	138.8	67%	0.671	78%	0.784	S	S	*	*			trans	36.9	145.1	143.2	67.2	0	0	0	0	123
178	F	29.1	Very low	31.3	Very low	176 Å²	176	137.7 Å²	137.7	77%	0.772	78%	0.778	S	S	*	*			cis	-165.5	163.9	5.5	-131	-146.1	0	0	0	111.9
179	Q	33.2	Very low	31	Very low	162 Å²	162	141.3 Å²	141.3	76%	0.757	79%	0.788	S	S	*	*			trans	60.4	104.9	152.6	-73.1	176.8	-0.9	0	0	123.5
180	K	32.6	Very low	30.8	Very low	183 Å²	183	144 Å²	144	80%	0.796	80%	0.795	S	S	*	*			trans	29.7	150.5	133.3	-76.1	-173.5	174.6	-178.1	0	123.6
181	P	33.5	Very low	30.7	Very low	126 Å²	126	141.6 Å²	141.6	82%	0.818	79%	0.794	S	S	*	*			trans	-99.6	167.1	-164	40.4	-38.1	0	0	0	116.3
182	A	31.9	Very low	30.6	Very low	100 Å²	100	142.5 Å²	142.5	83%	0.826	79%	0.794	S	S	*	*			trans	-141.1	156.2	166.8	0	0	0	0	0	112.2
183	K	27.2	Very low	30.5	Very low	207 Å²	207	142.2 Å²	142.2	90%	0.9	80%	0.795	S	S	*	*			trans	-87.7	136.3	178.7	-58.6	171.2	-178.3	173.5	0	111.2
184	T	29.5	Very low	30.4	Very low	129 Å²	129	147.9 Å²	147.9	79%	0.791	80%	0.799	S	S	*	*			trans	-144.2	139	159.2	-43.7	0	0	0	0	111	V186	T184-V186 HydrophobicContact CG2-CG2 4.03Å
185	T	26.2	Very low	30.5	Very low	140 Å²	140	147.9 Å²	147.9	86%	0.859	79%	0.794	S	S	*	*			trans	-116.1	125.3	173.2	-51.1	0	0	0	0	108.7
186	V	30.2	Very low	30.7	Very low	116 Å²	116	149 Å²	149	70%	0.703	80%	0.796	S	S	*	*			trans	-143.2	141.3	173.9	-174.4	0	0	0	0	109.5	T184 I188	T184-V186 HydrophobicContact CG2-CG2 4.03Å; V186-I188 HydrophobicContact CG1-CD1 4.2Å; V186-I188 HydrophobicContact CG1-CG1 4.16Å
187	S	23.8	Very low	30.7	Very low	114 Å²	114	146.1 Å²	146.1	80%	0.797	79%	0.794	S	S	*	*			trans	-144	112	179.3	56.1	0	0	0	0	110.3
188	I	30.7	Very low	30.9	Very low	132 Å²	132	150.3 Å²	150.3	68%	0.677	80%	0.8	S	S	*	*			trans	-141	111.6	-175.2	-68.3	-172.9	0	0	0	112.6	V186	V186-I188 HydrophobicContact CG1-CD1 4.2Å; V186-I188 HydrophobicContact CG1-CG1 4.16Å
189	Q	30.5	Very low	31.1	Very low	182 Å²	182	146.8 Å²	146.8	85%	0.85	80%	0.798	S	S	*	*			trans	65.7	137.9	140.9	-64.1	170.7	-14.9	0	0	123.8
190	D	25.6	Very low	31.3	Very low	150 Å²	150	145 Å²	145	80%	0.802	80%	0.798	S	S	*	*			trans	-81.6	159.6	168.4	-43.4	-97.5	0	0	0	113.8
191	T	34.3	Very low	31.4	Very low	147 Å²	147	142.9 Å²	142.9	90%	0.902	80%	0.795	S	S	*	*			trans	-145.9	157	150	39.7	0	0	0	0	111.1
192	T	31.1	Very low	31.3	Very low	136 Å²	136	143.3 Å²	143.3	83%	0.834	79%	0.79	S	S	*	*			trans	-132.9	137.8	-162	58.4	0	0	0	0	115.9
193	S	35.2	Very low	31.3	Very low	113 Å²	113	146 Å²	146	79%	0.79	79%	0.785	S	S	*	*			trans	-157.6	119.7	155.9	49.2	0	0	0	0	110.9
194	R	30.1	Very low	31.4	Very low	231 Å²	231	143.7 Å²	143.7	87%	0.872	78%	0.775	S	S	*	*				64.2	120.9	92	-110.7	-176	-174.6	-167.9	3.1	112.7
195	L	34	Very low	31.4	Very low	131 Å²	131	143.7 Å²	143.7	69%	0.686	77%	0.77	S	S	*	*			cis	-161.7	150.9	44.1	-83.5	151.8	0	0	0	113.5
196	K	33.4	Very low	31.5	Very low	192 Å²	192	141.2 Å²	141.2	84%	0.835	76%	0.758	S	S	*	*			trans	46.9	137.7	149.5	-58.7	170.6	179.3	177.7	0	119.2
197	S	34.7	Very low	31.5	Very low	106 Å²	106	144.7 Å²	144.7	74%	0.741	76%	0.764	S	S	*	*			cis	-176.6	163.4	-8.6	53.9	0	0	0	0	106.1
198	K	32.7	Very low	31.8	Very low	184 Å²	184	144.7 Å²	144.7	80%	0.8	76%	0.759	S	S	*	*			cis	-134.9	172.3	23.5	-55.9	173	-178.2	172.2	0	110.1
199	S	34	Very low	31.7	Very low	102 Å²	102	144.8 Å²	144.8	71%	0.713	77%	0.766	S	S	*	*				36.2	113.6	88.8	114.2	0	0	0	0	114.9
200	T	36.7	Very low	31.7	Very low	123 Å²	123	141.5 Å²	141.5	76%	0.755	76%	0.763	S	S	*	*			cis	-154.2	163.2	9.9	51.7	0	0	0	0	109.1
201	N	34.5	Very low	31.9	Very low	140 Å²	140	141.6 Å²	141.6	75%	0.749	76%	0.763	S	S	*	*			cis	-150.7	-170.9	8.4	-139.6	14.6	0	0	0	113.9
202	L	31.9	Very low	31.7	Very low	135 Å²	135	143.4 Å²	143.4	71%	0.707	76%	0.759	S	S	*	*			trans	-85.7	169	177.5	-68.4	72.6	0	0	0	112.1
203	H	31.8	Very low	31.5	Very low	155 Å²	155	141.7 Å²	141.7	72%	0.718	75%	0.753	S	S	*	*			cis	-153.1	144.5	-5.6	-129.4	-140.2	0	0	0	107.6
204	F	29.4	Very low	31.2	Very low	159 Å²	159	141 Å²	141	70%	0.697	75%	0.748	S	S	*	*			cis	98.8	92.1	43.5	-135.4	-99.6	0	0	0	115.5
205	L	28.4	Very low	31.2	Very low	129 Å²	129	137.1 Å²	137.1	68%	0.675	74%	0.744	S	S	*	*			trans	55.4	121.9	132.7	-82.2	158.1	0	0	0	124.1
206	S	28	Very low	30.7	Very low	89 Å²	89	136 Å²	136	62%	0.622	75%	0.746	S	S	*	*			trans	65.5	129.4	130.3	73	0	0	0	0	121.8
207	K	31.4	Very low	30.5	Very low	188 Å²	188	132.4 Å²	132.4	82%	0.817	75%	0.745	S	S	*	*				-176.2	129.7	100.8	-97.2	166.8	-175.8	176.3	0	115.3
208	T	29.2	Very low	30.1	Very low	115 Å²	115	134.8 Å²	134.8	71%	0.706	75%	0.748	S	S	*	*			trans	6.4	131.6	146.1	54	0	0	0	0	122.7
209	T	28	Very low	30.1	Very low	133 Å²	133	131.3 Å²	131.3	82%	0.816	75%	0.747	S	S	*	*			trans	66.9	97.1	133.4	60.9	0	0	0	0	122.9
210	S	32	Very low	29.8	Very low	113 Å²	113	135.8 Å²	135.8	79%	0.79	75%	0.753	S	S	*	*			trans	-167.1	133.7	132.2	38.7	0	0	0	0	107.2
211	L	28.4	Very low	29.5	Very low	153 Å²	153	138.6 Å²	138.6	80%	0.801	76%	0.763	S	S	*	*				66	124.8	61	-73.8	177.8	0	0	0	114.8
212	F	30.8	Very low	29.2	Very low	184 Å²	184	136.8 Å²	136.8	81%	0.807	77%	0.767	S	S	*	*			trans	74.3	93.5	171.3	-67.4	-75.9	0	0	0	120.4
213	S	26.4	Very low	29.2	Very low	101 Å²	101	134.1 Å²	134.1	71%	0.706	77%	0.772	S	S	*	*				50.6	137.4	121.1	62.7	0	0	0	0	123.6
214	S	29.2	Very low	29.2	Very low	98 Å²	98	134.6 Å²	134.6	69%	0.685	78%	0.779	S	S	*	*			trans	103.7	143.7	143.9	79.2	0	0	0	0	119.2
215	N	29.4	Very low	29.4	Very low	150 Å²	150	133.7 Å²	133.7	80%	0.802	79%	0.786	S	S	*	*			trans	62.9	106.5	166.5	-51.2	-24.5	0	0	0	116.3
216	C	23.5	Very low	29.4	Very low	107 Å²	107	131.3 Å²	131.3	72%	0.723	79%	0.785	S	S	*	*			cis	80.9	106.5	45.9	-163	0	0	0	0	114.5
217	S	30	Very low	29.6	Very low	116 Å²	116	138.6 Å²	138.6	81%	0.811	80%	0.801	S	S	*	*			trans	-173.1	97.3	164.8	-76.2	0	0	0	0	106.4
218	I	26.5	Very low	29.3	Very low	156 Å²	156	137 Å²	137	80%	0.8	80%	0.801	S	S	*	*				59	90.8	75.3	-52.4	179.7	0	0	0	113.6
219	S	31.8	Very low	29.5	Very low	111 Å²	111	140.2 Å²	140.2	78%	0.776	81%	0.81	S	S	*	*			trans	-163.2	108.5	144.7	58.5	0	0	0	0	113.5
220	K	28.3	Very low	29.6	Very low	197 Å²	197	138.8 Å²	138.8	86%	0.857	80%	0.803	S	S	*	*			trans	27.1	120.2	147	-55	174.2	-179	176.4	0	119.9
221	L	30.9	Very low	29.4	Very low	182 Å²	182	140.8 Å²	140.8	95%	0.953	80%	0.803	S	S	*	*				-155.5	168.1	97	-128.9	77.4	0	0	0	110.1
222	A	28.4	Very low	29.5	Very low	102 Å²	102	142.9 Å²	142.9	84%	0.843	81%	0.806	S	S	*	*			trans	-111.6	147.8	-170.7	0	0	0	0	0	113.3
223	G	31.5	Very low	29.2	Very low	79 Å²	79	139.6 Å²	139.6	81%	0.814	80%	0.801	S	S	*	*			trans	-156.4	103.8	177	0	0	0	0	0	111.3
224	I	32.2	Very low	29.3	Very low	165 Å²	165	140.9 Å²	140.9	85%	0.846	80%	0.804	S	S	*	*			trans	-72.6	129.9	-168.3	-62.7	156.9	0	0	0	112.5
225	T	32.8	Very low	29.3	Very low	140 Å²	140	143.2 Å²	143.2	86%	0.859	81%	0.809	S	S	*	*				-174.8	151.9	129.8	18.3	0	0	0	0	110
226	A	28.3	Very low	29.2	Very low	79 Å²	79	141 Å²	141	65%	0.653	81%	0.805	S	S	*	*			trans	-141	147.5	-173.1	0	0	0	0	0	112.2
227	Y	32.4	Very low	29.6	Very low	242 Å²	242	143 Å²	143	95%	0.949	81%	0.814	S	S	*	*			trans	-146.7	97.9	162.4	-85.8	-73	0	0	0	109.4
228	D	25.5	Very low	29.5	Very low	154 Å²	154	141.2 Å²	141.2	82%	0.824	81%	0.814	S	S	*	*			trans	-83.4	146.4	166.6	-84.4	-57.3	0	0	0	110.8
229	M	33.8	Very low	29.5	Very low	183 Å²	183	139.9 Å²	139.9	90%	0.901	82%	0.817	S	S	*	*			trans	-166.9	154.7	141.7	-100.6	-129.8	135.9	0	0	111.3
230	P	30.5	Very low	29.2	Very low	102 Å²	102	142.2 Å²	142.2	66%	0.662	82%	0.82	S	S	*	*				-122.6	169.4	-117.1	42.1	-35.6	0	0	0	116.5
231	I	27	Very low	29.4	Very low	155 Å²	155	141 Å²	141	80%	0.795	82%	0.821	S	S	*	*			trans	-63.4	137.9	164.8	-61.5	169	0	0	0	110	T233	I231-T233 HydrophobicContact CG2-CG2 4.46Å
232	K	30.5	Very low	29.4	Very low	198 Å²	198	135.6 Å²	135.6	86%	0.861	81%	0.81	S	S	*	*			trans	-111.2	125.2	161.4	-78.4	-170.8	175	-176.1	0	111
233	T	24.9	Very low	29.5	Very low	115 Å²	115	141.7 Å²	141.7	71%	0.706	81%	0.813	S	S	*	*			trans	-111.2	-177.4	156.3	49.7	0	0	0	0	108.3	I231	I231-T233 HydrophobicContact CG2-CG2 4.46Å
234	V	28.9	Very low	29.5	Very low	127 Å²	127	147.3 Å²	147.3	77%	0.77	82%	0.815	S	S	*	*			trans	74.5	135.5	178.3	-168.9	0	0	0	0	111.8
235	D	28.2	Very low	29.6	Very low	148 Å²	148	145.5 Å²	145.5	79%	0.791	81%	0.812	S	S	*	*			cis	-139.7	176.5	17.1	-141.1	-32	0	0	0	113.9
236	S	26.9	Very low	29.7	Very low	102 Å²	102	145 Å²	145	71%	0.713	81%	0.811	S	S	*	*			trans	-130.7	99.8	-178.4	63.1	0	0	0	0	115.4
237	T	32.1	Very low	30.1	Very low	150 Å²	150	146.6 Å²	146.6	92%	0.92	82%	0.817	S	S	*	*			trans	-151.4	156.8	157.5	49.1	0	0	0	0	108.6
238	G	27.2	Very low	30.1	Very low	78 Å²	78	144.3 Å²	144.3	80%	0.804	81%	0.812	S	S	*	*			cis	152.2	80.9	-5.5	0	0	0	0	0	112.7
239	C	27	Very low	30.5	Very low	128 Å²	128	146.8 Å²	146.8	87%	0.865	82%	0.816	S	S	*	*			trans	-150.3	158	169.7	-160.3	0	0	0	0	112.1
240	L	25.3	Very low	30.5	Very low	160 Å²	160	141 Å²	141	84%	0.838	80%	0.803	S	S	*	*			trans	-118.3	-168.7	-166.3	-137.2	79.3	0	0	0	112.5
241	I	32.5	Very low	30.7	Very low	171 Å²	171	144 Å²	144	88%	0.877	81%	0.813	S	S	*	*			trans	85	125.9	174.8	-48.6	158.2	0	0	0	113.4
242	G	31.4	Very low	31	Very low	70 Å²	70	143 Å²	143	72%	0.722	81%	0.809	S	S	*	*			cis	-167.3	166.2	-1.8	0	0	0	0	0	113.5
243	Y	30	Very low	31.2	Very low	230 Å²	230	141.8 Å²	141.8	90%	0.902	81%	0.808	S	S	*	*			trans	-94.8	149.7	-168	-73.8	-98.2	0	0	0	115.9
244	K	32.2	Very low	31.4	Very low	196 Å²	196	141.3 Å²	141.3	85%	0.852	81%	0.809	S	S	*	*			trans	165.3	138.4	141.8	-90.3	155.5	-178.6	-177.3	0	108.4
245	T	35.1	Very low	31.3	Very low	127 Å²	127	139.9 Å²	139.9	78%	0.779	81%	0.805	S	S	*	*			cis	-160.7	138.4	-7.5	18.4	0	0	0	0	108.1
246	P	34.7	Very low	31.5	Very low	130 Å²	130	144.2 Å²	144.2	84%	0.844	81%	0.812	S	S	*	*			trans	-99	158	176.7	37.3	-33.3	0	0	0	113.6
247	S	36.8	Very low	31.7	Very low	112 Å²	112	145.5 Å²	145.5	78%	0.783	82%	0.816	S	S	*	*			trans	-140	92.4	176.8	59.5	0	0	0	0	113.7
248	F	31.7	Very low	31.7	Very low	194 Å²	194	142.5 Å²	142.5	85%	0.851	81%	0.806	S	S	*	*			trans	48.9	142.8	150.4	-88.7	-98.3	0	0	0	123.5
249	F	33.5	Very low	32	Very low	206 Å²	206	145.2 Å²	145.2	90%	0.904	80%	0.802	S	S	*	*			trans	62.7	118.8	173.4	-88.6	-96.3	0	0	0	116.8
250	G	33.5	Very low	32.2	Very low	61 Å²	61	147.7 Å²	147.7	63%	0.629	80%	0.798	S	S	*	*			cis	-153.2	154.7	-9.1	0	0	0	0	0	108.6
251	L	35.1	Very low	32.5	Very low	165 Å²	165	144.9 Å²	144.9	86%	0.864	79%	0.792	S	S	*	*				44	128.5	72.5	-83.5	88	0	0	0	113.2
252	L	33.4	Very low	32.7	Very low	135 Å²	135	146.6 Å²	146.6	71%	0.707	79%	0.793	S	S	*	*			cis	-159.5	133.9	-1.1	-165.3	74.7	0	0	0	106.7
253	M	34	Very low	32.8	Very low	173 Å²	173	146.9 Å²	146.9	85%	0.852	80%	0.796	S	S	*	*				178.7	162.8	95.9	-103.5	-59.9	-164.4	0	0	111.2
254	S	29.3	Very low	32.9	Very low	104 Å²	104	145.1 Å²	145.1	73%	0.727	79%	0.793	S	S	*	*			trans	-107.8	162.2	-176.4	-163.8	0	0	0	0	113.5
255	S	28.3	Very low	32.8	Very low	98 Å²	98	142.5 Å²	142.5	69%	0.685	79%	0.789	S	S	*	*			trans	-19	136.9	167.1	-50.2	0	0	0	0	118.5
256	Y	31.2	Very low	32.7	Very low	239 Å²	239	140 Å²	140	94%	0.937	79%	0.788	S	S	*	*			trans	-143.6	143.2	137.2	-110.7	-79.1	0	0	0	110.7
257	T	32.4	Very low	32.7	Very low	129 Å²	129	143 Å²	143	79%	0.791	79%	0.793	S	S	*	*			trans	-115.1	159.6	-174.1	46.8	0	0	0	0	113
258	A	32	Very low	32.5	Very low	87 Å²	87	145.5 Å²	145.5	72%	0.719	80%	0.797	S	S	*	*			trans	83.9	134.9	157	0	0	0	0	0	121.1
259	N	32.4	Very low	32.6	Very low	135 Å²	135	141.3 Å²	141.3	72%	0.722	79%	0.791	S	S	*	*			trans	78.5	100	148.5	-71.7	-45	0	0	0	122.7
260	K	31.8	Very low	32.5	Very low	179 Å²	179	142.1 Å²	142.1	78%	0.778	79%	0.788	S	S	*	*				65.4	96.4	123.1	-66.7	179.5	-179.8	174.4	0	120.6
261	S	32.3	Very low	32.4	Very low	101 Å²	101	148.8 Å²	148.8	71%	0.706	80%	0.8	S	S	*	*				83.5	142.5	118.2	79.4	0	0	0	0	121.1
262	K	35.2	Very low	32.1	Very low	208 Å²	208	146.1 Å²	146.1	90%	0.904	80%	0.796	S	S	*	*			trans	67.4	141.9	169.6	-54.3	-179.6	-179	-179.4	0	116
263	G	33.4	Very low	32	Very low	76 Å²	76	146.6 Å²	146.6	78%	0.784	80%	0.799	S	S	*	*			trans	127.1	72.6	162.1	0	0	0	0	0	116.1
264	F	32.4	Very low	31.9	Very low	192 Å²	192	145.3 Å²	145.3	84%	0.842	79%	0.794	S	S	*	*			trans	12.6	128	134.6	-126.9	-106.6	0	0	0	119.6
265	D	30.8	Very low	31.8	Very low	142 Å²	142	147 Å²	147	76%	0.759	79%	0.794	S	S	*	*			trans	37.9	136.6	146.4	-60.9	-1.2	0	0	0	122.6
266	G	33.1	Very low	31.7	Very low	73 Å²	73	148.4 Å²	148.4	75%	0.753	80%	0.797	S	S	*	*			trans	130.5	70	135.8	0	0	0	0	0	118.6
267	M	33.7	Very low	31.5	Very low	195 Å²	195	147.3 Å²	147.3	96%	0.961	79%	0.792	S	S	*	*			trans	-157	101.7	135.5	-122	170.9	60.9	0	0	113.4
268	L	32.2	Very low	31.2	Very low	163 Å²	163	147 Å²	147	85%	0.853	79%	0.79	S	S	*	*			trans	-78.6	169.9	164.8	-85.6	166.4	0	0	0	111.1
269	S	34	Very low	31.2	Very low	106 Å²	106	154.1 Å²	154.1	74%	0.741	80%	0.798	S	S	*	*			trans	74.1	103.9	169.6	77.1	0	0	0	0	117.6
270	R	32.1	Very low	30.8	Very low	223 Å²	223	152.9 Å²	152.9	84%	0.842	80%	0.8	S	S	*	*	S	Bend		-160.9	151	110.1	-96.2	156.7	-160	-155.2	3.9	109.3
271	F	31.2	Very low	31.1	Very low	201 Å²	201	149.3 Å²	149.3	88%	0.882	80%	0.795	S	S	*	*			trans	62.1	59.3	177.2	-52	-64.5	0	0	0	117.1
272	S	29.6	Very low	30.9	Very low	109 Å²	109	151.2 Å²	151.2	76%	0.762	80%	0.796	S	S	*	*			trans	-65.1	133.8	147.9	52.5	0	0	0	0	110.9
273	N	31.1	Very low	30.8	Very low	145 Å²	145	151.9 Å²	151.9	78%	0.775	79%	0.794	S	S	*	*			trans	-156.7	92.6	145.1	-106.9	-14.7	0	0	0	112.9
274	I	30.7	Very low	30.5	Very low	147 Å²	147	154.9 Å²	154.9	75%	0.754	79%	0.792	S	S	*	*			trans	51	96.9	134.3	-52	164	0	0	0	116.7
275	I	27.7	Very low	30.5	Very low	140 Å²	140	156.1 Å²	156.1	72%	0.718	79%	0.793	S	S	*	*				-156.8	124.3	105	-93.1	153.8	0	0	0	108
276	V	26.5	Very low	30.4	Very low	126 Å²	126	155.8 Å²	155.8	76%	0.764	79%	0.79	S	S	*	*			trans	-114.7	131.3	164.9	173.3	0	0	0	0	107.2
277	R	26.3	Very low	30.3	Very low	217 Å²	217	158 Å²	158	82%	0.819	78%	0.779	S	S	*	*			trans	-134.6	82.3	165.2	-89.2	-165.2	168.4	104.2	-1.8	110.8
278	T	27.2	Very low	30.1	Very low	121 Å²	121	152 Å²	152	74%	0.742	76%	0.761	S	S	*	*			trans	-64	133.2	144.3	43.8	0	0	0	0	108.5
279	R	30.3	Very low	29.9	Very low	238 Å²	238	150 Å²	150	90%	0.898	76%	0.758	S	S	*	*			trans	-174.4	97.5	159.8	-108.6	169.2	-161.8	-142.8	2.2	112.2
280	S	25.7	Very low	29.7	Very low	108 Å²	108	156.2 Å²	156.2	76%	0.755	77%	0.765	S	S	*	*				-80.6	175.2	126.8	57.8	0	0	0	0	108.3
281	P	36.6	Very low	29.7	Very low	105 Å²	105	151.6 Å²	151.6	68%	0.682	76%	0.762	S	S	*	*			cis	-122.9	-169.9	-5.6	43	-29.5	0	0	0	112.4
282	I	29.8	Very low	29.7	Very low	141 Å²	141	148.2 Å²	148.2	72%	0.723	76%	0.757	S	S	*	*			trans	41.9	113.2	153	-61.3	153.1	0	0	0	117.5
283	Y	32	Very low	29.8	Very low	222 Å²	222	148 Å²	148	87%	0.871	76%	0.756	S	S	*	*				-156.2	136.6	119.4	-121.7	-78.7	0	0	0	111.7
284	N	28.1	Very low	29.7	Very low	139 Å²	139	144 Å²	144	74%	0.743	75%	0.748	S	S	*	*			trans	-65.6	137.1	174.3	-72	-50	0	0	0	111
285	Y	32.1	Very low	29.8	Very low	218 Å²	218	146.1 Å²	146.1	86%	0.855	75%	0.753	S	S	*	*			trans	-138.2	124.5	131.5	-113.2	-76.1	0	0	0	110.3
286	L	27.6	Very low	30	Very low	135 Å²	135	145.2 Å²	145.2	71%	0.707	75%	0.753	S	S	*	*			trans	-26.9	130.5	-172.6	-62.2	77.6	0	0	0	114.3
287	F	31	Very low	30.4	Very low	119 Å²	119	147.4 Å²	147.4	52%	0.522	75%	0.753	S	S	.	*			trans	-139.2	148.7	130.9	-118.4	-82.5	0	0	0	112.7	K356 L357	F287-K356 HydrophobicContact CE2-CB 3.45Å; F287-K356 VanDerWaalsContact CE2-CB 3.45Å; F287-K356 HydrophobicContact CZ-CB 3.96Å; F287-L357 HydrophobicContact CB-CD1 3.51Å; F287-L357 HydrophobicContact CB-CD2 4.02Å; F287-L357 HydrophobicContact CB-CG 3.67Å; F287-L357 HydrophobicContact CD1-CB 3.43Å; F287-L357 VanDerWaalsContact CD1-CB 3.43Å; F287-L357 HydrophobicContact CD1-CD1 2.3Å; F287-L357 HydrophobicContact CD1-CD2 3.7Å; F287-L357 HydrophobicContact CD1-CG 2.33Å; F287-L357 HydrophobicContact CD2-CB 3.84Å; F287-L357 HydrophobicContact CD2-CD1 2.3Å; F287-L357 HydrophobicContact CD2-CD2 2.59Å; F287-L357 HydrophobicContact CD2-CG 2.32Å; F287-L357 HydrophobicContact CE1-CB 2.77Å; F287-L357 HydrophobicContact CE1-CD1 2.3Å; F287-L357 HydrophobicContact CE1-CD2 3.93Å; F287-L357 HydrophobicContact CE1-CG 2.32Å; F287-L357 HydrophobicContact CE2-CB 3.26Å; F287-L357 HydrophobicContact CE2-CD1 2.3Å; F287-L357 HydrophobicContact CE2-CD2 2.89Å; F287-L357 HydrophobicContact CE2-CG 2.31Å; F287-L357 HydrophobicContact CG-CB 3.9Å; F287-L357 HydrophobicContact CG-CD1 2.3Å; F287-L357 HydrophobicContact CG-CD2 3.05Å; F287-L357 HydrophobicContact CG-CG 2.32Å; F287-L357 HydrophobicContact CZ-CB 2.68Å; F287-L357 HydrophobicContact CZ-CD1 2.29Å; F287-L357 HydrophobicContact CZ-CD2 3.58Å; F287-L357 HydrophobicContact CZ-CG 2.32Å
288	A	30.3	Very low	30.9	Very low	70 Å²	70	144.1 Å²	144.1	58%	0.579	75%	0.751	S	S	*	*			trans	-84.4	141.8	-175.1	0	0	0	0	0	111.3	R290	A288-R290 PolarHBondContact O-N 3.44Å
289	P	27.9	Very low	31.5	Very low	120 Å²	120	144.9 Å²	144.9	78%	0.779	75%	0.75	S	S	*	*			trans	-65	109.2	166.8	28.4	-32.5	0	0	0	108.2	T291	P289-T291 VanDerWaalsContact C-N 3.27Å; P289-T291 PolarHBondContact O-N 2.61Å
290	R	28.7	Very low	32.1	Very low	236 Å²	236	139 Å²	139	89%	0.891	74%	0.742	S	S	*	*			trans	-70.6	92.9	165.9	-85.9	-168.7	170.9	-173	-1.8	107.9	A288 V292	A288-R290 PolarHBondContact O-N 3.44Å; R290-V292 PolarHBondContact O-N 3.2Å; R290-V292 VanDerWaalsContact O-N 3.14Å
291	T	32.1	Very low	32.8	Very low	127 Å²	127	142.4 Å²	142.4	78%	0.779	75%	0.746	S	S	*	*			trans	-45.9	118.8	164	50.2	0	0	0	0	108.6	P289 S293	P289-T291 VanDerWaalsContact C-N 3.27Å; P289-T291 PolarHBondContact O-N 2.61Å; T291-S293 PolarHBondContact O-N 2.59Å
292	V	33	Very low	32.8	Very low	130 Å²	130	143.1 Å²	143.1	79%	0.788	75%	0.751	S	S	*	*			trans	-59	114.3	172.6	176.9	0	0	0	0	106.9	R290 G294	R290-V292 PolarHBondContact O-N 3.2Å; R290-V292 VanDerWaalsContact O-N 3.14Å; V292-G294 PolarHBondContact O-N 2.92Å; V292-G294 VanDerWaalsContact O-N 3.09Å
293	S	31	Very low	33.3	Very low	104 Å²	104	146 Å²	146	73%	0.727	76%	0.758	S	S	*	*			trans	-58.8	114.9	172.7	48.9	0	0	0	0	107.7	T291 F295	T291-S293 PolarHBondContact O-N 2.59Å; S293-F295 PolarHBondContact O-N 2.86Å
294	G	29.8	Very low	33.4	Very low	60 Å²	60	141.7 Å²	141.7	62%	0.619	76%	0.755	S	S	*	*			trans	-55	137.9	-177.9	0	0	0	0	0	110.9	V292 V296	V292-G294 PolarHBondContact O-N 2.92Å; V292-G294 VanDerWaalsContact O-N 3.09Å; G294-V296 PolarHBondContact O-N 3.42Å
295	F	32.9	Very low	33.5	Very low	193 Å²	193	144.9 Å²	144.9	85%	0.846	76%	0.763	S	S	*	*			trans	-62	99.3	174.5	-85.8	-94.5	0	0	0	109.6	S293 F297	S293-F295 PolarHBondContact O-N 2.86Å; F295-F297 PolarHBondContact O-N 2.74Å; F295-F297 VanDerWaalsContact O-N 3.11Å
296	V	31.8	Very low	33.6	Very low	121 Å²	121	143 Å²	143	73%	0.733	76%	0.762	S	S	*	*			trans	-72	100.9	164.4	179.6	0	0	0	0	106.7	G294 D298	G294-V296 PolarHBondContact O-N 3.42Å; V296-D298 PolarHBondContact O-N 2.72Å
297	F	34	Very low	33.6	Very low	172 Å²	172	148.5 Å²	148.5	75%	0.754	77%	0.773	S	S	*	*			trans	-70.5	105.2	160	-101.8	-92.9	0	0	0	107.6	F295 I299	F295-F297 PolarHBondContact O-N 2.74Å; F295-F297 VanDerWaalsContact O-N 3.11Å; F297-I299 HydrophobicContact CB-CG1 4.25Å; F297-I299 PolarHBondContact O-N 2.87Å
298	D	36.4	Very low	33.6	Very low	147 Å²	147	149.2 Å²	149.2	79%	0.786	79%	0.792	S	S	*	*			trans	-67.5	86.7	164.1	-80.7	-28.8	0	0	0	108.6	V296 P300	V296-D298 PolarHBondContact O-N 2.72Å; D298-P300 VanDerWaalsContact O-CD 3.28Å; D298-P300 WeakPolarHBondContact O-CD 3.17Å
299	I	39.8	Very low	33.7	Very low	137 Å²	137	148.8 Å²	148.8	70%	0.703	79%	0.794	S	S	*	*			trans	-73.8	113.3	171.7	-59.9	172.7	0	0	0	106.8	F297 E301	F297-I299 HydrophobicContact CB-CG1 4.25Å; F297-I299 PolarHBondContact O-N 2.87Å; I299-E301 PolarHBondContact O-N 2.93Å
300	P	43.7	Very low	33.9	Very low	115 Å²	115	148.4 Å²	148.4	75%	0.747	79%	0.794	S	S	*	*			trans	-65.6	127.9	176.5	27.6	-33.7	0	0	0	109.6	D298	D298-P300 VanDerWaalsContact O-CD 3.28Å; D298-P300 WeakPolarHBondContact O-CD 3.17Å
301	E	41	Very low	34.1	Very low	179 Å²	179	146.8 Å²	146.8	84%	0.836	79%	0.793	S	S	*	*			trans	-58.5	137.3	-177.2	-64.7	-172.9	134.8	0	0	111.8	I299 K303	I299-E301 PolarHBondContact O-N 2.93Å; E301-K303 PolarHBondContact O-N 3.35Å
302	P	36.4	Very low	34	Very low	120 Å²	120	149 Å²	149	78%	0.779	80%	0.799	S	S	*	*			trans	-70.6	102.2	177.4	29.2	-33.4	0	0	0	109.4	T304	P302-T304 PolarHBondContact O-N 3.34Å
303	K	39	Very low	34.1	Very low	203 Å²	203	147.8 Å²	147.8	88%	0.883	80%	0.803	S	S	*	*			trans	-53.5	117.6	176.1	-72.6	-171.1	175.5	-175.7	0	110.4	E301 F305	E301-K303 PolarHBondContact O-N 3.35Å; K303-F305 PolarHBondContact O-N 3.03Å; K303-F305 VanDerWaalsContact O-N 3.16Å
304	T	34	Very low	34.1	Very low	131 Å²	131	148 Å²	148	80%	0.804	81%	0.805	S	S	*	*			trans	-61.5	112.3	-179.3	35.1	0	0	0	0	110.7	P302 E306	P302-T304 PolarHBondContact O-N 3.34Å; T304-E306 PolarHBondContact O-N 3.5Å
305	F	30.5	Very low	34.3	Very low	205 Å²	205	151.1 Å²	151.1	90%	0.899	81%	0.812	S	S	*	*			trans	-84.2	93.6	174.6	-141.5	-79	0	0	0	108.8	K303 R307	K303-F305 PolarHBondContact O-N 3.03Å; K303-F305 VanDerWaalsContact O-N 3.16Å; F305-R307 PolarHBondContact O-N 3.45Å
306	E	35.1	Very low	34.2	Very low	178 Å²	178	147 Å²	147	83%	0.832	80%	0.803	S	S	*	*			trans	-61.3	129.2	-179.9	-71.2	-164.8	131.4	0	0	111.6	T304 C308	T304-E306 PolarHBondContact O-N 3.5Å; E306-C308 PolarHBondContact O-N 3.02Å
307	R	27.8	Very low	34.3	Very low	251 Å²	251	147.1 Å²	147.1	95%	0.947	80%	0.804	S	S	*	*			trans	-79.2	107.3	167.3	-74.7	177.9	170.1	177.1	-3.1	108.9	F305	F305-R307 PolarHBondContact O-N 3.45Å
308	C	31.6	Very low	34.3	Very low	135 Å²	135	150 Å²	150	91%	0.912	81%	0.809	S	S	*	*			trans	-113.2	137.7	155.6	-157.1	0	0	0	0	109.4	E306	E306-C308 PolarHBondContact O-N 3.02Å
309	G	32.2	Very low	34.3	Very low	61 Å²	61	149 Å²	149	63%	0.629	81%	0.811	S	S	*	*			trans	-103.6	159.4	-153.6	0	0	0	0	0	116.7
310	S	31.3	Very low	33.9	Very low	111 Å²	111	148.5 Å²	148.5	78%	0.776	82%	0.818	S	S	*	*			trans	50.5	113.4	149.3	61.3	0	0	0	0	119.5
311	K	33.5	Very low	33.4	Very low	203 Å²	203	147.1 Å²	147.1	88%	0.883	81%	0.811	S	S	*	*				-161.6	161.1	99.1	-103.8	163.6	-174.7	176.2	0	112.5
312	L	29.4	Very low	33	Very low	172 Å²	172	146.8 Å²	146.8	90%	0.901	81%	0.809	S	S	*	*			trans	-83.1	144.7	-176.3	-68.8	66.1	0	0	0	111.1
313	A	34.6	Very low	32.8	Very low	105 Å²	105	152.9 Å²	152.9	87%	0.868	82%	0.817	S	S	*	*				-166.8	151.6	129.6	0	0	0	0	0	110.2
314	S	31	Very low	32.3	Very low	109 Å²	109	152.7 Å²	152.7	76%	0.762	82%	0.816	S	S	*	*			trans	-113	161.8	-179.3	49.7	0	0	0	0	112
315	V	34.5	Very low	32.4	Very low	126 Å²	126	153.4 Å²	153.4	76%	0.764	82%	0.82	S	S	*	*				164	95.4	125.2	162.7	0	0	0	0	112.5
316	T	31.2	Very low	32.4	Very low	107 Å²	107	149.7 Å²	149.7	66%	0.656	81%	0.814	S	S	*	*				46.5	93.1	117.9	-36.2	0	0	0	0	123
317	T	33.6	Very low	32.3	Very low	123 Å²	123	145 Å²	145	76%	0.755	81%	0.806	S	S	*	*			trans	68.8	165.8	141.4	73.3	0	0	0	0	119.2
318	R	34.5	Very low	32.7	Very low	232 Å²	232	141.9 Å²	141.9	88%	0.875	80%	0.802	S	S	*	*			cis	-137.8	168	12.9	-74.7	-174.9	174.8	-174.7	-2.7	112.6
319	P	36.6	Very low	32.9	Very low	125 Å²	125	139 Å²	139	81%	0.812	79%	0.788	S	S	*	*			trans	-108.3	160.3	-176.1	39.8	-33.6	0	0	0	115.8
320	C	30.9	Very low	33.1	Very low	128 Å²	128	144.9 Å²	144.9	87%	0.865	80%	0.804	S	S	*	*			trans	-162.5	131.7	154.4	-147.8	0	0	0	0	117.2
321	S	32.4	Very low	33.3	Very low	85 Å²	85	142.9 Å²	142.9	59%	0.594	80%	0.801	S	S	*	*			trans	38.5	123.1	141.4	-148	0	0	0	0	125.6
322	Q	33.2	Very low	33.6	Very low	172 Å²	172	140.1 Å²	140.1	80%	0.804	80%	0.801	S	S	*	*			trans	49	124.3	133.3	-61	174.1	22.6	0	0	123.2
323	R	32.7	Very low	34	Very low	248 Å²	248	137.3 Å²	137.3	94%	0.936	79%	0.793	S	S	*	*				-168	162.4	104	-109.2	175.1	174.9	168.9	-2	113.7
324	K	27.7	Very low	34.1	Very low	200 Å²	200	141.7 Å²	141.7	87%	0.87	80%	0.795	S	S	*	*			trans	-89.2	156.8	165.7	-65.5	177.9	176.4	179.4	0	110.2
325	V	35.8	Very low	34.4	Very low	146 Å²	146	141 Å²	141	89%	0.885	80%	0.796	S	S	*	*			trans	-169.1	175.6	134.8	138.3	0	0	0	0	108.7
326	T	31.9	Very low	34.2	Very low	126 Å²	126	145.6 Å²	145.6	77%	0.773	80%	0.8	S	S	*	*			trans	-125.9	156.7	-153.3	48.9	0	0	0	0	116.5
327	A	32.8	Very low	34.5	Very low	81 Å²	81	146.8 Å²	146.8	67%	0.669	81%	0.809	S	S	*	*			trans	84.1	162.7	144.5	0	0	0	0	0	121.1
328	H	35.6	Very low	34.3	Very low	185 Å²	185	146.3 Å²	146.3	86%	0.856	81%	0.806	S	S	*	*			trans	74	146.4	178	-56.3	-85.8	0	0	0	117.4
329	A	35.4	Very low	34.5	Very low	74 Å²	74	144.8 Å²	144.8	61%	0.612	81%	0.809	S	S	*	*			cis	-170.1	174.8	-22.7	0	0	0	0	0	110.1
330	L	37.6	Very low	34	Very low	184 Å²	184	147.7 Å²	147.7	96%	0.963	81%	0.812	S	S	*	*			trans	70.9	149.2	173.3	-45	169.6	0	0	0	114.2
331	G	35.3	Very low	34.2	Very low	70 Å²	70	147.7 Å²	147.7	72%	0.722	81%	0.807	S	S	*	*			cis	167.1	151	-3.3	0	0	0	0	0	106.3
332	V	39.7	Very low	34.2	Very low	144 Å²	144	148.9 Å²	148.9	87%	0.873	81%	0.807	S	S	*	*			cis	-157.5	159.6	26.2	165.2	0	0	0	0	108.2
333	P	36.1	Very low	34.2	Very low	113 Å²	113	150.8 Å²	150.8	73%	0.734	81%	0.807	S	S	*	*			trans	-116.1	167.3	-168.1	41.7	-32.5	0	0	0	116.9
334	Q	38.1	Very low	34.1	Very low	198 Å²	198	142.9 Å²	142.9	93%	0.925	80%	0.795	S	S	*	*			trans	171.7	155.3	152.2	-96.7	168.9	26.8	0	0	108.6
335	A	35.9	Very low	34.2	Very low	93 Å²	93	140.5 Å²	140.5	77%	0.769	79%	0.792	S	S	*	*			cis	-158.4	170.4	-20.2	0	0	0	0	0	109.5
336	R	31.1	Very low	34.2	Very low	224 Å²	224	140 Å²	140	85%	0.845	79%	0.789	S	S	*	*			trans	-123.9	164.3	166.4	-77.8	-172.1	-179.4	178.5	-0.4	109.7
337	P	37	Very low	34.2	Very low	131 Å²	131	138.6 Å²	138.6	85%	0.851	78%	0.784	S	S	*	*				-127.7	175.7	123.4	37.5	-31.5	0	0	0	113.3
338	T	30.6	Very low	34.3	Very low	114 Å²	114	142.6 Å²	142.6	70%	0.699	79%	0.793	S	S	*	*			trans	-138.3	143.7	-179.2	46.2	0	0	0	0	109.1
339	E	37.8	Very low	34.1	Very low	199 Å²	199	140.8 Å²	140.8	93%	0.93	79%	0.789	S	S	*	*			trans	-153	145	159.5	-119.4	160.8	-139.4	0	0	110.5
340	E	25.8	Very low	34.3	Very low	186 Å²	186	144.1 Å²	144.1	87%	0.869	80%	0.797	S	S	*	*			trans	-112.6	158.8	174.7	-57.1	-178.7	138.6	0	0	108.7
341	V	36.6	Very low	34.4	Very low	128 Å²	128	141.9 Å²	141.9	78%	0.776	79%	0.785	S	S	*	*			trans	179.2	114.7	140.2	143.1	0	0	0	0	112.5
342	N	32.1	Very low	34.2	Very low	110 Å²	110	142.9 Å²	142.9	59%	0.588	78%	0.781	S	S	*	*			trans	43.6	130.3	141.9	-64.8	-67.1	0	0	0	125.1
343	R	32.8	Very low	34	Very low	212 Å²	212	144.1 Å²	144.1	80%	0.8	78%	0.782	S	S	*	*			trans	83.7	109.3	130.8	-73.8	175.7	-174.6	100.5	7.6	122.5
344	A	31.2	Very low	34	Very low	82 Å²	82	143.8 Å²	143.8	68%	0.678	78%	0.782	S	S	*	*				75.8	121	117.7	0	0	0	0	0	122.4
345	D	28.3	Very low	33.7	Very low	151 Å²	151	143.4 Å²	143.4	81%	0.807	78%	0.78	S	S	*	*			trans	49.3	106.4	134	-52.5	-16.7	0	0	0	121.4
346	T	35.9	Very low	33.6	Very low	135 Å²	135	147.9 Å²	147.9	83%	0.828	78%	0.783	S	S	*	*			trans	-171.7	96.5	139.3	15.5	0	0	0	0	107.6
347	S	32.4	Very low	33.6	Very low	96 Å²	96	141.7 Å²	141.7	67%	0.671	77%	0.766	S	S	*	*				70.7	106.8	88.9	73.7	0	0	0	0	115.7
348	L	34.4	Very low	33.2	Very low	165 Å²	165	141.4 Å²	141.4	86%	0.864	76%	0.762	S	S	*	*			trans	42.1	119.9	141.7	-54	174.1	0	0	0	119.6
349	L	33.2	Very low	33.3	Very low	147 Å²	147	143.6 Å²	143.6	77%	0.77	77%	0.767	S	S	*	*				-178.9	169.7	114.5	-97.8	164.9	0	0	0	112.8	L351	L349-L351 HydrophobicContact CD2-CD1 3.73Å
350	N	39.4	Very low	32.7	Very low	144 Å²	144	139.4 Å²	139.4	77%	0.77	76%	0.76	S	S	*	*			trans	78.7	91.4	179.8	-54.3	-26.8	0	0	0	114.8
351	L	38	Very low	32.9	Very low	138 Å²	138	135.7 Å²	135.7	72%	0.723	76%	0.755	S	S	*	*				62.7	140.3	66.8	-72.5	82.3	0	0	0	114.1	L349	L349-L351 HydrophobicContact CD2-CD1 3.73Å
352	S	32.2	Very low	32.5	Very low	91 Å²	91	139.2 Å²	139.2	64%	0.636	76%	0.763	S	S	*	*			cis	171.5	110.4	-35.2	45.6	0	0	0	0	107.7
353	L	34.5	Very low	32.4	Very low	170 Å²	170	138.2 Å²	138.2	89%	0.89	76%	0.764	S	S	*	*			trans	-176.1	138.4	163.8	-122.6	72.8	0	0	0	105.9
354	S	37.5	Very low	32.4	Very low	106 Å²	106	135.3 Å²	135.3	74%	0.741	76%	0.764	S	S	*	*			cis	-140	147.8	3.8	-61.4	0	0	0	0	110
355	Q	30.6	Very low	32.3	Very low	189 Å²	189	140.2 Å²	140.2	88%	0.883	77%	0.773	S	S	*	*			trans	-87.6	169.7	178.2	-79	-176.3	-30.9	0	0	113.9
356	K	33.6	Very low	32.4	Very low	187 Å²	187	143.7 Å²	143.7	81%	0.813	78%	0.775	S	S	*	*			trans	72.4	144.6	-172	-41.7	171.2	-178.9	177.9	0	110.5	F287	F287-K356 HydrophobicContact CE2-CB 3.45Å; F287-K356 VanDerWaalsContact CE2-CB 3.45Å; F287-K356 HydrophobicContact CZ-CB 3.96Å
357	L	31.5	Very low	32.2	Very low	94 Å²	94	141.7 Å²	141.7	49%	0.492	77%	0.767	S	S	.	*			cis	-109.1	172.6	17.8	-101.4	89.9	0	0	0	111.9	F287	F287-L357 HydrophobicContact CB-CD1 3.51Å; F287-L357 HydrophobicContact CB-CD2 4.02Å; F287-L357 HydrophobicContact CB-CG 3.67Å; F287-L357 HydrophobicContact CD1-CB 3.43Å; F287-L357 VanDerWaalsContact CD1-CB 3.43Å; F287-L357 HydrophobicContact CD1-CD1 2.3Å; F287-L357 HydrophobicContact CD1-CD2 3.7Å; F287-L357 HydrophobicContact CD1-CG 2.33Å; F287-L357 HydrophobicContact CD2-CB 3.84Å; F287-L357 HydrophobicContact CD2-CD1 2.3Å; F287-L357 HydrophobicContact CD2-CD2 2.59Å; F287-L357 HydrophobicContact CD2-CG 2.32Å; F287-L357 HydrophobicContact CE1-CB 2.77Å; F287-L357 HydrophobicContact CE1-CD1 2.3Å; F287-L357 HydrophobicContact CE1-CD2 3.93Å; F287-L357 HydrophobicContact CE1-CG 2.32Å; F287-L357 HydrophobicContact CE2-CB 3.26Å; F287-L357 HydrophobicContact CE2-CD1 2.3Å; F287-L357 HydrophobicContact CE2-CD2 2.89Å; F287-L357 HydrophobicContact CE2-CG 2.31Å; F287-L357 HydrophobicContact CG-CB 3.9Å; F287-L357 HydrophobicContact CG-CD1 2.3Å; F287-L357 HydrophobicContact CG-CD2 3.05Å; F287-L357 HydrophobicContact CG-CG 2.32Å; F287-L357 HydrophobicContact CZ-CB 2.68Å; F287-L357 HydrophobicContact CZ-CD1 2.29Å; F287-L357 HydrophobicContact CZ-CD2 3.58Å; F287-L357 HydrophobicContact CZ-CG 2.32Å
358	T	28.1	Very low	32	Very low	125 Å²	125	144 Å²	144	77%	0.767	77%	0.772	S	S	*	*			trans	-137.1	137	168.4	47.9	0	0	0	0	110.6
359	I	32.8	Very low	31.8	Very low	160 Å²	160	144.5 Å²	144.5	82%	0.821	77%	0.767	S	S	*	*			trans	-164.3	127.6	146.5	-100	151.7	0	0	0	108.1
360	S	25.9	Very low	31.6	Very low	111 Å²	111	145.7 Å²	145.7	78%	0.776	77%	0.773	S	S	*	*	S	Bend	trans	34.8	88.1	165.1	65.5	0	0	0	0	120.8
361	S	29.9	Very low	31.2	Very low	108 Å²	108	148.9 Å²	148.9	76%	0.755	77%	0.774	S	S	*	*			trans	-161.3	104.8	138.2	57.4	0	0	0	0	110.4
362	H	29.1	Very low	31	Very low	203 Å²	203	148.6 Å²	148.6	94%	0.94	78%	0.779	S	S	*	*			trans	-111	86.5	174.2	-88.8	-65.4	0	0	0	111
363	S	30.1	Very low	31.1	Very low	88 Å²	88	150.4 Å²	150.4	62%	0.615	79%	0.789	S	S	*	*			trans	-112.3	164.6	148.9	59.7	0	0	0	0	108.4
364	D	31.7	Very low	31	Very low	151 Å²	151	146 Å²	146	81%	0.807	78%	0.783	S	S	*	*			trans	73.5	40.9	166.2	-46.8	-46.7	0	0	0	119
365	E	28.4	Very low	30.6	Very low	186 Å²	186	148.8 Å²	148.8	87%	0.869	79%	0.79	S	S	*	*			trans	-126.7	83	145.8	-76.6	-159.4	155.3	0	0	111.4
366	R	30.4	Very low	30.7	Very low	223 Å²	223	147.1 Å²	147.1	84%	0.842	79%	0.788	S	S	*	*			trans	-132.8	59.6	165.3	-81.1	-165.4	175.8	-173	0.9	111.8
367	S	32.3	Very low	30.5	Very low	94 Å²	94	144 Å²	144	66%	0.657	79%	0.789	S	S	*	*	S	Bend	trans	-146.9	158.7	162.8	61.9	0	0	0	0	110.1
368	N	28.7	Very low	30.5	Very low	145 Å²	145	144.1 Å²	144.1	78%	0.775	80%	0.803	S	S	*	*			trans	67.4	59.5	172.7	-55	-23	0	0	0	118.1
369	F	29.6	Very low	30.6	Very low	175 Å²	175	144.2 Å²	144.2	77%	0.768	80%	0.804	S	S	*	*			trans	-122.5	56.6	153.5	-105.7	-84.1	0	0	0	112.5	R371	F369-R371 HydrophobicContact CD1-CG 4.28Å; F369-R371 PolarHBondContact O-N 3.5Å
370	L	29.5	Very low	30.5	Very low	172 Å²	172	142.6 Å²	142.6	90%	0.901	80%	0.804	S	S	*	*			trans	-72.6	113.7	154.7	-86.1	81	0	0	0	108.1
371	R	31.7	Very low	31.1	Very low	210 Å²	210	140.6 Å²	140.6	79%	0.792	79%	0.79	S	S	*	*			trans	-128	150.2	162	-74.9	-167.7	174.3	-164.5	-1.7	110	F369	F369-R371 HydrophobicContact CD1-CG 4.28Å; F369-R371 PolarHBondContact O-N 3.5Å
372	T	33	Very low	31.8	Very low	133 Å²	133	144.4 Å²	144.4	82%	0.816	79%	0.793	S	S	*	*			trans	-69.9	151.9	-166.2	41.4	0	0	0	0	113.3	G374	T372-G374 PolarHBondContact O-N 2.94Å
373	P	34.9	Very low	32.8	Very low	129 Å²	129	139.5 Å²	139.5	84%	0.838	78%	0.779	S	S	*	*			trans	-71.1	99.8	179.5	28.9	-34.3	0	0	0	111.1	N375	P373-N375 PolarHBondContact O-N 3.28Å
374	G	30.9	Very low	34.2	Very low	76 Å²	76	137.1 Å²	137.1	78%	0.784	76%	0.759	S	S	*	*			trans	-72	101.1	170.6	0	0	0	0	0	111	T372 N376	T372-G374 PolarHBondContact O-N 2.94Å; G374-N376 PolarHBondContact O-N 3.42Å; G374-N376 VanDerWaalsContact O-N 3.12Å
375	N	30	Very low	35.6	Very low	165 Å²	165	134.9 Å²	134.9	88%	0.882	75%	0.747	S	S	*	*			trans	-65	108.3	177.8	-127.4	-3.9	0	0	0	110.2	P373	P373-N375 PolarHBondContact O-N 3.28Å
376	N	33.1	Very low	37.4	Very low	155 Å²	155	129.7 Å²	129.7	83%	0.829	72%	0.72	S	S	*	*			trans	-149	128.5	164.5	-101.5	-35.6	0	0	0	111.1	G374 A378	G374-N376 PolarHBondContact O-N 3.42Å; G374-N376 VanDerWaalsContact O-N 3.12Å; N376-A378 PolarHBondContact O-N 3.24Å
377	S	28.1	Very low	39.2	Very low	121 Å²	121	126.1 Å²	126.1	85%	0.846	71%	0.712	S	S	*	*			trans	-47.7	122.8	-168.7	52.9	0	0	0	0	116.8
378	A	32.6	Very low	41.1	Very low	96 Å²	96	124.1 Å²	124.1	79%	0.793	70%	0.698	S	S	*	*			trans	-128.7	130	145	0	0	0	0	0	107.9	N376	N376-A378 PolarHBondContact O-N 3.24Å
379	T	29.5	Very low	43.3	Very low	128 Å²	128	117.7 Å²	117.7	79%	0.785	66%	0.664	S	S	*	*			trans	-65.4	150.7	179.4	44.3	0	0	0	0	111	S381	T379-S381 VanDerWaalsContact C-N 3.31Å; T379-S381 PolarHBondContact O-N 3.07Å
380	P	30.8	Very low	45.5	Very low	125 Å²	125	111.2 Å²	111.2	81%	0.812	64%	0.638	S	S	*	*			trans	-66.5	92.9	172.6	27.9	-33.6	0	0	0	109.2	K382	P380-K382 PolarHBondContact O-N 3.25Å
381	S	38.6	Very low	47.4	Very low	69 Å²	69	105.2 Å²	105.2	48%	0.483	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-54.1	124.1	168	55.3	0	0	0	0	108.1	T379 K678	T379-S381 VanDerWaalsContact C-N 3.31Å; T379-S381 PolarHBondContact O-N 3.07Å; S381-K678 PolarHBondContact OG-NZ 2.69Å
382	K	44.8	Very low	49.5	Very low	189 Å²	189	98.9 Å²	98.9	82%	0.822	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-47.8	143.8	180	-65.3	-178.5	178.6	-177.9	0	110.6	P380	P380-K382 PolarHBondContact O-N 3.25Å
383	P	50.7	Low	51.5	Low	99 Å²	99	95.2 Å²	95.2	64%	0.643	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-54.7	148.1	171.4	26	-34.8	0	0	0	109.6	D385	P383-D385 PolarHBondContact O-N 3.09Å; P383-D385 VanDerWaalsContact O-N 3.15Å
384	I	59.5	Low	53.2	Low	38 Å²	38	91 Å²	91	20%	0.195	54%	0.536	C	S	.	.	P	Polyproline II helix	trans	-62.6	120.3	179.8	-58.1	168.8	0	0	0	107.3	R386 L389	I384-R386 VanDerWaalsContact C-N 3.33Å; I384-R386 PolarHBondContact O-N 2.97Å; I384-L389 HydrophobicContact CG2-CD1 3.91Å
385	D	60.4	Low	55.1	Low	104 Å²	104	92.1 Å²	92.1	56%	0.556	52%	0.519	S	S	*	.			trans	-71.8	91.5	177.6	-175.3	-2.2	0	0	0	109.1	P383 H387 S388	P383-D385 PolarHBondContact O-N 3.09Å; P383-D385 VanDerWaalsContact O-N 3.15Å; D385-H387 PolarHBondContact O-N 3.43Å; D385-H387 VanDerWaalsContact O-N 3.11Å; D385-H387 VanDerWaalsContact OD1-CB 3.24Å; D385-H387 WeakPolarHBondContact OD1-CB 3.19Å; D385-H387 PolarHBondContact OD1-N 2.89Å; D385-H387 VanDerWaalsContact OD1-N 3.13Å; D385-S388 WeakPolarHBondContact O-CB 3.47Å; D385-S388 PolarHBondContact O-N 3.07Å; D385-S388 PolarHBondContact O-OG 2.92Å
386	R	67.2	Low	57.1	Low	78 Å²	78	86.1 Å²	86.1	29%	0.294	49%	0.486	S	S	.	.	H	α-helix	trans	-55.1	-28.7	-179.7	-66.3	-177.8	178.8	80.1	3.1	111.9	I384 S388 L389 V390 D749 D751	I384-R386 VanDerWaalsContact C-N 3.33Å; I384-R386 PolarHBondContact O-N 2.97Å; R386-S388 VanDerWaalsContact C-N 3.25Å; R386-S388 PolarHBondContact O-N 3.49Å; R386-L389 PolarHBondContact O-N 3.22Å; R386-L389 VanDerWaalsContact O-N 3.16Å; R386-V390 WeakPolarHBondContact O-CG2 3.47Å; R386-V390 PolarHBondContact O-N 2.88Å; R386-D749 IonicContact CZ-OD2 3.97Å; R386-D749 IonicContact NE-OD2 3.87Å; R386-D749 PolarHBondContact NE-OD2 3.29Å; R386-D749 IonicContact NH2-OD1 2.71Å; R386-D749 IonicContact NH2-OD2 3.75Å; R386-D749 PolarHBondContact NH2-OD2 3.5Å; R386-D751 IonicContact CZ-OD2 3.44Å; R386-D751 IonicContact NH1-OD2 2.76Å; R386-D751 PolarHBondContact NH1-OD2 2.92Å; R386-D751 IonicContact NH2-OD2 3.18Å; R386-D751 PolarHBondContact NH2-OD2 2.73Å
387	H	66.6	Low	58.7	Low	147 Å²	147	82.3 Å²	82.3	68%	0.681	46%	0.464	S	S	*	.	H	α-helix	trans	-65.1	-28.3	176.6	-162.6	-68.3	0	0	0	112.5	D385 S391	D385-H387 PolarHBondContact O-N 3.43Å; D385-H387 VanDerWaalsContact O-N 3.11Å; D385-H387 VanDerWaalsContact OD1-CB 3.24Å; D385-H387 WeakPolarHBondContact OD1-CB 3.19Å; D385-H387 PolarHBondContact OD1-N 2.89Å; D385-H387 VanDerWaalsContact OD1-N 3.13Å; H387-S391 VanDerWaalsContact O-CB 3.26Å; H387-S391 WeakPolarHBondContact O-CB 3.48Å; H387-S391 PolarHBondContact O-N 2.67Å
388	S	73.1	Confident	60.4	Low	52 Å²	52	84.8 Å²	84.8	36%	0.364	46%	0.459	S	S	.	.	H	α-helix	trans	-67.5	-44.7	171.9	70.7	0	0	0	0	111.8	D385 R386 S391 E392	D385-S388 WeakPolarHBondContact O-CB 3.47Å; D385-S388 PolarHBondContact O-N 3.07Å; D385-S388 PolarHBondContact O-OG 2.92Å; R386-S388 VanDerWaalsContact C-N 3.25Å; R386-S388 PolarHBondContact O-N 3.49Å; S388-S391 WeakPolarHBondContact O-CB 3.23Å; S388-S391 PolarHBondContact O-N 3.42Å; S388-E392 WeakPolarHBondContact O-CB 3.42Å; S388-E392 PolarHBondContact O-N 3.13Å
389	L	74.7	Confident	61.7	Low	10 Å²	10	87.3 Å²	87.3	5%	0.052	46%	0.455	C	S	.	.	H	α-helix	trans	-69.3	-37.9	179.7	-58.5	179.8	0	0	0	112.4	I384 R386 S391 E392 Y393 A667 F721	I384-L389 HydrophobicContact CG2-CD1 3.91Å; R386-L389 PolarHBondContact O-N 3.22Å; R386-L389 VanDerWaalsContact O-N 3.16Å; L389-S391 VanDerWaalsContact C-N 3.35Å; L389-E392 PolarHBondContact O-N 2.62Å; L389-Y393 WeakPolarHBondContact O-CB 3.44Å; L389-Y393 PolarHBondContact O-N 3.47Å; L389-A667 HydrophobicContact CB-CB 4.07Å; L389-A667 HydrophobicContact CD1-CB 4.11Å; L389-F721 HydrophobicContact CD2-CD1 4.03Å; L389-F721 HydrophobicContact CD2-CE1 3.94Å
390	V	75.6	Confident	63.1	Low	39 Å²	39	84 Å²	84	24%	0.236	44%	0.436	C	S	.	.	H	α-helix	trans	-68.7	-34.2	173.8	174.4	0	0	0	0	111.4	R386 S394 D638	R386-V390 WeakPolarHBondContact O-CG2 3.47Å; R386-V390 PolarHBondContact O-N 2.88Å; V390-S394 WeakPolarHBondContact O-CB 3.37Å; V390-S394 PolarHBondContact O-N 2.67Å; V390-S394 PolarHBondContact O-OG 3.29Å; V390-D638 HydrophobicContact CG2-CB 4.33Å
391	S	70.3	Confident	64.7	Low	47 Å²	47	83.2 Å²	83.2	33%	0.329	44%	0.441	S	S	.	.	H	α-helix	trans	-65.9	-43.2	170.2	-172.8	0	0	0	0	111.5	H387 S388 L389 S394 K395	H387-S391 VanDerWaalsContact O-CB 3.26Å; H387-S391 WeakPolarHBondContact O-CB 3.48Å; H387-S391 PolarHBondContact O-N 2.67Å; S388-S391 WeakPolarHBondContact O-CB 3.23Å; S388-S391 PolarHBondContact O-N 3.42Å; L389-S391 VanDerWaalsContact C-N 3.35Å; S391-S394 WeakPolarHBondContact O-CB 3.36Å; S391-S394 PolarHBondContact O-N 2.82Å; S391-K395 WeakPolarHBondContact O-CG 3.44Å; S391-K395 PolarHBondContact O-N 2.91Å
392	E	74.7	Confident	66.2	Low	76 Å²	76	84.3 Å²	84.3	36%	0.355	44%	0.438	S	S	.	.	H	α-helix	trans	-69.1	-40.5	-179.4	-166	143.2	-155.6	0	0	112.4	S388 L389 S394 K395 L396 F721	S388-E392 WeakPolarHBondContact O-CB 3.42Å; S388-E392 PolarHBondContact O-N 3.13Å; L389-E392 PolarHBondContact O-N 2.62Å; E392-S394 VanDerWaalsContact C-N 3.31Å; E392-S394 PolarHBondContact O-N 2.91Å; E392-K395 PolarHBondContact O-N 3.33Å; E392-K395 VanDerWaalsContact O-N 3.17Å; E392-L396 HydrophobicContact CG-CD1 4.38Å; E392-L396 WeakPolarHBondContact O-CG 3.42Å; E392-L396 PolarHBondContact O-N 2.94Å; E392-F721 HydrophobicContact CG-CD2 4.37Å; E392-F721 HydrophobicContact CG-CE2 4.02Å; E392-F721 HydrophobicContact CG-CZ 4.2Å; E392-F721 WeakPolarHBondContact OE1-CE2 3.48Å; E392-F721 WeakPolarHBondContact OE1-CZ 3.47Å; E392-F721 WeakPolarHBondContact OE2-CZ 3.24Å
393	Y	75.4	Confident	68	Low	57 Å²	57	78.2 Å²	78.2	22%	0.224	41%	0.412	C	S	.	.	H	α-helix	trans	-55.5	-45.7	166.4	179.4	-100.7	0	0	0	111.8	L389 K395 L396 H397 V637 F723	L389-Y393 WeakPolarHBondContact O-CB 3.44Å; L389-Y393 PolarHBondContact O-N 3.47Å; Y393-K395 VanDerWaalsContact C-N 3.26Å; Y393-K395 PolarHBondContact O-N 3.44Å; Y393-L396 PolarHBondContact O-N 2.87Å; Y393-H397 AromaticContact CD2-CD2 3.39Å; Y393-H397 WeakPolarHBondContact CD2-CD2 3.49Å; Y393-H397 AromaticContact CD2-NE2 3.62Å; Y393-H397 AromaticContact CE2-CD2 3.11Å; Y393-H397 WeakPolarHBondContact CE2-CD2 3.34Å; Y393-H397 AromaticContact CE2-NE2 3.19Å; Y393-H397 WeakPolarHBondContact CE2-NE2 3.49Å; Y393-H397 AromaticContact CG-CD2 3.98Å; Y393-H397 AromaticContact CZ-CD2 3.47Å; Y393-H397 VanDerWaalsContact CZ-CD2 3.47Å; Y393-H397 AromaticContact CZ-NE2 3.89Å; Y393-H397 PolarHBondContact O-CD2 3.16Å; Y393-H397 PolarHBondContact O-N 3.02Å; Y393-H397 VanDerWaalsContact O-N 3.1Å; Y393-V637 HydrophobicContact CD1-CB 4.35Å; Y393-V637 HydrophobicContact CD1-CG1 4.31Å; Y393-V637 HydrophobicContact CD1-CG2 4.15Å; Y393-V637 HydrophobicContact CD2-CG1 4.14Å; Y393-V637 HydrophobicContact CD2-CG2 3.86Å; Y393-V637 HydrophobicContact CE1-CB 4.5Å; Y393-V637 HydrophobicContact CE1-CG2 3.93Å; Y393-V637 HydrophobicContact CE2-CG2 3.61Å; Y393-V637 HydrophobicContact CG-CB 4.37Å; Y393-V637 HydrophobicContact CG-CG1 3.91Å; Y393-V637 HydrophobicContact CG-CG2 4.12Å; Y393-F723 HydrophobicContact CD2-CB 3.99Å; Y393-F723 AromaticContact CD2-CD1 3.59Å; Y393-F723 HydrophobicContact CD2-CD1 3.59Å; Y393-F723 AromaticContact CD2-CD2 3.94Å; Y393-F723 HydrophobicContact CD2-CD2 3.94Å; Y393-F723 HydrophobicContact CD2-CE1 4.02Å; Y393-F723 HydrophobicContact CD2-CE2 4.32Å; Y393-F723 AromaticContact CD2-CG 3.55Å; Y393-F723 HydrophobicContact CD2-CG 3.55Å; Y393-F723 HydrophobicContact CD2-CZ 4.36Å; Y393-F723 HydrophobicContact CE2-CB 4.13Å; Y393-F723 HydrophobicContact CE2-CG 4.16Å; Y393-F723 HydrophobicContact CG-CD1 4.2Å; Y393-F723 HydrophobicContact CG-CE1 4.34Å
394	S	70.6	Confident	69.6	Low	41 Å²	41	77.6 Å²	77.6	29%	0.287	40%	0.4	S	S	.	.	H	α-helix	trans	-63.5	-30.8	178.4	-64.3	0	0	0	0	112.9	V390 S391 E392 K398	V390-S394 WeakPolarHBondContact O-CB 3.37Å; V390-S394 PolarHBondContact O-N 2.67Å; V390-S394 PolarHBondContact O-OG 3.29Å; S391-S394 WeakPolarHBondContact O-CB 3.36Å; S391-S394 PolarHBondContact O-N 2.82Å; E392-S394 VanDerWaalsContact C-N 3.31Å; E392-S394 PolarHBondContact O-N 2.91Å; S394-K398 WeakPolarHBondContact O-CB 3.11Å; S394-K398 WeakPolarHBondContact O-CD 3.43Å; S394-K398 WeakPolarHBondContact O-CG 3.39Å; S394-K398 PolarHBondContact O-N 2.88Å
395	K	72.1	Confident	70.9	Confident	99 Å²	99	77 Å²	77	43%	0.43	40%	0.397	S	S	.	.	H	α-helix	trans	-76	-49.7	174.4	-68	176.1	-176.5	176.8	0	111.3	S391 E392 Y393 H397 K398 E399 S400	S391-K395 WeakPolarHBondContact O-CG 3.44Å; S391-K395 PolarHBondContact O-N 2.91Å; E392-K395 PolarHBondContact O-N 3.33Å; E392-K395 VanDerWaalsContact O-N 3.17Å; Y393-K395 VanDerWaalsContact C-N 3.26Å; Y393-K395 PolarHBondContact O-N 3.44Å; K395-H397 PolarHBondContact O-N 3.15Å; K395-K398 PolarHBondContact O-N 2.93Å; K395-K398 VanDerWaalsContact O-N 3.16Å; K395-E399 HydrophobicContact CB-CG 4.45Å; K395-E399 WeakPolarHBondContact CB-OE2 3.23Å; K395-E399 WeakPolarHBondContact CG-OE2 3.26Å; K395-E399 WeakPolarHBondContact O-CA 3.32Å; K395-E399 WeakPolarHBondContact O-CB 3.38Å; K395-E399 PolarHBondContact O-N 2.78Å; K395-S400 PolarHBondContact O-N 3.38Å
396	L	70.2	Confident	72.4	Confident	38 Å²	38	72.2 Å²	72.2	20%	0.199	37%	0.371	C	S	.	.	H	α-helix	trans	-60.8	-28.6	-178.4	-70.1	171.3	0	0	0	113.4	E392 Y393 S400 F723	E392-L396 HydrophobicContact CG-CD1 4.38Å; E392-L396 WeakPolarHBondContact O-CG 3.42Å; E392-L396 PolarHBondContact O-N 2.94Å; Y393-L396 PolarHBondContact O-N 2.87Å; L396-S400 WeakPolarHBondContact O-CB 3.49Å; L396-F723 HydrophobicContact CD1-CE2 3.78Å; L396-F723 HydrophobicContact CD1-CZ 3.85Å
397	H	67.5	Low	73.6	Confident	76 Å²	76	68.5 Å²	68.5	35%	0.352	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	0.1	176.4	-66.2	-59.5	0	0	0	116.2	Y393 K395	Y393-H397 AromaticContact CD2-CD2 3.39Å; Y393-H397 WeakPolarHBondContact CD2-CD2 3.49Å; Y393-H397 AromaticContact CD2-NE2 3.62Å; Y393-H397 AromaticContact CE2-CD2 3.11Å; Y393-H397 WeakPolarHBondContact CE2-CD2 3.34Å; Y393-H397 AromaticContact CE2-NE2 3.19Å; Y393-H397 WeakPolarHBondContact CE2-NE2 3.49Å; Y393-H397 AromaticContact CG-CD2 3.98Å; Y393-H397 AromaticContact CZ-CD2 3.47Å; Y393-H397 VanDerWaalsContact CZ-CD2 3.47Å; Y393-H397 AromaticContact CZ-NE2 3.89Å; Y393-H397 PolarHBondContact O-CD2 3.16Å; Y393-H397 PolarHBondContact O-N 3.02Å; Y393-H397 VanDerWaalsContact O-N 3.1Å; K395-H397 PolarHBondContact O-N 3.15Å
398	K	64.3	Low	74.9	Confident	172 Å²	172	61.5 Å²	61.5	75%	0.748	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.3	-34.6	175.9	-61.9	176.5	-177.1	174.9	0	113.9	S394 K395	S394-K398 WeakPolarHBondContact O-CB 3.11Å; S394-K398 WeakPolarHBondContact O-CD 3.43Å; S394-K398 WeakPolarHBondContact O-CG 3.39Å; S394-K398 PolarHBondContact O-N 2.88Å; K395-K398 PolarHBondContact O-N 2.93Å; K395-K398 VanDerWaalsContact O-N 3.16Å
399	E	59.9	Low	75.9	Confident	150 Å²	150	59 Å²	59	70%	0.701	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-37.5	-177.8	-56.6	176.5	171.5	0	0	111.1	K395	K395-E399 HydrophobicContact CB-CG 4.45Å; K395-E399 WeakPolarHBondContact CB-OE2 3.23Å; K395-E399 WeakPolarHBondContact CG-OE2 3.26Å; K395-E399 WeakPolarHBondContact O-CA 3.32Å; K395-E399 WeakPolarHBondContact O-CB 3.38Å; K395-E399 PolarHBondContact O-N 2.78Å
400	S	57.6	Low	76.9	Confident	57 Å²	57	58.5 Å²	58.5	40%	0.399	31%	0.305	S	S	.	.	S	Bend	trans	-93.8	141.8	172.3	-63.9	0	0	0	0	111.3	K395 L396 E402	K395-S400 PolarHBondContact O-N 3.38Å; L396-S400 WeakPolarHBondContact O-CB 3.49Å; S400-E402 PolarHBondContact O-N 3.42Å
401	A	64.5	Low	77.8	Confident	110 Å²	110	56.8 Å²	56.8	91%	0.909	30%	0.295	S	S	*	.			trans	-80.7	45	176.8	0	0	0	0	0	112.5	K403	A401-K403 PolarHBondContact O-N 3.05Å
402	E	71.5	Confident	78.9	Confident	92 Å²	92	54.6 Å²	54.6	43%	0.43	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-74.1	120.7	-179.2	-64.3	-152.8	133.4	0	0	111.5	S400 Q404	S400-E402 PolarHBondContact O-N 3.42Å; E402-Q404 PolarHBondContact O-N 3.01Å
403	K	81.6	Confident	79.7	Confident	60 Å²	60	52.6 Å²	52.6	26%	0.261	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-59	132.6	178.6	-70.8	-176.6	-178	178	0	111.3	A401 E479 T480 K481 R484	A401-K403 PolarHBondContact O-N 3.05Å; K403-E479 HydrophobicContact CD-CB 4.46Å; K403-E479 WeakPolarHBondContact CE-OE2 3.43Å; K403-E479 IonicContact NZ-OE2 2.73Å; K403-E479 PolarHBondContact NZ-OE2 3.48Å; K403-T480 PolarHBondContact NZ-O 3.02Å; K403-K481 WeakPolarHBondContact CE-O 3.27Å; K403-R484 HydrophobicContact CB-CG 4.12Å
404	Q	84.3	Confident	80.3	Confident	86 Å²	86	51.4 Å²	51.4	40%	0.402	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	138.2	179.7	-66.7	172.6	-14.7	0	0	111.2	E402 S482 K483 R484	E402-Q404 PolarHBondContact O-N 3.01Å; Q404-S482 PolarHBondContact N-O 3.36Å; Q404-K483 HydrophobicContact CB-CG 3.94Å; Q404-K483 CarbonylContact O-C 3.56Å; Q404-K483 WeakPolarHBondContact O-CA 3.32Å; Q404-K483 VanDerWaalsContact O-CB 3.23Å; Q404-K483 WeakPolarHBondContact O-CB 3.42Å; Q404-K483 WeakPolarHBondContact O-CG 3.5Å; Q404-R484 PolarHBondContact O-N 3.43Å
405	I	87	Confident	81.2	Confident	26 Å²	26	53.6 Å²	53.6	13%	0.133	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	133.6	-179.6	-65.9	160.1	0	0	0	110.1	R484 R635 D726	I405-R484 CarbonylContact C-O 3.59Å; I405-R484 WeakPolarHBondContact CA-O 3.14Å; I405-R484 HydrophobicContact CG1-CB 4Å; I405-R635 VanDerWaalsContact CB-NH2 3.34Å; I405-R635 PolarHBondContact O-NH2 2.97Å; I405-D726 VanDerWaalsContact CD1-OD1 3.25Å; I405-D726 WeakPolarHBondContact CD1-OD1 3.48Å
406	I	91	Very high	82.1	Confident	3 Å²	3	48.9 Å²	48.9	2%	0.015	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	134.5	171.2	-62.4	-172.6	0	0	0	109.5	K483 R484 V485 A486 A509 I630	I406-K483 HydrophobicContact CD1-CD 3.8Å; I406-K483 HydrophobicContact CD1-CG 4.33Å; I406-R484 PolarHBondContact N-O 3.33Å; I406-V485 WeakPolarHBondContact O-CA 3.32Å; I406-A486 PolarHBondContact O-N 3.02Å; I406-A509 HydrophobicContact CG2-CB 4.47Å; I406-I630 HydrophobicContact CD1-CB 4.09Å; I406-I630 HydrophobicContact CD1-CG2 4.11Å; I406-I630 WeakPolarHBondContact CD1-O 3.34Å
407	N	92.5	Very high	83.1	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	118.2	174	-57.2	-87.4	0	0	0	109.6	M488 Q506 D508 A509 R662 G725 Q727	N407-M488 HydrophobicContact CB-CE 3.99Å; N407-Q506 WeakPolarHBondContact CB-O 3.17Å; N407-D508 WeakPolarHBondContact CB-OD2 3.49Å; N407-D508 PolarHBondContact N-OD2 3.28Å; N407-D508 VanDerWaalsContact N-OD2 3.16Å; N407-D508 PolarHBondContact ND2-OD2 2.92Å; N407-D508 PolarHBondContact O-N 3.17Å; N407-A509 PolarHBondContact O-N 2.87Å; N407-A509 VanDerWaalsContact O-N 3.17Å; N407-R662 PolarHBondContact ND2-NH2 2.74Å; N407-G725 PolarHBondContact ND2-O 3.03Å; N407-Q727 WeakPolarHBondContact OD1-CG 3.32Å; N407-Q727 PolarHBondContact OD1-NE2 2.83Å
408	L	93.8	Very high	84.3	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	120	-175.1	-179.9	65.2	0	0	0	110.5	V485 A486 L487 M488 A509 L511 I627	L408-V485 HydrophobicContact CB-CG1 3.76Å; L408-V485 HydrophobicContact CD2-CG1 3.99Å; L408-A486 PolarHBondContact N-O 2.79Å; L408-L487 HydrophobicContact CD2-CD1 4.08Å; L408-L487 HydrophobicContact CG-CD1 4.28Å; L408-L487 WeakPolarHBondContact O-CA 3.43Å; L408-M488 PolarHBondContact O-N 2.81Å; L408-A509 WeakPolarHBondContact CA-O 3.48Å; L408-A509 HydrophobicContact CD1-CB 4.07Å; L408-L511 HydrophobicContact CD1-CB 4.24Å; L408-I627 HydrophobicContact CD2-CD1 3.84Å; L408-I627 HydrophobicContact CD2-CG1 4Å; L408-I627 HydrophobicContact CD2-CG2 4.13Å
409	I	95	Very high	85.8	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	140.3	171.9	-174.6	163.2	0	0	0	111.8	M411 M488 A490 G503 A504 A507 A509 A510 L511	I409-M411 HydrophobicContact CD1-CE 3.85Å; I409-M411 HydrophobicContact CG1-CE 4.25Å; I409-M411 HydrophobicContact CG1-CG 4.27Å; I409-M411 HydrophobicContact CG2-CE 3.87Å; I409-M488 CarbonylContact C-O 3.6Å; I409-M488 WeakPolarHBondContact CA-O 3.44Å; I409-M488 HydrophobicContact CB-CB 4.36Å; I409-M488 HydrophobicContact CB-CE 4.48Å; I409-M488 HydrophobicContact CG1-CB 4.34Å; I409-A490 HydrophobicContact CD1-CB 3.93Å; I409-A490 HydrophobicContact CG1-CB 4Å; I409-G503 VanDerWaalsContact CD1-C 3.49Å; I409-A504 HydrophobicContact CD1-CB 4.08Å; I409-A507 HydrophobicContact CB-CB 3.78Å; I409-A507 HydrophobicContact CG2-CB 3.42Å; I409-A507 VanDerWaalsContact CG2-CB 3.42Å; I409-A509 PolarHBondContact N-O 3.39Å; I409-A510 HydrophobicContact CG2-CB 3.68Å; I409-A510 CarbonylContact O-C 3.58Å; I409-A510 VanDerWaalsContact O-CA 3.27Å; I409-A510 WeakPolarHBondContact O-CA 3.36Å; I409-L511 PolarHBondContact O-N 3.39Å
410	V	95.5	Very high	87.3	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	130	175.5	-170.2	0	0	0	0	109.4	K418 M422 L487 M488 A490 L511 V513	V410-K418 HydrophobicContact CG1-CB 3.95Å; V410-K418 HydrophobicContact CG1-CG 4.29Å; V410-M422 HydrophobicContact CG1-CG 4.3Å; V410-M422 HydrophobicContact CG2-CG 3.79Å; V410-M422 HydrophobicContact CG2-SD 3.69Å; V410-L487 HydrophobicContact CG2-CD1 3.6Å; V410-L487 HydrophobicContact CG2-CG 4.46Å; V410-M488 PolarHBondContact N-O 2.93Å; V410-A490 WeakPolarHBondContact O-CB 3.07Å; V410-A490 PolarHBondContact O-N 2.58Å; V410-L511 WeakPolarHBondContact CA-O 3.33Å; V410-L511 HydrophobicContact CG1-CD2 4.44Å; V410-L511 HydrophobicContact CG2-CB 4.49Å; V410-L511 HydrophobicContact CG2-CD2 4.42Å; V410-V513 HydrophobicContact CG1-CG2 3.62Å
411	M	94.5	Very high	89.1	Confident	3 Å²	3	28.4 Å²	28.4	2%	0.015	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	154.9	-175.6	-68.9	-173.5	177.4	0	0	111	I409 V500 A504 L511 L512 V513 H534 A538	I409-M411 HydrophobicContact CD1-CE 3.85Å; I409-M411 HydrophobicContact CG1-CE 4.25Å; I409-M411 HydrophobicContact CG1-CG 4.27Å; I409-M411 HydrophobicContact CG2-CE 3.87Å; M411-V500 HydrophobicContact CE-CG1 3.92Å; M411-V500 HydrophobicContact CG-CG1 4.47Å; M411-A504 HydrophobicContact CE-CB 3.52Å; M411-L511 PolarHBondContact N-O 3.41Å; M411-L512 HydrophobicContact CB-CD1 4.1Å; M411-L512 CarbonylContact O-C 3.6Å; M411-L512 WeakPolarHBondContact O-CA 3.21Å; M411-V513 PolarHBondContact O-N 2.84Å; M411-H534 HydrophobicContact CB-CB 4.11Å; M411-H534 HydrophobicContact CG-CB 4.47Å; M411-H534 HydrophobicContact SD-CB 4Å; M411-A538 HydrophobicContact CE-CB 4.22Å; M411-A538 HydrophobicContact SD-CB 4.03Å
412	G	92.9	Very high	90.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.8	-173.2	175.8	0	0	0	0	0	112.3	V513 H534	G412-V513 WeakPolarHBondContact CA-O 3.36Å; G412-H534 PolarHBondContact O-CE1 3.43Å; G412-H534 VanDerWaalsContact O-CE1 3.22Å; G412-H534 PolarHBondContact O-ND1 3.4Å
413	H	92	Very high	91.4	Very high	34 Å²	34	18.8 Å²	18.8	16%	0.157	10%	0.1	C	C	.	.			trans	-63.3	170.8	170.3	-162.2	23.4	0	0	0	111.1	A416 K418 Q530	H413-A416 HydrophobicContact CB-CB 4.12Å; H413-K418 PolarHBondContact O-NZ 3.44Å; H413-Q530 PolarHBondContact ND1-OE1 2.94Å
414	V	88.8	Confident	92	Very high	33 Å²	33	16.2 Å²	16.2	20%	0.2	9%	0.089	C	C	.	.	S	Bend	trans	-56.2	-63.2	170.9	175.4	0	0	0	0	109.5	A416 K418 V469 H493	V414-A416 PolarHBondContact O-N 3.31Å; V414-A416 VanDerWaalsContact O-N 3.12Å; V414-K418 PolarHBondContact O-NZ 3.39Å; V414-V469 HydrophobicContact CG1-CG2 4.44Å; V414-H493 HydrophobicContact CG2-CB 4.49Å
415	D	88.2	Confident	92.3	Very high	87 Å²	87	12.2 Å²	12.2	47%	0.465	7%	0.07	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	8	-172	-53.2	-75.4	0	0	0	114.8	G417 N515 K552	D415-G417 PolarHBondContact O-N 2.89Å; D415-N515 PolarHBondContact O-ND2 3.4Å; D415-K552 WeakPolarHBondContact O-CE 3.46Å; D415-K552 PolarHBondContact O-NZ 3.35Å
416	A	91.9	Very high	92.5	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-8.2	173.3	0	0	0	0	0	113.5	H413 V414 V513 N551	H413-A416 HydrophobicContact CB-CB 4.12Å; V414-A416 PolarHBondContact O-N 3.31Å; V414-A416 VanDerWaalsContact O-N 3.12Å; A416-V513 HydrophobicContact CB-CB 4.41Å; A416-V513 HydrophobicContact CB-CG1 4.19Å; A416-V513 VanDerWaalsContact O-CG1 3.22Å; A416-V513 WeakPolarHBondContact O-CG1 3.41Å; A416-N551 PolarHBondContact O-ND2 3.17Å
417	G	91.4	Very high	92.5	Very high	17 Å²	17	12.3 Å²	12.3	18%	0.175	7%	0.073	C	C	.	.			trans	73	30.9	173.6	0	0	0	0	0	114.9	D415 T420 L421	D415-G417 PolarHBondContact O-N 2.89Å; G417-T420 PolarHBondContact O-N 3.25Å; G417-L421 WeakPolarHBondContact O-CB 3.34Å; G417-L421 PolarHBondContact O-N 2.86Å
418	K	93.4	Very high	92.3	Very high	8 Å²	8	15.9 Å²	15.9	4%	0.035	9%	0.092	C	C	.	.	H	α-helix	trans	-48.5	-61.5	-178.5	-57.6	176.8	-57.3	-57.4	0	112.6	V410 H413 V414 T420 L421 M422 A490 V513	V410-K418 HydrophobicContact CG1-CB 3.95Å; V410-K418 HydrophobicContact CG1-CG 4.29Å; H413-K418 PolarHBondContact O-NZ 3.44Å; V414-K418 PolarHBondContact O-NZ 3.39Å; K418-T420 VanDerWaalsContact C-N 3.34Å; K418-T420 PolarHBondContact O-N 3.46Å; K418-L421 WeakPolarHBondContact O-CB 3.5Å; K418-L421 PolarHBondContact O-N 3.41Å; K418-M422 WeakPolarHBondContact O-CG 3.45Å; K418-M422 PolarHBondContact O-N 2.88Å; K418-A490 WeakPolarHBondContact CE-O 3.33Å; K418-V513 HydrophobicContact CG-CB 4.21Å; K418-V513 HydrophobicContact CG-CG2 4.31Å
419	S	93.7	Very high	92	Very high	10 Å²	10	18.1 Å²	18.1	7%	0.07	10%	0.103	C	C	.	.	H	α-helix	trans	-66.1	-35.3	-176.1	-37.4	0	0	0	0	112.1	G423 T470 D489	S419-G423 PolarHBondContact O-N 2.82Å; S419-T470 PolarHBondContact OG-OG1 3.44Å; S419-T470 VanDerWaalsContact OG-OG1 3.05Å; S419-D489 VanDerWaalsContact CA-OD2 3.23Å; S419-D489 WeakPolarHBondContact CA-OD2 3.47Å; S419-D489 WeakPolarHBondContact CB-OD2 3.45Å; S419-D489 PolarHBondContact OG-OD2 2.85Å
420	T	93.4	Very high	91.5	Very high	27 Å²	27	20.9 Å²	20.9	17%	0.166	13%	0.132	C	C	.	.	H	α-helix	trans	-64	-47	172.9	-45.8	0	0	0	0	111.7	G417 K418 M422 N424 Y454	G417-T420 PolarHBondContact O-N 3.25Å; K418-T420 VanDerWaalsContact C-N 3.34Å; K418-T420 PolarHBondContact O-N 3.46Å; T420-M422 VanDerWaalsContact C-N 3.34Å; T420-M422 PolarHBondContact O-N 3.48Å; T420-N424 WeakPolarHBondContact O-CB 3.38Å; T420-N424 PolarHBondContact O-N 2.9Å; T420-Y454 HydrophobicContact CG2-CD2 4.08Å
421	L	94.1	Very high	90.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.1	-42.4	178	-177.2	69.8	0	0	0	111.3	G417 K418 L425 V513 A549 V587 L595 L623	G417-L421 WeakPolarHBondContact O-CB 3.34Å; G417-L421 PolarHBondContact O-N 2.86Å; K418-L421 WeakPolarHBondContact O-CB 3.5Å; K418-L421 PolarHBondContact O-N 3.41Å; L421-L425 WeakPolarHBondContact O-CB 3.41Å; L421-L425 PolarHBondContact O-N 2.96Å; L421-L425 VanDerWaalsContact O-N 3.08Å; L421-V513 HydrophobicContact CD2-CG1 3.98Å; L421-V513 HydrophobicContact CD2-CG2 3.88Å; L421-A549 HydrophobicContact CD2-CB 4.33Å; L421-V587 HydrophobicContact CD1-CB 4.24Å; L421-V587 HydrophobicContact CD1-CG2 3.79Å; L421-V587 HydrophobicContact CD2-CG2 4.29Å; L421-L595 HydrophobicContact CD1-CD1 4.34Å; L421-L595 HydrophobicContact CD1-CD2 3.39Å; L421-L623 HydrophobicContact CD2-CD2 4.36Å; L421-L623 HydrophobicContact CG-CD2 4.47Å
422	M	93.1	Very high	90.4	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-74.9	-42.1	179.4	-66.7	-57.9	96.6	0	0	113.2	V410 K418 T420 N424 L425 L426 L458 L487 L511 L623	V410-M422 HydrophobicContact CG1-CG 4.3Å; V410-M422 HydrophobicContact CG2-CG 3.79Å; V410-M422 HydrophobicContact CG2-SD 3.69Å; K418-M422 WeakPolarHBondContact O-CG 3.45Å; K418-M422 PolarHBondContact O-N 2.88Å; T420-M422 VanDerWaalsContact C-N 3.34Å; T420-M422 PolarHBondContact O-N 3.48Å; M422-N424 VanDerWaalsContact C-N 3.32Å; M422-N424 PolarHBondContact O-N 2.85Å; M422-L425 HydrophobicContact CE-CD2 4.23Å; M422-L425 WeakPolarHBondContact O-CB 3.36Å; M422-L425 PolarHBondContact O-N 3.06Å; M422-L425 HydrophobicContact SD-CD2 4.4Å; M422-L426 WeakPolarHBondContact O-CG 3Å; M422-L426 PolarHBondContact O-N 3.04Å; M422-L458 HydrophobicContact CB-CD1 3.64Å; M422-L487 HydrophobicContact CB-CD2 4.07Å; M422-L487 HydrophobicContact CG-CD2 4.04Å; M422-L487 HydrophobicContact SD-CD1 3.78Å; M422-L487 HydrophobicContact SD-CD2 3.75Å; M422-L487 HydrophobicContact SD-CG 4.37Å; M422-L511 HydrophobicContact CE-CD2 3.55Å; M422-L511 HydrophobicContact SD-CD2 4.22Å; M422-L623 HydrophobicContact CE-CD2 4.29Å
423	G	92.3	Very high	90.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.9	-42	174.4	0	0	0	0	0	112.2	S419 L426 C427 Y454 I457	S419-G423 PolarHBondContact O-N 2.82Å; G423-L426 PolarHBondContact O-N 3.4Å; G423-C427 PolarHBondContact O-N 3.38Å; G423-C427 PolarHBondContact O-SG 3.35Å; G423-Y454 WeakPolarHBondContact CA-O 3.33Å; G423-I457 WeakPolarHBondContact O-CD1 3.4Å
424	N	92.5	Very high	90	Very high	7 Å²	7	30.9 Å²	30.9	4%	0.037	20%	0.196	C	C	.	.	H	α-helix	trans	-66.3	-41.6	174.3	-164	-8.6	0	0	0	111.7	T420 M422 L426 C427 L428 Y454 G589 G592 L595	T420-N424 WeakPolarHBondContact O-CB 3.38Å; T420-N424 PolarHBondContact O-N 2.9Å; M422-N424 VanDerWaalsContact C-N 3.32Å; M422-N424 PolarHBondContact O-N 2.85Å; N424-L426 VanDerWaalsContact C-N 3.34Å; N424-L426 PolarHBondContact O-N 2.82Å; N424-C427 WeakPolarHBondContact O-CB 3.34Å; N424-C427 PolarHBondContact O-N 3.32Å; N424-C427 VanDerWaalsContact O-N 3.15Å; N424-L428 WeakPolarHBondContact O-CG 3.24Å; N424-L428 PolarHBondContact O-N 3.34Å; N424-Y454 HydrophobicContact CB-CD1 4.06Å; N424-Y454 HydrophobicContact CB-CD2 4.39Å; N424-Y454 HydrophobicContact CB-CE1 4.24Å; N424-Y454 HydrophobicContact CB-CG 4.15Å; N424-G589 WeakPolarHBondContact CB-O 3.45Å; N424-G589 PolarHBondContact ND2-O 3.3Å; N424-G592 WeakPolarHBondContact ND2-CA 3.43Å; N424-G592 PolarHBondContact ND2-N 2.85Å; N424-L595 HydrophobicContact CB-CD1 4.18Å
425	L	91.8	Very high	90.1	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-57.6	-43.8	173.1	-177.9	64.1	0	0	0	112.1	L421 M422 C427 L428 L429 F478 L595 V596	L421-L425 WeakPolarHBondContact O-CB 3.41Å; L421-L425 PolarHBondContact O-N 2.96Å; L421-L425 VanDerWaalsContact O-N 3.08Å; M422-L425 HydrophobicContact CE-CD2 4.23Å; M422-L425 WeakPolarHBondContact O-CB 3.36Å; M422-L425 PolarHBondContact O-N 3.06Å; M422-L425 HydrophobicContact SD-CD2 4.4Å; L425-C427 PolarHBondContact O-N 2.73Å; L425-L428 PolarHBondContact O-N 3.22Å; L425-L429 HydrophobicContact CD1-CD1 4.25Å; L425-L429 HydrophobicContact CD1-CG 4.41Å; L425-L429 HydrophobicContact CG-CD1 4.08Å; L425-L429 WeakPolarHBondContact O-CB 3.37Å; L425-L429 VanDerWaalsContact O-CG 3.29Å; L425-L429 WeakPolarHBondContact O-CG 3.45Å; L425-L429 PolarHBondContact O-N 3.3Å; L425-F478 HydrophobicContact CD2-CZ 4.3Å; L425-L595 HydrophobicContact CD1-CB 4.28Å; L425-V596 HydrophobicContact CD1-CG2 3.84Å
426	L	91	Very high	90.2	Very high	7 Å²	7	36.8 Å²	36.8	4%	0.037	22%	0.216	C	C	.	.	H	α-helix	trans	-66.5	-33.3	176.2	-69.3	173.5	0	0	0	113	M422 G423 N424 G430 H431 V432 I457 L458 T476 F478	M422-L426 WeakPolarHBondContact O-CG 3Å; M422-L426 PolarHBondContact O-N 3.04Å; G423-L426 PolarHBondContact O-N 3.4Å; N424-L426 VanDerWaalsContact C-N 3.34Å; N424-L426 PolarHBondContact O-N 2.82Å; L426-G430 PolarHBondContact O-N 2.91Å; L426-H431 HydrophobicContact CD2-CB 4.35Å; L426-H431 PolarHBondContact O-N 2.96Å; L426-V432 HydrophobicContact CB-CG2 4.31Å; L426-I457 HydrophobicContact CD1-CG2 4.24Å; L426-L458 HydrophobicContact CD1-CD2 3.93Å; L426-T476 HydrophobicContact CD1-CG2 4.39Å; L426-F478 HydrophobicContact CD2-CB 4.18Å; L426-F478 HydrophobicContact CD2-CD1 4.19Å
427	C	90.4	Very high	90	Very high	25 Å²	25	38 Å²	38	17%	0.169	22%	0.222	C	C	.	.	H	α-helix	trans	-66.6	-46.3	170.3	-75.9	0	0	0	0	112.4	G423 N424 L425 L429 G430 I457	G423-C427 PolarHBondContact O-N 3.38Å; G423-C427 PolarHBondContact O-SG 3.35Å; N424-C427 WeakPolarHBondContact O-CB 3.34Å; N424-C427 PolarHBondContact O-N 3.32Å; N424-C427 VanDerWaalsContact O-N 3.15Å; L425-C427 PolarHBondContact O-N 2.73Å; C427-L429 VanDerWaalsContact C-N 3.3Å; C427-L429 PolarHBondContact O-N 3.3Å; C427-G430 PolarHBondContact O-N 3.35Å; C427-I457 WeakPolarHBondContact SG-CD1 3.13Å
428	L	88.8	Confident	90	Very high	75 Å²	75	39.5 Å²	39.5	39%	0.393	23%	0.233	S	C	.	.	H	α-helix	trans	-67.1	-30.3	180	-68.3	173.6	0	0	0	112.9	N424 L425 G430 L595 V596	N424-L428 WeakPolarHBondContact O-CG 3.24Å; N424-L428 PolarHBondContact O-N 3.34Å; L425-L428 PolarHBondContact O-N 3.22Å; L428-G430 VanDerWaalsContact C-N 3.25Å; L428-G430 PolarHBondContact O-N 3.33Å; L428-L595 HydrophobicContact CD1-CB 3.91Å; L428-L595 HydrophobicContact CD1-CD1 3.91Å; L428-L595 HydrophobicContact CD1-CG 4.34Å; L428-V596 HydrophobicContact CB-CG2 3.77Å; L428-V596 HydrophobicContact CD1-CG2 4.13Å
429	L	87.1	Confident	90	Very high	46 Å²	46	45.1 Å²	45.1	24%	0.241	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-5.9	171.3	-68.9	172.4	0	0	0	113.5	L425 C427 H431 F478 L624	L425-L429 HydrophobicContact CD1-CD1 4.25Å; L425-L429 HydrophobicContact CD1-CG 4.41Å; L425-L429 HydrophobicContact CG-CD1 4.08Å; L425-L429 WeakPolarHBondContact O-CB 3.37Å; L425-L429 VanDerWaalsContact O-CG 3.29Å; L425-L429 WeakPolarHBondContact O-CG 3.45Å; L425-L429 PolarHBondContact O-N 3.3Å; C427-L429 VanDerWaalsContact C-N 3.3Å; C427-L429 PolarHBondContact O-N 3.3Å; L429-H431 VanDerWaalsContact C-N 3.31Å; L429-H431 PolarHBondContact O-N 2.93Å; L429-F478 HydrophobicContact CD1-CB 3.97Å; L429-F478 HydrophobicContact CD1-CD2 3.58Å; L429-F478 HydrophobicContact CD1-CE2 4.16Å; L429-F478 HydrophobicContact CD1-CG 3.83Å; L429-L624 HydrophobicContact CD1-CD1 4.28Å; L429-L624 HydrophobicContact CD2-CD1 4.09Å; L429-L624 HydrophobicContact CD2-CD2 3.8Å
430	G	84.7	Confident	89.9	Confident	58 Å²	58	47.5 Å²	47.5	60%	0.598	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	9.5	178.8	0	0	0	0	0	115.5	L426 C427 L428 V432	L426-G430 PolarHBondContact O-N 2.91Å; C427-G430 PolarHBondContact O-N 3.35Å; L428-G430 VanDerWaalsContact C-N 3.25Å; L428-G430 PolarHBondContact O-N 3.33Å; G430-V432 PolarHBondContact O-N 3.14Å
431	H	82.5	Confident	89.7	Confident	79 Å²	79	49.7 Å²	49.7	37%	0.366	27%	0.274	S	S	.	.	S	Bend	trans	-69	-21.4	176.4	-78.8	-77.2	0	0	0	113	L426 L429 F478	L426-H431 HydrophobicContact CD2-CB 4.35Å; L426-H431 PolarHBondContact O-N 2.96Å; L429-H431 VanDerWaalsContact C-N 3.31Å; L429-H431 PolarHBondContact O-N 2.93Å; H431-F478 WeakPolarHBondContact NE2-CA 3.25Å; H431-F478 VanDerWaalsContact NE2-CB 3.35Å; H431-F478 WeakPolarHBondContact NE2-CB 3.39Å
432	V	85	Confident	89.6	Confident	23 Å²	23	56.8 Å²	56.8	14%	0.139	30%	0.3	C	S	.	.	S	Bend	trans	-113.8	126.8	175.1	-178.5	0	0	0	0	109.2	L426 G430 Q436 I457	L426-V432 HydrophobicContact CB-CG2 4.31Å; G430-V432 PolarHBondContact O-N 3.14Å; V432-Q436 HydrophobicContact CG1-CB 4.04Å; V432-I457 HydrophobicContact CG1-CD1 4.4Å; V432-I457 HydrophobicContact CG1-CG1 4.47Å; V432-I457 HydrophobicContact CG2-CD1 4.24Å; V432-I457 HydrophobicContact CG2-CG1 4.44Å; V432-I457 HydrophobicContact CG2-CG2 3.64Å
433	S	89	Confident	89.5	Confident	46 Å²	46	58.5 Å²	58.5	32%	0.322	31%	0.31	S	S	.	.			trans	-70.8	146	177.6	72.8	0	0	0	0	111.6	K435 Q436 L437	S433-K435 PolarHBondContact O-N 2.74Å; S433-K435 VanDerWaalsContact O-N 3.11Å; S433-Q436 WeakPolarHBondContact O-CB 3.42Å; S433-Q436 PolarHBondContact O-N 2.93Å; S433-Q436 VanDerWaalsContact OG-CD 3.24Å; S433-Q436 WeakPolarHBondContact OG-CG 3.41Å; S433-Q436 PolarHBondContact OG-N 3.41Å; S433-Q436 PolarHBondContact OG-OE1 2.95Å; S433-L437 PolarHBondContact O-N 3.4Å
434	S	86.8	Confident	89.4	Confident	99 Å²	99	58.5 Å²	58.5	69%	0.692	31%	0.31	S	S	*	.	H	α-helix	trans	-57.1	-27.8	176.1	55	0	0	0	0	113.3	A438	S434-A438 VanDerWaalsContact O-CB 3.32Å; S434-A438 WeakPolarHBondContact O-CB 3.25Å; S434-A438 PolarHBondContact O-N 3.44Å
435	K	91.2	Very high	89.4	Confident	180 Å²	180	63.6 Å²	63.6	78%	0.783	33%	0.333	S	S	*	.	H	α-helix	trans	-67.5	-40.2	173.1	-65	-179.7	-179.1	175.9	0	112.6	S433 K439	S433-K435 PolarHBondContact O-N 2.74Å; S433-K435 VanDerWaalsContact O-N 3.11Å; K435-K439 PolarHBondContact O-N 3.41Å; K435-K439 VanDerWaalsContact O-N 3.12Å
436	Q	89.1	Confident	89.3	Confident	64 Å²	64	69 Å²	69	30%	0.299	36%	0.357	S	S	.	.	H	α-helix	trans	-68.5	-44.6	174.9	-75.6	153.7	-36.7	0	0	110.7	V432 S433 A438 K439 Y440 L710	V432-Q436 HydrophobicContact CG1-CB 4.04Å; S433-Q436 WeakPolarHBondContact O-CB 3.42Å; S433-Q436 PolarHBondContact O-N 2.93Å; S433-Q436 VanDerWaalsContact OG-CD 3.24Å; S433-Q436 WeakPolarHBondContact OG-CG 3.41Å; S433-Q436 PolarHBondContact OG-N 3.41Å; S433-Q436 PolarHBondContact OG-OE1 2.95Å; Q436-A438 PolarHBondContact O-N 3.25Å; Q436-K439 WeakPolarHBondContact O-CB 3.19Å; Q436-K439 PolarHBondContact O-N 2.85Å; Q436-K439 VanDerWaalsContact O-N 3.16Å; Q436-Y440 HydrophobicContact CB-CE2 4.19Å; Q436-Y440 VanDerWaalsContact O-CD2 3.23Å; Q436-Y440 WeakPolarHBondContact O-CD2 3.44Å; Q436-Y440 PolarHBondContact O-N 3.33Å; Q436-L710 PolarHBondContact NE2-O 3.08Å
437	L	89.3	Confident	89.2	Confident	25 Å²	25	73 Å²	73	13%	0.131	38%	0.377	C	S	.	.	H	α-helix	trans	-58.7	-46.4	175.3	-179	63.6	0	0	0	112	S433 K439 Y440 Q441 Y454 I457	S433-L437 PolarHBondContact O-N 3.4Å; L437-K439 VanDerWaalsContact C-N 3.29Å; L437-K439 PolarHBondContact O-N 3.15Å; L437-Y440 PolarHBondContact O-N 3.45Å; L437-Q441 WeakPolarHBondContact O-CG 3.45Å; L437-Q441 PolarHBondContact O-N 2.86Å; L437-Y454 HydrophobicContact CD1-CD1 3.95Å; L437-Y454 HydrophobicContact CD1-CE1 4.03Å; L437-Y454 HydrophobicContact CD2-CE1 4.07Å; L437-I457 HydrophobicContact CD1-CD1 4.38Å
438	A	91.3	Very high	89.1	Confident	50 Å²	50	75.1 Å²	75.1	41%	0.413	40%	0.404	S	S	.	.	H	α-helix	trans	-62	-35.1	176.7	0	0	0	0	0	112.7	S434 Q436 W442	S434-A438 VanDerWaalsContact O-CB 3.32Å; S434-A438 WeakPolarHBondContact O-CB 3.25Å; S434-A438 PolarHBondContact O-N 3.44Å; Q436-A438 PolarHBondContact O-N 3.25Å; A438-W442 PolarHBondContact O-N 3.1Å; A438-W442 VanDerWaalsContact O-N 3.11Å
439	K	92.2	Very high	89	Confident	126 Å²	126	73.7 Å²	73.7	55%	0.548	40%	0.395	S	S	.	.	H	α-helix	trans	-64.5	-48.6	171.7	-175.6	-173.2	172.5	-172.4	0	111.2	K435 Q436 L437 Q441 W442 D443	K435-K439 PolarHBondContact O-N 3.41Å; K435-K439 VanDerWaalsContact O-N 3.12Å; Q436-K439 WeakPolarHBondContact O-CB 3.19Å; Q436-K439 PolarHBondContact O-N 2.85Å; Q436-K439 VanDerWaalsContact O-N 3.16Å; L437-K439 VanDerWaalsContact C-N 3.29Å; L437-K439 PolarHBondContact O-N 3.15Å; K439-Q441 VanDerWaalsContact C-N 3.31Å; K439-Q441 PolarHBondContact O-N 3.39Å; K439-W442 PolarHBondContact O-N 2.9Å; K439-W442 VanDerWaalsContact O-N 3.16Å; K439-D443 WeakPolarHBondContact CE-OD2 3.44Å; K439-D443 WeakPolarHBondContact CG-OD2 3.35Å; K439-D443 PolarHBondContact O-N 3.12Å
440	Y	91.7	Very high	88.7	Confident	60 Å²	60	74 Å²	74	24%	0.235	40%	0.404	C	S	.	.	H	α-helix	trans	-62.8	-37	178.5	-61.4	-44.6	0	0	0	112.2	Q436 L437 A444 W456 I457	Q436-Y440 HydrophobicContact CB-CE2 4.19Å; Q436-Y440 VanDerWaalsContact O-CD2 3.23Å; Q436-Y440 WeakPolarHBondContact O-CD2 3.44Å; Q436-Y440 PolarHBondContact O-N 3.33Å; L437-Y440 PolarHBondContact O-N 3.45Å; Y440-A444 WeakPolarHBondContact O-CB 3.29Å; Y440-A444 PolarHBondContact O-N 2.89Å; Y440-W456 HydrophobicContact CG-CB 4.42Å; Y440-I457 HydrophobicContact CD2-CG1 4.12Å; Y440-I457 HydrophobicContact CE2-CG1 4.26Å
441	Q	90.7	Very high	88.6	Confident	73 Å²	73	75 Å²	75	34%	0.341	40%	0.401	S	S	.	.	H	α-helix	trans	-58.9	-45.9	171.7	-73.5	171.2	-12.3	0	0	111.9	L437 K439 Q445 A453	L437-Q441 WeakPolarHBondContact O-CG 3.45Å; L437-Q441 PolarHBondContact O-N 2.86Å; K439-Q441 VanDerWaalsContact C-N 3.31Å; K439-Q441 PolarHBondContact O-N 3.39Å; Q441-Q445 WeakPolarHBondContact O-CB 3.34Å; Q441-Q445 WeakPolarHBondContact O-CG 3.36Å; Q441-Q445 PolarHBondContact O-N 3.29Å; Q441-A453 HydrophobicContact CB-CB 4.24Å; Q441-A453 HydrophobicContact CG-CB 3.48Å; Q441-A453 VanDerWaalsContact CG-CB 3.48Å
442	W	91.8	Very high	88.7	Confident	148 Å²	148	74.8 Å²	74.8	56%	0.561	40%	0.4	S	S	*	.	H	α-helix	trans	-68.8	-44.3	178.8	-178.6	63.5	0	0	0	113.2	A438 K439 A444 Q445 K446	A438-W442 PolarHBondContact O-N 3.1Å; A438-W442 VanDerWaalsContact O-N 3.11Å; K439-W442 PolarHBondContact O-N 2.9Å; K439-W442 VanDerWaalsContact O-N 3.16Å; W442-A444 VanDerWaalsContact C-N 3.34Å; W442-Q445 PolarHBondContact O-N 2.93Å; W442-K446 VanDerWaalsContact CE2-CE 3.45Å; W442-K446 VanDerWaalsContact CE3-NZ 3.3Å; W442-K446 PolarHBondContact O-N 3.28Å
443	D	90.9	Very high	88.8	Confident	36 Å²	36	73.9 Å²	73.9	19%	0.193	40%	0.395	C	S	.	.	H	α-helix	trans	-68.7	-33.1	178	-71.4	-35.5	0	0	0	111.6	K439 K446 W456	K439-D443 WeakPolarHBondContact CE-OD2 3.44Å; K439-D443 WeakPolarHBondContact CG-OD2 3.35Å; K439-D443 PolarHBondContact O-N 3.12Å; D443-K446 PolarHBondContact O-N 3.31Å; D443-K446 IonicContact OD1-NZ 3.19Å; D443-K446 PolarHBondContact OD1-NZ 2.67Å; D443-W456 HydrophobicContact CB-CH2 4.39Å; D443-W456 HydrophobicContact CB-CZ3 3.69Å; D443-W456 WeakPolarHBondContact O-CH2 3.47Å
444	A	90.4	Very high	89	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-70.8	-36.6	172.4	0	0	0	0	0	112.8	Y440 W442 K446 L447 G448 K449 W456	Y440-A444 WeakPolarHBondContact O-CB 3.29Å; Y440-A444 PolarHBondContact O-N 2.89Å; W442-A444 VanDerWaalsContact C-N 3.34Å; A444-K446 VanDerWaalsContact C-N 3.33Å; A444-K446 PolarHBondContact O-N 3.11Å; A444-L447 PolarHBondContact O-N 3.15Å; A444-G448 PolarHBondContact O-N 3.02Å; A444-K449 CarbonylContact O-C 3.49Å; A444-K449 WeakPolarHBondContact O-CA 3.38Å; A444-K449 PolarHBondContact O-N 2.92Å; A444-W456 HydrophobicContact CB-CD2 4.03Å; A444-W456 HydrophobicContact CB-CE3 4.29Å; A444-W456 HydrophobicContact CB-CH2 4.07Å; A444-W456 HydrophobicContact CB-CZ2 3.79Å; A444-W456 HydrophobicContact CB-CZ3 4.31Å
445	Q	91.5	Very high	89.2	Confident	114 Å²	114	69.6 Å²	69.6	53%	0.533	36%	0.358	S	S	.	.	H	α-helix	trans	-59.4	-40.6	172.6	-79.8	164.8	5.7	0	0	112.1	Q441 W442 L447 G448 A450	Q441-Q445 WeakPolarHBondContact O-CB 3.34Å; Q441-Q445 WeakPolarHBondContact O-CG 3.36Å; Q441-Q445 PolarHBondContact O-N 3.29Å; W442-Q445 PolarHBondContact O-N 2.93Å; Q445-L447 VanDerWaalsContact C-N 3.3Å; Q445-L447 PolarHBondContact O-N 3.47Å; Q445-G448 PolarHBondContact O-N 3.21Å; Q445-A450 HydrophobicContact CG-CB 3.61Å
446	K	90.8	Very high	89.2	Confident	116 Å²	116	61.5 Å²	61.5	50%	0.504	32%	0.322	S	S	.	.	H	α-helix	trans	-59.9	-36.8	176.2	-67.6	171.8	-170.2	161.6	0	113.5	W442 D443 A444 G448	W442-K446 VanDerWaalsContact CE2-CE 3.45Å; W442-K446 VanDerWaalsContact CE3-NZ 3.3Å; W442-K446 PolarHBondContact O-N 3.28Å; D443-K446 PolarHBondContact O-N 3.31Å; D443-K446 IonicContact OD1-NZ 3.19Å; D443-K446 PolarHBondContact OD1-NZ 2.67Å; A444-K446 VanDerWaalsContact C-N 3.33Å; A444-K446 PolarHBondContact O-N 3.11Å; K446-G448 PolarHBondContact O-N 3.15Å
447	L	88.6	Confident	89.3	Confident	89 Å²	89	59.3 Å²	59.3	47%	0.466	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	12.4	178	-59.8	-170.6	0	0	0	112.9	A444 Q445 K449 W456	A444-L447 PolarHBondContact O-N 3.15Å; Q445-L447 VanDerWaalsContact C-N 3.3Å; Q445-L447 PolarHBondContact O-N 3.47Å; L447-K449 PolarHBondContact O-N 3.04Å; L447-W456 HydrophobicContact CD1-CH2 3.69Å; L447-W456 HydrophobicContact CD1-CZ2 3.91Å; L447-W456 HydrophobicContact CG-CH2 4.22Å
448	G	87.7	Confident	89.4	Confident	71 Å²	71	58.3 Å²	58.3	73%	0.732	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	9.2	-177	0	0	0	0	0	114.6	A444 Q445 K446	A444-G448 PolarHBondContact O-N 3.02Å; Q445-G448 PolarHBondContact O-N 3.21Å; K446-G448 PolarHBondContact O-N 3.15Å
449	K	86.1	Confident	89.4	Confident	44 Å²	44	56.1 Å²	56.1	19%	0.191	29%	0.288	C	S	.	.			trans	-112.2	36.4	-169.2	-73.9	-175.2	175.8	-171.1	0	113.4	A444 L447 S451 F452 R465 N466 R467	A444-K449 CarbonylContact O-C 3.49Å; A444-K449 WeakPolarHBondContact O-CA 3.38Å; A444-K449 PolarHBondContact O-N 2.92Å; L447-K449 PolarHBondContact O-N 3.04Å; K449-S451 PolarHBondContact O-N 3.45Å; K449-F452 HydrophobicContact CB-CD2 3.86Å; K449-F452 HydrophobicContact CG-CD2 4.2Å; K449-F452 PolarHBondContact O-N 2.9Å; K449-R465 PolarHBondContact NZ-O 3.39Å; K449-N466 PolarHBondContact NZ-O 2.95Å; K449-R467 PolarHBondContact NZ-O 3.11Å
450	A	81.9	Confident	89	Confident	52 Å²	52	56.6 Å²	56.6	43%	0.43	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-51.6	-31.3	-174.2	0	0	0	0	0	114.9	Q445 F452	Q445-A450 HydrophobicContact CG-CB 3.61Å; A450-F452 VanDerWaalsContact C-N 3.32Å; A450-F452 PolarHBondContact O-N 2.94Å
451	S	81.5	Confident	88.9	Confident	79 Å²	79	56.3 Å²	56.3	55%	0.552	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-68.8	-22.4	177.7	47.2	0	0	0	0	114.7	K449 A453	K449-S451 PolarHBondContact O-N 3.45Å; S451-A453 VanDerWaalsContact C-N 3.34Å; S451-A453 PolarHBondContact O-N 3.01Å
452	F	85.2	Confident	88.9	Confident	75 Å²	75	56.9 Å²	56.9	33%	0.329	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-89.8	7.6	-173.2	-65.3	-89.3	0	0	0	114	K449 A450 Y454 A455 W456	K449-F452 HydrophobicContact CB-CD2 3.86Å; K449-F452 HydrophobicContact CG-CD2 4.2Å; K449-F452 PolarHBondContact O-N 2.9Å; A450-F452 VanDerWaalsContact C-N 3.32Å; A450-F452 PolarHBondContact O-N 2.94Å; F452-Y454 PolarHBondContact O-N 2.71Å; F452-A455 WeakPolarHBondContact O-CB 3.48Å; F452-A455 PolarHBondContact O-N 3.29Å; F452-W456 VanDerWaalsContact O-CD1 3.24Å; F452-W456 PolarHBondContact O-N 3.41Å
453	A	88.5	Confident	88.8	Confident	5 Å²	5	54.9 Å²	54.9	4%	0.041	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-25.8	-171.2	0	0	0	0	0	115.5	Q441 S451	Q441-A453 HydrophobicContact CB-CB 4.24Å; Q441-A453 HydrophobicContact CG-CB 3.48Å; Q441-A453 VanDerWaalsContact CG-CB 3.48Å; S451-A453 VanDerWaalsContact C-N 3.34Å; S451-A453 PolarHBondContact O-N 3.01Å
454	Y	91.1	Very high	88.9	Confident	50 Å²	50	53.5 Å²	53.5	20%	0.196	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-36	172.1	-65.3	-62.7	0	0	0	112.8	T420 G423 N424 L437 F452 W456 I457 L590	T420-Y454 HydrophobicContact CG2-CD2 4.08Å; G423-Y454 WeakPolarHBondContact CA-O 3.33Å; N424-Y454 HydrophobicContact CB-CD1 4.06Å; N424-Y454 HydrophobicContact CB-CD2 4.39Å; N424-Y454 HydrophobicContact CB-CE1 4.24Å; N424-Y454 HydrophobicContact CB-CG 4.15Å; L437-Y454 HydrophobicContact CD1-CD1 3.95Å; L437-Y454 HydrophobicContact CD1-CE1 4.03Å; L437-Y454 HydrophobicContact CD2-CE1 4.07Å; F452-Y454 PolarHBondContact O-N 2.71Å; Y454-W456 VanDerWaalsContact C-N 3.3Å; Y454-W456 PolarHBondContact O-N 3.15Å; Y454-I457 HydrophobicContact CD1-CD1 4.47Å; Y454-I457 WeakPolarHBondContact O-CB 3.35Å; Y454-I457 WeakPolarHBondContact O-CD1 3.46Å; Y454-I457 WeakPolarHBondContact O-CG1 3.33Å; Y454-I457 PolarHBondContact O-N 3.09Å; Y454-L590 HydrophobicContact CE2-CD1 4.34Å
455	A	92.5	Very high	88.9	Confident	4 Å²	4	56.1 Å²	56.1	3%	0.033	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-66.4	-34.4	179.3	0	0	0	0	0	111.7	F452 I457 L458 D459	F452-A455 WeakPolarHBondContact O-CB 3.48Å; F452-A455 PolarHBondContact O-N 3.29Å; A455-I457 PolarHBondContact O-N 2.8Å; A455-L458 PolarHBondContact O-N 2.99Å; A455-D459 WeakPolarHBondContact CB-OD2 3.45Å; A455-D459 PolarHBondContact O-N 3.15Å
456	W	91.1	Very high	88.9	Confident	11 Å²	11	55.7 Å²	55.7	4%	0.042	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-59.3	-12.1	176.8	-78.4	41.4	0	0	0	115.8	Y440 D443 A444 L447 F452 Y454 L458 R465	Y440-W456 HydrophobicContact CG-CB 4.42Å; D443-W456 HydrophobicContact CB-CH2 4.39Å; D443-W456 HydrophobicContact CB-CZ3 3.69Å; D443-W456 WeakPolarHBondContact O-CH2 3.47Å; A444-W456 HydrophobicContact CB-CD2 4.03Å; A444-W456 HydrophobicContact CB-CE3 4.29Å; A444-W456 HydrophobicContact CB-CH2 4.07Å; A444-W456 HydrophobicContact CB-CZ2 3.79Å; A444-W456 HydrophobicContact CB-CZ3 4.31Å; L447-W456 HydrophobicContact CD1-CH2 3.69Å; L447-W456 HydrophobicContact CD1-CZ2 3.91Å; L447-W456 HydrophobicContact CG-CH2 4.22Å; F452-W456 VanDerWaalsContact O-CD1 3.24Å; F452-W456 PolarHBondContact O-N 3.41Å; Y454-W456 VanDerWaalsContact C-N 3.3Å; Y454-W456 PolarHBondContact O-N 3.15Å; W456-L458 VanDerWaalsContact C-N 3.34Å; W456-R465 HydrophobicContact CD2-CG 3.91Å; W456-R465 HydrophobicContact CE3-CG 4.33Å; W456-R465 HydrophobicContact CG-CG 4.24Å; W456-R465 HydrophobicContact CH2-CB 4.37Å; W456-R465 HydrophobicContact CZ2-CB 3.88Å; W456-R465 HydrophobicContact CZ2-CG 4.15Å; W456-R465 PolarHBondContact O-NH2 3.03Å; W456-R465 VanDerWaalsContact O-NH2 3.1Å
457	I	91	Very high	88.8	Confident	18 Å²	18	56.6 Å²	56.6	9%	0.092	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-69.1	-35.3	170.5	-64.8	167.4	0	0	0	110.8	G423 L426 C427 V432 L437 Y440 Y454 A455	G423-I457 WeakPolarHBondContact O-CD1 3.4Å; L426-I457 HydrophobicContact CD1-CG2 4.24Å; C427-I457 WeakPolarHBondContact SG-CD1 3.13Å; V432-I457 HydrophobicContact CG1-CD1 4.4Å; V432-I457 HydrophobicContact CG1-CG1 4.47Å; V432-I457 HydrophobicContact CG2-CD1 4.24Å; V432-I457 HydrophobicContact CG2-CG1 4.44Å; V432-I457 HydrophobicContact CG2-CG2 3.64Å; L437-I457 HydrophobicContact CD1-CD1 4.38Å; Y440-I457 HydrophobicContact CD2-CG1 4.12Å; Y440-I457 HydrophobicContact CE2-CG1 4.26Å; Y454-I457 HydrophobicContact CD1-CD1 4.47Å; Y454-I457 WeakPolarHBondContact O-CB 3.35Å; Y454-I457 WeakPolarHBondContact O-CD1 3.46Å; Y454-I457 WeakPolarHBondContact O-CG1 3.33Å; Y454-I457 PolarHBondContact O-N 3.09Å; A455-I457 PolarHBondContact O-N 2.8Å
458	L	90.5	Very high	88.8	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.016	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-45.6	-177.4	-64.3	172.5	0	0	0	111.2	M422 L426 A455 W456 Q460 A474 T476 D489	M422-L458 HydrophobicContact CB-CD1 3.64Å; L426-L458 HydrophobicContact CD1-CD2 3.93Å; A455-L458 PolarHBondContact O-N 2.99Å; W456-L458 VanDerWaalsContact C-N 3.34Å; L458-Q460 PolarHBondContact O-N 3.5Å; L458-A474 HydrophobicContact CB-CB 3.94Å; L458-A474 HydrophobicContact CD2-CB 4.25Å; L458-T476 HydrophobicContact CD2-CG2 3.52Å; L458-D489 HydrophobicContact CD1-CB 4.11Å
459	D	91.3	Very high	88.9	Confident	4 Å²	4	51.8 Å²	51.8	2%	0.021	27%	0.274	C	S	.	.			trans	-65.8	96.1	173.2	-60.2	-35.2	0	0	0	109	A455 E464 R465 T470	A455-D459 WeakPolarHBondContact CB-OD2 3.45Å; A455-D459 PolarHBondContact O-N 3.15Å; D459-E464 HydrophobicContact CB-CB 3.88Å; D459-R465 HydrophobicContact CB-CG 4.43Å; D459-R465 PolarHBondContact O-NE 2.8Å; D459-R465 PolarHBondContact O-NH2 2.78Å; D459-T470 WeakPolarHBondContact OD1-CB 3.14Å; D459-T470 PolarHBondContact OD1-OG1 3.46Å
460	Q	84.9	Confident	89.2	Confident	137 Å²	137	50 Å²	50	64%	0.64	27%	0.267	S	S	*	.			trans	-93.4	-27.5	-176.5	-74.7	-177.9	47	0	0	113	L458	L458-Q460 PolarHBondContact O-N 3.5Å
461	T	89.1	Confident	89.6	Confident	54 Å²	54	49 Å²	49	33%	0.331	25%	0.253	S	S	.	.	S	Bend	trans	-75.3	157.4	-177.7	71.3	0	0	0	0	112.1	E463 E464 R465	T461-E463 VanDerWaalsContact C-N 3.34Å; T461-E464 WeakPolarHBondContact CB-OE2 3.1Å; T461-E464 WeakPolarHBondContact CG2-OE2 3.38Å; T461-E464 PolarHBondContact N-OE2 2.71Å; T461-E464 VanDerWaalsContact N-OE2 3.16Å; T461-E464 VanDerWaalsContact OG1-CB 3.32Å; T461-E464 WeakPolarHBondContact OG1-CB 3.43Å; T461-E464 WeakPolarHBondContact OG1-CG 3.41Å; T461-E464 PolarHBondContact OG1-N 3.29Å; T461-E464 VanDerWaalsContact OG1-N 3.08Å; T461-E464 PolarHBondContact OG1-OE2 2.98Å; T461-R465 WeakPolarHBondContact O-CG 3.47Å; T461-R465 PolarHBondContact O-N 3.47Å
462	S	89.9	Confident	90.1	Very high	85 Å²	85	49 Å²	49	59%	0.594	25%	0.247	S	C	*	.	H	α-helix	trans	-67.6	-34.7	171	43.9	0	0	0	0	112	N466	S462-N466 WeakPolarHBondContact O-CB 3.38Å; S462-N466 PolarHBondContact O-N 2.91Å; S462-N466 PolarHBondContact O-ND2 2.85Å; S462-N466 PolarHBondContact O-OD1 2.93Å
463	E	91.1	Very high	90.3	Very high	105 Å²	105	47.4 Å²	47.4	49%	0.491	24%	0.242	S	C	.	.	H	α-helix	trans	-67.3	-43.5	179.8	-72.5	-163.7	-135.4	0	0	112.7	T461 R465 N466 R467	T461-E463 VanDerWaalsContact C-N 3.34Å; E463-R465 VanDerWaalsContact C-N 3.35Å; E463-R465 PolarHBondContact O-N 3.21Å; E463-N466 PolarHBondContact O-N 2.69Å; E463-R467 WeakPolarHBondContact O-CB 3.36Å; E463-R467 WeakPolarHBondContact O-CG 3.12Å; E463-R467 PolarHBondContact O-N 3.16Å; E463-R467 IonicContact OE2-CZ 2.8Å; E463-R467 IonicContact OE2-NH1 2.7Å; E463-R467 PolarHBondContact OE2-NH1 3.37Å; E463-R467 IonicContact OE2-NH2 3.26Å; E463-R467 PolarHBondContact OE2-NH2 3.21Å
464	E	91.6	Very high	90.3	Very high	8 Å²	8	47.8 Å²	47.8	4%	0.037	25%	0.245	C	C	.	.	H	α-helix	trans	-61.5	-42.9	176.9	-71.7	164	140.9	0	0	111.8	D459 T461 G468 V469 M471 D472	D459-E464 HydrophobicContact CB-CB 3.88Å; T461-E464 WeakPolarHBondContact CB-OE2 3.1Å; T461-E464 WeakPolarHBondContact CG2-OE2 3.38Å; T461-E464 PolarHBondContact N-OE2 2.71Å; T461-E464 VanDerWaalsContact N-OE2 3.16Å; T461-E464 VanDerWaalsContact OG1-CB 3.32Å; T461-E464 WeakPolarHBondContact OG1-CB 3.43Å; T461-E464 WeakPolarHBondContact OG1-CG 3.41Å; T461-E464 PolarHBondContact OG1-N 3.29Å; T461-E464 VanDerWaalsContact OG1-N 3.08Å; T461-E464 PolarHBondContact OG1-OE2 2.98Å; E464-G468 VanDerWaalsContact O-CA 3.29Å; E464-G468 WeakPolarHBondContact O-CA 3.5Å; E464-G468 PolarHBondContact O-N 3.12Å; E464-V469 PolarHBondContact O-N 2.75Å; E464-M471 HydrophobicContact CG-CB 3.74Å; E464-M471 HydrophobicContact CG-CG 3.51Å; E464-M471 PolarHBondContact OE1-N 3.01Å; E464-D472 PolarHBondContact OE1-N 2.82Å
465	R	90.6	Very high	90.2	Very high	54 Å²	54	48.3 Å²	48.3	20%	0.204	25%	0.249	C	C	.	.	H	α-helix	trans	-67.5	-43.1	177	-66.6	173.3	-179.6	162.9	-0.2	111.7	K449 W456 D459 T461 E463 G468	K449-R465 PolarHBondContact NZ-O 3.39Å; W456-R465 HydrophobicContact CD2-CG 3.91Å; W456-R465 HydrophobicContact CE3-CG 4.33Å; W456-R465 HydrophobicContact CG-CG 4.24Å; W456-R465 HydrophobicContact CH2-CB 4.37Å; W456-R465 HydrophobicContact CZ2-CB 3.88Å; W456-R465 HydrophobicContact CZ2-CG 4.15Å; W456-R465 PolarHBondContact O-NH2 3.03Å; W456-R465 VanDerWaalsContact O-NH2 3.1Å; D459-R465 HydrophobicContact CB-CG 4.43Å; D459-R465 PolarHBondContact O-NE 2.8Å; D459-R465 PolarHBondContact O-NH2 2.78Å; T461-R465 WeakPolarHBondContact O-CG 3.47Å; T461-R465 PolarHBondContact O-N 3.47Å; E463-R465 VanDerWaalsContact C-N 3.35Å; E463-R465 PolarHBondContact O-N 3.21Å; R465-G468 PolarHBondContact O-N 3.08Å
466	N	91.5	Very high	90	Very high	105 Å²	105	49.4 Å²	49.4	56%	0.561	26%	0.256	S	S	*	.	H	α-helix	trans	-68.2	-36.5	179	-72.7	-4.6	0	0	0	112.4	K449 S462 E463	K449-N466 PolarHBondContact NZ-O 2.95Å; S462-N466 WeakPolarHBondContact O-CB 3.38Å; S462-N466 PolarHBondContact O-N 2.91Å; S462-N466 PolarHBondContact O-ND2 2.85Å; S462-N466 PolarHBondContact O-OD1 2.93Å; E463-N466 PolarHBondContact O-N 2.69Å
467	R	90.2	Very high	89.8	Confident	135 Å²	135	49.2 Å²	49.2	51%	0.509	26%	0.256	S	S	.	.	H	α-helix	trans	-78.4	-38.9	172.4	-67.5	-169.5	-175.7	100.5	12.6	112.6	K449 E463 M471	K449-R467 PolarHBondContact NZ-O 3.11Å; E463-R467 WeakPolarHBondContact O-CB 3.36Å; E463-R467 WeakPolarHBondContact O-CG 3.12Å; E463-R467 PolarHBondContact O-N 3.16Å; E463-R467 IonicContact OE2-CZ 2.8Å; E463-R467 IonicContact OE2-NH1 2.7Å; E463-R467 PolarHBondContact OE2-NH1 3.37Å; E463-R467 IonicContact OE2-NH2 3.26Å; E463-R467 PolarHBondContact OE2-NH2 3.21Å; R467-M471 VanDerWaalsContact NH1-CE 3.32Å; R467-M471 PolarHBondContact NH1-SD 2.91Å
468	G	88	Confident	89.7	Confident	19 Å²	19	48.4 Å²	48.4	20%	0.196	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	23.1	-170.6	0	0	0	0	0	112.9	E464 R465	E464-G468 VanDerWaalsContact O-CA 3.29Å; E464-G468 WeakPolarHBondContact O-CA 3.5Å; E464-G468 PolarHBondContact O-N 3.12Å; R465-G468 PolarHBondContact O-N 3.08Å
469	V	90.3	Very high	89.5	Confident	41 Å²	41	49.7 Å²	49.7	25%	0.248	26%	0.258	C	S	.	.	S	Bend	trans	-141.2	123.5	-175.7	-178.1	0	0	0	0	107.8	V414 E464	V414-V469 HydrophobicContact CG1-CG2 4.44Å; E464-V469 PolarHBondContact O-N 2.75Å
470	T	91.8	Very high	89.2	Confident	7 Å²	7	50 Å²	50	4%	0.043	26%	0.26	C	S	.	.			trans	-58.1	132.9	171.6	-44.7	0	0	0	0	110.3	S419 D459 D472 P491	S419-T470 PolarHBondContact OG-OG1 3.44Å; S419-T470 VanDerWaalsContact OG-OG1 3.05Å; D459-T470 WeakPolarHBondContact OD1-CB 3.14Å; D459-T470 PolarHBondContact OD1-OG1 3.46Å; T470-D472 WeakPolarHBondContact CG2-O 3.32Å; T470-P491 WeakPolarHBondContact O-CB 3.33Å
471	M	91.1	Very high	89.3	Confident	29 Å²	29	50.3 Å²	50.3	14%	0.143	26%	0.259	C	S	.	.			trans	-110.3	-47.9	-172	-63.8	-78.3	-57.6	0	0	110.2	E464 R467 F496	E464-M471 HydrophobicContact CG-CB 3.74Å; E464-M471 HydrophobicContact CG-CG 3.51Å; E464-M471 PolarHBondContact OE1-N 3.01Å; R467-M471 VanDerWaalsContact NH1-CE 3.32Å; R467-M471 PolarHBondContact NH1-SD 2.91Å; M471-F496 HydrophobicContact CE-CD1 4.43Å; M471-F496 HydrophobicContact CE-CE1 3.57Å; M471-F496 HydrophobicContact CE-CE2 3.97Å; M471-F496 HydrophobicContact CE-CZ 3.31Å; M471-F496 HydrophobicContact SD-CD2 4.34Å; M471-F496 HydrophobicContact SD-CE1 4.26Å; M471-F496 HydrophobicContact SD-CE2 3.52Å; M471-F496 VanDerWaalsContact SD-CE2 3.52Å; M471-F496 HydrophobicContact SD-CZ 3.49Å; M471-F496 WeakPolarHBondContact SD-CZ 2.87Å
472	D	90.4	Very high	89.1	Confident	80 Å²	80	50.2 Å²	50.2	43%	0.428	26%	0.26	S	S	.	.	S	Bend	trans	-111.6	173.2	-178.7	-71.5	-47.6	0	0	0	111.2	E464 T470 A474 Q499	E464-D472 PolarHBondContact OE1-N 2.82Å; T470-D472 WeakPolarHBondContact CG2-O 3.32Å; D472-A474 PolarHBondContact O-N 3.06Å; D472-Q499 PolarHBondContact OD1-NE2 2.91Å
473	I	90.6	Very high	89	Confident	41 Å²	41	46.9 Å²	46.9	21%	0.21	24%	0.235	C	C	.	.			trans	-86.3	109.8	-178.6	-71.1	161.1	0	0	0	110.7	Q475 M488 D489 Q499 G503	I473-Q475 HydrophobicContact CG2-CG 4.26Å; I473-Q475 PolarHBondContact O-N 2.7Å; I473-M488 HydrophobicContact CG2-CB 3.81Å; I473-M488 HydrophobicContact CG2-CG 4.02Å; I473-D489 WeakPolarHBondContact CA-O 3.35Å; I473-Q499 HydrophobicContact CD1-CB 4.32Å; I473-Q499 WeakPolarHBondContact CD1-O 3.43Å; I473-Q499 HydrophobicContact CG1-CB 4.5Å; I473-G503 VanDerWaalsContact CD1-CA 3.46Å
474	A	89	Confident	88.9	Confident	13 Å²	13	43.6 Å²	43.6	11%	0.107	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	112.5	168.9	0	0	0	0	0	110.3	L458 D472 D489	L458-A474 HydrophobicContact CB-CB 3.94Å; L458-A474 HydrophobicContact CD2-CB 4.25Å; D472-A474 PolarHBondContact O-N 3.06Å; A474-D489 PolarHBondContact O-N 2.82Å; A474-D489 VanDerWaalsContact O-N 3.13Å
475	Q	87.4	Confident	88.9	Confident	61 Å²	61	43.3 Å²	43.3	29%	0.285	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	124.9	171.6	-69.9	-175	-21.5	0	0	110.7	I473 L487 M488 Q506	I473-Q475 HydrophobicContact CG2-CG 4.26Å; I473-Q475 PolarHBondContact O-N 2.7Å; Q475-L487 WeakPolarHBondContact CA-O 3.46Å; Q475-M488 HydrophobicContact CG-CG 4.11Å; Q475-Q506 VanDerWaalsContact NE2-OE1 3.15Å
476	T	88.2	Confident	88.9	Confident	28 Å²	28	40.9 Å²	40.9	17%	0.172	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	168.3	173	53.2	0	0	0	0	110.7	L426 L458 L487	L426-T476 HydrophobicContact CD1-CG2 4.39Å; L458-T476 HydrophobicContact CD2-CG2 3.52Å; T476-L487 PolarHBondContact N-O 3.16Å; T476-L487 PolarHBondContact O-N 3.26Å
477	S	87.8	Confident	88.9	Confident	7 Å²	7	36 Å²	36	5%	0.049	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	141.5	175.6	48.3	0	0	0	0	112.2	V485 C697	S477-V485 WeakPolarHBondContact CA-O 3.46Å; S477-C697 WeakPolarHBondContact CB-O 3.3Å; S477-C697 PolarHBondContact OG-O 3.17Å
478	F	88.6	Confident	89	Confident	1 Å²	1	29.6 Å²	29.6	0%	0.004	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	157.6	174.6	65.6	-93.5	0	0	0	111.1	L425 L426 L429 H431 T480 V485 L487 L624 I627	L425-F478 HydrophobicContact CD2-CZ 4.3Å; L426-F478 HydrophobicContact CD2-CB 4.18Å; L426-F478 HydrophobicContact CD2-CD1 4.19Å; L429-F478 HydrophobicContact CD1-CB 3.97Å; L429-F478 HydrophobicContact CD1-CD2 3.58Å; L429-F478 HydrophobicContact CD1-CE2 4.16Å; L429-F478 HydrophobicContact CD1-CG 3.83Å; H431-F478 WeakPolarHBondContact NE2-CA 3.25Å; H431-F478 VanDerWaalsContact NE2-CB 3.35Å; H431-F478 WeakPolarHBondContact NE2-CB 3.39Å; F478-T480 HydrophobicContact CD2-CG2 4.35Å; F478-T480 HydrophobicContact CE2-CG2 3.94Å; F478-V485 HydrophobicContact CD1-CB 4.25Å; F478-V485 HydrophobicContact CD1-CG1 4.5Å; F478-V485 HydrophobicContact CD2-CB 4.18Å; F478-V485 HydrophobicContact CD2-CG2 4.44Å; F478-V485 HydrophobicContact CE1-CB 3.87Å; F478-V485 HydrophobicContact CE1-CG1 3.74Å; F478-V485 HydrophobicContact CE2-CB 3.79Å; F478-V485 HydrophobicContact CE2-CG1 4.29Å; F478-V485 HydrophobicContact CE2-CG2 3.84Å; F478-V485 HydrophobicContact CG-CB 4.41Å; F478-V485 HydrophobicContact CZ-CB 3.62Å; F478-V485 HydrophobicContact CZ-CG1 3.62Å; F478-V485 HydrophobicContact CZ-CG2 4Å; F478-V485 PolarHBondContact N-O 2.86Å; F478-V485 VanDerWaalsContact N-O 3.09Å; F478-V485 PolarHBondContact O-N 3.17Å; F478-L487 HydrophobicContact CD1-CB 4.38Å; F478-L487 HydrophobicContact CE1-CB 4.12Å; F478-L487 HydrophobicContact CE1-CD1 4.4Å; F478-L487 HydrophobicContact CE1-CD2 4.21Å; F478-L487 HydrophobicContact CE1-CG 4.49Å; F478-L624 HydrophobicContact CD2-CD1 4.5Å; F478-L624 HydrophobicContact CE2-CD1 3.93Å; F478-I627 HydrophobicContact CZ-CD1 4.45Å; F478-I627 HydrophobicContact CZ-CG2 4.4Å
479	E	86.4	Confident	89.3	Confident	30 Å²	30	28.7 Å²	28.7	14%	0.14	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	134.4	175.4	-56.1	-153.3	161	0	0	111.5	K403 R484 T701	K403-E479 HydrophobicContact CD-CB 4.46Å; K403-E479 WeakPolarHBondContact CE-OE2 3.43Å; K403-E479 IonicContact NZ-OE2 2.73Å; K403-E479 PolarHBondContact NZ-OE2 3.48Å; E479-R484 HydrophobicContact CG-CG 4.13Å; E479-R484 IonicContact OE1-CZ 2.86Å; E479-R484 VanDerWaalsContact OE1-CZ 3.31Å; E479-R484 IonicContact OE1-NE 3.81Å; E479-R484 PolarHBondContact OE1-NE 2.99Å; E479-R484 IonicContact OE1-NH2 2.71Å; E479-R484 PolarHBondContact OE1-NH2 3.45Å; E479-T701 PolarHBondContact OE1-OG1 2.95Å; E479-T701 WeakPolarHBondContact OE2-CG2 3.45Å
480	T	85.8	Confident	89.5	Confident	9 Å²	9	26.8 Å²	26.8	6%	0.055	14%	0.137	C	C	.	.			trans	-92.6	-167.6	165.1	68.8	0	0	0	0	109.9	K403 F478 S482 K483 V485 L624 D628	K403-T480 PolarHBondContact NZ-O 3.02Å; F478-T480 HydrophobicContact CD2-CG2 4.35Å; F478-T480 HydrophobicContact CE2-CG2 3.94Å; T480-S482 PolarHBondContact OG1-N 3.2Å; T480-K483 PolarHBondContact N-O 3.29Å; T480-K483 WeakPolarHBondContact OG1-CA 3.36Å; T480-K483 WeakPolarHBondContact OG1-CB 3.36Å; T480-K483 PolarHBondContact OG1-N 2.82Å; T480-K483 PolarHBondContact OG1-O 2.93Å; T480-V485 HydrophobicContact CG2-CG2 3.92Å; T480-L624 HydrophobicContact CG2-CD1 4.01Å; T480-D628 WeakPolarHBondContact CB-OD1 3.39Å; T480-D628 HydrophobicContact CG2-CB 4.34Å; T480-D628 PolarHBondContact OG1-OD1 2.97Å
481	K	85.9	Confident	89.5	Confident	145 Å²	145	26.5 Å²	26.5	63%	0.63	14%	0.136	S	C	*	.	S	Bend	trans	-66.3	-46.1	173	-58.8	167.1	-175.2	162.8	0	110.4	K403 E625 D628	K403-K481 WeakPolarHBondContact CE-O 3.27Å; K481-E625 IonicContact NZ-OE1 3.66Å; K481-D628 WeakPolarHBondContact CB-OD2 3.42Å
482	S	86.3	Confident	89.4	Confident	51 Å²	51	25.1 Å²	25.1	36%	0.357	13%	0.129	S	C	.	.	S	Bend	trans	-101.8	-22.1	-174.9	78.5	0	0	0	0	115.9	Q404 T480 D628	Q404-S482 PolarHBondContact N-O 3.36Å; T480-S482 PolarHBondContact OG1-N 3.2Å; S482-D628 WeakPolarHBondContact CB-OD1 3.48Å; S482-D628 PolarHBondContact N-OD1 2.9Å; S482-D628 PolarHBondContact OG-OD1 3.31Å
483	K	87.5	Confident	89.4	Confident	16 Å²	16	25 Å²	25	7%	0.07	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	161.3	-164.8	-75	141.1	-166.4	174.4	0	113.7	Q404 I406 T480 D628 I630	Q404-K483 HydrophobicContact CB-CG 3.94Å; Q404-K483 CarbonylContact O-C 3.56Å; Q404-K483 WeakPolarHBondContact O-CA 3.32Å; Q404-K483 VanDerWaalsContact O-CB 3.23Å; Q404-K483 WeakPolarHBondContact O-CB 3.42Å; Q404-K483 WeakPolarHBondContact O-CG 3.5Å; I406-K483 HydrophobicContact CD1-CD 3.8Å; I406-K483 HydrophobicContact CD1-CG 4.33Å; T480-K483 PolarHBondContact N-O 3.29Å; T480-K483 WeakPolarHBondContact OG1-CA 3.36Å; T480-K483 WeakPolarHBondContact OG1-CB 3.36Å; T480-K483 PolarHBondContact OG1-N 2.82Å; T480-K483 PolarHBondContact OG1-O 2.93Å; K483-D628 PolarHBondContact NZ-O 3.22Å; K483-I630 PolarHBondContact NZ-O 3.06Å
484	R	88.2	Confident	89.2	Confident	36 Å²	36	26.8 Å²	26.8	14%	0.136	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	126.3	160.1	-72.5	-174.6	172.6	136.1	9.4	108	K403 Q404 I405 I406 E479 N698	K403-R484 HydrophobicContact CB-CG 4.12Å; Q404-R484 PolarHBondContact O-N 3.43Å; I405-R484 CarbonylContact C-O 3.59Å; I405-R484 WeakPolarHBondContact CA-O 3.14Å; I405-R484 HydrophobicContact CG1-CB 4Å; I406-R484 PolarHBondContact N-O 3.33Å; E479-R484 HydrophobicContact CG-CG 4.13Å; E479-R484 IonicContact OE1-CZ 2.86Å; E479-R484 VanDerWaalsContact OE1-CZ 3.31Å; E479-R484 IonicContact OE1-NE 3.81Å; E479-R484 PolarHBondContact OE1-NE 2.99Å; E479-R484 IonicContact OE1-NH2 2.71Å; E479-R484 PolarHBondContact OE1-NH2 3.45Å; R484-N698 PolarHBondContact NH1-OD1 3.16Å
485	V	91.1	Very high	89.3	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.006	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	114.5	179.7	-176.7	0	0	0	0	108.1	I406 L408 S477 F478 T480 I627	I406-V485 WeakPolarHBondContact O-CA 3.32Å; L408-V485 HydrophobicContact CB-CG1 3.76Å; L408-V485 HydrophobicContact CD2-CG1 3.99Å; S477-V485 WeakPolarHBondContact CA-O 3.46Å; F478-V485 HydrophobicContact CD1-CB 4.25Å; F478-V485 HydrophobicContact CD1-CG1 4.5Å; F478-V485 HydrophobicContact CD2-CB 4.18Å; F478-V485 HydrophobicContact CD2-CG2 4.44Å; F478-V485 HydrophobicContact CE1-CB 3.87Å; F478-V485 HydrophobicContact CE1-CG1 3.74Å; F478-V485 HydrophobicContact CE2-CB 3.79Å; F478-V485 HydrophobicContact CE2-CG1 4.29Å; F478-V485 HydrophobicContact CE2-CG2 3.84Å; F478-V485 HydrophobicContact CG-CB 4.41Å; F478-V485 HydrophobicContact CZ-CB 3.62Å; F478-V485 HydrophobicContact CZ-CG1 3.62Å; F478-V485 HydrophobicContact CZ-CG2 4Å; F478-V485 PolarHBondContact N-O 2.86Å; F478-V485 VanDerWaalsContact N-O 3.09Å; F478-V485 PolarHBondContact O-N 3.17Å; T480-V485 HydrophobicContact CG2-CG2 3.92Å; V485-I627 HydrophobicContact CG1-CG2 4.3Å; V485-I627 HydrophobicContact CG2-CG2 3.72Å
486	A	90.9	Very high	89.4	Confident	4 Å²	4	30.3 Å²	30.3	3%	0.033	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	109.7	166.9	0	0	0	0	0	107.5	I406 L408 C697	I406-A486 PolarHBondContact O-N 3.02Å; L408-A486 PolarHBondContact N-O 2.79Å; A486-C697 HydrophobicContact CB-CB 4.38Å
487	L	92.4	Very high	89.6	Confident	2 Å²	2	29 Å²	29	1%	0.01	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	128.7	-175.2	-175.3	70	0	0	0	110	L408 V410 M422 Q475 T476 F478	L408-L487 HydrophobicContact CD2-CD1 4.08Å; L408-L487 HydrophobicContact CG-CD1 4.28Å; L408-L487 WeakPolarHBondContact O-CA 3.43Å; V410-L487 HydrophobicContact CG2-CD1 3.6Å; V410-L487 HydrophobicContact CG2-CG 4.46Å; M422-L487 HydrophobicContact CB-CD2 4.07Å; M422-L487 HydrophobicContact CG-CD2 4.04Å; M422-L487 HydrophobicContact SD-CD1 3.78Å; M422-L487 HydrophobicContact SD-CD2 3.75Å; M422-L487 HydrophobicContact SD-CG 4.37Å; Q475-L487 WeakPolarHBondContact CA-O 3.46Å; T476-L487 PolarHBondContact N-O 3.16Å; T476-L487 PolarHBondContact O-N 3.26Å; F478-L487 HydrophobicContact CD1-CB 4.38Å; F478-L487 HydrophobicContact CE1-CB 4.12Å; F478-L487 HydrophobicContact CE1-CD1 4.4Å; F478-L487 HydrophobicContact CE1-CD2 4.21Å; F478-L487 HydrophobicContact CE1-CG 4.49Å
488	M	92.6	Very high	89.7	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	108.4	173.1	-70.6	165.8	-72	0	0	108.4	N407 L408 I409 V410 I473 Q475 Q506 A507	N407-M488 HydrophobicContact CB-CE 3.99Å; L408-M488 PolarHBondContact O-N 2.81Å; I409-M488 CarbonylContact C-O 3.6Å; I409-M488 WeakPolarHBondContact CA-O 3.44Å; I409-M488 HydrophobicContact CB-CB 4.36Å; I409-M488 HydrophobicContact CB-CE 4.48Å; I409-M488 HydrophobicContact CG1-CB 4.34Å; V410-M488 PolarHBondContact N-O 2.93Å; I473-M488 HydrophobicContact CG2-CB 3.81Å; I473-M488 HydrophobicContact CG2-CG 4.02Å; Q475-M488 HydrophobicContact CG-CG 4.11Å; M488-Q506 HydrophobicContact CE-CB 4.27Å; M488-Q506 HydrophobicContact SD-CB 3.74Å; M488-A507 HydrophobicContact CE-CB 3.87Å
489	D	94	Very high	89.9	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	135.3	168.7	-165.2	23.6	0	0	0	109.2	S419 L458 I473 A474	S419-D489 VanDerWaalsContact CA-OD2 3.23Å; S419-D489 WeakPolarHBondContact CA-OD2 3.47Å; S419-D489 WeakPolarHBondContact CB-OD2 3.45Å; S419-D489 PolarHBondContact OG-OD2 2.85Å; L458-D489 HydrophobicContact CD1-CB 4.11Å; I473-D489 WeakPolarHBondContact CA-O 3.35Å; A474-D489 PolarHBondContact O-N 2.82Å; A474-D489 VanDerWaalsContact O-N 3.13Å
490	A	92.8	Very high	90.2	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.008	16%	0.161	C	C	.	.			trans	-119.7	143.1	-173.4	0	0	0	0	0	111.5	I409 V410 K418 V500	I409-A490 HydrophobicContact CD1-CB 3.93Å; I409-A490 HydrophobicContact CG1-CB 4Å; V410-A490 WeakPolarHBondContact O-CB 3.07Å; V410-A490 PolarHBondContact O-N 2.58Å; K418-A490 WeakPolarHBondContact CE-O 3.33Å; A490-V500 HydrophobicContact CB-CG1 4.38Å; A490-V500 HydrophobicContact CB-CG2 4.19Å
491	P	93.2	Very high	90.5	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.006	16%	0.159	C	C	.	.			trans	-64.6	151.1	-175.4	28.1	-36.8	0	0	0	111.9	T470 F496 Q499 V500	T470-P491 WeakPolarHBondContact O-CB 3.33Å; P491-F496 HydrophobicContact CB-CB 3.68Å; P491-F496 HydrophobicContact CB-CD2 4.26Å; P491-F496 HydrophobicContact CB-CG 4.37Å; P491-F496 HydrophobicContact CG-CB 3.53Å; P491-Q499 HydrophobicContact CG-CB 4.06Å; P491-V500 HydrophobicContact CG-CG2 3.89Å; P491-V500 WeakPolarHBondContact O-CG2 3.36Å
492	G	88.5	Confident	90.8	Very high	1 Å²	1	26 Å²	26	1%	0.01	13%	0.134	C	C	.	.			trans	-87.6	-27	-178.2	0	0	0	0	0	114.9	Q530	G492-Q530 PolarHBondContact O-NE2 2.62Å; G492-Q530 PolarHBondContact O-OE1 2.76Å
493	H	89.7	Confident	91	Very high	78 Å²	78	23.6 Å²	23.6	36%	0.361	12%	0.117	S	C	.	.	S	Bend	trans	-77.3	151.2	-165.6	-151	-109	0	0	0	113.5	V414 D495 F496	V414-H493 HydrophobicContact CG2-CB 4.49Å; H493-D495 IonicContact CE1-OD2 3.28Å; H493-D495 PolarHBondContact CE1-OD2 3.43Å; H493-D495 IonicContact ND1-OD2 3.26Å; H493-D495 PolarHBondContact ND1-OD2 2.94Å; H493-D495 PolarHBondContact O-N 3.43Å; H493-F496 HydrophobicContact CB-CD2 3.57Å; H493-F496 HydrophobicContact CB-CE2 3.81Å; H493-F496 PolarHBondContact O-N 3.33Å; H493-F496 VanDerWaalsContact O-N 3.16Å
494	K	87.5	Confident	91.2	Very high	77 Å²	77	23 Å²	23	34%	0.335	11%	0.114	S	C	.	.	G	3₁₀ helix	trans	-59	-31.3	-177.8	-169.2	179.9	-177.5	-179	0	112.7	V497 E852	K494-V497 VanDerWaalsContact O-CG2 3.26Å; K494-V497 WeakPolarHBondContact O-CG2 3.38Å; K494-E852 IonicContact NZ-OE1 2.82Å; K494-E852 PolarHBondContact NZ-OE1 3.05Å
495	D	90.2	Very high	91.3	Very high	98 Å²	98	22.8 Å²	22.8	52%	0.524	12%	0.117	S	C	.	.	G	3₁₀ helix	trans	-79	-24.2	-176.8	-47.4	-51.2	0	0	0	113.2	H493 P498	H493-D495 IonicContact CE1-OD2 3.28Å; H493-D495 PolarHBondContact CE1-OD2 3.43Å; H493-D495 IonicContact ND1-OD2 3.26Å; H493-D495 PolarHBondContact ND1-OD2 2.94Å; H493-D495 PolarHBondContact O-N 3.43Å; D495-P498 WeakPolarHBondContact O-CD 3.46Å
496	F	90.8	Very high	91.2	Very high	51 Å²	51	23.4 Å²	23.4	22%	0.224	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-97.8	6.6	-178	-48.3	-46.8	0	0	0	113.2	M471 P491 H493 Q499 V500	M471-F496 HydrophobicContact CE-CD1 4.43Å; M471-F496 HydrophobicContact CE-CE1 3.57Å; M471-F496 HydrophobicContact CE-CE2 3.97Å; M471-F496 HydrophobicContact CE-CZ 3.31Å; M471-F496 HydrophobicContact SD-CD2 4.34Å; M471-F496 HydrophobicContact SD-CE1 4.26Å; M471-F496 HydrophobicContact SD-CE2 3.52Å; M471-F496 VanDerWaalsContact SD-CE2 3.52Å; M471-F496 HydrophobicContact SD-CZ 3.49Å; M471-F496 WeakPolarHBondContact SD-CZ 2.87Å; P491-F496 HydrophobicContact CB-CB 3.68Å; P491-F496 HydrophobicContact CB-CD2 4.26Å; P491-F496 HydrophobicContact CB-CG 4.37Å; P491-F496 HydrophobicContact CG-CB 3.53Å; H493-F496 HydrophobicContact CB-CD2 3.57Å; H493-F496 HydrophobicContact CB-CE2 3.81Å; H493-F496 PolarHBondContact O-N 3.33Å; H493-F496 VanDerWaalsContact O-N 3.16Å; F496-Q499 WeakPolarHBondContact O-CA 3.48Å; F496-Q499 WeakPolarHBondContact O-CB 3.4Å; F496-Q499 PolarHBondContact O-N 2.84Å; F496-V500 PolarHBondContact O-N 2.87Å
497	V	90.8	Very high	91.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-56.4	-27.7	170.8	-170.7	0	0	0	0	113.8	K494 Q499 V500 I501 L537	K494-V497 VanDerWaalsContact O-CG2 3.26Å; K494-V497 WeakPolarHBondContact O-CG2 3.38Å; V497-Q499 VanDerWaalsContact C-N 3.32Å; V497-Q499 PolarHBondContact O-N 3.44Å; V497-V500 HydrophobicContact CG1-CB 4.4Å; V497-V500 WeakPolarHBondContact O-CB 3.2Å; V497-V500 PolarHBondContact O-N 3.27Å; V497-I501 WeakPolarHBondContact O-CG1 3.46Å; V497-I501 PolarHBondContact O-N 2.96Å; V497-L537 HydrophobicContact CG1-CD1 3.27Å
498	P	91.2	Very high	91.2	Very high	35 Å²	35	24.5 Å²	24.5	23%	0.227	13%	0.127	C	C	.	.	H	α-helix	trans	-48.6	-45.8	161.7	-34.1	41.3	0	0	0	114.7	D495 I501 G502 Y782	D495-P498 WeakPolarHBondContact O-CD 3.46Å; P498-I501 PolarHBondContact O-N 2.78Å; P498-G502 PolarHBondContact O-N 3.34Å; P498-Y782 HydrophobicContact CB-CE1 3.86Å; P498-Y782 HydrophobicContact CG-CE1 4.1Å
499	Q	91.4	Very high	91.2	Very high	81 Å²	81	24.6 Å²	24.6	38%	0.379	13%	0.128	S	C	.	.	H	α-helix	trans	-67.9	-44.3	175.7	-54.7	-59.8	50.3	0	0	110.2	D472 I473 P491 F496 V497 I501 G502 G503	D472-Q499 PolarHBondContact OD1-NE2 2.91Å; I473-Q499 HydrophobicContact CD1-CB 4.32Å; I473-Q499 WeakPolarHBondContact CD1-O 3.43Å; I473-Q499 HydrophobicContact CG1-CB 4.5Å; P491-Q499 HydrophobicContact CG-CB 4.06Å; F496-Q499 WeakPolarHBondContact O-CA 3.48Å; F496-Q499 WeakPolarHBondContact O-CB 3.4Å; F496-Q499 PolarHBondContact O-N 2.84Å; V497-Q499 VanDerWaalsContact C-N 3.32Å; V497-Q499 PolarHBondContact O-N 3.44Å; Q499-I501 PolarHBondContact O-N 2.93Å; Q499-I501 VanDerWaalsContact O-N 3.15Å; Q499-G502 WeakPolarHBondContact O-CA 3.43Å; Q499-G502 PolarHBondContact O-N 3.4Å; Q499-G503 PolarHBondContact O-N 3.41Å
500	V	93.1	Very high	91.2	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.006	13%	0.128	C	C	.	.	H	α-helix	trans	-53.2	-38.3	175.9	-174.8	0	0	0	0	111.7	M411 A490 P491 F496 V497 A504	M411-V500 HydrophobicContact CE-CG1 3.92Å; M411-V500 HydrophobicContact CG-CG1 4.47Å; A490-V500 HydrophobicContact CB-CG1 4.38Å; A490-V500 HydrophobicContact CB-CG2 4.19Å; P491-V500 HydrophobicContact CG-CG2 3.89Å; P491-V500 WeakPolarHBondContact O-CG2 3.36Å; F496-V500 PolarHBondContact O-N 2.87Å; V497-V500 HydrophobicContact CG1-CB 4.4Å; V497-V500 WeakPolarHBondContact O-CB 3.2Å; V497-V500 PolarHBondContact O-N 3.27Å; V500-A504 WeakPolarHBondContact O-CB 3.4Å; V500-A504 PolarHBondContact O-N 2.96Å
501	I	92.9	Very high	91.3	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.015	13%	0.127	C	C	.	.	H	α-helix	trans	-64.1	-46.3	173.4	-68.4	164.7	0	0	0	111.3	V497 P498 Q499 G503 A504 T505 L537 L541 Y782 M846	V497-I501 WeakPolarHBondContact O-CG1 3.46Å; V497-I501 PolarHBondContact O-N 2.96Å; P498-I501 PolarHBondContact O-N 2.78Å; Q499-I501 PolarHBondContact O-N 2.93Å; Q499-I501 VanDerWaalsContact O-N 3.15Å; I501-G503 VanDerWaalsContact C-N 3.34Å; I501-G503 PolarHBondContact O-N 2.89Å; I501-A504 PolarHBondContact O-N 3.37Å; I501-T505 PolarHBondContact O-N 3.48Å; I501-T505 VanDerWaalsContact O-N 3.11Å; I501-T505 PolarHBondContact O-OG1 3.02Å; I501-L537 HydrophobicContact CD1-CD2 4.32Å; I501-L537 HydrophobicContact CG1-CD1 4.19Å; I501-L537 HydrophobicContact CG1-CD2 4.12Å; I501-L541 HydrophobicContact CB-CD1 4.31Å; I501-L541 HydrophobicContact CG1-CD1 4.38Å; I501-L541 HydrophobicContact CG2-CD1 4.02Å; I501-L541 HydrophobicContact CG2-CD2 4.39Å; I501-Y782 HydrophobicContact CD1-CD1 4.32Å; I501-Y782 HydrophobicContact CD1-CG 4.27Å; I501-M846 HydrophobicContact CD1-CB 4.34Å
502	G	90.7	Very high	91.4	Very high	10 Å²	10	24.6 Å²	24.6	10%	0.103	13%	0.128	C	C	.	.	H	α-helix	trans	-62.5	-33.3	178.8	0	0	0	0	0	114.6	P498 Q499 T505 Q506 C785	P498-G502 PolarHBondContact O-N 3.34Å; Q499-G502 WeakPolarHBondContact O-CA 3.43Å; Q499-G502 PolarHBondContact O-N 3.4Å; G502-T505 PolarHBondContact O-OG1 3.18Å; G502-T505 VanDerWaalsContact O-OG1 3.09Å; G502-Q506 PolarHBondContact O-NE2 3.02Å; G502-C785 PolarHBondContact O-SG 2.7Å
503	G	91	Very high	91.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-78	-37.7	171.1	0	0	0	0	0	113.1	I409 I473 Q499 I501 T505 Q506 A507	I409-G503 VanDerWaalsContact CD1-C 3.49Å; I473-G503 VanDerWaalsContact CD1-CA 3.46Å; Q499-G503 PolarHBondContact O-N 3.41Å; I501-G503 VanDerWaalsContact C-N 3.34Å; I501-G503 PolarHBondContact O-N 2.89Å; G503-T505 VanDerWaalsContact C-N 3.3Å; G503-T505 PolarHBondContact O-N 3.04Å; G503-Q506 WeakPolarHBondContact O-CA 3.34Å; G503-Q506 WeakPolarHBondContact O-CB 3.35Å; G503-Q506 PolarHBondContact O-N 3.4Å; G503-A507 PolarHBondContact O-N 3.48Å
504	A	92.3	Very high	92	Very high	2 Å²	2	21.1 Å²	21.1	2%	0.017	11%	0.111	C	C	.	.	H	α-helix	trans	-71.5	-21.2	-176.5	0	0	0	0	0	113.8	I409 M411 V500 I501 Q506 L541	I409-A504 HydrophobicContact CD1-CB 4.08Å; M411-A504 HydrophobicContact CE-CB 3.52Å; V500-A504 WeakPolarHBondContact O-CB 3.4Å; V500-A504 PolarHBondContact O-N 2.96Å; I501-A504 PolarHBondContact O-N 3.37Å; A504-Q506 VanDerWaalsContact C-N 3.34Å; A504-L541 HydrophobicContact CB-CD1 3.45Å; A504-L541 VanDerWaalsContact CB-CD1 3.45Å
505	T	90.8	Very high	92.4	Very high	32 Å²	32	17.6 Å²	17.6	20%	0.196	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-23.3	167.3	54.3	0	0	0	0	113	I501 G502 G503 L541 N784	I501-T505 PolarHBondContact O-N 3.48Å; I501-T505 VanDerWaalsContact O-N 3.11Å; I501-T505 PolarHBondContact O-OG1 3.02Å; G502-T505 PolarHBondContact O-OG1 3.18Å; G502-T505 VanDerWaalsContact O-OG1 3.09Å; G503-T505 VanDerWaalsContact C-N 3.3Å; G503-T505 PolarHBondContact O-N 3.04Å; T505-L541 HydrophobicContact CG2-CB 4.49Å; T505-L541 HydrophobicContact CG2-CD1 4.32Å; T505-L541 HydrophobicContact CG2-CD2 3.84Å; T505-L541 HydrophobicContact CG2-CG 4.42Å; T505-N784 WeakPolarHBondContact CG2-O 3.49Å; T505-N784 PolarHBondContact OG1-O 3.05Å
506	Q	88.9	Confident	92.6	Very high	14 Å²	14	13 Å²	13	7%	0.065	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-13.3	176	-63.4	175.9	60.8	0	0	112.8	N407 Q475 M488 G502 G503 A504 R662 C785	N407-Q506 WeakPolarHBondContact CB-O 3.17Å; Q475-Q506 VanDerWaalsContact NE2-OE1 3.15Å; M488-Q506 HydrophobicContact CE-CB 4.27Å; M488-Q506 HydrophobicContact SD-CB 3.74Å; G502-Q506 PolarHBondContact O-NE2 3.02Å; G503-Q506 WeakPolarHBondContact O-CA 3.34Å; G503-Q506 WeakPolarHBondContact O-CB 3.35Å; G503-Q506 PolarHBondContact O-N 3.4Å; A504-Q506 VanDerWaalsContact C-N 3.34Å; Q506-R662 VanDerWaalsContact O-CZ 3.24Å; Q506-R662 PolarHBondContact O-NE 3.27Å; Q506-R662 PolarHBondContact O-NH1 2.94Å; Q506-C785 PolarHBondContact NE2-SG 3.07Å; Q506-C785 VanDerWaalsContact NE2-SG 3.42Å
507	A	91.8	Very high	92.8	Very high	10 Å²	10	12 Å²	12	8%	0.083	7%	0.069	C	C	.	.			trans	-90.6	151.8	-175.8	0	0	0	0	0	114.4	I409 M488 G503	I409-A507 HydrophobicContact CB-CB 3.78Å; I409-A507 HydrophobicContact CG2-CB 3.42Å; I409-A507 VanDerWaalsContact CG2-CB 3.42Å; M488-A507 HydrophobicContact CE-CB 3.87Å; G503-A507 PolarHBondContact O-N 3.48Å
508	D	90	Very high	92.8	Very high	19 Å²	19	21.2 Å²	21.2	10%	0.102	10%	0.104	C	C	.	.	S	Bend	trans	-107	-35.1	174.2	-56.9	-50.2	0	0	0	111.7	N407 S544 P633 R662	N407-D508 WeakPolarHBondContact CB-OD2 3.49Å; N407-D508 PolarHBondContact N-OD2 3.28Å; N407-D508 VanDerWaalsContact N-OD2 3.16Å; N407-D508 PolarHBondContact ND2-OD2 2.92Å; N407-D508 PolarHBondContact O-N 3.17Å; D508-S544 PolarHBondContact O-N 3.13Å; D508-S544 PolarHBondContact O-OG 3.44Å; D508-P633 HydrophobicContact CB-CG 4Å; D508-R662 IonicContact OD1-CZ 3.44Å; D508-R662 IonicContact OD1-NH1 2.77Å; D508-R662 PolarHBondContact OD1-NH1 3.45Å; D508-R662 IonicContact OD1-NH2 3.41Å; D508-R662 PolarHBondContact OD1-NH2 2.88Å; D508-R662 IonicContact OD2-CZ 2.73Å; D508-R662 IonicContact OD2-NH2 3.61Å; D508-R662 PolarHBondContact OD2-NH2 3.02Å
509	A	92.8	Very high	92.8	Very high	2 Å²	2	21.6 Å²	21.6	2%	0.017	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	159	175.1	0	0	0	0	0	110.4	I406 N407 L408 I409 V543 R545 I630	I406-A509 HydrophobicContact CG2-CB 4.47Å; N407-A509 PolarHBondContact O-N 2.87Å; N407-A509 VanDerWaalsContact O-N 3.17Å; L408-A509 WeakPolarHBondContact CA-O 3.48Å; L408-A509 HydrophobicContact CD1-CB 4.07Å; I409-A509 PolarHBondContact N-O 3.39Å; A509-V543 VanDerWaalsContact C-CG1 3.48Å; A509-R545 WeakPolarHBondContact CA-O 3.23Å; A509-R545 HydrophobicContact CB-CB 4.44Å; A509-I630 HydrophobicContact CB-CD1 3.86Å; A509-I630 HydrophobicContact CB-CG2 4.12Å
510	A	94.4	Very high	92.7	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	146.7	175.1	0	0	0	0	0	112.6	I409 V543 R545 L546 I547	I409-A510 HydrophobicContact CG2-CB 3.68Å; I409-A510 CarbonylContact O-C 3.58Å; I409-A510 VanDerWaalsContact O-CA 3.27Å; I409-A510 WeakPolarHBondContact O-CA 3.36Å; A510-V543 HydrophobicContact CB-CG1 3.78Å; A510-V543 HydrophobicContact CB-CG2 4.47Å; A510-R545 PolarHBondContact N-O 2.9Å; A510-L546 HydrophobicContact CB-CD1 3.84Å; A510-L546 WeakPolarHBondContact O-CA 3.27Å; A510-I547 PolarHBondContact O-N 3.07Å
511	L	95.3	Very high	92.7	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	105.9	171.7	179.5	62.4	0	0	0	108.9	L408 I409 V410 M411 M422 V513 I547 A549 L623	L408-L511 HydrophobicContact CD1-CB 4.24Å; I409-L511 PolarHBondContact O-N 3.39Å; V410-L511 WeakPolarHBondContact CA-O 3.33Å; V410-L511 HydrophobicContact CG1-CD2 4.44Å; V410-L511 HydrophobicContact CG2-CB 4.49Å; V410-L511 HydrophobicContact CG2-CD2 4.42Å; M411-L511 PolarHBondContact N-O 3.41Å; M422-L511 HydrophobicContact CE-CD2 3.55Å; M422-L511 HydrophobicContact SD-CD2 4.22Å; L511-V513 HydrophobicContact CD2-CG2 4.43Å; L511-V513 HydrophobicContact CG-CG2 4.2Å; L511-V513 PolarHBondContact O-N 3.36Å; L511-I547 CarbonylContact C-O 3.56Å; L511-I547 HydrophobicContact CD1-CB 3.9Å; L511-I547 HydrophobicContact CD1-CG2 3.68Å; L511-A549 HydrophobicContact CD1-CB 3.82Å; L511-L623 HydrophobicContact CD1-CD1 3.81Å; L511-L623 HydrophobicContact CD2-CD1 4.36Å; L511-L623 HydrophobicContact CD2-CD2 4.41Å
512	L	95.1	Very high	92.7	Very high	3 Å²	3	23.6 Å²	23.6	2%	0.016	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	103.3	175.5	-171.5	63.3	0	0	0	109.5	M411 I514 T531 A535 L546 I547 V548 A549	M411-L512 HydrophobicContact CB-CD1 4.1Å; M411-L512 CarbonylContact O-C 3.6Å; M411-L512 WeakPolarHBondContact O-CA 3.21Å; L512-I514 HydrophobicContact CD2-CD1 3.92Å; L512-I514 HydrophobicContact CD2-CG1 4.45Å; L512-I514 HydrophobicContact CG-CD1 4.04Å; L512-I514 HydrophobicContact CG-CG1 4.02Å; L512-T531 HydrophobicContact CD1-CG2 3.94Å; L512-T531 HydrophobicContact CD2-CG2 4.24Å; L512-T531 HydrophobicContact CG-CG2 4.22Å; L512-A535 HydrophobicContact CD2-CB 4.16Å; L512-L546 HydrophobicContact CB-CD1 4.04Å; L512-L546 HydrophobicContact CD2-CD2 4.41Å; L512-I547 PolarHBondContact N-O 2.81Å; L512-V548 WeakPolarHBondContact O-CA 3.41Å; L512-A549 PolarHBondContact O-N 3.46Å
513	V	95.7	Very high	92.7	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	123.2	175.7	-167.2	0	0	0	0	109	V410 M411 G412 A416 K418 L421 L511 A549 N551	V410-V513 HydrophobicContact CG1-CG2 3.62Å; M411-V513 PolarHBondContact O-N 2.84Å; G412-V513 WeakPolarHBondContact CA-O 3.36Å; A416-V513 HydrophobicContact CB-CB 4.41Å; A416-V513 HydrophobicContact CB-CG1 4.19Å; A416-V513 VanDerWaalsContact O-CG1 3.22Å; A416-V513 WeakPolarHBondContact O-CG1 3.41Å; K418-V513 HydrophobicContact CG-CB 4.21Å; K418-V513 HydrophobicContact CG-CG2 4.31Å; L421-V513 HydrophobicContact CD2-CG1 3.98Å; L421-V513 HydrophobicContact CD2-CG2 3.88Å; L511-V513 HydrophobicContact CD2-CG2 4.43Å; L511-V513 HydrophobicContact CG-CG2 4.2Å; L511-V513 PolarHBondContact O-N 3.36Å; V513-A549 WeakPolarHBondContact CA-O 3.48Å; V513-N551 HydrophobicContact CG1-CB 3.74Å
514	I	95.3	Very high	92.5	Very high	6 Å²	6	27.1 Å²	27.1	3%	0.031	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	143	-177	-61.7	-175.3	0	0	0	108.4	L512 F521 T531 V548 A549 V550 N551 I570	L512-I514 HydrophobicContact CD2-CD1 3.92Å; L512-I514 HydrophobicContact CD2-CG1 4.45Å; L512-I514 HydrophobicContact CG-CD1 4.04Å; L512-I514 HydrophobicContact CG-CG1 4.02Å; I514-F521 HydrophobicContact CG2-CD2 3.65Å; I514-F521 HydrophobicContact CG2-CE2 3.77Å; I514-T531 HydrophobicContact CD1-CG2 3.9Å; I514-T531 HydrophobicContact CG1-CG2 3.82Å; I514-V548 HydrophobicContact CD1-CG1 3.92Å; I514-V548 HydrophobicContact CG1-CG1 4.44Å; I514-A549 PolarHBondContact N-O 2.8Å; I514-V550 CarbonylContact O-C 3.58Å; I514-V550 WeakPolarHBondContact O-CA 3.38Å; I514-N551 PolarHBondContact O-N 2.89Å; I514-I570 HydrophobicContact CD1-CD1 3.49Å; I514-I570 VanDerWaalsContact CD1-CD1 3.49Å; I514-I570 HydrophobicContact CD1-CG1 3.85Å; I514-I570 HydrophobicContact CD1-CG2 4.32Å; I514-I570 HydrophobicContact CG2-CD1 4.23Å
515	N	95	Very high	92.3	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.016	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	139.2	-177.1	-162.9	-21.1	0	0	0	111.3	D415 T517 E520 F521 K552	D415-N515 PolarHBondContact O-ND2 3.4Å; N515-T517 PolarHBondContact OD1-N 2.98Å; N515-T517 VanDerWaalsContact OD1-N 3.13Å; N515-T517 PolarHBondContact OD1-OG1 3Å; N515-T517 VanDerWaalsContact OD1-OG1 3.05Å; N515-E520 HydrophobicContact CB-CB 4.22Å; N515-E520 WeakPolarHBondContact ND2-CB 3.44Å; N515-E520 PolarHBondContact ND2-OE1 3.17Å; N515-E520 VanDerWaalsContact ND2-OE1 3.08Å; N515-E520 PolarHBondContact ND2-OE2 2.8Å; N515-E520 PolarHBondContact OD1-OE2 3.05Å; N515-F521 WeakPolarHBondContact O-CB 3.32Å; N515-F521 WeakPolarHBondContact O-CD2 3.27Å; N515-K552 WeakPolarHBondContact ND2-CE 3.47Å; N515-K552 PolarHBondContact ND2-NZ 3.37Å; N515-K552 WeakPolarHBondContact OD1-CD 3.47Å
516	A	95.2	Very high	92	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.157	C	C	.	.			trans	-84.4	-28.7	177.4	0	0	0	0	0	113.9	V550 N551 M553 V556 R562 I566	A516-V550 HydrophobicContact CB-CG1 3.97Å; A516-N551 VanDerWaalsContact CB-O 3.24Å; A516-N551 WeakPolarHBondContact CB-O 3.4Å; A516-N551 PolarHBondContact N-O 3.22Å; A516-M553 HydrophobicContact CB-CG 4.35Å; A516-M553 HydrophobicContact CB-SD 3.69Å; A516-V556 HydrophobicContact CB-CG2 3.89Å; A516-R562 PolarHBondContact O-NE 3.18Å; A516-R562 PolarHBondContact O-NH2 2.72Å; A516-I566 HydrophobicContact CB-CD1 4.27Å
517	T	94.2	Very high	91.3	Very high	30 Å²	30	33.2 Å²	33.2	18%	0.184	20%	0.198	C	C	.	.	S	Bend	trans	-56.5	146.5	-175	-41.5	0	0	0	0	111.2	N515 E520 F521 T555 R562	N515-T517 PolarHBondContact OD1-N 2.98Å; N515-T517 VanDerWaalsContact OD1-N 3.13Å; N515-T517 PolarHBondContact OD1-OG1 3Å; N515-T517 VanDerWaalsContact OD1-OG1 3.05Å; T517-E520 WeakPolarHBondContact CB-OE2 3.3Å; T517-E520 HydrophobicContact CG2-CG 4.31Å; T517-E520 PolarHBondContact OG1-OE2 3.26Å; T517-F521 WeakPolarHBondContact O-CB 3.42Å; T517-F521 PolarHBondContact O-N 3.04Å; T517-T555 PolarHBondContact OG1-OG1 2.93Å; T517-R562 PolarHBondContact O-NH2 3.35Å
518	R	91.8	Very high	90.7	Very high	194 Å²	194	36.1 Å²	36.1	73%	0.732	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	142.9	171.9	-62.8	178.2	-178.8	171.3	1.7	110.1	E520	R518-E520 VanDerWaalsContact C-N 3.27Å; R518-E520 PolarHBondContact O-N 3.43Å
519	G	90.2	Very high	90.4	Very high	43 Å²	43	35.7 Å²	35.7	44%	0.443	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	85	-62.6	-169	0	0	0	0	0	111.6	F521 E522 T523	G519-F521 PolarHBondContact O-N 3.39Å; G519-E522 WeakPolarHBondContact CA-OE2 3.24Å; G519-E522 PolarHBondContact N-OE2 2.77Å; G519-E522 PolarHBondContact O-N 2.96Å; G519-T523 PolarHBondContact O-N 3.24Å; G519-T523 PolarHBondContact O-OG1 3.44Å
520	E	91.2	Very high	90.2	Very high	52 Å²	52	36.9 Å²	36.9	24%	0.243	23%	0.233	C	C	.	.	H	α-helix	trans	-63.5	-24.7	-176	-52.7	-170.5	90.7	0	0	114.2	N515 T517 R518 T523 K552	N515-E520 HydrophobicContact CB-CB 4.22Å; N515-E520 WeakPolarHBondContact ND2-CB 3.44Å; N515-E520 PolarHBondContact ND2-OE1 3.17Å; N515-E520 VanDerWaalsContact ND2-OE1 3.08Å; N515-E520 PolarHBondContact ND2-OE2 2.8Å; N515-E520 PolarHBondContact OD1-OE2 3.05Å; T517-E520 WeakPolarHBondContact CB-OE2 3.3Å; T517-E520 HydrophobicContact CG2-CG 4.31Å; T517-E520 PolarHBondContact OG1-OE2 3.26Å; R518-E520 VanDerWaalsContact C-N 3.27Å; R518-E520 PolarHBondContact O-N 3.43Å; E520-T523 PolarHBondContact O-OG1 2.95Å; E520-K552 IonicContact OE1-NZ 2.62Å; E520-K552 PolarHBondContact OE1-NZ 3.23Å; E520-K552 IonicContact OE2-NZ 3.26Å; E520-K552 PolarHBondContact OE2-NZ 2.91Å
521	F	93	Very high	90	Very high	3 Å²	3	37.1 Å²	37.1	1%	0.013	24%	0.235	C	C	.	.	H	α-helix	trans	-77.8	-47.5	174	173.3	-112.3	0	0	0	111.5	I514 N515 T517 G519 G524 I525 I566 Q569 I570	I514-F521 HydrophobicContact CG2-CD2 3.65Å; I514-F521 HydrophobicContact CG2-CE2 3.77Å; N515-F521 WeakPolarHBondContact O-CB 3.32Å; N515-F521 WeakPolarHBondContact O-CD2 3.27Å; T517-F521 WeakPolarHBondContact O-CB 3.42Å; T517-F521 PolarHBondContact O-N 3.04Å; G519-F521 PolarHBondContact O-N 3.39Å; F521-G524 PolarHBondContact O-N 3.49Å; F521-G524 VanDerWaalsContact O-N 3.16Å; F521-I525 HydrophobicContact CD2-CD1 4.27Å; F521-I525 HydrophobicContact CE1-CD1 4.18Å; F521-I525 HydrophobicContact CE2-CD1 3.39Å; F521-I525 HydrophobicContact CE2-CG1 4.21Å; F521-I525 HydrophobicContact CZ-CD1 3.34Å; F521-I525 HydrophobicContact CZ-CG1 4.41Å; F521-I525 PolarHBondContact O-N 3.29Å; F521-I566 HydrophobicContact CD1-CG1 4.14Å; F521-I566 HydrophobicContact CD2-CD1 4.42Å; F521-I566 HydrophobicContact CD2-CG1 4.02Å; F521-I566 HydrophobicContact CD2-CG2 4.44Å; F521-I566 HydrophobicContact CE1-CG1 3.89Å; F521-I566 HydrophobicContact CE2-CB 4.1Å; F521-I566 HydrophobicContact CE2-CG1 3.77Å; F521-I566 HydrophobicContact CE2-CG2 3.76Å; F521-I566 HydrophobicContact CG-CG1 4.2Å; F521-I566 HydrophobicContact CZ-CB 4Å; F521-I566 HydrophobicContact CZ-CG1 3.7Å; F521-I566 HydrophobicContact CZ-CG2 4.12Å; F521-Q569 HydrophobicContact CZ-CB 4.2Å; F521-I570 HydrophobicContact CE2-CD1 4.21Å; F521-I570 HydrophobicContact CE2-CG1 4.27Å
522	E	92.2	Very high	89.6	Confident	72 Å²	72	42.3 Å²	42.3	34%	0.336	26%	0.255	S	S	.	.	H	α-helix	trans	-66	-38.9	-175.1	-69	74.7	-165.8	0	0	111.8	G519 G524 I525 G526 R562	G519-E522 WeakPolarHBondContact CA-OE2 3.24Å; G519-E522 PolarHBondContact N-OE2 2.77Å; G519-E522 PolarHBondContact O-N 2.96Å; E522-G524 VanDerWaalsContact C-N 3.33Å; E522-G524 PolarHBondContact O-N 2.7Å; E522-I525 PolarHBondContact O-N 3.15Å; E522-G526 PolarHBondContact O-N 2.92Å; E522-R562 IonicContact OE1-CZ 3.82Å; E522-R562 VanDerWaalsContact OE1-CZ 3.26Å; E522-R562 IonicContact OE1-NH1 3.04Å; E522-R562 PolarHBondContact OE1-NH1 3.32Å; E522-R562 IonicContact OE1-NH2 2.8Å; E522-R562 PolarHBondContact OE1-NH2 2.84Å; E522-R562 IonicContact OE2-NH2 3.68Å; E522-R562 PolarHBondContact OE2-NH2 3.27Å
523	T	90.3	Very high	89.3	Confident	82 Å²	82	43.7 Å²	43.7	50%	0.503	26%	0.261	S	S	.	.	H	α-helix	trans	-62	-39.3	171.8	55.3	0	0	0	0	112.2	G519 E520 I525 G529	G519-T523 PolarHBondContact O-N 3.24Å; G519-T523 PolarHBondContact O-OG1 3.44Å; E520-T523 PolarHBondContact O-OG1 2.95Å; T523-I525 PolarHBondContact O-N 2.93Å; T523-G529 WeakPolarHBondContact O-CA 3.48Å
524	G	86.6	Confident	89.1	Confident	3 Å²	3	43.7 Å²	43.7	3%	0.031	26%	0.261	C	S	.	.	H	α-helix	trans	-67.1	-31.6	-179.8	0	0	0	0	0	114.5	F521 E522 G529 T531	F521-G524 PolarHBondContact O-N 3.49Å; F521-G524 VanDerWaalsContact O-N 3.16Å; E522-G524 VanDerWaalsContact C-N 3.33Å; E522-G524 PolarHBondContact O-N 2.7Å; G524-G529 CarbonylContact O-C 3.42Å; G524-G529 WeakPolarHBondContact O-CA 3.21Å; G524-T531 WeakPolarHBondContact O-CB 3.47Å
525	I	88.1	Confident	88.9	Confident	36 Å²	36	43.5 Å²	43.5	19%	0.185	26%	0.26	C	S	.	.	H	α-helix	trans	-94.1	-17.1	179.6	-69.4	-167.7	0	0	0	113.2	F521 E522 T523 I570	F521-I525 HydrophobicContact CD2-CD1 4.27Å; F521-I525 HydrophobicContact CE1-CD1 4.18Å; F521-I525 HydrophobicContact CE2-CD1 3.39Å; F521-I525 HydrophobicContact CE2-CG1 4.21Å; F521-I525 HydrophobicContact CZ-CD1 3.34Å; F521-I525 HydrophobicContact CZ-CG1 4.41Å; F521-I525 PolarHBondContact O-N 3.29Å; E522-I525 PolarHBondContact O-N 3.15Å; T523-I525 PolarHBondContact O-N 2.93Å; I525-I570 HydrophobicContact CD1-CG1 3.92Å
526	G	84.7	Confident	88.6	Confident	29 Å²	29	45 Å²	45	30%	0.299	27%	0.266	S	S	.	.	S	Bend	trans	-53.8	172.9	-177.7	0	0	0	0	0	116.2	E522 G528 G529	E522-G526 PolarHBondContact O-N 2.92Å; G526-G528 VanDerWaalsContact C-N 3.29Å; G526-G528 PolarHBondContact O-N 3.25Å; G526-G529 PolarHBondContact O-N 2.93Å
527	A	73.9	Confident	88.4	Confident	111 Å²	111	45.1 Å²	45.1	92%	0.917	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	81.6	179.2	0	0	0	0	0	111.5
528	G	79.2	Confident	88.3	Confident	70 Å²	70	43.7 Å²	43.7	72%	0.722	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	127.2	-2.8	-173	0	0	0	0	0	114.3	G526	G526-G528 VanDerWaalsContact C-N 3.29Å; G526-G528 PolarHBondContact O-N 3.25Å
529	G	84.2	Confident	88.2	Confident	10 Å²	10	35.4 Å²	35.4	10%	0.103	23%	0.226	C	C	.	.			trans	-64	138.6	-177.8	0	0	0	0	0	113.9	T523 G524 G526 T531 R532 E533	T523-G529 WeakPolarHBondContact O-CA 3.48Å; G524-G529 CarbonylContact O-C 3.42Å; G524-G529 WeakPolarHBondContact O-CA 3.21Å; G526-G529 PolarHBondContact O-N 2.93Å; G529-T531 PolarHBondContact O-N 3.17Å; G529-R532 WeakPolarHBondContact O-CA 3.18Å; G529-R532 WeakPolarHBondContact O-CB 3.31Å; G529-R532 PolarHBondContact O-N 3.16Å; G529-E533 PolarHBondContact O-N 3.11Å
530	Q	88.3	Confident	88.2	Confident	27 Å²	27	33.7 Å²	33.7	13%	0.126	21%	0.207	C	C	.	.	H	α-helix	trans	-60	-40.8	-174.6	-70.6	161.4	-5.3	0	0	112.9	H413 G492 R532 E533 H534	H413-Q530 PolarHBondContact ND1-OE1 2.94Å; G492-Q530 PolarHBondContact O-NE2 2.62Å; G492-Q530 PolarHBondContact O-OE1 2.76Å; Q530-R532 PolarHBondContact O-N 2.88Å; Q530-E533 PolarHBondContact O-N 3.12Å; Q530-H534 VanDerWaalsContact O-CG 3.28Å; Q530-H534 PolarHBondContact O-N 2.98Å
531	T	89.7	Confident	88.1	Confident	6 Å²	6	31.8 Å²	31.8	4%	0.037	20%	0.198	C	C	.	.	H	α-helix	trans	-55.7	-36.5	174.7	-48.7	0	0	0	0	111.6	L512 I514 G524 G529 A535	L512-T531 HydrophobicContact CD1-CG2 3.94Å; L512-T531 HydrophobicContact CD2-CG2 4.24Å; L512-T531 HydrophobicContact CG-CG2 4.22Å; I514-T531 HydrophobicContact CD1-CG2 3.9Å; I514-T531 HydrophobicContact CG1-CG2 3.82Å; G524-T531 WeakPolarHBondContact O-CB 3.47Å; G529-T531 PolarHBondContact O-N 3.17Å; T531-A535 WeakPolarHBondContact O-CB 3.48Å; T531-A535 PolarHBondContact O-N 2.83Å; T531-A535 VanDerWaalsContact O-N 3.13Å
532	R	88.2	Confident	87.6	Confident	108 Å²	108	32 Å²	32	41%	0.408	20%	0.201	S	C	.	.	H	α-helix	trans	-71.3	-35.1	178.1	-157.4	-171.7	172.4	154.9	-1.6	112.7	G529 Q530 F573	G529-R532 WeakPolarHBondContact O-CA 3.18Å; G529-R532 WeakPolarHBondContact O-CB 3.31Å; G529-R532 PolarHBondContact O-N 3.16Å; Q530-R532 PolarHBondContact O-N 2.88Å; R532-F573 HydrophobicContact CB-CZ 4.12Å; R532-F573 HydrophobicContact CG-CD2 4.28Å; R532-F573 HydrophobicContact CG-CE1 4.23Å; R532-F573 HydrophobicContact CG-CE2 3.38Å; R532-F573 HydrophobicContact CG-CZ 3.35Å
533	E	89.1	Confident	87.4	Confident	32 Å²	32	28.7 Å²	28.7	15%	0.15	19%	0.186	C	C	.	.	H	α-helix	trans	-72.3	-48.1	172.6	-176.6	168.5	-177.7	0	0	111.2	G529 Q530 A535 R536 L537 R848 S853	G529-E533 PolarHBondContact O-N 3.11Å; Q530-E533 PolarHBondContact O-N 3.12Å; E533-A535 PolarHBondContact O-N 3Å; E533-R536 WeakPolarHBondContact O-CA 3.18Å; E533-R536 VanDerWaalsContact O-CB 3.22Å; E533-R536 WeakPolarHBondContact O-CB 3.32Å; E533-R536 PolarHBondContact O-N 3.16Å; E533-L537 HydrophobicContact CG-CD1 4.01Å; E533-L537 HydrophobicContact CG-CG 4.26Å; E533-L537 WeakPolarHBondContact O-CG 3.5Å; E533-L537 PolarHBondContact O-N 2.97Å; E533-R848 IonicContact OE1-CZ 2.71Å; E533-R848 IonicContact OE1-NH1 3.19Å; E533-R848 PolarHBondContact OE1-NH1 3.37Å; E533-R848 IonicContact OE1-NH2 2.7Å; E533-R848 PolarHBondContact OE1-NH2 2.77Å; E533-R848 IonicContact OE2-NH2 3.07Å; E533-S853 WeakPolarHBondContact OE1-CB 3.31Å; E533-S853 PolarHBondContact OE1-OG 2.91Å
534	H	91	Very high	86.9	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-59.3	-44.1	-177.7	-65.7	164.4	0	0	0	112.7	M411 G412 Q530 R536 L537 A538	M411-H534 HydrophobicContact CB-CB 4.11Å; M411-H534 HydrophobicContact CG-CB 4.47Å; M411-H534 HydrophobicContact SD-CB 4Å; G412-H534 PolarHBondContact O-CE1 3.43Å; G412-H534 VanDerWaalsContact O-CE1 3.22Å; G412-H534 PolarHBondContact O-ND1 3.4Å; Q530-H534 VanDerWaalsContact O-CG 3.28Å; Q530-H534 PolarHBondContact O-N 2.98Å; H534-R536 VanDerWaalsContact C-N 3.26Å; H534-R536 PolarHBondContact O-N 2.73Å; H534-L537 PolarHBondContact O-N 2.91Å; H534-A538 PolarHBondContact O-N 2.87Å
535	A	90.8	Very high	87	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.008	18%	0.184	C	C	.	.	H	α-helix	trans	-59.9	-35	173.3	0	0	0	0	0	112.9	L512 T531 E533 R539 F573 L574 M577 F579	L512-A535 HydrophobicContact CD2-CB 4.16Å; T531-A535 WeakPolarHBondContact O-CB 3.48Å; T531-A535 PolarHBondContact O-N 2.83Å; T531-A535 VanDerWaalsContact O-N 3.13Å; E533-A535 PolarHBondContact O-N 3Å; A535-R539 PolarHBondContact O-N 3.36Å; A535-F573 HydrophobicContact CB-CE1 3.73Å; A535-F573 HydrophobicContact CB-CZ 4.1Å; A535-L574 HydrophobicContact CB-CD2 4.14Å; A535-M577 HydrophobicContact CB-SD 4.01Å; A535-F579 WeakPolarHBondContact O-CZ 3.05Å
536	R	89.1	Confident	87.2	Confident	36 Å²	36	27.9 Å²	27.9	14%	0.136	18%	0.176	C	C	.	.	H	α-helix	trans	-67.7	-44.3	176.3	-159.2	171.8	-161.2	153.7	7.2	111.5	F64 E533 H534 R539 L540 M577 F767	F64-R536 VanDerWaalsContact CE2-NH2 3.25Å; E533-R536 WeakPolarHBondContact O-CA 3.18Å; E533-R536 VanDerWaalsContact O-CB 3.22Å; E533-R536 WeakPolarHBondContact O-CB 3.32Å; E533-R536 PolarHBondContact O-N 3.16Å; H534-R536 VanDerWaalsContact C-N 3.26Å; H534-R536 PolarHBondContact O-N 2.73Å; R536-R539 PolarHBondContact O-N 2.86Å; R536-L540 HydrophobicContact CG-CD1 3.96Å; R536-L540 WeakPolarHBondContact O-CD1 3.05Å; R536-L540 VanDerWaalsContact O-CG 3.32Å; R536-L540 WeakPolarHBondContact O-CG 3.14Å; R536-L540 PolarHBondContact O-N 2.83Å; R536-M577 HydrophobicContact CB-CE 3.51Å; R536-M577 HydrophobicContact CB-SD 4.39Å; R536-M577 HydrophobicContact CG-CE 3.76Å; R536-F767 HydrophobicContact CG-CE2 4.33Å; R536-F767 HydrophobicContact CG-CZ 4.24Å; R536-F767 VanDerWaalsContact NE-CD1 3.34Å; R536-F767 VanDerWaalsContact NH2-CD1 3.27Å
537	L	91	Very high	87.6	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-63.3	-47.6	179	-65.9	173	0	0	0	111.1	V497 I501 E533 H534 R539 L540 L541 M846	V497-L537 HydrophobicContact CG1-CD1 3.27Å; I501-L537 HydrophobicContact CD1-CD2 4.32Å; I501-L537 HydrophobicContact CG1-CD1 4.19Å; I501-L537 HydrophobicContact CG1-CD2 4.12Å; E533-L537 HydrophobicContact CG-CD1 4.01Å; E533-L537 HydrophobicContact CG-CG 4.26Å; E533-L537 WeakPolarHBondContact O-CG 3.5Å; E533-L537 PolarHBondContact O-N 2.97Å; H534-L537 PolarHBondContact O-N 2.91Å; L537-R539 VanDerWaalsContact C-N 3.26Å; L537-R539 PolarHBondContact O-N 2.7Å; L537-L540 PolarHBondContact O-N 3.32Å; L537-L540 VanDerWaalsContact O-N 3.1Å; L537-L541 WeakPolarHBondContact O-CB 3.46Å; L537-L541 WeakPolarHBondContact O-CG 3.46Å; L537-L541 PolarHBondContact O-N 3.02Å; L537-M846 HydrophobicContact CD2-CE 3.51Å; L537-M846 HydrophobicContact CD2-CG 4.11Å; L537-M846 HydrophobicContact CD2-SD 3.97Å
538	A	91.7	Very high	88.6	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-52.6	-44	174.8	0	0	0	0	0	111.9	M411 H534 L540 G542 V543 F579	M411-A538 HydrophobicContact CE-CB 4.22Å; M411-A538 HydrophobicContact SD-CB 4.03Å; H534-A538 PolarHBondContact O-N 2.87Å; A538-L540 VanDerWaalsContact C-N 3.34Å; A538-L540 PolarHBondContact O-N 2.98Å; A538-G542 WeakPolarHBondContact O-CA 3.44Å; A538-G542 PolarHBondContact O-N 3.48Å; A538-V543 HydrophobicContact CB-CB 4.24Å; A538-V543 HydrophobicContact CB-CG2 4.06Å; A538-V543 WeakPolarHBondContact O-CB 3.29Å; A538-V543 WeakPolarHBondContact O-CG2 3.42Å; A538-V543 PolarHBondContact O-N 3.38Å; A538-F579 HydrophobicContact CB-CZ 4.37Å
539	R	89.9	Confident	89.4	Confident	21 Å²	21	17.9 Å²	17.9	8%	0.079	8%	0.084	C	C	.	.	H	α-helix	trans	-67.6	-29.9	-179.7	-168.4	58.7	-179.9	90.9	-8.7	114.6	F69 P70 A535 R536 L537 G542 M577 N578 F579	F69-R539 HydrophobicContact CD1-CB 4.45Å; F69-R539 HydrophobicContact CD1-CG 3.62Å; F69-R539 HydrophobicContact CE1-CB 4.31Å; F69-R539 HydrophobicContact CE1-CG 3.79Å; F69-R539 HydrophobicContact CG-CG 4.25Å; P70-R539 PolarHBondContact O-NH1 3.32Å; P70-R539 VanDerWaalsContact O-NH1 3.12Å; A535-R539 PolarHBondContact O-N 3.36Å; R536-R539 PolarHBondContact O-N 2.86Å; L537-R539 VanDerWaalsContact C-N 3.26Å; L537-R539 PolarHBondContact O-N 2.7Å; R539-G542 WeakPolarHBondContact O-CA 3.38Å; R539-M577 WeakPolarHBondContact CD-O 3.38Å; R539-M577 WeakPolarHBondContact CG-O 3.49Å; R539-M577 PolarHBondContact NE-O 2.87Å; R539-M577 VanDerWaalsContact NE-O 3.13Å; R539-N578 PolarHBondContact NE-O 2.96Å; R539-N578 PolarHBondContact NH2-O 2.91Å; R539-F579 HydrophobicContact CB-CE1 4.22Å; R539-F579 HydrophobicContact CB-CE2 3.83Å; R539-F579 HydrophobicContact CB-CZ 3.55Å; R539-F579 HydrophobicContact CG-CE2 4.26Å; R539-F579 HydrophobicContact CG-CZ 4.19Å
540	L	89.5	Confident	89.9	Confident	7 Å²	7	17.5 Å²	17.5	4%	0.037	8%	0.08	C	C	.	.	H	α-helix	trans	-92.5	-40.2	-171.8	-71.5	166	0	0	0	113.2	F69 R536 L537 A538 G542 L765 F767 R844 M846	F69-L540 HydrophobicContact CD1-CD2 3.71Å; F69-L540 HydrophobicContact CD1-CG 4.32Å; F69-L540 HydrophobicContact CE1-CD2 3.96Å; F69-L540 HydrophobicContact CE1-CG 4.26Å; R536-L540 HydrophobicContact CG-CD1 3.96Å; R536-L540 WeakPolarHBondContact O-CD1 3.05Å; R536-L540 VanDerWaalsContact O-CG 3.32Å; R536-L540 WeakPolarHBondContact O-CG 3.14Å; R536-L540 PolarHBondContact O-N 2.83Å; L537-L540 PolarHBondContact O-N 3.32Å; L537-L540 VanDerWaalsContact O-N 3.1Å; A538-L540 VanDerWaalsContact C-N 3.34Å; A538-L540 PolarHBondContact O-N 2.98Å; L540-G542 PolarHBondContact O-N 2.78Å; L540-L765 HydrophobicContact CD2-CD2 3.99Å; L540-F767 HydrophobicContact CD1-CE1 3.86Å; L540-F767 HydrophobicContact CD1-CE2 4.36Å; L540-F767 HydrophobicContact CD1-CZ 3.33Å; L540-R844 WeakPolarHBondContact O-CD 3.21Å; L540-M846 HydrophobicContact CB-SD 3.96Å; L540-M846 HydrophobicContact CD1-CE 4.32Å; L540-M846 HydrophobicContact CD1-SD 3.81Å
541	L	88.8	Confident	90.3	Very high	12 Å²	12	16.5 Å²	16.5	6%	0.063	8%	0.075	C	C	.	.	H	α-helix	trans	-67.4	-19.1	163.6	-54.4	173.9	0	0	0	109.8	I501 A504 T505 L537 R844 M846	I501-L541 HydrophobicContact CB-CD1 4.31Å; I501-L541 HydrophobicContact CG1-CD1 4.38Å; I501-L541 HydrophobicContact CG2-CD1 4.02Å; I501-L541 HydrophobicContact CG2-CD2 4.39Å; A504-L541 HydrophobicContact CB-CD1 3.45Å; A504-L541 VanDerWaalsContact CB-CD1 3.45Å; T505-L541 HydrophobicContact CG2-CB 4.49Å; T505-L541 HydrophobicContact CG2-CD1 4.32Å; T505-L541 HydrophobicContact CG2-CD2 3.84Å; T505-L541 HydrophobicContact CG2-CG 4.42Å; L537-L541 WeakPolarHBondContact O-CB 3.46Å; L537-L541 WeakPolarHBondContact O-CG 3.46Å; L537-L541 PolarHBondContact O-N 3.02Å; L541-R844 WeakPolarHBondContact O-CD 3.1Å; L541-R844 PolarHBondContact O-NH1 3.37Å; L541-M846 HydrophobicContact CD2-CG 3.92Å
542	G	83.7	Confident	90.4	Very high	7 Å²	7	18.7 Å²	18.7	7%	0.072	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	36.5	155.3	0	0	0	0	0	113.5	N72 A538 R539 L540 S544 R844	N72-G542 PolarHBondContact ND2-O 3.43Å; A538-G542 WeakPolarHBondContact O-CA 3.44Å; A538-G542 PolarHBondContact O-N 3.48Å; R539-G542 WeakPolarHBondContact O-CA 3.38Å; L540-G542 PolarHBondContact O-N 2.78Å; G542-S544 PolarHBondContact O-N 2.88Å; G542-R844 VanDerWaalsContact CA-NH1 3.3Å; G542-R844 PolarHBondContact O-NH1 3.13Å
543	V	86.7	Confident	90.6	Very high	3 Å²	3	13.5 Å²	13.5	2%	0.018	7%	0.065	C	C	.	.			trans	-44.6	131.1	160.1	177	0	0	0	0	109.3	N72 A509 A510 A538 R545	N72-V543 PolarHBondContact ND2-O 2.91Å; A509-V543 VanDerWaalsContact C-CG1 3.48Å; A510-V543 HydrophobicContact CB-CG1 3.78Å; A510-V543 HydrophobicContact CB-CG2 4.47Å; A538-V543 HydrophobicContact CB-CB 4.24Å; A538-V543 HydrophobicContact CB-CG2 4.06Å; A538-V543 WeakPolarHBondContact O-CB 3.29Å; A538-V543 WeakPolarHBondContact O-CG2 3.42Å; A538-V543 PolarHBondContact O-N 3.38Å; V543-R545 WeakPolarHBondContact CG1-O 3.44Å
544	S	80	Confident	90.6	Very high	39 Å²	39	14.3 Å²	14.3	27%	0.273	7%	0.07	S	C	.	.	S	Bend	trans	-85.5	-39.1	-170.8	64.3	0	0	0	0	113.4	D508 G542	D508-S544 PolarHBondContact O-N 3.13Å; D508-S544 PolarHBondContact O-OG 3.44Å; G542-S544 PolarHBondContact O-N 2.88Å
545	R	88.5	Confident	90.7	Very high	60 Å²	60	17.7 Å²	17.7	23%	0.226	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	138	-176.9	-61.6	-62.2	-176.5	-163.4	-2.2	110.4	E75 A509 A510 V543 I630	E75-R545 IonicContact OE1-CZ 2.67Å; E75-R545 IonicContact OE1-NH1 2.93Å; E75-R545 PolarHBondContact OE1-NH1 3.06Å; E75-R545 IonicContact OE1-NH2 3.31Å; E75-R545 PolarHBondContact OE1-NH2 3.46Å; A509-R545 WeakPolarHBondContact CA-O 3.23Å; A509-R545 HydrophobicContact CB-CB 4.44Å; A510-R545 PolarHBondContact N-O 2.9Å; V543-R545 WeakPolarHBondContact CG1-O 3.44Å; R545-I630 HydrophobicContact CB-CG2 4.22Å; R545-I630 HydrophobicContact CG-CG2 4.25Å
546	L	92.5	Very high	90.6	Very high	4 Å²	4	18.8 Å²	18.8	2%	0.021	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	121.2	-178.4	-171.9	70.4	0	0	0	109.5	A510 L512 L574 F579	A510-L546 HydrophobicContact CB-CD1 3.84Å; A510-L546 WeakPolarHBondContact O-CA 3.27Å; L512-L546 HydrophobicContact CB-CD1 4.04Å; L512-L546 HydrophobicContact CD2-CD2 4.41Å; L546-L574 HydrophobicContact CD2-CD1 3.89Å; L546-L574 HydrophobicContact CD2-CD2 3.72Å; L546-L574 HydrophobicContact CD2-CG 4.47Å; L546-F579 HydrophobicContact CB-CD1 4.09Å; L546-F579 HydrophobicContact CB-CE1 4.11Å; L546-F579 HydrophobicContact CD2-CD1 4.29Å; L546-F579 HydrophobicContact CD2-CD2 4.19Å; L546-F579 HydrophobicContact CD2-CE1 4.11Å; L546-F579 HydrophobicContact CD2-CE2 4Å; L546-F579 HydrophobicContact CD2-CG 4.32Å; L546-F579 HydrophobicContact CD2-CZ 3.95Å
547	I	94.2	Very high	90.6	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	136.2	170.6	-59.8	175.2	0	0	0	107.7	A510 L511 L512 M583 L623 L626 I627 I630	A510-I547 PolarHBondContact O-N 3.07Å; L511-I547 CarbonylContact C-O 3.56Å; L511-I547 HydrophobicContact CD1-CB 3.9Å; L511-I547 HydrophobicContact CD1-CG2 3.68Å; L512-I547 PolarHBondContact N-O 2.81Å; I547-M583 HydrophobicContact CD1-CE 4.03Å; I547-M583 HydrophobicContact CG1-CE 3.88Å; I547-L623 HydrophobicContact CG2-CD1 4.36Å; I547-L626 HydrophobicContact CD1-CB 4.16Å; I547-L626 WeakPolarHBondContact CD1-O 3.4Å; I547-I627 HydrophobicContact CD1-CG1 4.13Å; I547-I630 HydrophobicContact CD1-CD1 3.74Å; I547-I630 HydrophobicContact CD1-CG1 3.95Å
548	V	95	Very high	90.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	114	175.3	176.5	0	0	0	0	109.2	L512 I514 V550 I570 L574 V582 M583 Y584 C585	L512-V548 WeakPolarHBondContact O-CA 3.41Å; I514-V548 HydrophobicContact CD1-CG1 3.92Å; I514-V548 HydrophobicContact CG1-CG1 4.44Å; V548-V550 HydrophobicContact CG1-CG2 4.37Å; V548-I570 HydrophobicContact CG1-CD1 4.13Å; V548-I570 HydrophobicContact CG2-CG2 4.37Å; V548-L574 HydrophobicContact CG2-CD1 4.02Å; V548-V582 HydrophobicContact CG2-CG1 3.66Å; V548-M583 PolarHBondContact N-O 3.45Å; V548-Y584 HydrophobicContact CB-CD1 3.76Å; V548-Y584 HydrophobicContact CB-CE1 4.02Å; V548-Y584 HydrophobicContact CB-CG 4.4Å; V548-Y584 HydrophobicContact CG1-CD1 3.77Å; V548-Y584 HydrophobicContact CG1-CE1 3.99Å; V548-Y584 HydrophobicContact CG2-CD1 4.35Å; V548-Y584 HydrophobicContact CG2-CE1 4.13Å; V548-Y584 WeakPolarHBondContact O-CA 3.48Å; V548-C585 PolarHBondContact O-N 3.29Å
549	A	95.5	Very high	90.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	114.9	173.1	0	0	0	0	0	109.8	L421 L511 L512 V513 I514 N551 C585 V587	L421-A549 HydrophobicContact CD2-CB 4.33Å; L511-A549 HydrophobicContact CD1-CB 3.82Å; L512-A549 PolarHBondContact O-N 3.46Å; V513-A549 WeakPolarHBondContact CA-O 3.48Å; I514-A549 PolarHBondContact N-O 2.8Å; A549-N551 PolarHBondContact O-N 3.03Å; A549-C585 CarbonylContact C-O 3.47Å; A549-C585 WeakPolarHBondContact CA-O 3.46Å; A549-V587 HydrophobicContact CB-CG2 4.05Å
550	V	95.5	Very high	90.5	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	101.6	174.5	-175.4	0	0	0	0	107.5	I514 A516 V548 M553 F563 I566 C585 V587	I514-V550 CarbonylContact O-C 3.58Å; I514-V550 WeakPolarHBondContact O-CA 3.38Å; A516-V550 HydrophobicContact CB-CG1 3.97Å; V548-V550 HydrophobicContact CG1-CG2 4.37Å; V550-M553 HydrophobicContact CB-SD 4.47Å; V550-M553 HydrophobicContact CG1-CG 4.24Å; V550-M553 HydrophobicContact CG1-SD 3.66Å; V550-M553 WeakPolarHBondContact O-CG 3.46Å; V550-F563 HydrophobicContact CB-CD2 4.09Å; V550-F563 HydrophobicContact CB-CE2 4.02Å; V550-F563 HydrophobicContact CG1-CD2 4.28Å; V550-F563 HydrophobicContact CG2-CD2 4.06Å; V550-F563 HydrophobicContact CG2-CE2 3.76Å; V550-I566 HydrophobicContact CG1-CD1 4.03Å; V550-I566 HydrophobicContact CG1-CG2 4.1Å; V550-I566 HydrophobicContact CG2-CG2 3.8Å; V550-C585 PolarHBondContact N-O 3.06Å; V550-V587 PolarHBondContact O-N 2.87Å
551	N	95.2	Very high	90.7	Very high	6 Å²	6	34.8 Å²	34.8	3%	0.032	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	167.4	-174.7	-166.8	20.9	0	0	0	111.8	A416 V513 I514 A516 A549 M553 V587 G589	A416-N551 PolarHBondContact O-ND2 3.17Å; V513-N551 HydrophobicContact CG1-CB 3.74Å; I514-N551 PolarHBondContact O-N 2.89Å; A516-N551 VanDerWaalsContact CB-O 3.24Å; A516-N551 WeakPolarHBondContact CB-O 3.4Å; A516-N551 PolarHBondContact N-O 3.22Å; A549-N551 PolarHBondContact O-N 3.03Å; N551-M553 VanDerWaalsContact C-N 3.25Å; N551-M553 PolarHBondContact O-N 3.44Å; N551-V587 WeakPolarHBondContact CA-O 3.41Å; N551-V587 HydrophobicContact CB-CG2 4.01Å; N551-G589 PolarHBondContact OD1-N 3.42Å
552	K	93.1	Very high	90.9	Very high	52 Å²	52	34.6 Å²	34.6	23%	0.226	19%	0.187	C	C	.	.			trans	59.2	27.9	-169.7	-51	-162.3	-161.9	177	0	113.8	D415 N515 E520 D554 T555	D415-K552 WeakPolarHBondContact O-CE 3.46Å; D415-K552 PolarHBondContact O-NZ 3.35Å; N515-K552 WeakPolarHBondContact ND2-CE 3.47Å; N515-K552 PolarHBondContact ND2-NZ 3.37Å; N515-K552 WeakPolarHBondContact OD1-CD 3.47Å; E520-K552 IonicContact OE1-NZ 2.62Å; E520-K552 PolarHBondContact OE1-NZ 3.23Å; E520-K552 IonicContact OE2-NZ 3.26Å; E520-K552 PolarHBondContact OE2-NZ 2.91Å; K552-D554 WeakPolarHBondContact CA-OD1 3.41Å; K552-D554 PolarHBondContact O-N 2.82Å; K552-T555 HydrophobicContact CB-CG2 4.04Å; K552-T555 HydrophobicContact CD-CG2 4.39Å; K552-T555 PolarHBondContact O-N 2.87Å; K552-T555 PolarHBondContact O-OG1 3.42Å
553	M	92.2	Very high	91.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-60.8	-17.4	177.8	-75.7	-65	-53.6	0	0	113.6	A516 V550 N551 V556 E557 W558 F563 P586 V587 W617	A516-M553 HydrophobicContact CB-CG 4.35Å; A516-M553 HydrophobicContact CB-SD 3.69Å; V550-M553 HydrophobicContact CB-SD 4.47Å; V550-M553 HydrophobicContact CG1-CG 4.24Å; V550-M553 HydrophobicContact CG1-SD 3.66Å; V550-M553 WeakPolarHBondContact O-CG 3.46Å; N551-M553 VanDerWaalsContact C-N 3.25Å; N551-M553 PolarHBondContact O-N 3.44Å; M553-V556 HydrophobicContact CE-CG2 3.93Å; M553-V556 CarbonylContact O-C 3.59Å; M553-V556 WeakPolarHBondContact O-CG2 3.43Å; M553-V556 PolarHBondContact O-N 3.37Å; M553-V556 HydrophobicContact SD-CG2 4.06Å; M553-E557 PolarHBondContact O-N 3.26Å; M553-W558 HydrophobicContact CB-CD2 3.98Å; M553-W558 HydrophobicContact CB-CE3 3.38Å; M553-W558 HydrophobicContact CB-CH2 3.82Å; M553-W558 HydrophobicContact CB-CZ2 4.35Å; M553-W558 HydrophobicContact CB-CZ3 3.3Å; M553-W558 HydrophobicContact CG-CE3 4.21Å; M553-W558 HydrophobicContact CG-CZ3 4.03Å; M553-W558 PolarHBondContact O-N 3.47Å; M553-F563 HydrophobicContact CE-CB 4.18Å; M553-F563 HydrophobicContact SD-CD2 4.34Å; M553-P586 HydrophobicContact CG-CB 3.98Å; M553-V587 PolarHBondContact N-O 2.89Å; M553-W617 HydrophobicContact CE-CZ2 4.38Å
554	D	89.8	Confident	91.8	Very high	49 Å²	49	37.7 Å²	37.7	26%	0.262	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-63	-33.2	167.7	47.8	-68.9	0	0	0	114.2	K552 V556 E557 S588 V591	K552-D554 WeakPolarHBondContact CA-OD1 3.41Å; K552-D554 PolarHBondContact O-N 2.82Å; D554-V556 PolarHBondContact O-N 2.85Å; D554-E557 PolarHBondContact O-N 2.92Å; D554-S588 WeakPolarHBondContact OD1-CB 3.44Å; D554-S588 PolarHBondContact OD1-OG 3.46Å; D554-V591 HydrophobicContact CB-CG2 4.29Å
555	T	91.1	Very high	92.5	Very high	72 Å²	72	39.5 Å²	39.5	44%	0.442	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-73.4	-11.2	177.3	69	0	0	0	0	113.3	T517 K552	T517-T555 PolarHBondContact OG1-OG1 2.93Å; K552-T555 HydrophobicContact CB-CG2 4.04Å; K552-T555 HydrophobicContact CD-CG2 4.39Å; K552-T555 PolarHBondContact O-N 2.87Å; K552-T555 PolarHBondContact O-OG1 3.42Å
556	V	90.2	Very high	92.8	Very high	23 Å²	23	36.7 Å²	36.7	14%	0.139	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-120.6	23.2	177.5	-60.8	0	0	0	0	112	A516 M553 D554 W558 C559 R562	A516-V556 HydrophobicContact CB-CG2 3.89Å; M553-V556 HydrophobicContact CE-CG2 3.93Å; M553-V556 CarbonylContact O-C 3.59Å; M553-V556 WeakPolarHBondContact O-CG2 3.43Å; M553-V556 PolarHBondContact O-N 3.37Å; M553-V556 HydrophobicContact SD-CG2 4.06Å; D554-V556 PolarHBondContact O-N 2.85Å; V556-W558 PolarHBondContact O-N 2.76Å; V556-C559 WeakPolarHBondContact O-CB 3.33Å; V556-C559 PolarHBondContact O-N 3.17Å; V556-R562 HydrophobicContact CG1-CG 4.37Å
557	E	88.2	Confident	92.9	Very high	162 Å²	162	39.7 Å²	39.7	76%	0.757	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	31.8	174.1	-58.3	-177	161.3	0	0	114.4	M553 D554 C559	M553-E557 PolarHBondContact O-N 3.26Å; D554-E557 PolarHBondContact O-N 2.92Å; E557-C559 PolarHBondContact O-N 2.89Å
558	W	88.4	Confident	92.9	Very high	10 Å²	10	44.3 Å²	44.3	4%	0.038	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	26	-175.2	-56.9	94.3	0	0	0	114.9	M553 V556 Q560 P586 A593 N613 L614 W617	M553-W558 HydrophobicContact CB-CD2 3.98Å; M553-W558 HydrophobicContact CB-CE3 3.38Å; M553-W558 HydrophobicContact CB-CH2 3.82Å; M553-W558 HydrophobicContact CB-CZ2 4.35Å; M553-W558 HydrophobicContact CB-CZ3 3.3Å; M553-W558 HydrophobicContact CG-CE3 4.21Å; M553-W558 HydrophobicContact CG-CZ3 4.03Å; M553-W558 PolarHBondContact O-N 3.47Å; V556-W558 PolarHBondContact O-N 2.76Å; W558-Q560 PolarHBondContact O-N 3.38Å; W558-P586 HydrophobicContact CZ3-CB 4.46Å; W558-A593 HydrophobicContact CH2-CB 3.55Å; W558-A593 HydrophobicContact CZ2-CB 3.63Å; W558-N613 HydrophobicContact CB-CB 4.32Å; W558-L614 HydrophobicContact CD2-CB 4.2Å; W558-L614 HydrophobicContact CD2-CD1 4.37Å; W558-L614 HydrophobicContact CE3-CB 3.97Å; W558-L614 HydrophobicContact CE3-CD1 3.39Å; W558-L614 HydrophobicContact CE3-CG 4.23Å; W558-L614 HydrophobicContact CG-CB 4.49Å; W558-L614 HydrophobicContact CH2-CD1 4.16Å; W558-L614 HydrophobicContact CZ3-CD1 3.26Å; W558-L614 HydrophobicContact CZ3-CG 4.48Å; W558-W617 PolarHBondContact O-NE1 2.61Å
559	C	90.2	Very high	92.8	Very high	55 Å²	55	47.4 Å²	47.4	37%	0.372	25%	0.252	S	S	.	.			trans	-65.6	114.4	-175.3	-173.6	0	0	0	0	113.5	V556 E557 S561 R562 F563	V556-C559 WeakPolarHBondContact O-CB 3.33Å; V556-C559 PolarHBondContact O-N 3.17Å; E557-C559 PolarHBondContact O-N 2.89Å; C559-S561 VanDerWaalsContact C-N 3.32Å; C559-S561 PolarHBondContact O-N 3.01Å; C559-S561 PolarHBondContact SG-OG 3.4Å; C559-R562 PolarHBondContact O-N 2.91Å; C559-F563 PolarHBondContact O-N 2.7Å
560	Q	91.8	Very high	92.6	Very high	90 Å²	90	47.5 Å²	47.5	42%	0.421	25%	0.252	S	S	.	.	H	α-helix	trans	-58.5	-36.8	-177.9	-173.4	-177.8	26.5	0	0	113.6	W558 R562 F563 N564 W617	W558-Q560 PolarHBondContact O-N 3.38Å; Q560-R562 PolarHBondContact O-N 3.27Å; Q560-F563 PolarHBondContact O-N 2.72Å; Q560-N564 VanDerWaalsContact O-CG 3.29Å; Q560-N564 PolarHBondContact O-N 3.05Å; Q560-N564 PolarHBondContact O-OD1 3.22Å; Q560-W617 HydrophobicContact CB-CD2 3.78Å; Q560-W617 HydrophobicContact CB-CE3 4.2Å; Q560-W617 HydrophobicContact CB-CG 4.01Å; Q560-W617 HydrophobicContact CB-CZ2 4.33Å; Q560-W617 HydrophobicContact CG-CB 4.49Å; Q560-W617 HydrophobicContact CG-CD2 3.72Å; Q560-W617 HydrophobicContact CG-CE3 3.66Å; Q560-W617 HydrophobicContact CG-CG 4.1Å; Q560-W617 HydrophobicContact CG-CZ3 4.13Å
561	S	93.8	Very high	92.4	Very high	84 Å²	84	48.8 Å²	48.8	59%	0.587	26%	0.261	S	S	*	.	H	α-helix	trans	-65.7	-38.2	-177	61.9	0	0	0	0	112.2	C559 N564 E565	C559-S561 VanDerWaalsContact C-N 3.32Å; C559-S561 PolarHBondContact O-N 3.01Å; C559-S561 PolarHBondContact SG-OG 3.4Å; S561-N564 PolarHBondContact O-N 3.13Å; S561-E565 WeakPolarHBondContact O-CB 3.34Å; S561-E565 PolarHBondContact O-N 3.12Å
562	R	93.9	Very high	92.2	Very high	8 Å²	8	52.2 Å²	52.2	3%	0.03	29%	0.286	C	S	.	.	H	α-helix	trans	-67.1	-39.6	173.2	-179.4	54.1	169.3	-174.3	-0.9	111.6	A516 T517 E522 V556 C559 Q560 E565 I566	A516-R562 PolarHBondContact O-NE 3.18Å; A516-R562 PolarHBondContact O-NH2 2.72Å; T517-R562 PolarHBondContact O-NH2 3.35Å; E522-R562 IonicContact OE1-CZ 3.82Å; E522-R562 VanDerWaalsContact OE1-CZ 3.26Å; E522-R562 IonicContact OE1-NH1 3.04Å; E522-R562 PolarHBondContact OE1-NH1 3.32Å; E522-R562 IonicContact OE1-NH2 2.8Å; E522-R562 PolarHBondContact OE1-NH2 2.84Å; E522-R562 IonicContact OE2-NH2 3.68Å; E522-R562 PolarHBondContact OE2-NH2 3.27Å; V556-R562 HydrophobicContact CG1-CG 4.37Å; C559-R562 PolarHBondContact O-N 2.91Å; Q560-R562 PolarHBondContact O-N 3.27Å; R562-E565 WeakPolarHBondContact CD-OE2 3.49Å; R562-E565 IonicContact CZ-OE2 3.86Å; R562-E565 IonicContact NE-OE2 2.69Å; R562-E565 VanDerWaalsContact NH1-CD 3.33Å; R562-E565 IonicContact NH1-OE1 3.39Å; R562-E565 PolarHBondContact NH1-OE1 3.26Å; R562-E565 IonicContact NH1-OE2 2.7Å; R562-E565 PolarHBondContact NH1-OE2 3.22Å; R562-E565 PolarHBondContact O-N 3.13Å; R562-I566 HydrophobicContact CG-CD1 3.83Å; R562-I566 HydrophobicContact CG-CG1 4.47Å; R562-I566 VanDerWaalsContact O-CB 3.31Å; R562-I566 WeakPolarHBondContact O-CB 3.48Å; R562-I566 WeakPolarHBondContact O-CD1 3.47Å; R562-I566 WeakPolarHBondContact O-CG1 3.37Å; R562-I566 PolarHBondContact O-N 3.23Å
563	F	94.6	Very high	91.9	Very high	9 Å²	9	51 Å²	51	4%	0.039	28%	0.281	C	S	.	.	H	α-helix	trans	-61.4	-44.1	173.9	-179.1	-95.4	0	0	0	112.1	V550 M553 C559 Q560 I566 Q567 P586 W617	V550-F563 HydrophobicContact CB-CD2 4.09Å; V550-F563 HydrophobicContact CB-CE2 4.02Å; V550-F563 HydrophobicContact CG1-CD2 4.28Å; V550-F563 HydrophobicContact CG2-CD2 4.06Å; V550-F563 HydrophobicContact CG2-CE2 3.76Å; M553-F563 HydrophobicContact CE-CB 4.18Å; M553-F563 HydrophobicContact SD-CD2 4.34Å; C559-F563 PolarHBondContact O-N 2.7Å; Q560-F563 PolarHBondContact O-N 2.72Å; F563-I566 PolarHBondContact O-N 3.45Å; F563-Q567 VanDerWaalsContact O-CB 3.32Å; F563-Q567 WeakPolarHBondContact O-CB 3.23Å; F563-Q567 PolarHBondContact O-N 2.79Å; F563-P586 HydrophobicContact CD2-CB 3.88Å; F563-P586 HydrophobicContact CD2-CG 4.49Å; F563-P586 HydrophobicContact CE2-CB 3.75Å; F563-P586 HydrophobicContact CE2-CG 4.08Å; F563-P586 HydrophobicContact CZ-CG 4.39Å; F563-W617 HydrophobicContact CB-CH2 3.75Å; F563-W617 HydrophobicContact CB-CZ2 4.42Å; F563-W617 HydrophobicContact CB-CZ3 4.45Å; F563-W617 AromaticContact CD1-CH2 3.73Å; F563-W617 HydrophobicContact CD1-CH2 3.73Å; F563-W617 AromaticContact CD1-CZ3 3.72Å; F563-W617 HydrophobicContact CD1-CZ3 3.72Å; F563-W617 HydrophobicContact CD2-CH2 4.2Å; F563-W617 HydrophobicContact CE1-CH2 4.37Å; F563-W617 HydrophobicContact CE1-CZ3 4.17Å; F563-W617 AromaticContact CG-CH2 3.62Å; F563-W617 HydrophobicContact CG-CH2 3.62Å; F563-W617 HydrophobicContact CG-CZ3 4.13Å
564	N	94.8	Very high	91.8	Very high	67 Å²	67	51.1 Å²	51.1	36%	0.358	28%	0.281	S	S	.	.	H	α-helix	trans	-66.9	-38.1	178.4	-67.7	-7.1	0	0	0	112.4	Q560 S561 T568	Q560-N564 VanDerWaalsContact O-CG 3.29Å; Q560-N564 PolarHBondContact O-N 3.05Å; Q560-N564 PolarHBondContact O-OD1 3.22Å; S561-N564 PolarHBondContact O-N 3.13Å; N564-T568 WeakPolarHBondContact O-CB 3.33Å; N564-T568 PolarHBondContact O-N 2.75Å; N564-T568 PolarHBondContact O-OG1 3.08Å
565	E	94.8	Very high	91.6	Very high	77 Å²	77	55.6 Å²	55.6	36%	0.36	30%	0.298	S	S	.	.	H	α-helix	trans	-59.1	-54.3	172.2	-173.5	-152.5	166.2	0	0	110.7	S561 R562 Q567 T568 Q569	S561-E565 WeakPolarHBondContact O-CB 3.34Å; S561-E565 PolarHBondContact O-N 3.12Å; R562-E565 WeakPolarHBondContact CD-OE2 3.49Å; R562-E565 IonicContact CZ-OE2 3.86Å; R562-E565 IonicContact NE-OE2 2.69Å; R562-E565 VanDerWaalsContact NH1-CD 3.33Å; R562-E565 IonicContact NH1-OE1 3.39Å; R562-E565 PolarHBondContact NH1-OE1 3.26Å; R562-E565 IonicContact NH1-OE2 2.7Å; R562-E565 PolarHBondContact NH1-OE2 3.22Å; R562-E565 PolarHBondContact O-N 3.13Å; E565-Q567 PolarHBondContact O-N 3.2Å; E565-T568 WeakPolarHBondContact O-CB 3.36Å; E565-T568 PolarHBondContact O-N 3.49Å; E565-T568 VanDerWaalsContact O-N 3.14Å; E565-Q569 PolarHBondContact O-N 3.03Å; E565-Q569 PolarHBondContact OE1-NE2 3.24Å
566	I	95	Very high	91.2	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-53.9	-52.1	177.4	-75.4	171.3	0	0	0	110.3	A516 F521 V550 R562 F563 T568 Q569 I570	A516-I566 HydrophobicContact CB-CD1 4.27Å; F521-I566 HydrophobicContact CD1-CG1 4.14Å; F521-I566 HydrophobicContact CD2-CD1 4.42Å; F521-I566 HydrophobicContact CD2-CG1 4.02Å; F521-I566 HydrophobicContact CD2-CG2 4.44Å; F521-I566 HydrophobicContact CE1-CG1 3.89Å; F521-I566 HydrophobicContact CE2-CB 4.1Å; F521-I566 HydrophobicContact CE2-CG1 3.77Å; F521-I566 HydrophobicContact CE2-CG2 3.76Å; F521-I566 HydrophobicContact CG-CG1 4.2Å; F521-I566 HydrophobicContact CZ-CB 4Å; F521-I566 HydrophobicContact CZ-CG1 3.7Å; F521-I566 HydrophobicContact CZ-CG2 4.12Å; V550-I566 HydrophobicContact CG1-CD1 4.03Å; V550-I566 HydrophobicContact CG1-CG2 4.1Å; V550-I566 HydrophobicContact CG2-CG2 3.8Å; R562-I566 HydrophobicContact CG-CD1 3.83Å; R562-I566 HydrophobicContact CG-CG1 4.47Å; R562-I566 VanDerWaalsContact O-CB 3.31Å; R562-I566 WeakPolarHBondContact O-CB 3.48Å; R562-I566 WeakPolarHBondContact O-CD1 3.47Å; R562-I566 WeakPolarHBondContact O-CG1 3.37Å; R562-I566 PolarHBondContact O-N 3.23Å; F563-I566 PolarHBondContact O-N 3.45Å; I566-T568 VanDerWaalsContact C-N 3.31Å; I566-T568 PolarHBondContact O-N 3.02Å; I566-Q569 PolarHBondContact O-N 3.39Å; I566-I570 HydrophobicContact CG2-CD1 3.41Å; I566-I570 VanDerWaalsContact CG2-CD1 3.41Å; I566-I570 HydrophobicContact CG2-CG1 4.5Å; I566-I570 WeakPolarHBondContact O-CB 3.49Å; I566-I570 VanDerWaalsContact O-CD1 3.27Å; I566-I570 WeakPolarHBondContact O-CD1 3.12Å; I566-I570 WeakPolarHBondContact O-CG1 3.35Å; I566-I570 PolarHBondContact O-N 3.44Å
567	Q	93.9	Very high	90.7	Very high	67 Å²	67	53.7 Å²	53.7	31%	0.313	29%	0.288	S	S	.	.	H	α-helix	trans	-57.5	-42.3	178.2	-174.1	-179.3	32.5	0	0	111.9	F563 E565 S571 Y584	F563-Q567 VanDerWaalsContact O-CB 3.32Å; F563-Q567 WeakPolarHBondContact O-CB 3.23Å; F563-Q567 PolarHBondContact O-N 2.79Å; E565-Q567 PolarHBondContact O-N 3.2Å; Q567-S571 WeakPolarHBondContact O-CB 3.47Å; Q567-S571 PolarHBondContact O-N 3.4Å; Q567-Y584 HydrophobicContact CB-CD1 4.39Å; Q567-Y584 HydrophobicContact CB-CE1 4.44Å; Q567-Y584 HydrophobicContact CG-CD1 3.85Å; Q567-Y584 HydrophobicContact CG-CD2 4.13Å; Q567-Y584 HydrophobicContact CG-CE1 3.87Å; Q567-Y584 HydrophobicContact CG-CE2 4.15Å; Q567-Y584 HydrophobicContact CG-CG 3.98Å
568	T	94.1	Very high	90.3	Very high	98 Å²	98	47.9 Å²	47.9	60%	0.601	26%	0.262	S	S	*	.	H	α-helix	trans	-64.8	-49	-179.7	-60.7	0	0	0	0	111.5	N564 E565 I566 S571 S572	N564-T568 WeakPolarHBondContact O-CB 3.33Å; N564-T568 PolarHBondContact O-N 2.75Å; N564-T568 PolarHBondContact O-OG1 3.08Å; E565-T568 WeakPolarHBondContact O-CB 3.36Å; E565-T568 PolarHBondContact O-N 3.49Å; E565-T568 VanDerWaalsContact O-N 3.14Å; I566-T568 VanDerWaalsContact C-N 3.31Å; I566-T568 PolarHBondContact O-N 3.02Å; T568-S571 PolarHBondContact O-N 3.28Å; T568-S572 PolarHBondContact O-N 2.75Å
569	Q	92.5	Very high	89.7	Confident	65 Å²	65	48.5 Å²	48.5	30%	0.304	27%	0.265	S	S	.	.	H	α-helix	trans	-60.5	-50.6	177.8	-65.5	-168.4	35.4	0	0	111.1	F521 E565 I566 S571 S572 F573	F521-Q569 HydrophobicContact CZ-CB 4.2Å; E565-Q569 PolarHBondContact O-N 3.03Å; E565-Q569 PolarHBondContact OE1-NE2 3.24Å; I566-Q569 PolarHBondContact O-N 3.39Å; Q569-S571 VanDerWaalsContact C-N 3.35Å; Q569-S571 PolarHBondContact O-N 2.78Å; Q569-S572 PolarHBondContact O-N 2.75Å; Q569-S572 PolarHBondContact O-OG 3.44Å; Q569-F573 PolarHBondContact O-N 2.92Å
570	I	92.6	Very high	88.9	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-62.2	-40.9	178.6	-61.5	157.5	0	0	0	111.3	I514 F521 I525 V548 I566 S572 F573 L574 Y584	I514-I570 HydrophobicContact CD1-CD1 3.49Å; I514-I570 VanDerWaalsContact CD1-CD1 3.49Å; I514-I570 HydrophobicContact CD1-CG1 3.85Å; I514-I570 HydrophobicContact CD1-CG2 4.32Å; I514-I570 HydrophobicContact CG2-CD1 4.23Å; F521-I570 HydrophobicContact CE2-CD1 4.21Å; F521-I570 HydrophobicContact CE2-CG1 4.27Å; I525-I570 HydrophobicContact CD1-CG1 3.92Å; V548-I570 HydrophobicContact CG1-CD1 4.13Å; V548-I570 HydrophobicContact CG2-CG2 4.37Å; I566-I570 HydrophobicContact CG2-CD1 3.41Å; I566-I570 VanDerWaalsContact CG2-CD1 3.41Å; I566-I570 HydrophobicContact CG2-CG1 4.5Å; I566-I570 WeakPolarHBondContact O-CB 3.49Å; I566-I570 VanDerWaalsContact O-CD1 3.27Å; I566-I570 WeakPolarHBondContact O-CD1 3.12Å; I566-I570 WeakPolarHBondContact O-CG1 3.35Å; I566-I570 PolarHBondContact O-N 3.44Å; I570-S572 VanDerWaalsContact C-N 3.34Å; I570-S572 PolarHBondContact O-N 2.73Å; I570-F573 PolarHBondContact O-N 2.63Å; I570-F573 VanDerWaalsContact O-N 3.17Å; I570-L574 HydrophobicContact CG2-CD1 3.51Å; I570-L574 HydrophobicContact CG2-CG 3.87Å; I570-L574 WeakPolarHBondContact O-CG 2.98Å; I570-L574 PolarHBondContact O-N 3.03Å; I570-Y584 HydrophobicContact CB-CE1 4.17Å; I570-Y584 HydrophobicContact CD1-CE1 4.48Å; I570-Y584 HydrophobicContact CG2-CE1 3.94Å
571	S	91.5	Very high	88.2	Confident	28 Å²	28	46.6 Å²	46.6	20%	0.196	27%	0.272	C	S	.	.	H	α-helix	trans	-61.4	-43.2	179	-171.8	0	0	0	0	111.3	Q567 T568 Q569 F573 K575 Y584	Q567-S571 WeakPolarHBondContact O-CB 3.47Å; Q567-S571 PolarHBondContact O-N 3.4Å; T568-S571 PolarHBondContact O-N 3.28Å; Q569-S571 VanDerWaalsContact C-N 3.35Å; Q569-S571 PolarHBondContact O-N 2.78Å; S571-F573 VanDerWaalsContact C-N 3.28Å; S571-F573 PolarHBondContact O-N 2.8Å; S571-K575 WeakPolarHBondContact O-CB 3.23Å; S571-K575 VanDerWaalsContact O-CD 3.31Å; S571-K575 WeakPolarHBondContact O-CD 3.42Å; S571-K575 WeakPolarHBondContact O-CG 3.41Å; S571-K575 PolarHBondContact O-N 3.44Å; S571-K575 WeakPolarHBondContact OG-CE 3.45Å; S571-K575 PolarHBondContact OG-NZ 3.26Å; S571-Y584 WeakPolarHBondContact CA-OH 3.35Å; S571-Y584 PolarHBondContact N-OH 3.42Å
572	S	89.6	Confident	87.8	Confident	79 Å²	79	44.1 Å²	44.1	55%	0.552	25%	0.253	S	S	*	.	H	α-helix	trans	-59.6	-40.4	175.1	80.6	0	0	0	0	112.1	T568 Q569 I570 S576	T568-S572 PolarHBondContact O-N 2.75Å; Q569-S572 PolarHBondContact O-N 2.75Å; Q569-S572 PolarHBondContact O-OG 3.44Å; I570-S572 VanDerWaalsContact C-N 3.34Å; I570-S572 PolarHBondContact O-N 2.73Å; S572-S576 PolarHBondContact O-N 3.21Å
573	F	88.2	Confident	87.6	Confident	26 Å²	26	46.6 Å²	46.6	11%	0.114	27%	0.265	C	S	.	.	H	α-helix	trans	-70.9	-48.9	179.8	169.4	-117.2	0	0	0	112.7	R532 A535 Q569 I570 S571 K575 S576 M577	R532-F573 HydrophobicContact CB-CZ 4.12Å; R532-F573 HydrophobicContact CG-CD2 4.28Å; R532-F573 HydrophobicContact CG-CE1 4.23Å; R532-F573 HydrophobicContact CG-CE2 3.38Å; R532-F573 HydrophobicContact CG-CZ 3.35Å; A535-F573 HydrophobicContact CB-CE1 3.73Å; A535-F573 HydrophobicContact CB-CZ 4.1Å; Q569-F573 PolarHBondContact O-N 2.92Å; I570-F573 PolarHBondContact O-N 2.63Å; I570-F573 VanDerWaalsContact O-N 3.17Å; S571-F573 VanDerWaalsContact C-N 3.28Å; S571-F573 PolarHBondContact O-N 2.8Å; F573-K575 VanDerWaalsContact C-N 3.31Å; F573-K575 PolarHBondContact O-N 3Å; F573-S576 WeakPolarHBondContact O-CB 3.45Å; F573-S576 PolarHBondContact O-N 2.81Å; F573-S576 PolarHBondContact O-OG 2.86Å; F573-M577 HydrophobicContact CE1-CE 4.35Å; F573-M577 HydrophobicContact CE1-SD 4.16Å; F573-M577 HydrophobicContact CE2-CE 3.42Å; F573-M577 VanDerWaalsContact CE2-CE 3.42Å; F573-M577 HydrophobicContact CE2-SD 4.02Å; F573-M577 HydrophobicContact CZ-CE 3.27Å; F573-M577 HydrophobicContact CZ-SD 3.6Å; F573-M577 VanDerWaalsContact CZ-SD 3.6Å; F573-M577 PolarHBondContact O-N 3.04Å
574	L	88.9	Confident	87.5	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-68.5	-29	-179.8	-65	177.7	0	0	0	112.6	A535 L546 V548 I570 S576 M577 N578 F579 V582	A535-L574 HydrophobicContact CB-CD2 4.14Å; L546-L574 HydrophobicContact CD2-CD1 3.89Å; L546-L574 HydrophobicContact CD2-CD2 3.72Å; L546-L574 HydrophobicContact CD2-CG 4.47Å; V548-L574 HydrophobicContact CG2-CD1 4.02Å; I570-L574 HydrophobicContact CG2-CD1 3.51Å; I570-L574 HydrophobicContact CG2-CG 3.87Å; I570-L574 WeakPolarHBondContact O-CG 2.98Å; I570-L574 PolarHBondContact O-N 3.03Å; L574-S576 VanDerWaalsContact C-N 3.32Å; L574-S576 PolarHBondContact O-N 3.02Å; L574-M577 CarbonylContact O-C 3.59Å; L574-M577 WeakPolarHBondContact O-CA 3.22Å; L574-M577 PolarHBondContact O-N 2.76Å; L574-M577 VanDerWaalsContact O-N 3.07Å; L574-N578 PolarHBondContact O-N 2.73Å; L574-N578 VanDerWaalsContact O-N 3.17Å; L574-F579 HydrophobicContact CB-CD2 4.34Å; L574-F579 HydrophobicContact CD2-CD2 3.82Å; L574-F579 HydrophobicContact CD2-CE2 3.96Å; L574-F579 PolarHBondContact O-N 2.83Å; L574-V582 HydrophobicContact CD1-CB 4.44Å; L574-V582 HydrophobicContact CD1-CG1 3.75Å; L574-V582 HydrophobicContact CD1-CG2 4.01Å
575	K	86.2	Confident	87.4	Confident	143 Å²	143	44.4 Å²	44.4	62%	0.622	25%	0.252	S	S	*	.	H	α-helix	trans	-59.1	-40.8	167.5	-77.4	164.3	179.4	153	0	111.7	S571 F573 M577 N578	S571-K575 WeakPolarHBondContact O-CB 3.23Å; S571-K575 VanDerWaalsContact O-CD 3.31Å; S571-K575 WeakPolarHBondContact O-CD 3.42Å; S571-K575 WeakPolarHBondContact O-CG 3.41Å; S571-K575 PolarHBondContact O-N 3.44Å; S571-K575 WeakPolarHBondContact OG-CE 3.45Å; S571-K575 PolarHBondContact OG-NZ 3.26Å; F573-K575 VanDerWaalsContact C-N 3.31Å; F573-K575 PolarHBondContact O-N 3Å; K575-M577 PolarHBondContact O-N 2.77Å; K575-N578 PolarHBondContact O-N 3.24Å
576	S	82.2	Confident	87.4	Confident	45 Å²	45	40.7 Å²	40.7	32%	0.315	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-13.6	174.9	82	0	0	0	0	114.5	S572 F573 L574	S572-S576 PolarHBondContact O-N 3.21Å; F573-S576 WeakPolarHBondContact O-CB 3.45Å; F573-S576 PolarHBondContact O-N 2.81Å; F573-S576 PolarHBondContact O-OG 2.86Å; L574-S576 VanDerWaalsContact C-N 3.32Å; L574-S576 PolarHBondContact O-N 3.02Å
577	M	79.1	Confident	87.3	Confident	10 Å²	10	40.7 Å²	40.7	5%	0.049	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	1.3	173.9	-65.7	-171.4	162.3	0	0	113.3	F69 A535 R536 R539 F573 L574 K575 F579	F69-M577 HydrophobicContact CZ-CB 4.4Å; A535-M577 HydrophobicContact CB-SD 4.01Å; R536-M577 HydrophobicContact CB-CE 3.51Å; R536-M577 HydrophobicContact CB-SD 4.39Å; R536-M577 HydrophobicContact CG-CE 3.76Å; R539-M577 WeakPolarHBondContact CD-O 3.38Å; R539-M577 WeakPolarHBondContact CG-O 3.49Å; R539-M577 PolarHBondContact NE-O 2.87Å; R539-M577 VanDerWaalsContact NE-O 3.13Å; F573-M577 HydrophobicContact CE1-CE 4.35Å; F573-M577 HydrophobicContact CE1-SD 4.16Å; F573-M577 HydrophobicContact CE2-CE 3.42Å; F573-M577 VanDerWaalsContact CE2-CE 3.42Å; F573-M577 HydrophobicContact CE2-SD 4.02Å; F573-M577 HydrophobicContact CZ-CE 3.27Å; F573-M577 HydrophobicContact CZ-SD 3.6Å; F573-M577 VanDerWaalsContact CZ-SD 3.6Å; F573-M577 PolarHBondContact O-N 3.04Å; L574-M577 CarbonylContact O-C 3.59Å; L574-M577 WeakPolarHBondContact O-CA 3.22Å; L574-M577 PolarHBondContact O-N 2.76Å; L574-M577 VanDerWaalsContact O-N 3.07Å; K575-M577 PolarHBondContact O-N 2.77Å; M577-F579 HydrophobicContact CB-CD2 3.8Å; M577-F579 HydrophobicContact CB-CE2 3.93Å; M577-F579 PolarHBondContact O-N 2.69Å; M577-F579 HydrophobicContact SD-CE2 4.28Å
578	N	80.1	Confident	87.3	Confident	41 Å²	41	37.5 Å²	37.5	22%	0.219	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	47.4	178	-52.2	-89.6	0	0	0	112.7	F64 T65 A66 F69 R539 L574 K575	F64-N578 PolarHBondContact O-ND2 2.82Å; T65-N578 VanDerWaalsContact C-ND2 3.32Å; T65-N578 PolarHBondContact O-ND2 3.12Å; A66-N578 HydrophobicContact CB-CB 4.15Å; A66-N578 VanDerWaalsContact N-CG 3.3Å; A66-N578 PolarHBondContact N-OD1 3.1Å; F69-N578 HydrophobicContact CD2-CB 4.49Å; F69-N578 WeakPolarHBondContact CE2-ND2 3.36Å; R539-N578 PolarHBondContact NE-O 2.96Å; R539-N578 PolarHBondContact NH2-O 2.91Å; L574-N578 PolarHBondContact O-N 2.73Å; L574-N578 VanDerWaalsContact O-N 3.17Å; K575-N578 PolarHBondContact O-N 3.24Å
579	F	76.9	Confident	87.1	Confident	23 Å²	23	32.9 Å²	32.9	10%	0.101	19%	0.191	C	C	.	.			trans	-85.8	128.3	163.6	-76.1	-79.3	0	0	0	110.1	A535 A538 R539 L546 L574 M577 V582	A535-F579 WeakPolarHBondContact O-CZ 3.05Å; A538-F579 HydrophobicContact CB-CZ 4.37Å; R539-F579 HydrophobicContact CB-CE1 4.22Å; R539-F579 HydrophobicContact CB-CE2 3.83Å; R539-F579 HydrophobicContact CB-CZ 3.55Å; R539-F579 HydrophobicContact CG-CE2 4.26Å; R539-F579 HydrophobicContact CG-CZ 4.19Å; L546-F579 HydrophobicContact CB-CD1 4.09Å; L546-F579 HydrophobicContact CB-CE1 4.11Å; L546-F579 HydrophobicContact CD2-CD1 4.29Å; L546-F579 HydrophobicContact CD2-CD2 4.19Å; L546-F579 HydrophobicContact CD2-CE1 4.11Å; L546-F579 HydrophobicContact CD2-CE2 4Å; L546-F579 HydrophobicContact CD2-CG 4.32Å; L546-F579 HydrophobicContact CD2-CZ 3.95Å; L574-F579 HydrophobicContact CB-CD2 4.34Å; L574-F579 HydrophobicContact CD2-CD2 3.82Å; L574-F579 HydrophobicContact CD2-CE2 3.96Å; L574-F579 PolarHBondContact O-N 2.83Å; M577-F579 HydrophobicContact CB-CD2 3.8Å; M577-F579 HydrophobicContact CB-CE2 3.93Å; M577-F579 PolarHBondContact O-N 2.69Å; M577-F579 HydrophobicContact SD-CE2 4.28Å; F579-V582 HydrophobicContact CB-CG2 3.77Å
580	S	71.7	Confident	86.8	Confident	49 Å²	49	34.7 Å²	34.7	34%	0.343	20%	0.202	S	C	.	.			trans	-93.4	151.9	168.3	62.7	0	0	0	0	111	E75 V582	E75-S580 PolarHBondContact OE1-OG 2.88Å; E75-S580 WeakPolarHBondContact OE2-CB 3.24Å; E75-S580 PolarHBondContact OE2-OG 3.42Å; S580-V582 PolarHBondContact O-N 3.34Å
581	G	76.9	Confident	86.6	Confident	56 Å²	56	37.6 Å²	37.6	58%	0.577	22%	0.22	S	C	*	.	S	Bend	trans	61.8	37.1	169	0	0	0	0	0	116.4	M583	G581-M583 PolarHBondContact O-N 3.19Å
582	V	86	Confident	86.3	Confident	32 Å²	32	37.1 Å²	37.1	19%	0.194	22%	0.22	C	C	.	.			trans	-70.5	126.4	176.5	-177.5	0	0	0	0	110.7	V548 L574 F579 S580 Y584	V548-V582 HydrophobicContact CG2-CG1 3.66Å; L574-V582 HydrophobicContact CD1-CB 4.44Å; L574-V582 HydrophobicContact CD1-CG1 3.75Å; L574-V582 HydrophobicContact CD1-CG2 4.01Å; F579-V582 HydrophobicContact CB-CG2 3.77Å; S580-V582 PolarHBondContact O-N 3.34Å; V582-Y584 HydrophobicContact CB-CE2 4.25Å; V582-Y584 HydrophobicContact CG1-CD2 4.4Å; V582-Y584 HydrophobicContact CG1-CE2 3.83Å
583	M	90	Very high	86.2	Confident	60 Å²	60	34.4 Å²	34.4	30%	0.296	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	144.8	177.5	-57.1	-171.4	-66.1	0	0	111	I547 V548 G581 L626	I547-M583 HydrophobicContact CD1-CE 4.03Å; I547-M583 HydrophobicContact CG1-CE 3.88Å; V548-M583 PolarHBondContact N-O 3.45Å; G581-M583 PolarHBondContact O-N 3.19Å; M583-L626 HydrophobicContact CB-CD2 3.96Å; M583-L626 HydrophobicContact CE-CB 4.35Å; M583-L626 HydrophobicContact CE-CD2 3.84Å; M583-L626 WeakPolarHBondContact CE-O 3.06Å; M583-L626 HydrophobicContact CG-CD2 4.35Å; M583-L626 HydrophobicContact SD-CD2 3.58Å; M583-L626 VanDerWaalsContact SD-CD2 3.58Å
584	Y	93.3	Very high	86.2	Confident	29 Å²	29	33.9 Å²	33.9	11%	0.114	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	133.1	-175.5	-66.2	-96.6	0	0	0	111.8	V548 Q567 I570 S571 V582 Y618	V548-Y584 HydrophobicContact CB-CD1 3.76Å; V548-Y584 HydrophobicContact CB-CE1 4.02Å; V548-Y584 HydrophobicContact CB-CG 4.4Å; V548-Y584 HydrophobicContact CG1-CD1 3.77Å; V548-Y584 HydrophobicContact CG1-CE1 3.99Å; V548-Y584 HydrophobicContact CG2-CD1 4.35Å; V548-Y584 HydrophobicContact CG2-CE1 4.13Å; V548-Y584 WeakPolarHBondContact O-CA 3.48Å; Q567-Y584 HydrophobicContact CB-CD1 4.39Å; Q567-Y584 HydrophobicContact CB-CE1 4.44Å; Q567-Y584 HydrophobicContact CG-CD1 3.85Å; Q567-Y584 HydrophobicContact CG-CD2 4.13Å; Q567-Y584 HydrophobicContact CG-CE1 3.87Å; Q567-Y584 HydrophobicContact CG-CE2 4.15Å; Q567-Y584 HydrophobicContact CG-CG 3.98Å; I570-Y584 HydrophobicContact CB-CE1 4.17Å; I570-Y584 HydrophobicContact CD1-CE1 4.48Å; I570-Y584 HydrophobicContact CG2-CE1 3.94Å; S571-Y584 WeakPolarHBondContact CA-OH 3.35Å; S571-Y584 PolarHBondContact N-OH 3.42Å; V582-Y584 HydrophobicContact CB-CE2 4.25Å; V582-Y584 HydrophobicContact CG1-CD2 4.4Å; V582-Y584 HydrophobicContact CG1-CE2 3.83Å; Y584-Y618 PolarHBondContact O-OH 3.05Å; Y584-Y618 VanDerWaalsContact O-OH 3.07Å
585	C	92.7	Very high	86.1	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	119.3	-175.6	-168.9	0	0	0	0	111.5	V548 A549 V550 V587 N594 L626	V548-C585 PolarHBondContact O-N 3.29Å; A549-C585 CarbonylContact C-O 3.47Å; A549-C585 WeakPolarHBondContact CA-O 3.46Å; V550-C585 PolarHBondContact N-O 3.06Å; C585-V587 HydrophobicContact CB-CG1 4.45Å; C585-V587 VanDerWaalsContact SG-CG1 3.59Å; C585-N594 PolarHBondContact SG-ND2 3.1Å; C585-L626 HydrophobicContact CB-CD1 3.51Å
586	P	94.4	Very high	86.1	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	130.6	166.8	30.5	-28.8	0	0	0	109.4	M553 W558 F563 N594 L614 W617 Y618	M553-P586 HydrophobicContact CG-CB 3.98Å; W558-P586 HydrophobicContact CZ3-CB 4.46Å; F563-P586 HydrophobicContact CD2-CB 3.88Å; F563-P586 HydrophobicContact CD2-CG 4.49Å; F563-P586 HydrophobicContact CE2-CB 3.75Å; F563-P586 HydrophobicContact CE2-CG 4.08Å; F563-P586 HydrophobicContact CZ-CG 4.39Å; P586-N594 WeakPolarHBondContact O-CB 3.38Å; P586-N594 PolarHBondContact O-ND2 2.81Å; P586-L614 HydrophobicContact CB-CD1 4.29Å; P586-L614 HydrophobicContact CG-CD1 4.01Å; P586-W617 HydrophobicContact CB-CH2 4.28Å; P586-W617 HydrophobicContact CG-CH2 4.07Å; P586-Y618 HydrophobicContact CG-CD1 4.06Å; P586-Y618 HydrophobicContact CG-CD2 3.57Å; P586-Y618 HydrophobicContact CG-CE1 4.23Å; P586-Y618 HydrophobicContact CG-CE2 3.77Å; P586-Y618 HydrophobicContact CG-CG 3.71Å
587	V	93.2	Very high	85.8	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	17%	0.165	C	C	.	.			trans	-142.1	163.2	-177.8	-61.5	0	0	0	0	111.6	L421 A549 V550 N551 M553 C585 N594 L595 L623	L421-V587 HydrophobicContact CD1-CB 4.24Å; L421-V587 HydrophobicContact CD1-CG2 3.79Å; L421-V587 HydrophobicContact CD2-CG2 4.29Å; A549-V587 HydrophobicContact CB-CG2 4.05Å; V550-V587 PolarHBondContact O-N 2.87Å; N551-V587 WeakPolarHBondContact CA-O 3.41Å; N551-V587 HydrophobicContact CB-CG2 4.01Å; M553-V587 PolarHBondContact N-O 2.89Å; C585-V587 HydrophobicContact CB-CG1 4.45Å; C585-V587 VanDerWaalsContact SG-CG1 3.59Å; V587-N594 HydrophobicContact CG1-CB 4.48Å; V587-L595 HydrophobicContact CB-CD2 3.91Å; V587-L595 HydrophobicContact CG1-CD2 4.02Å; V587-L623 HydrophobicContact CG1-CB 4.32Å; V587-L623 HydrophobicContact CG1-CD2 4.47Å
588	S	93.1	Very high	85	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-132.8	111.6	161.8	176.5	0	0	0	0	109.9	D554 L590 V591 G592 A593	D554-S588 WeakPolarHBondContact OD1-CB 3.44Å; D554-S588 PolarHBondContact OD1-OG 3.46Å; S588-L590 VanDerWaalsContact C-N 3.26Å; S588-L590 PolarHBondContact O-N 3.05Å; S588-V591 WeakPolarHBondContact OG-CG2 3.4Å; S588-V591 PolarHBondContact OG-N 3.32Å; S588-G592 WeakPolarHBondContact O-CA 3.46Å; S588-G592 PolarHBondContact O-N 3.31Å; S588-A593 PolarHBondContact N-O 2.86Å; S588-A593 PolarHBondContact O-N 2.95Å
589	G	89.7	Confident	83.5	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-17.7	179	0	0	0	0	0	114.4	N424 N551	N424-G589 WeakPolarHBondContact CB-O 3.45Å; N424-G589 PolarHBondContact ND2-O 3.3Å; N551-G589 PolarHBondContact OD1-N 3.42Å
590	L	87.4	Confident	82.3	Confident	103 Å²	103	41.2 Å²	41.2	54%	0.539	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-45.9	175.2	-173.8	63.4	0	0	0	111.6	Y454 S588	Y454-L590 HydrophobicContact CE2-CD1 4.34Å; S588-L590 VanDerWaalsContact C-N 3.26Å; S588-L590 PolarHBondContact O-N 3.05Å
591	V	87	Confident	81.3	Confident	63 Å²	63	41.3 Å²	41.3	38%	0.382	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-23.4	-179.4	-177.5	0	0	0	0	112.2	D554 S588 A593	D554-V591 HydrophobicContact CB-CG2 4.29Å; S588-V591 WeakPolarHBondContact OG-CG2 3.4Å; S588-V591 PolarHBondContact OG-N 3.32Å; V591-A593 HydrophobicContact CG1-CB 4.38Å
592	G	85.8	Confident	79.5	Confident	19 Å²	19	44 Å²	44	20%	0.196	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	11.7	-174.7	0	0	0	0	0	114	N424 S588	N424-G592 WeakPolarHBondContact ND2-CA 3.43Å; N424-G592 PolarHBondContact ND2-N 2.85Å; S588-G592 WeakPolarHBondContact O-CA 3.46Å; S588-G592 PolarHBondContact O-N 3.31Å
593	A	87.4	Confident	77.4	Confident	21 Å²	21	48 Å²	48	17%	0.174	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-73.5	135.4	-175.9	0	0	0	0	0	112.4	W558 S588 V591 L595	W558-A593 HydrophobicContact CH2-CB 3.55Å; W558-A593 HydrophobicContact CZ2-CB 3.63Å; S588-A593 PolarHBondContact N-O 2.86Å; S588-A593 PolarHBondContact O-N 2.95Å; V591-A593 HydrophobicContact CG1-CB 4.38Å; A593-L595 PolarHBondContact O-N 2.89Å
594	N	87.8	Confident	75.1	Confident	15 Å²	15	48.1 Å²	48.1	8%	0.08	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	60	17.1	-180	-157.6	28.3	0	0	0	116.3	C585 P586 V587 L614 Y618 S622 L623	C585-N594 PolarHBondContact SG-ND2 3.1Å; P586-N594 WeakPolarHBondContact O-CB 3.38Å; P586-N594 PolarHBondContact O-ND2 2.81Å; V587-N594 HydrophobicContact CG1-CB 4.48Å; N594-L614 HydrophobicContact CB-CD1 4.32Å; N594-Y618 WeakPolarHBondContact ND2-CE1 3.3Å; N594-S622 WeakPolarHBondContact OD1-CA 3.5Å; N594-L623 PolarHBondContact O-N 3.24Å
595	L	87.8	Confident	72.5	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	32%	0.321	C	S	.	.	S	Bend	trans	-78.1	-50.2	178.4	-54	-169.2	0	0	0	111.8	L421 N424 L425 L428 V587 A593 S622 L623 L624	L421-L595 HydrophobicContact CD1-CD1 4.34Å; L421-L595 HydrophobicContact CD1-CD2 3.39Å; N424-L595 HydrophobicContact CB-CD1 4.18Å; L425-L595 HydrophobicContact CD1-CB 4.28Å; L428-L595 HydrophobicContact CD1-CB 3.91Å; L428-L595 HydrophobicContact CD1-CD1 3.91Å; L428-L595 HydrophobicContact CD1-CG 4.34Å; V587-L595 HydrophobicContact CB-CD2 3.91Å; V587-L595 HydrophobicContact CG1-CD2 4.02Å; A593-L595 PolarHBondContact O-N 2.89Å; L595-S622 PolarHBondContact O-OG 3.05Å; L595-L623 HydrophobicContact CD2-CD2 4.14Å; L595-L624 WeakPolarHBondContact O-CB 3.28Å; L595-L624 PolarHBondContact O-N 3.22Å
596	V	85.8	Confident	69.9	Low	17 Å²	17	63.1 Å²	63.1	10%	0.103	36%	0.361	C	S	.	.	S	Bend	trans	-123	147.5	-175	179.7	0	0	0	0	108.7	L425 L428 L600 L624	L425-V596 HydrophobicContact CD1-CG2 3.84Å; L428-V596 HydrophobicContact CB-CG2 3.77Å; L428-V596 HydrophobicContact CD1-CG2 4.13Å; V596-L600 HydrophobicContact CG1-CB 3.69Å; V596-L600 HydrophobicContact CG1-CD1 3.93Å; V596-L600 HydrophobicContact CG1-CG 4.43Å; V596-L624 HydrophobicContact CG1-CD2 4.16Å; V596-L624 HydrophobicContact CG2-CD2 4.4Å
597	P	75.5	Confident	67.4	Low	15 Å²	15	64 Å²	64	10%	0.097	37%	0.369	C	S	.	.			trans	-59.5	142.5	-178.7	-26	37	0	0	0	112.5	N599 L600 S622 E625	P597-N599 PolarHBondContact O-N 2.94Å; P597-L600 PolarHBondContact O-N 3.27Å; P597-S622 WeakPolarHBondContact CD-OG 3.47Å; P597-E625 HydrophobicContact CG-CG 3.69Å; P597-E625 VanDerWaalsContact CG-OE1 3.23Å; P597-E625 WeakPolarHBondContact CG-OE1 3.44Å
598	Q	61.9	Low	65.1	Low	116 Å²	116	67.5 Å²	67.5	54%	0.542	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-50.9	-35	-173.9	-66.7	-177.3	-4.6	0	0	113.8	L600 S601 F615	Q598-L600 PolarHBondContact O-N 2.85Å; Q598-S601 WeakPolarHBondContact CA-OG 3.16Å; Q598-S601 PolarHBondContact O-N 3.44Å; Q598-S601 VanDerWaalsContact O-N 3.09Å; Q598-S601 PolarHBondContact O-OG 2.98Å; Q598-F615 HydrophobicContact CG-CZ 4.16Å; Q598-F615 VanDerWaalsContact NE2-CE1 3.34Å
599	N	49.1	Very low	62.8	Low	162 Å²	162	73.4 Å²	73.4	87%	0.866	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-60.8	-17.8	179.5	-62.6	-8	0	0	0	114.1	P597	P597-N599 PolarHBondContact O-N 2.94Å
600	L	52.8	Low	60.9	Low	108 Å²	108	76.4 Å²	76.4	57%	0.565	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-102.7	-18.1	177.6	-76.7	147.6	0	0	0	112.9	V596 P597 Q598 S602	V596-L600 HydrophobicContact CG1-CB 3.69Å; V596-L600 HydrophobicContact CG1-CD1 3.93Å; V596-L600 HydrophobicContact CG1-CG 4.43Å; P597-L600 PolarHBondContact O-N 3.27Å; Q598-L600 PolarHBondContact O-N 2.85Å; L600-S602 PolarHBondContact O-N 3.46Å
601	S	49.9	Very low	59.4	Low	52 Å²	52	73.4 Å²	73.4	36%	0.364	43%	0.431	S	S	.	.			trans	-80.7	43.6	-175.1	60.8	0	0	0	0	113.9	Q598 S603 S604	Q598-S601 WeakPolarHBondContact CA-OG 3.16Å; Q598-S601 PolarHBondContact O-N 3.44Å; Q598-S601 VanDerWaalsContact O-N 3.09Å; Q598-S601 PolarHBondContact O-OG 2.98Å; S601-S603 PolarHBondContact O-N 2.92Å; S601-S603 VanDerWaalsContact O-N 3.1Å; S601-S604 PolarHBondContact O-N 2.87Å
602	S	39.3	Very low	57.9	Low	111 Å²	111	73.2 Å²	73.2	78%	0.776	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-13.6	-176.2	59.4	0	0	0	0	114.9	L600	L600-S602 PolarHBondContact O-N 3.46Å
603	S	41.9	Very low	56.8	Low	117 Å²	117	76.6 Å²	76.6	82%	0.818	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-13.5	176.7	-165.9	0	0	0	0	114.2	S601 K605	S601-S603 PolarHBondContact O-N 2.92Å; S601-S603 VanDerWaalsContact O-N 3.1Å; S603-K605 PolarHBondContact O-N 3.42Å; S603-K605 VanDerWaalsContact O-N 3.16Å
604	S	41.3	Very low	55.9	Low	62 Å²	62	75.7 Å²	75.7	43%	0.434	44%	0.438	S	S	.	.			trans	-93.6	65.1	-165.7	-153.1	0	0	0	0	114.3	S601 N606 A607	S601-S604 PolarHBondContact O-N 2.87Å; S604-N606 PolarHBondContact O-N 3.4Å; S604-A607 WeakPolarHBondContact OG-CB 3.12Å
605	K	39.6	Very low	55	Low	187 Å²	187	79.2 Å²	79.2	81%	0.813	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-5.4	174.5	-71.9	-170.7	175.1	-176.1	0	114.8	S603	S603-K605 PolarHBondContact O-N 3.42Å; S603-K605 VanDerWaalsContact O-N 3.16Å
606	N	38.2	Very low	54.4	Low	157 Å²	157	84.7 Å²	84.7	84%	0.84	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.6	-0.3	-174.6	-63.7	12.7	0	0	0	113.7	S604	S604-N606 PolarHBondContact O-N 3.4Å
607	A	42.1	Very low	54.4	Low	19 Å²	19	86 Å²	86	16%	0.157	49%	0.49	C	S	.	.			trans	-105.2	11.9	-178.3	0	0	0	0	0	113.9	S604 D609 S611	S604-A607 WeakPolarHBondContact OG-CB 3.12Å; A607-D609 PolarHBondContact O-N 2.68Å; A607-S611 WeakPolarHBondContact O-CB 3.3Å; A607-S611 PolarHBondContact O-N 3.27Å; A607-S611 PolarHBondContact O-OG 2.95Å
608	S	43.5	Very low	54.9	Low	73 Å²	73	86.6 Å²	86.6	51%	0.51	49%	0.49	S	S	.	.	H	α-helix	trans	-50	-44.4	177.6	41.7	0	0	0	0	112.3	S611	S608-S611 PolarHBondContact O-OG 2.77Å
609	D	45.9	Very low	55.9	Low	124 Å²	124	88.1 Å²	88.1	66%	0.663	51%	0.508	S	S	*	.	H	α-helix	trans	-81.3	-49.2	-166.6	-55.8	14	0	0	0	109.7	A607 S611 S612	A607-D609 PolarHBondContact O-N 2.68Å; D609-S611 PolarHBondContact O-N 2.7Å; D609-S612 PolarHBondContact O-OG 3.01Å
610	T	49	Very low	57.5	Low	63 Å²	63	81.7 Å²	81.7	39%	0.387	48%	0.48	S	S	.	.	H	α-helix	trans	-69.2	-32.6	-180	-46.8	0	0	0	0	113.6	S612	T610-S612 VanDerWaalsContact C-N 3.35Å
611	S	56.1	Low	59.2	Low	40 Å²	40	79.5 Å²	79.5	28%	0.28	47%	0.472	S	S	.	.	H	α-helix	trans	-73.1	-27.6	-178.6	61.4	0	0	0	0	113.2	A607 S608 D609 N613 L614 F615	A607-S611 WeakPolarHBondContact O-CB 3.3Å; A607-S611 PolarHBondContact O-N 3.27Å; A607-S611 PolarHBondContact O-OG 2.95Å; S608-S611 PolarHBondContact O-OG 2.77Å; D609-S611 PolarHBondContact O-N 2.7Å; S611-N613 VanDerWaalsContact C-N 3.34Å; S611-N613 PolarHBondContact O-N 3.25Å; S611-L614 PolarHBondContact O-N 3Å; S611-F615 VanDerWaalsContact O-CD2 3.24Å; S611-F615 WeakPolarHBondContact O-CD2 3.23Å
612	S	55.7	Low	61.2	Low	59 Å²	59	77.3 Å²	77.3	41%	0.413	46%	0.457	S	S	.	.	H	α-helix	trans	-51.3	-49	-177.8	67.4	0	0	0	0	113	D609 T610 L614 F615 T616	D609-S612 PolarHBondContact O-OG 3.01Å; T610-S612 VanDerWaalsContact C-N 3.35Å; S612-L614 PolarHBondContact O-N 3.09Å; S612-F615 PolarHBondContact O-N 3.23Å; S612-T616 PolarHBondContact O-N 3.42Å; S612-T616 PolarHBondContact O-OG1 3.39Å; S612-T616 VanDerWaalsContact O-OG1 3.12Å
613	N	62.9	Low	63.7	Low	90 Å²	90	72 Å²	72	48%	0.481	42%	0.42	S	S	.	.	H	α-helix	trans	-64.5	-30	-175.2	-74.4	-12.7	0	0	0	114.7	W558 S611 W617	W558-N613 HydrophobicContact CB-CB 4.32Å; S611-N613 VanDerWaalsContact C-N 3.34Å; S611-N613 PolarHBondContact O-N 3.25Å; N613-W617 PolarHBondContact O-NE1 3.48Å
614	L	68.8	Low	66.1	Low	3 Å²	3	67.2 Å²	67.2	2%	0.016	39%	0.385	C	S	.	.	H	α-helix	trans	-72.4	-45.4	176.8	171.3	144.4	0	0	0	111	W558 P586 N594 S611 S612 T616 W617 Y618	W558-L614 HydrophobicContact CD2-CB 4.2Å; W558-L614 HydrophobicContact CD2-CD1 4.37Å; W558-L614 HydrophobicContact CE3-CB 3.97Å; W558-L614 HydrophobicContact CE3-CD1 3.39Å; W558-L614 HydrophobicContact CE3-CG 4.23Å; W558-L614 HydrophobicContact CG-CB 4.49Å; W558-L614 HydrophobicContact CH2-CD1 4.16Å; W558-L614 HydrophobicContact CZ3-CD1 3.26Å; W558-L614 HydrophobicContact CZ3-CG 4.48Å; P586-L614 HydrophobicContact CB-CD1 4.29Å; P586-L614 HydrophobicContact CG-CD1 4.01Å; N594-L614 HydrophobicContact CB-CD1 4.32Å; S611-L614 PolarHBondContact O-N 3Å; S612-L614 PolarHBondContact O-N 3.09Å; L614-T616 PolarHBondContact O-N 2.96Å; L614-W617 PolarHBondContact O-N 3.36Å; L614-W617 VanDerWaalsContact O-N 3.16Å; L614-Y618 HydrophobicContact CD2-CD1 4.37Å; L614-Y618 WeakPolarHBondContact O-CB 3.31Å; L614-Y618 PolarHBondContact O-N 3.11Å
615	F	67.4	Low	68.5	Low	88 Å²	88	67.4 Å²	67.4	39%	0.386	38%	0.379	S	S	.	.	H	α-helix	trans	-73.5	-11.3	-175.8	-64.9	-66.7	0	0	0	113.2	Q598 S611 S612 W617	Q598-F615 HydrophobicContact CG-CZ 4.16Å; Q598-F615 VanDerWaalsContact NE2-CE1 3.34Å; S611-F615 VanDerWaalsContact O-CD2 3.24Å; S611-F615 WeakPolarHBondContact O-CD2 3.23Å; S612-F615 PolarHBondContact O-N 3.23Å; F615-W617 VanDerWaalsContact C-N 3.28Å; F615-W617 PolarHBondContact O-N 2.95Å
616	T	75.4	Confident	71	Confident	116 Å²	116	58.9 Å²	58.9	71%	0.712	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-31	167.4	-54.4	0	0	0	0	113.3	S612 L614	S612-T616 PolarHBondContact O-N 3.42Å; S612-T616 PolarHBondContact O-OG1 3.39Å; S612-T616 VanDerWaalsContact O-OG1 3.12Å; L614-T616 PolarHBondContact O-N 2.96Å
617	W	86.2	Confident	73.6	Confident	45 Å²	45	51.5 Å²	51.5	17%	0.17	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.4	-19.6	-173	68	-98.6	0	0	0	115.8	M553 W558 Q560 F563 P586 N613 L614 F615	M553-W617 HydrophobicContact CE-CZ2 4.38Å; W558-W617 PolarHBondContact O-NE1 2.61Å; Q560-W617 HydrophobicContact CB-CD2 3.78Å; Q560-W617 HydrophobicContact CB-CE3 4.2Å; Q560-W617 HydrophobicContact CB-CG 4.01Å; Q560-W617 HydrophobicContact CB-CZ2 4.33Å; Q560-W617 HydrophobicContact CG-CB 4.49Å; Q560-W617 HydrophobicContact CG-CD2 3.72Å; Q560-W617 HydrophobicContact CG-CE3 3.66Å; Q560-W617 HydrophobicContact CG-CG 4.1Å; Q560-W617 HydrophobicContact CG-CZ3 4.13Å; F563-W617 HydrophobicContact CB-CH2 3.75Å; F563-W617 HydrophobicContact CB-CZ2 4.42Å; F563-W617 HydrophobicContact CB-CZ3 4.45Å; F563-W617 AromaticContact CD1-CH2 3.73Å; F563-W617 HydrophobicContact CD1-CH2 3.73Å; F563-W617 AromaticContact CD1-CZ3 3.72Å; F563-W617 HydrophobicContact CD1-CZ3 3.72Å; F563-W617 HydrophobicContact CD2-CH2 4.2Å; F563-W617 HydrophobicContact CE1-CH2 4.37Å; F563-W617 HydrophobicContact CE1-CZ3 4.17Å; F563-W617 AromaticContact CG-CH2 3.62Å; F563-W617 HydrophobicContact CG-CH2 3.62Å; F563-W617 HydrophobicContact CG-CZ3 4.13Å; P586-W617 HydrophobicContact CB-CH2 4.28Å; P586-W617 HydrophobicContact CG-CH2 4.07Å; N613-W617 PolarHBondContact O-NE1 3.48Å; L614-W617 PolarHBondContact O-N 3.36Å; L614-W617 VanDerWaalsContact O-N 3.16Å; F615-W617 VanDerWaalsContact C-N 3.28Å; F615-W617 PolarHBondContact O-N 2.95Å
618	Y	85.9	Confident	76	Confident	27 Å²	27	52 Å²	52	11%	0.106	30%	0.303	C	S	.	.			trans	-100.8	99.6	179.8	-170.9	-100.8	0	0	0	112.3	Y584 P586 N594 L614 G620	Y584-Y618 PolarHBondContact O-OH 3.05Å; Y584-Y618 VanDerWaalsContact O-OH 3.07Å; P586-Y618 HydrophobicContact CG-CD1 4.06Å; P586-Y618 HydrophobicContact CG-CD2 3.57Å; P586-Y618 HydrophobicContact CG-CE1 4.23Å; P586-Y618 HydrophobicContact CG-CE2 3.77Å; P586-Y618 HydrophobicContact CG-CG 3.71Å; N594-Y618 WeakPolarHBondContact ND2-CE1 3.3Å; L614-Y618 HydrophobicContact CD2-CD1 4.37Å; L614-Y618 WeakPolarHBondContact O-CB 3.31Å; L614-Y618 PolarHBondContact O-N 3.11Å; Y618-G620 VanDerWaalsContact C-N 3.31Å; Y618-G620 WeakPolarHBondContact CE1-O 3.48Å; Y618-G620 PolarHBondContact O-N 3.1Å
619	T	82.4	Confident	78.2	Confident	147 Å²	147	51.7 Å²	51.7	90%	0.902	30%	0.3	S	S	*	.			trans	-94.5	28.1	175.6	-28.7	0	0	0	0	112.7
620	G	83.4	Confident	80.3	Confident	28 Å²	28	46 Å²	46	29%	0.289	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-94.8	162.8	-179.2	0	0	0	0	0	113.9	Y618	Y618-G620 VanDerWaalsContact C-N 3.31Å; Y618-G620 WeakPolarHBondContact CE1-O 3.48Å; Y618-G620 PolarHBondContact O-N 3.1Å
621	P	89	Confident	82.1	Confident	62 Å²	62	46 Å²	46	40%	0.403	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-66.5	159.1	174.6	28.8	-35.9	0	0	0	112.7	E625 L626	P621-E625 HydrophobicContact CB-CB 3.96Å; P621-L626 HydrophobicContact CB-CG 4.43Å; P621-L626 HydrophobicContact CG-CD2 3.63Å; P621-L626 HydrophobicContact CG-CG 3.84Å
622	S	90.4	Very high	83.3	Confident	5 Å²	5	46.8 Å²	46.8	4%	0.035	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-71.7	164.1	178	90.6	0	0	0	0	112.4	N594 L595 P597 L624 E625 L626	N594-S622 WeakPolarHBondContact OD1-CA 3.5Å; L595-S622 PolarHBondContact O-OG 3.05Å; P597-S622 WeakPolarHBondContact CD-OG 3.47Å; S622-L624 VanDerWaalsContact C-N 3.29Å; S622-L624 PolarHBondContact O-N 2.95Å; S622-L624 PolarHBondContact OG-N 3.36Å; S622-E625 PolarHBondContact N-OE2 3.45Å; S622-E625 PolarHBondContact O-N 2.86Å; S622-E625 PolarHBondContact OG-N 3.12Å; S622-L626 WeakPolarHBondContact O-CG 3.4Å; S622-L626 PolarHBondContact O-N 2.94Å
623	L	92.7	Very high	84.7	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-55.2	-42.7	177.4	-179.3	60.9	0	0	0	112.7	L421 M422 L511 I547 V587 N594 L595 E625 L626 I627	L421-L623 HydrophobicContact CD2-CD2 4.36Å; L421-L623 HydrophobicContact CG-CD2 4.47Å; M422-L623 HydrophobicContact CE-CD2 4.29Å; L511-L623 HydrophobicContact CD1-CD1 3.81Å; L511-L623 HydrophobicContact CD2-CD1 4.36Å; L511-L623 HydrophobicContact CD2-CD2 4.41Å; I547-L623 HydrophobicContact CG2-CD1 4.36Å; V587-L623 HydrophobicContact CG1-CB 4.32Å; V587-L623 HydrophobicContact CG1-CD2 4.47Å; N594-L623 PolarHBondContact O-N 3.24Å; L595-L623 HydrophobicContact CD2-CD2 4.14Å; L623-E625 VanDerWaalsContact C-N 3.33Å; L623-E625 PolarHBondContact O-N 3.23Å; L623-L626 PolarHBondContact O-N 3.15Å; L623-I627 HydrophobicContact CD1-CD1 4.33Å; L623-I627 HydrophobicContact CG-CD1 4.17Å; L623-I627 WeakPolarHBondContact O-CG1 3.08Å; L623-I627 PolarHBondContact O-N 2.92Å
624	L	92.5	Very high	85.7	Confident	16 Å²	16	50.3 Å²	50.3	8%	0.084	29%	0.286	C	S	.	.	H	α-helix	trans	-60.7	-39.1	175	-174.1	68.1	0	0	0	112.9	L429 F478 T480 L595 V596 S622 I627 D628	L429-L624 HydrophobicContact CD1-CD1 4.28Å; L429-L624 HydrophobicContact CD2-CD1 4.09Å; L429-L624 HydrophobicContact CD2-CD2 3.8Å; F478-L624 HydrophobicContact CD2-CD1 4.5Å; F478-L624 HydrophobicContact CE2-CD1 3.93Å; T480-L624 HydrophobicContact CG2-CD1 4.01Å; L595-L624 WeakPolarHBondContact O-CB 3.28Å; L595-L624 PolarHBondContact O-N 3.22Å; V596-L624 HydrophobicContact CG1-CD2 4.16Å; V596-L624 HydrophobicContact CG2-CD2 4.4Å; S622-L624 VanDerWaalsContact C-N 3.29Å; S622-L624 PolarHBondContact O-N 2.95Å; S622-L624 PolarHBondContact OG-N 3.36Å; L624-I627 PolarHBondContact O-N 2.96Å; L624-D628 WeakPolarHBondContact O-CB 3.17Å; L624-D628 PolarHBondContact O-N 3.26Å
625	E	91.8	Very high	86.5	Confident	66 Å²	66	52.2 Å²	52.2	31%	0.308	29%	0.293	S	S	.	.	H	α-helix	trans	-74.8	-32.3	178.7	-71.2	173.5	148.8	0	0	112.4	K481 P597 P621 S622 L623 I627 D628 S629	K481-E625 IonicContact NZ-OE1 3.66Å; P597-E625 HydrophobicContact CG-CG 3.69Å; P597-E625 VanDerWaalsContact CG-OE1 3.23Å; P597-E625 WeakPolarHBondContact CG-OE1 3.44Å; P621-E625 HydrophobicContact CB-CB 3.96Å; S622-E625 PolarHBondContact N-OE2 3.45Å; S622-E625 PolarHBondContact O-N 2.86Å; S622-E625 PolarHBondContact OG-N 3.12Å; L623-E625 VanDerWaalsContact C-N 3.33Å; L623-E625 PolarHBondContact O-N 3.23Å; E625-I627 VanDerWaalsContact C-N 3.3Å; E625-D628 PolarHBondContact O-N 2.99Å; E625-S629 WeakPolarHBondContact O-CB 3.39Å; E625-S629 PolarHBondContact O-N 3.38Å; E625-S629 PolarHBondContact O-OG 2.86Å
626	L	92.2	Very high	87.3	Confident	8 Å²	8	51.6 Å²	51.6	4%	0.042	30%	0.296	C	S	.	.	H	α-helix	trans	-65.8	-31.4	169.5	-73.3	168.4	0	0	0	112.6	I547 M583 C585 P621 S622 L623 S629 I630	I547-L626 HydrophobicContact CD1-CB 4.16Å; I547-L626 WeakPolarHBondContact CD1-O 3.4Å; M583-L626 HydrophobicContact CB-CD2 3.96Å; M583-L626 HydrophobicContact CE-CB 4.35Å; M583-L626 HydrophobicContact CE-CD2 3.84Å; M583-L626 WeakPolarHBondContact CE-O 3.06Å; M583-L626 HydrophobicContact CG-CD2 4.35Å; M583-L626 HydrophobicContact SD-CD2 3.58Å; M583-L626 VanDerWaalsContact SD-CD2 3.58Å; C585-L626 HydrophobicContact CB-CD1 3.51Å; P621-L626 HydrophobicContact CB-CG 4.43Å; P621-L626 HydrophobicContact CG-CD2 3.63Å; P621-L626 HydrophobicContact CG-CG 3.84Å; S622-L626 WeakPolarHBondContact O-CG 3.4Å; S622-L626 PolarHBondContact O-N 2.94Å; L623-L626 PolarHBondContact O-N 3.15Å; L626-S629 PolarHBondContact O-OG 2.97Å; L626-S629 VanDerWaalsContact O-OG 3.09Å; L626-I630 WeakPolarHBondContact O-CG1 3.48Å
627	I	92.9	Very high	87.7	Confident	3 Å²	3	46.6 Å²	46.6	2%	0.015	27%	0.265	C	S	.	.	H	α-helix	trans	-75.5	-40.2	172.7	-67.3	165	0	0	0	110.5	L408 F478 V485 I547 L623 L624 E625 S629 I630	L408-I627 HydrophobicContact CD2-CD1 3.84Å; L408-I627 HydrophobicContact CD2-CG1 4Å; L408-I627 HydrophobicContact CD2-CG2 4.13Å; F478-I627 HydrophobicContact CZ-CD1 4.45Å; F478-I627 HydrophobicContact CZ-CG2 4.4Å; V485-I627 HydrophobicContact CG1-CG2 4.3Å; V485-I627 HydrophobicContact CG2-CG2 3.72Å; I547-I627 HydrophobicContact CD1-CG1 4.13Å; L623-I627 HydrophobicContact CD1-CD1 4.33Å; L623-I627 HydrophobicContact CG-CD1 4.17Å; L623-I627 WeakPolarHBondContact O-CG1 3.08Å; L623-I627 PolarHBondContact O-N 2.92Å; L624-I627 PolarHBondContact O-N 2.96Å; E625-I627 VanDerWaalsContact C-N 3.3Å; I627-S629 VanDerWaalsContact C-N 3.28Å; I627-S629 PolarHBondContact O-N 3.13Å; I627-I630 HydrophobicContact CG2-CD1 4.48Å; I627-I630 WeakPolarHBondContact O-CG1 3.44Å; I627-I630 PolarHBondContact O-N 3.1Å
628	D	91.9	Very high	87.6	Confident	29 Å²	29	50.4 Å²	50.4	16%	0.155	29%	0.289	C	S	.	.	H	α-helix	trans	-70	-23.2	177.1	-152.5	23	0	0	0	112.6	T480 K481 S482 K483 L624 E625	T480-D628 WeakPolarHBondContact CB-OD1 3.39Å; T480-D628 HydrophobicContact CG2-CB 4.34Å; T480-D628 PolarHBondContact OG1-OD1 2.97Å; K481-D628 WeakPolarHBondContact CB-OD2 3.42Å; S482-D628 WeakPolarHBondContact CB-OD1 3.48Å; S482-D628 PolarHBondContact N-OD1 2.9Å; S482-D628 PolarHBondContact OG-OD1 3.31Å; K483-D628 PolarHBondContact NZ-O 3.22Å; L624-D628 WeakPolarHBondContact O-CB 3.17Å; L624-D628 PolarHBondContact O-N 3.26Å; E625-D628 PolarHBondContact O-N 2.99Å
629	S	90.7	Very high	87.5	Confident	66 Å²	66	50 Å²	50	46%	0.462	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-13.8	176.7	75.1	0	0	0	0	114.7	E625 L626 I627 P631	E625-S629 WeakPolarHBondContact O-CB 3.39Å; E625-S629 PolarHBondContact O-N 3.38Å; E625-S629 PolarHBondContact O-OG 2.86Å; L626-S629 PolarHBondContact O-OG 2.97Å; L626-S629 VanDerWaalsContact O-OG 3.09Å; I627-S629 VanDerWaalsContact C-N 3.28Å; I627-S629 PolarHBondContact O-N 3.13Å; S629-P631 WeakPolarHBondContact O-CD 3.37Å
630	I	89	Confident	87.9	Confident	5 Å²	5	44.7 Å²	44.7	3%	0.026	26%	0.261	C	S	.	.	S	Bend	trans	-57.8	122.2	177.3	-55.3	173.7	0	0	0	109.1	I406 K483 A509 R545 I547 L626 I627	I406-I630 HydrophobicContact CD1-CB 4.09Å; I406-I630 HydrophobicContact CD1-CG2 4.11Å; I406-I630 WeakPolarHBondContact CD1-O 3.34Å; K483-I630 PolarHBondContact NZ-O 3.06Å; A509-I630 HydrophobicContact CB-CD1 3.86Å; A509-I630 HydrophobicContact CB-CG2 4.12Å; R545-I630 HydrophobicContact CB-CG2 4.22Å; R545-I630 HydrophobicContact CG-CG2 4.25Å; I547-I630 HydrophobicContact CD1-CD1 3.74Å; I547-I630 HydrophobicContact CD1-CG1 3.95Å; L626-I630 WeakPolarHBondContact O-CG1 3.48Å; I627-I630 HydrophobicContact CG2-CD1 4.48Å; I627-I630 WeakPolarHBondContact O-CG1 3.44Å; I627-I630 PolarHBondContact O-N 3.1Å
631	P	86.3	Confident	88.3	Confident	64 Å²	64	43.5 Å²	43.5	42%	0.416	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-66	138.1	174	27.4	-33.7	0	0	0	110	S629	S629-P631 WeakPolarHBondContact O-CD 3.37Å
632	P	82.6	Confident	88.4	Confident	55 Å²	55	41.5 Å²	41.5	36%	0.357	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-62.2	147.1	176.6	31	-38.6	0	0	0	110.6
633	P	85	Confident	88.6	Confident	37 Å²	37	41.2 Å²	41.2	24%	0.24	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-68.8	150.4	171.8	31.7	-36.8	0	0	0	110.9	D508 R635	D508-P633 HydrophobicContact CB-CG 4Å; P633-R635 WeakPolarHBondContact O-CG 3.37Å; P633-R635 PolarHBondContact O-N 3.21Å
634	E	84.1	Confident	88.6	Confident	187 Å²	187	41.6 Å²	41.6	87%	0.874	23%	0.233	S	C	*	.	P	Polyproline II helix	trans	-64.1	127.3	169.1	-172.7	-179.5	-178.9	0	0	110.1
635	R	84.5	Confident	88.7	Confident	43 Å²	43	40.9 Å²	40.9	16%	0.162	23%	0.229	C	C	.	.			trans	-112.2	125	-172.2	-60.7	-136.6	-174.2	170.6	-6	111.3	I405 P633 V637 S724 G725 D726	I405-R635 VanDerWaalsContact CB-NH2 3.34Å; I405-R635 PolarHBondContact O-NH2 2.97Å; P633-R635 WeakPolarHBondContact O-CG 3.37Å; P633-R635 PolarHBondContact O-N 3.21Å; R635-V637 HydrophobicContact CB-CG2 4.46Å; R635-V637 PolarHBondContact O-N 3.24Å; R635-V637 VanDerWaalsContact O-N 3.12Å; R635-S724 WeakPolarHBondContact CD-O 3.41Å; R635-S724 PolarHBondContact NH1-O 3.02Å; R635-G725 VanDerWaalsContact NH1-C 3.32Å; R635-D726 IonicContact CZ-OD1 3.56Å; R635-D726 IonicContact NH1-OD1 3.61Å; R635-D726 PolarHBondContact NH1-OD1 2.77Å; R635-D726 IonicContact NH2-OD1 3.14Å
636	T	84.7	Confident	88.6	Confident	74 Å²	74	38.8 Å²	38.8	45%	0.454	22%	0.221	S	C	.	.			trans	-92.6	67.4	-168.8	48.5	0	0	0	0	112.3	G639 S665 G666 S724	T636-G639 PolarHBondContact O-N 3Å; T636-S665 WeakPolarHBondContact OG1-CB 3.33Å; T636-G666 PolarHBondContact O-N 3.36Å; T636-S724 PolarHBondContact N-OG 3.13Å; T636-S724 VanDerWaalsContact N-OG 3.16Å
637	V	83.6	Confident	88.5	Confident	12 Å²	12	42.2 Å²	42.2	7%	0.073	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-27	-175.7	-174.4	0	0	0	0	113.4	Y393 R635 G639 G666 A667 F723	Y393-V637 HydrophobicContact CD1-CB 4.35Å; Y393-V637 HydrophobicContact CD1-CG1 4.31Å; Y393-V637 HydrophobicContact CD1-CG2 4.15Å; Y393-V637 HydrophobicContact CD2-CG1 4.14Å; Y393-V637 HydrophobicContact CD2-CG2 3.86Å; Y393-V637 HydrophobicContact CE1-CB 4.5Å; Y393-V637 HydrophobicContact CE1-CG2 3.93Å; Y393-V637 HydrophobicContact CE2-CG2 3.61Å; Y393-V637 HydrophobicContact CG-CB 4.37Å; Y393-V637 HydrophobicContact CG-CG1 3.91Å; Y393-V637 HydrophobicContact CG-CG2 4.12Å; R635-V637 HydrophobicContact CB-CG2 4.46Å; R635-V637 PolarHBondContact O-N 3.24Å; R635-V637 VanDerWaalsContact O-N 3.12Å; V637-G639 VanDerWaalsContact C-N 3.27Å; V637-G666 CarbonylContact O-C 3.51Å; V637-G666 WeakPolarHBondContact O-CA 3.44Å; V637-A667 HydrophobicContact CG1-CB 4.13Å; V637-F723 HydrophobicContact CG1-CD1 3.96Å; V637-F723 HydrophobicContact CG2-CB 4.4Å
638	D	84.4	Confident	88.4	Confident	125 Å²	125	42.8 Å²	42.8	67%	0.668	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-11.7	174.1	-168.6	50.7	0	0	0	113	V390	V390-D638 HydrophobicContact CG2-CB 4.33Å
639	G	84.3	Confident	88.3	Confident	19 Å²	19	43.7 Å²	43.7	20%	0.196	25%	0.246	C	C	.	.	S	Bend	trans	-68.9	165.1	176.5	0	0	0	0	0	113.2	T636 V637 G666	T636-G639 PolarHBondContact O-N 3Å; V637-G639 VanDerWaalsContact C-N 3.27Å; G639-G666 WeakPolarHBondContact O-CA 3.37Å; G639-G666 PolarHBondContact O-N 3.47Å
640	P	88.9	Confident	88.1	Confident	34 Å²	34	46 Å²	46	22%	0.221	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-61	148.2	171.6	28.5	-35.2	0	0	0	110.4	R642 S665 N752	P640-R642 PolarHBondContact O-N 3.45Å; P640-S665 CarbonylContact O-C 3.6Å; P640-S665 PolarHBondContact O-OG 2.84Å; P640-N752 HydrophobicContact CB-CB 4.42Å
641	F	92	Very high	87.8	Confident	3 Å²	3	46.3 Å²	46.3	1%	0.013	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-63	127.6	178.6	-177.5	-107.6	0	0	0	110.8	F643 V663 S665 I668 V679 L747 T748 D749	F641-F643 HydrophobicContact CE1-CB 3.77Å; F641-F643 HydrophobicContact CE2-CB 4.22Å; F641-F643 HydrophobicContact CZ-CB 3.43Å; F641-F643 VanDerWaalsContact CZ-CB 3.43Å; F641-F643 HydrophobicContact CZ-CG 4.23Å; F641-V663 HydrophobicContact CD2-CG1 4.15Å; F641-V663 HydrophobicContact CE2-CG1 3.74Å; F641-V663 HydrophobicContact CE2-CG2 4.16Å; F641-S665 WeakPolarHBondContact CA-O 3.46Å; F641-I668 HydrophobicContact CD2-CB 4.05Å; F641-I668 HydrophobicContact CE1-CD1 3.96Å; F641-I668 HydrophobicContact CE2-CB 3.58Å; F641-I668 HydrophobicContact CE2-CD1 4.21Å; F641-I668 HydrophobicContact CE2-CG1 4.41Å; F641-I668 HydrophobicContact CE2-CG2 3.8Å; F641-I668 HydrophobicContact CZ-CB 3.98Å; F641-I668 HydrophobicContact CZ-CD1 3.68Å; F641-I668 HydrophobicContact CZ-CG1 4.36Å; F641-I668 HydrophobicContact CZ-CG2 4.14Å; F641-V679 HydrophobicContact CD1-CG1 3.96Å; F641-V679 HydrophobicContact CE1-CG1 3.83Å; F641-L747 HydrophobicContact CE1-CB 4.36Å; F641-T748 VanDerWaalsContact O-CA 3.28Å; F641-T748 WeakPolarHBondContact O-CA 3.4Å; F641-T748 WeakPolarHBondContact O-CB 3.48Å; F641-D749 HydrophobicContact CB-CB 4.48Å; F641-D749 VanDerWaalsContact CB-CG 3.49Å; F641-D749 WeakPolarHBondContact CB-OD1 3.29Å; F641-D749 PolarHBondContact N-OD2 3.46Å; F641-D749 PolarHBondContact O-N 3.3Å
642	R	92.1	Very high	87.4	Confident	20 Å²	20	48.5 Å²	48.5	8%	0.075	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	124.5	173.6	-59.7	178.4	-174.4	110.4	-17.3	108.8	P640 I664 S665 I754 E834	P640-R642 PolarHBondContact O-N 3.45Å; R642-I664 HydrophobicContact CB-CB 4.34Å; R642-I664 PolarHBondContact O-N 3.22Å; R642-S665 WeakPolarHBondContact CD-OG 3.36Å; R642-S665 WeakPolarHBondContact CG-OG 3.29Å; R642-S665 PolarHBondContact N-O 3.05Å; R642-S665 PolarHBondContact NH1-OG 2.99Å; R642-S665 PolarHBondContact O-N 2.9Å; R642-I754 HydrophobicContact CG-CD1 4.48Å; R642-E834 IonicContact CZ-OE1 2.7Å; R642-E834 IonicContact CZ-OE2 3.06Å; R642-E834 IonicContact NE-OE1 2.66Å; R642-E834 PolarHBondContact NE-OE1 2.86Å; R642-E834 IonicContact NE-OE2 2.73Å; R642-E834 IonicContact NH2-OE1 3.41Å; R642-E834 PolarHBondContact NH2-OE1 3.16Å; R642-E834 IonicContact NH2-OE2 4Å; R642-E834 PolarHBondContact NH2-OE2 3.47Å
643	F	93.8	Very high	87.1	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	127.7	177.5	169.1	-85.6	0	0	0	109.7	F641 V645 V659 G661 R662 V663 V728 L730 L746 L747	F641-F643 HydrophobicContact CE1-CB 3.77Å; F641-F643 HydrophobicContact CE2-CB 4.22Å; F641-F643 HydrophobicContact CZ-CB 3.43Å; F641-F643 VanDerWaalsContact CZ-CB 3.43Å; F641-F643 HydrophobicContact CZ-CG 4.23Å; F643-V645 HydrophobicContact CE1-CG2 4.28Å; F643-V659 HydrophobicContact CE1-CG1 4.13Å; F643-G661 WeakPolarHBondContact CE2-O 3.14Å; F643-R662 WeakPolarHBondContact CA-O 3.25Å; F643-V663 HydrophobicContact CD2-CG2 3.94Å; F643-V728 HydrophobicContact CD2-CG2 4.4Å; F643-V728 HydrophobicContact CE2-CG2 3.74Å; F643-L730 HydrophobicContact CD1-CD1 4.06Å; F643-L730 HydrophobicContact CD2-CD1 4.11Å; F643-L730 HydrophobicContact CE1-CD1 3.8Å; F643-L730 HydrophobicContact CE1-CG 4.43Å; F643-L730 HydrophobicContact CE2-CD1 3.86Å; F643-L730 HydrophobicContact CE2-CG 4.09Å; F643-L730 HydrophobicContact CG-CD1 4.19Å; F643-L730 HydrophobicContact CZ-CD1 3.67Å; F643-L730 HydrophobicContact CZ-CG 3.89Å; F643-L746 WeakPolarHBondContact O-CA 3.4Å; F643-L747 HydrophobicContact CB-CB 4.29Å; F643-L747 HydrophobicContact CD1-CB 4.11Å; F643-L747 HydrophobicContact CD1-CD1 3.72Å; F643-L747 HydrophobicContact CD1-CG 3.87Å; F643-L747 HydrophobicContact CE1-CD1 3.96Å; F643-L747 HydrophobicContact CE1-CG 4.44Å; F643-L747 PolarHBondContact N-O 2.81Å; F643-L747 PolarHBondContact O-N 3.28Å
644	V	93.9	Very high	86.7	Confident	8 Å²	8	50.3 Å²	50.3	5%	0.048	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	124.7	174.2	162.7	0	0	0	0	108.4	S646 G661 R662 I664 L746 N784 L842	V644-S646 PolarHBondContact O-N 3.32Å; V644-G661 CarbonylContact O-C 3.56Å; V644-G661 WeakPolarHBondContact O-CA 3.03Å; V644-R662 PolarHBondContact N-O 2.95Å; V644-R662 PolarHBondContact O-N 3.49Å; V644-I664 HydrophobicContact CB-CD1 4.46Å; V644-I664 HydrophobicContact CG2-CD1 3.49Å; V644-I664 VanDerWaalsContact CG2-CD1 3.49Å; V644-I664 HydrophobicContact CG2-CG1 4.37Å; V644-L746 HydrophobicContact CB-CD2 4.42Å; V644-L746 HydrophobicContact CG2-CD2 3.5Å; V644-L746 VanDerWaalsContact CG2-CD2 3.5Å; V644-N784 HydrophobicContact CG1-CB 3.91Å; V644-N784 HydrophobicContact CG2-CB 4.22Å; V644-L842 HydrophobicContact CG2-CD2 4.01Å
645	V	93.6	Very high	86.5	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	124.3	167.2	-178.4	0	0	0	0	108.8	F643 I648 V659 G744 D745 L747	F643-V645 HydrophobicContact CE1-CG2 4.28Å; V645-I648 HydrophobicContact CG1-CD1 4.32Å; V645-I648 HydrophobicContact CG1-CG1 3.93Å; V645-V659 HydrophobicContact CB-CG1 4.18Å; V645-V659 HydrophobicContact CG1-CG1 3.66Å; V645-V659 HydrophobicContact CG2-CG1 3.62Å; V645-G744 PolarHBondContact O-N 2.8Å; V645-D745 HydrophobicContact CG2-CB 4.48Å; V645-D745 PolarHBondContact N-O 3.06Å; V645-L747 HydrophobicContact CG2-CG 4.39Å
646	S	90.5	Very high	86.6	Confident	22 Å²	22	47.1 Å²	47.1	15%	0.154	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-37.7	172.9	63.1	0	0	0	0	112.2	V644 A660 G661	V644-S646 PolarHBondContact O-N 3.32Å; S646-A660 PolarHBondContact N-O 2.88Å; S646-A660 PolarHBondContact OG-O 3.24Å; S646-G661 WeakPolarHBondContact OG-CA 3.37Å; S646-G661 PolarHBondContact OG-N 3.2Å
647	D	89.8	Confident	86.8	Confident	80 Å²	80	44.5 Å²	44.5	43%	0.428	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	162.5	-178.8	-177.5	37.4	0	0	0	111.5	A660	D647-A660 HydrophobicContact CB-CB 4.38Å; D647-A660 PolarHBondContact N-O 3.11Å; D647-A660 PolarHBondContact O-N 3.06Å
648	I	91	Very high	87	Confident	16 Å²	16	43.9 Å²	43.9	8%	0.082	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	108.7	178.5	-51.7	175.2	0	0	0	108.7	V645 M658 P737 F738 L741	V645-I648 HydrophobicContact CG1-CD1 4.32Å; V645-I648 HydrophobicContact CG1-CG1 3.93Å; I648-M658 WeakPolarHBondContact CA-O 3.09Å; I648-P737 HydrophobicContact CD1-CB 4.46Å; I648-P737 HydrophobicContact CG2-CB 3.93Å; I648-P737 HydrophobicContact CG2-CG 3.97Å; I648-F738 HydrophobicContact CG2-CD2 3.87Å; I648-F738 HydrophobicContact CG2-CE1 4.36Å; I648-F738 HydrophobicContact CG2-CE2 3.67Å; I648-F738 HydrophobicContact CG2-CG 4.29Å; I648-F738 HydrophobicContact CG2-CZ 3.96Å; I648-F738 WeakPolarHBondContact O-CE1 3.48Å; I648-F738 WeakPolarHBondContact O-CZ 3.39Å; I648-L741 HydrophobicContact CD1-CB 3.66Å; I648-L741 WeakPolarHBondContact CD1-O 2.95Å
649	F	88.8	Confident	87.4	Confident	48 Å²	48	38 Å²	38	21%	0.211	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	162.6	-176	63.4	-110.3	0	0	0	113.2	P651 M658 A660 L715 A729	F649-P651 HydrophobicContact CD2-CB 4.36Å; F649-P651 HydrophobicContact CE2-CB 4.12Å; F649-P651 HydrophobicContact CE2-CG 4.32Å; F649-M658 HydrophobicContact CD2-CB 4.49Å; F649-M658 HydrophobicContact CE2-CB 4.14Å; F649-M658 PolarHBondContact N-O 3.06Å; F649-M658 PolarHBondContact O-N 2.76Å; F649-A660 HydrophobicContact CD1-CB 4.28Å; F649-A660 HydrophobicContact CE1-CB 3.78Å; F649-L715 HydrophobicContact CE2-CD1 3.72Å; F649-L715 HydrophobicContact CE2-CD2 4.39Å; F649-L715 HydrophobicContact CZ-CD1 3.99Å; F649-L715 HydrophobicContact CZ-CD2 3.89Å; F649-A729 HydrophobicContact CZ-CB 4.12Å
650	K	88.1	Confident	87.7	Confident	115 Å²	115	37.2 Å²	37.2	50%	0.5	25%	0.247	S	C	.	.			trans	-108.1	105.5	171.7	-60.3	-168.8	-177.3	-175.6	0	108.9	P657 F738	K650-P657 HydrophobicContact CG-CB 4.05Å; K650-F738 HydrophobicContact CD-CE2 4.06Å; K650-F738 VanDerWaalsContact CE-CD2 3.41Å; K650-F738 HydrophobicContact CG-CE2 3.56Å; K650-F738 HydrophobicContact CG-CZ 3.96Å
651	P	81.8	Confident	87.8	Confident	11 Å²	11	35.8 Å²	35.8	7%	0.071	24%	0.238	C	C	.	.			trans	-67.3	136.6	-176.2	22.4	-27.8	0	0	0	111.3	F649 G653 S654 M658 L715	F649-P651 HydrophobicContact CD2-CB 4.36Å; F649-P651 HydrophobicContact CE2-CB 4.12Å; F649-P651 HydrophobicContact CE2-CG 4.32Å; P651-G653 PolarHBondContact O-N 3.19Å; P651-S654 PolarHBondContact O-N 3.05Å; P651-M658 HydrophobicContact CG-CG 3.99Å; P651-M658 HydrophobicContact CG-SD 3.88Å; P651-L715 HydrophobicContact CB-CD1 3.96Å
652	A	78.1	Confident	87.8	Confident	110 Å²	110	36.9 Å²	36.9	91%	0.909	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54	127	-178.1	0	0	0	0	0	111.7
653	G	75.6	Confident	87.8	Confident	96 Å²	96	35.9 Å²	35.9	99%	0.99	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.1	-1.2	-175.1	0	0	0	0	0	115.7	P651	P651-G653 PolarHBondContact O-N 3.19Å
654	S	77.3	Confident	87.7	Confident	33 Å²	33	37 Å²	37	23%	0.231	24%	0.243	C	C	.	.			trans	-125.5	125.7	172.2	169.7	0	0	0	0	111	P651 V656	P651-S654 PolarHBondContact O-N 3.05Å; S654-V656 VanDerWaalsContact C-N 3.25Å; S654-V656 PolarHBondContact O-N 2.72Å; S654-V656 PolarHBondContact OG-N 3.44Å; S654-V656 PolarHBondContact OG-O 3.5Å; S654-V656 VanDerWaalsContact OG-O 3.11Å
655	S	80.3	Confident	87.4	Confident	112 Å²	112	36.6 Å²	36.6	78%	0.783	24%	0.241	S	C	*	.	S	Bend	trans	-71.6	-21.2	171.1	53.2	0	0	0	0	113.1
656	V	85	Confident	87.1	Confident	52 Å²	52	36.6 Å²	36.6	32%	0.315	24%	0.242	S	C	.	.	S	Bend	trans	-77.4	123.4	179	-172.5	0	0	0	0	109.3	S654 M731	S654-V656 VanDerWaalsContact C-N 3.25Å; S654-V656 PolarHBondContact O-N 2.72Å; S654-V656 PolarHBondContact OG-N 3.44Å; S654-V656 PolarHBondContact OG-O 3.5Å; S654-V656 VanDerWaalsContact OG-O 3.11Å; V656-M731 HydrophobicContact CB-CE 3.98Å; V656-M731 HydrophobicContact CB-SD 4.32Å; V656-M731 HydrophobicContact CG1-CE 3.96Å; V656-M731 HydrophobicContact CG1-CG 3.77Å; V656-M731 HydrophobicContact CG1-SD 3.85Å
657	P	89.1	Confident	87	Confident	18 Å²	18	36.1 Å²	36.1	12%	0.117	24%	0.239	C	C	.	.			trans	-70.1	157.3	175.9	31.3	-36.8	0	0	0	112.1	K650 P737 F738	K650-P657 HydrophobicContact CG-CB 4.05Å; P657-P737 HydrophobicContact CB-CG 3.73Å; P657-P737 VanDerWaalsContact CG-CD 3.43Å; P657-P737 HydrophobicContact CG-CG 3.49Å; P657-P737 VanDerWaalsContact CG-CG 3.49Å; P657-F738 HydrophobicContact CB-CD2 3.76Å; P657-F738 HydrophobicContact CB-CE2 3.57Å; P657-F738 HydrophobicContact CG-CD2 4.4Å
658	M	89.4	Confident	86.9	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	145.1	177.3	-68.1	-164.5	72.7	0	0	110.9	I648 F649 P651 R694 A729 L730 M731	I648-M658 WeakPolarHBondContact CA-O 3.09Å; F649-M658 HydrophobicContact CD2-CB 4.49Å; F649-M658 HydrophobicContact CE2-CB 4.14Å; F649-M658 PolarHBondContact N-O 3.06Å; F649-M658 PolarHBondContact O-N 2.76Å; P651-M658 HydrophobicContact CG-CG 3.99Å; P651-M658 HydrophobicContact CG-SD 3.88Å; M658-R694 HydrophobicContact CE-CB 4.29Å; M658-R694 HydrophobicContact CE-CG 3.77Å; M658-A729 HydrophobicContact CB-CB 4.48Å; M658-A729 HydrophobicContact CE-CB 3.62Å; M658-A729 WeakPolarHBondContact CE-O 3.42Å; M658-A729 HydrophobicContact SD-CB 4.46Å; M658-L730 WeakPolarHBondContact CA-O 3.48Å; M658-M731 HydrophobicContact CE-CB 4.27Å; M658-M731 HydrophobicContact CG-CE 4.35Å; M658-M731 HydrophobicContact SD-CE 4.42Å
659	V	92.5	Very high	86.7	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.006	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	109.1	179.9	-175.8	0	0	0	0	107.6	F643 V645 A729 L730 L732 P737 L741	F643-V659 HydrophobicContact CE1-CG1 4.13Å; V645-V659 HydrophobicContact CB-CG1 4.18Å; V645-V659 HydrophobicContact CG1-CG1 3.66Å; V645-V659 HydrophobicContact CG2-CG1 3.62Å; V659-A729 WeakPolarHBondContact O-CA 3.47Å; V659-L730 PolarHBondContact N-O 2.66Å; V659-L730 PolarHBondContact O-N 2.9Å; V659-L732 HydrophobicContact CG2-CD1 3.92Å; V659-L732 HydrophobicContact CG2-CG 4.17Å; V659-P737 HydrophobicContact CG2-CB 3.58Å; V659-P737 HydrophobicContact CG2-CG 4.02Å; V659-L741 HydrophobicContact CG1-CD1 4.25Å; V659-L741 HydrophobicContact CG2-CD1 3.99Å
660	A	91	Very high	86.5	Confident	3 Å²	3	29.5 Å²	29.5	3%	0.025	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	149	176	0	0	0	0	0	110.6	S646 D647 F649	S646-A660 PolarHBondContact N-O 2.88Å; S646-A660 PolarHBondContact OG-O 3.24Å; D647-A660 HydrophobicContact CB-CB 4.38Å; D647-A660 PolarHBondContact N-O 3.11Å; D647-A660 PolarHBondContact O-N 3.06Å; F649-A660 HydrophobicContact CD1-CB 4.28Å; F649-A660 HydrophobicContact CE1-CB 3.78Å
661	G	91.2	Very high	85.7	Confident	3 Å²	3	25.4 Å²	25.4	3%	0.031	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.5	-176.4	-177.8	0	0	0	0	0	114.3	F643 V644 S646 Q727 V728	F643-G661 WeakPolarHBondContact CE2-O 3.14Å; V644-G661 CarbonylContact O-C 3.56Å; V644-G661 WeakPolarHBondContact O-CA 3.03Å; S646-G661 WeakPolarHBondContact OG-CA 3.37Å; S646-G661 PolarHBondContact OG-N 3.2Å; G661-Q727 WeakPolarHBondContact O-CA 3.1Å; G661-V728 PolarHBondContact N-O 3.47Å; G661-V728 VanDerWaalsContact N-O 3.1Å; G661-V728 PolarHBondContact O-N 3.41Å
662	R	91.3	Very high	85	Confident	26 Å²	26	31 Å²	31	10%	0.098	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	128.4	-178.8	-169	179.5	-175.2	-151.2	-4.3	110.5	N407 Q506 D508 F643 V644 I664 G725 D726	N407-R662 PolarHBondContact ND2-NH2 2.74Å; Q506-R662 VanDerWaalsContact O-CZ 3.24Å; Q506-R662 PolarHBondContact O-NE 3.27Å; Q506-R662 PolarHBondContact O-NH1 2.94Å; D508-R662 IonicContact OD1-CZ 3.44Å; D508-R662 IonicContact OD1-NH1 2.77Å; D508-R662 PolarHBondContact OD1-NH1 3.45Å; D508-R662 IonicContact OD1-NH2 3.41Å; D508-R662 PolarHBondContact OD1-NH2 2.88Å; D508-R662 IonicContact OD2-CZ 2.73Å; D508-R662 IonicContact OD2-NH2 3.61Å; D508-R662 PolarHBondContact OD2-NH2 3.02Å; F643-R662 WeakPolarHBondContact CA-O 3.25Å; V644-R662 PolarHBondContact N-O 2.95Å; V644-R662 PolarHBondContact O-N 3.49Å; R662-I664 PolarHBondContact O-N 2.84Å; R662-G725 PolarHBondContact NE-O 3.23Å; R662-G725 PolarHBondContact NH2-O 2.8Å; R662-D726 WeakPolarHBondContact CA-O 3.37Å
663	V	92.2	Very high	84.3	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	124.2	166.8	-171.4	0	0	0	0	107.6	F641 F643 A722 F723 G725 D726 V728	F641-V663 HydrophobicContact CD2-CG1 4.15Å; F641-V663 HydrophobicContact CE2-CG1 3.74Å; F641-V663 HydrophobicContact CE2-CG2 4.16Å; F643-V663 HydrophobicContact CD2-CG2 3.94Å; V663-A722 HydrophobicContact CG2-CB 4.35Å; V663-F723 WeakPolarHBondContact CB-O 3.29Å; V663-G725 WeakPolarHBondContact O-CA 3.39Å; V663-G725 PolarHBondContact O-N 2.86Å; V663-D726 PolarHBondContact N-O 2.78Å; V663-V728 HydrophobicContact CG2-CG2 4.26Å
664	I	90.5	Very high	84.4	Confident	22 Å²	22	31 Å²	31	11%	0.113	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-51.4	175.7	-71.4	177.7	0	0	0	110.2	R642 V644 R662 S724 P841 L842	R642-I664 HydrophobicContact CB-CB 4.34Å; R642-I664 PolarHBondContact O-N 3.22Å; V644-I664 HydrophobicContact CB-CD1 4.46Å; V644-I664 HydrophobicContact CG2-CD1 3.49Å; V644-I664 VanDerWaalsContact CG2-CD1 3.49Å; V644-I664 HydrophobicContact CG2-CG1 4.37Å; R662-I664 PolarHBondContact O-N 2.84Å; I664-S724 PolarHBondContact O-OG 2.92Å; I664-P841 HydrophobicContact CD1-CB 4.22Å; I664-P841 HydrophobicContact CG2-CB 4.39Å; I664-P841 HydrophobicContact CG2-CG 4.08Å; I664-L842 HydrophobicContact CD1-CD2 3.66Å; I664-L842 HydrophobicContact CD1-CG 3.91Å
665	S	88.8	Confident	84.1	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	162.1	-178.6	61.5	0	0	0	0	111.2	T636 P640 F641 R642	T636-S665 WeakPolarHBondContact OG1-CB 3.33Å; P640-S665 CarbonylContact O-C 3.6Å; P640-S665 PolarHBondContact O-OG 2.84Å; F641-S665 WeakPolarHBondContact CA-O 3.46Å; R642-S665 WeakPolarHBondContact CD-OG 3.36Å; R642-S665 WeakPolarHBondContact CG-OG 3.29Å; R642-S665 PolarHBondContact N-O 3.05Å; R642-S665 PolarHBondContact NH1-OG 2.99Å; R642-S665 PolarHBondContact O-N 2.9Å
666	G	86.9	Confident	84.1	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.01	19%	0.191	C	C	.	.	S	Bend	trans	77.1	-160.2	-176.3	0	0	0	0	0	113.5	T636 V637 G639 S724	T636-G666 PolarHBondContact O-N 3.36Å; V637-G666 CarbonylContact O-C 3.51Å; V637-G666 WeakPolarHBondContact O-CA 3.44Å; G639-G666 WeakPolarHBondContact O-CA 3.37Å; G639-G666 PolarHBondContact O-N 3.47Å; G666-S724 PolarHBondContact O-N 3.19Å
667	A	87.6	Confident	84	Confident	12 Å²	12	29.3 Å²	29.3	10%	0.099	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	158.6	176.7	0	0	0	0	0	109.8	L389 V637 A722 F723	L389-A667 HydrophobicContact CB-CB 4.07Å; L389-A667 HydrophobicContact CD1-CB 4.11Å; V637-A667 HydrophobicContact CG1-CB 4.13Å; A667-A722 CarbonylContact C-O 3.57Å; A667-A722 WeakPolarHBondContact CA-O 3.16Å; A667-F723 HydrophobicContact CB-CD1 3.65Å; A667-F723 HydrophobicContact CB-CE1 4.05Å
668	I	88.9	Confident	84	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	142.9	176.6	-166.7	169.4	0	0	0	111.2	F641 S677 V679 V690 I693 F721 A722	F641-I668 HydrophobicContact CD2-CB 4.05Å; F641-I668 HydrophobicContact CE1-CD1 3.96Å; F641-I668 HydrophobicContact CE2-CB 3.58Å; F641-I668 HydrophobicContact CE2-CD1 4.21Å; F641-I668 HydrophobicContact CE2-CG1 4.41Å; F641-I668 HydrophobicContact CE2-CG2 3.8Å; F641-I668 HydrophobicContact CZ-CB 3.98Å; F641-I668 HydrophobicContact CZ-CD1 3.68Å; F641-I668 HydrophobicContact CZ-CG1 4.36Å; F641-I668 HydrophobicContact CZ-CG2 4.14Å; I668-S677 VanDerWaalsContact CG1-CB 3.49Å; I668-S677 WeakPolarHBondContact CG1-OG 3.1Å; I668-V679 HydrophobicContact CD1-CG1 3.81Å; I668-V690 HydrophobicContact CD1-CB 4.15Å; I668-V690 HydrophobicContact CD1-CG1 4.44Å; I668-V690 HydrophobicContact CD1-CG2 3.55Å; I668-I693 HydrophobicContact CG2-CD1 3.94Å; I668-I693 HydrophobicContact CG2-CG1 4.48Å; I668-F721 CarbonylContact O-C 3.57Å; I668-F721 VanDerWaalsContact O-CA 3.27Å; I668-F721 WeakPolarHBondContact O-CA 3.48Å; I668-A722 HydrophobicContact CG2-CB 3.96Å; I668-A722 PolarHBondContact N-O 2.67Å; I668-A722 PolarHBondContact O-N 3.16Å
669	S	85.5	Confident	84.1	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	134.7	-174.9	58.7	0	0	0	0	112.5	P675 S677	S669-P675 PolarHBondContact OG-O 3.49Å; S669-S677 PolarHBondContact N-OG 3.46Å; S669-S677 PolarHBondContact O-N 3.45Å; S669-S677 PolarHBondContact O-OG 3.08Å; S669-S677 PolarHBondContact OG-OG 3.36Å; S669-S677 VanDerWaalsContact OG-OG 3.1Å
670	S	84.9	Confident	84.1	Confident	2 Å²	2	33.1 Å²	33.1	1%	0.014	19%	0.193	C	C	.	.			trans	-155.4	120.6	177.7	-168.5	0	0	0	0	110.9	V690 K691 S692 K720	S670-V690 PolarHBondContact OG-O 3.49Å; S670-K691 PolarHBondContact OG-O 3.15Å; S670-S692 PolarHBondContact OG-N 3.42Å; S670-K720 PolarHBondContact N-O 2.77Å; S670-K720 WeakPolarHBondContact O-CA 3.46Å
671	G	71.7	Confident	84.2	Confident	30 Å²	30	33 Å²	33	31%	0.309	19%	0.191	S	C	.	.	S	Bend	trans	171.5	173.9	178.3	0	0	0	0	0	113.4
672	V	67.7	Low	84.2	Confident	129 Å²	129	33 Å²	33	78%	0.782	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.4	135.9	172.7	-174.6	0	0	0	0	109.1	I674	V672-I674 VanDerWaalsContact C-N 3.27Å; V672-I674 PolarHBondContact O-N 3.07Å
673	N	63.9	Low	84.1	Confident	169 Å²	169	34 Å²	34	90%	0.904	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.1	16.7	-176.5	-53.4	-25	0	0	0	116
674	I	76.7	Confident	83.9	Confident	37 Å²	37	36.2 Å²	36.2	19%	0.19	22%	0.216	C	C	.	.	S	Bend	trans	-125.3	139.4	176	-62.4	162.4	0	0	0	107.6	V672 T676 K720 F721	V672-I674 VanDerWaalsContact C-N 3.27Å; V672-I674 PolarHBondContact O-N 3.07Å; I674-T676 PolarHBondContact O-N 3.02Å; I674-T676 VanDerWaalsContact O-N 3.15Å; I674-K720 HydrophobicContact CD1-CB 3.97Å; I674-K720 HydrophobicContact CD1-CD 3.86Å; I674-K720 HydrophobicContact CD1-CG 4Å; I674-F721 HydrophobicContact CD1-CE1 4.41Å; I674-F721 HydrophobicContact CD1-CE2 4.16Å; I674-F721 HydrophobicContact CD1-CZ 3.68Å; I674-F721 HydrophobicContact CG1-CZ 4.35Å; I674-F721 HydrophobicContact CG2-CE1 3.96Å; I674-F721 HydrophobicContact CG2-CZ 4.17Å
675	P	71.5	Confident	83.8	Confident	88 Å²	88	39.9 Å²	39.9	57%	0.571	24%	0.236	S	C	*	.	P	Polyproline II helix	trans	-60.1	119.3	173.7	24.9	-33.9	0	0	0	110.4	S669 S677	S669-P675 PolarHBondContact OG-O 3.49Å; P675-S677 PolarHBondContact O-N 3.18Å
676	T	79.2	Confident	83.9	Confident	68 Å²	68	42.7 Å²	42.7	42%	0.417	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-69.2	125.8	175.5	43.5	0	0	0	0	109.9	I674 K678	I674-T676 PolarHBondContact O-N 3.02Å; I674-T676 VanDerWaalsContact O-N 3.15Å; T676-K678 PolarHBondContact O-N 2.79Å
677	S	83.8	Confident	84.1	Confident	4 Å²	4	51.2 Å²	51.2	3%	0.028	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-66.6	136.4	179.2	-52.3	0	0	0	0	111.4	I668 S669 P675 V690	I668-S677 VanDerWaalsContact CG1-CB 3.49Å; I668-S677 WeakPolarHBondContact CG1-OG 3.1Å; S669-S677 PolarHBondContact N-OG 3.46Å; S669-S677 PolarHBondContact O-N 3.45Å; S669-S677 PolarHBondContact O-OG 3.08Å; S669-S677 PolarHBondContact OG-OG 3.36Å; S669-S677 VanDerWaalsContact OG-OG 3.1Å; P675-S677 PolarHBondContact O-N 3.18Å; S677-V690 PolarHBondContact O-N 2.91Å
678	K	88.6	Confident	84.3	Confident	94 Å²	94	50.8 Å²	50.8	41%	0.409	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	134.2	168.5	-65.4	179.2	176.2	176.2	0	108	S381 T676 T688 P750	S381-K678 PolarHBondContact OG-NZ 2.69Å; T676-K678 PolarHBondContact O-N 2.79Å; K678-T688 WeakPolarHBondContact CA-O 3.44Å; K678-P750 VanDerWaalsContact O-CD 3.3Å; K678-P750 WeakPolarHBondContact O-CD 3.22Å
679	V	91.9	Very high	84.3	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.012	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	160.2	179.8	-58.2	0	0	0	0	110.3	F641 I668 T688 V690 L747 T748	F641-V679 HydrophobicContact CD1-CG1 3.96Å; F641-V679 HydrophobicContact CE1-CG1 3.83Å; I668-V679 HydrophobicContact CD1-CG1 3.81Å; V679-T688 VanDerWaalsContact CG2-OG1 3.23Å; V679-T688 WeakPolarHBondContact CG2-OG1 3.37Å; V679-T688 PolarHBondContact N-O 2.98Å; V679-T688 PolarHBondContact O-N 2.85Å; V679-V690 HydrophobicContact CG1-CG2 4.39Å; V679-V690 HydrophobicContact CG2-CG2 4.14Å; V679-L747 HydrophobicContact CG2-CB 4.48Å; V679-L747 HydrophobicContact CG2-CD1 4.45Å; V679-T748 CarbonylContact C-O 3.5Å; V679-T748 VanDerWaalsContact CA-O 3.31Å; V679-T748 WeakPolarHBondContact CA-O 3.27Å
680	I	92.9	Very high	84.6	Confident	4 Å²	4	52.4 Å²	52.4	2%	0.021	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	132.4	177.5	-163.2	163.9	0	0	0	110.7	L682 D685 R687 L747 T748 P753	I680-L682 HydrophobicContact CG1-CD2 4.45Å; I680-L682 HydrophobicContact CG2-CD1 4.31Å; I680-L682 HydrophobicContact CG2-CD2 4.45Å; I680-L682 HydrophobicContact CG2-CG 4.25Å; I680-D685 WeakPolarHBondContact CD1-OD1 3.46Å; I680-R687 HydrophobicContact CB-CG 4.45Å; I680-R687 HydrophobicContact CD1-CG 3.78Å; I680-R687 HydrophobicContact CG1-CG 3.92Å; I680-L747 WeakPolarHBondContact O-CA 3.32Å; I680-T748 VanDerWaalsContact CG2-OG1 3.29Å; I680-T748 WeakPolarHBondContact CG2-OG1 3.39Å; I680-T748 PolarHBondContact N-O 3.28Å; I680-T748 PolarHBondContact O-N 2.99Å; I680-P753 HydrophobicContact CG2-CB 4.36Å
681	C	92.6	Very high	84.7	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	111.8	-176.1	-61.2	0	0	0	0	110	S684 D685 V686 L741 L747	C681-S684 CarbonylContact O-C 3.55Å; C681-S684 PolarHBondContact O-N 2.72Å; C681-D685 WeakPolarHBondContact O-CA 3.16Å; C681-D685 PolarHBondContact O-N 3.49Å; C681-V686 VanDerWaalsContact CB-O 3.31Å; C681-V686 WeakPolarHBondContact CB-O 3.45Å; C681-V686 PolarHBondContact N-O 3.24Å; C681-V686 PolarHBondContact O-N 2.71Å; C681-L741 HydrophobicContact CB-CD2 3.88Å; C681-L747 HydrophobicContact CB-CD2 4.03Å; C681-L747 WeakPolarHBondContact SG-CD2 3.22Å
682	L	91.3	Very high	85.5	Confident	4 Å²	4	58 Å²	58	2%	0.021	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	131.5	-175.3	-59.2	171.9	0	0	0	109.8	I680 D745 L746 T748 P753 I754 C832	I680-L682 HydrophobicContact CG1-CD2 4.45Å; I680-L682 HydrophobicContact CG2-CD1 4.31Å; I680-L682 HydrophobicContact CG2-CD2 4.45Å; I680-L682 HydrophobicContact CG2-CG 4.25Å; L682-D745 WeakPolarHBondContact O-CB 3.35Å; L682-L746 PolarHBondContact N-O 2.84Å; L682-L746 PolarHBondContact O-N 3.26Å; L682-T748 HydrophobicContact CD1-CG2 3.95Å; L682-T748 WeakPolarHBondContact CD1-OG1 3.26Å; L682-P753 HydrophobicContact CD1-CB 4.15Å; L682-I754 HydrophobicContact CD1-CB 4.08Å; L682-I754 VanDerWaalsContact CD1-N 3.32Å; L682-C832 HydrophobicContact CB-CB 4.45Å
683	P	88.7	Confident	86.5	Confident	46 Å²	46	51.9 Å²	51.9	30%	0.299	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	cis	-88.7	-1	21.2	34.5	-36.7	0	0	0	116.4	D685 D745 P756 C832	P683-D685 VanDerWaalsContact C-N 3.27Å; P683-D685 PolarHBondContact O-N 3.33Å; P683-D745 WeakPolarHBondContact CD-OD1 3.41Å; P683-P756 HydrophobicContact CB-CB 4.37Å; P683-C832 VanDerWaalsContact CA-SG 3.58Å
684	S	87.6	Confident	87.6	Confident	46 Å²	46	45.7 Å²	45.7	32%	0.322	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-8.8	-171.5	-59.4	0	0	0	0	115.9	C681 V686 T740	C681-S684 CarbonylContact O-C 3.55Å; C681-S684 PolarHBondContact O-N 2.72Å; S684-V686 VanDerWaalsContact O-CG2 3.25Å; S684-V686 WeakPolarHBondContact O-CG2 3.36Å; S684-V686 PolarHBondContact O-N 2.89Å; S684-V686 VanDerWaalsContact O-N 3.15Å; S684-T740 PolarHBondContact OG-O 3.39Å
685	D	89.2	Confident	87.7	Confident	100 Å²	100	44.4 Å²	44.4	54%	0.535	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	21.3	-176.1	-156.8	47.1	0	0	0	116.1	I680 C681 P683	I680-D685 WeakPolarHBondContact CD1-OD1 3.46Å; C681-D685 WeakPolarHBondContact O-CA 3.16Å; C681-D685 PolarHBondContact O-N 3.49Å; P683-D685 VanDerWaalsContact C-N 3.27Å; P683-D685 PolarHBondContact O-N 3.33Å
686	V	91	Very high	87.8	Confident	58 Å²	58	41.5 Å²	41.5	35%	0.352	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	131.6	-177.3	-158.5	0	0	0	0	110.7	C681 S684 I735	C681-V686 VanDerWaalsContact CB-O 3.31Å; C681-V686 WeakPolarHBondContact CB-O 3.45Å; C681-V686 PolarHBondContact N-O 3.24Å; C681-V686 PolarHBondContact O-N 2.71Å; S684-V686 VanDerWaalsContact O-CG2 3.25Å; S684-V686 WeakPolarHBondContact O-CG2 3.36Å; S684-V686 PolarHBondContact O-N 2.89Å; S684-V686 VanDerWaalsContact O-N 3.15Å; V686-I735 HydrophobicContact CB-CD1 3.54Å; V686-I735 HydrophobicContact CG1-CD1 3.42Å; V686-I735 VanDerWaalsContact CG1-CD1 3.42Å; V686-I735 HydrophobicContact CG1-CG1 3.93Å; V686-I735 HydrophobicContact CG2-CD1 4.42Å
687	R	91.7	Very high	86.8	Confident	180 Å²	180	38.5 Å²	38.5	68%	0.679	19%	0.192	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	139.4	-177.6	-60.4	175.1	-172.2	-174.7	-0.1	111	I680	I680-R687 HydrophobicContact CB-CG 4.45Å; I680-R687 HydrophobicContact CD1-CG 3.78Å; I680-R687 HydrophobicContact CG1-CG 3.92Å
688	T	90.8	Very high	85.4	Confident	4 Å²	4	39.7 Å²	39.7	3%	0.025	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	166.7	177.5	59.6	0	0	0	0	111.9	K678 V679 L732 T733 I735	K678-T688 WeakPolarHBondContact CA-O 3.44Å; V679-T688 VanDerWaalsContact CG2-OG1 3.23Å; V679-T688 WeakPolarHBondContact CG2-OG1 3.37Å; V679-T688 PolarHBondContact N-O 2.98Å; V679-T688 PolarHBondContact O-N 2.85Å; T688-L732 HydrophobicContact CG2-CB 4.43Å; T688-L732 HydrophobicContact CG2-CD1 4.39Å; T688-T733 WeakPolarHBondContact CB-O 3.29Å; T688-T733 WeakPolarHBondContact CG2-O 3.5Å; T688-I735 HydrophobicContact CG2-CB 3.88Å; T688-I735 HydrophobicContact CG2-CD1 3.2Å; T688-I735 HydrophobicContact CG2-CG1 3.57Å
689	C	89.9	Confident	83.4	Confident	35 Å²	35	37 Å²	37	24%	0.236	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	148.1	165.1	-50.9	0	0	0	0	109.8	T733	C689-T733 WeakPolarHBondContact CB-OG1 3.24Å; C689-T733 PolarHBondContact O-N 2.89Å; C689-T733 PolarHBondContact O-OG1 3.12Å
690	V	90.9	Very high	80.8	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	116.1	174.6	-179.4	0	0	0	0	110.3	I668 S670 S677 V679 I693 L730 L732	I668-V690 HydrophobicContact CD1-CB 4.15Å; I668-V690 HydrophobicContact CD1-CG1 4.44Å; I668-V690 HydrophobicContact CD1-CG2 3.55Å; S670-V690 PolarHBondContact OG-O 3.49Å; S677-V690 PolarHBondContact O-N 2.91Å; V679-V690 HydrophobicContact CG1-CG2 4.39Å; V679-V690 HydrophobicContact CG2-CG2 4.14Å; V690-I693 HydrophobicContact CG1-CG1 3.92Å; V690-L730 HydrophobicContact CG1-CB 4.49Å; V690-L730 HydrophobicContact CG1-CD2 4.17Å; V690-L732 HydrophobicContact CG2-CD2 3.83Å
691	K	88.1	Confident	77.8	Confident	132 Å²	132	48.2 Å²	48.2	57%	0.574	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	-29.2	-175.2	170.5	177.3	177.3	-176.4	0	114.2	S670 M731 T733	S670-K691 PolarHBondContact OG-O 3.15Å; K691-M731 HydrophobicContact CB-CG 4.5Å; K691-M731 HydrophobicContact CD-SD 4.04Å; K691-M731 HydrophobicContact CG-SD 4.39Å; K691-M731 PolarHBondContact N-O 3.24Å; K691-T733 HydrophobicContact CB-CG2 3.7Å; K691-T733 HydrophobicContact CD-CG2 3.98Å; K691-T733 HydrophobicContact CG-CG2 4.42Å
692	S	87.4	Confident	74.9	Confident	17 Å²	17	52.2 Å²	52.2	12%	0.119	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	140.3	169.8	67.4	0	0	0	0	110.6	S670 M731	S670-S692 PolarHBondContact OG-N 3.42Å; S692-M731 PolarHBondContact O-N 3.41Å; S692-M731 VanDerWaalsContact OG-CB 3.3Å; S692-M731 WeakPolarHBondContact OG-CB 3.41Å
693	I	88.8	Confident	72.1	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	137.6	169.8	-58.2	154.4	0	0	0	107.7	I668 V690 V718 V719 A722 V728 L730	I668-I693 HydrophobicContact CG2-CD1 3.94Å; I668-I693 HydrophobicContact CG2-CG1 4.48Å; V690-I693 HydrophobicContact CG1-CG1 3.92Å; I693-V718 WeakPolarHBondContact O-CA 3.46Å; I693-V718 WeakPolarHBondContact O-CG1 3.39Å; I693-V719 PolarHBondContact O-N 2.71Å; I693-A722 HydrophobicContact CG2-CB 3.93Å; I693-V728 HydrophobicContact CG2-CB 4.03Å; I693-V728 HydrophobicContact CG2-CG1 4.07Å; I693-V728 HydrophobicContact CG2-CG2 4.33Å; I693-L730 HydrophobicContact CB-CD2 4.33Å; I693-L730 HydrophobicContact CG1-CD2 3.83Å; I693-L730 HydrophobicContact CG2-CD2 4.15Å
694	R	86.7	Confident	69.2	Low	39 Å²	39	66.2 Å²	66.2	15%	0.147	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	131.4	171.3	-53.2	-166.1	-164.5	-167.1	4.1	109.7	M658 L715 V718 V728 A729	M658-R694 HydrophobicContact CE-CB 4.29Å; M658-R694 HydrophobicContact CE-CG 3.77Å; R694-L715 WeakPolarHBondContact CD-O 3.22Å; R694-L715 PolarHBondContact NH1-O 3.39Å; R694-V718 HydrophobicContact CG-CG2 4.32Å; R694-V728 CarbonylContact O-C 3.45Å; R694-V728 VanDerWaalsContact O-CA 3.29Å; R694-V728 WeakPolarHBondContact O-CA 3.42Å; R694-V728 WeakPolarHBondContact O-CB 3.46Å; R694-A729 PolarHBondContact N-O 2.86Å; R694-A729 PolarHBondContact O-N 3.04Å
695	S	79.9	Confident	66.7	Low	10 Å²	10	69.3 Å²	69.3	7%	0.07	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	137.6	174.9	173	0	0	0	0	110.2	C697 N698	S695-C697 PolarHBondContact OG-N 3.23Å; S695-C697 VanDerWaalsContact OG-N 3.15Å; S695-C697 PolarHBondContact OG-SG 3.21Å; S695-N698 VanDerWaalsContact OG-CG 3.28Å; S695-N698 PolarHBondContact OG-N 2.94Å; S695-N698 PolarHBondContact OG-OD1 2.92Å
696	L	72	Confident	64	Low	28 Å²	28	69 Å²	69	15%	0.147	36%	0.359	C	S	.	.	S	Bend	trans	-96.1	-7.8	172.9	-155.7	66.3	0	0	0	112.2	L714 L715 Q727	L696-L714 HydrophobicContact CD1-CD2 3.82Å; L696-L714 HydrophobicContact CG-CD2 4.23Å; L696-L714 WeakPolarHBondContact O-CD2 3.35Å; L696-L715 HydrophobicContact CD1-CD2 3.61Å; L696-Q727 HydrophobicContact CB-CB 4.4Å; L696-Q727 PolarHBondContact N-O 2.95Å; L696-Q727 VanDerWaalsContact N-O 3.12Å
697	C	59.2	Low	61.1	Low	5 Å²	5	76 Å²	76	3%	0.034	39%	0.388	C	S	.	.	S	Bend	trans	-110.3	-0.4	-177.2	63.3	0	0	0	0	114.8	S477 A486 S695 T699	S477-C697 WeakPolarHBondContact CB-O 3.3Å; S477-C697 PolarHBondContact OG-O 3.17Å; A486-C697 HydrophobicContact CB-CB 4.38Å; S695-C697 PolarHBondContact OG-N 3.23Å; S695-C697 VanDerWaalsContact OG-N 3.15Å; S695-C697 PolarHBondContact OG-SG 3.21Å; C697-T699 PolarHBondContact O-N 3.49Å
698	N	54.7	Low	58.1	Low	29 Å²	29	71.3 Å²	71.3	16%	0.155	40%	0.396	C	S	.	.			trans	-91.1	99.6	178.5	-73	10.7	0	0	0	111.6	R484 S695 Q717	R484-N698 PolarHBondContact NH1-OD1 3.16Å; S695-N698 VanDerWaalsContact OG-CG 3.28Å; S695-N698 PolarHBondContact OG-N 2.94Å; S695-N698 PolarHBondContact OG-OD1 2.92Å; N698-Q717 VanDerWaalsContact CB-OE1 3.25Å; N698-Q717 PolarHBondContact ND2-OE1 2.73Å
699	T	45.9	Very low	55.2	Low	37 Å²	37	78.5 Å²	78.5	23%	0.227	43%	0.434	C	S	.	.			trans	-73.9	149.2	159.7	51	0	0	0	0	110.1	C697 T701	C697-T699 PolarHBondContact O-N 3.49Å; T699-T701 PolarHBondContact O-N 3.08Å
700	R	36.8	Very low	52.5	Low	158 Å²	158	84.3 Å²	84.3	60%	0.596	46%	0.462	S	S	*	.			trans	-72.1	87	-176.6	-72.6	-166.2	-171.4	-171.3	6.9	112.1	S702 D705 D716	R700-S702 VanDerWaalsContact C-N 3.26Å; R700-S702 PolarHBondContact O-N 3.42Å; R700-S702 VanDerWaalsContact O-N 3.1Å; R700-D705 IonicContact CZ-OD2 3.54Å; R700-D705 IonicContact NH1-OD2 3.51Å; R700-D705 PolarHBondContact NH1-OD2 2.92Å; R700-D716 IonicContact NH2-OD2 2.78Å
701	T	30.5	Very low	49.5	Very low	84 Å²	84	87.1 Å²	87.1	52%	0.515	49%	0.491	S	S	.	.			trans	-80.7	71.8	162	34.7	0	0	0	0	110.8	E479 T699	E479-T701 PolarHBondContact OE1-OG1 2.95Å; E479-T701 WeakPolarHBondContact OE2-CG2 3.45Å; T699-T701 PolarHBondContact O-N 3.08Å
702	S	32.5	Very low	46.7	Very low	83 Å²	83	84.5 Å²	84.5	58%	0.58	50%	0.502	S	S	*	.			trans	-149.6	116.9	172.8	-71.6	0	0	0	0	110.4	R700 N704	R700-S702 VanDerWaalsContact C-N 3.26Å; R700-S702 PolarHBondContact O-N 3.42Å; R700-S702 VanDerWaalsContact O-N 3.1Å; S702-N704 PolarHBondContact O-N 3.14Å; S702-N704 VanDerWaalsContact O-N 3.08Å
703	Q	31.3	Very low	44.6	Very low	198 Å²	198	90.5 Å²	90.5	93%	0.925	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	15.5	-165	-64.4	173.5	-26.9	0	0	114.8
704	N	27.8	Very low	42.6	Very low	147 Å²	147	94.6 Å²	94.6	79%	0.786	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	-9.9	-159.4	-66.9	-1.7	0	0	0	115.5	S702	S702-N704 PolarHBondContact O-N 3.14Å; S702-N704 VanDerWaalsContact O-N 3.08Å
705	D	35.4	Very low	40.9	Very low	111 Å²	111	94.6 Å²	94.6	59%	0.594	55%	0.55	S	S	*	.			trans	-90.2	110.2	178.8	-68.3	-29.4	0	0	0	110.4	R700	R700-D705 IonicContact CZ-OD2 3.54Å; R700-D705 IonicContact NH1-OD2 3.51Å; R700-D705 PolarHBondContact NH1-OD2 2.92Å
706	A	33.5	Very low	39.6	Very low	94 Å²	94	97.3 Å²	97.3	78%	0.777	56%	0.563	S	S	*	*			trans	-73.9	159.6	178.7	0	0	0	0	0	113.3
707	E	30.1	Very low	39.3	Very low	203 Å²	203	100.4 Å²	100.4	95%	0.949	58%	0.577	S	S	*	*	S	Bend	trans	1.4	125.2	167.1	-56.6	-173.7	123.8	0	0	118.8
708	G	27.8	Very low	40.1	Very low	82 Å²	82	104.3 Å²	104.3	85%	0.845	60%	0.601	S	S	*	*	S	Bend	trans	177.8	-84	162	0	0	0	0	0	115.9
709	D	30.7	Very low	41.4	Very low	155 Å²	155	105 Å²	105	83%	0.829	61%	0.606	S	S	*	*			trans	-145.8	91.4	-158.6	-161.7	8.6	0	0	0	111.9	G711	D709-G711 PolarHBondContact O-N 2.91Å
710	L	33.3	Very low	43.1	Very low	157 Å²	157	109.5 Å²	109.5	82%	0.822	62%	0.623	S	S	*	*			trans	-102.4	53.4	-169.2	-146.6	81.1	0	0	0	113.3	Q436	Q436-L710 PolarHBondContact NE2-O 3.08Å
711	G	27.5	Very low	45.4	Very low	60 Å²	60	102.7 Å²	102.7	62%	0.619	60%	0.597	S	S	*	*	S	Bend	trans	-162	113	173.5	0	0	0	0	0	113.8	D709	D709-G711 PolarHBondContact O-N 2.91Å
712	G	29.8	Very low	48.1	Very low	78 Å²	78	98.8 Å²	98.8	80%	0.804	57%	0.573	S	S	*	*	S	Bend	trans	127.4	-0.3	163.8	0	0	0	0	0	117.8
713	K	43.3	Very low	50.7	Low	143 Å²	143	95.4 Å²	95.4	62%	0.622	55%	0.548	S	S	*	.			trans	-128.6	60.2	-174.1	-66.3	-150.4	-179.9	-170.2	0	115.8	L715 D716	K713-L715 PolarHBondContact O-N 2.93Å; K713-D716 HydrophobicContact CB-CB 4.43Å; K713-D716 HydrophobicContact CD-CB 4.48Å; K713-D716 VanDerWaalsContact CD-CG 3.42Å; K713-D716 WeakPolarHBondContact CD-OD1 3.4Å; K713-D716 WeakPolarHBondContact CD-OD2 3.5Å; K713-D716 IonicContact NZ-OD1 3.68Å; K713-D716 PolarHBondContact NZ-OD1 2.6Å; K713-D716 IonicContact NZ-OD2 2.72Å; K713-D716 PolarHBondContact NZ-OD2 2.8Å
714	L	47.1	Very low	53.5	Low	86 Å²	86	86.2 Å²	86.2	45%	0.45	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-11.2	165.4	-159.2	137.9	0	0	0	112.4	L696	L696-L714 HydrophobicContact CD1-CD2 3.82Å; L696-L714 HydrophobicContact CG-CD2 4.23Å; L696-L714 WeakPolarHBondContact O-CD2 3.35Å
715	L	50.5	Low	56.4	Low	39 Å²	39	79.3 Å²	79.3	20%	0.204	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	12.7	-172.6	-60.9	173.7	0	0	0	114.9	F649 P651 R694 L696 K713	F649-L715 HydrophobicContact CE2-CD1 3.72Å; F649-L715 HydrophobicContact CE2-CD2 4.39Å; F649-L715 HydrophobicContact CZ-CD1 3.99Å; F649-L715 HydrophobicContact CZ-CD2 3.89Å; P651-L715 HydrophobicContact CB-CD1 3.96Å; R694-L715 WeakPolarHBondContact CD-O 3.22Å; R694-L715 PolarHBondContact NH1-O 3.39Å; L696-L715 HydrophobicContact CD1-CD2 3.61Å; K713-L715 PolarHBondContact O-N 2.93Å
716	D	52.3	Low	58.9	Low	66 Å²	66	74.9 Å²	74.9	35%	0.353	45%	0.446	S	S	.	.			trans	-91	-15.5	-172.6	-102.7	15.6	0	0	0	115	R700 K713 V718	R700-D716 IonicContact NH2-OD2 2.78Å; K713-D716 HydrophobicContact CB-CB 4.43Å; K713-D716 HydrophobicContact CD-CB 4.48Å; K713-D716 VanDerWaalsContact CD-CG 3.42Å; K713-D716 WeakPolarHBondContact CD-OD1 3.4Å; K713-D716 WeakPolarHBondContact CD-OD2 3.5Å; K713-D716 IonicContact NZ-OD1 3.68Å; K713-D716 PolarHBondContact NZ-OD1 2.6Å; K713-D716 IonicContact NZ-OD2 2.72Å; K713-D716 PolarHBondContact NZ-OD2 2.8Å; D716-V718 PolarHBondContact O-N 2.87Å
717	Q	65.4	Low	61.5	Low	94 Å²	94	70.8 Å²	70.8	44%	0.439	41%	0.41	S	S	.	.			trans	-87.4	102.5	178.2	-161.4	177.3	46.4	0	0	111.9	N698	N698-Q717 VanDerWaalsContact CB-OE1 3.25Å; N698-Q717 PolarHBondContact ND2-OE1 2.73Å
718	V	75.9	Confident	64.4	Low	87 Å²	87	61.3 Å²	61.3	53%	0.527	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	129.2	166.4	-179.3	0	0	0	0	108.9	I693 R694 D716	I693-V718 WeakPolarHBondContact O-CA 3.46Å; I693-V718 WeakPolarHBondContact O-CG1 3.39Å; R694-V718 HydrophobicContact CG-CG2 4.32Å; D716-V718 PolarHBondContact O-N 2.87Å
719	V	81.2	Confident	67.4	Low	44 Å²	44	57.4 Å²	57.4	27%	0.267	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	145.8	178.1	-168.5	0	0	0	0	108.7	I693 F721	I693-V719 PolarHBondContact O-N 2.71Å; V719-F721 VanDerWaalsContact CG1-O 3.25Å; V719-F721 WeakPolarHBondContact CG1-O 3.33Å
720	K	82.9	Confident	70.3	Confident	131 Å²	131	50 Å²	50	57%	0.57	29%	0.287	S	S	*	.	S	Bend	trans	-74.6	-27.7	-177.6	-69.5	172.4	172.4	-177.7	0	113.6	S670 I674	S670-K720 PolarHBondContact N-O 2.77Å; S670-K720 WeakPolarHBondContact O-CA 3.46Å; I674-K720 HydrophobicContact CD1-CB 3.97Å; I674-K720 HydrophobicContact CD1-CD 3.86Å; I674-K720 HydrophobicContact CD1-CG 4Å
721	F	84.9	Confident	73.1	Confident	15 Å²	15	43.2 Å²	43.2	7%	0.066	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	156.5	-173.2	-54.4	-76.5	0	0	0	110.4	L389 E392 I668 I674 V719 F723	L389-F721 HydrophobicContact CD2-CD1 4.03Å; L389-F721 HydrophobicContact CD2-CE1 3.94Å; E392-F721 HydrophobicContact CG-CD2 4.37Å; E392-F721 HydrophobicContact CG-CE2 4.02Å; E392-F721 HydrophobicContact CG-CZ 4.2Å; E392-F721 WeakPolarHBondContact OE1-CE2 3.48Å; E392-F721 WeakPolarHBondContact OE1-CZ 3.47Å; E392-F721 WeakPolarHBondContact OE2-CZ 3.24Å; I668-F721 CarbonylContact O-C 3.57Å; I668-F721 VanDerWaalsContact O-CA 3.27Å; I668-F721 WeakPolarHBondContact O-CA 3.48Å; I674-F721 HydrophobicContact CD1-CE1 4.41Å; I674-F721 HydrophobicContact CD1-CE2 4.16Å; I674-F721 HydrophobicContact CD1-CZ 3.68Å; I674-F721 HydrophobicContact CG1-CZ 4.35Å; I674-F721 HydrophobicContact CG2-CE1 3.96Å; I674-F721 HydrophobicContact CG2-CZ 4.17Å; V719-F721 VanDerWaalsContact CG1-O 3.25Å; V719-F721 WeakPolarHBondContact CG1-O 3.33Å; F721-F723 HydrophobicContact CB-CE1 4.37Å; F721-F723 HydrophobicContact CB-CE2 4.01Å; F721-F723 HydrophobicContact CB-CZ 3.74Å; F721-F723 HydrophobicContact CG-CZ 4.34Å
722	A	87	Confident	76.1	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.008	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	143.9	162.5	0	0	0	0	0	109.6	V663 A667 I668 I693 V728	V663-A722 HydrophobicContact CG2-CB 4.35Å; A667-A722 CarbonylContact C-O 3.57Å; A667-A722 WeakPolarHBondContact CA-O 3.16Å; I668-A722 HydrophobicContact CG2-CB 3.96Å; I668-A722 PolarHBondContact N-O 2.67Å; I668-A722 PolarHBondContact O-N 3.16Å; I693-A722 HydrophobicContact CG2-CB 3.93Å; A722-V728 HydrophobicContact CB-CG1 3.71Å; A722-V728 HydrophobicContact CB-CG2 4.17Å
723	F	88.2	Confident	78.9	Confident	12 Å²	12	38.9 Å²	38.9	5%	0.053	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	163.7	-171.8	-57	-73.7	0	0	0	110.9	Y393 L396 V637 V663 A667 F721 G725 D726	Y393-F723 HydrophobicContact CD2-CB 3.99Å; Y393-F723 AromaticContact CD2-CD1 3.59Å; Y393-F723 HydrophobicContact CD2-CD1 3.59Å; Y393-F723 AromaticContact CD2-CD2 3.94Å; Y393-F723 HydrophobicContact CD2-CD2 3.94Å; Y393-F723 HydrophobicContact CD2-CE1 4.02Å; Y393-F723 HydrophobicContact CD2-CE2 4.32Å; Y393-F723 AromaticContact CD2-CG 3.55Å; Y393-F723 HydrophobicContact CD2-CG 3.55Å; Y393-F723 HydrophobicContact CD2-CZ 4.36Å; Y393-F723 HydrophobicContact CE2-CB 4.13Å; Y393-F723 HydrophobicContact CE2-CG 4.16Å; Y393-F723 HydrophobicContact CG-CD1 4.2Å; Y393-F723 HydrophobicContact CG-CE1 4.34Å; L396-F723 HydrophobicContact CD1-CE2 3.78Å; L396-F723 HydrophobicContact CD1-CZ 3.85Å; V637-F723 HydrophobicContact CG1-CD1 3.96Å; V637-F723 HydrophobicContact CG2-CB 4.4Å; V663-F723 WeakPolarHBondContact CB-O 3.29Å; A667-F723 HydrophobicContact CB-CD1 3.65Å; A667-F723 HydrophobicContact CB-CE1 4.05Å; F721-F723 HydrophobicContact CB-CE1 4.37Å; F721-F723 HydrophobicContact CB-CE2 4.01Å; F721-F723 HydrophobicContact CB-CZ 3.74Å; F721-F723 HydrophobicContact CG-CZ 4.34Å; F723-G725 PolarHBondContact O-N 2.96Å; F723-D726 PolarHBondContact N-OD2 3.11Å; F723-D726 WeakPolarHBondContact O-CB 3.36Å; F723-D726 PolarHBondContact O-N 2.81Å; F723-D726 VanDerWaalsContact O-N 3.15Å
724	S	89.7	Confident	80.9	Confident	5 Å²	5	38.5 Å²	38.5	4%	0.035	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-37	130.3	167.1	172.3	0	0	0	0	110.6	R635 T636 I664 G666	R635-S724 WeakPolarHBondContact CD-O 3.41Å; R635-S724 PolarHBondContact NH1-O 3.02Å; T636-S724 PolarHBondContact N-OG 3.13Å; T636-S724 VanDerWaalsContact N-OG 3.16Å; I664-S724 PolarHBondContact O-OG 2.92Å; G666-S724 PolarHBondContact O-N 3.19Å
725	G	87.1	Confident	82.8	Confident	3 Å²	3	35.8 Å²	35.8	3%	0.031	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.3	-11.9	177.6	0	0	0	0	0	116.8	N407 R635 R662 V663 F723	N407-G725 PolarHBondContact ND2-O 3.03Å; R635-G725 VanDerWaalsContact NH1-C 3.32Å; R662-G725 PolarHBondContact NE-O 3.23Å; R662-G725 PolarHBondContact NH2-O 2.8Å; V663-G725 WeakPolarHBondContact O-CA 3.39Å; V663-G725 PolarHBondContact O-N 2.86Å; F723-G725 PolarHBondContact O-N 2.96Å
726	D	88	Confident	84.6	Confident	17 Å²	17	36.6 Å²	36.6	9%	0.091	19%	0.191	C	C	.	.			trans	-83.2	148.3	-176	-61.4	-25.4	0	0	0	113.6	I405 R635 R662 V663 F723 V728	I405-D726 VanDerWaalsContact CD1-OD1 3.25Å; I405-D726 WeakPolarHBondContact CD1-OD1 3.48Å; R635-D726 IonicContact CZ-OD1 3.56Å; R635-D726 IonicContact NH1-OD1 3.61Å; R635-D726 PolarHBondContact NH1-OD1 2.77Å; R635-D726 IonicContact NH2-OD1 3.14Å; R662-D726 WeakPolarHBondContact CA-O 3.37Å; V663-D726 PolarHBondContact N-O 2.78Å; F723-D726 PolarHBondContact N-OD2 3.11Å; F723-D726 WeakPolarHBondContact O-CB 3.36Å; F723-D726 PolarHBondContact O-N 2.81Å; F723-D726 VanDerWaalsContact O-N 3.15Å; D726-V728 HydrophobicContact CB-CG1 4.35Å
727	Q	89.1	Confident	86.2	Confident	8 Å²	8	33.6 Å²	33.6	4%	0.037	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	117.8	172.7	-61.1	-172.2	19.7	0	0	110.1	N407 G661 L696	N407-Q727 WeakPolarHBondContact OD1-CG 3.32Å; N407-Q727 PolarHBondContact OD1-NE2 2.83Å; G661-Q727 WeakPolarHBondContact O-CA 3.1Å; L696-Q727 HydrophobicContact CB-CB 4.4Å; L696-Q727 PolarHBondContact N-O 2.95Å; L696-Q727 VanDerWaalsContact N-O 3.12Å
728	V	90.5	Very high	87.3	Confident	5 Å²	5	33.8 Å²	33.8	3%	0.03	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	149.6	-173.4	-61.7	0	0	0	0	112.7	F643 G661 V663 I693 R694 A722 D726 L730	F643-V728 HydrophobicContact CD2-CG2 4.4Å; F643-V728 HydrophobicContact CE2-CG2 3.74Å; G661-V728 PolarHBondContact N-O 3.47Å; G661-V728 VanDerWaalsContact N-O 3.1Å; G661-V728 PolarHBondContact O-N 3.41Å; V663-V728 HydrophobicContact CG2-CG2 4.26Å; I693-V728 HydrophobicContact CG2-CB 4.03Å; I693-V728 HydrophobicContact CG2-CG1 4.07Å; I693-V728 HydrophobicContact CG2-CG2 4.33Å; R694-V728 CarbonylContact O-C 3.45Å; R694-V728 VanDerWaalsContact O-CA 3.29Å; R694-V728 WeakPolarHBondContact O-CA 3.42Å; R694-V728 WeakPolarHBondContact O-CB 3.46Å; A722-V728 HydrophobicContact CB-CG1 3.71Å; A722-V728 HydrophobicContact CB-CG2 4.17Å; D726-V728 HydrophobicContact CB-CG1 4.35Å; V728-L730 HydrophobicContact CG2-CD2 3.83Å; V728-L730 HydrophobicContact CG2-CG 4.3Å
729	A	91.3	Very high	87.8	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	120	168.6	0	0	0	0	0	109.5	F649 M658 V659 R694	F649-A729 HydrophobicContact CZ-CB 4.12Å; M658-A729 HydrophobicContact CB-CB 4.48Å; M658-A729 HydrophobicContact CE-CB 3.62Å; M658-A729 WeakPolarHBondContact CE-O 3.42Å; M658-A729 HydrophobicContact SD-CB 4.46Å; V659-A729 WeakPolarHBondContact O-CA 3.47Å; R694-A729 PolarHBondContact N-O 2.86Å; R694-A729 PolarHBondContact O-N 3.04Å
730	L	91.6	Very high	88.1	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	132.7	179.6	-56.3	-179	0	0	0	110.4	F643 M658 V659 V690 I693 V728 L732 L747	F643-L730 HydrophobicContact CD1-CD1 4.06Å; F643-L730 HydrophobicContact CD2-CD1 4.11Å; F643-L730 HydrophobicContact CE1-CD1 3.8Å; F643-L730 HydrophobicContact CE1-CG 4.43Å; F643-L730 HydrophobicContact CE2-CD1 3.86Å; F643-L730 HydrophobicContact CE2-CG 4.09Å; F643-L730 HydrophobicContact CG-CD1 4.19Å; F643-L730 HydrophobicContact CZ-CD1 3.67Å; F643-L730 HydrophobicContact CZ-CG 3.89Å; M658-L730 WeakPolarHBondContact CA-O 3.48Å; V659-L730 PolarHBondContact N-O 2.66Å; V659-L730 PolarHBondContact O-N 2.9Å; V690-L730 HydrophobicContact CG1-CB 4.49Å; V690-L730 HydrophobicContact CG1-CD2 4.17Å; I693-L730 HydrophobicContact CB-CD2 4.33Å; I693-L730 HydrophobicContact CG1-CD2 3.83Å; I693-L730 HydrophobicContact CG2-CD2 4.15Å; V728-L730 HydrophobicContact CG2-CD2 3.83Å; V728-L730 HydrophobicContact CG2-CG 4.3Å; L730-L732 HydrophobicContact CB-CD2 4.2Å; L730-L747 HydrophobicContact CD1-CD1 3.97Å
731	M	91.3	Very high	88.4	Confident	13 Å²	13	30 Å²	30	6%	0.064	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	107.8	164.7	-175.1	174.7	-71.9	0	0	108.8	V656 M658 K691 S692	V656-M731 HydrophobicContact CB-CE 3.98Å; V656-M731 HydrophobicContact CB-SD 4.32Å; V656-M731 HydrophobicContact CG1-CE 3.96Å; V656-M731 HydrophobicContact CG1-CG 3.77Å; V656-M731 HydrophobicContact CG1-SD 3.85Å; M658-M731 HydrophobicContact CE-CB 4.27Å; M658-M731 HydrophobicContact CG-CE 4.35Å; M658-M731 HydrophobicContact SD-CE 4.42Å; K691-M731 HydrophobicContact CB-CG 4.5Å; K691-M731 HydrophobicContact CD-SD 4.04Å; K691-M731 HydrophobicContact CG-SD 4.39Å; K691-M731 PolarHBondContact N-O 3.24Å; S692-M731 PolarHBondContact O-N 3.41Å; S692-M731 VanDerWaalsContact OG-CB 3.3Å; S692-M731 WeakPolarHBondContact OG-CB 3.41Å
732	L	90.8	Very high	88.6	Confident	11 Å²	11	33.8 Å²	33.8	6%	0.058	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	156.9	175.1	-52.4	-173.9	0	0	0	110.7	V659 T688 V690 L730 L741 L747	V659-L732 HydrophobicContact CG2-CD1 3.92Å; V659-L732 HydrophobicContact CG2-CG 4.17Å; T688-L732 HydrophobicContact CG2-CB 4.43Å; T688-L732 HydrophobicContact CG2-CD1 4.39Å; V690-L732 HydrophobicContact CG2-CD2 3.83Å; L730-L732 HydrophobicContact CB-CD2 4.2Å; L732-L741 HydrophobicContact CD1-CD1 3.99Å; L732-L747 HydrophobicContact CD1-CD1 4.33Å; L732-L747 HydrophobicContact CD2-CD1 4.23Å
733	T	88.9	Confident	88.7	Confident	36 Å²	36	36.1 Å²	36.1	22%	0.221	19%	0.189	C	C	.	.	S	Bend	trans	-107.8	166.8	165.3	58	0	0	0	0	111.3	T688 C689 K691 I735	T688-T733 WeakPolarHBondContact CB-O 3.29Å; T688-T733 WeakPolarHBondContact CG2-O 3.5Å; C689-T733 WeakPolarHBondContact CB-OG1 3.24Å; C689-T733 PolarHBondContact O-N 2.89Å; C689-T733 PolarHBondContact O-OG1 3.12Å; K691-T733 HydrophobicContact CB-CG2 3.7Å; K691-T733 HydrophobicContact CD-CG2 3.98Å; K691-T733 HydrophobicContact CG-CG2 4.42Å; T733-I735 PolarHBondContact O-N 3.47Å
734	D	85.1	Confident	88.7	Confident	135 Å²	135	35.7 Å²	35.7	72%	0.722	19%	0.187	S	C	*	.	S	Bend	trans	67.4	5.4	166.9	-39.3	-54.8	0	0	0	115.5
735	I	87.4	Confident	88.8	Confident	30 Å²	30	36.2 Å²	36.2	15%	0.154	19%	0.19	C	C	.	.	S	Bend	trans	-140.2	146.2	-179.7	-81.4	-171.8	0	0	0	111	V686 T688 T733 P737 T740	V686-I735 HydrophobicContact CB-CD1 3.54Å; V686-I735 HydrophobicContact CG1-CD1 3.42Å; V686-I735 VanDerWaalsContact CG1-CD1 3.42Å; V686-I735 HydrophobicContact CG1-CG1 3.93Å; V686-I735 HydrophobicContact CG2-CD1 4.42Å; T688-I735 HydrophobicContact CG2-CB 3.88Å; T688-I735 HydrophobicContact CG2-CD1 3.2Å; T688-I735 HydrophobicContact CG2-CG1 3.57Å; T733-I735 PolarHBondContact O-N 3.47Å; I735-P737 WeakPolarHBondContact O-CD 3.4Å; I735-T740 HydrophobicContact CG2-CG2 3.96Å; I735-T740 WeakPolarHBondContact CG2-OG1 3.38Å
736	D	88.8	Confident	89.1	Confident	55 Å²	55	36.1 Å²	36.1	29%	0.294	19%	0.188	S	C	.	.			trans	-93.2	103.3	155.6	-179.4	15.6	0	0	0	109.8	F738 Q739 T740	D736-F738 PolarHBondContact O-N 3.48Å; D736-F738 VanDerWaalsContact O-N 3.13Å; D736-F738 PolarHBondContact OD1-N 3.13Å; D736-Q739 PolarHBondContact O-N 3.4Å; D736-Q739 PolarHBondContact OD2-NE2 3.15Å; D736-T740 PolarHBondContact O-OG1 3.06Å
737	P	85.4	Confident	89.4	Confident	4 Å²	4	35.3 Å²	35.3	3%	0.026	18%	0.184	C	C	.	.	H	α-helix	trans	-60.2	-27	-174.1	25	-36.4	0	0	0	113.1	I648 P657 V659 I735 Q739 T740 L741	I648-P737 HydrophobicContact CD1-CB 4.46Å; I648-P737 HydrophobicContact CG2-CB 3.93Å; I648-P737 HydrophobicContact CG2-CG 3.97Å; P657-P737 HydrophobicContact CB-CG 3.73Å; P657-P737 VanDerWaalsContact CG-CD 3.43Å; P657-P737 HydrophobicContact CG-CG 3.49Å; P657-P737 VanDerWaalsContact CG-CG 3.49Å; V659-P737 HydrophobicContact CG2-CB 3.58Å; V659-P737 HydrophobicContact CG2-CG 4.02Å; I735-P737 WeakPolarHBondContact O-CD 3.4Å; P737-Q739 PolarHBondContact O-N 3.4Å; P737-Q739 VanDerWaalsContact O-N 3.12Å; P737-T740 PolarHBondContact O-N 2.83Å; P737-L741 HydrophobicContact CB-CD1 4.06Å; P737-L741 PolarHBondContact O-N 3.02Å
738	F	87.5	Confident	89.5	Confident	97 Å²	97	35 Å²	35	43%	0.425	18%	0.183	S	C	.	.	H	α-helix	trans	-63.5	-14.9	177.2	-82.1	-86.8	0	0	0	114.2	I648 K650 P657 D736	I648-F738 HydrophobicContact CG2-CD2 3.87Å; I648-F738 HydrophobicContact CG2-CE1 4.36Å; I648-F738 HydrophobicContact CG2-CE2 3.67Å; I648-F738 HydrophobicContact CG2-CG 4.29Å; I648-F738 HydrophobicContact CG2-CZ 3.96Å; I648-F738 WeakPolarHBondContact O-CE1 3.48Å; I648-F738 WeakPolarHBondContact O-CZ 3.39Å; K650-F738 HydrophobicContact CD-CE2 4.06Å; K650-F738 VanDerWaalsContact CE-CD2 3.41Å; K650-F738 HydrophobicContact CG-CE2 3.56Å; K650-F738 HydrophobicContact CG-CZ 3.96Å; P657-F738 HydrophobicContact CB-CD2 3.76Å; P657-F738 HydrophobicContact CB-CE2 3.57Å; P657-F738 HydrophobicContact CG-CD2 4.4Å; D736-F738 PolarHBondContact O-N 3.48Å; D736-F738 VanDerWaalsContact O-N 3.13Å; D736-F738 PolarHBondContact OD1-N 3.13Å
739	Q	87	Confident	89.5	Confident	142 Å²	142	35.2 Å²	35.2	66%	0.664	18%	0.184	S	C	*	.	H	α-helix	trans	-111.8	-16.3	179.7	-60.7	-180	48.8	0	0	113.4	D736 P737	D736-Q739 PolarHBondContact O-N 3.4Å; D736-Q739 PolarHBondContact OD2-NE2 3.15Å; P737-Q739 PolarHBondContact O-N 3.4Å; P737-Q739 VanDerWaalsContact O-N 3.12Å
740	T	86.9	Confident	89.3	Confident	32 Å²	32	37.6 Å²	37.6	20%	0.196	20%	0.199	C	C	.	.	H	α-helix	trans	-118	-20	-169.3	63	0	0	0	0	114.8	S684 I735 D736 P737	S684-T740 PolarHBondContact OG-O 3.39Å; I735-T740 HydrophobicContact CG2-CG2 3.96Å; I735-T740 WeakPolarHBondContact CG2-OG1 3.38Å; D736-T740 PolarHBondContact O-OG1 3.06Å; P737-T740 PolarHBondContact O-N 2.83Å
741	L	89.7	Confident	89	Confident	8 Å²	8	42 Å²	42	4%	0.042	22%	0.222	C	C	.	.			trans	-126	147.2	-176.2	-71.7	171.2	0	0	0	110.4	I648 V659 C681 L732 P737 D745 L747	I648-L741 HydrophobicContact CD1-CB 3.66Å; I648-L741 WeakPolarHBondContact CD1-O 2.95Å; V659-L741 HydrophobicContact CG1-CD1 4.25Å; V659-L741 HydrophobicContact CG2-CD1 3.99Å; C681-L741 HydrophobicContact CB-CD2 3.88Å; L732-L741 HydrophobicContact CD1-CD1 3.99Å; P737-L741 HydrophobicContact CB-CD1 4.06Å; P737-L741 PolarHBondContact O-N 3.02Å; L741-D745 WeakPolarHBondContact CA-OD2 3.36Å; L741-D745 HydrophobicContact CD2-CB 3.98Å; L741-L747 HydrophobicContact CD1-CD2 4.19Å; L741-L747 HydrophobicContact CD2-CD2 4.02Å
742	I	90.1	Very high	88.7	Confident	96 Å²	96	44.9 Å²	44.9	49%	0.492	24%	0.238	S	C	.	.			trans	-125.4	145.4	174.3	-56.7	178.4	0	0	0	107.4	G744 D745	I742-G744 PolarHBondContact O-N 3.31Å; I742-D745 PolarHBondContact N-OD2 3.25Å; I742-D745 VanDerWaalsContact O-CB 3.22Å; I742-D745 WeakPolarHBondContact O-CB 3.39Å; I742-D745 PolarHBondContact O-N 3.12Å
743	P	89	Confident	88.5	Confident	50 Å²	50	47.2 Å²	47.2	33%	0.325	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.7	131	166.8	-32.2	38.4	0	0	0	112.3	A786	P743-A786 WeakPolarHBondContact O-CB 3.2Å
744	G	88	Confident	88.6	Confident	2 Å²	2	46 Å²	46	2%	0.021	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	-8.8	-173.1	0	0	0	0	0	116.4	V645 I742	V645-G744 PolarHBondContact O-N 2.8Å; I742-G744 PolarHBondContact O-N 3.31Å
745	D	92.2	Very high	88.7	Confident	17 Å²	17	46.7 Å²	46.7	9%	0.091	25%	0.245	C	C	.	.			trans	-64.7	162.7	168.4	-76	-15.4	0	0	0	111.8	V645 L682 P683 L741 I742	V645-D745 HydrophobicContact CG2-CB 4.48Å; V645-D745 PolarHBondContact N-O 3.06Å; L682-D745 WeakPolarHBondContact O-CB 3.35Å; P683-D745 WeakPolarHBondContact CD-OD1 3.41Å; L741-D745 WeakPolarHBondContact CA-OD2 3.36Å; L741-D745 HydrophobicContact CD2-CB 3.98Å; I742-D745 PolarHBondContact N-OD2 3.25Å; I742-D745 VanDerWaalsContact O-CB 3.22Å; I742-D745 WeakPolarHBondContact O-CB 3.39Å; I742-D745 PolarHBondContact O-N 3.12Å
746	L	93.1	Very high	88.9	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	133.9	-175	-58.8	-175.7	0	0	0	111.9	F643 V644 L682 T748 I754 C832 L842	F643-L746 WeakPolarHBondContact O-CA 3.4Å; V644-L746 HydrophobicContact CB-CD2 4.42Å; V644-L746 HydrophobicContact CG2-CD2 3.5Å; V644-L746 VanDerWaalsContact CG2-CD2 3.5Å; L682-L746 PolarHBondContact N-O 2.84Å; L682-L746 PolarHBondContact O-N 3.26Å; L746-T748 HydrophobicContact CB-CG2 4.45Å; L746-I754 HydrophobicContact CD1-CD1 3.57Å; L746-C832 HydrophobicContact CD1-CB 3.8Å; L746-C832 HydrophobicContact CG-CB 4.27Å; L746-L842 HydrophobicContact CD1-CD1 4.03Å; L746-L842 HydrophobicContact CD1-CD2 4.2Å; L746-L842 HydrophobicContact CD2-CD2 3.83Å
747	L	93.2	Very high	88.9	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.1	161.6	-51.1	-175.3	0	0	0	108.5	F641 F643 V645 V679 I680 C681 L730 L732 L741	F641-L747 HydrophobicContact CE1-CB 4.36Å; F643-L747 HydrophobicContact CB-CB 4.29Å; F643-L747 HydrophobicContact CD1-CB 4.11Å; F643-L747 HydrophobicContact CD1-CD1 3.72Å; F643-L747 HydrophobicContact CD1-CG 3.87Å; F643-L747 HydrophobicContact CE1-CD1 3.96Å; F643-L747 HydrophobicContact CE1-CG 4.44Å; F643-L747 PolarHBondContact N-O 2.81Å; F643-L747 PolarHBondContact O-N 3.28Å; V645-L747 HydrophobicContact CG2-CG 4.39Å; V679-L747 HydrophobicContact CG2-CB 4.48Å; V679-L747 HydrophobicContact CG2-CD1 4.45Å; I680-L747 WeakPolarHBondContact O-CA 3.32Å; C681-L747 HydrophobicContact CB-CD2 4.03Å; C681-L747 WeakPolarHBondContact SG-CD2 3.22Å; L730-L747 HydrophobicContact CD1-CD1 3.97Å; L732-L747 HydrophobicContact CD1-CD1 4.33Å; L732-L747 HydrophobicContact CD2-CD1 4.23Å; L741-L747 HydrophobicContact CD1-CD2 4.19Å; L741-L747 HydrophobicContact CD2-CD2 4.02Å
748	T	92.3	Very high	89.3	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	170.5	178.6	69.6	0	0	0	0	112.7	F641 V679 I680 L682 L746 I754	F641-T748 VanDerWaalsContact O-CA 3.28Å; F641-T748 WeakPolarHBondContact O-CA 3.4Å; F641-T748 WeakPolarHBondContact O-CB 3.48Å; V679-T748 CarbonylContact C-O 3.5Å; V679-T748 VanDerWaalsContact CA-O 3.31Å; V679-T748 WeakPolarHBondContact CA-O 3.27Å; I680-T748 VanDerWaalsContact CG2-OG1 3.29Å; I680-T748 WeakPolarHBondContact CG2-OG1 3.39Å; I680-T748 PolarHBondContact N-O 3.28Å; I680-T748 PolarHBondContact O-N 2.99Å; L682-T748 HydrophobicContact CD1-CG2 3.95Å; L682-T748 WeakPolarHBondContact CD1-OG1 3.26Å; L746-T748 HydrophobicContact CB-CG2 4.45Å; T748-I754 HydrophobicContact CG2-CD1 3.77Å; T748-I754 HydrophobicContact CG2-CG1 4.07Å
749	D	89.3	Confident	89.6	Confident	10 Å²	10	45.3 Å²	45.3	5%	0.053	25%	0.25	C	S	.	.			trans	-57.3	143	162.7	-77.7	-39.4	0	0	0	111.1	R386 F641 D751 N752	R386-D749 IonicContact CZ-OD2 3.97Å; R386-D749 IonicContact NE-OD2 3.87Å; R386-D749 PolarHBondContact NE-OD2 3.29Å; R386-D749 IonicContact NH2-OD1 2.71Å; R386-D749 IonicContact NH2-OD2 3.75Å; R386-D749 PolarHBondContact NH2-OD2 3.5Å; F641-D749 HydrophobicContact CB-CB 4.48Å; F641-D749 VanDerWaalsContact CB-CG 3.49Å; F641-D749 WeakPolarHBondContact CB-OD1 3.29Å; F641-D749 PolarHBondContact N-OD2 3.46Å; F641-D749 PolarHBondContact O-N 3.3Å; D749-D751 PolarHBondContact O-N 3.48Å; D749-N752 CarbonylContact O-C 3.53Å; D749-N752 PolarHBondContact O-N 2.7Å
750	P	88.1	Confident	90	Very high	50 Å²	50	38.5 Å²	38.5	33%	0.325	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-17.8	172.9	30.8	-36.1	0	0	0	113	K678 N752	K678-P750 VanDerWaalsContact O-CD 3.3Å; K678-P750 WeakPolarHBondContact O-CD 3.22Å; P750-N752 VanDerWaalsContact C-N 3.34Å
751	D	85.8	Confident	90.4	Very high	91 Å²	91	37.5 Å²	37.5	49%	0.487	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-28	176.9	-54.4	-25.8	0	0	0	112.6	R386 D749	R386-D751 IonicContact CZ-OD2 3.44Å; R386-D751 IonicContact NH1-OD2 2.76Å; R386-D751 PolarHBondContact NH1-OD2 2.92Å; R386-D751 IonicContact NH2-OD2 3.18Å; R386-D751 PolarHBondContact NH2-OD2 2.73Å; D749-D751 PolarHBondContact O-N 3.48Å
752	N	84.7	Confident	90.6	Very high	75 Å²	75	37.1 Å²	37.1	40%	0.401	21%	0.211	S	C	.	.	S	Bend	trans	-142.5	68	-172.2	-178.9	65	0	0	0	110.7	P640 D749 P750	P640-N752 HydrophobicContact CB-CB 4.42Å; D749-N752 CarbonylContact O-C 3.53Å; D749-N752 PolarHBondContact O-N 2.7Å; P750-N752 VanDerWaalsContact C-N 3.34Å
753	P	86.8	Confident	90.8	Very high	60 Å²	60	35.6 Å²	35.6	39%	0.39	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-69.5	141.8	177.2	29.7	-35.1	0	0	0	111.7	I680 L682	I680-P753 HydrophobicContact CG2-CB 4.36Å; L682-P753 HydrophobicContact CD1-CB 4.15Å
754	I	90.6	Very high	91.1	Very high	10 Å²	10	33.3 Å²	33.3	5%	0.051	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-78.3	121.4	174	-66.5	168.3	0	0	0	109	R642 L682 L746 T748 C832 I833 E834 L842	R642-I754 HydrophobicContact CG-CD1 4.48Å; L682-I754 HydrophobicContact CD1-CB 4.08Å; L682-I754 VanDerWaalsContact CD1-N 3.32Å; L746-I754 HydrophobicContact CD1-CD1 3.57Å; T748-I754 HydrophobicContact CG2-CD1 3.77Å; T748-I754 HydrophobicContact CG2-CG1 4.07Å; I754-C832 HydrophobicContact CG2-CB 3.99Å; I754-I833 WeakPolarHBondContact CG2-O 3.46Å; I754-E834 HydrophobicContact CD1-CG 4.05Å; I754-E834 WeakPolarHBondContact CD1-OE1 3.43Å; I754-E834 HydrophobicContact CG1-CG 4.1Å; I754-E834 WeakPolarHBondContact CG1-OE1 3.43Å; I754-E834 HydrophobicContact CG2-CG 4.33Å; I754-L842 HydrophobicContact CD1-CD1 3.89Å
755	Q	87.1	Confident	91.3	Very high	150 Å²	150	33.4 Å²	33.4	70%	0.701	19%	0.186	S	C	*	.	P	Polyproline II helix	trans	-66.4	124.9	179.5	-69.7	-177	-29	0	0	111.1
756	P	90.6	Very high	91.3	Very high	71 Å²	71	32.6 Å²	32.6	46%	0.461	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	140	174.2	28.2	-33.8	0	0	0	110.2	P683 P830	P683-P756 HydrophobicContact CB-CB 4.37Å; P756-P830 HydrophobicContact CB-CB 4.38Å
757	S	90.3	Very high	91	Very high	6 Å²	6	32.9 Å²	32.9	4%	0.042	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	143.6	-176.6	71.3	0	0	0	0	112.7	I831	S757-I831 PolarHBondContact N-O 3.08Å; S757-I831 PolarHBondContact O-N 3.47Å
758	T	92.2	Very high	90.6	Very high	47 Å²	47	36.9 Å²	36.9	29%	0.288	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-9.7	173.2	55.4	0	0	0	0	112.6	T826 F827 P830	T758-T826 CarbonylContact O-C 3.52Å; T758-T826 VanDerWaalsContact O-CA 3.24Å; T758-T826 WeakPolarHBondContact O-CA 3.42Å; T758-F827 PolarHBondContact O-N 2.83Å; T758-P830 HydrophobicContact CG2-CB 3.98Å
759	C	94.1	Very high	90.1	Very high	32 Å²	32	38.5 Å²	38.5	22%	0.216	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	125.7	-171.5	-62.8	0	0	0	0	110.1	L825 T826 I863	C759-L825 WeakPolarHBondContact CA-O 3.18Å; C759-T826 HydrophobicContact CB-CG2 4.38Å; C759-I863 HydrophobicContact CB-CB 3.87Å; C759-I863 HydrophobicContact CB-CG2 4.26Å; C759-I863 WeakPolarHBondContact O-CB 3.38Å; C759-I863 PolarHBondContact O-N 3.35Å; C759-I863 VanDerWaalsContact O-O 3.14Å
760	I	95	Very high	89.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	155.6	173.7	63.9	165.5	0	0	0	112.4	Y781 E824 L825 F827 V859	I760-Y781 HydrophobicContact CD1-CE2 4.22Å; I760-E824 CarbonylContact O-C 3.41Å; I760-E824 VanDerWaalsContact O-CA 3.24Å; I760-E824 WeakPolarHBondContact O-CA 3.42Å; I760-L825 HydrophobicContact CD1-CD1 4.33Å; I760-L825 HydrophobicContact CG1-CB 4.03Å; I760-L825 PolarHBondContact N-O 3.34Å; I760-L825 PolarHBondContact O-N 2.88Å; I760-F827 HydrophobicContact CB-CE2 4.5Å; I760-F827 HydrophobicContact CD1-CE2 4.12Å; I760-F827 HydrophobicContact CD1-CZ 3.69Å; I760-F827 HydrophobicContact CG1-CE2 3.82Å; I760-F827 HydrophobicContact CG1-CZ 3.72Å; I760-F827 HydrophobicContact CG2-CE2 4.06Å; I760-V859 HydrophobicContact CB-CG1 4.5Å; I760-V859 HydrophobicContact CD1-CG1 4.34Å; I760-V859 HydrophobicContact CD1-CG2 3.96Å
761	S	95.4	Very high	89.8	Confident	10 Å²	10	49.8 Å²	49.8	7%	0.07	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	134.3	164.2	-172.9	0	0	0	0	109.1	K796 V823 T860 K861	S761-K796 PolarHBondContact OG-NZ 2.87Å; S761-V823 WeakPolarHBondContact CA-O 3.14Å; S761-T860 PolarHBondContact O-N 3.31Å; S761-T860 PolarHBondContact O-OG1 3.07Å; S761-T860 VanDerWaalsContact O-OG1 3.14Å; S761-K861 WeakPolarHBondContact CB-O 3.5Å; S761-K861 PolarHBondContact N-O 3.16Å; S761-K861 PolarHBondContact O-N 3.07Å; S761-K861 VanDerWaalsContact O-N 3.08Å
762	A	95.5	Very high	90.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	153.4	-176.5	0	0	0	0	0	112.7	N822 V823 F845 T858	A762-N822 WeakPolarHBondContact O-CA 3.29Å; A762-V823 PolarHBondContact N-O 3.09Å; A762-V823 VanDerWaalsContact N-O 3.07Å; A762-V823 PolarHBondContact O-N 2.99Å; A762-F845 HydrophobicContact CB-CE1 3.63Å; A762-F845 HydrophobicContact CB-CZ 3.52Å; A762-T858 CarbonylContact C-O 3.57Å; A762-T858 VanDerWaalsContact CA-O 3.22Å; A762-T858 WeakPolarHBondContact CA-O 3.49Å; A762-T858 VanDerWaalsContact CB-O 3.29Å; A762-T858 WeakPolarHBondContact CB-O 3.38Å
763	K	94.4	Very high	90.5	Very high	65 Å²	65	45 Å²	45	28%	0.283	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	116.6	165.2	-179.5	-171.7	175.7	-170	0	107.4	E67 G857 T858 T860	E67-K763 PolarHBondContact O-NZ 3.15Å; K763-G857 CarbonylContact O-C 3.54Å; K763-G857 WeakPolarHBondContact O-CA 3.27Å; K763-T858 PolarHBondContact N-O 2.87Å; K763-T858 PolarHBondContact O-N 3.23Å; K763-T860 HydrophobicContact CB-CG2 4.1Å
764	L	94.1	Very high	90.9	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	147.3	171.7	-62.6	-174.1	0	0	0	111.1	V766 T820 A821 V823 F845 L847 A855 G856	L764-V766 HydrophobicContact CB-CG2 4.37Å; L764-T820 CarbonylContact O-C 3.55Å; L764-T820 VanDerWaalsContact O-CA 3.27Å; L764-T820 WeakPolarHBondContact O-CA 3.48Å; L764-A821 PolarHBondContact N-O 2.83Å; L764-A821 PolarHBondContact O-N 3.48Å; L764-V823 HydrophobicContact CD1-CG1 3.97Å; L764-V823 HydrophobicContact CD1-CG2 3.72Å; L764-V823 HydrophobicContact CD2-CG2 4.47Å; L764-V823 HydrophobicContact CG-CG1 4.39Å; L764-V823 HydrophobicContact CG-CG2 3.79Å; L764-F845 HydrophobicContact CD2-CE2 3.51Å; L764-F845 HydrophobicContact CD2-CZ 3.53Å; L764-L847 HydrophobicContact CD1-CD1 3.85Å; L764-L847 HydrophobicContact CD2-CD1 3.89Å; L764-A855 HydrophobicContact CB-CB 4.44Å; L764-A855 HydrophobicContact CD1-CB 4.47Å; L764-G856 CarbonylContact C-O 3.57Å; L764-G856 WeakPolarHBondContact CA-O 3.22Å
765	L	92.2	Very high	91.1	Very high	5 Å²	5	52 Å²	52	3%	0.026	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	104.9	161.2	-175.6	66.3	0	0	0	108	F64 D68 F69 L540 F767 T820 A855 G856	F64-L765 HydrophobicContact CD1-CD1 3.55Å; F64-L765 HydrophobicContact CD1-CG 4.41Å; F64-L765 HydrophobicContact CE1-CD1 3.53Å; F64-L765 HydrophobicContact CE1-CG 4.18Å; F64-L765 HydrophobicContact CG-CD1 4.47Å; F64-L765 HydrophobicContact CZ-CD1 4.46Å; D68-L765 HydrophobicContact CB-CD1 3.81Å; F69-L765 HydrophobicContact CD1-CD2 3.92Å; F69-L765 HydrophobicContact CE1-CD2 3.74Å; F69-L765 HydrophobicContact CE2-CD2 4.47Å; F69-L765 HydrophobicContact CG-CD2 4.36Å; F69-L765 HydrophobicContact CZ-CD2 4.04Å; L540-L765 HydrophobicContact CD2-CD2 3.99Å; L765-F767 HydrophobicContact CD2-CE1 4.45Å; L765-F767 HydrophobicContact CG-CE1 4.35Å; L765-F767 VanDerWaalsContact O-CD1 3.29Å; L765-F767 WeakPolarHBondContact O-CD1 3.19Å; L765-F767 WeakPolarHBondContact O-CE1 3.46Å; L765-T820 HydrophobicContact CD1-CG2 3.45Å; L765-T820 VanDerWaalsContact CD1-CG2 3.45Å; L765-A855 WeakPolarHBondContact O-CA 3.2Å; L765-A855 VanDerWaalsContact O-CB 3.27Å; L765-A855 WeakPolarHBondContact O-CB 3.35Å; L765-G856 PolarHBondContact N-O 3.43Å; L765-G856 PolarHBondContact O-N 3.09Å
766	V	92.1	Very high	91.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	133.6	-175	-174.2	0	0	0	0	110.1	L764 I769 I773 L815 L816 N818 C819	L764-V766 HydrophobicContact CB-CG2 4.37Å; V766-I769 HydrophobicContact CG1-CD1 3.52Å; V766-I773 HydrophobicContact CG1-CD1 3.78Å; V766-I773 HydrophobicContact CG2-CD1 4.18Å; V766-L815 HydrophobicContact CG2-CB 4.38Å; V766-L815 HydrophobicContact CG2-CD1 3.93Å; V766-L816 WeakPolarHBondContact CG1-O 3.48Å; V766-N818 WeakPolarHBondContact O-CA 3.47Å; V766-N818 PolarHBondContact O-N 2.72Å; V766-C819 WeakPolarHBondContact CB-O 3.36Å; V766-C819 PolarHBondContact N-O 3.35Å
767	F	88	Confident	91.6	Very high	6 Å²	6	45.1 Å²	45.1	3%	0.026	25%	0.247	C	C	.	.			trans	-90.5	179.5	-175.6	-56.3	-9.9	0	0	0	111.9	R536 L540 L765 I769 G817 N818 M846 S853 I854 G856	R536-F767 HydrophobicContact CG-CE2 4.33Å; R536-F767 HydrophobicContact CG-CZ 4.24Å; R536-F767 VanDerWaalsContact NE-CD1 3.34Å; R536-F767 VanDerWaalsContact NH2-CD1 3.27Å; L540-F767 HydrophobicContact CD1-CE1 3.86Å; L540-F767 HydrophobicContact CD1-CE2 4.36Å; L540-F767 HydrophobicContact CD1-CZ 3.33Å; L765-F767 HydrophobicContact CD2-CE1 4.45Å; L765-F767 HydrophobicContact CG-CE1 4.35Å; L765-F767 VanDerWaalsContact O-CD1 3.29Å; L765-F767 WeakPolarHBondContact O-CD1 3.19Å; L765-F767 WeakPolarHBondContact O-CE1 3.46Å; F767-I769 VanDerWaalsContact C-N 3.27Å; F767-I769 WeakPolarHBondContact O-CG1 3.27Å; F767-I769 PolarHBondContact O-N 3.07Å; F767-G817 WeakPolarHBondContact O-CA 3.27Å; F767-N818 PolarHBondContact O-N 2.77Å; F767-M846 HydrophobicContact CE2-CE 3.91Å; F767-M846 HydrophobicContact CZ-CE 3.9Å; F767-S853 WeakPolarHBondContact CD2-O 3.47Å; F767-I854 WeakPolarHBondContact CB-O 3.04Å; F767-I854 WeakPolarHBondContact CG-O 3.4Å; F767-I854 PolarHBondContact N-O 3.01Å; F767-G856 VanDerWaalsContact CZ-N 3.26Å
768	S	83.5	Confident	91.8	Very high	84 Å²	84	48.9 Å²	48.9	59%	0.587	27%	0.272	S	S	*	.			trans	-73.2	77.5	172.7	53.6	0	0	0	0	111	N818	S768-N818 PolarHBondContact N-OD1 2.93Å
769	I	82.1	Confident	91.9	Very high	35 Å²	35	46.9 Å²	46.9	18%	0.179	26%	0.26	C	S	.	.			trans	-91.1	145.2	-179.9	-43.5	145.9	0	0	0	109.2	V766 F767 Q771 I773 I854	V766-I769 HydrophobicContact CG1-CD1 3.52Å; F767-I769 VanDerWaalsContact C-N 3.27Å; F767-I769 WeakPolarHBondContact O-CG1 3.27Å; F767-I769 PolarHBondContact O-N 3.07Å; I769-Q771 WeakPolarHBondContact CG2-O 3.08Å; I769-I773 HydrophobicContact CD1-CD1 3.96Å; I769-I773 HydrophobicContact CD1-CG1 4Å; I769-I854 HydrophobicContact CD1-CB 4.21Å; I769-I854 HydrophobicContact CD1-CG1 4.21Å; I769-I854 HydrophobicContact CD1-CG2 3.75Å; I769-I854 WeakPolarHBondContact CD1-O 2.96Å; I769-I854 HydrophobicContact CG1-CB 4.45Å; I769-I854 HydrophobicContact CG1-CG1 4.16Å; I769-I854 HydrophobicContact CG2-CD1 4.35Å; I769-I854 HydrophobicContact CG2-CG1 4.12Å
770	Q	83.2	Confident	92	Very high	179 Å²	179	48.6 Å²	48.6	84%	0.836	27%	0.266	S	S	*	.	S	Bend	trans	-67.2	-36.3	174.4	-56.2	-178.2	13.8	0	0	112.6
771	Q	88.7	Confident	92	Very high	119 Å²	119	48.6 Å²	48.6	56%	0.556	27%	0.266	S	S	*	.	S	Bend	trans	-99.8	131.2	179.4	-61.8	-178	4.2	0	0	111.1	I769 Y777	I769-Q771 WeakPolarHBondContact CG2-O 3.08Å; Q771-Y777 PolarHBondContact OE1-OH 3.12Å
772	P	92	Very high	91.9	Very high	64 Å²	64	49.1 Å²	49.1	42%	0.416	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-77	137.6	176.8	31.6	-34.4	0	0	0	111.5	T774 C814 L815 L816	P772-T774 PolarHBondContact O-N 3.4Å; P772-C814 HydrophobicContact CB-CB 4.34Å; P772-L815 WeakPolarHBondContact CA-O 3.39Å; P772-L816 HydrophobicContact CB-CD2 4.22Å
773	I	93.7	Very high	91.8	Very high	1 Å²	1	50 Å²	50	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	125	-177.9	-53.4	175.3	0	0	0	109.8	V766 I769 Y777 I792 C814 L815 I854	V766-I773 HydrophobicContact CG1-CD1 3.78Å; V766-I773 HydrophobicContact CG2-CD1 4.18Å; I769-I773 HydrophobicContact CD1-CD1 3.96Å; I769-I773 HydrophobicContact CD1-CG1 4Å; I773-Y777 HydrophobicContact CG2-CD1 4.08Å; I773-Y777 HydrophobicContact CG2-CG 4.24Å; I773-I792 HydrophobicContact CG2-CD1 3.48Å; I773-I792 VanDerWaalsContact CG2-CD1 3.48Å; I773-C814 CarbonylContact O-C 3.55Å; I773-C814 WeakPolarHBondContact O-CA 3.45Å; I773-C814 WeakPolarHBondContact O-CB 3.25Å; I773-L815 HydrophobicContact CB-CB 4.14Å; I773-L815 HydrophobicContact CB-CD1 4.46Å; I773-L815 HydrophobicContact CB-CG 4.46Å; I773-L815 HydrophobicContact CD1-CD1 4.43Å; I773-L815 PolarHBondContact N-O 3.02Å; I773-L815 PolarHBondContact O-N 3.03Å; I773-I854 HydrophobicContact CD1-CG2 3.67Å; I773-I854 HydrophobicContact CG1-CG2 4.29Å
774	T	94.4	Very high	91.4	Very high	65 Å²	65	47.3 Å²	47.3	40%	0.399	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	167.5	178.3	59.2	0	0	0	0	112.2	P772 G776 Y777 C814	P772-T774 PolarHBondContact O-N 3.4Å; T774-G776 PolarHBondContact O-N 2.85Å; T774-Y777 VanDerWaalsContact O-CB 3.26Å; T774-Y777 WeakPolarHBondContact O-CB 3.31Å; T774-Y777 PolarHBondContact O-N 2.8Å; T774-C814 HydrophobicContact CG2-CB 4.33Å
775	K	94.7	Very high	91.1	Very high	153 Å²	153	48.8 Å²	48.8	67%	0.665	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	123.9	170.5	-173.9	-147.5	171	-160.6	0	109.4	T793	K775-T793 WeakPolarHBondContact CE-O 3.47Å; K775-T793 WeakPolarHBondContact CG-O 3.47Å
776	G	93.3	Very high	91	Very high	47 Å²	47	49.4 Å²	49.4	49%	0.485	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.2	2.5	-175	0	0	0	0	0	114.1	T774 I792	T774-G776 PolarHBondContact O-N 2.85Å; G776-I792 PolarHBondContact N-O 2.92Å
777	Y	94.1	Very high	91	Very high	28 Å²	28	53.3 Å²	53.3	11%	0.11	30%	0.295	C	S	.	.			trans	-61.9	127.6	178.3	-168.1	-105.2	0	0	0	111	Q771 I773 T774 V779 I792 V849 I854	Q771-Y777 PolarHBondContact OE1-OH 3.12Å; I773-Y777 HydrophobicContact CG2-CD1 4.08Å; I773-Y777 HydrophobicContact CG2-CG 4.24Å; T774-Y777 VanDerWaalsContact O-CB 3.26Å; T774-Y777 WeakPolarHBondContact O-CB 3.31Å; T774-Y777 PolarHBondContact O-N 2.8Å; Y777-V779 HydrophobicContact CD1-CG1 3.66Å; Y777-V779 HydrophobicContact CE1-CG1 3.94Å; Y777-I792 HydrophobicContact CD1-CD1 4.41Å; Y777-I792 PolarHBondContact O-N 3.31Å; Y777-V849 HydrophobicContact CE1-CG2 3.94Å; Y777-I854 HydrophobicContact CE1-CD1 3.74Å
778	P	95.4	Very high	91.3	Very high	85 Å²	85	53.1 Å²	53.1	55%	0.552	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	140.8	176.5	32.7	-33.8	0	0	0	110.7	T791 V849	P778-T791 HydrophobicContact CB-CG2 4.46Å; P778-V849 WeakPolarHBondContact O-CG2 3.44Å
779	V	95.1	Very high	91.9	Very high	6 Å²	6	50.7 Å²	50.7	4%	0.036	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	149.3	-179.9	-65.4	0	0	0	0	110.8	Y777 A790 I792 L847 V849	Y777-V779 HydrophobicContact CD1-CG1 3.66Å; Y777-V779 HydrophobicContact CE1-CG1 3.94Å; V779-A790 HydrophobicContact CG2-CB 4.1Å; V779-A790 PolarHBondContact N-O 2.84Å; V779-A790 PolarHBondContact O-N 3.37Å; V779-I792 HydrophobicContact CG1-CD1 3.82Å; V779-I792 HydrophobicContact CG1-CG1 4.3Å; V779-I792 HydrophobicContact CG2-CD1 4.4Å; V779-I792 HydrophobicContact CG2-CG1 4.13Å; V779-L847 HydrophobicContact CB-CB 4.48Å; V779-L847 HydrophobicContact CB-CD2 4.38Å; V779-L847 HydrophobicContact CG2-CD1 4.27Å; V779-L847 HydrophobicContact CG2-CD2 3.85Å; V779-V849 HydrophobicContact CB-CG2 4.29Å; V779-V849 HydrophobicContact CG1-CG2 3.99Å
780	I	95.2	Very high	92.5	Very high	67 Å²	67	49.2 Å²	49.2	34%	0.344	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	120	167	-52.9	175.2	0	0	0	107.4	Y782 N787 L847 R848	I780-Y782 HydrophobicContact CB-CD2 4.41Å; I780-Y782 HydrophobicContact CB-CE2 3.71Å; I780-Y782 HydrophobicContact CG2-CD2 3.97Å; I780-Y782 HydrophobicContact CG2-CE2 3.32Å; I780-Y782 WeakPolarHBondContact O-CD2 3.43Å; I780-N787 HydrophobicContact CG2-CB 3.87Å; I780-L847 WeakPolarHBondContact O-CA 3.4Å; I780-R848 PolarHBondContact N-O 3.13Å; I780-R848 PolarHBondContact O-N 3.42Å
781	Y	95.1	Very high	93.1	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	115.8	180	-179.4	-89.7	0	0	0	109.7	I760 Y783 N787 V788 L825 F827 I831 I833 F845 L847	I760-Y781 HydrophobicContact CD1-CE2 4.22Å; Y781-Y783 AromaticContact CD1-CD1 3.54Å; Y781-Y783 HydrophobicContact CD1-CD1 3.54Å; Y781-Y783 HydrophobicContact CD1-CE1 4.27Å; Y781-Y783 HydrophobicContact CD1-CG 4.24Å; Y781-Y783 AromaticContact CE1-CD1 3.59Å; Y781-Y783 HydrophobicContact CE1-CD1 3.59Å; Y781-Y783 HydrophobicContact CE1-CE1 4.48Å; Y781-Y783 AromaticContact CE1-CG 3.82Å; Y781-Y783 HydrophobicContact CE1-CG 3.82Å; Y781-N787 WeakPolarHBondContact O-CA 3.13Å; Y781-V788 WeakPolarHBondContact CB-O 3.08Å; Y781-V788 PolarHBondContact N-O 3.39Å; Y781-V788 PolarHBondContact O-N 2.71Å; Y781-L825 HydrophobicContact CD2-CD1 3.79Å; Y781-L825 HydrophobicContact CE2-CD1 3.78Å; Y781-F827 HydrophobicContact CD1-CD1 4.43Å; Y781-F827 AromaticContact CD1-CE1 3.69Å; Y781-F827 HydrophobicContact CD1-CE1 3.69Å; Y781-F827 HydrophobicContact CD1-CZ 4.23Å; Y781-F827 AromaticContact CD2-CE1 3.61Å; Y781-F827 HydrophobicContact CD2-CE1 3.61Å; Y781-F827 HydrophobicContact CD2-CZ 4.09Å; Y781-F827 AromaticContact CE1-CE1 3.99Å; Y781-F827 HydrophobicContact CE1-CE1 3.99Å; Y781-F827 HydrophobicContact CE1-CZ 4.04Å; Y781-F827 AromaticContact CE2-CE1 3.89Å; Y781-F827 HydrophobicContact CE2-CE1 3.89Å; Y781-F827 AromaticContact CE2-CZ 3.86Å; Y781-F827 HydrophobicContact CE2-CZ 3.86Å; Y781-F827 HydrophobicContact CG-CD1 4.36Å; Y781-F827 AromaticContact CG-CE1 3.52Å; Y781-F827 HydrophobicContact CG-CE1 3.52Å; Y781-F827 HydrophobicContact CG-CZ 4.28Å; Y781-F827 AromaticContact CZ-CZ 3.87Å; Y781-I831 HydrophobicContact CD1-CD1 3.98Å; Y781-I831 HydrophobicContact CE1-CD1 3.72Å; Y781-I833 HydrophobicContact CE1-CD1 3.83Å; Y781-I833 VanDerWaalsContact OH-CD1 3.23Å; Y781-I833 WeakPolarHBondContact OH-CD1 3.49Å; Y781-F845 HydrophobicContact CD2-CB 4.42Å; Y781-F845 AromaticContact CD2-CD2 3.68Å; Y781-F845 HydrophobicContact CD2-CD2 3.68Å; Y781-F845 HydrophobicContact CD2-CE2 4.09Å; Y781-F845 HydrophobicContact CD2-CG 4.13Å; Y781-F845 HydrophobicContact CE1-CB 4.19Å; Y781-F845 HydrophobicContact CE2-CB 3.67Å; Y781-F845 AromaticContact CE2-CD1 3.75Å; Y781-F845 HydrophobicContact CE2-CD1 3.75Å; Y781-F845 AromaticContact CE2-CD2 3.2Å; Y781-F845 HydrophobicContact CE2-CD2 3.2Å; Y781-F845 HydrophobicContact CE2-CE1 4.12Å; Y781-F845 AromaticContact CE2-CE2 3.64Å; Y781-F845 HydrophobicContact CE2-CE2 3.64Å; Y781-F845 AromaticContact CE2-CG 3.26Å; Y781-F845 HydrophobicContact CE2-CG 3.26Å; Y781-F845 HydrophobicContact CE2-CZ 4.06Å; Y781-F845 VanDerWaalsContact CZ-CB 3.5Å; Y781-F845 AromaticContact CZ-CD1 3.91Å; Y781-F845 AromaticContact CZ-CD2 3.98Å; Y781-F845 AromaticContact CZ-CG 3.54Å; Y781-F845 WeakPolarHBondContact OH-CB 3.39Å; Y781-F845 VanDerWaalsContact OH-CD1 3.32Å; Y781-F845 WeakPolarHBondContact OH-CD1 3.39Å; Y781-F845 WeakPolarHBondContact OH-CG 3.44Å; Y781-L847 HydrophobicContact CD2-CD2 3.67Å; Y781-L847 HydrophobicContact CG-CD2 4.37Å
782	Y	94.1	Very high	93.5	Very high	21 Å²	21	37.3 Å²	37.3	8%	0.082	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	128.6	179.2	-69.4	-99.1	0	0	0	110.3	P498 I501 I780 A786 N787 F845 M846 R848	P498-Y782 HydrophobicContact CB-CE1 3.86Å; P498-Y782 HydrophobicContact CG-CE1 4.1Å; I501-Y782 HydrophobicContact CD1-CD1 4.32Å; I501-Y782 HydrophobicContact CD1-CG 4.27Å; I780-Y782 HydrophobicContact CB-CD2 4.41Å; I780-Y782 HydrophobicContact CB-CE2 3.71Å; I780-Y782 HydrophobicContact CG2-CD2 3.97Å; I780-Y782 HydrophobicContact CG2-CE2 3.32Å; I780-Y782 WeakPolarHBondContact O-CD2 3.43Å; Y782-A786 WeakPolarHBondContact CA-O 3.22Å; Y782-N787 HydrophobicContact CD1-CB 3.81Å; Y782-N787 HydrophobicContact CE1-CB 3.71Å; Y782-N787 HydrophobicContact CG-CB 4.3Å; Y782-F845 WeakPolarHBondContact O-CA 3.45Å; Y782-F845 WeakPolarHBondContact O-CB 3.36Å; Y782-M846 PolarHBondContact N-O 3.43Å; Y782-M846 PolarHBondContact O-N 2.74Å; Y782-R848 HydrophobicContact CD2-CB 4.33Å; Y782-R848 HydrophobicContact CD2-CG 3.87Å; Y782-R848 HydrophobicContact CE2-CB 3.76Å; Y782-R848 HydrophobicContact CE2-CG 3.61Å
783	Y	91.8	Very high	93.6	Very high	19 Å²	19	35.9 Å²	35.9	8%	0.075	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	144.1	-179	65.1	-74.6	0	0	0	109.2	Y781 C785 A786 V788 I831	Y781-Y783 AromaticContact CD1-CD1 3.54Å; Y781-Y783 HydrophobicContact CD1-CD1 3.54Å; Y781-Y783 HydrophobicContact CD1-CE1 4.27Å; Y781-Y783 HydrophobicContact CD1-CG 4.24Å; Y781-Y783 AromaticContact CE1-CD1 3.59Å; Y781-Y783 HydrophobicContact CE1-CD1 3.59Å; Y781-Y783 HydrophobicContact CE1-CE1 4.48Å; Y781-Y783 AromaticContact CE1-CG 3.82Å; Y781-Y783 HydrophobicContact CE1-CG 3.82Å; Y783-C785 PolarHBondContact O-N 3.07Å; Y783-A786 HydrophobicContact CD1-CB 4.38Å; Y783-A786 HydrophobicContact CE1-CB 3.79Å; Y783-A786 HydrophobicContact CE2-CB 4.04Å; Y783-A786 PolarHBondContact N-O 2.99Å; Y783-A786 PolarHBondContact O-N 2.82Å; Y783-A786 VanDerWaalsContact O-O 3.12Å; Y783-V788 HydrophobicContact CE1-CB 4.26Å; Y783-V788 HydrophobicContact CE1-CG2 3.96Å; Y783-I831 HydrophobicContact CD1-CD1 4.45Å; Y783-I831 HydrophobicContact CE1-CD1 4.19Å; Y783-I831 HydrophobicContact CE1-CG2 4.33Å; Y783-I831 WeakPolarHBondContact OH-CG2 3.22Å
784	N	86.7	Confident	93.6	Very high	9 Å²	9	41.1 Å²	41.1	5%	0.048	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	-110.9	-177.7	-59.4	-20.4	0	0	0	111.7	T505 V644 L842	T505-N784 WeakPolarHBondContact CG2-O 3.49Å; T505-N784 PolarHBondContact OG1-O 3.05Å; V644-N784 HydrophobicContact CG1-CB 3.91Å; V644-N784 HydrophobicContact CG2-CB 4.22Å; N784-L842 WeakPolarHBondContact ND2-CD2 3.24Å
785	C	86.8	Confident	93.6	Very high	32 Å²	32	38.7 Å²	38.7	22%	0.216	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.7	18.5	176.4	-58.9	0	0	0	0	112.6	G502 Q506 Y783	G502-C785 PolarHBondContact O-SG 2.7Å; Q506-C785 PolarHBondContact NE2-SG 3.07Å; Q506-C785 VanDerWaalsContact NE2-SG 3.42Å; Y783-C785 PolarHBondContact O-N 3.07Å
786	A	90.6	Very high	93.5	Very high	18 Å²	18	35.1 Å²	35.1	15%	0.149	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	162.6	-172.9	0	0	0	0	0	113.7	P743 Y782 Y783	P743-A786 WeakPolarHBondContact O-CB 3.2Å; Y782-A786 WeakPolarHBondContact CA-O 3.22Å; Y783-A786 HydrophobicContact CD1-CB 4.38Å; Y783-A786 HydrophobicContact CE1-CB 3.79Å; Y783-A786 HydrophobicContact CE2-CB 4.04Å; Y783-A786 PolarHBondContact N-O 2.99Å; Y783-A786 PolarHBondContact O-N 2.82Å; Y783-A786 VanDerWaalsContact O-O 3.12Å
787	N	92.9	Very high	93.4	Very high	81 Å²	81	33.7 Å²	33.7	43%	0.433	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	142	168.5	59.9	12.6	0	0	0	112.4	I780 Y781 Y782	I780-N787 HydrophobicContact CG2-CB 3.87Å; Y781-N787 WeakPolarHBondContact O-CA 3.13Å; Y782-N787 HydrophobicContact CD1-CB 3.81Å; Y782-N787 HydrophobicContact CE1-CB 3.71Å; Y782-N787 HydrophobicContact CG-CB 4.3Å
788	V	93.9	Very high	93.3	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.018	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	139.8	176.1	165.6	0	0	0	0	109	Y781 Y783 F827 R829 I831	Y781-V788 WeakPolarHBondContact CB-O 3.08Å; Y781-V788 PolarHBondContact N-O 3.39Å; Y781-V788 PolarHBondContact O-N 2.71Å; Y783-V788 HydrophobicContact CE1-CB 4.26Å; Y783-V788 HydrophobicContact CE1-CG2 3.96Å; V788-F827 HydrophobicContact CG1-CB 4.1Å; V788-F827 HydrophobicContact CG1-CD1 4.34Å; V788-R829 HydrophobicContact CG1-CB 4.49Å; V788-I831 HydrophobicContact CB-CG2 4.48Å; V788-I831 HydrophobicContact CG1-CG2 4.48Å; V788-I831 HydrophobicContact CG2-CG2 3.87Å
789	A	95.7	Very high	93	Very high	33 Å²	33	30.3 Å²	30.3	27%	0.273	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	135.6	174	0	0	0	0	0	110.7	E828	A789-E828 VanDerWaalsContact CB-CD 3.47Å; A789-E828 HydrophobicContact CB-CG 4.27Å; A789-E828 WeakPolarHBondContact CB-OE1 2.91Å; A789-E828 WeakPolarHBondContact CB-OE2 3.27Å; A789-E828 PolarHBondContact O-N 3.16Å; A789-E828 VanDerWaalsContact O-N 3.16Å
790	A	95.5	Very high	92.4	Very high	3 Å²	3	32 Å²	32	3%	0.025	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	158.5	-173.3	0	0	0	0	0	111.5	V779 T826 F827	V779-A790 HydrophobicContact CG2-CB 4.1Å; V779-A790 PolarHBondContact N-O 2.84Å; V779-A790 PolarHBondContact O-N 3.37Å; A790-T826 CarbonylContact C-O 3.57Å; A790-T826 VanDerWaalsContact CA-O 3.28Å; A790-T826 WeakPolarHBondContact CA-O 3.3Å; A790-F827 HydrophobicContact CB-CD1 3.62Å; A790-F827 HydrophobicContact CB-CE1 3.89Å
791	T	96.2	Very high	91.3	Very high	48 Å²	48	31 Å²	31	29%	0.294	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	139.1	177.5	48	0	0	0	0	111.8	P778 T793 T826	P778-T791 HydrophobicContact CB-CG2 4.46Å; T791-T793 PolarHBondContact O-N 2.85Å; T791-T793 VanDerWaalsContact O-N 3.11Å; T791-T826 PolarHBondContact N-O 3.32Å; T791-T826 PolarHBondContact O-N 3.07Å; T791-T826 PolarHBondContact OG1-OG1 3.37Å; T791-T826 VanDerWaalsContact OG1-OG1 3.08Å
792	I	95.6	Very high	89.9	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	82.3	-177.1	-54.6	179.9	0	0	0	109.3	I773 G776 Y777 V779 L795 V823 L825 L847	I773-I792 HydrophobicContact CG2-CD1 3.48Å; I773-I792 VanDerWaalsContact CG2-CD1 3.48Å; G776-I792 PolarHBondContact N-O 2.92Å; Y777-I792 HydrophobicContact CD1-CD1 4.41Å; Y777-I792 PolarHBondContact O-N 3.31Å; V779-I792 HydrophobicContact CG1-CD1 3.82Å; V779-I792 HydrophobicContact CG1-CG1 4.3Å; V779-I792 HydrophobicContact CG2-CD1 4.4Å; V779-I792 HydrophobicContact CG2-CG1 4.13Å; I792-L795 HydrophobicContact CG2-CD2 3.66Å; I792-V823 HydrophobicContact CG2-CB 4.19Å; I792-V823 HydrophobicContact CG2-CG1 4.31Å; I792-L825 HydrophobicContact CB-CD2 4.32Å; I792-L825 HydrophobicContact CG1-CD2 3.7Å; I792-L825 HydrophobicContact CG2-CD2 4.42Å; I792-L847 HydrophobicContact CD1-CD1 4.39Å
793	T	93.6	Very high	88.3	Confident	34 Å²	34	39.8 Å²	39.8	21%	0.209	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	-31.3	-167.8	60.7	0	0	0	0	115.1	K775 T791 E824 T826	K775-T793 WeakPolarHBondContact CE-O 3.47Å; K775-T793 WeakPolarHBondContact CG-O 3.47Å; T791-T793 PolarHBondContact O-N 2.85Å; T791-T793 VanDerWaalsContact O-N 3.11Å; T793-E824 PolarHBondContact N-O 3.05Å; T793-E824 PolarHBondContact OG1-O 3.19Å; T793-T826 HydrophobicContact CG2-CG2 3.69Å; T793-T826 WeakPolarHBondContact CG2-OG1 3.18Å
794	K	93.9	Very high	87	Confident	111 Å²	111	49.2 Å²	49.2	48%	0.483	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	134.3	178.2	-52.1	-167.7	-159.5	68.1	0	112	V823 E824	K794-V823 CarbonylContact O-C 3.45Å; K794-V823 VanDerWaalsContact O-CA 3.27Å; K794-V823 WeakPolarHBondContact O-CA 3.38Å; K794-E824 HydrophobicContact CB-CB 4.2Å; K794-E824 HydrophobicContact CB-CG 4.49Å; K794-E824 WeakPolarHBondContact CD-OE2 3.24Å; K794-E824 WeakPolarHBondContact CE-OE2 3.43Å; K794-E824 PolarHBondContact N-O 3.39Å; K794-E824 IonicContact NZ-OE2 2.62Å; K794-E824 PolarHBondContact NZ-OE2 2.99Å; K794-E824 PolarHBondContact O-N 2.81Å
795	L	94.8	Very high	86.3	Confident	15 Å²	15	54 Å²	54	8%	0.079	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	112.8	167.2	-51.2	179.9	0	0	0	108.1	I792 P812 L815 V823	I792-L795 HydrophobicContact CG2-CD2 3.66Å; L795-P812 HydrophobicContact CB-CG 3.88Å; L795-P812 HydrophobicContact CD1-CG 4.28Å; L795-L815 HydrophobicContact CD1-CD2 4.2Å; L795-L815 HydrophobicContact CD1-CG 4.14Å; L795-L815 HydrophobicContact CD2-CD1 3.99Å; L795-L815 HydrophobicContact CD2-CD2 4.36Å; L795-L815 HydrophobicContact CD2-CG 4.06Å; L795-V823 HydrophobicContact CD2-CB 4.5Å; L795-V823 HydrophobicContact CD2-CG1 3.73Å
796	K	92.6	Very high	85.9	Confident	77 Å²	77	57 Å²	57	34%	0.335	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-53.6	-177.4	-69.5	173.5	165.4	160.7	0	111.4	S761 K811 N822 E824	S761-K796 PolarHBondContact OG-NZ 2.87Å; K796-K811 PolarHBondContact O-N 2.89Å; K796-N822 WeakPolarHBondContact CA-O 3.44Å; K796-N822 HydrophobicContact CB-CB 4.12Å; K796-N822 WeakPolarHBondContact CB-O 3.44Å; K796-N822 PolarHBondContact N-O 3.31Å; K796-E824 HydrophobicContact CD-CG 4.33Å; K796-E824 VanDerWaalsContact CE-CD 3.45Å; K796-E824 VanDerWaalsContact CE-CG 3.47Å; K796-E824 WeakPolarHBondContact CE-OE1 3.34Å; K796-E824 VanDerWaalsContact NZ-CG 3.34Å; K796-E824 IonicContact NZ-OE1 2.78Å; K796-E824 PolarHBondContact NZ-OE1 3.1Å
797	S	92.3	Very high	85.5	Confident	17 Å²	17	60.9 Å²	60.9	12%	0.119	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	148.6	179	59.2	0	0	0	0	110.5	V809 A821 N822	S797-V809 CarbonylContact C-O 3.58Å; S797-V809 VanDerWaalsContact CA-O 3.23Å; S797-V809 WeakPolarHBondContact CA-O 3.32Å; S797-A821 CarbonylContact O-C 3.55Å; S797-A821 VanDerWaalsContact O-CA 3.27Å; S797-A821 WeakPolarHBondContact O-CA 3.4Å; S797-N822 PolarHBondContact N-O 2.98Å; S797-N822 PolarHBondContact O-N 2.98Å; S797-N822 PolarHBondContact OG-ND2 3.36Å; S797-N822 VanDerWaalsContact OG-ND2 3.13Å
798	M	92.2	Very high	85.2	Confident	22 Å²	22	61 Å²	61	11%	0.108	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	131	167.1	175.9	-178.5	76.2	0	0	108.2	V808 V809 P812 L815 C819 T820	M798-V808 CarbonylContact O-C 3.55Å; M798-V809 HydrophobicContact CE-CB 4.45Å; M798-V809 HydrophobicContact CE-CG2 4.28Å; M798-V809 PolarHBondContact N-O 3.16Å; M798-V809 PolarHBondContact O-N 3.17Å; M798-P812 HydrophobicContact CB-CB 4.14Å; M798-P812 HydrophobicContact CB-CG 3.88Å; M798-L815 HydrophobicContact CB-CD2 3.93Å; M798-L815 HydrophobicContact CG-CD2 4.2Å; M798-L815 HydrophobicContact SD-CD2 4.17Å; M798-C819 HydrophobicContact CG-CB 3.81Å; M798-C819 HydrophobicContact SD-CB 4.05Å; M798-T820 CarbonylContact C-O 3.56Å; M798-T820 WeakPolarHBondContact CA-O 3.2Å
799	T	88	Confident	85	Confident	20 Å²	20	63.9 Å²	63.9	12%	0.123	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	118.8	167.6	-58.8	0	0	0	0	107.4	E806 V808 T820	T799-E806 HydrophobicContact CG2-CB 4.08Å; T799-E806 HydrophobicContact CG2-CG 4.35Å; T799-V808 HydrophobicContact CG2-CG2 4.26Å; T799-T820 PolarHBondContact N-O 2.85Å; T799-T820 PolarHBondContact O-N 2.62Å; T799-T820 VanDerWaalsContact O-N 3.11Å
800	H	82.1	Confident	84.8	Confident	43 Å²	43	72.9 Å²	72.9	20%	0.199	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	126.9	171.6	-172.4	-86	0	0	0	109	K807	H800-K807 PolarHBondContact N-O 3.11Å; H800-K807 PolarHBondContact O-N 3.02Å
801	R	71.9	Confident	84.6	Confident	45 Å²	45	81.2 Å²	81.2	17%	0.17	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	109.1	-179.8	-74.6	172.3	162.4	-149.9	-18.7	108.8	T65 E67 D68 E806	T65-R801 PolarHBondContact OG1-NH1 2.8Å; E67-R801 IonicContact OE2-CZ 3.68Å; E67-R801 IonicContact OE2-NH1 2.8Å; E67-R801 IonicContact OE2-NH2 3.35Å; E67-R801 PolarHBondContact OE2-NH2 2.98Å; D68-R801 WeakPolarHBondContact OD1-CD 3.43Å; D68-R801 IonicContact OD1-CZ 3.5Å; D68-R801 IonicContact OD1-NE 2.8Å; D68-R801 PolarHBondContact OD1-NE 3.01Å; D68-R801 IonicContact OD1-NH1 3.43Å; D68-R801 PolarHBondContact OD1-NH1 2.82Å; D68-R801 VanDerWaalsContact OD2-CD 3.3Å; D68-R801 WeakPolarHBondContact OD2-CD 3.49Å; D68-R801 IonicContact OD2-CZ 2.98Å; D68-R801 IonicContact OD2-NE 3.21Å; D68-R801 IonicContact OD2-NH1 3.72Å; D68-R801 PolarHBondContact OD2-NH1 3.46Å; R801-E806 HydrophobicContact CG-CG 4.32Å; R801-E806 IonicContact CZ-OE1 2.73Å; R801-E806 IonicContact NE-OE1 3.76Å; R801-E806 PolarHBondContact NE-OE1 2.89Å; R801-E806 IonicContact NH2-OE1 2.77Å; R801-E806 PolarHBondContact NH2-OE1 2.94Å
802	E	67	Low	84.4	Confident	73 Å²	73	79.7 Å²	79.7	34%	0.341	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	122.1	-176.3	-165.9	-172.3	161.3	0	0	109.1	K804 I805 K807	E802-K804 VanDerWaalsContact C-N 3.26Å; E802-K804 PolarHBondContact O-N 2.88Å; E802-I805 PolarHBondContact N-O 2.84Å; E802-I805 WeakPolarHBondContact O-CB 3.44Å; E802-I805 PolarHBondContact O-N 2.89Å; E802-K807 IonicContact OE1-NZ 2.84Å; E802-K807 WeakPolarHBondContact OE2-CE 3.23Å; E802-K807 IonicContact OE2-NZ 2.89Å; E802-K807 PolarHBondContact OE2-NZ 2.93Å
803	N	60.9	Low	84.2	Confident	133 Å²	133	90.9 Å²	90.9	71%	0.711	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	41.3	-179	-55.7	-32.8	0	0	0	113.7	I805	N803-I805 PolarHBondContact O-N 2.93Å
804	K	64.6	Low	84.1	Confident	216 Å²	216	91.3 Å²	91.3	94%	0.939	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	0.9	-172	-54.5	-177.3	178.6	-177.9	0	116.2	E802	E802-K804 VanDerWaalsContact C-N 3.26Å; E802-K804 PolarHBondContact O-N 2.88Å
805	I	71.4	Confident	84	Confident	109 Å²	109	86 Å²	86	56%	0.559	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	128.1	176.6	-58.3	175.4	0	0	0	109.3	E802 N803	E802-I805 PolarHBondContact N-O 2.84Å; E802-I805 WeakPolarHBondContact O-CB 3.44Å; E802-I805 PolarHBondContact O-N 2.89Å; N803-I805 PolarHBondContact O-N 2.93Å
806	E	78.5	Confident	83.7	Confident	97 Å²	97	89.8 Å²	89.8	45%	0.453	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	114.2	173.1	-61.7	-146.7	134.2	0	0	111.5	T799 R801	T799-E806 HydrophobicContact CG2-CB 4.08Å; T799-E806 HydrophobicContact CG2-CG 4.35Å; R801-E806 HydrophobicContact CG-CG 4.32Å; R801-E806 IonicContact CZ-OE1 2.73Å; R801-E806 IonicContact NE-OE1 3.76Å; R801-E806 PolarHBondContact NE-OE1 2.89Å; R801-E806 IonicContact NH2-OE1 2.77Å; R801-E806 PolarHBondContact NH2-OE1 2.94Å
807	K	81.7	Confident	83.4	Confident	99 Å²	99	87.4 Å²	87.4	43%	0.43	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	100.6	173.9	-65	178.4	-175.9	174.2	0	109.5	H800 E802 V809	H800-K807 PolarHBondContact N-O 3.11Å; H800-K807 PolarHBondContact O-N 3.02Å; E802-K807 IonicContact OE1-NZ 2.84Å; E802-K807 WeakPolarHBondContact OE2-CE 3.23Å; E802-K807 IonicContact OE2-NZ 2.89Å; E802-K807 PolarHBondContact OE2-NZ 2.93Å; K807-V809 PolarHBondContact O-N 2.95Å
808	V	86.6	Confident	83.1	Confident	82 Å²	82	88.6 Å²	88.6	50%	0.497	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	102.1	179.6	-173.8	0	0	0	0	111.1	M798 T799	M798-V808 CarbonylContact O-C 3.55Å; T799-V808 HydrophobicContact CG2-CG2 4.26Å
809	V	90.4	Very high	82.9	Confident	65 Å²	65	87.7 Å²	87.7	39%	0.394	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	115.3	176.3	-177.9	0	0	0	0	109.8	S797 M798 K807 P812	S797-V809 CarbonylContact C-O 3.58Å; S797-V809 VanDerWaalsContact CA-O 3.23Å; S797-V809 WeakPolarHBondContact CA-O 3.32Å; M798-V809 HydrophobicContact CE-CB 4.45Å; M798-V809 HydrophobicContact CE-CG2 4.28Å; M798-V809 PolarHBondContact N-O 3.16Å; M798-V809 PolarHBondContact O-N 3.17Å; K807-V809 PolarHBondContact O-N 2.95Å; V809-P812 HydrophobicContact CG1-CB 4.3Å
810	R	91.1	Very high	83.1	Confident	221 Å²	221	87.1 Å²	87.1	83%	0.834	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	134.5	173	-63.9	-179.6	178.7	-179	-0.8	110.2
811	K	90.4	Very high	83.7	Confident	178 Å²	178	85.2 Å²	85.2	77%	0.774	40%	0.404	S	S	*	.	S	Bend	trans	49.6	62.3	-178.9	-60.3	-179.5	-178.4	177	0	113.9	K796	K796-K811 PolarHBondContact O-N 2.89Å
812	P	92.3	Very high	84.8	Confident	16 Å²	16	85.9 Å²	85.9	10%	0.104	41%	0.41	C	S	.	.			trans	-63.4	153.2	176.2	32.4	-39	0	0	0	111.6	L795 M798 V809 L815	L795-P812 HydrophobicContact CB-CG 3.88Å; L795-P812 HydrophobicContact CD1-CG 4.28Å; M798-P812 HydrophobicContact CB-CB 4.14Å; M798-P812 HydrophobicContact CB-CG 3.88Å; V809-P812 HydrophobicContact CG1-CB 4.3Å; P812-L815 HydrophobicContact CG-CD2 3.82Å
813	R	91.6	Very high	86.2	Confident	235 Å²	235	82.4 Å²	82.4	89%	0.887	39%	0.394	S	S	*	.	S	Bend	trans	-74.4	-38.1	176.6	-68.1	-170.9	-69.5	177.4	-1.5	112.6
814	C	91.8	Very high	87.8	Confident	43 Å²	43	77.4 Å²	77.4	29%	0.291	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	162.6	174.8	54.5	0	0	0	0	108.9	P772 I773 T774	P772-C814 HydrophobicContact CB-CB 4.34Å; I773-C814 CarbonylContact O-C 3.55Å; I773-C814 WeakPolarHBondContact O-CA 3.45Å; I773-C814 WeakPolarHBondContact O-CB 3.25Å; T774-C814 HydrophobicContact CG2-CB 4.33Å
815	L	91.7	Very high	89.3	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	132.5	167.4	-48.8	179	0	0	0	108.6	V766 P772 I773 L795 M798 P812 A821 V823	V766-L815 HydrophobicContact CG2-CB 4.38Å; V766-L815 HydrophobicContact CG2-CD1 3.93Å; P772-L815 WeakPolarHBondContact CA-O 3.39Å; I773-L815 HydrophobicContact CB-CB 4.14Å; I773-L815 HydrophobicContact CB-CD1 4.46Å; I773-L815 HydrophobicContact CB-CG 4.46Å; I773-L815 HydrophobicContact CD1-CD1 4.43Å; I773-L815 PolarHBondContact N-O 3.02Å; I773-L815 PolarHBondContact O-N 3.03Å; L795-L815 HydrophobicContact CD1-CD2 4.2Å; L795-L815 HydrophobicContact CD1-CG 4.14Å; L795-L815 HydrophobicContact CD2-CD1 3.99Å; L795-L815 HydrophobicContact CD2-CD2 4.36Å; L795-L815 HydrophobicContact CD2-CG 4.06Å; M798-L815 HydrophobicContact CB-CD2 3.93Å; M798-L815 HydrophobicContact CG-CD2 4.2Å; M798-L815 HydrophobicContact SD-CD2 4.17Å; P812-L815 HydrophobicContact CG-CD2 3.82Å; L815-A821 HydrophobicContact CD1-CB 3.5Å; L815-A821 HydrophobicContact CD2-CB 3.65Å; L815-A821 HydrophobicContact CG-CB 4.21Å; L815-V823 HydrophobicContact CD1-CG1 4.17Å
816	L	89	Confident	90.4	Very high	95 Å²	95	63.7 Å²	63.7	50%	0.497	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-89.9	169	171	-60.5	179.7	0	0	0	109.9	V766 P772 C819	V766-L816 WeakPolarHBondContact CG1-O 3.48Å; P772-L816 HydrophobicContact CB-CD2 4.22Å; L816-C819 PolarHBondContact O-SG 3.23Å
817	G	86.5	Confident	91.2	Very high	27 Å²	27	59.8 Å²	59.8	28%	0.278	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	153.9	175.6	0	0	0	0	0	113.3	F767 C819	F767-G817 WeakPolarHBondContact O-CA 3.27Å; G817-C819 VanDerWaalsContact C-N 3.34Å; G817-C819 PolarHBondContact O-N 3.36Å
818	N	85.4	Confident	91.7	Very high	42 Å²	42	62.2 Å²	62.2	23%	0.225	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	34.6	179.4	-54.1	-28.7	0	0	0	115.2	F64 V766 F767 S768	F64-N818 HydrophobicContact CE1-CB 4.09Å; F64-N818 HydrophobicContact CZ-CB 3.8Å; F64-N818 WeakPolarHBondContact CZ-OD1 3.34Å; V766-N818 WeakPolarHBondContact O-CA 3.47Å; V766-N818 PolarHBondContact O-N 2.72Å; F767-N818 PolarHBondContact O-N 2.77Å; S768-N818 PolarHBondContact N-OD1 2.93Å
819	C	89.2	Confident	91.9	Very high	2 Å²	2	64.3 Å²	64.3	1%	0.014	30%	0.299	C	S	.	.			trans	-112.4	158.4	169.8	72.9	0	0	0	0	112.1	V766 M798 L816 G817	V766-C819 WeakPolarHBondContact CB-O 3.36Å; V766-C819 PolarHBondContact N-O 3.35Å; M798-C819 HydrophobicContact CG-CB 3.81Å; M798-C819 HydrophobicContact SD-CB 4.05Å; L816-C819 PolarHBondContact O-SG 3.23Å; G817-C819 VanDerWaalsContact C-N 3.34Å; G817-C819 PolarHBondContact O-N 3.36Å
820	T	91.9	Very high	91.9	Very high	9 Å²	9	64.3 Å²	64.3	6%	0.055	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	143.3	163.2	40.7	0	0	0	0	109.9	D68 L764 L765 M798 T799	D68-T820 HydrophobicContact CB-CG2 4.18Å; D68-T820 WeakPolarHBondContact OD1-CG2 3.43Å; L764-T820 CarbonylContact O-C 3.55Å; L764-T820 VanDerWaalsContact O-CA 3.27Å; L764-T820 WeakPolarHBondContact O-CA 3.48Å; L765-T820 HydrophobicContact CD1-CG2 3.45Å; L765-T820 VanDerWaalsContact CD1-CG2 3.45Å; M798-T820 CarbonylContact C-O 3.56Å; M798-T820 WeakPolarHBondContact CA-O 3.2Å; T799-T820 PolarHBondContact N-O 2.85Å; T799-T820 PolarHBondContact O-N 2.62Å; T799-T820 VanDerWaalsContact O-N 3.11Å
821	A	94	Very high	91.9	Very high	3 Å²	3	54 Å²	54	3%	0.025	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	135.4	-175.1	0	0	0	0	0	113.2	L764 S797 L815 V823	L764-A821 PolarHBondContact N-O 2.83Å; L764-A821 PolarHBondContact O-N 3.48Å; S797-A821 CarbonylContact O-C 3.55Å; S797-A821 VanDerWaalsContact O-CA 3.27Å; S797-A821 WeakPolarHBondContact O-CA 3.4Å; L815-A821 HydrophobicContact CD1-CB 3.5Å; L815-A821 HydrophobicContact CD2-CB 3.65Å; L815-A821 HydrophobicContact CG-CB 4.21Å; A821-V823 HydrophobicContact CB-CG1 4.32Å
822	N	95	Very high	91.9	Very high	58 Å²	58	45.9 Å²	45.9	31%	0.31	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	123.2	169.2	-66.8	-44.6	0	0	0	109	A762 K796 S797	A762-N822 WeakPolarHBondContact O-CA 3.29Å; K796-N822 WeakPolarHBondContact CA-O 3.44Å; K796-N822 HydrophobicContact CB-CB 4.12Å; K796-N822 WeakPolarHBondContact CB-O 3.44Å; K796-N822 PolarHBondContact N-O 3.31Å; S797-N822 PolarHBondContact N-O 2.98Å; S797-N822 PolarHBondContact O-N 2.98Å; S797-N822 PolarHBondContact OG-ND2 3.36Å; S797-N822 VanDerWaalsContact OG-ND2 3.13Å
823	V	95.3	Very high	91.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	168.3	-177.8	-52.8	0	0	0	0	111.8	S761 A762 L764 I792 K794 L795 L815 A821 L825	S761-V823 WeakPolarHBondContact CA-O 3.14Å; A762-V823 PolarHBondContact N-O 3.09Å; A762-V823 VanDerWaalsContact N-O 3.07Å; A762-V823 PolarHBondContact O-N 2.99Å; L764-V823 HydrophobicContact CD1-CG1 3.97Å; L764-V823 HydrophobicContact CD1-CG2 3.72Å; L764-V823 HydrophobicContact CD2-CG2 4.47Å; L764-V823 HydrophobicContact CG-CG1 4.39Å; L764-V823 HydrophobicContact CG-CG2 3.79Å; I792-V823 HydrophobicContact CG2-CB 4.19Å; I792-V823 HydrophobicContact CG2-CG1 4.31Å; K794-V823 CarbonylContact O-C 3.45Å; K794-V823 VanDerWaalsContact O-CA 3.27Å; K794-V823 WeakPolarHBondContact O-CA 3.38Å; L795-V823 HydrophobicContact CD2-CB 4.5Å; L795-V823 HydrophobicContact CD2-CG1 3.73Å; L815-V823 HydrophobicContact CD1-CG1 4.17Å; A821-V823 HydrophobicContact CB-CG1 4.32Å; V823-L825 HydrophobicContact CG2-CD2 3.83Å; V823-L825 HydrophobicContact CG2-CG 4.11Å
824	E	95.9	Very high	91.9	Very high	29 Å²	29	34.8 Å²	34.8	14%	0.136	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	127.6	161.4	-64.3	-178.3	163.7	0	0	110	I760 T793 K794 K796 I863	I760-E824 CarbonylContact O-C 3.41Å; I760-E824 VanDerWaalsContact O-CA 3.24Å; I760-E824 WeakPolarHBondContact O-CA 3.42Å; T793-E824 PolarHBondContact N-O 3.05Å; T793-E824 PolarHBondContact OG1-O 3.19Å; K794-E824 HydrophobicContact CB-CB 4.2Å; K794-E824 HydrophobicContact CB-CG 4.49Å; K794-E824 WeakPolarHBondContact CD-OE2 3.24Å; K794-E824 WeakPolarHBondContact CE-OE2 3.43Å; K794-E824 PolarHBondContact N-O 3.39Å; K794-E824 IonicContact NZ-OE2 2.62Å; K794-E824 PolarHBondContact NZ-OE2 2.99Å; K794-E824 PolarHBondContact O-N 2.81Å; K796-E824 HydrophobicContact CD-CG 4.33Å; K796-E824 VanDerWaalsContact CE-CD 3.45Å; K796-E824 VanDerWaalsContact CE-CG 3.47Å; K796-E824 WeakPolarHBondContact CE-OE1 3.34Å; K796-E824 VanDerWaalsContact NZ-CG 3.34Å; K796-E824 IonicContact NZ-OE1 2.78Å; K796-E824 PolarHBondContact NZ-OE1 3.1Å; E824-I863 HydrophobicContact CG-CD1 4.02Å; E824-I863 WeakPolarHBondContact OE1-CD1 3.28Å
825	L	95.5	Very high	92	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	143.5	175	-55.5	-178.4	0	0	0	108.9	C759 I760 Y781 I792 V823 F827 F845 L847	C759-L825 WeakPolarHBondContact CA-O 3.18Å; I760-L825 HydrophobicContact CD1-CD1 4.33Å; I760-L825 HydrophobicContact CG1-CB 4.03Å; I760-L825 PolarHBondContact N-O 3.34Å; I760-L825 PolarHBondContact O-N 2.88Å; Y781-L825 HydrophobicContact CD2-CD1 3.79Å; Y781-L825 HydrophobicContact CE2-CD1 3.78Å; I792-L825 HydrophobicContact CB-CD2 4.32Å; I792-L825 HydrophobicContact CG1-CD2 3.7Å; I792-L825 HydrophobicContact CG2-CD2 4.42Å; V823-L825 HydrophobicContact CG2-CD2 3.83Å; V823-L825 HydrophobicContact CG2-CG 4.11Å; L825-F827 HydrophobicContact CB-CE1 4.4Å; L825-F827 HydrophobicContact CB-CZ 4.32Å; L825-F845 HydrophobicContact CD1-CE2 3.89Å; L825-F845 HydrophobicContact CD1-CZ 3.92Å; L825-L847 HydrophobicContact CD1-CD2 4.39Å
826	T	95.4	Very high	92.1	Very high	37 Å²	37	35.3 Å²	35.3	23%	0.227	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	137.1	166.7	56.9	0	0	0	0	111.1	T758 C759 A790 T791 T793	T758-T826 CarbonylContact O-C 3.52Å; T758-T826 VanDerWaalsContact O-CA 3.24Å; T758-T826 WeakPolarHBondContact O-CA 3.42Å; C759-T826 HydrophobicContact CB-CG2 4.38Å; A790-T826 CarbonylContact C-O 3.57Å; A790-T826 VanDerWaalsContact CA-O 3.28Å; A790-T826 WeakPolarHBondContact CA-O 3.3Å; T791-T826 PolarHBondContact N-O 3.32Å; T791-T826 PolarHBondContact O-N 3.07Å; T791-T826 PolarHBondContact OG1-OG1 3.37Å; T791-T826 VanDerWaalsContact OG1-OG1 3.08Å; T793-T826 HydrophobicContact CG2-CG2 3.69Å; T793-T826 WeakPolarHBondContact CG2-OG1 3.18Å
827	F	94.8	Very high	92.2	Very high	14 Å²	14	38.8 Å²	38.8	6%	0.061	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	146.9	-175.2	-53.1	-61.9	0	0	0	111.2	T758 I760 Y781 V788 A790 L825 R829 I831 I833	T758-F827 PolarHBondContact O-N 2.83Å; I760-F827 HydrophobicContact CB-CE2 4.5Å; I760-F827 HydrophobicContact CD1-CE2 4.12Å; I760-F827 HydrophobicContact CD1-CZ 3.69Å; I760-F827 HydrophobicContact CG1-CE2 3.82Å; I760-F827 HydrophobicContact CG1-CZ 3.72Å; I760-F827 HydrophobicContact CG2-CE2 4.06Å; Y781-F827 HydrophobicContact CD1-CD1 4.43Å; Y781-F827 AromaticContact CD1-CE1 3.69Å; Y781-F827 HydrophobicContact CD1-CE1 3.69Å; Y781-F827 HydrophobicContact CD1-CZ 4.23Å; Y781-F827 AromaticContact CD2-CE1 3.61Å; Y781-F827 HydrophobicContact CD2-CE1 3.61Å; Y781-F827 HydrophobicContact CD2-CZ 4.09Å; Y781-F827 AromaticContact CE1-CE1 3.99Å; Y781-F827 HydrophobicContact CE1-CE1 3.99Å; Y781-F827 HydrophobicContact CE1-CZ 4.04Å; Y781-F827 AromaticContact CE2-CE1 3.89Å; Y781-F827 HydrophobicContact CE2-CE1 3.89Å; Y781-F827 AromaticContact CE2-CZ 3.86Å; Y781-F827 HydrophobicContact CE2-CZ 3.86Å; Y781-F827 HydrophobicContact CG-CD1 4.36Å; Y781-F827 AromaticContact CG-CE1 3.52Å; Y781-F827 HydrophobicContact CG-CE1 3.52Å; Y781-F827 HydrophobicContact CG-CZ 4.28Å; Y781-F827 AromaticContact CZ-CZ 3.87Å; V788-F827 HydrophobicContact CG1-CB 4.1Å; V788-F827 HydrophobicContact CG1-CD1 4.34Å; A790-F827 HydrophobicContact CB-CD1 3.62Å; A790-F827 HydrophobicContact CB-CE1 3.89Å; L825-F827 HydrophobicContact CB-CE1 4.4Å; L825-F827 HydrophobicContact CB-CZ 4.32Å; F827-R829 VanDerWaalsContact C-N 3.33Å; F827-R829 WeakPolarHBondContact CB-O 3.5Å; F827-I831 HydrophobicContact CD1-CD1 3.85Å; F827-I831 HydrophobicContact CD2-CD1 3.64Å; F827-I831 HydrophobicContact CD2-CG1 3.68Å; F827-I831 HydrophobicContact CE1-CD1 3.82Å; F827-I831 HydrophobicContact CE2-CD1 3.57Å; F827-I831 HydrophobicContact CE2-CG1 3.84Å; F827-I831 HydrophobicContact CG-CD1 3.79Å; F827-I831 HydrophobicContact CG-CG1 4.14Å; F827-I831 HydrophobicContact CZ-CD1 3.66Å; F827-I831 HydrophobicContact CZ-CG1 4.44Å; F827-I833 HydrophobicContact CE2-CD1 4.47Å; F827-I833 HydrophobicContact CZ-CD1 4.46Å
828	E	91.7	Very high	92.3	Very high	150 Å²	150	45 Å²	45	70%	0.701	22%	0.216	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71	-30.9	173.2	-67.8	176.8	-174.3	0	0	112.5	A789	A789-E828 VanDerWaalsContact CB-CD 3.47Å; A789-E828 HydrophobicContact CB-CG 4.27Å; A789-E828 WeakPolarHBondContact CB-OE1 2.91Å; A789-E828 WeakPolarHBondContact CB-OE2 3.27Å; A789-E828 PolarHBondContact O-N 3.16Å; A789-E828 VanDerWaalsContact O-N 3.16Å
829	R	90.5	Very high	92.5	Very high	126 Å²	126	43.3 Å²	43.3	48%	0.475	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	144.4	176.3	-71	-178.2	-83	141.5	-3	109.8	V788 F827	V788-R829 HydrophobicContact CG1-CB 4.49Å; F827-R829 VanDerWaalsContact C-N 3.33Å; F827-R829 WeakPolarHBondContact CB-O 3.5Å
830	P	90.6	Very high	92.5	Very high	66 Å²	66	46.8 Å²	46.8	43%	0.429	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	136	174.5	29.4	-34.2	0	0	0	110.2	P756 T758	P756-P830 HydrophobicContact CB-CB 4.38Å; T758-P830 HydrophobicContact CG2-CB 3.98Å
831	I	91.8	Very high	92.4	Very high	5 Å²	5	48.9 Å²	48.9	3%	0.026	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	148	-178.8	60.9	-179.6	0	0	0	112.4	S757 Y781 Y783 V788 F827 I833	S757-I831 PolarHBondContact N-O 3.08Å; S757-I831 PolarHBondContact O-N 3.47Å; Y781-I831 HydrophobicContact CD1-CD1 3.98Å; Y781-I831 HydrophobicContact CE1-CD1 3.72Å; Y783-I831 HydrophobicContact CD1-CD1 4.45Å; Y783-I831 HydrophobicContact CE1-CD1 4.19Å; Y783-I831 HydrophobicContact CE1-CG2 4.33Å; Y783-I831 WeakPolarHBondContact OH-CG2 3.22Å; V788-I831 HydrophobicContact CB-CG2 4.48Å; V788-I831 HydrophobicContact CG1-CG2 4.48Å; V788-I831 HydrophobicContact CG2-CG2 3.87Å; F827-I831 HydrophobicContact CD1-CD1 3.85Å; F827-I831 HydrophobicContact CD2-CD1 3.64Å; F827-I831 HydrophobicContact CD2-CG1 3.68Å; F827-I831 HydrophobicContact CE1-CD1 3.82Å; F827-I831 HydrophobicContact CE2-CD1 3.57Å; F827-I831 HydrophobicContact CE2-CG1 3.84Å; F827-I831 HydrophobicContact CG-CD1 3.79Å; F827-I831 HydrophobicContact CG-CG1 4.14Å; F827-I831 HydrophobicContact CZ-CD1 3.66Å; F827-I831 HydrophobicContact CZ-CG1 4.44Å; I831-I833 HydrophobicContact CD1-CD1 3.45Å; I831-I833 VanDerWaalsContact CD1-CD1 3.45Å; I831-I833 HydrophobicContact CD1-CG1 4.3Å; I831-I833 HydrophobicContact CG1-CD1 3.73Å; I831-I833 HydrophobicContact CG1-CG1 4.19Å
832	C	91	Very high	92.3	Very high	7 Å²	7	49 Å²	49	5%	0.047	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	115.3	-176.6	-57.3	0	0	0	0	109.9	L682 P683 L746 I754	L682-C832 HydrophobicContact CB-CB 4.45Å; P683-C832 VanDerWaalsContact CA-SG 3.58Å; L746-C832 HydrophobicContact CD1-CB 3.8Å; L746-C832 HydrophobicContact CG-CB 4.27Å; I754-C832 HydrophobicContact CG2-CB 3.99Å
833	I	91.3	Very high	92.1	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.015	22%	0.222	C	C	.	.			trans	-142.9	149.4	-169.4	-77	-178	0	0	0	109.2	I754 Y781 F827 I831 V859 I862	I754-I833 WeakPolarHBondContact CG2-O 3.46Å; Y781-I833 HydrophobicContact CE1-CD1 3.83Å; Y781-I833 VanDerWaalsContact OH-CD1 3.23Å; Y781-I833 WeakPolarHBondContact OH-CD1 3.49Å; F827-I833 HydrophobicContact CE2-CD1 4.47Å; F827-I833 HydrophobicContact CZ-CD1 4.46Å; I831-I833 HydrophobicContact CD1-CD1 3.45Å; I831-I833 VanDerWaalsContact CD1-CD1 3.45Å; I831-I833 HydrophobicContact CD1-CG1 4.3Å; I831-I833 HydrophobicContact CG1-CD1 3.73Å; I831-I833 HydrophobicContact CG1-CG1 4.19Å; I833-V859 HydrophobicContact CG2-CB 4.26Å; I833-V859 HydrophobicContact CG2-CG1 3.89Å; I833-V859 HydrophobicContact CG2-CG2 3.76Å; I833-I862 VanDerWaalsContact O-CD1 3.24Å; I833-I862 WeakPolarHBondContact O-CD1 3.32Å
834	E	91.9	Very high	92	Very high	15 Å²	15	47.2 Å²	47.2	7%	0.07	23%	0.226	C	C	.	.			trans	-113.7	162.2	168.5	-76.5	-158	-147.8	0	0	113.2	R642 I754 K838 C839 L842 G843	R642-E834 IonicContact CZ-OE1 2.7Å; R642-E834 IonicContact CZ-OE2 3.06Å; R642-E834 IonicContact NE-OE1 2.66Å; R642-E834 PolarHBondContact NE-OE1 2.86Å; R642-E834 IonicContact NE-OE2 2.73Å; R642-E834 IonicContact NH2-OE1 3.41Å; R642-E834 PolarHBondContact NH2-OE1 3.16Å; R642-E834 IonicContact NH2-OE2 4Å; R642-E834 PolarHBondContact NH2-OE2 3.47Å; I754-E834 HydrophobicContact CD1-CG 4.05Å; I754-E834 WeakPolarHBondContact CD1-OE1 3.43Å; I754-E834 HydrophobicContact CG1-CG 4.1Å; I754-E834 WeakPolarHBondContact CG1-OE1 3.43Å; I754-E834 HydrophobicContact CG2-CG 4.33Å; E834-K838 VanDerWaalsContact OE2-CB 3.25Å; E834-K838 WeakPolarHBondContact OE2-CB 2.95Å; E834-C839 HydrophobicContact CB-CB 4.04Å; E834-L842 HydrophobicContact CB-CB 4.3Å; E834-L842 HydrophobicContact CG-CD1 4.43Å; E834-G843 WeakPolarHBondContact O-CA 3.28Å
835	V	93.9	Very high	92	Very high	25 Å²	25	45.9 Å²	45.9	15%	0.152	22%	0.22	C	C	.	.			trans	-69.6	138.8	170.2	178.5	0	0	0	0	108.9	E837 K838 C839 I862	V835-E837 HydrophobicContact CG1-CB 4.22Å; V835-E837 HydrophobicContact CG1-CG 4.42Å; V835-E837 PolarHBondContact O-N 2.89Å; V835-E837 VanDerWaalsContact O-N 3.1Å; V835-K838 PolarHBondContact O-N 3.03Å; V835-C839 PolarHBondContact O-N 3.47Å; V835-I862 HydrophobicContact CG2-CD1 4.35Å; V835-I862 HydrophobicContact CG2-CG1 4.22Å
836	Y	92.8	Very high	91.9	Very high	29 Å²	29	45.9 Å²	45.9	11%	0.114	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-35.7	-176.5	-179.6	-108.9	0	0	0	113.8	P70 A71 K838 C839 K840 R844 T858 V859	P70-Y836 HydrophobicContact CB-CE1 4.37Å; P70-Y836 HydrophobicContact CB-CE2 4.22Å; A71-Y836 PolarHBondContact O-OH 2.82Å; Y836-K838 VanDerWaalsContact C-N 3.32Å; Y836-K838 PolarHBondContact O-N 3.26Å; Y836-C839 CarbonylContact O-C 3.57Å; Y836-K840 HydrophobicContact CD2-CB 4.28Å; Y836-K840 HydrophobicContact CD2-CG 4.45Å; Y836-K840 WeakPolarHBondContact CD2-O 3.48Å; Y836-K840 HydrophobicContact CE1-CG 4.43Å; Y836-K840 HydrophobicContact CE2-CB 3.67Å; Y836-K840 HydrophobicContact CE2-CG 3.88Å; Y836-K840 WeakPolarHBondContact CE2-O 3.23Å; Y836-K840 WeakPolarHBondContact O-CA 3.48Å; Y836-K840 PolarHBondContact O-N 3.42Å; Y836-R844 HydrophobicContact CD2-CG 4.09Å; Y836-R844 HydrophobicContact CE2-CG 3.88Å; Y836-R844 PolarHBondContact OH-NH2 3.39Å; Y836-T858 HydrophobicContact CD1-CG2 4.19Å; Y836-T858 HydrophobicContact CD2-CG2 3.85Å; Y836-T858 HydrophobicContact CE2-CG2 4.2Å; Y836-T858 HydrophobicContact CG-CG2 3.86Å; Y836-V859 PolarHBondContact N-O 3.32Å
837	E	91.5	Very high	91.9	Very high	168 Å²	168	44.1 Å²	44.1	79%	0.785	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-30.2	177.1	-63.6	165.7	-172.1	0	0	113.5	V835	V835-E837 HydrophobicContact CG1-CB 4.22Å; V835-E837 HydrophobicContact CG1-CG 4.42Å; V835-E837 PolarHBondContact O-N 2.89Å; V835-E837 VanDerWaalsContact O-N 3.1Å
838	K	90	Very high	91.8	Very high	156 Å²	156	43.7 Å²	43.7	68%	0.678	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-35.9	178.7	-70.3	-170.2	170.8	-167.2	0	113.3	E834 V835 Y836	E834-K838 VanDerWaalsContact OE2-CB 3.25Å; E834-K838 WeakPolarHBondContact OE2-CB 2.95Å; V835-K838 PolarHBondContact O-N 3.03Å; Y836-K838 VanDerWaalsContact C-N 3.32Å; Y836-K838 PolarHBondContact O-N 3.26Å
839	C	88.9	Confident	91.8	Very high	7 Å²	7	38.8 Å²	38.8	5%	0.047	19%	0.187	C	C	.	.			trans	-152.7	92	-174.6	-171.5	0	0	0	0	109.9	E834 V835 Y836 P841 L842 G843	E834-C839 HydrophobicContact CB-CB 4.04Å; V835-C839 PolarHBondContact O-N 3.47Å; Y836-C839 CarbonylContact O-C 3.57Å; C839-P841 VanDerWaalsContact C-N 3.34Å; C839-L842 HydrophobicContact CB-CB 4.29Å; C839-L842 PolarHBondContact O-N 3.05Å; C839-G843 PolarHBondContact O-N 3.15Å
840	K	89.3	Confident	91.6	Very high	75 Å²	75	36.3 Å²	36.3	33%	0.326	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-39.9	-173.1	-65.4	-173.9	-174.4	-178.2	0	114.3	D73 Y836 R844	D73-K840 IonicContact OD2-NZ 2.88Å; D73-K840 PolarHBondContact OD2-NZ 2.96Å; Y836-K840 HydrophobicContact CD2-CB 4.28Å; Y836-K840 HydrophobicContact CD2-CG 4.45Å; Y836-K840 WeakPolarHBondContact CD2-O 3.48Å; Y836-K840 HydrophobicContact CE1-CG 4.43Å; Y836-K840 HydrophobicContact CE2-CB 3.67Å; Y836-K840 HydrophobicContact CE2-CG 3.88Å; Y836-K840 WeakPolarHBondContact CE2-O 3.23Å; Y836-K840 WeakPolarHBondContact O-CA 3.48Å; Y836-K840 PolarHBondContact O-N 3.42Å; K840-R844 WeakPolarHBondContact O-CD 3.47Å; K840-R844 VanDerWaalsContact O-CG 3.29Å; K840-R844 WeakPolarHBondContact O-CG 3.17Å
841	P	89.4	Confident	91.3	Very high	53 Å²	53	34.9 Å²	34.9	34%	0.344	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-52.1	176.9	-23.5	36.3	0	0	0	113.6	I664 C839 G843 R844	I664-P841 HydrophobicContact CD1-CB 4.22Å; I664-P841 HydrophobicContact CG2-CB 4.39Å; I664-P841 HydrophobicContact CG2-CG 4.08Å; C839-P841 VanDerWaalsContact C-N 3.34Å; P841-G843 PolarHBondContact O-N 3.17Å; P841-R844 PolarHBondContact O-N 3.33Å; P841-R844 VanDerWaalsContact O-N 3.15Å
842	L	91.5	Very high	91.1	Very high	5 Å²	5	38.4 Å²	38.4	3%	0.026	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-22.7	-178.3	-67.4	-177.7	0	0	0	113.8	V644 I664 L746 I754 N784 E834 C839 R844	V644-L842 HydrophobicContact CG2-CD2 4.01Å; I664-L842 HydrophobicContact CD1-CD2 3.66Å; I664-L842 HydrophobicContact CD1-CG 3.91Å; L746-L842 HydrophobicContact CD1-CD1 4.03Å; L746-L842 HydrophobicContact CD1-CD2 4.2Å; L746-L842 HydrophobicContact CD2-CD2 3.83Å; I754-L842 HydrophobicContact CD1-CD1 3.89Å; N784-L842 WeakPolarHBondContact ND2-CD2 3.24Å; E834-L842 HydrophobicContact CB-CB 4.3Å; E834-L842 HydrophobicContact CG-CD1 4.43Å; C839-L842 HydrophobicContact CB-CB 4.29Å; C839-L842 PolarHBondContact O-N 3.05Å; L842-R844 VanDerWaalsContact C-N 3.35Å
843	G	92	Very high	91	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	4.2	176.3	0	0	0	0	0	115.2	E834 C839 P841 T858 V859	E834-G843 WeakPolarHBondContact O-CA 3.28Å; C839-G843 PolarHBondContact O-N 3.15Å; P841-G843 PolarHBondContact O-N 3.17Å; G843-T858 CarbonylContact O-C 3.58Å; G843-T858 VanDerWaalsContact O-CA 3.27Å; G843-T858 WeakPolarHBondContact O-CA 3.36Å; G843-V859 PolarHBondContact O-N 3.38Å
844	R	93.5	Very high	91	Very high	21 Å²	21	39 Å²	39	8%	0.079	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	141.6	177.1	-72.3	167	-178.8	164.7	4.9	111.1	N72 L540 L541 G542 Y836 K840 P841 L842	N72-R844 PolarHBondContact OD1-NH2 3.38Å; L540-R844 WeakPolarHBondContact O-CD 3.21Å; L541-R844 WeakPolarHBondContact O-CD 3.1Å; L541-R844 PolarHBondContact O-NH1 3.37Å; G542-R844 VanDerWaalsContact CA-NH1 3.3Å; G542-R844 PolarHBondContact O-NH1 3.13Å; Y836-R844 HydrophobicContact CD2-CG 4.09Å; Y836-R844 HydrophobicContact CE2-CG 3.88Å; Y836-R844 PolarHBondContact OH-NH2 3.39Å; K840-R844 WeakPolarHBondContact O-CD 3.47Å; K840-R844 VanDerWaalsContact O-CG 3.29Å; K840-R844 WeakPolarHBondContact O-CG 3.17Å; P841-R844 PolarHBondContact O-N 3.33Å; P841-R844 VanDerWaalsContact O-N 3.15Å; L842-R844 VanDerWaalsContact C-N 3.35Å
845	F	94.2	Very high	91.1	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.009	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	166.7	177.3	66.9	-94.2	0	0	0	112.8	A762 L764 Y781 Y782 L825 L847 G857 V859	A762-F845 HydrophobicContact CB-CE1 3.63Å; A762-F845 HydrophobicContact CB-CZ 3.52Å; L764-F845 HydrophobicContact CD2-CE2 3.51Å; L764-F845 HydrophobicContact CD2-CZ 3.53Å; Y781-F845 HydrophobicContact CD2-CB 4.42Å; Y781-F845 AromaticContact CD2-CD2 3.68Å; Y781-F845 HydrophobicContact CD2-CD2 3.68Å; Y781-F845 HydrophobicContact CD2-CE2 4.09Å; Y781-F845 HydrophobicContact CD2-CG 4.13Å; Y781-F845 HydrophobicContact CE1-CB 4.19Å; Y781-F845 HydrophobicContact CE2-CB 3.67Å; Y781-F845 AromaticContact CE2-CD1 3.75Å; Y781-F845 HydrophobicContact CE2-CD1 3.75Å; Y781-F845 AromaticContact CE2-CD2 3.2Å; Y781-F845 HydrophobicContact CE2-CD2 3.2Å; Y781-F845 HydrophobicContact CE2-CE1 4.12Å; Y781-F845 AromaticContact CE2-CE2 3.64Å; Y781-F845 HydrophobicContact CE2-CE2 3.64Å; Y781-F845 AromaticContact CE2-CG 3.26Å; Y781-F845 HydrophobicContact CE2-CG 3.26Å; Y781-F845 HydrophobicContact CE2-CZ 4.06Å; Y781-F845 VanDerWaalsContact CZ-CB 3.5Å; Y781-F845 AromaticContact CZ-CD1 3.91Å; Y781-F845 AromaticContact CZ-CD2 3.98Å; Y781-F845 AromaticContact CZ-CG 3.54Å; Y781-F845 WeakPolarHBondContact OH-CB 3.39Å; Y781-F845 VanDerWaalsContact OH-CD1 3.32Å; Y781-F845 WeakPolarHBondContact OH-CD1 3.39Å; Y781-F845 WeakPolarHBondContact OH-CG 3.44Å; Y782-F845 WeakPolarHBondContact O-CA 3.45Å; Y782-F845 WeakPolarHBondContact O-CB 3.36Å; L825-F845 HydrophobicContact CD1-CE2 3.89Å; L825-F845 HydrophobicContact CD1-CZ 3.92Å; F845-L847 HydrophobicContact CD2-CD2 4.07Å; F845-L847 HydrophobicContact CD2-CG 4.31Å; F845-L847 HydrophobicContact CE2-CD1 4.45Å; F845-L847 HydrophobicContact CE2-CD2 3.98Å; F845-L847 HydrophobicContact CE2-CG 4.03Å; F845-G857 WeakPolarHBondContact CD1-O 3.26Å; F845-G857 PolarHBondContact N-O 3.11Å; F845-G857 VanDerWaalsContact N-O 3.08Å; F845-G857 PolarHBondContact O-N 2.88Å; F845-V859 HydrophobicContact CD1-CG2 3.86Å; F845-V859 HydrophobicContact CE1-CG2 3.94Å
846	M	94.3	Very high	91	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	147	176.3	-71.7	-63.4	-50.9	0	0	111.2	I501 L537 L540 L541 F767 Y782 A855 G856	I501-M846 HydrophobicContact CD1-CB 4.34Å; L537-M846 HydrophobicContact CD2-CE 3.51Å; L537-M846 HydrophobicContact CD2-CG 4.11Å; L537-M846 HydrophobicContact CD2-SD 3.97Å; L540-M846 HydrophobicContact CB-SD 3.96Å; L540-M846 HydrophobicContact CD1-CE 4.32Å; L540-M846 HydrophobicContact CD1-SD 3.81Å; L541-M846 HydrophobicContact CD2-CG 3.92Å; F767-M846 HydrophobicContact CE2-CE 3.91Å; F767-M846 HydrophobicContact CZ-CE 3.9Å; Y782-M846 PolarHBondContact N-O 3.43Å; Y782-M846 PolarHBondContact O-N 2.74Å; M846-A855 WeakPolarHBondContact CE-O 3.16Å; M846-G856 VanDerWaalsContact SD-CA 3.58Å
847	L	94.8	Very high	91	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	127.9	172.2	-58.3	-175.6	0	0	0	109.7	L764 V779 I780 Y781 I792 L825 F845 I854 A855	L764-L847 HydrophobicContact CD1-CD1 3.85Å; L764-L847 HydrophobicContact CD2-CD1 3.89Å; V779-L847 HydrophobicContact CB-CB 4.48Å; V779-L847 HydrophobicContact CB-CD2 4.38Å; V779-L847 HydrophobicContact CG2-CD1 4.27Å; V779-L847 HydrophobicContact CG2-CD2 3.85Å; I780-L847 WeakPolarHBondContact O-CA 3.4Å; Y781-L847 HydrophobicContact CD2-CD2 3.67Å; Y781-L847 HydrophobicContact CG-CD2 4.37Å; I792-L847 HydrophobicContact CD1-CD1 4.39Å; L825-L847 HydrophobicContact CD1-CD2 4.39Å; F845-L847 HydrophobicContact CD2-CD2 4.07Å; F845-L847 HydrophobicContact CD2-CG 4.31Å; F845-L847 HydrophobicContact CE2-CD1 4.45Å; F845-L847 HydrophobicContact CE2-CD2 3.98Å; F845-L847 HydrophobicContact CE2-CG 4.03Å; L847-I854 PolarHBondContact O-N 3.49Å; L847-A855 HydrophobicContact CB-CB 4.43Å; L847-A855 HydrophobicContact CD1-CB 4.31Å; L847-A855 PolarHBondContact N-O 2.89Å; L847-A855 PolarHBondContact O-N 3.28Å
848	R	92.9	Very high	91.2	Very high	5 Å²	5	29.1 Å²	29.1	2%	0.019	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	153.1	170.8	-49.3	-179.2	77.9	88	2.6	111.8	E533 I780 Y782 G851 E852 S853	E533-R848 IonicContact OE1-CZ 2.71Å; E533-R848 IonicContact OE1-NH1 3.19Å; E533-R848 PolarHBondContact OE1-NH1 3.37Å; E533-R848 IonicContact OE1-NH2 2.7Å; E533-R848 PolarHBondContact OE1-NH2 2.77Å; E533-R848 IonicContact OE2-NH2 3.07Å; I780-R848 PolarHBondContact N-O 3.13Å; I780-R848 PolarHBondContact O-N 3.42Å; Y782-R848 HydrophobicContact CD2-CB 4.33Å; Y782-R848 HydrophobicContact CD2-CG 3.87Å; Y782-R848 HydrophobicContact CE2-CB 3.76Å; Y782-R848 HydrophobicContact CE2-CG 3.61Å; R848-G851 PolarHBondContact NH2-O 2.99Å; R848-E852 WeakPolarHBondContact CA-O 3.44Å; R848-E852 VanDerWaalsContact CB-O 3.3Å; R848-E852 WeakPolarHBondContact CB-O 3.49Å; R848-S853 PolarHBondContact NH1-OG 3.14Å
849	V	92.5	Very high	91.4	Very high	46 Å²	46	21.7 Å²	21.7	28%	0.279	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	143.5	165.6	175.5	0	0	0	0	108	Y777 P778 V779 G851 E852 I854	Y777-V849 HydrophobicContact CE1-CG2 3.94Å; P778-V849 WeakPolarHBondContact O-CG2 3.44Å; V779-V849 HydrophobicContact CB-CG2 4.29Å; V779-V849 HydrophobicContact CG1-CG2 3.99Å; V849-G851 PolarHBondContact O-N 3.37Å; V849-G851 VanDerWaalsContact O-N 3.16Å; V849-E852 PolarHBondContact N-O 2.85Å; V849-E852 VanDerWaalsContact N-O 3.12Å; V849-E852 PolarHBondContact O-N 3.11Å; V849-I854 HydrophobicContact CB-CD1 3.68Å; V849-I854 HydrophobicContact CG2-CD1 3.77Å
850	G	85.9	Confident	91.7	Very high	74 Å²	74	24 Å²	24	76%	0.763	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.9	31.5	172.7	0	0	0	0	0	114.7	E852	G850-E852 VanDerWaalsContact C-N 3.26Å; G850-E852 PolarHBondContact O-N 2.87Å
851	G	84.2	Confident	91.9	Very high	37 Å²	37	26.9 Å²	26.9	38%	0.381	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.4	-3.6	-175	0	0	0	0	0	115.2	R848 V849	R848-G851 PolarHBondContact NH2-O 2.99Å; V849-G851 PolarHBondContact O-N 3.37Å; V849-G851 VanDerWaalsContact O-N 3.16Å
852	E	87.1	Confident	92	Very high	79 Å²	79	26.5 Å²	26.5	37%	0.369	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	142.3	-176.3	-50.9	-146.1	130.8	0	0	113.2	K494 R848 V849 G850 I854	K494-E852 IonicContact NZ-OE1 2.82Å; K494-E852 PolarHBondContact NZ-OE1 3.05Å; R848-E852 WeakPolarHBondContact CA-O 3.44Å; R848-E852 VanDerWaalsContact CB-O 3.3Å; R848-E852 WeakPolarHBondContact CB-O 3.49Å; V849-E852 PolarHBondContact N-O 2.85Å; V849-E852 VanDerWaalsContact N-O 3.12Å; V849-E852 PolarHBondContact O-N 3.11Å; G850-E852 VanDerWaalsContact C-N 3.26Å; G850-E852 PolarHBondContact O-N 2.87Å; E852-I854 PolarHBondContact O-N 3.03Å
853	S	89.5	Confident	91.9	Very high	18 Å²	18	28.4 Å²	28.4	13%	0.126	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	120.4	170.2	-71.5	0	0	0	0	111.6	E533 F767 R848	E533-S853 WeakPolarHBondContact OE1-CB 3.31Å; E533-S853 PolarHBondContact OE1-OG 2.91Å; F767-S853 WeakPolarHBondContact CD2-O 3.47Å; R848-S853 PolarHBondContact NH1-OG 3.14Å
854	I	91.8	Very high	91.2	Very high	5 Å²	5	32.7 Å²	32.7	3%	0.026	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-45.4	-177.5	-84.7	-169.3	0	0	0	112.2	F767 I769 I773 Y777 L847 V849 E852	F767-I854 WeakPolarHBondContact CB-O 3.04Å; F767-I854 WeakPolarHBondContact CG-O 3.4Å; F767-I854 PolarHBondContact N-O 3.01Å; I769-I854 HydrophobicContact CD1-CB 4.21Å; I769-I854 HydrophobicContact CD1-CG1 4.21Å; I769-I854 HydrophobicContact CD1-CG2 3.75Å; I769-I854 WeakPolarHBondContact CD1-O 2.96Å; I769-I854 HydrophobicContact CG1-CB 4.45Å; I769-I854 HydrophobicContact CG1-CG1 4.16Å; I769-I854 HydrophobicContact CG2-CD1 4.35Å; I769-I854 HydrophobicContact CG2-CG1 4.12Å; I773-I854 HydrophobicContact CD1-CG2 3.67Å; I773-I854 HydrophobicContact CG1-CG2 4.29Å; Y777-I854 HydrophobicContact CE1-CD1 3.74Å; L847-I854 PolarHBondContact O-N 3.49Å; V849-I854 HydrophobicContact CB-CD1 3.68Å; V849-I854 HydrophobicContact CG2-CD1 3.77Å; E852-I854 PolarHBondContact O-N 3.03Å
855	A	92.9	Very high	89.9	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	150.8	-179.6	0	0	0	0	0	111.3	L764 L765 M846 L847	L764-A855 HydrophobicContact CB-CB 4.44Å; L764-A855 HydrophobicContact CD1-CB 4.47Å; L765-A855 WeakPolarHBondContact O-CA 3.2Å; L765-A855 VanDerWaalsContact O-CB 3.27Å; L765-A855 WeakPolarHBondContact O-CB 3.35Å; M846-A855 WeakPolarHBondContact CE-O 3.16Å; L847-A855 HydrophobicContact CB-CB 4.43Å; L847-A855 HydrophobicContact CD1-CB 4.31Å; L847-A855 PolarHBondContact N-O 2.89Å; L847-A855 PolarHBondContact O-N 3.28Å
856	G	92.8	Very high	87.9	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	161.7	158.3	0	0	0	0	0	109.9	L764 L765 F767 M846	L764-G856 CarbonylContact C-O 3.57Å; L764-G856 WeakPolarHBondContact CA-O 3.22Å; L765-G856 PolarHBondContact N-O 3.43Å; L765-G856 PolarHBondContact O-N 3.09Å; F767-G856 VanDerWaalsContact CZ-N 3.26Å; M846-G856 VanDerWaalsContact SD-CA 3.58Å
857	G	92.5	Very high	85.8	Confident	10 Å²	10	52.2 Å²	52.2	10%	0.103	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	160.9	178	0	0	0	0	0	115.7	K763 F845	K763-G857 CarbonylContact O-C 3.54Å; K763-G857 WeakPolarHBondContact O-CA 3.27Å; F845-G857 WeakPolarHBondContact CD1-O 3.26Å; F845-G857 PolarHBondContact N-O 3.11Å; F845-G857 VanDerWaalsContact N-O 3.08Å; F845-G857 PolarHBondContact O-N 2.88Å
858	T	94.5	Very high	83.3	Confident	17 Å²	17	59.2 Å²	59.2	10%	0.104	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	136.8	170.8	52.9	0	0	0	0	111.6	P70 A762 K763 Y836 G843 T860	P70-T858 HydrophobicContact CB-CG2 3.92Å; A762-T858 CarbonylContact C-O 3.57Å; A762-T858 VanDerWaalsContact CA-O 3.22Å; A762-T858 WeakPolarHBondContact CA-O 3.49Å; A762-T858 VanDerWaalsContact CB-O 3.29Å; A762-T858 WeakPolarHBondContact CB-O 3.38Å; K763-T858 PolarHBondContact N-O 2.87Å; K763-T858 PolarHBondContact O-N 3.23Å; Y836-T858 HydrophobicContact CD1-CG2 4.19Å; Y836-T858 HydrophobicContact CD2-CG2 3.85Å; Y836-T858 HydrophobicContact CE2-CG2 4.2Å; Y836-T858 HydrophobicContact CG-CG2 3.86Å; G843-T858 CarbonylContact O-C 3.58Å; G843-T858 VanDerWaalsContact O-CA 3.27Å; G843-T858 WeakPolarHBondContact O-CA 3.36Å; T858-T860 PolarHBondContact O-N 2.98Å
859	V	95.1	Very high	80.7	Confident	1 Å²	1	64 Å²	64	1%	0.006	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	117.9	179.4	-175.9	0	0	0	0	109.5	I760 I833 Y836 G843 F845	I760-V859 HydrophobicContact CB-CG1 4.5Å; I760-V859 HydrophobicContact CD1-CG1 4.34Å; I760-V859 HydrophobicContact CD1-CG2 3.96Å; I833-V859 HydrophobicContact CG2-CB 4.26Å; I833-V859 HydrophobicContact CG2-CG1 3.89Å; I833-V859 HydrophobicContact CG2-CG2 3.76Å; Y836-V859 PolarHBondContact N-O 3.32Å; G843-V859 PolarHBondContact O-N 3.38Å; F845-V859 HydrophobicContact CD1-CG2 3.86Å; F845-V859 HydrophobicContact CE1-CG2 3.94Å
860	T	94.6	Very high	78	Confident	54 Å²	54	67 Å²	67	33%	0.331	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	-31.5	-177.2	54.6	0	0	0	0	113.3	S761 K763 T858	S761-T860 PolarHBondContact O-N 3.31Å; S761-T860 PolarHBondContact O-OG1 3.07Å; S761-T860 VanDerWaalsContact O-OG1 3.14Å; K763-T860 HydrophobicContact CB-CG2 4.1Å; T858-T860 PolarHBondContact O-N 2.98Å
861	K	93.6	Very high	75.4	Confident	137 Å²	137	71.2 Å²	71.2	60%	0.596	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-156.7	127.6	173.4	176.9	163.6	-177.7	167.5	0	112.1	S761	S761-K861 WeakPolarHBondContact CB-O 3.5Å; S761-K861 PolarHBondContact N-O 3.16Å; S761-K861 PolarHBondContact O-N 3.07Å; S761-K861 VanDerWaalsContact O-N 3.08Å
862	I	92	Very high	75	Confident	44 Å²	44	73 Å²	73	23%	0.226	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	138.3	168.7	-57	165.7	0	0	0	108.7	I833 V835	I833-I862 VanDerWaalsContact O-CD1 3.24Å; I833-I862 WeakPolarHBondContact O-CD1 3.32Å; V835-I862 HydrophobicContact CG2-CD1 4.35Å; V835-I862 HydrophobicContact CG2-CG1 4.22Å
863	I	88.5	Confident	74.4	Confident	45 Å²	45	72.6 Å²	72.6	23%	0.231	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	110.7	178.8	-55.2	174.5	0	0	0	107.7	C759 E824	C759-I863 HydrophobicContact CB-CB 3.87Å; C759-I863 HydrophobicContact CB-CG2 4.26Å; C759-I863 WeakPolarHBondContact O-CB 3.38Å; C759-I863 PolarHBondContact O-N 3.35Å; C759-I863 VanDerWaalsContact O-O 3.14Å; E824-I863 HydrophobicContact CG-CD1 4.02Å; E824-I863 WeakPolarHBondContact OE1-CD1 3.28Å
864	P	78.1	Confident	73.5	Confident	91 Å²	91	75.7 Å²	75.7	59%	0.591	42%	0.42	S	S	*	.			trans	-62.2	147	177.9	26.5	-34.1	0	0	0	110.7
865	S	65.8	Low	72.5	Confident	51 Å²	51	79.8 Å²	79.8	36%	0.357	44%	0.443	S	S	.	.			trans	-68.3	137.5	178.3	102.7	0	0	0	0	109.8	K867	S865-K867 PolarHBondContact O-N 3.22Å
866	K	53.2	Low	71.2	Confident	197 Å²	197	84.8 Å²	84.8	86%	0.857	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	13.5	-175.1	-83.2	-162.8	168.6	-159.6	0	115.3
867	K	50.4	Low	69.7	Low	184 Å²	184	90.4 Å²	90.4	80%	0.8	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-13.5	-176.4	-73.5	-170.3	172.4	-174.5	0	114.8	S865	S865-K867 PolarHBondContact O-N 3.22Å
868	E	42	Very low	68.1	Low	148 Å²	148	96.1 Å²	96.1	69%	0.692	53%	0.53	S	S	*	.	S	Bend	trans	-103.1	-3.8	-173.8	-65.7	171.3	165	0	0	113.7	S870	E868-S870 VanDerWaalsContact C-N 3.35Å; E868-S870 PolarHBondContact O-N 3.37Å
869	S	37.7	Very low	66.1	Low	105 Å²	105	102.2 Å²	102.2	73%	0.734	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	35.2	-179.7	74	0	0	0	0	113.1
870	S	36.3	Very low	63.7	Low	108 Å²	108	110.7 Å²	110.7	76%	0.755	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.5	31.6	179.2	64.4	0	0	0	0	112.6	E868	E868-S870 VanDerWaalsContact C-N 3.35Å; E868-S870 PolarHBondContact O-N 3.37Å
871	S	31.8	Very low	60.8	Low	164 Å²	164	115.8 Å²	115.8	100%	1.147	64%	0.635	S	S	*	*			trans	-138	0	172.1	56.9	0	0	0	0	107.9

Retrieved 871 of 871 residues in 1294.9 ms (Link to these results)

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