A0A087YIZ0_POEFO Loading...

BTB (POZ) domain containing 11a

AlphaFold DB , UniProt , Accession A0A087YIZ0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,027 aa.

						>A0A087YIZ0_POEFO|A0A087YIZ0
MAGKDKTVVRTLEDLTLDSGYGGAADSVRSSSVSLCCSDTHQSVSHGGNYWHLTESMHSRHNSLDTVNTVLAEDTEILECAGHCAKLPELEEVPWSLGEVEGALRKDEELMLGNPSPEVLARLSALISRALVRVAREAQRLSLRYAKCTKHEIQSAIKVVLSWTISVNCITAALSALSLYNMSSAGDKFSRGKSVRCGLVFSVGRFFRWMVDSRVALRIHEHAAIYLCACMESLFREVFGRVLRSALVERDNGIPKITLESMEQAISNDSEIWGLLQPYQHLICGKNSSGVLSLPESLNLHRDQQRSGRGGEGHGYSQAELRTLEQSLLATRVGSIAELSDLVSRAMHHLQPLHIKNPSNGTPVHQKSSSTVHWEPEALYTLCYFMHCPQMEWENPNVEPSKVTLQTERPFLVLPPLMEWIRVAVAHTEHRRSFSVDSDDVRQAARLLLPGVDCEPRQIKAEDCFCATRKLDAASTEAKFLQDLGFRMLNCGRTDLVKQAVNLLGPDGINSMSEQGMTPLMYACVRGDEAMVQMLLDAGADINSEVPSTVNKHPSVYPETRQATPLTFAVLHGHVPVVQLLLDNRANVEGALQDGAENYTETPLQLAAAAGNFELVSLLLERGADPMIGTMCRNGISSTPLGDMNSFSLAASHGHRNVFRKLLSHSEKEKGDVLSLEEILAEGSDPGEKRLAPQANCSGTLRTGKAKLRALREAMYHSAEHGHVDITIDIRSLGVPWTLHTWLESLRTCFMQNRRPLIQGLLKDFSCIQEDEYTEELITHGLPLMFQILRTSKNEVISQQLSVIFTQCYGPFPIPKLTEIKKKQTSRLDPHFLNNKEMSDVTFLVEGKPFYAHKVLLFTASARFKSLLQNRPAAENTCIEISHVKYNIFHLVMQYLYCGGTESLHIRNTEVMELLSAAKFFQLEALQRHCEIICSKNITTETCVDLYKHAKFLGALELTAFIEGYFLKNMVLLIELDAFKQLLYEPSAAESPASSPGLCSDILHDLEKTLATRIHSIHLSTSKGSVV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.3	Very low	25.6	Very low	242 Å²	242	153.2 Å²	153.2	100%	1.192	84%	0.835	S	S	*	*				0	93.1	0	-66.1	-169.4	-174.8	0	0	106.5
2	A	25.5	Very low	25.4	Very low	111 Å²	111	154.6 Å²	154.6	92%	0.917	84%	0.84	S	S	*	*				70.4	119.4	105.8	0	0	0	0	0	112.2
3	G	26.3	Very low	25.2	Very low	71 Å²	71	155.3 Å²	155.3	73%	0.732	83%	0.834	S	S	*	*			cis	-166.1	148.2	2.8	0	0	0	0	0	109.8
4	K	26.7	Very low	25	Very low	198 Å²	198	153.7 Å²	153.7	86%	0.861	83%	0.825	S	S	*	*				82.8	108.7	109.6	-84.1	-171.6	174.1	-179.6	0	118
5	D	24.4	Very low	25	Very low	144 Å²	144	155.5 Å²	155.5	77%	0.77	83%	0.834	S	S	*	*				30.7	128.1	128.7	-54.4	-31.2	0	0	0	120.9
6	K	24.4	Very low	25	Very low	199 Å²	199	152.9 Å²	152.9	87%	0.865	83%	0.825	S	S	*	*				-179.1	136.7	97.8	-97	177.9	-178.9	-178.5	0	113.7
7	T	27.1	Very low	25.1	Very low	130 Å²	130	153.2 Å²	153.2	80%	0.798	83%	0.825	S	S	*	*			trans	-66.5	145.5	158.5	43.3	0	0	0	0	111.5
8	V	22.1	Very low	24.9	Very low	129 Å²	129	153.1 Å²	153.1	78%	0.782	82%	0.824	S	S	*	*			trans	-142.1	114.5	156.9	177	0	0	0	0	110.1
9	V	25.1	Very low	24.8	Very low	117 Å²	117	151.1 Å²	151.1	71%	0.709	82%	0.823	S	S	*	*			trans	-62.3	142.9	160.4	169.4	0	0	0	0	110.1	T11	V9-T11 HydrophobicContact CG1-CG2 4.38Å
10	R	23.7	Very low	24.7	Very low	232 Å²	232	147.3 Å²	147.3	88%	0.875	82%	0.821	S	S	*	*			trans	-135.4	109.1	151.1	-76	-169	177.8	167.3	-0.7	110.6
11	T	26.8	Very low	24.6	Very low	112 Å²	112	152 Å²	152	69%	0.687	83%	0.827	S	S	*	*			trans	-62.7	154.7	154.1	41.7	0	0	0	0	110.3	V9	V9-T11 HydrophobicContact CG1-CG2 4.38Å
12	L	22.9	Very low	24.3	Very low	170 Å²	170	144 Å²	144	89%	0.89	81%	0.808	S	S	*	*			trans	-141.5	90.9	155.5	-134.1	99.4	0	0	0	108.8
13	E	23.2	Very low	24.2	Very low	164 Å²	164	142.4 Å²	142.4	77%	0.766	80%	0.802	S	S	*	*			trans	-79.6	157.6	150	-75.4	171.8	152.8	0	0	108.5
14	D	22.4	Very low	24.1	Very low	133 Å²	133	143.9 Å²	143.9	71%	0.711	81%	0.807	S	S	*	*			trans	72.7	95.6	161.8	-63.8	-16.6	0	0	0	120.2
15	L	25.2	Very low	24	Very low	181 Å²	181	138.9 Å²	138.9	95%	0.948	80%	0.803	S	S	*	*				-136.6	105.8	129.3	-84.1	172.8	0	0	0	109.4
16	T	25.5	Very low	24	Very low	113 Å²	113	139.6 Å²	139.6	69%	0.693	81%	0.807	S	S	*	*			trans	-84.6	161.8	169.4	40.2	0	0	0	0	111.6
17	L	25.8	Very low	24	Very low	159 Å²	159	135.6 Å²	135.6	83%	0.832	80%	0.803	S	S	*	*			trans	118.6	86.5	152.4	-61.4	170.8	0	0	0	117.1
18	D	21.5	Very low	24	Very low	150 Å²	150	135.9 Å²	135.9	80%	0.802	81%	0.805	S	S	*	*				49.1	120	113.9	-152.2	16	0	0	0	121
19	S	24.1	Very low	24.1	Very low	116 Å²	116	140.7 Å²	140.7	81%	0.811	81%	0.809	S	S	*	*				169.9	134	116.7	48.2	0	0	0	0	112.8
20	G	22.8	Very low	24	Very low	75 Å²	75	140.8 Å²	140.8	77%	0.773	82%	0.815	S	S	*	*			trans	120.5	86.6	143.8	0	0	0	0	0	119.5
21	Y	22.3	Very low	24.2	Very low	245 Å²	245	134.4 Å²	134.4	96%	0.961	81%	0.805	S	S	*	*			trans	3.6	131.8	139.7	-115.9	-105.5	0	0	0	120.3
22	G	23.1	Very low	24.2	Very low	75 Å²	75	134.1 Å²	134.1	77%	0.773	81%	0.808	S	S	*	*			trans	129.5	101.8	133.9	0	0	0	0	0	119.6
23	G	22.9	Very low	24.2	Very low	78 Å²	78	132.2 Å²	132.2	80%	0.804	80%	0.803	S	S	*	*				84.8	126.5	126.1	0	0	0	0	0	121.8
24	A	23.5	Very low	24.2	Very low	102 Å²	102	130 Å²	130	84%	0.843	81%	0.806	S	S	*	*			trans	83.1	107.7	150.8	0	0	0	0	0	120.1
25	A	25.4	Very low	24.3	Very low	92 Å²	92	131.2 Å²	131.2	76%	0.76	81%	0.812	S	S	*	*			trans	40.9	137.2	130.5	0	0	0	0	0	121.5
26	D	23.6	Very low	24.2	Very low	160 Å²	160	128.8 Å²	128.8	86%	0.856	81%	0.809	S	S	*	*			trans	79.7	94.3	162.2	-58	-21.6	0	0	0	118.2
27	S	25.8	Very low	24.1	Very low	114 Å²	114	129.5 Å²	129.5	80%	0.797	82%	0.816	S	S	*	*				162.1	107.5	117.7	-173.2	0	0	0	0	109.3	R29	S27-R29 PolarHBondContact O-N 2.87Å
28	V	26	Very low	24.1	Very low	136 Å²	136	127 Å²	127	82%	0.824	81%	0.812	S	S	*	*			trans	-70.7	99.4	177.2	-174.8	0	0	0	0	108.6	S30	V28-S30 PolarHBondContact O-N 3.27Å
29	R	24.3	Very low	24.2	Very low	231 Å²	231	127.6 Å²	127.6	87%	0.872	82%	0.816	S	S	*	*			trans	-71.7	111.3	157.8	-89	-176.2	179.6	178.3	1	108.4	S27	S27-R29 PolarHBondContact O-N 2.87Å
30	S	24	Very low	24.1	Very low	118 Å²	118	128.2 Å²	128.2	83%	0.825	81%	0.814	S	S	*	*			trans	-87.7	112.2	156.3	-64	0	0	0	0	108.7	V28	V28-S30 PolarHBondContact O-N 3.27Å
31	S	26.7	Very low	24.1	Very low	98 Å²	98	133.4 Å²	133.4	69%	0.685	82%	0.818	S	S	*	*			trans	-128.3	137	163.1	38.9	0	0	0	0	105.8
32	S	26.6	Very low	24	Very low	106 Å²	106	131.3 Å²	131.3	74%	0.741	82%	0.817	S	S	*	*			cis	178.2	150.3	18.2	40.6	0	0	0	0	108.7
33	V	22.6	Very low	23.9	Very low	131 Å²	131	132.7 Å²	132.7	79%	0.794	82%	0.815	S	S	*	*			trans	-149	96.4	136.4	-172.4	0	0	0	0	109
34	S	24.7	Very low	23.8	Very low	118 Å²	118	135.2 Å²	135.2	83%	0.825	82%	0.815	S	S	*	*			trans	-142.6	117.8	158.9	173.6	0	0	0	0	106.5
35	L	23.5	Very low	23.7	Very low	158 Å²	158	134.5 Å²	134.5	83%	0.827	80%	0.804	S	S	*	*			trans	-97.9	123.2	175.4	-83.6	158.5	0	0	0	107.6
36	C	23.9	Very low	23.6	Very low	130 Å²	130	139.6 Å²	139.6	88%	0.878	81%	0.811	S	S	*	*			trans	-150.4	137	147.5	-98	0	0	0	0	109.6
37	C	24.1	Very low	23.6	Very low	127 Å²	127	135.3 Å²	135.3	86%	0.858	81%	0.805	S	S	*	*			trans	-70.9	152.8	-164.8	-58.3	0	0	0	0	114.4
38	S	24.4	Very low	23.4	Very low	107 Å²	107	133.1 Å²	133.1	75%	0.748	80%	0.8	S	S	*	*			trans	-66	141.9	169.2	47.5	0	0	0	0	112.8
39	D	23.6	Very low	23.3	Very low	163 Å²	163	134.6 Å²	134.6	87%	0.872	80%	0.804	S	S	*	*			trans	-158	155.2	139	-102.7	-22.7	0	0	0	113.8
40	T	22	Very low	23.1	Very low	128 Å²	128	131.8 Å²	131.8	79%	0.785	79%	0.794	S	S	*	*			trans	-84.2	153.2	-153.8	44.9	0	0	0	0	116.9
41	H	22.5	Very low	23.1	Very low	185 Å²	185	138.8 Å²	138.8	86%	0.856	80%	0.803	S	S	*	*			trans	-38.2	146.8	175.4	-67	-87.1	0	0	0	118.8
42	Q	20.8	Very low	22.8	Very low	200 Å²	200	140.8 Å²	140.8	94%	0.935	80%	0.801	S	S	*	*				-160.7	156.7	124.7	-110.8	172.2	17.7	0	0	114.1
43	S	21.2	Very low	22.6	Very low	105 Å²	105	143.2 Å²	143.2	73%	0.734	81%	0.805	S	S	*	*			trans	-90.9	174.9	-153.8	49.8	0	0	0	0	117.5
44	V	21.7	Very low	22.6	Very low	131 Å²	131	143.2 Å²	143.2	79%	0.794	81%	0.805	S	S	*	*			trans	115.3	137.4	153.9	177.4	0	0	0	0	112.6
45	S	20.9	Very low	22.7	Very low	87 Å²	87	147 Å²	147	61%	0.608	81%	0.81	S	S	*	*			cis	-178.7	147.2	-20.1	58.7	0	0	0	0	108.4
46	H	22.9	Very low	22.8	Very low	198 Å²	198	144.4 Å²	144.4	92%	0.917	81%	0.805	S	S	*	*			trans	64.5	138.1	157.1	-64.6	-35.3	0	0	0	119.8
47	G	23.4	Very low	22.9	Very low	70 Å²	70	146.1 Å²	146.1	72%	0.722	80%	0.802	S	S	*	*			cis	172.7	154.1	1.1	0	0	0	0	0	112.4
48	G	21.4	Very low	22.9	Very low	68 Å²	68	149 Å²	149	70%	0.701	80%	0.803	S	S	*	*			trans	61.3	133.5	156.6	0	0	0	0	0	118.5
49	N	24.6	Very low	22.9	Very low	168 Å²	168	150.1 Å²	150.1	90%	0.898	81%	0.81	S	S	*	*			cis	-156.7	152.8	29.2	-89.2	-24.9	0	0	0	112.8
50	Y	20.6	Very low	23.3	Very low	171 Å²	171	152.5 Å²	152.5	67%	0.671	81%	0.807	S	S	*	*			trans	-67.8	148.3	-174.1	-87.4	-101.2	0	0	0	116.9	H52	Y50-H52 AromaticContact CD1-CD2 3.46Å; Y50-H52 VanDerWaalsContact CD1-CD2 3.46Å; Y50-H52 WeakPolarHBondContact CD1-CD2 3.49Å; Y50-H52 AromaticContact CD1-CE1 3.66Å; Y50-H52 AromaticContact CD1-NE2 3.19Å; Y50-H52 WeakPolarHBondContact CD1-NE2 3.42Å; Y50-H52 AromaticContact CE1-CD2 3.97Å; Y50-H52 AromaticContact CE1-CE1 3.36Å; Y50-H52 WeakPolarHBondContact CE1-CE1 3.44Å; Y50-H52 AromaticContact CE1-NE2 3.21Å; Y50-H52 WeakPolarHBondContact CE1-NE2 3.47Å
51	W	22.6	Very low	23.6	Very low	266 Å²	266	155.7 Å²	155.7	100%	1.008	81%	0.813	S	S	*	*			trans	-139	137.7	134.4	-75.3	105.2	0	0	0	109.4
52	H	21.9	Very low	23.9	Very low	140 Å²	140	154 Å²	154	65%	0.648	81%	0.81	S	S	*	*			trans	-102.7	164	-166.9	-87.7	-80.5	0	0	0	114.4	Y50	Y50-H52 AromaticContact CD1-CD2 3.46Å; Y50-H52 VanDerWaalsContact CD1-CD2 3.46Å; Y50-H52 WeakPolarHBondContact CD1-CD2 3.49Å; Y50-H52 AromaticContact CD1-CE1 3.66Å; Y50-H52 AromaticContact CD1-NE2 3.19Å; Y50-H52 WeakPolarHBondContact CD1-NE2 3.42Å; Y50-H52 AromaticContact CE1-CD2 3.97Å; Y50-H52 AromaticContact CE1-CE1 3.36Å; Y50-H52 WeakPolarHBondContact CE1-CE1 3.44Å; Y50-H52 AromaticContact CE1-NE2 3.21Å; Y50-H52 WeakPolarHBondContact CE1-NE2 3.47Å
53	L	22.4	Very low	24.1	Very low	157 Å²	157	150.4 Å²	150.4	82%	0.822	81%	0.807	S	S	*	*			trans	86.1	126.3	173.5	-78.3	95.1	0	0	0	115.2
54	T	22.4	Very low	24.6	Very low	131 Å²	131	152.5 Å²	152.5	80%	0.804	81%	0.809	S	S	*	*			cis	-157.7	148.8	11.6	4.3	0	0	0	0	108.6
55	E	25.1	Very low	24.7	Very low	196 Å²	196	153.3 Å²	153.3	92%	0.916	81%	0.809	S	S	*	*			trans	-59.2	130.6	-168.9	-68	172.4	138.9	0	0	115.7
56	S	26.6	Very low	25	Very low	104 Å²	104	154.6 Å²	154.6	73%	0.727	81%	0.813	S	S	*	*				154.4	136.7	121.4	-171.4	0	0	0	0	109.9
57	M	25.8	Very low	25	Very low	166 Å²	166	151.2 Å²	151.2	82%	0.818	81%	0.806	S	S	*	*			trans	83	79.4	173.9	-54.7	-91.1	178.1	0	0	116.9
58	H	24.8	Very low	24.9	Very low	189 Å²	189	154.5 Å²	154.5	88%	0.875	81%	0.807	S	S	*	*			trans	-153.7	112.5	140.6	-83.3	93.3	0	0	0	110
59	S	23.1	Very low	24.9	Very low	129 Å²	129	157.1 Å²	157.1	90%	0.902	81%	0.81	S	S	*	*			trans	-128.1	75.4	151.1	178.2	0	0	0	0	108.4
60	R	33.7	Very low	24.8	Very low	214 Å²	214	155.4 Å²	155.4	81%	0.808	81%	0.805	S	S	*	*			trans	-125.6	128.7	152	-74.5	-176.3	174.3	-177.6	-1.4	104.5
61	H	26.4	Very low	25	Very low	195 Å²	195	154.2 Å²	154.2	90%	0.903	81%	0.809	S	S	*	*			trans	-155.8	138.1	144.2	-100.9	82.2	0	0	0	109.6
62	N	30.4	Very low	25.1	Very low	149 Å²	149	146.5 Å²	146.5	80%	0.797	80%	0.802	S	S	*	*			trans	-59.3	160	176.7	-61.4	-36.6	0	0	0	112.6
63	S	25	Very low	25.3	Very low	125 Å²	125	147.3 Å²	147.3	87%	0.874	81%	0.807	S	S	*	*			trans	-126.2	117.6	150.1	69.6	0	0	0	0	110.4
64	L	30.1	Very low	25.5	Very low	149 Å²	149	146.6 Å²	146.6	78%	0.78	80%	0.803	S	S	*	*			trans	-88.1	142.7	164.3	-81.5	148.4	0	0	0	109
65	D	24.4	Very low	25.6	Very low	147 Å²	147	147.3 Å²	147.3	79%	0.786	81%	0.808	S	S	*	*			trans	-174.9	98.6	137.3	-98.7	-22.9	0	0	0	109.6
66	T	27.4	Very low	26	Very low	114 Å²	114	146.4 Å²	146.4	70%	0.699	80%	0.804	S	S	*	*				74.4	130.1	94.9	50.1	0	0	0	0	114.4
67	V	22.4	Very low	26.4	Very low	127 Å²	127	148.8 Å²	148.8	77%	0.77	81%	0.807	S	S	*	*				-154.1	134.8	75.7	176.4	0	0	0	0	114
68	N	21.7	Very low	27	Very low	139 Å²	139	146.6 Å²	146.6	74%	0.743	80%	0.798	S	S	*	*			trans	8.9	142.7	150.7	-63.4	-33.5	0	0	0	121
69	T	22.4	Very low	27.4	Very low	124 Å²	124	146.5 Å²	146.5	76%	0.761	80%	0.798	S	S	*	*				-162.1	139.1	58.9	42.1	0	0	0	0	115.9
70	V	22	Very low	28	Very low	131 Å²	131	145.8 Å²	145.8	79%	0.794	79%	0.791	S	S	*	*			trans	75.9	106.3	136.6	-175.3	0	0	0	0	121.4
71	L	25.3	Very low	28.2	Very low	146 Å²	146	138.7 Å²	138.7	76%	0.764	78%	0.779	S	S	*	*			trans	2.3	131.5	143.4	-59.2	166.5	0	0	0	120.6
72	A	23.7	Very low	29.1	Very low	104 Å²	104	132.4 Å²	132.4	86%	0.86	77%	0.767	S	S	*	*				-143.9	126.6	128.7	0	0	0	0	0	108.5
73	E	26.4	Very low	30.3	Very low	158 Å²	158	133.3 Å²	133.3	74%	0.738	77%	0.766	S	S	*	*			trans	-76.4	165.5	-174.6	-68	168.7	148.8	0	0	112.7
74	D	27.1	Very low	32.1	Very low	141 Å²	141	129.1 Å²	129.1	75%	0.754	74%	0.736	S	S	*	*			trans	88.4	93.8	160	-56.6	-23.7	0	0	0	119.9
75	T	24.8	Very low	34.3	Very low	147 Å²	147	124.6 Å²	124.6	90%	0.902	72%	0.72	S	S	*	*				-172.6	101.9	112.8	19.2	0	0	0	0	111.6	I77	T75-I77 PolarHBondContact O-N 2.95Å
76	E	33.1	Very low	37.2	Very low	177 Å²	177	125.1 Å²	125.1	83%	0.827	72%	0.715	S	S	*	*			trans	-67.9	81.3	179	-62.8	175	147.4	0	0	113.4
77	I	35.4	Very low	40	Very low	154 Å²	154	120.5 Å²	120.5	79%	0.79	69%	0.686	S	S	*	*	S	Bend	trans	-149	68.1	157.6	-48.2	177.1	0	0	0	109.9	T75	T75-I77 PolarHBondContact O-N 2.95Å
78	L	37.3	Very low	43	Very low	119 Å²	119	117.4 Å²	117.4	62%	0.623	67%	0.669	S	S	*	*			trans	-175.5	24.6	154.2	-128	78.5	0	0	0	114.4	C80 A81	L78-C80 PolarHBondContact O-N 3.27Å; L78-A81 VanDerWaalsContact O-CB 3.3Å; L78-A81 WeakPolarHBondContact O-CB 3.35Å; L78-A81 PolarHBondContact O-N 2.86Å
79	E	33.3	Very low	45.9	Very low	187 Å²	187	119.1 Å²	119.1	87%	0.874	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	53.4	-179.7	-68.1	-165.7	157.3	0	0	113.6
80	C	35.1	Very low	49	Very low	114 Å²	114	115.5 Å²	115.5	77%	0.77	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	6.1	146.9	-77.7	0	0	0	0	111	L78 G82	L78-C80 PolarHBondContact O-N 3.27Å; C80-G82 VanDerWaalsContact C-N 3.29Å; C80-G82 PolarHBondContact O-N 3.31Å
81	A	38.8	Very low	51.6	Low	66 Å²	66	118.9 Å²	118.9	55%	0.545	66%	0.655	S	S	.	*			trans	-86.8	45	-168.6	0	0	0	0	0	114.6	L78	L78-A81 VanDerWaalsContact O-CB 3.3Å; L78-A81 WeakPolarHBondContact O-CB 3.35Å; L78-A81 PolarHBondContact O-N 2.86Å
82	G	44.2	Very low	54.5	Low	63 Å²	63	119.6 Å²	119.6	65%	0.649	66%	0.655	S	S	*	*	S	Bend	trans	-83.9	-9.4	172.5	0	0	0	0	0	115.5	C80	C80-G82 VanDerWaalsContact C-N 3.29Å; C80-G82 PolarHBondContact O-N 3.31Å
83	H	56.2	Low	57.8	Low	168 Å²	168	116.9 Å²	116.9	78%	0.778	63%	0.627	S	S	*	*	S	Bend	trans	-139.5	6	-163.1	-72.5	89.6	0	0	0	117.2
84	C	63.1	Low	61	Low	37 Å²	37	109.6 Å²	109.6	25%	0.25	59%	0.594	C	S	.	*	P	Polyproline II helix	trans	-93.2	118	178	-75.4	0	0	0	0	112.1	Y279	C84-Y279 HydrophobicContact CB-CD1 4.15Å
85	A	76.4	Confident	64.3	Low	54 Å²	54	103.4 Å²	103.4	45%	0.446	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-59.4	135.5	175.8	0	0	0	0	0	111.8	Q280	A85-Q280 HydrophobicContact CB-CB 4.2Å; A85-Q280 WeakPolarHBondContact O-CB 3.46Å; A85-Q280 PolarHBondContact O-N 3.29Å
86	K	85.1	Confident	67.5	Low	158 Å²	158	98.8 Å²	98.8	69%	0.687	53%	0.534	S	S	*	.	B	Isolated β-bridge	trans	-90.9	154.1	176.7	-67.8	-176.9	179.5	179	0	111.2	P278	K86-P278 CarbonylContact C-O 3.51Å; K86-P278 VanDerWaalsContact CA-O 3.31Å; K86-P278 WeakPolarHBondContact CA-O 3.34Å
87	L	86.1	Confident	70.3	Confident	16 Å²	16	94.1 Å²	94.1	8%	0.084	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-66.8	146.9	168.3	-72.1	172.7	0	0	0	110	R129 V132 R133 P278 Y279	L87-R129 HydrophobicContact CD1-CB 4.16Å; L87-V132 HydrophobicContact CD2-CG1 4.13Å; L87-R133 HydrophobicContact CD1-CG 3.93Å; L87-R133 HydrophobicContact CD2-CG 4.35Å; L87-P278 PolarHBondContact N-O 3.27Å; L87-Y279 WeakPolarHBondContact CG-O 3.36Å
88	P	85.8	Confident	73	Confident	62 Å²	62	89.1 Å²	89.1	40%	0.403	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-63.3	136.9	170	28.1	-33.2	0	0	0	109.5	V132	P88-V132 HydrophobicContact CG-CG1 3.9Å
89	E	82.7	Confident	75.6	Confident	175 Å²	175	85.3 Å²	85.3	82%	0.818	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-79	135.5	169.9	-64.2	-171.9	166.8	0	0	108.9
90	L	85.9	Confident	78.5	Confident	49 Å²	49	76.4 Å²	76.4	26%	0.257	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-84.3	119.6	178.6	-69.9	177.3	0	0	0	109.5	V93 L131 V132 W209	L90-V93 HydrophobicContact CB-CG1 4.18Å; L90-V93 HydrophobicContact CD1-CG1 4.13Å; L90-L131 HydrophobicContact CD1-CD2 3.89Å; L90-V132 HydrophobicContact CD1-CG2 3.54Å; L90-V132 HydrophobicContact CD2-CG2 3.86Å; L90-V132 HydrophobicContact CG-CG2 3.52Å; L90-W209 HydrophobicContact CD1-CZ2 3.93Å; L90-W209 HydrophobicContact CD2-CZ2 4.01Å
91	E	78.5	Confident	81.2	Confident	201 Å²	201	74 Å²	74	94%	0.939	42%	0.415	S	S	*	.	S	Bend	trans	-65.8	-40.9	172	-65.7	-176.9	173	0	0	111.2
92	E	84.6	Confident	83.7	Confident	162 Å²	162	72.1 Å²	72.1	76%	0.757	40%	0.402	S	S	*	.	S	Bend	trans	-128.3	129.4	177.3	-65.9	-170.5	169.9	0	0	111.5	W209	E92-W209 PolarHBondContact O-NE1 3.21Å
93	V	93.2	Very high	85.9	Confident	46 Å²	46	69.1 Å²	69.1	28%	0.279	37%	0.371	S	S	.	.			trans	-103.5	149.8	174.2	-69.5	0	0	0	0	110.7	L90 W95	L90-V93 HydrophobicContact CB-CG1 4.18Å; L90-V93 HydrophobicContact CD1-CG1 4.13Å; V93-W95 HydrophobicContact CB-CD2 4.17Å; V93-W95 HydrophobicContact CB-CZ2 4.02Å; V93-W95 HydrophobicContact CG1-CZ2 4.04Å; V93-W95 HydrophobicContact CG2-CD2 4.37Å; V93-W95 HydrophobicContact CG2-CG 4.38Å; V93-W95 PolarHBondContact O-N 3.33Å
94	P	95.1	Very high	87.5	Confident	6 Å²	6	61.3 Å²	61.3	4%	0.039	34%	0.335	C	S	.	.	S	Bend	trans	-76.5	16.1	-175.4	30.3	-34.4	0	0	0	114.7	L131 R205 F206 W209	P94-L131 HydrophobicContact CG-CD2 3.97Å; P94-R205 VanDerWaalsContact O-CZ 3.26Å; P94-R205 PolarHBondContact O-NH1 3.27Å; P94-R205 PolarHBondContact O-NH2 2.8Å; P94-F206 HydrophobicContact CB-CD1 4.33Å; P94-F206 HydrophobicContact CB-CD2 3.85Å; P94-F206 HydrophobicContact CB-CE1 4.49Å; P94-F206 HydrophobicContact CB-CE2 4.03Å; P94-F206 HydrophobicContact CB-CG 4.03Å; P94-F206 HydrophobicContact CB-CZ 4.37Å; P94-F206 HydrophobicContact CG-CD1 3.89Å; P94-F206 HydrophobicContact CG-CD2 4.05Å; P94-F206 HydrophobicContact CG-CE1 3.69Å; P94-F206 HydrophobicContact CG-CE2 3.86Å; P94-F206 HydrophobicContact CG-CG 4.09Å; P94-F206 HydrophobicContact CG-CZ 3.7Å; P94-W209 HydrophobicContact CB-CB 3.88Å; P94-W209 HydrophobicContact CB-CG 4.08Å; P94-W209 HydrophobicContact CG-CB 4.4Å; P94-W209 HydrophobicContact CG-CD2 4.3Å; P94-W209 HydrophobicContact CG-CG 4.13Å
95	W	94.8	Very high	88.6	Confident	10 Å²	10	65.1 Å²	65.1	4%	0.038	34%	0.344	C	S	.	.	S	Bend	trans	-136.7	156.6	179.8	56.7	77.8	0	0	0	112	V93 V100 S124 L131 F201 F206 M231 F235	V93-W95 HydrophobicContact CB-CD2 4.17Å; V93-W95 HydrophobicContact CB-CZ2 4.02Å; V93-W95 HydrophobicContact CG1-CZ2 4.04Å; V93-W95 HydrophobicContact CG2-CD2 4.37Å; V93-W95 HydrophobicContact CG2-CG 4.38Å; V93-W95 PolarHBondContact O-N 3.33Å; W95-V100 HydrophobicContact CG-CG2 4.18Å; W95-S124 PolarHBondContact NE1-OG 2.88Å; W95-L131 HydrophobicContact CH2-CB 4.09Å; W95-L131 HydrophobicContact CH2-CD2 3.74Å; W95-L131 HydrophobicContact CH2-CG 4.47Å; W95-L131 HydrophobicContact CZ3-CB 4.48Å; W95-L131 HydrophobicContact CZ3-CD2 3.68Å; W95-L131 HydrophobicContact CZ3-CG 4.49Å; W95-F201 HydrophobicContact CB-CD1 4.4Å; W95-F201 HydrophobicContact CB-CE1 4.25Å; W95-F201 HydrophobicContact CB-CZ 4.33Å; W95-F201 HydrophobicContact CE3-CE2 4.48Å; W95-F201 HydrophobicContact CG-CZ 4.5Å; W95-F206 HydrophobicContact CE3-CE1 4.43Å; W95-F206 HydrophobicContact CE3-CE2 4.02Å; W95-F206 AromaticContact CE3-CZ 3.53Å; W95-F206 HydrophobicContact CE3-CZ 3.53Å; W95-F206 HydrophobicContact CZ3-CE1 4.25Å; W95-F206 AromaticContact CZ3-CZ 3.72Å; W95-F206 HydrophobicContact CZ3-CZ 3.72Å; W95-M231 HydrophobicContact CZ3-CB 4.37Å; W95-M231 HydrophobicContact CZ3-CG 4.22Å; W95-F235 HydrophobicContact CD2-CE2 4.24Å; W95-F235 HydrophobicContact CD2-CZ 4.42Å; W95-F235 AromaticContact CE2-CE2 3.98Å; W95-F235 AromaticContact CE2-CZ 3.78Å; W95-F235 HydrophobicContact CH2-CE2 4.36Å; W95-F235 HydrophobicContact CZ2-CE2 4.07Å; W95-F235 AromaticContact CZ2-CZ 3.92Å; W95-F235 HydrophobicContact CZ2-CZ 3.92Å; W95-F235 AromaticContact NE1-CZ 3.82Å
96	S	92.7	Very high	88.8	Confident	51 Å²	51	67.3 Å²	67.3	36%	0.357	34%	0.344	S	S	.	.			trans	-101.3	158	170.5	67.5	0	0	0	0	111	G98 E99 V100	S96-G98 VanDerWaalsContact C-N 3.25Å; S96-G98 PolarHBondContact O-N 3.13Å; S96-E99 WeakPolarHBondContact CB-OE2 3.35Å; S96-E99 PolarHBondContact N-OE2 2.99Å; S96-E99 PolarHBondContact O-N 3.1Å; S96-E99 VanDerWaalsContact O-N 3.15Å; S96-E99 WeakPolarHBondContact OG-CG 3.34Å; S96-E99 PolarHBondContact OG-N 2.64Å; S96-E99 PolarHBondContact OG-OE2 3.24Å; S96-V100 WeakPolarHBondContact O-CG2 3.42Å; S96-V100 PolarHBondContact O-N 2.92Å; S96-V100 VanDerWaalsContact O-N 3.08Å
97	L	92.5	Very high	88.3	Confident	78 Å²	78	62.4 Å²	62.4	41%	0.408	33%	0.325	S	S	.	.	H	α-helix	trans	-61.7	-33.5	177.2	-64.4	-179.1	0	0	0	112.8	E99 V100 E101 A121	L97-E99 VanDerWaalsContact C-N 3.33Å; L97-E99 PolarHBondContact O-N 3.43Å; L97-V100 PolarHBondContact O-N 3.11Å; L97-E101 PolarHBondContact O-N 2.64Å; L97-A121 HydrophobicContact CD1-CB 4.32Å; L97-A121 HydrophobicContact CD2-CB 4.49Å
98	G	90.5	Very high	87.3	Confident	49 Å²	49	70 Å²	70	51%	0.505	36%	0.36	S	S	.	.	H	α-helix	trans	-66.1	-34.4	175.9	0	0	0	0	0	112.9	S96 G102	S96-G98 VanDerWaalsContact C-N 3.25Å; S96-G98 PolarHBondContact O-N 3.13Å; G98-G102 PolarHBondContact O-N 3.48Å
99	E	93	Very high	86.4	Confident	40 Å²	40	72.8 Å²	72.8	19%	0.187	37%	0.368	C	S	.	.	H	α-helix	trans	-73.5	-34.9	173.3	-70.1	162.5	130.2	0	0	112.1	S96 L97 E101 G102 A103 V200 F201 R205	S96-E99 WeakPolarHBondContact CB-OE2 3.35Å; S96-E99 PolarHBondContact N-OE2 2.99Å; S96-E99 PolarHBondContact O-N 3.1Å; S96-E99 VanDerWaalsContact O-N 3.15Å; S96-E99 WeakPolarHBondContact OG-CG 3.34Å; S96-E99 PolarHBondContact OG-N 2.64Å; S96-E99 PolarHBondContact OG-OE2 3.24Å; L97-E99 VanDerWaalsContact C-N 3.33Å; L97-E99 PolarHBondContact O-N 3.43Å; E99-E101 VanDerWaalsContact C-N 3.31Å; E99-G102 PolarHBondContact O-N 2.93Å; E99-A103 WeakPolarHBondContact O-CB 3.11Å; E99-A103 PolarHBondContact O-N 2.85Å; E99-V200 HydrophobicContact CB-CG1 4.16Å; E99-V200 HydrophobicContact CG-CG1 4.4Å; E99-F201 HydrophobicContact CB-CD1 3.83Å; E99-F201 HydrophobicContact CB-CE1 3.96Å; E99-F201 WeakPolarHBondContact O-CE1 3.11Å; E99-R205 IonicContact OE1-CZ 2.96Å; E99-R205 IonicContact OE1-NH2 2.81Å; E99-R205 PolarHBondContact OE1-NH2 3.46Å; E99-R205 IonicContact OE2-CZ 3.39Å; E99-R205 IonicContact OE2-NH1 3.44Å; E99-R205 IonicContact OE2-NH2 2.9Å; E99-R205 PolarHBondContact OE2-NH2 3.06Å
100	V	94	Very high	85.6	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-60	-47.2	172.9	176.6	0	0	0	0	109.5	W95 S96 L97 G102 A103 L104 L120 F201 F235	W95-V100 HydrophobicContact CG-CG2 4.18Å; S96-V100 WeakPolarHBondContact O-CG2 3.42Å; S96-V100 PolarHBondContact O-N 2.92Å; S96-V100 VanDerWaalsContact O-N 3.08Å; L97-V100 PolarHBondContact O-N 3.11Å; V100-G102 PolarHBondContact O-N 3.19Å; V100-A103 PolarHBondContact O-N 2.84Å; V100-L104 HydrophobicContact CG1-CD1 4.43Å; V100-L104 WeakPolarHBondContact O-CG 3.41Å; V100-L104 PolarHBondContact O-N 2.91Å; V100-L104 VanDerWaalsContact O-N 3.07Å; V100-L120 HydrophobicContact CG1-CD2 3.98Å; V100-F201 HydrophobicContact CG2-CE1 4.24Å; V100-F201 HydrophobicContact CG2-CZ 4.09Å; V100-F235 HydrophobicContact CB-CE1 4.42Å; V100-F235 HydrophobicContact CG1-CD1 3.57Å; V100-F235 HydrophobicContact CG1-CE1 3.53Å; V100-F235 HydrophobicContact CG1-CG 4.39Å; V100-F235 HydrophobicContact CG1-CZ 4.32Å; V100-F235 HydrophobicContact CG2-CE1 3.93Å; V100-F235 HydrophobicContact CG2-CE2 4.43Å; V100-F235 HydrophobicContact CG2-CZ 3.89Å
101	E	92.1	Very high	84.4	Confident	63 Å²	63	66.5 Å²	66.5	29%	0.294	34%	0.338	S	S	.	.	H	α-helix	trans	-58.5	-47.8	174.5	-171.3	-179.1	-172.7	0	0	111.7	L97 E99 A103 L104 R105 L120	L97-E101 PolarHBondContact O-N 2.64Å; E99-E101 VanDerWaalsContact C-N 3.31Å; E101-A103 VanDerWaalsContact C-N 3.32Å; E101-A103 PolarHBondContact O-N 2.97Å; E101-L104 PolarHBondContact O-N 3.36Å; E101-R105 WeakPolarHBondContact O-CB 2.85Å; E101-R105 VanDerWaalsContact O-CG 3.29Å; E101-R105 WeakPolarHBondContact O-CG 3.32Å; E101-R105 PolarHBondContact O-N 3.11Å; E101-R105 IonicContact OE1-CZ 2.79Å; E101-R105 IonicContact OE1-NE 3.76Å; E101-R105 PolarHBondContact OE1-NE 3.44Å; E101-R105 IonicContact OE1-NH2 3.63Å; E101-R105 PolarHBondContact OE1-NH2 3.28Å; E101-L120 HydrophobicContact CB-CD1 3.95Å; E101-L120 HydrophobicContact CG-CD1 4.25Å
102	G	90.6	Very high	83.6	Confident	26 Å²	26	61.8 Å²	61.8	27%	0.268	32%	0.319	S	S	.	.	H	α-helix	trans	-60.4	-37.4	177.1	0	0	0	0	0	113.8	G98 E99 V100 R105 K106	G98-G102 PolarHBondContact O-N 3.48Å; E99-G102 PolarHBondContact O-N 2.93Å; V100-G102 PolarHBondContact O-N 3.19Å; G102-R105 PolarHBondContact O-N 2.92Å; G102-K106 PolarHBondContact O-N 2.75Å
103	A	91.2	Very high	82.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-66.7	-40.9	176.6	0	0	0	0	0	112.3	E99 V100 E101 R105 K106 V200 F201 E232	E99-A103 WeakPolarHBondContact O-CB 3.11Å; E99-A103 PolarHBondContact O-N 2.85Å; V100-A103 PolarHBondContact O-N 2.84Å; E101-A103 VanDerWaalsContact C-N 3.32Å; E101-A103 PolarHBondContact O-N 2.97Å; A103-R105 VanDerWaalsContact C-N 3.32Å; A103-K106 PolarHBondContact O-N 3.13Å; A103-V200 HydrophobicContact CB-CB 4.37Å; A103-V200 HydrophobicContact CB-CG2 4.45Å; A103-F201 HydrophobicContact CB-CE1 3.94Å; A103-F201 HydrophobicContact CB-CZ 4.31Å; A103-E232 HydrophobicContact CB-CG 3.87Å
104	L	90.1	Very high	81.5	Confident	4 Å²	4	57.7 Å²	57.7	2%	0.021	30%	0.302	C	S	.	.	H	α-helix	trans	-68.1	-34.1	176.3	-64.8	178.7	0	0	0	111.7	V100 E101 K106 L110 P115 L120 L123 F235 R236 F239	V100-L104 HydrophobicContact CG1-CD1 4.43Å; V100-L104 WeakPolarHBondContact O-CG 3.41Å; V100-L104 PolarHBondContact O-N 2.91Å; V100-L104 VanDerWaalsContact O-N 3.07Å; E101-L104 PolarHBondContact O-N 3.36Å; L104-K106 VanDerWaalsContact C-N 3.28Å; L104-K106 PolarHBondContact O-N 3.26Å; L104-L110 WeakPolarHBondContact O-CB 3.37Å; L104-P115 HydrophobicContact CD1-CG 4.24Å; L104-L120 HydrophobicContact CD1-CD2 3.74Å; L104-L123 HydrophobicContact CD1-CD2 4.22Å; L104-F235 HydrophobicContact CD2-CB 4.28Å; L104-R236 HydrophobicContact CD2-CG 4.35Å; L104-F239 HydrophobicContact CD1-CD1 4.09Å; L104-F239 HydrophobicContact CD1-CD2 4.25Å; L104-F239 HydrophobicContact CD1-CE1 4.3Å; L104-F239 HydrophobicContact CD1-CE2 4.47Å; L104-F239 HydrophobicContact CD1-CG 4.05Å; L104-F239 HydrophobicContact CD1-CZ 4.48Å; L104-F239 HydrophobicContact CD2-CB 3.69Å; L104-F239 HydrophobicContact CD2-CD1 3.9Å; L104-F239 HydrophobicContact CD2-CG 3.91Å; L104-F239 HydrophobicContact CG-CD1 4.41Å
105	R	85.5	Confident	80.8	Confident	118 Å²	118	58.4 Å²	58.4	45%	0.445	31%	0.306	S	S	.	.	H	α-helix	trans	-71	-13.6	178.1	-74.4	-175	-175.1	-141.8	5.9	114.6	E101 G102 A103 D107 M111	E101-R105 WeakPolarHBondContact O-CB 2.85Å; E101-R105 VanDerWaalsContact O-CG 3.29Å; E101-R105 WeakPolarHBondContact O-CG 3.32Å; E101-R105 PolarHBondContact O-N 3.11Å; E101-R105 IonicContact OE1-CZ 2.79Å; E101-R105 IonicContact OE1-NE 3.76Å; E101-R105 PolarHBondContact OE1-NE 3.44Å; E101-R105 IonicContact OE1-NH2 3.63Å; E101-R105 PolarHBondContact OE1-NH2 3.28Å; G102-R105 PolarHBondContact O-N 2.92Å; A103-R105 VanDerWaalsContact C-N 3.32Å; R105-D107 PolarHBondContact O-N 3.37Å; R105-M111 HydrophobicContact CB-CE 3.68Å; R105-M111 HydrophobicContact CB-SD 3.57Å; R105-M111 VanDerWaalsContact CB-SD 3.57Å; R105-M111 HydrophobicContact CG-CE 4.17Å; R105-M111 HydrophobicContact CG-SD 3.54Å; R105-M111 VanDerWaalsContact CG-SD 3.54Å; R105-M111 WeakPolarHBondContact O-CE 3.4Å
106	K	80.7	Confident	80.4	Confident	100 Å²	100	60.1 Å²	60.1	44%	0.435	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-23	177.5	-93.2	-174.4	178	163.7	0	114	G102 A103 L104 G198 V200 E232	G102-K106 PolarHBondContact O-N 2.75Å; A103-K106 PolarHBondContact O-N 3.13Å; L104-K106 VanDerWaalsContact C-N 3.28Å; L104-K106 PolarHBondContact O-N 3.26Å; K106-G198 PolarHBondContact NZ-O 3.26Å; K106-V200 HydrophobicContact CD-CG2 3.89Å; K106-V200 HydrophobicContact CG-CG2 4.29Å; K106-E232 IonicContact NZ-OE1 3.49Å; K106-E232 PolarHBondContact NZ-OE1 2.95Å
107	D	75.4	Confident	80.3	Confident	55 Å²	55	62.4 Å²	62.4	29%	0.294	33%	0.333	S	S	.	.	S	Bend	trans	-104	118	-177.2	-164.6	-26.4	0	0	0	109.4	R105 E109 L110 M111	R105-D107 PolarHBondContact O-N 3.37Å; D107-E109 PolarHBondContact O-N 3.35Å; D107-E109 PolarHBondContact OD1-N 3.06Å; D107-L110 HydrophobicContact CB-CB 4.17Å; D107-L110 HydrophobicContact CB-CD1 3.72Å; D107-L110 HydrophobicContact CB-CG 3.76Å; D107-L110 PolarHBondContact O-N 3.24Å; D107-M111 PolarHBondContact O-N 2.78Å
108	E	65.1	Low	80.2	Confident	174 Å²	174	65.4 Å²	65.4	81%	0.813	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-29.4	-177.7	-67.8	-174	173.5	0	0	112.2	L110	E108-L110 VanDerWaalsContact C-N 3.33Å; E108-L110 PolarHBondContact O-N 3.42Å
109	E	65.9	Low	80.2	Confident	122 Å²	122	63.1 Å²	63.1	57%	0.57	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-32.2	175.2	-70.6	-169.1	173.2	0	0	112.5	D107 R244	D107-E109 PolarHBondContact O-N 3.35Å; D107-E109 PolarHBondContact OD1-N 3.06Å; E109-R244 IonicContact OE2-NH2 2.86Å; E109-R244 PolarHBondContact OE2-NH2 3.45Å
110	L	66.4	Low	80.1	Confident	8 Å²	8	61.7 Å²	61.7	4%	0.042	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-19.2	-176.6	-56	-179.5	0	0	0	112.5	L104 D107 E108 L112 G113 R236 F239 L243	L104-L110 WeakPolarHBondContact O-CB 3.37Å; D107-L110 HydrophobicContact CB-CB 4.17Å; D107-L110 HydrophobicContact CB-CD1 3.72Å; D107-L110 HydrophobicContact CB-CG 3.76Å; D107-L110 PolarHBondContact O-N 3.24Å; E108-L110 VanDerWaalsContact C-N 3.33Å; E108-L110 PolarHBondContact O-N 3.42Å; L110-L112 PolarHBondContact O-N 2.86Å; L110-G113 PolarHBondContact O-N 3.4Å; L110-R236 HydrophobicContact CD1-CB 3.94Å; L110-R236 HydrophobicContact CD1-CG 3.88Å; L110-F239 HydrophobicContact CB-CD1 4.36Å; L110-F239 HydrophobicContact CB-CE1 4.47Å; L110-F239 HydrophobicContact CD2-CD1 4.17Å; L110-L243 HydrophobicContact CB-CD1 4.4Å; L110-L243 HydrophobicContact CD2-CD1 3.6Å
111	M	61.1	Low	80.1	Confident	84 Å²	84	63.7 Å²	63.7	41%	0.414	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-58.7	-27.1	177.9	-77.9	-70.6	-148	0	0	113.9	R105 D107 G113 N114	R105-M111 HydrophobicContact CB-CE 3.68Å; R105-M111 HydrophobicContact CB-SD 3.57Å; R105-M111 VanDerWaalsContact CB-SD 3.57Å; R105-M111 HydrophobicContact CG-CE 4.17Å; R105-M111 HydrophobicContact CG-SD 3.54Å; R105-M111 VanDerWaalsContact CG-SD 3.54Å; R105-M111 WeakPolarHBondContact O-CE 3.4Å; D107-M111 PolarHBondContact O-N 2.78Å; M111-G113 PolarHBondContact O-N 3.09Å; M111-N114 PolarHBondContact O-OD1 2.96Å
112	L	60.8	Low	80.2	Confident	102 Å²	102	65.1 Å²	65.1	53%	0.534	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-71	-16.6	-178.1	-72.1	163.2	0	0	0	113.2	L110 I254 P255	L110-L112 PolarHBondContact O-N 2.86Å; L112-I254 VanDerWaalsContact O-CG2 3.27Å; L112-I254 WeakPolarHBondContact O-CG2 3.4Å; L112-P255 HydrophobicContact CB-CG 4.45Å
113	G	62.9	Low	80.4	Confident	5 Å²	5	64 Å²	64	5%	0.052	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-86.6	-17	-173.9	0	0	0	0	0	117	L110 M111	L110-G113 PolarHBondContact O-N 3.4Å; M111-G113 PolarHBondContact O-N 3.09Å
114	N	71.9	Confident	80.6	Confident	117 Å²	117	64.5 Å²	64.5	63%	0.626	33%	0.326	S	S	*	.			trans	22.8	76.5	-174.7	-77	-22.8	0	0	0	114.3	M111	M111-N114 PolarHBondContact O-OD1 2.96Å
115	P	79.7	Confident	80.8	Confident	20 Å²	20	66.4 Å²	66.4	13%	0.13	34%	0.343	C	S	.	.			trans	-65.4	139.4	-173.5	27.3	-34.6	0	0	0	111.9	L104 V119 L120 F239	L104-P115 HydrophobicContact CD1-CG 4.24Å; P115-V119 HydrophobicContact CB-CB 4.41Å; P115-V119 HydrophobicContact CB-CG1 4.08Å; P115-L120 HydrophobicContact CB-CD2 4.05Å; P115-L120 HydrophobicContact CB-CG 4.07Å; P115-L120 HydrophobicContact CG-CD1 4.39Å; P115-L120 HydrophobicContact CG-CD2 3.63Å; P115-L120 HydrophobicContact CG-CG 3.97Å; P115-F239 HydrophobicContact CB-CE2 3.99Å; P115-F239 HydrophobicContact CB-CZ 3.95Å; P115-F239 HydrophobicContact CG-CE2 4.36Å; P115-F239 HydrophobicContact CG-CZ 3.98Å
116	S	86.6	Confident	81.2	Confident	46 Å²	46	61.3 Å²	61.3	32%	0.322	32%	0.324	S	S	.	.			trans	-66.2	157	172.6	78.2	0	0	0	0	111	E118 V119 L120	S116-E118 PolarHBondContact O-N 3.15Å; S116-V119 PolarHBondContact O-N 3.43Å; S116-V119 VanDerWaalsContact O-N 3.1Å; S116-V119 WeakPolarHBondContact OG-CG2 3.3Å; S116-V119 PolarHBondContact OG-N 3.07Å; S116-L120 PolarHBondContact O-N 3.07Å
117	P	89.2	Confident	81.9	Confident	99 Å²	99	56.6 Å²	56.6	64%	0.643	30%	0.303	S	S	*	.	H	α-helix	trans	-59.5	-31.2	178.5	23.3	-34.3	0	0	0	113	L120 A121	P117-L120 PolarHBondContact O-N 2.98Å; P117-A121 WeakPolarHBondContact O-CB 3.41Å; P117-A121 PolarHBondContact O-N 3.47Å
118	E	90.5	Very high	82.9	Confident	141 Å²	141	54.8 Å²	54.8	66%	0.659	30%	0.295	S	S	*	.	H	α-helix	trans	-67.5	-42.3	175.6	-65.7	176	-178.5	0	0	112	S116 A121 R122	S116-E118 PolarHBondContact O-N 3.15Å; E118-A121 PolarHBondContact O-N 3.24Å; E118-R122 WeakPolarHBondContact O-CB 3.46Å; E118-R122 PolarHBondContact O-N 2.96Å
119	V	90.4	Very high	84.3	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.012	27%	0.267	C	S	.	.	H	α-helix	trans	-63.5	-43.6	175.2	170.5	0	0	0	0	110.3	P115 S116 R122 L123 I257 M262	P115-V119 HydrophobicContact CB-CB 4.41Å; P115-V119 HydrophobicContact CB-CG1 4.08Å; S116-V119 PolarHBondContact O-N 3.43Å; S116-V119 VanDerWaalsContact O-N 3.1Å; S116-V119 WeakPolarHBondContact OG-CG2 3.3Å; S116-V119 PolarHBondContact OG-N 3.07Å; V119-R122 PolarHBondContact O-N 2.95Å; V119-L123 VanDerWaalsContact O-CB 3.3Å; V119-L123 WeakPolarHBondContact O-CB 3.38Å; V119-L123 PolarHBondContact O-N 3.28Å; V119-I257 HydrophobicContact CG1-CG2 4.11Å; V119-I257 HydrophobicContact CG2-CG2 4.4Å; V119-M262 HydrophobicContact CG1-CE 4.25Å; V119-M262 HydrophobicContact CG1-SD 3.85Å
120	L	92.8	Very high	85.8	Confident	9 Å²	9	43.3 Å²	43.3	5%	0.047	24%	0.24	C	C	.	.	H	α-helix	trans	-61.3	-44.7	175.7	-70.8	174.4	0	0	0	112.2	V100 E101 L104 P115 S116 P117 L123 S124	V100-L120 HydrophobicContact CG1-CD2 3.98Å; E101-L120 HydrophobicContact CB-CD1 3.95Å; E101-L120 HydrophobicContact CG-CD1 4.25Å; L104-L120 HydrophobicContact CD1-CD2 3.74Å; P115-L120 HydrophobicContact CB-CD2 4.05Å; P115-L120 HydrophobicContact CB-CG 4.07Å; P115-L120 HydrophobicContact CG-CD1 4.39Å; P115-L120 HydrophobicContact CG-CD2 3.63Å; P115-L120 HydrophobicContact CG-CG 3.97Å; S116-L120 PolarHBondContact O-N 3.07Å; P117-L120 PolarHBondContact O-N 2.98Å; L120-L123 PolarHBondContact O-N 3.33Å; L120-S124 VanDerWaalsContact O-CB 3.28Å; L120-S124 WeakPolarHBondContact O-CB 3.05Å; L120-S124 PolarHBondContact O-N 3.34Å
121	A	93.3	Very high	87.2	Confident	43 Å²	43	43 Å²	43	36%	0.355	24%	0.238	S	C	.	.	H	α-helix	trans	-63.1	-43.2	177.5	0	0	0	0	0	111.7	L97 P117 E118 S124 A125	L97-A121 HydrophobicContact CD1-CB 4.32Å; L97-A121 HydrophobicContact CD2-CB 4.49Å; P117-A121 WeakPolarHBondContact O-CB 3.41Å; P117-A121 PolarHBondContact O-N 3.47Å; E118-A121 PolarHBondContact O-N 3.24Å; A121-S124 WeakPolarHBondContact O-CB 3.26Å; A121-S124 PolarHBondContact O-N 3.32Å; A121-A125 PolarHBondContact O-N 3.39Å
122	R	93.9	Very high	88.9	Confident	93 Å²	93	39.4 Å²	39.4	35%	0.351	22%	0.22	S	C	.	.	H	α-helix	trans	-65.8	-44.3	176.7	-176.7	65.1	165.8	174.7	-4.7	112.1	E118 V119 S124 A125 L126 L259 M262 E263	E118-R122 WeakPolarHBondContact O-CB 3.46Å; E118-R122 PolarHBondContact O-N 2.96Å; V119-R122 PolarHBondContact O-N 2.95Å; R122-S124 VanDerWaalsContact C-N 3.33Å; R122-S124 PolarHBondContact O-N 3.02Å; R122-A125 PolarHBondContact O-N 2.88Å; R122-L126 HydrophobicContact CG-CD1 4.32Å; R122-L126 WeakPolarHBondContact O-CG 3.45Å; R122-L126 PolarHBondContact O-N 3.21Å; R122-L259 HydrophobicContact CB-CD1 3.58Å; R122-L259 HydrophobicContact CG-CD1 3.61Å; R122-M262 HydrophobicContact CB-CE 3.8Å; R122-M262 HydrophobicContact CG-CE 3.58Å; R122-E263 IonicContact CZ-OE1 3.58Å; R122-E263 IonicContact NE-OE1 2.75Å; R122-E263 PolarHBondContact NE-OE1 3.39Å; R122-E263 IonicContact NH2-OE1 3.41Å; R122-E263 PolarHBondContact NH2-OE1 3.06Å
123	L	93.9	Very high	90.5	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-60.3	-44	176.2	-177.7	64.1	0	0	0	111.2	L104 V119 L120 A125 L126 I127 F235 V238 F239 M262	L104-L123 HydrophobicContact CD1-CD2 4.22Å; V119-L123 VanDerWaalsContact O-CB 3.3Å; V119-L123 WeakPolarHBondContact O-CB 3.38Å; V119-L123 PolarHBondContact O-N 3.28Å; L120-L123 PolarHBondContact O-N 3.33Å; L123-A125 PolarHBondContact O-N 3.35Å; L123-L126 PolarHBondContact O-N 3.3Å; L123-I127 HydrophobicContact CD1-CD1 3.75Å; L123-I127 HydrophobicContact CD1-CG1 4.25Å; L123-I127 HydrophobicContact CG-CD1 3.99Å; L123-I127 WeakPolarHBondContact O-CB 3.47Å; L123-I127 WeakPolarHBondContact O-CG1 3.43Å; L123-I127 PolarHBondContact O-N 3.29Å; L123-F235 HydrophobicContact CD2-CD1 3.84Å; L123-F235 HydrophobicContact CD2-CE1 4.33Å; L123-F235 HydrophobicContact CG-CD1 3.94Å; L123-F235 HydrophobicContact CG-CE1 4.03Å; L123-V238 HydrophobicContact CD1-CB 4.37Å; L123-V238 HydrophobicContact CD1-CG1 3.68Å; L123-F239 HydrophobicContact CD2-CB 4.26Å; L123-F239 HydrophobicContact CD2-CD2 4.13Å; L123-M262 HydrophobicContact CB-SD 4.37Å
124	S	95.4	Very high	92.1	Very high	12 Å²	12	34.6 Å²	34.6	8%	0.084	19%	0.194	C	C	.	.	H	α-helix	trans	-56.6	-47.9	173.8	178.1	0	0	0	0	111.8	W95 L120 A121 R122 L126 I127 S128	W95-S124 PolarHBondContact NE1-OG 2.88Å; L120-S124 VanDerWaalsContact O-CB 3.28Å; L120-S124 WeakPolarHBondContact O-CB 3.05Å; L120-S124 PolarHBondContact O-N 3.34Å; A121-S124 WeakPolarHBondContact O-CB 3.26Å; A121-S124 PolarHBondContact O-N 3.32Å; R122-S124 VanDerWaalsContact C-N 3.33Å; R122-S124 PolarHBondContact O-N 3.02Å; S124-L126 PolarHBondContact O-N 3.41Å; S124-I127 PolarHBondContact O-N 3.33Å; S124-S128 WeakPolarHBondContact O-CB 3.38Å; S124-S128 PolarHBondContact O-N 3.33Å
125	A	94.1	Very high	93.3	Very high	44 Å²	44	29.4 Å²	29.4	36%	0.364	17%	0.167	S	C	.	.	H	α-helix	trans	-62.4	-41.1	177.8	0	0	0	0	0	112.4	A121 R122 L123 S128	A121-A125 PolarHBondContact O-N 3.39Å; R122-A125 PolarHBondContact O-N 2.88Å; L123-A125 PolarHBondContact O-N 3.35Å; A125-S128 PolarHBondContact O-OG 3.48Å
126	L	94.6	Very high	93.9	Very high	11 Å²	11	32.5 Å²	32.5	6%	0.058	18%	0.176	C	C	.	.	H	α-helix	trans	-66.2	-46.8	177.3	-68.7	173.6	0	0	0	111.7	R122 L123 S124 S128 R129 I266 L276	R122-L126 HydrophobicContact CG-CD1 4.32Å; R122-L126 WeakPolarHBondContact O-CG 3.45Å; R122-L126 PolarHBondContact O-N 3.21Å; L123-L126 PolarHBondContact O-N 3.3Å; S124-L126 PolarHBondContact O-N 3.41Å; L126-S128 VanDerWaalsContact C-N 3.29Å; L126-S128 PolarHBondContact O-N 3.07Å; L126-R129 WeakPolarHBondContact O-CB 3.49Å; L126-R129 PolarHBondContact O-N 3.18Å; L126-R129 VanDerWaalsContact O-N 3.16Å; L126-I266 HydrophobicContact CD1-CD1 3.7Å; L126-L276 HydrophobicContact CB-CB 4.49Å; L126-L276 HydrophobicContact CB-CD1 4.36Å; L126-L276 HydrophobicContact CB-CD2 4.2Å; L126-L276 HydrophobicContact CD2-CB 4.45Å; L126-L276 WeakPolarHBondContact O-CD2 3.47Å
127	I	96.3	Very high	94.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-71.2	-25.5	-178.2	-68.5	179.8	0	0	0	112	L123 S124 R129 A130 L131 M231 L234 F235 V238 L276	L123-I127 HydrophobicContact CD1-CD1 3.75Å; L123-I127 HydrophobicContact CD1-CG1 4.25Å; L123-I127 HydrophobicContact CG-CD1 3.99Å; L123-I127 WeakPolarHBondContact O-CB 3.47Å; L123-I127 WeakPolarHBondContact O-CG1 3.43Å; L123-I127 PolarHBondContact O-N 3.29Å; S124-I127 PolarHBondContact O-N 3.33Å; I127-R129 PolarHBondContact O-N 3.36Å; I127-R129 VanDerWaalsContact O-N 3.17Å; I127-A130 WeakPolarHBondContact O-CA 3.47Å; I127-A130 WeakPolarHBondContact O-CB 3.45Å; I127-A130 PolarHBondContact O-N 3.03Å; I127-L131 PolarHBondContact O-N 2.79Å; I127-M231 HydrophobicContact CG2-SD 4.39Å; I127-L234 HydrophobicContact CG2-CD2 4.13Å; I127-F235 HydrophobicContact CB-CE1 4.17Å; I127-F235 HydrophobicContact CB-CE2 4.22Å; I127-F235 HydrophobicContact CB-CZ 3.91Å; I127-F235 HydrophobicContact CD1-CB 4.18Å; I127-F235 HydrophobicContact CD1-CD1 3.41Å; I127-F235 VanDerWaalsContact CD1-CD1 3.41Å; I127-F235 HydrophobicContact CD1-CD2 4.14Å; I127-F235 HydrophobicContact CD1-CE1 3.7Å; I127-F235 HydrophobicContact CD1-CE2 4.37Å; I127-F235 HydrophobicContact CD1-CG 3.64Å; I127-F235 HydrophobicContact CD1-CZ 4.16Å; I127-F235 HydrophobicContact CG1-CE1 4.4Å; I127-F235 HydrophobicContact CG2-CD2 4.03Å; I127-F235 HydrophobicContact CG2-CE1 4.43Å; I127-F235 HydrophobicContact CG2-CE2 3.62Å; I127-F235 HydrophobicContact CG2-CZ 3.83Å; I127-V238 HydrophobicContact CD1-CB 4.26Å; I127-V238 HydrophobicContact CD1-CG2 4.29Å; I127-L276 HydrophobicContact CG1-CD2 4.41Å
128	S	95.9	Very high	94.7	Very high	18 Å²	18	25.9 Å²	25.9	13%	0.126	13%	0.131	C	C	.	.	H	α-helix	trans	-55.1	-32.8	170.4	81.5	0	0	0	0	112.4	S124 A125 L126 L131 V132	S124-S128 WeakPolarHBondContact O-CB 3.38Å; S124-S128 PolarHBondContact O-N 3.33Å; A125-S128 PolarHBondContact O-OG 3.48Å; L126-S128 VanDerWaalsContact C-N 3.29Å; L126-S128 PolarHBondContact O-N 3.07Å; S128-L131 WeakPolarHBondContact O-CB 3.5Å; S128-L131 PolarHBondContact O-N 3.27Å; S128-V132 WeakPolarHBondContact O-CG2 3.36Å; S128-V132 PolarHBondContact O-N 3.21Å
129	R	95.4	Very high	94.9	Very high	55 Å²	55	22.7 Å²	22.7	21%	0.208	12%	0.117	C	C	.	.	H	α-helix	trans	-67.3	-39.9	175.8	-60.3	170.7	178.3	171.1	0.3	111.6	L87 L126 I127 V132 R133 L276	L87-R129 HydrophobicContact CD1-CB 4.16Å; L126-R129 WeakPolarHBondContact O-CB 3.49Å; L126-R129 PolarHBondContact O-N 3.18Å; L126-R129 VanDerWaalsContact O-N 3.16Å; I127-R129 PolarHBondContact O-N 3.36Å; I127-R129 VanDerWaalsContact O-N 3.17Å; R129-V132 PolarHBondContact O-N 2.86Å; R129-R133 VanDerWaalsContact O-CG 3.32Å; R129-R133 WeakPolarHBondContact O-CG 3.49Å; R129-R133 PolarHBondContact O-N 3.44Å; R129-L276 WeakPolarHBondContact CD-O 3.42Å; R129-L276 PolarHBondContact NH1-O 3.26Å
130	A	95.9	Very high	95.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-65.1	-40.2	174.5	0	0	0	0	0	111.4	I127 V132 R133 V134 L234 L275	I127-A130 WeakPolarHBondContact O-CA 3.47Å; I127-A130 WeakPolarHBondContact O-CB 3.45Å; I127-A130 PolarHBondContact O-N 3.03Å; A130-V132 PolarHBondContact O-N 3.04Å; A130-R133 PolarHBondContact O-N 2.95Å; A130-V134 WeakPolarHBondContact O-CG2 3.4Å; A130-V134 PolarHBondContact O-N 3.49Å; A130-L234 HydrophobicContact CB-CD2 3.57Å; A130-L275 HydrophobicContact CB-CD1 4.08Å; A130-L275 HydrophobicContact CB-CD2 4.08Å; A130-L275 HydrophobicContact CB-CG 4.02Å
131	L	97.1	Very high	95	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-56.3	-50.4	172.3	173.6	67.7	0	0	0	111.2	L90 P94 W95 I127 S128 R133 V134 A135 F206 W209 L227 M231	L90-L131 HydrophobicContact CD1-CD2 3.89Å; P94-L131 HydrophobicContact CG-CD2 3.97Å; W95-L131 HydrophobicContact CH2-CB 4.09Å; W95-L131 HydrophobicContact CH2-CD2 3.74Å; W95-L131 HydrophobicContact CH2-CG 4.47Å; W95-L131 HydrophobicContact CZ3-CB 4.48Å; W95-L131 HydrophobicContact CZ3-CD2 3.68Å; W95-L131 HydrophobicContact CZ3-CG 4.49Å; I127-L131 PolarHBondContact O-N 2.79Å; S128-L131 WeakPolarHBondContact O-CB 3.5Å; S128-L131 PolarHBondContact O-N 3.27Å; L131-R133 VanDerWaalsContact C-N 3.31Å; L131-R133 PolarHBondContact O-N 3.11Å; L131-V134 PolarHBondContact O-N 3.08Å; L131-A135 VanDerWaalsContact O-CB 3.23Å; L131-A135 WeakPolarHBondContact O-CB 3.41Å; L131-A135 PolarHBondContact O-N 2.95Å; L131-F206 HydrophobicContact CD1-CE1 4.17Å; L131-W209 HydrophobicContact CD1-CH2 3.96Å; L131-W209 HydrophobicContact CD1-CZ3 3.9Å; L131-W209 HydrophobicContact CD2-CH2 3.8Å; L131-W209 HydrophobicContact CD2-CZ2 3.71Å; L131-W209 HydrophobicContact CD2-CZ3 4.24Å; L131-W209 HydrophobicContact CG-CH2 3.68Å; L131-W209 HydrophobicContact CG-CZ2 4.06Å; L131-W209 HydrophobicContact CG-CZ3 4.13Å; L131-L227 HydrophobicContact CD1-CD1 4Å; L131-L227 HydrophobicContact CD1-CD2 3.98Å; L131-L227 HydrophobicContact CD1-CG 4.09Å; L131-M231 HydrophobicContact CB-CE 4.43Å; L131-M231 HydrophobicContact CB-SD 3.94Å; L131-M231 HydrophobicContact CD1-CE 4.19Å; L131-M231 HydrophobicContact CD1-CG 4.09Å; L131-M231 HydrophobicContact CD1-SD 4.19Å
132	V	95.2	Very high	95	Very high	9 Å²	9	24.1 Å²	24.1	6%	0.055	11%	0.113	C	C	.	.	H	α-helix	trans	-58.8	-43.1	179.2	173.4	0	0	0	0	111.4	L87 P88 L90 S128 R129 A130 A135 R136	L87-V132 HydrophobicContact CD2-CG1 4.13Å; P88-V132 HydrophobicContact CG-CG1 3.9Å; L90-V132 HydrophobicContact CD1-CG2 3.54Å; L90-V132 HydrophobicContact CD2-CG2 3.86Å; L90-V132 HydrophobicContact CG-CG2 3.52Å; S128-V132 WeakPolarHBondContact O-CG2 3.36Å; S128-V132 PolarHBondContact O-N 3.21Å; R129-V132 PolarHBondContact O-N 2.86Å; A130-V132 PolarHBondContact O-N 3.04Å; V132-A135 PolarHBondContact O-N 2.75Å; V132-R136 HydrophobicContact CG1-CG 4.4Å; V132-R136 WeakPolarHBondContact O-CB 3.46Å; V132-R136 WeakPolarHBondContact O-CG 3.45Å; V132-R136 PolarHBondContact O-N 3.48Å
133	R	95.1	Very high	94.8	Very high	7 Å²	7	24 Å²	24	3%	0.026	12%	0.12	C	C	.	.	H	α-helix	trans	-62.5	-51.3	178.5	-69.7	174.1	-176.8	-67.3	0.4	111.5	L87 R129 A130 L131 A135 R136 E137 V160 L275 Q277 Y279 Q280 H281	L87-R133 HydrophobicContact CD1-CG 3.93Å; L87-R133 HydrophobicContact CD2-CG 4.35Å; R129-R133 VanDerWaalsContact O-CG 3.32Å; R129-R133 WeakPolarHBondContact O-CG 3.49Å; R129-R133 PolarHBondContact O-N 3.44Å; A130-R133 PolarHBondContact O-N 2.95Å; L131-R133 VanDerWaalsContact C-N 3.31Å; L131-R133 PolarHBondContact O-N 3.11Å; R133-A135 VanDerWaalsContact C-N 3.31Å; R133-A135 PolarHBondContact O-N 3.24Å; R133-R136 PolarHBondContact O-N 3.49Å; R133-E137 WeakPolarHBondContact O-CG 3.22Å; R133-E137 PolarHBondContact O-N 3.36Å; R133-E137 VanDerWaalsContact O-N 3.09Å; R133-V160 HydrophobicContact CB-CG1 3.57Å; R133-V160 HydrophobicContact CB-CG2 4.27Å; R133-L275 PolarHBondContact NE-O 2.87Å; R133-Q277 PolarHBondContact NH2-O 3.39Å; R133-Y279 PolarHBondContact NH1-O 3.48Å; R133-Y279 VanDerWaalsContact NH1-O 3.09Å; R133-Y279 PolarHBondContact NH2-O 2.94Å; R133-Q280 PolarHBondContact NH1-O 2.81Å; R133-Q280 VanDerWaalsContact NH1-O 3.14Å; R133-H281 PolarHBondContact NH1-O 3.44Å; R133-H281 VanDerWaalsContact NH1-O 3.09Å; R133-H281 PolarHBondContact NH2-O 3.41Å
134	V	96.9	Very high	94.4	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60.9	-42.6	178.5	175	0	0	0	0	110.6	A130 L131 E137 A138 A156 I157 V160 L227 M231	A130-V134 WeakPolarHBondContact O-CG2 3.4Å; A130-V134 PolarHBondContact O-N 3.49Å; L131-V134 PolarHBondContact O-N 3.08Å; V134-E137 PolarHBondContact O-N 3.49Å; V134-A138 VanDerWaalsContact O-CB 3.28Å; V134-A138 WeakPolarHBondContact O-CB 3.49Å; V134-A138 PolarHBondContact O-N 2.8Å; V134-A156 HydrophobicContact CG1-CB 4.05Å; V134-A156 WeakPolarHBondContact O-CB 3.41Å; V134-I157 HydrophobicContact CG1-CG1 4.16Å; V134-V160 HydrophobicContact CG2-CB 4.04Å; V134-V160 HydrophobicContact CG2-CG1 3.98Å; V134-V160 HydrophobicContact CG2-CG2 4.41Å; V134-L227 HydrophobicContact CB-CD1 4.5Å; V134-L227 HydrophobicContact CG1-CD1 3.8Å; V134-M231 HydrophobicContact CB-CE 4.28Å; V134-M231 HydrophobicContact CG2-CE 4.19Å
135	A	96.1	Very high	93.9	Very high	7 Å²	7	24.6 Å²	24.6	6%	0.058	12%	0.12	C	C	.	.	H	α-helix	trans	-65.7	-41.2	179.4	0	0	0	0	0	112.8	L131 V132 R133 A138 Q139 W209 V215	L131-A135 VanDerWaalsContact O-CB 3.23Å; L131-A135 WeakPolarHBondContact O-CB 3.41Å; L131-A135 PolarHBondContact O-N 2.95Å; V132-A135 PolarHBondContact O-N 2.75Å; R133-A135 VanDerWaalsContact C-N 3.31Å; R133-A135 PolarHBondContact O-N 3.24Å; A135-A138 PolarHBondContact O-N 2.8Å; A135-Q139 VanDerWaalsContact O-CB 3.31Å; A135-Q139 WeakPolarHBondContact O-CB 3.45Å; A135-Q139 PolarHBondContact O-N 2.93Å; A135-W209 HydrophobicContact CB-CH2 3.65Å; A135-W209 HydrophobicContact CB-CZ3 3.91Å; A135-V215 HydrophobicContact CB-CG2 4.18Å
136	R	94	Very high	93.6	Very high	85 Å²	85	22.8 Å²	22.8	32%	0.321	11%	0.105	S	C	.	.	H	α-helix	trans	-63.4	-42.4	175.7	-82.4	-177.6	155.6	-169.6	-7.1	112.2	V132 R133 Q139 R140	V132-R136 HydrophobicContact CG1-CG 4.4Å; V132-R136 WeakPolarHBondContact O-CB 3.46Å; V132-R136 WeakPolarHBondContact O-CG 3.45Å; V132-R136 PolarHBondContact O-N 3.48Å; R133-R136 PolarHBondContact O-N 3.49Å; R136-Q139 WeakPolarHBondContact O-CB 3.29Å; R136-Q139 PolarHBondContact O-N 2.95Å; R136-R140 WeakPolarHBondContact O-CG 3.34Å; R136-R140 PolarHBondContact O-N 2.8Å
137	E	95.2	Very high	93.3	Very high	7 Å²	7	22.9 Å²	22.9	3%	0.033	11%	0.105	C	C	.	.	H	α-helix	trans	-69.3	-41.6	176.6	-64.5	-48.9	136.2	0	0	111.6	R133 V134 Q139 R140 L141 A156 V159 V160 R446	R133-E137 WeakPolarHBondContact O-CG 3.22Å; R133-E137 PolarHBondContact O-N 3.36Å; R133-E137 VanDerWaalsContact O-N 3.09Å; V134-E137 PolarHBondContact O-N 3.49Å; E137-Q139 VanDerWaalsContact C-N 3.26Å; E137-Q139 PolarHBondContact O-N 3.33Å; E137-R140 PolarHBondContact O-N 3.22Å; E137-L141 WeakPolarHBondContact O-CB 3.42Å; E137-L141 VanDerWaalsContact O-CG 3.24Å; E137-L141 WeakPolarHBondContact O-CG 3.47Å; E137-L141 PolarHBondContact O-N 3.28Å; E137-A156 HydrophobicContact CB-CB 3.92Å; E137-V159 HydrophobicContact CG-CG1 4.18Å; E137-V160 HydrophobicContact CB-CG2 4.12Å; E137-V160 HydrophobicContact CG-CG2 3.54Å; E137-R446 IonicContact OE1-CZ 2.78Å; E137-R446 IonicContact OE1-NH1 2.95Å; E137-R446 PolarHBondContact OE1-NH1 2.85Å; E137-R446 IonicContact OE1-NH2 3.39Å; E137-R446 PolarHBondContact OE1-NH2 3.45Å; E137-R446 IonicContact OE2-CZ 3.95Å; E137-R446 IonicContact OE2-NH2 2.86Å; E137-R446 PolarHBondContact OE2-NH2 2.94Å
138	A	96.3	Very high	93.1	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-59.6	-38.9	173	0	0	0	0	0	111.8	V134 A135 L141 S142 I153 A156 V215	V134-A138 VanDerWaalsContact O-CB 3.28Å; V134-A138 WeakPolarHBondContact O-CB 3.49Å; V134-A138 PolarHBondContact O-N 2.8Å; A135-A138 PolarHBondContact O-N 2.8Å; A138-L141 PolarHBondContact O-N 2.95Å; A138-S142 VanDerWaalsContact O-CB 3.24Å; A138-S142 WeakPolarHBondContact O-CB 3.2Å; A138-S142 PolarHBondContact O-N 3.2Å; A138-S142 PolarHBondContact O-OG 3.33Å; A138-I153 HydrophobicContact CB-CD1 3.63Å; A138-A156 HydrophobicContact CB-CB 3.97Å; A138-V215 HydrophobicContact CB-CG1 4.19Å
139	Q	95.3	Very high	92.9	Very high	74 Å²	74	22.2 Å²	22.2	35%	0.346	10%	0.1	S	C	.	.	H	α-helix	trans	-61.2	-51.3	174.9	178.6	179.8	43.4	0	0	111.2	A135 R136 E137 L141 S142 L143 R214 V215	A135-Q139 VanDerWaalsContact O-CB 3.31Å; A135-Q139 WeakPolarHBondContact O-CB 3.45Å; A135-Q139 PolarHBondContact O-N 2.93Å; R136-Q139 WeakPolarHBondContact O-CB 3.29Å; R136-Q139 PolarHBondContact O-N 2.95Å; E137-Q139 VanDerWaalsContact C-N 3.26Å; E137-Q139 PolarHBondContact O-N 3.33Å; Q139-L141 VanDerWaalsContact C-N 3.34Å; Q139-L141 PolarHBondContact O-N 3.08Å; Q139-S142 PolarHBondContact O-N 3.35Å; Q139-S142 PolarHBondContact O-OG 3.02Å; Q139-L143 PolarHBondContact O-N 3.15Å; Q139-R214 PolarHBondContact NE2-O 3.28Å; Q139-V215 WeakPolarHBondContact CA-O 3.23Å; Q139-V215 HydrophobicContact CB-CG1 4.42Å; Q139-V215 VanDerWaalsContact CB-O 3.24Å; Q139-V215 WeakPolarHBondContact CB-O 3.12Å; Q139-V215 VanDerWaalsContact CG-O 3.28Å; Q139-V215 WeakPolarHBondContact CG-O 3.3Å
140	R	93.8	Very high	92.6	Very high	62 Å²	62	22 Å²	22	23%	0.234	10%	0.101	C	C	.	.	H	α-helix	trans	-59.2	-43.8	177.8	-68.3	-174.5	88.9	80	-4.9	112.3	R136 E137 S142 L143 C454 P456	R136-R140 WeakPolarHBondContact O-CG 3.34Å; R136-R140 PolarHBondContact O-N 2.8Å; E137-R140 PolarHBondContact O-N 3.22Å; R140-S142 VanDerWaalsContact C-N 3.33Å; R140-S142 PolarHBondContact O-N 2.61Å; R140-L143 PolarHBondContact O-N 3.06Å; R140-C454 PolarHBondContact NH2-O 3.11Å; R140-P456 HydrophobicContact CG-CG 4.48Å; R140-P456 VanDerWaalsContact NH2-CD 3.26Å
141	L	92.2	Very high	92.4	Very high	18 Å²	18	23.8 Å²	23.8	9%	0.094	11%	0.109	C	C	.	.	H	α-helix	trans	-65.6	-36.9	178.5	-66.1	171.2	0	0	0	111.9	E137 A138 Q139 L143 E152 A156	E137-L141 WeakPolarHBondContact O-CB 3.42Å; E137-L141 VanDerWaalsContact O-CG 3.24Å; E137-L141 WeakPolarHBondContact O-CG 3.47Å; E137-L141 PolarHBondContact O-N 3.28Å; A138-L141 PolarHBondContact O-N 2.95Å; Q139-L141 VanDerWaalsContact C-N 3.34Å; Q139-L141 PolarHBondContact O-N 3.08Å; L141-L143 VanDerWaalsContact C-N 3.3Å; L141-L143 PolarHBondContact O-N 2.93Å; L141-E152 HydrophobicContact CB-CB 4.26Å; L141-E152 HydrophobicContact CB-CG 4.13Å; L141-A156 HydrophobicContact CD1-CB 4.31Å
142	S	91.9	Very high	92.2	Very high	3 Å²	3	23.9 Å²	23.9	2%	0.021	11%	0.109	C	C	.	.	H	α-helix	trans	-70.2	-21.2	-178.9	75.7	0	0	0	0	114.4	A138 Q139 R140 R144 Y145 A146 K147 V215 A216	A138-S142 VanDerWaalsContact O-CB 3.24Å; A138-S142 WeakPolarHBondContact O-CB 3.2Å; A138-S142 PolarHBondContact O-N 3.2Å; A138-S142 PolarHBondContact O-OG 3.33Å; Q139-S142 PolarHBondContact O-N 3.35Å; Q139-S142 PolarHBondContact O-OG 3.02Å; R140-S142 VanDerWaalsContact C-N 3.33Å; R140-S142 PolarHBondContact O-N 2.61Å; S142-R144 PolarHBondContact O-N 3.38Å; S142-Y145 PolarHBondContact O-N 3.46Å; S142-A146 VanDerWaalsContact O-CA 3.24Å; S142-A146 WeakPolarHBondContact O-CA 3.33Å; S142-A146 PolarHBondContact O-N 3.45Å; S142-K147 WeakPolarHBondContact CB-O 3.42Å; S142-K147 PolarHBondContact O-N 3.06Å; S142-V215 PolarHBondContact OG-O 3.49Å; S142-A216 WeakPolarHBondContact OG-CB 3.34Å
143	L	89.6	Confident	92.3	Very high	92 Å²	92	23.4 Å²	23.4	48%	0.482	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-31.1	-178.3	-73.7	171.4	0	0	0	112.6	Q139 R140 L141 Y145 A146 P456	Q139-L143 PolarHBondContact O-N 3.15Å; R140-L143 PolarHBondContact O-N 3.06Å; L141-L143 VanDerWaalsContact C-N 3.3Å; L141-L143 PolarHBondContact O-N 2.93Å; L143-Y145 VanDerWaalsContact C-N 3.32Å; L143-Y145 PolarHBondContact O-N 3.47Å; L143-A146 PolarHBondContact O-N 3.35Å; L143-P456 HydrophobicContact CD1-CB 3.71Å; L143-P456 HydrophobicContact CD1-CG 3.49Å; L143-P456 VanDerWaalsContact CD1-CG 3.49Å
144	R	85.5	Confident	92.3	Very high	15 Å²	15	23.9 Å²	23.9	6%	0.057	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-47.2	-179.5	-168	177.2	-177.3	153.2	15.5	111.5	S142 I459 D463 H572	S142-R144 PolarHBondContact O-N 3.38Å; R144-I459 HydrophobicContact CB-CG1 4.49Å; R144-I459 HydrophobicContact CG-CD1 4.03Å; R144-I459 HydrophobicContact CG-CG1 3.32Å; R144-I459 WeakPolarHBondContact O-CD1 3.46Å; R144-I459 WeakPolarHBondContact O-CG1 3.38Å; R144-D463 IonicContact CZ-OD2 3.45Å; R144-D463 IonicContact NH1-OD2 3.42Å; R144-D463 IonicContact NH2-OD2 3.88Å; R144-D463 PolarHBondContact NH2-OD2 3.19Å; R144-H572 PolarHBondContact O-CE1 2.62Å
145	Y	84.9	Confident	92.1	Very high	9 Å²	9	24.5 Å²	24.5	4%	0.035	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.7	12.3	-178.1	-57.6	-65.8	0	0	0	113.2	S142 L143 K147 R218 I459 Y557 T560 L571	S142-Y145 PolarHBondContact O-N 3.46Å; L143-Y145 VanDerWaalsContact C-N 3.32Å; L143-Y145 PolarHBondContact O-N 3.47Å; Y145-K147 PolarHBondContact O-N 2.96Å; Y145-R218 PolarHBondContact O-NH2 3.26Å; Y145-I459 HydrophobicContact CD1-CD1 3.66Å; Y145-I459 HydrophobicContact CE1-CD1 3.52Å; Y145-I459 HydrophobicContact CE1-CG1 4.26Å; Y145-Y557 AromaticContact CD2-CD1 3.78Å; Y145-Y557 HydrophobicContact CD2-CD1 3.78Å; Y145-Y557 AromaticContact CD2-CE1 3.7Å; Y145-Y557 HydrophobicContact CD2-CE1 3.7Å; Y145-Y557 AromaticContact CE2-CD1 3.35Å; Y145-Y557 HydrophobicContact CE2-CD1 3.35Å; Y145-Y557 HydrophobicContact CE2-CD2 4.15Å; Y145-Y557 AromaticContact CE2-CE1 3.57Å; Y145-Y557 HydrophobicContact CE2-CE1 3.57Å; Y145-Y557 HydrophobicContact CE2-CE2 4.34Å; Y145-Y557 AromaticContact CE2-CG 3.67Å; Y145-Y557 HydrophobicContact CE2-CG 3.67Å; Y145-Y557 AromaticContact CZ-CD1 3.88Å; Y145-Y557 AromaticContact CZ-CG 3.92Å; Y145-T560 HydrophobicContact CD1-CG2 3.69Å; Y145-T560 HydrophobicContact CE1-CG2 3.23Å; Y145-L571 WeakPolarHBondContact O-CD1 3.27Å; Y145-L571 WeakPolarHBondContact O-CG 3.23Å
146	A	87.9	Confident	92.2	Very high	6 Å²	6	24.2 Å²	24.2	5%	0.05	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.8	30.1	-174.3	0	0	0	0	0	114.2	S142 L143 L217 R218 L571	S142-A146 VanDerWaalsContact O-CA 3.24Å; S142-A146 WeakPolarHBondContact O-CA 3.33Å; S142-A146 PolarHBondContact O-N 3.45Å; L143-A146 PolarHBondContact O-N 3.35Å; A146-L217 HydrophobicContact CB-CB 4.49Å; A146-L217 HydrophobicContact CB-CD1 3.88Å; A146-R218 VanDerWaalsContact CB-NH2 3.26Å; A146-R218 PolarHBondContact O-N 3.37Å; A146-R218 PolarHBondContact O-NH2 3.3Å; A146-L571 WeakPolarHBondContact CB-O 3.22Å
147	K	89.2	Confident	92.3	Very high	13 Å²	13	20.1 Å²	20.1	6%	0.057	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	131.8	-175.5	-172.6	179.1	-175.5	176.6	0	109.8	S142 Y145 T149 R218 E559 E601	S142-K147 WeakPolarHBondContact CB-O 3.42Å; S142-K147 PolarHBondContact O-N 3.06Å; Y145-K147 PolarHBondContact O-N 2.96Å; K147-T149 HydrophobicContact CD-CG2 4Å; K147-T149 HydrophobicContact CG-CG2 3.97Å; K147-R218 CarbonylContact C-O 3.53Å; K147-R218 WeakPolarHBondContact CA-O 3.43Å; K147-R218 HydrophobicContact CB-CB 4.47Å; K147-R218 HydrophobicContact CG-CB 4.3Å; K147-E559 WeakPolarHBondContact CE-OE2 3.44Å; K147-E559 IonicContact NZ-OE2 3.62Å; K147-E559 PolarHBondContact NZ-OE2 3.5Å; K147-E601 IonicContact NZ-OE1 3.65Å; K147-E601 PolarHBondContact NZ-OE1 3.1Å; K147-E601 IonicContact NZ-OE2 3.85Å; K147-E601 PolarHBondContact NZ-OE2 2.86Å
148	C	92.8	Very high	92.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	114.5	171.5	-171.6	0	0	0	0	109.5	A216 R218 I219 H220 A223	C148-A216 HydrophobicContact CB-CB 3.57Å; C148-R218 PolarHBondContact N-O 3.09Å; C148-I219 HydrophobicContact CB-CG1 4.39Å; C148-H220 PolarHBondContact O-N 3.04Å; C148-A223 WeakPolarHBondContact O-CB 3.29Å
149	T	90.2	Very high	92.2	Very high	4 Å²	4	22.1 Å²	22.1	3%	0.025	10%	0.104	C	C	.	.			trans	-111.4	-177.6	174.8	80.7	0	0	0	0	110.5	K147 H151 E152 I153 H220 E559	K147-T149 HydrophobicContact CD-CG2 4Å; K147-T149 HydrophobicContact CG-CG2 3.97Å; T149-H151 PolarHBondContact O-N 3.24Å; T149-H151 PolarHBondContact OG1-N 2.91Å; T149-H151 VanDerWaalsContact OG1-N 3.09Å; T149-E152 VanDerWaalsContact CA-OE2 3.29Å; T149-E152 WeakPolarHBondContact CA-OE2 3.46Å; T149-E152 VanDerWaalsContact CB-OE2 3.25Å; T149-E152 WeakPolarHBondContact CB-OE2 3.37Å; T149-E152 PolarHBondContact N-OE2 3.47Å; T149-E152 PolarHBondContact O-N 2.84Å; T149-E152 PolarHBondContact OG1-OE2 2.9Å; T149-I153 PolarHBondContact O-N 3.3Å; T149-H220 HydrophobicContact CG2-CB 4.39Å; T149-E559 HydrophobicContact CG2-CG 4.17Å
150	K	90.5	Very high	92.2	Very high	52 Å²	52	18.7 Å²	18.7	23%	0.226	9%	0.088	C	C	.	.	H	α-helix	trans	-57.2	-27.2	171.6	67	-179.6	-177.4	-178	0	112.8	Q154 L177 H222 Y226	K150-Q154 WeakPolarHBondContact O-CB 3.39Å; K150-Q154 PolarHBondContact O-N 3.44Å; K150-L177 HydrophobicContact CD-CD2 3.89Å; K150-H222 HydrophobicContact CB-CB 4.04Å; K150-H222 HydrophobicContact CD-CB 4.46Å; K150-Y226 HydrophobicContact CB-CD1 4.09Å; K150-Y226 HydrophobicContact CB-CD2 3.83Å; K150-Y226 HydrophobicContact CB-CE1 4.05Å; K150-Y226 HydrophobicContact CB-CE2 3.82Å; K150-Y226 HydrophobicContact CB-CG 3.96Å; K150-Y226 HydrophobicContact CD-CE2 4.17Å
151	H	90	Very high	92.1	Very high	37 Å²	37	15.8 Å²	15.8	17%	0.171	8%	0.077	C	C	.	.	H	α-helix	trans	-72.4	-43.9	-177	-65.2	-60.2	0	0	0	112	T149 Q154 S155	T149-H151 PolarHBondContact O-N 3.24Å; T149-H151 PolarHBondContact OG1-N 2.91Å; T149-H151 VanDerWaalsContact OG1-N 3.09Å; H151-Q154 PolarHBondContact O-N 3.22Å; H151-S155 WeakPolarHBondContact O-CB 3.32Å; H151-S155 PolarHBondContact O-N 3.27Å; H151-S155 PolarHBondContact O-OG 3.5Å
152	E	93.8	Very high	92	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.005	8%	0.076	C	C	.	.	H	α-helix	trans	-63.4	-43	175.8	-69	65.7	-138.8	0	0	110.7	L141 T149 S155 A156 H430 Y557	L141-E152 HydrophobicContact CB-CB 4.26Å; L141-E152 HydrophobicContact CB-CG 4.13Å; T149-E152 VanDerWaalsContact CA-OE2 3.29Å; T149-E152 WeakPolarHBondContact CA-OE2 3.46Å; T149-E152 VanDerWaalsContact CB-OE2 3.25Å; T149-E152 WeakPolarHBondContact CB-OE2 3.37Å; T149-E152 PolarHBondContact N-OE2 3.47Å; T149-E152 PolarHBondContact O-N 2.84Å; T149-E152 PolarHBondContact OG1-OE2 2.9Å; E152-S155 PolarHBondContact O-N 3.19Å; E152-A156 VanDerWaalsContact O-CB 3.3Å; E152-A156 WeakPolarHBondContact O-CB 3.44Å; E152-A156 PolarHBondContact O-N 2.91Å; E152-H430 IonicContact OE1-CE1 3.14Å; E152-Y557 PolarHBondContact OE1-OH 3.27Å
153	I	96.8	Very high	91.7	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-65.2	-44.9	176.2	-60.1	-68.3	0	0	0	111.3	A138 T149 S155 A156 I157 M210 A223 L227	A138-I153 HydrophobicContact CB-CD1 3.63Å; T149-I153 PolarHBondContact O-N 3.3Å; I153-S155 VanDerWaalsContact C-N 3.35Å; I153-S155 PolarHBondContact O-N 3.23Å; I153-A156 PolarHBondContact O-N 3.19Å; I153-I157 HydrophobicContact CG2-CD1 3.84Å; I153-I157 HydrophobicContact CG2-CG1 4.37Å; I153-I157 VanDerWaalsContact O-CG1 3.23Å; I153-I157 WeakPolarHBondContact O-CG1 3.45Å; I153-I157 PolarHBondContact O-N 3.23Å; I153-M210 HydrophobicContact CD1-CE 3.93Å; I153-A223 HydrophobicContact CG1-CB 3.89Å; I153-L227 HydrophobicContact CD1-CB 4.38Å; I153-L227 HydrophobicContact CG2-CB 4.27Å
154	Q	94.9	Very high	91.4	Very high	17 Å²	17	13.6 Å²	13.6	8%	0.079	6%	0.064	C	C	.	.	H	α-helix	trans	-60.3	-43.7	177.8	-179.7	177.8	-23.5	0	0	112	K150 H151 I157 K158 I170 Y226	K150-Q154 WeakPolarHBondContact O-CB 3.39Å; K150-Q154 PolarHBondContact O-N 3.44Å; H151-Q154 PolarHBondContact O-N 3.22Å; Q154-I157 PolarHBondContact O-N 2.88Å; Q154-K158 PolarHBondContact O-N 3.17Å; Q154-K158 VanDerWaalsContact O-N 3.08Å; Q154-I170 HydrophobicContact CG-CD1 3.89Å; Q154-I170 HydrophobicContact CG-CG1 4.11Å; Q154-I170 HydrophobicContact CG-CG2 4.25Å; Q154-Y226 HydrophobicContact CB-CD1 4.29Å; Q154-Y226 HydrophobicContact CB-CE1 4.12Å
155	S	94.2	Very high	91.7	Very high	13 Å²	13	12.9 Å²	12.9	9%	0.091	6%	0.062	C	C	.	.	H	α-helix	trans	-66.2	-42.2	175.7	-70.1	0	0	0	0	111.6	H151 E152 I153 I157 K158 V159 H430	H151-S155 WeakPolarHBondContact O-CB 3.32Å; H151-S155 PolarHBondContact O-N 3.27Å; H151-S155 PolarHBondContact O-OG 3.5Å; E152-S155 PolarHBondContact O-N 3.19Å; I153-S155 VanDerWaalsContact C-N 3.35Å; I153-S155 PolarHBondContact O-N 3.23Å; S155-I157 VanDerWaalsContact C-N 3.31Å; S155-I157 PolarHBondContact O-N 3.33Å; S155-K158 PolarHBondContact O-N 3.22Å; S155-K158 VanDerWaalsContact O-N 3.17Å; S155-V159 WeakPolarHBondContact O-CB 3.44Å; S155-V159 VanDerWaalsContact O-CG2 3.26Å; S155-V159 WeakPolarHBondContact O-CG2 3.06Å; S155-V159 PolarHBondContact O-N 2.81Å; S155-H430 WeakPolarHBondContact CB-ND1 3.41Å; S155-H430 WeakPolarHBondContact OG-CB 3.46Å; S155-H430 PolarHBondContact OG-ND1 3.44Å
156	A	97.2	Very high	92	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-59.4	-40.6	174.1	0	0	0	0	0	112.2	V134 E137 A138 L141 E152 I153 V159 V160	V134-A156 HydrophobicContact CG1-CB 4.05Å; V134-A156 WeakPolarHBondContact O-CB 3.41Å; E137-A156 HydrophobicContact CB-CB 3.92Å; A138-A156 HydrophobicContact CB-CB 3.97Å; L141-A156 HydrophobicContact CD1-CB 4.31Å; E152-A156 VanDerWaalsContact O-CB 3.3Å; E152-A156 WeakPolarHBondContact O-CB 3.44Å; E152-A156 PolarHBondContact O-N 2.91Å; I153-A156 PolarHBondContact O-N 3.19Å; A156-V159 PolarHBondContact O-N 2.86Å; A156-V160 WeakPolarHBondContact O-CB 3.38Å; A156-V160 WeakPolarHBondContact O-CG2 3.22Å; A156-V160 PolarHBondContact O-N 3.38Å
157	I	96.6	Very high	92	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-60.8	-46.2	174.3	-70.1	165	0	0	0	111	V134 I153 Q154 S155 V159 L161 C169 I170 C230	V134-I157 HydrophobicContact CG1-CG1 4.16Å; I153-I157 HydrophobicContact CG2-CD1 3.84Å; I153-I157 HydrophobicContact CG2-CG1 4.37Å; I153-I157 VanDerWaalsContact O-CG1 3.23Å; I153-I157 WeakPolarHBondContact O-CG1 3.45Å; I153-I157 PolarHBondContact O-N 3.23Å; Q154-I157 PolarHBondContact O-N 2.88Å; S155-I157 VanDerWaalsContact C-N 3.31Å; S155-I157 PolarHBondContact O-N 3.33Å; I157-V159 VanDerWaalsContact C-N 3.31Å; I157-V159 PolarHBondContact O-N 3Å; I157-L161 HydrophobicContact CG2-CD1 3.76Å; I157-L161 HydrophobicContact CG2-CG 4.28Å; I157-L161 WeakPolarHBondContact O-CB 3.42Å; I157-L161 PolarHBondContact O-N 3.05Å; I157-C169 HydrophobicContact CG2-CB 4.22Å; I157-I170 HydrophobicContact CB-CG1 4.38Å; I157-I170 HydrophobicContact CG2-CD1 4.07Å; I157-I170 HydrophobicContact CG2-CG1 3.84Å; I157-C230 HydrophobicContact CD1-CB 3.67Å; I157-C230 VanDerWaalsContact CD1-SG 3.58Å; I157-C230 HydrophobicContact CG1-CB 4.37Å
158	K	93.8	Very high	92.1	Very high	49 Å²	49	16.4 Å²	16.4	21%	0.213	8%	0.083	C	C	.	.	H	α-helix	trans	-64.4	-34	177	-73.3	-177.9	169.5	-175.8	0	113.2	Q154 S155 I170 R422 A426 E429	Q154-K158 PolarHBondContact O-N 3.17Å; Q154-K158 VanDerWaalsContact O-N 3.08Å; S155-K158 PolarHBondContact O-N 3.22Å; S155-K158 VanDerWaalsContact O-N 3.17Å; K158-I170 HydrophobicContact CD-CD1 4.44Å; K158-I170 HydrophobicContact CG-CD1 3.67Å; K158-R422 PolarHBondContact O-NH1 3Å; K158-A426 HydrophobicContact CB-CB 3.91Å; K158-E429 IonicContact NZ-OE2 2.74Å; K158-E429 PolarHBondContact NZ-OE2 3.49Å
159	V	94.3	Very high	92.2	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-75.6	-40.5	-179.7	164.1	0	0	0	0	111.2	E137 S155 A156 I157 R422 V423 A426 L447	E137-V159 HydrophobicContact CG-CG1 4.18Å; S155-V159 WeakPolarHBondContact O-CB 3.44Å; S155-V159 VanDerWaalsContact O-CG2 3.26Å; S155-V159 WeakPolarHBondContact O-CG2 3.06Å; S155-V159 PolarHBondContact O-N 2.81Å; A156-V159 PolarHBondContact O-N 2.86Å; I157-V159 VanDerWaalsContact C-N 3.31Å; I157-V159 PolarHBondContact O-N 3Å; V159-R422 VanDerWaalsContact C-NH1 3.27Å; V159-R422 PolarHBondContact O-NH1 3.28Å; V159-R422 PolarHBondContact O-NH2 3.31Å; V159-V423 HydrophobicContact CG1-CG1 4.08Å; V159-A426 HydrophobicContact CG2-CB 3.67Å; V159-L447 HydrophobicContact CG1-CD2 3.32Å; V159-L447 WeakPolarHBondContact O-CD2 3.5Å
160	V	95.5	Very high	92.3	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.012	9%	0.085	C	C	.	.	H	α-helix	trans	-91.6	-39.9	-173.2	175.5	0	0	0	0	113.5	R133 V134 E137 A156 L275 L282	R133-V160 HydrophobicContact CB-CG1 3.57Å; R133-V160 HydrophobicContact CB-CG2 4.27Å; V134-V160 HydrophobicContact CG2-CB 4.04Å; V134-V160 HydrophobicContact CG2-CG1 3.98Å; V134-V160 HydrophobicContact CG2-CG2 4.41Å; E137-V160 HydrophobicContact CB-CG2 4.12Å; E137-V160 HydrophobicContact CG-CG2 3.54Å; A156-V160 WeakPolarHBondContact O-CB 3.38Å; A156-V160 WeakPolarHBondContact O-CG2 3.22Å; A156-V160 PolarHBondContact O-N 3.38Å; V160-L275 HydrophobicContact CG1-CD1 3.63Å; V160-L282 WeakPolarHBondContact O-CD2 3.46Å
161	L	93.4	Very high	92.4	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	-91	153.9	-174.5	-52.2	-174.1	0	0	0	111.4	I157 I165 C169 L275 R422	I157-L161 HydrophobicContact CG2-CD1 3.76Å; I157-L161 HydrophobicContact CG2-CG 4.28Å; I157-L161 WeakPolarHBondContact O-CB 3.42Å; I157-L161 PolarHBondContact O-N 3.05Å; L161-I165 HydrophobicContact CB-CB 4.38Å; L161-I165 HydrophobicContact CB-CG2 4.24Å; L161-I165 HydrophobicContact CD1-CG2 3.87Å; L161-C169 HydrophobicContact CD1-CB 4.27Å; L161-L275 HydrophobicContact CD2-CD1 3.85Å; L161-L275 HydrophobicContact CD2-CD2 3.53Å; L161-L275 HydrophobicContact CD2-CG 4.36Å; L161-R422 PolarHBondContact O-NH1 2.59Å
162	S	89.4	Confident	92.6	Very high	11 Å²	11	17.1 Å²	17.1	8%	0.077	10%	0.095	C	C	.	.			trans	-59.3	162.4	171.8	80	0	0	0	0	111	T164 I165 S166 E271	S162-T164 PolarHBondContact O-N 3.34Å; S162-I165 PolarHBondContact O-N 2.93Å; S162-I165 WeakPolarHBondContact OG-CD1 3.26Å; S162-I165 WeakPolarHBondContact OG-CG1 3.38Å; S162-S166 VanDerWaalsContact O-CB 3.25Å; S162-S166 WeakPolarHBondContact O-CB 3.46Å; S162-S166 PolarHBondContact O-N 3.3Å; S162-S166 PolarHBondContact O-OG 3.41Å; S162-E271 WeakPolarHBondContact CB-OE1 3.36Å; S162-E271 PolarHBondContact OG-OE1 3.45Å
163	W	84.4	Confident	92.7	Very high	37 Å²	37	17 Å²	17	14%	0.14	10%	0.095	C	C	.	.	H	α-helix	trans	-50.8	-54.6	-178.7	-167.9	-78.3	0	0	0	112.7	I165 S166 V167 L353 H354 R422	W163-I165 PolarHBondContact O-N 3.19Å; W163-S166 PolarHBondContact O-N 2.92Å; W163-S166 PolarHBondContact O-OG 3.19Å; W163-V167 WeakPolarHBondContact O-CG2 3.42Å; W163-V167 PolarHBondContact O-N 3.17Å; W163-L353 HydrophobicContact CZ2-CB 4.19Å; W163-H354 AromaticContact CH2-CD2 3.84Å; W163-H354 AromaticContact CH2-CE1 3.29Å; W163-H354 WeakPolarHBondContact CH2-CE1 3.36Å; W163-H354 AromaticContact CH2-CG 3.95Å; W163-H354 AromaticContact CH2-ND1 3.59Å; W163-H354 AromaticContact CH2-NE2 3.41Å; W163-H354 WeakPolarHBondContact CH2-NE2 3.34Å; W163-H354 AromaticContact CZ3-CE1 3.84Å; W163-H354 AromaticContact CZ3-NE2 3.89Å; W163-R422 HydrophobicContact CE3-CG 4.33Å
164	T	85.1	Confident	92.4	Very high	19 Å²	19	19.9 Å²	19.9	12%	0.117	11%	0.11	C	C	.	.	H	α-helix	trans	-61.6	-48.4	-176.7	-41.4	0	0	0	0	111.6	S162 V167 N168 E271 S297	S162-T164 PolarHBondContact O-N 3.34Å; T164-V167 PolarHBondContact O-N 2.95Å; T164-N168 PolarHBondContact O-N 2.81Å; T164-E271 WeakPolarHBondContact CB-OE1 3.41Å; T164-E271 PolarHBondContact OG1-OE1 3.09Å; T164-S297 PolarHBondContact OG1-OG 3.44Å
165	I	90.7	Very high	92.3	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-67.9	-40.9	-175.9	-59.2	175.7	0	0	0	110.4	L161 S162 W163 V167 N168 C169 L234 E237 E271 I272	L161-I165 HydrophobicContact CB-CB 4.38Å; L161-I165 HydrophobicContact CB-CG2 4.24Å; L161-I165 HydrophobicContact CD1-CG2 3.87Å; S162-I165 PolarHBondContact O-N 2.93Å; S162-I165 WeakPolarHBondContact OG-CD1 3.26Å; S162-I165 WeakPolarHBondContact OG-CG1 3.38Å; W163-I165 PolarHBondContact O-N 3.19Å; I165-V167 PolarHBondContact O-N 2.91Å; I165-N168 PolarHBondContact O-N 3.39Å; I165-C169 WeakPolarHBondContact O-CB 3.27Å; I165-C169 PolarHBondContact O-N 2.78Å; I165-C169 PolarHBondContact O-SG 3Å; I165-L234 HydrophobicContact CG2-CD1 3.67Å; I165-E237 HydrophobicContact CG1-CG 4.05Å; I165-E237 HydrophobicContact CG2-CG 4.38Å; I165-E271 HydrophobicContact CD1-CB 4.14Å; I165-I272 HydrophobicContact CD1-CG2 3.5Å
166	S	91.8	Very high	92.3	Very high	8 Å²	8	21.7 Å²	21.7	6%	0.056	12%	0.124	C	C	.	.	H	α-helix	trans	-60.5	-44	178.7	73.9	0	0	0	0	111.9	S162 W163 C169 I170	S162-S166 VanDerWaalsContact O-CB 3.25Å; S162-S166 WeakPolarHBondContact O-CB 3.46Å; S162-S166 PolarHBondContact O-N 3.3Å; S162-S166 PolarHBondContact O-OG 3.41Å; W163-S166 PolarHBondContact O-N 2.92Å; W163-S166 PolarHBondContact O-OG 3.19Å; S166-C169 PolarHBondContact O-N 3.31Å; S166-I170 WeakPolarHBondContact O-CB 3.45Å; S166-I170 WeakPolarHBondContact O-CD1 3.36Å; S166-I170 WeakPolarHBondContact O-CG1 3.43Å; S166-I170 PolarHBondContact O-N 3.45Å
167	V	88.2	Confident	92	Very high	32 Å²	32	22 Å²	22	19%	0.194	13%	0.126	C	C	.	.	H	α-helix	trans	-64.3	-45.3	178.9	173.5	0	0	0	0	111	W163 T164 I165 I170 T171	W163-V167 WeakPolarHBondContact O-CG2 3.42Å; W163-V167 PolarHBondContact O-N 3.17Å; T164-V167 PolarHBondContact O-N 2.95Å; I165-V167 PolarHBondContact O-N 2.91Å; V167-I170 PolarHBondContact O-N 2.98Å; V167-T171 WeakPolarHBondContact O-CB 3.26Å; V167-T171 PolarHBondContact O-N 3.3Å; V167-T171 PolarHBondContact O-OG1 3.45Å
168	N	90.4	Very high	91.6	Very high	63 Å²	63	24.8 Å²	24.8	34%	0.337	15%	0.145	S	C	.	.	H	α-helix	trans	-61.2	-46.5	177.4	-69.7	-5	0	0	0	111.2	T164 I165 T171 A172 E237	T164-N168 PolarHBondContact O-N 2.81Å; I165-N168 PolarHBondContact O-N 3.39Å; N168-T171 PolarHBondContact O-N 3.34Å; N168-A172 PolarHBondContact O-N 2.96Å; N168-E237 PolarHBondContact ND2-OE2 3.45Å
169	C	94.4	Very high	91.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64.6	-42.7	179.2	-68.1	0	0	0	0	112.7	I157 L161 I165 S166 T171 A172 A173 C230	I157-C169 HydrophobicContact CG2-CB 4.22Å; L161-C169 HydrophobicContact CD1-CB 4.27Å; I165-C169 WeakPolarHBondContact O-CB 3.27Å; I165-C169 PolarHBondContact O-N 2.78Å; I165-C169 PolarHBondContact O-SG 3Å; S166-C169 PolarHBondContact O-N 3.31Å; C169-T171 VanDerWaalsContact C-N 3.35Å; C169-A172 PolarHBondContact O-N 3.46Å; C169-A173 WeakPolarHBondContact O-CB 3.22Å; C169-A173 PolarHBondContact O-N 3.45Å; C169-C230 HydrophobicContact CB-CB 4.34Å
170	I	93.6	Very high	91	Very high	12 Å²	12	27.3 Å²	27.3	6%	0.062	16%	0.16	C	C	.	.	H	α-helix	trans	-66.6	-39	177.4	-68.9	165.3	0	0	0	110.8	Q154 I157 K158 S166 V167 A173 L174	Q154-I170 HydrophobicContact CG-CD1 3.89Å; Q154-I170 HydrophobicContact CG-CG1 4.11Å; Q154-I170 HydrophobicContact CG-CG2 4.25Å; I157-I170 HydrophobicContact CB-CG1 4.38Å; I157-I170 HydrophobicContact CG2-CD1 4.07Å; I157-I170 HydrophobicContact CG2-CG1 3.84Å; K158-I170 HydrophobicContact CD-CD1 4.44Å; K158-I170 HydrophobicContact CG-CD1 3.67Å; S166-I170 WeakPolarHBondContact O-CB 3.45Å; S166-I170 WeakPolarHBondContact O-CD1 3.36Å; S166-I170 WeakPolarHBondContact O-CG1 3.43Å; S166-I170 PolarHBondContact O-N 3.45Å; V167-I170 PolarHBondContact O-N 2.98Å; I170-A173 PolarHBondContact O-N 2.99Å; I170-L174 HydrophobicContact CG2-CD1 3.93Å; I170-L174 HydrophobicContact CG2-CG 4.4Å; I170-L174 WeakPolarHBondContact O-CB 3.34Å; I170-L174 WeakPolarHBondContact O-CG 3.24Å; I170-L174 PolarHBondContact O-N 2.97Å
171	T	92.3	Very high	90.4	Very high	78 Å²	78	29.1 Å²	29.1	48%	0.479	17%	0.17	S	C	.	.	H	α-helix	trans	-64.5	-42.6	177.2	-56.3	0	0	0	0	111.2	V167 N168 C169 L174 S175	V167-T171 WeakPolarHBondContact O-CB 3.26Å; V167-T171 PolarHBondContact O-N 3.3Å; V167-T171 PolarHBondContact O-OG1 3.45Å; N168-T171 PolarHBondContact O-N 3.34Å; C169-T171 VanDerWaalsContact C-N 3.35Å; T171-L174 PolarHBondContact O-N 3.27Å; T171-S175 PolarHBondContact O-N 3.05Å; T171-S175 PolarHBondContact O-OG 3.41Å
172	A	93.7	Very high	89.8	Confident	17 Å²	17	35.2 Å²	35.2	14%	0.14	20%	0.2	C	C	.	.	H	α-helix	trans	-64.3	-38.7	173.8	0	0	0	0	0	112.6	N168 C169 S175 A176	N168-A172 PolarHBondContact O-N 2.96Å; C169-A172 PolarHBondContact O-N 3.46Å; A172-S175 PolarHBondContact O-N 3.3Å; A172-S175 PolarHBondContact O-OG 3.37Å; A172-A176 WeakPolarHBondContact O-CB 3.36Å; A172-A176 PolarHBondContact O-N 3.03Å
173	A	95.4	Very high	88.9	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.5	-40.7	174.6	0	0	0	0	0	112.7	C169 I170 A176 L177 Y226 A229	C169-A173 WeakPolarHBondContact O-CB 3.22Å; C169-A173 PolarHBondContact O-N 3.45Å; I170-A173 PolarHBondContact O-N 2.99Å; A173-A176 PolarHBondContact O-N 3.04Å; A173-L177 WeakPolarHBondContact O-CB 3.46Å; A173-L177 PolarHBondContact O-N 2.92Å; A173-Y226 HydrophobicContact CB-CD1 3.81Å; A173-Y226 HydrophobicContact CB-CD2 4.03Å; A173-Y226 HydrophobicContact CB-CE1 4.13Å; A173-Y226 HydrophobicContact CB-CE2 4.3Å; A173-Y226 HydrophobicContact CB-CG 3.78Å; A173-A229 HydrophobicContact CB-CB 4.11Å
174	L	92.1	Very high	87.6	Confident	59 Å²	59	37.4 Å²	37.4	31%	0.309	22%	0.221	S	C	.	.	H	α-helix	trans	-64.8	-41.5	175.9	-78.2	167	0	0	0	112	I170 T171 L177 S178 Y226	I170-L174 HydrophobicContact CG2-CD1 3.93Å; I170-L174 HydrophobicContact CG2-CG 4.4Å; I170-L174 WeakPolarHBondContact O-CB 3.34Å; I170-L174 WeakPolarHBondContact O-CG 3.24Å; I170-L174 PolarHBondContact O-N 2.97Å; T171-L174 PolarHBondContact O-N 3.27Å; L174-L177 PolarHBondContact O-N 2.89Å; L174-S178 WeakPolarHBondContact O-CB 3.46Å; L174-S178 PolarHBondContact O-N 3.38Å; L174-Y226 WeakPolarHBondContact CD2-OH 3.44Å
175	S	92.5	Very high	86.1	Confident	66 Å²	66	39.8 Å²	39.8	46%	0.462	24%	0.242	S	C	.	.	H	α-helix	trans	-65.7	-43.8	176.8	66.3	0	0	0	0	111.6	T171 A172 L177 S178 L179	T171-S175 PolarHBondContact O-N 3.05Å; T171-S175 PolarHBondContact O-OG 3.41Å; A172-S175 PolarHBondContact O-N 3.3Å; A172-S175 PolarHBondContact O-OG 3.37Å; S175-L177 PolarHBondContact O-N 2.96Å; S175-S178 WeakPolarHBondContact O-CB 3.42Å; S175-S178 PolarHBondContact O-N 2.89Å; S175-L179 WeakPolarHBondContact O-CG 3.37Å; S175-L179 PolarHBondContact O-N 3.39Å
176	A	93.1	Very high	84.3	Confident	2 Å²	2	43.1 Å²	43.1	2%	0.017	28%	0.277	C	S	.	.	H	α-helix	trans	-59.5	-45.9	175	0	0	0	0	0	112.1	A172 A173 S178 L179 Y180 C197 L199 I225 A229	A172-A176 WeakPolarHBondContact O-CB 3.36Å; A172-A176 PolarHBondContact O-N 3.03Å; A173-A176 PolarHBondContact O-N 3.04Å; A176-S178 VanDerWaalsContact C-N 3.33Å; A176-S178 PolarHBondContact O-N 3.43Å; A176-L179 PolarHBondContact O-N 3.2Å; A176-Y180 PolarHBondContact O-N 2.76Å; A176-C197 HydrophobicContact CB-CB 4.24Å; A176-L199 HydrophobicContact CB-CD1 4.18Å; A176-L199 HydrophobicContact CB-CD2 4.16Å; A176-L199 HydrophobicContact CB-CG 4.23Å; A176-I225 HydrophobicContact CB-CG2 4.17Å; A176-A229 HydrophobicContact CB-CB 3.96Å
177	L	90.3	Very high	82.6	Confident	8 Å²	8	46.3 Å²	46.3	4%	0.042	29%	0.294	C	S	.	.	H	α-helix	trans	-64.4	-37.2	176.1	179.7	62.3	0	0	0	112.1	K150 A173 L174 S175 Y180 N181 H222 I225 Y226	K150-L177 HydrophobicContact CD-CD2 3.89Å; A173-L177 WeakPolarHBondContact O-CB 3.46Å; A173-L177 PolarHBondContact O-N 2.92Å; L174-L177 PolarHBondContact O-N 2.89Å; S175-L177 PolarHBondContact O-N 2.96Å; L177-Y180 HydrophobicContact CD1-CD1 4.35Å; L177-Y180 WeakPolarHBondContact O-CB 3.39Å; L177-Y180 PolarHBondContact O-N 3.26Å; L177-N181 VanDerWaalsContact O-CG 3.3Å; L177-N181 PolarHBondContact O-N 3.2Å; L177-N181 PolarHBondContact O-ND2 3.28Å; L177-H222 HydrophobicContact CD1-CB 4.36Å; L177-H222 WeakPolarHBondContact CD1-CD2 3.34Å; L177-I225 HydrophobicContact CD1-CD1 4.31Å; L177-Y226 HydrophobicContact CB-CE2 4Å; L177-Y226 HydrophobicContact CD2-CE2 3.63Å; L177-Y226 HydrophobicContact CG-CE2 4.37Å
178	S	89.1	Confident	81.6	Confident	57 Å²	57	45.8 Å²	45.8	40%	0.399	29%	0.289	S	S	.	.	H	α-helix	trans	-61.2	-46.5	175.8	-172.4	0	0	0	0	111.4	L174 S175 A176 Y180 N181 M182	L174-S178 WeakPolarHBondContact O-CB 3.46Å; L174-S178 PolarHBondContact O-N 3.38Å; S175-S178 WeakPolarHBondContact O-CB 3.42Å; S175-S178 PolarHBondContact O-N 2.89Å; A176-S178 VanDerWaalsContact C-N 3.33Å; A176-S178 PolarHBondContact O-N 3.43Å; S178-Y180 VanDerWaalsContact C-N 3.33Å; S178-Y180 PolarHBondContact O-N 2.99Å; S178-N181 PolarHBondContact O-N 3.21Å; S178-M182 VanDerWaalsContact O-CG 3.28Å; S178-M182 WeakPolarHBondContact O-CG 3.07Å; S178-M182 PolarHBondContact O-N 3.21Å
179	L	89.1	Confident	80.7	Confident	94 Å²	94	46.2 Å²	46.2	49%	0.492	29%	0.288	S	S	.	.	H	α-helix	trans	-60.7	-41.9	175.7	-68.1	173.2	0	0	0	112.1	S175 A176 N181 M182 S183 R196 C197	S175-L179 WeakPolarHBondContact O-CG 3.37Å; S175-L179 PolarHBondContact O-N 3.39Å; A176-L179 PolarHBondContact O-N 3.2Å; L179-N181 VanDerWaalsContact C-N 3.32Å; L179-N181 PolarHBondContact O-N 3.25Å; L179-M182 PolarHBondContact O-N 2.89Å; L179-S183 PolarHBondContact O-N 2.94Å; L179-S183 PolarHBondContact O-OG 3.4Å; L179-S183 VanDerWaalsContact O-OG 3.09Å; L179-R196 CarbonylContact C-O 3.6Å; L179-R196 VanDerWaalsContact C-O 3.22Å; L179-R196 WeakPolarHBondContact CB-O 3.18Å; L179-C197 WeakPolarHBondContact CD1-O 3.28Å
180	Y	86.8	Confident	79.7	Confident	8 Å²	8	48 Å²	48	3%	0.031	30%	0.301	C	S	.	.	H	α-helix	trans	-59	-42.9	176.5	-177.7	-105.8	0	0	0	112.5	A176 L177 S178 S183 K193 R196 E221 I225	A176-Y180 PolarHBondContact O-N 2.76Å; L177-Y180 HydrophobicContact CD1-CD1 4.35Å; L177-Y180 WeakPolarHBondContact O-CB 3.39Å; L177-Y180 PolarHBondContact O-N 3.26Å; S178-Y180 VanDerWaalsContact C-N 3.33Å; S178-Y180 PolarHBondContact O-N 2.99Å; Y180-S183 WeakPolarHBondContact O-CB 3.34Å; Y180-K193 HydrophobicContact CE2-CG 4.32Å; Y180-R196 HydrophobicContact CD2-CB 4.03Å; Y180-R196 VanDerWaalsContact CE2-CZ 3.49Å; Y180-R196 PolarHBondContact N-O 3.46Å; Y180-R196 PolarHBondContact O-NH2 3.28Å; Y180-R196 VanDerWaalsContact O-NH2 3.12Å; Y180-E221 WeakPolarHBondContact CE1-OE1 3.28Å; Y180-E221 PolarHBondContact OH-OE1 2.86Å; Y180-E221 PolarHBondContact OH-OE2 3.06Å; Y180-I225 HydrophobicContact CD1-CD1 3.78Å; Y180-I225 HydrophobicContact CD2-CD1 4.07Å; Y180-I225 HydrophobicContact CE1-CD1 4.12Å; Y180-I225 HydrophobicContact CE2-CD1 4.41Å; Y180-I225 HydrophobicContact CG-CD1 3.75Å
181	N	83	Confident	79.2	Confident	41 Å²	41	53 Å²	53	22%	0.219	32%	0.319	C	S	.	.	H	α-helix	trans	-73.9	-30.5	-179.8	-71.9	-31.7	0	0	0	113.5	L177 S178 L179 S183 N634	L177-N181 VanDerWaalsContact O-CG 3.3Å; L177-N181 PolarHBondContact O-N 3.2Å; L177-N181 PolarHBondContact O-ND2 3.28Å; S178-N181 PolarHBondContact O-N 3.21Å; L179-N181 VanDerWaalsContact C-N 3.32Å; L179-N181 PolarHBondContact O-N 3.25Å; N181-S183 VanDerWaalsContact C-N 3.31Å; N181-N634 PolarHBondContact ND2-ND2 3.3Å; N181-N634 PolarHBondContact OD1-ND2 2.84Å
182	M	80	Confident	78.9	Confident	127 Å²	127	49.6 Å²	49.6	63%	0.626	30%	0.299	S	S	*	.	H	α-helix	trans	-79.7	-12.2	177.7	-67.5	-65.2	168.9	0	0	113.2	S178 L179 S184	S178-M182 VanDerWaalsContact O-CG 3.28Å; S178-M182 WeakPolarHBondContact O-CG 3.07Å; S178-M182 PolarHBondContact O-N 3.21Å; L179-M182 PolarHBondContact O-N 2.89Å; M182-S184 PolarHBondContact O-N 3.07Å
183	S	71.1	Confident	78.8	Confident	27 Å²	27	48.9 Å²	48.9	19%	0.189	29%	0.293	C	S	.	.	S	Bend	trans	-61.3	119.1	175.2	-63.5	0	0	0	0	110.3	L179 Y180 N181	L179-S183 PolarHBondContact O-N 2.94Å; L179-S183 PolarHBondContact O-OG 3.4Å; L179-S183 VanDerWaalsContact O-OG 3.09Å; Y180-S183 WeakPolarHBondContact O-CB 3.34Å; N181-S183 VanDerWaalsContact C-N 3.31Å
184	S	58	Low	78.6	Confident	67 Å²	67	49.7 Å²	49.7	47%	0.469	30%	0.298	S	S	.	.			trans	-58.8	151.7	-172	81.3	0	0	0	0	113.1	M182 G186 D187	M182-S184 PolarHBondContact O-N 3.07Å; S184-G186 PolarHBondContact O-N 3.48Å; S184-G186 VanDerWaalsContact O-N 3.13Å; S184-D187 PolarHBondContact O-N 3.09Å; S184-D187 VanDerWaalsContact O-N 3.15Å
185	A	53	Low	78.4	Confident	69 Å²	69	50.1 Å²	50.1	57%	0.57	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-21.8	-177.5	0	0	0	0	0	114.7	K188	A185-K188 HydrophobicContact CB-CD 4.38Å
186	G	52.2	Low	78.3	Confident	71 Å²	71	47.7 Å²	47.7	73%	0.732	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-25.5	177.3	0	0	0	0	0	114.3	S184	S184-G186 PolarHBondContact O-N 3.48Å; S184-G186 VanDerWaalsContact O-N 3.13Å
187	D	57.2	Low	78.1	Confident	75 Å²	75	47.7 Å²	47.7	40%	0.401	28%	0.284	S	S	.	.	S	Bend	trans	-103.1	5.9	-175	-79	-25.6	0	0	0	114.1	S184 F189 S190	S184-D187 PolarHBondContact O-N 3.09Å; S184-D187 VanDerWaalsContact O-N 3.15Å; D187-F189 VanDerWaalsContact C-N 3.31Å; D187-F189 PolarHBondContact O-N 3.2Å; D187-S190 WeakPolarHBondContact CA-OG 3.45Å; D187-S190 PolarHBondContact O-N 2.98Å; D187-S190 PolarHBondContact O-OG 3.21Å
188	K	66	Low	78.2	Confident	20 Å²	20	49.3 Å²	49.3	9%	0.087	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-33.6	-167.9	-78.5	176.7	176	166.8	0	114.2	A185 R196 P640 Y716	A185-K188 HydrophobicContact CB-CD 4.38Å; K188-R196 PolarHBondContact O-NH1 3.22Å; K188-P640 PolarHBondContact NZ-O 3.39Å; K188-Y716 PolarHBondContact O-OH 3.37Å
189	F	72.2	Confident	78.4	Confident	72 Å²	72	47.7 Å²	47.7	32%	0.316	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	5.2	-175.7	-53.4	-51.8	0	0	0	113.9	D187 E713 Y716	D187-F189 VanDerWaalsContact C-N 3.31Å; D187-F189 PolarHBondContact O-N 3.2Å; F189-E713 HydrophobicContact CE1-CB 4.16Å; F189-E713 HydrophobicContact CE1-CG 3.86Å; F189-E713 HydrophobicContact CE2-CB 4.49Å; F189-E713 HydrophobicContact CZ-CB 3.83Å; F189-E713 HydrophobicContact CZ-CG 3.74Å; F189-Y716 HydrophobicContact CB-CD2 4.1Å; F189-Y716 HydrophobicContact CB-CG 4.33Å; F189-Y716 AromaticContact CD1-CD1 3.62Å; F189-Y716 HydrophobicContact CD1-CD1 3.62Å; F189-Y716 HydrophobicContact CD1-CD2 4.08Å; F189-Y716 HydrophobicContact CD1-CE1 4.17Å; F189-Y716 AromaticContact CD1-CG 3.56Å; F189-Y716 HydrophobicContact CD1-CG 3.56Å; F189-Y716 HydrophobicContact CE1-CD1 4.07Å; F189-Y716 HydrophobicContact CE1-CG 4.36Å; F189-Y716 HydrophobicContact CG-CG 4.38Å
190	S	74.3	Confident	78.7	Confident	39 Å²	39	45.2 Å²	45.2	27%	0.273	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-9.8	178.6	58.7	0	0	0	0	113.1	D187 H740	D187-S190 WeakPolarHBondContact CA-OG 3.45Å; D187-S190 PolarHBondContact O-N 2.98Å; D187-S190 PolarHBondContact O-OG 3.21Å; S190-H740 WeakPolarHBondContact O-CB 3.3Å
191	R	82.4	Confident	79.1	Confident	117 Å²	117	44.9 Å²	44.9	44%	0.442	28%	0.276	S	S	.	.	S	Bend	trans	-137.4	150.2	-177.7	-59.2	179.8	74.9	178.5	5.8	111.6	R196 Y716	R191-R196 HydrophobicContact CB-CG 4.38Å; R191-Y716 WeakPolarHBondContact O-CE2 3.48Å; R191-Y716 PolarHBondContact O-OH 2.72Å
192	G	86.6	Confident	79.6	Confident	6 Å²	6	43.6 Å²	43.6	6%	0.062	27%	0.271	C	S	.	.			trans	-66.3	151.8	177.3	0	0	0	0	0	114	S194 V195 R196 E720 H740	G192-S194 VanDerWaalsContact C-N 3.31Å; G192-S194 PolarHBondContact O-N 3.08Å; G192-V195 PolarHBondContact O-N 3.45Å; G192-R196 PolarHBondContact O-N 3.27Å; G192-E720 WeakPolarHBondContact CA-OE1 3.47Å; G192-H740 WeakPolarHBondContact CA-CE1 3.45Å; G192-H740 WeakPolarHBondContact CA-NE2 3.47Å; G192-H740 PolarHBondContact N-CE1 3.17Å; G192-H740 PolarHBondContact N-ND1 3.32Å; G192-H740 PolarHBondContact N-NE2 3.03Å
193	K	89.6	Confident	80.4	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.009	24%	0.241	C	C	.	.	H	α-helix	trans	-59.3	-40.6	-178.3	-70.8	178.5	173	-163.1	0	112.1	Y180 V195 R196 C197 V203 E221 Y716 H717 E720 H721	Y180-K193 HydrophobicContact CE2-CG 4.32Å; K193-V195 PolarHBondContact O-N 3.07Å; K193-R196 PolarHBondContact O-N 3.19Å; K193-C197 PolarHBondContact O-N 3.23Å; K193-C197 PolarHBondContact O-SG 3.4Å; K193-V203 HydrophobicContact CB-CB 4.01Å; K193-V203 HydrophobicContact CB-CG1 4.18Å; K193-V203 HydrophobicContact CD-CG1 4.33Å; K193-E221 IonicContact NZ-OE2 3.31Å; K193-E221 PolarHBondContact NZ-OE2 3.17Å; K193-Y716 HydrophobicContact CG-CE1 4.34Å; K193-H717 WeakPolarHBondContact CE-ND1 3.24Å; K193-H717 PolarHBondContact NZ-CE1 2.93Å; K193-H717 PolarHBondContact NZ-ND1 3.32Å; K193-H717 VanDerWaalsContact NZ-ND1 3.14Å; K193-E720 VanDerWaalsContact CB-OE2 3.26Å; K193-E720 WeakPolarHBondContact CB-OE2 3.4Å; K193-E720 HydrophobicContact CG-CG 4.49Å; K193-E720 VanDerWaalsContact CG-OE2 3.25Å; K193-E720 WeakPolarHBondContact CG-OE2 3.31Å; K193-E720 PolarHBondContact N-OE2 3.39Å; K193-H721 PolarHBondContact NZ-NE2 3.44Å
194	S	91.9	Very high	81.5	Confident	16 Å²	16	36.3 Å²	36.3	11%	0.112	23%	0.232	C	C	.	.	H	α-helix	trans	-61	-43.6	178.7	-65.3	0	0	0	0	112.9	G192 R196 C197 G198 L199 F201 S202 V203	G192-S194 VanDerWaalsContact C-N 3.31Å; G192-S194 PolarHBondContact O-N 3.08Å; S194-R196 VanDerWaalsContact C-N 3.33Å; S194-R196 PolarHBondContact O-N 2.89Å; S194-C197 CarbonylContact O-C 3.5Å; S194-C197 PolarHBondContact O-N 3.11Å; S194-C197 VanDerWaalsContact O-N 3.13Å; S194-G198 PolarHBondContact O-N 2.83Å; S194-L199 PolarHBondContact O-N 3.42Å; S194-F201 VanDerWaalsContact CB-O 3.31Å; S194-F201 WeakPolarHBondContact CB-O 3.48Å; S194-F201 PolarHBondContact OG-O 3.09Å; S194-S202 VanDerWaalsContact OG-CA 3.22Å; S194-S202 WeakPolarHBondContact OG-CA 3.44Å; S194-V203 PolarHBondContact OG-N 3.04Å
195	V	89.1	Confident	83.2	Confident	68 Å²	68	37 Å²	37	41%	0.412	22%	0.224	S	C	.	.	H	α-helix	trans	-64.6	-41.1	179.1	179.3	0	0	0	0	110.4	G192 K193 C197 G198	G192-V195 PolarHBondContact O-N 3.45Å; K193-V195 PolarHBondContact O-N 3.07Å; V195-C197 VanDerWaalsContact C-N 3.26Å; V195-C197 PolarHBondContact O-N 2.99Å; V195-G198 PolarHBondContact O-N 3.39Å; V195-G198 VanDerWaalsContact O-N 3.11Å
196	R	88.6	Confident	85.3	Confident	16 Å²	16	33.7 Å²	33.7	6%	0.06	20%	0.197	C	C	.	.	H	α-helix	trans	-64.2	-29.3	174.8	-68.7	177.8	57.8	-161.8	-11.4	113.2	L179 Y180 K188 R191 G192 K193 S194	L179-R196 CarbonylContact C-O 3.6Å; L179-R196 VanDerWaalsContact C-O 3.22Å; L179-R196 WeakPolarHBondContact CB-O 3.18Å; Y180-R196 HydrophobicContact CD2-CB 4.03Å; Y180-R196 VanDerWaalsContact CE2-CZ 3.49Å; Y180-R196 PolarHBondContact N-O 3.46Å; Y180-R196 PolarHBondContact O-NH2 3.28Å; Y180-R196 VanDerWaalsContact O-NH2 3.12Å; K188-R196 PolarHBondContact O-NH1 3.22Å; R191-R196 HydrophobicContact CB-CG 4.38Å; G192-R196 PolarHBondContact O-N 3.27Å; K193-R196 PolarHBondContact O-N 3.19Å; S194-R196 VanDerWaalsContact C-N 3.33Å; S194-R196 PolarHBondContact O-N 2.89Å
197	C	90.8	Very high	87.4	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.014	16%	0.163	C	C	.	.	H	α-helix	trans	-86.3	-9.5	175	-60.8	0	0	0	0	113.4	A176 L179 K193 S194 V195 L199	A176-C197 HydrophobicContact CB-CB 4.24Å; L179-C197 WeakPolarHBondContact CD1-O 3.28Å; K193-C197 PolarHBondContact O-N 3.23Å; K193-C197 PolarHBondContact O-SG 3.4Å; S194-C197 CarbonylContact O-C 3.5Å; S194-C197 PolarHBondContact O-N 3.11Å; S194-C197 VanDerWaalsContact O-N 3.13Å; V195-C197 VanDerWaalsContact C-N 3.26Å; V195-C197 PolarHBondContact O-N 2.99Å; C197-L199 VanDerWaalsContact C-N 3.29Å; C197-L199 HydrophobicContact CB-CB 4.34Å; C197-L199 HydrophobicContact CB-CD1 3.69Å; C197-L199 HydrophobicContact CB-CG 3.72Å; C197-L199 PolarHBondContact O-N 3.19Å
198	G	91.3	Very high	89.3	Confident	42 Å²	42	30.4 Å²	30.4	43%	0.433	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	29	-170.3	0	0	0	0	0	113.6	K106 S194 V195	K106-G198 PolarHBondContact NZ-O 3.26Å; S194-G198 PolarHBondContact O-N 2.83Å; V195-G198 PolarHBondContact O-N 3.39Å; V195-G198 VanDerWaalsContact O-N 3.11Å
199	L	93.9	Very high	90.7	Very high	22 Å²	22	30.7 Å²	30.7	12%	0.115	16%	0.158	C	C	.	.			trans	-99.8	147.9	-180	-64.5	174	0	0	0	111	A176 S194 C197 V203 C228 A229	A176-L199 HydrophobicContact CB-CD1 4.18Å; A176-L199 HydrophobicContact CB-CD2 4.16Å; A176-L199 HydrophobicContact CB-CG 4.23Å; S194-L199 PolarHBondContact O-N 3.42Å; C197-L199 VanDerWaalsContact C-N 3.29Å; C197-L199 HydrophobicContact CB-CB 4.34Å; C197-L199 HydrophobicContact CB-CD1 3.69Å; C197-L199 HydrophobicContact CB-CG 3.72Å; C197-L199 PolarHBondContact O-N 3.19Å; L199-V203 HydrophobicContact CD1-CG2 3.91Å; L199-C228 HydrophobicContact CD1-CB 4.29Å; L199-A229 HydrophobicContact CD1-CB 4.11Å; L199-A229 HydrophobicContact CD2-CB 3.91Å
200	V	93.8	Very high	91.8	Very high	43 Å²	43	27.3 Å²	27.3	26%	0.261	14%	0.143	S	C	.	.	S	Bend	trans	-81.2	-42.4	171.1	-177	0	0	0	0	109.9	E99 A103 K106 E232	E99-V200 HydrophobicContact CB-CG1 4.16Å; E99-V200 HydrophobicContact CG-CG1 4.4Å; A103-V200 HydrophobicContact CB-CB 4.37Å; A103-V200 HydrophobicContact CB-CG2 4.45Å; K106-V200 HydrophobicContact CD-CG2 3.89Å; K106-V200 HydrophobicContact CG-CG2 4.29Å; V200-E232 PolarHBondContact N-OE1 2.86Å; V200-E232 PolarHBondContact N-OE2 3.37Å
201	F	95.6	Very high	92.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	-68.1	145.2	-179.5	-71.4	-3.3	0	0	0	111.8	W95 E99 V100 A103 S194 V203 F206 C228 M231 E232 F235	W95-F201 HydrophobicContact CB-CD1 4.4Å; W95-F201 HydrophobicContact CB-CE1 4.25Å; W95-F201 HydrophobicContact CB-CZ 4.33Å; W95-F201 HydrophobicContact CE3-CE2 4.48Å; W95-F201 HydrophobicContact CG-CZ 4.5Å; E99-F201 HydrophobicContact CB-CD1 3.83Å; E99-F201 HydrophobicContact CB-CE1 3.96Å; E99-F201 WeakPolarHBondContact O-CE1 3.11Å; V100-F201 HydrophobicContact CG2-CE1 4.24Å; V100-F201 HydrophobicContact CG2-CZ 4.09Å; A103-F201 HydrophobicContact CB-CE1 3.94Å; A103-F201 HydrophobicContact CB-CZ 4.31Å; S194-F201 VanDerWaalsContact CB-O 3.31Å; S194-F201 WeakPolarHBondContact CB-O 3.48Å; S194-F201 PolarHBondContact OG-O 3.09Å; F201-V203 PolarHBondContact O-N 3.45Å; F201-F206 HydrophobicContact CB-CE2 4.05Å; F201-F206 AromaticContact CD2-CE2 3.89Å; F201-F206 HydrophobicContact CD2-CE2 3.89Å; F201-F206 HydrophobicContact CD2-CZ 4.12Å; F201-F206 HydrophobicContact CG-CE2 4.3Å; F201-C228 WeakPolarHBondContact CB-SG 3.48Å; F201-M231 HydrophobicContact CD2-CB 4.49Å; F201-M231 HydrophobicContact CE2-CB 4.28Å; F201-E232 HydrophobicContact CD2-CB 3.95Å; F201-E232 HydrophobicContact CE2-CB 4.15Å; F201-E232 HydrophobicContact CG-CB 4.44Å; F201-E232 PolarHBondContact N-OE2 3.4Å; F201-E232 VanDerWaalsContact N-OE2 3.15Å; F201-F235 AromaticContact CE2-CD2 3.66Å; F201-F235 HydrophobicContact CE2-CD2 3.66Å; F201-F235 AromaticContact CE2-CE2 3.8Å; F201-F235 HydrophobicContact CE2-CE2 3.8Å; F201-F235 AromaticContact CZ-CD2 3.61Å; F201-F235 HydrophobicContact CZ-CD2 3.61Å; F201-F235 AromaticContact CZ-CE2 3.75Å; F201-F235 HydrophobicContact CZ-CE2 3.75Å; F201-F235 HydrophobicContact CZ-CG 4.36Å
202	S	93.9	Very high	93.3	Very high	15 Å²	15	25.3 Å²	25.3	11%	0.105	14%	0.139	C	C	.	.			trans	-73.9	109.3	178.4	174.8	0	0	0	0	111.6	S194 G204 R205 F206	S194-S202 VanDerWaalsContact OG-CA 3.22Å; S194-S202 WeakPolarHBondContact OG-CA 3.44Å; S202-G204 PolarHBondContact O-N 2.89Å; S202-R205 PolarHBondContact O-N 3.09Å; S202-R205 PolarHBondContact OG-N 3.02Å; S202-F206 WeakPolarHBondContact O-CD2 3.29Å; S202-F206 PolarHBondContact O-N 2.94Å; S202-F206 VanDerWaalsContact O-N 3.12Å
203	V	96	Very high	93.6	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.006	15%	0.152	C	C	.	.	H	α-helix	trans	-60.9	-37.1	175.5	174.5	0	0	0	0	110.4	K193 S194 L199 F201 F206 F207 A224 I225 C228	K193-V203 HydrophobicContact CB-CB 4.01Å; K193-V203 HydrophobicContact CB-CG1 4.18Å; K193-V203 HydrophobicContact CD-CG1 4.33Å; S194-V203 PolarHBondContact OG-N 3.04Å; L199-V203 HydrophobicContact CD1-CG2 3.91Å; F201-V203 PolarHBondContact O-N 3.45Å; V203-F206 PolarHBondContact O-N 3.05Å; V203-F207 PolarHBondContact O-N 3.45Å; V203-A224 HydrophobicContact CG1-CB 4.22Å; V203-I225 HydrophobicContact CG1-CG1 3.74Å; V203-I225 HydrophobicContact CG2-CG1 4.42Å; V203-C228 HydrophobicContact CG2-CB 4.28Å
204	G	94.3	Very high	93.8	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.2	-42.1	177.1	0	0	0	0	0	113.5	S202 F207 R208 E720	S202-G204 PolarHBondContact O-N 2.89Å; G204-F207 WeakPolarHBondContact O-CB 3.39Å; G204-F207 PolarHBondContact O-N 3.37Å; G204-R208 WeakPolarHBondContact O-CB 3.49Å; G204-R208 PolarHBondContact O-N 3.49Å; G204-E720 VanDerWaalsContact CA-O 3.27Å; G204-E720 WeakPolarHBondContact CA-O 3.15Å
205	R	94.9	Very high	93.8	Very high	81 Å²	81	35.4 Å²	35.4	31%	0.306	18%	0.181	S	C	.	.	H	α-helix	trans	-67.7	-37.3	174	-74.1	-170.8	-64.1	135.8	16.7	112.8	P94 E99 S202 R208 W209	P94-R205 VanDerWaalsContact O-CZ 3.26Å; P94-R205 PolarHBondContact O-NH1 3.27Å; P94-R205 PolarHBondContact O-NH2 2.8Å; E99-R205 IonicContact OE1-CZ 2.96Å; E99-R205 IonicContact OE1-NH2 2.81Å; E99-R205 PolarHBondContact OE1-NH2 3.46Å; E99-R205 IonicContact OE2-CZ 3.39Å; E99-R205 IonicContact OE2-NH1 3.44Å; E99-R205 IonicContact OE2-NH2 2.9Å; E99-R205 PolarHBondContact OE2-NH2 3.06Å; S202-R205 PolarHBondContact O-N 3.09Å; S202-R205 PolarHBondContact OG-N 3.02Å; R205-R208 PolarHBondContact O-N 2.68Å; R205-W209 WeakPolarHBondContact O-CB 3.48Å; R205-W209 PolarHBondContact O-N 3.27Å
206	F	97.2	Very high	94	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62	-44.2	171.1	-91.8	-95.3	0	0	0	111.8	P94 W95 L131 F201 S202 V203 W209 M210 L227 C228 M231	P94-F206 HydrophobicContact CB-CD1 4.33Å; P94-F206 HydrophobicContact CB-CD2 3.85Å; P94-F206 HydrophobicContact CB-CE1 4.49Å; P94-F206 HydrophobicContact CB-CE2 4.03Å; P94-F206 HydrophobicContact CB-CG 4.03Å; P94-F206 HydrophobicContact CB-CZ 4.37Å; P94-F206 HydrophobicContact CG-CD1 3.89Å; P94-F206 HydrophobicContact CG-CD2 4.05Å; P94-F206 HydrophobicContact CG-CE1 3.69Å; P94-F206 HydrophobicContact CG-CE2 3.86Å; P94-F206 HydrophobicContact CG-CG 4.09Å; P94-F206 HydrophobicContact CG-CZ 3.7Å; W95-F206 HydrophobicContact CE3-CE1 4.43Å; W95-F206 HydrophobicContact CE3-CE2 4.02Å; W95-F206 AromaticContact CE3-CZ 3.53Å; W95-F206 HydrophobicContact CE3-CZ 3.53Å; W95-F206 HydrophobicContact CZ3-CE1 4.25Å; W95-F206 AromaticContact CZ3-CZ 3.72Å; W95-F206 HydrophobicContact CZ3-CZ 3.72Å; L131-F206 HydrophobicContact CD1-CE1 4.17Å; F201-F206 HydrophobicContact CB-CE2 4.05Å; F201-F206 AromaticContact CD2-CE2 3.89Å; F201-F206 HydrophobicContact CD2-CE2 3.89Å; F201-F206 HydrophobicContact CD2-CZ 4.12Å; F201-F206 HydrophobicContact CG-CE2 4.3Å; S202-F206 WeakPolarHBondContact O-CD2 3.29Å; S202-F206 PolarHBondContact O-N 2.94Å; S202-F206 VanDerWaalsContact O-N 3.12Å; V203-F206 PolarHBondContact O-N 3.05Å; F206-W209 PolarHBondContact O-N 3.02Å; F206-M210 VanDerWaalsContact O-CG 3.24Å; F206-M210 WeakPolarHBondContact O-CG 3.49Å; F206-M210 PolarHBondContact O-N 2.85Å; F206-L227 HydrophobicContact CD1-CB 4.37Å; F206-L227 HydrophobicContact CD1-CD2 4.07Å; F206-L227 HydrophobicContact CD1-CG 3.93Å; F206-L227 HydrophobicContact CE1-CG 4.1Å; F206-C228 HydrophobicContact CB-CB 4.23Å; F206-C228 HydrophobicContact CD1-CB 4.29Å; F206-C228 HydrophobicContact CD2-CB 3.93Å; F206-C228 HydrophobicContact CE2-CB 4.33Å; F206-C228 HydrophobicContact CG-CB 3.89Å; F206-M231 HydrophobicContact CE1-CB 4.16Å; F206-M231 HydrophobicContact CE1-CG 3.75Å; F206-M231 HydrophobicContact CZ-CB 3.85Å; F206-M231 HydrophobicContact CZ-CG 3.93Å
207	F	96.8	Very high	94.1	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.018	19%	0.189	C	C	.	.	H	α-helix	trans	-59	-51.6	176	-171.5	-77	0	0	0	110.9	V203 G204 W209 M210 V211 I219 A224 S652 H653 H721	V203-F207 PolarHBondContact O-N 3.45Å; G204-F207 WeakPolarHBondContact O-CB 3.39Å; G204-F207 PolarHBondContact O-N 3.37Å; F207-W209 VanDerWaalsContact C-N 3.35Å; F207-W209 PolarHBondContact O-N 3.29Å; F207-M210 WeakPolarHBondContact O-CB 3.43Å; F207-M210 PolarHBondContact O-N 3.33Å; F207-V211 HydrophobicContact CD1-CG2 3.91Å; F207-V211 HydrophobicContact CE1-CG2 3.62Å; F207-V211 HydrophobicContact CZ-CG2 4.48Å; F207-V211 WeakPolarHBondContact O-CG2 3.25Å; F207-V211 PolarHBondContact O-N 3.29Å; F207-I219 HydrophobicContact CD2-CG2 4Å; F207-I219 HydrophobicContact CE2-CB 4.16Å; F207-I219 HydrophobicContact CE2-CG2 3.77Å; F207-I219 VanDerWaalsContact CE2-O 3.27Å; F207-I219 WeakPolarHBondContact CE2-O 3.46Å; F207-I219 HydrophobicContact CZ-CB 4.18Å; F207-I219 HydrophobicContact CZ-CG2 4.26Å; F207-I219 WeakPolarHBondContact CZ-O 3.29Å; F207-A224 HydrophobicContact CB-CB 3.77Å; F207-A224 HydrophobicContact CD2-CB 3.86Å; F207-A224 HydrophobicContact CG-CB 4.3Å; F207-S652 VanDerWaalsContact CE1-O 3.24Å; F207-S652 WeakPolarHBondContact CE1-O 3.25Å; F207-H653 AromaticContact CZ-CE1 3.8Å; F207-H653 AromaticContact CZ-NE2 3.8Å; F207-H721 HydrophobicContact CD1-CB 4.44Å; F207-H721 AromaticContact CD1-CE1 3.31Å; F207-H721 WeakPolarHBondContact CD1-CE1 3.47Å; F207-H721 AromaticContact CD1-CG 3.74Å; F207-H721 AromaticContact CD1-ND1 3.11Å; F207-H721 WeakPolarHBondContact CD1-ND1 3.5Å; F207-H721 AromaticContact CD2-CE1 3.68Å; F207-H721 AromaticContact CE1-CE1 3.46Å; F207-H721 VanDerWaalsContact CE1-CE1 3.46Å; F207-H721 WeakPolarHBondContact CE1-CE1 3.39Å; F207-H721 AromaticContact CE1-ND1 3.31Å; F207-H721 VanDerWaalsContact CE1-ND1 3.31Å; F207-H721 WeakPolarHBondContact CE1-ND1 3.47Å; F207-H721 AromaticContact CE2-CE1 3.8Å; F207-H721 AromaticContact CG-CE1 3.44Å; F207-H721 VanDerWaalsContact CG-CE1 3.44Å; F207-H721 WeakPolarHBondContact CG-CE1 3.33Å; F207-H721 AromaticContact CG-ND1 3.69Å; F207-H721 AromaticContact CG-NE2 3.79Å; F207-H721 AromaticContact CZ-CE1 3.7Å
208	R	95.3	Very high	94.2	Very high	72 Å²	72	37 Å²	37	27%	0.272	19%	0.189	S	C	.	.	H	α-helix	trans	-58.5	-46.7	178	-179.5	176	177.7	97.3	17.8	111.8	G204 R205 M210 V211 D212 H721 G722 H723	G204-R208 WeakPolarHBondContact O-CB 3.49Å; G204-R208 PolarHBondContact O-N 3.49Å; R205-R208 PolarHBondContact O-N 2.68Å; R208-M210 VanDerWaalsContact C-N 3.28Å; R208-M210 PolarHBondContact O-N 2.79Å; R208-V211 WeakPolarHBondContact O-CB 3.49Å; R208-V211 PolarHBondContact O-N 3.37Å; R208-V211 VanDerWaalsContact O-N 3.09Å; R208-D212 WeakPolarHBondContact CG-OD2 3.34Å; R208-D212 IonicContact CZ-OD2 3.94Å; R208-D212 IonicContact NE-OD2 3.93Å; R208-D212 PolarHBondContact NE-OD2 2.83Å; R208-D212 IonicContact NH2-OD1 2.78Å; R208-D212 IonicContact NH2-OD2 3.23Å; R208-D212 PolarHBondContact NH2-OD2 3.14Å; R208-D212 VanDerWaalsContact NH2-OD2 3.1Å; R208-D212 WeakPolarHBondContact O-CB 3.42Å; R208-D212 PolarHBondContact O-N 3.43Å; R208-H721 WeakPolarHBondContact CB-O 3.4Å; R208-H721 VanDerWaalsContact CD-O 3.23Å; R208-H721 WeakPolarHBondContact CD-O 3.46Å; R208-G722 PolarHBondContact NH1-O 2.81Å; R208-H723 PolarHBondContact NH1-CE1 3.01Å; R208-H723 PolarHBondContact NH1-ND1 3.27Å
209	W	96.1	Very high	94.3	Very high	27 Å²	27	35.4 Å²	35.4	10%	0.102	17%	0.17	C	C	.	.	H	α-helix	trans	-59.5	-39.2	177.9	178.2	89.1	0	0	0	111.9	L90 E92 P94 L131 A135 R205 F206 F207 V211 S213 V215 L227	L90-W209 HydrophobicContact CD1-CZ2 3.93Å; L90-W209 HydrophobicContact CD2-CZ2 4.01Å; E92-W209 PolarHBondContact O-NE1 3.21Å; P94-W209 HydrophobicContact CB-CB 3.88Å; P94-W209 HydrophobicContact CB-CG 4.08Å; P94-W209 HydrophobicContact CG-CB 4.4Å; P94-W209 HydrophobicContact CG-CD2 4.3Å; P94-W209 HydrophobicContact CG-CG 4.13Å; L131-W209 HydrophobicContact CD1-CH2 3.96Å; L131-W209 HydrophobicContact CD1-CZ3 3.9Å; L131-W209 HydrophobicContact CD2-CH2 3.8Å; L131-W209 HydrophobicContact CD2-CZ2 3.71Å; L131-W209 HydrophobicContact CD2-CZ3 4.24Å; L131-W209 HydrophobicContact CG-CH2 3.68Å; L131-W209 HydrophobicContact CG-CZ2 4.06Å; L131-W209 HydrophobicContact CG-CZ3 4.13Å; A135-W209 HydrophobicContact CB-CH2 3.65Å; A135-W209 HydrophobicContact CB-CZ3 3.91Å; R205-W209 WeakPolarHBondContact O-CB 3.48Å; R205-W209 PolarHBondContact O-N 3.27Å; F206-W209 PolarHBondContact O-N 3.02Å; F207-W209 VanDerWaalsContact C-N 3.35Å; F207-W209 PolarHBondContact O-N 3.29Å; W209-V211 VanDerWaalsContact C-N 3.35Å; W209-S213 WeakPolarHBondContact O-CB 3.35Å; W209-S213 PolarHBondContact O-N 2.88Å; W209-S213 PolarHBondContact O-OG 2.92Å; W209-V215 HydrophobicContact CZ3-CG2 4.26Å; W209-L227 HydrophobicContact CZ3-CD2 4.2Å
210	M	96.4	Very high	94.1	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64.3	-38.6	175.3	-70.2	174.4	71.7	0	0	112.1	I153 F206 F207 R208 R214 V215 I219 A223 A224 L227	I153-M210 HydrophobicContact CD1-CE 3.93Å; F206-M210 VanDerWaalsContact O-CG 3.24Å; F206-M210 WeakPolarHBondContact O-CG 3.49Å; F206-M210 PolarHBondContact O-N 2.85Å; F207-M210 WeakPolarHBondContact O-CB 3.43Å; F207-M210 PolarHBondContact O-N 3.33Å; R208-M210 VanDerWaalsContact C-N 3.28Å; R208-M210 PolarHBondContact O-N 2.79Å; M210-R214 PolarHBondContact O-N 3.14Å; M210-V215 HydrophobicContact CB-CB 4.23Å; M210-V215 HydrophobicContact CB-CG2 4.07Å; M210-V215 HydrophobicContact CE-CB 4.47Å; M210-V215 HydrophobicContact CE-CG1 4.1Å; M210-V215 HydrophobicContact CG-CG2 4.18Å; M210-V215 PolarHBondContact O-N 3.24Å; M210-I219 HydrophobicContact CB-CD1 3.51Å; M210-I219 HydrophobicContact CB-CG1 4.4Å; M210-I219 HydrophobicContact CB-CG2 4.49Å; M210-I219 HydrophobicContact CE-CG1 4.48Å; M210-I219 HydrophobicContact CE-CG2 3.86Å; M210-I219 WeakPolarHBondContact O-CD1 3.37Å; M210-I219 HydrophobicContact SD-CG2 4.22Å; M210-A223 HydrophobicContact CE-CB 4.12Å; M210-A224 HydrophobicContact SD-CB 4.18Å; M210-L227 HydrophobicContact CE-CD2 4.42Å; M210-L227 HydrophobicContact CG-CD2 3.79Å; M210-L227 HydrophobicContact SD-CB 4.42Å; M210-L227 HydrophobicContact SD-CD2 3.68Å
211	V	94.8	Very high	93.8	Very high	25 Å²	25	35.3 Å²	35.3	15%	0.152	17%	0.166	C	C	.	.	H	α-helix	trans	-67.4	-52.7	175.9	175.3	0	0	0	0	110.5	F207 R208 W209 S213 R214 I219	F207-V211 HydrophobicContact CD1-CG2 3.91Å; F207-V211 HydrophobicContact CE1-CG2 3.62Å; F207-V211 HydrophobicContact CZ-CG2 4.48Å; F207-V211 WeakPolarHBondContact O-CG2 3.25Å; F207-V211 PolarHBondContact O-N 3.29Å; R208-V211 WeakPolarHBondContact O-CB 3.49Å; R208-V211 PolarHBondContact O-N 3.37Å; R208-V211 VanDerWaalsContact O-N 3.09Å; W209-V211 VanDerWaalsContact C-N 3.35Å; V211-S213 VanDerWaalsContact C-N 3.3Å; V211-S213 PolarHBondContact O-N 3.35Å; V211-R214 WeakPolarHBondContact O-CA 3.45Å; V211-R214 PolarHBondContact O-N 2.91Å; V211-I219 HydrophobicContact CB-CD1 4.21Å; V211-I219 HydrophobicContact CG2-CD1 3.57Å; V211-I219 VanDerWaalsContact N-CD1 3.33Å
212	D	93.1	Very high	93.6	Very high	89 Å²	89	36.1 Å²	36.1	48%	0.476	17%	0.17	S	C	.	.	H	α-helix	trans	-63.4	-37.1	-177.4	-71.7	-14.5	0	0	0	110.9	R208 R214	R208-D212 WeakPolarHBondContact CG-OD2 3.34Å; R208-D212 IonicContact CZ-OD2 3.94Å; R208-D212 IonicContact NE-OD2 3.93Å; R208-D212 PolarHBondContact NE-OD2 2.83Å; R208-D212 IonicContact NH2-OD1 2.78Å; R208-D212 IonicContact NH2-OD2 3.23Å; R208-D212 PolarHBondContact NH2-OD2 3.14Å; R208-D212 VanDerWaalsContact NH2-OD2 3.1Å; R208-D212 WeakPolarHBondContact O-CB 3.42Å; R208-D212 PolarHBondContact O-N 3.43Å; D212-R214 VanDerWaalsContact C-N 3.26Å; D212-R214 PolarHBondContact O-N 3.44Å
213	S	92.6	Very high	93.6	Very high	50 Å²	50	35.4 Å²	35.4	35%	0.35	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-1.6	174.8	-54.2	0	0	0	0	114	W209 V211 V215	W209-S213 WeakPolarHBondContact O-CB 3.35Å; W209-S213 PolarHBondContact O-N 2.88Å; W209-S213 PolarHBondContact O-OG 2.92Å; V211-S213 VanDerWaalsContact C-N 3.3Å; V211-S213 PolarHBondContact O-N 3.35Å; S213-V215 VanDerWaalsContact C-N 3.33Å; S213-V215 PolarHBondContact O-N 2.96Å
214	R	92.9	Very high	93.6	Very high	183 Å²	183	35.3 Å²	35.3	69%	0.691	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	43.9	-179.3	-55.5	-176.9	179.8	-171	-0.6	113.8	Q139 M210 V211 D212 A216	Q139-R214 PolarHBondContact NE2-O 3.28Å; M210-R214 PolarHBondContact O-N 3.14Å; V211-R214 WeakPolarHBondContact O-CA 3.45Å; V211-R214 PolarHBondContact O-N 2.91Å; D212-R214 VanDerWaalsContact C-N 3.26Å; D212-R214 PolarHBondContact O-N 3.44Å; R214-A216 PolarHBondContact O-N 3.47Å
215	V	93.5	Very high	93.7	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.024	16%	0.164	C	C	.	.	S	Bend	trans	-57.8	-38.9	174.3	177.1	0	0	0	0	110.1	A135 A138 Q139 S142 W209 M210 S213	A135-V215 HydrophobicContact CB-CG2 4.18Å; A138-V215 HydrophobicContact CB-CG1 4.19Å; Q139-V215 WeakPolarHBondContact CA-O 3.23Å; Q139-V215 HydrophobicContact CB-CG1 4.42Å; Q139-V215 VanDerWaalsContact CB-O 3.24Å; Q139-V215 WeakPolarHBondContact CB-O 3.12Å; Q139-V215 VanDerWaalsContact CG-O 3.28Å; Q139-V215 WeakPolarHBondContact CG-O 3.3Å; S142-V215 PolarHBondContact OG-O 3.49Å; W209-V215 HydrophobicContact CZ3-CG2 4.26Å; M210-V215 HydrophobicContact CB-CB 4.23Å; M210-V215 HydrophobicContact CB-CG2 4.07Å; M210-V215 HydrophobicContact CE-CB 4.47Å; M210-V215 HydrophobicContact CE-CG1 4.1Å; M210-V215 HydrophobicContact CG-CG2 4.18Å; M210-V215 PolarHBondContact O-N 3.24Å; S213-V215 VanDerWaalsContact C-N 3.33Å; S213-V215 PolarHBondContact O-N 2.96Å
216	A	93.3	Very high	93.8	Very high	12 Å²	12	31.6 Å²	31.6	10%	0.099	15%	0.15	C	C	.	.			trans	-151.3	162	167.4	0	0	0	0	0	110.2	S142 C148 R214 R218 I219	S142-A216 WeakPolarHBondContact OG-CB 3.34Å; C148-A216 HydrophobicContact CB-CB 3.57Å; R214-A216 PolarHBondContact O-N 3.47Å; A216-R218 VanDerWaalsContact CB-O 3.3Å; A216-R218 WeakPolarHBondContact CB-O 3.41Å; A216-R218 PolarHBondContact O-N 2.92Å; A216-I219 HydrophobicContact CB-CG1 4.3Å
217	L	90.4	Very high	93.8	Very high	103 Å²	103	31.6 Å²	31.6	54%	0.539	15%	0.15	S	C	.	.	S	Bend	trans	-58.2	-40	171	-82.8	148.6	0	0	0	111.5	A146	A146-L217 HydrophobicContact CB-CB 4.49Å; A146-L217 HydrophobicContact CB-CD1 3.88Å
218	R	92	Very high	93.9	Very high	5 Å²	5	31.4 Å²	31.4	2%	0.019	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	139.2	176.4	-63.2	178.8	-65.4	-82.1	-11	110.1	Y145 A146 K147 C148 A216 L571 A609 A610	Y145-R218 PolarHBondContact O-NH2 3.26Å; A146-R218 VanDerWaalsContact CB-NH2 3.26Å; A146-R218 PolarHBondContact O-N 3.37Å; A146-R218 PolarHBondContact O-NH2 3.3Å; K147-R218 CarbonylContact C-O 3.53Å; K147-R218 WeakPolarHBondContact CA-O 3.43Å; K147-R218 HydrophobicContact CB-CB 4.47Å; K147-R218 HydrophobicContact CG-CB 4.3Å; C148-R218 PolarHBondContact N-O 3.09Å; A216-R218 VanDerWaalsContact CB-O 3.3Å; A216-R218 WeakPolarHBondContact CB-O 3.41Å; A216-R218 PolarHBondContact O-N 2.92Å; R218-L571 PolarHBondContact NH1-O 2.98Å; R218-L571 PolarHBondContact NH2-O 3.5Å; R218-L571 VanDerWaalsContact NH2-O 3.07Å; R218-A609 HydrophobicContact CB-CB 4.49Å; R218-A609 HydrophobicContact CG-CB 3.81Å; R218-A610 HydrophobicContact CG-CB 4.17Å
219	I	93.3	Very high	94	Very high	7 Å²	7	28 Å²	28	4%	0.036	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	120.1	-175.5	-66.2	156.2	0	0	0	107.4	C148 F207 M210 V211 A216 A223 H653	C148-I219 HydrophobicContact CB-CG1 4.39Å; F207-I219 HydrophobicContact CD2-CG2 4Å; F207-I219 HydrophobicContact CE2-CB 4.16Å; F207-I219 HydrophobicContact CE2-CG2 3.77Å; F207-I219 VanDerWaalsContact CE2-O 3.27Å; F207-I219 WeakPolarHBondContact CE2-O 3.46Å; F207-I219 HydrophobicContact CZ-CB 4.18Å; F207-I219 HydrophobicContact CZ-CG2 4.26Å; F207-I219 WeakPolarHBondContact CZ-O 3.29Å; M210-I219 HydrophobicContact CB-CD1 3.51Å; M210-I219 HydrophobicContact CB-CG1 4.4Å; M210-I219 HydrophobicContact CB-CG2 4.49Å; M210-I219 HydrophobicContact CE-CG1 4.48Å; M210-I219 HydrophobicContact CE-CG2 3.86Å; M210-I219 WeakPolarHBondContact O-CD1 3.37Å; M210-I219 HydrophobicContact SD-CG2 4.22Å; V211-I219 HydrophobicContact CB-CD1 4.21Å; V211-I219 HydrophobicContact CG2-CD1 3.57Å; V211-I219 VanDerWaalsContact N-CD1 3.33Å; A216-I219 HydrophobicContact CB-CG1 4.3Å; I219-A223 HydrophobicContact CG2-CB 4.39Å; I219-H653 PolarHBondContact N-CE1 3.24Å; I219-H653 PolarHBondContact O-NE2 3.22Å
220	H	89.9	Confident	94.1	Very high	36 Å²	36	26.8 Å²	26.8	17%	0.167	13%	0.132	C	C	.	.			trans	-80.2	144.5	174.3	-168.6	-78.5	0	0	0	109.9	C148 T149 H222 A223	C148-H220 PolarHBondContact O-N 3.04Å; T149-H220 HydrophobicContact CG2-CB 4.39Å; H220-H222 VanDerWaalsContact C-N 3.29Å; H220-H222 AromaticContact CE1-CD2 3.86Å; H220-H222 AromaticContact CE1-CE1 3.56Å; H220-H222 AromaticContact CE1-CG 3.4Å; H220-H222 VanDerWaalsContact CE1-CG 3.4Å; H220-H222 AromaticContact CE1-ND1 3.2Å; H220-H222 PolarHBondContact CE1-ND1 3.44Å; H220-H222 AromaticContact CE1-NE2 3.97Å; H220-H222 WeakPolarHBondContact ND1-CB 3.46Å; H220-H222 AromaticContact ND1-CG 3.42Å; H220-H222 PolarHBondContact ND1-N 3.42Å; H220-H222 VanDerWaalsContact ND1-N 3.11Å; H220-H222 AromaticContact ND1-ND1 3.56Å; H220-H222 PolarHBondContact O-N 2.66Å; H220-A223 WeakPolarHBondContact O-CB 3.34Å; H220-A223 PolarHBondContact O-N 3.49Å
221	E	88.2	Confident	94.1	Very high	27 Å²	27	26.8 Å²	26.8	13%	0.126	13%	0.132	C	C	.	.	H	α-helix	trans	-60.2	-37	-177.4	60.3	171.9	-167.6	0	0	113.8	Y180 K193 A223 A224 I225 H717	Y180-E221 WeakPolarHBondContact CE1-OE1 3.28Å; Y180-E221 PolarHBondContact OH-OE1 2.86Å; Y180-E221 PolarHBondContact OH-OE2 3.06Å; K193-E221 IonicContact NZ-OE2 3.31Å; K193-E221 PolarHBondContact NZ-OE2 3.17Å; E221-A223 PolarHBondContact O-N 2.73Å; E221-A224 PolarHBondContact O-N 2.99Å; E221-A224 VanDerWaalsContact O-N 3.09Å; E221-I225 PolarHBondContact O-N 3.38Å; E221-H717 IonicContact OE2-CE1 3.1Å
222	H	91.1	Very high	94.2	Very high	17 Å²	17	25.8 Å²	25.8	8%	0.079	13%	0.126	C	C	.	.	H	α-helix	trans	-56.7	-29.3	172.7	-59.5	160.9	0	0	0	113.5	K150 L177 H220 Y226	K150-H222 HydrophobicContact CB-CB 4.04Å; K150-H222 HydrophobicContact CD-CB 4.46Å; L177-H222 HydrophobicContact CD1-CB 4.36Å; L177-H222 WeakPolarHBondContact CD1-CD2 3.34Å; H220-H222 VanDerWaalsContact C-N 3.29Å; H220-H222 AromaticContact CE1-CD2 3.86Å; H220-H222 AromaticContact CE1-CE1 3.56Å; H220-H222 AromaticContact CE1-CG 3.4Å; H220-H222 VanDerWaalsContact CE1-CG 3.4Å; H220-H222 AromaticContact CE1-ND1 3.2Å; H220-H222 PolarHBondContact CE1-ND1 3.44Å; H220-H222 AromaticContact CE1-NE2 3.97Å; H220-H222 WeakPolarHBondContact ND1-CB 3.46Å; H220-H222 AromaticContact ND1-CG 3.42Å; H220-H222 PolarHBondContact ND1-N 3.42Å; H220-H222 VanDerWaalsContact ND1-N 3.11Å; H220-H222 AromaticContact ND1-ND1 3.56Å; H220-H222 PolarHBondContact O-N 2.66Å; H222-Y226 WeakPolarHBondContact O-CB 3.48Å; H222-Y226 VanDerWaalsContact O-CD2 3.31Å; H222-Y226 WeakPolarHBondContact O-CD2 3.47Å; H222-Y226 PolarHBondContact O-N 2.88Å
223	A	94.2	Very high	94.3	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-67.4	-44.8	175.8	0	0	0	0	0	110.9	C148 I153 M210 I219 H220 E221 Y226 L227	C148-A223 WeakPolarHBondContact O-CB 3.29Å; I153-A223 HydrophobicContact CG1-CB 3.89Å; M210-A223 HydrophobicContact CE-CB 4.12Å; I219-A223 HydrophobicContact CG2-CB 4.39Å; H220-A223 WeakPolarHBondContact O-CB 3.34Å; H220-A223 PolarHBondContact O-N 3.49Å; E221-A223 PolarHBondContact O-N 2.73Å; A223-Y226 PolarHBondContact O-N 3.23Å; A223-L227 PolarHBondContact O-N 3.41Å
224	A	96.4	Very high	94.5	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-64	-40.6	176.2	0	0	0	0	0	111.9	V203 F207 M210 E221 Y226 L227 C228	V203-A224 HydrophobicContact CG1-CB 4.22Å; F207-A224 HydrophobicContact CB-CB 3.77Å; F207-A224 HydrophobicContact CD2-CB 3.86Å; F207-A224 HydrophobicContact CG-CB 4.3Å; M210-A224 HydrophobicContact SD-CB 4.18Å; E221-A224 PolarHBondContact O-N 2.99Å; E221-A224 VanDerWaalsContact O-N 3.09Å; A224-Y226 PolarHBondContact O-N 2.68Å; A224-L227 PolarHBondContact O-N 2.98Å; A224-C228 WeakPolarHBondContact O-CB 3.22Å; A224-C228 PolarHBondContact O-N 3.48Å
225	I	95.6	Very high	94.6	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-59.8	-46.9	174	-64.4	170.2	0	0	0	110.5	A176 L177 Y180 V203 E221 C228 A229	A176-I225 HydrophobicContact CB-CG2 4.17Å; L177-I225 HydrophobicContact CD1-CD1 4.31Å; Y180-I225 HydrophobicContact CD1-CD1 3.78Å; Y180-I225 HydrophobicContact CD2-CD1 4.07Å; Y180-I225 HydrophobicContact CE1-CD1 4.12Å; Y180-I225 HydrophobicContact CE2-CD1 4.41Å; Y180-I225 HydrophobicContact CG-CD1 3.75Å; V203-I225 HydrophobicContact CG1-CG1 3.74Å; V203-I225 HydrophobicContact CG2-CG1 4.42Å; E221-I225 PolarHBondContact O-N 3.38Å; I225-C228 PolarHBondContact O-N 3.19Å; I225-A229 VanDerWaalsContact O-CB 3.27Å; I225-A229 WeakPolarHBondContact O-CB 3.5Å; I225-A229 PolarHBondContact O-N 2.84Å
226	Y	96.8	Very high	94.6	Very high	2 Å²	2	14.2 Å²	14.2	1%	0.008	7%	0.069	C	C	.	.	H	α-helix	trans	-62	-46	179.2	-95.1	-125.4	0	0	0	112.2	K150 Q154 A173 L174 L177 H222 A223 A224 C230	K150-Y226 HydrophobicContact CB-CD1 4.09Å; K150-Y226 HydrophobicContact CB-CD2 3.83Å; K150-Y226 HydrophobicContact CB-CE1 4.05Å; K150-Y226 HydrophobicContact CB-CE2 3.82Å; K150-Y226 HydrophobicContact CB-CG 3.96Å; K150-Y226 HydrophobicContact CD-CE2 4.17Å; Q154-Y226 HydrophobicContact CB-CD1 4.29Å; Q154-Y226 HydrophobicContact CB-CE1 4.12Å; A173-Y226 HydrophobicContact CB-CD1 3.81Å; A173-Y226 HydrophobicContact CB-CD2 4.03Å; A173-Y226 HydrophobicContact CB-CE1 4.13Å; A173-Y226 HydrophobicContact CB-CE2 4.3Å; A173-Y226 HydrophobicContact CB-CG 3.78Å; L174-Y226 WeakPolarHBondContact CD2-OH 3.44Å; L177-Y226 HydrophobicContact CB-CE2 4Å; L177-Y226 HydrophobicContact CD2-CE2 3.63Å; L177-Y226 HydrophobicContact CG-CE2 4.37Å; H222-Y226 WeakPolarHBondContact O-CB 3.48Å; H222-Y226 VanDerWaalsContact O-CD2 3.31Å; H222-Y226 WeakPolarHBondContact O-CD2 3.47Å; H222-Y226 PolarHBondContact O-N 2.88Å; A223-Y226 PolarHBondContact O-N 3.23Å; A224-Y226 PolarHBondContact O-N 2.68Å; Y226-C230 WeakPolarHBondContact O-CB 3.48Å; Y226-C230 PolarHBondContact O-N 3.26Å
227	L	98.1	Very high	94.6	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-65.9	-44.5	-179.7	-172.5	61.1	0	0	0	111.1	L131 V134 I153 F206 W209 M210 A223 A224 C230 M231	L131-L227 HydrophobicContact CD1-CD1 4Å; L131-L227 HydrophobicContact CD1-CD2 3.98Å; L131-L227 HydrophobicContact CD1-CG 4.09Å; V134-L227 HydrophobicContact CB-CD1 4.5Å; V134-L227 HydrophobicContact CG1-CD1 3.8Å; I153-L227 HydrophobicContact CD1-CB 4.38Å; I153-L227 HydrophobicContact CG2-CB 4.27Å; F206-L227 HydrophobicContact CD1-CB 4.37Å; F206-L227 HydrophobicContact CD1-CD2 4.07Å; F206-L227 HydrophobicContact CD1-CG 3.93Å; F206-L227 HydrophobicContact CE1-CG 4.1Å; W209-L227 HydrophobicContact CZ3-CD2 4.2Å; M210-L227 HydrophobicContact CE-CD2 4.42Å; M210-L227 HydrophobicContact CG-CD2 3.79Å; M210-L227 HydrophobicContact SD-CB 4.42Å; M210-L227 HydrophobicContact SD-CD2 3.68Å; A223-L227 PolarHBondContact O-N 3.41Å; A224-L227 PolarHBondContact O-N 2.98Å; L227-C230 WeakPolarHBondContact O-CB 3.26Å; L227-C230 PolarHBondContact O-N 2.89Å; L227-M231 HydrophobicContact CD1-CE 3.8Å; L227-M231 WeakPolarHBondContact O-CG 3.35Å; L227-M231 PolarHBondContact O-N 2.87Å
228	C	98.1	Very high	94.7	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-59.7	-50.9	177.4	-174.6	0	0	0	0	111.6	L199 F201 V203 F206 A224 I225 C230 M231 E232	L199-C228 HydrophobicContact CD1-CB 4.29Å; F201-C228 WeakPolarHBondContact CB-SG 3.48Å; V203-C228 HydrophobicContact CG2-CB 4.28Å; F206-C228 HydrophobicContact CB-CB 4.23Å; F206-C228 HydrophobicContact CD1-CB 4.29Å; F206-C228 HydrophobicContact CD2-CB 3.93Å; F206-C228 HydrophobicContact CE2-CB 4.33Å; F206-C228 HydrophobicContact CG-CB 3.89Å; A224-C228 WeakPolarHBondContact O-CB 3.22Å; A224-C228 PolarHBondContact O-N 3.48Å; I225-C228 PolarHBondContact O-N 3.19Å; C228-C230 VanDerWaalsContact C-N 3.35Å; C228-C230 PolarHBondContact O-N 3.43Å; C228-M231 PolarHBondContact O-N 3.29Å; C228-E232 PolarHBondContact O-N 3.31Å
229	A	97.6	Very high	94.7	Very high	2 Å²	2	10 Å²	10	2%	0.017	5%	0.045	C	C	.	.	H	α-helix	trans	-64.9	-37.7	178.4	0	0	0	0	0	112.4	A173 A176 L199 I225 E232 S233	A173-A229 HydrophobicContact CB-CB 4.11Å; A176-A229 HydrophobicContact CB-CB 3.96Å; L199-A229 HydrophobicContact CD1-CB 4.11Å; L199-A229 HydrophobicContact CD2-CB 3.91Å; I225-A229 VanDerWaalsContact O-CB 3.27Å; I225-A229 WeakPolarHBondContact O-CB 3.5Å; I225-A229 PolarHBondContact O-N 2.84Å; A229-E232 PolarHBondContact O-N 3.11Å; A229-S233 VanDerWaalsContact O-CB 3.31Å; A229-S233 WeakPolarHBondContact O-CB 3.24Å; A229-S233 PolarHBondContact O-N 3.21Å
230	C	97.6	Very high	94.5	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-60	-47.8	174.2	178.8	0	0	0	0	111.1	I157 C169 Y226 L227 C228 S233 L234	I157-C230 HydrophobicContact CD1-CB 3.67Å; I157-C230 VanDerWaalsContact CD1-SG 3.58Å; I157-C230 HydrophobicContact CG1-CB 4.37Å; C169-C230 HydrophobicContact CB-CB 4.34Å; Y226-C230 WeakPolarHBondContact O-CB 3.48Å; Y226-C230 PolarHBondContact O-N 3.26Å; L227-C230 WeakPolarHBondContact O-CB 3.26Å; L227-C230 PolarHBondContact O-N 2.89Å; C228-C230 VanDerWaalsContact C-N 3.35Å; C228-C230 PolarHBondContact O-N 3.43Å; C230-S233 PolarHBondContact O-N 3.44Å; C230-L234 VanDerWaalsContact O-CB 3.31Å; C230-L234 WeakPolarHBondContact O-CB 3.36Å; C230-L234 PolarHBondContact O-N 3.06Å
231	M	97.6	Very high	94.4	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-65.9	-44.9	179.5	-65.3	-55.6	131.7	0	0	111.3	W95 I127 L131 V134 F201 F206 L227 C228 S233 L234 F235	W95-M231 HydrophobicContact CZ3-CB 4.37Å; W95-M231 HydrophobicContact CZ3-CG 4.22Å; I127-M231 HydrophobicContact CG2-SD 4.39Å; L131-M231 HydrophobicContact CB-CE 4.43Å; L131-M231 HydrophobicContact CB-SD 3.94Å; L131-M231 HydrophobicContact CD1-CE 4.19Å; L131-M231 HydrophobicContact CD1-CG 4.09Å; L131-M231 HydrophobicContact CD1-SD 4.19Å; V134-M231 HydrophobicContact CB-CE 4.28Å; V134-M231 HydrophobicContact CG2-CE 4.19Å; F201-M231 HydrophobicContact CD2-CB 4.49Å; F201-M231 HydrophobicContact CE2-CB 4.28Å; F206-M231 HydrophobicContact CE1-CB 4.16Å; F206-M231 HydrophobicContact CE1-CG 3.75Å; F206-M231 HydrophobicContact CZ-CB 3.85Å; F206-M231 HydrophobicContact CZ-CG 3.93Å; L227-M231 HydrophobicContact CD1-CE 3.8Å; L227-M231 WeakPolarHBondContact O-CG 3.35Å; L227-M231 PolarHBondContact O-N 2.87Å; C228-M231 PolarHBondContact O-N 3.29Å; M231-S233 VanDerWaalsContact C-N 3.27Å; M231-S233 PolarHBondContact O-N 2.67Å; M231-L234 PolarHBondContact O-N 3.22Å; M231-L234 VanDerWaalsContact O-N 3.1Å; M231-L234 HydrophobicContact SD-CD2 4.31Å; M231-F235 VanDerWaalsContact O-CD2 3.23Å; M231-F235 WeakPolarHBondContact O-CD2 3.35Å; M231-F235 PolarHBondContact O-N 3.34Å
232	E	96.4	Very high	94.4	Very high	4 Å²	4	8.6 Å²	8.6	2%	0.019	4%	0.037	C	C	.	.	H	α-helix	trans	-58.7	-37.8	175.9	-172.2	169.8	143.1	0	0	112.1	A103 K106 V200 F201 C228 A229 R236	A103-E232 HydrophobicContact CB-CG 3.87Å; K106-E232 IonicContact NZ-OE1 3.49Å; K106-E232 PolarHBondContact NZ-OE1 2.95Å; V200-E232 PolarHBondContact N-OE1 2.86Å; V200-E232 PolarHBondContact N-OE2 3.37Å; F201-E232 HydrophobicContact CD2-CB 3.95Å; F201-E232 HydrophobicContact CE2-CB 4.15Å; F201-E232 HydrophobicContact CG-CB 4.44Å; F201-E232 PolarHBondContact N-OE2 3.4Å; F201-E232 VanDerWaalsContact N-OE2 3.15Å; C228-E232 PolarHBondContact O-N 3.31Å; A229-E232 PolarHBondContact O-N 3.11Å; E232-R236 PolarHBondContact O-N 3.02Å; E232-R236 PolarHBondContact O-NE 3.15Å
233	S	95.8	Very high	94.2	Very high	10 Å²	10	8.4 Å²	8.4	7%	0.07	4%	0.037	C	C	.	.	H	α-helix	trans	-69.7	-41.2	174	-160.4	0	0	0	0	112.3	A229 C230 M231 F235 R236 E237	A229-S233 VanDerWaalsContact O-CB 3.31Å; A229-S233 WeakPolarHBondContact O-CB 3.24Å; A229-S233 PolarHBondContact O-N 3.21Å; C230-S233 PolarHBondContact O-N 3.44Å; M231-S233 VanDerWaalsContact C-N 3.27Å; M231-S233 PolarHBondContact O-N 2.67Å; S233-F235 PolarHBondContact O-N 3.49Å; S233-R236 PolarHBondContact O-N 3.4Å; S233-E237 WeakPolarHBondContact O-CB 3.01Å; S233-E237 PolarHBondContact O-N 3.02Å
234	L	96.1	Very high	93.7	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-65	-38.6	179.9	-174.6	61.9	0	0	0	112.1	I127 A130 I165 C230 M231 R236 E237 V238 L275	I127-L234 HydrophobicContact CG2-CD2 4.13Å; A130-L234 HydrophobicContact CB-CD2 3.57Å; I165-L234 HydrophobicContact CG2-CD1 3.67Å; C230-L234 VanDerWaalsContact O-CB 3.31Å; C230-L234 WeakPolarHBondContact O-CB 3.36Å; C230-L234 PolarHBondContact O-N 3.06Å; M231-L234 PolarHBondContact O-N 3.22Å; M231-L234 VanDerWaalsContact O-N 3.1Å; M231-L234 HydrophobicContact SD-CD2 4.31Å; L234-R236 VanDerWaalsContact C-N 3.34Å; L234-R236 PolarHBondContact O-N 3.21Å; L234-E237 PolarHBondContact O-N 2.97Å; L234-V238 HydrophobicContact CD1-CG2 4Å; L234-V238 HydrophobicContact CG-CG2 4.3Å; L234-V238 WeakPolarHBondContact O-CB 3.43Å; L234-V238 VanDerWaalsContact O-CG2 3.3Å; L234-V238 WeakPolarHBondContact O-CG2 3.35Å; L234-V238 PolarHBondContact O-N 3.35Å; L234-L275 HydrophobicContact CD1-CD2 4.43Å
235	F	95.8	Very high	93	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-56	-47.9	171.4	-87.8	-80.6	0	0	0	111.6	W95 V100 L104 L123 I127 F201 M231 S233 F239	W95-F235 HydrophobicContact CD2-CE2 4.24Å; W95-F235 HydrophobicContact CD2-CZ 4.42Å; W95-F235 AromaticContact CE2-CE2 3.98Å; W95-F235 AromaticContact CE2-CZ 3.78Å; W95-F235 HydrophobicContact CH2-CE2 4.36Å; W95-F235 HydrophobicContact CZ2-CE2 4.07Å; W95-F235 AromaticContact CZ2-CZ 3.92Å; W95-F235 HydrophobicContact CZ2-CZ 3.92Å; W95-F235 AromaticContact NE1-CZ 3.82Å; V100-F235 HydrophobicContact CB-CE1 4.42Å; V100-F235 HydrophobicContact CG1-CD1 3.57Å; V100-F235 HydrophobicContact CG1-CE1 3.53Å; V100-F235 HydrophobicContact CG1-CG 4.39Å; V100-F235 HydrophobicContact CG1-CZ 4.32Å; V100-F235 HydrophobicContact CG2-CE1 3.93Å; V100-F235 HydrophobicContact CG2-CE2 4.43Å; V100-F235 HydrophobicContact CG2-CZ 3.89Å; L104-F235 HydrophobicContact CD2-CB 4.28Å; L123-F235 HydrophobicContact CD2-CD1 3.84Å; L123-F235 HydrophobicContact CD2-CE1 4.33Å; L123-F235 HydrophobicContact CG-CD1 3.94Å; L123-F235 HydrophobicContact CG-CE1 4.03Å; I127-F235 HydrophobicContact CB-CE1 4.17Å; I127-F235 HydrophobicContact CB-CE2 4.22Å; I127-F235 HydrophobicContact CB-CZ 3.91Å; I127-F235 HydrophobicContact CD1-CB 4.18Å; I127-F235 HydrophobicContact CD1-CD1 3.41Å; I127-F235 VanDerWaalsContact CD1-CD1 3.41Å; I127-F235 HydrophobicContact CD1-CD2 4.14Å; I127-F235 HydrophobicContact CD1-CE1 3.7Å; I127-F235 HydrophobicContact CD1-CE2 4.37Å; I127-F235 HydrophobicContact CD1-CG 3.64Å; I127-F235 HydrophobicContact CD1-CZ 4.16Å; I127-F235 HydrophobicContact CG1-CE1 4.4Å; I127-F235 HydrophobicContact CG2-CD2 4.03Å; I127-F235 HydrophobicContact CG2-CE1 4.43Å; I127-F235 HydrophobicContact CG2-CE2 3.62Å; I127-F235 HydrophobicContact CG2-CZ 3.83Å; F201-F235 AromaticContact CE2-CD2 3.66Å; F201-F235 HydrophobicContact CE2-CD2 3.66Å; F201-F235 AromaticContact CE2-CE2 3.8Å; F201-F235 HydrophobicContact CE2-CE2 3.8Å; F201-F235 AromaticContact CZ-CD2 3.61Å; F201-F235 HydrophobicContact CZ-CD2 3.61Å; F201-F235 AromaticContact CZ-CE2 3.75Å; F201-F235 HydrophobicContact CZ-CE2 3.75Å; F201-F235 HydrophobicContact CZ-CG 4.36Å; M231-F235 VanDerWaalsContact O-CD2 3.23Å; M231-F235 WeakPolarHBondContact O-CD2 3.35Å; M231-F235 PolarHBondContact O-N 3.34Å; S233-F235 PolarHBondContact O-N 3.49Å; F235-F239 WeakPolarHBondContact O-CB 3.39Å; F235-F239 PolarHBondContact O-N 2.55Å
236	R	93.2	Very high	91.5	Very high	73 Å²	73	22.1 Å²	22.1	28%	0.275	12%	0.116	S	C	.	.	H	α-helix	trans	-67.2	-40.5	179	-70.8	-175.8	-70.6	139.5	-2.6	112.7	L104 L110 E232 S233 L234 G240	L104-R236 HydrophobicContact CD2-CG 4.35Å; L110-R236 HydrophobicContact CD1-CB 3.94Å; L110-R236 HydrophobicContact CD1-CG 3.88Å; E232-R236 PolarHBondContact O-N 3.02Å; E232-R236 PolarHBondContact O-NE 3.15Å; S233-R236 PolarHBondContact O-N 3.4Å; L234-R236 VanDerWaalsContact C-N 3.34Å; L234-R236 PolarHBondContact O-N 3.21Å; R236-G240 WeakPolarHBondContact O-CA 3.31Å; R236-G240 PolarHBondContact O-N 3.36Å
237	E	91.8	Very high	89.9	Confident	32 Å²	32	25.5 Å²	25.5	15%	0.15	13%	0.134	C	C	.	.	H	α-helix	trans	-65.5	-49.1	179.6	-175.2	72.2	-155.5	0	0	111.5	I165 N168 S233 L234 R241	I165-E237 HydrophobicContact CG1-CG 4.05Å; I165-E237 HydrophobicContact CG2-CG 4.38Å; N168-E237 PolarHBondContact ND2-OE2 3.45Å; S233-E237 WeakPolarHBondContact O-CB 3.01Å; S233-E237 PolarHBondContact O-N 3.02Å; L234-E237 PolarHBondContact O-N 2.97Å; E237-R241 WeakPolarHBondContact O-CB 3.39Å; E237-R241 VanDerWaalsContact O-CG 3.28Å; E237-R241 WeakPolarHBondContact O-CG 3.35Å; E237-R241 PolarHBondContact O-N 2.7Å; E237-R241 IonicContact OE1-CZ 2.61Å; E237-R241 IonicContact OE1-NE 2.73Å; E237-R241 PolarHBondContact OE1-NE 3.06Å; E237-R241 IonicContact OE1-NH2 3.56Å; E237-R241 PolarHBondContact OE1-NH2 3.27Å
238	V	92.8	Very high	88.6	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.2	-47.7	178.5	174.1	0	0	0	0	110.3	L123 I127 L234 R241 V242 I266 I272 L276	L123-V238 HydrophobicContact CD1-CB 4.37Å; L123-V238 HydrophobicContact CD1-CG1 3.68Å; I127-V238 HydrophobicContact CD1-CB 4.26Å; I127-V238 HydrophobicContact CD1-CG2 4.29Å; L234-V238 HydrophobicContact CD1-CG2 4Å; L234-V238 HydrophobicContact CG-CG2 4.3Å; L234-V238 WeakPolarHBondContact O-CB 3.43Å; L234-V238 VanDerWaalsContact O-CG2 3.3Å; L234-V238 WeakPolarHBondContact O-CG2 3.35Å; L234-V238 PolarHBondContact O-N 3.35Å; V238-R241 PolarHBondContact O-N 3.34Å; V238-V242 WeakPolarHBondContact O-CG2 3.36Å; V238-V242 PolarHBondContact O-N 3.13Å; V238-I266 HydrophobicContact CG1-CD1 4.46Å; V238-I272 HydrophobicContact CG1-CD1 4.39Å; V238-I272 HydrophobicContact CG2-CG2 4.29Å; V238-L276 HydrophobicContact CG1-CD1 4.35Å
239	F	91.7	Very high	87.3	Confident	1 Å²	1	33.4 Å²	33.4	0%	0.004	17%	0.171	C	C	.	.	H	α-helix	trans	-67	-40.3	-179.4	-169.9	-110	0	0	0	112.5	L104 L110 P115 L123 F235 R241 V242 L243 I257	L104-F239 HydrophobicContact CD1-CD1 4.09Å; L104-F239 HydrophobicContact CD1-CD2 4.25Å; L104-F239 HydrophobicContact CD1-CE1 4.3Å; L104-F239 HydrophobicContact CD1-CE2 4.47Å; L104-F239 HydrophobicContact CD1-CG 4.05Å; L104-F239 HydrophobicContact CD1-CZ 4.48Å; L104-F239 HydrophobicContact CD2-CB 3.69Å; L104-F239 HydrophobicContact CD2-CD1 3.9Å; L104-F239 HydrophobicContact CD2-CG 3.91Å; L104-F239 HydrophobicContact CG-CD1 4.41Å; L110-F239 HydrophobicContact CB-CD1 4.36Å; L110-F239 HydrophobicContact CB-CE1 4.47Å; L110-F239 HydrophobicContact CD2-CD1 4.17Å; P115-F239 HydrophobicContact CB-CE2 3.99Å; P115-F239 HydrophobicContact CB-CZ 3.95Å; P115-F239 HydrophobicContact CG-CE2 4.36Å; P115-F239 HydrophobicContact CG-CZ 3.98Å; L123-F239 HydrophobicContact CD2-CB 4.26Å; L123-F239 HydrophobicContact CD2-CD2 4.13Å; F235-F239 WeakPolarHBondContact O-CB 3.39Å; F235-F239 PolarHBondContact O-N 2.55Å; F239-R241 VanDerWaalsContact C-N 3.33Å; F239-R241 PolarHBondContact O-N 3.28Å; F239-V242 WeakPolarHBondContact O-CB 3.31Å; F239-V242 PolarHBondContact O-N 3.34Å; F239-L243 HydrophobicContact CD1-CD1 3.85Å; F239-L243 HydrophobicContact CD1-CG 4.36Å; F239-L243 HydrophobicContact CE1-CD1 3.6Å; F239-L243 HydrophobicContact CE1-CG 4.12Å; F239-L243 HydrophobicContact CZ-CD1 4.33Å; F239-L243 HydrophobicContact CZ-CG 4.43Å; F239-L243 PolarHBondContact O-N 3.34Å; F239-I257 HydrophobicContact CE1-CD1 4.32Å; F239-I257 HydrophobicContact CE2-CD1 3.45Å; F239-I257 VanDerWaalsContact CE2-CD1 3.45Å; F239-I257 HydrophobicContact CZ-CD1 3.28Å
240	G	89.8	Confident	86.2	Confident	2 Å²	2	41.5 Å²	41.5	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-63.5	-36.7	175.7	0	0	0	0	0	113	R236 L243 R244	R236-G240 WeakPolarHBondContact O-CA 3.31Å; R236-G240 PolarHBondContact O-N 3.36Å; G240-L243 PolarHBondContact O-N 3.38Å; G240-R244 WeakPolarHBondContact O-CG 3.48Å; G240-R244 PolarHBondContact O-N 2.84Å
241	R	88.6	Confident	84.7	Confident	36 Å²	36	46.5 Å²	46.5	14%	0.136	23%	0.228	C	C	.	.	H	α-helix	trans	-66.4	-42.5	172.8	-75	170.2	176.3	-111.4	1.4	112	E237 V238 F239 L243 R244 S245 D269 E271	E237-R241 WeakPolarHBondContact O-CB 3.39Å; E237-R241 VanDerWaalsContact O-CG 3.28Å; E237-R241 WeakPolarHBondContact O-CG 3.35Å; E237-R241 PolarHBondContact O-N 2.7Å; E237-R241 IonicContact OE1-CZ 2.61Å; E237-R241 IonicContact OE1-NE 2.73Å; E237-R241 PolarHBondContact OE1-NE 3.06Å; E237-R241 IonicContact OE1-NH2 3.56Å; E237-R241 PolarHBondContact OE1-NH2 3.27Å; V238-R241 PolarHBondContact O-N 3.34Å; F239-R241 VanDerWaalsContact C-N 3.33Å; F239-R241 PolarHBondContact O-N 3.28Å; R241-L243 VanDerWaalsContact C-N 3.34Å; R241-L243 PolarHBondContact O-N 3.49Å; R241-R244 PolarHBondContact O-N 3.46Å; R241-S245 PolarHBondContact O-N 2.98Å; R241-S245 VanDerWaalsContact O-N 3.13Å; R241-D269 WeakPolarHBondContact CD-OD2 3.14Å; R241-D269 IonicContact CZ-OD2 2.59Å; R241-D269 IonicContact NH1-OD1 3.2Å; R241-D269 IonicContact NH1-OD2 2.65Å; R241-D269 PolarHBondContact NH1-OD2 3.3Å; R241-E271 IonicContact CZ-OE2 2.88Å; R241-E271 IonicContact NH1-OE2 3.73Å; R241-E271 PolarHBondContact NH1-OE2 3.49Å; R241-E271 IonicContact NH2-OE1 2.6Å; R241-E271 IonicContact NH2-OE2 2.63Å; R241-E271 PolarHBondContact NH2-OE2 3.39Å
242	V	88.6	Confident	83.2	Confident	1 Å²	1	54 Å²	54	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-58.3	-47.3	173.6	171.2	0	0	0	0	110.6	V238 F239 R244 S245 V248 M262 A265 I266	V238-V242 WeakPolarHBondContact O-CG2 3.36Å; V238-V242 PolarHBondContact O-N 3.13Å; F239-V242 WeakPolarHBondContact O-CB 3.31Å; F239-V242 PolarHBondContact O-N 3.34Å; V242-R244 VanDerWaalsContact C-N 3.34Å; V242-R244 PolarHBondContact O-N 3.34Å; V242-S245 WeakPolarHBondContact O-CB 3.35Å; V242-S245 PolarHBondContact O-N 2.92Å; V242-S245 VanDerWaalsContact O-N 3.16Å; V242-V248 WeakPolarHBondContact O-CG2 3.42Å; V242-M262 HydrophobicContact CG1-CB 4.09Å; V242-M262 HydrophobicContact CG1-CG 4.06Å; V242-M262 HydrophobicContact CG2-CG 3.99Å; V242-A265 HydrophobicContact CB-CB 4.43Å; V242-A265 HydrophobicContact CG1-CB 4.29Å; V242-A265 HydrophobicContact CG2-CB 4.22Å; V242-I266 HydrophobicContact CG2-CD1 4.46Å; V242-I266 HydrophobicContact CG2-CG1 3.98Å
243	L	85.3	Confident	81.9	Confident	14 Å²	14	56.1 Å²	56.1	7%	0.073	29%	0.29	C	S	.	.	H	α-helix	trans	-62.9	-34.5	178.9	-80.8	177.3	0	0	0	114.5	L110 F239 G240 R241 S245 P255 I257	L110-L243 HydrophobicContact CB-CD1 4.4Å; L110-L243 HydrophobicContact CD2-CD1 3.6Å; F239-L243 HydrophobicContact CD1-CD1 3.85Å; F239-L243 HydrophobicContact CD1-CG 4.36Å; F239-L243 HydrophobicContact CE1-CD1 3.6Å; F239-L243 HydrophobicContact CE1-CG 4.12Å; F239-L243 HydrophobicContact CZ-CD1 4.33Å; F239-L243 HydrophobicContact CZ-CG 4.43Å; F239-L243 PolarHBondContact O-N 3.34Å; G240-L243 PolarHBondContact O-N 3.38Å; R241-L243 VanDerWaalsContact C-N 3.34Å; R241-L243 PolarHBondContact O-N 3.49Å; L243-S245 VanDerWaalsContact C-N 3.3Å; L243-P255 HydrophobicContact CD2-CB 3.81Å; L243-P255 HydrophobicContact CD2-CG 3.64Å; L243-I257 HydrophobicContact CD2-CD1 3.49Å; L243-I257 VanDerWaalsContact CD2-CD1 3.49Å; L243-I257 HydrophobicContact CD2-CG1 4Å; L243-I257 HydrophobicContact CG-CD1 4.2Å
244	R	84	Confident	80.7	Confident	154 Å²	154	60.1 Å²	60.1	58%	0.581	31%	0.31	S	S	*	.	H	α-helix	trans	-81.2	-10.6	178.3	-68.9	179.5	-167.2	118.1	3.2	112.9	E109 G240 R241 V242 A246	E109-R244 IonicContact OE2-NH2 2.86Å; E109-R244 PolarHBondContact OE2-NH2 3.45Å; G240-R244 WeakPolarHBondContact O-CG 3.48Å; G240-R244 PolarHBondContact O-N 2.84Å; R241-R244 PolarHBondContact O-N 3.46Å; V242-R244 VanDerWaalsContact C-N 3.34Å; V242-R244 PolarHBondContact O-N 3.34Å; R244-A246 PolarHBondContact O-N 3.46Å
245	S	83.1	Confident	79.6	Confident	29 Å²	29	60.7 Å²	60.7	20%	0.203	31%	0.314	C	S	.	.	S	Bend	trans	-60	132.9	176.3	-177.5	0	0	0	0	110.7	R241 V242 L243 L247 V248	R241-S245 PolarHBondContact O-N 2.98Å; R241-S245 VanDerWaalsContact O-N 3.13Å; V242-S245 WeakPolarHBondContact O-CB 3.35Å; V242-S245 PolarHBondContact O-N 2.92Å; V242-S245 VanDerWaalsContact O-N 3.16Å; L243-S245 VanDerWaalsContact C-N 3.3Å; S245-L247 PolarHBondContact O-N 3.26Å; S245-L247 PolarHBondContact OG-N 3.31Å; S245-V248 PolarHBondContact O-N 2.99Å
246	A	62.4	Low	78.7	Confident	105 Å²	105	67 Å²	67	87%	0.868	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-10.5	177.4	0	0	0	0	0	113.5	R244	R244-A246 PolarHBondContact O-N 3.46Å
247	L	64.5	Low	78.1	Confident	73 Å²	73	64.4 Å²	64.4	38%	0.382	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-6.4	-178.4	-58.7	172	0	0	0	113.3	S245 E249 Q264 N268	S245-L247 PolarHBondContact O-N 3.26Å; S245-L247 PolarHBondContact OG-N 3.31Å; L247-E249 PolarHBondContact O-N 3.32Å; L247-Q264 HydrophobicContact CD1-CB 4.47Å; L247-Q264 HydrophobicContact CD1-CG 3.87Å; L247-N268 WeakPolarHBondContact CD1-ND2 3.23Å
248	V	70	Confident	77.8	Confident	10 Å²	10	65.9 Å²	65.9	6%	0.061	34%	0.344	C	S	.	.	S	Bend	trans	-85	110.8	176	-179.7	0	0	0	0	109.4	V242 S245 P255	V242-V248 WeakPolarHBondContact O-CG2 3.42Å; S245-V248 PolarHBondContact O-N 2.99Å; V248-P255 HydrophobicContact CG1-CB 3.61Å
249	E	70.1	Confident	77.5	Confident	155 Å²	155	69.1 Å²	69.1	72%	0.724	36%	0.361	S	S	*	.			trans	-60.6	136.7	174	-66	-174.1	167.6	0	0	110.6	L247 K256	L247-E249 PolarHBondContact O-N 3.32Å; E249-K256 PolarHBondContact O-N 3.45Å
250	R	76.3	Confident	77.3	Confident	173 Å²	173	76.3 Å²	76.3	65%	0.653	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.1	115.9	177.9	-63.6	-173.5	-179.7	-152.2	-1.8	109.6	I254	R250-I254 WeakPolarHBondContact CA-O 3.44Å
251	D	65.8	Low	77.1	Confident	104 Å²	104	76.8 Å²	76.8	56%	0.556	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.2	117.7	172.9	-167.3	4.7	0	0	0	108.8	G253 I254	D251-G253 PolarHBondContact O-N 2.95Å; D251-I254 PolarHBondContact N-O 3.13Å; D251-I254 WeakPolarHBondContact O-CB 3.42Å; D251-I254 PolarHBondContact O-N 3.08Å
252	N	65	Low	77.2	Confident	159 Å²	159	75 Å²	75	85%	0.85	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	30	-173.6	-63.6	-34.2	0	0	0	115.1	I254	N252-I254 VanDerWaalsContact C-N 3.35Å
253	G	68.9	Low	77.3	Confident	47 Å²	47	78.2 Å²	78.2	49%	0.485	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	-5.4	-177.9	0	0	0	0	0	115.1	D251	D251-G253 PolarHBondContact O-N 2.95Å
254	I	70.4	Confident	77.5	Confident	94 Å²	94	82.5 Å²	82.5	48%	0.482	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	122.2	176.2	-58	176.4	0	0	0	108.7	L112 R250 D251 N252 K256	L112-I254 VanDerWaalsContact O-CG2 3.27Å; L112-I254 WeakPolarHBondContact O-CG2 3.4Å; R250-I254 WeakPolarHBondContact CA-O 3.44Å; D251-I254 PolarHBondContact N-O 3.13Å; D251-I254 WeakPolarHBondContact O-CB 3.42Å; D251-I254 PolarHBondContact O-N 3.08Å; N252-I254 VanDerWaalsContact C-N 3.35Å; I254-K256 PolarHBondContact O-N 2.91Å
255	P	73.3	Confident	77.8	Confident	13 Å²	13	75.5 Å²	75.5	8%	0.084	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	124.2	177.1	23.6	-27.5	0	0	0	111	L112 L243 V248	L112-P255 HydrophobicContact CB-CG 4.45Å; L243-P255 HydrophobicContact CD2-CB 3.81Å; L243-P255 HydrophobicContact CD2-CG 3.64Å; V248-P255 HydrophobicContact CG1-CB 3.61Å
256	K	77.9	Confident	78.3	Confident	133 Å²	133	74.5 Å²	74.5	58%	0.578	39%	0.392	S	S	*	.			trans	-95.1	108	175.7	-170.5	178.7	179.8	-177.1	0	109.6	E249 I254	E249-K256 PolarHBondContact O-N 3.45Å; I254-K256 PolarHBondContact O-N 2.91Å
257	I	80.2	Confident	79.6	Confident	18 Å²	18	71.1 Å²	71.1	9%	0.092	36%	0.363	C	S	.	.			trans	-94.1	118.1	-176.7	-49.8	175.1	0	0	0	109.6	V119 F239 L243 M262	V119-I257 HydrophobicContact CG1-CG2 4.11Å; V119-I257 HydrophobicContact CG2-CG2 4.4Å; F239-I257 HydrophobicContact CE1-CD1 4.32Å; F239-I257 HydrophobicContact CE2-CD1 3.45Å; F239-I257 VanDerWaalsContact CE2-CD1 3.45Å; F239-I257 HydrophobicContact CZ-CD1 3.28Å; L243-I257 HydrophobicContact CD2-CD1 3.49Å; L243-I257 VanDerWaalsContact CD2-CD1 3.49Å; L243-I257 HydrophobicContact CD2-CG1 4Å; L243-I257 HydrophobicContact CG-CD1 4.2Å; I257-M262 HydrophobicContact CG2-CB 4.43Å
258	T	85.3	Confident	80.9	Confident	62 Å²	62	71.4 Å²	71.4	38%	0.38	37%	0.365	S	S	.	.			trans	-105.1	164.3	169.4	63.5	0	0	0	0	109.3	E260 S261 M262	T258-E260 VanDerWaalsContact C-N 3.27Å; T258-E260 PolarHBondContact O-N 3.14Å; T258-S261 PolarHBondContact N-OG 3.48Å; T258-S261 VanDerWaalsContact N-OG 3.11Å; T258-S261 PolarHBondContact O-N 3.04Å; T258-S261 PolarHBondContact O-OG 3.35Å; T258-S261 PolarHBondContact OG1-N 2.95Å; T258-S261 PolarHBondContact OG1-OG 3.23Å; T258-M262 PolarHBondContact O-N 3.32Å; T258-M262 VanDerWaalsContact O-N 3.13Å
259	L	87	Confident	81.8	Confident	69 Å²	69	72.5 Å²	72.5	36%	0.361	37%	0.37	S	S	.	.	H	α-helix	trans	-58.3	-43.9	175.5	-166.7	70	0	0	0	111.1	R122 M262 E263	R122-L259 HydrophobicContact CB-CD1 3.58Å; R122-L259 HydrophobicContact CG-CD1 3.61Å; L259-M262 HydrophobicContact CD1-CE 4.02Å; L259-M262 PolarHBondContact O-N 2.78Å; L259-E263 WeakPolarHBondContact O-CG 3.4Å; L259-E263 PolarHBondContact O-N 2.84Å
260	E	86.4	Confident	82.7	Confident	152 Å²	152	65.8 Å²	65.8	71%	0.71	34%	0.34	S	S	*	.	H	α-helix	trans	-63.9	-45.1	179.1	-68.3	178.3	164.6	0	0	112.4	T258 M262 E263 Q264	T258-E260 VanDerWaalsContact C-N 3.27Å; T258-E260 PolarHBondContact O-N 3.14Å; E260-M262 VanDerWaalsContact C-N 3.28Å; E260-M262 PolarHBondContact O-N 2.9Å; E260-E263 PolarHBondContact O-N 3.26Å; E260-Q264 WeakPolarHBondContact O-CB 3.31Å; E260-Q264 PolarHBondContact O-N 2.81Å
261	S	86.6	Confident	83.2	Confident	11 Å²	11	58.5 Å²	58.5	8%	0.077	31%	0.314	C	S	.	.	H	α-helix	trans	-66.1	-34	-179.8	71.6	0	0	0	0	111.9	T258 A265	T258-S261 PolarHBondContact N-OG 3.48Å; T258-S261 VanDerWaalsContact N-OG 3.11Å; T258-S261 PolarHBondContact O-N 3.04Å; T258-S261 PolarHBondContact O-OG 3.35Å; T258-S261 PolarHBondContact OG1-N 2.95Å; T258-S261 PolarHBondContact OG1-OG 3.23Å; S261-A265 VanDerWaalsContact O-CB 3.25Å; S261-A265 WeakPolarHBondContact O-CB 3.34Å; S261-A265 PolarHBondContact O-N 3.14Å
262	M	90.3	Very high	84.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65.4	-49.5	172	-179.2	176.5	67.6	0	0	111.9	V119 R122 L123 V242 I257 T258 L259 E260 Q264 A265 I266	V119-M262 HydrophobicContact CG1-CE 4.25Å; V119-M262 HydrophobicContact CG1-SD 3.85Å; R122-M262 HydrophobicContact CB-CE 3.8Å; R122-M262 HydrophobicContact CG-CE 3.58Å; L123-M262 HydrophobicContact CB-SD 4.37Å; V242-M262 HydrophobicContact CG1-CB 4.09Å; V242-M262 HydrophobicContact CG1-CG 4.06Å; V242-M262 HydrophobicContact CG2-CG 3.99Å; I257-M262 HydrophobicContact CG2-CB 4.43Å; T258-M262 PolarHBondContact O-N 3.32Å; T258-M262 VanDerWaalsContact O-N 3.13Å; L259-M262 HydrophobicContact CD1-CE 4.02Å; L259-M262 PolarHBondContact O-N 2.78Å; E260-M262 VanDerWaalsContact C-N 3.28Å; E260-M262 PolarHBondContact O-N 2.9Å; M262-Q264 VanDerWaalsContact C-N 3.33Å; M262-Q264 PolarHBondContact O-N 2.81Å; M262-A265 PolarHBondContact O-N 3.27Å; M262-I266 HydrophobicContact CG-CD1 3.88Å; M262-I266 WeakPolarHBondContact O-CG1 3.23Å; M262-I266 PolarHBondContact O-N 3.35Å
263	E	90.5	Very high	85.8	Confident	67 Å²	67	47.8 Å²	47.8	31%	0.313	25%	0.254	S	S	.	.	H	α-helix	trans	-64.6	-38.3	-178.9	-72	-168.4	159.6	0	0	112.1	R122 L259 E260 I266 S267	R122-E263 IonicContact CZ-OE1 3.58Å; R122-E263 IonicContact NE-OE1 2.75Å; R122-E263 PolarHBondContact NE-OE1 3.39Å; R122-E263 IonicContact NH2-OE1 3.41Å; R122-E263 PolarHBondContact NH2-OE1 3.06Å; L259-E263 WeakPolarHBondContact O-CG 3.4Å; L259-E263 PolarHBondContact O-N 2.84Å; E260-E263 PolarHBondContact O-N 3.26Å; E263-I266 PolarHBondContact O-N 3.42Å; E263-S267 VanDerWaalsContact O-CB 3.23Å; E263-S267 WeakPolarHBondContact O-CB 3.46Å; E263-S267 PolarHBondContact O-N 3.4Å; E263-S267 PolarHBondContact O-OG 2.96Å
264	Q	89.8	Confident	86.8	Confident	104 Å²	104	45.6 Å²	45.6	49%	0.486	23%	0.231	S	C	.	.	H	α-helix	trans	-68.9	-39.5	176.2	-163.5	-179.7	10.4	0	0	112	L247 E260 M262 S267 N268	L247-Q264 HydrophobicContact CD1-CB 4.47Å; L247-Q264 HydrophobicContact CD1-CG 3.87Å; E260-Q264 WeakPolarHBondContact O-CB 3.31Å; E260-Q264 PolarHBondContact O-N 2.81Å; M262-Q264 VanDerWaalsContact C-N 3.33Å; M262-Q264 PolarHBondContact O-N 2.81Å; Q264-S267 PolarHBondContact O-N 3.34Å; Q264-N268 PolarHBondContact O-N 3.05Å; Q264-N268 VanDerWaalsContact O-N 3.14Å; Q264-N268 PolarHBondContact O-ND2 3.32Å
265	A	90.6	Very high	87.9	Confident	7 Å²	7	41.4 Å²	41.4	6%	0.058	21%	0.21	C	C	.	.	H	α-helix	trans	-61.8	-46.4	174.2	0	0	0	0	0	111.5	V242 S261 M262 S267 N268 D269	V242-A265 HydrophobicContact CB-CB 4.43Å; V242-A265 HydrophobicContact CG1-CB 4.29Å; V242-A265 HydrophobicContact CG2-CB 4.22Å; S261-A265 VanDerWaalsContact O-CB 3.25Å; S261-A265 WeakPolarHBondContact O-CB 3.34Å; S261-A265 PolarHBondContact O-N 3.14Å; M262-A265 PolarHBondContact O-N 3.27Å; A265-S267 VanDerWaalsContact C-N 3.31Å; A265-S267 PolarHBondContact O-N 3.18Å; A265-N268 PolarHBondContact O-N 2.99Å; A265-D269 PolarHBondContact O-N 2.84Å
266	I	92.3	Very high	88.9	Confident	8 Å²	8	40.8 Å²	40.8	4%	0.041	21%	0.206	C	C	.	.	H	α-helix	trans	-61.9	-41.3	175.3	-67.9	170.8	0	0	0	110.7	L126 V238 V242 M262 E263 N268 D269 I272 W273 L276	L126-I266 HydrophobicContact CD1-CD1 3.7Å; V238-I266 HydrophobicContact CG1-CD1 4.46Å; V242-I266 HydrophobicContact CG2-CD1 4.46Å; V242-I266 HydrophobicContact CG2-CG1 3.98Å; M262-I266 HydrophobicContact CG-CD1 3.88Å; M262-I266 WeakPolarHBondContact O-CG1 3.23Å; M262-I266 PolarHBondContact O-N 3.35Å; E263-I266 PolarHBondContact O-N 3.42Å; I266-N268 PolarHBondContact O-N 3.49Å; I266-D269 PolarHBondContact O-N 3.5Å; I266-I272 HydrophobicContact CB-CD1 4.42Å; I266-I272 HydrophobicContact CG1-CD1 4.02Å; I266-I272 HydrophobicContact CG2-CD1 4.46Å; I266-I272 HydrophobicContact CG2-CG1 4.38Å; I266-W273 WeakPolarHBondContact O-CB 3.48Å; I266-L276 HydrophobicContact CD1-CD1 4.16Å; I266-L276 HydrophobicContact CG2-CD1 3.85Å
267	S	91.6	Very high	89.6	Confident	35 Å²	35	36.2 Å²	36.2	25%	0.245	19%	0.186	C	C	.	.	H	α-helix	trans	-64.8	-24.5	-179	-64.3	0	0	0	0	114	E263 Q264 A265 N287 S288	E263-S267 VanDerWaalsContact O-CB 3.23Å; E263-S267 WeakPolarHBondContact O-CB 3.46Å; E263-S267 PolarHBondContact O-N 3.4Å; E263-S267 PolarHBondContact O-OG 2.96Å; Q264-S267 PolarHBondContact O-N 3.34Å; A265-S267 VanDerWaalsContact C-N 3.31Å; A265-S267 PolarHBondContact O-N 3.18Å; S267-N287 WeakPolarHBondContact O-CB 3.4Å; S267-S288 VanDerWaalsContact O-CB 3.29Å; S267-S288 WeakPolarHBondContact O-CB 3.44Å; S267-S288 PolarHBondContact O-N 2.79Å; S267-S288 PolarHBondContact O-OG 3Å
268	N	90.1	Very high	90.1	Very high	79 Å²	79	36.9 Å²	36.9	42%	0.422	19%	0.191	S	C	.	.	H	α-helix	trans	-94	-13.7	179.6	-72.8	-31.9	0	0	0	113.8	L247 Q264 A265 I266	L247-N268 WeakPolarHBondContact CD1-ND2 3.23Å; Q264-N268 PolarHBondContact O-N 3.05Å; Q264-N268 VanDerWaalsContact O-N 3.14Å; Q264-N268 PolarHBondContact O-ND2 3.32Å; A265-N268 PolarHBondContact O-N 2.99Å; I266-N268 PolarHBondContact O-N 3.49Å
269	D	90.1	Very high	90.2	Very high	33 Å²	33	36.2 Å²	36.2	18%	0.176	18%	0.182	C	C	.	.			trans	-92.7	116.6	179.9	-176.2	-40.6	0	0	0	111.2	R241 A265 I266 E271 I272 W273	R241-D269 WeakPolarHBondContact CD-OD2 3.14Å; R241-D269 IonicContact CZ-OD2 2.59Å; R241-D269 IonicContact NH1-OD1 3.2Å; R241-D269 IonicContact NH1-OD2 2.65Å; R241-D269 PolarHBondContact NH1-OD2 3.3Å; A265-D269 PolarHBondContact O-N 2.84Å; I266-D269 PolarHBondContact O-N 3.5Å; D269-E271 VanDerWaalsContact C-N 3.31Å; D269-E271 PolarHBondContact O-N 2.9Å; D269-E271 WeakPolarHBondContact OD1-CA 3.5Å; D269-E271 WeakPolarHBondContact OD1-CB 3.41Å; D269-E271 PolarHBondContact OD1-N 3.13Å; D269-I272 HydrophobicContact CB-CD1 3.95Å; D269-I272 HydrophobicContact CB-CG1 3.67Å; D269-I272 PolarHBondContact OD1-N 2.93Å; D269-W273 WeakPolarHBondContact O-CB 3.45Å; D269-W273 PolarHBondContact O-N 2.83Å
270	S	87.6	Confident	90.1	Very high	13 Å²	13	37.4 Å²	37.4	9%	0.091	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-18.6	-176.7	61.4	0	0	0	0	115.4	K286 S293	S270-K286 WeakPolarHBondContact CA-O 3.31Å; S270-S293 WeakPolarHBondContact CB-OG 3.45Å; S270-S293 PolarHBondContact OG-OG 3.39Å
271	E	88.7	Confident	90.1	Very high	21 Å²	21	30.8 Å²	30.8	10%	0.098	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-32.4	-179	-67.1	-167.7	85.6	0	0	112	S162 T164 I165 R241 D269 P295	S162-E271 WeakPolarHBondContact CB-OE1 3.36Å; S162-E271 PolarHBondContact OG-OE1 3.45Å; T164-E271 WeakPolarHBondContact CB-OE1 3.41Å; T164-E271 PolarHBondContact OG1-OE1 3.09Å; I165-E271 HydrophobicContact CD1-CB 4.14Å; R241-E271 IonicContact CZ-OE2 2.88Å; R241-E271 IonicContact NH1-OE2 3.73Å; R241-E271 PolarHBondContact NH1-OE2 3.49Å; R241-E271 IonicContact NH2-OE1 2.6Å; R241-E271 IonicContact NH2-OE2 2.63Å; R241-E271 PolarHBondContact NH2-OE2 3.39Å; D269-E271 VanDerWaalsContact C-N 3.31Å; D269-E271 PolarHBondContact O-N 2.9Å; D269-E271 WeakPolarHBondContact OD1-CA 3.5Å; D269-E271 WeakPolarHBondContact OD1-CB 3.41Å; D269-E271 PolarHBondContact OD1-N 3.13Å; E271-P295 HydrophobicContact CG-CB 4.49Å; E271-P295 WeakPolarHBondContact OE1-CB 3.45Å
272	I	92.6	Very high	90.3	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-28.9	-176.5	64.6	179.8	0	0	0	113.8	I165 V238 I266 D269 G274 L275 L276	I165-I272 HydrophobicContact CD1-CG2 3.5Å; V238-I272 HydrophobicContact CG1-CD1 4.39Å; V238-I272 HydrophobicContact CG2-CG2 4.29Å; I266-I272 HydrophobicContact CB-CD1 4.42Å; I266-I272 HydrophobicContact CG1-CD1 4.02Å; I266-I272 HydrophobicContact CG2-CD1 4.46Å; I266-I272 HydrophobicContact CG2-CG1 4.38Å; D269-I272 HydrophobicContact CB-CD1 3.95Å; D269-I272 HydrophobicContact CB-CG1 3.67Å; D269-I272 PolarHBondContact OD1-N 2.93Å; I272-G274 PolarHBondContact O-N 3.24Å; I272-L275 WeakPolarHBondContact O-CB 3.44Å; I272-L275 PolarHBondContact O-N 3.41Å; I272-L276 HydrophobicContact CB-CD1 4.41Å; I272-L276 WeakPolarHBondContact O-CG 3.37Å; I272-L276 PolarHBondContact O-N 3.12Å
273	W	92.1	Very high	90.1	Very high	37 Å²	37	31 Å²	31	14%	0.14	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-53.1	-172.2	176.3	68.7	0	0	0	112.1	I266 D269 L275 L276 Q277 I283 K286 N287	I266-W273 WeakPolarHBondContact O-CB 3.48Å; D269-W273 WeakPolarHBondContact O-CB 3.45Å; D269-W273 PolarHBondContact O-N 2.83Å; W273-L275 PolarHBondContact O-N 3.25Å; W273-L276 PolarHBondContact O-N 2.94Å; W273-Q277 HydrophobicContact CD2-CG 4.42Å; W273-Q277 HydrophobicContact CZ2-CG 4.23Å; W273-Q277 VanDerWaalsContact NE1-NE2 3.19Å; W273-Q277 WeakPolarHBondContact O-CG 3.4Å; W273-Q277 PolarHBondContact O-N 2.93Å; W273-Q277 PolarHBondContact O-NE2 2.74Å; W273-I283 HydrophobicContact CE3-CG2 4.08Å; W273-I283 HydrophobicContact CZ3-CD1 4.49Å; W273-I283 HydrophobicContact CZ3-CG2 3.65Å; W273-K286 HydrophobicContact CZ3-CG 4.18Å; W273-N287 WeakPolarHBondContact CZ3-O 3.47Å
274	G	89.4	Confident	89.8	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.01	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-31.4	-175.4	0	0	0	0	0	114	I272 L276 Q277 I283	I272-G274 PolarHBondContact O-N 3.24Å; G274-L276 VanDerWaalsContact C-N 3.31Å; G274-L276 PolarHBondContact O-N 3.3Å; G274-Q277 PolarHBondContact O-N 3.45Å; G274-I283 CarbonylContact C-O 3.43Å; G274-I283 VanDerWaalsContact C-O 3.29Å; G274-I283 WeakPolarHBondContact CA-O 3.38Å
275	L	93.7	Very high	89.5	Confident	6 Å²	6	23.9 Å²	23.9	3%	0.031	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-41.4	173.6	175.2	66.8	0	0	0	111.6	A130 R133 V160 L161 L234 I272 W273 Q277 L282	A130-L275 HydrophobicContact CB-CD1 4.08Å; A130-L275 HydrophobicContact CB-CD2 4.08Å; A130-L275 HydrophobicContact CB-CG 4.02Å; R133-L275 PolarHBondContact NE-O 2.87Å; V160-L275 HydrophobicContact CG1-CD1 3.63Å; L161-L275 HydrophobicContact CD2-CD1 3.85Å; L161-L275 HydrophobicContact CD2-CD2 3.53Å; L161-L275 HydrophobicContact CD2-CG 4.36Å; L234-L275 HydrophobicContact CD1-CD2 4.43Å; I272-L275 WeakPolarHBondContact O-CB 3.44Å; I272-L275 PolarHBondContact O-N 3.41Å; W273-L275 PolarHBondContact O-N 3.25Å; L275-Q277 VanDerWaalsContact C-N 3.31Å; L275-Q277 PolarHBondContact O-N 2.89Å; L275-L282 HydrophobicContact CD1-CD1 4.13Å
276	L	94.1	Very high	89.2	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	0.7	-174.2	-58	176.8	0	0	0	113.4	L126 I127 R129 V238 I266 I272 W273 G274	L126-L276 HydrophobicContact CB-CB 4.49Å; L126-L276 HydrophobicContact CB-CD1 4.36Å; L126-L276 HydrophobicContact CB-CD2 4.2Å; L126-L276 HydrophobicContact CD2-CB 4.45Å; L126-L276 WeakPolarHBondContact O-CD2 3.47Å; I127-L276 HydrophobicContact CG1-CD2 4.41Å; R129-L276 WeakPolarHBondContact CD-O 3.42Å; R129-L276 PolarHBondContact NH1-O 3.26Å; V238-L276 HydrophobicContact CG1-CD1 4.35Å; I266-L276 HydrophobicContact CD1-CD1 4.16Å; I266-L276 HydrophobicContact CG2-CD1 3.85Å; I272-L276 HydrophobicContact CB-CD1 4.41Å; I272-L276 WeakPolarHBondContact O-CG 3.37Å; I272-L276 PolarHBondContact O-N 3.12Å; W273-L276 PolarHBondContact O-N 2.94Å; G274-L276 VanDerWaalsContact C-N 3.31Å; G274-L276 PolarHBondContact O-N 3.3Å
277	Q	92	Very high	89	Confident	37 Å²	37	25.7 Å²	25.7	17%	0.173	13%	0.132	C	C	.	.	S	Bend	trans	-74	151.7	175.6	-65.1	-44.6	-58.7	0	0	112.4	R133 W273 G274 L275 Y279 I283	R133-Q277 PolarHBondContact NH2-O 3.39Å; W273-Q277 HydrophobicContact CD2-CG 4.42Å; W273-Q277 HydrophobicContact CZ2-CG 4.23Å; W273-Q277 VanDerWaalsContact NE1-NE2 3.19Å; W273-Q277 WeakPolarHBondContact O-CG 3.4Å; W273-Q277 PolarHBondContact O-N 2.93Å; W273-Q277 PolarHBondContact O-NE2 2.74Å; G274-Q277 PolarHBondContact O-N 3.45Å; L275-Q277 VanDerWaalsContact C-N 3.31Å; L275-Q277 PolarHBondContact O-N 2.89Å; Q277-Y279 HydrophobicContact CB-CD2 3.81Å; Q277-Y279 HydrophobicContact CB-CE2 4.22Å; Q277-Y279 PolarHBondContact O-N 3.01Å; Q277-I283 HydrophobicContact CB-CD1 4.38Å; Q277-I283 HydrophobicContact CG-CD1 4.24Å
278	P	90.6	Very high	88.8	Confident	31 Å²	31	26.8 Å²	26.8	20%	0.201	14%	0.14	C	C	.	.	S	Bend	trans	-77.9	2.8	-175.3	33.1	-37.2	0	0	0	114.2	K86 L87	K86-P278 CarbonylContact C-O 3.51Å; K86-P278 VanDerWaalsContact CA-O 3.31Å; K86-P278 WeakPolarHBondContact CA-O 3.34Å; L87-P278 PolarHBondContact N-O 3.27Å
279	Y	88.7	Confident	88.5	Confident	48 Å²	48	27 Å²	27	19%	0.188	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-81.8	148.1	-174.8	-53.9	-65.3	0	0	0	113	C84 L87 R133 Q277 H281 I283	C84-Y279 HydrophobicContact CB-CD1 4.15Å; L87-Y279 WeakPolarHBondContact CG-O 3.36Å; R133-Y279 PolarHBondContact NH1-O 3.48Å; R133-Y279 VanDerWaalsContact NH1-O 3.09Å; R133-Y279 PolarHBondContact NH2-O 2.94Å; Q277-Y279 HydrophobicContact CB-CD2 3.81Å; Q277-Y279 HydrophobicContact CB-CE2 4.22Å; Q277-Y279 PolarHBondContact O-N 3.01Å; Y279-H281 VanDerWaalsContact CB-CE1 3.48Å; Y279-H281 WeakPolarHBondContact CB-CE1 3.43Å; Y279-H281 AromaticContact CG-CE1 3.81Å; Y279-H281 VanDerWaalsContact O-O 3.1Å; Y279-I283 HydrophobicContact CD2-CD1 3.7Å; Y279-I283 HydrophobicContact CE2-CD1 4.12Å
280	Q	84.3	Confident	88.1	Confident	94 Å²	94	26.8 Å²	26.8	44%	0.439	15%	0.153	S	C	.	.	S	Bend	trans	-63.8	-44.2	177.7	-178.9	174.4	-1.6	0	0	112.5	A85 R133	A85-Q280 HydrophobicContact CB-CB 4.2Å; A85-Q280 WeakPolarHBondContact O-CB 3.46Å; A85-Q280 PolarHBondContact O-N 3.29Å; R133-Q280 PolarHBondContact NH1-O 2.81Å; R133-Q280 VanDerWaalsContact NH1-O 3.14Å
281	H	86.8	Confident	87.9	Confident	13 Å²	13	30.1 Å²	30.1	6%	0.06	17%	0.173	C	C	.	.	S	Bend	trans	-65.9	151.1	172.1	67.5	-82.6	0	0	0	110.2	R133 Y279 F411 L447	R133-H281 PolarHBondContact NH1-O 3.44Å; R133-H281 VanDerWaalsContact NH1-O 3.09Å; R133-H281 PolarHBondContact NH2-O 3.41Å; Y279-H281 VanDerWaalsContact CB-CE1 3.48Å; Y279-H281 WeakPolarHBondContact CB-CE1 3.43Å; Y279-H281 AromaticContact CG-CE1 3.81Å; Y279-H281 VanDerWaalsContact O-O 3.1Å; H281-F411 AromaticContact CE1-CZ 3.83Å; H281-F411 AromaticContact NE2-CZ 3.53Å; H281-L447 CarbonylContact C-O 3.55Å; H281-L447 WeakPolarHBondContact CA-O 3.44Å
282	L	90	Very high	87.8	Confident	3 Å²	3	31.4 Å²	31.4	2%	0.016	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-91.8	120.3	178.9	-174	68.8	0	0	0	109.1	V160 L275 C284 L447	V160-L282 WeakPolarHBondContact O-CD2 3.46Å; L275-L282 HydrophobicContact CD1-CD1 4.13Å; L282-C284 WeakPolarHBondContact CD2-SG 3.41Å; L282-C284 WeakPolarHBondContact CG-SG 3.32Å; L282-L447 HydrophobicContact CB-CD1 3.92Å; L282-L447 HydrophobicContact CB-CG 3.87Å; L282-L447 HydrophobicContact CD2-CD2 4.03Å; L282-L447 HydrophobicContact CD2-CG 4.2Å; L282-L447 PolarHBondContact N-O 3.39Å
283	I	86.8	Confident	87.5	Confident	13 Å²	13	33.3 Å²	33.3	7%	0.067	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-86.9	124.4	171.7	-61.8	174.7	0	0	0	107.3	W273 G274 Q277 Y279 K286	W273-I283 HydrophobicContact CE3-CG2 4.08Å; W273-I283 HydrophobicContact CZ3-CD1 4.49Å; W273-I283 HydrophobicContact CZ3-CG2 3.65Å; G274-I283 CarbonylContact C-O 3.43Å; G274-I283 VanDerWaalsContact C-O 3.29Å; G274-I283 WeakPolarHBondContact CA-O 3.38Å; Q277-I283 HydrophobicContact CB-CD1 4.38Å; Q277-I283 HydrophobicContact CG-CD1 4.24Å; Y279-I283 HydrophobicContact CD2-CD1 3.7Å; Y279-I283 HydrophobicContact CE2-CD1 4.12Å; I283-K286 HydrophobicContact CG2-CD 4.25Å; I283-K286 HydrophobicContact CG2-CG 3.91Å
284	C	84.3	Confident	87.1	Confident	17 Å²	17	32.3 Å²	32.3	12%	0.115	19%	0.191	C	C	.	.			trans	-130	153.1	-177.2	-61.5	0	0	0	0	112.3	L282 K286 E419	L282-C284 WeakPolarHBondContact CD2-SG 3.41Å; L282-C284 WeakPolarHBondContact CG-SG 3.32Å; C284-K286 PolarHBondContact O-N 3.08Å; C284-E419 HydrophobicContact CB-CB 4.23Å; C284-E419 VanDerWaalsContact CB-CD 3.44Å; C284-E419 HydrophobicContact CB-CG 3.54Å
285	G	82.3	Confident	86.6	Confident	5 Å²	5	32.5 Å²	32.5	5%	0.052	19%	0.192	C	C	.	.	S	Bend	trans	69.8	11.6	165.8	0	0	0	0	0	115.2	L292 S293	G285-L292 VanDerWaalsContact O-CA 3.25Å; G285-L292 WeakPolarHBondContact O-CA 3.45Å; G285-L292 WeakPolarHBondContact O-CD2 3.5Å; G285-S293 PolarHBondContact O-N 3.1Å; G285-S293 VanDerWaalsContact O-N 3.15Å
286	K	85.6	Confident	85.5	Confident	34 Å²	34	37.2 Å²	37.2	15%	0.148	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-140	152.6	177.2	64.4	177	179.3	172.4	0	112.6	S270 W273 I283 C284 V291 L292	S270-K286 WeakPolarHBondContact CA-O 3.31Å; W273-K286 HydrophobicContact CZ3-CG 4.18Å; I283-K286 HydrophobicContact CG2-CD 4.25Å; I283-K286 HydrophobicContact CG2-CG 3.91Å; C284-K286 PolarHBondContact O-N 3.08Å; K286-V291 VanDerWaalsContact CA-O 3.23Å; K286-V291 WeakPolarHBondContact CA-O 3.26Å; K286-L292 HydrophobicContact CB-CD2 4.08Å
287	N	87.7	Confident	84.2	Confident	19 Å²	19	39.8 Å²	39.8	10%	0.102	23%	0.232	C	C	.	.			trans	-89.1	-178.1	170.1	68.6	4.3	0	0	0	111.6	S267 W273 S289 G290 V291	S267-N287 WeakPolarHBondContact O-CB 3.4Å; W273-N287 WeakPolarHBondContact CZ3-O 3.47Å; N287-S289 PolarHBondContact ND2-OG 3.31Å; N287-S289 PolarHBondContact O-N 3.41Å; N287-S289 PolarHBondContact OD1-N 2.98Å; N287-S289 PolarHBondContact OD1-OG 3.17Å; N287-G290 PolarHBondContact O-N 3.03Å; N287-G290 PolarHBondContact OD1-N 3Å; N287-G290 VanDerWaalsContact OD1-N 3.15Å; N287-V291 PolarHBondContact N-O 3.26Å; N287-V291 WeakPolarHBondContact OD1-CB 3.32Å; N287-V291 PolarHBondContact OD1-N 3.37Å
288	S	87	Confident	83.1	Confident	57 Å²	57	38.6 Å²	38.6	40%	0.399	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-28.9	179.3	60.3	0	0	0	0	114.4	S267 G290	S267-S288 VanDerWaalsContact O-CB 3.29Å; S267-S288 WeakPolarHBondContact O-CB 3.44Å; S267-S288 PolarHBondContact O-N 2.79Å; S267-S288 PolarHBondContact O-OG 3Å; S288-G290 VanDerWaalsContact C-N 3.27Å; S288-G290 PolarHBondContact O-N 2.89Å
289	S	84.2	Confident	82	Confident	84 Å²	84	40.4 Å²	40.4	59%	0.587	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	0	176	59.1	0	0	0	0	113.7	N287 V291	N287-S289 PolarHBondContact ND2-OG 3.31Å; N287-S289 PolarHBondContact O-N 3.41Å; N287-S289 PolarHBondContact OD1-N 2.98Å; N287-S289 PolarHBondContact OD1-OG 3.17Å; S289-V291 VanDerWaalsContact C-N 3.34Å
290	G	81.5	Confident	80.7	Confident	29 Å²	29	40.2 Å²	40.2	30%	0.299	24%	0.236	S	C	.	.			trans	81.3	9.2	178.4	0	0	0	0	0	114.8	N287 S288 L292	N287-G290 PolarHBondContact O-N 3.03Å; N287-G290 PolarHBondContact OD1-N 3Å; N287-G290 VanDerWaalsContact OD1-N 3.15Å; S288-G290 VanDerWaalsContact C-N 3.27Å; S288-G290 PolarHBondContact O-N 2.89Å; G290-L292 PolarHBondContact O-N 3.32Å
291	V	84.7	Confident	79.4	Confident	82 Å²	82	38.6 Å²	38.6	50%	0.497	23%	0.229	S	C	.	.			trans	-73.4	126.2	176.4	179.8	0	0	0	0	109.2	K286 N287 S289	K286-V291 VanDerWaalsContact CA-O 3.23Å; K286-V291 WeakPolarHBondContact CA-O 3.26Å; N287-V291 PolarHBondContact N-O 3.26Å; N287-V291 WeakPolarHBondContact OD1-CB 3.32Å; N287-V291 PolarHBondContact OD1-N 3.37Å; S289-V291 VanDerWaalsContact C-N 3.34Å
292	L	86.1	Confident	77.7	Confident	48 Å²	48	43.1 Å²	43.1	25%	0.251	25%	0.245	S	C	.	.	B	Isolated β-bridge	trans	-83	139.3	176.9	-64	168.3	0	0	0	111.1	G285 K286 G290 L329 T331 V413 P416	G285-L292 VanDerWaalsContact O-CA 3.25Å; G285-L292 WeakPolarHBondContact O-CA 3.45Å; G285-L292 WeakPolarHBondContact O-CD2 3.5Å; K286-L292 HydrophobicContact CB-CD2 4.08Å; G290-L292 PolarHBondContact O-N 3.32Å; L292-L329 HydrophobicContact CB-CD2 4.09Å; L292-T331 HydrophobicContact CD1-CG2 3.63Å; L292-V413 HydrophobicContact CD1-CG1 4.19Å; L292-V413 HydrophobicContact CD2-CG1 4.35Å; L292-V413 HydrophobicContact CG-CG1 4.48Å; L292-P416 HydrophobicContact CD2-CG 4.26Å
293	S	85.2	Confident	75.7	Confident	41 Å²	41	48.8 Å²	48.8	29%	0.287	28%	0.276	S	S	.	.			trans	-147	148.5	175.5	36.3	0	0	0	0	112.6	S270 G285	S270-S293 WeakPolarHBondContact CB-OG 3.45Å; S270-S293 PolarHBondContact OG-OG 3.39Å; G285-S293 PolarHBondContact O-N 3.1Å; G285-S293 VanDerWaalsContact O-N 3.15Å
294	L	83.4	Confident	73.7	Confident	17 Å²	17	52.3 Å²	52.3	9%	0.089	29%	0.292	C	S	.	.			trans	-73.8	143.4	171.8	-60.9	-176	0	0	0	110.3	L298 E325 L328 L329 M418	L294-L298 HydrophobicContact CB-CB 4.41Å; L294-E325 HydrophobicContact CD1-CB 4.06Å; L294-E325 HydrophobicContact CD1-CG 3.79Å; L294-E325 HydrophobicContact CG-CG 4.26Å; L294-L328 HydrophobicContact CD1-CD1 4.49Å; L294-L328 HydrophobicContact CD2-CB 3.83Å; L294-L328 HydrophobicContact CD2-CD1 4.18Å; L294-L329 HydrophobicContact CD2-CD1 4.44Å; L294-L329 HydrophobicContact CD2-CD2 3.75Å; L294-L329 HydrophobicContact CD2-CG 3.82Å; L294-L329 HydrophobicContact CG-CD1 4.48Å; L294-L329 HydrophobicContact CG-CD2 4.39Å; L294-L329 HydrophobicContact CG-CG 4.37Å; L294-M418 HydrophobicContact CD2-CE 3.19Å; L294-M418 HydrophobicContact CD2-SD 4.1Å; L294-M418 HydrophobicContact CG-CE 4.42Å
295	P	79.8	Confident	71.8	Confident	5 Å²	5	59.6 Å²	59.6	3%	0.032	32%	0.324	C	S	.	.			trans	-50.6	149.5	165.7	-28.3	35.5	0	0	0	112.5	E271 S297 L298 N299 M418	E271-P295 HydrophobicContact CG-CB 4.49Å; E271-P295 WeakPolarHBondContact OE1-CB 3.45Å; P295-S297 PolarHBondContact O-N 2.99Å; P295-S297 VanDerWaalsContact O-N 3.16Å; P295-L298 HydrophobicContact CG-CD1 4.17Å; P295-L298 CarbonylContact O-C 3.59Å; P295-L298 WeakPolarHBondContact O-CA 3.32Å; P295-L298 PolarHBondContact O-N 3Å; P295-N299 PolarHBondContact O-N 2.83Å; P295-M418 WeakPolarHBondContact CD-SD 3.33Å; P295-M418 HydrophobicContact CG-SD 4.15Å
296	E	70.3	Confident	69.8	Low	105 Å²	105	68.2 Å²	68.2	49%	0.491	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-58	-34.2	-179.1	-168.1	176.6	-172.7	0	0	112.6	L298 N299 R302	E296-L298 PolarHBondContact O-N 2.88Å; E296-N299 VanDerWaalsContact O-CB 3.31Å; E296-N299 WeakPolarHBondContact O-CB 3.23Å; E296-N299 PolarHBondContact O-N 3.25Å; E296-N299 VanDerWaalsContact O-N 3.17Å; E296-R302 IonicContact OE1-CZ 3.23Å; E296-R302 IonicContact OE1-NH1 3.39Å; E296-R302 PolarHBondContact OE1-NH1 3.35Å
297	S	67	Low	67.6	Low	53 Å²	53	70.6 Å²	70.6	37%	0.371	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-68.1	-18.9	175.6	52.5	0	0	0	0	114.6	T164 P295	T164-S297 PolarHBondContact OG1-OG 3.44Å; P295-S297 PolarHBondContact O-N 2.99Å; P295-S297 VanDerWaalsContact O-N 3.16Å
298	L	70.1	Confident	65.4	Low	13 Å²	13	73.2 Å²	73.2	7%	0.068	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-106.5	7.8	175.6	-62.7	178.8	0	0	0	111.6	L294 P295 E296 L300 L350 L353 M418	L294-L298 HydrophobicContact CB-CB 4.41Å; P295-L298 HydrophobicContact CG-CD1 4.17Å; P295-L298 CarbonylContact O-C 3.59Å; P295-L298 WeakPolarHBondContact O-CA 3.32Å; P295-L298 PolarHBondContact O-N 3Å; E296-L298 PolarHBondContact O-N 2.88Å; L298-L300 WeakPolarHBondContact O-CG 3.47Å; L298-L300 PolarHBondContact O-N 3Å; L298-L350 HydrophobicContact CD1-CD2 4.17Å; L298-L350 HydrophobicContact CD2-CD2 3.63Å; L298-L353 HydrophobicContact CD2-CD1 3.36Å; L298-M418 HydrophobicContact CD1-SD 4.26Å
299	N	66.6	Low	63	Low	68 Å²	68	81.7 Å²	81.7	36%	0.364	43%	0.431	S	S	.	.			trans	-80.8	91.5	-177.7	-160.8	-18.7	0	0	0	110.7	P295 E296 H301 R302	P295-N299 PolarHBondContact O-N 2.83Å; E296-N299 VanDerWaalsContact O-CB 3.31Å; E296-N299 WeakPolarHBondContact O-CB 3.23Å; E296-N299 PolarHBondContact O-N 3.25Å; E296-N299 VanDerWaalsContact O-N 3.17Å; N299-H301 PolarHBondContact O-N 3.36Å; N299-H301 VanDerWaalsContact O-N 3.09Å; N299-R302 PolarHBondContact O-N 3.41Å
300	L	61.4	Low	60.9	Low	44 Å²	44	82 Å²	82	23%	0.23	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-15.7	-170.4	-61.1	159.8	0	0	0	114.5	L298 L321 L324	L298-L300 WeakPolarHBondContact O-CG 3.47Å; L298-L300 PolarHBondContact O-N 3Å; L300-L321 HydrophobicContact CB-CB 4.28Å; L300-L321 HydrophobicContact CB-CD1 4.22Å; L300-L321 HydrophobicContact CB-CD2 3.82Å; L300-L321 HydrophobicContact CB-CG 4.31Å; L300-L321 HydrophobicContact CD1-CB 4.43Å; L300-L321 HydrophobicContact CD1-CD2 4.06Å; L300-L321 HydrophobicContact CD2-CD2 4.07Å; L300-L321 HydrophobicContact CG-CD2 4.17Å; L300-L324 HydrophobicContact CD1-CB 4.24Å; L300-L324 HydrophobicContact CD1-CD2 3.63Å; L300-L324 HydrophobicContact CD1-CG 4.05Å; L300-L324 HydrophobicContact CD2-CD2 4.26Å
301	H	56.7	Low	58.6	Low	60 Å²	60	84 Å²	84	28%	0.278	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-19.6	-175.6	-62.1	-76.2	0	0	0	113.7	N299 E325	N299-H301 PolarHBondContact O-N 3.36Å; N299-H301 VanDerWaalsContact O-N 3.09Å; H301-E325 IonicContact CD2-OE2 3.77Å; H301-E325 IonicContact CE1-OE2 3.95Å; H301-E325 IonicContact NE2-OE2 2.9Å; H301-E325 PolarHBondContact NE2-OE2 3.25Å
302	R	51.1	Low	56.6	Low	109 Å²	109	90.3 Å²	90.3	41%	0.411	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-30	-175	-163.3	-180	178.2	-170.7	8	113.7	E296 N299 Q304 Q305 R306	E296-R302 IonicContact OE1-CZ 3.23Å; E296-R302 IonicContact OE1-NH1 3.39Å; E296-R302 PolarHBondContact OE1-NH1 3.35Å; N299-R302 PolarHBondContact O-N 3.41Å; R302-Q304 VanDerWaalsContact C-N 3.28Å; R302-Q304 PolarHBondContact O-N 3.06Å; R302-Q305 PolarHBondContact O-N 3.25Å; R302-R306 PolarHBondContact O-N 3.47Å
303	D	47.2	Very low	54.4	Low	122 Å²	122	91 Å²	91	65%	0.652	51%	0.511	S	S	*	.	H	α-helix	trans	-65.7	-30.6	178.5	-87.7	-16.4	0	0	0	112.4	Q305 R306 S307	D303-Q305 VanDerWaalsContact C-N 3.3Å; D303-Q305 PolarHBondContact O-N 2.92Å; D303-R306 PolarHBondContact O-N 3.22Å; D303-S307 PolarHBondContact O-N 2.9Å
304	Q	46.1	Very low	52.4	Low	87 Å²	87	97.8 Å²	97.8	41%	0.407	54%	0.537	S	S	.	.	H	α-helix	trans	-65.7	-28	171.6	-94.1	-179.2	5.1	0	0	113.4	R302 Y316	R302-Q304 VanDerWaalsContact C-N 3.28Å; R302-Q304 PolarHBondContact O-N 3.06Å; Q304-Y316 PolarHBondContact NE2-O 2.62Å
305	Q	43.7	Very low	50.9	Low	169 Å²	169	100.5 Å²	100.5	79%	0.79	57%	0.569	S	S	*	*	H	α-helix	trans	-81.6	-22.6	178.6	-74.9	-176.9	-18.5	0	0	113.2	R302 D303	R302-Q305 PolarHBondContact O-N 3.25Å; D303-Q305 VanDerWaalsContact C-N 3.3Å; D303-Q305 PolarHBondContact O-N 2.92Å
306	R	40.1	Very low	50	Low	186 Å²	186	104.1 Å²	104.1	70%	0.702	58%	0.583	S	S	*	*	H	α-helix	trans	-89.6	-23.3	176.7	-78.5	-177.6	172.1	175.5	-2.2	113.7	R302 D303 G308	R302-R306 PolarHBondContact O-N 3.47Å; D303-R306 PolarHBondContact O-N 3.22Å; R306-G308 PolarHBondContact O-N 3.37Å
307	S	40	Very low	49.9	Very low	84 Å²	84	101.6 Å²	101.6	59%	0.587	58%	0.577	S	S	*	*			trans	-80.8	30.1	-178.1	91.6	0	0	0	0	115.1	D303 R309	D303-S307 PolarHBondContact O-N 2.9Å; S307-R309 PolarHBondContact O-N 2.98Å
308	G	40.7	Very low	50	Low	75 Å²	75	103.9 Å²	103.9	77%	0.773	58%	0.582	S	S	*	*			trans	-66.5	3.7	173.9	0	0	0	0	0	115	R306	R306-G308 PolarHBondContact O-N 3.37Å
309	R	37.1	Very low	50.1	Low	234 Å²	234	106.3 Å²	106.3	88%	0.883	60%	0.604	S	S	*	*	S	Bend	trans	-136.1	126.4	169.9	-75.2	-171.5	174.4	-163.2	-1.6	109.9	S307	S307-R309 PolarHBondContact O-N 2.98Å
310	G	40.2	Very low	50.4	Low	90 Å²	90	107.8 Å²	107.8	93%	0.928	61%	0.609	S	S	*	*			trans	-53.1	132.2	-163.8	0	0	0	0	0	115.3
311	G	32.6	Very low	51	Low	71 Å²	71	106.1 Å²	106.1	73%	0.732	60%	0.6	S	S	*	*			trans	-158.2	124.8	163.3	0	0	0	0	0	107.4	G313	G311-G313 PolarHBondContact O-N 3.49Å
312	E	42.5	Very low	52	Low	216 Å²	216	110.1 Å²	110.1	100%	1.009	61%	0.613	S	S	*	*			trans	-59	104.2	-179	-68.9	178.5	148.7	0	0	110.9
313	G	39.8	Very low	53.5	Low	62 Å²	62	108.1 Å²	108.1	64%	0.639	61%	0.613	S	S	*	*			trans	-139.4	136.4	168.1	0	0	0	0	0	108.2	G311 G315	G311-G313 PolarHBondContact O-N 3.49Å; G313-G315 PolarHBondContact O-N 3.27Å
314	H	44	Very low	55.2	Low	183 Å²	183	102.6 Å²	102.6	85%	0.847	58%	0.583	S	S	*	*			trans	-48.1	104.8	-176.4	-69.7	-64.6	0	0	0	111.8	Y316	H314-Y316 PolarHBondContact O-N 3.05Å
315	G	51.8	Low	57	Low	74 Å²	74	101 Å²	101	76%	0.763	58%	0.575	S	S	*	*			trans	-79.5	102.8	-179.2	0	0	0	0	0	110.4	G313	G313-G315 PolarHBondContact O-N 3.27Å
316	Y	60.1	Low	59	Low	81 Å²	81	99.4 Å²	99.4	32%	0.318	57%	0.568	S	S	.	*			trans	-66.2	139.8	167	-66.9	-72.1	0	0	0	110.3	Q304 H314 E320 L321 H349	Q304-Y316 PolarHBondContact NE2-O 2.62Å; H314-Y316 PolarHBondContact O-N 3.05Å; Y316-E320 HydrophobicContact CD1-CB 4.38Å; Y316-L321 VanDerWaalsContact CB-CD2 3.45Å; Y316-L321 HydrophobicContact CD2-CD2 4.03Å; Y316-L321 HydrophobicContact CG-CD2 3.91Å; Y316-H349 AromaticContact CD1-CE1 3.94Å; Y316-H349 AromaticContact CE1-CE1 3.23Å; Y316-H349 WeakPolarHBondContact CE1-CE1 3.44Å; Y316-H349 AromaticContact CE1-ND1 3.91Å; Y316-H349 AromaticContact CE2-CE1 3.96Å; Y316-H349 AromaticContact CE2-ND1 3.87Å; Y316-H349 AromaticContact CZ-CE1 3.23Å; Y316-H349 AromaticContact CZ-ND1 3.4Å; Y316-H349 PolarHBondContact OH-CE1 2.84Å; Y316-H349 VanDerWaalsContact OH-CE1 3.29Å; Y316-H349 PolarHBondContact OH-ND1 3.42Å
317	S	68.7	Low	61.3	Low	53 Å²	53	90.8 Å²	90.8	37%	0.371	54%	0.537	S	S	.	.			trans	-66.9	152.2	168.9	66.7	0	0	0	0	110.5	A319 E320 L321	S317-A319 PolarHBondContact O-N 3.36Å; S317-A319 VanDerWaalsContact O-N 3.11Å; S317-E320 PolarHBondContact N-OE2 3.24Å; S317-E320 PolarHBondContact O-N 3.26Å; S317-E320 VanDerWaalsContact O-N 3.08Å; S317-E320 WeakPolarHBondContact OG-CG 3.28Å; S317-E320 PolarHBondContact OG-N 2.94Å; S317-E320 PolarHBondContact OG-OE2 3.35Å; S317-L321 PolarHBondContact O-N 2.9Å; S317-L321 VanDerWaalsContact O-N 3.11Å
318	Q	68.8	Low	63.6	Low	100 Å²	100	87 Å²	87	47%	0.467	51%	0.51	S	S	.	.	H	α-helix	trans	-57.2	-28.4	176.7	-84.4	-149	-12.3	0	0	113.3	R322	Q318-R322 WeakPolarHBondContact O-CG 3.42Å; Q318-R322 PolarHBondContact O-N 2.98Å; Q318-R322 VanDerWaalsContact O-N 3.16Å
319	A	72.1	Confident	65.9	Low	65 Å²	65	85.1 Å²	85.1	54%	0.537	48%	0.482	S	S	.	.	H	α-helix	trans	-70.1	-42	176.6	0	0	0	0	0	112	S317 R322 T323	S317-A319 PolarHBondContact O-N 3.36Å; S317-A319 VanDerWaalsContact O-N 3.11Å; A319-R322 PolarHBondContact O-N 3.03Å; A319-T323 WeakPolarHBondContact O-CB 3.45Å; A319-T323 PolarHBondContact O-N 3.48Å; A319-T323 PolarHBondContact O-OG1 3.13Å
320	E	73.9	Confident	68.4	Low	99 Å²	99	75 Å²	75	46%	0.463	45%	0.448	S	S	.	.	H	α-helix	trans	-64.4	-40.3	175.7	-72.4	162	156.3	0	0	111.5	Y316 S317 T323 L324	Y316-E320 HydrophobicContact CD1-CB 4.38Å; S317-E320 PolarHBondContact N-OE2 3.24Å; S317-E320 PolarHBondContact O-N 3.26Å; S317-E320 VanDerWaalsContact O-N 3.08Å; S317-E320 WeakPolarHBondContact OG-CG 3.28Å; S317-E320 PolarHBondContact OG-N 2.94Å; S317-E320 PolarHBondContact OG-OE2 3.35Å; E320-T323 PolarHBondContact O-N 2.79Å; E320-L324 WeakPolarHBondContact O-CB 3.49Å; E320-L324 PolarHBondContact O-N 3.09Å
321	L	73.8	Confident	70.7	Confident	8 Å²	8	72 Å²	72	4%	0.042	41%	0.412	C	S	.	.	H	α-helix	trans	-63.5	-43.6	176.9	-64.8	-177.7	0	0	0	112.3	L300 Y316 S317 T323 L324 E325	L300-L321 HydrophobicContact CB-CB 4.28Å; L300-L321 HydrophobicContact CB-CD1 4.22Å; L300-L321 HydrophobicContact CB-CD2 3.82Å; L300-L321 HydrophobicContact CB-CG 4.31Å; L300-L321 HydrophobicContact CD1-CB 4.43Å; L300-L321 HydrophobicContact CD1-CD2 4.06Å; L300-L321 HydrophobicContact CD2-CD2 4.07Å; L300-L321 HydrophobicContact CG-CD2 4.17Å; Y316-L321 VanDerWaalsContact CB-CD2 3.45Å; Y316-L321 HydrophobicContact CD2-CD2 4.03Å; Y316-L321 HydrophobicContact CG-CD2 3.91Å; S317-L321 PolarHBondContact O-N 2.9Å; S317-L321 VanDerWaalsContact O-N 3.11Å; L321-T323 VanDerWaalsContact C-N 3.35Å; L321-L324 PolarHBondContact O-N 3.33Å; L321-E325 WeakPolarHBondContact O-CB 3.47Å; L321-E325 PolarHBondContact O-N 2.87Å
322	R	78	Confident	73.1	Confident	144 Å²	144	74.1 Å²	74.1	54%	0.543	40%	0.398	S	S	.	.	H	α-helix	trans	-64.5	-39.3	175	-73.7	-179.1	-172.8	171.9	5.1	112.3	Q318 A319 L324 E325 Q326	Q318-R322 WeakPolarHBondContact O-CG 3.42Å; Q318-R322 PolarHBondContact O-N 2.98Å; Q318-R322 VanDerWaalsContact O-N 3.16Å; A319-R322 PolarHBondContact O-N 3.03Å; R322-L324 VanDerWaalsContact C-N 3.33Å; R322-E325 PolarHBondContact O-N 3.05Å; R322-Q326 WeakPolarHBondContact O-CB 3.48Å; R322-Q326 VanDerWaalsContact O-CG 3.29Å; R322-Q326 WeakPolarHBondContact O-CG 3.23Å; R322-Q326 PolarHBondContact O-N 3Å
323	T	82.3	Confident	75.1	Confident	68 Å²	68	64 Å²	64	42%	0.417	35%	0.351	S	S	.	.	H	α-helix	trans	-65.9	-38.7	178.3	-53.8	0	0	0	0	111.1	A319 E320 L321 S327	A319-T323 WeakPolarHBondContact O-CB 3.45Å; A319-T323 PolarHBondContact O-N 3.48Å; A319-T323 PolarHBondContact O-OG1 3.13Å; E320-T323 PolarHBondContact O-N 2.79Å; L321-T323 VanDerWaalsContact C-N 3.35Å; T323-S327 WeakPolarHBondContact O-CB 3.21Å; T323-S327 PolarHBondContact O-N 3.16Å; T323-S327 PolarHBondContact O-OG 2.96Å
324	L	82.9	Confident	77	Confident	5 Å²	5	62.1 Å²	62.1	3%	0.026	33%	0.331	C	S	.	.	H	α-helix	trans	-67.4	-44.9	174.7	178.9	60.4	0	0	0	112.1	L300 E320 L321 R322 Q326 S327 L328 H349	L300-L324 HydrophobicContact CD1-CB 4.24Å; L300-L324 HydrophobicContact CD1-CD2 3.63Å; L300-L324 HydrophobicContact CD1-CG 4.05Å; L300-L324 HydrophobicContact CD2-CD2 4.26Å; E320-L324 WeakPolarHBondContact O-CB 3.49Å; E320-L324 PolarHBondContact O-N 3.09Å; L321-L324 PolarHBondContact O-N 3.33Å; R322-L324 VanDerWaalsContact C-N 3.33Å; L324-Q326 VanDerWaalsContact C-N 3.31Å; L324-Q326 PolarHBondContact O-N 3.14Å; L324-S327 WeakPolarHBondContact O-CA 3.33Å; L324-S327 WeakPolarHBondContact O-CB 3.19Å; L324-S327 PolarHBondContact O-N 2.7Å; L324-L328 HydrophobicContact CD1-CD1 4.33Å; L324-L328 HydrophobicContact CD1-CG 4.26Å; L324-L328 HydrophobicContact CG-CD1 4.17Å; L324-L328 WeakPolarHBondContact O-CG 3.46Å; L324-L328 PolarHBondContact O-N 3.24Å; L324-H349 HydrophobicContact CD1-CB 4.05Å; L324-H349 WeakPolarHBondContact CD1-CD2 3.3Å; L324-H349 HydrophobicContact CD2-CB 3.66Å; L324-H349 VanDerWaalsContact CD2-CD2 3.49Å; L324-H349 WeakPolarHBondContact CD2-CD2 3.23Å; L324-H349 WeakPolarHBondContact CD2-ND1 3.47Å; L324-H349 HydrophobicContact CG-CB 4.5Å
325	E	84.3	Confident	78.8	Confident	53 Å²	53	55.9 Å²	55.9	25%	0.248	31%	0.308	C	S	.	.	H	α-helix	trans	-57.3	-45.7	175.4	174.8	170.2	-162.1	0	0	111.2	L294 H301 L321 R322 S327 L328 L329	L294-E325 HydrophobicContact CD1-CB 4.06Å; L294-E325 HydrophobicContact CD1-CG 3.79Å; L294-E325 HydrophobicContact CG-CG 4.26Å; H301-E325 IonicContact CD2-OE2 3.77Å; H301-E325 IonicContact CE1-OE2 3.95Å; H301-E325 IonicContact NE2-OE2 2.9Å; H301-E325 PolarHBondContact NE2-OE2 3.25Å; L321-E325 WeakPolarHBondContact O-CB 3.47Å; L321-E325 PolarHBondContact O-N 2.87Å; R322-E325 PolarHBondContact O-N 3.05Å; E325-S327 VanDerWaalsContact C-N 3.32Å; E325-S327 PolarHBondContact O-N 3.28Å; E325-L328 PolarHBondContact O-N 2.86Å; E325-L329 HydrophobicContact CG-CD1 3.94Å; E325-L329 WeakPolarHBondContact O-CB 3.36Å; E325-L329 VanDerWaalsContact O-CG 3.3Å; E325-L329 WeakPolarHBondContact O-CG 3.38Å; E325-L329 PolarHBondContact O-N 3.5Å
326	Q	84.8	Confident	80.4	Confident	136 Å²	136	54.5 Å²	54.5	64%	0.636	28%	0.283	S	S	*	.	H	α-helix	trans	-60.6	-39.7	172.6	-73.3	174.3	-9.4	0	0	112.6	R322 L324 L329 A330	R322-Q326 WeakPolarHBondContact O-CB 3.48Å; R322-Q326 VanDerWaalsContact O-CG 3.29Å; R322-Q326 WeakPolarHBondContact O-CG 3.23Å; R322-Q326 PolarHBondContact O-N 3Å; L324-Q326 VanDerWaalsContact C-N 3.31Å; L324-Q326 PolarHBondContact O-N 3.14Å; Q326-L329 PolarHBondContact O-N 3.3Å; Q326-A330 PolarHBondContact O-N 3.09Å; Q326-A330 VanDerWaalsContact O-N 3.12Å
327	S	88.3	Confident	81.6	Confident	6 Å²	6	54 Å²	54	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-64.5	-43.2	178.2	-59.1	0	0	0	0	111.8	T323 L324 E325 A330 R345 L417	T323-S327 WeakPolarHBondContact O-CB 3.21Å; T323-S327 PolarHBondContact O-N 3.16Å; T323-S327 PolarHBondContact O-OG 2.96Å; L324-S327 WeakPolarHBondContact O-CA 3.33Å; L324-S327 WeakPolarHBondContact O-CB 3.19Å; L324-S327 PolarHBondContact O-N 2.7Å; E325-S327 VanDerWaalsContact C-N 3.32Å; E325-S327 PolarHBondContact O-N 3.28Å; S327-A330 WeakPolarHBondContact O-CB 3.49Å; S327-A330 PolarHBondContact O-N 2.87Å; S327-R345 PolarHBondContact OG-NE 3.04Å; S327-L417 WeakPolarHBondContact O-CD2 3.46Å
328	L	88.4	Confident	82.6	Confident	5 Å²	5	55.5 Å²	55.5	3%	0.026	30%	0.296	C	S	.	.	H	α-helix	trans	-70.6	-32.8	-180	-71.6	172.8	0	0	0	112.8	L294 L324 E325 A330 A346 L350 L417 M418	L294-L328 HydrophobicContact CD1-CD1 4.49Å; L294-L328 HydrophobicContact CD2-CB 3.83Å; L294-L328 HydrophobicContact CD2-CD1 4.18Å; L324-L328 HydrophobicContact CD1-CD1 4.33Å; L324-L328 HydrophobicContact CD1-CG 4.26Å; L324-L328 HydrophobicContact CG-CD1 4.17Å; L324-L328 WeakPolarHBondContact O-CG 3.46Å; L324-L328 PolarHBondContact O-N 3.24Å; E325-L328 PolarHBondContact O-N 2.86Å; L328-A330 VanDerWaalsContact C-N 3.35Å; L328-A346 HydrophobicContact CD2-CB 3.74Å; L328-L350 HydrophobicContact CD2-CD1 4.2Å; L328-L417 PolarHBondContact O-N 3.05Å; L328-M418 HydrophobicContact CB-CB 4.25Å; L328-M418 HydrophobicContact CD2-CB 3.98Å; L328-M418 PolarHBondContact O-N 3.1Å; L328-M418 VanDerWaalsContact O-N 3.07Å
329	L	89.4	Confident	83.5	Confident	34 Å²	34	50.8 Å²	50.8	18%	0.178	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-1.4	178.7	-66.1	177.2	0	0	0	113.7	L292 L294 E325 Q326 T331 M418	L292-L329 HydrophobicContact CB-CD2 4.09Å; L294-L329 HydrophobicContact CD2-CD1 4.44Å; L294-L329 HydrophobicContact CD2-CD2 3.75Å; L294-L329 HydrophobicContact CD2-CG 3.82Å; L294-L329 HydrophobicContact CG-CD1 4.48Å; L294-L329 HydrophobicContact CG-CD2 4.39Å; L294-L329 HydrophobicContact CG-CG 4.37Å; E325-L329 HydrophobicContact CG-CD1 3.94Å; E325-L329 WeakPolarHBondContact O-CB 3.36Å; E325-L329 VanDerWaalsContact O-CG 3.3Å; E325-L329 WeakPolarHBondContact O-CG 3.38Å; E325-L329 PolarHBondContact O-N 3.5Å; Q326-L329 PolarHBondContact O-N 3.3Å; L329-T331 PolarHBondContact O-N 3.23Å; L329-M418 HydrophobicContact CD2-CE 3.56Å
330	A	89.6	Confident	84.3	Confident	21 Å²	21	49.9 Å²	49.9	17%	0.174	26%	0.264	C	S	.	.			trans	-60.7	125.1	177.4	0	0	0	0	0	110.8	Q326 S327 L328 L342 M386 P416 L417	Q326-A330 PolarHBondContact O-N 3.09Å; Q326-A330 VanDerWaalsContact O-N 3.12Å; S327-A330 WeakPolarHBondContact O-CB 3.49Å; S327-A330 PolarHBondContact O-N 2.87Å; L328-A330 VanDerWaalsContact C-N 3.35Å; A330-L342 HydrophobicContact CB-CD1 4.36Å; A330-M386 WeakPolarHBondContact O-CE 2.89Å; A330-P416 CarbonylContact O-C 3.5Å; A330-P416 WeakPolarHBondContact O-CA 3.26Å; A330-L417 PolarHBondContact O-N 2.95Å
331	T	87.8	Confident	85	Confident	27 Å²	27	48.8 Å²	48.8	17%	0.166	26%	0.261	C	S	.	.			trans	-106.9	-17.1	-178.5	57.3	0	0	0	0	113.1	L292 L329 V413 L414 P416	L292-T331 HydrophobicContact CD1-CG2 3.63Å; L329-T331 PolarHBondContact O-N 3.23Å; T331-V413 HydrophobicContact CG2-CG1 4Å; T331-L414 WeakPolarHBondContact CB-O 3.49Å; T331-L414 WeakPolarHBondContact CG2-O 3.43Å; T331-L414 WeakPolarHBondContact O-CB 3.49Å; T331-P416 HydrophobicContact CG2-CB 4.39Å
332	R	84.1	Confident	85.8	Confident	117 Å²	117	49.1 Å²	49.1	44%	0.442	26%	0.263	S	S	.	.			trans	-139.2	152.8	179.2	-67.4	-176.7	-173.1	130.3	6.9	110.1	M386 L412 L414	R332-M386 VanDerWaalsContact CA-O 3.26Å; R332-M386 WeakPolarHBondContact CA-O 3.46Å; R332-L412 PolarHBondContact NH2-O 3.23Å; R332-L414 HydrophobicContact CG-CD1 4Å
333	V	84.6	Confident	86.4	Confident	4 Å²	4	42.4 Å²	42.4	2%	0.024	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-136.9	146.1	179.1	-177.8	0	0	0	0	109.8	S335 E338 L339 L342 M386	V333-S335 WeakPolarHBondContact CG1-O 3.48Å; V333-E338 HydrophobicContact CG1-CB 3.81Å; V333-E338 HydrophobicContact CG1-CG 3.81Å; V333-E338 WeakPolarHBondContact CG1-OE2 3.46Å; V333-L339 HydrophobicContact CG1-CB 3.88Å; V333-L339 HydrophobicContact CG2-CD1 4.03Å; V333-L342 HydrophobicContact CG2-CD1 3.96Å; V333-M386 HydrophobicContact CG2-CB 4.45Å; V333-M386 HydrophobicContact CG2-CE 4.04Å; V333-M386 HydrophobicContact CG2-SD 4.48Å; V333-M386 PolarHBondContact N-O 3.28Å
334	G	78.6	Confident	86.6	Confident	22 Å²	22	42.5 Å²	42.5	23%	0.227	24%	0.242	C	C	.	.	S	Bend	trans	-92.3	-25.3	-179.9	0	0	0	0	0	114.6	E338 M391	G334-E338 WeakPolarHBondContact CA-OE2 3.39Å; G334-E338 PolarHBondContact N-OE2 2.94Å; G334-M391 WeakPolarHBondContact O-CE 3.48Å
335	S	83.2	Confident	86.7	Confident	51 Å²	51	46.2 Å²	46.2	36%	0.357	26%	0.255	S	S	.	.			trans	-149	159.8	179.4	69.5	0	0	0	0	113.7	V333 A337 E338 L339	V333-S335 WeakPolarHBondContact CG1-O 3.48Å; S335-A337 VanDerWaalsContact C-N 3.26Å; S335-A337 PolarHBondContact O-N 3.42Å; S335-E338 PolarHBondContact O-N 3.17Å; S335-E338 WeakPolarHBondContact OG-CB 3.3Å; S335-E338 PolarHBondContact OG-N 3.43Å; S335-L339 PolarHBondContact O-N 2.7Å
336	I	85.3	Confident	86.8	Confident	46 Å²	46	43.7 Å²	43.7	24%	0.236	24%	0.244	C	C	.	.	H	α-helix	trans	-63.2	-31.8	174	-171.5	162.6	0	0	0	112.8	L339 S340 L379 Y380	I336-L339 PolarHBondContact O-N 3.46Å; I336-S340 VanDerWaalsContact O-CB 3.31Å; I336-S340 WeakPolarHBondContact O-CB 3.47Å; I336-S340 PolarHBondContact O-N 2.88Å; I336-L379 HydrophobicContact CD1-CB 4.27Å; I336-L379 HydrophobicContact CG1-CB 4.47Å; I336-Y380 HydrophobicContact CD1-CD1 3.28Å; I336-Y380 HydrophobicContact CD1-CD2 3.94Å; I336-Y380 HydrophobicContact CD1-CE1 3.26Å; I336-Y380 HydrophobicContact CD1-CE2 3.91Å; I336-Y380 HydrophobicContact CD1-CG 3.6Å
337	A	85.6	Confident	86.7	Confident	70 Å²	70	38 Å²	38	58%	0.579	22%	0.217	S	C	*	.	H	α-helix	trans	-65.9	-44.5	177.1	0	0	0	0	0	111.3	S335 S340 D341	S335-A337 VanDerWaalsContact C-N 3.26Å; S335-A337 PolarHBondContact O-N 3.42Å; A337-S340 PolarHBondContact O-N 3.06Å; A337-D341 WeakPolarHBondContact O-CB 3.35Å; A337-D341 PolarHBondContact O-N 3.1Å; A337-D341 VanDerWaalsContact O-N 3.11Å
338	E	88.5	Confident	86.4	Confident	85 Å²	85	43.4 Å²	43.4	40%	0.397	24%	0.241	S	C	.	.	H	α-helix	trans	-60.8	-45.7	173.6	-177.7	-171.9	-178.2	0	0	111.2	V333 G334 S335 S340 D341 L342	V333-E338 HydrophobicContact CG1-CB 3.81Å; V333-E338 HydrophobicContact CG1-CG 3.81Å; V333-E338 WeakPolarHBondContact CG1-OE2 3.46Å; G334-E338 WeakPolarHBondContact CA-OE2 3.39Å; G334-E338 PolarHBondContact N-OE2 2.94Å; S335-E338 PolarHBondContact O-N 3.17Å; S335-E338 WeakPolarHBondContact OG-CB 3.3Å; S335-E338 PolarHBondContact OG-N 3.43Å; E338-S340 PolarHBondContact O-N 3.4Å; E338-D341 PolarHBondContact O-N 3.36Å; E338-L342 HydrophobicContact CG-CD1 4.1Å; E338-L342 WeakPolarHBondContact O-CG 3.47Å; E338-L342 PolarHBondContact O-N 2.97Å
339	L	89.1	Confident	85.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.3	-46.6	178	-178.9	62.3	0	0	0	111.6	V333 S335 I336 D341 L342 V343 L379 L382 C383 M386 L417	V333-L339 HydrophobicContact CG1-CB 3.88Å; V333-L339 HydrophobicContact CG2-CD1 4.03Å; S335-L339 PolarHBondContact O-N 2.7Å; I336-L339 PolarHBondContact O-N 3.46Å; L339-D341 PolarHBondContact O-N 3.11Å; L339-L342 PolarHBondContact O-N 2.94Å; L339-V343 HydrophobicContact CD1-CG2 3.9Å; L339-V343 HydrophobicContact CG-CG2 4.18Å; L339-V343 WeakPolarHBondContact O-CB 3.44Å; L339-V343 VanDerWaalsContact O-CG2 3.31Å; L339-V343 WeakPolarHBondContact O-CG2 3.3Å; L339-V343 PolarHBondContact O-N 3.4Å; L339-L379 WeakPolarHBondContact CD2-O 3.38Å; L339-L382 HydrophobicContact CD1-CD2 3.95Å; L339-L382 HydrophobicContact CD1-CG 4.25Å; L339-L382 HydrophobicContact CD2-CB 3.97Å; L339-L382 HydrophobicContact CD2-CD2 4.11Å; L339-L382 HydrophobicContact CD2-CG 3.9Å; L339-L382 HydrophobicContact CG-CD2 4.42Å; L339-C383 HydrophobicContact CD2-CB 3.64Å; L339-C383 VanDerWaalsContact CD2-N 3.33Å; L339-M386 HydrophobicContact CD1-SD 4Å; L339-L417 HydrophobicContact CD1-CD1 4.09Å
340	S	88.8	Confident	85	Confident	46 Å²	46	43.8 Å²	43.8	32%	0.322	24%	0.242	S	C	.	.	H	α-helix	trans	-58.5	-39.9	179.9	-177.6	0	0	0	0	111.5	I336 A337 E338 S344	I336-S340 VanDerWaalsContact O-CB 3.31Å; I336-S340 WeakPolarHBondContact O-CB 3.47Å; I336-S340 PolarHBondContact O-N 2.88Å; A337-S340 PolarHBondContact O-N 3.06Å; E338-S340 PolarHBondContact O-N 3.4Å; S340-S344 VanDerWaalsContact O-CB 3.26Å; S340-S344 WeakPolarHBondContact O-CB 3.37Å; S340-S344 PolarHBondContact O-N 2.97Å; S340-S344 PolarHBondContact O-OG 3.48Å
341	D	87.9	Confident	83.9	Confident	77 Å²	77	44.6 Å²	44.6	41%	0.412	24%	0.243	S	C	.	.	H	α-helix	trans	-70.2	-44.1	178	-179.7	43.5	0	0	0	111.9	A337 E338 L339 S344 R345	A337-D341 WeakPolarHBondContact O-CB 3.35Å; A337-D341 PolarHBondContact O-N 3.1Å; A337-D341 VanDerWaalsContact O-N 3.11Å; E338-D341 PolarHBondContact O-N 3.36Å; L339-D341 PolarHBondContact O-N 3.11Å; D341-S344 PolarHBondContact O-N 3.48Å; D341-R345 PolarHBondContact O-N 2.92Å; D341-R345 IonicContact OD1-CZ 3.7Å; D341-R345 IonicContact OD1-NH1 3Å; D341-R345 PolarHBondContact OD1-NH1 2.73Å; D341-R345 IonicContact OD2-CZ 3.08Å; D341-R345 IonicContact OD2-NH1 2.62Å; D341-R345 PolarHBondContact OD2-NH1 2.98Å; D341-R345 IonicContact OD2-NH2 2.8Å; D341-R345 PolarHBondContact OD2-NH2 3.41Å
342	L	90.4	Very high	82.5	Confident	14 Å²	14	46.7 Å²	46.7	7%	0.073	26%	0.256	C	S	.	.	H	α-helix	trans	-60.4	-47.9	174.3	-71.8	170.2	0	0	0	112.5	A330 V333 E338 L339 S344 R345 A346 L417	A330-L342 HydrophobicContact CB-CD1 4.36Å; V333-L342 HydrophobicContact CG2-CD1 3.96Å; E338-L342 HydrophobicContact CG-CD1 4.1Å; E338-L342 WeakPolarHBondContact O-CG 3.47Å; E338-L342 PolarHBondContact O-N 2.97Å; L339-L342 PolarHBondContact O-N 2.94Å; L342-S344 VanDerWaalsContact C-N 3.34Å; L342-S344 PolarHBondContact O-N 2.85Å; L342-R345 PolarHBondContact O-N 3.41Å; L342-A346 WeakPolarHBondContact O-CB 3.45Å; L342-A346 PolarHBondContact O-N 3.32Å; L342-L417 HydrophobicContact CB-CD2 3.7Å
343	V	89.6	Confident	81.1	Confident	4 Å²	4	44.1 Å²	44.1	2%	0.024	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-42.6	177.3	171.8	0	0	0	0	110.4	L339 A346 M347 W374 L379 L382 L417	L339-V343 HydrophobicContact CD1-CG2 3.9Å; L339-V343 HydrophobicContact CG-CG2 4.18Å; L339-V343 WeakPolarHBondContact O-CB 3.44Å; L339-V343 VanDerWaalsContact O-CG2 3.31Å; L339-V343 WeakPolarHBondContact O-CG2 3.3Å; L339-V343 PolarHBondContact O-N 3.4Å; V343-A346 PolarHBondContact O-N 3.27Å; V343-M347 HydrophobicContact CG1-CG 4.07Å; V343-M347 VanDerWaalsContact O-CB 3.3Å; V343-M347 WeakPolarHBondContact O-CB 3.5Å; V343-M347 VanDerWaalsContact O-CG 3.25Å; V343-M347 WeakPolarHBondContact O-CG 3.43Å; V343-M347 PolarHBondContact O-N 2.78Å; V343-W374 HydrophobicContact CG1-CD2 4Å; V343-W374 HydrophobicContact CG1-CG 3.91Å; V343-L379 HydrophobicContact CB-CD2 4.37Å; V343-L379 HydrophobicContact CG1-CD2 4.34Å; V343-L379 HydrophobicContact CG2-CD2 4.2Å; V343-L382 HydrophobicContact CG2-CD2 4.19Å; V343-L417 HydrophobicContact CG2-CD1 4.07Å
344	S	87.1	Confident	79.7	Confident	70 Å²	70	46.3 Å²	46.3	49%	0.49	26%	0.261	S	S	.	.	H	α-helix	trans	-62.1	-45.5	178.6	-63.3	0	0	0	0	112	S340 D341 L342 H348	S340-S344 VanDerWaalsContact O-CB 3.26Å; S340-S344 WeakPolarHBondContact O-CB 3.37Å; S340-S344 PolarHBondContact O-N 2.97Å; S340-S344 PolarHBondContact O-OG 3.48Å; D341-S344 PolarHBondContact O-N 3.48Å; L342-S344 VanDerWaalsContact C-N 3.34Å; L342-S344 PolarHBondContact O-N 2.85Å; S344-H348 WeakPolarHBondContact O-CB 2.98Å; S344-H348 PolarHBondContact O-N 3.37Å; S344-H348 VanDerWaalsContact O-N 3.07Å
345	R	85.3	Confident	78	Confident	83 Å²	83	50.5 Å²	50.5	31%	0.313	28%	0.277	S	S	.	.	H	α-helix	trans	-59.1	-54.6	173.1	-78.6	-166.3	-75.3	-88.1	-5.5	111.1	S327 D341 L342 M347 H348 H349	S327-R345 PolarHBondContact OG-NE 3.04Å; D341-R345 PolarHBondContact O-N 2.92Å; D341-R345 IonicContact OD1-CZ 3.7Å; D341-R345 IonicContact OD1-NH1 3Å; D341-R345 PolarHBondContact OD1-NH1 2.73Å; D341-R345 IonicContact OD2-CZ 3.08Å; D341-R345 IonicContact OD2-NH1 2.62Å; D341-R345 PolarHBondContact OD2-NH1 2.98Å; D341-R345 IonicContact OD2-NH2 2.8Å; D341-R345 PolarHBondContact OD2-NH2 3.41Å; L342-R345 PolarHBondContact O-N 3.41Å; R345-M347 VanDerWaalsContact C-N 3.35Å; R345-M347 PolarHBondContact O-N 2.78Å; R345-H348 PolarHBondContact O-N 3.48Å; R345-H349 PolarHBondContact O-CD2 2.79Å; R345-H349 PolarHBondContact O-N 3.04Å
346	A	86	Confident	76	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-57	-46.9	-177.9	0	0	0	0	0	111.9	L328 L342 V343 H348 H349 L350 I421	L328-A346 HydrophobicContact CD2-CB 3.74Å; L342-A346 WeakPolarHBondContact O-CB 3.45Å; L342-A346 PolarHBondContact O-N 3.32Å; V343-A346 PolarHBondContact O-N 3.27Å; A346-H348 PolarHBondContact O-N 3.28Å; A346-H349 PolarHBondContact O-N 3.5Å; A346-L350 WeakPolarHBondContact O-CB 3.39Å; A346-L350 VanDerWaalsContact O-CG 3.28Å; A346-L350 WeakPolarHBondContact O-CG 3.42Å; A346-L350 PolarHBondContact O-N 3.07Å; A346-I421 HydrophobicContact CB-CD1 3.52Å
347	M	83.9	Confident	74	Confident	16 Å²	16	57.5 Å²	57.5	8%	0.079	30%	0.303	C	S	.	.	H	α-helix	trans	-63.6	-39.6	179.2	-72.8	-61.5	-65.8	0	0	112.6	V343 R345 H349 L350 Q351 V372 I421 V425	V343-M347 HydrophobicContact CG1-CG 4.07Å; V343-M347 VanDerWaalsContact O-CB 3.3Å; V343-M347 WeakPolarHBondContact O-CB 3.5Å; V343-M347 VanDerWaalsContact O-CG 3.25Å; V343-M347 WeakPolarHBondContact O-CG 3.43Å; V343-M347 PolarHBondContact O-N 2.78Å; R345-M347 VanDerWaalsContact C-N 3.35Å; R345-M347 PolarHBondContact O-N 2.78Å; M347-H349 PolarHBondContact O-N 3.21Å; M347-L350 PolarHBondContact O-N 3.18Å; M347-Q351 WeakPolarHBondContact O-CB 3.42Å; M347-Q351 PolarHBondContact O-N 3.3Å; M347-V372 HydrophobicContact CE-CB 3.96Å; M347-V372 HydrophobicContact CE-CG1 4.4Å; M347-I421 HydrophobicContact SD-CG2 3.54Å; M347-I421 VanDerWaalsContact SD-CG2 3.54Å; M347-V425 HydrophobicContact CE-CG2 4.24Å; M347-V425 HydrophobicContact SD-CG2 4.25Å
348	H	80.6	Confident	71.8	Confident	119 Å²	119	59.8 Å²	59.8	55%	0.551	31%	0.312	S	S	*	.	H	α-helix	trans	-58.8	-37.2	176.1	-174.9	-83.1	0	0	0	112.1	S344 R345 A346	S344-H348 WeakPolarHBondContact O-CB 2.98Å; S344-H348 PolarHBondContact O-N 3.37Å; S344-H348 VanDerWaalsContact O-N 3.07Å; R345-H348 PolarHBondContact O-N 3.48Å; A346-H348 PolarHBondContact O-N 3.28Å
349	H	75	Confident	69.5	Low	41 Å²	41	57.6 Å²	57.6	19%	0.19	31%	0.306	C	S	.	.	H	α-helix	trans	-84.2	-33.8	179.1	-72.1	-81.8	0	0	0	114.3	Y316 L324 R345 A346 M347 Q351 P352	Y316-H349 AromaticContact CD1-CE1 3.94Å; Y316-H349 AromaticContact CE1-CE1 3.23Å; Y316-H349 WeakPolarHBondContact CE1-CE1 3.44Å; Y316-H349 AromaticContact CE1-ND1 3.91Å; Y316-H349 AromaticContact CE2-CE1 3.96Å; Y316-H349 AromaticContact CE2-ND1 3.87Å; Y316-H349 AromaticContact CZ-CE1 3.23Å; Y316-H349 AromaticContact CZ-ND1 3.4Å; Y316-H349 PolarHBondContact OH-CE1 2.84Å; Y316-H349 VanDerWaalsContact OH-CE1 3.29Å; Y316-H349 PolarHBondContact OH-ND1 3.42Å; L324-H349 HydrophobicContact CD1-CB 4.05Å; L324-H349 WeakPolarHBondContact CD1-CD2 3.3Å; L324-H349 HydrophobicContact CD2-CB 3.66Å; L324-H349 VanDerWaalsContact CD2-CD2 3.49Å; L324-H349 WeakPolarHBondContact CD2-CD2 3.23Å; L324-H349 WeakPolarHBondContact CD2-ND1 3.47Å; L324-H349 HydrophobicContact CG-CB 4.5Å; R345-H349 PolarHBondContact O-CD2 2.79Å; R345-H349 PolarHBondContact O-N 3.04Å; A346-H349 PolarHBondContact O-N 3.5Å; M347-H349 PolarHBondContact O-N 3.21Å; H349-Q351 VanDerWaalsContact C-N 3.33Å; H349-P352 WeakPolarHBondContact O-CD 3.26Å
350	L	75.1	Confident	67.2	Low	7 Å²	7	62.5 Å²	62.5	4%	0.037	33%	0.332	C	S	.	.	H	α-helix	trans	-75.9	-23.7	178.4	-67.8	171	0	0	0	111.9	L298 L328 A346 M347 L353 H354 I421	L298-L350 HydrophobicContact CD1-CD2 4.17Å; L298-L350 HydrophobicContact CD2-CD2 3.63Å; L328-L350 HydrophobicContact CD2-CD1 4.2Å; A346-L350 WeakPolarHBondContact O-CB 3.39Å; A346-L350 VanDerWaalsContact O-CG 3.28Å; A346-L350 WeakPolarHBondContact O-CG 3.42Å; A346-L350 PolarHBondContact O-N 3.07Å; M347-L350 PolarHBondContact O-N 3.18Å; L350-L353 HydrophobicContact CD2-CD1 4.46Å; L350-L353 WeakPolarHBondContact O-CB 3.41Å; L350-L353 PolarHBondContact O-N 2.68Å; L350-L353 VanDerWaalsContact O-N 3.14Å; L350-H354 PolarHBondContact O-N 3.23Å; L350-H354 PolarHBondContact O-ND1 2.99Å; L350-I421 HydrophobicContact CD1-CG2 3.95Å
351	Q	66.5	Low	64.6	Low	38 Å²	38	63.7 Å²	63.7	18%	0.178	35%	0.351	C	S	.	.	H	α-helix	trans	-58.7	-45.9	-175.1	178.2	173.6	16	0	0	114.8	M347 H349 L353 H354 I355 T371	M347-Q351 WeakPolarHBondContact O-CB 3.42Å; M347-Q351 PolarHBondContact O-N 3.3Å; H349-Q351 VanDerWaalsContact C-N 3.33Å; Q351-L353 PolarHBondContact O-N 3.49Å; Q351-H354 PolarHBondContact O-N 3.13Å; Q351-I355 HydrophobicContact CG-CD1 4.01Å; Q351-I355 WeakPolarHBondContact O-CG1 3.34Å; Q351-I355 PolarHBondContact O-N 3.38Å; Q351-T371 PolarHBondContact NE2-OG1 3.46Å
352	P	56.8	Low	62	Low	70 Å²	70	63.9 Å²	63.9	46%	0.455	36%	0.355	S	S	.	.	H	α-helix	trans	-62.6	-28.6	175.8	-23.2	34.7	0	0	0	114	H349 I355 K356	H349-P352 WeakPolarHBondContact O-CD 3.26Å; P352-I355 PolarHBondContact O-N 3.3Å; P352-K356 PolarHBondContact O-N 3.13Å
353	L	55.9	Low	59	Low	64 Å²	64	69.4 Å²	69.4	34%	0.335	39%	0.392	S	S	.	.	H	α-helix	trans	-74.3	-28.9	177.7	-61.7	173.7	0	0	0	112	W163 L298 L350 Q351	W163-L353 HydrophobicContact CZ2-CB 4.19Å; L298-L353 HydrophobicContact CD2-CD1 3.36Å; L350-L353 HydrophobicContact CD2-CD1 4.46Å; L350-L353 WeakPolarHBondContact O-CB 3.41Å; L350-L353 PolarHBondContact O-N 2.68Å; L350-L353 VanDerWaalsContact O-N 3.14Å; Q351-L353 PolarHBondContact O-N 3.49Å
354	H	53.9	Low	56.4	Low	49 Å²	49	74 Å²	74	23%	0.227	42%	0.42	C	S	.	.	H	α-helix	trans	-71.2	-35	170.1	-68.5	83.6	0	0	0	111.9	W163 L350 Q351 E429	W163-H354 AromaticContact CH2-CD2 3.84Å; W163-H354 AromaticContact CH2-CE1 3.29Å; W163-H354 WeakPolarHBondContact CH2-CE1 3.36Å; W163-H354 AromaticContact CH2-CG 3.95Å; W163-H354 AromaticContact CH2-ND1 3.59Å; W163-H354 AromaticContact CH2-NE2 3.41Å; W163-H354 WeakPolarHBondContact CH2-NE2 3.34Å; W163-H354 AromaticContact CZ3-CE1 3.84Å; W163-H354 AromaticContact CZ3-NE2 3.89Å; L350-H354 PolarHBondContact O-N 3.23Å; L350-H354 PolarHBondContact O-ND1 2.99Å; Q351-H354 PolarHBondContact O-N 3.13Å; H354-E429 IonicContact CD2-OE1 3.6Å
355	I	43.5	Very low	53.8	Low	111 Å²	111	79 Å²	79	57%	0.569	44%	0.435	S	S	*	.	H	α-helix	trans	-75.2	-30.4	-175.8	-65.5	165.4	0	0	0	112.8	Q351 P352 N357	Q351-I355 HydrophobicContact CG-CD1 4.01Å; Q351-I355 WeakPolarHBondContact O-CG1 3.34Å; Q351-I355 PolarHBondContact O-N 3.38Å; P352-I355 PolarHBondContact O-N 3.3Å; I355-N357 PolarHBondContact O-N 2.88Å
356	K	40.5	Very low	51.5	Low	173 Å²	173	82.5 Å²	82.5	75%	0.752	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-3	178.5	-75.2	-174.7	-179.3	178.1	0	114.7	P352 P358	P352-K356 PolarHBondContact O-N 3.13Å; K356-P358 VanDerWaalsContact C-CD 3.49Å; K356-P358 WeakPolarHBondContact O-CD 3.2Å
357	N	43.1	Very low	48.8	Very low	70 Å²	70	92.1 Å²	92.1	37%	0.374	50%	0.497	S	S	.	.			trans	-104.5	83.1	175.3	-92.8	-16.8	0	0	0	111.1	I355 S359	I355-N357 PolarHBondContact O-N 2.88Å; N357-S359 PolarHBondContact O-N 3.44Å
358	P	39.8	Very low	46.7	Very low	119 Å²	119	95.2 Å²	95.2	77%	0.773	52%	0.52	S	S	*	.			trans	-74.2	80.2	173.3	33	-33.6	0	0	0	108.9	K356 N360	K356-P358 VanDerWaalsContact C-CD 3.49Å; K356-P358 WeakPolarHBondContact O-CD 3.2Å; P358-N360 PolarHBondContact O-N 2.94Å
359	S	40.5	Very low	45	Very low	38 Å²	38	93.6 Å²	93.6	27%	0.266	52%	0.522	S	S	.	.			trans	-83.7	9.6	179.6	52.3	0	0	0	0	114	N357	N357-S359 PolarHBondContact O-N 3.44Å
360	N	40.2	Very low	43.8	Very low	104 Å²	104	94.6 Å²	94.6	56%	0.556	53%	0.534	S	S	*	.	S	Bend	trans	-124.5	112.9	175.5	-80.4	-21.7	0	0	0	110.6	P358 T362	P358-N360 PolarHBondContact O-N 2.94Å; N360-T362 PolarHBondContact O-N 3.07Å
361	G	35	Very low	43.3	Very low	70 Å²	70	96.2 Å²	96.2	72%	0.722	54%	0.544	S	S	*	.	S	Bend	trans	-70.2	52.6	176.4	0	0	0	0	0	114.7
362	T	32.4	Very low	43.8	Very low	81 Å²	81	95.8 Å²	95.8	50%	0.497	54%	0.544	S	S	.	.	S	Bend	trans	-137.9	124.1	160.6	43.4	0	0	0	0	108.1	N360 V364	N360-T362 PolarHBondContact O-N 3.07Å; T362-V364 PolarHBondContact O-N 3.04Å
363	P	27.8	Very low	45	Very low	130 Å²	130	97.8 Å²	97.8	84%	0.844	55%	0.547	S	S	*	.			trans	-72.8	80.3	171.2	31.4	-30.6	0	0	0	107.6	H365	P363-H365 PolarHBondContact O-N 3.3Å
364	V	35	Very low	46.5	Very low	100 Å²	100	96.4 Å²	96.4	61%	0.606	54%	0.537	S	S	*	.			trans	-75.9	114.6	160.3	-179.1	0	0	0	0	104.5	T362 Q366	T362-V364 PolarHBondContact O-N 3.04Å; V364-Q366 HydrophobicContact CG1-CG 4.3Å; V364-Q366 PolarHBondContact O-N 3.43Å
365	H	32.1	Very low	48	Very low	177 Å²	177	96.7 Å²	96.7	82%	0.819	54%	0.539	S	S	*	.			trans	-58.1	83.2	166	-82.7	-71.2	0	0	0	109	P363 K367	P363-H365 PolarHBondContact O-N 3.3Å; H365-K367 PolarHBondContact O-N 3.06Å
366	Q	37.1	Very low	49.9	Very low	156 Å²	156	95.5 Å²	95.5	73%	0.729	54%	0.538	S	S	*	.			trans	-73.2	79.1	172.5	-82.1	-179.5	-26.1	0	0	108.6	V364 S368	V364-Q366 HydrophobicContact CG1-CG 4.3Å; V364-Q366 PolarHBondContact O-N 3.43Å; Q366-S368 PolarHBondContact O-N 3.04Å; Q366-S368 VanDerWaalsContact O-N 3.07Å
367	K	30.8	Very low	52	Low	201 Å²	201	92.9 Å²	92.9	87%	0.874	53%	0.529	S	S	*	.			trans	-78.4	56.2	162.4	-77.2	-174.8	175.7	179	0	110.1	H365	H365-K367 PolarHBondContact O-N 3.06Å
368	S	38.8	Very low	54.1	Low	82 Å²	82	89.5 Å²	89.5	57%	0.573	51%	0.511	S	S	*	.	S	Bend	trans	-171.8	117	158.4	-154.2	0	0	0	0	109	Q366 S370	Q366-S368 PolarHBondContact O-N 3.04Å; Q366-S368 VanDerWaalsContact O-N 3.07Å; S368-S370 PolarHBondContact O-N 3.26Å
369	S	44.3	Very low	56.5	Low	84 Å²	84	84.8 Å²	84.8	59%	0.587	48%	0.479	S	S	*	.			trans	-64.2	100.4	170.6	-176.4	0	0	0	0	108.9	T371	S369-T371 PolarHBondContact O-N 3.4Å
370	S	51.8	Low	58.7	Low	62 Å²	62	88.4 Å²	88.4	43%	0.434	49%	0.487	S	S	.	.			trans	-89.3	96.8	176.2	60.3	0	0	0	0	109.7	S368	S368-S370 PolarHBondContact O-N 3.26Å
371	T	64.1	Low	61	Low	42 Å²	42	84.4 Å²	84.4	26%	0.258	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-65.8	133.8	170.9	-48.6	0	0	0	0	110.1	Q351 S369 H373	Q351-T371 PolarHBondContact NE2-OG1 3.46Å; S369-T371 PolarHBondContact O-N 3.4Å; T371-H373 PolarHBondContact O-CD2 3.18Å; T371-H373 PolarHBondContact O-N 2.91Å; T371-H373 PolarHBondContact O-NE2 3.23Å
372	V	76.3	Confident	63.6	Low	28 Å²	28	81.1 Å²	81.1	17%	0.17	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-70.4	124.5	168.8	177.2	0	0	0	0	108.6	M347 T428 F434 V436	M347-V372 HydrophobicContact CE-CB 3.96Å; M347-V372 HydrophobicContact CE-CG1 4.4Å; V372-T428 HydrophobicContact CG1-CG2 4.13Å; V372-F434 CarbonylContact C-O 3.58Å; V372-F434 WeakPolarHBondContact CA-O 3.34Å; V372-V436 HydrophobicContact CG1-CG2 3.69Å
373	H	82.8	Confident	66.3	Low	113 Å²	113	77.4 Å²	77.4	52%	0.523	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	153	-178	-62.1	-63.3	0	0	0	111.2	T371 F434 S435 V436	T371-H373 PolarHBondContact O-CD2 3.18Å; T371-H373 PolarHBondContact O-N 2.91Å; T371-H373 PolarHBondContact O-NE2 3.23Å; H373-F434 PolarHBondContact N-O 2.96Å; H373-S435 CarbonylContact O-C 3.59Å; H373-S435 WeakPolarHBondContact O-CA 3.48Å; H373-V436 PolarHBondContact O-N 3.47Å
374	W	87.4	Confident	69	Low	34 Å²	34	77.5 Å²	77.5	13%	0.129	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	130.1	174.8	-75.4	66.7	0	0	0	110.1	V343 A378 L379 L382 I421 A424 V436 V441	V343-W374 HydrophobicContact CG1-CD2 4Å; V343-W374 HydrophobicContact CG1-CG 3.91Å; W374-A378 HydrophobicContact CE3-CB 3.98Å; W374-L379 HydrophobicContact CB-CD2 3.99Å; W374-L379 HydrophobicContact CB-CG 4.1Å; W374-L379 HydrophobicContact CD2-CD2 4.32Å; W374-L379 HydrophobicContact CE3-CD2 4Å; W374-L379 HydrophobicContact CG-CD2 4.35Å; W374-L382 HydrophobicContact CH2-CD2 4.03Å; W374-L382 HydrophobicContact CZ3-CB 4.48Å; W374-L382 HydrophobicContact CZ3-CD2 3.78Å; W374-I421 HydrophobicContact CZ2-CB 4.48Å; W374-I421 HydrophobicContact CZ2-CG1 4.05Å; W374-A424 HydrophobicContact CH2-CB 3.75Å; W374-A424 HydrophobicContact CZ2-CB 4.2Å; W374-V436 HydrophobicContact CD2-CB 3.89Å; W374-V436 HydrophobicContact CD2-CG1 4.07Å; W374-V436 HydrophobicContact CD2-CG2 4.05Å; W374-V436 HydrophobicContact CE3-CB 4.15Å; W374-V436 HydrophobicContact CE3-CG1 3.9Å; W374-V436 HydrophobicContact CG-CB 4.17Å; W374-V436 HydrophobicContact CG-CG2 4.24Å; W374-V436 HydrophobicContact CH2-CG1 4.03Å; W374-V436 HydrophobicContact CZ2-CG1 4.18Å; W374-V436 HydrophobicContact CZ2-CG2 4.2Å; W374-V436 HydrophobicContact CZ3-CG1 3.89Å; W374-V441 HydrophobicContact CE3-CG2 4.43Å; W374-V441 HydrophobicContact CH2-CG2 4.3Å; W374-V441 HydrophobicContact CZ3-CG2 3.61Å
375	E	84.3	Confident	71.5	Confident	56 Å²	56	73.8 Å²	73.8	26%	0.262	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-73.2	150.3	174.8	-69.1	178.5	-170	0	0	111	E377 A378 L379 S435 V436	E375-E377 VanDerWaalsContact C-N 3.27Å; E375-E377 PolarHBondContact O-N 3.23Å; E375-A378 HydrophobicContact CB-CB 4.37Å; E375-A378 VanDerWaalsContact O-CB 3.31Å; E375-A378 WeakPolarHBondContact O-CB 3.41Å; E375-A378 PolarHBondContact O-N 3.31Å; E375-L379 PolarHBondContact O-N 2.93Å; E375-L379 VanDerWaalsContact O-N 3.1Å; E375-S435 WeakPolarHBondContact OE1-CB 3.26Å; E375-S435 PolarHBondContact OE1-OG 2.72Å; E375-V436 WeakPolarHBondContact CB-O 3.28Å; E375-V436 PolarHBondContact N-O 3.35Å
376	P	84.7	Confident	74	Confident	86 Å²	86	65.3 Å²	65.3	56%	0.558	33%	0.331	S	S	*	.	H	α-helix	trans	-53.3	-44.8	177.5	-26.8	35.3	0	0	0	112.6	A378 L379 Y380	P376-A378 VanDerWaalsContact C-N 3.28Å; P376-A378 PolarHBondContact O-N 2.97Å; P376-L379 WeakPolarHBondContact O-CB 3.45Å; P376-L379 PolarHBondContact O-N 3.42Å; P376-L379 VanDerWaalsContact O-N 3.11Å; P376-Y380 HydrophobicContact CB-CE2 4.37Å; P376-Y380 WeakPolarHBondContact O-CD2 3.45Å; P376-Y380 PolarHBondContact O-N 3.05Å
377	E	82.8	Confident	75.9	Confident	117 Å²	117	59.1 Å²	59.1	55%	0.547	30%	0.302	S	S	.	.	H	α-helix	trans	-60.6	-34.9	176.9	-65.8	-57.9	138.9	0	0	112.9	E375 T381	E375-E377 VanDerWaalsContact C-N 3.27Å; E375-E377 PolarHBondContact O-N 3.23Å; E377-T381 WeakPolarHBondContact O-CB 3.5Å; E377-T381 PolarHBondContact O-N 3.1Å; E377-T381 PolarHBondContact O-OG1 3.43Å
378	A	88.4	Confident	77.3	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.1	-42.6	174.7	0	0	0	0	0	111.3	W374 E375 P376 T381 L382 V436 D437 V441	W374-A378 HydrophobicContact CE3-CB 3.98Å; E375-A378 HydrophobicContact CB-CB 4.37Å; E375-A378 VanDerWaalsContact O-CB 3.31Å; E375-A378 WeakPolarHBondContact O-CB 3.41Å; E375-A378 PolarHBondContact O-N 3.31Å; P376-A378 VanDerWaalsContact C-N 3.28Å; P376-A378 PolarHBondContact O-N 2.97Å; A378-T381 PolarHBondContact O-N 3.2Å; A378-L382 WeakPolarHBondContact O-CB 3.16Å; A378-L382 PolarHBondContact O-N 2.86Å; A378-V436 HydrophobicContact CB-CG1 4.43Å; A378-V436 WeakPolarHBondContact CB-O 3.38Å; A378-D437 VanDerWaalsContact CB-C 3.47Å; A378-D437 WeakPolarHBondContact CB-O 3.44Å; A378-V441 HydrophobicContact CB-CG2 4.05Å
379	L	89.1	Confident	78	Confident	19 Å²	19	52 Å²	52	10%	0.099	28%	0.275	C	S	.	.	H	α-helix	trans	-66.7	-40.4	176.4	-65.3	174.8	0	0	0	112	I336 L339 V343 W374 E375 P376 T381 L382 C383	I336-L379 HydrophobicContact CD1-CB 4.27Å; I336-L379 HydrophobicContact CG1-CB 4.47Å; L339-L379 WeakPolarHBondContact CD2-O 3.38Å; V343-L379 HydrophobicContact CB-CD2 4.37Å; V343-L379 HydrophobicContact CG1-CD2 4.34Å; V343-L379 HydrophobicContact CG2-CD2 4.2Å; W374-L379 HydrophobicContact CB-CD2 3.99Å; W374-L379 HydrophobicContact CB-CG 4.1Å; W374-L379 HydrophobicContact CD2-CD2 4.32Å; W374-L379 HydrophobicContact CE3-CD2 4Å; W374-L379 HydrophobicContact CG-CD2 4.35Å; E375-L379 PolarHBondContact O-N 2.93Å; E375-L379 VanDerWaalsContact O-N 3.1Å; P376-L379 WeakPolarHBondContact O-CB 3.45Å; P376-L379 PolarHBondContact O-N 3.42Å; P376-L379 VanDerWaalsContact O-N 3.11Å; L379-T381 VanDerWaalsContact C-N 3.34Å; L379-L382 PolarHBondContact O-N 3.35Å; L379-C383 WeakPolarHBondContact O-CB 3.18Å; L379-C383 PolarHBondContact O-N 2.97Å
380	Y	86.9	Confident	78	Confident	114 Å²	114	56.4 Å²	56.4	45%	0.447	29%	0.286	S	S	.	.	H	α-helix	trans	-59.8	-46.2	172.5	-77.8	-69	0	0	0	111.4	I336 P376 L382 C383 Y384	I336-Y380 HydrophobicContact CD1-CD1 3.28Å; I336-Y380 HydrophobicContact CD1-CD2 3.94Å; I336-Y380 HydrophobicContact CD1-CE1 3.26Å; I336-Y380 HydrophobicContact CD1-CE2 3.91Å; I336-Y380 HydrophobicContact CD1-CG 3.6Å; P376-Y380 HydrophobicContact CB-CE2 4.37Å; P376-Y380 WeakPolarHBondContact O-CD2 3.45Å; P376-Y380 PolarHBondContact O-N 3.05Å; Y380-L382 PolarHBondContact O-N 2.78Å; Y380-C383 PolarHBondContact O-N 3.05Å; Y380-Y384 PolarHBondContact O-N 3.17Å
381	T	88.8	Confident	77.6	Confident	21 Å²	21	58.4 Å²	58.4	13%	0.129	29%	0.29	C	S	.	.	H	α-helix	trans	-63	-42.9	179	-54.6	0	0	0	0	111.5	E377 A378 L379 Y384 F385 S438 V441 R442	E377-T381 WeakPolarHBondContact O-CB 3.5Å; E377-T381 PolarHBondContact O-N 3.1Å; E377-T381 PolarHBondContact O-OG1 3.43Å; A378-T381 PolarHBondContact O-N 3.2Å; L379-T381 VanDerWaalsContact C-N 3.34Å; T381-Y384 WeakPolarHBondContact O-CB 3.35Å; T381-Y384 PolarHBondContact O-N 3.19Å; T381-F385 HydrophobicContact CG2-CD2 4.18Å; T381-F385 HydrophobicContact CG2-CE2 3.75Å; T381-F385 WeakPolarHBondContact O-CD2 3.27Å; T381-F385 PolarHBondContact O-N 3.08Å; T381-S438 WeakPolarHBondContact OG1-CB 3.3Å; T381-S438 PolarHBondContact OG1-OG 3.27Å; T381-V441 HydrophobicContact CG2-CB 4.01Å; T381-V441 HydrophobicContact CG2-CG1 3.81Å; T381-R442 HydrophobicContact CG2-CG 4Å
382	L	90.3	Very high	76.6	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-68	-40.9	177.7	179.9	61.1	0	0	0	111.3	L339 V343 W374 A378 L379 Y380 Y384 F385 M386 L417 W420 V441	L339-L382 HydrophobicContact CD1-CD2 3.95Å; L339-L382 HydrophobicContact CD1-CG 4.25Å; L339-L382 HydrophobicContact CD2-CB 3.97Å; L339-L382 HydrophobicContact CD2-CD2 4.11Å; L339-L382 HydrophobicContact CD2-CG 3.9Å; L339-L382 HydrophobicContact CG-CD2 4.42Å; V343-L382 HydrophobicContact CG2-CD2 4.19Å; W374-L382 HydrophobicContact CH2-CD2 4.03Å; W374-L382 HydrophobicContact CZ3-CB 4.48Å; W374-L382 HydrophobicContact CZ3-CD2 3.78Å; A378-L382 WeakPolarHBondContact O-CB 3.16Å; A378-L382 PolarHBondContact O-N 2.86Å; L379-L382 PolarHBondContact O-N 3.35Å; Y380-L382 PolarHBondContact O-N 2.78Å; L382-Y384 VanDerWaalsContact C-N 3.3Å; L382-Y384 PolarHBondContact O-N 3.46Å; L382-F385 PolarHBondContact O-N 3.09Å; L382-F385 VanDerWaalsContact O-N 3.14Å; L382-M386 HydrophobicContact CD1-CG 4.01Å; L382-M386 HydrophobicContact CD1-SD 3.81Å; L382-M386 HydrophobicContact CD2-SD 4.38Å; L382-M386 HydrophobicContact CG-CG 4.39Å; L382-M386 HydrophobicContact CG-SD 3.94Å; L382-M386 PolarHBondContact O-N 3.2Å; L382-L417 HydrophobicContact CD2-CD1 4.15Å; L382-W420 HydrophobicContact CD1-CB 3.84Å; L382-W420 HydrophobicContact CD1-CD2 3.51Å; L382-W420 HydrophobicContact CD1-CE3 3.55Å; L382-W420 HydrophobicContact CD1-CG 3.66Å; L382-W420 HydrophobicContact CD1-CZ3 4.25Å; L382-V441 HydrophobicContact CB-CG1 3.89Å; L382-V441 HydrophobicContact CD1-CG1 4.24Å
383	C	88.6	Confident	75.1	Confident	3 Å²	3	72.3 Å²	72.3	2%	0.02	34%	0.343	C	S	.	.	H	α-helix	trans	-57.9	-45	175.4	-171	0	0	0	0	110.6	L339 L379 Y380 F385 M386 H387	L339-C383 HydrophobicContact CD2-CB 3.64Å; L339-C383 VanDerWaalsContact CD2-N 3.33Å; L379-C383 WeakPolarHBondContact O-CB 3.18Å; L379-C383 PolarHBondContact O-N 2.97Å; Y380-C383 PolarHBondContact O-N 3.05Å; C383-F385 VanDerWaalsContact C-N 3.32Å; C383-F385 PolarHBondContact O-N 2.65Å; C383-M386 CarbonylContact O-C 3.49Å; C383-M386 PolarHBondContact O-N 3.43Å; C383-H387 WeakPolarHBondContact O-CA 3.45Å; C383-H387 VanDerWaalsContact O-CB 3.29Å; C383-H387 WeakPolarHBondContact O-CB 3.39Å; C383-H387 PolarHBondContact O-N 3.25Å
384	Y	85.8	Confident	72.9	Confident	132 Å²	132	75.9 Å²	75.9	52%	0.518	36%	0.36	S	S	.	.	H	α-helix	trans	-54.6	-44.7	174.6	172.6	-93.4	0	0	0	112.8	Y380 T381 L382 R409	Y380-Y384 PolarHBondContact O-N 3.17Å; T381-Y384 WeakPolarHBondContact O-CB 3.35Å; T381-Y384 PolarHBondContact O-N 3.19Å; L382-Y384 VanDerWaalsContact C-N 3.3Å; L382-Y384 PolarHBondContact O-N 3.46Å; Y384-R409 PolarHBondContact O-NH2 3.13Å
385	F	86.2	Confident	70.9	Confident	22 Å²	22	81 Å²	81	10%	0.096	39%	0.39	C	S	.	.	H	α-helix	trans	-74.6	-30.2	178.9	-69.4	-60.8	0	0	0	113.6	T381 L382 C383 R409 W420 V441 R442 A445 L449 V452	T381-F385 HydrophobicContact CG2-CD2 4.18Å; T381-F385 HydrophobicContact CG2-CE2 3.75Å; T381-F385 WeakPolarHBondContact O-CD2 3.27Å; T381-F385 PolarHBondContact O-N 3.08Å; L382-F385 PolarHBondContact O-N 3.09Å; L382-F385 VanDerWaalsContact O-N 3.14Å; C383-F385 VanDerWaalsContact C-N 3.32Å; C383-F385 PolarHBondContact O-N 2.65Å; F385-R409 PolarHBondContact O-NH1 2.9Å; F385-R409 PolarHBondContact O-NH2 3Å; F385-W420 HydrophobicContact CB-CH2 3.6Å; F385-W420 HydrophobicContact CB-CZ2 3.92Å; F385-W420 HydrophobicContact CB-CZ3 4.33Å; F385-W420 HydrophobicContact CD2-CH2 4.16Å; F385-W420 HydrophobicContact CD2-CZ3 4.29Å; F385-W420 AromaticContact CG-CH2 3.9Å; F385-W420 HydrophobicContact CG-CH2 3.9Å; F385-W420 HydrophobicContact CG-CZ3 4.48Å; F385-V441 HydrophobicContact CD2-CG1 4.24Å; F385-R442 HydrophobicContact CE2-CG 4.5Å; F385-A445 HydrophobicContact CD1-CB 4.12Å; F385-A445 HydrophobicContact CD2-CB 3.78Å; F385-A445 HydrophobicContact CE1-CB 3.88Å; F385-A445 HydrophobicContact CE2-CB 3.51Å; F385-A445 HydrophobicContact CG-CB 4.09Å; F385-A445 HydrophobicContact CZ-CB 3.57Å; F385-L449 HydrophobicContact CB-CD1 4.28Å; F385-L449 HydrophobicContact CD1-CD1 3.72Å; F385-L449 HydrophobicContact CE1-CD1 4.43Å; F385-L449 HydrophobicContact CG-CD1 4.23Å; F385-V452 HydrophobicContact CE1-CG1 4.4Å; F385-V452 HydrophobicContact CE1-CG2 4.49Å; F385-V452 HydrophobicContact CZ-CG1 4.5Å
386	M	85.3	Confident	69	Low	0 Å²	0	82.9 Å²	82.9	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-91.2	-4.9	178.7	-64.8	-173	74.9	0	0	114.2	A330 R332 V333 L339 L382 C383 L417	A330-M386 WeakPolarHBondContact O-CE 2.89Å; R332-M386 VanDerWaalsContact CA-O 3.26Å; R332-M386 WeakPolarHBondContact CA-O 3.46Å; V333-M386 HydrophobicContact CG2-CB 4.45Å; V333-M386 HydrophobicContact CG2-CE 4.04Å; V333-M386 HydrophobicContact CG2-SD 4.48Å; V333-M386 PolarHBondContact N-O 3.28Å; L339-M386 HydrophobicContact CD1-SD 4Å; L382-M386 HydrophobicContact CD1-CG 4.01Å; L382-M386 HydrophobicContact CD1-SD 3.81Å; L382-M386 HydrophobicContact CD2-SD 4.38Å; L382-M386 HydrophobicContact CG-CG 4.39Å; L382-M386 HydrophobicContact CG-SD 3.94Å; L382-M386 PolarHBondContact O-N 3.2Å; C383-M386 CarbonylContact O-C 3.49Å; C383-M386 PolarHBondContact O-N 3.43Å; M386-L417 HydrophobicContact CE-CB 4.15Å; M386-L417 HydrophobicContact CE-CD1 4.13Å; M386-L417 HydrophobicContact SD-CD1 3.81Å
387	H	76.9	Confident	66.9	Low	26 Å²	26	85.9 Å²	85.9	12%	0.12	42%	0.418	C	S	.	.	B	Isolated β-bridge	trans	-65.2	148.3	-173.9	-168.6	57.5	0	0	0	113.4	C383 M391 W393	C383-H387 WeakPolarHBondContact O-CA 3.45Å; C383-H387 VanDerWaalsContact O-CB 3.29Å; C383-H387 WeakPolarHBondContact O-CB 3.39Å; C383-H387 PolarHBondContact O-N 3.25Å; H387-M391 PolarHBondContact NE2-O 3.49Å; H387-M391 VanDerWaalsContact NE2-O 3.16Å; H387-W393 AromaticContact CE1-NE1 3.72Å; H387-W393 AromaticContact NE2-CD1 3.91Å; H387-W393 AromaticContact NE2-NE1 3.75Å
388	C	59.2	Low	65	Low	25 Å²	25	87.3 Å²	87.3	17%	0.169	43%	0.434	C	S	.	.			trans	-93.4	119.3	170.9	-164.4	0	0	0	0	110.4	Q390 M391	C388-Q390 PolarHBondContact O-N 3.12Å; C388-Q390 PolarHBondContact SG-OE1 2.79Å; C388-Q390 VanDerWaalsContact SG-OE1 3.34Å; C388-M391 PolarHBondContact O-N 2.96Å
389	P	54	Low	62.3	Low	109 Å²	109	95.5 Å²	95.5	71%	0.708	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-1.4	-175.7	23.2	-31.3	0	0	0	115.4
390	Q	43.5	Very low	60.1	Low	175 Å²	175	100 Å²	100	82%	0.818	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-0.1	-179.9	-66.3	158.2	-18.3	0	0	113.7	C388	C388-Q390 PolarHBondContact O-N 3.12Å; C388-Q390 PolarHBondContact SG-OE1 2.79Å; C388-Q390 VanDerWaalsContact SG-OE1 3.34Å
391	M	44.2	Very low	57.7	Low	105 Å²	105	99.7 Å²	99.7	52%	0.517	52%	0.518	S	S	.	.	S	Bend	trans	-116.2	112.1	176.4	-98.1	164.9	61.5	0	0	110	G334 H387 C388	G334-M391 WeakPolarHBondContact O-CE 3.48Å; H387-M391 PolarHBondContact NE2-O 3.49Å; H387-M391 VanDerWaalsContact NE2-O 3.16Å; C388-M391 PolarHBondContact O-N 2.96Å
392	E	43.3	Very low	55.4	Low	191 Å²	191	108.6 Å²	108.6	89%	0.893	55%	0.554	S	S	*	*			trans	-67.9	134.2	173.8	-68.5	-176.7	164.5	0	0	110.5	E394	E392-E394 PolarHBondContact O-N 2.98Å
393	W	45.8	Very low	53	Low	170 Å²	170	113.1 Å²	113.1	64%	0.644	58%	0.582	S	S	*	*			trans	-79.5	114.1	171	-85.2	62.2	0	0	0	109.2	H387 N395	H387-W393 AromaticContact CE1-NE1 3.72Å; H387-W393 AromaticContact NE2-CD1 3.91Å; H387-W393 AromaticContact NE2-NE1 3.75Å; W393-N395 PolarHBondContact O-N 3.27Å
394	E	36.5	Very low	50.4	Low	188 Å²	188	119.9 Å²	119.9	88%	0.879	62%	0.623	S	S	*	*			trans	-76.7	91.3	166.7	-76.4	-173	157.3	0	0	110.5	E392	E392-E394 PolarHBondContact O-N 2.98Å
395	N	44.5	Very low	48.4	Very low	143 Å²	143	118.5 Å²	118.5	77%	0.765	62%	0.624	S	S	*	*			trans	77.6	165	143.4	-93.8	-18.6	0	0	0	122.2	W393	W393-N395 PolarHBondContact O-N 3.27Å
396	P	43.8	Very low	46.1	Very low	95 Å²	95	125.3 Å²	125.3	62%	0.617	66%	0.656	S	S	*	*			cis	-142.2	15.4	-31.3	34.5	-15.4	0	0	0	115.1
397	N	42	Very low	44.1	Very low	148 Å²	148	132 Å²	132	79%	0.791	70%	0.698	S	S	*	*	S	Bend	trans	-134.8	102.6	-170.3	-73.2	-34.8	0	0	0	114.5
398	V	42.8	Very low	42.5	Very low	147 Å²	147	138.8 Å²	138.8	89%	0.891	73%	0.729	S	S	*	*	S	Bend	trans	102.2	130.8	154.4	-168.2	0	0	0	0	116.9
399	E	32	Very low	42.2	Very low	173 Å²	173	142.8 Å²	142.8	81%	0.808	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-75.3	137.1	-142.2	-63.5	179.4	142.1	0	0	115.8	S401	E399-S401 PolarHBondContact O-N 3.38Å
400	P	42	Very low	41.8	Very low	114 Å²	114	141.6 Å²	141.6	74%	0.74	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-65.5	129.2	160.9	28.2	-29.8	0	0	0	108.5	K402	P400-K402 PolarHBondContact O-N 2.96Å
401	S	37	Very low	42.3	Very low	107 Å²	107	136.2 Å²	136.2	75%	0.748	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-50.1	132.3	176.4	32.8	0	0	0	0	110.6	E399 V403	E399-S401 PolarHBondContact O-N 3.38Å; S401-V403 PolarHBondContact O-N 3.36Å
402	K	39.2	Very low	42.9	Very low	207 Å²	207	139.1 Å²	139.1	90%	0.9	72%	0.724	S	S	*	*	S	Bend	trans	-63.2	77.1	176.1	-76.6	179.1	178	172	0	110.6	P400	P400-K402 PolarHBondContact O-N 2.96Å
403	V	39.5	Very low	44	Very low	96 Å²	96	132.2 Å²	132.2	58%	0.582	70%	0.695	S	S	*	*			trans	-122.4	89.6	159.4	-173.2	0	0	0	0	105	S401 L405	S401-V403 PolarHBondContact O-N 3.36Å; V403-L405 VanDerWaalsContact C-N 3.29Å; V403-L405 HydrophobicContact CG1-CD1 4.31Å; V403-L405 HydrophobicContact CG1-CG 4.01Å; V403-L405 PolarHBondContact O-N 3.04Å
404	T	34.3	Very low	45.8	Very low	144 Å²	144	124.9 Å²	124.9	88%	0.883	67%	0.668	S	S	*	*			trans	-67	91.3	171.1	44	0	0	0	0	108.4
405	L	44.3	Very low	48.2	Very low	103 Å²	103	116.7 Å²	116.7	54%	0.539	63%	0.631	S	S	.	*			trans	-85.3	135.7	165.9	-74.3	161.7	0	0	0	108.4	V403 T407	V403-L405 VanDerWaalsContact C-N 3.29Å; V403-L405 HydrophobicContact CG1-CD1 4.31Å; V403-L405 HydrophobicContact CG1-CG 4.01Å; V403-L405 PolarHBondContact O-N 3.04Å; L405-T407 PolarHBondContact O-N 3.11Å
406	Q	38.8	Very low	50.4	Low	165 Å²	165	109.9 Å²	109.9	77%	0.771	60%	0.595	S	S	*	*			trans	-44.8	126.9	176.8	-73.2	171.1	-37.4	0	0	110.4	E408	Q406-E408 PolarHBondContact O-N 3.37Å
407	T	42.8	Very low	52.7	Low	142 Å²	142	105.4 Å²	105.4	87%	0.871	57%	0.566	S	S	*	*	S	Bend	trans	-65.4	-3.3	-175.1	33.2	0	0	0	0	114.5	L405	L405-T407 PolarHBondContact O-N 3.11Å
408	E	42.9	Very low	55	Low	168 Å²	168	98.8 Å²	98.8	79%	0.785	53%	0.53	S	S	*	.			trans	-106.5	101.7	175.3	-66.3	-175.4	171.1	0	0	109.3	Q406 P410	Q406-E408 PolarHBondContact O-N 3.37Å; E408-P410 WeakPolarHBondContact O-CD 3.43Å
409	R	52.3	Low	57.2	Low	108 Å²	108	92 Å²	92	41%	0.408	49%	0.489	S	S	.	.			trans	-70.5	121.8	168	-68.1	-174.4	-176.5	177.4	2.4	107.7	Y384 F385 F411	Y384-R409 PolarHBondContact O-NH2 3.13Å; F385-R409 PolarHBondContact O-NH1 2.9Å; F385-R409 PolarHBondContact O-NH2 3Å; R409-F411 PolarHBondContact O-N 2.98Å
410	P	45.8	Very low	60.2	Low	85 Å²	85	84 Å²	84	55%	0.552	45%	0.451	S	S	*	.	S	Bend	trans	-73.1	19	-171.1	26.5	-32.7	0	0	0	115.2	E408	E408-P410 WeakPolarHBondContact O-CD 3.43Å
411	F	54.1	Low	62.5	Low	62 Å²	62	78.6 Å²	78.6	27%	0.272	42%	0.416	S	S	.	.			trans	-128.3	132.7	-172.6	-80.4	-94.1	0	0	0	113.1	H281 R409 V413 P450	H281-F411 AromaticContact CE1-CZ 3.83Å; H281-F411 AromaticContact NE2-CZ 3.53Å; R409-F411 PolarHBondContact O-N 2.98Å; F411-V413 VanDerWaalsContact C-N 3.31Å; F411-V413 PolarHBondContact O-N 3.4Å; F411-P450 HydrophobicContact CD2-CG 3.91Å; F411-P450 HydrophobicContact CE2-CB 4.27Å; F411-P450 HydrophobicContact CE2-CG 3.59Å
412	L	56.4	Low	65.1	Low	166 Å²	166	74.3 Å²	74.3	87%	0.869	38%	0.384	S	S	*	.	S	Bend	trans	-65.2	-29.9	173.7	-103	90.6	0	0	0	113.2	R332	R332-L412 PolarHBondContact NH2-O 3.23Å
413	V	67.9	Low	67.7	Low	46 Å²	46	64.5 Å²	64.5	28%	0.279	34%	0.341	S	S	.	.	S	Bend	trans	-138.9	122	-173.2	-172.2	0	0	0	0	111.5	L292 T331 F411	L292-V413 HydrophobicContact CD1-CG1 4.19Å; L292-V413 HydrophobicContact CD2-CG1 4.35Å; L292-V413 HydrophobicContact CG-CG1 4.48Å; T331-V413 HydrophobicContact CG2-CG1 4Å; F411-V413 VanDerWaalsContact C-N 3.31Å; F411-V413 PolarHBondContact O-N 3.4Å
414	L	82.1	Confident	70.2	Confident	16 Å²	16	60 Å²	60	8%	0.084	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-75.9	160.5	174	-68.5	174.3	0	0	0	111.4	T331 R332 L449	T331-L414 WeakPolarHBondContact CB-O 3.49Å; T331-L414 WeakPolarHBondContact CG2-O 3.43Å; T331-L414 WeakPolarHBondContact O-CB 3.49Å; R332-L414 HydrophobicContact CG-CD1 4Å; L414-L449 HydrophobicContact CD2-CD2 4.04Å
415	P	88.4	Confident	72.9	Confident	16 Å²	16	53.2 Å²	53.2	10%	0.104	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-57.9	140.5	174.6	-20.1	30.1	0	0	0	112	W420 L448 L449	P415-W420 PolarHBondContact O-NE1 3.38Å; P415-L448 HydrophobicContact CB-CB 4.42Å; P415-L448 HydrophobicContact CG-CB 3.85Å; P415-L449 HydrophobicContact CG-CD2 4.06Å
416	P	90.6	Very high	75.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-68.5	153.5	177.2	27.9	-32.9	0	0	0	111.8	L292 A330 T331 M418 E419	L292-P416 HydrophobicContact CD2-CG 4.26Å; A330-P416 CarbonylContact O-C 3.5Å; A330-P416 WeakPolarHBondContact O-CA 3.26Å; T331-P416 HydrophobicContact CG2-CB 4.39Å; P416-M418 HydrophobicContact CB-CE 4.43Å; P416-M418 HydrophobicContact CG-CE 4.28Å; P416-M418 PolarHBondContact O-N 3.16Å; P416-M418 VanDerWaalsContact O-N 3.1Å; P416-E419 HydrophobicContact CG-CG 3.85Å; P416-E419 WeakPolarHBondContact O-CB 3.46Å; P416-E419 PolarHBondContact O-N 3.02Å
417	L	91.2	Very high	77.6	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-52.4	-36	-175.9	-179.3	61.6	0	0	0	113	S327 L328 A330 L339 L342 V343 L382 M386 E419 W420 I421	S327-L417 WeakPolarHBondContact O-CD2 3.46Å; L328-L417 PolarHBondContact O-N 3.05Å; A330-L417 PolarHBondContact O-N 2.95Å; L339-L417 HydrophobicContact CD1-CD1 4.09Å; L342-L417 HydrophobicContact CB-CD2 3.7Å; V343-L417 HydrophobicContact CG2-CD1 4.07Å; L382-L417 HydrophobicContact CD2-CD1 4.15Å; M386-L417 HydrophobicContact CE-CB 4.15Å; M386-L417 HydrophobicContact CE-CD1 4.13Å; M386-L417 HydrophobicContact SD-CD1 3.81Å; L417-E419 PolarHBondContact O-N 2.93Å; L417-W420 WeakPolarHBondContact O-CB 3.39Å; L417-W420 PolarHBondContact O-N 2.94Å; L417-I421 HydrophobicContact CD1-CD1 4.29Å; L417-I421 HydrophobicContact CD1-CG1 4.34Å; L417-I421 HydrophobicContact CD2-CD1 4.38Å; L417-I421 HydrophobicContact CG-CD1 3.91Å; L417-I421 HydrophobicContact CG-CG1 4.38Å; L417-I421 WeakPolarHBondContact O-CG1 3.38Å; L417-I421 PolarHBondContact O-N 2.86Å
418	M	90.4	Very high	79.7	Confident	9 Å²	9	34.6 Å²	34.6	4%	0.044	17%	0.173	C	C	.	.	H	α-helix	trans	-58.3	-34.7	178.8	87.2	175.6	92	0	0	112.9	L294 P295 L298 L328 L329 P416 I421 R422	L294-M418 HydrophobicContact CD2-CE 3.19Å; L294-M418 HydrophobicContact CD2-SD 4.1Å; L294-M418 HydrophobicContact CG-CE 4.42Å; P295-M418 WeakPolarHBondContact CD-SD 3.33Å; P295-M418 HydrophobicContact CG-SD 4.15Å; L298-M418 HydrophobicContact CD1-SD 4.26Å; L328-M418 HydrophobicContact CB-CB 4.25Å; L328-M418 HydrophobicContact CD2-CB 3.98Å; L328-M418 PolarHBondContact O-N 3.1Å; L328-M418 VanDerWaalsContact O-N 3.07Å; L329-M418 HydrophobicContact CD2-CE 3.56Å; P416-M418 HydrophobicContact CB-CE 4.43Å; P416-M418 HydrophobicContact CG-CE 4.28Å; P416-M418 PolarHBondContact O-N 3.16Å; P416-M418 VanDerWaalsContact O-N 3.1Å; M418-I421 PolarHBondContact O-N 3.4Å; M418-R422 VanDerWaalsContact O-CB 3.32Å; M418-R422 WeakPolarHBondContact O-CB 3.41Å; M418-R422 PolarHBondContact O-N 2.83Å
419	E	90.1	Very high	81.7	Confident	5 Å²	5	29.7 Å²	29.7	2%	0.023	15%	0.15	C	C	.	.	H	α-helix	trans	-76.1	-37.8	-175.9	-65.6	-65.3	159.9	0	0	110.4	C284 P416 L417 R422 V423 L448	C284-E419 HydrophobicContact CB-CB 4.23Å; C284-E419 VanDerWaalsContact CB-CD 3.44Å; C284-E419 HydrophobicContact CB-CG 3.54Å; P416-E419 HydrophobicContact CG-CG 3.85Å; P416-E419 WeakPolarHBondContact O-CB 3.46Å; P416-E419 PolarHBondContact O-N 3.02Å; L417-E419 PolarHBondContact O-N 2.93Å; E419-R422 PolarHBondContact O-N 3.39Å; E419-R422 IonicContact OE2-CZ 3.44Å; E419-R422 IonicContact OE2-NE 3.79Å; E419-R422 PolarHBondContact OE2-NE 3.14Å; E419-R422 IonicContact OE2-NH2 3.68Å; E419-R422 PolarHBondContact OE2-NH2 2.61Å; E419-V423 WeakPolarHBondContact O-CG2 3.3Å; E419-V423 PolarHBondContact O-N 3.37Å; E419-L448 HydrophobicContact CB-CD1 4.46Å; E419-L448 HydrophobicContact CB-CD2 4.47Å
420	W	93.2	Very high	83.2	Confident	4 Å²	4	25.4 Å²	25.4	2%	0.015	14%	0.135	C	C	.	.	H	α-helix	trans	-58.5	-47.7	169.4	-73	101.7	0	0	0	111.7	L382 F385 P415 L417 A424 V441 A444 A445 L448 L449	L382-W420 HydrophobicContact CD1-CB 3.84Å; L382-W420 HydrophobicContact CD1-CD2 3.51Å; L382-W420 HydrophobicContact CD1-CE3 3.55Å; L382-W420 HydrophobicContact CD1-CG 3.66Å; L382-W420 HydrophobicContact CD1-CZ3 4.25Å; F385-W420 HydrophobicContact CB-CH2 3.6Å; F385-W420 HydrophobicContact CB-CZ2 3.92Å; F385-W420 HydrophobicContact CB-CZ3 4.33Å; F385-W420 HydrophobicContact CD2-CH2 4.16Å; F385-W420 HydrophobicContact CD2-CZ3 4.29Å; F385-W420 AromaticContact CG-CH2 3.9Å; F385-W420 HydrophobicContact CG-CH2 3.9Å; F385-W420 HydrophobicContact CG-CZ3 4.48Å; P415-W420 PolarHBondContact O-NE1 3.38Å; L417-W420 WeakPolarHBondContact O-CB 3.39Å; L417-W420 PolarHBondContact O-N 2.94Å; W420-A424 VanDerWaalsContact O-CB 3.23Å; W420-A424 WeakPolarHBondContact O-CB 3.46Å; W420-A424 PolarHBondContact O-N 3.33Å; W420-V441 HydrophobicContact CE3-CG1 4.49Å; W420-V441 HydrophobicContact CZ3-CG1 4.33Å; W420-A444 HydrophobicContact CE3-CB 4.04Å; W420-A444 HydrophobicContact CZ3-CB 4.21Å; W420-A445 HydrophobicContact CH2-CB 3.64Å; W420-A445 HydrophobicContact CZ3-CB 3.69Å; W420-L448 HydrophobicContact CD2-CD1 4.02Å; W420-L448 HydrophobicContact CE3-CD1 4.16Å; W420-L448 HydrophobicContact CG-CD1 4.34Å; W420-L449 HydrophobicContact CH2-CD1 3.78Å; W420-L449 HydrophobicContact CH2-CG 4.1Å; W420-L449 HydrophobicContact CZ2-CD1 3.93Å; W420-L449 HydrophobicContact CZ2-CD2 4.27Å; W420-L449 HydrophobicContact CZ2-CG 4.06Å
421	I	92.1	Very high	84.9	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-62.9	-48.6	178.2	-67.5	172.9	0	0	0	110.4	A346 M347 L350 W374 L417 M418 V423 V425	A346-I421 HydrophobicContact CB-CD1 3.52Å; M347-I421 HydrophobicContact SD-CG2 3.54Å; M347-I421 VanDerWaalsContact SD-CG2 3.54Å; L350-I421 HydrophobicContact CD1-CG2 3.95Å; W374-I421 HydrophobicContact CZ2-CB 4.48Å; W374-I421 HydrophobicContact CZ2-CG1 4.05Å; L417-I421 HydrophobicContact CD1-CD1 4.29Å; L417-I421 HydrophobicContact CD1-CG1 4.34Å; L417-I421 HydrophobicContact CD2-CD1 4.38Å; L417-I421 HydrophobicContact CG-CD1 3.91Å; L417-I421 HydrophobicContact CG-CG1 4.38Å; L417-I421 WeakPolarHBondContact O-CG1 3.38Å; L417-I421 PolarHBondContact O-N 2.86Å; M418-I421 PolarHBondContact O-N 3.4Å; I421-V423 PolarHBondContact O-N 2.73Å; I421-V425 HydrophobicContact CG2-CG2 4.02Å; I421-V425 VanDerWaalsContact O-CB 3.22Å; I421-V425 WeakPolarHBondContact O-CB 3.25Å; I421-V425 WeakPolarHBondContact O-CG2 3.38Å; I421-V425 PolarHBondContact O-N 3.27Å
422	R	90.7	Very high	86	Confident	18 Å²	18	22.9 Å²	22.9	7%	0.068	11%	0.112	C	C	.	.	H	α-helix	trans	-55.1	-51.4	-179.6	-179.2	-178	63.4	74	2.2	111.6	K158 V159 L161 W163 M418 E419 A426	K158-R422 PolarHBondContact O-NH1 3Å; V159-R422 VanDerWaalsContact C-NH1 3.27Å; V159-R422 PolarHBondContact O-NH1 3.28Å; V159-R422 PolarHBondContact O-NH2 3.31Å; L161-R422 PolarHBondContact O-NH1 2.59Å; W163-R422 HydrophobicContact CE3-CG 4.33Å; M418-R422 VanDerWaalsContact O-CB 3.32Å; M418-R422 WeakPolarHBondContact O-CB 3.41Å; M418-R422 PolarHBondContact O-N 2.83Å; E419-R422 PolarHBondContact O-N 3.39Å; E419-R422 IonicContact OE2-CZ 3.44Å; E419-R422 IonicContact OE2-NE 3.79Å; E419-R422 PolarHBondContact OE2-NE 3.14Å; E419-R422 IonicContact OE2-NH2 3.68Å; E419-R422 PolarHBondContact OE2-NH2 2.61Å; R422-A426 VanDerWaalsContact O-CB 3.29Å; R422-A426 WeakPolarHBondContact O-CB 3.38Å; R422-A426 PolarHBondContact O-N 2.96Å
423	V	93.4	Very high	87	Confident	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-70.9	-45.4	-175.7	179.7	0	0	0	0	111.5	V159 E419 I421 V425 A426 H427 A444 L447 L448	V159-V423 HydrophobicContact CG1-CG1 4.08Å; E419-V423 WeakPolarHBondContact O-CG2 3.3Å; E419-V423 PolarHBondContact O-N 3.37Å; I421-V423 PolarHBondContact O-N 2.73Å; V423-V425 PolarHBondContact O-N 2.78Å; V423-A426 PolarHBondContact O-N 3.48Å; V423-H427 PolarHBondContact O-CD2 2.98Å; V423-H427 VanDerWaalsContact O-CD2 3.26Å; V423-H427 PolarHBondContact O-N 3.08Å; V423-H427 VanDerWaalsContact O-N 3.11Å; V423-A444 HydrophobicContact CB-CB 3.9Å; V423-A444 HydrophobicContact CG1-CB 3.61Å; V423-L447 HydrophobicContact CG1-CD2 4.2Å; V423-L447 HydrophobicContact CG2-CD2 4.32Å; V423-L448 HydrophobicContact CG2-CD1 4.27Å; V423-L448 HydrophobicContact CG2-CD2 4.31Å; V423-L448 HydrophobicContact CG2-CG 4.47Å
424	A	93.5	Very high	87.4	Confident	1 Å²	1	18.2 Å²	18.2	1%	0.008	8%	0.083	C	C	.	.	H	α-helix	trans	-65	-41.1	-179.8	0	0	0	0	0	112.3	W374 W420 H427 T428 V436	W374-A424 HydrophobicContact CH2-CB 3.75Å; W374-A424 HydrophobicContact CZ2-CB 4.2Å; W420-A424 VanDerWaalsContact O-CB 3.23Å; W420-A424 WeakPolarHBondContact O-CB 3.46Å; W420-A424 PolarHBondContact O-N 3.33Å; A424-H427 PolarHBondContact O-N 3.15Å; A424-T428 PolarHBondContact O-N 3.48Å; A424-T428 PolarHBondContact O-OG1 3.32Å; A424-V436 HydrophobicContact CB-CG1 3.91Å
425	V	90.6	Very high	87.4	Confident	2 Å²	2	18 Å²	18	1%	0.012	8%	0.084	C	C	.	.	H	α-helix	trans	-66.4	-38.7	174.9	174	0	0	0	0	110.8	M347 I421 V423 H427 T428 E429 V436	M347-V425 HydrophobicContact CE-CG2 4.24Å; M347-V425 HydrophobicContact SD-CG2 4.25Å; I421-V425 HydrophobicContact CG2-CG2 4.02Å; I421-V425 VanDerWaalsContact O-CB 3.22Å; I421-V425 WeakPolarHBondContact O-CB 3.25Å; I421-V425 WeakPolarHBondContact O-CG2 3.38Å; I421-V425 PolarHBondContact O-N 3.27Å; V423-V425 PolarHBondContact O-N 2.78Å; V425-H427 VanDerWaalsContact C-N 3.33Å; V425-H427 PolarHBondContact O-N 2.95Å; V425-T428 WeakPolarHBondContact O-CB 3.23Å; V425-T428 PolarHBondContact O-N 3.24Å; V425-T428 VanDerWaalsContact O-N 3.14Å; V425-E429 HydrophobicContact CG1-CG 4.18Å; V425-E429 WeakPolarHBondContact O-CB 3.45Å; V425-E429 WeakPolarHBondContact O-CG 3.47Å; V425-E429 PolarHBondContact O-N 3.42Å; V425-V436 HydrophobicContact CG2-CG2 4.28Å
426	A	90.8	Very high	87.3	Confident	4 Å²	4	17.3 Å²	17.3	3%	0.033	8%	0.079	C	C	.	.	H	α-helix	trans	-61.8	-37.9	176.3	0	0	0	0	0	112.9	K158 V159 R422 V423 H430	K158-A426 HydrophobicContact CB-CB 3.91Å; V159-A426 HydrophobicContact CG2-CB 3.67Å; R422-A426 VanDerWaalsContact O-CB 3.29Å; R422-A426 WeakPolarHBondContact O-CB 3.38Å; R422-A426 PolarHBondContact O-N 2.96Å; V423-A426 PolarHBondContact O-N 3.48Å; A426-H430 WeakPolarHBondContact O-CB 3.49Å; A426-H430 PolarHBondContact O-N 3.37Å; A426-H430 VanDerWaalsContact O-N 3.07Å
427	H	90.1	Very high	87.2	Confident	15 Å²	15	18.2 Å²	18.2	7%	0.069	8%	0.084	C	C	.	.	H	α-helix	trans	-66.4	-41.4	171.8	-78.6	-69.8	0	0	0	112.3	V423 A424 V425 H430 R431 D440	V423-H427 PolarHBondContact O-CD2 2.98Å; V423-H427 VanDerWaalsContact O-CD2 3.26Å; V423-H427 PolarHBondContact O-N 3.08Å; V423-H427 VanDerWaalsContact O-N 3.11Å; A424-H427 PolarHBondContact O-N 3.15Å; V425-H427 VanDerWaalsContact C-N 3.33Å; V425-H427 PolarHBondContact O-N 2.95Å; H427-H430 WeakPolarHBondContact O-CB 3.47Å; H427-H430 PolarHBondContact O-N 2.94Å; H427-R431 PolarHBondContact O-N 2.65Å; H427-D440 HydrophobicContact CB-CB 4.3Å
428	T	86.9	Confident	87	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-61.1	-45.8	176.5	-59.1	0	0	0	0	111.9	V372 A424 V425 R431 R432 S433 S435 V436 D440	V372-T428 HydrophobicContact CG1-CG2 4.13Å; A424-T428 PolarHBondContact O-N 3.48Å; A424-T428 PolarHBondContact O-OG1 3.32Å; V425-T428 WeakPolarHBondContact O-CB 3.23Å; V425-T428 PolarHBondContact O-N 3.24Å; V425-T428 VanDerWaalsContact O-N 3.14Å; T428-R431 VanDerWaalsContact O-CG 3.27Å; T428-R431 WeakPolarHBondContact O-CG 3.47Å; T428-R431 PolarHBondContact O-N 2.96Å; T428-R432 PolarHBondContact O-N 3.32Å; T428-S433 WeakPolarHBondContact CG2-O 3.41Å; T428-S433 PolarHBondContact O-N 2.73Å; T428-S435 WeakPolarHBondContact CG2-O 3.45Å; T428-V436 HydrophobicContact CG2-CG2 4.4Å; T428-V436 WeakPolarHBondContact OG1-CG2 3.43Å; T428-D440 PolarHBondContact OG1-OD2 3.4Å; T428-D440 VanDerWaalsContact OG1-OD2 3.12Å
429	E	84.2	Confident	86.9	Confident	66 Å²	66	20 Å²	20	31%	0.308	10%	0.095	S	C	.	.	H	α-helix	trans	-63.9	-39.8	176.6	-74	-174.4	159.8	0	0	111.8	K158 H354 V425 R431 R432	K158-E429 IonicContact NZ-OE2 2.74Å; K158-E429 PolarHBondContact NZ-OE2 3.49Å; H354-E429 IonicContact CD2-OE1 3.6Å; V425-E429 HydrophobicContact CG1-CG 4.18Å; V425-E429 WeakPolarHBondContact O-CB 3.45Å; V425-E429 WeakPolarHBondContact O-CG 3.47Å; V425-E429 PolarHBondContact O-N 3.42Å; E429-R431 VanDerWaalsContact C-N 3.32Å; E429-R431 PolarHBondContact O-N 3.37Å; E429-R432 PolarHBondContact O-N 3.1Å
430	H	85.1	Confident	86.9	Confident	18 Å²	18	19.9 Å²	19.9	8%	0.083	10%	0.095	C	C	.	.	H	α-helix	trans	-58.1	-44.5	178.5	-178.9	68.1	0	0	0	111.6	E152 S155 A426 H427 R432 Y557	E152-H430 IonicContact OE1-CE1 3.14Å; S155-H430 WeakPolarHBondContact CB-ND1 3.41Å; S155-H430 WeakPolarHBondContact OG-CB 3.46Å; S155-H430 PolarHBondContact OG-ND1 3.44Å; A426-H430 WeakPolarHBondContact O-CB 3.49Å; A426-H430 PolarHBondContact O-N 3.37Å; A426-H430 VanDerWaalsContact O-N 3.07Å; H427-H430 WeakPolarHBondContact O-CB 3.47Å; H427-H430 PolarHBondContact O-N 2.94Å; H430-R432 PolarHBondContact O-N 2.9Å; H430-Y557 PolarHBondContact CE1-OH 3.18Å
431	R	81.6	Confident	86.9	Confident	27 Å²	27	19.7 Å²	19.7	10%	0.102	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	4.1	176.5	68.6	-177.2	-179.7	98.6	-3	114.4	H427 T428 E429 S433 S435 D437 D440	H427-R431 PolarHBondContact O-N 2.65Å; T428-R431 VanDerWaalsContact O-CG 3.27Å; T428-R431 WeakPolarHBondContact O-CG 3.47Å; T428-R431 PolarHBondContact O-N 2.96Å; E429-R431 VanDerWaalsContact C-N 3.32Å; E429-R431 PolarHBondContact O-N 3.37Å; R431-S433 PolarHBondContact NH1-OG 2.86Å; R431-S433 PolarHBondContact NH2-OG 3.31Å; R431-S433 PolarHBondContact O-N 2.92Å; R431-S435 PolarHBondContact NH2-O 3.44Å; R431-D437 IonicContact CZ-OD2 3.07Å; R431-D437 IonicContact NE-OD2 2.9Å; R431-D437 IonicContact NH1-OD2 2.85Å; R431-D437 IonicContact NH2-OD2 3.19Å; R431-D437 PolarHBondContact NH2-OD2 2.95Å; R431-D440 IonicContact CZ-OD2 3.73Å; R431-D440 IonicContact NE-OD1 2.81Å; R431-D440 PolarHBondContact NE-OD1 3.02Å; R431-D440 IonicContact NE-OD2 2.74Å; R431-D440 PolarHBondContact NE-OD2 2.86Å; R431-D440 IonicContact NH2-OD2 2.78Å; R431-D440 PolarHBondContact NH2-OD2 3.48Å
432	R	76.9	Confident	86.8	Confident	67 Å²	67	24.3 Å²	24.3	25%	0.253	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	33.7	-178.7	-57	-179.5	171.6	-160.4	-11.1	113.8	T428 E429 H430 V556 P558	T428-R432 PolarHBondContact O-N 3.32Å; E429-R432 PolarHBondContact O-N 3.1Å; H430-R432 PolarHBondContact O-N 2.9Å; R432-V556 PolarHBondContact NH1-O 3.06Å; R432-P558 VanDerWaalsContact NH2-CD 3.34Å
433	S	77.6	Confident	86.9	Confident	15 Å²	15	23.8 Å²	23.8	11%	0.105	11%	0.11	C	C	.	.			trans	-90.4	156.7	174.7	178.1	0	0	0	0	111.2	T428 R431 S435	T428-S433 WeakPolarHBondContact CG2-O 3.41Å; T428-S433 PolarHBondContact O-N 2.73Å; R431-S433 PolarHBondContact NH1-OG 2.86Å; R431-S433 PolarHBondContact NH2-OG 3.31Å; R431-S433 PolarHBondContact O-N 2.92Å; S433-S435 PolarHBondContact OG-N 3.18Å; S433-S435 VanDerWaalsContact OG-N 3.07Å; S433-S435 PolarHBondContact OG-O 3.03Å
434	F	76.1	Confident	86.9	Confident	98 Å²	98	23.8 Å²	23.8	43%	0.43	11%	0.11	S	C	.	.	S	Bend	trans	-102.1	-3	172.2	-56.3	-76	0	0	0	112.7	V372 H373	V372-F434 CarbonylContact C-O 3.58Å; V372-F434 WeakPolarHBondContact CA-O 3.34Å; H373-F434 PolarHBondContact N-O 2.96Å
435	S	81.4	Confident	86.8	Confident	13 Å²	13	23.8 Å²	23.8	9%	0.091	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	138.2	175.7	61.3	0	0	0	0	111.2	H373 E375 T428 R431 S433	H373-S435 CarbonylContact O-C 3.59Å; H373-S435 WeakPolarHBondContact O-CA 3.48Å; E375-S435 WeakPolarHBondContact OE1-CB 3.26Å; E375-S435 PolarHBondContact OE1-OG 2.72Å; T428-S435 WeakPolarHBondContact CG2-O 3.45Å; R431-S435 PolarHBondContact NH2-O 3.44Å; S433-S435 PolarHBondContact OG-N 3.18Å; S433-S435 VanDerWaalsContact OG-N 3.07Å; S433-S435 PolarHBondContact OG-O 3.03Å
436	V	87.8	Confident	86.8	Confident	0 Å²	0	25 Å²	25	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	123.9	167.7	-173.9	0	0	0	0	107.8	V372 H373 W374 E375 A378 A424 V425 T428 D440 V441	V372-V436 HydrophobicContact CG1-CG2 3.69Å; H373-V436 PolarHBondContact O-N 3.47Å; W374-V436 HydrophobicContact CD2-CB 3.89Å; W374-V436 HydrophobicContact CD2-CG1 4.07Å; W374-V436 HydrophobicContact CD2-CG2 4.05Å; W374-V436 HydrophobicContact CE3-CB 4.15Å; W374-V436 HydrophobicContact CE3-CG1 3.9Å; W374-V436 HydrophobicContact CG-CB 4.17Å; W374-V436 HydrophobicContact CG-CG2 4.24Å; W374-V436 HydrophobicContact CH2-CG1 4.03Å; W374-V436 HydrophobicContact CZ2-CG1 4.18Å; W374-V436 HydrophobicContact CZ2-CG2 4.2Å; W374-V436 HydrophobicContact CZ3-CG1 3.89Å; E375-V436 WeakPolarHBondContact CB-O 3.28Å; E375-V436 PolarHBondContact N-O 3.35Å; A378-V436 HydrophobicContact CB-CG1 4.43Å; A378-V436 WeakPolarHBondContact CB-O 3.38Å; A424-V436 HydrophobicContact CB-CG1 3.91Å; V425-V436 HydrophobicContact CG2-CG2 4.28Å; T428-V436 HydrophobicContact CG2-CG2 4.4Å; T428-V436 WeakPolarHBondContact OG1-CG2 3.43Å; V436-D440 HydrophobicContact CG1-CB 3.85Å; V436-V441 HydrophobicContact CG1-CG2 4.3Å
437	D	86.9	Confident	86.8	Confident	20 Å²	20	25 Å²	25	11%	0.107	11%	0.113	C	C	.	.			trans	-103.3	176.5	178.9	71.9	25.4	0	0	0	112.2	A378 R431 D439 D440 V441 R457	A378-D437 VanDerWaalsContact CB-C 3.47Å; A378-D437 WeakPolarHBondContact CB-O 3.44Å; R431-D437 IonicContact CZ-OD2 3.07Å; R431-D437 IonicContact NE-OD2 2.9Å; R431-D437 IonicContact NH1-OD2 2.85Å; R431-D437 IonicContact NH2-OD2 3.19Å; R431-D437 PolarHBondContact NH2-OD2 2.95Å; D437-D439 VanDerWaalsContact C-N 3.25Å; D437-D439 PolarHBondContact O-N 3Å; D437-D439 WeakPolarHBondContact OD1-CA 3.37Å; D437-D439 WeakPolarHBondContact OD1-CB 3.39Å; D437-D439 PolarHBondContact OD1-N 2.93Å; D437-D440 PolarHBondContact N-OD2 3.28Å; D437-D440 PolarHBondContact O-N 3.49Å; D437-D440 VanDerWaalsContact OD1-CG 3.29Å; D437-D440 PolarHBondContact OD1-N 3.42Å; D437-V441 PolarHBondContact O-N 3.33Å; D437-R457 IonicContact OD1-CZ 3.69Å; D437-R457 IonicContact OD1-NH2 3.37Å; D437-R457 PolarHBondContact OD1-NH2 3.25Å; D437-R457 IonicContact OD2-CZ 2.89Å; D437-R457 VanDerWaalsContact OD2-CZ 3.31Å; D437-R457 IonicContact OD2-NH1 2.81Å; D437-R457 PolarHBondContact OD2-NH1 3.36Å; D437-R457 IonicContact OD2-NH2 3.36Å; D437-R457 PolarHBondContact OD2-NH2 3.47Å
438	S	87.1	Confident	86.8	Confident	20 Å²	20	24.6 Å²	24.6	14%	0.14	11%	0.111	C	C	.	.	H	α-helix	trans	-62.7	-30.3	179.5	175.4	0	0	0	0	113.1	T381 V441 R442	T381-S438 WeakPolarHBondContact OG1-CB 3.3Å; T381-S438 PolarHBondContact OG1-OG 3.27Å; S438-V441 PolarHBondContact O-N 3.25Å; S438-R442 WeakPolarHBondContact O-CG 3.26Å; S438-R442 PolarHBondContact O-N 3.42Å; S438-R442 VanDerWaalsContact O-N 3.13Å; S438-R442 PolarHBondContact OG-NH1 3.46Å
439	D	88.3	Confident	86.8	Confident	27 Å²	27	25.2 Å²	25.2	14%	0.144	12%	0.115	C	C	.	.	H	α-helix	trans	-73.5	-40.1	179.2	-167.5	74.7	0	0	0	111.6	D437 V441 R442 Q443 R457	D437-D439 VanDerWaalsContact C-N 3.25Å; D437-D439 PolarHBondContact O-N 3Å; D437-D439 WeakPolarHBondContact OD1-CA 3.37Å; D437-D439 WeakPolarHBondContact OD1-CB 3.39Å; D437-D439 PolarHBondContact OD1-N 2.93Å; D439-V441 PolarHBondContact O-N 3.3Å; D439-R442 VanDerWaalsContact CA-NH2 3.32Å; D439-R442 VanDerWaalsContact CB-NH2 3.26Å; D439-R442 PolarHBondContact O-N 2.95Å; D439-R442 IonicContact OD1-CZ 2.81Å; D439-R442 IonicContact OD1-NE 2.83Å; D439-R442 IonicContact OD1-NH2 3.54Å; D439-R442 PolarHBondContact OD1-NH2 2.95Å; D439-Q443 WeakPolarHBondContact O-CG 3.45Å; D439-Q443 PolarHBondContact O-N 2.97Å; D439-Q443 PolarHBondContact OD2-NE2 3.41Å; D439-R457 IonicContact OD2-CZ 2.99Å; D439-R457 IonicContact OD2-NE 3.91Å; D439-R457 PolarHBondContact OD2-NE 3.5Å; D439-R457 VanDerWaalsContact OD2-NE 3.14Å; D439-R457 IonicContact OD2-NH2 3.85Å
440	D	91.4	Very high	86.6	Confident	2 Å²	2	24 Å²	24	1%	0.011	11%	0.112	C	C	.	.	H	α-helix	trans	-54.7	-37.8	174.3	-61.5	-40.8	0	0	0	111.4	H427 T428 R431 V436 D437 A444 R457	H427-D440 HydrophobicContact CB-CB 4.3Å; T428-D440 PolarHBondContact OG1-OD2 3.4Å; T428-D440 VanDerWaalsContact OG1-OD2 3.12Å; R431-D440 IonicContact CZ-OD2 3.73Å; R431-D440 IonicContact NE-OD1 2.81Å; R431-D440 PolarHBondContact NE-OD1 3.02Å; R431-D440 IonicContact NE-OD2 2.74Å; R431-D440 PolarHBondContact NE-OD2 2.86Å; R431-D440 IonicContact NH2-OD2 2.78Å; R431-D440 PolarHBondContact NH2-OD2 3.48Å; V436-D440 HydrophobicContact CG1-CB 3.85Å; D437-D440 PolarHBondContact N-OD2 3.28Å; D437-D440 PolarHBondContact O-N 3.49Å; D437-D440 VanDerWaalsContact OD1-CG 3.29Å; D437-D440 PolarHBondContact OD1-N 3.42Å; D440-A444 PolarHBondContact O-N 3.38Å; D440-A444 VanDerWaalsContact O-N 3.13Å; D440-R457 IonicContact OD1-CZ 3.52Å; D440-R457 IonicContact OD1-NH2 2.72Å; D440-R457 PolarHBondContact OD1-NH2 2.97Å; D440-R457 IonicContact OD2-NH2 3.18Å
441	V	91.9	Very high	86	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-72.5	-39.1	175.4	-178.1	0	0	0	0	112.4	W374 A378 T381 L382 F385 W420 V436 D437 S438 D439 A444 A445	W374-V441 HydrophobicContact CE3-CG2 4.43Å; W374-V441 HydrophobicContact CH2-CG2 4.3Å; W374-V441 HydrophobicContact CZ3-CG2 3.61Å; A378-V441 HydrophobicContact CB-CG2 4.05Å; T381-V441 HydrophobicContact CG2-CB 4.01Å; T381-V441 HydrophobicContact CG2-CG1 3.81Å; L382-V441 HydrophobicContact CB-CG1 3.89Å; L382-V441 HydrophobicContact CD1-CG1 4.24Å; F385-V441 HydrophobicContact CD2-CG1 4.24Å; W420-V441 HydrophobicContact CE3-CG1 4.49Å; W420-V441 HydrophobicContact CZ3-CG1 4.33Å; V436-V441 HydrophobicContact CG1-CG2 4.3Å; D437-V441 PolarHBondContact O-N 3.33Å; S438-V441 PolarHBondContact O-N 3.25Å; D439-V441 PolarHBondContact O-N 3.3Å; V441-A444 WeakPolarHBondContact O-CB 3.14Å; V441-A444 PolarHBondContact O-N 3.01Å; V441-A445 WeakPolarHBondContact O-CB 2.98Å; V441-A445 PolarHBondContact O-N 2.9Å
442	R	90.6	Very high	86	Confident	97 Å²	97	27 Å²	27	37%	0.366	15%	0.15	S	C	.	.	H	α-helix	trans	-66.1	-38.5	175.2	-71.7	-171.6	-63.5	-92.8	-1.1	112.3	T381 F385 S438 D439 A444 A445 R446 C454	T381-R442 HydrophobicContact CG2-CG 4Å; F385-R442 HydrophobicContact CE2-CG 4.5Å; S438-R442 WeakPolarHBondContact O-CG 3.26Å; S438-R442 PolarHBondContact O-N 3.42Å; S438-R442 VanDerWaalsContact O-N 3.13Å; S438-R442 PolarHBondContact OG-NH1 3.46Å; D439-R442 VanDerWaalsContact CA-NH2 3.32Å; D439-R442 VanDerWaalsContact CB-NH2 3.26Å; D439-R442 PolarHBondContact O-N 2.95Å; D439-R442 IonicContact OD1-CZ 2.81Å; D439-R442 IonicContact OD1-NE 2.83Å; D439-R442 IonicContact OD1-NH2 3.54Å; D439-R442 PolarHBondContact OD1-NH2 2.95Å; R442-A444 VanDerWaalsContact C-N 3.31Å; R442-A444 PolarHBondContact O-N 2.89Å; R442-A445 WeakPolarHBondContact O-CB 3.35Å; R442-A445 PolarHBondContact O-N 3.39Å; R442-R446 PolarHBondContact O-N 3.14Å; R442-C454 HydrophobicContact CB-CB 4.3Å; R442-C454 VanDerWaalsContact CB-SG 3.56Å
443	Q	92.1	Very high	86	Confident	8 Å²	8	29.7 Å²	29.7	4%	0.037	17%	0.17	C	C	.	.	H	α-helix	trans	-62.1	-41.5	173.4	-63.1	-61.5	-20.5	0	0	111	D439 R446 L447 C454 E455	D439-Q443 WeakPolarHBondContact O-CG 3.45Å; D439-Q443 PolarHBondContact O-N 2.97Å; D439-Q443 PolarHBondContact OD2-NE2 3.41Å; Q443-R446 PolarHBondContact O-N 3.41Å; Q443-L447 PolarHBondContact O-N 3.47Å; Q443-C454 PolarHBondContact NE2-SG 2.9Å; Q443-E455 PolarHBondContact NE2-O 3.09Å
444	A	94	Very high	86.4	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.8	-43	173.1	0	0	0	0	0	112.2	W420 V423 D440 V441 R442 R446 L447 L448	W420-A444 HydrophobicContact CE3-CB 4.04Å; W420-A444 HydrophobicContact CZ3-CB 4.21Å; V423-A444 HydrophobicContact CB-CB 3.9Å; V423-A444 HydrophobicContact CG1-CB 3.61Å; D440-A444 PolarHBondContact O-N 3.38Å; D440-A444 VanDerWaalsContact O-N 3.13Å; V441-A444 WeakPolarHBondContact O-CB 3.14Å; V441-A444 PolarHBondContact O-N 3.01Å; R442-A444 VanDerWaalsContact C-N 3.31Å; R442-A444 PolarHBondContact O-N 2.89Å; A444-R446 PolarHBondContact O-N 3.2Å; A444-L447 PolarHBondContact O-N 3.44Å; A444-L448 HydrophobicContact CB-CD1 4.47Å; A444-L448 WeakPolarHBondContact O-CB 3.36Å; A444-L448 VanDerWaalsContact O-CG 3.32Å; A444-L448 WeakPolarHBondContact O-CG 3.28Å; A444-L448 PolarHBondContact O-N 3.26Å
445	A	90.6	Very high	86.8	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61	-44	178.4	0	0	0	0	0	112.1	F385 W420 V441 R442 L447 L448 L449 V452	F385-A445 HydrophobicContact CD1-CB 4.12Å; F385-A445 HydrophobicContact CD2-CB 3.78Å; F385-A445 HydrophobicContact CE1-CB 3.88Å; F385-A445 HydrophobicContact CE2-CB 3.51Å; F385-A445 HydrophobicContact CG-CB 4.09Å; F385-A445 HydrophobicContact CZ-CB 3.57Å; W420-A445 HydrophobicContact CH2-CB 3.64Å; W420-A445 HydrophobicContact CZ3-CB 3.69Å; V441-A445 WeakPolarHBondContact O-CB 2.98Å; V441-A445 PolarHBondContact O-N 2.9Å; R442-A445 WeakPolarHBondContact O-CB 3.35Å; R442-A445 PolarHBondContact O-N 3.39Å; A445-L447 VanDerWaalsContact C-N 3.25Å; A445-L447 PolarHBondContact O-N 3.22Å; A445-L448 PolarHBondContact O-N 3.32Å; A445-L449 HydrophobicContact CB-CD1 4.39Å; A445-L449 WeakPolarHBondContact O-CA 3.45Å; A445-L449 VanDerWaalsContact O-CB 3.28Å; A445-L449 WeakPolarHBondContact O-CB 3.27Å; A445-L449 PolarHBondContact O-N 3.01Å; A445-V452 HydrophobicContact CB-CG1 4Å
446	R	91.1	Very high	87.1	Confident	28 Å²	28	31.8 Å²	31.8	11%	0.106	18%	0.18	C	C	.	.	H	α-helix	trans	-58	-37.7	175.7	177.4	-144.1	56.9	89.9	3.6	112.3	E137 R442 Q443 A444 V452 C454	E137-R446 IonicContact OE1-CZ 2.78Å; E137-R446 IonicContact OE1-NH1 2.95Å; E137-R446 PolarHBondContact OE1-NH1 2.85Å; E137-R446 IonicContact OE1-NH2 3.39Å; E137-R446 PolarHBondContact OE1-NH2 3.45Å; E137-R446 IonicContact OE2-CZ 3.95Å; E137-R446 IonicContact OE2-NH2 2.86Å; E137-R446 PolarHBondContact OE2-NH2 2.94Å; R442-R446 PolarHBondContact O-N 3.14Å; Q443-R446 PolarHBondContact O-N 3.41Å; A444-R446 PolarHBondContact O-N 3.2Å; R446-V452 WeakPolarHBondContact CA-O 3.47Å; R446-V452 WeakPolarHBondContact CG-O 3.44Å; R446-C454 HydrophobicContact CB-CB 3.92Å; R446-C454 HydrophobicContact CG-CB 4.43Å
447	L	91.2	Very high	86.9	Confident	5 Å²	5	33.9 Å²	33.9	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-75.1	-45.4	178.1	-175.6	61.8	0	0	0	112	V159 H281 L282 V423 Q443 A444 A445	V159-L447 HydrophobicContact CG1-CD2 3.32Å; V159-L447 WeakPolarHBondContact O-CD2 3.5Å; H281-L447 CarbonylContact C-O 3.55Å; H281-L447 WeakPolarHBondContact CA-O 3.44Å; L282-L447 HydrophobicContact CB-CD1 3.92Å; L282-L447 HydrophobicContact CB-CG 3.87Å; L282-L447 HydrophobicContact CD2-CD2 4.03Å; L282-L447 HydrophobicContact CD2-CG 4.2Å; L282-L447 PolarHBondContact N-O 3.39Å; V423-L447 HydrophobicContact CG1-CD2 4.2Å; V423-L447 HydrophobicContact CG2-CD2 4.32Å; Q443-L447 PolarHBondContact O-N 3.47Å; A444-L447 PolarHBondContact O-N 3.44Å; A445-L447 VanDerWaalsContact C-N 3.25Å; A445-L447 PolarHBondContact O-N 3.22Å
448	L	90.6	Very high	86.7	Confident	5 Å²	5	38.7 Å²	38.7	3%	0.026	21%	0.21	C	C	.	.	H	α-helix	trans	-89.1	-20.2	-167.6	-61.5	170.6	0	0	0	113.8	P415 E419 W420 V423 A444 A445	P415-L448 HydrophobicContact CB-CB 4.42Å; P415-L448 HydrophobicContact CG-CB 3.85Å; E419-L448 HydrophobicContact CB-CD1 4.46Å; E419-L448 HydrophobicContact CB-CD2 4.47Å; W420-L448 HydrophobicContact CD2-CD1 4.02Å; W420-L448 HydrophobicContact CE3-CD1 4.16Å; W420-L448 HydrophobicContact CG-CD1 4.34Å; V423-L448 HydrophobicContact CG2-CD1 4.27Å; V423-L448 HydrophobicContact CG2-CD2 4.31Å; V423-L448 HydrophobicContact CG2-CG 4.47Å; A444-L448 HydrophobicContact CB-CD1 4.47Å; A444-L448 WeakPolarHBondContact O-CB 3.36Å; A444-L448 VanDerWaalsContact O-CG 3.32Å; A444-L448 WeakPolarHBondContact O-CG 3.28Å; A444-L448 PolarHBondContact O-N 3.26Å; A445-L448 PolarHBondContact O-N 3.32Å
449	L	85.9	Confident	86.4	Confident	14 Å²	14	38.3 Å²	38.3	7%	0.073	21%	0.206	C	C	.	.	S	Bend	trans	-115.3	140.9	-177.6	-58.3	178.6	0	0	0	111.5	F385 L414 P415 W420 A445 V452	F385-L449 HydrophobicContact CB-CD1 4.28Å; F385-L449 HydrophobicContact CD1-CD1 3.72Å; F385-L449 HydrophobicContact CE1-CD1 4.43Å; F385-L449 HydrophobicContact CG-CD1 4.23Å; L414-L449 HydrophobicContact CD2-CD2 4.04Å; P415-L449 HydrophobicContact CG-CD2 4.06Å; W420-L449 HydrophobicContact CH2-CD1 3.78Å; W420-L449 HydrophobicContact CH2-CG 4.1Å; W420-L449 HydrophobicContact CZ2-CD1 3.93Å; W420-L449 HydrophobicContact CZ2-CD2 4.27Å; W420-L449 HydrophobicContact CZ2-CG 4.06Å; A445-L449 HydrophobicContact CB-CD1 4.39Å; A445-L449 WeakPolarHBondContact O-CA 3.45Å; A445-L449 VanDerWaalsContact O-CB 3.28Å; A445-L449 WeakPolarHBondContact O-CB 3.27Å; A445-L449 PolarHBondContact O-N 3.01Å; L449-V452 HydrophobicContact CB-CB 4.36Å; L449-V452 HydrophobicContact CB-CG2 3.72Å; L449-V452 HydrophobicContact CD1-CG2 4.19Å
450	P	80.6	Confident	85.7	Confident	39 Å²	39	40.5 Å²	40.5	25%	0.253	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	143.4	173.6	33.2	-39.4	0	0	0	111.2	F411 V452	F411-P450 HydrophobicContact CD2-CG 3.91Å; F411-P450 HydrophobicContact CE2-CB 4.27Å; F411-P450 HydrophobicContact CE2-CG 3.59Å; P450-V452 PolarHBondContact O-N 3.06Å; P450-V452 VanDerWaalsContact O-N 3.1Å
451	G	72.7	Confident	84.4	Confident	76 Å²	76	41 Å²	41	78%	0.784	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.9	1.6	171.4	0	0	0	0	0	115.5
452	V	80.9	Confident	83	Confident	32 Å²	32	46 Å²	46	19%	0.194	24%	0.243	C	C	.	.			trans	-86.6	124	170.9	-179.9	0	0	0	0	108.2	F385 A445 R446 L449 P450	F385-V452 HydrophobicContact CE1-CG1 4.4Å; F385-V452 HydrophobicContact CE1-CG2 4.49Å; F385-V452 HydrophobicContact CZ-CG1 4.5Å; A445-V452 HydrophobicContact CB-CG1 4Å; R446-V452 WeakPolarHBondContact CA-O 3.47Å; R446-V452 WeakPolarHBondContact CG-O 3.44Å; L449-V452 HydrophobicContact CB-CB 4.36Å; L449-V452 HydrophobicContact CB-CG2 3.72Å; L449-V452 HydrophobicContact CD1-CG2 4.19Å; P450-V452 PolarHBondContact O-N 3.06Å; P450-V452 VanDerWaalsContact O-N 3.1Å
453	D	76.3	Confident	81.3	Confident	125 Å²	125	42.4 Å²	42.4	67%	0.668	23%	0.231	S	C	*	.			trans	-111.8	146.2	173.3	-157	1.4	0	0	0	110.7
454	C	86.9	Confident	79.4	Confident	13 Å²	13	43.5 Å²	43.5	9%	0.088	24%	0.239	C	C	.	.			trans	-152.6	114.1	179	179.7	0	0	0	0	108.2	R140 R442 Q443 R446	R140-C454 PolarHBondContact NH2-O 3.11Å; R442-C454 HydrophobicContact CB-CB 4.3Å; R442-C454 VanDerWaalsContact CB-SG 3.56Å; Q443-C454 PolarHBondContact NE2-SG 2.9Å; R446-C454 HydrophobicContact CB-CB 3.92Å; R446-C454 HydrophobicContact CG-CB 4.43Å
455	E	84.6	Confident	77.6	Confident	137 Å²	137	48 Å²	48	64%	0.64	26%	0.259	S	S	*	.	P	Polyproline II helix	trans	-55.2	148	-179.4	-71	-60.1	154.1	0	0	112.4	Q443 R457	Q443-E455 PolarHBondContact NE2-O 3.09Å; E455-R457 PolarHBondContact O-N 3.4Å
456	P	86.8	Confident	75.8	Confident	19 Å²	19	49.9 Å²	49.9	12%	0.123	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-58.5	140.2	175.1	-18.2	31.6	0	0	0	110.8	R140 L143 Q458	R140-P456 HydrophobicContact CG-CG 4.48Å; R140-P456 VanDerWaalsContact NH2-CD 3.26Å; L143-P456 HydrophobicContact CD1-CB 3.71Å; L143-P456 HydrophobicContact CD1-CG 3.49Å; L143-P456 VanDerWaalsContact CD1-CG 3.49Å; P456-Q458 PolarHBondContact O-N 3.42Å
457	R	85	Confident	73.8	Confident	44 Å²	44	51 Å²	51	17%	0.166	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-61.3	125.8	177.2	-172.6	-179.1	-70.1	-123.4	20.2	110.7	D437 D439 D440 E455 D463	D437-R457 IonicContact OD1-CZ 3.69Å; D437-R457 IonicContact OD1-NH2 3.37Å; D437-R457 PolarHBondContact OD1-NH2 3.25Å; D437-R457 IonicContact OD2-CZ 2.89Å; D437-R457 VanDerWaalsContact OD2-CZ 3.31Å; D437-R457 IonicContact OD2-NH1 2.81Å; D437-R457 PolarHBondContact OD2-NH1 3.36Å; D437-R457 IonicContact OD2-NH2 3.36Å; D437-R457 PolarHBondContact OD2-NH2 3.47Å; D439-R457 IonicContact OD2-CZ 2.99Å; D439-R457 IonicContact OD2-NE 3.91Å; D439-R457 PolarHBondContact OD2-NE 3.5Å; D439-R457 VanDerWaalsContact OD2-NE 3.14Å; D439-R457 IonicContact OD2-NH2 3.85Å; D440-R457 IonicContact OD1-CZ 3.52Å; D440-R457 IonicContact OD1-NH2 2.72Å; D440-R457 PolarHBondContact OD1-NH2 2.97Å; D440-R457 IonicContact OD2-NH2 3.18Å; E455-R457 PolarHBondContact O-N 3.4Å; R457-D463 IonicContact NH1-OD1 3.81Å; R457-D463 PolarHBondContact NH1-OD1 2.96Å; R457-D463 VanDerWaalsContact NH1-OD1 3.07Å
458	Q	82.1	Confident	72.1	Confident	121 Å²	121	54.3 Å²	54.3	57%	0.565	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-90.5	156	176.6	-63.6	179.3	-7.1	0	0	111	P456 K460	P456-Q458 PolarHBondContact O-N 3.42Å; Q458-K460 HydrophobicContact CB-CG 4.29Å; Q458-K460 PolarHBondContact O-N 3.47Å
459	I	79.9	Confident	70.2	Confident	12 Å²	12	66.3 Å²	66.3	6%	0.062	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-68.9	118.4	168.4	-61.1	179.4	0	0	0	108.5	R144 Y145 M517 Y522 V525	R144-I459 HydrophobicContact CB-CG1 4.49Å; R144-I459 HydrophobicContact CG-CD1 4.03Å; R144-I459 HydrophobicContact CG-CG1 3.32Å; R144-I459 WeakPolarHBondContact O-CD1 3.46Å; R144-I459 WeakPolarHBondContact O-CG1 3.38Å; Y145-I459 HydrophobicContact CD1-CD1 3.66Å; Y145-I459 HydrophobicContact CE1-CD1 3.52Å; Y145-I459 HydrophobicContact CE1-CG1 4.26Å; I459-M517 HydrophobicContact CG2-CE 4.17Å; I459-M517 HydrophobicContact CG2-SD 4.06Å; I459-Y522 HydrophobicContact CG2-CD1 3.89Å; I459-Y522 HydrophobicContact CG2-CE1 3.68Å; I459-V525 HydrophobicContact CB-CG1 3.95Å; I459-V525 HydrophobicContact CD1-CG1 4.13Å; I459-V525 HydrophobicContact CD1-CG2 4.32Å; I459-V525 HydrophobicContact CG1-CG1 4.47Å; I459-V525 HydrophobicContact CG2-CG1 4.37Å
460	K	73.9	Confident	68.9	Low	73 Å²	73	73.9 Å²	73.9	32%	0.317	38%	0.384	S	S	.	.			trans	-140.3	158.8	174.7	-57.2	-176.6	-179.6	175.6	0	111.6	Q458 E462 D463	Q458-K460 HydrophobicContact CB-CG 4.29Å; Q458-K460 PolarHBondContact O-N 3.47Å; K460-E462 HydrophobicContact CB-CG 3.77Å; K460-E462 HydrophobicContact CD-CG 3.97Å; K460-E462 WeakPolarHBondContact CD-OE1 3.27Å; K460-E462 IonicContact NZ-OE1 3.1Å; K460-E462 PolarHBondContact NZ-OE1 2.83Å; K460-E462 PolarHBondContact O-N 3.06Å; K460-D463 PolarHBondContact O-N 3.27Å
461	A	65.7	Low	68.2	Low	14 Å²	14	74.5 Å²	74.5	12%	0.116	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-66.3	-26	176.1	0	0	0	0	0	112.9	D463 F486 N490 Y522	A461-D463 VanDerWaalsContact C-N 3.31Å; A461-D463 PolarHBondContact O-N 3.2Å; A461-F486 HydrophobicContact CB-CB 4.21Å; A461-F486 HydrophobicContact CB-CD1 3.92Å; A461-F486 HydrophobicContact CB-CG 4.41Å; A461-N490 VanDerWaalsContact CB-ND2 3.31Å; A461-N490 WeakPolarHBondContact CB-ND2 3.31Å; A461-Y522 HydrophobicContact CB-CD2 4.21Å; A461-Y522 HydrophobicContact CB-CE1 4.47Å; A461-Y522 HydrophobicContact CB-CE2 4.02Å
462	E	61	Low	68.5	Low	103 Å²	103	75.2 Å²	75.2	48%	0.481	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-75.1	-11.1	-177.9	57.9	-171	-179	0	0	114.6	K460 C464	K460-E462 HydrophobicContact CB-CG 3.77Å; K460-E462 HydrophobicContact CD-CG 3.97Å; K460-E462 WeakPolarHBondContact CD-OE1 3.27Å; K460-E462 IonicContact NZ-OE1 3.1Å; K460-E462 PolarHBondContact NZ-OE1 2.83Å; K460-E462 PolarHBondContact O-N 3.06Å; E462-C464 PolarHBondContact O-N 2.96Å
463	D	56.3	Low	68.6	Low	22 Å²	22	77.8 Å²	77.8	12%	0.118	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-67.7	-0.7	-174.3	-94.6	-16.8	0	0	0	115.3	R144 R457 K460 A461	R144-D463 IonicContact CZ-OD2 3.45Å; R144-D463 IonicContact NH1-OD2 3.42Å; R144-D463 IonicContact NH2-OD2 3.88Å; R144-D463 PolarHBondContact NH2-OD2 3.19Å; R457-D463 IonicContact NH1-OD1 3.81Å; R457-D463 PolarHBondContact NH1-OD1 2.96Å; R457-D463 VanDerWaalsContact NH1-OD1 3.07Å; K460-D463 PolarHBondContact O-N 3.27Å; A461-D463 VanDerWaalsContact C-N 3.31Å; A461-D463 PolarHBondContact O-N 3.2Å
464	C	52.2	Low	69	Low	31 Å²	31	74.8 Å²	74.8	21%	0.209	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-132.3	22.9	-164.2	-71.6	0	0	0	0	115.4	E462 C466 E514 Q515	E462-C464 PolarHBondContact O-N 2.96Å; C464-C466 PolarHBondContact O-N 3.41Å; C464-E514 HydrophobicContact CB-CB 3.86Å; C464-E514 HydrophobicContact CB-CG 4.15Å; C464-Q515 VanDerWaalsContact SG-CG 3.55Å; C464-Q515 PolarHBondContact SG-NE2 2.92Å
465	F	54.5	Low	68.7	Low	95 Å²	95	76.5 Å²	76.5	42%	0.417	40%	0.4	S	S	.	.			trans	-76	89.4	170.2	-167.7	-97.3	0	0	0	110.9	A467	F465-A467 HydrophobicContact CD1-CB 4.36Å; F465-A467 HydrophobicContact CE1-CB 3.52Å; F465-A467 HydrophobicContact CZ-CB 3.72Å
466	C	52.9	Low	68.5	Low	40 Å²	40	72.4 Å²	72.4	27%	0.27	39%	0.385	S	S	.	.			trans	-106	85.2	166.5	-64.8	0	0	0	0	109.6	C464 T468	C464-C466 PolarHBondContact O-N 3.41Å; C466-T468 HydrophobicContact CB-CG2 4.49Å; C466-T468 PolarHBondContact O-N 3.01Å
467	A	50.4	Low	68.3	Low	51 Å²	51	77.5 Å²	77.5	42%	0.421	41%	0.407	S	S	.	.			trans	-69.9	81.7	161.7	0	0	0	0	0	108.6	F465 R469	F465-A467 HydrophobicContact CD1-CB 4.36Å; F465-A467 HydrophobicContact CE1-CB 3.52Å; F465-A467 HydrophobicContact CZ-CB 3.72Å; A467-R469 PolarHBondContact O-N 3.32Å
468	T	54.1	Low	68.2	Low	74 Å²	74	78.2 Å²	78.2	45%	0.454	42%	0.422	S	S	.	.			trans	-62.9	137.1	171.6	70	0	0	0	0	108	C466 K470 L471	C466-T468 HydrophobicContact CB-CG2 4.49Å; C466-T468 PolarHBondContact O-N 3.01Å; T468-K470 PolarHBondContact O-N 3.2Å; T468-L471 PolarHBondContact O-N 3.37Å; T468-L471 VanDerWaalsContact O-N 3.1Å
469	R	50.6	Low	68	Low	258 Å²	258	75.3 Å²	75.3	97%	0.974	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	3.5	174.8	-61.7	-175.6	-173.8	179.9	2.4	114	A467	A467-R469 PolarHBondContact O-N 3.32Å
470	K	58.5	Low	68.1	Low	173 Å²	173	80.2 Å²	80.2	75%	0.752	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	-6.1	-178.5	-63.5	-176.7	-179.5	176.6	0	113.2	T468	T468-K470 PolarHBondContact O-N 3.2Å
471	L	66.2	Low	68.8	Low	51 Å²	51	79.4 Å²	79.4	27%	0.267	43%	0.427	S	S	.	.	S	Bend	trans	-77.1	142	174.3	-69.2	164.8	0	0	0	109.9	T468 K479	T468-L471 PolarHBondContact O-N 3.37Å; T468-L471 VanDerWaalsContact O-N 3.1Å; L471-K479 HydrophobicContact CD1-CD 3.99Å
472	D	79.8	Confident	69.7	Low	92 Å²	92	81.4 Å²	81.4	49%	0.492	43%	0.434	S	S	.	.			trans	-73.1	165.2	168.7	66.1	-15.9	0	0	0	110.7	A474 S475 T476	D472-A474 VanDerWaalsContact C-N 3.27Å; D472-A474 PolarHBondContact O-N 2.87Å; D472-S475 PolarHBondContact O-N 3.36Å; D472-S475 WeakPolarHBondContact OD1-CB 3.48Å; D472-S475 PolarHBondContact OD1-N 3.28Å; D472-S475 PolarHBondContact OD1-OG 3.22Å; D472-T476 PolarHBondContact O-N 3.38Å; D472-T476 PolarHBondContact O-OG1 3.05Å
473	A	83.3	Confident	70.7	Confident	85 Å²	85	77.5 Å²	77.5	70%	0.702	42%	0.417	S	S	*	.	H	α-helix	trans	-58.6	-40.4	-176.2	0	0	0	0	0	112	T476 E477	A473-T476 PolarHBondContact O-N 3.29Å; A473-E477 WeakPolarHBondContact O-CB 3.41Å; A473-E477 PolarHBondContact O-N 3.24Å
474	A	84.8	Confident	72.1	Confident	62 Å²	62	79.6 Å²	79.6	51%	0.512	43%	0.428	S	S	.	.	H	α-helix	trans	-65	-44.6	179.3	0	0	0	0	0	112.6	D472 T476 E477 A478	D472-A474 VanDerWaalsContact C-N 3.27Å; D472-A474 PolarHBondContact O-N 2.87Å; A474-T476 VanDerWaalsContact C-N 3.29Å; A474-T476 PolarHBondContact O-N 3.3Å; A474-E477 PolarHBondContact O-N 3.22Å; A474-A478 WeakPolarHBondContact O-CB 3.37Å; A474-A478 PolarHBondContact O-N 3.43Å
475	S	80.4	Confident	73.9	Confident	49 Å²	49	78.1 Å²	78.1	34%	0.343	42%	0.418	S	S	.	.	H	α-helix	trans	-67.7	-32.4	176.3	-57.9	0	0	0	0	112.2	D472 K479	D472-S475 PolarHBondContact O-N 3.36Å; D472-S475 WeakPolarHBondContact OD1-CB 3.48Å; D472-S475 PolarHBondContact OD1-N 3.28Å; D472-S475 PolarHBondContact OD1-OG 3.22Å; S475-K479 WeakPolarHBondContact O-CG 3.38Å; S475-K479 PolarHBondContact O-N 3.47Å
476	T	79.4	Confident	75.4	Confident	51 Å²	51	73.9 Å²	73.9	31%	0.313	40%	0.399	S	S	.	.	H	α-helix	trans	-67.6	-44.6	176.3	-54.3	0	0	0	0	111	D472 A473 A474 K479 F480	D472-T476 PolarHBondContact O-N 3.38Å; D472-T476 PolarHBondContact O-OG1 3.05Å; A473-T476 PolarHBondContact O-N 3.29Å; A474-T476 VanDerWaalsContact C-N 3.29Å; A474-T476 PolarHBondContact O-N 3.3Å; T476-K479 PolarHBondContact O-N 3.39Å; T476-F480 WeakPolarHBondContact O-CB 3.21Å; T476-F480 PolarHBondContact O-N 2.96Å
477	E	83.3	Confident	77	Confident	127 Å²	127	78.1 Å²	78.1	59%	0.593	41%	0.409	S	S	*	.	H	α-helix	trans	-60.3	-47.7	174.1	-176.8	177.1	-171.6	0	0	111.3	A473 A474 K479 F480 L481	A473-E477 WeakPolarHBondContact O-CB 3.41Å; A473-E477 PolarHBondContact O-N 3.24Å; A474-E477 PolarHBondContact O-N 3.22Å; E477-K479 VanDerWaalsContact C-N 3.34Å; E477-K479 PolarHBondContact O-N 3.43Å; E477-F480 WeakPolarHBondContact O-CB 3.23Å; E477-F480 PolarHBondContact O-N 3.45Å; E477-F480 VanDerWaalsContact O-N 3.14Å; E477-L481 HydrophobicContact CG-CD1 4.24Å; E477-L481 HydrophobicContact CG-CG 4.45Å; E477-L481 WeakPolarHBondContact O-CG 3.39Å; E477-L481 PolarHBondContact O-N 3.03Å
478	A	82.1	Confident	78.8	Confident	58 Å²	58	76.8 Å²	76.8	48%	0.479	40%	0.395	S	S	.	.	H	α-helix	trans	-57.9	-44.1	178	0	0	0	0	0	112.5	A474 L481 Q482	A474-A478 WeakPolarHBondContact O-CB 3.37Å; A474-A478 PolarHBondContact O-N 3.43Å; A478-L481 PolarHBondContact O-N 2.8Å; A478-Q482 WeakPolarHBondContact O-CB 3.32Å; A478-Q482 PolarHBondContact O-N 2.89Å
479	K	78.6	Confident	80.5	Confident	61 Å²	61	73.4 Å²	73.4	27%	0.265	37%	0.374	S	S	.	.	H	α-helix	trans	-65.9	-38.3	176.1	-74.1	-168.9	-176.1	-145.6	0	112.8	L471 S475 T476 E477 Q482 D483 E514	L471-K479 HydrophobicContact CD1-CD 3.99Å; S475-K479 WeakPolarHBondContact O-CG 3.38Å; S475-K479 PolarHBondContact O-N 3.47Å; T476-K479 PolarHBondContact O-N 3.39Å; E477-K479 VanDerWaalsContact C-N 3.34Å; E477-K479 PolarHBondContact O-N 3.43Å; K479-Q482 PolarHBondContact O-N 3.17Å; K479-D483 WeakPolarHBondContact O-CB 3.45Å; K479-D483 PolarHBondContact O-N 2.81Å; K479-E514 WeakPolarHBondContact CE-OE1 3.26Å; K479-E514 IonicContact NZ-OE1 2.67Å; K479-E514 PolarHBondContact NZ-OE1 3.42Å
480	F	83	Confident	82	Confident	115 Å²	115	63.6 Å²	63.6	50%	0.504	34%	0.341	S	S	.	.	H	α-helix	trans	-63.9	-45.4	175.8	176.5	-95.6	0	0	0	111.6	T476 E477 Q482 D483 L484	T476-F480 WeakPolarHBondContact O-CB 3.21Å; T476-F480 PolarHBondContact O-N 2.96Å; E477-F480 WeakPolarHBondContact O-CB 3.23Å; E477-F480 PolarHBondContact O-N 3.45Å; E477-F480 VanDerWaalsContact O-N 3.14Å; F480-Q482 VanDerWaalsContact C-N 3.33Å; F480-Q482 PolarHBondContact O-N 2.99Å; F480-D483 PolarHBondContact O-N 3.36Å; F480-L484 WeakPolarHBondContact O-CB 3.37Å; F480-L484 PolarHBondContact O-N 2.83Å
481	L	86.9	Confident	83.2	Confident	56 Å²	56	59 Å²	59	29%	0.293	33%	0.329	S	S	.	.	H	α-helix	trans	-64.2	-39.3	176.4	-65.2	179	0	0	0	111.8	E477 A478 L484 G485 L503	E477-L481 HydrophobicContact CG-CD1 4.24Å; E477-L481 HydrophobicContact CG-CG 4.45Å; E477-L481 WeakPolarHBondContact O-CG 3.39Å; E477-L481 PolarHBondContact O-N 3.03Å; A478-L481 PolarHBondContact O-N 2.8Å; L481-L484 PolarHBondContact O-N 3.48Å; L481-G485 PolarHBondContact O-N 3.34Å; L481-L503 HydrophobicContact CD2-CD2 4.25Å
482	Q	84.8	Confident	83.9	Confident	55 Å²	55	58.4 Å²	58.4	26%	0.257	34%	0.336	S	S	.	.	H	α-helix	trans	-60.3	-52.3	174.2	-174.1	-176.6	44.5	0	0	111.1	A478 K479 F480 L484 G485 F486 L504 M512	A478-Q482 WeakPolarHBondContact O-CB 3.32Å; A478-Q482 PolarHBondContact O-N 2.89Å; K479-Q482 PolarHBondContact O-N 3.17Å; F480-Q482 VanDerWaalsContact C-N 3.33Å; F480-Q482 PolarHBondContact O-N 2.99Å; Q482-L484 VanDerWaalsContact C-N 3.34Å; Q482-L484 PolarHBondContact O-N 3.45Å; Q482-G485 WeakPolarHBondContact O-CA 3.48Å; Q482-G485 PolarHBondContact O-N 2.93Å; Q482-G485 VanDerWaalsContact O-N 3.12Å; Q482-F486 HydrophobicContact CG-CD2 3.98Å; Q482-F486 HydrophobicContact CG-CE2 3.93Å; Q482-F486 WeakPolarHBondContact O-CD2 3.43Å; Q482-F486 PolarHBondContact O-N 2.97Å; Q482-L504 HydrophobicContact CG-CD2 4.02Å; Q482-L504 WeakPolarHBondContact O-CD2 3.31Å; Q482-M512 PolarHBondContact NE2-O 3.41Å
483	D	82.5	Confident	84.2	Confident	21 Å²	21	60 Å²	60	11%	0.112	34%	0.335	C	S	.	.	H	α-helix	trans	-58.8	-44	178.2	176.2	53.7	0	0	0	111.8	K479 F480 G485 F486 R487	K479-D483 WeakPolarHBondContact O-CB 3.45Å; K479-D483 PolarHBondContact O-N 2.81Å; F480-D483 PolarHBondContact O-N 3.36Å; D483-G485 VanDerWaalsContact C-N 3.34Å; D483-G485 PolarHBondContact O-N 3.32Å; D483-F486 PolarHBondContact O-N 3.2Å; D483-R487 WeakPolarHBondContact O-CG 3.27Å; D483-R487 PolarHBondContact O-N 3.07Å; D483-R487 IonicContact OD1-NE 3.39Å; D483-R487 PolarHBondContact OD1-NE 2.9Å; D483-R487 IonicContact OD1-NH2 3.83Å; D483-R487 IonicContact OD2-CZ 3.11Å; D483-R487 IonicContact OD2-NE 2.98Å; D483-R487 PolarHBondContact OD2-NE 3.3Å; D483-R487 IonicContact OD2-NH2 2.65Å; D483-R487 PolarHBondContact OD2-NH2 3.36Å
484	L	86.4	Confident	84.5	Confident	66 Å²	66	61 Å²	61	35%	0.346	33%	0.332	S	S	.	.	H	α-helix	trans	-59.1	-45.2	173.9	-179.2	60.1	0	0	0	111.6	F480 L481 Q482 F486 R487 M488 L503	F480-L484 WeakPolarHBondContact O-CB 3.37Å; F480-L484 PolarHBondContact O-N 2.83Å; L481-L484 PolarHBondContact O-N 3.48Å; Q482-L484 VanDerWaalsContact C-N 3.34Å; Q482-L484 PolarHBondContact O-N 3.45Å; L484-F486 PolarHBondContact O-N 3.09Å; L484-R487 PolarHBondContact O-N 3.35Å; L484-M488 HydrophobicContact CD1-CG 4.44Å; L484-M488 HydrophobicContact CG-SD 4.26Å; L484-M488 VanDerWaalsContact O-CG 3.28Å; L484-M488 WeakPolarHBondContact O-CG 3.43Å; L484-M488 PolarHBondContact O-N 3.17Å; L484-L503 HydrophobicContact CD2-CD1 3.91Å; L484-L503 HydrophobicContact CG-CD1 3.98Å
485	G	88.6	Confident	84.7	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-58.3	-45.6	175.4	0	0	0	0	0	112.7	L481 Q482 D483 R487 M488 L489	L481-G485 PolarHBondContact O-N 3.34Å; Q482-G485 WeakPolarHBondContact O-CA 3.48Å; Q482-G485 PolarHBondContact O-N 2.93Å; Q482-G485 VanDerWaalsContact O-N 3.12Å; D483-G485 VanDerWaalsContact C-N 3.34Å; D483-G485 PolarHBondContact O-N 3.32Å; G485-R487 PolarHBondContact O-N 2.87Å; G485-M488 PolarHBondContact O-N 2.94Å; G485-L489 PolarHBondContact O-N 3.43Å; G485-L489 VanDerWaalsContact O-N 3.08Å
486	F	87	Confident	85.2	Confident	6 Å²	6	61.2 Å²	61.2	3%	0.026	32%	0.321	C	S	.	.	H	α-helix	trans	-61.1	-43.7	174.3	-91.4	-92.6	0	0	0	112.1	A461 Q482 D483 L484 M488 L489 N490 L504 S511 P519 Y522	A461-F486 HydrophobicContact CB-CB 4.21Å; A461-F486 HydrophobicContact CB-CD1 3.92Å; A461-F486 HydrophobicContact CB-CG 4.41Å; Q482-F486 HydrophobicContact CG-CD2 3.98Å; Q482-F486 HydrophobicContact CG-CE2 3.93Å; Q482-F486 WeakPolarHBondContact O-CD2 3.43Å; Q482-F486 PolarHBondContact O-N 2.97Å; D483-F486 PolarHBondContact O-N 3.2Å; L484-F486 PolarHBondContact O-N 3.09Å; F486-M488 VanDerWaalsContact C-N 3.34Å; F486-M488 PolarHBondContact O-N 2.79Å; F486-L489 PolarHBondContact O-N 3.39Å; F486-N490 WeakPolarHBondContact O-CB 3.24Å; F486-N490 PolarHBondContact O-N 3.47Å; F486-N490 PolarHBondContact O-ND2 3.35Å; F486-L504 HydrophobicContact CD2-CD2 3.59Å; F486-L504 HydrophobicContact CE2-CD2 3.8Å; F486-S511 VanDerWaalsContact CZ-O 3.25Å; F486-S511 WeakPolarHBondContact CZ-O 3.25Å; F486-P519 HydrophobicContact CD1-CG 4.1Å; F486-P519 HydrophobicContact CE1-CG 3.73Å; F486-P519 HydrophobicContact CZ-CG 4.2Å; F486-Y522 HydrophobicContact CD1-CD2 4.4Å; F486-Y522 HydrophobicContact CD1-CE2 4.33Å; F486-Y522 HydrophobicContact CE1-CD2 4.13Å; F486-Y522 AromaticContact CE1-CE2 3.92Å; F486-Y522 HydrophobicContact CE1-CE2 3.92Å
487	R	86.2	Confident	85.7	Confident	129 Å²	129	59.5 Å²	59.5	49%	0.487	31%	0.31	S	S	.	.	H	α-helix	trans	-62.3	-41.1	176.4	-69.3	-180	-159.7	-164.4	5.7	111.9	D483 L484 G485 L489 N490 C491	D483-R487 WeakPolarHBondContact O-CG 3.27Å; D483-R487 PolarHBondContact O-N 3.07Å; D483-R487 IonicContact OD1-NE 3.39Å; D483-R487 PolarHBondContact OD1-NE 2.9Å; D483-R487 IonicContact OD1-NH2 3.83Å; D483-R487 IonicContact OD2-CZ 3.11Å; D483-R487 IonicContact OD2-NE 2.98Å; D483-R487 PolarHBondContact OD2-NE 3.3Å; D483-R487 IonicContact OD2-NH2 2.65Å; D483-R487 PolarHBondContact OD2-NH2 3.36Å; L484-R487 PolarHBondContact O-N 3.35Å; G485-R487 PolarHBondContact O-N 2.87Å; R487-L489 PolarHBondContact O-N 2.84Å; R487-N490 PolarHBondContact O-N 2.87Å; R487-C491 PolarHBondContact O-N 3.12Å; R487-C491 VanDerWaalsContact O-N 3.13Å; R487-C491 PolarHBondContact O-SG 3.28Å
488	M	89.3	Confident	85.9	Confident	24 Å²	24	61.6 Å²	61.6	12%	0.118	32%	0.317	C	S	.	.	H	α-helix	trans	-61.4	-42.6	177	-71.8	176.4	73.5	0	0	112.1	L484 G485 F486 C491 L496 Q499 A500 L503	L484-M488 HydrophobicContact CD1-CG 4.44Å; L484-M488 HydrophobicContact CG-SD 4.26Å; L484-M488 VanDerWaalsContact O-CG 3.28Å; L484-M488 WeakPolarHBondContact O-CG 3.43Å; L484-M488 PolarHBondContact O-N 3.17Å; G485-M488 PolarHBondContact O-N 2.94Å; F486-M488 VanDerWaalsContact C-N 3.34Å; F486-M488 PolarHBondContact O-N 2.79Å; M488-C491 WeakPolarHBondContact O-CB 3.42Å; M488-C491 PolarHBondContact O-N 3.17Å; M488-L496 HydrophobicContact CB-CB 4.46Å; M488-L496 HydrophobicContact CB-CD1 4.31Å; M488-L496 HydrophobicContact CE-CB 4.05Å; M488-L496 HydrophobicContact CE-CD1 4.29Å; M488-L496 HydrophobicContact CE-CD2 4.02Å; M488-L496 HydrophobicContact CE-CG 4.36Å; M488-L496 HydrophobicContact CG-CD1 4.39Å; M488-Q499 HydrophobicContact CE-CB 3.51Å; M488-A500 HydrophobicContact CB-CB 3.78Å; M488-L503 HydrophobicContact SD-CD1 3.54Å; M488-L503 VanDerWaalsContact SD-CD1 3.54Å
489	L	87.9	Confident	86.4	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-65.6	-43.8	173.9	-66.9	178.4	0	0	0	111.4	G485 F486 R487 C491 G492 V497 A500 L504 I509 P519 L535	G485-L489 PolarHBondContact O-N 3.43Å; G485-L489 VanDerWaalsContact O-N 3.08Å; F486-L489 PolarHBondContact O-N 3.39Å; R487-L489 PolarHBondContact O-N 2.84Å; L489-C491 PolarHBondContact O-N 3.27Å; L489-C491 VanDerWaalsContact O-N 3.09Å; L489-G492 PolarHBondContact O-N 2.85Å; L489-G492 VanDerWaalsContact O-N 3.11Å; L489-V497 HydrophobicContact CD2-CB 4.45Å; L489-V497 HydrophobicContact CD2-CG1 4.26Å; L489-V497 HydrophobicContact CD2-CG2 4.29Å; L489-A500 HydrophobicContact CD2-CB 3.7Å; L489-A500 HydrophobicContact CG-CB 3.75Å; L489-L504 HydrophobicContact CD1-CD1 3.55Å; L489-L504 HydrophobicContact CG-CD1 4.41Å; L489-I509 HydrophobicContact CD1-CG1 4.36Å; L489-P519 HydrophobicContact CD1-CB 3.77Å; L489-P519 HydrophobicContact CD1-CG 3.49Å; L489-P519 VanDerWaalsContact CD1-CG 3.49Å; L489-L535 HydrophobicContact CD2-CD2 4.28Å
490	N	82.5	Confident	86.9	Confident	52 Å²	52	61.2 Å²	61.2	28%	0.278	31%	0.307	S	S	.	.	H	α-helix	trans	-65.5	-11.7	179.4	-72	-26.7	0	0	0	114.3	A461 F486 R487 G492 M531	A461-N490 VanDerWaalsContact CB-ND2 3.31Å; A461-N490 WeakPolarHBondContact CB-ND2 3.31Å; F486-N490 WeakPolarHBondContact O-CB 3.24Å; F486-N490 PolarHBondContact O-N 3.47Å; F486-N490 PolarHBondContact O-ND2 3.35Å; R487-N490 PolarHBondContact O-N 2.87Å; N490-G492 PolarHBondContact O-N 3.15Å; N490-M531 WeakPolarHBondContact O-CE 3.49Å
491	C	83.9	Confident	87.2	Confident	76 Å²	76	57.9 Å²	57.9	51%	0.514	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-11.3	172.5	-67.3	0	0	0	0	113.7	R487 M488 L489 R493	R487-C491 PolarHBondContact O-N 3.12Å; R487-C491 VanDerWaalsContact O-N 3.13Å; R487-C491 PolarHBondContact O-SG 3.28Å; M488-C491 WeakPolarHBondContact O-CB 3.42Å; M488-C491 PolarHBondContact O-N 3.17Å; L489-C491 PolarHBondContact O-N 3.27Å; L489-C491 VanDerWaalsContact O-N 3.09Å; C491-R493 HydrophobicContact CB-CB 4.41Å; C491-R493 PolarHBondContact O-N 2.87Å
492	G	81.1	Confident	87.3	Confident	39 Å²	39	61.3 Å²	61.3	40%	0.402	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	12.3	179.9	0	0	0	0	0	114.3	L489 N490 M531	L489-G492 PolarHBondContact O-N 2.85Å; L489-G492 VanDerWaalsContact O-N 3.11Å; N490-G492 PolarHBondContact O-N 3.15Å; G492-M531 VanDerWaalsContact CA-SD 3.54Å; G492-M531 VanDerWaalsContact N-CE 3.35Å
493	R	86.7	Confident	87.5	Confident	127 Å²	127	61.4 Å²	61.4	48%	0.479	32%	0.316	S	S	.	.			trans	-95.6	110.7	-174.5	-85.3	-154.4	-65.9	167.2	-10.1	111.1	C491 D495 L496	C491-R493 HydrophobicContact CB-CB 4.41Å; C491-R493 PolarHBondContact O-N 2.87Å; R493-D495 VanDerWaalsContact C-N 3.26Å; R493-D495 VanDerWaalsContact CB-OD1 3.27Å; R493-D495 WeakPolarHBondContact CB-OD1 3.4Å; R493-D495 IonicContact NH1-OD2 3.9Å; R493-D495 PolarHBondContact O-N 3.28Å; R493-L496 HydrophobicContact CB-CB 4.4Å; R493-L496 HydrophobicContact CB-CD1 4.23Å; R493-L496 HydrophobicContact CB-CG 4.07Å; R493-L496 PolarHBondContact O-N 3.38Å; R493-L496 VanDerWaalsContact O-N 3.17Å
494	T	88.3	Confident	87.6	Confident	105 Å²	105	61 Å²	61	64%	0.644	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-62.4	-30.2	-177.1	53.2	0	0	0	0	113.2	L496 V497 M534	T494-L496 VanDerWaalsContact C-N 3.3Å; T494-L496 PolarHBondContact O-N 2.82Å; T494-V497 WeakPolarHBondContact O-CG2 3.43Å; T494-V497 PolarHBondContact O-N 3.48Å; T494-M534 HydrophobicContact CG2-CB 4.41Å; T494-M534 HydrophobicContact CG2-CG 3.61Å
495	D	89.8	Confident	87.5	Confident	98 Å²	98	59.6 Å²	59.6	52%	0.524	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-66.3	-30.1	177.4	58.4	-48.7	0	0	0	112.9	R493	R493-D495 VanDerWaalsContact C-N 3.26Å; R493-D495 VanDerWaalsContact CB-OD1 3.27Å; R493-D495 WeakPolarHBondContact CB-OD1 3.4Å; R493-D495 IonicContact NH1-OD2 3.9Å; R493-D495 PolarHBondContact O-N 3.28Å
496	L	91.2	Very high	87.2	Confident	18 Å²	18	66 Å²	66	9%	0.094	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-82.5	-15.7	-179.4	-66	-168.1	0	0	0	114	M488 R493 T494 K498 Q499 A500	M488-L496 HydrophobicContact CB-CB 4.46Å; M488-L496 HydrophobicContact CB-CD1 4.31Å; M488-L496 HydrophobicContact CE-CB 4.05Å; M488-L496 HydrophobicContact CE-CD1 4.29Å; M488-L496 HydrophobicContact CE-CD2 4.02Å; M488-L496 HydrophobicContact CE-CG 4.36Å; M488-L496 HydrophobicContact CG-CD1 4.39Å; R493-L496 HydrophobicContact CB-CB 4.4Å; R493-L496 HydrophobicContact CB-CD1 4.23Å; R493-L496 HydrophobicContact CB-CG 4.07Å; R493-L496 PolarHBondContact O-N 3.38Å; R493-L496 VanDerWaalsContact O-N 3.17Å; T494-L496 VanDerWaalsContact C-N 3.3Å; T494-L496 PolarHBondContact O-N 2.82Å; L496-K498 VanDerWaalsContact C-N 3.33Å; L496-K498 PolarHBondContact O-N 3.29Å; L496-Q499 PolarHBondContact O-N 3.41Å; L496-A500 WeakPolarHBondContact O-CB 3.16Å; L496-A500 PolarHBondContact O-N 3.41Å
497	V	89.4	Confident	87	Confident	15 Å²	15	71 Å²	71	9%	0.091	38%	0.384	C	S	.	.	H	α-helix	trans	-56.3	-46.5	-172.6	177.4	0	0	0	0	111.7	L489 T494 Q499 A500 V501 I509 M534 A538	L489-V497 HydrophobicContact CD2-CB 4.45Å; L489-V497 HydrophobicContact CD2-CG1 4.26Å; L489-V497 HydrophobicContact CD2-CG2 4.29Å; T494-V497 WeakPolarHBondContact O-CG2 3.43Å; T494-V497 PolarHBondContact O-N 3.48Å; V497-Q499 VanDerWaalsContact C-N 3.32Å; V497-Q499 PolarHBondContact O-N 3.07Å; V497-A500 PolarHBondContact O-N 3.17Å; V497-V501 HydrophobicContact CG1-CG2 4.33Å; V497-V501 WeakPolarHBondContact O-CB 3.46Å; V497-V501 VanDerWaalsContact O-CG2 3.28Å; V497-V501 WeakPolarHBondContact O-CG2 3.31Å; V497-V501 PolarHBondContact O-N 3.42Å; V497-I509 HydrophobicContact CG1-CD1 4.27Å; V497-M534 HydrophobicContact CG2-CE 4.38Å; V497-M534 HydrophobicContact CG2-CG 4.29Å; V497-M534 HydrophobicContact CG2-SD 3.35Å; V497-M534 WeakPolarHBondContact CG2-SD 3.37Å; V497-A538 HydrophobicContact CG1-CB 3.73Å
498	K	88.6	Confident	87	Confident	170 Å²	170	65.1 Å²	65.1	74%	0.739	36%	0.363	S	S	*	.	H	α-helix	trans	-62	-39.8	179.4	-67.6	-177.7	-179.4	177.7	0	112.5	L496 N502	L496-K498 VanDerWaalsContact C-N 3.33Å; L496-K498 PolarHBondContact O-N 3.29Å; K498-N502 VanDerWaalsContact O-CG 3.26Å; K498-N502 PolarHBondContact O-N 3.03Å; K498-N502 PolarHBondContact O-ND2 3.26Å
499	Q	91.2	Very high	87	Confident	112 Å²	112	64.6 Å²	64.6	52%	0.523	36%	0.361	S	S	.	.	H	α-helix	trans	-69.9	-43.1	177.8	-66.7	178.3	1.5	0	0	110.5	M488 L496 V497 V501 N502 L503	M488-Q499 HydrophobicContact CE-CB 3.51Å; L496-Q499 PolarHBondContact O-N 3.41Å; V497-Q499 VanDerWaalsContact C-N 3.32Å; V497-Q499 PolarHBondContact O-N 3.07Å; Q499-V501 PolarHBondContact O-N 2.91Å; Q499-N502 WeakPolarHBondContact O-CB 3.46Å; Q499-N502 PolarHBondContact O-N 2.93Å; Q499-L503 WeakPolarHBondContact O-CG 3.33Å; Q499-L503 PolarHBondContact O-N 3.36Å; Q499-L503 VanDerWaalsContact O-N 3.16Å
500	A	89.4	Confident	87.1	Confident	0 Å²	0	67 Å²	67	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-60.6	-44.9	177.4	0	0	0	0	0	112.1	M488 L489 L496 V497 N502 L503 L504	M488-A500 HydrophobicContact CB-CB 3.78Å; L489-A500 HydrophobicContact CD2-CB 3.7Å; L489-A500 HydrophobicContact CG-CB 3.75Å; L496-A500 WeakPolarHBondContact O-CB 3.16Å; L496-A500 PolarHBondContact O-N 3.41Å; V497-A500 PolarHBondContact O-N 3.17Å; A500-N502 VanDerWaalsContact C-N 3.29Å; A500-N502 PolarHBondContact O-N 3.46Å; A500-L503 PolarHBondContact O-N 3.16Å; A500-L504 WeakPolarHBondContact O-CB 3.46Å; A500-L504 VanDerWaalsContact O-CG 3.27Å; A500-L504 WeakPolarHBondContact O-CG 3.48Å; A500-L504 PolarHBondContact O-N 2.63Å
501	V	89.1	Confident	87.4	Confident	44 Å²	44	64.8 Å²	64.8	27%	0.267	36%	0.362	S	S	.	.	H	α-helix	trans	-58	-40.9	175.8	168.1	0	0	0	0	111.4	V497 Q499 L503 L504 G505 I509	V497-V501 HydrophobicContact CG1-CG2 4.33Å; V497-V501 WeakPolarHBondContact O-CB 3.46Å; V497-V501 VanDerWaalsContact O-CG2 3.28Å; V497-V501 WeakPolarHBondContact O-CG2 3.31Å; V497-V501 PolarHBondContact O-N 3.42Å; Q499-V501 PolarHBondContact O-N 2.91Å; V501-L503 VanDerWaalsContact C-N 3.32Å; V501-L503 PolarHBondContact O-N 3.47Å; V501-L504 PolarHBondContact O-N 2.99Å; V501-G505 PolarHBondContact O-N 3.4Å; V501-I509 HydrophobicContact CG2-CB 4.13Å
502	N	88.7	Confident	87.5	Confident	129 Å²	129	64.3 Å²	64.3	69%	0.69	35%	0.353	S	S	*	.	H	α-helix	trans	-64.8	-34.9	176.4	-68	-21.9	0	0	0	112.7	K498 Q499 A500	K498-N502 VanDerWaalsContact O-CG 3.26Å; K498-N502 PolarHBondContact O-N 3.03Å; K498-N502 PolarHBondContact O-ND2 3.26Å; Q499-N502 WeakPolarHBondContact O-CB 3.46Å; Q499-N502 PolarHBondContact O-N 2.93Å; A500-N502 VanDerWaalsContact C-N 3.29Å; A500-N502 PolarHBondContact O-N 3.46Å
503	L	88.9	Confident	87.5	Confident	56 Å²	56	63 Å²	63	29%	0.293	34%	0.338	S	S	.	.	H	α-helix	trans	-75	-31	177.4	-62.1	-179.3	0	0	0	112.7	L481 L484 M488 Q499 A500 V501 G505	L481-L503 HydrophobicContact CD2-CD2 4.25Å; L484-L503 HydrophobicContact CD2-CD1 3.91Å; L484-L503 HydrophobicContact CG-CD1 3.98Å; M488-L503 HydrophobicContact SD-CD1 3.54Å; M488-L503 VanDerWaalsContact SD-CD1 3.54Å; Q499-L503 WeakPolarHBondContact O-CG 3.33Å; Q499-L503 PolarHBondContact O-N 3.36Å; Q499-L503 VanDerWaalsContact O-N 3.16Å; A500-L503 PolarHBondContact O-N 3.16Å; V501-L503 VanDerWaalsContact C-N 3.32Å; V501-L503 PolarHBondContact O-N 3.47Å; L503-G505 VanDerWaalsContact C-N 3.27Å; L503-G505 PolarHBondContact O-N 3.28Å
504	L	85.9	Confident	86.9	Confident	14 Å²	14	59.7 Å²	59.7	7%	0.073	33%	0.328	C	S	.	.	H	α-helix	trans	-78.5	-6.4	-178	-71.3	168.6	0	0	0	113.9	Q482 F486 L489 A500 V501 G508 S511	Q482-L504 HydrophobicContact CG-CD2 4.02Å; Q482-L504 WeakPolarHBondContact O-CD2 3.31Å; F486-L504 HydrophobicContact CD2-CD2 3.59Å; F486-L504 HydrophobicContact CE2-CD2 3.8Å; L489-L504 HydrophobicContact CD1-CD1 3.55Å; L489-L504 HydrophobicContact CG-CD1 4.41Å; A500-L504 WeakPolarHBondContact O-CB 3.46Å; A500-L504 VanDerWaalsContact O-CG 3.27Å; A500-L504 WeakPolarHBondContact O-CG 3.48Å; A500-L504 PolarHBondContact O-N 2.63Å; V501-L504 PolarHBondContact O-N 2.99Å; L504-G508 VanDerWaalsContact CB-O 3.23Å; L504-G508 WeakPolarHBondContact CB-O 3.11Å; L504-G508 VanDerWaalsContact CD1-O 3.3Å; L504-G508 WeakPolarHBondContact CD1-O 3.49Å; L504-S511 PolarHBondContact O-OG 3.13Å
505	G	84.1	Confident	86.4	Confident	35 Å²	35	55.2 Å²	55.2	36%	0.361	30%	0.3	S	S	.	.			trans	83	-153.5	173.1	0	0	0	0	0	114	V501 L503 D507 G508	V501-G505 PolarHBondContact O-N 3.4Å; L503-G505 VanDerWaalsContact C-N 3.27Å; L503-G505 PolarHBondContact O-N 3.28Å; G505-D507 VanDerWaalsContact C-N 3.32Å; G505-D507 PolarHBondContact O-N 3.46Å; G505-G508 PolarHBondContact O-N 3.32Å; G505-G508 VanDerWaalsContact O-N 3.1Å
506	P	81.6	Confident	86	Confident	135 Å²	135	50.6 Å²	50.6	88%	0.877	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-30	-170.1	27.2	-34.8	0	0	0	113.9	G508	P506-G508 VanDerWaalsContact C-N 3.26Å
507	D	82.5	Confident	85.8	Confident	111 Å²	111	49.7 Å²	49.7	59%	0.594	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-12.1	177.9	-59.9	-33.6	0	0	0	112.1	G505 I509 N510 S511	G505-D507 VanDerWaalsContact C-N 3.32Å; G505-D507 PolarHBondContact O-N 3.46Å; D507-I509 PolarHBondContact O-N 2.78Å; D507-N510 PolarHBondContact O-N 2.99Å; D507-S511 WeakPolarHBondContact CB-OG 3.44Å
508	G	87.8	Confident	85.8	Confident	6 Å²	6	49.1 Å²	49.1	6%	0.062	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	52.8	-119.2	171.6	0	0	0	0	0	113.4	L504 G505 P506 N510 S511	L504-G508 VanDerWaalsContact CB-O 3.23Å; L504-G508 WeakPolarHBondContact CB-O 3.11Å; L504-G508 VanDerWaalsContact CD1-O 3.3Å; L504-G508 WeakPolarHBondContact CD1-O 3.49Å; G505-G508 PolarHBondContact O-N 3.32Å; G505-G508 VanDerWaalsContact O-N 3.1Å; P506-G508 VanDerWaalsContact C-N 3.26Å; G508-N510 PolarHBondContact O-N 3.26Å; G508-S511 PolarHBondContact N-OG 2.84Å; G508-S511 WeakPolarHBondContact O-CB 3.49Å; G508-S511 PolarHBondContact O-N 3.23Å; G508-S511 PolarHBondContact O-OG 2.75Å; G508-S511 VanDerWaalsContact O-OG 3.08Å
509	I	88.4	Confident	85.9	Confident	12 Å²	12	41 Å²	41	6%	0.062	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-72.1	-16.6	-178.2	-158.9	158.6	0	0	0	113.6	L489 V497 V501 D507 P519 L535 A538 A540	L489-I509 HydrophobicContact CD1-CG1 4.36Å; V497-I509 HydrophobicContact CG1-CD1 4.27Å; V501-I509 HydrophobicContact CG2-CB 4.13Å; D507-I509 PolarHBondContact O-N 2.78Å; I509-P519 WeakPolarHBondContact O-CD 3.27Å; I509-L535 HydrophobicContact CD1-CD2 3.73Å; I509-L535 HydrophobicContact CG1-CD2 3.99Å; I509-A538 HydrophobicContact CD1-CB 3.34Å; I509-A540 HydrophobicContact CG1-CB 4.39Å; I509-A540 HydrophobicContact CG2-CB 4.25Å
510	N	90.2	Very high	86	Confident	54 Å²	54	35.8 Å²	35.8	29%	0.289	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-97.2	5.6	179.1	-63.3	-43.6	0	0	0	112.5	D507 G508 M512 A540 D541	D507-N510 PolarHBondContact O-N 2.99Å; G508-N510 PolarHBondContact O-N 3.26Å; N510-M512 PolarHBondContact O-N 3.4Å; N510-A540 WeakPolarHBondContact OD1-CA 3.5Å; N510-D541 PolarHBondContact OD1-N 3.06Å
511	S	88.4	Confident	86.1	Confident	5 Å²	5	35.8 Å²	35.8	4%	0.035	21%	0.207	C	C	.	.			trans	-54.2	136.1	172.8	-68.8	0	0	0	0	110.6	F486 L504 D507 G508 P519	F486-S511 VanDerWaalsContact CZ-O 3.25Å; F486-S511 WeakPolarHBondContact CZ-O 3.25Å; L504-S511 PolarHBondContact O-OG 3.13Å; D507-S511 WeakPolarHBondContact CB-OG 3.44Å; G508-S511 PolarHBondContact N-OG 2.84Å; G508-S511 WeakPolarHBondContact O-CB 3.49Å; G508-S511 PolarHBondContact O-N 3.23Å; G508-S511 PolarHBondContact O-OG 2.75Å; G508-S511 VanDerWaalsContact O-OG 3.08Å; S511-P519 WeakPolarHBondContact O-CD 3.24Å
512	M	85.7	Confident	86.2	Confident	66 Å²	66	34 Å²	34	33%	0.325	20%	0.195	S	C	.	.			trans	-99.2	144	-178.3	-66.2	-177.8	-70.4	0	0	111.5	Q482 N510 M517 T518 P547	Q482-M512 PolarHBondContact NE2-O 3.41Å; N510-M512 PolarHBondContact O-N 3.4Å; M512-M517 WeakPolarHBondContact CA-O 3.49Å; M512-T518 HydrophobicContact CG-CG2 4.08Å; M512-P547 HydrophobicContact CE-CG 3.82Å; M512-P547 VanDerWaalsContact SD-CD 3.6Å; M512-P547 HydrophobicContact SD-CG 3.58Å; M512-P547 VanDerWaalsContact SD-CG 3.58Å
513	S	81	Confident	86.3	Confident	10 Å²	10	27.9 Å²	27.9	7%	0.07	16%	0.163	C	C	.	.			trans	-72.3	175.8	170.9	74.4	0	0	0	0	111.8	Q515 G516 M517 Y522	S513-Q515 PolarHBondContact O-N 3.22Å; S513-Q515 VanDerWaalsContact O-N 3.14Å; S513-Q515 PolarHBondContact OG-N 3.11Å; S513-G516 WeakPolarHBondContact O-CA 3.43Å; S513-G516 PolarHBondContact O-N 3.39Å; S513-M517 PolarHBondContact N-O 3.23Å; S513-M517 PolarHBondContact OG-N 2.95Å; S513-M517 PolarHBondContact OG-O 2.89Å; S513-Y522 WeakPolarHBondContact CB-OH 3.44Å; S513-Y522 PolarHBondContact OG-OH 3.15Å
514	E	75.3	Confident	86.5	Confident	59 Å²	59	25.2 Å²	25.2	28%	0.276	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-22.3	172.1	-65.5	-74.4	169.9	0	0	113.1	C464 K479 G516	C464-E514 HydrophobicContact CB-CB 3.86Å; C464-E514 HydrophobicContact CB-CG 4.15Å; K479-E514 WeakPolarHBondContact CE-OE1 3.26Å; K479-E514 IonicContact NZ-OE1 2.67Å; K479-E514 PolarHBondContact NZ-OE1 3.42Å; E514-G516 VanDerWaalsContact C-N 3.27Å
515	Q	76.3	Confident	86.8	Confident	11 Å²	11	25.2 Å²	25.2	5%	0.051	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	3.6	173.3	-64.3	-175.8	-2.3	0	0	112.9	C464 S513 M517	C464-Q515 VanDerWaalsContact SG-CG 3.55Å; C464-Q515 PolarHBondContact SG-NE2 2.92Å; S513-Q515 PolarHBondContact O-N 3.22Å; S513-Q515 VanDerWaalsContact O-N 3.14Å; S513-Q515 PolarHBondContact OG-N 3.11Å; Q515-M517 VanDerWaalsContact C-N 3.27Å; Q515-M517 HydrophobicContact CB-CG 4.39Å; Q515-M517 PolarHBondContact O-N 3.07Å
516	G	82.3	Confident	87	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.159	C	C	.	.	S	Bend	trans	73.3	16.6	-177.9	0	0	0	0	0	113.7	S513 E514	S513-G516 WeakPolarHBondContact O-CA 3.43Å; S513-G516 PolarHBondContact O-N 3.39Å; E514-G516 VanDerWaalsContact C-N 3.27Å
517	M	86.8	Confident	87.4	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.13	C	C	.	.			trans	-99.2	139.9	-176.4	-68.3	-175.7	70	0	0	111.9	I459 M512 S513 Q515 M521 Y522 V525 V546 F568	I459-M517 HydrophobicContact CG2-CE 4.17Å; I459-M517 HydrophobicContact CG2-SD 4.06Å; M512-M517 WeakPolarHBondContact CA-O 3.49Å; S513-M517 PolarHBondContact N-O 3.23Å; S513-M517 PolarHBondContact OG-N 2.95Å; S513-M517 PolarHBondContact OG-O 2.89Å; Q515-M517 VanDerWaalsContact C-N 3.27Å; Q515-M517 HydrophobicContact CB-CG 4.39Å; Q515-M517 PolarHBondContact O-N 3.07Å; M517-M521 HydrophobicContact CB-CB 4.39Å; M517-M521 HydrophobicContact CB-SD 4.19Å; M517-M521 HydrophobicContact CE-CB 3.73Å; M517-M521 HydrophobicContact CG-SD 4.35Å; M517-Y522 HydrophobicContact CB-CD2 4.27Å; M517-Y522 HydrophobicContact CB-CE1 4.46Å; M517-Y522 HydrophobicContact CB-CE2 3.64Å; M517-Y522 HydrophobicContact CE-CD1 4.12Å; M517-Y522 HydrophobicContact CE-CE1 4.15Å; M517-Y522 HydrophobicContact CE-CG 4.48Å; M517-Y522 HydrophobicContact SD-CE1 3.94Å; M517-V525 HydrophobicContact CE-CG2 4.04Å; M517-V546 HydrophobicContact CG-CG2 4.39Å; M517-F568 HydrophobicContact CE-CD1 4.31Å; M517-F568 HydrophobicContact CE-CD2 4.45Å; M517-F568 HydrophobicContact CE-CE1 3.9Å; M517-F568 HydrophobicContact CE-CE2 4.04Å; M517-F568 HydrophobicContact CE-CZ 3.75Å; M517-F568 HydrophobicContact CG-CZ 4.37Å; M517-F568 HydrophobicContact SD-CE1 4.47Å; M517-F568 HydrophobicContact SD-CZ 4.17Å
518	T	90.5	Very high	87.9	Confident	2 Å²	2	22.5 Å²	22.5	1%	0.012	12%	0.115	C	C	.	.			trans	-85.8	160.8	173.9	64.6	0	0	0	0	111.4	M512 L520 M521 Y522	M512-T518 HydrophobicContact CG-CG2 4.08Å; T518-L520 PolarHBondContact O-N 3.05Å; T518-M521 HydrophobicContact CG2-CE 4.39Å; T518-M521 HydrophobicContact CG2-SD 4.47Å; T518-M521 PolarHBondContact N-SD 3.46Å; T518-M521 WeakPolarHBondContact O-CB 3.46Å; T518-M521 PolarHBondContact O-N 2.87Å; T518-M521 VanDerWaalsContact O-N 3.08Å; T518-M521 WeakPolarHBondContact OG1-CG 3.47Å; T518-M521 PolarHBondContact OG1-N 3.47Å; T518-Y522 VanDerWaalsContact O-CD2 3.27Å; T518-Y522 WeakPolarHBondContact O-CD2 3.09Å; T518-Y522 PolarHBondContact O-N 3.38Å
519	P	90.3	Very high	88.2	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-51.7	-38.3	171.3	-27.3	34.4	0	0	0	113.1	F486 L489 I509 S511 Y522 A523 L535	F486-P519 HydrophobicContact CD1-CG 4.1Å; F486-P519 HydrophobicContact CE1-CG 3.73Å; F486-P519 HydrophobicContact CZ-CG 4.2Å; L489-P519 HydrophobicContact CD1-CB 3.77Å; L489-P519 HydrophobicContact CD1-CG 3.49Å; L489-P519 VanDerWaalsContact CD1-CG 3.49Å; I509-P519 WeakPolarHBondContact O-CD 3.27Å; S511-P519 WeakPolarHBondContact O-CD 3.24Å; P519-Y522 PolarHBondContact O-N 3.38Å; P519-A523 PolarHBondContact O-N 3Å; P519-L535 HydrophobicContact CB-CD1 4.18Å; P519-L535 HydrophobicContact CB-CD2 4.23Å
520	L	92.8	Very high	88.5	Confident	2 Å²	2	30.1 Å²	30.1	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-62.7	-42.5	177.2	-178.3	63.5	0	0	0	111.8	T518 Y522 A523 C524 V532 L535 L536 A540 P565	T518-L520 PolarHBondContact O-N 3.05Å; L520-Y522 VanDerWaalsContact C-N 3.35Å; L520-Y522 PolarHBondContact O-N 3.27Å; L520-A523 PolarHBondContact O-N 3.45Å; L520-C524 PolarHBondContact O-N 2.74Å; L520-C524 PolarHBondContact O-SG 3.37Å; L520-V532 HydrophobicContact CD1-CB 4.45Å; L520-V532 HydrophobicContact CD1-CG1 4.01Å; L520-V532 HydrophobicContact CD1-CG2 4.43Å; L520-L535 HydrophobicContact CB-CD1 4.36Å; L520-L535 HydrophobicContact CD1-CB 4.14Å; L520-L535 HydrophobicContact CD1-CD1 4.43Å; L520-L536 HydrophobicContact CD1-CD2 4.33Å; L520-L536 HydrophobicContact CD1-CG 4.3Å; L520-L536 HydrophobicContact CD2-CD2 3.99Å; L520-A540 HydrophobicContact CB-CB 4.26Å; L520-A540 HydrophobicContact CD2-CB 4.1Å; L520-P565 HydrophobicContact CD2-CB 4.08Å; L520-P565 HydrophobicContact CD2-CG 3.77Å; L520-P565 HydrophobicContact CG-CB 4.11Å; L520-P565 HydrophobicContact CG-CG 4.07Å
521	M	91.9	Very high	88.6	Confident	1 Å²	1	28 Å²	28	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-62.5	-40.6	175.8	-66.6	168.8	-178.1	0	0	111.8	M517 T518 C524 V525 S544 V546 P565 F568	M517-M521 HydrophobicContact CB-CB 4.39Å; M517-M521 HydrophobicContact CB-SD 4.19Å; M517-M521 HydrophobicContact CE-CB 3.73Å; M517-M521 HydrophobicContact CG-SD 4.35Å; T518-M521 HydrophobicContact CG2-CE 4.39Å; T518-M521 HydrophobicContact CG2-SD 4.47Å; T518-M521 PolarHBondContact N-SD 3.46Å; T518-M521 WeakPolarHBondContact O-CB 3.46Å; T518-M521 PolarHBondContact O-N 2.87Å; T518-M521 VanDerWaalsContact O-N 3.08Å; T518-M521 WeakPolarHBondContact OG1-CG 3.47Å; T518-M521 PolarHBondContact OG1-N 3.47Å; M521-C524 PolarHBondContact O-N 3.12Å; M521-V525 WeakPolarHBondContact O-CG2 3.2Å; M521-V525 PolarHBondContact O-N 3.2Å; M521-S544 WeakPolarHBondContact CE-O 3.1Å; M521-V546 HydrophobicContact CE-CG2 3.95Å; M521-V546 HydrophobicContact SD-CG2 3.68Å; M521-P565 HydrophobicContact CG-CG 3.97Å; M521-F568 HydrophobicContact CB-CD2 3.95Å; M521-F568 HydrophobicContact CB-CE2 4.12Å; M521-F568 HydrophobicContact CG-CD2 3.91Å; M521-F568 HydrophobicContact CG-CE2 4.01Å; M521-F568 HydrophobicContact SD-CD2 4.37Å; M521-F568 HydrophobicContact SD-CE2 3.87Å
522	Y	90.2	Very high	88.9	Confident	5 Å²	5	27.7 Å²	27.7	2%	0.02	15%	0.148	C	C	.	.	H	α-helix	trans	-63.8	-39.8	175	-73.3	-68.6	0	0	0	112.4	I459 A461 F486 S513 M517 T518 P519 L520 C524 V525 R526	I459-Y522 HydrophobicContact CG2-CD1 3.89Å; I459-Y522 HydrophobicContact CG2-CE1 3.68Å; A461-Y522 HydrophobicContact CB-CD2 4.21Å; A461-Y522 HydrophobicContact CB-CE1 4.47Å; A461-Y522 HydrophobicContact CB-CE2 4.02Å; F486-Y522 HydrophobicContact CD1-CD2 4.4Å; F486-Y522 HydrophobicContact CD1-CE2 4.33Å; F486-Y522 HydrophobicContact CE1-CD2 4.13Å; F486-Y522 AromaticContact CE1-CE2 3.92Å; F486-Y522 HydrophobicContact CE1-CE2 3.92Å; S513-Y522 WeakPolarHBondContact CB-OH 3.44Å; S513-Y522 PolarHBondContact OG-OH 3.15Å; M517-Y522 HydrophobicContact CB-CD2 4.27Å; M517-Y522 HydrophobicContact CB-CE1 4.46Å; M517-Y522 HydrophobicContact CB-CE2 3.64Å; M517-Y522 HydrophobicContact CE-CD1 4.12Å; M517-Y522 HydrophobicContact CE-CE1 4.15Å; M517-Y522 HydrophobicContact CE-CG 4.48Å; M517-Y522 HydrophobicContact SD-CE1 3.94Å; T518-Y522 VanDerWaalsContact O-CD2 3.27Å; T518-Y522 WeakPolarHBondContact O-CD2 3.09Å; T518-Y522 PolarHBondContact O-N 3.38Å; P519-Y522 PolarHBondContact O-N 3.38Å; L520-Y522 VanDerWaalsContact C-N 3.35Å; L520-Y522 PolarHBondContact O-N 3.27Å; Y522-C524 VanDerWaalsContact C-N 3.35Å; Y522-V525 PolarHBondContact O-N 3.04Å; Y522-R526 WeakPolarHBondContact O-CG 3.22Å; Y522-R526 PolarHBondContact O-N 3.08Å; Y522-R526 VanDerWaalsContact O-N 3.15Å
523	A	92.1	Very high	89.3	Confident	2 Å²	2	27.7 Å²	27.7	2%	0.017	15%	0.147	C	C	.	.	H	α-helix	trans	-62.8	-41.6	173.8	0	0	0	0	0	111.8	P519 L520 R526 G527 D528 M531 V532 L535	P519-A523 PolarHBondContact O-N 3Å; L520-A523 PolarHBondContact O-N 3.45Å; A523-R526 PolarHBondContact O-N 3.23Å; A523-G527 PolarHBondContact O-N 2.72Å; A523-D528 PolarHBondContact O-N 2.83Å; A523-M531 HydrophobicContact CB-CB 4.02Å; A523-M531 HydrophobicContact CB-CG 3.58Å; A523-V532 HydrophobicContact CB-CG2 3.72Å; A523-L535 HydrophobicContact CB-CD1 3.89Å
524	C	93.3	Very high	89.9	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.6	-40.4	176.3	-66.7	0	0	0	0	112.6	L520 M521 Y522 R526 G527 F568 A569 H574 V577	L520-C524 PolarHBondContact O-N 2.74Å; L520-C524 PolarHBondContact O-SG 3.37Å; M521-C524 PolarHBondContact O-N 3.12Å; Y522-C524 VanDerWaalsContact C-N 3.35Å; C524-R526 VanDerWaalsContact C-N 3.3Å; C524-R526 PolarHBondContact O-N 3.29Å; C524-G527 PolarHBondContact O-N 3.14Å; C524-F568 HydrophobicContact CB-CB 4.3Å; C524-A569 HydrophobicContact CB-CB 4.22Å; C524-H574 PolarHBondContact O-CD2 3.48Å; C524-V577 HydrophobicContact CB-CG1 4.46Å
525	V	90.4	Very high	90.7	Very high	14 Å²	14	25.2 Å²	25.2	9%	0.085	13%	0.134	C	C	.	.	H	α-helix	trans	-62.3	-39.1	174.6	167.5	0	0	0	0	111.7	I459 M517 M521 Y522 G527 F568 H574	I459-V525 HydrophobicContact CB-CG1 3.95Å; I459-V525 HydrophobicContact CD1-CG1 4.13Å; I459-V525 HydrophobicContact CD1-CG2 4.32Å; I459-V525 HydrophobicContact CG1-CG1 4.47Å; I459-V525 HydrophobicContact CG2-CG1 4.37Å; M517-V525 HydrophobicContact CE-CG2 4.04Å; M521-V525 WeakPolarHBondContact O-CG2 3.2Å; M521-V525 PolarHBondContact O-N 3.2Å; Y522-V525 PolarHBondContact O-N 3.04Å; V525-G527 VanDerWaalsContact C-N 3.3Å; V525-G527 PolarHBondContact O-N 3.4Å; V525-F568 HydrophobicContact CG2-CB 3.88Å; V525-F568 HydrophobicContact CG2-CD1 3.57Å; V525-F568 HydrophobicContact CG2-CE1 4.35Å; V525-F568 HydrophobicContact CG2-CG 3.91Å; V525-H574 PolarHBondContact O-NE2 3.31Å
526	R	88.3	Confident	91.6	Very high	146 Å²	146	25.9 Å²	25.9	55%	0.551	14%	0.138	S	C	*	.	H	α-helix	trans	-73.4	-21	179	-69.7	171.8	63.5	91.4	1.3	113.5	Y522 A523 C524 D528	Y522-R526 WeakPolarHBondContact O-CG 3.22Å; Y522-R526 PolarHBondContact O-N 3.08Å; Y522-R526 VanDerWaalsContact O-N 3.15Å; A523-R526 PolarHBondContact O-N 3.23Å; C524-R526 VanDerWaalsContact C-N 3.3Å; C524-R526 PolarHBondContact O-N 3.29Å; R526-D528 VanDerWaalsContact C-N 3.28Å; R526-D528 HydrophobicContact CB-CB 4.34Å
527	G	92	Very high	92	Very high	25 Å²	25	31.8 Å²	31.8	26%	0.258	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.9	22.8	-172.7	0	0	0	0	0	113.1	A523 C524 V525 E529 H574	A523-G527 PolarHBondContact O-N 2.72Å; C524-G527 PolarHBondContact O-N 3.14Å; V525-G527 VanDerWaalsContact C-N 3.3Å; V525-G527 PolarHBondContact O-N 3.4Å; G527-E529 PolarHBondContact O-N 3.24Å; G527-H574 VanDerWaalsContact CA-CD2 3.41Å; G527-H574 WeakPolarHBondContact CA-CD2 3.35Å; G527-H574 VanDerWaalsContact CA-CG 3.48Å; G527-H574 PolarHBondContact N-CD2 3Å; G527-H574 PolarHBondContact N-NE2 3.36Å
528	D	92.4	Very high	92.2	Very high	52 Å²	52	33.8 Å²	33.8	28%	0.278	19%	0.187	S	C	.	.			trans	-85.2	90.1	-177.2	-170.5	-21.5	0	0	0	110.2	A523 R526 A530 M531 V532	A523-D528 PolarHBondContact O-N 2.83Å; R526-D528 VanDerWaalsContact C-N 3.28Å; R526-D528 HydrophobicContact CB-CB 4.34Å; D528-A530 VanDerWaalsContact C-N 3.31Å; D528-A530 PolarHBondContact O-N 3.14Å; D528-A530 PolarHBondContact OD1-N 3.06Å; D528-M531 HydrophobicContact CB-CB 3.8Å; D528-M531 WeakPolarHBondContact O-CB 3.4Å; D528-M531 PolarHBondContact O-N 2.92Å; D528-M531 PolarHBondContact OD1-N 3.44Å; D528-M531 VanDerWaalsContact OD1-N 3.08Å; D528-V532 WeakPolarHBondContact O-CG2 3.29Å; D528-V532 PolarHBondContact O-N 3.35Å
529	E	94.6	Very high	92.1	Very high	103 Å²	103	36.1 Å²	36.1	48%	0.481	21%	0.211	S	C	.	.	H	α-helix	trans	-57.4	-41.4	-177.2	-171.5	-177.4	157.1	0	0	112.7	G527 V532 Q533 V577 L580	G527-E529 PolarHBondContact O-N 3.24Å; E529-V532 PolarHBondContact O-N 2.8Å; E529-Q533 PolarHBondContact O-N 2.97Å; E529-V577 HydrophobicContact CB-CG2 4.37Å; E529-L580 HydrophobicContact CG-CD2 4.06Å
530	A	93.3	Very high	92.2	Very high	76 Å²	76	36.6 Å²	36.6	63%	0.628	22%	0.215	S	C	*	.	H	α-helix	trans	-66.5	-40.5	179.9	0	0	0	0	0	111.7	D528 M534	D528-A530 VanDerWaalsContact C-N 3.31Å; D528-A530 PolarHBondContact O-N 3.14Å; D528-A530 PolarHBondContact OD1-N 3.06Å; A530-M534 WeakPolarHBondContact O-CB 3.39Å; A530-M534 PolarHBondContact O-N 2.87Å
531	M	92.4	Very high	92.2	Very high	8 Å²	8	40.2 Å²	40.2	4%	0.039	23%	0.234	C	C	.	.	H	α-helix	trans	-64.8	-43.6	173.8	-172	82.9	65.5	0	0	111.7	N490 G492 A523 D528 M534 L535	N490-M531 WeakPolarHBondContact O-CE 3.49Å; G492-M531 VanDerWaalsContact CA-SD 3.54Å; G492-M531 VanDerWaalsContact N-CE 3.35Å; A523-M531 HydrophobicContact CB-CB 4.02Å; A523-M531 HydrophobicContact CB-CG 3.58Å; D528-M531 HydrophobicContact CB-CB 3.8Å; D528-M531 WeakPolarHBondContact O-CB 3.4Å; D528-M531 PolarHBondContact O-N 2.92Å; D528-M531 PolarHBondContact OD1-N 3.44Å; D528-M531 VanDerWaalsContact OD1-N 3.08Å; M531-M534 HydrophobicContact CG-CE 4.27Å; M531-M534 PolarHBondContact O-N 3.06Å; M531-M534 HydrophobicContact SD-CE 3.35Å; M531-M534 WeakPolarHBondContact SD-CE 3.33Å; M531-L535 HydrophobicContact CG-CD1 4.02Å; M531-L535 HydrophobicContact CG-CG 4.45Å; M531-L535 WeakPolarHBondContact O-CB 3.45Å; M531-L535 VanDerWaalsContact O-CG 3.27Å; M531-L535 WeakPolarHBondContact O-CG 3.4Å; M531-L535 PolarHBondContact O-N 3.32Å
532	V	94.8	Very high	92.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.4	-48.1	177.1	170.5	0	0	0	0	109.9	L520 A523 D528 E529 M534 L535 L536 V577 L580 L581	L520-V532 HydrophobicContact CD1-CB 4.45Å; L520-V532 HydrophobicContact CD1-CG1 4.01Å; L520-V532 HydrophobicContact CD1-CG2 4.43Å; A523-V532 HydrophobicContact CB-CG2 3.72Å; D528-V532 WeakPolarHBondContact O-CG2 3.29Å; D528-V532 PolarHBondContact O-N 3.35Å; E529-V532 PolarHBondContact O-N 2.8Å; V532-M534 PolarHBondContact O-N 3.22Å; V532-L535 PolarHBondContact O-N 2.9Å; V532-L536 HydrophobicContact CG1-CD1 3.88Å; V532-L536 HydrophobicContact CG1-CG 4.39Å; V532-L536 WeakPolarHBondContact O-CB 3.43Å; V532-L536 VanDerWaalsContact O-CG 3.26Å; V532-L536 WeakPolarHBondContact O-CG 3.4Å; V532-L536 PolarHBondContact O-N 3.12Å; V532-V577 HydrophobicContact CG1-CG1 4.38Å; V532-V577 HydrophobicContact CG2-CG1 3.96Å; V532-L580 HydrophobicContact CB-CD2 4.22Å; V532-L580 HydrophobicContact CG1-CD2 3.72Å; V532-L581 HydrophobicContact CG1-CD2 4.13Å
533	Q	94.4	Very high	92.2	Very high	65 Å²	65	43.7 Å²	43.7	30%	0.304	25%	0.253	S	S	.	.	H	α-helix	trans	-58.6	-47.6	176.1	-173.7	63.9	51	0	0	111.8	E529 L535 L536 D537 L580	E529-Q533 PolarHBondContact O-N 2.97Å; Q533-L535 VanDerWaalsContact C-N 3.33Å; Q533-L535 PolarHBondContact O-N 3.22Å; Q533-L536 PolarHBondContact O-N 2.94Å; Q533-D537 PolarHBondContact NE2-OD1 2.98Å; Q533-D537 WeakPolarHBondContact O-CB 3.5Å; Q533-D537 PolarHBondContact O-N 2.99Å; Q533-L580 HydrophobicContact CB-CD2 4.35Å; Q533-L580 VanDerWaalsContact OE1-CD1 3.22Å
534	M	93.5	Very high	92.1	Very high	15 Å²	15	44.4 Å²	44.4	7%	0.074	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-42.6	179.2	175.1	-85.1	-69.8	0	0	112.6	T494 V497 A530 M531 V532 A538	T494-M534 HydrophobicContact CG2-CB 4.41Å; T494-M534 HydrophobicContact CG2-CG 3.61Å; V497-M534 HydrophobicContact CG2-CE 4.38Å; V497-M534 HydrophobicContact CG2-CG 4.29Å; V497-M534 HydrophobicContact CG2-SD 3.35Å; V497-M534 WeakPolarHBondContact CG2-SD 3.37Å; A530-M534 WeakPolarHBondContact O-CB 3.39Å; A530-M534 PolarHBondContact O-N 2.87Å; M531-M534 HydrophobicContact CG-CE 4.27Å; M531-M534 PolarHBondContact O-N 3.06Å; M531-M534 HydrophobicContact SD-CE 3.35Å; M531-M534 WeakPolarHBondContact SD-CE 3.33Å; V532-M534 PolarHBondContact O-N 3.22Å; M534-A538 WeakPolarHBondContact O-CB 3.5Å; M534-A538 PolarHBondContact O-N 3.37Å; M534-A538 VanDerWaalsContact O-N 3.09Å
535	L	93.3	Very high	91.9	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-70.2	-38.8	179.2	-67.6	171.8	0	0	0	111.4	L489 I509 P519 L520 A523 M531 V532 Q533 A538 G539 A540	L489-L535 HydrophobicContact CD2-CD2 4.28Å; I509-L535 HydrophobicContact CD1-CD2 3.73Å; I509-L535 HydrophobicContact CG1-CD2 3.99Å; P519-L535 HydrophobicContact CB-CD1 4.18Å; P519-L535 HydrophobicContact CB-CD2 4.23Å; L520-L535 HydrophobicContact CB-CD1 4.36Å; L520-L535 HydrophobicContact CD1-CB 4.14Å; L520-L535 HydrophobicContact CD1-CD1 4.43Å; A523-L535 HydrophobicContact CB-CD1 3.89Å; M531-L535 HydrophobicContact CG-CD1 4.02Å; M531-L535 HydrophobicContact CG-CG 4.45Å; M531-L535 WeakPolarHBondContact O-CB 3.45Å; M531-L535 VanDerWaalsContact O-CG 3.27Å; M531-L535 WeakPolarHBondContact O-CG 3.4Å; M531-L535 PolarHBondContact O-N 3.32Å; V532-L535 PolarHBondContact O-N 2.9Å; Q533-L535 VanDerWaalsContact C-N 3.33Å; Q533-L535 PolarHBondContact O-N 3.22Å; L535-A538 PolarHBondContact O-N 3.37Å; L535-G539 PolarHBondContact O-N 2.85Å; L535-A540 HydrophobicContact CB-CB 4.16Å; L535-A540 WeakPolarHBondContact O-CB 3.34Å; L535-A540 PolarHBondContact O-N 2.92Å
536	L	93.5	Very high	91.7	Very high	25 Å²	25	46.7 Å²	46.7	13%	0.131	27%	0.268	C	S	.	.	H	α-helix	trans	-64.1	-44.4	174.2	-69.3	173.6	0	0	0	111.5	L520 V532 Q533 A538 G539 I542 L581	L520-L536 HydrophobicContact CD1-CD2 4.33Å; L520-L536 HydrophobicContact CD1-CG 4.3Å; L520-L536 HydrophobicContact CD2-CD2 3.99Å; V532-L536 HydrophobicContact CG1-CD1 3.88Å; V532-L536 HydrophobicContact CG1-CG 4.39Å; V532-L536 WeakPolarHBondContact O-CB 3.43Å; V532-L536 VanDerWaalsContact O-CG 3.26Å; V532-L536 WeakPolarHBondContact O-CG 3.4Å; V532-L536 PolarHBondContact O-N 3.12Å; Q533-L536 PolarHBondContact O-N 2.94Å; L536-A538 PolarHBondContact O-N 3.21Å; L536-G539 PolarHBondContact O-N 3.41Å; L536-I542 HydrophobicContact CD2-CB 4.15Å; L536-I542 HydrophobicContact CD2-CD1 4.15Å; L536-I542 HydrophobicContact CD2-CG1 4.17Å; L536-L581 HydrophobicContact CD1-CD2 4.41Å
537	D	91.9	Very high	91.4	Very high	124 Å²	124	41 Å²	41	66%	0.663	25%	0.25	S	C	*	.	H	α-helix	trans	-61.4	-30.9	175.9	-69.5	-16.7	0	0	0	112.2	Q533 G539	Q533-D537 PolarHBondContact NE2-OD1 2.98Å; Q533-D537 WeakPolarHBondContact O-CB 3.5Å; Q533-D537 PolarHBondContact O-N 2.99Å; D537-G539 VanDerWaalsContact C-N 3.27Å; D537-G539 PolarHBondContact O-N 3.2Å
538	A	89.9	Confident	90.3	Very high	43 Å²	43	42.6 Å²	42.6	36%	0.355	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	2.8	176.2	0	0	0	0	0	114.1	V497 I509 M534 L535 L536	V497-A538 HydrophobicContact CG1-CB 3.73Å; I509-A538 HydrophobicContact CD1-CB 3.34Å; M534-A538 WeakPolarHBondContact O-CB 3.5Å; M534-A538 PolarHBondContact O-N 3.37Å; M534-A538 VanDerWaalsContact O-N 3.09Å; L535-A538 PolarHBondContact O-N 3.37Å; L536-A538 PolarHBondContact O-N 3.21Å
539	G	89.7	Confident	89	Confident	50 Å²	50	43.5 Å²	43.5	52%	0.515	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.4	25.4	174.4	0	0	0	0	0	115.1	L535 L536 D537	L535-G539 PolarHBondContact O-N 2.85Å; L536-G539 PolarHBondContact O-N 3.41Å; D537-G539 VanDerWaalsContact C-N 3.27Å; D537-G539 PolarHBondContact O-N 3.2Å
540	A	92.4	Very high	87.3	Confident	11 Å²	11	41.3 Å²	41.3	9%	0.091	26%	0.258	C	S	.	.			trans	-64	138.9	171.8	0	0	0	0	0	111.7	I509 N510 L520 L535 I542	I509-A540 HydrophobicContact CG1-CB 4.39Å; I509-A540 HydrophobicContact CG2-CB 4.25Å; N510-A540 WeakPolarHBondContact OD1-CA 3.5Å; L520-A540 HydrophobicContact CB-CB 4.26Å; L520-A540 HydrophobicContact CD2-CB 4.1Å; L535-A540 HydrophobicContact CB-CB 4.16Å; L535-A540 WeakPolarHBondContact O-CB 3.34Å; L535-A540 PolarHBondContact O-N 2.92Å; A540-I542 PolarHBondContact O-N 3.12Å
541	D	91.3	Very high	85.6	Confident	78 Å²	78	45.4 Å²	45.4	42%	0.417	27%	0.269	S	S	.	.			trans	-77.4	112.8	178.2	-176.6	2	0	0	0	111	N510 N543 S544	N510-D541 PolarHBondContact OD1-N 3.06Å; D541-N543 VanDerWaalsContact C-N 3.27Å; D541-N543 PolarHBondContact O-N 3.24Å; D541-N543 PolarHBondContact OD1-N 3.04Å; D541-S544 WeakPolarHBondContact O-CB 3.48Å; D541-S544 PolarHBondContact O-N 3.05Å; D541-S544 PolarHBondContact O-OG 3.35Å
542	I	92.9	Very high	83.9	Confident	19 Å²	19	53.1 Å²	53.1	10%	0.097	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-24.7	-176.9	-161.3	167.2	0	0	0	113.6	L536 A540 P565 L581 N584 A586	L536-I542 HydrophobicContact CD2-CB 4.15Å; L536-I542 HydrophobicContact CD2-CD1 4.15Å; L536-I542 HydrophobicContact CD2-CG1 4.17Å; A540-I542 PolarHBondContact O-N 3.12Å; I542-P565 WeakPolarHBondContact O-CD 3.31Å; I542-P565 WeakPolarHBondContact O-CG 3.46Å; I542-L581 HydrophobicContact CD1-CB 4.3Å; I542-L581 HydrophobicContact CD1-CD2 3.83Å; I542-L581 VanDerWaalsContact CD1-O 3.32Å; I542-L581 WeakPolarHBondContact CD1-O 3.48Å; I542-L581 HydrophobicContact CG1-CD2 3.75Å; I542-N584 HydrophobicContact CD1-CB 3.68Å; I542-A586 HydrophobicContact CD1-CB 3.8Å; I542-A586 HydrophobicContact CG1-CB 3.93Å
543	N	90.1	Very high	82.4	Confident	60 Å²	60	55.3 Å²	55.3	32%	0.321	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	16.7	-179.5	-62.6	-51.9	0	0	0	111.8	D541 E545 N587	D541-N543 VanDerWaalsContact C-N 3.27Å; D541-N543 PolarHBondContact O-N 3.24Å; D541-N543 PolarHBondContact OD1-N 3.04Å; N543-E545 PolarHBondContact O-N 3.45Å; N543-N587 PolarHBondContact OD1-N 3.36Å
544	S	89.5	Confident	80.8	Confident	17 Å²	17	56 Å²	56	12%	0.119	32%	0.323	C	S	.	.			trans	-56.8	134.5	171.9	53.2	0	0	0	0	110.4	M521 D541 P565	M521-S544 WeakPolarHBondContact CE-O 3.1Å; D541-S544 WeakPolarHBondContact O-CB 3.48Å; D541-S544 PolarHBondContact O-N 3.05Å; D541-S544 PolarHBondContact O-OG 3.35Å; S544-P565 WeakPolarHBondContact O-CD 3.2Å
545	E	88.5	Confident	79.5	Confident	60 Å²	60	56.8 Å²	56.8	28%	0.28	33%	0.33	S	S	.	.			trans	-112.8	140.7	-177.9	-70.4	176.9	-156.1	0	0	110.8	N543 T564 A591	N543-E545 PolarHBondContact O-N 3.45Å; E545-T564 HydrophobicContact CG-CG2 3.81Å; E545-A591 HydrophobicContact CG-CB 3.78Å; E545-A591 WeakPolarHBondContact OE1-CA 3.22Å; E545-A591 WeakPolarHBondContact OE1-CB 3.36Å
546	V	86.2	Confident	78.5	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.006	33%	0.33	C	S	.	.			trans	-63	130	170.3	177.1	0	0	0	0	109.5	M517 M521 S548 V556 T560 Q562 A563 F568	M517-V546 HydrophobicContact CG-CG2 4.39Å; M521-V546 HydrophobicContact CE-CG2 3.95Å; M521-V546 HydrophobicContact SD-CG2 3.68Å; V546-S548 PolarHBondContact O-N 3.17Å; V546-V556 HydrophobicContact CG1-CG1 3.72Å; V546-T560 WeakPolarHBondContact CB-O 3.39Å; V546-T560 VanDerWaalsContact CG1-O 3.28Å; V546-T560 WeakPolarHBondContact CG1-O 3.27Å; V546-T560 VanDerWaalsContact CG2-O 3.3Å; V546-T560 WeakPolarHBondContact CG2-O 3.44Å; V546-Q562 WeakPolarHBondContact O-CA 3.46Å; V546-Q562 PolarHBondContact O-N 3.07Å; V546-A563 HydrophobicContact CG2-CB 4.25Å; V546-A563 PolarHBondContact N-O 2.86Å; V546-F568 HydrophobicContact CG2-CE2 3.95Å; V546-F568 HydrophobicContact CG2-CZ 4.2Å
547	P	81.9	Confident	77.5	Confident	27 Å²	27	56.1 Å²	56.1	18%	0.175	33%	0.326	C	S	.	.			trans	-56.1	135.7	-175.1	-28.3	35	0	0	0	114.6	M512	M512-P547 HydrophobicContact CE-CG 3.82Å; M512-P547 VanDerWaalsContact SD-CD 3.6Å; M512-P547 HydrophobicContact SD-CG 3.58Å; M512-P547 VanDerWaalsContact SD-CG 3.58Å
548	S	70.8	Confident	76.5	Confident	58 Å²	58	51.8 Å²	51.8	41%	0.406	31%	0.305	S	S	.	.			trans	-80.3	-22.4	179.3	64.4	0	0	0	0	114	V546	V546-S548 PolarHBondContact O-N 3.17Å
549	T	64	Low	75.6	Confident	71 Å²	71	53.3 Å²	53.3	44%	0.436	30%	0.304	S	S	.	.			trans	-86.8	119	-170.7	60.6	0	0	0	0	113.8	N551	T549-N551 VanDerWaalsContact C-N 3.28Å; T549-N551 PolarHBondContact O-N 3.45Å
550	V	59.7	Low	74.9	Confident	58 Å²	58	51.1 Å²	51.1	35%	0.352	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-28.2	179.5	-170	0	0	0	0	113.2	K552 H553	V550-K552 PolarHBondContact O-N 2.84Å; V550-H553 CarbonylContact O-C 3.43Å
551	N	57.4	Low	74.3	Confident	161 Å²	161	52.4 Å²	52.4	86%	0.861	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-25.4	-172.2	-63.5	-17.2	0	0	0	113.7	T549	T549-N551 VanDerWaalsContact C-N 3.28Å; T549-N551 PolarHBondContact O-N 3.45Å
552	K	56.7	Low	74	Confident	170 Å²	170	51 Å²	51	74%	0.739	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-31.5	177.6	-69.1	-174.7	178.6	-178.5	0	112.4	V550	V550-K552 PolarHBondContact O-N 2.84Å
553	H	62.8	Low	73.7	Confident	47 Å²	47	50.6 Å²	50.6	22%	0.218	27%	0.274	C	S	.	.			trans	-135.9	84.4	-179.5	-59.1	-82	0	0	0	111.1	V550 S555 V556	V550-H553 CarbonylContact O-C 3.43Å; H553-S555 PolarHBondContact O-N 3.01Å; H553-V556 HydrophobicContact CB-CG2 3.43Å; H553-V556 VanDerWaalsContact CB-CG2 3.43Å; H553-V556 PolarHBondContact O-N 3Å
554	P	61	Low	73.7	Confident	78 Å²	78	47.8 Å²	47.8	51%	0.506	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-23	-176.5	27.2	-34.3	0	0	0	113.3	V556	P554-V556 VanDerWaalsContact C-N 3.32Å
555	S	66.4	Low	73.9	Confident	33 Å²	33	47 Å²	47	23%	0.231	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-6.3	-178.4	-55.9	0	0	0	0	114	H553 Y557	H553-S555 PolarHBondContact O-N 3.01Å; S555-Y557 PolarHBondContact O-N 3.14Å
556	V	72.4	Confident	74.2	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.012	24%	0.24	C	C	.	.			trans	-65.7	126.6	178	175.7	0	0	0	0	110	R432 V546 H553 P554 R561	R432-V556 PolarHBondContact NH1-O 3.06Å; V546-V556 HydrophobicContact CG1-CG1 3.72Å; H553-V556 HydrophobicContact CB-CG2 3.43Å; H553-V556 VanDerWaalsContact CB-CG2 3.43Å; H553-V556 PolarHBondContact O-N 3Å; P554-V556 VanDerWaalsContact C-N 3.32Å; V556-R561 HydrophobicContact CG1-CG 3.67Å
557	Y	71.6	Confident	74.5	Confident	10 Å²	10	44.7 Å²	44.7	4%	0.039	24%	0.243	C	C	.	.			trans	-68.7	139.9	176.6	-152.6	-106.9	0	0	0	109.8	Y145 E152 H430 S555 E559 T560	Y145-Y557 AromaticContact CD2-CD1 3.78Å; Y145-Y557 HydrophobicContact CD2-CD1 3.78Å; Y145-Y557 AromaticContact CD2-CE1 3.7Å; Y145-Y557 HydrophobicContact CD2-CE1 3.7Å; Y145-Y557 AromaticContact CE2-CD1 3.35Å; Y145-Y557 HydrophobicContact CE2-CD1 3.35Å; Y145-Y557 HydrophobicContact CE2-CD2 4.15Å; Y145-Y557 AromaticContact CE2-CE1 3.57Å; Y145-Y557 HydrophobicContact CE2-CE1 3.57Å; Y145-Y557 HydrophobicContact CE2-CE2 4.34Å; Y145-Y557 AromaticContact CE2-CG 3.67Å; Y145-Y557 HydrophobicContact CE2-CG 3.67Å; Y145-Y557 AromaticContact CZ-CD1 3.88Å; Y145-Y557 AromaticContact CZ-CG 3.92Å; E152-Y557 PolarHBondContact OE1-OH 3.27Å; H430-Y557 PolarHBondContact CE1-OH 3.18Å; S555-Y557 PolarHBondContact O-N 3.14Å; Y557-E559 VanDerWaalsContact C-N 3.29Å; Y557-E559 HydrophobicContact CD1-CB 3.98Å; Y557-E559 HydrophobicContact CD1-CG 4.08Å; Y557-E559 HydrophobicContact CE1-CB 4.29Å; Y557-E559 HydrophobicContact CE1-CG 3.92Å; Y557-E559 PolarHBondContact O-N 3.08Å; Y557-T560 PolarHBondContact O-N 2.86Å; Y557-T560 PolarHBondContact O-OG1 3.14Å
558	P	71.6	Confident	74.9	Confident	34 Å²	34	43.5 Å²	43.5	22%	0.221	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-61.4	-39.1	-174.2	-21.8	35.1	0	0	0	112.7	R432 T560 R561	R432-P558 VanDerWaalsContact NH2-CD 3.34Å; P558-T560 PolarHBondContact O-N 3.38Å; P558-R561 WeakPolarHBondContact O-CB 3.4Å; P558-R561 PolarHBondContact O-N 3.4Å
559	E	70.2	Confident	76	Confident	75 Å²	75	40.8 Å²	40.8	35%	0.35	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-71.7	-18.3	-177.4	-55.1	-62.9	137.7	0	0	113	K147 T149 Y557	K147-E559 WeakPolarHBondContact CE-OE2 3.44Å; K147-E559 IonicContact NZ-OE2 3.62Å; K147-E559 PolarHBondContact NZ-OE2 3.5Å; T149-E559 HydrophobicContact CG2-CG 4.17Å; Y557-E559 VanDerWaalsContact C-N 3.29Å; Y557-E559 HydrophobicContact CD1-CB 3.98Å; Y557-E559 HydrophobicContact CD1-CG 4.08Å; Y557-E559 HydrophobicContact CE1-CB 4.29Å; Y557-E559 HydrophobicContact CE1-CG 3.92Å; Y557-E559 PolarHBondContact O-N 3.08Å
560	T	76.3	Confident	77.5	Confident	3 Å²	3	37.5 Å²	37.5	2%	0.018	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-93.6	-6.2	177.3	60.7	0	0	0	0	112.7	Y145 V546 Y557 P558 Q562 A563 F568	Y145-T560 HydrophobicContact CD1-CG2 3.69Å; Y145-T560 HydrophobicContact CE1-CG2 3.23Å; V546-T560 WeakPolarHBondContact CB-O 3.39Å; V546-T560 VanDerWaalsContact CG1-O 3.28Å; V546-T560 WeakPolarHBondContact CG1-O 3.27Å; V546-T560 VanDerWaalsContact CG2-O 3.3Å; V546-T560 WeakPolarHBondContact CG2-O 3.44Å; Y557-T560 PolarHBondContact O-N 2.86Å; Y557-T560 PolarHBondContact O-OG1 3.14Å; P558-T560 PolarHBondContact O-N 3.38Å; T560-Q562 PolarHBondContact O-N 2.92Å; T560-A563 WeakPolarHBondContact O-CB 3.3Å; T560-A563 PolarHBondContact O-N 2.94Å; T560-A563 VanDerWaalsContact O-N 3.14Å; T560-F568 HydrophobicContact CG2-CE1 3.97Å; T560-F568 HydrophobicContact CG2-CZ 4Å
561	R	79.3	Confident	78.9	Confident	38 Å²	38	35.8 Å²	35.8	14%	0.143	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	137.6	-179.7	-68.5	177	-173.6	164.8	1.2	109.9	V556 P558 A563 T600	V556-R561 HydrophobicContact CG1-CG 3.67Å; P558-R561 WeakPolarHBondContact O-CB 3.4Å; P558-R561 PolarHBondContact O-N 3.4Å; R561-A563 PolarHBondContact O-N 2.77Å; R561-A563 VanDerWaalsContact O-N 3.08Å; R561-T600 WeakPolarHBondContact O-CG2 3.37Å
562	Q	84	Confident	80.4	Confident	50 Å²	50	30.5 Å²	30.5	23%	0.234	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	24.2	-176.8	-44.7	168.8	-85.4	0	0	112.6	V546 T560 A591 T600	V546-Q562 WeakPolarHBondContact O-CA 3.46Å; V546-Q562 PolarHBondContact O-N 3.07Å; T560-Q562 PolarHBondContact O-N 2.92Å; Q562-A591 HydrophobicContact CB-CB 4Å; Q562-A591 WeakPolarHBondContact O-CB 3.45Å; Q562-T600 HydrophobicContact CB-CG2 3.71Å; Q562-T600 HydrophobicContact CG-CG2 4.47Å
563	A	86.6	Confident	82.1	Confident	10 Å²	10	23.8 Å²	23.8	8%	0.083	13%	0.133	C	C	.	.			trans	-77	137.3	168.1	0	0	0	0	0	109	V546 T560 R561 T567 F568	V546-A563 HydrophobicContact CG2-CB 4.25Å; V546-A563 PolarHBondContact N-O 2.86Å; T560-A563 WeakPolarHBondContact O-CB 3.3Å; T560-A563 PolarHBondContact O-N 2.94Å; T560-A563 VanDerWaalsContact O-N 3.14Å; R561-A563 PolarHBondContact O-N 2.77Å; R561-A563 VanDerWaalsContact O-N 3.08Å; A563-T567 WeakPolarHBondContact CA-OG1 3.33Å; A563-T567 WeakPolarHBondContact CB-OG1 3.42Å; A563-F568 HydrophobicContact CB-CD2 4.13Å; A563-F568 HydrophobicContact CB-CE2 3.5Å; A563-F568 VanDerWaalsContact CB-CE2 3.5Å; A563-F568 HydrophobicContact CB-CZ 3.72Å
564	T	91.6	Very high	83.7	Confident	1 Å²	1	24.1 Å²	24.1	1%	0.006	14%	0.135	C	C	.	.			trans	-99.7	164	171.4	63.8	0	0	0	0	111	E545 L566 T567 F568 A591	E545-T564 HydrophobicContact CG-CG2 3.81Å; T564-L566 PolarHBondContact O-N 3.12Å; T564-T567 PolarHBondContact N-OG1 3.47Å; T564-T567 PolarHBondContact O-N 3.19Å; T564-T567 PolarHBondContact O-OG1 3.43Å; T564-T567 PolarHBondContact OG1-N 3.26Å; T564-F568 WeakPolarHBondContact O-CD2 3.37Å; T564-F568 PolarHBondContact O-N 3.36Å; T564-F568 VanDerWaalsContact O-N 3.15Å; T564-A591 HydrophobicContact CG2-CB 4.02Å
565	P	93.5	Very high	85.3	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-46.8	-42.5	170	-30.6	35	0	0	0	113.6	L520 M521 I542 S544 F568 A569 L581	L520-P565 HydrophobicContact CD2-CB 4.08Å; L520-P565 HydrophobicContact CD2-CG 3.77Å; L520-P565 HydrophobicContact CG-CB 4.11Å; L520-P565 HydrophobicContact CG-CG 4.07Å; M521-P565 HydrophobicContact CG-CG 3.97Å; I542-P565 WeakPolarHBondContact O-CD 3.31Å; I542-P565 WeakPolarHBondContact O-CG 3.46Å; S544-P565 WeakPolarHBondContact O-CD 3.2Å; P565-F568 PolarHBondContact O-N 3.18Å; P565-A569 PolarHBondContact O-N 3.35Å; P565-L581 HydrophobicContact CB-CD1 4.42Å; P565-L581 HydrophobicContact CB-CD2 4.48Å
566	L	94.3	Very high	86.7	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-61.1	-46.3	176.5	-177.3	67.8	0	0	0	112.1	T564 F568 A569 V570 V578 L581 L582 A586 N587 P603	T564-L566 PolarHBondContact O-N 3.12Å; L566-F568 VanDerWaalsContact C-N 3.29Å; L566-F568 PolarHBondContact O-N 3.02Å; L566-A569 PolarHBondContact O-N 3.28Å; L566-V570 HydrophobicContact CD1-CG2 4.49Å; L566-V570 WeakPolarHBondContact O-CG2 3.38Å; L566-V570 PolarHBondContact O-N 3.46Å; L566-V578 HydrophobicContact CD1-CG1 3.91Å; L566-L581 HydrophobicContact CB-CD1 4.37Å; L566-L581 HydrophobicContact CD1-CB 4.15Å; L566-L581 HydrophobicContact CD1-CD1 4.28Å; L566-L582 HydrophobicContact CD1-CD2 4.04Å; L566-L582 HydrophobicContact CD1-CG 3.99Å; L566-L582 HydrophobicContact CD2-CD2 3.84Å; L566-A586 HydrophobicContact CB-CB 4.43Å; L566-A586 HydrophobicContact CD2-CB 4.38Å; L566-N587 WeakPolarHBondContact CD2-O 3.47Å; L566-P603 HydrophobicContact CD2-CB 4.43Å; L566-P603 HydrophobicContact CD2-CG 3.91Å; L566-P603 HydrophobicContact CG-CG 4.19Å
567	T	91.6	Very high	87.9	Confident	12 Å²	12	23.2 Å²	23.2	7%	0.074	13%	0.128	C	C	.	.	H	α-helix	trans	-60.3	-38.9	178.4	60.9	0	0	0	0	111.6	A563 T564 V570 L571 P603	A563-T567 WeakPolarHBondContact CA-OG1 3.33Å; A563-T567 WeakPolarHBondContact CB-OG1 3.42Å; T564-T567 PolarHBondContact N-OG1 3.47Å; T564-T567 PolarHBondContact O-N 3.19Å; T564-T567 PolarHBondContact O-OG1 3.43Å; T564-T567 PolarHBondContact OG1-N 3.26Å; T567-V570 PolarHBondContact O-N 3.38Å; T567-L571 WeakPolarHBondContact O-CB 3.43Å; T567-L571 PolarHBondContact O-N 3.29Å; T567-P603 HydrophobicContact CG2-CG 3.93Å
568	F	91.6	Very high	89.1	Confident	2 Å²	2	22.7 Å²	22.7	1%	0.009	13%	0.126	C	C	.	.	H	α-helix	trans	-67.7	-40.6	176.1	-77.1	-69.5	0	0	0	113.3	M517 M521 C524 V525 V546 T560 A563 T564 P565 L566 V570 L571 H572	M517-F568 HydrophobicContact CE-CD1 4.31Å; M517-F568 HydrophobicContact CE-CD2 4.45Å; M517-F568 HydrophobicContact CE-CE1 3.9Å; M517-F568 HydrophobicContact CE-CE2 4.04Å; M517-F568 HydrophobicContact CE-CZ 3.75Å; M517-F568 HydrophobicContact CG-CZ 4.37Å; M517-F568 HydrophobicContact SD-CE1 4.47Å; M517-F568 HydrophobicContact SD-CZ 4.17Å; M521-F568 HydrophobicContact CB-CD2 3.95Å; M521-F568 HydrophobicContact CB-CE2 4.12Å; M521-F568 HydrophobicContact CG-CD2 3.91Å; M521-F568 HydrophobicContact CG-CE2 4.01Å; M521-F568 HydrophobicContact SD-CD2 4.37Å; M521-F568 HydrophobicContact SD-CE2 3.87Å; C524-F568 HydrophobicContact CB-CB 4.3Å; V525-F568 HydrophobicContact CG2-CB 3.88Å; V525-F568 HydrophobicContact CG2-CD1 3.57Å; V525-F568 HydrophobicContact CG2-CE1 4.35Å; V525-F568 HydrophobicContact CG2-CG 3.91Å; V546-F568 HydrophobicContact CG2-CE2 3.95Å; V546-F568 HydrophobicContact CG2-CZ 4.2Å; T560-F568 HydrophobicContact CG2-CE1 3.97Å; T560-F568 HydrophobicContact CG2-CZ 4Å; A563-F568 HydrophobicContact CB-CD2 4.13Å; A563-F568 HydrophobicContact CB-CE2 3.5Å; A563-F568 VanDerWaalsContact CB-CE2 3.5Å; A563-F568 HydrophobicContact CB-CZ 3.72Å; T564-F568 WeakPolarHBondContact O-CD2 3.37Å; T564-F568 PolarHBondContact O-N 3.36Å; T564-F568 VanDerWaalsContact O-N 3.15Å; P565-F568 PolarHBondContact O-N 3.18Å; L566-F568 VanDerWaalsContact C-N 3.29Å; L566-F568 PolarHBondContact O-N 3.02Å; F568-V570 VanDerWaalsContact C-N 3.33Å; F568-V570 PolarHBondContact O-N 3.02Å; F568-L571 HydrophobicContact CD1-CD2 4.1Å; F568-L571 WeakPolarHBondContact O-CB 3.36Å; F568-L571 PolarHBondContact O-N 3.42Å; F568-H572 PolarHBondContact O-CD2 3.11Å; F568-H572 PolarHBondContact O-N 2.9Å
569	A	94.4	Very high	90.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.2	-42.9	175.9	0	0	0	0	0	111.2	C524 P565 L566 G573 H574 V577 V578 L581	C524-A569 HydrophobicContact CB-CB 4.22Å; P565-A569 PolarHBondContact O-N 3.35Å; L566-A569 PolarHBondContact O-N 3.28Å; A569-G573 PolarHBondContact O-N 2.99Å; A569-G573 VanDerWaalsContact O-N 3.14Å; A569-H574 PolarHBondContact O-N 3.48Å; A569-V577 HydrophobicContact CB-CB 4.31Å; A569-V577 HydrophobicContact CB-CG1 3.78Å; A569-V578 HydrophobicContact CB-CG2 3.63Å; A569-L581 HydrophobicContact CB-CD1 3.97Å
570	V	94.1	Very high	91.5	Very high	3 Å²	3	23 Å²	23	2%	0.018	13%	0.125	C	C	.	.	H	α-helix	trans	-68.4	-39.1	175.2	173	0	0	0	0	112	L566 T567 F568 H572 G573 V578 P603 L606 A607 L615 L619	L566-V570 HydrophobicContact CD1-CG2 4.49Å; L566-V570 WeakPolarHBondContact O-CG2 3.38Å; L566-V570 PolarHBondContact O-N 3.46Å; T567-V570 PolarHBondContact O-N 3.38Å; F568-V570 VanDerWaalsContact C-N 3.33Å; F568-V570 PolarHBondContact O-N 3.02Å; V570-H572 PolarHBondContact O-N 3.42Å; V570-G573 PolarHBondContact O-N 2.91Å; V570-V578 HydrophobicContact CB-CG2 4.46Å; V570-V578 HydrophobicContact CG2-CB 4.47Å; V570-V578 HydrophobicContact CG2-CG1 4.03Å; V570-V578 HydrophobicContact CG2-CG2 3.53Å; V570-P603 HydrophobicContact CB-CB 4.5Å; V570-P603 HydrophobicContact CG1-CB 4.49Å; V570-P603 WeakPolarHBondContact CG1-O 3.27Å; V570-P603 HydrophobicContact CG2-CB 4.11Å; V570-L606 HydrophobicContact CG1-CB 3.92Å; V570-A607 HydrophobicContact CG1-CB 4.09Å; V570-L615 HydrophobicContact CG1-CD1 4.21Å; V570-L619 HydrophobicContact CG2-CD1 4.4Å
571	L	90	Very high	92.4	Very high	22 Å²	22	22.9 Å²	22.9	12%	0.115	12%	0.124	C	C	.	.	H	α-helix	trans	-51.7	-40.8	178.5	-167.4	80.2	0	0	0	111.8	Y145 A146 R218 T567 F568 L606	Y145-L571 WeakPolarHBondContact O-CD1 3.27Å; Y145-L571 WeakPolarHBondContact O-CG 3.23Å; A146-L571 WeakPolarHBondContact CB-O 3.22Å; R218-L571 PolarHBondContact NH1-O 2.98Å; R218-L571 PolarHBondContact NH2-O 3.5Å; R218-L571 VanDerWaalsContact NH2-O 3.07Å; T567-L571 WeakPolarHBondContact O-CB 3.43Å; T567-L571 PolarHBondContact O-N 3.29Å; F568-L571 HydrophobicContact CD1-CD2 4.1Å; F568-L571 WeakPolarHBondContact O-CB 3.36Å; F568-L571 PolarHBondContact O-N 3.42Å; L571-L606 HydrophobicContact CD1-CD1 4.21Å; L571-L606 HydrophobicContact CD1-CD2 4.1Å
572	H	89.3	Confident	93.1	Very high	50 Å²	50	21.7 Å²	21.7	23%	0.231	12%	0.121	C	C	.	.	H	α-helix	trans	-98.2	-4.2	-178.8	-70	-75.1	0	0	0	114.4	R144 F568 V570	R144-H572 PolarHBondContact O-CE1 2.62Å; F568-H572 PolarHBondContact O-CD2 3.11Å; F568-H572 PolarHBondContact O-N 2.9Å; V570-H572 PolarHBondContact O-N 3.42Å
573	G	92.3	Very high	93.6	Very high	28 Å²	28	23.5 Å²	23.5	29%	0.289	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.1	19.9	174.7	0	0	0	0	0	115.3	A569 V570 V575	A569-G573 PolarHBondContact O-N 2.99Å; A569-G573 VanDerWaalsContact O-N 3.14Å; V570-G573 PolarHBondContact O-N 2.91Å; G573-V575 PolarHBondContact O-N 2.98Å
574	H	94.9	Very high	93.8	Very high	54 Å²	54	26.5 Å²	26.5	25%	0.25	15%	0.147	C	C	.	.			trans	-81	79.5	-174.9	-64.1	-53.4	0	0	0	112.2	C524 V525 G527 A569 V577 V578	C524-H574 PolarHBondContact O-CD2 3.48Å; V525-H574 PolarHBondContact O-NE2 3.31Å; G527-H574 VanDerWaalsContact CA-CD2 3.41Å; G527-H574 WeakPolarHBondContact CA-CD2 3.35Å; G527-H574 VanDerWaalsContact CA-CG 3.48Å; G527-H574 PolarHBondContact N-CD2 3Å; G527-H574 PolarHBondContact N-NE2 3.36Å; A569-H574 PolarHBondContact O-N 3.48Å; H574-V577 HydrophobicContact CB-CB 4.12Å; H574-V577 HydrophobicContact CB-CG2 4.28Å; H574-V577 PolarHBondContact O-N 2.83Å; H574-V578 WeakPolarHBondContact O-CG2 3.49Å; H574-V578 PolarHBondContact O-N 3.42Å
575	V	95.7	Very high	93.8	Very high	21 Å²	21	37.2 Å²	37.2	13%	0.127	19%	0.187	C	C	.	.	H	α-helix	trans	-51.1	-47.2	-176	-173.4	0	0	0	0	113.9	G573 V577 V578 Q579 E614 L615 L618	G573-V575 PolarHBondContact O-N 2.98Å; V575-V577 PolarHBondContact O-N 2.8Å; V575-V578 PolarHBondContact O-N 3.35Å; V575-Q579 PolarHBondContact O-N 2.85Å; V575-E614 HydrophobicContact CG1-CG 4.07Å; V575-E614 HydrophobicContact CG2-CG 4.37Å; V575-L615 HydrophobicContact CB-CD2 4.25Å; V575-L615 HydrophobicContact CG1-CD2 4.33Å; V575-L615 HydrophobicContact CG2-CD2 3.84Å; V575-L615 HydrophobicContact CG2-CG 3.99Å; V575-L618 HydrophobicContact CG1-CD2 4.5Å
576	P	96.4	Very high	93.7	Very high	71 Å²	71	37.6 Å²	37.6	46%	0.461	19%	0.19	S	C	.	.	H	α-helix	trans	-63	-40.9	-179	-23.1	35.3	0	0	0	112.9	Q579 L580	P576-Q579 PolarHBondContact O-N 3.35Å; P576-L580 WeakPolarHBondContact O-CB 3.26Å; P576-L580 PolarHBondContact O-N 2.9Å
577	V	96.6	Very high	93.4	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.012	21%	0.206	C	C	.	.	H	α-helix	trans	-66.1	-40.5	176.3	176.5	0	0	0	0	110.9	C524 E529 V532 A569 H574 V575 L580 L581	C524-V577 HydrophobicContact CB-CG1 4.46Å; E529-V577 HydrophobicContact CB-CG2 4.37Å; V532-V577 HydrophobicContact CG1-CG1 4.38Å; V532-V577 HydrophobicContact CG2-CG1 3.96Å; A569-V577 HydrophobicContact CB-CB 4.31Å; A569-V577 HydrophobicContact CB-CG1 3.78Å; H574-V577 HydrophobicContact CB-CB 4.12Å; H574-V577 HydrophobicContact CB-CG2 4.28Å; H574-V577 PolarHBondContact O-N 2.83Å; V575-V577 PolarHBondContact O-N 2.8Å; V577-L580 PolarHBondContact O-N 3.09Å; V577-L581 HydrophobicContact CG1-CD1 4Å; V577-L581 HydrophobicContact CG1-CG 4.3Å; V577-L581 WeakPolarHBondContact O-CB 3.21Å; V577-L581 VanDerWaalsContact O-CG 3.25Å; V577-L581 WeakPolarHBondContact O-CG 3.36Å; V577-L581 PolarHBondContact O-N 3.46Å
578	V	96.7	Very high	93.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61	-45.8	175.6	173.4	0	0	0	0	110.7	L566 A569 V570 H574 V575 L581 L582 L615 L618	L566-V578 HydrophobicContact CD1-CG1 3.91Å; A569-V578 HydrophobicContact CB-CG2 3.63Å; V570-V578 HydrophobicContact CB-CG2 4.46Å; V570-V578 HydrophobicContact CG2-CB 4.47Å; V570-V578 HydrophobicContact CG2-CG1 4.03Å; V570-V578 HydrophobicContact CG2-CG2 3.53Å; H574-V578 WeakPolarHBondContact O-CG2 3.49Å; H574-V578 PolarHBondContact O-N 3.42Å; V575-V578 PolarHBondContact O-N 3.35Å; V578-L581 PolarHBondContact O-N 2.85Å; V578-L582 HydrophobicContact CG1-CD1 3.69Å; V578-L582 HydrophobicContact CG1-CG 4.35Å; V578-L582 WeakPolarHBondContact O-CB 3.44Å; V578-L582 WeakPolarHBondContact O-CG 3.36Å; V578-L582 PolarHBondContact O-N 2.98Å; V578-L615 HydrophobicContact CB-CD2 3.96Å; V578-L615 HydrophobicContact CG1-CD2 3.94Å; V578-L615 HydrophobicContact CG2-CD2 3.9Å; V578-L618 HydrophobicContact CB-CD2 4.45Å; V578-L618 HydrophobicContact CG1-CD2 3.85Å
579	Q	96.1	Very high	93.1	Very high	93 Å²	93	42.3 Å²	42.3	44%	0.435	22%	0.215	S	C	.	.	H	α-helix	trans	-59.8	-47.7	176.1	-177.1	176.3	-14.6	0	0	111.3	V575 P576 L581 L582 D583 L618	V575-Q579 PolarHBondContact O-N 2.85Å; P576-Q579 PolarHBondContact O-N 3.35Å; Q579-L581 VanDerWaalsContact C-N 3.34Å; Q579-L581 PolarHBondContact O-N 3.34Å; Q579-L582 PolarHBondContact O-N 3.5Å; Q579-D583 WeakPolarHBondContact O-CB 3.32Å; Q579-D583 PolarHBondContact O-N 3.01Å; Q579-L618 HydrophobicContact CB-CD2 4.22Å
580	L	96	Very high	92.6	Very high	22 Å²	22	42.5 Å²	42.5	12%	0.115	22%	0.216	C	C	.	.	H	α-helix	trans	-58	-44.6	178.1	177.4	62.4	0	0	0	112.3	E529 V532 Q533 P576 V577 D583 N584	E529-L580 HydrophobicContact CG-CD2 4.06Å; V532-L580 HydrophobicContact CB-CD2 4.22Å; V532-L580 HydrophobicContact CG1-CD2 3.72Å; Q533-L580 HydrophobicContact CB-CD2 4.35Å; Q533-L580 VanDerWaalsContact OE1-CD1 3.22Å; P576-L580 WeakPolarHBondContact O-CB 3.26Å; P576-L580 PolarHBondContact O-N 2.9Å; V577-L580 PolarHBondContact O-N 3.09Å; L580-D583 PolarHBondContact O-N 3.38Å; L580-N584 WeakPolarHBondContact CD1-ND2 3.42Å; L580-N584 PolarHBondContact O-N 3.31Å; L580-N584 VanDerWaalsContact O-N 3.12Å; L580-N584 PolarHBondContact O-ND2 3.42Å
581	L	95.4	Very high	91.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.9	-43.4	178.4	-69.3	171.2	0	0	0	111.5	V532 L536 I542 P565 L566 A569 V577 V578 Q579 N584 R585 A586	V532-L581 HydrophobicContact CG1-CD2 4.13Å; L536-L581 HydrophobicContact CD1-CD2 4.41Å; I542-L581 HydrophobicContact CD1-CB 4.3Å; I542-L581 HydrophobicContact CD1-CD2 3.83Å; I542-L581 VanDerWaalsContact CD1-O 3.32Å; I542-L581 WeakPolarHBondContact CD1-O 3.48Å; I542-L581 HydrophobicContact CG1-CD2 3.75Å; P565-L581 HydrophobicContact CB-CD1 4.42Å; P565-L581 HydrophobicContact CB-CD2 4.48Å; L566-L581 HydrophobicContact CB-CD1 4.37Å; L566-L581 HydrophobicContact CD1-CB 4.15Å; L566-L581 HydrophobicContact CD1-CD1 4.28Å; A569-L581 HydrophobicContact CB-CD1 3.97Å; V577-L581 HydrophobicContact CG1-CD1 4Å; V577-L581 HydrophobicContact CG1-CG 4.3Å; V577-L581 WeakPolarHBondContact O-CB 3.21Å; V577-L581 VanDerWaalsContact O-CG 3.25Å; V577-L581 WeakPolarHBondContact O-CG 3.36Å; V577-L581 PolarHBondContact O-N 3.46Å; V578-L581 PolarHBondContact O-N 2.85Å; Q579-L581 VanDerWaalsContact C-N 3.34Å; Q579-L581 PolarHBondContact O-N 3.34Å; L581-N584 CarbonylContact O-C 3.47Å; L581-N584 PolarHBondContact O-N 2.95Å; L581-R585 PolarHBondContact O-N 3.49Å; L581-A586 HydrophobicContact CB-CB 4.05Å; L581-A586 WeakPolarHBondContact O-CB 3.46Å; L581-A586 PolarHBondContact O-N 3.43Å
582	L	94.2	Very high	91.1	Very high	13 Å²	13	43.3 Å²	43.3	7%	0.068	22%	0.222	C	C	.	.	H	α-helix	trans	-67.9	-35.2	178.8	-67.2	171.3	0	0	0	112.2	L566 V578 Q579 N584 R585 V588 L618 L619 R622	L566-L582 HydrophobicContact CD1-CD2 4.04Å; L566-L582 HydrophobicContact CD1-CG 3.99Å; L566-L582 HydrophobicContact CD2-CD2 3.84Å; V578-L582 HydrophobicContact CG1-CD1 3.69Å; V578-L582 HydrophobicContact CG1-CG 4.35Å; V578-L582 WeakPolarHBondContact O-CB 3.44Å; V578-L582 WeakPolarHBondContact O-CG 3.36Å; V578-L582 PolarHBondContact O-N 2.98Å; Q579-L582 PolarHBondContact O-N 3.5Å; L582-N584 VanDerWaalsContact C-N 3.27Å; L582-N584 PolarHBondContact O-N 3.5Å; L582-R585 PolarHBondContact O-N 3.37Å; L582-R585 VanDerWaalsContact O-N 3.12Å; L582-V588 HydrophobicContact CD2-CG2 3.88Å; L582-L618 HydrophobicContact CD1-CD2 4.18Å; L582-L618 HydrophobicContact CD1-CG 4.09Å; L582-L619 HydrophobicContact CD1-CD2 4.05Å; L582-R622 HydrophobicContact CB-CG 4.43Å; L582-R622 VanDerWaalsContact CB-NH1 3.31Å; L582-R622 HydrophobicContact CD1-CG 4.04Å
583	D	94	Very high	89.9	Confident	88 Å²	88	47.1 Å²	47.1	47%	0.471	24%	0.24	S	C	.	.	H	α-helix	trans	-66	-31.7	174.2	-68.5	-10.3	0	0	0	111.5	Q579 L580 R585 R622	Q579-D583 WeakPolarHBondContact O-CB 3.32Å; Q579-D583 PolarHBondContact O-N 3.01Å; L580-D583 PolarHBondContact O-N 3.38Å; D583-R585 PolarHBondContact O-N 3.31Å; D583-R622 IonicContact OD1-CZ 3.54Å; D583-R622 IonicContact OD1-NH1 3.07Å; D583-R622 PolarHBondContact OD1-NH1 3Å; D583-R622 IonicContact OD1-NH2 3.98Å; D583-R622 PolarHBondContact OD1-NH2 3.1Å
584	N	91.9	Very high	88	Confident	74 Å²	74	54.4 Å²	54.4	40%	0.396	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	18.6	172.1	-74.5	-80.7	0	0	0	113.9	I542 L580 L581 L582	I542-N584 HydrophobicContact CD1-CB 3.68Å; L580-N584 WeakPolarHBondContact CD1-ND2 3.42Å; L580-N584 PolarHBondContact O-N 3.31Å; L580-N584 VanDerWaalsContact O-N 3.12Å; L580-N584 PolarHBondContact O-ND2 3.42Å; L581-N584 CarbonylContact O-C 3.47Å; L581-N584 PolarHBondContact O-N 2.95Å; L582-N584 VanDerWaalsContact C-N 3.27Å; L582-N584 PolarHBondContact O-N 3.5Å
585	R	90.5	Very high	85.7	Confident	226 Å²	226	56.2 Å²	56.2	85%	0.853	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	36.1	175.9	-50.8	-178.8	178.4	-169.1	-1.4	115	L581 L582 D583	L581-R585 PolarHBondContact O-N 3.49Å; L582-R585 PolarHBondContact O-N 3.37Å; L582-R585 VanDerWaalsContact O-N 3.12Å; D583-R585 PolarHBondContact O-N 3.31Å
586	A	90.9	Very high	83.8	Confident	7 Å²	7	57.7 Å²	57.7	6%	0.058	32%	0.32	C	S	.	.			trans	-58	144.8	164.3	0	0	0	0	0	111	I542 L566 L581 V588	I542-A586 HydrophobicContact CD1-CB 3.8Å; I542-A586 HydrophobicContact CG1-CB 3.93Å; L566-A586 HydrophobicContact CB-CB 4.43Å; L566-A586 HydrophobicContact CD2-CB 4.38Å; L581-A586 HydrophobicContact CB-CB 4.05Å; L581-A586 WeakPolarHBondContact O-CB 3.46Å; L581-A586 PolarHBondContact O-N 3.43Å; A586-V588 PolarHBondContact O-N 3.37Å
587	N	89.7	Confident	81.8	Confident	64 Å²	64	60.4 Å²	60.4	34%	0.342	33%	0.326	S	S	.	.			trans	-66	118.7	175.3	-175.1	13.1	0	0	0	110.5	N543 L566 E589 G590 L592	N543-N587 PolarHBondContact OD1-N 3.36Å; L566-N587 WeakPolarHBondContact CD2-O 3.47Å; N587-E589 PolarHBondContact O-N 3.47Å; N587-E589 PolarHBondContact OD1-N 3.2Å; N587-G590 WeakPolarHBondContact CB-O 3.5Å; N587-G590 PolarHBondContact ND2-O 3.3Å; N587-G590 PolarHBondContact O-N 3.26Å; N587-L592 PolarHBondContact ND2-O 3.06Å
588	V	89.6	Confident	80.1	Confident	24 Å²	24	62 Å²	62	15%	0.145	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-32.4	-176.5	-179	0	0	0	0	111.7	L582 A586 G590 P603 L619 R622 A624	L582-V588 HydrophobicContact CD2-CG2 3.88Å; A586-V588 PolarHBondContact O-N 3.37Å; V588-G590 VanDerWaalsContact C-N 3.27Å; V588-G590 PolarHBondContact O-N 2.95Å; V588-P603 WeakPolarHBondContact O-CG 3.44Å; V588-L619 HydrophobicContact CG1-CD2 4.31Å; V588-R622 HydrophobicContact CG1-CB 4.47Å; V588-R622 HydrophobicContact CG2-CB 3.9Å; V588-A624 HydrophobicContact CG1-CB 3.55Å
589	E	86.5	Confident	78.6	Confident	27 Å²	27	66.8 Å²	66.8	13%	0.126	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	3.5	177.3	-61.2	-56.9	157.1	0	0	113.5	N587 A591 L592 A624 D625 I628	N587-E589 PolarHBondContact O-N 3.47Å; N587-E589 PolarHBondContact OD1-N 3.2Å; E589-A591 PolarHBondContact O-N 3.48Å; E589-L592 HydrophobicContact CB-CB 3.86Å; E589-L592 HydrophobicContact CB-CD2 4.45Å; E589-A624 VanDerWaalsContact OE1-CA 3.23Å; E589-A624 WeakPolarHBondContact OE1-CA 3.5Å; E589-D625 PolarHBondContact OE1-N 3.24Å; E589-I628 HydrophobicContact CG-CD1 3.99Å; E589-I628 VanDerWaalsContact OE2-CD1 3.25Å; E589-I628 WeakPolarHBondContact OE2-CD1 3.35Å
590	G	84.1	Confident	77.5	Confident	3 Å²	3	63.7 Å²	63.7	3%	0.031	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	-124.1	-178.8	0	0	0	0	0	112.5	N587 V588 L592	N587-G590 WeakPolarHBondContact CB-O 3.5Å; N587-G590 PolarHBondContact ND2-O 3.3Å; N587-G590 PolarHBondContact O-N 3.26Å; V588-G590 VanDerWaalsContact C-N 3.27Å; V588-G590 PolarHBondContact O-N 2.95Å; G590-L592 VanDerWaalsContact C-N 3.27Å; G590-L592 PolarHBondContact O-N 3.03Å
591	A	78.7	Confident	76.8	Confident	10 Å²	10	64.9 Å²	64.9	8%	0.083	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	5.4	-178.4	0	0	0	0	0	114.1	E545 Q562 T564 E589 Q593	E545-A591 HydrophobicContact CG-CB 3.78Å; E545-A591 WeakPolarHBondContact OE1-CA 3.22Å; E545-A591 WeakPolarHBondContact OE1-CB 3.36Å; Q562-A591 HydrophobicContact CB-CB 4Å; Q562-A591 WeakPolarHBondContact O-CB 3.45Å; T564-A591 HydrophobicContact CG2-CB 4.02Å; E589-A591 PolarHBondContact O-N 3.48Å; A591-Q593 PolarHBondContact O-N 3.21Å
592	L	73.3	Confident	76.5	Confident	33 Å²	33	65 Å²	65	17%	0.173	35%	0.347	C	S	.	.			trans	-68.3	123.1	-178.3	-142.2	69.7	0	0	0	110.8	N587 E589 G590 N598 I628	N587-L592 PolarHBondContact ND2-O 3.06Å; E589-L592 HydrophobicContact CB-CB 3.86Å; E589-L592 HydrophobicContact CB-CD2 4.45Å; G590-L592 VanDerWaalsContact C-N 3.27Å; G590-L592 PolarHBondContact O-N 3.03Å; L592-N598 HydrophobicContact CD1-CB 3.78Å; L592-N598 WeakPolarHBondContact CD1-OD1 3.02Å; L592-N598 WeakPolarHBondContact CG-OD1 3.38Å; L592-I628 HydrophobicContact CD2-CD1 3.84Å; L592-I628 HydrophobicContact CD2-CG1 4.41Å; L592-I628 HydrophobicContact CD2-CG2 3.74Å
593	Q	64.3	Low	76.4	Confident	130 Å²	130	64.4 Å²	64.4	61%	0.607	34%	0.343	S	S	*	.			trans	-109.8	143.7	171.8	-65	-177	21.9	0	0	109.8	A591 G595 A596	A591-Q593 PolarHBondContact O-N 3.21Å; Q593-G595 PolarHBondContact O-N 3.19Å; Q593-G595 VanDerWaalsContact O-N 3.16Å; Q593-A596 HydrophobicContact CB-CB 4.27Å; Q593-A596 WeakPolarHBondContact O-CB 3.01Å; Q593-A596 PolarHBondContact O-N 2.96Å
594	D	51.9	Low	76.4	Confident	181 Å²	181	60.2 Å²	60.2	97%	0.968	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	119.9	179.4	-79.7	-28	0	0	0	111.6
595	G	47.8	Very low	76.3	Confident	91 Å²	91	56.7 Å²	56.7	94%	0.938	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	4.4	178	0	0	0	0	0	115.9	Q593	Q593-G595 PolarHBondContact O-N 3.19Å; Q593-G595 VanDerWaalsContact O-N 3.16Å
596	A	54.7	Low	76.4	Confident	52 Å²	52	46.3 Å²	46.3	43%	0.43	26%	0.264	S	S	.	.	S	Bend	trans	-82.5	155.5	172.9	0	0	0	0	0	112.1	Q593 N598	Q593-A596 HydrophobicContact CB-CB 4.27Å; Q593-A596 WeakPolarHBondContact O-CB 3.01Å; Q593-A596 PolarHBondContact O-N 2.96Å; A596-N598 PolarHBondContact O-N 3.09Å; A596-N598 PolarHBondContact O-OD1 3.44Å
597	E	54.4	Low	76.6	Confident	128 Å²	128	46 Å²	46	60%	0.598	26%	0.261	S	S	*	.			trans	-74.9	122.2	172.1	-68.8	-178.1	155.2	0	0	110.2	Y599	E597-Y599 HydrophobicContact CB-CD2 4.03Å; E597-Y599 HydrophobicContact CB-CE2 3.35Å; E597-Y599 HydrophobicContact CG-CE2 4.4Å; E597-Y599 VanDerWaalsContact O-CD2 3.27Å; E597-Y599 WeakPolarHBondContact O-CD2 3.28Å; E597-Y599 PolarHBondContact O-N 3.14Å; E597-Y599 VanDerWaalsContact O-N 3.15Å; E597-Y599 WeakPolarHBondContact OE2-CE2 3.35Å; E597-Y599 VanDerWaalsContact OE2-CZ 3.25Å; E597-Y599 PolarHBondContact OE2-OH 2.66Å
598	N	61.8	Low	76.8	Confident	36 Å²	36	43 Å²	43	19%	0.193	25%	0.245	C	C	.	.			trans	-81.2	91.5	-173.3	-61.6	-5	0	0	0	111.2	L592 A596 G629 T630 M631	L592-N598 HydrophobicContact CD1-CB 3.78Å; L592-N598 WeakPolarHBondContact CD1-OD1 3.02Å; L592-N598 WeakPolarHBondContact CG-OD1 3.38Å; A596-N598 PolarHBondContact O-N 3.09Å; A596-N598 PolarHBondContact O-OD1 3.44Å; N598-G629 PolarHBondContact ND2-O 3.46Å; N598-T630 WeakPolarHBondContact O-CG2 3.34Å; N598-M631 PolarHBondContact O-N 3.09Å
599	Y	65.3	Low	76.9	Confident	101 Å²	101	42 Å²	42	40%	0.396	24%	0.24	S	C	.	.			trans	-94.5	-5.8	177.5	-65.5	-70.2	0	0	0	114.2	E597 M631 R633	E597-Y599 HydrophobicContact CB-CD2 4.03Å; E597-Y599 HydrophobicContact CB-CE2 3.35Å; E597-Y599 HydrophobicContact CG-CE2 4.4Å; E597-Y599 VanDerWaalsContact O-CD2 3.27Å; E597-Y599 WeakPolarHBondContact O-CD2 3.28Å; E597-Y599 PolarHBondContact O-N 3.14Å; E597-Y599 VanDerWaalsContact O-N 3.15Å; E597-Y599 WeakPolarHBondContact OE2-CE2 3.35Å; E597-Y599 VanDerWaalsContact OE2-CZ 3.25Å; E597-Y599 PolarHBondContact OE2-OH 2.66Å; Y599-M631 HydrophobicContact CD1-CB 4.5Å; Y599-M631 WeakPolarHBondContact CD1-O 3.32Å; Y599-M631 HydrophobicContact CE1-CB 4.5Å; Y599-R633 HydrophobicContact CD1-CB 4.16Å; Y599-R633 HydrophobicContact CE1-CB 4.38Å
600	T	73.4	Confident	77.2	Confident	28 Å²	28	41.9 Å²	41.9	17%	0.172	24%	0.243	C	C	.	.	S	Bend	trans	-118.6	140.4	-176.1	46.4	0	0	0	0	112.9	R561 Q562 T602 T630	R561-T600 WeakPolarHBondContact O-CG2 3.37Å; Q562-T600 HydrophobicContact CB-CG2 3.71Å; Q562-T600 HydrophobicContact CG-CG2 4.47Å; T600-T602 PolarHBondContact O-N 3.48Å; T600-T630 VanDerWaalsContact O-CG2 3.23Å; T600-T630 WeakPolarHBondContact O-CG2 3.42Å
601	E	81.1	Confident	77.7	Confident	46 Å²	46	42.9 Å²	42.9	22%	0.215	25%	0.254	C	S	.	.			trans	-66	125.6	174.8	-67.5	168.5	159.8	0	0	109.3	K147 Q605 L606	K147-E601 IonicContact NZ-OE1 3.65Å; K147-E601 PolarHBondContact NZ-OE1 3.1Å; K147-E601 IonicContact NZ-OE2 3.85Å; K147-E601 PolarHBondContact NZ-OE2 2.86Å; E601-Q605 HydrophobicContact CB-CB 4.41Å; E601-L606 HydrophobicContact CB-CD2 3.86Å; E601-L606 HydrophobicContact CB-CG 4.05Å; E601-L606 VanDerWaalsContact OE2-CD2 3.24Å; E601-L606 WeakPolarHBondContact OE2-CD2 3.11Å
602	T	88.6	Confident	78.5	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.018	26%	0.26	C	S	.	.			trans	-63.1	156.5	172.4	60.9	0	0	0	0	110.9	T600 L604 Q605 L606 I628	T600-T602 PolarHBondContact O-N 3.48Å; T602-L604 PolarHBondContact O-N 3.45Å; T602-Q605 WeakPolarHBondContact O-CB 3.24Å; T602-Q605 PolarHBondContact O-N 3.21Å; T602-Q605 VanDerWaalsContact O-N 3.12Å; T602-Q605 WeakPolarHBondContact OG1-CB 3.3Å; T602-Q605 VanDerWaalsContact OG1-CD 3.28Å; T602-Q605 VanDerWaalsContact OG1-CG 3.24Å; T602-Q605 WeakPolarHBondContact OG1-CG 3.38Å; T602-Q605 PolarHBondContact OG1-N 3.4Å; T602-Q605 PolarHBondContact OG1-OE1 3.46Å; T602-L606 WeakPolarHBondContact O-CG 3.28Å; T602-L606 PolarHBondContact O-N 3.06Å; T602-I628 HydrophobicContact CG2-CB 4.45Å; T602-I628 HydrophobicContact CG2-CG2 3.71Å
603	P	92.3	Very high	79.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-50.7	-40.2	172.2	-29.1	37.8	0	0	0	113	L566 T567 V570 V588 L606 A607 L619	L566-P603 HydrophobicContact CD2-CB 4.43Å; L566-P603 HydrophobicContact CD2-CG 3.91Å; L566-P603 HydrophobicContact CG-CG 4.19Å; T567-P603 HydrophobicContact CG2-CG 3.93Å; V570-P603 HydrophobicContact CB-CB 4.5Å; V570-P603 HydrophobicContact CG1-CB 4.49Å; V570-P603 WeakPolarHBondContact CG1-O 3.27Å; V570-P603 HydrophobicContact CG2-CB 4.11Å; V588-P603 WeakPolarHBondContact O-CG 3.44Å; P603-L606 PolarHBondContact O-N 2.94Å; P603-A607 WeakPolarHBondContact O-CB 3.31Å; P603-A607 PolarHBondContact O-N 3.45Å; P603-L619 HydrophobicContact CB-CD1 3.96Å; P603-L619 HydrophobicContact CB-CD2 4.06Å
604	L	92.8	Very high	81.1	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.8	-41.3	179.7	-175.9	63	0	0	0	112.3	T602 L606 A607 A608 V616 L619 L620 A624 P626 L662	T602-L604 PolarHBondContact O-N 3.45Å; L604-L606 VanDerWaalsContact C-N 3.35Å; L604-A607 PolarHBondContact O-N 3.25Å; L604-A608 VanDerWaalsContact O-CB 3.22Å; L604-A608 WeakPolarHBondContact O-CB 3.31Å; L604-A608 PolarHBondContact O-N 3.29Å; L604-V616 HydrophobicContact CD1-CB 4.47Å; L604-V616 HydrophobicContact CD1-CG1 4.14Å; L604-V616 HydrophobicContact CD1-CG2 4.39Å; L604-L619 HydrophobicContact CB-CD1 4.46Å; L604-L619 HydrophobicContact CD1-CB 4.16Å; L604-L620 HydrophobicContact CD1-CD2 4.27Å; L604-L620 HydrophobicContact CD1-CG 4.15Å; L604-L620 HydrophobicContact CD2-CD2 3.89Å; L604-A624 HydrophobicContact CB-CB 4.11Å; L604-A624 HydrophobicContact CD2-CB 3.87Å; L604-A624 HydrophobicContact CG-CB 4.41Å; L604-P626 HydrophobicContact CD2-CB 3.99Å; L604-L662 HydrophobicContact CD1-CD2 4.15Å; L604-L662 HydrophobicContact CD2-CD2 4.25Å; L604-L662 HydrophobicContact CG-CD2 4.38Å
605	Q	90.9	Very high	83.1	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-61.8	-42.4	174.8	-76.3	165.7	-44.8	0	0	111.7	E601 T602 A608 A609 I628 T630 M644 S646 L649	E601-Q605 HydrophobicContact CB-CB 4.41Å; T602-Q605 WeakPolarHBondContact O-CB 3.24Å; T602-Q605 PolarHBondContact O-N 3.21Å; T602-Q605 VanDerWaalsContact O-N 3.12Å; T602-Q605 WeakPolarHBondContact OG1-CB 3.3Å; T602-Q605 VanDerWaalsContact OG1-CD 3.28Å; T602-Q605 VanDerWaalsContact OG1-CG 3.24Å; T602-Q605 WeakPolarHBondContact OG1-CG 3.38Å; T602-Q605 PolarHBondContact OG1-N 3.4Å; T602-Q605 PolarHBondContact OG1-OE1 3.46Å; Q605-A608 PolarHBondContact O-N 3.28Å; Q605-A609 WeakPolarHBondContact O-CB 3.13Å; Q605-A609 PolarHBondContact O-N 3.31Å; Q605-I628 PolarHBondContact NE2-O 2.85Å; Q605-T630 PolarHBondContact NE2-OG1 3.33Å; Q605-T630 PolarHBondContact OE1-OG1 3.36Å; Q605-M644 PolarHBondContact NE2-O 3.28Å; Q605-S646 WeakPolarHBondContact CG-OG 3.29Å; Q605-L649 HydrophobicContact CB-CD1 3.51Å; Q605-L649 HydrophobicContact CG-CD1 3.82Å
606	L	91.5	Very high	85.5	Confident	7 Å²	7	34.3 Å²	34.3	4%	0.037	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-45.2	176.2	-67.8	175.5	0	0	0	112	V570 L571 E601 T602 P603 L604 A610	V570-L606 HydrophobicContact CG1-CB 3.92Å; L571-L606 HydrophobicContact CD1-CD1 4.21Å; L571-L606 HydrophobicContact CD1-CD2 4.1Å; E601-L606 HydrophobicContact CB-CD2 3.86Å; E601-L606 HydrophobicContact CB-CG 4.05Å; E601-L606 VanDerWaalsContact OE2-CD2 3.24Å; E601-L606 WeakPolarHBondContact OE2-CD2 3.11Å; T602-L606 WeakPolarHBondContact O-CG 3.28Å; T602-L606 PolarHBondContact O-N 3.06Å; P603-L606 PolarHBondContact O-N 2.94Å; L604-L606 VanDerWaalsContact C-N 3.35Å; L606-A610 WeakPolarHBondContact O-CB 3.47Å; L606-A610 PolarHBondContact O-N 2.93Å; L606-A610 VanDerWaalsContact O-N 3.08Å
607	A	95.1	Very high	87.4	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-66.3	-39	177.4	0	0	0	0	0	111.9	V570 P603 L604 A610 G611 N612 L615 V616 L619	V570-A607 HydrophobicContact CG1-CB 4.09Å; P603-A607 WeakPolarHBondContact O-CB 3.31Å; P603-A607 PolarHBondContact O-N 3.45Å; L604-A607 PolarHBondContact O-N 3.25Å; A607-A610 PolarHBondContact O-N 3.24Å; A607-G611 PolarHBondContact O-N 3.2Å; A607-G611 VanDerWaalsContact O-N 3.09Å; A607-N612 PolarHBondContact O-N 2.96Å; A607-N612 VanDerWaalsContact O-N 3.11Å; A607-L615 HydrophobicContact CB-CB 3.84Å; A607-V616 HydrophobicContact CB-CG2 3.74Å; A607-L619 HydrophobicContact CB-CD1 4.06Å
608	A	94.7	Very high	89.3	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-66.3	-44.5	178.5	0	0	0	0	0	112.4	L604 Q605 A610 G611 A650 H655 V658 L662	L604-A608 VanDerWaalsContact O-CB 3.22Å; L604-A608 WeakPolarHBondContact O-CB 3.31Å; L604-A608 PolarHBondContact O-N 3.29Å; Q605-A608 PolarHBondContact O-N 3.28Å; A608-A610 VanDerWaalsContact C-N 3.32Å; A608-A610 PolarHBondContact O-N 3.48Å; A608-G611 PolarHBondContact O-N 2.95Å; A608-A650 HydrophobicContact CB-CB 4.39Å; A608-H655 PolarHBondContact O-CD2 3.32Å; A608-V658 HydrophobicContact CB-CG1 4.23Å; A608-L662 HydrophobicContact CB-CD1 4.37Å
609	A	92.5	Very high	90.9	Very high	4 Å²	4	25.5 Å²	25.5	3%	0.033	13%	0.131	C	C	.	.	H	α-helix	trans	-66.3	-32.7	175.8	0	0	0	0	0	112.8	R218 Q605 G611 L649 H655	R218-A609 HydrophobicContact CB-CB 4.49Å; R218-A609 HydrophobicContact CG-CB 3.81Å; Q605-A609 WeakPolarHBondContact O-CB 3.13Å; Q605-A609 PolarHBondContact O-N 3.31Å; A609-G611 VanDerWaalsContact C-N 3.31Å; A609-L649 HydrophobicContact CB-CB 4.13Å; A609-L649 HydrophobicContact CB-CD1 4.48Å; A609-L649 HydrophobicContact CB-CD2 4.41Å; A609-H655 PolarHBondContact O-NE2 3.32Å
610	A	92.8	Very high	92.2	Very high	25 Å²	25	21.1 Å²	21.1	21%	0.207	12%	0.115	C	C	.	.	H	α-helix	trans	-80.1	-11.8	176.5	0	0	0	0	0	113.5	R218 L606 A607 A608 N612	R218-A610 HydrophobicContact CG-CB 4.17Å; L606-A610 WeakPolarHBondContact O-CB 3.47Å; L606-A610 PolarHBondContact O-N 2.93Å; L606-A610 VanDerWaalsContact O-N 3.08Å; A607-A610 PolarHBondContact O-N 3.24Å; A608-A610 VanDerWaalsContact C-N 3.32Å; A608-A610 PolarHBondContact O-N 3.48Å; A610-N612 VanDerWaalsContact C-N 3.26Å; A610-N612 PolarHBondContact O-N 3.16Å
611	G	94.3	Very high	93	Very high	24 Å²	24	25.8 Å²	25.8	25%	0.247	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.2	17	-177.4	0	0	0	0	0	114.3	A607 A608 A609 F613 H655	A607-G611 PolarHBondContact O-N 3.2Å; A607-G611 VanDerWaalsContact O-N 3.09Å; A608-G611 PolarHBondContact O-N 2.95Å; A609-G611 VanDerWaalsContact C-N 3.31Å; G611-F613 PolarHBondContact O-N 3.38Å; G611-H655 WeakPolarHBondContact CA-CD2 3.23Å; G611-H655 VanDerWaalsContact CA-CG 3.42Å; G611-H655 WeakPolarHBondContact CA-NE2 3.49Å; G611-H655 PolarHBondContact N-CD2 3.45Å; G611-H655 VanDerWaalsContact N-CD2 3.3Å; G611-H655 PolarHBondContact N-NE2 3.47Å
612	N	94.9	Very high	93.5	Very high	42 Å²	42	27.9 Å²	27.9	23%	0.225	14%	0.141	C	C	.	.			trans	-79.4	93.1	-178.4	-169.8	-24.7	0	0	0	110.3	A607 A610 E614 L615 V616	A607-N612 PolarHBondContact O-N 2.96Å; A607-N612 VanDerWaalsContact O-N 3.11Å; A610-N612 VanDerWaalsContact C-N 3.26Å; A610-N612 PolarHBondContact O-N 3.16Å; N612-E614 VanDerWaalsContact C-N 3.28Å; N612-E614 PolarHBondContact O-N 2.91Å; N612-E614 PolarHBondContact OD1-N 2.93Å; N612-L615 HydrophobicContact CB-CB 4.18Å; N612-L615 HydrophobicContact CB-CD1 4.25Å; N612-L615 HydrophobicContact CB-CG 4.4Å; N612-L615 VanDerWaalsContact ND2-CD1 3.32Å; N612-L615 WeakPolarHBondContact ND2-CD1 3.37Å; N612-L615 WeakPolarHBondContact ND2-CG 3.46Å; N612-L615 PolarHBondContact O-N 2.7Å; N612-L615 PolarHBondContact OD1-N 3.45Å; N612-V616 VanDerWaalsContact O-CG2 3.32Å; N612-V616 WeakPolarHBondContact O-CG2 3.46Å; N612-V616 PolarHBondContact O-N 3.3Å
613	F	95.6	Very high	93.4	Very high	101 Å²	101	29.9 Å²	29.9	44%	0.443	16%	0.161	S	C	.	.	H	α-helix	trans	-59.5	-35.1	-177.1	-177.5	-88.7	0	0	0	113.7	G611 S617 N657 V658 K661	G611-F613 PolarHBondContact O-N 3.38Å; F613-S617 WeakPolarHBondContact O-CB 3.23Å; F613-S617 PolarHBondContact O-N 2.86Å; F613-S617 PolarHBondContact O-OG 3.14Å; F613-N657 HydrophobicContact CD2-CB 4.47Å; F613-V658 HydrophobicContact CB-CG2 4.35Å; F613-K661 HydrophobicContact CD2-CB 4.39Å; F613-K661 HydrophobicContact CE2-CB 3.79Å; F613-K661 HydrophobicContact CE2-CD 4.23Å; F613-K661 HydrophobicContact CE2-CG 4.1Å; F613-K661 HydrophobicContact CZ-CB 4.49Å; F613-K661 HydrophobicContact CZ-CD 4.07Å; F613-K661 HydrophobicContact CZ-CG 4.41Å
614	E	96.1	Very high	93.2	Very high	122 Å²	122	29.9 Å²	29.9	57%	0.57	16%	0.161	S	C	*	.	H	α-helix	trans	-68.9	-49.5	-179.7	-173.8	173.9	-168.6	0	0	110.7	V575 N612 V616 S617 L618	V575-E614 HydrophobicContact CG1-CG 4.07Å; V575-E614 HydrophobicContact CG2-CG 4.37Å; N612-E614 VanDerWaalsContact C-N 3.28Å; N612-E614 PolarHBondContact O-N 2.91Å; N612-E614 PolarHBondContact OD1-N 2.93Å; E614-V616 VanDerWaalsContact C-N 3.34Å; E614-V616 PolarHBondContact O-N 2.76Å; E614-S617 PolarHBondContact O-N 3.33Å; E614-S617 VanDerWaalsContact O-N 3.14Å; E614-L618 WeakPolarHBondContact O-CB 3.37Å; E614-L618 PolarHBondContact O-N 3.23Å
615	L	95.8	Very high	92.9	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.6	-40.5	175.1	-73.8	-178.1	0	0	0	112.6	V570 V575 V578 A607 N612 S617 L618 L619	V570-L615 HydrophobicContact CG1-CD1 4.21Å; V575-L615 HydrophobicContact CB-CD2 4.25Å; V575-L615 HydrophobicContact CG1-CD2 4.33Å; V575-L615 HydrophobicContact CG2-CD2 3.84Å; V575-L615 HydrophobicContact CG2-CG 3.99Å; V578-L615 HydrophobicContact CB-CD2 3.96Å; V578-L615 HydrophobicContact CG1-CD2 3.94Å; V578-L615 HydrophobicContact CG2-CD2 3.9Å; A607-L615 HydrophobicContact CB-CB 3.84Å; N612-L615 HydrophobicContact CB-CB 4.18Å; N612-L615 HydrophobicContact CB-CD1 4.25Å; N612-L615 HydrophobicContact CB-CG 4.4Å; N612-L615 VanDerWaalsContact ND2-CD1 3.32Å; N612-L615 WeakPolarHBondContact ND2-CD1 3.37Å; N612-L615 WeakPolarHBondContact ND2-CG 3.46Å; N612-L615 PolarHBondContact O-N 2.7Å; N612-L615 PolarHBondContact OD1-N 3.45Å; L615-S617 VanDerWaalsContact C-N 3.31Å; L615-S617 PolarHBondContact O-N 3.3Å; L615-L618 PolarHBondContact O-N 3.01Å; L615-L619 WeakPolarHBondContact O-CB 3.39Å; L615-L619 VanDerWaalsContact O-CG 3.26Å; L615-L619 WeakPolarHBondContact O-CG 3.32Å; L615-L619 PolarHBondContact O-N 3.19Å
616	V	96.3	Very high	92.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.5	-42.3	175.3	169.4	0	0	0	0	110.7	L604 A607 N612 E614 L620 V658 K661 L662	L604-V616 HydrophobicContact CD1-CB 4.47Å; L604-V616 HydrophobicContact CD1-CG1 4.14Å; L604-V616 HydrophobicContact CD1-CG2 4.39Å; A607-V616 HydrophobicContact CB-CG2 3.74Å; N612-V616 VanDerWaalsContact O-CG2 3.32Å; N612-V616 WeakPolarHBondContact O-CG2 3.46Å; N612-V616 PolarHBondContact O-N 3.3Å; E614-V616 VanDerWaalsContact C-N 3.34Å; E614-V616 PolarHBondContact O-N 2.76Å; V616-L620 HydrophobicContact CG1-CD1 3.72Å; V616-L620 HydrophobicContact CG1-CG 4.37Å; V616-L620 WeakPolarHBondContact O-CB 3.3Å; V616-L620 WeakPolarHBondContact O-CD1 3.19Å; V616-L620 WeakPolarHBondContact O-CG 3.45Å; V616-L620 PolarHBondContact O-N 3.45Å; V616-L620 VanDerWaalsContact O-N 3.08Å; V616-V658 HydrophobicContact CG1-CG1 4.26Å; V616-V658 HydrophobicContact CG2-CG1 3.88Å; V616-K661 HydrophobicContact CG1-CG 4.23Å; V616-L662 HydrophobicContact CG1-CD2 4Å; V616-L662 HydrophobicContact CG1-CG 4.35Å
617	S	95.1	Very high	92.2	Very high	12 Å²	12	35.3 Å²	35.3	8%	0.084	19%	0.19	C	C	.	.	H	α-helix	trans	-64.5	-47.4	177.4	-61.5	0	0	0	0	111.6	F613 E614 L615 L620 E621 K661	F613-S617 WeakPolarHBondContact O-CB 3.23Å; F613-S617 PolarHBondContact O-N 2.86Å; F613-S617 PolarHBondContact O-OG 3.14Å; E614-S617 PolarHBondContact O-N 3.33Å; E614-S617 VanDerWaalsContact O-N 3.14Å; L615-S617 VanDerWaalsContact C-N 3.31Å; L615-S617 PolarHBondContact O-N 3.3Å; S617-L620 PolarHBondContact O-N 3.01Å; S617-E621 WeakPolarHBondContact O-CB 3.38Å; S617-E621 VanDerWaalsContact O-CG 3.26Å; S617-E621 WeakPolarHBondContact O-CG 3.39Å; S617-E621 PolarHBondContact O-N 3.46Å; S617-K661 WeakPolarHBondContact OG-CE 2.94Å; S617-K661 PolarHBondContact OG-NZ 3.37Å
618	L	94.9	Very high	91.4	Very high	19 Å²	19	36.6 Å²	36.6	10%	0.099	20%	0.196	C	C	.	.	H	α-helix	trans	-59.8	-47.8	178.8	179.7	64.2	0	0	0	111.8	V575 V578 Q579 L582 E614 L615 E621 R622	V575-L618 HydrophobicContact CG1-CD2 4.5Å; V578-L618 HydrophobicContact CB-CD2 4.45Å; V578-L618 HydrophobicContact CG1-CD2 3.85Å; Q579-L618 HydrophobicContact CB-CD2 4.22Å; L582-L618 HydrophobicContact CD1-CD2 4.18Å; L582-L618 HydrophobicContact CD1-CG 4.09Å; E614-L618 WeakPolarHBondContact O-CB 3.37Å; E614-L618 PolarHBondContact O-N 3.23Å; L615-L618 PolarHBondContact O-N 3.01Å; L618-E621 PolarHBondContact O-N 3.49Å; L618-R622 WeakPolarHBondContact O-CG 3.34Å; L618-R622 PolarHBondContact O-N 3.45Å; L618-R622 VanDerWaalsContact O-N 3.14Å
619	L	94.5	Very high	90.4	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.2	-41.7	-179.4	-70.8	168.4	0	0	0	111.9	V570 L582 V588 P603 L604 A607 L615 E621 R622 G623 A624	V570-L619 HydrophobicContact CG2-CD1 4.4Å; L582-L619 HydrophobicContact CD1-CD2 4.05Å; V588-L619 HydrophobicContact CG1-CD2 4.31Å; P603-L619 HydrophobicContact CB-CD1 3.96Å; P603-L619 HydrophobicContact CB-CD2 4.06Å; L604-L619 HydrophobicContact CB-CD1 4.46Å; L604-L619 HydrophobicContact CD1-CB 4.16Å; A607-L619 HydrophobicContact CB-CD1 4.06Å; L615-L619 WeakPolarHBondContact O-CB 3.39Å; L615-L619 VanDerWaalsContact O-CG 3.26Å; L615-L619 WeakPolarHBondContact O-CG 3.32Å; L615-L619 PolarHBondContact O-N 3.19Å; L619-E621 VanDerWaalsContact C-N 3.35Å; L619-E621 PolarHBondContact O-N 3.15Å; L619-R622 CarbonylContact O-C 3.55Å; L619-R622 PolarHBondContact O-N 3.45Å; L619-G623 PolarHBondContact O-N 3.04Å; L619-A624 HydrophobicContact CB-CB 4.03Å; L619-A624 VanDerWaalsContact O-CB 3.22Å; L619-A624 WeakPolarHBondContact O-CB 3.34Å; L619-A624 PolarHBondContact O-N 3.37Å
620	L	92.7	Very high	89.3	Confident	8 Å²	8	37.4 Å²	37.4	4%	0.042	20%	0.203	C	C	.	.	H	α-helix	trans	-64.5	-37.9	175.3	-69.5	169.4	0	0	0	112.1	L604 V616 S617 R622 G623 K661 L662 H665	L604-L620 HydrophobicContact CD1-CD2 4.27Å; L604-L620 HydrophobicContact CD1-CG 4.15Å; L604-L620 HydrophobicContact CD2-CD2 3.89Å; V616-L620 HydrophobicContact CG1-CD1 3.72Å; V616-L620 HydrophobicContact CG1-CG 4.37Å; V616-L620 WeakPolarHBondContact O-CB 3.3Å; V616-L620 WeakPolarHBondContact O-CD1 3.19Å; V616-L620 WeakPolarHBondContact O-CG 3.45Å; V616-L620 PolarHBondContact O-N 3.45Å; V616-L620 VanDerWaalsContact O-N 3.08Å; S617-L620 PolarHBondContact O-N 3.01Å; L620-R622 PolarHBondContact O-N 3.37Å; L620-G623 PolarHBondContact O-N 2.91Å; L620-G623 VanDerWaalsContact O-N 3.12Å; L620-K661 HydrophobicContact CD1-CG 4.06Å; L620-L662 HydrophobicContact CD1-CD2 4.2Å; L620-L662 HydrophobicContact CD2-CD2 4.33Å; L620-H665 HydrophobicContact CB-CB 4.48Å; L620-H665 HydrophobicContact CD1-CB 4.06Å; L620-H665 HydrophobicContact CD2-CB 4.33Å
621	E	91.4	Very high	87.7	Confident	127 Å²	127	39.1 Å²	39.1	59%	0.593	21%	0.207	S	C	*	.	H	α-helix	trans	-65.8	-25.7	175.6	-75.5	167.1	-161	0	0	112.9	S617 L618 L619	S617-E621 WeakPolarHBondContact O-CB 3.38Å; S617-E621 VanDerWaalsContact O-CG 3.26Å; S617-E621 WeakPolarHBondContact O-CG 3.39Å; S617-E621 PolarHBondContact O-N 3.46Å; L618-E621 PolarHBondContact O-N 3.49Å; L619-E621 VanDerWaalsContact C-N 3.35Å; L619-E621 PolarHBondContact O-N 3.15Å
622	R	90.9	Very high	85.7	Confident	90 Å²	90	39.9 Å²	39.9	34%	0.34	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	5.7	174	-57.1	-57.5	176.9	92.5	-0.4	113.6	L582 D583 V588 L618 L619 L620	L582-R622 HydrophobicContact CB-CG 4.43Å; L582-R622 VanDerWaalsContact CB-NH1 3.31Å; L582-R622 HydrophobicContact CD1-CG 4.04Å; D583-R622 IonicContact OD1-CZ 3.54Å; D583-R622 IonicContact OD1-NH1 3.07Å; D583-R622 PolarHBondContact OD1-NH1 3Å; D583-R622 IonicContact OD1-NH2 3.98Å; D583-R622 PolarHBondContact OD1-NH2 3.1Å; V588-R622 HydrophobicContact CG1-CB 4.47Å; V588-R622 HydrophobicContact CG2-CB 3.9Å; L618-R622 WeakPolarHBondContact O-CG 3.34Å; L618-R622 PolarHBondContact O-N 3.45Å; L618-R622 VanDerWaalsContact O-N 3.14Å; L619-R622 CarbonylContact O-C 3.55Å; L619-R622 PolarHBondContact O-N 3.45Å; L620-R622 PolarHBondContact O-N 3.37Å
623	G	87	Confident	83.3	Confident	44 Å²	44	46 Å²	46	45%	0.454	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	92	26.3	173.1	0	0	0	0	0	115.6	L619 L620	L619-G623 PolarHBondContact O-N 3.04Å; L620-G623 PolarHBondContact O-N 2.91Å; L620-G623 VanDerWaalsContact O-N 3.12Å
624	A	88.2	Confident	80.8	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.215	C	C	.	.			trans	-68.9	132.1	174.3	0	0	0	0	0	112.2	V588 E589 L604 L619 P626	V588-A624 HydrophobicContact CG1-CB 3.55Å; E589-A624 VanDerWaalsContact OE1-CA 3.23Å; E589-A624 WeakPolarHBondContact OE1-CA 3.5Å; L604-A624 HydrophobicContact CB-CB 4.11Å; L604-A624 HydrophobicContact CD2-CB 3.87Å; L604-A624 HydrophobicContact CG-CB 4.41Å; L619-A624 HydrophobicContact CB-CB 4.03Å; L619-A624 VanDerWaalsContact O-CB 3.22Å; L619-A624 WeakPolarHBondContact O-CB 3.34Å; L619-A624 PolarHBondContact O-N 3.37Å; A624-P626 WeakPolarHBondContact O-CD 3.48Å
625	D	85.1	Confident	78.2	Confident	65 Å²	65	39.9 Å²	39.9	35%	0.348	22%	0.219	S	C	.	.			trans	-87.4	115.7	179.6	-178.2	5	0	0	0	111.9	E589 M627 I628	E589-D625 PolarHBondContact OE1-N 3.24Å; D625-M627 PolarHBondContact O-N 3.12Å; D625-M627 VanDerWaalsContact OD1-CB 3.27Å; D625-M627 WeakPolarHBondContact OD1-CB 3.48Å; D625-M627 PolarHBondContact OD1-N 3.47Å; D625-I628 HydrophobicContact CB-CD1 3.78Å; D625-I628 HydrophobicContact CB-CG1 3.98Å; D625-I628 PolarHBondContact O-N 3.24Å
626	P	86	Confident	75.7	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.032	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-12.5	178	31.6	-38.1	0	0	0	114.4	L604 A624 F647 L662	L604-P626 HydrophobicContact CD2-CB 3.99Å; A624-P626 WeakPolarHBondContact O-CD 3.48Å; P626-F647 HydrophobicContact CB-CD2 4.5Å; P626-F647 HydrophobicContact CB-CE2 3.73Å; P626-F647 HydrophobicContact CB-CZ 3.93Å; P626-F647 HydrophobicContact CG-CE2 4.08Å; P626-F647 HydrophobicContact CG-CZ 4.08Å; P626-L662 HydrophobicContact CB-CD2 3.98Å
627	M	82.1	Confident	72.8	Confident	52 Å²	52	48.9 Å²	48.9	26%	0.256	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-12.8	-179.4	-66.9	-59.9	-47	0	0	113.6	D625 G629 F647 A706 K707 A710	D625-M627 PolarHBondContact O-N 3.12Å; D625-M627 VanDerWaalsContact OD1-CB 3.27Å; D625-M627 WeakPolarHBondContact OD1-CB 3.48Å; D625-M627 PolarHBondContact OD1-N 3.47Å; M627-G629 PolarHBondContact O-N 3.37Å; M627-F647 HydrophobicContact SD-CD2 4.28Å; M627-F647 HydrophobicContact SD-CE2 3.68Å; M627-A706 VanDerWaalsContact CE-C 3.5Å; M627-A706 HydrophobicContact CE-CB 4.08Å; M627-K707 HydrophobicContact CE-CB 4.34Å; M627-K707 HydrophobicContact SD-CB 4.19Å; M627-K707 HydrophobicContact SD-CG 4.36Å; M627-A710 HydrophobicContact CE-CB 3.8Å; M627-A710 HydrophobicContact SD-CB 4.46Å
628	I	79.4	Confident	70	Confident	28 Å²	28	54.2 Å²	54.2	14%	0.144	31%	0.308	C	S	.	.			trans	-63.9	126	174.6	-65.9	168.1	0	0	0	108.7	E589 L592 T602 Q605 D625	E589-I628 HydrophobicContact CG-CD1 3.99Å; E589-I628 VanDerWaalsContact OE2-CD1 3.25Å; E589-I628 WeakPolarHBondContact OE2-CD1 3.35Å; L592-I628 HydrophobicContact CD2-CD1 3.84Å; L592-I628 HydrophobicContact CD2-CG1 4.41Å; L592-I628 HydrophobicContact CD2-CG2 3.74Å; T602-I628 HydrophobicContact CG2-CB 4.45Å; T602-I628 HydrophobicContact CG2-CG2 3.71Å; Q605-I628 PolarHBondContact NE2-O 2.85Å; D625-I628 HydrophobicContact CB-CD1 3.78Å; D625-I628 HydrophobicContact CB-CG1 3.98Å; D625-I628 PolarHBondContact O-N 3.24Å
629	G	72.4	Confident	67.3	Low	10 Å²	10	57 Å²	57	10%	0.103	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	154.7	176.2	0	0	0	0	0	111.5	N598 M627	N598-G629 PolarHBondContact ND2-O 3.46Å; M627-G629 PolarHBondContact O-N 3.37Å
630	T	69.1	Low	64.7	Low	11 Å²	11	60.2 Å²	60.2	7%	0.067	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	136.4	179.1	-23	0	0	0	0	110.7	N598 T600 Q605 M644	N598-T630 WeakPolarHBondContact O-CG2 3.34Å; T600-T630 VanDerWaalsContact O-CG2 3.23Å; T600-T630 WeakPolarHBondContact O-CG2 3.42Å; Q605-T630 PolarHBondContact NE2-OG1 3.33Å; Q605-T630 PolarHBondContact OE1-OG1 3.36Å; T630-M644 PolarHBondContact N-O 3.12Å
631	M	60.8	Low	62.3	Low	61 Å²	61	60.7 Å²	60.7	30%	0.3	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-89.6	124.6	170.5	-62.7	-150.1	166.2	0	0	110.9	N598 Y599 P640 D643	N598-M631 PolarHBondContact O-N 3.09Å; Y599-M631 HydrophobicContact CD1-CB 4.5Å; Y599-M631 WeakPolarHBondContact CD1-O 3.32Å; Y599-M631 HydrophobicContact CE1-CB 4.5Å; M631-P640 HydrophobicContact CE-CB 3.74Å; M631-P640 HydrophobicContact CE-CG 4.4Å; M631-P640 HydrophobicContact SD-CB 4.04Å; M631-D643 WeakPolarHBondContact CE-OD1 3.2Å
632	C	51.1	Low	60.4	Low	41 Å²	41	55.5 Å²	55.5	28%	0.277	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-78.9	122.4	176.3	-72.5	0	0	0	0	111.7	N634	C632-N634 PolarHBondContact O-N 3.36Å; C632-N634 VanDerWaalsContact O-N 3.16Å
633	R	44.2	Very low	59	Low	170 Å²	170	54.6 Å²	54.6	64%	0.642	33%	0.331	S	S	*	.			trans	-72.9	103.3	174	-174	-179.5	177.5	179.1	1.3	111.4	Y599	Y599-R633 HydrophobicContact CD1-CB 4.16Å; Y599-R633 HydrophobicContact CE1-CB 4.38Å
634	N	43	Very low	58.3	Low	30 Å²	30	54 Å²	54	16%	0.16	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-104.9	120.4	160.9	-78.7	-17.5	0	0	0	109.3	N181 C632 I636 S637 L641	N181-N634 PolarHBondContact ND2-ND2 3.3Å; N181-N634 PolarHBondContact OD1-ND2 2.84Å; C632-N634 PolarHBondContact O-N 3.36Å; C632-N634 VanDerWaalsContact O-N 3.16Å; N634-I636 PolarHBondContact O-N 3.27Å; N634-S637 PolarHBondContact O-N 2.92Å; N634-L641 HydrophobicContact CB-CD1 4.39Å; N634-L641 VanDerWaalsContact ND2-CD1 3.32Å; N634-L641 WeakPolarHBondContact ND2-CD1 3.35Å
635	G	43.3	Very low	58.3	Low	64 Å²	64	54.3 Å²	54.3	66%	0.66	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	14.8	-175	0	0	0	0	0	116.9
636	I	41.6	Very low	58.5	Low	137 Å²	137	51.2 Å²	51.2	70%	0.703	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.6	-14.9	-175.4	-36.8	177.7	0	0	0	111.5	N634	N634-I636 PolarHBondContact O-N 3.27Å
637	S	36.4	Very low	58.8	Low	52 Å²	52	51 Å²	51	36%	0.364	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-149.2	125.4	178.6	-170.6	0	0	0	0	111.5	N634 T639	N634-S637 PolarHBondContact O-N 2.92Å; S637-T639 PolarHBondContact O-N 3.33Å; S637-T639 PolarHBondContact OG-N 3.23Å; S637-T639 PolarHBondContact OG-OG1 2.99Å
638	S	36.7	Very low	59.2	Low	125 Å²	125	48.5 Å²	48.5	87%	0.874	29%	0.288	S	S	*	.			trans	-80.9	11.1	169.6	55.9	0	0	0	0	112.9
639	T	37.6	Very low	59.7	Low	76 Å²	76	48 Å²	48	47%	0.466	29%	0.286	S	S	.	.	S	Bend	trans	-77.5	127.1	175.6	56	0	0	0	0	109.8	S637 L641	S637-T639 PolarHBondContact O-N 3.33Å; S637-T639 PolarHBondContact OG-N 3.23Å; S637-T639 PolarHBondContact OG-OG1 2.99Å; T639-L641 PolarHBondContact O-N 3.37Å
640	P	39.3	Very low	60.8	Low	68 Å²	68	47.5 Å²	47.5	44%	0.442	28%	0.281	S	S	.	.			trans	-59.6	107.5	-178.8	18.8	-28.3	0	0	0	110.1	K188 M631 G642	K188-P640 PolarHBondContact NZ-O 3.39Å; M631-P640 HydrophobicContact CE-CB 3.74Å; M631-P640 HydrophobicContact CE-CG 4.4Å; M631-P640 HydrophobicContact SD-CB 4.04Å; P640-G642 PolarHBondContact O-N 2.93Å
641	L	43.8	Very low	62	Low	19 Å²	19	47 Å²	47	10%	0.099	28%	0.277	C	S	.	.			trans	-76.4	97.4	162.6	-83.2	117.7	0	0	0	106.4	N634 T639	N634-L641 HydrophobicContact CB-CD1 4.39Å; N634-L641 VanDerWaalsContact ND2-CD1 3.32Å; N634-L641 WeakPolarHBondContact ND2-CD1 3.35Å; T639-L641 PolarHBondContact O-N 3.37Å
642	G	51	Low	63.5	Low	18 Å²	18	44.5 Å²	44.5	19%	0.186	27%	0.266	C	S	.	.			trans	43.7	102.9	163.4	0	0	0	0	0	114.4	P640 M644 E713	P640-G642 PolarHBondContact O-N 2.93Å; G642-M644 PolarHBondContact O-N 3.19Å; G642-E713 VanDerWaalsContact CA-OE1 3.28Å; G642-E713 WeakPolarHBondContact CA-OE1 3.24Å
643	D	60.2	Low	65.5	Low	70 Å²	70	42.9 Å²	42.9	37%	0.374	26%	0.255	S	S	.	.			trans	-65.2	78.7	175.7	-62.2	-24.3	0	0	0	109.1	M631 N645	M631-D643 WeakPolarHBondContact CE-OD1 3.2Å; D643-N645 PolarHBondContact O-N 3.46Å; D643-N645 PolarHBondContact O-ND2 3.23Å
644	M	74.1	Confident	67.9	Low	33 Å²	33	36 Å²	36	16%	0.163	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	108.5	-179.3	-72.6	-59.8	145.6	0	0	107	Q605 T630 G642 S648 L649 E713 H717	Q605-M644 PolarHBondContact NE2-O 3.28Å; T630-M644 PolarHBondContact N-O 3.12Å; G642-M644 PolarHBondContact O-N 3.19Å; M644-S648 WeakPolarHBondContact CA-OG 3.43Å; M644-S648 PolarHBondContact SD-OG 3Å; M644-S648 VanDerWaalsContact SD-OG 3.35Å; M644-L649 HydrophobicContact CB-CD2 4.49Å; M644-L649 HydrophobicContact CB-CG 4.48Å; M644-E713 HydrophobicContact CE-CG 4.1Å; M644-E713 WeakPolarHBondContact CE-OE1 3.17Å; M644-E713 HydrophobicContact SD-CG 4.28Å; M644-H717 WeakPolarHBondContact CE-NE2 3.37Å
645	N	86.6	Confident	70.4	Confident	5 Å²	5	37 Å²	37	3%	0.027	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	175.9	-178.7	52.4	65.3	0	0	0	109.4	D643 F647 S648 L649 A710	D643-N645 PolarHBondContact O-N 3.46Å; D643-N645 PolarHBondContact O-ND2 3.23Å; N645-F647 PolarHBondContact O-N 2.69Å; N645-F647 WeakPolarHBondContact OD1-CA 3.48Å; N645-F647 VanDerWaalsContact OD1-CB 3.27Å; N645-F647 WeakPolarHBondContact OD1-CB 3.23Å; N645-F647 PolarHBondContact OD1-N 2.81Å; N645-F647 VanDerWaalsContact OD1-N 3.12Å; N645-S648 PolarHBondContact N-OG 2.82Å; N645-S648 PolarHBondContact O-N 2.91Å; N645-S648 PolarHBondContact O-OG 3.22Å; N645-S648 VanDerWaalsContact O-OG 3.05Å; N645-S648 PolarHBondContact OD1-N 3.2Å; N645-L649 WeakPolarHBondContact O-CG 3.45Å; N645-L649 PolarHBondContact O-N 3.25Å; N645-A710 WeakPolarHBondContact ND2-CA 3.44Å; N645-A710 WeakPolarHBondContact ND2-CB 3.18Å
646	S	90.4	Very high	72.9	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.1	-31.6	-179.2	-61.1	0	0	0	0	112.7	Q605 A650 L662	Q605-S646 WeakPolarHBondContact CG-OG 3.29Å; S646-A650 WeakPolarHBondContact O-CB 3.41Å; S646-A650 PolarHBondContact O-N 3.24Å; S646-L662 WeakPolarHBondContact O-CD1 3.44Å
647	F	91.4	Very high	75.5	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.1	-47.1	175.9	-61.4	-80.7	0	0	0	112.1	P626 M627 N645 L649 A650 A651 F659 L662 L663 L711 A714	P626-F647 HydrophobicContact CB-CD2 4.5Å; P626-F647 HydrophobicContact CB-CE2 3.73Å; P626-F647 HydrophobicContact CB-CZ 3.93Å; P626-F647 HydrophobicContact CG-CE2 4.08Å; P626-F647 HydrophobicContact CG-CZ 4.08Å; M627-F647 HydrophobicContact SD-CD2 4.28Å; M627-F647 HydrophobicContact SD-CE2 3.68Å; N645-F647 PolarHBondContact O-N 2.69Å; N645-F647 WeakPolarHBondContact OD1-CA 3.48Å; N645-F647 VanDerWaalsContact OD1-CB 3.27Å; N645-F647 WeakPolarHBondContact OD1-CB 3.23Å; N645-F647 PolarHBondContact OD1-N 2.81Å; N645-F647 VanDerWaalsContact OD1-N 3.12Å; F647-L649 VanDerWaalsContact C-N 3.34Å; F647-A650 PolarHBondContact O-N 3.37Å; F647-A651 VanDerWaalsContact O-CB 3.23Å; F647-A651 WeakPolarHBondContact O-CB 3.25Å; F647-A651 PolarHBondContact O-N 2.69Å; F647-F659 HydrophobicContact CB-CD2 4.47Å; F647-F659 HydrophobicContact CB-CE2 3.91Å; F647-F659 HydrophobicContact CD1-CD2 4.38Å; F647-F659 AromaticContact CD1-CE2 3.98Å; F647-F659 HydrophobicContact CD1-CE2 3.98Å; F647-F659 HydrophobicContact CD1-CZ 4.46Å; F647-F659 HydrophobicContact CG-CE2 4.46Å; F647-L662 HydrophobicContact CD1-CB 3.96Å; F647-L662 HydrophobicContact CD1-CD1 4.44Å; F647-L662 HydrophobicContact CE1-CB 3.55Å; F647-L662 HydrophobicContact CZ-CB 4.17Å; F647-L663 HydrophobicContact CD1-CD2 4.33Å; F647-L663 HydrophobicContact CE1-CD2 3.82Å; F647-L663 HydrophobicContact CE1-CG 4.06Å; F647-L711 HydrophobicContact CD1-CD2 4.34Å; F647-A714 HydrophobicContact CB-CB 4.38Å
648	S	90.1	Very high	78.3	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-67.7	-35.9	-178.8	66.6	0	0	0	0	111.9	M644 N645 A651 S652	M644-S648 WeakPolarHBondContact CA-OG 3.43Å; M644-S648 PolarHBondContact SD-OG 3Å; M644-S648 VanDerWaalsContact SD-OG 3.35Å; N645-S648 PolarHBondContact N-OG 2.82Å; N645-S648 PolarHBondContact O-N 2.91Å; N645-S648 PolarHBondContact O-OG 3.22Å; N645-S648 VanDerWaalsContact O-OG 3.05Å; N645-S648 PolarHBondContact OD1-N 3.2Å; S648-A651 PolarHBondContact O-N 3.25Å; S648-S652 WeakPolarHBondContact O-CB 3.43Å; S648-S652 PolarHBondContact O-N 3.3Å; S648-S652 PolarHBondContact O-OG 3.35Å
649	L	91.3	Very high	81.1	Confident	17 Å²	17	28 Å²	28	9%	0.089	16%	0.159	C	C	.	.	H	α-helix	trans	-67.5	-45.2	174.4	-70.3	171.7	0	0	0	112.8	Q605 A609 M644 N645 F647 A651 S652 H653	Q605-L649 HydrophobicContact CB-CD1 3.51Å; Q605-L649 HydrophobicContact CG-CD1 3.82Å; A609-L649 HydrophobicContact CB-CB 4.13Å; A609-L649 HydrophobicContact CB-CD1 4.48Å; A609-L649 HydrophobicContact CB-CD2 4.41Å; M644-L649 HydrophobicContact CB-CD2 4.49Å; M644-L649 HydrophobicContact CB-CG 4.48Å; N645-L649 WeakPolarHBondContact O-CG 3.45Å; N645-L649 PolarHBondContact O-N 3.25Å; F647-L649 VanDerWaalsContact C-N 3.34Å; L649-A651 VanDerWaalsContact C-N 3.3Å; L649-A651 PolarHBondContact O-N 3.15Å; L649-S652 PolarHBondContact O-N 3.13Å; L649-S652 PolarHBondContact O-OG 3.34Å; L649-H653 PolarHBondContact O-CD2 3.04Å; L649-H653 PolarHBondContact O-N 3.08Å
650	A	94.4	Very high	83.7	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.2	-38.8	175.3	0	0	0	0	0	111.8	A608 S646 F647 G654 H655 V658 F659 L662	A608-A650 HydrophobicContact CB-CB 4.39Å; S646-A650 WeakPolarHBondContact O-CB 3.41Å; S646-A650 PolarHBondContact O-N 3.24Å; F647-A650 PolarHBondContact O-N 3.37Å; A650-G654 PolarHBondContact O-N 3.46Å; A650-H655 PolarHBondContact O-N 3.33Å; A650-V658 HydrophobicContact CB-CG1 3.96Å; A650-F659 HydrophobicContact CB-CB 4.25Å; A650-F659 HydrophobicContact CB-CD2 4.4Å; A650-L662 HydrophobicContact CB-CD1 4.07Å
651	A	94.6	Very high	86.3	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-71.7	-40	179.2	0	0	0	0	0	112.9	F647 S648 L649 H653 G654 F659 A714 I726	F647-A651 VanDerWaalsContact O-CB 3.23Å; F647-A651 WeakPolarHBondContact O-CB 3.25Å; F647-A651 PolarHBondContact O-N 2.69Å; S648-A651 PolarHBondContact O-N 3.25Å; L649-A651 VanDerWaalsContact C-N 3.3Å; L649-A651 PolarHBondContact O-N 3.15Å; A651-H653 VanDerWaalsContact C-N 3.28Å; A651-H653 PolarHBondContact O-N 3.19Å; A651-G654 PolarHBondContact O-N 3.46Å; A651-F659 HydrophobicContact CB-CD2 4.2Å; A651-F659 HydrophobicContact CB-CE2 4.27Å; A651-A714 HydrophobicContact CB-CB 3.79Å; A651-I726 HydrophobicContact CB-CG2 3.9Å
652	S	92.4	Very high	88.6	Confident	9 Å²	9	26.8 Å²	26.8	6%	0.063	14%	0.136	C	C	.	.	H	α-helix	trans	-65.2	-33.2	178.7	71.7	0	0	0	0	112.2	F207 S648 L649 H721 H723	F207-S652 VanDerWaalsContact CE1-O 3.24Å; F207-S652 WeakPolarHBondContact CE1-O 3.25Å; S648-S652 WeakPolarHBondContact O-CB 3.43Å; S648-S652 PolarHBondContact O-N 3.3Å; S648-S652 PolarHBondContact O-OG 3.35Å; L649-S652 PolarHBondContact O-N 3.13Å; L649-S652 PolarHBondContact O-OG 3.34Å; S652-H721 PolarHBondContact O-ND1 3.42Å; S652-H723 PolarHBondContact O-CD2 3.31Å; S652-H723 PolarHBondContact O-NE2 3.37Å
653	H	93.6	Very high	90.3	Very high	8 Å²	8	27.2 Å²	27.2	4%	0.037	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-4.3	177.8	-80.4	-79.9	0	0	0	114.7	F207 I219 L649 A651 H655	F207-H653 AromaticContact CZ-CE1 3.8Å; F207-H653 AromaticContact CZ-NE2 3.8Å; I219-H653 PolarHBondContact N-CE1 3.24Å; I219-H653 PolarHBondContact O-NE2 3.22Å; L649-H653 PolarHBondContact O-CD2 3.04Å; L649-H653 PolarHBondContact O-N 3.08Å; A651-H653 VanDerWaalsContact C-N 3.28Å; A651-H653 PolarHBondContact O-N 3.19Å; H653-H655 VanDerWaalsContact CB-CD2 3.43Å; H653-H655 WeakPolarHBondContact CB-CD2 3.5Å
654	G	94.7	Very high	91.6	Very high	24 Å²	24	26.4 Å²	26.4	25%	0.247	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.5	15.4	178.3	0	0	0	0	0	115.3	A650 A651 R656 H723	A650-G654 PolarHBondContact O-N 3.46Å; A651-G654 PolarHBondContact O-N 3.46Å; G654-R656 VanDerWaalsContact C-N 3.29Å; G654-R656 PolarHBondContact O-N 2.8Å; G654-H723 VanDerWaalsContact CA-CE1 3.41Å; G654-H723 WeakPolarHBondContact CA-CE1 3.21Å; G654-H723 VanDerWaalsContact CA-CG 3.45Å; G654-H723 VanDerWaalsContact CA-ND1 3.3Å; G654-H723 WeakPolarHBondContact CA-ND1 3.46Å; G654-H723 PolarHBondContact N-NE2 3.28Å
655	H	95.6	Very high	91.5	Very high	51 Å²	51	26.4 Å²	26.4	24%	0.236	13%	0.133	C	C	.	.			trans	-80.8	70.2	-178.7	-60.9	-47.5	0	0	0	112.2	A608 A609 G611 A650 H653 N657 V658 F659	A608-H655 PolarHBondContact O-CD2 3.32Å; A609-H655 PolarHBondContact O-NE2 3.32Å; G611-H655 WeakPolarHBondContact CA-CD2 3.23Å; G611-H655 VanDerWaalsContact CA-CG 3.42Å; G611-H655 WeakPolarHBondContact CA-NE2 3.49Å; G611-H655 PolarHBondContact N-CD2 3.45Å; G611-H655 VanDerWaalsContact N-CD2 3.3Å; G611-H655 PolarHBondContact N-NE2 3.47Å; A650-H655 PolarHBondContact O-N 3.33Å; H653-H655 VanDerWaalsContact CB-CD2 3.43Å; H653-H655 WeakPolarHBondContact CB-CD2 3.5Å; H655-N657 VanDerWaalsContact C-N 3.3Å; H655-N657 PolarHBondContact O-N 3.42Å; H655-V658 HydrophobicContact CB-CB 3.99Å; H655-V658 HydrophobicContact CB-CG2 4.24Å; H655-V658 PolarHBondContact O-N 3.07Å; H655-F659 WeakPolarHBondContact O-CB 3.44Å; H655-F659 PolarHBondContact O-N 2.74Å
656	R	95.3	Very high	90.3	Very high	78 Å²	78	26.9 Å²	26.9	29%	0.294	14%	0.137	S	C	.	.	H	α-helix	trans	-55.6	-38.4	-176.2	-170.5	177.1	-173.5	-161.4	7.6	114.1	G654 F659 R660 I726 D729	G654-R656 VanDerWaalsContact C-N 3.29Å; G654-R656 PolarHBondContact O-N 2.8Å; R656-F659 PolarHBondContact O-N 2.81Å; R656-R660 VanDerWaalsContact NE-CZ 3.29Å; R656-R660 WeakPolarHBondContact O-CG 3.34Å; R656-R660 PolarHBondContact O-N 2.9Å; R656-I726 HydrophobicContact CB-CD1 4.09Å; R656-I726 HydrophobicContact CB-CG1 3.82Å; R656-I726 HydrophobicContact CG-CG1 4Å; R656-D729 IonicContact CZ-OD1 3.63Å; R656-D729 IonicContact CZ-OD2 2.84Å; R656-D729 IonicContact NE-OD1 3.52Å; R656-D729 IonicContact NE-OD2 2.97Å; R656-D729 PolarHBondContact NE-OD2 2.82Å; R656-D729 IonicContact NH2-OD1 3.89Å; R656-D729 PolarHBondContact NH2-OD1 3.49Å; R656-D729 IonicContact NH2-OD2 2.83Å; R656-D729 PolarHBondContact NH2-OD2 3.46Å
657	N	95.4	Very high	88.6	Confident	110 Å²	110	34.1 Å²	34.1	59%	0.588	17%	0.171	S	C	*	.	H	α-helix	trans	-69	-42.2	-179.7	-65.7	-14.1	0	0	0	111.9	F613 H655 R660 K661	F613-N657 HydrophobicContact CD2-CB 4.47Å; H655-N657 VanDerWaalsContact C-N 3.3Å; H655-N657 PolarHBondContact O-N 3.42Å; N657-R660 PolarHBondContact O-N 2.9Å; N657-K661 PolarHBondContact O-N 2.95Å
658	V	95.8	Very high	86.7	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.018	20%	0.204	C	C	.	.	H	α-helix	trans	-63.1	-46.1	173.6	169.1	0	0	0	0	110.3	A608 F613 V616 A650 H655 R660 K661 L662	A608-V658 HydrophobicContact CB-CG1 4.23Å; F613-V658 HydrophobicContact CB-CG2 4.35Å; V616-V658 HydrophobicContact CG1-CG1 4.26Å; V616-V658 HydrophobicContact CG2-CG1 3.88Å; A650-V658 HydrophobicContact CB-CG1 3.96Å; H655-V658 HydrophobicContact CB-CB 3.99Å; H655-V658 HydrophobicContact CB-CG2 4.24Å; H655-V658 PolarHBondContact O-N 3.07Å; V658-R660 VanDerWaalsContact C-N 3.3Å; V658-R660 PolarHBondContact O-N 3.12Å; V658-K661 WeakPolarHBondContact O-CB 3.24Å; V658-K661 PolarHBondContact O-N 3.48Å; V658-L662 HydrophobicContact CG1-CD1 4.07Å; V658-L662 HydrophobicContact CG1-CG 4.39Å; V658-L662 WeakPolarHBondContact O-CG 3.09Å; V658-L662 PolarHBondContact O-N 2.97Å
659	F	94.5	Very high	84.8	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-54.5	-45	177.2	-174.2	-96.7	0	0	0	112.4	F647 A650 A651 H655 R656 L662 L663 L711 A714 I726 I730	F647-F659 HydrophobicContact CB-CD2 4.47Å; F647-F659 HydrophobicContact CB-CE2 3.91Å; F647-F659 HydrophobicContact CD1-CD2 4.38Å; F647-F659 AromaticContact CD1-CE2 3.98Å; F647-F659 HydrophobicContact CD1-CE2 3.98Å; F647-F659 HydrophobicContact CD1-CZ 4.46Å; F647-F659 HydrophobicContact CG-CE2 4.46Å; A650-F659 HydrophobicContact CB-CB 4.25Å; A650-F659 HydrophobicContact CB-CD2 4.4Å; A651-F659 HydrophobicContact CB-CD2 4.2Å; A651-F659 HydrophobicContact CB-CE2 4.27Å; H655-F659 WeakPolarHBondContact O-CB 3.44Å; H655-F659 PolarHBondContact O-N 2.74Å; R656-F659 PolarHBondContact O-N 2.81Å; F659-L662 PolarHBondContact O-N 3.47Å; F659-L663 HydrophobicContact CD1-CD1 3.85Å; F659-L663 HydrophobicContact CE1-CD1 3.45Å; F659-L663 VanDerWaalsContact CE1-CD1 3.45Å; F659-L663 HydrophobicContact CE1-CG 4.19Å; F659-L663 HydrophobicContact CZ-CD1 4.17Å; F659-L663 WeakPolarHBondContact O-CG 3.25Å; F659-L663 PolarHBondContact O-N 2.83Å; F659-L663 VanDerWaalsContact O-N 3.13Å; F659-L711 HydrophobicContact CE2-CD2 4.35Å; F659-L711 HydrophobicContact CZ-CD2 3.78Å; F659-A714 HydrophobicContact CE2-CB 4.18Å; F659-I726 HydrophobicContact CD1-CG2 4.22Å; F659-I726 HydrophobicContact CD2-CG2 4.45Å; F659-I726 HydrophobicContact CE1-CG2 4.38Å; F659-I726 HydrophobicContact CG-CG2 4.27Å; F659-I730 HydrophobicContact CE1-CD1 4.32Å; F659-I730 HydrophobicContact CE1-CG1 3.67Å; F659-I730 HydrophobicContact CE2-CD1 4.18Å; F659-I730 HydrophobicContact CE2-CG1 4.33Å; F659-I730 HydrophobicContact CZ-CD1 3.74Å; F659-I730 HydrophobicContact CZ-CG1 3.42Å; F659-I730 VanDerWaalsContact CZ-CG1 3.42Å
660	R	93.5	Very high	82.7	Confident	102 Å²	102	52.5 Å²	52.5	39%	0.385	25%	0.252	S	S	.	.	H	α-helix	trans	-67.6	-37.2	175.8	-70.9	174.5	-176.7	163.2	-23.6	113.6	R656 N657 V658 L663 S664 D729	R656-R660 VanDerWaalsContact NE-CZ 3.29Å; R656-R660 WeakPolarHBondContact O-CG 3.34Å; R656-R660 PolarHBondContact O-N 2.9Å; N657-R660 PolarHBondContact O-N 2.9Å; V658-R660 VanDerWaalsContact C-N 3.3Å; V658-R660 PolarHBondContact O-N 3.12Å; R660-L663 PolarHBondContact O-N 2.99Å; R660-S664 PolarHBondContact O-N 2.88Å; R660-D729 IonicContact CZ-OD2 3.21Å; R660-D729 IonicContact NE-OD2 3.69Å; R660-D729 PolarHBondContact NE-OD2 3.09Å; R660-D729 IonicContact NH2-OD1 2.64Å; R660-D729 IonicContact NH2-OD2 3.11Å; R660-D729 PolarHBondContact NH2-OD2 3.32Å
661	K	93.9	Very high	80.2	Confident	35 Å²	35	55.4 Å²	55.4	15%	0.152	28%	0.282	C	S	.	.	H	α-helix	trans	-61.4	-46.1	174.8	179.1	71.8	-178	-156.9	0	110.6	F613 V616 S617 L620 N657 V658 L663 S664 H665	F613-K661 HydrophobicContact CD2-CB 4.39Å; F613-K661 HydrophobicContact CE2-CB 3.79Å; F613-K661 HydrophobicContact CE2-CD 4.23Å; F613-K661 HydrophobicContact CE2-CG 4.1Å; F613-K661 HydrophobicContact CZ-CB 4.49Å; F613-K661 HydrophobicContact CZ-CD 4.07Å; F613-K661 HydrophobicContact CZ-CG 4.41Å; V616-K661 HydrophobicContact CG1-CG 4.23Å; S617-K661 WeakPolarHBondContact OG-CE 2.94Å; S617-K661 PolarHBondContact OG-NZ 3.37Å; L620-K661 HydrophobicContact CD1-CG 4.06Å; N657-K661 PolarHBondContact O-N 2.95Å; V658-K661 WeakPolarHBondContact O-CB 3.24Å; V658-K661 PolarHBondContact O-N 3.48Å; K661-L663 VanDerWaalsContact C-N 3.3Å; K661-L663 PolarHBondContact O-N 3.27Å; K661-S664 PolarHBondContact O-N 3.11Å; K661-S664 VanDerWaalsContact O-N 3.13Å; K661-S664 PolarHBondContact O-OG 3.24Å; K661-H665 WeakPolarHBondContact CE-CE1 3.46Å; K661-H665 PolarHBondContact NZ-CE1 3.05Å; K661-H665 VanDerWaalsContact NZ-CE1 3.3Å; K661-H665 PolarHBondContact O-N 3.03Å
662	L	91.3	Very high	77.7	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-57.4	-42.6	175.5	-66.3	167.5	0	0	0	111.6	L604 A608 V616 L620 P626 S646 F647 A650 V658 F659 S666	L604-L662 HydrophobicContact CD1-CD2 4.15Å; L604-L662 HydrophobicContact CD2-CD2 4.25Å; L604-L662 HydrophobicContact CG-CD2 4.38Å; A608-L662 HydrophobicContact CB-CD1 4.37Å; V616-L662 HydrophobicContact CG1-CD2 4Å; V616-L662 HydrophobicContact CG1-CG 4.35Å; L620-L662 HydrophobicContact CD1-CD2 4.2Å; L620-L662 HydrophobicContact CD2-CD2 4.33Å; P626-L662 HydrophobicContact CB-CD2 3.98Å; S646-L662 WeakPolarHBondContact O-CD1 3.44Å; F647-L662 HydrophobicContact CD1-CB 3.96Å; F647-L662 HydrophobicContact CD1-CD1 4.44Å; F647-L662 HydrophobicContact CE1-CB 3.55Å; F647-L662 HydrophobicContact CZ-CB 4.17Å; A650-L662 HydrophobicContact CB-CD1 4.07Å; V658-L662 HydrophobicContact CG1-CD1 4.07Å; V658-L662 HydrophobicContact CG1-CG 4.39Å; V658-L662 WeakPolarHBondContact O-CG 3.09Å; V658-L662 PolarHBondContact O-N 2.97Å; F659-L662 PolarHBondContact O-N 3.47Å; L662-S666 PolarHBondContact O-N 3.09Å
663	L	87.8	Confident	75.4	Confident	26 Å²	26	68.3 Å²	68.3	14%	0.136	36%	0.355	C	S	.	.	H	α-helix	trans	-63.5	-41.1	176.1	-72.8	170.7	0	0	0	112.8	F647 F659 R660 K661 H665 L711 L733	F647-L663 HydrophobicContact CD1-CD2 4.33Å; F647-L663 HydrophobicContact CE1-CD2 3.82Å; F647-L663 HydrophobicContact CE1-CG 4.06Å; F659-L663 HydrophobicContact CD1-CD1 3.85Å; F659-L663 HydrophobicContact CE1-CD1 3.45Å; F659-L663 VanDerWaalsContact CE1-CD1 3.45Å; F659-L663 HydrophobicContact CE1-CG 4.19Å; F659-L663 HydrophobicContact CZ-CD1 4.17Å; F659-L663 WeakPolarHBondContact O-CG 3.25Å; F659-L663 PolarHBondContact O-N 2.83Å; F659-L663 VanDerWaalsContact O-N 3.13Å; R660-L663 PolarHBondContact O-N 2.99Å; K661-L663 VanDerWaalsContact C-N 3.3Å; K661-L663 PolarHBondContact O-N 3.27Å; L663-H665 PolarHBondContact O-N 3.19Å; L663-L711 HydrophobicContact CD2-CD2 4.13Å; L663-L733 HydrophobicContact CD1-CD1 3.68Å; L663-L733 HydrophobicContact CD2-CD1 3.84Å; L663-L733 HydrophobicContact CG-CD1 4.44Å
664	S	86.3	Confident	72.9	Confident	53 Å²	53	74.7 Å²	74.7	37%	0.371	39%	0.388	S	S	.	.	H	α-helix	trans	-67.9	-31.8	-176.7	73.2	0	0	0	0	114.3	R660 K661	R660-S664 PolarHBondContact O-N 2.88Å; K661-S664 PolarHBondContact O-N 3.11Å; K661-S664 VanDerWaalsContact O-N 3.13Å; K661-S664 PolarHBondContact O-OG 3.24Å
665	H	73	Confident	70.7	Confident	34 Å²	34	75.9 Å²	75.9	16%	0.157	39%	0.393	C	S	.	.	H	α-helix	trans	-80.9	-34.7	-179.6	-83	50.2	0	0	0	112	L620 K661 L663 E667 K668	L620-H665 HydrophobicContact CB-CB 4.48Å; L620-H665 HydrophobicContact CD1-CB 4.06Å; L620-H665 HydrophobicContact CD2-CB 4.33Å; K661-H665 WeakPolarHBondContact CE-CE1 3.46Å; K661-H665 PolarHBondContact NZ-CE1 3.05Å; K661-H665 VanDerWaalsContact NZ-CE1 3.3Å; K661-H665 PolarHBondContact O-N 3.03Å; L663-H665 PolarHBondContact O-N 3.19Å; H665-E667 PolarHBondContact O-N 3.2Å; H665-K668 PolarHBondContact O-N 2.91Å
666	S	60.6	Low	68.2	Low	15 Å²	15	79.7 Å²	79.7	11%	0.105	41%	0.414	C	S	.	.	H	α-helix	trans	-57.4	-22.7	175.1	171.9	0	0	0	0	114.1	L662 K707	L662-S666 PolarHBondContact O-N 3.09Å; S666-K707 PolarHBondContact OG-NZ 3.35Å
667	E	55.4	Low	66.1	Low	152 Å²	152	83.4 Å²	83.4	71%	0.71	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-21.8	178.2	-65.4	-166.4	162.8	0	0	113.8	H665	H665-E667 PolarHBondContact O-N 3.2Å
668	K	51.8	Low	64	Low	160 Å²	160	82.3 Å²	82.3	70%	0.696	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-34.9	-174.3	-71.2	-175.3	177.7	-177.2	0	113.9	H665 K670 G671	H665-K668 PolarHBondContact O-N 2.91Å; K668-K670 VanDerWaalsContact C-N 3.3Å; K668-K670 PolarHBondContact O-N 3.13Å; K668-G671 PolarHBondContact O-N 3.33Å
669	E	49.9	Very low	62	Low	112 Å²	112	87.6 Å²	87.6	52%	0.523	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-71.1	-21.3	-176.1	-70.4	-179.5	157.4	0	0	114.1	G671	E669-G671 PolarHBondContact O-N 3.35Å
670	K	47.6	Very low	59.7	Low	130 Å²	130	94 Å²	94	57%	0.565	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-78	-1.5	-179.8	-68.2	-169.6	179.5	-173.2	0	114.5	K668 T703	K668-K670 VanDerWaalsContact C-N 3.3Å; K668-K670 PolarHBondContact O-N 3.13Å; K670-T703 PolarHBondContact NZ-OG1 3.18Å
671	G	41.8	Very low	57.6	Low	62 Å²	62	93 Å²	93	64%	0.639	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-80	-26.6	-179.4	0	0	0	0	0	115	K668 E669	K668-G671 PolarHBondContact O-N 3.33Å; E669-G671 PolarHBondContact O-N 3.35Å
672	D	41.4	Very low	55.3	Low	155 Å²	155	100.2 Å²	100.2	83%	0.829	54%	0.535	S	S	*	.	S	Bend	trans	-132.3	1.5	-155	-97.7	-17.8	0	0	0	118.3
673	V	44.8	Very low	52.9	Low	125 Å²	125	103.2 Å²	103.2	76%	0.758	57%	0.566	S	S	*	*			trans	-140.8	93.6	177.3	-165.4	0	0	0	0	111.8	S675	V673-S675 PolarHBondContact O-N 3.37Å
674	L	40.8	Very low	50.3	Low	142 Å²	142	107.3 Å²	107.3	74%	0.743	60%	0.597	S	S	*	*			trans	-67.8	121.7	156.6	-69.5	165.6	0	0	0	107.2	E678	L674-E678 WeakPolarHBondContact CA-OE2 3.48Å; L674-E678 WeakPolarHBondContact CD2-OE2 3.33Å
675	S	48.5	Very low	47.7	Very low	49 Å²	49	112.4 Å²	112.4	34%	0.343	62%	0.62	S	S	.	*			trans	-75.8	150.4	-179.7	70.9	0	0	0	0	110.6	V673 E677 E678	V673-S675 PolarHBondContact O-N 3.37Å; S675-E677 PolarHBondContact O-N 3.45Å; S675-E678 PolarHBondContact N-OE2 3.37Å; S675-E678 WeakPolarHBondContact O-CB 3.5Å; S675-E678 PolarHBondContact O-N 3.3Å
676	L	42.6	Very low	46	Very low	131 Å²	131	116.9 Å²	116.9	69%	0.686	65%	0.652	S	S	*	*	H	α-helix	trans	-56.9	-23.8	179.2	-126.1	91.2	0	0	0	112.9	I679 L680	L676-I679 PolarHBondContact O-N 2.74Å; L676-L680 HydrophobicContact CD2-CD1 4.45Å; L676-L680 VanDerWaalsContact O-CG 3.3Å; L676-L680 WeakPolarHBondContact O-CG 3.33Å; L676-L680 PolarHBondContact O-N 3.42Å; L676-L680 VanDerWaalsContact O-N 3.15Å
677	E	51	Low	44.6	Very low	156 Å²	156	119.7 Å²	119.7	73%	0.729	68%	0.683	S	S	*	*	H	α-helix	trans	-67.6	-33.6	174.5	-68.3	179.6	154.4	0	0	112.5	S675 I679 L680 A681	S675-E677 PolarHBondContact O-N 3.45Å; E677-I679 VanDerWaalsContact C-N 3.33Å; E677-L680 PolarHBondContact O-N 3.18Å; E677-A681 WeakPolarHBondContact O-CB 3.41Å; E677-A681 PolarHBondContact O-N 3.28Å
678	E	50.7	Low	43.3	Very low	87 Å²	87	122.2 Å²	122.2	41%	0.407	70%	0.695	S	S	.	*	H	α-helix	trans	-69.9	-31.2	174.8	-70.6	-179.3	142.8	0	0	111.8	L674 S675	L674-E678 WeakPolarHBondContact CA-OE2 3.48Å; L674-E678 WeakPolarHBondContact CD2-OE2 3.33Å; S675-E678 PolarHBondContact N-OE2 3.37Å; S675-E678 WeakPolarHBondContact O-CB 3.5Å; S675-E678 PolarHBondContact O-N 3.3Å
679	I	54.4	Low	42.3	Very low	113 Å²	113	124.2 Å²	124.2	58%	0.579	70%	0.704	S	S	*	*	H	α-helix	trans	-74.9	-34.4	176.5	-58.6	175.3	0	0	0	111.2	L676 E677	L676-I679 PolarHBondContact O-N 2.74Å; E677-I679 VanDerWaalsContact C-N 3.33Å
680	L	46.7	Very low	41.2	Very low	134 Å²	134	130 Å²	130	70%	0.702	72%	0.721	S	S	*	*	H	α-helix	trans	-86.8	-13.5	-174.5	-69.5	169	0	0	0	114	L676 E677 E682	L676-L680 HydrophobicContact CD2-CD1 4.45Å; L676-L680 VanDerWaalsContact O-CG 3.3Å; L676-L680 WeakPolarHBondContact O-CG 3.33Å; L676-L680 PolarHBondContact O-N 3.42Å; L676-L680 VanDerWaalsContact O-N 3.15Å; E677-L680 PolarHBondContact O-N 3.18Å; L680-E682 VanDerWaalsContact C-N 3.34Å; L680-E682 PolarHBondContact O-N 2.75Å
681	A	49.1	Very low	40.3	Very low	83 Å²	83	131.9 Å²	131.9	69%	0.686	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	0.4	-178.7	0	0	0	0	0	115	E677 G683	E677-A681 WeakPolarHBondContact O-CB 3.41Å; E677-A681 PolarHBondContact O-N 3.28Å; A681-G683 VanDerWaalsContact C-N 3.33Å; A681-G683 PolarHBondContact O-N 3.37Å
682	E	45.9	Very low	39.5	Very low	185 Å²	185	132.9 Å²	132.9	86%	0.864	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	6.7	-177.5	-72.6	-165	153.8	0	0	115.6	L680	L680-E682 VanDerWaalsContact C-N 3.34Å; L680-E682 PolarHBondContact O-N 2.75Å
683	G	40.6	Very low	39	Very low	63 Å²	63	132.2 Å²	132.2	65%	0.649	74%	0.743	S	S	*	*			trans	-140.9	64.8	-169	0	0	0	0	0	117.8	A681	A681-G683 VanDerWaalsContact C-N 3.33Å; A681-G683 PolarHBondContact O-N 3.37Å
684	S	32.7	Very low	38.2	Very low	113 Å²	113	134.4 Å²	134.4	79%	0.79	75%	0.745	S	S	*	*			trans	179.1	101.4	148.9	48.4	0	0	0	0	113.7
685	D	32.4	Very low	37.6	Very low	160 Å²	160	132.4 Å²	132.4	86%	0.856	75%	0.748	S	S	*	*				146.4	128.7	121.6	-97.3	-20.8	0	0	0	114.2
686	P	38	Very low	36.8	Very low	128 Å²	128	137 Å²	137	83%	0.831	77%	0.769	S	S	*	*			trans	-101.6	126.9	173.3	35.5	-25.1	0	0	0	111.7
687	G	30.6	Very low	36.1	Very low	74 Å²	74	134.2 Å²	134.2	76%	0.763	76%	0.76	S	S	*	*			trans	173.1	81.7	167.9	0	0	0	0	0	116.5
688	E	28.3	Very low	35.1	Very low	205 Å²	205	132.3 Å²	132.3	96%	0.958	76%	0.764	S	S	*	*			trans	138.6	126.1	134.3	-78.5	-168.5	144.9	0	0	114.9
689	K	29.9	Very low	34.1	Very low	202 Å²	202	129.9 Å²	129.9	88%	0.878	76%	0.762	S	S	*	*			trans	-91.5	137	-176.5	-71.4	172	172.8	174	0	110.5
690	R	27.5	Very low	33.3	Very low	232 Å²	232	128.6 Å²	128.6	88%	0.875	76%	0.759	S	S	*	*				-178.3	105.6	113.5	-95.4	170.7	-167.4	-173.2	5.6	114.2
691	L	28.6	Very low	33.1	Very low	171 Å²	171	126.7 Å²	126.7	90%	0.895	75%	0.749	S	S	*	*			trans	62.4	90.1	132.7	-59.9	167.9	0	0	0	121.9
692	A	26	Very low	32.8	Very low	83 Å²	83	132.7 Å²	132.7	69%	0.686	75%	0.754	S	S	*	*			trans	-153.1	150.6	132.6	0	0	0	0	0	108.1	Q694	A692-Q694 PolarHBondContact O-N 2.93Å
693	P	30.1	Very low	33.1	Very low	141 Å²	141	127.1 Å²	127.1	92%	0.916	73%	0.733	S	S	*	*			trans	-73	99	-172.5	29	-31.3	0	0	0	110.8
694	Q	27.9	Very low	34.4	Very low	171 Å²	171	125.7 Å²	125.7	80%	0.799	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-83.3	121.4	169.8	-77	178.4	-18	0	0	109.8	A692	A692-Q694 PolarHBondContact O-N 2.93Å
695	A	29.1	Very low	36.4	Very low	99 Å²	99	126 Å²	126	82%	0.818	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-84	120.6	152.8	0	0	0	0	0	107.6
696	N	30	Very low	38.4	Very low	147 Å²	147	120.4 Å²	120.4	79%	0.786	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-70.8	122.7	-176.9	-74.5	-19.3	0	0	0	111.9
697	C	28.1	Very low	40.5	Very low	72 Å²	72	116.3 Å²	116.3	49%	0.486	65%	0.651	S	S	.	*			trans	-163.8	82.2	166.7	-101.4	0	0	0	0	108.8	T700 L701	C697-T700 WeakPolarHBondContact CB-OG1 3.47Å; C697-T700 PolarHBondContact SG-OG1 3.47Å; C697-L701 HydrophobicContact CB-CD1 4.21Å; C697-L701 WeakPolarHBondContact O-CB 3.21Å; C697-L701 WeakPolarHBondContact O-CD1 3.48Å
698	S	31	Very low	43.1	Very low	116 Å²	116	115.6 Å²	115.6	81%	0.811	63%	0.629	S	S	*	*	H	α-helix	trans	-88.3	-28.6	-176.7	67.8	0	0	0	0	114.1
699	G	30.4	Very low	45.7	Very low	36 Å²	36	114.1 Å²	114.1	37%	0.371	62%	0.615	S	S	.	*	H	α-helix	trans	-78	-46.8	179	0	0	0	0	0	114.5	L701 R702	G699-L701 VanDerWaalsContact C-N 3.32Å; G699-L701 PolarHBondContact O-N 3.46Å; G699-R702 PolarHBondContact O-N 3.27Å
700	T	36.9	Very low	48.3	Very low	85 Å²	85	104.7 Å²	104.7	52%	0.521	57%	0.574	S	S	.	*	H	α-helix	trans	-66.8	-28.3	178.1	44.9	0	0	0	0	113.5	C697 T703 G704	C697-T700 WeakPolarHBondContact CB-OG1 3.47Å; C697-T700 PolarHBondContact SG-OG1 3.47Å; T700-T703 PolarHBondContact O-OG1 3.02Å; T700-G704 PolarHBondContact O-N 2.92Å
701	L	41.3	Very low	51.3	Low	95 Å²	95	94.1 Å²	94.1	50%	0.497	54%	0.535	S	S	.	.	H	α-helix	trans	-71.2	-28.2	176.3	-108.9	128.3	0	0	0	113.2	C697 G699 K705	C697-L701 HydrophobicContact CB-CD1 4.21Å; C697-L701 WeakPolarHBondContact O-CB 3.21Å; C697-L701 WeakPolarHBondContact O-CD1 3.48Å; G699-L701 VanDerWaalsContact C-N 3.32Å; G699-L701 PolarHBondContact O-N 3.46Å; L701-K705 WeakPolarHBondContact O-CG 3.42Å; L701-K705 PolarHBondContact O-N 2.66Å; L701-K705 VanDerWaalsContact O-N 3.15Å
702	R	43.9	Very low	54.2	Low	209 Å²	209	91.4 Å²	91.4	79%	0.789	51%	0.513	S	S	*	.	H	α-helix	trans	-73.2	-42.8	-178.3	-163.2	174.4	178.9	168	-2.5	111.6	G699 A706	G699-R702 PolarHBondContact O-N 3.27Å; R702-A706 PolarHBondContact O-N 3.39Å
703	T	51.6	Low	57.2	Low	67 Å²	67	88 Å²	88	41%	0.411	48%	0.483	S	S	.	.	H	α-helix	trans	-70.9	-34.6	175.4	59.7	0	0	0	0	112.4	K670 T700 A706 K707	K670-T703 PolarHBondContact NZ-OG1 3.18Å; T700-T703 PolarHBondContact O-OG1 3.02Å; T703-A706 PolarHBondContact O-N 3.46Å; T703-K707 WeakPolarHBondContact O-CB 3.24Å; T703-K707 PolarHBondContact O-N 2.94Å
704	G	68.3	Low	60.1	Low	34 Å²	34	81.3 Å²	81.3	35%	0.351	44%	0.44	S	S	.	.	H	α-helix	trans	-64.2	-40.6	173.9	0	0	0	0	0	113.5	T700 L708	T700-G704 PolarHBondContact O-N 2.92Å; G704-L708 WeakPolarHBondContact O-CB 3.32Å; G704-L708 PolarHBondContact O-N 3.5Å
705	K	74.3	Confident	63.2	Low	118 Å²	118	73.4 Å²	73.4	51%	0.513	40%	0.403	S	S	.	.	H	α-helix	trans	-67.3	-39.6	175.8	-74.9	177.6	-177.2	179.5	0	112.6	L701 L708 R709	L701-K705 WeakPolarHBondContact O-CG 3.42Å; L701-K705 PolarHBondContact O-N 2.66Å; L701-K705 VanDerWaalsContact O-N 3.15Å; K705-L708 PolarHBondContact O-N 3.37Å; K705-R709 WeakPolarHBondContact O-CG 3.3Å; K705-R709 PolarHBondContact O-N 3.49Å
706	A	75.8	Confident	66.2	Low	43 Å²	43	68.8 Å²	68.8	36%	0.355	36%	0.364	S	S	.	.	H	α-helix	trans	-64.1	-47.6	175.4	0	0	0	0	0	111.3	M627 R702 T703 L708 R709 A710	M627-A706 VanDerWaalsContact CE-C 3.5Å; M627-A706 HydrophobicContact CE-CB 4.08Å; R702-A706 PolarHBondContact O-N 3.39Å; T703-A706 PolarHBondContact O-N 3.46Å; A706-L708 VanDerWaalsContact C-N 3.34Å; A706-L708 PolarHBondContact O-N 2.87Å; A706-R709 WeakPolarHBondContact O-CB 3.41Å; A706-R709 PolarHBondContact O-N 3.02Å; A706-R709 VanDerWaalsContact O-N 3.14Å; A706-A710 PolarHBondContact O-N 2.93Å
707	K	81.7	Confident	69.2	Low	42 Å²	42	62 Å²	62	18%	0.183	33%	0.328	C	S	.	.	H	α-helix	trans	-58.1	-43.8	174.7	-172.7	171	-178.2	169.8	0	112.1	M627 S666 T703 R709 A710 L711	M627-K707 HydrophobicContact CE-CB 4.34Å; M627-K707 HydrophobicContact SD-CB 4.19Å; M627-K707 HydrophobicContact SD-CG 4.36Å; S666-K707 PolarHBondContact OG-NZ 3.35Å; T703-K707 WeakPolarHBondContact O-CB 3.24Å; T703-K707 PolarHBondContact O-N 2.94Å; K707-R709 VanDerWaalsContact C-N 3.33Å; K707-R709 PolarHBondContact O-N 3.24Å; K707-A710 PolarHBondContact O-N 3.19Å; K707-L711 HydrophobicContact CG-CD1 4.08Å; K707-L711 HydrophobicContact CG-CG 4.42Å; K707-L711 WeakPolarHBondContact O-CB 3.24Å; K707-L711 VanDerWaalsContact O-CG 3.28Å; K707-L711 WeakPolarHBondContact O-CG 3.41Å; K707-L711 PolarHBondContact O-N 2.88Å
708	L	84.1	Confident	72.4	Confident	59 Å²	59	58.6 Å²	58.6	31%	0.309	31%	0.305	S	S	.	.	H	α-helix	trans	-62.5	-38.6	176.7	-178.5	60.4	0	0	0	112.4	G704 K705 A706 R712 V735	G704-L708 WeakPolarHBondContact O-CB 3.32Å; G704-L708 PolarHBondContact O-N 3.5Å; K705-L708 PolarHBondContact O-N 3.37Å; A706-L708 VanDerWaalsContact C-N 3.34Å; A706-L708 PolarHBondContact O-N 2.87Å; L708-R712 WeakPolarHBondContact O-CB 3.46Å; L708-R712 VanDerWaalsContact O-CG 3.27Å; L708-R712 WeakPolarHBondContact O-CG 3.45Å; L708-R712 PolarHBondContact O-N 2.89Å; L708-V735 HydrophobicContact CD1-CB 4.46Å; L708-V735 HydrophobicContact CD1-CG1 4.41Å; L708-V735 HydrophobicContact CD1-CG2 3.92Å
709	R	83.1	Confident	75.5	Confident	174 Å²	174	53 Å²	53	66%	0.657	27%	0.266	S	S	*	.	H	α-helix	trans	-65.2	-46.7	175.1	-72.1	172.8	-172.3	162.2	-0.2	111.6	K705 A706 K707 L711 R712 E713	K705-R709 WeakPolarHBondContact O-CG 3.3Å; K705-R709 PolarHBondContact O-N 3.49Å; A706-R709 WeakPolarHBondContact O-CB 3.41Å; A706-R709 PolarHBondContact O-N 3.02Å; A706-R709 VanDerWaalsContact O-N 3.14Å; K707-R709 VanDerWaalsContact C-N 3.33Å; K707-R709 PolarHBondContact O-N 3.24Å; R709-L711 VanDerWaalsContact C-N 3.32Å; R709-L711 PolarHBondContact O-N 3.43Å; R709-R712 PolarHBondContact O-N 3.18Å; R709-E713 PolarHBondContact O-N 3.31Å
710	A	84.8	Confident	78.4	Confident	4 Å²	4	51.9 Å²	51.9	3%	0.033	25%	0.251	C	S	.	.	H	α-helix	trans	-57.8	-44.4	176	0	0	0	0	0	111.9	M627 N645 A706 K707 E713 A714	M627-A710 HydrophobicContact CE-CB 3.8Å; M627-A710 HydrophobicContact SD-CB 4.46Å; N645-A710 WeakPolarHBondContact ND2-CA 3.44Å; N645-A710 WeakPolarHBondContact ND2-CB 3.18Å; A706-A710 PolarHBondContact O-N 2.93Å; K707-A710 PolarHBondContact O-N 3.19Å; A710-E713 PolarHBondContact O-N 2.61Å; A710-A714 WeakPolarHBondContact O-CB 3.47Å; A710-A714 PolarHBondContact O-N 2.74Å
711	L	90	Very high	81.2	Confident	11 Å²	11	48 Å²	48	6%	0.058	23%	0.227	C	C	.	.	H	α-helix	trans	-69.5	-33.4	177.8	-67.5	175.6	0	0	0	113	F647 F659 L663 K707 R709 A714 M715 I730 L733 V735	F647-L711 HydrophobicContact CD1-CD2 4.34Å; F659-L711 HydrophobicContact CE2-CD2 4.35Å; F659-L711 HydrophobicContact CZ-CD2 3.78Å; L663-L711 HydrophobicContact CD2-CD2 4.13Å; K707-L711 HydrophobicContact CG-CD1 4.08Å; K707-L711 HydrophobicContact CG-CG 4.42Å; K707-L711 WeakPolarHBondContact O-CB 3.24Å; K707-L711 VanDerWaalsContact O-CG 3.28Å; K707-L711 WeakPolarHBondContact O-CG 3.41Å; K707-L711 PolarHBondContact O-N 2.88Å; R709-L711 VanDerWaalsContact C-N 3.32Å; R709-L711 PolarHBondContact O-N 3.43Å; L711-A714 PolarHBondContact O-N 2.85Å; L711-M715 WeakPolarHBondContact O-CB 3.45Å; L711-M715 PolarHBondContact O-N 3.36Å; L711-I730 HydrophobicContact CB-CG2 4.1Å; L711-L733 HydrophobicContact CD1-CD1 4.23Å; L711-V735 HydrophobicContact CB-CG2 3.82Å; L711-V735 HydrophobicContact CD1-CG2 4.33Å
712	R	89.8	Confident	83.6	Confident	114 Å²	114	43.9 Å²	43.9	43%	0.43	21%	0.207	S	C	.	.	H	α-helix	trans	-64.4	-42.6	172.4	-78.4	174.9	-178.1	-179	-1.1	111.8	L708 R709 M715 Y716 V735	L708-R712 WeakPolarHBondContact O-CB 3.46Å; L708-R712 VanDerWaalsContact O-CG 3.27Å; L708-R712 WeakPolarHBondContact O-CG 3.45Å; L708-R712 PolarHBondContact O-N 2.89Å; R709-R712 PolarHBondContact O-N 3.18Å; R712-M715 WeakPolarHBondContact O-CB 3.47Å; R712-M715 PolarHBondContact O-N 2.86Å; R712-Y716 PolarHBondContact O-N 3.49Å; R712-V735 HydrophobicContact CB-CG1 4.46Å; R712-V735 HydrophobicContact CG-CG1 3.55Å
713	E	88.4	Confident	86.1	Confident	12 Å²	12	34.9 Å²	34.9	6%	0.056	17%	0.174	C	C	.	.	H	α-helix	trans	-65	-43.3	174.9	-179.4	167	-137.7	0	0	111.5	F189 G642 M644 R709 A710 M715 Y716 H717	F189-E713 HydrophobicContact CE1-CB 4.16Å; F189-E713 HydrophobicContact CE1-CG 3.86Å; F189-E713 HydrophobicContact CE2-CB 4.49Å; F189-E713 HydrophobicContact CZ-CB 3.83Å; F189-E713 HydrophobicContact CZ-CG 3.74Å; G642-E713 VanDerWaalsContact CA-OE1 3.28Å; G642-E713 WeakPolarHBondContact CA-OE1 3.24Å; M644-E713 HydrophobicContact CE-CG 4.1Å; M644-E713 WeakPolarHBondContact CE-OE1 3.17Å; M644-E713 HydrophobicContact SD-CG 4.28Å; R709-E713 PolarHBondContact O-N 3.31Å; A710-E713 PolarHBondContact O-N 2.61Å; E713-M715 VanDerWaalsContact C-N 3.32Å; E713-M715 PolarHBondContact O-N 2.89Å; E713-Y716 WeakPolarHBondContact O-CB 3.27Å; E713-Y716 PolarHBondContact O-N 3.25Å; E713-H717 PolarHBondContact O-CD2 3.17Å; E713-H717 PolarHBondContact O-N 3.32Å
714	A	91.9	Very high	88.2	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-60.1	-39.8	173	0	0	0	0	0	112.5	F647 A651 F659 A710 L711 S718 I730	F647-A714 HydrophobicContact CB-CB 4.38Å; A651-A714 HydrophobicContact CB-CB 3.79Å; F659-A714 HydrophobicContact CE2-CB 4.18Å; A710-A714 WeakPolarHBondContact O-CB 3.47Å; A710-A714 PolarHBondContact O-N 2.74Å; L711-A714 PolarHBondContact O-N 2.85Å; A714-S718 WeakPolarHBondContact O-CB 3.29Å; A714-S718 PolarHBondContact O-N 2.74Å; A714-S718 PolarHBondContact O-OG 3.5Å; A714-I730 HydrophobicContact CB-CD1 3.89Å
715	M	93.4	Very high	89.4	Confident	4 Å²	4	32.8 Å²	32.8	2%	0.02	15%	0.152	C	C	.	.	H	α-helix	trans	-62.6	-43.9	174.5	-176.2	-177	-83.5	0	0	111.2	L711 R712 E713 S718 A719 T727 I730 R731 V735 W737 T741	L711-M715 WeakPolarHBondContact O-CB 3.45Å; L711-M715 PolarHBondContact O-N 3.36Å; R712-M715 WeakPolarHBondContact O-CB 3.47Å; R712-M715 PolarHBondContact O-N 2.86Å; E713-M715 VanDerWaalsContact C-N 3.32Å; E713-M715 PolarHBondContact O-N 2.89Å; M715-S718 WeakPolarHBondContact CA-OG 3.48Å; M715-S718 PolarHBondContact O-OG 3.01Å; M715-S718 VanDerWaalsContact O-OG 3.1Å; M715-A719 VanDerWaalsContact O-CB 3.26Å; M715-A719 WeakPolarHBondContact O-CB 3.31Å; M715-A719 PolarHBondContact O-N 2.81Å; M715-T727 HydrophobicContact CG-CG2 3.65Å; M715-I730 HydrophobicContact CB-CD1 4.25Å; M715-I730 HydrophobicContact CB-CG2 4.11Å; M715-I730 HydrophobicContact CE-CB 4.14Å; M715-I730 HydrophobicContact CE-CG2 3.83Å; M715-R731 HydrophobicContact CE-CB 4.02Å; M715-V735 HydrophobicContact CE-CB 3.65Å; M715-V735 HydrophobicContact CE-CG1 3.63Å; M715-V735 HydrophobicContact SD-CG1 4Å; M715-W737 HydrophobicContact SD-CE3 4.13Å; M715-W737 HydrophobicContact SD-CZ3 4.28Å; M715-T741 HydrophobicContact CG-CG2 4.38Å
716	Y	92.7	Very high	90.5	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.008	13%	0.129	C	C	.	.	H	α-helix	trans	-58.8	-52.3	176.6	175.1	-99.9	0	0	0	111.9	K188 F189 R191 K193 R712 E713 A719 E720 H740 T741	K188-Y716 PolarHBondContact O-OH 3.37Å; F189-Y716 HydrophobicContact CB-CD2 4.1Å; F189-Y716 HydrophobicContact CB-CG 4.33Å; F189-Y716 AromaticContact CD1-CD1 3.62Å; F189-Y716 HydrophobicContact CD1-CD1 3.62Å; F189-Y716 HydrophobicContact CD1-CD2 4.08Å; F189-Y716 HydrophobicContact CD1-CE1 4.17Å; F189-Y716 AromaticContact CD1-CG 3.56Å; F189-Y716 HydrophobicContact CD1-CG 3.56Å; F189-Y716 HydrophobicContact CE1-CD1 4.07Å; F189-Y716 HydrophobicContact CE1-CG 4.36Å; F189-Y716 HydrophobicContact CG-CG 4.38Å; R191-Y716 WeakPolarHBondContact O-CE2 3.48Å; R191-Y716 PolarHBondContact O-OH 2.72Å; K193-Y716 HydrophobicContact CG-CE1 4.34Å; R712-Y716 PolarHBondContact O-N 3.49Å; E713-Y716 WeakPolarHBondContact O-CB 3.27Å; E713-Y716 PolarHBondContact O-N 3.25Å; Y716-A719 PolarHBondContact O-N 3.45Å; Y716-E720 HydrophobicContact CD2-CG 4.41Å; Y716-E720 HydrophobicContact CE1-CG 4.24Å; Y716-E720 HydrophobicContact CE2-CG 4.01Å; Y716-E720 WeakPolarHBondContact O-CB 3.31Å; Y716-E720 PolarHBondContact O-N 3.3Å; Y716-H740 AromaticContact CD2-CD2 3.88Å; Y716-H740 AromaticContact CE2-CD2 3.54Å; Y716-H740 AromaticContact CE2-NE2 3.63Å; Y716-T741 HydrophobicContact CD2-CG2 4.28Å
717	H	92.8	Very high	91.4	Very high	5 Å²	5	25.3 Å²	25.3	2%	0.023	11%	0.112	C	C	.	.	H	α-helix	trans	-66.5	-40.7	-178.7	-74.3	-62.6	0	0	0	113.5	K193 E221 M644 E713 H721	K193-H717 WeakPolarHBondContact CE-ND1 3.24Å; K193-H717 PolarHBondContact NZ-CE1 2.93Å; K193-H717 PolarHBondContact NZ-ND1 3.32Å; K193-H717 VanDerWaalsContact NZ-ND1 3.14Å; E221-H717 IonicContact OE2-CE1 3.1Å; M644-H717 WeakPolarHBondContact CE-NE2 3.37Å; E713-H717 PolarHBondContact O-CD2 3.17Å; E713-H717 PolarHBondContact O-N 3.32Å; H717-H721 VanDerWaalsContact O-CB 3.31Å; H717-H721 WeakPolarHBondContact O-CB 3.39Å; H717-H721 PolarHBondContact O-CD2 2.85Å; H717-H721 PolarHBondContact O-N 3.1Å
718	S	95.4	Very high	92	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-65.4	-39.3	176.3	49.5	0	0	0	0	112.3	A714 M715 G722 H723 T727	A714-S718 WeakPolarHBondContact O-CB 3.29Å; A714-S718 PolarHBondContact O-N 2.74Å; A714-S718 PolarHBondContact O-OG 3.5Å; M715-S718 WeakPolarHBondContact CA-OG 3.48Å; M715-S718 PolarHBondContact O-OG 3.01Å; M715-S718 VanDerWaalsContact O-OG 3.1Å; S718-G722 PolarHBondContact O-N 2.77Å; S718-G722 VanDerWaalsContact O-N 3.12Å; S718-H723 PolarHBondContact O-N 3.13Å; S718-T727 PolarHBondContact OG-OG1 3.07Å
719	A	94.9	Very high	92.5	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-65	-52.2	175.3	0	0	0	0	0	111.7	M715 Y716 H721 G722 T727 T741 E744	M715-A719 VanDerWaalsContact O-CB 3.26Å; M715-A719 WeakPolarHBondContact O-CB 3.31Å; M715-A719 PolarHBondContact O-N 2.81Å; Y716-A719 PolarHBondContact O-N 3.45Å; A719-H721 VanDerWaalsContact C-N 3.26Å; A719-H721 PolarHBondContact O-N 2.91Å; A719-G722 PolarHBondContact O-N 3.03Å; A719-T727 HydrophobicContact CB-CG2 4.04Å; A719-T727 PolarHBondContact N-OG1 2.9Å; A719-T741 HydrophobicContact CB-CG2 4.09Å; A719-E744 WeakPolarHBondContact O-CG 3.28Å
720	E	92.5	Very high	93	Very high	12 Å²	12	15.9 Å²	15.9	6%	0.056	8%	0.076	C	C	.	.	H	α-helix	trans	-57.4	-37.8	179.1	-86	-79.2	108.2	0	0	112.6	G192 K193 G204 Y716 G722 H740	G192-E720 WeakPolarHBondContact CA-OE1 3.47Å; K193-E720 VanDerWaalsContact CB-OE2 3.26Å; K193-E720 WeakPolarHBondContact CB-OE2 3.4Å; K193-E720 HydrophobicContact CG-CG 4.49Å; K193-E720 VanDerWaalsContact CG-OE2 3.25Å; K193-E720 WeakPolarHBondContact CG-OE2 3.31Å; K193-E720 PolarHBondContact N-OE2 3.39Å; G204-E720 VanDerWaalsContact CA-O 3.27Å; G204-E720 WeakPolarHBondContact CA-O 3.15Å; Y716-E720 HydrophobicContact CD2-CG 4.41Å; Y716-E720 HydrophobicContact CE1-CG 4.24Å; Y716-E720 HydrophobicContact CE2-CG 4.01Å; Y716-E720 WeakPolarHBondContact O-CB 3.31Å; Y716-E720 PolarHBondContact O-N 3.3Å; E720-G722 VanDerWaalsContact C-N 3.32Å; E720-H740 IonicContact OE1-CE1 3.97Å; E720-H740 PolarHBondContact OE1-CE1 3.29Å; E720-H740 IonicContact OE1-NE2 3.69Å; E720-H740 PolarHBondContact OE1-NE2 3.15Å
721	H	93.9	Very high	93.4	Very high	4 Å²	4	18.4 Å²	18.4	2%	0.019	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89	1.4	-179.9	-56.9	178.7	0	0	0	112.5	K193 F207 R208 S652 H717 A719	K193-H721 PolarHBondContact NZ-NE2 3.44Å; F207-H721 HydrophobicContact CD1-CB 4.44Å; F207-H721 AromaticContact CD1-CE1 3.31Å; F207-H721 WeakPolarHBondContact CD1-CE1 3.47Å; F207-H721 AromaticContact CD1-CG 3.74Å; F207-H721 AromaticContact CD1-ND1 3.11Å; F207-H721 WeakPolarHBondContact CD1-ND1 3.5Å; F207-H721 AromaticContact CD2-CE1 3.68Å; F207-H721 AromaticContact CE1-CE1 3.46Å; F207-H721 VanDerWaalsContact CE1-CE1 3.46Å; F207-H721 WeakPolarHBondContact CE1-CE1 3.39Å; F207-H721 AromaticContact CE1-ND1 3.31Å; F207-H721 VanDerWaalsContact CE1-ND1 3.31Å; F207-H721 WeakPolarHBondContact CE1-ND1 3.47Å; F207-H721 AromaticContact CE2-CE1 3.8Å; F207-H721 AromaticContact CG-CE1 3.44Å; F207-H721 VanDerWaalsContact CG-CE1 3.44Å; F207-H721 WeakPolarHBondContact CG-CE1 3.33Å; F207-H721 AromaticContact CG-ND1 3.69Å; F207-H721 AromaticContact CG-NE2 3.79Å; F207-H721 AromaticContact CZ-CE1 3.7Å; R208-H721 WeakPolarHBondContact CB-O 3.4Å; R208-H721 VanDerWaalsContact CD-O 3.23Å; R208-H721 WeakPolarHBondContact CD-O 3.46Å; S652-H721 PolarHBondContact O-ND1 3.42Å; H717-H721 VanDerWaalsContact O-CB 3.31Å; H717-H721 WeakPolarHBondContact O-CB 3.39Å; H717-H721 PolarHBondContact O-CD2 2.85Å; H717-H721 PolarHBondContact O-N 3.1Å; A719-H721 VanDerWaalsContact C-N 3.26Å; A719-H721 PolarHBondContact O-N 2.91Å
722	G	93.5	Very high	93.5	Very high	8 Å²	8	22.5 Å²	22.5	8%	0.082	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	22.5	176.7	0	0	0	0	0	116	R208 S718 A719 E720 V724	R208-G722 PolarHBondContact NH1-O 2.81Å; S718-G722 PolarHBondContact O-N 2.77Å; S718-G722 VanDerWaalsContact O-N 3.12Å; A719-G722 PolarHBondContact O-N 3.03Å; E720-G722 VanDerWaalsContact C-N 3.32Å; G722-V724 VanDerWaalsContact C-N 3.25Å; G722-V724 PolarHBondContact O-N 2.86Å; G722-V724 VanDerWaalsContact O-N 3.16Å
723	H	95.5	Very high	93.5	Very high	19 Å²	19	21.2 Å²	21.2	9%	0.088	12%	0.116	C	C	.	.			trans	-85.4	59.5	171.9	-62.3	-65.1	0	0	0	111.8	R208 S652 G654 S718 D725 I726 T727	R208-H723 PolarHBondContact NH1-CE1 3.01Å; R208-H723 PolarHBondContact NH1-ND1 3.27Å; S652-H723 PolarHBondContact O-CD2 3.31Å; S652-H723 PolarHBondContact O-NE2 3.37Å; G654-H723 VanDerWaalsContact CA-CE1 3.41Å; G654-H723 WeakPolarHBondContact CA-CE1 3.21Å; G654-H723 VanDerWaalsContact CA-CG 3.45Å; G654-H723 VanDerWaalsContact CA-ND1 3.3Å; G654-H723 WeakPolarHBondContact CA-ND1 3.46Å; G654-H723 PolarHBondContact N-NE2 3.28Å; S718-H723 PolarHBondContact O-N 3.13Å; H723-D725 VanDerWaalsContact C-N 3.29Å; H723-D725 PolarHBondContact O-N 2.98Å; H723-D725 VanDerWaalsContact O-N 3.14Å; H723-I726 HydrophobicContact CB-CD1 4.28Å; H723-I726 WeakPolarHBondContact O-CB 3.5Å; H723-I726 PolarHBondContact O-N 3.21Å; H723-T727 PolarHBondContact O-N 3.42Å; H723-T727 PolarHBondContact O-OG1 3.25Å
724	V	94.8	Very high	93.4	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.012	14%	0.138	C	C	.	.	H	α-helix	trans	-52.5	-40.7	-171.8	-179	0	0	0	0	113.7	G722 I726 T727 I728 T748 C749 L757	G722-V724 VanDerWaalsContact C-N 3.25Å; G722-V724 PolarHBondContact O-N 2.86Å; G722-V724 VanDerWaalsContact O-N 3.16Å; V724-I726 PolarHBondContact O-N 3.43Å; V724-T727 WeakPolarHBondContact O-CB 3.46Å; V724-T727 PolarHBondContact O-N 3.15Å; V724-I728 HydrophobicContact CG1-CG1 3.96Å; V724-I728 WeakPolarHBondContact O-CG1 3.33Å; V724-I728 PolarHBondContact O-N 3.22Å; V724-T748 WeakPolarHBondContact CG2-OG1 3.4Å; V724-C749 VanDerWaalsContact CG1-SG 3.58Å; V724-L757 HydrophobicContact CG1-CD1 4.15Å
725	D	94.8	Very high	93.4	Very high	56 Å²	56	23.1 Å²	23.1	30%	0.299	14%	0.139	S	C	.	.	H	α-helix	trans	-62.3	-31.6	-177.8	-62.9	-65.8	0	0	0	112.3	H723 D729 R754	H723-D725 VanDerWaalsContact C-N 3.29Å; H723-D725 PolarHBondContact O-N 2.98Å; H723-D725 VanDerWaalsContact O-N 3.14Å; D725-D729 WeakPolarHBondContact O-CB 3.28Å; D725-D729 PolarHBondContact O-N 3.23Å; D725-D729 VanDerWaalsContact O-N 3.09Å; D725-R754 VanDerWaalsContact CG-NH1 3.27Å; D725-R754 IonicContact OD1-CZ 2.66Å; D725-R754 IonicContact OD1-NH1 3.48Å; D725-R754 PolarHBondContact OD1-NH1 3.49Å; D725-R754 IonicContact OD1-NH2 3.65Å; D725-R754 PolarHBondContact OD1-NH2 3.48Å; D725-R754 IonicContact OD2-CZ 3.35Å; D725-R754 IonicContact OD2-NH1 2.91Å; D725-R754 PolarHBondContact OD2-NH1 3.25Å; D725-R754 IonicContact OD2-NH2 2.88Å
726	I	95.8	Very high	93.2	Very high	4 Å²	4	25.5 Å²	25.5	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-72.7	-44.3	173	-61.1	179.5	0	0	0	109.5	A651 R656 F659 H723 V724 I728 D729 I730	A651-I726 HydrophobicContact CB-CG2 3.9Å; R656-I726 HydrophobicContact CB-CD1 4.09Å; R656-I726 HydrophobicContact CB-CG1 3.82Å; R656-I726 HydrophobicContact CG-CG1 4Å; F659-I726 HydrophobicContact CD1-CG2 4.22Å; F659-I726 HydrophobicContact CD2-CG2 4.45Å; F659-I726 HydrophobicContact CE1-CG2 4.38Å; F659-I726 HydrophobicContact CG-CG2 4.27Å; H723-I726 HydrophobicContact CB-CD1 4.28Å; H723-I726 WeakPolarHBondContact O-CB 3.5Å; H723-I726 PolarHBondContact O-N 3.21Å; V724-I726 PolarHBondContact O-N 3.43Å; I726-I728 VanDerWaalsContact C-N 3.29Å; I726-I728 PolarHBondContact O-N 2.91Å; I726-D729 WeakPolarHBondContact O-CB 3.46Å; I726-D729 PolarHBondContact O-N 2.96Å; I726-D729 VanDerWaalsContact O-N 3.13Å; I726-I730 HydrophobicContact CG2-CD1 3.82Å; I726-I730 HydrophobicContact CG2-CG1 4.24Å; I726-I730 VanDerWaalsContact O-CG1 3.27Å; I726-I730 WeakPolarHBondContact O-CG1 3.32Å; I726-I730 PolarHBondContact O-N 2.81Å
727	T	95.9	Very high	93.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-56.7	-43.1	177.9	-41.1	0	0	0	0	111.9	M715 S718 A719 H723 V724 I730 R731 W737	M715-T727 HydrophobicContact CG-CG2 3.65Å; S718-T727 PolarHBondContact OG-OG1 3.07Å; A719-T727 HydrophobicContact CB-CG2 4.04Å; A719-T727 PolarHBondContact N-OG1 2.9Å; H723-T727 PolarHBondContact O-N 3.42Å; H723-T727 PolarHBondContact O-OG1 3.25Å; V724-T727 WeakPolarHBondContact O-CB 3.46Å; V724-T727 PolarHBondContact O-N 3.15Å; T727-I730 PolarHBondContact O-N 2.96Å; T727-R731 WeakPolarHBondContact O-CB 3.17Å; T727-R731 PolarHBondContact O-N 3.48Å; T727-W737 HydrophobicContact CG2-CH2 3.92Å; T727-W737 HydrophobicContact CG2-CZ3 3.67Å
728	I	94.5	Very high	92.9	Very high	46 Å²	46	27.5 Å²	27.5	24%	0.236	17%	0.167	C	C	.	.	H	α-helix	trans	-68.6	-41.2	176.2	-61	-62.9	0	0	0	111.5	V724 I726 I730 R731 S732 W737 L757 L761	V724-I728 HydrophobicContact CG1-CG1 3.96Å; V724-I728 WeakPolarHBondContact O-CG1 3.33Å; V724-I728 PolarHBondContact O-N 3.22Å; I726-I728 VanDerWaalsContact C-N 3.29Å; I726-I728 PolarHBondContact O-N 2.91Å; I728-I730 VanDerWaalsContact C-N 3.29Å; I728-I730 PolarHBondContact O-N 3.49Å; I728-R731 WeakPolarHBondContact O-CB 3.46Å; I728-R731 PolarHBondContact O-N 2.99Å; I728-S732 PolarHBondContact O-N 3.39Å; I728-W737 HydrophobicContact CD1-CH2 4.05Å; I728-W737 HydrophobicContact CD1-CZ2 4.08Å; I728-L757 HydrophobicContact CG1-CD2 4.45Å; I728-L761 HydrophobicContact CD1-CD2 3.95Å; I728-L761 HydrophobicContact CD1-CG 4.46Å
729	D	94.1	Very high	92.7	Very high	30 Å²	30	27.9 Å²	27.9	16%	0.16	17%	0.168	C	C	.	.	H	α-helix	trans	-58.2	-43.6	173.1	-76.3	2.2	0	0	0	110	R656 R660 D725 I726 S732 L733	R656-D729 IonicContact CZ-OD1 3.63Å; R656-D729 IonicContact CZ-OD2 2.84Å; R656-D729 IonicContact NE-OD1 3.52Å; R656-D729 IonicContact NE-OD2 2.97Å; R656-D729 PolarHBondContact NE-OD2 2.82Å; R656-D729 IonicContact NH2-OD1 3.89Å; R656-D729 PolarHBondContact NH2-OD1 3.49Å; R656-D729 IonicContact NH2-OD2 2.83Å; R656-D729 PolarHBondContact NH2-OD2 3.46Å; R660-D729 IonicContact CZ-OD2 3.21Å; R660-D729 IonicContact NE-OD2 3.69Å; R660-D729 PolarHBondContact NE-OD2 3.09Å; R660-D729 IonicContact NH2-OD1 2.64Å; R660-D729 IonicContact NH2-OD2 3.11Å; R660-D729 PolarHBondContact NH2-OD2 3.32Å; D725-D729 WeakPolarHBondContact O-CB 3.28Å; D725-D729 PolarHBondContact O-N 3.23Å; D725-D729 VanDerWaalsContact O-N 3.09Å; I726-D729 WeakPolarHBondContact O-CB 3.46Å; I726-D729 PolarHBondContact O-N 2.96Å; I726-D729 VanDerWaalsContact O-N 3.13Å; D729-S732 WeakPolarHBondContact O-CB 3.48Å; D729-S732 PolarHBondContact O-N 3.41Å; D729-S732 PolarHBondContact O-OG 3.46Å; D729-L733 PolarHBondContact O-N 3.38Å
730	I	93.6	Very high	92.5	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.9	-41.4	177	-60.5	168.2	0	0	0	111.4	F659 L711 A714 M715 I726 T727 I728 S732 L733 V735	F659-I730 HydrophobicContact CE1-CD1 4.32Å; F659-I730 HydrophobicContact CE1-CG1 3.67Å; F659-I730 HydrophobicContact CE2-CD1 4.18Å; F659-I730 HydrophobicContact CE2-CG1 4.33Å; F659-I730 HydrophobicContact CZ-CD1 3.74Å; F659-I730 HydrophobicContact CZ-CG1 3.42Å; F659-I730 VanDerWaalsContact CZ-CG1 3.42Å; L711-I730 HydrophobicContact CB-CG2 4.1Å; A714-I730 HydrophobicContact CB-CD1 3.89Å; M715-I730 HydrophobicContact CB-CD1 4.25Å; M715-I730 HydrophobicContact CB-CG2 4.11Å; M715-I730 HydrophobicContact CE-CB 4.14Å; M715-I730 HydrophobicContact CE-CG2 3.83Å; I726-I730 HydrophobicContact CG2-CD1 3.82Å; I726-I730 HydrophobicContact CG2-CG1 4.24Å; I726-I730 VanDerWaalsContact O-CG1 3.27Å; I726-I730 WeakPolarHBondContact O-CG1 3.32Å; I726-I730 PolarHBondContact O-N 2.81Å; T727-I730 PolarHBondContact O-N 2.96Å; I728-I730 VanDerWaalsContact C-N 3.29Å; I728-I730 PolarHBondContact O-N 3.49Å; I730-S732 PolarHBondContact O-N 3.3Å; I730-L733 WeakPolarHBondContact O-CB 3.5Å; I730-L733 PolarHBondContact O-N 3.25Å; I730-V735 HydrophobicContact CG2-CB 3.94Å; I730-V735 HydrophobicContact CG2-CG1 4.38Å; I730-V735 HydrophobicContact CG2-CG2 3.58Å
731	R	93.4	Very high	92.5	Very high	58 Å²	58	27.6 Å²	27.6	22%	0.219	17%	0.167	C	C	.	.	H	α-helix	trans	-57.9	-40	175	172.3	60.4	-173.5	130.3	0.6	111.4	M715 T727 I728 L733 G734 V735 W737 D764 C767	M715-R731 HydrophobicContact CE-CB 4.02Å; T727-R731 WeakPolarHBondContact O-CB 3.17Å; T727-R731 PolarHBondContact O-N 3.48Å; I728-R731 WeakPolarHBondContact O-CB 3.46Å; I728-R731 PolarHBondContact O-N 2.99Å; R731-L733 PolarHBondContact O-N 2.97Å; R731-G734 PolarHBondContact O-N 3.33Å; R731-V735 VanDerWaalsContact CD-O 3.3Å; R731-V735 WeakPolarHBondContact CD-O 3.13Å; R731-V735 PolarHBondContact NH1-O 3.48Å; R731-W737 HydrophobicContact CB-CH2 4.26Å; R731-W737 HydrophobicContact CB-CZ2 3.87Å; R731-W737 HydrophobicContact CG-CH2 4.49Å; R731-W737 HydrophobicContact CG-CZ2 3.64Å; R731-D764 IonicContact CZ-OD2 2.64Å; R731-D764 IonicContact NE-OD2 2.78Å; R731-D764 PolarHBondContact NE-OD2 3.3Å; R731-D764 VanDerWaalsContact NE-OD2 3.08Å; R731-D764 IonicContact NH2-OD2 3.43Å; R731-C767 PolarHBondContact NH2-SG 2.74Å
732	S	91.4	Very high	92.5	Very high	96 Å²	96	27.4 Å²	27.4	67%	0.671	17%	0.166	S	C	*	.	H	α-helix	trans	-63.6	-21.5	178	80.7	0	0	0	0	113.6	I728 D729 I730 G734	I728-S732 PolarHBondContact O-N 3.39Å; D729-S732 WeakPolarHBondContact O-CB 3.48Å; D729-S732 PolarHBondContact O-N 3.41Å; D729-S732 PolarHBondContact O-OG 3.46Å; I730-S732 PolarHBondContact O-N 3.3Å; S732-G734 PolarHBondContact O-N 2.97Å
733	L	89.4	Confident	92.6	Very high	87 Å²	87	27 Å²	27	46%	0.455	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	3.3	173.4	-56.7	172.4	0	0	0	113.3	L663 L711 D729 I730 R731	L663-L733 HydrophobicContact CD1-CD1 3.68Å; L663-L733 HydrophobicContact CD2-CD1 3.84Å; L663-L733 HydrophobicContact CG-CD1 4.44Å; L711-L733 HydrophobicContact CD1-CD1 4.23Å; D729-L733 PolarHBondContact O-N 3.38Å; I730-L733 WeakPolarHBondContact O-CB 3.5Å; I730-L733 PolarHBondContact O-N 3.25Å; R731-L733 PolarHBondContact O-N 2.97Å
734	G	88	Confident	92.5	Very high	52 Å²	52	27.1 Å²	27.1	54%	0.536	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.3	11.3	177	0	0	0	0	0	114.8	R731 S732	R731-G734 PolarHBondContact O-N 3.33Å; S732-G734 PolarHBondContact O-N 2.97Å
735	V	90.2	Very high	92.5	Very high	1 Å²	1	27 Å²	27	1%	0.006	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-69.7	128	171	-175.8	0	0	0	0	108.9	L708 L711 R712 M715 I730 R731	L708-V735 HydrophobicContact CD1-CB 4.46Å; L708-V735 HydrophobicContact CD1-CG1 4.41Å; L708-V735 HydrophobicContact CD1-CG2 3.92Å; L711-V735 HydrophobicContact CB-CG2 3.82Å; L711-V735 HydrophobicContact CD1-CG2 4.33Å; R712-V735 HydrophobicContact CB-CG1 4.46Å; R712-V735 HydrophobicContact CG-CG1 3.55Å; M715-V735 HydrophobicContact CE-CB 3.65Å; M715-V735 HydrophobicContact CE-CG1 3.63Å; M715-V735 HydrophobicContact SD-CG1 4Å; I730-V735 HydrophobicContact CG2-CB 3.94Å; I730-V735 HydrophobicContact CG2-CG1 4.38Å; I730-V735 HydrophobicContact CG2-CG2 3.58Å; R731-V735 VanDerWaalsContact CD-O 3.3Å; R731-V735 WeakPolarHBondContact CD-O 3.13Å; R731-V735 PolarHBondContact NH1-O 3.48Å
736	P	89.6	Confident	92.6	Very high	54 Å²	54	24.4 Å²	24.4	35%	0.351	15%	0.148	S	C	.	.	P	Polyproline II helix	trans	-72.6	150.2	178.7	30.3	-34.7	0	0	0	111
737	W	90.4	Very high	92.5	Very high	5 Å²	5	27.8 Å²	27.8	2%	0.019	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-64.4	142.1	169.3	-69.8	118	0	0	0	110.5	M715 T727 I728 R731 W742 L761 D764 I768	M715-W737 HydrophobicContact SD-CE3 4.13Å; M715-W737 HydrophobicContact SD-CZ3 4.28Å; T727-W737 HydrophobicContact CG2-CH2 3.92Å; T727-W737 HydrophobicContact CG2-CZ3 3.67Å; I728-W737 HydrophobicContact CD1-CH2 4.05Å; I728-W737 HydrophobicContact CD1-CZ2 4.08Å; R731-W737 HydrophobicContact CB-CH2 4.26Å; R731-W737 HydrophobicContact CB-CZ2 3.87Å; R731-W737 HydrophobicContact CG-CH2 4.49Å; R731-W737 HydrophobicContact CG-CZ2 3.64Å; W737-W742 HydrophobicContact CB-CB 4.17Å; W737-W742 HydrophobicContact CD2-CB 4.13Å; W737-W742 HydrophobicContact CE3-CB 4.03Å; W737-W742 HydrophobicContact CG-CB 4.21Å; W737-L761 HydrophobicContact CH2-CD2 3.77Å; W737-L761 HydrophobicContact CZ2-CD2 3.47Å; W737-L761 VanDerWaalsContact CZ2-CD2 3.47Å; W737-D764 PolarHBondContact NE1-OD2 2.92Å; W737-I768 HydrophobicContact CB-CG1 4.09Å
738	T	89.6	Confident	92.4	Very high	44 Å²	44	28.7 Å²	28.7	27%	0.27	17%	0.167	S	C	.	.	P	Polyproline II helix	trans	-93.9	152.9	151.7	66.3	0	0	0	0	107.9	H740 T741 W742	T738-H740 PolarHBondContact O-N 3.14Å; T738-T741 PolarHBondContact N-OG1 2.9Å; T738-T741 PolarHBondContact O-N 2.66Å; T738-T741 PolarHBondContact O-OG1 2.91Å; T738-T741 VanDerWaalsContact O-OG1 3.05Å; T738-T741 WeakPolarHBondContact OG1-CB 3.26Å; T738-T741 WeakPolarHBondContact OG1-CG2 3.49Å; T738-T741 PolarHBondContact OG1-N 2.84Å; T738-T741 VanDerWaalsContact OG1-N 3.17Å; T738-T741 PolarHBondContact OG1-OG1 3.25Å; T738-W742 WeakPolarHBondContact O-CB 3.19Å; T738-W742 PolarHBondContact O-N 2.93Å
739	L	90.1	Very high	92.4	Very high	7 Å²	7	26.5 Å²	26.5	4%	0.037	16%	0.156	C	C	.	.	H	α-helix	trans	-49.1	-45.9	175.9	174.4	62.5	0	0	0	112.1	W742 L743 I768 E772 T774 L777	L739-W742 HydrophobicContact CD1-CE3 4.49Å; L739-L743 VanDerWaalsContact O-CB 3.25Å; L739-L743 WeakPolarHBondContact O-CB 3.32Å; L739-L743 PolarHBondContact O-N 2.95Å; L739-I768 HydrophobicContact CB-CG2 4.32Å; L739-I768 HydrophobicContact CD1-CD1 4.47Å; L739-E772 WeakPolarHBondContact CD2-O 3.39Å; L739-T774 HydrophobicContact CD2-CG2 4.43Å; L739-T774 WeakPolarHBondContact CD2-OG1 3.5Å; L739-L777 HydrophobicContact CD1-CB 4.37Å; L739-L777 HydrophobicContact CD1-CD1 4.15Å; L739-L777 HydrophobicContact CD2-CB 3.94Å
740	H	90.9	Very high	92.4	Very high	3 Å²	3	26 Å²	26	1%	0.014	15%	0.152	C	C	.	.	H	α-helix	trans	-64.6	-48.9	-179.7	175.3	65.4	0	0	0	113.1	S190 G192 Y716 E720 T738 W742 L743 E744 E776	S190-H740 WeakPolarHBondContact O-CB 3.3Å; G192-H740 WeakPolarHBondContact CA-CE1 3.45Å; G192-H740 WeakPolarHBondContact CA-NE2 3.47Å; G192-H740 PolarHBondContact N-CE1 3.17Å; G192-H740 PolarHBondContact N-ND1 3.32Å; G192-H740 PolarHBondContact N-NE2 3.03Å; Y716-H740 AromaticContact CD2-CD2 3.88Å; Y716-H740 AromaticContact CE2-CD2 3.54Å; Y716-H740 AromaticContact CE2-NE2 3.63Å; E720-H740 IonicContact OE1-CE1 3.97Å; E720-H740 PolarHBondContact OE1-CE1 3.29Å; E720-H740 IonicContact OE1-NE2 3.69Å; E720-H740 PolarHBondContact OE1-NE2 3.15Å; T738-H740 PolarHBondContact O-N 3.14Å; H740-W742 VanDerWaalsContact C-N 3.33Å; H740-W742 PolarHBondContact O-N 3.22Å; H740-L743 PolarHBondContact O-N 3.41Å; H740-E744 PolarHBondContact O-N 2.93Å; H740-E776 IonicContact CE1-OE1 2.83Å; H740-E776 IonicContact CG-OE1 3.33Å; H740-E776 IonicContact CG-OE2 3.48Å; H740-E776 IonicContact ND1-OE1 3.05Å; H740-E776 PolarHBondContact ND1-OE1 3Å; H740-E776 IonicContact ND1-OE2 3.62Å
741	T	92.9	Very high	92.2	Very high	3 Å²	3	31.7 Å²	31.7	2%	0.018	18%	0.18	C	C	.	.	H	α-helix	trans	-66	-35.7	180	51.2	0	0	0	0	112.8	M715 Y716 A719 T738 S745	M715-T741 HydrophobicContact CG-CG2 4.38Å; Y716-T741 HydrophobicContact CD2-CG2 4.28Å; A719-T741 HydrophobicContact CB-CG2 4.09Å; T738-T741 PolarHBondContact N-OG1 2.9Å; T738-T741 PolarHBondContact O-N 2.66Å; T738-T741 PolarHBondContact O-OG1 2.91Å; T738-T741 VanDerWaalsContact O-OG1 3.05Å; T738-T741 WeakPolarHBondContact OG1-CB 3.26Å; T738-T741 WeakPolarHBondContact OG1-CG2 3.49Å; T738-T741 PolarHBondContact OG1-N 2.84Å; T738-T741 VanDerWaalsContact OG1-N 3.17Å; T738-T741 PolarHBondContact OG1-OG1 3.25Å; T741-S745 VanDerWaalsContact O-CB 3.3Å; T741-S745 WeakPolarHBondContact O-CB 3.37Å; T741-S745 PolarHBondContact O-N 3.26Å; T741-S745 VanDerWaalsContact O-N 3.09Å; T741-S745 PolarHBondContact O-OG 3.31Å
742	W	94.8	Very high	92.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-64.3	-47.5	172.3	173.9	88	0	0	0	111.4	W737 T738 L739 H740 E744 S745 L746 L761 L762 F765 I768 M785	W737-W742 HydrophobicContact CB-CB 4.17Å; W737-W742 HydrophobicContact CD2-CB 4.13Å; W737-W742 HydrophobicContact CE3-CB 4.03Å; W737-W742 HydrophobicContact CG-CB 4.21Å; T738-W742 WeakPolarHBondContact O-CB 3.19Å; T738-W742 PolarHBondContact O-N 2.93Å; L739-W742 HydrophobicContact CD1-CE3 4.49Å; H740-W742 VanDerWaalsContact C-N 3.33Å; H740-W742 PolarHBondContact O-N 3.22Å; W742-E744 PolarHBondContact O-N 3.06Å; W742-S745 PolarHBondContact O-N 3.02Å; W742-L746 HydrophobicContact CH2-CD2 3.56Å; W742-L746 HydrophobicContact CZ2-CD2 3.81Å; W742-L746 HydrophobicContact CZ3-CD2 4.11Å; W742-L746 WeakPolarHBondContact O-CB 3.35Å; W742-L746 PolarHBondContact O-N 2.99Å; W742-L761 PolarHBondContact NE1-O 3.37Å; W742-L762 HydrophobicContact CZ2-CD2 4.29Å; W742-F765 HydrophobicContact CD2-CD2 4.28Å; W742-F765 AromaticContact CE2-CD2 3.9Å; W742-F765 HydrophobicContact CE3-CD2 4.24Å; W742-F765 AromaticContact CH2-CD2 3.47Å; W742-F765 HydrophobicContact CH2-CD2 3.47Å; W742-F765 VanDerWaalsContact CH2-CD2 3.47Å; W742-F765 AromaticContact CH2-CE2 3.96Å; W742-F765 HydrophobicContact CH2-CE2 3.96Å; W742-F765 HydrophobicContact CH2-CG 4.47Å; W742-F765 HydrophobicContact CZ2-CB 4.05Å; W742-F765 AromaticContact CZ2-CD2 3.5Å; W742-F765 HydrophobicContact CZ2-CD2 3.5Å; W742-F765 VanDerWaalsContact CZ2-CD2 3.5Å; W742-F765 HydrophobicContact CZ2-CE2 4.42Å; W742-F765 HydrophobicContact CZ2-CG 4.21Å; W742-F765 AromaticContact CZ3-CD2 3.86Å; W742-F765 HydrophobicContact CZ3-CD2 3.86Å; W742-F765 HydrophobicContact CZ3-CE2 4.01Å; W742-I768 HydrophobicContact CB-CD1 3.78Å; W742-I768 HydrophobicContact CD2-CD1 3.79Å; W742-I768 HydrophobicContact CE3-CD1 4.1Å; W742-I768 HydrophobicContact CG-CD1 3.63Å; W742-M785 HydrophobicContact CH2-SD 4.21Å
743	L	94	Very high	92.1	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-61.9	-45.1	-177.9	179.5	61	0	0	0	111.6	L739 H740 L746 R747 E776 H780 L784	L739-L743 VanDerWaalsContact O-CB 3.25Å; L739-L743 WeakPolarHBondContact O-CB 3.32Å; L739-L743 PolarHBondContact O-N 2.95Å; H740-L743 PolarHBondContact O-N 3.41Å; L743-L746 WeakPolarHBondContact O-CB 3.34Å; L743-L746 PolarHBondContact O-N 3.21Å; L743-R747 WeakPolarHBondContact O-CB 2.92Å; L743-R747 PolarHBondContact O-N 3.28Å; L743-E776 HydrophobicContact CD2-CG 3.85Å; L743-H780 HydrophobicContact CD2-CB 3.94Å; L743-L784 HydrophobicContact CD1-CD2 3.75Å
744	E	93.9	Very high	92.2	Very high	21 Å²	21	34.4 Å²	34.4	10%	0.098	18%	0.182	C	C	.	.	H	α-helix	trans	-70.4	-34.5	-179.7	-160.1	59.2	-165.1	0	0	111.8	A719 H740 W742 L746 R747 T748	A719-E744 WeakPolarHBondContact O-CG 3.28Å; H740-E744 PolarHBondContact O-N 2.93Å; W742-E744 PolarHBondContact O-N 3.06Å; E744-L746 VanDerWaalsContact C-N 3.35Å; E744-L746 PolarHBondContact O-N 3.21Å; E744-R747 PolarHBondContact O-N 3.15Å; E744-R747 WeakPolarHBondContact OE2-CD 3.23Å; E744-R747 IonicContact OE2-NE 3Å; E744-R747 PolarHBondContact OE2-NE 3.39Å; E744-R747 VanDerWaalsContact OE2-NE 3.1Å; E744-T748 WeakPolarHBondContact O-CB 3.48Å; E744-T748 VanDerWaalsContact O-CG2 3.26Å; E744-T748 WeakPolarHBondContact O-CG2 3.27Å; E744-T748 PolarHBondContact O-N 3.24Å; E744-T748 PolarHBondContact O-OG1 3.35Å
745	S	95.8	Very high	92.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.5	-39.5	170.5	-59.4	0	0	0	0	112.2	T741 W742 T748 C749	T741-S745 VanDerWaalsContact O-CB 3.3Å; T741-S745 WeakPolarHBondContact O-CB 3.37Å; T741-S745 PolarHBondContact O-N 3.26Å; T741-S745 VanDerWaalsContact O-N 3.09Å; T741-S745 PolarHBondContact O-OG 3.31Å; W742-S745 PolarHBondContact O-N 3.02Å; S745-T748 WeakPolarHBondContact CA-OG1 3.45Å; S745-T748 PolarHBondContact O-OG1 2.93Å; S745-C749 WeakPolarHBondContact O-CB 3.49Å; S745-C749 PolarHBondContact O-N 3.38Å; S745-C749 PolarHBondContact O-SG 3.28Å
746	L	96.1	Very high	92.5	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.3	-44.9	176.5	-177.7	65.9	0	0	0	111.1	W742 L743 E744 C749 F750 I758 L761 L762 L784 M785 I788	W742-L746 HydrophobicContact CH2-CD2 3.56Å; W742-L746 HydrophobicContact CZ2-CD2 3.81Å; W742-L746 HydrophobicContact CZ3-CD2 4.11Å; W742-L746 WeakPolarHBondContact O-CB 3.35Å; W742-L746 PolarHBondContact O-N 2.99Å; L743-L746 WeakPolarHBondContact O-CB 3.34Å; L743-L746 PolarHBondContact O-N 3.21Å; E744-L746 VanDerWaalsContact C-N 3.35Å; E744-L746 PolarHBondContact O-N 3.21Å; L746-C749 PolarHBondContact O-N 3.03Å; L746-F750 WeakPolarHBondContact O-CB 3.36Å; L746-F750 PolarHBondContact O-N 2.57Å; L746-I758 HydrophobicContact CD1-CG2 4.01Å; L746-L761 HydrophobicContact CB-CD1 4.42Å; L746-L761 HydrophobicContact CD1-CB 4.28Å; L746-L761 HydrophobicContact CD1-CD1 4.49Å; L746-L762 HydrophobicContact CD1-CD2 4.06Å; L746-L762 HydrophobicContact CD1-CG 4.34Å; L746-L762 HydrophobicContact CD2-CD2 4.09Å; L746-L784 HydrophobicContact CB-CD2 4.37Å; L746-L784 HydrophobicContact CD2-CD2 4.12Å; L746-L784 HydrophobicContact CG-CD2 4.1Å; L746-M785 HydrophobicContact CD2-CG 4.38Å; L746-I788 HydrophobicContact CD1-CD1 3.95Å; L746-I788 HydrophobicContact CD2-CD1 3.95Å; L746-I788 HydrophobicContact CG-CD1 3.86Å
747	R	94.2	Very high	92.6	Very high	75 Å²	75	43.7 Å²	43.7	28%	0.283	21%	0.209	S	C	.	.	H	α-helix	trans	-57.8	-50.5	177.7	-175.4	-170.7	-62.1	-80	-5	111.1	L743 E744 F750 M751 L784	L743-R747 WeakPolarHBondContact O-CB 2.92Å; L743-R747 PolarHBondContact O-N 3.28Å; E744-R747 PolarHBondContact O-N 3.15Å; E744-R747 WeakPolarHBondContact OE2-CD 3.23Å; E744-R747 IonicContact OE2-NE 3Å; E744-R747 PolarHBondContact OE2-NE 3.39Å; E744-R747 VanDerWaalsContact OE2-NE 3.1Å; R747-F750 PolarHBondContact O-N 2.65Å; R747-M751 WeakPolarHBondContact O-CG 3.37Å; R747-M751 PolarHBondContact O-N 3.18Å; R747-L784 HydrophobicContact CB-CD2 3.8Å; R747-L784 HydrophobicContact CG-CD2 4.47Å
748	T	93.1	Very high	92.8	Very high	20 Å²	20	43.7 Å²	43.7	12%	0.123	21%	0.21	C	C	.	.	H	α-helix	trans	-65.3	-41.6	-179.3	48.8	0	0	0	0	111.8	V724 E744 S745 F750 M751 Q752	V724-T748 WeakPolarHBondContact CG2-OG1 3.4Å; E744-T748 WeakPolarHBondContact O-CB 3.48Å; E744-T748 VanDerWaalsContact O-CG2 3.26Å; E744-T748 WeakPolarHBondContact O-CG2 3.27Å; E744-T748 PolarHBondContact O-N 3.24Å; E744-T748 PolarHBondContact O-OG1 3.35Å; S745-T748 WeakPolarHBondContact CA-OG1 3.45Å; S745-T748 PolarHBondContact O-OG1 2.93Å; T748-F750 VanDerWaalsContact C-N 3.31Å; T748-F750 PolarHBondContact O-N 3.09Å; T748-M751 PolarHBondContact O-N 3.04Å; T748-Q752 WeakPolarHBondContact O-CB 3.32Å; T748-Q752 VanDerWaalsContact O-CG 3.32Å; T748-Q752 WeakPolarHBondContact O-CG 3.39Å; T748-Q752 PolarHBondContact O-N 3.44Å
749	C	94.9	Very high	93	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.9	-40.4	172.3	-73.7	0	0	0	0	112.9	V724 S745 L746 Q752 N753 R754 L757 I758 L761	V724-C749 VanDerWaalsContact CG1-SG 3.58Å; S745-C749 WeakPolarHBondContact O-CB 3.49Å; S745-C749 PolarHBondContact O-N 3.38Å; S745-C749 PolarHBondContact O-SG 3.28Å; L746-C749 PolarHBondContact O-N 3.03Å; C749-Q752 CarbonylContact O-C 3.46Å; C749-Q752 PolarHBondContact O-N 3.02Å; C749-N753 PolarHBondContact O-N 3.35Å; C749-N753 VanDerWaalsContact O-N 3.09Å; C749-R754 PolarHBondContact O-N 3.2Å; C749-L757 HydrophobicContact CB-CB 4.5Å; C749-L757 VanDerWaalsContact SG-CB 3.6Å; C749-I758 HydrophobicContact CB-CG1 3.73Å; C749-L761 HydrophobicContact CB-CD1 4.35Å
750	F	93.6	Very high	93.1	Very high	20 Å²	20	45.4 Å²	45.4	9%	0.088	22%	0.224	C	C	.	.	H	α-helix	trans	-66.4	-47.5	178.5	178.9	-118.8	0	0	0	111.6	L746 R747 T748 Q752 N753 I758 L784 Q787 I788 T791	L746-F750 WeakPolarHBondContact O-CB 3.36Å; L746-F750 PolarHBondContact O-N 2.57Å; R747-F750 PolarHBondContact O-N 2.65Å; T748-F750 VanDerWaalsContact C-N 3.31Å; T748-F750 PolarHBondContact O-N 3.09Å; F750-Q752 VanDerWaalsContact C-N 3.29Å; F750-Q752 PolarHBondContact O-N 2.9Å; F750-N753 PolarHBondContact O-N 2.95Å; F750-I758 HydrophobicContact CB-CD1 4.35Å; F750-I758 HydrophobicContact CD2-CD1 4.36Å; F750-L784 HydrophobicContact CB-CD1 4.46Å; F750-L784 HydrophobicContact CD1-CD1 3.71Å; F750-L784 HydrophobicContact CE1-CD1 4.37Å; F750-L784 HydrophobicContact CG-CD1 4.34Å; F750-Q787 HydrophobicContact CE1-CG 3.95Å; F750-Q787 HydrophobicContact CZ-CG 4.03Å; F750-I788 HydrophobicContact CB-CD1 4.35Å; F750-I788 HydrophobicContact CB-CG1 4.29Å; F750-I788 HydrophobicContact CD1-CG1 4.24Å; F750-I788 HydrophobicContact CD2-CB 4.48Å; F750-I788 HydrophobicContact CD2-CD1 4.43Å; F750-I788 HydrophobicContact CD2-CG1 3.55Å; F750-I788 HydrophobicContact CE2-CB 4.43Å; F750-I788 HydrophobicContact CE2-CG1 3.84Å; F750-I788 HydrophobicContact CG-CD1 4.34Å; F750-I788 HydrophobicContact CG-CG1 3.76Å; F750-I788 HydrophobicContact CZ-CG1 4.32Å; F750-T791 VanDerWaalsContact CE2-OG1 3.24Å; F750-T791 WeakPolarHBondContact CE2-OG1 3.28Å; F750-T791 HydrophobicContact CZ-CG2 4.22Å; F750-T791 WeakPolarHBondContact CZ-OG1 3.5Å
751	M	89.6	Confident	93.3	Very high	118 Å²	118	45.3 Å²	45.3	58%	0.581	22%	0.224	S	C	*	.	H	α-helix	trans	-60	-38.6	175.3	-67.9	-66.3	99.5	0	0	112.4	R747 T748 N753	R747-M751 WeakPolarHBondContact O-CG 3.37Å; R747-M751 PolarHBondContact O-N 3.18Å; T748-M751 PolarHBondContact O-N 3.04Å; M751-N753 VanDerWaalsContact C-N 3.27Å; M751-N753 PolarHBondContact O-N 3.48Å
752	Q	90.6	Very high	93.4	Very high	90 Å²	90	45.4 Å²	45.4	42%	0.421	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	1.7	176.7	-66	175.7	5.3	0	0	113.9	T748 C749 F750 R754	T748-Q752 WeakPolarHBondContact O-CB 3.32Å; T748-Q752 VanDerWaalsContact O-CG 3.32Å; T748-Q752 WeakPolarHBondContact O-CG 3.39Å; T748-Q752 PolarHBondContact O-N 3.44Å; C749-Q752 CarbonylContact O-C 3.46Å; C749-Q752 PolarHBondContact O-N 3.02Å; F750-Q752 VanDerWaalsContact C-N 3.29Å; F750-Q752 PolarHBondContact O-N 2.9Å; Q752-R754 HydrophobicContact CB-CG 3.88Å; Q752-R754 PolarHBondContact O-N 2.92Å
753	N	91.6	Very high	93.2	Very high	123 Å²	123	52.7 Å²	52.7	66%	0.658	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	29.6	-176.8	-66.4	-65.9	0	0	0	115.1	C749 F750 M751 R755	C749-N753 PolarHBondContact O-N 3.35Å; C749-N753 VanDerWaalsContact O-N 3.09Å; F750-N753 PolarHBondContact O-N 2.95Å; M751-N753 VanDerWaalsContact C-N 3.27Å; M751-N753 PolarHBondContact O-N 3.48Å; N753-R755 PolarHBondContact O-N 3.05Å
754	R	92.9	Very high	93.1	Very high	85 Å²	85	54.7 Å²	54.7	32%	0.321	27%	0.266	S	S	.	.			trans	-84.5	72.2	-177.1	-63	-173.3	80.5	-173.5	-0.1	112.3	D725 C749 Q752 P756 L757 I758	D725-R754 VanDerWaalsContact CG-NH1 3.27Å; D725-R754 IonicContact OD1-CZ 2.66Å; D725-R754 IonicContact OD1-NH1 3.48Å; D725-R754 PolarHBondContact OD1-NH1 3.49Å; D725-R754 IonicContact OD1-NH2 3.65Å; D725-R754 PolarHBondContact OD1-NH2 3.48Å; D725-R754 IonicContact OD2-CZ 3.35Å; D725-R754 IonicContact OD2-NH1 2.91Å; D725-R754 PolarHBondContact OD2-NH1 3.25Å; D725-R754 IonicContact OD2-NH2 2.88Å; C749-R754 PolarHBondContact O-N 3.2Å; Q752-R754 HydrophobicContact CB-CG 3.88Å; Q752-R754 PolarHBondContact O-N 2.92Å; R754-P756 VanDerWaalsContact C-CD 3.46Å; R754-L757 HydrophobicContact CB-CB 4.42Å; R754-L757 HydrophobicContact CB-CD1 4.21Å; R754-L757 PolarHBondContact O-N 3.27Å; R754-L757 VanDerWaalsContact O-N 3.09Å; R754-I758 PolarHBondContact O-N 3.04Å
755	R	90.4	Very high	93	Very high	166 Å²	166	53.8 Å²	53.8	63%	0.626	26%	0.262	S	S	*	.	H	α-helix	trans	-48.7	-43.8	-174.7	-58.7	179.3	-175.8	174.5	0.8	116.1	N753 L757 I758 Q759	N753-R755 PolarHBondContact O-N 3.05Å; R755-L757 VanDerWaalsContact C-N 3.31Å; R755-L757 PolarHBondContact O-N 3.49Å; R755-I758 WeakPolarHBondContact O-CB 3.32Å; R755-I758 PolarHBondContact O-N 3.44Å; R755-Q759 PolarHBondContact O-N 3.49Å
756	P	92.6	Very high	92.6	Very high	98 Å²	98	57.5 Å²	57.5	64%	0.636	29%	0.288	S	S	*	.	H	α-helix	trans	-64.4	-35.7	-179.2	-22.3	34.6	0	0	0	113	R754 Q759 G760	R754-P756 VanDerWaalsContact C-CD 3.46Å; P756-Q759 PolarHBondContact O-N 2.98Å; P756-G760 PolarHBondContact O-N 2.86Å; P756-G760 VanDerWaalsContact O-N 3.09Å
757	L	93.4	Very high	92.2	Very high	38 Å²	38	59.9 Å²	59.9	20%	0.199	30%	0.304	C	S	.	.	H	α-helix	trans	-71.6	-38.5	176.7	-65.4	-179.7	0	0	0	111.2	V724 I728 C749 R754 R755 Q759 G760 L761	V724-L757 HydrophobicContact CG1-CD1 4.15Å; I728-L757 HydrophobicContact CG1-CD2 4.45Å; C749-L757 HydrophobicContact CB-CB 4.5Å; C749-L757 VanDerWaalsContact SG-CB 3.6Å; R754-L757 HydrophobicContact CB-CB 4.42Å; R754-L757 HydrophobicContact CB-CD1 4.21Å; R754-L757 PolarHBondContact O-N 3.27Å; R754-L757 VanDerWaalsContact O-N 3.09Å; R755-L757 VanDerWaalsContact C-N 3.31Å; R755-L757 PolarHBondContact O-N 3.49Å; L757-Q759 VanDerWaalsContact C-N 3.33Å; L757-Q759 PolarHBondContact O-N 3.47Å; L757-G760 PolarHBondContact O-N 3.26Å; L757-L761 WeakPolarHBondContact O-CB 3.33Å; L757-L761 VanDerWaalsContact O-CG 3.31Å; L757-L761 WeakPolarHBondContact O-CG 3Å; L757-L761 PolarHBondContact O-N 3.26Å
758	I	94.3	Very high	91.8	Very high	6 Å²	6	56.5 Å²	56.5	3%	0.031	29%	0.292	C	S	.	.	H	α-helix	trans	-56.7	-49.2	172.8	-61.1	172.5	0	0	0	109.9	L746 C749 F750 R754 R755 G760 L761 L762 I788 I797	L746-I758 HydrophobicContact CD1-CG2 4.01Å; C749-I758 HydrophobicContact CB-CG1 3.73Å; F750-I758 HydrophobicContact CB-CD1 4.35Å; F750-I758 HydrophobicContact CD2-CD1 4.36Å; R754-I758 PolarHBondContact O-N 3.04Å; R755-I758 WeakPolarHBondContact O-CB 3.32Å; R755-I758 PolarHBondContact O-N 3.44Å; I758-G760 VanDerWaalsContact C-N 3.32Å; I758-G760 PolarHBondContact O-N 2.88Å; I758-L761 PolarHBondContact O-N 2.87Å; I758-L762 HydrophobicContact CG2-CD1 3.85Å; I758-L762 HydrophobicContact CG2-CG 4.19Å; I758-L762 WeakPolarHBondContact O-CB 3.25Å; I758-L762 VanDerWaalsContact O-CG 3.25Å; I758-L762 WeakPolarHBondContact O-CG 3.44Å; I758-L762 PolarHBondContact O-N 2.94Å; I758-I788 HydrophobicContact CG2-CG2 4.38Å; I758-I797 HydrophobicContact CG2-CD1 4.33Å
759	Q	92.8	Very high	91.3	Very high	51 Å²	51	61 Å²	61	24%	0.238	31%	0.312	C	S	.	.	H	α-helix	trans	-60.6	-39.3	178.4	-72.4	176.9	-23.7	0	0	113	R755 P756 L757 K763 N794 I797 Q800	R755-Q759 PolarHBondContact O-N 3.49Å; P756-Q759 PolarHBondContact O-N 2.98Å; L757-Q759 VanDerWaalsContact C-N 3.33Å; L757-Q759 PolarHBondContact O-N 3.47Å; Q759-K763 PolarHBondContact O-N 2.93Å; Q759-N794 PolarHBondContact NE2-ND2 3.21Å; Q759-I797 HydrophobicContact CG-CD1 4.19Å; Q759-I797 HydrophobicContact CG-CG1 3.63Å; Q759-Q800 PolarHBondContact O-NE2 3.37Å; Q759-Q800 PolarHBondContact O-OE1 2.87Å
760	G	92.9	Very high	90.5	Very high	35 Å²	35	65 Å²	65	36%	0.361	33%	0.33	S	S	.	.	H	α-helix	trans	-65	-47	174.9	0	0	0	0	0	112.5	P756 L757 I758 K763 D764	P756-G760 PolarHBondContact O-N 2.86Å; P756-G760 VanDerWaalsContact O-N 3.09Å; L757-G760 PolarHBondContact O-N 3.26Å; I758-G760 VanDerWaalsContact C-N 3.32Å; I758-G760 PolarHBondContact O-N 2.88Å; G760-K763 WeakPolarHBondContact O-CB 3.28Å; G760-K763 PolarHBondContact O-N 2.93Å; G760-D764 PolarHBondContact O-N 3.47Å
761	L	94.3	Very high	89.6	Confident	2 Å²	2	70.8 Å²	70.8	1%	0.01	36%	0.362	C	S	.	.	H	α-helix	trans	-64.5	-42	179.7	-73.3	170.7	0	0	0	112.3	I728 W737 W742 L746 C749 L757 I758 K763 D764 F765	I728-L761 HydrophobicContact CD1-CD2 3.95Å; I728-L761 HydrophobicContact CD1-CG 4.46Å; W737-L761 HydrophobicContact CH2-CD2 3.77Å; W737-L761 HydrophobicContact CZ2-CD2 3.47Å; W737-L761 VanDerWaalsContact CZ2-CD2 3.47Å; W742-L761 PolarHBondContact NE1-O 3.37Å; L746-L761 HydrophobicContact CB-CD1 4.42Å; L746-L761 HydrophobicContact CD1-CB 4.28Å; L746-L761 HydrophobicContact CD1-CD1 4.49Å; C749-L761 HydrophobicContact CB-CD1 4.35Å; L757-L761 WeakPolarHBondContact O-CB 3.33Å; L757-L761 VanDerWaalsContact O-CG 3.31Å; L757-L761 WeakPolarHBondContact O-CG 3Å; L757-L761 PolarHBondContact O-N 3.26Å; I758-L761 PolarHBondContact O-N 2.87Å; L761-K763 VanDerWaalsContact C-N 3.3Å; L761-K763 PolarHBondContact O-N 3.36Å; L761-D764 PolarHBondContact O-N 3.41Å; L761-D764 VanDerWaalsContact O-N 3.14Å; L761-F765 PolarHBondContact O-N 3.29Å
762	L	94.7	Very high	89	Confident	4 Å²	4	69 Å²	69	2%	0.021	35%	0.352	C	S	.	.	H	α-helix	trans	-63.9	-37.1	176.5	-67.1	177.4	0	0	0	111.6	W742 L746 I758 D764 F765 I797 Q800 L801 I804	W742-L762 HydrophobicContact CZ2-CD2 4.29Å; L746-L762 HydrophobicContact CD1-CD2 4.06Å; L746-L762 HydrophobicContact CD1-CG 4.34Å; L746-L762 HydrophobicContact CD2-CD2 4.09Å; I758-L762 HydrophobicContact CG2-CD1 3.85Å; I758-L762 HydrophobicContact CG2-CG 4.19Å; I758-L762 WeakPolarHBondContact O-CB 3.25Å; I758-L762 VanDerWaalsContact O-CG 3.25Å; I758-L762 WeakPolarHBondContact O-CG 3.44Å; I758-L762 PolarHBondContact O-N 2.94Å; L762-D764 VanDerWaalsContact C-N 3.31Å; L762-D764 PolarHBondContact O-N 2.99Å; L762-F765 WeakPolarHBondContact O-CB 3.17Å; L762-F765 PolarHBondContact O-N 3.26Å; L762-I797 HydrophobicContact CD1-CG2 3.82Å; L762-Q800 HydrophobicContact CB-CB 4.02Å; L762-Q800 HydrophobicContact CD1-CB 4.35Å; L762-L801 HydrophobicContact CD1-CD2 4.04Å; L762-L801 HydrophobicContact CD1-CG 3.96Å; L762-L801 HydrophobicContact CD2-CD2 3.65Å; L762-L801 HydrophobicContact CD2-CG 4.45Å; L762-L801 HydrophobicContact CG-CD2 4.49Å; L762-I804 HydrophobicContact CB-CD1 4.1Å; L762-I804 HydrophobicContact CD2-CD1 3.76Å
763	K	92.3	Very high	88.7	Confident	153 Å²	153	65.1 Å²	65.1	67%	0.665	33%	0.334	S	S	*	.	H	α-helix	trans	-64	-37.8	172.9	-172.1	-178.5	177.3	-176.3	0	112.1	Q759 G760 L761 F765	Q759-K763 PolarHBondContact O-N 2.93Å; G760-K763 WeakPolarHBondContact O-CB 3.28Å; G760-K763 PolarHBondContact O-N 2.93Å; L761-K763 VanDerWaalsContact C-N 3.3Å; L761-K763 PolarHBondContact O-N 3.36Å; K763-F765 PolarHBondContact O-N 2.89Å
764	D	91.6	Very high	88.4	Confident	44 Å²	44	61.7 Å²	61.7	24%	0.235	32%	0.317	C	S	.	.	H	α-helix	trans	-73.6	-9.9	-178.6	-94.9	25.1	0	0	0	113.9	R731 W737 G760 L761 L762 S766 C767	R731-D764 IonicContact CZ-OD2 2.64Å; R731-D764 IonicContact NE-OD2 2.78Å; R731-D764 PolarHBondContact NE-OD2 3.3Å; R731-D764 VanDerWaalsContact NE-OD2 3.08Å; R731-D764 IonicContact NH2-OD2 3.43Å; W737-D764 PolarHBondContact NE1-OD2 2.92Å; G760-D764 PolarHBondContact O-N 3.47Å; L761-D764 PolarHBondContact O-N 3.41Å; L761-D764 VanDerWaalsContact O-N 3.14Å; L762-D764 VanDerWaalsContact C-N 3.31Å; L762-D764 PolarHBondContact O-N 2.99Å; D764-S766 PolarHBondContact O-N 3.45Å; D764-S766 VanDerWaalsContact O-N 3.13Å; D764-C767 VanDerWaalsContact O-CB 3.23Å; D764-C767 WeakPolarHBondContact O-CB 3.4Å; D764-C767 PolarHBondContact O-N 2.79Å; D764-C767 PolarHBondContact O-SG 3.43Å
765	F	91.5	Very high	88	Confident	1 Å²	1	64 Å²	64	0%	0.004	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-54.8	-33.6	-179.7	-177	-94.4	0	0	0	112.7	W742 L761 L762 K763 C767 I768 Y773 L777 I804	W742-F765 HydrophobicContact CD2-CD2 4.28Å; W742-F765 AromaticContact CE2-CD2 3.9Å; W742-F765 HydrophobicContact CE3-CD2 4.24Å; W742-F765 AromaticContact CH2-CD2 3.47Å; W742-F765 HydrophobicContact CH2-CD2 3.47Å; W742-F765 VanDerWaalsContact CH2-CD2 3.47Å; W742-F765 AromaticContact CH2-CE2 3.96Å; W742-F765 HydrophobicContact CH2-CE2 3.96Å; W742-F765 HydrophobicContact CH2-CG 4.47Å; W742-F765 HydrophobicContact CZ2-CB 4.05Å; W742-F765 AromaticContact CZ2-CD2 3.5Å; W742-F765 HydrophobicContact CZ2-CD2 3.5Å; W742-F765 VanDerWaalsContact CZ2-CD2 3.5Å; W742-F765 HydrophobicContact CZ2-CE2 4.42Å; W742-F765 HydrophobicContact CZ2-CG 4.21Å; W742-F765 AromaticContact CZ3-CD2 3.86Å; W742-F765 HydrophobicContact CZ3-CD2 3.86Å; W742-F765 HydrophobicContact CZ3-CE2 4.01Å; L761-F765 PolarHBondContact O-N 3.29Å; L762-F765 WeakPolarHBondContact O-CB 3.17Å; L762-F765 PolarHBondContact O-N 3.26Å; K763-F765 PolarHBondContact O-N 2.89Å; F765-C767 PolarHBondContact O-N 3.3Å; F765-I768 HydrophobicContact CD2-CD1 3.99Å; F765-I768 HydrophobicContact CE2-CD1 4.28Å; F765-I768 WeakPolarHBondContact O-CB 3.06Å; F765-I768 PolarHBondContact O-N 2.9Å; F765-Y773 HydrophobicContact CE1-CE1 4.5Å; F765-Y773 WeakPolarHBondContact CE1-OH 3.44Å; F765-Y773 AromaticContact CZ-CE1 3.97Å; F765-Y773 HydrophobicContact CZ-CE1 3.97Å; F765-L777 HydrophobicContact CE2-CD1 4.49Å; F765-I804 HydrophobicContact CB-CD1 3.85Å; F765-I804 HydrophobicContact CB-CG1 3.98Å; F765-I804 HydrophobicContact CD1-CB 4.23Å; F765-I804 HydrophobicContact CD1-CD1 4.48Å; F765-I804 HydrophobicContact CD1-CG1 3.89Å; F765-I804 HydrophobicContact CD1-CG2 3.5Å; F765-I804 VanDerWaalsContact CD1-CG2 3.5Å; F765-I804 HydrophobicContact CD2-CG2 4.24Å; F765-I804 HydrophobicContact CE1-CG2 3.47Å; F765-I804 VanDerWaalsContact CE1-CG2 3.47Å; F765-I804 HydrophobicContact CE2-CG2 4.2Å; F765-I804 HydrophobicContact CG-CD1 4.08Å; F765-I804 HydrophobicContact CG-CG1 4Å; F765-I804 HydrophobicContact CG-CG2 3.9Å; F765-I804 HydrophobicContact CZ-CG2 3.82Å
766	S	87.6	Confident	87.8	Confident	78 Å²	78	57.5 Å²	57.5	55%	0.545	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-63.2	-11.9	177.2	68.6	0	0	0	0	114.3	D764 I768	D764-S766 PolarHBondContact O-N 3.45Å; D764-S766 VanDerWaalsContact O-N 3.13Å; S766-I768 VanDerWaalsContact C-N 3.33Å
767	C	87.5	Confident	87.7	Confident	51 Å²	51	52.8 Å²	52.8	35%	0.345	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-78.9	-18.3	174.1	-59.7	0	0	0	0	112.7	R731 D764 F765	R731-C767 PolarHBondContact NH2-SG 2.74Å; D764-C767 VanDerWaalsContact O-CB 3.23Å; D764-C767 WeakPolarHBondContact O-CB 3.4Å; D764-C767 PolarHBondContact O-N 2.79Å; D764-C767 PolarHBondContact O-SG 3.43Å; F765-C767 PolarHBondContact O-N 3.3Å
768	I	86.4	Confident	87.5	Confident	3 Å²	3	52.3 Å²	52.3	2%	0.015	28%	0.275	C	S	.	.	S	Bend	trans	-83.7	124.6	177.4	-57	166.9	0	0	0	107.6	W737 L739 W742 F765 S766 E772 Y773	W737-I768 HydrophobicContact CB-CG1 4.09Å; L739-I768 HydrophobicContact CB-CG2 4.32Å; L739-I768 HydrophobicContact CD1-CD1 4.47Å; W742-I768 HydrophobicContact CB-CD1 3.78Å; W742-I768 HydrophobicContact CD2-CD1 3.79Å; W742-I768 HydrophobicContact CE3-CD1 4.1Å; W742-I768 HydrophobicContact CG-CD1 3.63Å; F765-I768 HydrophobicContact CD2-CD1 3.99Å; F765-I768 HydrophobicContact CE2-CD1 4.28Å; F765-I768 WeakPolarHBondContact O-CB 3.06Å; F765-I768 PolarHBondContact O-N 2.9Å; S766-I768 VanDerWaalsContact C-N 3.33Å; I768-E772 HydrophobicContact CG2-CB 4.23Å; I768-Y773 HydrophobicContact CG2-CE1 4.4Å
769	Q	81.1	Confident	87.2	Confident	116 Å²	116	55.2 Å²	55.2	54%	0.542	29%	0.294	S	S	.	.			trans	-79	150.4	-178.6	-58.7	-66.6	-33.2	0	0	111	D771 E772	Q769-D771 WeakPolarHBondContact CB-OD1 3.4Å; Q769-D771 PolarHBondContact O-N 3.17Å; Q769-E772 WeakPolarHBondContact O-CB 3.45Å; Q769-E772 PolarHBondContact O-N 3.39Å
770	E	79.1	Confident	87	Confident	84 Å²	84	56.9 Å²	56.9	39%	0.393	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-66.2	-21.9	-176.4	-65.8	-179.8	-173.7	0	0	113.6	E772 Y773 H1018	E770-E772 VanDerWaalsContact C-N 3.28Å; E770-Y773 HydrophobicContact CB-CE2 4.29Å; E770-Y773 HydrophobicContact CG-CE2 4.12Å; E770-Y773 WeakPolarHBondContact O-CB 3.42Å; E770-Y773 PolarHBondContact O-N 3.08Å; E770-H1018 IonicContact OE2-CE1 3.49Å; E770-H1018 PolarHBondContact OE2-CE1 2.93Å
771	D	74	Confident	86.9	Confident	141 Å²	141	55.2 Å²	55.2	75%	0.754	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-74.8	-16.2	173.6	60.7	-42.3	0	0	0	113.1	Q769 Y773	Q769-D771 WeakPolarHBondContact CB-OD1 3.4Å; Q769-D771 PolarHBondContact O-N 3.17Å; D771-Y773 VanDerWaalsContact C-N 3.32Å
772	E	77.4	Confident	86.8	Confident	79 Å²	79	55.1 Å²	55.1	37%	0.369	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-86.8	-0.1	172.9	-61.5	-169.8	-174.8	0	0	113.1	L739 I768 Q769 E770 T774	L739-E772 WeakPolarHBondContact CD2-O 3.39Å; I768-E772 HydrophobicContact CG2-CB 4.23Å; Q769-E772 WeakPolarHBondContact O-CB 3.45Å; Q769-E772 PolarHBondContact O-N 3.39Å; E770-E772 VanDerWaalsContact C-N 3.28Å; E772-T774 PolarHBondContact O-N 3.4Å; E772-T774 VanDerWaalsContact O-N 3.08Å
773	Y	85.1	Confident	86.8	Confident	9 Å²	9	56.9 Å²	56.9	4%	0.035	30%	0.295	C	S	.	.			trans	-67.2	109.7	177.4	-70.3	-1.1	0	0	0	110.7	F765 I768 E770 D771 L777 H1018 L1019	F765-Y773 HydrophobicContact CE1-CE1 4.5Å; F765-Y773 WeakPolarHBondContact CE1-OH 3.44Å; F765-Y773 AromaticContact CZ-CE1 3.97Å; F765-Y773 HydrophobicContact CZ-CE1 3.97Å; I768-Y773 HydrophobicContact CG2-CE1 4.4Å; E770-Y773 HydrophobicContact CB-CE2 4.29Å; E770-Y773 HydrophobicContact CG-CE2 4.12Å; E770-Y773 WeakPolarHBondContact O-CB 3.42Å; E770-Y773 PolarHBondContact O-N 3.08Å; D771-Y773 VanDerWaalsContact C-N 3.32Å; Y773-L777 HydrophobicContact CD1-CD2 3.86Å; Y773-L777 HydrophobicContact CD2-CD2 4.03Å; Y773-L777 HydrophobicContact CE1-CD2 4.18Å; Y773-L777 HydrophobicContact CE2-CD2 4.35Å; Y773-L777 HydrophobicContact CG-CD2 3.78Å; Y773-H1018 AromaticContact CD2-CD2 3.96Å; Y773-H1018 AromaticContact CD2-CG 3.96Å; Y773-L1019 WeakPolarHBondContact O-CD2 3.49Å
774	T	84.5	Confident	86.8	Confident	52 Å²	52	49.8 Å²	49.8	32%	0.319	26%	0.264	S	S	.	.			trans	-102.1	172.1	176.1	67.9	0	0	0	0	111.4	L739 E772 E776 L777	L739-T774 HydrophobicContact CD2-CG2 4.43Å; L739-T774 WeakPolarHBondContact CD2-OG1 3.5Å; E772-T774 PolarHBondContact O-N 3.4Å; E772-T774 VanDerWaalsContact O-N 3.08Å; T774-E776 PolarHBondContact O-N 2.9Å; T774-E776 VanDerWaalsContact O-N 3.13Å; T774-E776 WeakPolarHBondContact OG1-CB 3.3Å; T774-E776 PolarHBondContact OG1-N 2.9Å; T774-L777 WeakPolarHBondContact O-CB 3.44Å; T774-L777 PolarHBondContact O-N 3.45Å; T774-L777 VanDerWaalsContact O-N 3.11Å
775	E	85	Confident	87	Confident	132 Å²	132	47.7 Å²	47.7	62%	0.617	25%	0.253	S	S	*	.	H	α-helix	trans	-57	-24.5	172.6	-163.2	175.5	-163	0	0	112.5	L777 I778 T779	E775-L777 VanDerWaalsContact C-N 3.3Å; E775-L777 PolarHBondContact O-N 3.41Å; E775-I778 WeakPolarHBondContact O-CB 3.23Å; E775-I778 PolarHBondContact O-N 2.94Å; E775-T779 HydrophobicContact CG-CG2 4.12Å; E775-T779 PolarHBondContact O-N 3.2Å; E775-T779 PolarHBondContact O-OG1 2.85Å; E775-T779 VanDerWaalsContact O-OG1 3.14Å
776	E	85.6	Confident	87.1	Confident	30 Å²	30	47.6 Å²	47.6	14%	0.14	25%	0.253	C	S	.	.	H	α-helix	trans	-61.7	-34.3	176.5	-170.8	175.6	-169.9	0	0	112.8	H740 L743 T774 I778 H780 G781	H740-E776 IonicContact CE1-OE1 2.83Å; H740-E776 IonicContact CG-OE1 3.33Å; H740-E776 IonicContact CG-OE2 3.48Å; H740-E776 IonicContact ND1-OE1 3.05Å; H740-E776 PolarHBondContact ND1-OE1 3Å; H740-E776 IonicContact ND1-OE2 3.62Å; L743-E776 HydrophobicContact CD2-CG 3.85Å; T774-E776 PolarHBondContact O-N 2.9Å; T774-E776 VanDerWaalsContact O-N 3.13Å; T774-E776 WeakPolarHBondContact OG1-CB 3.3Å; T774-E776 PolarHBondContact OG1-N 2.9Å; E776-I778 PolarHBondContact O-N 3.37Å; E776-H780 HydrophobicContact CG-CB 4.4Å; E776-H780 WeakPolarHBondContact O-CA 3.33Å; E776-H780 WeakPolarHBondContact O-CB 3.43Å; E776-H780 PolarHBondContact O-N 2.98Å; E776-G781 PolarHBondContact O-N 3.49Å
777	L	90	Very high	87.3	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.246	C	C	.	.	I	π-helix	trans	-61	-37.9	174	179.5	61.1	0	0	0	110.6	L739 F765 Y773 T774 E775 G781 L782 I1014	L739-L777 HydrophobicContact CD1-CB 4.37Å; L739-L777 HydrophobicContact CD1-CD1 4.15Å; L739-L777 HydrophobicContact CD2-CB 3.94Å; F765-L777 HydrophobicContact CE2-CD1 4.49Å; Y773-L777 HydrophobicContact CD1-CD2 3.86Å; Y773-L777 HydrophobicContact CD2-CD2 4.03Å; Y773-L777 HydrophobicContact CE1-CD2 4.18Å; Y773-L777 HydrophobicContact CE2-CD2 4.35Å; Y773-L777 HydrophobicContact CG-CD2 3.78Å; T774-L777 WeakPolarHBondContact O-CB 3.44Å; T774-L777 PolarHBondContact O-N 3.45Å; T774-L777 VanDerWaalsContact O-N 3.11Å; E775-L777 VanDerWaalsContact C-N 3.3Å; E775-L777 PolarHBondContact O-N 3.41Å; L777-G781 CarbonylContact O-C 3.44Å; L777-G781 WeakPolarHBondContact O-CA 3.34Å; L777-G781 PolarHBondContact O-N 3.3Å; L777-G781 VanDerWaalsContact O-N 3.16Å; L777-L782 PolarHBondContact O-N 3.13Å; L777-I1014 HydrophobicContact CD2-CD1 4.24Å
778	I	90	Very high	87.5	Confident	27 Å²	27	45.6 Å²	45.6	14%	0.138	23%	0.23	C	C	.	.	I	π-helix	trans	-77.3	-49	-178.8	-58.8	-179	0	0	0	110.7	E775 E776 P783 A1011 I1014 H1015 L1019	E775-I778 WeakPolarHBondContact O-CB 3.23Å; E775-I778 PolarHBondContact O-N 2.94Å; E776-I778 PolarHBondContact O-N 3.37Å; I778-P783 WeakPolarHBondContact O-CD 3.33Å; I778-A1011 HydrophobicContact CG2-CB 3.61Å; I778-I1014 HydrophobicContact CD1-CB 4.29Å; I778-I1014 HydrophobicContact CD1-CG2 4.03Å; I778-I1014 HydrophobicContact CG1-CB 4.43Å; I778-I1014 HydrophobicContact CG1-CG2 4.1Å; I778-H1015 HydrophobicContact CD1-CB 3.99Å; I778-L1019 HydrophobicContact CD1-CD1 3.43Å; I778-L1019 VanDerWaalsContact CD1-CD1 3.43Å; I778-L1019 HydrophobicContact CG1-CD1 4.43Å
779	T	87.4	Confident	87.7	Confident	68 Å²	68	45.5 Å²	45.5	42%	0.417	23%	0.229	S	C	.	.	I	π-helix	trans	-78.4	-26.5	-172	55.9	0	0	0	0	113.7	E775 P783	E775-T779 HydrophobicContact CG-CG2 4.12Å; E775-T779 PolarHBondContact O-N 3.2Å; E775-T779 PolarHBondContact O-OG1 2.85Å; E775-T779 VanDerWaalsContact O-OG1 3.14Å; T779-P783 WeakPolarHBondContact O-CG 3.4Å
780	H	88	Confident	88.1	Confident	85 Å²	85	45 Å²	45	39%	0.394	22%	0.222	S	C	.	.	I	π-helix	trans	-130	-36.2	-174.5	-66.5	-47.7	0	0	0	113.6	L743 E776 L784	L743-H780 HydrophobicContact CD2-CB 3.94Å; E776-H780 HydrophobicContact CG-CB 4.4Å; E776-H780 WeakPolarHBondContact O-CA 3.33Å; E776-H780 WeakPolarHBondContact O-CB 3.43Å; E776-H780 PolarHBondContact O-N 2.98Å; H780-L784 WeakPolarHBondContact O-CB 3.37Å; H780-L784 PolarHBondContact O-N 3.23Å
781	G	91.5	Very high	88.4	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.227	C	C	.	.	I	π-helix	trans	-67.9	-57.7	-179.2	0	0	0	0	0	114.4	E776 L777 L784 M785	E776-G781 PolarHBondContact O-N 3.49Å; L777-G781 CarbonylContact O-C 3.44Å; L777-G781 WeakPolarHBondContact O-CA 3.34Å; L777-G781 PolarHBondContact O-N 3.3Å; L777-G781 VanDerWaalsContact O-N 3.16Å; G781-L784 PolarHBondContact O-N 2.77Å; G781-M785 WeakPolarHBondContact O-CG 3.38Å; G781-M785 PolarHBondContact O-N 3.01Å
782	L	93.3	Very high	88.8	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.3	-49.1	179.3	-65.6	-174.5	0	0	0	112.1	L777 L784 M785 F786 F805 E1007 L1010 A1011 I1014	L777-L782 PolarHBondContact O-N 3.13Å; L782-L784 VanDerWaalsContact C-N 3.27Å; L782-L784 PolarHBondContact O-N 3.49Å; L782-M785 PolarHBondContact O-N 3.49Å; L782-M785 VanDerWaalsContact O-N 3.12Å; L782-F786 HydrophobicContact CB-CD2 4.41Å; L782-F786 VanDerWaalsContact O-CD2 3.32Å; L782-F786 WeakPolarHBondContact O-CD2 3.26Å; L782-F786 PolarHBondContact O-N 2.86Å; L782-F805 HydrophobicContact CD2-CE1 4.33Å; L782-E1007 HydrophobicContact CB-CG 4.25Å; L782-L1010 HydrophobicContact CD1-CB 4.2Å; L782-L1010 HydrophobicContact CD1-CD2 4.11Å; L782-L1010 HydrophobicContact CD1-CG 3.98Å; L782-L1010 HydrophobicContact CD2-CD2 3.55Å; L782-L1010 HydrophobicContact CD2-CG 4.26Å; L782-L1010 HydrophobicContact CG-CD2 4.47Å; L782-A1011 HydrophobicContact CD1-CB 4.09Å; L782-I1014 HydrophobicContact CD1-CD1 3.97Å; L782-I1014 HydrophobicContact CD2-CD1 4.34Å; L782-I1014 HydrophobicContact CG-CD1 4.45Å
783	P	93.8	Very high	88.9	Confident	41 Å²	41	44.7 Å²	44.7	27%	0.266	22%	0.221	S	C	.	.	H	α-helix	trans	-54.8	-43.3	176.7	-24.4	30.2	0	0	0	112.8	I778 T779 Q787 E1007	I778-P783 WeakPolarHBondContact O-CD 3.33Å; T779-P783 WeakPolarHBondContact O-CG 3.4Å; P783-Q787 VanDerWaalsContact O-CB 3.23Å; P783-Q787 WeakPolarHBondContact O-CB 3.38Å; P783-Q787 PolarHBondContact O-N 3.46Å; P783-E1007 WeakPolarHBondContact CG-OE1 3.34Å
784	L	93.1	Very high	88.9	Confident	4 Å²	4	46.5 Å²	46.5	2%	0.021	23%	0.231	C	C	.	.	H	α-helix	trans	-63.9	-46.4	177.7	177	66.1	0	0	0	111.4	L743 L746 R747 F750 H780 G781 L782 Q787 I788	L743-L784 HydrophobicContact CD1-CD2 3.75Å; L746-L784 HydrophobicContact CB-CD2 4.37Å; L746-L784 HydrophobicContact CD2-CD2 4.12Å; L746-L784 HydrophobicContact CG-CD2 4.1Å; R747-L784 HydrophobicContact CB-CD2 3.8Å; R747-L784 HydrophobicContact CG-CD2 4.47Å; F750-L784 HydrophobicContact CB-CD1 4.46Å; F750-L784 HydrophobicContact CD1-CD1 3.71Å; F750-L784 HydrophobicContact CE1-CD1 4.37Å; F750-L784 HydrophobicContact CG-CD1 4.34Å; H780-L784 WeakPolarHBondContact O-CB 3.37Å; H780-L784 PolarHBondContact O-N 3.23Å; G781-L784 PolarHBondContact O-N 2.77Å; L782-L784 VanDerWaalsContact C-N 3.27Å; L782-L784 PolarHBondContact O-N 3.49Å; L784-Q787 WeakPolarHBondContact O-CB 3.19Å; L784-Q787 PolarHBondContact O-N 2.7Å; L784-I788 HydrophobicContact CD1-CD1 4.32Å; L784-I788 HydrophobicContact CD1-CG1 4.46Å; L784-I788 HydrophobicContact CG-CD1 4.02Å; L784-I788 VanDerWaalsContact O-CG1 3.26Å; L784-I788 WeakPolarHBondContact O-CG1 3.43Å; L784-I788 PolarHBondContact O-N 3.33Å
785	M	95	Very high	89.1	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.9	-42.4	179.6	-75.1	176.8	67.4	0	0	112.8	W742 L746 G781 L782 Q787 I788 L789 L801 I804 F805	W742-M785 HydrophobicContact CH2-SD 4.21Å; L746-M785 HydrophobicContact CD2-CG 4.38Å; G781-M785 WeakPolarHBondContact O-CG 3.38Å; G781-M785 PolarHBondContact O-N 3.01Å; L782-M785 PolarHBondContact O-N 3.49Å; L782-M785 VanDerWaalsContact O-N 3.12Å; M785-Q787 VanDerWaalsContact C-N 3.32Å; M785-I788 PolarHBondContact O-N 3.34Å; M785-L789 PolarHBondContact O-N 3.34Å; M785-L801 HydrophobicContact CB-CD2 3.97Å; M785-L801 HydrophobicContact CE-CD2 3.56Å; M785-L801 HydrophobicContact CG-CD2 4.04Å; M785-I804 HydrophobicContact CE-CB 3.63Å; M785-I804 HydrophobicContact CE-CD1 3.9Å; M785-I804 HydrophobicContact CE-CG1 4.39Å; M785-I804 HydrophobicContact CE-CG2 3.26Å; M785-I804 HydrophobicContact SD-CG2 4.21Å; M785-F805 HydrophobicContact CB-CE1 3.79Å; M785-F805 HydrophobicContact CB-CZ 3.83Å; M785-F805 HydrophobicContact CE-CD1 3.79Å; M785-F805 HydrophobicContact CE-CE1 3.38Å; M785-F805 HydrophobicContact CE-CZ 4Å; M785-F805 HydrophobicContact SD-CE1 4.19Å
786	F	93.2	Very high	89.4	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.7	-34	174.6	-84.1	-81.6	0	0	0	111.6	L782 L789 R790 F805 L967 L1003 L1006 E1007 L1010	L782-F786 HydrophobicContact CB-CD2 4.41Å; L782-F786 VanDerWaalsContact O-CD2 3.32Å; L782-F786 WeakPolarHBondContact O-CD2 3.26Å; L782-F786 PolarHBondContact O-N 2.86Å; F786-L789 PolarHBondContact O-N 3.41Å; F786-R790 WeakPolarHBondContact O-CB 3.49Å; F786-R790 PolarHBondContact O-N 2.64Å; F786-F805 HydrophobicContact CD1-CZ 4.26Å; F786-F805 AromaticContact CD2-CE1 3.96Å; F786-F805 HydrophobicContact CD2-CE1 3.96Å; F786-F805 AromaticContact CD2-CZ 3.87Å; F786-F805 HydrophobicContact CD2-CZ 3.87Å; F786-F805 HydrophobicContact CE1-CE2 4.22Å; F786-F805 HydrophobicContact CE1-CZ 4.2Å; F786-F805 HydrophobicContact CE2-CD1 4.18Å; F786-F805 AromaticContact CE2-CE1 3.62Å; F786-F805 HydrophobicContact CE2-CE1 3.62Å; F786-F805 HydrophobicContact CE2-CE2 4.46Å; F786-F805 AromaticContact CE2-CZ 3.78Å; F786-F805 HydrophobicContact CE2-CZ 3.78Å; F786-F805 HydrophobicContact CG-CZ 4.1Å; F786-F805 HydrophobicContact CZ-CD1 4.38Å; F786-F805 HydrophobicContact CZ-CD2 4.49Å; F786-F805 HydrophobicContact CZ-CE1 4.07Å; F786-F805 HydrophobicContact CZ-CE2 4.18Å; F786-F805 AromaticContact CZ-CZ 3.96Å; F786-F805 HydrophobicContact CZ-CZ 3.96Å; F786-L967 HydrophobicContact CZ-CD2 4.49Å; F786-L1003 HydrophobicContact CD1-CB 4.19Å; F786-L1003 HydrophobicContact CD1-CD2 4.07Å; F786-L1003 HydrophobicContact CE1-CD2 4.41Å; F786-L1006 HydrophobicContact CE1-CB 3.79Å; F786-L1006 HydrophobicContact CZ-CB 3.94Å; F786-E1007 HydrophobicContact CD2-CB 3.72Å; F786-E1007 HydrophobicContact CD2-CG 3.85Å; F786-E1007 HydrophobicContact CE2-CB 3.82Å; F786-E1007 HydrophobicContact CE2-CG 4.21Å; F786-E1007 HydrophobicContact CG-CB 4.13Å; F786-E1007 HydrophobicContact CG-CG 4.49Å; F786-E1007 HydrophobicContact CZ-CB 4.29Å; F786-L1010 HydrophobicContact CE2-CD2 4.23Å
787	Q	91.6	Very high	89.6	Confident	86 Å²	86	45.4 Å²	45.4	40%	0.402	23%	0.227	S	C	.	.	H	α-helix	trans	-66	-40.9	171.4	-173.3	176.4	5.8	0	0	112	F750 P783 L784 M785 L789 R790 T791	F750-Q787 HydrophobicContact CE1-CG 3.95Å; F750-Q787 HydrophobicContact CZ-CG 4.03Å; P783-Q787 VanDerWaalsContact O-CB 3.23Å; P783-Q787 WeakPolarHBondContact O-CB 3.38Å; P783-Q787 PolarHBondContact O-N 3.46Å; L784-Q787 WeakPolarHBondContact O-CB 3.19Å; L784-Q787 PolarHBondContact O-N 2.7Å; M785-Q787 VanDerWaalsContact C-N 3.32Å; Q787-L789 VanDerWaalsContact C-N 3.35Å; Q787-R790 PolarHBondContact O-N 3.21Å; Q787-T791 WeakPolarHBondContact O-CB 3.35Å; Q787-T791 WeakPolarHBondContact O-CG2 3.25Å; Q787-T791 PolarHBondContact O-N 2.78Å; Q787-T791 PolarHBondContact O-OG1 2.67Å
788	I	92.1	Very high	89.7	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-61.6	-45.2	172	-65.7	164.4	0	0	0	109.4	L746 F750 I758 L784 M785 R790 T791 S792 I797 L801	L746-I788 HydrophobicContact CD1-CD1 3.95Å; L746-I788 HydrophobicContact CD2-CD1 3.95Å; L746-I788 HydrophobicContact CG-CD1 3.86Å; F750-I788 HydrophobicContact CB-CD1 4.35Å; F750-I788 HydrophobicContact CB-CG1 4.29Å; F750-I788 HydrophobicContact CD1-CG1 4.24Å; F750-I788 HydrophobicContact CD2-CB 4.48Å; F750-I788 HydrophobicContact CD2-CD1 4.43Å; F750-I788 HydrophobicContact CD2-CG1 3.55Å; F750-I788 HydrophobicContact CE2-CB 4.43Å; F750-I788 HydrophobicContact CE2-CG1 3.84Å; F750-I788 HydrophobicContact CG-CD1 4.34Å; F750-I788 HydrophobicContact CG-CG1 3.76Å; F750-I788 HydrophobicContact CZ-CG1 4.32Å; I758-I788 HydrophobicContact CG2-CG2 4.38Å; L784-I788 HydrophobicContact CD1-CD1 4.32Å; L784-I788 HydrophobicContact CD1-CG1 4.46Å; L784-I788 HydrophobicContact CG-CD1 4.02Å; L784-I788 VanDerWaalsContact O-CG1 3.26Å; L784-I788 WeakPolarHBondContact O-CG1 3.43Å; L784-I788 PolarHBondContact O-N 3.33Å; M785-I788 PolarHBondContact O-N 3.34Å; I788-R790 PolarHBondContact O-N 3.46Å; I788-T791 PolarHBondContact O-N 3.49Å; I788-T791 PolarHBondContact O-OG1 3.43Å; I788-S792 WeakPolarHBondContact O-CA 3.32Å; I788-S792 WeakPolarHBondContact O-CB 3.43Å; I788-S792 PolarHBondContact O-N 2.97Å; I788-S792 PolarHBondContact O-OG 2.88Å; I788-I797 HydrophobicContact CG2-CG2 3.75Å; I788-L801 HydrophobicContact CB-CD1 4.28Å; I788-L801 HydrophobicContact CG2-CD1 3.95Å
789	L	90.8	Very high	89.8	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-58.5	-47.7	176.9	-174.4	65.3	0	0	0	111.1	M785 F786 Q787 T791 L801 F805 M970 Y984 L1003	M785-L789 PolarHBondContact O-N 3.34Å; F786-L789 PolarHBondContact O-N 3.41Å; Q787-L789 VanDerWaalsContact C-N 3.35Å; L789-T791 VanDerWaalsContact C-N 3.35Å; L789-T791 PolarHBondContact O-N 3.46Å; L789-L801 HydrophobicContact CB-CD1 3.82Å; L789-L801 HydrophobicContact CD1-CD1 4.11Å; L789-F805 HydrophobicContact CD2-CE2 4.1Å; L789-M970 HydrophobicContact CD2-CE 3.81Å; L789-Y984 WeakPolarHBondContact O-CE1 3.48Å; L789-L1003 HydrophobicContact CD2-CD2 3.86Å
790	R	88.9	Confident	90.1	Very high	105 Å²	105	46.8 Å²	46.8	40%	0.396	23%	0.228	S	C	.	.	H	α-helix	trans	-61.4	-40.9	-179.1	-169.8	-177.5	-72	119.3	-2.6	112.5	F786 Q787 I788 D1001 L1003	F786-R790 WeakPolarHBondContact O-CB 3.49Å; F786-R790 PolarHBondContact O-N 2.64Å; Q787-R790 PolarHBondContact O-N 3.21Å; I788-R790 PolarHBondContact O-N 3.46Å; R790-D1001 IonicContact CZ-OD2 3.66Å; R790-D1001 IonicContact NE-OD2 3.43Å; R790-D1001 IonicContact NH2-OD1 3.1Å; R790-D1001 IonicContact NH2-OD2 3.55Å; R790-D1001 PolarHBondContact NH2-OD2 3.14Å; R790-L1003 HydrophobicContact CB-CD1 3.79Å; R790-L1003 HydrophobicContact CG-CD1 3.88Å
791	T	87.1	Confident	90.4	Very high	78 Å²	78	42.8 Å²	42.8	48%	0.479	21%	0.21	S	C	.	.	H	α-helix	trans	-88.7	-29	-174.8	53.9	0	0	0	0	113.1	F750 Q787 I788 L789 K793	F750-T791 VanDerWaalsContact CE2-OG1 3.24Å; F750-T791 WeakPolarHBondContact CE2-OG1 3.28Å; F750-T791 HydrophobicContact CZ-CG2 4.22Å; F750-T791 WeakPolarHBondContact CZ-OG1 3.5Å; Q787-T791 WeakPolarHBondContact O-CB 3.35Å; Q787-T791 WeakPolarHBondContact O-CG2 3.25Å; Q787-T791 PolarHBondContact O-N 2.78Å; Q787-T791 PolarHBondContact O-OG1 2.67Å; I788-T791 PolarHBondContact O-N 3.49Å; I788-T791 PolarHBondContact O-OG1 3.43Å; L789-T791 VanDerWaalsContact C-N 3.35Å; L789-T791 PolarHBondContact O-N 3.46Å; T791-K793 PolarHBondContact O-N 2.91Å
792	S	81.7	Confident	90.4	Very high	15 Å²	15	42.8 Å²	42.8	11%	0.105	21%	0.21	C	C	.	.			trans	-82	119.8	-178.4	75.4	0	0	0	0	110.9	I788 I797	I788-S792 WeakPolarHBondContact O-CA 3.32Å; I788-S792 WeakPolarHBondContact O-CB 3.43Å; I788-S792 PolarHBondContact O-N 2.97Å; I788-S792 PolarHBondContact O-OG 2.88Å; S792-I797 WeakPolarHBondContact OG-CG2 3.38Å
793	K	78.9	Confident	90.5	Very high	205 Å²	205	46.2 Å²	46.2	89%	0.891	23%	0.231	S	C	*	.			trans	-90.2	15.9	168.9	-60.1	-174	178.9	-175.6	0	112.3	T791	T791-K793 PolarHBondContact O-N 2.91Å
794	N	86.1	Confident	90.5	Very high	47 Å²	47	44.5 Å²	44.5	25%	0.251	22%	0.219	S	C	.	.			trans	-97.2	116.1	-173.2	-175.3	-51.7	0	0	0	109.3	Q759 V796 I797 S798	Q759-N794 PolarHBondContact NE2-ND2 3.21Å; N794-V796 VanDerWaalsContact C-N 3.25Å; N794-V796 PolarHBondContact O-N 3.36Å; N794-V796 WeakPolarHBondContact OD1-CB 3.44Å; N794-V796 PolarHBondContact OD1-N 2.97Å; N794-I797 HydrophobicContact CB-CB 4.22Å; N794-I797 HydrophobicContact CB-CD1 3.99Å; N794-I797 HydrophobicContact CB-CG1 4.08Å; N794-I797 PolarHBondContact O-N 2.68Å; N794-I797 VanDerWaalsContact O-N 3.1Å; N794-I797 PolarHBondContact OD1-N 2.87Å; N794-S798 PolarHBondContact O-N 3.5Å; N794-S798 PolarHBondContact O-OG 3.02Å
795	E	87.8	Confident	90.5	Very high	121 Å²	121	44.3 Å²	44.3	57%	0.565	22%	0.218	S	C	*	.	H	α-helix	trans	-59.9	-34.6	-175.8	-59.9	-165.3	135.9	0	0	113.1	I797 S798 Q799 K980	E795-I797 PolarHBondContact O-N 3.15Å; E795-S798 PolarHBondContact O-N 3.16Å; E795-Q799 WeakPolarHBondContact O-CB 3.49Å; E795-Q799 VanDerWaalsContact O-CG 3.29Å; E795-Q799 WeakPolarHBondContact O-CG 3.09Å; E795-Q799 PolarHBondContact O-N 2.97Å; E795-K980 IonicContact OE1-NZ 3.51Å; E795-K980 PolarHBondContact OE1-NZ 3.41Å
796	V	91.4	Very high	90.4	Very high	66 Å²	66	46 Å²	46	40%	0.4	23%	0.228	S	C	.	.	H	α-helix	trans	-65.9	-41.1	178.2	-177.3	0	0	0	0	110.9	N794 Q799 Q800	N794-V796 VanDerWaalsContact C-N 3.25Å; N794-V796 PolarHBondContact O-N 3.36Å; N794-V796 WeakPolarHBondContact OD1-CB 3.44Å; N794-V796 PolarHBondContact OD1-N 2.97Å; V796-Q799 PolarHBondContact O-N 3.17Å; V796-Q800 WeakPolarHBondContact O-CB 3.45Å; V796-Q800 VanDerWaalsContact O-CG 3.29Å; V796-Q800 WeakPolarHBondContact O-CG 3.25Å; V796-Q800 PolarHBondContact O-N 2.98Å
797	I	90.9	Very high	90.2	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-66.3	-45.2	177.2	-65.4	179	0	0	0	109.6	I758 Q759 L762 I788 S792 N794 E795 Q799 Q800 L801	I758-I797 HydrophobicContact CG2-CD1 4.33Å; Q759-I797 HydrophobicContact CG-CD1 4.19Å; Q759-I797 HydrophobicContact CG-CG1 3.63Å; L762-I797 HydrophobicContact CD1-CG2 3.82Å; I788-I797 HydrophobicContact CG2-CG2 3.75Å; S792-I797 WeakPolarHBondContact OG-CG2 3.38Å; N794-I797 HydrophobicContact CB-CB 4.22Å; N794-I797 HydrophobicContact CB-CD1 3.99Å; N794-I797 HydrophobicContact CB-CG1 4.08Å; N794-I797 PolarHBondContact O-N 2.68Å; N794-I797 VanDerWaalsContact O-N 3.1Å; N794-I797 PolarHBondContact OD1-N 2.87Å; E795-I797 PolarHBondContact O-N 3.15Å; I797-Q799 VanDerWaalsContact C-N 3.34Å; I797-Q799 PolarHBondContact O-N 3.47Å; I797-Q800 PolarHBondContact O-N 3.27Å; I797-L801 HydrophobicContact CG2-CD1 3.85Å; I797-L801 HydrophobicContact CG2-CG 4.36Å; I797-L801 WeakPolarHBondContact O-CB 3.33Å; I797-L801 WeakPolarHBondContact O-CG 3.4Å; I797-L801 PolarHBondContact O-N 3.19Å
798	S	91.3	Very high	90.1	Very high	6 Å²	6	44.6 Å²	44.6	4%	0.042	22%	0.222	C	C	.	.	H	α-helix	trans	-61.3	-41.4	177.2	-56.2	0	0	0	0	112.3	N794 E795 L801 S802 Y984	N794-S798 PolarHBondContact O-N 3.5Å; N794-S798 PolarHBondContact O-OG 3.02Å; E795-S798 PolarHBondContact O-N 3.16Å; S798-L801 PolarHBondContact O-N 3.07Å; S798-S802 WeakPolarHBondContact O-CB 3.49Å; S798-S802 PolarHBondContact O-N 3.29Å; S798-Y984 PolarHBondContact OG-OH 3.46Å
799	Q	92.1	Very high	90	Very high	81 Å²	81	44.8 Å²	44.8	38%	0.379	22%	0.223	S	C	.	.	H	α-helix	trans	-63.1	-47.4	174.5	-77.8	177.2	-14.5	0	0	111.5	E795 V796 I797 L801 S802 V803 I974	E795-Q799 WeakPolarHBondContact O-CB 3.49Å; E795-Q799 VanDerWaalsContact O-CG 3.29Å; E795-Q799 WeakPolarHBondContact O-CG 3.09Å; E795-Q799 PolarHBondContact O-N 2.97Å; V796-Q799 PolarHBondContact O-N 3.17Å; I797-Q799 VanDerWaalsContact C-N 3.34Å; I797-Q799 PolarHBondContact O-N 3.47Å; Q799-L801 PolarHBondContact O-N 3.14Å; Q799-S802 PolarHBondContact O-N 3.48Å; Q799-S802 PolarHBondContact O-OG 3.03Å; Q799-V803 WeakPolarHBondContact O-CG2 3.46Å; Q799-V803 PolarHBondContact O-N 2.86Å; Q799-V803 VanDerWaalsContact O-N 3.08Å; Q799-I974 HydrophobicContact CG-CG2 4.21Å
800	Q	93.6	Very high	89.8	Confident	37 Å²	37	45.1 Å²	45.1	17%	0.173	23%	0.226	C	C	.	.	H	α-helix	trans	-62.1	-43.4	177.6	-73	176.5	-30.2	0	0	112.3	Q759 L762 V796 I797 S802 V803 I804	Q759-Q800 PolarHBondContact O-NE2 3.37Å; Q759-Q800 PolarHBondContact O-OE1 2.87Å; L762-Q800 HydrophobicContact CB-CB 4.02Å; L762-Q800 HydrophobicContact CD1-CB 4.35Å; V796-Q800 WeakPolarHBondContact O-CB 3.45Å; V796-Q800 VanDerWaalsContact O-CG 3.29Å; V796-Q800 WeakPolarHBondContact O-CG 3.25Å; V796-Q800 PolarHBondContact O-N 2.98Å; I797-Q800 PolarHBondContact O-N 3.27Å; Q800-S802 VanDerWaalsContact C-N 3.31Å; Q800-S802 PolarHBondContact O-N 3.33Å; Q800-V803 WeakPolarHBondContact O-CB 3.44Å; Q800-V803 PolarHBondContact O-N 2.82Å; Q800-I804 WeakPolarHBondContact O-CG1 3.37Å; Q800-I804 PolarHBondContact O-N 3.15Å; Q800-I804 VanDerWaalsContact O-N 3.07Å
801	L	93.9	Very high	89.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.8	-40	175	-72.4	171.3	0	0	0	111.7	L762 M785 I788 L789 I797 S798 Q799 V803 I804 F805	L762-L801 HydrophobicContact CD1-CD2 4.04Å; L762-L801 HydrophobicContact CD1-CG 3.96Å; L762-L801 HydrophobicContact CD2-CD2 3.65Å; L762-L801 HydrophobicContact CD2-CG 4.45Å; L762-L801 HydrophobicContact CG-CD2 4.49Å; M785-L801 HydrophobicContact CB-CD2 3.97Å; M785-L801 HydrophobicContact CE-CD2 3.56Å; M785-L801 HydrophobicContact CG-CD2 4.04Å; I788-L801 HydrophobicContact CB-CD1 4.28Å; I788-L801 HydrophobicContact CG2-CD1 3.95Å; L789-L801 HydrophobicContact CB-CD1 3.82Å; L789-L801 HydrophobicContact CD1-CD1 4.11Å; I797-L801 HydrophobicContact CG2-CD1 3.85Å; I797-L801 HydrophobicContact CG2-CG 4.36Å; I797-L801 WeakPolarHBondContact O-CB 3.33Å; I797-L801 WeakPolarHBondContact O-CG 3.4Å; I797-L801 PolarHBondContact O-N 3.19Å; S798-L801 PolarHBondContact O-N 3.07Å; Q799-L801 PolarHBondContact O-N 3.14Å; L801-V803 VanDerWaalsContact C-N 3.3Å; L801-V803 PolarHBondContact O-N 3.32Å; L801-I804 PolarHBondContact O-N 2.49Å; L801-F805 HydrophobicContact CB-CD2 4.34Å; L801-F805 HydrophobicContact CB-CE2 3.9Å; L801-F805 HydrophobicContact CB-CZ 4.4Å; L801-F805 HydrophobicContact CD2-CZ 4.43Å; L801-F805 WeakPolarHBondContact O-CD2 3.02Å; L801-F805 VanDerWaalsContact O-CG 3.23Å; L801-F805 WeakPolarHBondContact O-CG 3.23Å; L801-F805 PolarHBondContact O-N 3.09Å
802	S	92.7	Very high	89.4	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61	-39.3	176.3	76.6	0	0	0	0	112.3	S798 Q799 Q800 F805 T806 V971	S798-S802 WeakPolarHBondContact O-CB 3.49Å; S798-S802 PolarHBondContact O-N 3.29Å; Q799-S802 PolarHBondContact O-N 3.48Å; Q799-S802 PolarHBondContact O-OG 3.03Å; Q800-S802 VanDerWaalsContact C-N 3.31Å; Q800-S802 PolarHBondContact O-N 3.33Å; S802-F805 PolarHBondContact O-N 3.38Å; S802-T806 WeakPolarHBondContact O-CB 2.96Å; S802-T806 PolarHBondContact O-N 3.02Å; S802-T806 PolarHBondContact O-OG1 2.82Å; S802-T806 VanDerWaalsContact O-OG1 3.08Å; S802-V971 WeakPolarHBondContact OG-CA 3.41Å
803	V	93.9	Very high	89.5	Confident	73 Å²	73	50 Å²	50	44%	0.442	26%	0.262	S	S	.	.	H	α-helix	trans	-63.2	-45.7	174.9	173.8	0	0	0	0	110.4	Q799 Q800 L801 T806 Q807 V971	Q799-V803 WeakPolarHBondContact O-CG2 3.46Å; Q799-V803 PolarHBondContact O-N 2.86Å; Q799-V803 VanDerWaalsContact O-N 3.08Å; Q800-V803 WeakPolarHBondContact O-CB 3.44Å; Q800-V803 PolarHBondContact O-N 2.82Å; L801-V803 VanDerWaalsContact C-N 3.3Å; L801-V803 PolarHBondContact O-N 3.32Å; V803-T806 PolarHBondContact O-N 3.14Å; V803-Q807 WeakPolarHBondContact O-CB 3.41Å; V803-Q807 PolarHBondContact O-N 3.39Å; V803-V971 HydrophobicContact CB-CG2 4.45Å; V803-V971 HydrophobicContact CG2-CG1 4.41Å; V803-V971 HydrophobicContact CG2-CG2 3.88Å
804	I	93.6	Very high	90	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-63.9	-46.4	178.8	-61.2	165.9	0	0	0	110.8	L762 F765 M785 Q800 L801 T806 Q807 C808	L762-I804 HydrophobicContact CB-CD1 4.1Å; L762-I804 HydrophobicContact CD2-CD1 3.76Å; F765-I804 HydrophobicContact CB-CD1 3.85Å; F765-I804 HydrophobicContact CB-CG1 3.98Å; F765-I804 HydrophobicContact CD1-CB 4.23Å; F765-I804 HydrophobicContact CD1-CD1 4.48Å; F765-I804 HydrophobicContact CD1-CG1 3.89Å; F765-I804 HydrophobicContact CD1-CG2 3.5Å; F765-I804 VanDerWaalsContact CD1-CG2 3.5Å; F765-I804 HydrophobicContact CD2-CG2 4.24Å; F765-I804 HydrophobicContact CE1-CG2 3.47Å; F765-I804 VanDerWaalsContact CE1-CG2 3.47Å; F765-I804 HydrophobicContact CE2-CG2 4.2Å; F765-I804 HydrophobicContact CG-CD1 4.08Å; F765-I804 HydrophobicContact CG-CG1 4Å; F765-I804 HydrophobicContact CG-CG2 3.9Å; F765-I804 HydrophobicContact CZ-CG2 3.82Å; M785-I804 HydrophobicContact CE-CB 3.63Å; M785-I804 HydrophobicContact CE-CD1 3.9Å; M785-I804 HydrophobicContact CE-CG1 4.39Å; M785-I804 HydrophobicContact CE-CG2 3.26Å; M785-I804 HydrophobicContact SD-CG2 4.21Å; Q800-I804 WeakPolarHBondContact O-CG1 3.37Å; Q800-I804 PolarHBondContact O-N 3.15Å; Q800-I804 VanDerWaalsContact O-N 3.07Å; L801-I804 PolarHBondContact O-N 2.49Å; I804-T806 VanDerWaalsContact C-N 3.32Å; I804-T806 PolarHBondContact O-N 3.08Å; I804-Q807 WeakPolarHBondContact O-CB 3.41Å; I804-Q807 PolarHBondContact O-N 3.16Å; I804-Q807 VanDerWaalsContact O-N 3.14Å; I804-C808 WeakPolarHBondContact O-CB 3.41Å; I804-C808 PolarHBondContact O-N 2.72Å; I804-C808 PolarHBondContact O-SG 3.3Å; I804-C808 VanDerWaalsContact O-SG 3.35Å
805	F	93.9	Very high	89.9	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.1	-39.9	179.5	-64	-38.6	0	0	0	112.2	L782 M785 F786 L789 L801 S802 Y809 L967 M970 L1010	L782-F805 HydrophobicContact CD2-CE1 4.33Å; M785-F805 HydrophobicContact CB-CE1 3.79Å; M785-F805 HydrophobicContact CB-CZ 3.83Å; M785-F805 HydrophobicContact CE-CD1 3.79Å; M785-F805 HydrophobicContact CE-CE1 3.38Å; M785-F805 HydrophobicContact CE-CZ 4Å; M785-F805 HydrophobicContact SD-CE1 4.19Å; F786-F805 HydrophobicContact CD1-CZ 4.26Å; F786-F805 AromaticContact CD2-CE1 3.96Å; F786-F805 HydrophobicContact CD2-CE1 3.96Å; F786-F805 AromaticContact CD2-CZ 3.87Å; F786-F805 HydrophobicContact CD2-CZ 3.87Å; F786-F805 HydrophobicContact CE1-CE2 4.22Å; F786-F805 HydrophobicContact CE1-CZ 4.2Å; F786-F805 HydrophobicContact CE2-CD1 4.18Å; F786-F805 AromaticContact CE2-CE1 3.62Å; F786-F805 HydrophobicContact CE2-CE1 3.62Å; F786-F805 HydrophobicContact CE2-CE2 4.46Å; F786-F805 AromaticContact CE2-CZ 3.78Å; F786-F805 HydrophobicContact CE2-CZ 3.78Å; F786-F805 HydrophobicContact CG-CZ 4.1Å; F786-F805 HydrophobicContact CZ-CD1 4.38Å; F786-F805 HydrophobicContact CZ-CD2 4.49Å; F786-F805 HydrophobicContact CZ-CE1 4.07Å; F786-F805 HydrophobicContact CZ-CE2 4.18Å; F786-F805 AromaticContact CZ-CZ 3.96Å; F786-F805 HydrophobicContact CZ-CZ 3.96Å; L789-F805 HydrophobicContact CD2-CE2 4.1Å; L801-F805 HydrophobicContact CB-CD2 4.34Å; L801-F805 HydrophobicContact CB-CE2 3.9Å; L801-F805 HydrophobicContact CB-CZ 4.4Å; L801-F805 HydrophobicContact CD2-CZ 4.43Å; L801-F805 WeakPolarHBondContact O-CD2 3.02Å; L801-F805 VanDerWaalsContact O-CG 3.23Å; L801-F805 WeakPolarHBondContact O-CG 3.23Å; L801-F805 PolarHBondContact O-N 3.09Å; S802-F805 PolarHBondContact O-N 3.38Å; F805-Y809 WeakPolarHBondContact O-CB 3.47Å; F805-Y809 PolarHBondContact O-N 2.94Å; F805-L967 HydrophobicContact CB-CD2 4.4Å; F805-M970 HydrophobicContact CB-SD 3.94Å; F805-M970 HydrophobicContact CD2-CE 3.78Å; F805-M970 HydrophobicContact CD2-SD 3.55Å; F805-M970 VanDerWaalsContact CD2-SD 3.55Å; F805-M970 HydrophobicContact CE2-CE 4.19Å; F805-M970 HydrophobicContact CE2-SD 4.5Å; F805-M970 HydrophobicContact CG-SD 4.19Å; F805-L1010 HydrophobicContact CB-CD2 4.24Å; F805-L1010 HydrophobicContact CD1-CD2 3.58Å; F805-L1010 HydrophobicContact CE1-CD2 4.33Å; F805-L1010 HydrophobicContact CG-CD2 4.23Å
806	T	92.4	Very high	89.9	Confident	36 Å²	36	46.1 Å²	46.1	22%	0.221	25%	0.25	C	C	.	.	H	α-helix	trans	-66	-39.8	173.5	-62.6	0	0	0	0	112	S802 V803 I804 Y809 G810 L967 K968	S802-T806 WeakPolarHBondContact O-CB 2.96Å; S802-T806 PolarHBondContact O-N 3.02Å; S802-T806 PolarHBondContact O-OG1 2.82Å; S802-T806 VanDerWaalsContact O-OG1 3.08Å; V803-T806 PolarHBondContact O-N 3.14Å; I804-T806 VanDerWaalsContact C-N 3.32Å; I804-T806 PolarHBondContact O-N 3.08Å; T806-Y809 PolarHBondContact O-N 3.31Å; T806-G810 PolarHBondContact O-N 3.26Å; T806-L967 WeakPolarHBondContact CA-O 3.41Å; T806-L967 PolarHBondContact OG1-O 3.48Å; T806-K968 WeakPolarHBondContact CG2-O 3.31Å
807	Q	90.3	Very high	89.7	Confident	57 Å²	57	44.1 Å²	44.1	27%	0.266	24%	0.237	S	C	.	.	H	α-helix	trans	-61.7	-49.9	174	-175.9	-177.4	-13.5	0	0	111.2	V803 I804 Y809 G810	V803-Q807 WeakPolarHBondContact O-CB 3.41Å; V803-Q807 PolarHBondContact O-N 3.39Å; I804-Q807 WeakPolarHBondContact O-CB 3.41Å; I804-Q807 PolarHBondContact O-N 3.16Å; I804-Q807 VanDerWaalsContact O-N 3.14Å; Q807-Y809 VanDerWaalsContact C-N 3.27Å; Q807-Y809 PolarHBondContact O-N 3.41Å; Q807-G810 WeakPolarHBondContact O-CA 3.38Å; Q807-G810 PolarHBondContact O-N 3.29Å
808	C	89.7	Confident	89.4	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.1	-27.3	178.6	-69.1	0	0	0	0	113.6	I804 G810 L1010 I1014	I804-C808 WeakPolarHBondContact O-CB 3.41Å; I804-C808 PolarHBondContact O-N 2.72Å; I804-C808 PolarHBondContact O-SG 3.3Å; I804-C808 VanDerWaalsContact O-SG 3.35Å; C808-G810 VanDerWaalsContact C-N 3.25Å; C808-G810 PolarHBondContact O-N 3.47Å; C808-L1010 HydrophobicContact CB-CD1 4.11Å; C808-L1010 HydrophobicContact CB-CD2 4.48Å; C808-I1014 HydrophobicContact CB-CD1 3.93Å; C808-I1014 HydrophobicContact CB-CG1 4.33Å
809	Y	89.4	Confident	89.1	Confident	5 Å²	5	52.5 Å²	52.5	2%	0.02	28%	0.283	C	S	.	.	H	α-helix	trans	-70	-26.2	174.5	-166.9	-91.6	0	0	0	112.5	F805 T806 Q807 I814 G964 L967 K968 L1010 R1013	F805-Y809 WeakPolarHBondContact O-CB 3.47Å; F805-Y809 PolarHBondContact O-N 2.94Å; T806-Y809 PolarHBondContact O-N 3.31Å; Q807-Y809 VanDerWaalsContact C-N 3.27Å; Q807-Y809 PolarHBondContact O-N 3.41Å; Y809-I814 HydrophobicContact CE1-CG1 4.23Å; Y809-G964 WeakPolarHBondContact OH-CA 3.42Å; Y809-L967 HydrophobicContact CD2-CB 3.62Å; Y809-L967 HydrophobicContact CD2-CD1 3.82Å; Y809-L967 HydrophobicContact CD2-CG 4.37Å; Y809-L967 HydrophobicContact CE2-CB 4.12Å; Y809-L967 HydrophobicContact CE2-CD1 4.01Å; Y809-L967 HydrophobicContact CG-CB 4.13Å; Y809-K968 HydrophobicContact CD1-CB 4.12Å; Y809-K968 HydrophobicContact CE1-CB 4.22Å; Y809-L1010 HydrophobicContact CD2-CD1 4.12Å; Y809-R1013 HydrophobicContact CD2-CB 4.19Å; Y809-R1013 HydrophobicContact CD2-CG 3.77Å; Y809-R1013 HydrophobicContact CE2-CB 4.14Å; Y809-R1013 HydrophobicContact CE2-CG 3.78Å; Y809-R1013 HydrophobicContact CG-CG 4.19Å; Y809-R1013 PolarHBondContact O-NE 3.17Å
810	G	85.6	Confident	88.6	Confident	8 Å²	8	51.3 Å²	51.3	8%	0.082	28%	0.278	C	S	.	.			trans	82.1	168.3	175.5	0	0	0	0	0	114.8	T806 Q807 C808 F812	T806-G810 PolarHBondContact O-N 3.26Å; Q807-G810 WeakPolarHBondContact O-CA 3.38Å; Q807-G810 PolarHBondContact O-N 3.29Å; C808-G810 VanDerWaalsContact C-N 3.25Å; C808-G810 PolarHBondContact O-N 3.47Å; G810-F812 PolarHBondContact O-N 3.19Å
811	P	83.5	Confident	87.5	Confident	100 Å²	100	58.5 Å²	58.5	65%	0.649	31%	0.309	S	S	*	.	S	Bend	trans	-73.1	-16.8	-176.2	29.4	-35.2	0	0	0	113.4	K968	P811-K968 PolarHBondContact O-NZ 2.95Å
812	F	84.6	Confident	86.1	Confident	107 Å²	107	64.8 Å²	64.8	47%	0.469	34%	0.336	S	S	.	.	S	Bend	trans	-59.6	149.2	-173.9	-59.8	-79.8	0	0	0	112.8	G810 K968 R1013 I1017	G810-F812 PolarHBondContact O-N 3.19Å; F812-K968 PolarHBondContact O-NZ 3.42Å; F812-K968 VanDerWaalsContact O-NZ 3.07Å; F812-R1013 VanDerWaalsContact CB-NH2 3.32Å; F812-R1013 PolarHBondContact O-NH2 3.33Å; F812-I1017 HydrophobicContact CD2-CD1 3.72Å; F812-I1017 HydrophobicContact CD2-CG1 4.29Å; F812-I1017 HydrophobicContact CD2-CG2 4.21Å; F812-I1017 HydrophobicContact CE2-CD1 4.32Å; F812-I1017 HydrophobicContact CE2-CG2 3.72Å
813	P	84.4	Confident	84.4	Confident	94 Å²	94	74.5 Å²	74.5	61%	0.61	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-64.7	149.8	176.4	27.8	-34.1	0	0	0	111.3	R1013	P813-R1013 PolarHBondContact O-NH2 3.08Å
814	I	87.9	Confident	82.7	Confident	25 Å²	25	73.1 Å²	73.1	13%	0.128	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-61	134.4	173.7	-56.4	162.3	0	0	0	107.6	Y809 K816 F961 Y965 K968	Y809-I814 HydrophobicContact CE1-CG1 4.23Å; I814-K816 PolarHBondContact O-N 3.23Å; I814-F961 HydrophobicContact CB-CD2 4.47Å; I814-F961 HydrophobicContact CB-CE2 4Å; I814-F961 HydrophobicContact CB-CZ 4.47Å; I814-F961 HydrophobicContact CD1-CZ 4.49Å; I814-F961 HydrophobicContact CG2-CD2 3.56Å; I814-F961 HydrophobicContact CG2-CE2 3.58Å; I814-F961 HydrophobicContact CG2-CG 4.24Å; I814-F961 HydrophobicContact CG2-CZ 4.27Å; I814-Y965 HydrophobicContact CD1-CD2 4.06Å; I814-Y965 HydrophobicContact CD1-CG 4.44Å; I814-K968 HydrophobicContact CD1-CD 4.35Å; I814-K968 HydrophobicContact CG1-CD 4.12Å
815	P	85.3	Confident	80.9	Confident	81 Å²	81	79.6 Å²	79.6	53%	0.526	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-51.2	123.9	177.7	-27.6	35.9	0	0	0	111.3	F961	P815-F961 WeakPolarHBondContact O-CD2 3.38Å
816	K	87.1	Confident	79.3	Confident	184 Å²	184	81.2 Å²	81.2	80%	0.8	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-73.9	139.7	-178.2	-68.9	179.5	179.7	175.8	0	110.1	I814 T818	I814-K816 PolarHBondContact O-N 3.23Å; K816-T818 PolarHBondContact O-N 3.46Å
817	L	88.1	Confident	77.9	Confident	24 Å²	24	87.9 Å²	87.9	13%	0.126	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-64.7	127.1	171.4	-64.2	176	0	0	0	110.2	E931 I932 E957 F961	L817-E931 HydrophobicContact CD1-CB 3.84Å; L817-I932 HydrophobicContact CB-CG1 3.69Å; L817-E957 HydrophobicContact CD2-CB 3.95Å; L817-F961 HydrophobicContact CD2-CB 4.48Å; L817-F961 HydrophobicContact CG-CD2 4.43Å
818	T	84.9	Confident	76.8	Confident	104 Å²	104	88 Å²	88	64%	0.638	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-87.7	133.9	178	52.8	0	0	0	0	111	K816 R928	K816-T818 PolarHBondContact O-N 3.46Å; T818-R928 WeakPolarHBondContact O-CD 3.18Å; T818-R928 WeakPolarHBondContact O-CG 3.31Å
819	E	83.5	Confident	75.8	Confident	82 Å²	82	92.9 Å²	92.9	38%	0.383	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-73	134.6	179	-167	166	-145.5	0	0	111.7	K821 T901 H929 I932	E819-K821 PolarHBondContact O-N 3.21Å; E819-T901 PolarHBondContact OE1-OG1 3.3Å; E819-T901 VanDerWaalsContact OE1-OG1 3.14Å; E819-H929 IonicContact OE1-CE1 3.42Å; E819-H929 IonicContact OE1-CG 2.86Å; E819-H929 IonicContact OE1-ND1 2.64Å; E819-H929 PolarHBondContact OE1-ND1 3.11Å; E819-I932 HydrophobicContact CB-CD1 3.79Å; E819-I932 HydrophobicContact CG-CD1 4.2Å
820	I	83	Confident	75	Confident	57 Å²	57	96.1 Å²	96.1	29%	0.292	49%	0.49	S	S	.	.			trans	-84.4	100.8	176.8	-63.2	167	0	0	0	108.5	K822 A925 R928	I820-K822 HydrophobicContact CG2-CG 4.22Å; I820-K822 PolarHBondContact O-N 3.38Å; I820-K822 VanDerWaalsContact O-N 3.08Å; I820-A925 HydrophobicContact CB-CB 4.2Å; I820-A925 HydrophobicContact CG2-CB 4.18Å; I820-R928 HydrophobicContact CD1-CB 3.86Å; I820-R928 HydrophobicContact CD1-CG 4.1Å; I820-R928 HydrophobicContact CG1-CB 4.21Å; I820-R928 HydrophobicContact CG1-CG 4.05Å
821	K	70.1	Confident	74.7	Confident	187 Å²	187	102.2 Å²	102.2	81%	0.813	52%	0.516	S	S	*	.			trans	-81.7	77	174	-65.3	-174	178.3	-175.2	0	111	E819	E819-K821 PolarHBondContact O-N 3.21Å
822	K	64.9	Low	74.5	Confident	132 Å²	132	100.4 Å²	100.4	57%	0.574	50%	0.498	S	S	*	.			trans	-80.8	120.1	168.2	-99.3	176.5	176.6	168.2	0	109.3	I820 Q824 E924	I820-K822 HydrophobicContact CG2-CG 4.22Å; I820-K822 PolarHBondContact O-N 3.38Å; I820-K822 VanDerWaalsContact O-N 3.08Å; K822-Q824 PolarHBondContact O-N 3.23Å; K822-Q824 VanDerWaalsContact O-N 3.1Å; K822-E924 IonicContact NZ-OE2 2.97Å; K822-E924 PolarHBondContact NZ-OE2 2.68Å
823	K	57	Low	74.4	Confident	205 Å²	205	96.9 Å²	96.9	89%	0.891	48%	0.483	S	S	*	.			trans	-70.4	101.2	167.3	-78.2	-176.3	177.7	179.6	0	108.4	T825	K823-T825 PolarHBondContact O-N 2.78Å
824	Q	58.4	Low	74.4	Confident	43 Å²	43	94.6 Å²	94.6	20%	0.201	47%	0.466	C	S	.	.			trans	-66.9	129.3	169.5	-108	162.9	-21.6	0	0	109.5	K822	K822-Q824 PolarHBondContact O-N 3.23Å; K822-Q824 VanDerWaalsContact O-N 3.1Å
825	T	55.2	Low	74.2	Confident	140 Å²	140	95.3 Å²	95.3	86%	0.859	47%	0.47	S	S	*	.	S	Bend	trans	-81.6	-13.9	-173.9	46.2	0	0	0	0	113.6	K823	K823-T825 PolarHBondContact O-N 2.78Å
826	S	59.4	Low	74.1	Confident	34 Å²	34	98.3 Å²	98.3	24%	0.238	48%	0.475	C	S	.	.			trans	-123.2	89.2	-176.3	39.9	0	0	0	0	110.5	L856 T859	S826-L856 VanDerWaalsContact O-CD1 3.3Å; S826-L856 WeakPolarHBondContact O-CD1 3.27Å; S826-T859 PolarHBondContact OG-OG1 2.63Å
827	R	63.3	Low	73.7	Confident	177 Å²	177	97.8 Å²	97.8	67%	0.668	48%	0.476	S	S	*	.			trans	-91.4	125	169	-79	-177.5	173.5	-175.6	-5.3	109.4	G899	R827-G899 PolarHBondContact NH2-O 3.35Å
828	L	68.3	Low	73	Confident	60 Å²	60	102.3 Å²	102.3	31%	0.314	50%	0.498	S	S	.	.			trans	-111	142.1	168.4	-80.6	165.8	0	0	0	108.1	F832 H853 L856 Y897	L828-F832 HydrophobicContact CD2-CD2 4.5Å; L828-H853 HydrophobicContact CD1-CB 4.43Å; L828-L856 HydrophobicContact CD1-CB 4.22Å; L828-L856 HydrophobicContact CD1-CD1 4.09Å; L828-Y897 HydrophobicContact CB-CD1 3.87Å; L828-Y897 HydrophobicContact CB-CE1 4.36Å; L828-Y897 HydrophobicContact CD1-CE1 4.28Å; L828-Y897 PolarHBondContact N-O 3.47Å; L828-Y897 CarbonylContact O-C 3.29Å
829	D	68.3	Low	72.8	Confident	101 Å²	101	98.6 Å²	98.6	54%	0.54	48%	0.476	S	S	.	.			trans	-55.9	136.2	179	-166.3	-50.7	0	0	0	110.4	H831 F832	D829-H831 HydrophobicContact CB-CB 4.49Å; D829-H831 PolarHBondContact O-N 3.09Å; D829-H831 WeakPolarHBondContact OD1-CB 3.13Å; D829-H831 PolarHBondContact OD1-N 3.25Å; D829-F832 HydrophobicContact CB-CD2 3.77Å; D829-F832 HydrophobicContact CB-CE2 3.84Å; D829-F832 WeakPolarHBondContact O-CD2 3.34Å; D829-F832 PolarHBondContact O-N 3.42Å
830	P	72.8	Confident	72.7	Confident	74 Å²	74	98.4 Å²	98.4	48%	0.481	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-47.9	-24.5	172.5	-29.3	34.5	0	0	0	114.7	F832 L833	P830-F832 PolarHBondContact O-N 3.42Å; P830-L833 VanDerWaalsContact O-CB 3.22Å; P830-L833 WeakPolarHBondContact O-CB 3.49Å; P830-L833 PolarHBondContact O-N 3.11Å; P830-L833 VanDerWaalsContact O-N 3.11Å
831	H	78.9	Confident	72.8	Confident	135 Å²	135	96.2 Å²	96.2	63%	0.625	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-57.5	-25.8	173.3	-175.1	71.4	0	0	0	114.3	D829 L833	D829-H831 HydrophobicContact CB-CB 4.49Å; D829-H831 PolarHBondContact O-N 3.09Å; D829-H831 WeakPolarHBondContact OD1-CB 3.13Å; D829-H831 PolarHBondContact OD1-N 3.25Å; H831-L833 VanDerWaalsContact C-N 3.34Å
832	F	78.9	Confident	73.6	Confident	62 Å²	62	89.1 Å²	89.1	27%	0.272	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-87.2	-1.6	179.1	-61.9	-70.8	0	0	0	113.8	L828 D829 P830 N834 Y897	L828-F832 HydrophobicContact CD2-CD2 4.5Å; D829-F832 HydrophobicContact CB-CD2 3.77Å; D829-F832 HydrophobicContact CB-CE2 3.84Å; D829-F832 WeakPolarHBondContact O-CD2 3.34Å; D829-F832 PolarHBondContact O-N 3.42Å; P830-F832 PolarHBondContact O-N 3.42Å; F832-N834 PolarHBondContact O-N 3.13Å; F832-Y897 HydrophobicContact CB-CD1 4.28Å; F832-Y897 HydrophobicContact CB-CE1 4.01Å; F832-Y897 WeakPolarHBondContact O-CE1 3.36Å
833	L	83.5	Confident	74.6	Confident	33 Å²	33	82.8 Å²	82.8	17%	0.173	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	122.5	177.8	-174.3	67.9	0	0	0	110.2	P830 H831 N835 F850 M893 Q894 Y897	P830-L833 VanDerWaalsContact O-CB 3.22Å; P830-L833 WeakPolarHBondContact O-CB 3.49Å; P830-L833 PolarHBondContact O-N 3.11Å; P830-L833 VanDerWaalsContact O-N 3.11Å; H831-L833 VanDerWaalsContact C-N 3.34Å; L833-N835 PolarHBondContact O-N 3.18Å; L833-F850 HydrophobicContact CD1-CZ 4.27Å; L833-M893 HydrophobicContact CD1-CB 3.72Å; L833-Q894 HydrophobicContact CD2-CB 4.11Å; L833-Q894 HydrophobicContact CD2-CG 4.36Å; L833-Y897 HydrophobicContact CD1-CD2 3.83Å; L833-Y897 HydrophobicContact CD1-CE2 4.1Å; L833-Y897 HydrophobicContact CD1-CG 4.11Å
834	N	84.7	Confident	76.1	Confident	47 Å²	47	75.4 Å²	75.4	25%	0.251	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	32.4	177.4	-161	25.7	0	0	0	114.7	F832 F850 Y851 Y886	F832-N834 PolarHBondContact O-N 3.13Å; N834-F850 HydrophobicContact CB-CE1 4.13Å; N834-F850 HydrophobicContact CB-CE2 4.28Å; N834-F850 HydrophobicContact CB-CZ 3.96Å; N834-F850 WeakPolarHBondContact OD1-CA 3.01Å; N834-Y851 WeakPolarHBondContact CA-O 3.18Å; N834-Y851 PolarHBondContact N-O 3.25Å; N834-Y851 PolarHBondContact OD1-N 2.92Å; N834-Y886 PolarHBondContact ND2-OH 3.47Å; N834-Y886 VanDerWaalsContact ND2-OH 3.11Å
835	N	83.6	Confident	77.4	Confident	40 Å²	40	73.3 Å²	73.3	21%	0.214	37%	0.372	C	S	.	.			trans	-92.3	122.9	177.2	-171	-20.9	0	0	0	111.3	L833 E837 S839 Y851	L833-N835 PolarHBondContact O-N 3.18Å; N835-E837 PolarHBondContact OD1-N 2.99Å; N835-E837 VanDerWaalsContact OD1-N 3.08Å; N835-S839 WeakPolarHBondContact O-CB 3.36Å; N835-S839 PolarHBondContact O-OG 3.19Å; N835-Y851 WeakPolarHBondContact O-CB 3.03Å
836	K	82.2	Confident	78.9	Confident	143 Å²	143	72.3 Å²	72.3	62%	0.622	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-32.2	-176.6	-176	176.4	-179.6	-175.9	0	114	M838 S839 Y851	K836-M838 VanDerWaalsContact C-N 3.35Å; K836-M838 PolarHBondContact O-N 3.31Å; K836-S839 PolarHBondContact O-OG 3.49Å; K836-Y851 HydrophobicContact CB-CD1 4.37Å; K836-Y851 HydrophobicContact CB-CD2 3.87Å; K836-Y851 HydrophobicContact CB-CE1 4.29Å; K836-Y851 HydrophobicContact CB-CE2 3.75Å; K836-Y851 HydrophobicContact CB-CG 4.18Å; K836-Y851 HydrophobicContact CD-CE1 4.42Å; K836-Y851 HydrophobicContact CD-CE2 4.17Å; K836-Y851 HydrophobicContact CG-CD1 4.28Å; K836-Y851 HydrophobicContact CG-CD2 4.41Å; K836-Y851 HydrophobicContact CG-CE1 3.82Å; K836-Y851 HydrophobicContact CG-CE2 3.94Å
837	E	78.3	Confident	79.8	Confident	174 Å²	174	73.4 Å²	73.4	81%	0.813	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-25.4	-170.8	-65.5	-174.4	174.3	0	0	113	N835	N835-E837 PolarHBondContact OD1-N 2.99Å; N835-E837 VanDerWaalsContact OD1-N 3.08Å
838	M	73.3	Confident	80.9	Confident	119 Å²	119	70.6 Å²	70.6	59%	0.586	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	-0.7	-170	-62.4	-66.9	-78.3	0	0	114	K836 H853	K836-M838 VanDerWaalsContact C-N 3.35Å; K836-M838 PolarHBondContact O-N 3.31Å; M838-H853 PolarHBondContact O-CD2 2.83Å; M838-H853 VanDerWaalsContact O-CD2 3.28Å; M838-H853 PolarHBondContact O-NE2 2.88Å
839	S	81.8	Confident	81.8	Confident	26 Å²	26	70.4 Å²	70.4	18%	0.182	37%	0.369	C	S	.	.			trans	-82.5	139.8	180	62.6	0	0	0	0	113.4	N835 K836 Y851 A852	N835-S839 WeakPolarHBondContact O-CB 3.36Å; N835-S839 PolarHBondContact O-OG 3.19Å; K836-S839 PolarHBondContact O-OG 3.49Å; S839-Y851 WeakPolarHBondContact OG-CB 3.47Å; S839-Y851 WeakPolarHBondContact OG-CD1 3.27Å; S839-A852 WeakPolarHBondContact CA-O 3.49Å; S839-A852 VanDerWaalsContact CB-O 3.29Å; S839-A852 WeakPolarHBondContact CB-O 3.07Å
840	D	81.6	Confident	82.8	Confident	78 Å²	78	65.6 Å²	65.6	42%	0.417	34%	0.344	S	S	.	.	S	Bend	trans	-107.8	1.7	176.3	64.4	-5.4	0	0	0	113.1	A852 H853 K854	D840-A852 PolarHBondContact N-O 3.07Å; D840-H853 WeakPolarHBondContact OD1-CA 3.37Å; D840-K854 WeakPolarHBondContact O-CE 3.35Å; D840-K854 PolarHBondContact O-NZ 3.37Å; D840-K854 WeakPolarHBondContact OD1-CG 3.35Å; D840-K854 PolarHBondContact OD1-N 2.86Å; D840-K854 WeakPolarHBondContact OD2-CB 2.92Å; D840-K854 PolarHBondContact OD2-N 3.39Å
841	V	84.6	Confident	83.5	Confident	11 Å²	11	64.3 Å²	64.3	7%	0.067	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	142.2	170.3	62.5	0	0	0	0	111.5	F843 A852 K854 L857 L868 I879	V841-F843 HydrophobicContact CG1-CE2 3.91Å; V841-F843 HydrophobicContact CG2-CE2 4.07Å; V841-F843 HydrophobicContact CG2-CZ 4.27Å; V841-A852 HydrophobicContact CG1-CB 4Å; V841-A852 VanDerWaalsContact CG1-O 3.28Å; V841-A852 WeakPolarHBondContact CG1-O 3.31Å; V841-A852 PolarHBondContact N-O 2.81Å; V841-A852 PolarHBondContact O-N 3.28Å; V841-K854 HydrophobicContact CB-CG 3.82Å; V841-K854 HydrophobicContact CG1-CG 3.95Å; V841-L857 HydrophobicContact CG1-CD1 4.24Å; V841-L868 HydrophobicContact CG2-CD2 3.94Å; V841-I879 HydrophobicContact CG2-CD1 3.75Å; V841-I879 HydrophobicContact CG2-CG1 4.49Å
842	T	85.6	Confident	83.9	Confident	37 Å²	37	57.9 Å²	57.9	23%	0.227	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	127.3	173.5	-52.3	0	0	0	0	109.7	P849 F850 Y851 C878 I879	T842-P849 HydrophobicContact CG2-CB 3.93Å; T842-F850 CarbonylContact C-O 3.58Å; T842-F850 WeakPolarHBondContact CA-O 3.28Å; T842-Y851 HydrophobicContact CG2-CD1 4.02Å; T842-Y851 HydrophobicContact CG2-CE1 3.83Å; T842-C878 WeakPolarHBondContact O-CA 3.35Å; T842-I879 PolarHBondContact O-N 2.75Å
843	F	87.5	Confident	84.2	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	146.4	169.8	-65.9	-88.1	0	0	0	109.9	V841 V845 P849 F850 A852 L857 F864 I879 I881 F889 M893	V841-F843 HydrophobicContact CG1-CE2 3.91Å; V841-F843 HydrophobicContact CG2-CE2 4.07Å; V841-F843 HydrophobicContact CG2-CZ 4.27Å; F843-V845 HydrophobicContact CB-CG2 4.18Å; F843-P849 CarbonylContact O-C 3.51Å; F843-P849 WeakPolarHBondContact O-CA 3.3Å; F843-F850 HydrophobicContact CB-CB 4.3Å; F843-F850 PolarHBondContact N-O 3.35Å; F843-F850 PolarHBondContact O-N 3.42Å; F843-A852 HydrophobicContact CD2-CB 4.21Å; F843-A852 HydrophobicContact CE2-CB 4.02Å; F843-L857 HydrophobicContact CE2-CD1 3.5Å; F843-L857 HydrophobicContact CZ-CD1 3.67Å; F843-F864 HydrophobicContact CZ-CD1 4.44Å; F843-F864 HydrophobicContact CZ-CE1 4.37Å; F843-I879 CarbonylContact C-O 3.59Å; F843-I879 WeakPolarHBondContact CA-O 3.32Å; F843-I879 HydrophobicContact CD1-CB 3.55Å; F843-I879 HydrophobicContact CD1-CD1 4.41Å; F843-I879 HydrophobicContact CD1-CG2 3.69Å; F843-I879 HydrophobicContact CE1-CB 3.78Å; F843-I879 HydrophobicContact CE1-CD1 3.84Å; F843-I879 HydrophobicContact CE1-CG1 4.41Å; F843-I879 HydrophobicContact CE1-CG2 3.69Å; F843-I879 HydrophobicContact CG-CB 4.42Å; F843-I879 HydrophobicContact CZ-CD1 4.19Å; F843-I881 HydrophobicContact CB-CD1 4.36Å; F843-I881 HydrophobicContact CD1-CD1 3.54Å; F843-I881 HydrophobicContact CD1-CG1 4.02Å; F843-I881 HydrophobicContact CE1-CD1 4.15Å; F843-I881 HydrophobicContact CG-CD1 4.16Å; F843-F889 HydrophobicContact CB-CE1 4.07Å; F843-F889 HydrophobicContact CB-CZ 4.18Å; F843-F889 HydrophobicContact CD1-CZ 4.14Å; F843-F889 HydrophobicContact CD2-CE1 4.23Å; F843-F889 AromaticContact CD2-CZ 3.99Å; F843-F889 HydrophobicContact CD2-CZ 3.99Å; F843-F889 HydrophobicContact CE2-CZ 4.45Å; F843-F889 HydrophobicContact CG-CE1 4.14Å; F843-F889 AromaticContact CG-CZ 3.83Å; F843-F889 HydrophobicContact CG-CZ 3.83Å; F843-M893 HydrophobicContact CD2-CE 4.43Å; F843-M893 HydrophobicContact CE2-CE 4.15Å
844	L	87.1	Confident	84.2	Confident	49 Å²	49	59 Å²	59	26%	0.257	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	108	170.8	-170.1	73.4	0	0	0	107.8	G847 C878 I879 E880 I881	L844-G847 VanDerWaalsContact CD1-C 3.49Å; L844-G847 WeakPolarHBondContact CD1-O 3.13Å; L844-C878 HydrophobicContact CB-CB 4.17Å; L844-I879 PolarHBondContact N-O 2.72Å; L844-E880 HydrophobicContact CD2-CG 4.43Å; L844-E880 CarbonylContact O-C 3.47Å; L844-E880 WeakPolarHBondContact O-CA 3.27Å; L844-I881 PolarHBondContact O-N 3.46Å
845	V	87.1	Confident	84	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	118.4	-177.6	-168.9	0	0	0	0	108.1	F843 G847 K848 F850 I881 V884 Y886 F889	F843-V845 HydrophobicContact CB-CG2 4.18Å; V845-G847 PolarHBondContact O-N 2.86Å; V845-K848 PolarHBondContact N-O 3.07Å; V845-K848 PolarHBondContact O-N 3.41Å; V845-F850 HydrophobicContact CG2-CB 4.5Å; V845-I881 HydrophobicContact CG2-CB 4.12Å; V845-I881 HydrophobicContact CG2-CD1 4.27Å; V845-V884 WeakPolarHBondContact CG1-O 3.29Å; V845-Y886 HydrophobicContact CB-CD2 4.03Å; V845-F889 HydrophobicContact CG1-CB 4.11Å; V845-F889 HydrophobicContact CG1-CG 4.49Å; V845-F889 HydrophobicContact CG2-CB 4.41Å; V845-F889 HydrophobicContact CG2-CD1 3.62Å; V845-F889 HydrophobicContact CG2-CE1 3.9Å; V845-F889 HydrophobicContact CG2-CG 3.96Å
846	E	85.8	Confident	84	Confident	118 Å²	118	60.2 Å²	60.2	55%	0.551	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	37.9	-172.2	-60.7	-179.2	132.8	0	0	113.1	K848 Y886	E846-K848 PolarHBondContact O-N 3.14Å; E846-Y886 WeakPolarHBondContact OE2-CB 3.47Å; E846-Y886 PolarHBondContact OE2-N 3.24Å
847	G	79.3	Confident	84.2	Confident	58 Å²	58	53.4 Å²	53.4	60%	0.598	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	2.4	-178.4	0	0	0	0	0	115.4	L844 V845	L844-G847 VanDerWaalsContact CD1-C 3.49Å; L844-G847 WeakPolarHBondContact CD1-O 3.13Å; V845-G847 PolarHBondContact O-N 2.86Å
848	K	86.4	Confident	84.4	Confident	117 Å²	117	48.3 Å²	48.3	51%	0.509	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	135.1	175.3	-65.8	176.8	-177.4	172.9	0	111.2	V845 E846 Y886	V845-K848 PolarHBondContact N-O 3.07Å; V845-K848 PolarHBondContact O-N 3.41Å; E846-K848 PolarHBondContact O-N 3.14Å; K848-Y886 HydrophobicContact CB-CD2 3.64Å; K848-Y886 HydrophobicContact CB-CE2 3.55Å; K848-Y886 HydrophobicContact CD-CD2 4.03Å; K848-Y886 HydrophobicContact CD-CE2 4.28Å; K848-Y886 HydrophobicContact CD-CG 4.22Å; K848-Y886 HydrophobicContact CG-CD2 4.45Å
849	P	86.4	Confident	84.8	Confident	57 Å²	57	46.7 Å²	46.7	37%	0.37	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	141	175.2	29.3	-33.3	0	0	0	111.1	T842 F843 Y851	T842-P849 HydrophobicContact CG2-CB 3.93Å; F843-P849 CarbonylContact O-C 3.51Å; F843-P849 WeakPolarHBondContact O-CA 3.3Å; P849-Y851 HydrophobicContact CB-CE2 4.43Å
850	F	89.2	Confident	84.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	120.9	173.9	-162.9	-71.6	0	0	0	109.4	L833 N834 T842 F843 V845 Y886 F889 H890 M893	L833-F850 HydrophobicContact CD1-CZ 4.27Å; N834-F850 HydrophobicContact CB-CE1 4.13Å; N834-F850 HydrophobicContact CB-CE2 4.28Å; N834-F850 HydrophobicContact CB-CZ 3.96Å; N834-F850 WeakPolarHBondContact OD1-CA 3.01Å; T842-F850 CarbonylContact C-O 3.58Å; T842-F850 WeakPolarHBondContact CA-O 3.28Å; F843-F850 HydrophobicContact CB-CB 4.3Å; F843-F850 PolarHBondContact N-O 3.35Å; F843-F850 PolarHBondContact O-N 3.42Å; V845-F850 HydrophobicContact CG2-CB 4.5Å; F850-Y886 HydrophobicContact CB-CE2 4.31Å; F850-Y886 HydrophobicContact CD2-CE1 4.41Å; F850-Y886 AromaticContact CD2-CE2 3.86Å; F850-Y886 HydrophobicContact CD2-CE2 3.86Å; F850-Y886 AromaticContact CD2-CZ 3.73Å; F850-F889 HydrophobicContact CB-CD1 4.38Å; F850-F889 HydrophobicContact CB-CE1 4.17Å; F850-F889 HydrophobicContact CD1-CD1 4.24Å; F850-F889 AromaticContact CD1-CE1 3.86Å; F850-F889 HydrophobicContact CD1-CE1 3.86Å; F850-F889 AromaticContact CD2-CD1 3.99Å; F850-F889 HydrophobicContact CD2-CD1 3.99Å; F850-F889 HydrophobicContact CD2-CE1 4.39Å; F850-F889 HydrophobicContact CE1-CE1 4.4Å; F850-F889 HydrophobicContact CE2-CD1 4.36Å; F850-F889 AromaticContact CG-CD1 3.94Å; F850-F889 HydrophobicContact CG-CD1 3.94Å; F850-F889 AromaticContact CG-CE1 3.87Å; F850-F889 HydrophobicContact CG-CE1 3.87Å; F850-H890 HydrophobicContact CE2-CB 3.9Å; F850-H890 AromaticContact CE2-CD2 3.69Å; F850-H890 HydrophobicContact CZ-CB 4.49Å; F850-M893 HydrophobicContact CD1-CG 4.32Å; F850-M893 HydrophobicContact CE1-CB 3.82Å; F850-M893 HydrophobicContact CE1-CG 3.58Å; F850-M893 HydrophobicContact CZ-CB 3.74Å; F850-M893 HydrophobicContact CZ-CG 3.88Å
851	Y	87.4	Confident	85	Confident	46 Å²	46	43.2 Å²	43.2	18%	0.18	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	128	-172.7	-61.9	-70.7	0	0	0	111.1	N834 N835 K836 S839 T842 P849	N834-Y851 WeakPolarHBondContact CA-O 3.18Å; N834-Y851 PolarHBondContact N-O 3.25Å; N834-Y851 PolarHBondContact OD1-N 2.92Å; N835-Y851 WeakPolarHBondContact O-CB 3.03Å; K836-Y851 HydrophobicContact CB-CD1 4.37Å; K836-Y851 HydrophobicContact CB-CD2 3.87Å; K836-Y851 HydrophobicContact CB-CE1 4.29Å; K836-Y851 HydrophobicContact CB-CE2 3.75Å; K836-Y851 HydrophobicContact CB-CG 4.18Å; K836-Y851 HydrophobicContact CD-CE1 4.42Å; K836-Y851 HydrophobicContact CD-CE2 4.17Å; K836-Y851 HydrophobicContact CG-CD1 4.28Å; K836-Y851 HydrophobicContact CG-CD2 4.41Å; K836-Y851 HydrophobicContact CG-CE1 3.82Å; K836-Y851 HydrophobicContact CG-CE2 3.94Å; S839-Y851 WeakPolarHBondContact OG-CB 3.47Å; S839-Y851 WeakPolarHBondContact OG-CD1 3.27Å; T842-Y851 HydrophobicContact CG2-CD1 4.02Å; T842-Y851 HydrophobicContact CG2-CE1 3.83Å; P849-Y851 HydrophobicContact CB-CE2 4.43Å
852	A	86.9	Confident	85	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	176.3	-177.1	0	0	0	0	0	113.7	S839 D840 V841 F843 L857 M893 Y897	S839-A852 WeakPolarHBondContact CA-O 3.49Å; S839-A852 VanDerWaalsContact CB-O 3.29Å; S839-A852 WeakPolarHBondContact CB-O 3.07Å; D840-A852 PolarHBondContact N-O 3.07Å; V841-A852 HydrophobicContact CG1-CB 4Å; V841-A852 VanDerWaalsContact CG1-O 3.28Å; V841-A852 WeakPolarHBondContact CG1-O 3.31Å; V841-A852 PolarHBondContact N-O 2.81Å; V841-A852 PolarHBondContact O-N 3.28Å; F843-A852 HydrophobicContact CD2-CB 4.21Å; F843-A852 HydrophobicContact CE2-CB 4.02Å; A852-L857 HydrophobicContact CB-CD1 4.08Å; A852-M893 HydrophobicContact CB-CE 4.49Å; A852-M893 HydrophobicContact CB-SD 4.44Å; A852-Y897 WeakPolarHBondContact CA-OH 3.4Å
853	H	86.8	Confident	85.1	Confident	28 Å²	28	48.4 Å²	48.4	13%	0.13	27%	0.268	C	S	.	.			trans	-114	120.8	-175.9	-59.2	83.4	0	0	0	111.8	L828 M838 D840 V855 L856 L857 Y897	L828-H853 HydrophobicContact CD1-CB 4.43Å; M838-H853 PolarHBondContact O-CD2 2.83Å; M838-H853 VanDerWaalsContact O-CD2 3.28Å; M838-H853 PolarHBondContact O-NE2 2.88Å; D840-H853 WeakPolarHBondContact OD1-CA 3.37Å; H853-V855 PolarHBondContact O-N 3.36Å; H853-L856 HydrophobicContact CB-CB 4.39Å; H853-L856 PolarHBondContact O-N 3.03Å; H853-L857 WeakPolarHBondContact O-CG 3.34Å; H853-L857 PolarHBondContact O-N 3.39Å; H853-Y897 PolarHBondContact N-OH 2.87Å; H853-Y897 AromaticContact ND1-CE1 3.51Å; H853-Y897 AromaticContact ND1-CZ 3.49Å; H853-Y897 PolarHBondContact ND1-OH 3.39Å
854	K	82.2	Confident	85.1	Confident	90 Å²	90	48.4 Å²	48.4	39%	0.391	27%	0.268	S	S	.	.	H	α-helix	trans	-57.9	-46.2	-176.2	-71.5	173.7	175.2	162.6	0	111.8	D840 V841 L856 L857 F858 L868	D840-K854 WeakPolarHBondContact O-CE 3.35Å; D840-K854 PolarHBondContact O-NZ 3.37Å; D840-K854 WeakPolarHBondContact OD1-CG 3.35Å; D840-K854 PolarHBondContact OD1-N 2.86Å; D840-K854 WeakPolarHBondContact OD2-CB 2.92Å; D840-K854 PolarHBondContact OD2-N 3.39Å; V841-K854 HydrophobicContact CB-CG 3.82Å; V841-K854 HydrophobicContact CG1-CG 3.95Å; K854-L856 VanDerWaalsContact C-N 3.32Å; K854-L856 PolarHBondContact O-N 3.14Å; K854-L857 PolarHBondContact O-N 3.11Å; K854-L857 VanDerWaalsContact O-N 3.13Å; K854-F858 HydrophobicContact CB-CD2 4.35Å; K854-F858 WeakPolarHBondContact O-CB 3.44Å; K854-F858 VanDerWaalsContact O-CD2 3.31Å; K854-F858 WeakPolarHBondContact O-CD2 3.47Å; K854-F858 PolarHBondContact O-N 2.9Å; K854-L868 HydrophobicContact CG-CD2 4.49Å
855	V	81.3	Confident	85	Confident	107 Å²	107	50.4 Å²	50.4	65%	0.648	28%	0.275	S	S	*	.	H	α-helix	trans	-59.6	-41.3	-176.4	178.3	0	0	0	0	112.1	H853 T859	H853-V855 PolarHBondContact O-N 3.36Å; V855-T859 WeakPolarHBondContact O-CG2 3.39Å; V855-T859 PolarHBondContact O-N 2.89Å; V855-T859 PolarHBondContact O-OG1 2.73Å
856	L	83.7	Confident	85	Confident	6 Å²	6	52.4 Å²	52.4	3%	0.031	29%	0.289	C	S	.	.	H	α-helix	trans	-62.5	-47.7	175.6	-175.5	85.4	0	0	0	110.7	S826 L828 H853 K854 T859 A860 L896 Y897	S826-L856 VanDerWaalsContact O-CD1 3.3Å; S826-L856 WeakPolarHBondContact O-CD1 3.27Å; L828-L856 HydrophobicContact CD1-CB 4.22Å; L828-L856 HydrophobicContact CD1-CD1 4.09Å; H853-L856 HydrophobicContact CB-CB 4.39Å; H853-L856 PolarHBondContact O-N 3.03Å; K854-L856 VanDerWaalsContact C-N 3.32Å; K854-L856 PolarHBondContact O-N 3.14Å; L856-T859 PolarHBondContact O-N 3.37Å; L856-T859 PolarHBondContact O-OG1 2.77Å; L856-A860 VanDerWaalsContact O-CB 3.23Å; L856-A860 WeakPolarHBondContact O-CB 3.4Å; L856-A860 PolarHBondContact O-N 2.71Å; L856-L896 HydrophobicContact CD2-CB 4.03Å; L856-Y897 HydrophobicContact CD2-CD1 4.41Å; L856-Y897 HydrophobicContact CD2-CD2 3.39Å; L856-Y897 HydrophobicContact CD2-CE1 4.33Å; L856-Y897 HydrophobicContact CD2-CE2 3.34Å; L856-Y897 HydrophobicContact CD2-CG 3.99Å
857	L	84.9	Confident	84.8	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-68.6	-37.7	-177.2	-63.8	179.3	0	0	0	113	V841 F843 A852 H853 K854 T859 A860 S861 F864 L868 M893 L896	V841-L857 HydrophobicContact CG1-CD1 4.24Å; F843-L857 HydrophobicContact CE2-CD1 3.5Å; F843-L857 HydrophobicContact CZ-CD1 3.67Å; A852-L857 HydrophobicContact CB-CD1 4.08Å; H853-L857 WeakPolarHBondContact O-CG 3.34Å; H853-L857 PolarHBondContact O-N 3.39Å; K854-L857 PolarHBondContact O-N 3.11Å; K854-L857 VanDerWaalsContact O-N 3.13Å; L857-T859 VanDerWaalsContact C-N 3.3Å; L857-T859 PolarHBondContact O-N 3.25Å; L857-A860 PolarHBondContact O-N 2.99Å; L857-S861 PolarHBondContact O-N 3.02Å; L857-F864 HydrophobicContact CB-CB 4.04Å; L857-F864 HydrophobicContact CB-CG 4.28Å; L857-F864 HydrophobicContact CD1-CD1 4.48Å; L857-F864 HydrophobicContact CD2-CD1 4.38Å; L857-F864 HydrophobicContact CD2-CD2 4.17Å; L857-F864 HydrophobicContact CD2-CE1 4.49Å; L857-F864 HydrophobicContact CD2-CE2 4.31Å; L857-F864 HydrophobicContact CD2-CG 4.23Å; L857-F864 HydrophobicContact CD2-CZ 4.47Å; L857-F864 WeakPolarHBondContact O-CB 3.34Å; L857-L868 HydrophobicContact CB-CD1 3.93Å; L857-L868 HydrophobicContact CD1-CD1 4.43Å; L857-M893 HydrophobicContact CD1-CE 4.08Å; L857-M893 HydrophobicContact CD2-CE 3.68Å; L857-M893 HydrophobicContact CD2-SD 3.77Å; L857-L896 HydrophobicContact CD2-CD1 3.59Å
858	F	82.6	Confident	84.9	Confident	67 Å²	67	47.5 Å²	47.5	29%	0.294	25%	0.252	S	S	.	.	H	α-helix	trans	-62.4	-36.6	175.6	-99.9	-100.4	0	0	0	112.8	K854 K865 L868 Q869	K854-F858 HydrophobicContact CB-CD2 4.35Å; K854-F858 WeakPolarHBondContact O-CB 3.44Å; K854-F858 VanDerWaalsContact O-CD2 3.31Å; K854-F858 WeakPolarHBondContact O-CD2 3.47Å; K854-F858 PolarHBondContact O-N 2.9Å; F858-K865 HydrophobicContact CD1-CB 4.16Å; F858-K865 HydrophobicContact CD1-CD 4.06Å; F858-K865 HydrophobicContact CD1-CG 3.61Å; F858-K865 HydrophobicContact CE1-CD 4.47Å; F858-K865 HydrophobicContact CE1-CG 3.75Å; F858-K865 HydrophobicContact CG-CG 4.44Å; F858-L868 HydrophobicContact CD2-CB 4.15Å; F858-L868 HydrophobicContact CD2-CD1 3.57Å; F858-L868 HydrophobicContact CE2-CB 3.35Å; F858-L868 HydrophobicContact CE2-CD1 3.63Å; F858-L868 HydrophobicContact CE2-CG 4.11Å; F858-L868 HydrophobicContact CZ-CB 3.86Å; F858-Q869 HydrophobicContact CE1-CG 3.6Å; F858-Q869 HydrophobicContact CZ-CG 3.68Å
859	T	82	Confident	84.4	Confident	85 Å²	85	47.1 Å²	47.1	52%	0.521	25%	0.252	S	S	.	.	H	α-helix	trans	-84.7	-27.7	-179.2	50.3	0	0	0	0	112.4	S826 V855 L856 L857	S826-T859 PolarHBondContact OG-OG1 2.63Å; V855-T859 WeakPolarHBondContact O-CG2 3.39Å; V855-T859 PolarHBondContact O-N 2.89Å; V855-T859 PolarHBondContact O-OG1 2.73Å; L856-T859 PolarHBondContact O-N 3.37Å; L856-T859 PolarHBondContact O-OG1 2.77Å; L857-T859 VanDerWaalsContact C-N 3.3Å; L857-T859 PolarHBondContact O-N 3.25Å
860	A	81.6	Confident	83.3	Confident	25 Å²	25	50.7 Å²	50.7	21%	0.207	27%	0.268	C	S	.	.	H	α-helix	trans	-80.6	-33.7	-175.5	0	0	0	0	0	115.4	L856 L857 L896	L856-A860 VanDerWaalsContact O-CB 3.23Å; L856-A860 WeakPolarHBondContact O-CB 3.4Å; L856-A860 PolarHBondContact O-N 2.71Å; L857-A860 PolarHBondContact O-N 2.99Å; A860-L896 HydrophobicContact CB-CD1 4.32Å; A860-L896 HydrophobicContact CB-CD2 3.54Å; A860-L896 HydrophobicContact CB-CG 4.49Å
861	S	86.9	Confident	82	Confident	7 Å²	7	56.2 Å²	56.2	5%	0.049	29%	0.289	C	S	.	.			trans	-152.4	138.5	-175.4	165.5	0	0	0	0	113	L857 R863 F864 K865 F921	L857-S861 PolarHBondContact O-N 3.02Å; S861-R863 VanDerWaalsContact C-N 3.28Å; S861-R863 PolarHBondContact O-N 3.48Å; S861-R863 PolarHBondContact OG-N 3.19Å; S861-F864 PolarHBondContact O-N 3.49Å; S861-F864 PolarHBondContact OG-N 3.02Å; S861-K865 WeakPolarHBondContact O-CB 3.29Å; S861-K865 PolarHBondContact O-N 3.13Å; S861-F921 WeakPolarHBondContact CB-O 3.48Å; S861-F921 PolarHBondContact OG-O 2.78Å
862	A	84.8	Confident	80.3	Confident	67 Å²	67	59.4 Å²	59.4	55%	0.554	32%	0.315	S	S	*	.	H	α-helix	trans	-63	-33.4	172.4	0	0	0	0	0	112.6	K865 S866	A862-K865 PolarHBondContact O-N 3.41Å; A862-S866 WeakPolarHBondContact O-CB 3.43Å; A862-S866 PolarHBondContact O-N 3.21Å
863	R	87.4	Confident	78.6	Confident	89 Å²	89	65 Å²	65	34%	0.336	36%	0.362	S	S	.	.	H	α-helix	trans	-66	-47.1	175.9	-175.4	66.5	169.6	169.9	-1	111.4	S861 K865 S866 L867 F920 Q922	S861-R863 VanDerWaalsContact C-N 3.28Å; S861-R863 PolarHBondContact O-N 3.48Å; S861-R863 PolarHBondContact OG-N 3.19Å; R863-K865 VanDerWaalsContact C-N 3.33Å; R863-K865 PolarHBondContact O-N 3.03Å; R863-S866 PolarHBondContact O-N 2.85Å; R863-L867 HydrophobicContact CG-CD1 4.17Å; R863-L867 WeakPolarHBondContact O-CG 3.47Å; R863-L867 PolarHBondContact O-N 3.41Å; R863-F920 WeakPolarHBondContact CG-O 3.39Å; R863-Q922 HydrophobicContact CB-CB 4.44Å; R863-Q922 HydrophobicContact CB-CG 4.16Å
864	F	87.6	Confident	76.8	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-63	-41	176.6	-83.5	-58.7	0	0	0	111.5	F843 L857 S861 S866 L867 L868 F889 V892 M893 L896 F921	F843-F864 HydrophobicContact CZ-CD1 4.44Å; F843-F864 HydrophobicContact CZ-CE1 4.37Å; L857-F864 HydrophobicContact CB-CB 4.04Å; L857-F864 HydrophobicContact CB-CG 4.28Å; L857-F864 HydrophobicContact CD1-CD1 4.48Å; L857-F864 HydrophobicContact CD2-CD1 4.38Å; L857-F864 HydrophobicContact CD2-CD2 4.17Å; L857-F864 HydrophobicContact CD2-CE1 4.49Å; L857-F864 HydrophobicContact CD2-CE2 4.31Å; L857-F864 HydrophobicContact CD2-CG 4.23Å; L857-F864 HydrophobicContact CD2-CZ 4.47Å; L857-F864 WeakPolarHBondContact O-CB 3.34Å; S861-F864 PolarHBondContact O-N 3.49Å; S861-F864 PolarHBondContact OG-N 3.02Å; F864-S866 PolarHBondContact O-N 3.49Å; F864-L867 HydrophobicContact CD1-CD1 4.4Å; F864-L867 PolarHBondContact O-N 3.42Å; F864-L868 WeakPolarHBondContact O-CB 3.45Å; F864-L868 WeakPolarHBondContact O-CD1 3.23Å; F864-L868 VanDerWaalsContact O-CG 3.23Å; F864-L868 WeakPolarHBondContact O-CG 3.47Å; F864-L868 PolarHBondContact O-N 2.87Å; F864-F889 HydrophobicContact CE1-CE2 4.28Å; F864-F889 HydrophobicContact CZ-CE2 4.18Å; F864-V892 HydrophobicContact CE2-CG1 4.43Å; F864-V892 HydrophobicContact CZ-CG1 4.49Å; F864-M893 HydrophobicContact CE1-CE 4.04Å; F864-M893 HydrophobicContact CZ-CE 3.91Å; F864-L896 HydrophobicContact CD2-CD1 4.39Å; F864-L896 HydrophobicContact CE2-CD1 3.99Å; F864-F921 HydrophobicContact CD1-CD1 4.2Å; F864-F921 HydrophobicContact CD1-CE1 4.39Å; F864-F921 HydrophobicContact CD2-CB 4.41Å; F864-F921 HydrophobicContact CD2-CD1 4.24Å; F864-F921 AromaticContact CE1-CD1 3.57Å; F864-F921 HydrophobicContact CE1-CD1 3.57Å; F864-F921 AromaticContact CE1-CE1 3.52Å; F864-F921 HydrophobicContact CE1-CE1 3.52Å; F864-F921 HydrophobicContact CE1-CG 4.42Å; F864-F921 HydrophobicContact CE1-CZ 4.34Å; F864-F921 HydrophobicContact CE2-CB 3.82Å; F864-F921 AromaticContact CE2-CD1 3.61Å; F864-F921 HydrophobicContact CE2-CD1 3.61Å; F864-F921 HydrophobicContact CE2-CD2 4.46Å; F864-F921 HydrophobicContact CE2-CE1 4.31Å; F864-F921 AromaticContact CE2-CG 3.72Å; F864-F921 HydrophobicContact CE2-CG 3.72Å; F864-F921 HydrophobicContact CG-CD1 4.5Å; F864-F921 HydrophobicContact CZ-CB 4.26Å; F864-F921 AromaticContact CZ-CD1 3.22Å; F864-F921 HydrophobicContact CZ-CD1 3.22Å; F864-F921 HydrophobicContact CZ-CD2 4.16Å; F864-F921 AromaticContact CZ-CE1 3.46Å; F864-F921 HydrophobicContact CZ-CE1 3.46Å; F864-F921 VanDerWaalsContact CZ-CE1 3.46Å; F864-F921 HydrophobicContact CZ-CE2 4.36Å; F864-F921 AromaticContact CZ-CG 3.63Å; F864-F921 HydrophobicContact CZ-CG 3.63Å; F864-F921 HydrophobicContact CZ-CZ 4.06Å
865	K	85.5	Confident	75.3	Confident	91 Å²	91	70.8 Å²	70.8	40%	0.396	41%	0.406	S	S	.	.	H	α-helix	trans	-56.6	-47.2	172.3	178.1	170.1	-177.8	-176.3	0	112.2	F858 S861 A862 R863 L868 Q869	F858-K865 HydrophobicContact CD1-CB 4.16Å; F858-K865 HydrophobicContact CD1-CD 4.06Å; F858-K865 HydrophobicContact CD1-CG 3.61Å; F858-K865 HydrophobicContact CE1-CD 4.47Å; F858-K865 HydrophobicContact CE1-CG 3.75Å; F858-K865 HydrophobicContact CG-CG 4.44Å; S861-K865 WeakPolarHBondContact O-CB 3.29Å; S861-K865 PolarHBondContact O-N 3.13Å; A862-K865 PolarHBondContact O-N 3.41Å; R863-K865 VanDerWaalsContact C-N 3.33Å; R863-K865 PolarHBondContact O-N 3.03Å; K865-L868 PolarHBondContact O-N 3.03Å; K865-Q869 HydrophobicContact CG-CG 4.25Å; K865-Q869 WeakPolarHBondContact O-CB 3.4Å; K865-Q869 VanDerWaalsContact O-CG 3.23Å; K865-Q869 WeakPolarHBondContact O-CG 3.15Å; K865-Q869 PolarHBondContact O-N 2.82Å
866	S	85.1	Confident	74.1	Confident	42 Å²	42	74.3 Å²	74.3	29%	0.294	42%	0.422	S	S	.	.	H	α-helix	trans	-64.2	-43.4	177.3	174	0	0	0	0	112.9	A862 R863 F864 L868 Q869 N870	A862-S866 WeakPolarHBondContact O-CB 3.43Å; A862-S866 PolarHBondContact O-N 3.21Å; R863-S866 PolarHBondContact O-N 2.85Å; F864-S866 PolarHBondContact O-N 3.49Å; S866-L868 PolarHBondContact O-N 3.45Å; S866-Q869 PolarHBondContact O-N 3.28Å; S866-N870 PolarHBondContact O-N 3.29Å
867	L	82.4	Confident	72.9	Confident	48 Å²	48	77.1 Å²	77.1	25%	0.251	44%	0.439	S	S	.	.	H	α-helix	trans	-60	-32.1	176.8	-74.6	170.7	0	0	0	112.3	R863 F864 F921	R863-L867 HydrophobicContact CG-CD1 4.17Å; R863-L867 WeakPolarHBondContact O-CG 3.47Å; R863-L867 PolarHBondContact O-N 3.41Å; F864-L867 HydrophobicContact CD1-CD1 4.4Å; F864-L867 PolarHBondContact O-N 3.42Å; L867-F921 HydrophobicContact CD1-CE1 4.45Å
868	L	81	Confident	72.2	Confident	26 Å²	26	80 Å²	80	14%	0.136	46%	0.458	C	S	.	.	H	α-helix	trans	-90.5	-25.3	-179.5	-64.2	168.4	0	0	0	113.8	V841 K854 L857 F858 F864 K865 S866 I879	V841-L868 HydrophobicContact CG2-CD2 3.94Å; K854-L868 HydrophobicContact CG-CD2 4.49Å; L857-L868 HydrophobicContact CB-CD1 3.93Å; L857-L868 HydrophobicContact CD1-CD1 4.43Å; F858-L868 HydrophobicContact CD2-CB 4.15Å; F858-L868 HydrophobicContact CD2-CD1 3.57Å; F858-L868 HydrophobicContact CE2-CB 3.35Å; F858-L868 HydrophobicContact CE2-CD1 3.63Å; F858-L868 HydrophobicContact CE2-CG 4.11Å; F858-L868 HydrophobicContact CZ-CB 3.86Å; F864-L868 WeakPolarHBondContact O-CB 3.45Å; F864-L868 WeakPolarHBondContact O-CD1 3.23Å; F864-L868 VanDerWaalsContact O-CG 3.23Å; F864-L868 WeakPolarHBondContact O-CG 3.47Å; F864-L868 PolarHBondContact O-N 2.87Å; K865-L868 PolarHBondContact O-N 3.03Å; S866-L868 PolarHBondContact O-N 3.45Å; L868-I879 HydrophobicContact CD2-CD1 3.39Å
869	Q	77.1	Confident	72	Confident	109 Å²	109	77.4 Å²	77.4	51%	0.509	45%	0.448	S	S	.	.	H	α-helix	trans	-81.1	-28.4	-179	-79.2	-178.4	-33.4	0	0	114.1	F858 K865 S866 R871	F858-Q869 HydrophobicContact CE1-CG 3.6Å; F858-Q869 HydrophobicContact CZ-CG 3.68Å; K865-Q869 HydrophobicContact CG-CG 4.25Å; K865-Q869 WeakPolarHBondContact O-CB 3.4Å; K865-Q869 VanDerWaalsContact O-CG 3.23Å; K865-Q869 WeakPolarHBondContact O-CG 3.15Å; K865-Q869 PolarHBondContact O-N 2.82Å; S866-Q869 PolarHBondContact O-N 3.28Å; Q869-R871 PolarHBondContact O-N 3.23Å
870	N	62.3	Low	72	Confident	132 Å²	132	79.8 Å²	79.8	71%	0.706	45%	0.453	S	S	*	.	S	Bend	trans	-79.2	31.1	-173.6	-75.8	-11	0	0	0	114.5	S866	S866-N870 PolarHBondContact O-N 3.29Å
871	R	62.4	Low	72.1	Confident	115 Å²	115	79.2 Å²	79.2	43%	0.434	45%	0.446	S	S	.	.	S	Bend	trans	-133.1	140.8	-177.3	-70.4	-162.8	177.9	-171.6	0.8	115.2	Q869 T877 C878	Q869-R871 PolarHBondContact O-N 3.23Å; R871-T877 PolarHBondContact NH1-OG1 2.95Å; R871-C878 PolarHBondContact NH1-O 2.92Å
872	P	52.3	Low	71.8	Confident	113 Å²	113	82.8 Å²	82.8	73%	0.734	47%	0.471	S	S	*	.			trans	-71.2	143.5	172.9	28.7	-31.9	0	0	0	111.5	A874	P872-A874 PolarHBondContact O-N 2.83Å
873	A	51.6	Low	71.5	Confident	118 Å²	118	87.3 Å²	87.3	98%	0.975	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	9.2	-166.9	0	0	0	0	0	116.8
874	A	47.8	Very low	71.5	Confident	94 Å²	94	83.7 Å²	83.7	78%	0.777	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	-5.6	-163.3	0	0	0	0	0	116.4	P872	P872-A874 PolarHBondContact O-N 2.83Å
875	E	50.8	Low	71.6	Confident	145 Å²	145	88.5 Å²	88.5	68%	0.678	49%	0.489	S	S	*	.			trans	-129.3	130	-179.6	-68.3	-178.1	169.5	0	0	112.1	T877	E875-T877 HydrophobicContact CB-CG2 3.9Å; E875-T877 PolarHBondContact O-N 3.16Å; E875-T877 PolarHBondContact O-OG1 3.18Å; E875-T877 WeakPolarHBondContact OE2-CG2 3.48Å
876	N	56.2	Low	71.8	Confident	182 Å²	182	85.9 Å²	85.9	97%	0.973	48%	0.477	S	S	*	.			trans	-69.7	57.6	165.6	-78.8	-23.3	0	0	0	110.2
877	T	57.8	Low	72	Confident	64 Å²	64	88.5 Å²	88.5	39%	0.393	49%	0.488	S	S	.	.			trans	-85.7	124.4	-174.5	25.3	0	0	0	0	110.8	R871 E875	R871-T877 PolarHBondContact NH1-OG1 2.95Å; E875-T877 HydrophobicContact CB-CG2 3.9Å; E875-T877 PolarHBondContact O-N 3.16Å; E875-T877 PolarHBondContact O-OG1 3.18Å; E875-T877 WeakPolarHBondContact OE2-CG2 3.48Å
878	C	70.4	Confident	72.4	Confident	61 Å²	61	86.4 Å²	86.4	41%	0.412	48%	0.477	S	S	.	.			trans	-54.1	142	166	-72.8	0	0	0	0	110.3	T842 L844 R871	T842-C878 WeakPolarHBondContact O-CA 3.35Å; L844-C878 HydrophobicContact CB-CB 4.17Å; R871-C878 PolarHBondContact NH1-O 2.92Å
879	I	79.5	Confident	72.9	Confident	13 Å²	13	85.2 Å²	85.2	7%	0.067	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	109.8	174.2	-60.1	172.4	0	0	0	108.1	V841 T842 F843 L844 L868	V841-I879 HydrophobicContact CG2-CD1 3.75Å; V841-I879 HydrophobicContact CG2-CG1 4.49Å; T842-I879 PolarHBondContact O-N 2.75Å; F843-I879 CarbonylContact C-O 3.59Å; F843-I879 WeakPolarHBondContact CA-O 3.32Å; F843-I879 HydrophobicContact CD1-CB 3.55Å; F843-I879 HydrophobicContact CD1-CD1 4.41Å; F843-I879 HydrophobicContact CD1-CG2 3.69Å; F843-I879 HydrophobicContact CE1-CB 3.78Å; F843-I879 HydrophobicContact CE1-CD1 3.84Å; F843-I879 HydrophobicContact CE1-CG1 4.41Å; F843-I879 HydrophobicContact CE1-CG2 3.69Å; F843-I879 HydrophobicContact CG-CB 4.42Å; F843-I879 HydrophobicContact CZ-CD1 4.19Å; L844-I879 PolarHBondContact N-O 2.72Å; L868-I879 HydrophobicContact CD2-CD1 3.39Å
880	E	81.4	Confident	73.5	Confident	135 Å²	135	82.9 Å²	82.9	63%	0.631	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	130.9	-180	-165.3	172.6	-170.2	0	0	111.4	L844	L844-E880 HydrophobicContact CD2-CG 4.43Å; L844-E880 CarbonylContact O-C 3.47Å; L844-E880 WeakPolarHBondContact O-CA 3.27Å
881	I	84.3	Confident	74.8	Confident	12 Å²	12	77.2 Å²	77.2	6%	0.062	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	100.3	171.8	-58.9	177.7	0	0	0	106.7	F843 L844 V845 V884 F889 F921	F843-I881 HydrophobicContact CB-CD1 4.36Å; F843-I881 HydrophobicContact CD1-CD1 3.54Å; F843-I881 HydrophobicContact CD1-CG1 4.02Å; F843-I881 HydrophobicContact CE1-CD1 4.15Å; F843-I881 HydrophobicContact CG-CD1 4.16Å; L844-I881 PolarHBondContact O-N 3.46Å; V845-I881 HydrophobicContact CG2-CB 4.12Å; V845-I881 HydrophobicContact CG2-CD1 4.27Å; I881-V884 HydrophobicContact CG2-CB 3.86Å; I881-V884 HydrophobicContact CG2-CG2 3.95Å; I881-F889 HydrophobicContact CD1-CD2 3.7Å; I881-F889 HydrophobicContact CD1-CE1 4.19Å; I881-F889 HydrophobicContact CD1-CE2 3.05Å; I881-F889 HydrophobicContact CD1-CG 4.48Å; I881-F889 HydrophobicContact CD1-CZ 3.3Å; I881-F921 HydrophobicContact CD1-CE1 4.45Å; I881-F921 HydrophobicContact CD1-CZ 4.14Å; I881-F921 HydrophobicContact CG2-CZ 4.44Å
882	S	79.6	Confident	76.1	Confident	83 Å²	83	71.8 Å²	71.8	58%	0.58	41%	0.409	S	S	*	.			trans	-85	-22.7	-176.3	47	0	0	0	0	113.7
883	H	79.1	Confident	77.8	Confident	161 Å²	161	66.4 Å²	66.4	75%	0.745	37%	0.374	S	S	*	.	S	Bend	trans	-105.8	10	-167.4	-57.8	-66.3	0	0	0	114.6
884	V	87.8	Confident	79.5	Confident	14 Å²	14	63 Å²	63	9%	0.085	34%	0.338	C	S	.	.	S	Bend	trans	-136.6	131.6	-179.9	-174.8	0	0	0	0	109	V845 I881 I888 F889 A917 F921	V845-V884 WeakPolarHBondContact CG1-O 3.29Å; I881-V884 HydrophobicContact CG2-CB 3.86Å; I881-V884 HydrophobicContact CG2-CG2 3.95Å; V884-I888 HydrophobicContact CG1-CB 3.89Å; V884-I888 HydrophobicContact CG1-CG2 3.83Å; V884-F889 HydrophobicContact CG1-CB 4.08Å; V884-A917 HydrophobicContact CG1-CB 4.08Å; V884-A917 HydrophobicContact CG2-CB 4.35Å; V884-F921 HydrophobicContact CG2-CE2 4.09Å; V884-F921 HydrophobicContact CG2-CZ 4.28Å
885	K	89.8	Confident	81.3	Confident	100 Å²	100	59.2 Å²	59.2	44%	0.435	30%	0.303	S	S	.	.			trans	-66.1	151.3	176.1	-61.7	-175.4	-173.8	155.6	0	111.4	N887 I888 F889 E913	K885-N887 VanDerWaalsContact C-N 3.31Å; K885-N887 PolarHBondContact O-N 3.33Å; K885-I888 HydrophobicContact CB-CG1 4.21Å; K885-I888 PolarHBondContact O-N 3.07Å; K885-I888 VanDerWaalsContact O-N 3.13Å; K885-F889 PolarHBondContact O-N 3.14Å; K885-E913 WeakPolarHBondContact CD-OE2 3.27Å; K885-E913 VanDerWaalsContact NZ-CD 3.28Å; K885-E913 IonicContact NZ-OE1 2.86Å; K885-E913 PolarHBondContact NZ-OE1 3.23Å; K885-E913 IonicContact NZ-OE2 2.74Å; K885-E913 PolarHBondContact NZ-OE2 3.4Å; K885-E913 VanDerWaalsContact NZ-OE2 3.11Å
886	Y	88.9	Confident	83	Confident	36 Å²	36	52.3 Å²	52.3	14%	0.141	27%	0.271	C	S	.	.	H	α-helix	trans	-54.9	-44.5	-177.4	-171.9	-89.7	0	0	0	112.9	N834 V845 E846 K848 F850 I888 F889 H890	N834-Y886 PolarHBondContact ND2-OH 3.47Å; N834-Y886 VanDerWaalsContact ND2-OH 3.11Å; V845-Y886 HydrophobicContact CB-CD2 4.03Å; E846-Y886 WeakPolarHBondContact OE2-CB 3.47Å; E846-Y886 PolarHBondContact OE2-N 3.24Å; K848-Y886 HydrophobicContact CB-CD2 3.64Å; K848-Y886 HydrophobicContact CB-CE2 3.55Å; K848-Y886 HydrophobicContact CD-CD2 4.03Å; K848-Y886 HydrophobicContact CD-CE2 4.28Å; K848-Y886 HydrophobicContact CD-CG 4.22Å; K848-Y886 HydrophobicContact CG-CD2 4.45Å; F850-Y886 HydrophobicContact CB-CE2 4.31Å; F850-Y886 HydrophobicContact CD2-CE1 4.41Å; F850-Y886 AromaticContact CD2-CE2 3.86Å; F850-Y886 HydrophobicContact CD2-CE2 3.86Å; F850-Y886 AromaticContact CD2-CZ 3.73Å; Y886-I888 PolarHBondContact O-N 2.8Å; Y886-F889 PolarHBondContact O-N 3.41Å; Y886-H890 WeakPolarHBondContact O-CB 3.5Å; Y886-H890 PolarHBondContact O-N 2.82Å
887	N	89.8	Confident	84.3	Confident	98 Å²	98	43.7 Å²	43.7	52%	0.524	23%	0.225	S	C	.	.	H	α-helix	trans	-66.7	-37.6	-178.9	-65.8	-11.6	0	0	0	112.6	K885 H890 L891	K885-N887 VanDerWaalsContact C-N 3.31Å; K885-N887 PolarHBondContact O-N 3.33Å; N887-H890 WeakPolarHBondContact O-CB 3.49Å; N887-H890 PolarHBondContact O-N 3.1Å; N887-L891 PolarHBondContact O-N 3.18Å
888	I	91.3	Very high	85.3	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-69.2	-41.5	177.5	-57.7	-59.9	0	0	0	110.1	V884 K885 Y886 H890 L891 V892 E910 E913 L914 A917	V884-I888 HydrophobicContact CG1-CB 3.89Å; V884-I888 HydrophobicContact CG1-CG2 3.83Å; K885-I888 HydrophobicContact CB-CG1 4.21Å; K885-I888 PolarHBondContact O-N 3.07Å; K885-I888 VanDerWaalsContact O-N 3.13Å; Y886-I888 PolarHBondContact O-N 2.8Å; I888-H890 VanDerWaalsContact C-N 3.3Å; I888-H890 PolarHBondContact O-N 3.17Å; I888-L891 HydrophobicContact CD1-CD1 4.48Å; I888-L891 WeakPolarHBondContact O-CB 3.26Å; I888-L891 PolarHBondContact O-N 3.3Å; I888-V892 WeakPolarHBondContact O-CG2 3.47Å; I888-V892 PolarHBondContact O-N 2.98Å; I888-E910 HydrophobicContact CD1-CB 3.81Å; I888-E910 HydrophobicContact CD1-CG 4.17Å; I888-E913 HydrophobicContact CD1-CB 3.89Å; I888-E913 HydrophobicContact CG1-CB 3.93Å; I888-L914 HydrophobicContact CG2-CB 4.35Å; I888-L914 HydrophobicContact CG2-CD1 4.03Å; I888-A917 HydrophobicContact CG2-CB 3.7Å
889	F	90.6	Very high	85.5	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.2	-38	174.5	-170	-105.6	0	0	0	112.1	F843 V845 F850 F864 I881 V884 K885 Y886 L891 V892 M893 F921	F843-F889 HydrophobicContact CB-CE1 4.07Å; F843-F889 HydrophobicContact CB-CZ 4.18Å; F843-F889 HydrophobicContact CD1-CZ 4.14Å; F843-F889 HydrophobicContact CD2-CE1 4.23Å; F843-F889 AromaticContact CD2-CZ 3.99Å; F843-F889 HydrophobicContact CD2-CZ 3.99Å; F843-F889 HydrophobicContact CE2-CZ 4.45Å; F843-F889 HydrophobicContact CG-CE1 4.14Å; F843-F889 AromaticContact CG-CZ 3.83Å; F843-F889 HydrophobicContact CG-CZ 3.83Å; V845-F889 HydrophobicContact CG1-CB 4.11Å; V845-F889 HydrophobicContact CG1-CG 4.49Å; V845-F889 HydrophobicContact CG2-CB 4.41Å; V845-F889 HydrophobicContact CG2-CD1 3.62Å; V845-F889 HydrophobicContact CG2-CE1 3.9Å; V845-F889 HydrophobicContact CG2-CG 3.96Å; F850-F889 HydrophobicContact CB-CD1 4.38Å; F850-F889 HydrophobicContact CB-CE1 4.17Å; F850-F889 HydrophobicContact CD1-CD1 4.24Å; F850-F889 AromaticContact CD1-CE1 3.86Å; F850-F889 HydrophobicContact CD1-CE1 3.86Å; F850-F889 AromaticContact CD2-CD1 3.99Å; F850-F889 HydrophobicContact CD2-CD1 3.99Å; F850-F889 HydrophobicContact CD2-CE1 4.39Å; F850-F889 HydrophobicContact CE1-CE1 4.4Å; F850-F889 HydrophobicContact CE2-CD1 4.36Å; F850-F889 AromaticContact CG-CD1 3.94Å; F850-F889 HydrophobicContact CG-CD1 3.94Å; F850-F889 AromaticContact CG-CE1 3.87Å; F850-F889 HydrophobicContact CG-CE1 3.87Å; F864-F889 HydrophobicContact CE1-CE2 4.28Å; F864-F889 HydrophobicContact CZ-CE2 4.18Å; I881-F889 HydrophobicContact CD1-CD2 3.7Å; I881-F889 HydrophobicContact CD1-CE1 4.19Å; I881-F889 HydrophobicContact CD1-CE2 3.05Å; I881-F889 HydrophobicContact CD1-CG 4.48Å; I881-F889 HydrophobicContact CD1-CZ 3.3Å; V884-F889 HydrophobicContact CG1-CB 4.08Å; K885-F889 PolarHBondContact O-N 3.14Å; Y886-F889 PolarHBondContact O-N 3.41Å; F889-L891 PolarHBondContact O-N 3.34Å; F889-V892 PolarHBondContact O-N 2.86Å; F889-M893 HydrophobicContact CD1-CG 4.22Å; F889-M893 HydrophobicContact CE1-CE 3.62Å; F889-M893 HydrophobicContact CE1-CG 3.95Å; F889-M893 HydrophobicContact CE2-CE 3.71Å; F889-M893 HydrophobicContact CZ-CE 3.09Å; F889-M893 HydrophobicContact CZ-CG 4.26Å; F889-M893 WeakPolarHBondContact O-CG 3.42Å; F889-M893 PolarHBondContact O-N 3.27Å; F889-F921 HydrophobicContact CD2-CE2 4.03Å; F889-F921 AromaticContact CD2-CZ 3.89Å; F889-F921 HydrophobicContact CD2-CZ 3.89Å; F889-F921 HydrophobicContact CE2-CE1 4.36Å; F889-F921 HydrophobicContact CE2-CE2 4.2Å; F889-F921 AromaticContact CE2-CZ 3.73Å; F889-F921 HydrophobicContact CE2-CZ 3.73Å
890	H	89.7	Confident	85.4	Confident	60 Å²	60	39.6 Å²	39.6	28%	0.278	20%	0.204	S	C	.	.	H	α-helix	trans	-59.5	-43.7	172.4	-174.6	-75	0	0	0	111.8	F850 Y886 N887 I888 M893 Q894	F850-H890 HydrophobicContact CE2-CB 3.9Å; F850-H890 AromaticContact CE2-CD2 3.69Å; F850-H890 HydrophobicContact CZ-CB 4.49Å; Y886-H890 WeakPolarHBondContact O-CB 3.5Å; Y886-H890 PolarHBondContact O-N 2.82Å; N887-H890 WeakPolarHBondContact O-CB 3.49Å; N887-H890 PolarHBondContact O-N 3.1Å; I888-H890 VanDerWaalsContact C-N 3.3Å; I888-H890 PolarHBondContact O-N 3.17Å; H890-M893 PolarHBondContact O-N 2.6Å; H890-Q894 WeakPolarHBondContact O-CB 3.45Å; H890-Q894 PolarHBondContact O-N 3.16Å
891	L	89.6	Confident	85.4	Confident	14 Å²	14	34.2 Å²	34.2	7%	0.073	18%	0.181	C	C	.	.	H	α-helix	trans	-63.6	-41.5	176	-71.9	170.1	0	0	0	112.5	N887 I888 F889 M893 Q894 Y895 L904 L914	N887-L891 PolarHBondContact O-N 3.18Å; I888-L891 HydrophobicContact CD1-CD1 4.48Å; I888-L891 WeakPolarHBondContact O-CB 3.26Å; I888-L891 PolarHBondContact O-N 3.3Å; F889-L891 PolarHBondContact O-N 3.34Å; L891-M893 VanDerWaalsContact C-N 3.31Å; L891-M893 PolarHBondContact O-N 2.9Å; L891-Q894 PolarHBondContact O-N 3.34Å; L891-Y895 PolarHBondContact O-N 3.34Å; L891-L904 HydrophobicContact CD2-CD2 4.24Å; L891-L914 HydrophobicContact CB-CD1 3.97Å; L891-L914 HydrophobicContact CD1-CD2 4.46Å
892	V	89.4	Confident	84.8	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.2	-44.2	173.6	172.4	0	0	0	0	110.6	F864 I888 F889 Y895 L896 L914 A917 F921 L923 L926	F864-V892 HydrophobicContact CE2-CG1 4.43Å; F864-V892 HydrophobicContact CZ-CG1 4.49Å; I888-V892 WeakPolarHBondContact O-CG2 3.47Å; I888-V892 PolarHBondContact O-N 2.98Å; F889-V892 PolarHBondContact O-N 2.86Å; V892-Y895 WeakPolarHBondContact O-CB 3.42Å; V892-Y895 PolarHBondContact O-N 3.07Å; V892-L896 WeakPolarHBondContact O-CG 3.3Å; V892-L896 PolarHBondContact O-N 3.44Å; V892-L914 HydrophobicContact CG2-CD1 3.7Å; V892-A917 HydrophobicContact CG2-CB 4.04Å; V892-F921 HydrophobicContact CG1-CD2 4.04Å; V892-F921 HydrophobicContact CG2-CD2 4.38Å; V892-L923 HydrophobicContact CG1-CD1 3.65Å; V892-L926 HydrophobicContact CG2-CD2 4.32Å
893	M	87.9	Confident	84.5	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-68.4	-40.8	177.5	-71	-66.3	173.9	0	0	111.8	L833 F843 F850 A852 L857 F864 F889 H890 L891 Y895 L896 Y897	L833-M893 HydrophobicContact CD1-CB 3.72Å; F843-M893 HydrophobicContact CD2-CE 4.43Å; F843-M893 HydrophobicContact CE2-CE 4.15Å; F850-M893 HydrophobicContact CD1-CG 4.32Å; F850-M893 HydrophobicContact CE1-CB 3.82Å; F850-M893 HydrophobicContact CE1-CG 3.58Å; F850-M893 HydrophobicContact CZ-CB 3.74Å; F850-M893 HydrophobicContact CZ-CG 3.88Å; A852-M893 HydrophobicContact CB-CE 4.49Å; A852-M893 HydrophobicContact CB-SD 4.44Å; L857-M893 HydrophobicContact CD1-CE 4.08Å; L857-M893 HydrophobicContact CD2-CE 3.68Å; L857-M893 HydrophobicContact CD2-SD 3.77Å; F864-M893 HydrophobicContact CE1-CE 4.04Å; F864-M893 HydrophobicContact CZ-CE 3.91Å; F889-M893 HydrophobicContact CD1-CG 4.22Å; F889-M893 HydrophobicContact CE1-CE 3.62Å; F889-M893 HydrophobicContact CE1-CG 3.95Å; F889-M893 HydrophobicContact CE2-CE 3.71Å; F889-M893 HydrophobicContact CZ-CE 3.09Å; F889-M893 HydrophobicContact CZ-CG 4.26Å; F889-M893 WeakPolarHBondContact O-CG 3.42Å; F889-M893 PolarHBondContact O-N 3.27Å; H890-M893 PolarHBondContact O-N 2.6Å; L891-M893 VanDerWaalsContact C-N 3.31Å; L891-M893 PolarHBondContact O-N 2.9Å; M893-Y895 VanDerWaalsContact C-N 3.29Å; M893-Y895 PolarHBondContact O-N 2.86Å; M893-L896 PolarHBondContact O-N 2.97Å; M893-L896 HydrophobicContact SD-CD1 4.29Å; M893-Y897 VanDerWaalsContact O-CD2 3.22Å; M893-Y897 WeakPolarHBondContact O-CD2 3.38Å; M893-Y897 PolarHBondContact O-N 3.37Å; M893-Y897 HydrophobicContact SD-CE2 4.42Å
894	Q	87.1	Confident	84.6	Confident	47 Å²	47	35 Å²	35	22%	0.22	18%	0.183	C	C	.	.	H	α-helix	trans	-58.6	-41.2	176	-173.3	176.6	1.1	0	0	111.8	L833 H890 L891 L896 Y897 C898 L904	L833-Q894 HydrophobicContact CD2-CB 4.11Å; L833-Q894 HydrophobicContact CD2-CG 4.36Å; H890-Q894 WeakPolarHBondContact O-CB 3.45Å; H890-Q894 PolarHBondContact O-N 3.16Å; L891-Q894 PolarHBondContact O-N 3.34Å; Q894-L896 VanDerWaalsContact C-N 3.33Å; Q894-L896 PolarHBondContact O-N 3.45Å; Q894-Y897 PolarHBondContact O-N 3.28Å; Q894-C898 VanDerWaalsContact O-CB 3.26Å; Q894-C898 WeakPolarHBondContact O-CB 3.48Å; Q894-C898 PolarHBondContact O-N 3.42Å; Q894-C898 PolarHBondContact O-SG 3.47Å; Q894-L904 HydrophobicContact CB-CD2 3.99Å; Q894-L904 HydrophobicContact CG-CD2 3.99Å
895	Y	87.6	Confident	84.4	Confident	14 Å²	14	41.4 Å²	41.4	6%	0.055	21%	0.212	C	C	.	.	H	α-helix	trans	-56.9	-45.5	172.6	166.1	-105.2	0	0	0	111.9	L891 V892 M893 G899 G900 T901 L904 L923 A925 L926	L891-Y895 PolarHBondContact O-N 3.34Å; V892-Y895 WeakPolarHBondContact O-CB 3.42Å; V892-Y895 PolarHBondContact O-N 3.07Å; M893-Y895 VanDerWaalsContact C-N 3.29Å; M893-Y895 PolarHBondContact O-N 2.86Å; Y895-G899 PolarHBondContact O-N 3.08Å; Y895-G899 VanDerWaalsContact O-N 3.11Å; Y895-G900 WeakPolarHBondContact CD2-O 3.38Å; Y895-G900 PolarHBondContact O-N 3.3Å; Y895-T901 HydrophobicContact CD2-CG2 3.97Å; Y895-T901 HydrophobicContact CE2-CG2 3.89Å; Y895-L904 HydrophobicContact CD2-CD1 3.88Å; Y895-L904 HydrophobicContact CG-CD1 4.21Å; Y895-L923 HydrophobicContact CD1-CD1 4.25Å; Y895-L923 HydrophobicContact CE1-CD1 4.37Å; Y895-L923 HydrophobicContact CE1-CD2 4.44Å; Y895-A925 WeakPolarHBondContact OH-CB 3.36Å; Y895-L926 HydrophobicContact CD1-CB 4Å; Y895-L926 HydrophobicContact CD1-CD2 3.86Å; Y895-L926 HydrophobicContact CD1-CG 4.35Å; Y895-L926 HydrophobicContact CD2-CB 4.23Å; Y895-L926 HydrophobicContact CD2-CD1 3.92Å; Y895-L926 HydrophobicContact CD2-CG 4.5Å; Y895-L926 HydrophobicContact CE1-CB 3.85Å; Y895-L926 HydrophobicContact CE1-CD2 4.5Å; Y895-L926 HydrophobicContact CE2-CB 4.08Å; Y895-L926 HydrophobicContact CE2-CD1 4.48Å; Y895-L926 HydrophobicContact CG-CB 4.19Å; Y895-L926 HydrophobicContact CG-CD1 3.95Å; Y895-L926 HydrophobicContact CG-CD2 3.98Å; Y895-L926 HydrophobicContact CG-CG 4.26Å
896	L	86.3	Confident	84.3	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-68.7	-38.8	-177.7	-66.5	-178.8	0	0	0	113.2	L856 L857 A860 F864 V892 M893 Q894 L923	L856-L896 HydrophobicContact CD2-CB 4.03Å; L857-L896 HydrophobicContact CD2-CD1 3.59Å; A860-L896 HydrophobicContact CB-CD1 4.32Å; A860-L896 HydrophobicContact CB-CD2 3.54Å; A860-L896 HydrophobicContact CB-CG 4.49Å; F864-L896 HydrophobicContact CD2-CD1 4.39Å; F864-L896 HydrophobicContact CE2-CD1 3.99Å; V892-L896 WeakPolarHBondContact O-CG 3.3Å; V892-L896 PolarHBondContact O-N 3.44Å; M893-L896 PolarHBondContact O-N 2.97Å; M893-L896 HydrophobicContact SD-CD1 4.29Å; Q894-L896 VanDerWaalsContact C-N 3.33Å; Q894-L896 PolarHBondContact O-N 3.45Å; L896-L923 HydrophobicContact CD2-CD1 4.42Å; L896-L923 HydrophobicContact CD2-CD2 4Å
897	Y	83.1	Confident	84	Confident	1 Å²	1	42 Å²	42	0%	0.004	21%	0.212	C	C	.	.	H	α-helix	trans	-76.4	-45.2	179.7	-79.1	-112.6	0	0	0	111.2	L828 F832 L833 A852 H853 L856 M893 Q894 G899	L828-Y897 HydrophobicContact CB-CD1 3.87Å; L828-Y897 HydrophobicContact CB-CE1 4.36Å; L828-Y897 HydrophobicContact CD1-CE1 4.28Å; L828-Y897 PolarHBondContact N-O 3.47Å; L828-Y897 CarbonylContact O-C 3.29Å; F832-Y897 HydrophobicContact CB-CD1 4.28Å; F832-Y897 HydrophobicContact CB-CE1 4.01Å; F832-Y897 WeakPolarHBondContact O-CE1 3.36Å; L833-Y897 HydrophobicContact CD1-CD2 3.83Å; L833-Y897 HydrophobicContact CD1-CE2 4.1Å; L833-Y897 HydrophobicContact CD1-CG 4.11Å; A852-Y897 WeakPolarHBondContact CA-OH 3.4Å; H853-Y897 PolarHBondContact N-OH 2.87Å; H853-Y897 AromaticContact ND1-CE1 3.51Å; H853-Y897 AromaticContact ND1-CZ 3.49Å; H853-Y897 PolarHBondContact ND1-OH 3.39Å; L856-Y897 HydrophobicContact CD2-CD1 4.41Å; L856-Y897 HydrophobicContact CD2-CD2 3.39Å; L856-Y897 HydrophobicContact CD2-CE1 4.33Å; L856-Y897 HydrophobicContact CD2-CE2 3.34Å; L856-Y897 HydrophobicContact CD2-CG 3.99Å; M893-Y897 VanDerWaalsContact O-CD2 3.22Å; M893-Y897 WeakPolarHBondContact O-CD2 3.38Å; M893-Y897 PolarHBondContact O-N 3.37Å; M893-Y897 HydrophobicContact SD-CE2 4.42Å; Q894-Y897 PolarHBondContact O-N 3.28Å; Y897-G899 PolarHBondContact O-N 3.5Å
898	C	78.5	Confident	83.6	Confident	27 Å²	27	42.3 Å²	42.3	18%	0.182	21%	0.214	C	C	.	.	H	α-helix	trans	-70.1	-14.9	179.9	-59.4	0	0	0	0	113.1	Q894 S903	Q894-C898 VanDerWaalsContact O-CB 3.26Å; Q894-C898 WeakPolarHBondContact O-CB 3.48Å; Q894-C898 PolarHBondContact O-N 3.42Å; Q894-C898 PolarHBondContact O-SG 3.47Å; C898-S903 VanDerWaalsContact CB-OG 3.26Å; C898-S903 WeakPolarHBondContact CB-OG 3.45Å; C898-S903 PolarHBondContact SG-OG 3.5Å
899	G	73.8	Confident	83.2	Confident	5 Å²	5	47.4 Å²	47.4	5%	0.052	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	40	175.6	0	0	0	0	0	113.4	R827 Y895 Y897	R827-G899 PolarHBondContact NH2-O 3.35Å; Y895-G899 PolarHBondContact O-N 3.08Å; Y895-G899 VanDerWaalsContact O-N 3.11Å; Y897-G899 PolarHBondContact O-N 3.5Å
900	G	78.3	Confident	83.1	Confident	20 Å²	20	48.5 Å²	48.5	21%	0.206	25%	0.251	C	S	.	.	S	Bend	trans	159.5	-179.5	179.7	0	0	0	0	0	114.4	Y895	Y895-G900 WeakPolarHBondContact CD2-O 3.38Å; Y895-G900 PolarHBondContact O-N 3.3Å
901	T	80.3	Confident	83.1	Confident	22 Å²	22	45.9 Å²	45.9	14%	0.135	24%	0.239	C	C	.	.	S	Bend	trans	-97	-9.7	-176.6	47	0	0	0	0	114	E819 Y895 S903 L904 L926 H929	E819-T901 PolarHBondContact OE1-OG1 3.3Å; E819-T901 VanDerWaalsContact OE1-OG1 3.14Å; Y895-T901 HydrophobicContact CD2-CG2 3.97Å; Y895-T901 HydrophobicContact CE2-CG2 3.89Å; T901-S903 VanDerWaalsContact C-N 3.27Å; T901-S903 PolarHBondContact O-N 3.48Å; T901-L904 HydrophobicContact CG2-CD1 4.21Å; T901-L904 PolarHBondContact O-N 2.9Å; T901-L926 HydrophobicContact CG2-CD1 4.38Å; T901-H929 HydrophobicContact CG2-CB 3.61Å; T901-H929 VanDerWaalsContact CG2-CG 3.47Å
902	E	73.4	Confident	83	Confident	189 Å²	189	47.2 Å²	47.2	88%	0.883	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-26.5	-172.6	-62.8	179.6	171.9	0	0	114.1
903	S	71.9	Confident	83	Confident	64 Å²	64	50.6 Å²	50.6	45%	0.448	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	4.2	-178.2	59.4	0	0	0	0	114.3	C898 T901	C898-S903 VanDerWaalsContact CB-OG 3.26Å; C898-S903 WeakPolarHBondContact CB-OG 3.45Å; C898-S903 PolarHBondContact SG-OG 3.5Å; T901-S903 VanDerWaalsContact C-N 3.27Å; T901-S903 PolarHBondContact O-N 3.48Å
904	L	82.6	Confident	83.1	Confident	20 Å²	20	50.6 Å²	50.6	11%	0.105	26%	0.261	C	S	.	.			trans	-86.3	119.9	-178.5	-74.9	162.7	0	0	0	110.9	L891 Q894 Y895 T901 I906 L926	L891-L904 HydrophobicContact CD2-CD2 4.24Å; Q894-L904 HydrophobicContact CB-CD2 3.99Å; Q894-L904 HydrophobicContact CG-CD2 3.99Å; Y895-L904 HydrophobicContact CD2-CD1 3.88Å; Y895-L904 HydrophobicContact CG-CD1 4.21Å; T901-L904 HydrophobicContact CG2-CD1 4.21Å; T901-L904 PolarHBondContact O-N 2.9Å; L904-I906 HydrophobicContact CB-CD1 4.29Å; L904-I906 HydrophobicContact CB-CG1 4.18Å; L904-L926 HydrophobicContact CD1-CD1 3.94Å
905	H	83.6	Confident	83.2	Confident	149 Å²	149	48.4 Å²	48.4	69%	0.69	25%	0.251	S	S	*	.			trans	-93.8	99.5	168.2	-176	71.9	0	0	0	109.7
906	I	85.9	Confident	83.3	Confident	18 Å²	18	49.6 Å²	49.6	9%	0.092	26%	0.261	C	S	.	.			trans	-102.8	119	-179.5	-54.3	163.1	0	0	0	108.5	L904 V911 L914 I933	L904-I906 HydrophobicContact CB-CD1 4.29Å; L904-I906 HydrophobicContact CB-CG1 4.18Å; I906-V911 HydrophobicContact CG2-CB 4.36Å; I906-V911 HydrophobicContact CG2-CG2 3.62Å; I906-L914 HydrophobicContact CB-CD2 4.5Å; I906-L914 HydrophobicContact CD1-CD2 3.53Å; I906-L914 HydrophobicContact CG1-CD2 3.73Å; I906-L914 HydrophobicContact CG2-CD2 3.91Å; I906-I933 HydrophobicContact CB-CD1 4.24Å; I906-I933 HydrophobicContact CD1-CD1 3.69Å
907	R	84.1	Confident	83.5	Confident	129 Å²	129	49.7 Å²	49.7	49%	0.487	26%	0.262	S	S	.	.			trans	-76.7	145.2	174.3	-59.4	-175.1	-67.4	160.2	-6.1	110	T909 E910 V911	R907-T909 PolarHBondContact O-N 3.49Å; R907-T909 VanDerWaalsContact O-N 3.1Å; R907-E910 HydrophobicContact CB-CG 4.4Å; R907-E910 WeakPolarHBondContact CB-OE2 3.44Å; R907-E910 IonicContact CZ-OE1 3.7Å; R907-E910 IonicContact CZ-OE2 3.67Å; R907-E910 VanDerWaalsContact NE-CD 3.29Å; R907-E910 IonicContact NE-OE1 2.92Å; R907-E910 PolarHBondContact NE-OE1 2.91Å; R907-E910 IonicContact NE-OE2 3.21Å; R907-E910 PolarHBondContact NE-OE2 3.26Å; R907-E910 VanDerWaalsContact NH2-CD 3.27Å; R907-E910 IonicContact NH2-OE1 3.69Å; R907-E910 PolarHBondContact NH2-OE1 3.27Å; R907-E910 IonicContact NH2-OE2 2.74Å; R907-E910 PolarHBondContact O-N 2.85Å; R907-V911 WeakPolarHBondContact O-CG2 3.28Å; R907-V911 PolarHBondContact O-N 3.14Å
908	N	80.5	Confident	83.9	Confident	106 Å²	106	49.6 Å²	49.6	57%	0.567	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-34.8	-179.1	-70.5	-4.1	0	0	0	113.6	E910 N937	N908-E910 PolarHBondContact O-N 2.84Å; N908-N937 VanDerWaalsContact CG-ND2 3.31Å; N908-N937 PolarHBondContact OD1-ND2 3.3Å
909	T	83.9	Confident	84.4	Confident	111 Å²	111	52.2 Å²	52.2	68%	0.681	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-18.8	177.8	53.9	0	0	0	0	113.9	R907	R907-T909 PolarHBondContact O-N 3.49Å; R907-T909 VanDerWaalsContact O-N 3.1Å
910	E	87.3	Confident	85.1	Confident	23 Å²	23	55.7 Å²	55.7	11%	0.107	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-13.5	-174.8	-65.3	175.9	143	0	0	112.6	I888 R907 N908 M912 E913 L914	I888-E910 HydrophobicContact CD1-CB 3.81Å; I888-E910 HydrophobicContact CD1-CG 4.17Å; R907-E910 HydrophobicContact CB-CG 4.4Å; R907-E910 WeakPolarHBondContact CB-OE2 3.44Å; R907-E910 IonicContact CZ-OE1 3.7Å; R907-E910 IonicContact CZ-OE2 3.67Å; R907-E910 VanDerWaalsContact NE-CD 3.29Å; R907-E910 IonicContact NE-OE1 2.92Å; R907-E910 PolarHBondContact NE-OE1 2.91Å; R907-E910 IonicContact NE-OE2 3.21Å; R907-E910 PolarHBondContact NE-OE2 3.26Å; R907-E910 VanDerWaalsContact NH2-CD 3.27Å; R907-E910 IonicContact NH2-OE1 3.69Å; R907-E910 PolarHBondContact NH2-OE1 3.27Å; R907-E910 IonicContact NH2-OE2 2.74Å; R907-E910 PolarHBondContact O-N 2.85Å; N908-E910 PolarHBondContact O-N 2.84Å; E910-M912 VanDerWaalsContact C-N 3.34Å; E910-M912 PolarHBondContact O-N 3.39Å; E910-E913 PolarHBondContact O-N 2.82Å; E910-L914 WeakPolarHBondContact O-CB 3.25Å; E910-L914 PolarHBondContact O-N 3.32Å
911	V	89.4	Confident	85.7	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.024	27%	0.274	C	S	.	.	H	α-helix	trans	-59.8	-42	-172.9	-176.6	0	0	0	0	112	I906 R907 L914 L915 C930 I933 C934	I906-V911 HydrophobicContact CG2-CB 4.36Å; I906-V911 HydrophobicContact CG2-CG2 3.62Å; R907-V911 WeakPolarHBondContact O-CG2 3.28Å; R907-V911 PolarHBondContact O-N 3.14Å; V911-L914 PolarHBondContact O-N 2.99Å; V911-L915 WeakPolarHBondContact O-CB 3.08Å; V911-L915 PolarHBondContact O-N 3.18Å; V911-C930 HydrophobicContact CG1-CB 4.18Å; V911-I933 HydrophobicContact CG1-CB 4.22Å; V911-I933 HydrophobicContact CG1-CG2 4.15Å; V911-I933 HydrophobicContact CG2-CG2 3.67Å; V911-C934 WeakPolarHBondContact CG1-SG 3.28Å
912	M	87.6	Confident	86.1	Confident	43 Å²	43	58.9 Å²	58.9	21%	0.212	29%	0.292	C	S	.	.	H	α-helix	trans	-69.7	-40	-178	-62	-54.3	-64.6	0	0	112.1	E910 L914 L915 S916 L946 H949	E910-M912 VanDerWaalsContact C-N 3.34Å; E910-M912 PolarHBondContact O-N 3.39Å; M912-L914 VanDerWaalsContact C-N 3.33Å; M912-L915 HydrophobicContact CE-CD2 4.34Å; M912-L915 PolarHBondContact O-N 3.33Å; M912-S916 PolarHBondContact O-N 3.22Å; M912-L946 HydrophobicContact CE-CD2 4.11Å; M912-L946 HydrophobicContact SD-CD2 3.57Å; M912-L946 VanDerWaalsContact SD-CD2 3.57Å; M912-H949 HydrophobicContact CE-CB 3.57Å; M912-H949 WeakPolarHBondContact CE-CD2 3.49Å
913	E	89.1	Confident	86.8	Confident	70 Å²	70	50.2 Å²	50.2	33%	0.327	25%	0.251	S	S	.	.	H	α-helix	trans	-68.3	-34.6	174.4	-61.6	-175.1	-179.4	0	0	111.5	K885 I888 E910 S916 A917	K885-E913 WeakPolarHBondContact CD-OE2 3.27Å; K885-E913 VanDerWaalsContact NZ-CD 3.28Å; K885-E913 IonicContact NZ-OE1 2.86Å; K885-E913 PolarHBondContact NZ-OE1 3.23Å; K885-E913 IonicContact NZ-OE2 2.74Å; K885-E913 PolarHBondContact NZ-OE2 3.4Å; K885-E913 VanDerWaalsContact NZ-OE2 3.11Å; I888-E913 HydrophobicContact CD1-CB 3.89Å; I888-E913 HydrophobicContact CG1-CB 3.93Å; E910-E913 PolarHBondContact O-N 2.82Å; E913-S916 PolarHBondContact O-OG 3.23Å; E913-A917 WeakPolarHBondContact O-CB 3.36Å; E913-A917 PolarHBondContact O-N 2.91Å
914	L	91.3	Very high	87.6	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-70.5	-36.7	173.7	-174.1	62.5	0	0	0	111.9	I888 L891 V892 I906 E910 V911 M912 A917 A918 L926	I888-L914 HydrophobicContact CG2-CB 4.35Å; I888-L914 HydrophobicContact CG2-CD1 4.03Å; L891-L914 HydrophobicContact CB-CD1 3.97Å; L891-L914 HydrophobicContact CD1-CD2 4.46Å; V892-L914 HydrophobicContact CG2-CD1 3.7Å; I906-L914 HydrophobicContact CB-CD2 4.5Å; I906-L914 HydrophobicContact CD1-CD2 3.53Å; I906-L914 HydrophobicContact CG1-CD2 3.73Å; I906-L914 HydrophobicContact CG2-CD2 3.91Å; E910-L914 WeakPolarHBondContact O-CB 3.25Å; E910-L914 PolarHBondContact O-N 3.32Å; V911-L914 PolarHBondContact O-N 2.99Å; M912-L914 VanDerWaalsContact C-N 3.33Å; L914-A917 PolarHBondContact O-N 3.32Å; L914-A918 VanDerWaalsContact O-CB 3.24Å; L914-A918 WeakPolarHBondContact O-CB 3.5Å; L914-A918 PolarHBondContact O-N 3.38Å; L914-L926 HydrophobicContact CD1-CD2 4.37Å
915	L	89.6	Confident	87.8	Confident	1 Å²	1	52 Å²	52	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-62.7	-44.5	174.8	-178.4	68.3	0	0	0	110.8	V911 M912 A918 K919 Q927 C930 E931 L953 L958	V911-L915 WeakPolarHBondContact O-CB 3.08Å; V911-L915 PolarHBondContact O-N 3.18Å; M912-L915 HydrophobicContact CE-CD2 4.34Å; M912-L915 PolarHBondContact O-N 3.33Å; L915-A918 PolarHBondContact O-N 3.07Å; L915-K919 WeakPolarHBondContact O-CB 3.22Å; L915-K919 PolarHBondContact O-N 2.97Å; L915-Q927 HydrophobicContact CD1-CG 3.66Å; L915-C930 HydrophobicContact CB-CB 4.05Å; L915-C930 HydrophobicContact CD1-CB 3.77Å; L915-C930 HydrophobicContact CG-CB 4.5Å; L915-E931 HydrophobicContact CD1-CG 3.86Å; L915-L953 HydrophobicContact CB-CD1 4.37Å; L915-L953 HydrophobicContact CD2-CD1 3.88Å; L915-L953 HydrophobicContact CG-CD1 3.82Å; L915-L958 HydrophobicContact CD2-CD2 3.96Å
916	S	89.9	Confident	88	Confident	39 Å²	39	44.9 Å²	44.9	27%	0.273	22%	0.221	S	C	.	.	H	α-helix	trans	-65.1	-41.2	176.5	69	0	0	0	0	111.9	M912 E913 K919 F920	M912-S916 PolarHBondContact O-N 3.22Å; E913-S916 PolarHBondContact O-OG 3.23Å; S916-K919 PolarHBondContact O-N 3.48Å; S916-F920 WeakPolarHBondContact O-CB 3.48Å; S916-F920 PolarHBondContact O-N 3.06Å
917	A	90.4	Very high	88.2	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-64.3	-44.9	173.6	0	0	0	0	0	112.2	V884 I888 V892 E913 L914 K919 F920 F921	V884-A917 HydrophobicContact CG1-CB 4.08Å; V884-A917 HydrophobicContact CG2-CB 4.35Å; I888-A917 HydrophobicContact CG2-CB 3.7Å; V892-A917 HydrophobicContact CG2-CB 4.04Å; E913-A917 WeakPolarHBondContact O-CB 3.36Å; E913-A917 PolarHBondContact O-N 2.91Å; L914-A917 PolarHBondContact O-N 3.32Å; A917-K919 VanDerWaalsContact C-N 3.3Å; A917-K919 PolarHBondContact O-N 3.39Å; A917-F920 PolarHBondContact O-N 3.01Å; A917-F921 HydrophobicContact CB-CD2 4.4Å; A917-F921 HydrophobicContact CB-CE2 4.37Å; A917-F921 WeakPolarHBondContact O-CD2 3.38Å; A917-F921 PolarHBondContact O-N 3.26Å
918	A	90.2	Very high	88.5	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.2	-40.9	177.7	0	0	0	0	0	111.4	L914 L915 Q922 L923 L926 Q927	L914-A918 VanDerWaalsContact O-CB 3.24Å; L914-A918 WeakPolarHBondContact O-CB 3.5Å; L914-A918 PolarHBondContact O-N 3.38Å; L915-A918 PolarHBondContact O-N 3.07Å; A918-Q922 PolarHBondContact O-N 2.83Å; A918-L923 PolarHBondContact O-N 2.69Å; A918-L926 HydrophobicContact CB-CB 4.29Å; A918-L926 HydrophobicContact CB-CD2 4.02Å; A918-L926 HydrophobicContact CB-CG 3.98Å; A918-Q927 HydrophobicContact CB-CB 4.23Å
919	K	89.4	Confident	88.9	Confident	82 Å²	82	37 Å²	37	36%	0.357	18%	0.184	S	C	.	.	H	α-helix	trans	-64.9	-48.3	173.2	-176.5	70.1	-179.2	-161	0	111.7	L915 S916 A917 F921 Q922 L953 G954	L915-K919 WeakPolarHBondContact O-CB 3.22Å; L915-K919 PolarHBondContact O-N 2.97Å; S916-K919 PolarHBondContact O-N 3.48Å; A917-K919 VanDerWaalsContact C-N 3.3Å; A917-K919 PolarHBondContact O-N 3.39Å; K919-F921 VanDerWaalsContact C-N 3.29Å; K919-F921 PolarHBondContact O-N 3.19Å; K919-Q922 PolarHBondContact O-N 3.01Å; K919-L953 WeakPolarHBondContact CE-O 3.3Å; K919-G954 PolarHBondContact NZ-O 3.45Å
920	F	89.3	Confident	89.2	Confident	77 Å²	77	31.7 Å²	31.7	34%	0.338	15%	0.151	S	C	.	.	H	α-helix	trans	-57	-43	179.2	177.3	-98.1	0	0	0	111.8	R863 S916 A917 Q922	R863-F920 WeakPolarHBondContact CG-O 3.39Å; S916-F920 WeakPolarHBondContact O-CB 3.48Å; S916-F920 PolarHBondContact O-N 3.06Å; A917-F920 PolarHBondContact O-N 3.01Å; F920-Q922 VanDerWaalsContact C-N 3.31Å; F920-Q922 PolarHBondContact O-N 3.12Å
921	F	89.8	Confident	89.4	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	6	176.5	-62.8	-63.2	0	0	0	114	S861 F864 L867 I881 V884 F889 V892 A917 K919 L923	S861-F921 WeakPolarHBondContact CB-O 3.48Å; S861-F921 PolarHBondContact OG-O 2.78Å; F864-F921 HydrophobicContact CD1-CD1 4.2Å; F864-F921 HydrophobicContact CD1-CE1 4.39Å; F864-F921 HydrophobicContact CD2-CB 4.41Å; F864-F921 HydrophobicContact CD2-CD1 4.24Å; F864-F921 AromaticContact CE1-CD1 3.57Å; F864-F921 HydrophobicContact CE1-CD1 3.57Å; F864-F921 AromaticContact CE1-CE1 3.52Å; F864-F921 HydrophobicContact CE1-CE1 3.52Å; F864-F921 HydrophobicContact CE1-CG 4.42Å; F864-F921 HydrophobicContact CE1-CZ 4.34Å; F864-F921 HydrophobicContact CE2-CB 3.82Å; F864-F921 AromaticContact CE2-CD1 3.61Å; F864-F921 HydrophobicContact CE2-CD1 3.61Å; F864-F921 HydrophobicContact CE2-CD2 4.46Å; F864-F921 HydrophobicContact CE2-CE1 4.31Å; F864-F921 AromaticContact CE2-CG 3.72Å; F864-F921 HydrophobicContact CE2-CG 3.72Å; F864-F921 HydrophobicContact CG-CD1 4.5Å; F864-F921 HydrophobicContact CZ-CB 4.26Å; F864-F921 AromaticContact CZ-CD1 3.22Å; F864-F921 HydrophobicContact CZ-CD1 3.22Å; F864-F921 HydrophobicContact CZ-CD2 4.16Å; F864-F921 AromaticContact CZ-CE1 3.46Å; F864-F921 HydrophobicContact CZ-CE1 3.46Å; F864-F921 VanDerWaalsContact CZ-CE1 3.46Å; F864-F921 HydrophobicContact CZ-CE2 4.36Å; F864-F921 AromaticContact CZ-CG 3.63Å; F864-F921 HydrophobicContact CZ-CG 3.63Å; F864-F921 HydrophobicContact CZ-CZ 4.06Å; L867-F921 HydrophobicContact CD1-CE1 4.45Å; I881-F921 HydrophobicContact CD1-CE1 4.45Å; I881-F921 HydrophobicContact CD1-CZ 4.14Å; I881-F921 HydrophobicContact CG2-CZ 4.44Å; V884-F921 HydrophobicContact CG2-CE2 4.09Å; V884-F921 HydrophobicContact CG2-CZ 4.28Å; F889-F921 HydrophobicContact CD2-CE2 4.03Å; F889-F921 AromaticContact CD2-CZ 3.89Å; F889-F921 HydrophobicContact CD2-CZ 3.89Å; F889-F921 HydrophobicContact CE2-CE1 4.36Å; F889-F921 HydrophobicContact CE2-CE2 4.2Å; F889-F921 AromaticContact CE2-CZ 3.73Å; F889-F921 HydrophobicContact CE2-CZ 3.73Å; V892-F921 HydrophobicContact CG1-CD2 4.04Å; V892-F921 HydrophobicContact CG2-CD2 4.38Å; A917-F921 HydrophobicContact CB-CD2 4.4Å; A917-F921 HydrophobicContact CB-CE2 4.37Å; A917-F921 WeakPolarHBondContact O-CD2 3.38Å; A917-F921 PolarHBondContact O-N 3.26Å; K919-F921 VanDerWaalsContact C-N 3.29Å; K919-F921 PolarHBondContact O-N 3.19Å; F921-L923 VanDerWaalsContact C-N 3.34Å; F921-L923 HydrophobicContact CB-CD1 4.1Å; F921-L923 HydrophobicContact CB-CG 4.06Å; F921-L923 PolarHBondContact O-N 2.83Å
922	Q	88.9	Confident	89.4	Confident	110 Å²	110	31.4 Å²	31.4	51%	0.514	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	41.4	177.5	-58.6	176.3	-13.8	0	0	114	R863 A918 K919 F920	R863-Q922 HydrophobicContact CB-CB 4.44Å; R863-Q922 HydrophobicContact CB-CG 4.16Å; A918-Q922 PolarHBondContact O-N 2.83Å; K919-Q922 PolarHBondContact O-N 3.01Å; F920-Q922 VanDerWaalsContact C-N 3.31Å; F920-Q922 PolarHBondContact O-N 3.12Å
923	L	88.8	Confident	89.5	Confident	7 Å²	7	30.7 Å²	30.7	4%	0.037	15%	0.147	C	C	.	.			trans	-99.1	83	-179.6	-62	175.3	0	0	0	111	V892 Y895 L896 A918 F921 A925 L926 Q927	V892-L923 HydrophobicContact CG1-CD1 3.65Å; Y895-L923 HydrophobicContact CD1-CD1 4.25Å; Y895-L923 HydrophobicContact CE1-CD1 4.37Å; Y895-L923 HydrophobicContact CE1-CD2 4.44Å; L896-L923 HydrophobicContact CD2-CD1 4.42Å; L896-L923 HydrophobicContact CD2-CD2 4Å; A918-L923 PolarHBondContact O-N 2.69Å; F921-L923 VanDerWaalsContact C-N 3.34Å; F921-L923 HydrophobicContact CB-CD1 4.1Å; F921-L923 HydrophobicContact CB-CG 4.06Å; F921-L923 PolarHBondContact O-N 2.83Å; L923-A925 PolarHBondContact O-N 2.96Å; L923-L926 HydrophobicContact CB-CB 4.07Å; L923-L926 HydrophobicContact CD1-CD2 4.04Å; L923-L926 PolarHBondContact O-N 3.01Å; L923-Q927 WeakPolarHBondContact O-CB 3.44Å; L923-Q927 PolarHBondContact O-N 3.34Å
924	E	87.2	Confident	89.5	Confident	112 Å²	112	27.7 Å²	27.7	52%	0.523	13%	0.134	S	C	.	.	H	α-helix	trans	-56.7	-42.4	-172.4	-64.4	173.4	162.2	0	0	115	K822 Q927 R928	K822-E924 IonicContact NZ-OE2 2.97Å; K822-E924 PolarHBondContact NZ-OE2 2.68Å; E924-Q927 WeakPolarHBondContact O-CB 3.32Å; E924-Q927 PolarHBondContact O-N 2.92Å; E924-R928 WeakPolarHBondContact O-CB 3.46Å; E924-R928 PolarHBondContact O-N 3.34Å
925	A	87.1	Confident	89.4	Confident	9 Å²	9	28.5 Å²	28.5	7%	0.074	14%	0.14	C	C	.	.	H	α-helix	trans	-73.3	-36.8	-177.3	0	0	0	0	0	112.2	I820 Y895 L923 R928 H929	I820-A925 HydrophobicContact CB-CB 4.2Å; I820-A925 HydrophobicContact CG2-CB 4.18Å; Y895-A925 WeakPolarHBondContact OH-CB 3.36Å; L923-A925 PolarHBondContact O-N 2.96Å; A925-R928 PolarHBondContact O-N 2.99Å; A925-H929 WeakPolarHBondContact O-CB 3.41Å; A925-H929 PolarHBondContact O-N 2.88Å
926	L	88.4	Confident	89.4	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-67.5	-40.6	171.7	-177.6	61.9	0	0	0	110.9	V892 Y895 T901 L904 L914 A918 L923 H929 C930	V892-L926 HydrophobicContact CG2-CD2 4.32Å; Y895-L926 HydrophobicContact CD1-CB 4Å; Y895-L926 HydrophobicContact CD1-CD2 3.86Å; Y895-L926 HydrophobicContact CD1-CG 4.35Å; Y895-L926 HydrophobicContact CD2-CB 4.23Å; Y895-L926 HydrophobicContact CD2-CD1 3.92Å; Y895-L926 HydrophobicContact CD2-CG 4.5Å; Y895-L926 HydrophobicContact CE1-CB 3.85Å; Y895-L926 HydrophobicContact CE1-CD2 4.5Å; Y895-L926 HydrophobicContact CE2-CB 4.08Å; Y895-L926 HydrophobicContact CE2-CD1 4.48Å; Y895-L926 HydrophobicContact CG-CB 4.19Å; Y895-L926 HydrophobicContact CG-CD1 3.95Å; Y895-L926 HydrophobicContact CG-CD2 3.98Å; Y895-L926 HydrophobicContact CG-CG 4.26Å; T901-L926 HydrophobicContact CG2-CD1 4.38Å; L904-L926 HydrophobicContact CD1-CD1 3.94Å; L914-L926 HydrophobicContact CD1-CD2 4.37Å; A918-L926 HydrophobicContact CB-CB 4.29Å; A918-L926 HydrophobicContact CB-CD2 4.02Å; A918-L926 HydrophobicContact CB-CG 3.98Å; L923-L926 HydrophobicContact CB-CB 4.07Å; L923-L926 HydrophobicContact CD1-CD2 4.04Å; L923-L926 PolarHBondContact O-N 3.01Å; L926-H929 PolarHBondContact O-N 2.92Å; L926-C930 PolarHBondContact O-N 3.35Å; L926-C930 PolarHBondContact O-SG 3.09Å
927	Q	90	Very high	89.3	Confident	26 Å²	26	37.5 Å²	37.5	12%	0.121	18%	0.177	C	C	.	.	H	α-helix	trans	-56.6	-54	173.3	-173.6	-167.9	-34.6	0	0	110.1	L915 A918 L923 E924 H929 C930 E931	L915-Q927 HydrophobicContact CD1-CG 3.66Å; A918-Q927 HydrophobicContact CB-CB 4.23Å; L923-Q927 WeakPolarHBondContact O-CB 3.44Å; L923-Q927 PolarHBondContact O-N 3.34Å; E924-Q927 WeakPolarHBondContact O-CB 3.32Å; E924-Q927 PolarHBondContact O-N 2.92Å; Q927-H929 VanDerWaalsContact C-N 3.27Å; Q927-H929 PolarHBondContact O-N 2.85Å; Q927-C930 WeakPolarHBondContact O-CB 3.29Å; Q927-C930 PolarHBondContact O-N 2.89Å; Q927-C930 VanDerWaalsContact O-N 3.09Å; Q927-E931 PolarHBondContact NE2-OE1 2.84Å; Q927-E931 VanDerWaalsContact O-CG 3.31Å; Q927-E931 WeakPolarHBondContact O-CG 3.22Å; Q927-E931 PolarHBondContact O-N 3.38Å
928	R	90.2	Very high	89.3	Confident	29 Å²	29	38.5 Å²	38.5	11%	0.109	18%	0.182	C	C	.	.	H	α-helix	trans	-58.1	-37.7	179	-175.1	64	62.9	135.7	5.5	112.7	T818 I820 E924 A925 E931 I932 E957	T818-R928 WeakPolarHBondContact O-CD 3.18Å; T818-R928 WeakPolarHBondContact O-CG 3.31Å; I820-R928 HydrophobicContact CD1-CB 3.86Å; I820-R928 HydrophobicContact CD1-CG 4.1Å; I820-R928 HydrophobicContact CG1-CB 4.21Å; I820-R928 HydrophobicContact CG1-CG 4.05Å; E924-R928 WeakPolarHBondContact O-CB 3.46Å; E924-R928 PolarHBondContact O-N 3.34Å; A925-R928 PolarHBondContact O-N 2.99Å; R928-E931 WeakPolarHBondContact CD-OE2 3.22Å; R928-E931 IonicContact NE-OE2 2.95Å; R928-E931 PolarHBondContact NE-OE2 3.32Å; R928-E931 WeakPolarHBondContact O-CB 3.41Å; R928-E931 PolarHBondContact O-N 3.17Å; R928-I932 HydrophobicContact CG-CD1 4.25Å; R928-I932 VanDerWaalsContact O-CG1 3.29Å; R928-I932 WeakPolarHBondContact O-CG1 3.36Å; R928-I932 PolarHBondContact O-N 3.44Å; R928-E957 VanDerWaalsContact CZ-CD 3.45Å; R928-E957 IonicContact CZ-OE1 3.08Å; R928-E957 IonicContact CZ-OE2 3.82Å; R928-E957 IonicContact NH1-OE1 3.91Å; R928-E957 PolarHBondContact NH1-OE1 2.96Å; R928-E957 IonicContact NH1-OE2 2.67Å; R928-E957 PolarHBondContact NH1-OE2 3.48Å; R928-E957 IonicContact NH2-OE1 3.75Å; R928-E957 PolarHBondContact NH2-OE1 3.41Å; R928-E957 IonicContact NH2-OE2 2.87Å
929	H	89.3	Confident	89.3	Confident	31 Å²	31	41.5 Å²	41.5	14%	0.144	20%	0.2	C	C	.	.	H	α-helix	trans	-67.3	-41.3	176.9	-172.9	83.8	0	0	0	112.3	E819 T901 A925 L926 Q927 E931 I932 I933	E819-H929 IonicContact OE1-CE1 3.42Å; E819-H929 IonicContact OE1-CG 2.86Å; E819-H929 IonicContact OE1-ND1 2.64Å; E819-H929 PolarHBondContact OE1-ND1 3.11Å; T901-H929 HydrophobicContact CG2-CB 3.61Å; T901-H929 VanDerWaalsContact CG2-CG 3.47Å; A925-H929 WeakPolarHBondContact O-CB 3.41Å; A925-H929 PolarHBondContact O-N 2.88Å; L926-H929 PolarHBondContact O-N 2.92Å; Q927-H929 VanDerWaalsContact C-N 3.27Å; Q927-H929 PolarHBondContact O-N 2.85Å; H929-E931 VanDerWaalsContact C-N 3.33Å; H929-E931 PolarHBondContact O-N 3.06Å; H929-I932 PolarHBondContact O-N 3.12Å; H929-I933 WeakPolarHBondContact O-CG1 3.44Å; H929-I933 PolarHBondContact O-N 3.48Å
930	C	89.9	Confident	89.2	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.6	-42.2	172.6	-62.6	0	0	0	0	111.1	V911 L915 L926 Q927 I932 I933 C934	V911-C930 HydrophobicContact CG1-CB 4.18Å; L915-C930 HydrophobicContact CB-CB 4.05Å; L915-C930 HydrophobicContact CD1-CB 3.77Å; L915-C930 HydrophobicContact CG-CB 4.5Å; L926-C930 PolarHBondContact O-N 3.35Å; L926-C930 PolarHBondContact O-SG 3.09Å; Q927-C930 WeakPolarHBondContact O-CB 3.29Å; Q927-C930 PolarHBondContact O-N 2.89Å; Q927-C930 VanDerWaalsContact O-N 3.09Å; C930-I932 VanDerWaalsContact C-N 3.33Å; C930-I932 PolarHBondContact O-N 3.04Å; C930-I933 PolarHBondContact O-N 3.02Å; C930-C934 PolarHBondContact O-N 3.34Å; C930-C934 PolarHBondContact O-SG 3.44Å
931	E	91.1	Very high	89	Confident	3 Å²	3	44.1 Å²	44.1	1%	0.014	22%	0.218	C	C	.	.	H	α-helix	trans	-59.3	-41.2	174.6	-64	171.7	173	0	0	111.9	L817 L915 Q927 R928 H929 C934 S935 L958	L817-E931 HydrophobicContact CD1-CB 3.84Å; L915-E931 HydrophobicContact CD1-CG 3.86Å; Q927-E931 PolarHBondContact NE2-OE1 2.84Å; Q927-E931 VanDerWaalsContact O-CG 3.31Å; Q927-E931 WeakPolarHBondContact O-CG 3.22Å; Q927-E931 PolarHBondContact O-N 3.38Å; R928-E931 WeakPolarHBondContact CD-OE2 3.22Å; R928-E931 IonicContact NE-OE2 2.95Å; R928-E931 PolarHBondContact NE-OE2 3.32Å; R928-E931 WeakPolarHBondContact O-CB 3.41Å; R928-E931 PolarHBondContact O-N 3.17Å; H929-E931 VanDerWaalsContact C-N 3.33Å; H929-E931 PolarHBondContact O-N 3.06Å; E931-C934 PolarHBondContact O-N 2.9Å; E931-S935 WeakPolarHBondContact O-CB 3.48Å; E931-S935 PolarHBondContact O-N 2.95Å; E931-L958 HydrophobicContact CB-CB 3.99Å; E931-L958 HydrophobicContact CG-CB 3.77Å; E931-L958 HydrophobicContact CG-CD2 4.24Å
932	I	90.2	Very high	89	Confident	19 Å²	19	46.7 Å²	46.7	10%	0.097	23%	0.234	C	C	.	.	H	α-helix	trans	-62.5	-42.8	175	-70.3	161.7	0	0	0	111.2	L817 E819 R928 H929 C930 S935 K936	L817-I932 HydrophobicContact CB-CG1 3.69Å; E819-I932 HydrophobicContact CB-CD1 3.79Å; E819-I932 HydrophobicContact CG-CD1 4.2Å; R928-I932 HydrophobicContact CG-CD1 4.25Å; R928-I932 VanDerWaalsContact O-CG1 3.29Å; R928-I932 WeakPolarHBondContact O-CG1 3.36Å; R928-I932 PolarHBondContact O-N 3.44Å; H929-I932 PolarHBondContact O-N 3.12Å; C930-I932 VanDerWaalsContact C-N 3.33Å; C930-I932 PolarHBondContact O-N 3.04Å; I932-S935 PolarHBondContact O-N 3.42Å; I932-S935 PolarHBondContact O-OG 3.48Å; I932-K936 HydrophobicContact CG2-CD 4.48Å; I932-K936 WeakPolarHBondContact O-CG 3.46Å; I932-K936 PolarHBondContact O-N 3.2Å
933	I	88.6	Confident	89.1	Confident	28 Å²	28	41.5 Å²	41.5	14%	0.144	21%	0.21	C	C	.	.	H	α-helix	trans	-63.6	-45.6	176.9	-64.2	166.9	0	0	0	110.2	I906 V911 H929 C930 S935 K936 N937	I906-I933 HydrophobicContact CB-CD1 4.24Å; I906-I933 HydrophobicContact CD1-CD1 3.69Å; V911-I933 HydrophobicContact CG1-CB 4.22Å; V911-I933 HydrophobicContact CG1-CG2 4.15Å; V911-I933 HydrophobicContact CG2-CG2 3.67Å; H929-I933 WeakPolarHBondContact O-CG1 3.44Å; H929-I933 PolarHBondContact O-N 3.48Å; C930-I933 PolarHBondContact O-N 3.02Å; I933-S935 VanDerWaalsContact C-N 3.31Å; I933-S935 PolarHBondContact O-N 2.9Å; I933-K936 PolarHBondContact O-N 3.1Å; I933-N937 PolarHBondContact O-N 3.41Å; I933-N937 PolarHBondContact O-ND2 3.28Å
934	C	89.6	Confident	89.1	Confident	7 Å²	7	41.3 Å²	41.3	5%	0.047	21%	0.209	C	C	.	.	H	α-helix	trans	-57.1	-43.9	174.9	-67.7	0	0	0	0	111.9	V911 C930 E931 K936 N937 I938 L946 L958	V911-C934 WeakPolarHBondContact CG1-SG 3.28Å; C930-C934 PolarHBondContact O-N 3.34Å; C930-C934 PolarHBondContact O-SG 3.44Å; E931-C934 PolarHBondContact O-N 2.9Å; C934-K936 VanDerWaalsContact C-N 3.25Å; C934-K936 PolarHBondContact O-N 3.49Å; C934-N937 PolarHBondContact O-N 3.38Å; C934-I938 PolarHBondContact O-N 3.35Å; C934-L946 HydrophobicContact CB-CD2 3.93Å; C934-L958 HydrophobicContact CB-CD1 3.83Å; C934-L958 HydrophobicContact CB-CD2 4Å
935	S	89.9	Confident	89.2	Confident	18 Å²	18	41.1 Å²	41.1	13%	0.126	21%	0.212	C	C	.	.	H	α-helix	trans	-62.9	-28.4	179.9	76.3	0	0	0	0	113.8	E931 I932 I933 I938 F961	E931-S935 WeakPolarHBondContact O-CB 3.48Å; E931-S935 PolarHBondContact O-N 2.95Å; I932-S935 PolarHBondContact O-N 3.42Å; I932-S935 PolarHBondContact O-OG 3.48Å; I933-S935 VanDerWaalsContact C-N 3.31Å; I933-S935 PolarHBondContact O-N 2.9Å; S935-I938 WeakPolarHBondContact O-CG2 3.31Å; S935-F961 VanDerWaalsContact CB-CE1 3.49Å
936	K	88.6	Confident	89.3	Confident	162 Å²	162	41.8 Å²	41.8	70%	0.704	21%	0.214	S	C	*	.	H	α-helix	trans	-82.7	-27.7	178.6	-70.3	175.5	-176.7	175.6	0	113.1	I932 I933 C934	I932-K936 HydrophobicContact CG2-CD 4.48Å; I932-K936 WeakPolarHBondContact O-CG 3.46Å; I932-K936 PolarHBondContact O-N 3.2Å; I933-K936 PolarHBondContact O-N 3.1Å; C934-K936 VanDerWaalsContact C-N 3.25Å; C934-K936 PolarHBondContact O-N 3.49Å
937	N	87.9	Confident	89.4	Confident	67 Å²	67	42.2 Å²	42.2	36%	0.358	22%	0.216	S	C	.	.	H	α-helix	trans	-101.4	4.7	-174.1	-68.4	-29.1	0	0	0	113.4	N908 I933 C934	N908-N937 VanDerWaalsContact CG-ND2 3.31Å; N908-N937 PolarHBondContact OD1-ND2 3.3Å; I933-N937 PolarHBondContact O-N 3.41Å; I933-N937 PolarHBondContact O-ND2 3.28Å; C934-N937 PolarHBondContact O-N 3.38Å
938	I	90.5	Very high	89.3	Confident	22 Å²	22	46.1 Å²	46.1	11%	0.113	23%	0.232	C	C	.	.			trans	-66	133.4	-179.5	-166.4	168.9	0	0	0	111.3	C934 S935 C943 L946 F961 I962 Y965	C934-I938 PolarHBondContact O-N 3.35Å; S935-I938 WeakPolarHBondContact O-CG2 3.31Å; I938-C943 HydrophobicContact CD1-CB 3.89Å; I938-C943 HydrophobicContact CG1-CB 3.84Å; I938-L946 HydrophobicContact CG1-CD1 4.34Å; I938-F961 HydrophobicContact CG2-CE1 4.33Å; I938-I962 HydrophobicContact CD1-CB 4.43Å; I938-I962 HydrophobicContact CD1-CG1 3.88Å; I938-I962 HydrophobicContact CD1-CG2 4.18Å; I938-Y965 HydrophobicContact CD1-CD1 3.82Å; I938-Y965 HydrophobicContact CD1-CD2 4.35Å; I938-Y965 HydrophobicContact CD1-CE1 4.29Å; I938-Y965 HydrophobicContact CD1-CG 3.85Å; I938-Y965 HydrophobicContact CG1-CD1 4.25Å; I938-Y965 HydrophobicContact CG1-CE1 4.21Å; I938-Y965 HydrophobicContact CG1-CG 4.47Å; I938-Y965 HydrophobicContact CG2-CD2 3.83Å; I938-Y965 HydrophobicContact CG2-CE2 3.75Å; I938-Y965 HydrophobicContact CG2-CG 4.4Å
939	T	90	Very high	89.2	Confident	62 Å²	62	47.9 Å²	47.9	38%	0.38	24%	0.242	S	C	.	.			trans	-127.7	166.1	175.2	65	0	0	0	0	110.4	E941 T942 C943	T939-E941 PolarHBondContact O-N 2.89Å; T939-T942 PolarHBondContact N-OG1 3.08Å; T939-T942 VanDerWaalsContact N-OG1 3.09Å; T939-T942 PolarHBondContact O-N 3.07Å; T939-T942 PolarHBondContact O-OG1 3.22Å; T939-T942 WeakPolarHBondContact OG1-CG2 3.4Å; T939-T942 PolarHBondContact OG1-N 2.96Å; T939-T942 PolarHBondContact OG1-OG1 3.36Å; T939-C943 VanDerWaalsContact O-CB 3.3Å; T939-C943 WeakPolarHBondContact O-CB 3.49Å; T939-C943 PolarHBondContact O-N 3.48Å
940	T	87.3	Confident	89.2	Confident	52 Å²	52	46.4 Å²	46.4	32%	0.319	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-25.9	177.5	48	0	0	0	0	113.5	C943 Y965 L973 L976	T940-C943 PolarHBondContact O-SG 3.31Å; T940-Y965 PolarHBondContact N-OH 3.37Å; T940-L973 HydrophobicContact CG2-CD2 4.27Å; T940-L976 WeakPolarHBondContact O-CD1 3.4Å
941	E	86.7	Confident	89.1	Confident	162 Å²	162	48.4 Å²	48.4	76%	0.757	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-33.8	178.3	-63.6	176.4	179	0	0	112.4	T939	T939-E941 PolarHBondContact O-N 2.89Å
942	T	89	Confident	88.9	Confident	55 Å²	55	56.1 Å²	56.1	34%	0.337	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-17.1	-172.5	56.8	0	0	0	0	113.7	T939 V944 D945 L946	T939-T942 PolarHBondContact N-OG1 3.08Å; T939-T942 VanDerWaalsContact N-OG1 3.09Å; T939-T942 PolarHBondContact O-N 3.07Å; T939-T942 PolarHBondContact O-OG1 3.22Å; T939-T942 WeakPolarHBondContact OG1-CG2 3.4Å; T939-T942 PolarHBondContact OG1-N 2.96Å; T939-T942 PolarHBondContact OG1-OG1 3.36Å; T942-V944 VanDerWaalsContact C-N 3.33Å; T942-V944 PolarHBondContact O-N 3.44Å; T942-D945 PolarHBondContact O-N 3.26Å; T942-L946 WeakPolarHBondContact O-CB 2.98Å; T942-L946 WeakPolarHBondContact O-CD1 3.39Å; T942-L946 PolarHBondContact O-N 3.16Å; T942-L946 VanDerWaalsContact O-N 3.07Å
943	C	90.3	Very high	88.7	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62	-33.7	-169.9	57.6	0	0	0	0	114.5	I938 T939 T940 Y947 Y965 F966	I938-C943 HydrophobicContact CD1-CB 3.89Å; I938-C943 HydrophobicContact CG1-CB 3.84Å; T939-C943 VanDerWaalsContact O-CB 3.3Å; T939-C943 WeakPolarHBondContact O-CB 3.49Å; T939-C943 PolarHBondContact O-N 3.48Å; T940-C943 PolarHBondContact O-SG 3.31Å; C943-Y947 WeakPolarHBondContact O-CB 3.21Å; C943-Y947 PolarHBondContact O-N 2.95Å; C943-Y965 HydrophobicContact CB-CD1 4.18Å; C943-Y965 HydrophobicContact CB-CE1 4.1Å; C943-F966 HydrophobicContact CB-CD1 4.44Å; C943-F966 HydrophobicContact CB-CE1 3.71Å
944	V	89.6	Confident	88.5	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.024	29%	0.286	C	S	.	.	H	α-helix	trans	-67.4	-46.4	179.4	172.5	0	0	0	0	111.3	T942 Y947 K948 A978 F979 L982	T942-V944 VanDerWaalsContact C-N 3.33Å; T942-V944 PolarHBondContact O-N 3.44Å; V944-Y947 WeakPolarHBondContact O-CB 3.38Å; V944-Y947 PolarHBondContact O-N 3.12Å; V944-K948 HydrophobicContact CG1-CD 4.46Å; V944-K948 WeakPolarHBondContact O-CG 3.49Å; V944-K948 PolarHBondContact O-N 2.87Å; V944-A978 HydrophobicContact CG1-CB 4.49Å; V944-A978 HydrophobicContact CG2-CB 4.4Å; V944-F979 HydrophobicContact CG2-CB 4.13Å; V944-F979 HydrophobicContact CG2-CD2 4.08Å; V944-L982 HydrophobicContact CG1-CB 4.47Å; V944-L982 HydrophobicContact CG1-CD2 4.23Å; V944-L982 HydrophobicContact CG2-CD2 4.46Å
945	D	88.4	Confident	88.4	Confident	108 Å²	108	56.1 Å²	56.1	58%	0.578	28%	0.284	S	S	*	.	H	α-helix	trans	-70	-39.7	-179.7	-65.1	-29.5	0	0	0	111.6	T942 Y947 K948 H949	T942-D945 PolarHBondContact O-N 3.26Å; D945-Y947 VanDerWaalsContact C-N 3.29Å; D945-Y947 PolarHBondContact O-N 3.42Å; D945-K948 PolarHBondContact O-N 3.47Å; D945-H949 WeakPolarHBondContact O-CB 3.45Å; D945-H949 PolarHBondContact O-N 3.01Å
946	L	89.5	Confident	88.3	Confident	23 Å²	23	61.9 Å²	61.9	12%	0.12	31%	0.313	C	S	.	.	H	α-helix	trans	-56.4	-43.3	171.4	-91.4	149.2	0	0	0	111.6	M912 C934 I938 T942 A950 I962	M912-L946 HydrophobicContact CE-CD2 4.11Å; M912-L946 HydrophobicContact SD-CD2 3.57Å; M912-L946 VanDerWaalsContact SD-CD2 3.57Å; C934-L946 HydrophobicContact CB-CD2 3.93Å; I938-L946 HydrophobicContact CG1-CD1 4.34Å; T942-L946 WeakPolarHBondContact O-CB 2.98Å; T942-L946 WeakPolarHBondContact O-CD1 3.39Å; T942-L946 PolarHBondContact O-N 3.16Å; T942-L946 VanDerWaalsContact O-N 3.07Å; L946-A950 VanDerWaalsContact O-CB 3.26Å; L946-A950 WeakPolarHBondContact O-CB 3.47Å; L946-A950 PolarHBondContact O-N 2.92Å; L946-I962 HydrophobicContact CB-CD1 4.13Å
947	Y	90.3	Very high	88.3	Confident	9 Å²	9	58.6 Å²	58.6	4%	0.035	30%	0.3	C	S	.	.	H	α-helix	trans	-64.4	-50.8	177.9	179.5	-100.5	0	0	0	112.1	C943 V944 D945 H949 A950 K951 T959 I962 E963 F966 L982 I1002 D1005	C943-Y947 WeakPolarHBondContact O-CB 3.21Å; C943-Y947 PolarHBondContact O-N 2.95Å; V944-Y947 WeakPolarHBondContact O-CB 3.38Å; V944-Y947 PolarHBondContact O-N 3.12Å; D945-Y947 VanDerWaalsContact C-N 3.29Å; D945-Y947 PolarHBondContact O-N 3.42Å; Y947-H949 VanDerWaalsContact C-N 3.26Å; Y947-H949 PolarHBondContact O-N 2.8Å; Y947-A950 PolarHBondContact O-N 2.65Å; Y947-K951 HydrophobicContact CD1-CG 4.42Å; Y947-K951 HydrophobicContact CE1-CG 3.95Å; Y947-K951 HydrophobicContact CE2-CG 4.14Å; Y947-K951 PolarHBondContact O-N 3.32Å; Y947-K951 WeakPolarHBondContact OH-CE 3.28Å; Y947-T959 HydrophobicContact CD2-CG2 4.15Å; Y947-T959 HydrophobicContact CE2-CG2 3.61Å; Y947-I962 HydrophobicContact CD2-CB 4.34Å; Y947-I962 HydrophobicContact CD2-CG2 4.02Å; Y947-I962 HydrophobicContact CG-CG2 4.42Å; Y947-E963 HydrophobicContact CE2-CG 3.83Å; Y947-F966 HydrophobicContact CD1-CE2 4.23Å; Y947-F966 AromaticContact CD2-CE2 3.69Å; Y947-F966 HydrophobicContact CD2-CE2 3.69Å; Y947-F966 HydrophobicContact CD2-CZ 4.32Å; Y947-F966 HydrophobicContact CE2-CE2 4.22Å; Y947-F966 AromaticContact CG-CE2 3.68Å; Y947-F966 HydrophobicContact CG-CE2 3.68Å; Y947-F966 AromaticContact CG-CZ 3.98Å; Y947-F966 HydrophobicContact CG-CZ 3.98Å; Y947-L982 HydrophobicContact CD1-CD1 4.23Å; Y947-L982 HydrophobicContact CD1-CD2 4.03Å; Y947-L982 HydrophobicContact CE1-CD1 4.39Å; Y947-L982 HydrophobicContact CE1-CD2 4.45Å; Y947-I1002 HydrophobicContact CD1-CD1 4.15Å; Y947-I1002 HydrophobicContact CE1-CD1 3.57Å; Y947-I1002 HydrophobicContact CE1-CG1 4.13Å; Y947-D1005 PolarHBondContact OH-OD2 3.21Å
948	K	88.8	Confident	88.4	Confident	107 Å²	107	55.4 Å²	55.4	47%	0.465	28%	0.283	S	S	.	.	H	α-helix	trans	-55.6	-43.9	178.4	-71.8	177.4	-179.4	177.6	0	111.1	V944 D945 F952 L982	V944-K948 HydrophobicContact CG1-CD 4.46Å; V944-K948 WeakPolarHBondContact O-CG 3.49Å; V944-K948 PolarHBondContact O-N 2.87Å; D945-K948 PolarHBondContact O-N 3.47Å; K948-F952 WeakPolarHBondContact O-CB 3.43Å; K948-F952 PolarHBondContact O-N 3.39Å; K948-L982 HydrophobicContact CG-CD1 4.38Å
949	H	88.1	Confident	88.4	Confident	67 Å²	67	54.7 Å²	54.7	31%	0.31	28%	0.28	S	S	.	.	H	α-helix	trans	-71	-39.8	179.1	-155.4	87.7	0	0	0	112.9	M912 D945 Y947 F952 L953	M912-H949 HydrophobicContact CE-CB 3.57Å; M912-H949 WeakPolarHBondContact CE-CD2 3.49Å; D945-H949 WeakPolarHBondContact O-CB 3.45Å; D945-H949 PolarHBondContact O-N 3.01Å; Y947-H949 VanDerWaalsContact C-N 3.26Å; Y947-H949 PolarHBondContact O-N 2.8Å; H949-F952 PolarHBondContact O-N 3.39Å; H949-L953 VanDerWaalsContact CD2-CD1 3.49Å; H949-L953 WeakPolarHBondContact CD2-CD1 3.5Å; H949-L953 WeakPolarHBondContact O-CG 3.27Å; H949-L953 PolarHBondContact O-N 2.94Å
950	A	89	Confident	88.4	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.5	-41.2	176.5	0	0	0	0	0	112.2	L946 Y947 L953 G954 A955 L958 I962	L946-A950 VanDerWaalsContact O-CB 3.26Å; L946-A950 WeakPolarHBondContact O-CB 3.47Å; L946-A950 PolarHBondContact O-N 2.92Å; Y947-A950 PolarHBondContact O-N 2.65Å; A950-L953 PolarHBondContact O-N 2.97Å; A950-G954 PolarHBondContact O-N 2.77Å; A950-G954 VanDerWaalsContact O-N 3.15Å; A950-A955 HydrophobicContact CB-CB 4.4Å; A950-A955 PolarHBondContact O-N 2.98Å; A950-L958 HydrophobicContact CB-CD2 3.96Å; A950-L958 HydrophobicContact CB-CG 4.14Å; A950-I962 HydrophobicContact CB-CD1 4.22Å
951	K	87.8	Confident	88.6	Confident	42 Å²	42	52.5 Å²	52.5	18%	0.183	27%	0.269	C	S	.	.	H	α-helix	trans	-62.9	-46.9	173.2	-82.4	-70.2	-163.6	175.7	0	111.8	Y947 L953 G954 T959 E963 S1000 D1005	Y947-K951 HydrophobicContact CD1-CG 4.42Å; Y947-K951 HydrophobicContact CE1-CG 3.95Å; Y947-K951 HydrophobicContact CE2-CG 4.14Å; Y947-K951 PolarHBondContact O-N 3.32Å; Y947-K951 WeakPolarHBondContact OH-CE 3.28Å; K951-L953 VanDerWaalsContact C-N 3.26Å; K951-L953 PolarHBondContact O-N 2.74Å; K951-G954 PolarHBondContact O-N 2.9Å; K951-T959 HydrophobicContact CD-CG2 3.71Å; K951-T959 VanDerWaalsContact CE-CG2 3.43Å; K951-T959 HydrophobicContact CG-CG2 3.97Å; K951-E963 IonicContact NZ-OE1 3.92Å; K951-S1000 PolarHBondContact NZ-OG 2.9Å; K951-D1005 WeakPolarHBondContact CE-OD2 3.38Å; K951-D1005 IonicContact NZ-OD1 3.96Å; K951-D1005 IonicContact NZ-OD2 2.92Å; K951-D1005 PolarHBondContact NZ-OD2 2.82Å
952	F	87.1	Confident	88.9	Confident	164 Å²	164	44.9 Å²	44.9	72%	0.719	23%	0.234	S	C	*	.	H	α-helix	trans	-56.4	-39.9	176.7	178.4	-98.7	0	0	0	112.5	K948 H949 G954	K948-F952 WeakPolarHBondContact O-CB 3.43Å; K948-F952 PolarHBondContact O-N 3.39Å; H949-F952 PolarHBondContact O-N 3.39Å; F952-G954 VanDerWaalsContact C-N 3.33Å
953	L	86	Confident	89	Confident	22 Å²	22	42.8 Å²	42.8	12%	0.115	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-7.9	178.2	-65	178.5	0	0	0	114.3	L915 K919 H949 A950 K951 A955	L915-L953 HydrophobicContact CB-CD1 4.37Å; L915-L953 HydrophobicContact CD2-CD1 3.88Å; L915-L953 HydrophobicContact CG-CD1 3.82Å; K919-L953 WeakPolarHBondContact CE-O 3.3Å; H949-L953 VanDerWaalsContact CD2-CD1 3.49Å; H949-L953 WeakPolarHBondContact CD2-CD1 3.5Å; H949-L953 WeakPolarHBondContact O-CG 3.27Å; H949-L953 PolarHBondContact O-N 2.94Å; A950-L953 PolarHBondContact O-N 2.97Å; K951-L953 VanDerWaalsContact C-N 3.26Å; K951-L953 PolarHBondContact O-N 2.74Å; L953-A955 VanDerWaalsContact C-N 3.34Å
954	G	84.9	Confident	89.1	Confident	31 Å²	31	42.8 Å²	42.8	32%	0.32	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	40.6	-172.4	0	0	0	0	0	112.6	K919 A950 K951 F952 L956	K919-G954 PolarHBondContact NZ-O 3.45Å; A950-G954 PolarHBondContact O-N 2.77Å; A950-G954 VanDerWaalsContact O-N 3.15Å; K951-G954 PolarHBondContact O-N 2.9Å; F952-G954 VanDerWaalsContact C-N 3.33Å; G954-L956 PolarHBondContact O-N 3.23Å
955	A	87	Confident	89.2	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.008	23%	0.226	C	C	.	.			trans	-88.3	77.9	175.8	0	0	0	0	0	110.1	A950 L953 E957 L958 T959	A950-A955 HydrophobicContact CB-CB 4.4Å; A950-A955 PolarHBondContact O-N 2.98Å; L953-A955 VanDerWaalsContact C-N 3.34Å; A955-E957 VanDerWaalsContact C-N 3.26Å; A955-E957 PolarHBondContact O-N 3.38Å; A955-L958 HydrophobicContact CB-CB 4.35Å; A955-L958 PolarHBondContact O-N 3.27Å; A955-T959 WeakPolarHBondContact O-CB 3.23Å; A955-T959 PolarHBondContact O-N 3.28Å; A955-T959 PolarHBondContact O-OG1 3.18Å
956	L	87.9	Confident	89.5	Confident	139 Å²	139	39.1 Å²	39.1	73%	0.728	20%	0.198	S	C	*	.	H	α-helix	trans	-57.2	-35.5	-169.4	-61.4	178.2	0	0	0	113.9	G954 T959 A960	G954-L956 PolarHBondContact O-N 3.23Å; L956-T959 PolarHBondContact O-N 3.1Å; L956-A960 WeakPolarHBondContact O-CB 3.5Å; L956-A960 PolarHBondContact O-N 3.23Å
957	E	87.8	Confident	89.7	Confident	93 Å²	93	38 Å²	38	44%	0.435	19%	0.193	S	C	.	.	H	α-helix	trans	-80.6	-41.8	-172	-65.5	-107.6	-158.4	0	0	112.1	L817 R928 A955 T959 A960 F961	L817-E957 HydrophobicContact CD2-CB 3.95Å; R928-E957 VanDerWaalsContact CZ-CD 3.45Å; R928-E957 IonicContact CZ-OE1 3.08Å; R928-E957 IonicContact CZ-OE2 3.82Å; R928-E957 IonicContact NH1-OE1 3.91Å; R928-E957 PolarHBondContact NH1-OE1 2.96Å; R928-E957 IonicContact NH1-OE2 2.67Å; R928-E957 PolarHBondContact NH1-OE2 3.48Å; R928-E957 IonicContact NH2-OE1 3.75Å; R928-E957 PolarHBondContact NH2-OE1 3.41Å; R928-E957 IonicContact NH2-OE2 2.87Å; A955-E957 VanDerWaalsContact C-N 3.26Å; A955-E957 PolarHBondContact O-N 3.38Å; E957-T959 VanDerWaalsContact C-N 3.29Å; E957-A960 PolarHBondContact O-N 3.29Å; E957-F961 PolarHBondContact O-N 3.14Å
958	L	90.1	Very high	89.7	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-62.8	-39.8	168.7	180	59.8	0	0	0	111	L915 E931 C934 A950 A955 F961 I962	L915-L958 HydrophobicContact CD2-CD2 3.96Å; E931-L958 HydrophobicContact CB-CB 3.99Å; E931-L958 HydrophobicContact CG-CB 3.77Å; E931-L958 HydrophobicContact CG-CD2 4.24Å; C934-L958 HydrophobicContact CB-CD1 3.83Å; C934-L958 HydrophobicContact CB-CD2 4Å; A950-L958 HydrophobicContact CB-CD2 3.96Å; A950-L958 HydrophobicContact CB-CG 4.14Å; A955-L958 HydrophobicContact CB-CB 4.35Å; A955-L958 PolarHBondContact O-N 3.27Å; L958-F961 WeakPolarHBondContact O-CB 3.49Å; L958-F961 PolarHBondContact O-N 3.27Å; L958-I962 HydrophobicContact CD1-CD1 4.03Å; L958-I962 HydrophobicContact CD1-CG1 4.2Å; L958-I962 HydrophobicContact CD2-CD1 4.49Å; L958-I962 HydrophobicContact CG-CD1 3.79Å; L958-I962 HydrophobicContact CG-CG1 4.4Å; L958-I962 WeakPolarHBondContact O-CG1 3.4Å; L958-I962 PolarHBondContact O-N 3.33Å
959	T	90.8	Very high	89.9	Confident	6 Å²	6	37.7 Å²	37.7	4%	0.037	19%	0.193	C	C	.	.	H	α-helix	trans	-60.5	-50.2	177.2	-55.4	0	0	0	0	110.9	Y947 K951 A955 L956 E957 F961 I962 E963	Y947-T959 HydrophobicContact CD2-CG2 4.15Å; Y947-T959 HydrophobicContact CE2-CG2 3.61Å; K951-T959 HydrophobicContact CD-CG2 3.71Å; K951-T959 VanDerWaalsContact CE-CG2 3.43Å; K951-T959 HydrophobicContact CG-CG2 3.97Å; A955-T959 WeakPolarHBondContact O-CB 3.23Å; A955-T959 PolarHBondContact O-N 3.28Å; A955-T959 PolarHBondContact O-OG1 3.18Å; L956-T959 PolarHBondContact O-N 3.1Å; E957-T959 VanDerWaalsContact C-N 3.29Å; T959-F961 VanDerWaalsContact C-N 3.29Å; T959-F961 PolarHBondContact O-N 2.79Å; T959-I962 PolarHBondContact O-N 2.98Å; T959-I962 VanDerWaalsContact O-N 3.14Å; T959-E963 VanDerWaalsContact CG2-OE1 3.31Å; T959-E963 WeakPolarHBondContact CG2-OE1 3.43Å; T959-E963 WeakPolarHBondContact O-CG 3.44Å; T959-E963 PolarHBondContact O-N 3.5Å
960	A	89.2	Confident	90.1	Very high	46 Å²	46	34.6 Å²	34.6	38%	0.38	18%	0.179	S	C	.	.	H	α-helix	trans	-61	-36.6	176.5	0	0	0	0	0	112.7	L956 E957 G964	L956-A960 WeakPolarHBondContact O-CB 3.5Å; L956-A960 PolarHBondContact O-N 3.23Å; E957-A960 PolarHBondContact O-N 3.29Å; A960-G964 PolarHBondContact O-N 3Å
961	F	91.9	Very high	90.2	Very high	23 Å²	23	37.3 Å²	37.3	10%	0.101	20%	0.196	C	C	.	.	H	α-helix	trans	-64.1	-44.8	173.8	-177.2	-86.9	0	0	0	112	I814 P815 L817 S935 I938 E957 L958 T959 G964 Y965	I814-F961 HydrophobicContact CB-CD2 4.47Å; I814-F961 HydrophobicContact CB-CE2 4Å; I814-F961 HydrophobicContact CB-CZ 4.47Å; I814-F961 HydrophobicContact CD1-CZ 4.49Å; I814-F961 HydrophobicContact CG2-CD2 3.56Å; I814-F961 HydrophobicContact CG2-CE2 3.58Å; I814-F961 HydrophobicContact CG2-CG 4.24Å; I814-F961 HydrophobicContact CG2-CZ 4.27Å; P815-F961 WeakPolarHBondContact O-CD2 3.38Å; L817-F961 HydrophobicContact CD2-CB 4.48Å; L817-F961 HydrophobicContact CG-CD2 4.43Å; S935-F961 VanDerWaalsContact CB-CE1 3.49Å; I938-F961 HydrophobicContact CG2-CE1 4.33Å; E957-F961 PolarHBondContact O-N 3.14Å; L958-F961 WeakPolarHBondContact O-CB 3.49Å; L958-F961 PolarHBondContact O-N 3.27Å; T959-F961 VanDerWaalsContact C-N 3.29Å; T959-F961 PolarHBondContact O-N 2.79Å; F961-G964 PolarHBondContact O-N 3.37Å; F961-Y965 PolarHBondContact O-N 3.39Å
962	I	92.6	Very high	90.3	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-66.7	-39.1	178.7	-63.1	163.2	0	0	0	110.8	I938 L946 Y947 A950 L958 T959 G964 Y965 F966	I938-I962 HydrophobicContact CD1-CB 4.43Å; I938-I962 HydrophobicContact CD1-CG1 3.88Å; I938-I962 HydrophobicContact CD1-CG2 4.18Å; L946-I962 HydrophobicContact CB-CD1 4.13Å; Y947-I962 HydrophobicContact CD2-CB 4.34Å; Y947-I962 HydrophobicContact CD2-CG2 4.02Å; Y947-I962 HydrophobicContact CG-CG2 4.42Å; A950-I962 HydrophobicContact CB-CD1 4.22Å; L958-I962 HydrophobicContact CD1-CD1 4.03Å; L958-I962 HydrophobicContact CD1-CG1 4.2Å; L958-I962 HydrophobicContact CD2-CD1 4.49Å; L958-I962 HydrophobicContact CG-CD1 3.79Å; L958-I962 HydrophobicContact CG-CG1 4.4Å; L958-I962 WeakPolarHBondContact O-CG1 3.4Å; L958-I962 PolarHBondContact O-N 3.33Å; T959-I962 PolarHBondContact O-N 2.98Å; T959-I962 VanDerWaalsContact O-N 3.14Å; I962-G964 VanDerWaalsContact C-N 3.33Å; I962-G964 PolarHBondContact O-N 2.85Å; I962-Y965 CarbonylContact O-C 3.22Å; I962-Y965 WeakPolarHBondContact O-CA 3.39Å; I962-Y965 WeakPolarHBondContact O-CB 3.18Å; I962-Y965 PolarHBondContact O-N 2.89Å; I962-F966 HydrophobicContact CG2-CD1 4.25Å; I962-F966 HydrophobicContact CG2-CD2 4.22Å; I962-F966 HydrophobicContact CG2-CE1 3.8Å; I962-F966 HydrophobicContact CG2-CE2 3.76Å; I962-F966 HydrophobicContact CG2-CG 4.46Å; I962-F966 HydrophobicContact CG2-CZ 3.55Å; I962-F966 WeakPolarHBondContact O-CG 3.44Å; I962-F966 PolarHBondContact O-N 3.21Å
963	E	92.8	Very high	90.5	Very high	11 Å²	11	32.5 Å²	32.5	5%	0.051	18%	0.179	C	C	.	.	H	α-helix	trans	-59.8	-42.3	172.9	-71.7	166.1	-169.5	0	0	111.7	Y947 K951 T959 Y965 F966 L967 D1005 L1006 T1009	Y947-E963 HydrophobicContact CE2-CG 3.83Å; K951-E963 IonicContact NZ-OE1 3.92Å; T959-E963 VanDerWaalsContact CG2-OE1 3.31Å; T959-E963 WeakPolarHBondContact CG2-OE1 3.43Å; T959-E963 WeakPolarHBondContact O-CG 3.44Å; T959-E963 PolarHBondContact O-N 3.5Å; E963-Y965 VanDerWaalsContact C-N 3.32Å; E963-Y965 PolarHBondContact O-N 3.31Å; E963-F966 WeakPolarHBondContact O-CB 3.35Å; E963-F966 PolarHBondContact O-N 3.46Å; E963-L967 WeakPolarHBondContact O-CG 3.07Å; E963-L967 PolarHBondContact O-N 3.36Å; E963-D1005 WeakPolarHBondContact OE1-CB 3.45Å; E963-L1006 HydrophobicContact CB-CD2 4.11Å; E963-L1006 HydrophobicContact CG-CD2 4.3Å; E963-T1009 HydrophobicContact CB-CG2 4.02Å; E963-T1009 PolarHBondContact OE2-OG1 3.17Å
964	G	91.2	Very high	90.6	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-62.5	-36.8	171.4	0	0	0	0	0	113.2	Y809 A960 F961 I962 K968	Y809-G964 WeakPolarHBondContact OH-CA 3.42Å; A960-G964 PolarHBondContact O-N 3Å; F961-G964 PolarHBondContact O-N 3.37Å; I962-G964 VanDerWaalsContact C-N 3.33Å; I962-G964 PolarHBondContact O-N 2.85Å; G964-K968 WeakPolarHBondContact O-CB 3.49Å; G964-K968 PolarHBondContact O-N 2.87Å; G964-K968 VanDerWaalsContact O-N 3.09Å
965	Y	92.8	Very high	90.8	Very high	35 Å²	35	35.9 Å²	35.9	14%	0.137	19%	0.186	C	C	.	.	H	α-helix	trans	-66.5	-39.6	173.8	-174.9	-89.5	0	0	0	112.2	I814 I938 T940 C943 F961 I962 E963 K968 N969	I814-Y965 HydrophobicContact CD1-CD2 4.06Å; I814-Y965 HydrophobicContact CD1-CG 4.44Å; I938-Y965 HydrophobicContact CD1-CD1 3.82Å; I938-Y965 HydrophobicContact CD1-CD2 4.35Å; I938-Y965 HydrophobicContact CD1-CE1 4.29Å; I938-Y965 HydrophobicContact CD1-CG 3.85Å; I938-Y965 HydrophobicContact CG1-CD1 4.25Å; I938-Y965 HydrophobicContact CG1-CE1 4.21Å; I938-Y965 HydrophobicContact CG1-CG 4.47Å; I938-Y965 HydrophobicContact CG2-CD2 3.83Å; I938-Y965 HydrophobicContact CG2-CE2 3.75Å; I938-Y965 HydrophobicContact CG2-CG 4.4Å; T940-Y965 PolarHBondContact N-OH 3.37Å; C943-Y965 HydrophobicContact CB-CD1 4.18Å; C943-Y965 HydrophobicContact CB-CE1 4.1Å; F961-Y965 PolarHBondContact O-N 3.39Å; I962-Y965 CarbonylContact O-C 3.22Å; I962-Y965 WeakPolarHBondContact O-CA 3.39Å; I962-Y965 WeakPolarHBondContact O-CB 3.18Å; I962-Y965 PolarHBondContact O-N 2.89Å; E963-Y965 VanDerWaalsContact C-N 3.32Å; E963-Y965 PolarHBondContact O-N 3.31Å; Y965-K968 PolarHBondContact O-N 3.4Å; Y965-N969 WeakPolarHBondContact CE2-ND2 3.25Å; Y965-N969 PolarHBondContact O-N 3.48Å; Y965-N969 VanDerWaalsContact O-N 3.11Å; Y965-N969 PolarHBondContact O-ND2 3.02Å
966	F	94.2	Very high	91	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.3	-51.7	174.3	-68.7	-25.9	0	0	0	111.2	C943 Y947 I962 E963 K968 N969 M970 L973 F979 L982 I1002 L1006	C943-F966 HydrophobicContact CB-CD1 4.44Å; C943-F966 HydrophobicContact CB-CE1 3.71Å; Y947-F966 HydrophobicContact CD1-CE2 4.23Å; Y947-F966 AromaticContact CD2-CE2 3.69Å; Y947-F966 HydrophobicContact CD2-CE2 3.69Å; Y947-F966 HydrophobicContact CD2-CZ 4.32Å; Y947-F966 HydrophobicContact CE2-CE2 4.22Å; Y947-F966 AromaticContact CG-CE2 3.68Å; Y947-F966 HydrophobicContact CG-CE2 3.68Å; Y947-F966 AromaticContact CG-CZ 3.98Å; Y947-F966 HydrophobicContact CG-CZ 3.98Å; I962-F966 HydrophobicContact CG2-CD1 4.25Å; I962-F966 HydrophobicContact CG2-CD2 4.22Å; I962-F966 HydrophobicContact CG2-CE1 3.8Å; I962-F966 HydrophobicContact CG2-CE2 3.76Å; I962-F966 HydrophobicContact CG2-CG 4.46Å; I962-F966 HydrophobicContact CG2-CZ 3.55Å; I962-F966 WeakPolarHBondContact O-CG 3.44Å; I962-F966 PolarHBondContact O-N 3.21Å; E963-F966 WeakPolarHBondContact O-CB 3.35Å; E963-F966 PolarHBondContact O-N 3.46Å; F966-K968 VanDerWaalsContact C-N 3.32Å; F966-K968 PolarHBondContact O-N 3.27Å; F966-N969 CarbonylContact O-C 3.55Å; F966-N969 PolarHBondContact O-N 3.33Å; F966-M970 WeakPolarHBondContact O-CA 3.3Å; F966-M970 VanDerWaalsContact O-CB 3.3Å; F966-M970 WeakPolarHBondContact O-CB 3.44Å; F966-M970 PolarHBondContact O-N 3.41Å; F966-L973 HydrophobicContact CB-CD1 4.33Å; F966-L973 HydrophobicContact CD1-CD1 3.66Å; F966-L973 HydrophobicContact CE1-CD1 4.48Å; F966-L973 HydrophobicContact CG-CD1 4.43Å; F966-F979 HydrophobicContact CB-CE2 4.17Å; F966-F979 HydrophobicContact CB-CZ 4.16Å; F966-F979 HydrophobicContact CD1-CD2 4.37Å; F966-F979 AromaticContact CD1-CE2 3.74Å; F966-F979 HydrophobicContact CD1-CE2 3.74Å; F966-F979 HydrophobicContact CD1-CZ 4.46Å; F966-F979 AromaticContact CD2-CE2 3.94Å; F966-F979 HydrophobicContact CD2-CE2 3.94Å; F966-F979 HydrophobicContact CE1-CD2 4.25Å; F966-F979 AromaticContact CE1-CE2 3.96Å; F966-F979 HydrophobicContact CE1-CE2 3.96Å; F966-F979 HydrophobicContact CE2-CE2 4.18Å; F966-F979 AromaticContact CG-CE2 3.71Å; F966-F979 HydrophobicContact CG-CE2 3.71Å; F966-F979 HydrophobicContact CG-CZ 4.21Å; F966-F979 HydrophobicContact CZ-CE2 4.18Å; F966-L982 HydrophobicContact CE2-CD2 4.12Å; F966-L982 HydrophobicContact CZ-CD2 4.12Å; F966-I1002 HydrophobicContact CD2-CD1 4.38Å; F966-I1002 HydrophobicContact CE2-CD1 4.04Å; F966-L1006 HydrophobicContact CB-CD2 3.95Å; F966-L1006 HydrophobicContact CD2-CD2 4.18Å
967	L	92.9	Very high	90.9	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.2	-39.5	-179.9	-68.9	166.4	0	0	0	112.5	F786 F805 T806 Y809 E963 M970 L1006 T1009 L1010	F786-L967 HydrophobicContact CZ-CD2 4.49Å; F805-L967 HydrophobicContact CB-CD2 4.4Å; T806-L967 WeakPolarHBondContact CA-O 3.41Å; T806-L967 PolarHBondContact OG1-O 3.48Å; Y809-L967 HydrophobicContact CD2-CB 3.62Å; Y809-L967 HydrophobicContact CD2-CD1 3.82Å; Y809-L967 HydrophobicContact CD2-CG 4.37Å; Y809-L967 HydrophobicContact CE2-CB 4.12Å; Y809-L967 HydrophobicContact CE2-CD1 4.01Å; Y809-L967 HydrophobicContact CG-CB 4.13Å; E963-L967 WeakPolarHBondContact O-CG 3.07Å; E963-L967 PolarHBondContact O-N 3.36Å; L967-M970 HydrophobicContact CD2-SD 4.42Å; L967-L1006 HydrophobicContact CD2-CB 4.36Å; L967-L1006 HydrophobicContact CD2-CD2 4.28Å; L967-L1006 HydrophobicContact CG-CD2 4.03Å; L967-T1009 HydrophobicContact CD1-CG2 3.89Å; L967-L1010 HydrophobicContact CD1-CB 3.79Å; L967-L1010 HydrophobicContact CD1-CD1 4.36Å; L967-L1010 HydrophobicContact CD2-CB 4.25Å; L967-L1010 HydrophobicContact CD2-CD2 4.38Å
968	K	91.6	Very high	90.8	Very high	67 Å²	67	35.9 Å²	35.9	29%	0.291	20%	0.195	S	C	.	.	H	α-helix	trans	-69.9	-31.1	179.9	-173.1	165.6	-173.8	158	0	113.7	T806 Y809 P811 F812 I814 G964 Y965 F966	T806-K968 WeakPolarHBondContact CG2-O 3.31Å; Y809-K968 HydrophobicContact CD1-CB 4.12Å; Y809-K968 HydrophobicContact CE1-CB 4.22Å; P811-K968 PolarHBondContact O-NZ 2.95Å; F812-K968 PolarHBondContact O-NZ 3.42Å; F812-K968 VanDerWaalsContact O-NZ 3.07Å; I814-K968 HydrophobicContact CD1-CD 4.35Å; I814-K968 HydrophobicContact CG1-CD 4.12Å; G964-K968 WeakPolarHBondContact O-CB 3.49Å; G964-K968 PolarHBondContact O-N 2.87Å; G964-K968 VanDerWaalsContact O-N 3.09Å; Y965-K968 PolarHBondContact O-N 3.4Å; F966-K968 VanDerWaalsContact C-N 3.32Å; F966-K968 PolarHBondContact O-N 3.27Å
969	N	91.7	Very high	90.8	Very high	42 Å²	42	35.9 Å²	35.9	23%	0.225	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112	17.3	-177.7	-59.6	-77.1	0	0	0	112.5	Y965 F966 V971 L972 L973	Y965-N969 WeakPolarHBondContact CE2-ND2 3.25Å; Y965-N969 PolarHBondContact O-N 3.48Å; Y965-N969 VanDerWaalsContact O-N 3.11Å; Y965-N969 PolarHBondContact O-ND2 3.02Å; F966-N969 CarbonylContact O-C 3.55Å; F966-N969 PolarHBondContact O-N 3.33Å; N969-V971 PolarHBondContact O-N 3.38Å; N969-V971 VanDerWaalsContact O-N 3.15Å; N969-L972 PolarHBondContact O-N 3.37Å; N969-L973 HydrophobicContact CB-CD1 4.15Å; N969-L973 HydrophobicContact CB-CG 4.26Å; N969-L973 WeakPolarHBondContact O-CG 3.45Å; N969-L973 PolarHBondContact O-N 2.86Å
970	M	92.3	Very high	90.6	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-60.2	-34.4	-167.6	-160.3	166.7	177.6	0	0	112.6	L789 F805 F966 L967 L972 L973 I974 F979	L789-M970 HydrophobicContact CD2-CE 3.81Å; F805-M970 HydrophobicContact CB-SD 3.94Å; F805-M970 HydrophobicContact CD2-CE 3.78Å; F805-M970 HydrophobicContact CD2-SD 3.55Å; F805-M970 VanDerWaalsContact CD2-SD 3.55Å; F805-M970 HydrophobicContact CE2-CE 4.19Å; F805-M970 HydrophobicContact CE2-SD 4.5Å; F805-M970 HydrophobicContact CG-SD 4.19Å; F966-M970 WeakPolarHBondContact O-CA 3.3Å; F966-M970 VanDerWaalsContact O-CB 3.3Å; F966-M970 WeakPolarHBondContact O-CB 3.44Å; F966-M970 PolarHBondContact O-N 3.41Å; L967-M970 HydrophobicContact CD2-SD 4.42Å; M970-L972 VanDerWaalsContact C-N 3.27Å; M970-L972 PolarHBondContact O-N 3.41Å; M970-L973 PolarHBondContact O-N 2.91Å; M970-I974 WeakPolarHBondContact O-CB 3.42Å; M970-I974 PolarHBondContact O-N 3.4Å; M970-F979 HydrophobicContact CG-CE1 4.42Å
971	V	91.4	Very high	90.5	Very high	58 Å²	58	40.9 Å²	40.9	35%	0.352	21%	0.21	S	C	.	.	H	α-helix	trans	-57.1	-38.7	176.9	-177.1	0	0	0	0	112.6	S802 V803 N969	S802-V971 WeakPolarHBondContact OG-CA 3.41Å; V803-V971 HydrophobicContact CB-CG2 4.45Å; V803-V971 HydrophobicContact CG2-CG1 4.41Å; V803-V971 HydrophobicContact CG2-CG2 3.88Å; N969-V971 PolarHBondContact O-N 3.38Å; N969-V971 VanDerWaalsContact O-N 3.15Å
972	L	90.8	Very high	90.2	Very high	105 Å²	105	41.1 Å²	41.1	55%	0.55	21%	0.212	S	C	.	.	H	α-helix	trans	-82.9	-40.2	177.3	-63.8	173.8	0	0	0	111.3	N969 M970 I974 E975	N969-L972 PolarHBondContact O-N 3.37Å; M970-L972 VanDerWaalsContact C-N 3.27Å; M970-L972 PolarHBondContact O-N 3.41Å; L972-I974 VanDerWaalsContact C-N 3.34Å; L972-I974 PolarHBondContact O-N 3.24Å; L972-E975 PolarHBondContact O-N 3.07Å
973	L	90.7	Very high	89.9	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-68.9	-32	-175	-65.1	174.6	0	0	0	112.5	T940 F966 N969 M970 E975 L976 F979	T940-L973 HydrophobicContact CG2-CD2 4.27Å; F966-L973 HydrophobicContact CB-CD1 4.33Å; F966-L973 HydrophobicContact CD1-CD1 3.66Å; F966-L973 HydrophobicContact CE1-CD1 4.48Å; F966-L973 HydrophobicContact CG-CD1 4.43Å; N969-L973 HydrophobicContact CB-CD1 4.15Å; N969-L973 HydrophobicContact CB-CG 4.26Å; N969-L973 WeakPolarHBondContact O-CG 3.45Å; N969-L973 PolarHBondContact O-N 2.86Å; M970-L973 PolarHBondContact O-N 2.91Å; L973-E975 PolarHBondContact O-N 3.04Å; L973-E975 VanDerWaalsContact O-N 3.13Å; L973-L976 HydrophobicContact CD2-CD1 3.75Å; L973-L976 WeakPolarHBondContact O-CB 3.31Å; L973-L976 PolarHBondContact O-N 3.18Å; L973-F979 HydrophobicContact CB-CB 4.45Å; L973-F979 HydrophobicContact CB-CD1 3.59Å; L973-F979 HydrophobicContact CB-CD2 4.42Å; L973-F979 HydrophobicContact CB-CE1 3.79Å; L973-F979 HydrophobicContact CB-CG 3.92Å; L973-F979 HydrophobicContact CB-CZ 4.33Å; L973-F979 HydrophobicContact CD1-CE2 4.43Å; L973-F979 HydrophobicContact CD1-CZ 4.43Å; L973-F979 WeakPolarHBondContact O-CB 3.35Å; L973-F979 VanDerWaalsContact O-CD1 3.32Å; L973-F979 WeakPolarHBondContact O-CD1 3.3Å
974	I	88.7	Confident	89.4	Confident	6 Å²	6	45 Å²	45	3%	0.031	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-19.1	-179.6	-155.6	69.8	0	0	0	112.7	Q799 M970 L972 K980 L983	Q799-I974 HydrophobicContact CG-CG2 4.21Å; M970-I974 WeakPolarHBondContact O-CB 3.42Å; M970-I974 PolarHBondContact O-N 3.4Å; L972-I974 VanDerWaalsContact C-N 3.34Å; L972-I974 PolarHBondContact O-N 3.24Å; I974-K980 WeakPolarHBondContact O-CE 3.42Å; I974-K980 WeakPolarHBondContact O-CG 3.49Å; I974-L983 HydrophobicContact CD1-CD1 3.57Å
975	E	88.4	Confident	88.6	Confident	118 Å²	118	50.9 Å²	50.9	55%	0.551	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-18.2	175.4	-58.7	-170.9	159.1	0	0	112.6	L972 L973	L972-E975 PolarHBondContact O-N 3.07Å; L973-E975 PolarHBondContact O-N 3.04Å; L973-E975 VanDerWaalsContact O-N 3.13Å
976	L	90.2	Very high	87	Confident	68 Å²	68	54.7 Å²	54.7	36%	0.356	28%	0.284	S	S	.	.			trans	-83.1	126.7	-178	-58.9	176.9	0	0	0	111.5	T940 L973 A978 F979 K980	T940-L976 WeakPolarHBondContact O-CD1 3.4Å; L973-L976 HydrophobicContact CD2-CD1 3.75Å; L973-L976 WeakPolarHBondContact O-CB 3.31Å; L973-L976 PolarHBondContact O-N 3.18Å; L976-A978 VanDerWaalsContact C-N 3.3Å; L976-A978 PolarHBondContact O-N 2.95Å; L976-F979 HydrophobicContact CB-CB 4.33Å; L976-F979 PolarHBondContact O-N 3.32Å; L976-F979 VanDerWaalsContact O-N 3.07Å; L976-K980 PolarHBondContact O-N 3.41Å
977	D	86.6	Confident	85.1	Confident	116 Å²	116	59.2 Å²	59.2	62%	0.62	32%	0.315	S	S	*	.	H	α-helix	trans	-58.9	-39.3	-179.5	-69.5	-30.6	0	0	0	113	F979 K980 Q981	D977-F979 VanDerWaalsContact C-N 3.26Å; D977-F979 PolarHBondContact O-N 2.79Å; D977-K980 PolarHBondContact O-N 3.49Å; D977-Q981 WeakPolarHBondContact O-CB 3.48Å; D977-Q981 WeakPolarHBondContact O-CG 3.33Å; D977-Q981 PolarHBondContact O-N 3.05Å
978	A	86.4	Confident	82.8	Confident	48 Å²	48	63 Å²	63	40%	0.397	35%	0.346	S	S	.	.	H	α-helix	trans	-61.4	-34.6	178.1	0	0	0	0	0	112.6	V944 L976 L982	V944-A978 HydrophobicContact CG1-CB 4.49Å; V944-A978 HydrophobicContact CG2-CB 4.4Å; L976-A978 VanDerWaalsContact C-N 3.3Å; L976-A978 PolarHBondContact O-N 2.95Å; A978-L982 PolarHBondContact O-N 3.35Å
979	F	89.1	Confident	80.3	Confident	1 Å²	1	64.8 Å²	64.8	0%	0.004	37%	0.374	C	S	.	.	H	α-helix	trans	-81.3	-37.8	177.2	-170.9	-112	0	0	0	111.5	V944 F966 M970 L973 L976 D977 Q981 L982 L983	V944-F979 HydrophobicContact CG2-CB 4.13Å; V944-F979 HydrophobicContact CG2-CD2 4.08Å; F966-F979 HydrophobicContact CB-CE2 4.17Å; F966-F979 HydrophobicContact CB-CZ 4.16Å; F966-F979 HydrophobicContact CD1-CD2 4.37Å; F966-F979 AromaticContact CD1-CE2 3.74Å; F966-F979 HydrophobicContact CD1-CE2 3.74Å; F966-F979 HydrophobicContact CD1-CZ 4.46Å; F966-F979 AromaticContact CD2-CE2 3.94Å; F966-F979 HydrophobicContact CD2-CE2 3.94Å; F966-F979 HydrophobicContact CE1-CD2 4.25Å; F966-F979 AromaticContact CE1-CE2 3.96Å; F966-F979 HydrophobicContact CE1-CE2 3.96Å; F966-F979 HydrophobicContact CE2-CE2 4.18Å; F966-F979 AromaticContact CG-CE2 3.71Å; F966-F979 HydrophobicContact CG-CE2 3.71Å; F966-F979 HydrophobicContact CG-CZ 4.21Å; F966-F979 HydrophobicContact CZ-CE2 4.18Å; M970-F979 HydrophobicContact CG-CE1 4.42Å; L973-F979 HydrophobicContact CB-CB 4.45Å; L973-F979 HydrophobicContact CB-CD1 3.59Å; L973-F979 HydrophobicContact CB-CD2 4.42Å; L973-F979 HydrophobicContact CB-CE1 3.79Å; L973-F979 HydrophobicContact CB-CG 3.92Å; L973-F979 HydrophobicContact CB-CZ 4.33Å; L973-F979 HydrophobicContact CD1-CE2 4.43Å; L973-F979 HydrophobicContact CD1-CZ 4.43Å; L973-F979 WeakPolarHBondContact O-CB 3.35Å; L973-F979 VanDerWaalsContact O-CD1 3.32Å; L973-F979 WeakPolarHBondContact O-CD1 3.3Å; L976-F979 HydrophobicContact CB-CB 4.33Å; L976-F979 PolarHBondContact O-N 3.32Å; L976-F979 VanDerWaalsContact O-N 3.07Å; D977-F979 VanDerWaalsContact C-N 3.26Å; D977-F979 PolarHBondContact O-N 2.79Å; F979-Q981 VanDerWaalsContact C-N 3.32Å; F979-Q981 PolarHBondContact O-N 2.92Å; F979-L982 HydrophobicContact CD2-CD2 4.19Å; F979-L982 HydrophobicContact CE2-CD2 4.39Å; F979-L982 WeakPolarHBondContact O-CB 3.37Å; F979-L982 PolarHBondContact O-N 3.38Å; F979-L982 VanDerWaalsContact O-N 3.15Å; F979-L983 HydrophobicContact CD1-CD1 3.76Å; F979-L983 HydrophobicContact CD1-CG 4.26Å; F979-L983 HydrophobicContact CE1-CD1 3.51Å; F979-L983 HydrophobicContact CE1-CD2 4.34Å; F979-L983 HydrophobicContact CE1-CG 4.06Å; F979-L983 HydrophobicContact CZ-CD1 4.13Å; F979-L983 HydrophobicContact CZ-CD2 4.12Å; F979-L983 HydrophobicContact CZ-CG 4.25Å; F979-L983 WeakPolarHBondContact O-CG 3.48Å; F979-L983 PolarHBondContact O-N 2.93Å
980	K	86.9	Confident	77.7	Confident	54 Å²	54	70.5 Å²	70.5	24%	0.235	40%	0.399	C	S	.	.	H	α-helix	trans	-57.2	-45	170.6	-71.2	-178.5	-177.6	178.5	0	111.3	E795 I974 L976 D977 L982 L983 Y984	E795-K980 IonicContact OE1-NZ 3.51Å; E795-K980 PolarHBondContact OE1-NZ 3.41Å; I974-K980 WeakPolarHBondContact O-CE 3.42Å; I974-K980 WeakPolarHBondContact O-CG 3.49Å; L976-K980 PolarHBondContact O-N 3.41Å; D977-K980 PolarHBondContact O-N 3.49Å; K980-L982 VanDerWaalsContact C-N 3.34Å; K980-L982 PolarHBondContact O-N 3.43Å; K980-L983 PolarHBondContact O-N 3.3Å; K980-Y984 HydrophobicContact CB-CD2 4.3Å; K980-Y984 WeakPolarHBondContact O-CB 3.48Å; K980-Y984 VanDerWaalsContact O-CD2 3.26Å; K980-Y984 WeakPolarHBondContact O-CD2 3.29Å; K980-Y984 PolarHBondContact O-N 2.99Å
981	Q	86.6	Confident	74.9	Confident	104 Å²	104	74.4 Å²	74.4	49%	0.486	43%	0.427	S	S	.	.	H	α-helix	trans	-58.4	-45.8	174.3	-76	175.5	-7.7	0	0	111.2	D977 F979 L983 E985	D977-Q981 WeakPolarHBondContact O-CB 3.48Å; D977-Q981 WeakPolarHBondContact O-CG 3.33Å; D977-Q981 PolarHBondContact O-N 3.05Å; F979-Q981 VanDerWaalsContact C-N 3.32Å; F979-Q981 PolarHBondContact O-N 2.92Å; Q981-L983 VanDerWaalsContact C-N 3.29Å; Q981-L983 PolarHBondContact O-N 3.43Å; Q981-E985 WeakPolarHBondContact O-CB 3.47Å; Q981-E985 PolarHBondContact O-N 3.16Å
982	L	86.4	Confident	72.2	Confident	28 Å²	28	78.6 Å²	78.6	15%	0.147	46%	0.455	C	S	.	.	H	α-helix	trans	-59.9	-36.9	177.1	-174.1	68	0	0	0	113	V944 Y947 K948 F966 A978 F979 K980 I1002	V944-L982 HydrophobicContact CG1-CB 4.47Å; V944-L982 HydrophobicContact CG1-CD2 4.23Å; V944-L982 HydrophobicContact CG2-CD2 4.46Å; Y947-L982 HydrophobicContact CD1-CD1 4.23Å; Y947-L982 HydrophobicContact CD1-CD2 4.03Å; Y947-L982 HydrophobicContact CE1-CD1 4.39Å; Y947-L982 HydrophobicContact CE1-CD2 4.45Å; K948-L982 HydrophobicContact CG-CD1 4.38Å; F966-L982 HydrophobicContact CE2-CD2 4.12Å; F966-L982 HydrophobicContact CZ-CD2 4.12Å; A978-L982 PolarHBondContact O-N 3.35Å; F979-L982 HydrophobicContact CD2-CD2 4.19Å; F979-L982 HydrophobicContact CE2-CD2 4.39Å; F979-L982 WeakPolarHBondContact O-CB 3.37Å; F979-L982 PolarHBondContact O-N 3.38Å; F979-L982 VanDerWaalsContact O-N 3.15Å; K980-L982 VanDerWaalsContact C-N 3.34Å; K980-L982 PolarHBondContact O-N 3.43Å; L982-I1002 HydrophobicContact CD1-CD1 4.22Å; L982-I1002 HydrophobicContact CD2-CD1 3.29Å; L982-I1002 HydrophobicContact CG-CD1 3.53Å; L982-I1002 WeakPolarHBondContact O-CG2 3.39Å
983	L	85.5	Confident	69.4	Low	11 Å²	11	78 Å²	78	6%	0.058	47%	0.465	C	S	.	.	H	α-helix	trans	-80.8	-37.6	-178	-67.5	176	0	0	0	114.2	I974 F979 K980 Q981 I1002 L1003 L1006	I974-L983 HydrophobicContact CD1-CD1 3.57Å; F979-L983 HydrophobicContact CD1-CD1 3.76Å; F979-L983 HydrophobicContact CD1-CG 4.26Å; F979-L983 HydrophobicContact CE1-CD1 3.51Å; F979-L983 HydrophobicContact CE1-CD2 4.34Å; F979-L983 HydrophobicContact CE1-CG 4.06Å; F979-L983 HydrophobicContact CZ-CD1 4.13Å; F979-L983 HydrophobicContact CZ-CD2 4.12Å; F979-L983 HydrophobicContact CZ-CG 4.25Å; F979-L983 WeakPolarHBondContact O-CG 3.48Å; F979-L983 PolarHBondContact O-N 2.93Å; K980-L983 PolarHBondContact O-N 3.3Å; Q981-L983 VanDerWaalsContact C-N 3.29Å; Q981-L983 PolarHBondContact O-N 3.43Å; L983-I1002 HydrophobicContact CD2-CG2 4.28Å; L983-L1003 HydrophobicContact CD2-CD2 3.69Å; L983-L1006 HydrophobicContact CD2-CD1 3.95Å
984	Y	82.1	Confident	66.6	Low	83 Å²	83	82.2 Å²	82.2	33%	0.325	50%	0.495	S	S	.	.	H	α-helix	trans	-108.4	-20.6	-168.3	-66.5	-64.9	0	0	0	114.6	L789 S798 K980	L789-Y984 WeakPolarHBondContact O-CE1 3.48Å; S798-Y984 PolarHBondContact OG-OH 3.46Å; K980-Y984 HydrophobicContact CB-CD2 4.3Å; K980-Y984 WeakPolarHBondContact O-CB 3.48Å; K980-Y984 VanDerWaalsContact O-CD2 3.26Å; K980-Y984 WeakPolarHBondContact O-CD2 3.29Å; K980-Y984 PolarHBondContact O-N 2.99Å
985	E	75.7	Confident	63.7	Low	123 Å²	123	86.3 Å²	86.3	58%	0.575	52%	0.524	S	S	*	.	S	Bend	trans	-90.7	123.4	-175.8	-153.3	163.7	-164.7	0	0	109.8	Q981 S987	Q981-E985 WeakPolarHBondContact O-CB 3.47Å; Q981-E985 PolarHBondContact O-N 3.16Å; E985-S987 PolarHBondContact O-N 3.32Å
986	P	59.8	Low	61	Low	115 Å²	115	87.3 Å²	87.3	75%	0.747	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-60.9	128.2	172.1	-12.9	25.4	0	0	0	108.1	A988	P986-A988 PolarHBondContact O-N 3.42Å
987	S	54.2	Low	58.3	Low	96 Å²	96	87.4 Å²	87.4	67%	0.671	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-50.2	116.3	171.9	-177.6	0	0	0	0	108	E985 A989	E985-S987 PolarHBondContact O-N 3.32Å; S987-A989 PolarHBondContact O-N 3.45Å
988	A	43.4	Very low	56.1	Low	78 Å²	78	87.8 Å²	87.8	65%	0.645	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-50.2	130.5	176.1	0	0	0	0	0	108	P986 E990	P986-A988 PolarHBondContact O-N 3.42Å; A988-E990 PolarHBondContact O-N 2.93Å
989	A	39.1	Very low	53.9	Low	105 Å²	105	91 Å²	91	87%	0.868	58%	0.578	S	S	*	*			trans	-62	90.6	173.9	0	0	0	0	0	108.3	S987 S991	S987-A989 PolarHBondContact O-N 3.45Å; A989-S991 VanDerWaalsContact C-N 3.32Å; A989-S991 PolarHBondContact O-N 3.5Å
990	E	37	Very low	52.3	Low	163 Å²	163	93.6 Å²	93.6	76%	0.762	60%	0.596	S	S	*	*			trans	-71.9	91.3	173.2	-79.4	-168.5	163.7	0	0	109.1	A988	A988-E990 PolarHBondContact O-N 2.93Å
991	S	33.2	Very low	51.9	Low	83 Å²	83	94.5 Å²	94.5	58%	0.58	60%	0.603	S	S	*	*			trans	62.7	147.5	159.4	71.9	0	0	0	0	118.1	A989 A993	A989-S991 VanDerWaalsContact C-N 3.32Å; A989-S991 PolarHBondContact O-N 3.5Å; S991-A993 PolarHBondContact O-N 3.44Å
992	P	35.4	Very low	51.9	Low	146 Å²	146	90 Å²	90	95%	0.948	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	12.2	-173.5	-11.6	28.1	0	0	0	115.5
993	A	32.8	Very low	52	Low	93 Å²	93	88.8 Å²	88.8	77%	0.769	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.6	-0.2	-166.8	0	0	0	0	0	115	S991	S991-A993 PolarHBondContact O-N 3.44Å
994	S	30.8	Very low	52.2	Low	88 Å²	88	93.2 Å²	93.2	62%	0.615	60%	0.596	S	S	*	*	S	Bend	trans	-96.7	135.3	173.8	64	0	0	0	0	111
995	S	28.9	Very low	52.5	Low	91 Å²	91	90.5 Å²	90.5	64%	0.636	59%	0.587	S	S	*	*			trans	-47	141.4	-177.2	48.2	0	0	0	0	113.8	G997	S995-G997 PolarHBondContact O-N 3.44Å
996	P	30.9	Very low	53.3	Low	140 Å²	140	84.6 Å²	84.6	91%	0.909	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	99.5	179.6	30.1	-31.7	0	0	0	109.3
997	G	34.3	Very low	54.9	Low	69 Å²	69	81 Å²	81	71%	0.711	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	175.4	-1.9	176.4	0	0	0	0	0	119.6	S995	S995-G997 PolarHBondContact O-N 3.44Å
998	L	39.3	Very low	56.7	Low	124 Å²	124	82.9 Å²	82.9	65%	0.649	53%	0.529	S	S	*	.			trans	-127.3	24.6	-171.9	-104.4	110.4	0	0	0	116	S1000	L998-S1000 VanDerWaalsContact C-N 3.35Å; L998-S1000 PolarHBondContact O-N 3.36Å
999	C	41.3	Very low	59	Low	117 Å²	117	80.4 Å²	80.4	79%	0.791	51%	0.506	S	S	*	.			trans	-87.7	76.7	167.9	-143	0	0	0	0	108.9
1000	S	55.2	Low	61.5	Low	55 Å²	55	75.4 Å²	75.4	39%	0.385	47%	0.465	S	S	.	.			trans	-85.1	120.3	177.9	62.5	0	0	0	0	110.7	K951 L998 I1002	K951-S1000 PolarHBondContact NZ-OG 2.9Å; L998-S1000 VanDerWaalsContact C-N 3.35Å; L998-S1000 PolarHBondContact O-N 3.36Å; S1000-I1002 PolarHBondContact O-N 2.98Å
1001	D	77.9	Confident	64.1	Low	72 Å²	72	68.6 Å²	68.6	39%	0.385	44%	0.436	S	S	.	.			trans	-66.7	109.3	170.5	-179.5	-2	0	0	0	109.6	R790 L1003 H1004 D1005	R790-D1001 IonicContact CZ-OD2 3.66Å; R790-D1001 IonicContact NE-OD2 3.43Å; R790-D1001 IonicContact NH2-OD1 3.1Å; R790-D1001 IonicContact NH2-OD2 3.55Å; R790-D1001 PolarHBondContact NH2-OD2 3.14Å; D1001-L1003 PolarHBondContact O-N 2.67Å; D1001-L1003 VanDerWaalsContact O-N 3.17Å; D1001-L1003 WeakPolarHBondContact OD1-CB 3.36Å; D1001-L1003 PolarHBondContact OD1-N 2.7Å; D1001-H1004 HydrophobicContact CB-CB 4.13Å; D1001-H1004 WeakPolarHBondContact O-CB 3.37Å; D1001-H1004 PolarHBondContact O-N 2.86Å; D1001-D1005 PolarHBondContact O-N 3.42Å
1002	I	87.2	Confident	66.7	Low	10 Å²	10	68.9 Å²	68.9	5%	0.051	43%	0.434	C	S	.	.	H	α-helix	trans	-56.5	-32.9	-179	-175	167.4	0	0	0	112.4	Y947 F966 L982 L983 S1000 H1004 D1005 L1006	Y947-I1002 HydrophobicContact CD1-CD1 4.15Å; Y947-I1002 HydrophobicContact CE1-CD1 3.57Å; Y947-I1002 HydrophobicContact CE1-CG1 4.13Å; F966-I1002 HydrophobicContact CD2-CD1 4.38Å; F966-I1002 HydrophobicContact CE2-CD1 4.04Å; L982-I1002 HydrophobicContact CD1-CD1 4.22Å; L982-I1002 HydrophobicContact CD2-CD1 3.29Å; L982-I1002 HydrophobicContact CG-CD1 3.53Å; L982-I1002 WeakPolarHBondContact O-CG2 3.39Å; L983-I1002 HydrophobicContact CD2-CG2 4.28Å; S1000-I1002 PolarHBondContact O-N 2.98Å; I1002-H1004 VanDerWaalsContact C-N 3.26Å; I1002-H1004 PolarHBondContact O-N 3.36Å; I1002-D1005 PolarHBondContact O-N 3.41Å; I1002-L1006 HydrophobicContact CG1-CD1 4.06Å; I1002-L1006 HydrophobicContact CG1-CG 4.11Å; I1002-L1006 WeakPolarHBondContact O-CB 3.37Å; I1002-L1006 VanDerWaalsContact O-CG 3.28Å; I1002-L1006 WeakPolarHBondContact O-CG 3.39Å; I1002-L1006 PolarHBondContact O-N 3.06Å
1003	L	88	Confident	69.3	Low	3 Å²	3	63.3 Å²	63.3	2%	0.016	40%	0.395	C	S	.	.	H	α-helix	trans	-64.8	-36.9	178.8	-65.7	174.2	0	0	0	110.7	F786 L789 R790 L983 D1001 E1007	F786-L1003 HydrophobicContact CD1-CB 4.19Å; F786-L1003 HydrophobicContact CD1-CD2 4.07Å; F786-L1003 HydrophobicContact CE1-CD2 4.41Å; L789-L1003 HydrophobicContact CD2-CD2 3.86Å; R790-L1003 HydrophobicContact CB-CD1 3.79Å; R790-L1003 HydrophobicContact CG-CD1 3.88Å; L983-L1003 HydrophobicContact CD2-CD2 3.69Å; D1001-L1003 PolarHBondContact O-N 2.67Å; D1001-L1003 VanDerWaalsContact O-N 3.17Å; D1001-L1003 WeakPolarHBondContact OD1-CB 3.36Å; D1001-L1003 PolarHBondContact OD1-N 2.7Å; L1003-E1007 VanDerWaalsContact O-CB 3.28Å; L1003-E1007 WeakPolarHBondContact O-CB 3.19Å; L1003-E1007 PolarHBondContact O-N 3.07Å
1004	H	89.2	Confident	71.9	Confident	103 Å²	103	58.9 Å²	58.9	48%	0.477	36%	0.358	S	S	.	.	H	α-helix	trans	-69.1	-38.4	175.5	-174.2	63.5	0	0	0	112	D1001 I1002 E1007 K1008	D1001-H1004 HydrophobicContact CB-CB 4.13Å; D1001-H1004 WeakPolarHBondContact O-CB 3.37Å; D1001-H1004 PolarHBondContact O-N 2.86Å; I1002-H1004 VanDerWaalsContact C-N 3.26Å; I1002-H1004 PolarHBondContact O-N 3.36Å; H1004-E1007 PolarHBondContact O-N 3.27Å; H1004-K1008 WeakPolarHBondContact O-CB 3.48Å; H1004-K1008 PolarHBondContact O-N 3.04Å
1005	D	89.6	Confident	74.6	Confident	26 Å²	26	59.4 Å²	59.4	14%	0.139	35%	0.35	C	S	.	.	H	α-helix	trans	-64.9	-44.7	175.3	-69.1	-36.3	0	0	0	111.6	Y947 K951 E963 D1001 I1002 K1008 T1009	Y947-D1005 PolarHBondContact OH-OD2 3.21Å; K951-D1005 WeakPolarHBondContact CE-OD2 3.38Å; K951-D1005 IonicContact NZ-OD1 3.96Å; K951-D1005 IonicContact NZ-OD2 2.92Å; K951-D1005 PolarHBondContact NZ-OD2 2.82Å; E963-D1005 WeakPolarHBondContact OE1-CB 3.45Å; D1001-D1005 PolarHBondContact O-N 3.42Å; I1002-D1005 PolarHBondContact O-N 3.41Å; D1005-K1008 PolarHBondContact O-N 3.32Å; D1005-T1009 WeakPolarHBondContact O-CB 3.43Å; D1005-T1009 PolarHBondContact O-N 3.16Å; D1005-T1009 PolarHBondContact O-OG1 3.11Å
1006	L	92.2	Very high	77.2	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-62.3	-42.4	175.3	-70.7	175.1	0	0	0	112	F786 E963 F966 L967 L983 I1002 T1009 L1010	F786-L1006 HydrophobicContact CE1-CB 3.79Å; F786-L1006 HydrophobicContact CZ-CB 3.94Å; E963-L1006 HydrophobicContact CB-CD2 4.11Å; E963-L1006 HydrophobicContact CG-CD2 4.3Å; F966-L1006 HydrophobicContact CB-CD2 3.95Å; F966-L1006 HydrophobicContact CD2-CD2 4.18Å; L967-L1006 HydrophobicContact CD2-CB 4.36Å; L967-L1006 HydrophobicContact CD2-CD2 4.28Å; L967-L1006 HydrophobicContact CG-CD2 4.03Å; L983-L1006 HydrophobicContact CD2-CD1 3.95Å; I1002-L1006 HydrophobicContact CG1-CD1 4.06Å; I1002-L1006 HydrophobicContact CG1-CG 4.11Å; I1002-L1006 WeakPolarHBondContact O-CB 3.37Å; I1002-L1006 VanDerWaalsContact O-CG 3.28Å; I1002-L1006 WeakPolarHBondContact O-CG 3.39Å; I1002-L1006 PolarHBondContact O-N 3.06Å; L1006-T1009 PolarHBondContact O-N 3.43Å; L1006-L1010 WeakPolarHBondContact O-CB 3.26Å; L1006-L1010 PolarHBondContact O-N 2.68Å
1007	E	93.1	Very high	79.6	Confident	39 Å²	39	52.4 Å²	52.4	18%	0.182	30%	0.302	C	S	.	.	H	α-helix	trans	-57.1	-49.9	174.5	-176.4	-167.9	149.6	0	0	110.9	L782 P783 F786 L1003 H1004 T1009 L1010 A1011	L782-E1007 HydrophobicContact CB-CG 4.25Å; P783-E1007 WeakPolarHBondContact CG-OE1 3.34Å; F786-E1007 HydrophobicContact CD2-CB 3.72Å; F786-E1007 HydrophobicContact CD2-CG 3.85Å; F786-E1007 HydrophobicContact CE2-CB 3.82Å; F786-E1007 HydrophobicContact CE2-CG 4.21Å; F786-E1007 HydrophobicContact CG-CB 4.13Å; F786-E1007 HydrophobicContact CG-CG 4.49Å; F786-E1007 HydrophobicContact CZ-CB 4.29Å; L1003-E1007 VanDerWaalsContact O-CB 3.28Å; L1003-E1007 WeakPolarHBondContact O-CB 3.19Å; L1003-E1007 PolarHBondContact O-N 3.07Å; H1004-E1007 PolarHBondContact O-N 3.27Å; E1007-T1009 PolarHBondContact O-N 3.29Å; E1007-L1010 PolarHBondContact O-N 3.31Å; E1007-A1011 VanDerWaalsContact O-CB 3.26Å; E1007-A1011 WeakPolarHBondContact O-CB 3.46Å; E1007-A1011 PolarHBondContact O-N 3Å
1008	K	91.6	Very high	81.6	Confident	136 Å²	136	50.8 Å²	50.8	59%	0.591	28%	0.276	S	S	*	.	H	α-helix	trans	-63.4	-41.7	179	-175.2	-179.4	179.1	-179.2	0	112.5	H1004 D1005 A1011 T1012	H1004-K1008 WeakPolarHBondContact O-CB 3.48Å; H1004-K1008 PolarHBondContact O-N 3.04Å; D1005-K1008 PolarHBondContact O-N 3.32Å; K1008-A1011 PolarHBondContact O-N 3.02Å; K1008-T1012 WeakPolarHBondContact O-CB 3.41Å; K1008-T1012 PolarHBondContact O-N 2.8Å; K1008-T1012 PolarHBondContact O-OG1 3.22Å
1009	T	91.3	Very high	83.3	Confident	26 Å²	26	46.6 Å²	46.6	16%	0.16	25%	0.254	C	S	.	.	H	α-helix	trans	-67.4	-40.6	179	-71.1	0	0	0	0	111.1	E963 L967 D1005 L1006 E1007 R1013	E963-T1009 HydrophobicContact CB-CG2 4.02Å; E963-T1009 PolarHBondContact OE2-OG1 3.17Å; L967-T1009 HydrophobicContact CD1-CG2 3.89Å; D1005-T1009 WeakPolarHBondContact O-CB 3.43Å; D1005-T1009 PolarHBondContact O-N 3.16Å; D1005-T1009 PolarHBondContact O-OG1 3.11Å; L1006-T1009 PolarHBondContact O-N 3.43Å; E1007-T1009 PolarHBondContact O-N 3.29Å; T1009-R1013 WeakPolarHBondContact O-CB 3.23Å; T1009-R1013 PolarHBondContact O-N 2.62Å
1010	L	92	Very high	84.4	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66.5	-45.1	174.2	-173.6	59.6	0	0	0	111.8	L782 F786 F805 C808 Y809 L967 L1006 E1007 T1012 R1013 I1014	L782-L1010 HydrophobicContact CD1-CB 4.2Å; L782-L1010 HydrophobicContact CD1-CD2 4.11Å; L782-L1010 HydrophobicContact CD1-CG 3.98Å; L782-L1010 HydrophobicContact CD2-CD2 3.55Å; L782-L1010 HydrophobicContact CD2-CG 4.26Å; L782-L1010 HydrophobicContact CG-CD2 4.47Å; F786-L1010 HydrophobicContact CE2-CD2 4.23Å; F805-L1010 HydrophobicContact CB-CD2 4.24Å; F805-L1010 HydrophobicContact CD1-CD2 3.58Å; F805-L1010 HydrophobicContact CE1-CD2 4.33Å; F805-L1010 HydrophobicContact CG-CD2 4.23Å; C808-L1010 HydrophobicContact CB-CD1 4.11Å; C808-L1010 HydrophobicContact CB-CD2 4.48Å; Y809-L1010 HydrophobicContact CD2-CD1 4.12Å; L967-L1010 HydrophobicContact CD1-CB 3.79Å; L967-L1010 HydrophobicContact CD1-CD1 4.36Å; L967-L1010 HydrophobicContact CD2-CB 4.25Å; L967-L1010 HydrophobicContact CD2-CD2 4.38Å; L1006-L1010 WeakPolarHBondContact O-CB 3.26Å; L1006-L1010 PolarHBondContact O-N 2.68Å; E1007-L1010 PolarHBondContact O-N 3.31Å; L1010-T1012 VanDerWaalsContact C-N 3.33Å; L1010-T1012 PolarHBondContact O-N 2.95Å; L1010-R1013 WeakPolarHBondContact O-CB 3.46Å; L1010-R1013 PolarHBondContact O-N 3.11Å; L1010-R1013 VanDerWaalsContact O-N 3.11Å; L1010-I1014 HydrophobicContact CD1-CD1 4.39Å; L1010-I1014 HydrophobicContact CD1-CG1 4.35Å; L1010-I1014 HydrophobicContact CG-CD1 4.08Å; L1010-I1014 HydrophobicContact CG-CG1 4.44Å; L1010-I1014 WeakPolarHBondContact O-CG1 3.46Å; L1010-I1014 PolarHBondContact O-N 2.75Å
1011	A	91.1	Very high	84.3	Confident	19 Å²	19	45.1 Å²	45.1	16%	0.157	24%	0.24	C	C	.	.	H	α-helix	trans	-54.5	-48.6	175.2	0	0	0	0	0	112	I778 L782 E1007 K1008 R1013 I1014 H1015	I778-A1011 HydrophobicContact CG2-CB 3.61Å; L782-A1011 HydrophobicContact CD1-CB 4.09Å; E1007-A1011 VanDerWaalsContact O-CB 3.26Å; E1007-A1011 WeakPolarHBondContact O-CB 3.46Å; E1007-A1011 PolarHBondContact O-N 3Å; K1008-A1011 PolarHBondContact O-N 3.02Å; A1011-R1013 VanDerWaalsContact C-N 3.29Å; A1011-R1013 PolarHBondContact O-N 3.31Å; A1011-I1014 PolarHBondContact O-N 2.96Å; A1011-H1015 WeakPolarHBondContact O-CB 3.48Å; A1011-H1015 PolarHBondContact O-N 3.44Å
1012	T	89.8	Confident	82.7	Confident	90 Å²	90	46.9 Å²	46.9	55%	0.552	26%	0.258	S	S	*	.	H	α-helix	trans	-61.2	-40.7	177.8	-54.9	0	0	0	0	111.2	K1008 L1010 S1016	K1008-T1012 WeakPolarHBondContact O-CB 3.41Å; K1008-T1012 PolarHBondContact O-N 2.8Å; K1008-T1012 PolarHBondContact O-OG1 3.22Å; L1010-T1012 VanDerWaalsContact C-N 3.33Å; L1010-T1012 PolarHBondContact O-N 2.95Å; T1012-S1016 WeakPolarHBondContact O-CB 2.99Å; T1012-S1016 PolarHBondContact O-N 3.31Å; T1012-S1016 PolarHBondContact O-OG 3.31Å
1013	R	88.8	Confident	80.4	Confident	29 Å²	29	55.2 Å²	55.2	11%	0.109	29%	0.294	C	S	.	.	H	α-helix	trans	-65.3	-50	178.8	-173.7	59.8	163.3	-174.4	-4.9	112	Y809 F812 P813 T1009 L1010 A1011 H1015 S1016 I1017	Y809-R1013 HydrophobicContact CD2-CB 4.19Å; Y809-R1013 HydrophobicContact CD2-CG 3.77Å; Y809-R1013 HydrophobicContact CE2-CB 4.14Å; Y809-R1013 HydrophobicContact CE2-CG 3.78Å; Y809-R1013 HydrophobicContact CG-CG 4.19Å; Y809-R1013 PolarHBondContact O-NE 3.17Å; F812-R1013 VanDerWaalsContact CB-NH2 3.32Å; F812-R1013 PolarHBondContact O-NH2 3.33Å; P813-R1013 PolarHBondContact O-NH2 3.08Å; T1009-R1013 WeakPolarHBondContact O-CB 3.23Å; T1009-R1013 PolarHBondContact O-N 2.62Å; L1010-R1013 WeakPolarHBondContact O-CB 3.46Å; L1010-R1013 PolarHBondContact O-N 3.11Å; L1010-R1013 VanDerWaalsContact O-N 3.11Å; A1011-R1013 VanDerWaalsContact C-N 3.29Å; A1011-R1013 PolarHBondContact O-N 3.31Å; R1013-H1015 VanDerWaalsContact C-N 3.32Å; R1013-H1015 PolarHBondContact O-N 3.08Å; R1013-S1016 PolarHBondContact O-N 3.11Å; R1013-S1016 VanDerWaalsContact O-N 3.17Å; R1013-S1016 PolarHBondContact O-OG 3.33Å; R1013-I1017 HydrophobicContact CG-CD1 3.9Å; R1013-I1017 PolarHBondContact O-N 3.05Å; R1013-I1017 VanDerWaalsContact O-N 3.09Å
1014	I	88.2	Confident	77.9	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-58.5	-46.8	177.6	-65.7	173.7	0	0	0	110.1	L777 I778 L782 C808 L1010 A1011 S1016 I1017 H1018	L777-I1014 HydrophobicContact CD2-CD1 4.24Å; I778-I1014 HydrophobicContact CD1-CB 4.29Å; I778-I1014 HydrophobicContact CD1-CG2 4.03Å; I778-I1014 HydrophobicContact CG1-CB 4.43Å; I778-I1014 HydrophobicContact CG1-CG2 4.1Å; L782-I1014 HydrophobicContact CD1-CD1 3.97Å; L782-I1014 HydrophobicContact CD2-CD1 4.34Å; L782-I1014 HydrophobicContact CG-CD1 4.45Å; C808-I1014 HydrophobicContact CB-CD1 3.93Å; C808-I1014 HydrophobicContact CB-CG1 4.33Å; L1010-I1014 HydrophobicContact CD1-CD1 4.39Å; L1010-I1014 HydrophobicContact CD1-CG1 4.35Å; L1010-I1014 HydrophobicContact CG-CD1 4.08Å; L1010-I1014 HydrophobicContact CG-CG1 4.44Å; L1010-I1014 WeakPolarHBondContact O-CG1 3.46Å; L1010-I1014 PolarHBondContact O-N 2.75Å; A1011-I1014 PolarHBondContact O-N 2.96Å; I1014-S1016 VanDerWaalsContact C-N 3.29Å; I1014-S1016 PolarHBondContact O-N 3.41Å; I1014-I1017 PolarHBondContact O-N 2.92Å; I1014-H1018 HydrophobicContact CG2-CB 4.49Å; I1014-H1018 PolarHBondContact O-N 2.9Å
1015	H	86.7	Confident	75.1	Confident	99 Å²	99	58.2 Å²	58.2	46%	0.458	34%	0.34	S	S	.	.	I	π-helix	trans	-59	-42.1	178.3	-167.1	83.4	0	0	0	111.9	I778 A1011 R1013 I1017 L1019 S1020	I778-H1015 HydrophobicContact CD1-CB 3.99Å; A1011-H1015 WeakPolarHBondContact O-CB 3.48Å; A1011-H1015 PolarHBondContact O-N 3.44Å; R1013-H1015 VanDerWaalsContact C-N 3.32Å; R1013-H1015 PolarHBondContact O-N 3.08Å; H1015-I1017 PolarHBondContact O-N 2.55Å; H1015-L1019 PolarHBondContact O-N 3.1Å; H1015-S1020 WeakPolarHBondContact O-CB 3.22Å; H1015-S1020 PolarHBondContact O-N 3.07Å
1016	S	84.8	Confident	72.5	Confident	51 Å²	51	63.4 Å²	63.4	36%	0.357	37%	0.373	S	S	.	.	I	π-helix	trans	-69.1	-27.8	-179.7	73.3	0	0	0	0	114.7	T1012 R1013 I1014 S1020	T1012-S1016 WeakPolarHBondContact O-CB 2.99Å; T1012-S1016 PolarHBondContact O-N 3.31Å; T1012-S1016 PolarHBondContact O-OG 3.31Å; R1013-S1016 PolarHBondContact O-N 3.11Å; R1013-S1016 VanDerWaalsContact O-N 3.17Å; R1013-S1016 PolarHBondContact O-OG 3.33Å; I1014-S1016 VanDerWaalsContact C-N 3.29Å; I1014-S1016 PolarHBondContact O-N 3.41Å; S1016-S1020 VanDerWaalsContact C-OG 3.3Å; S1016-S1020 PolarHBondContact O-OG 3.02Å
1017	I	81.3	Confident	69.8	Low	33 Å²	33	72.5 Å²	72.5	17%	0.169	43%	0.428	C	S	.	.	I	π-helix	trans	-97.4	-49	-176	-66.6	169.9	0	0	0	111.4	F812 R1013 I1014 H1015	F812-I1017 HydrophobicContact CD2-CD1 3.72Å; F812-I1017 HydrophobicContact CD2-CG1 4.29Å; F812-I1017 HydrophobicContact CD2-CG2 4.21Å; F812-I1017 HydrophobicContact CE2-CD1 4.32Å; F812-I1017 HydrophobicContact CE2-CG2 3.72Å; R1013-I1017 HydrophobicContact CG-CD1 3.9Å; R1013-I1017 PolarHBondContact O-N 3.05Å; R1013-I1017 VanDerWaalsContact O-N 3.09Å; I1014-I1017 PolarHBondContact O-N 2.92Å; H1015-I1017 PolarHBondContact O-N 2.55Å
1018	H	75.2	Confident	68.7	Low	35 Å²	35	74.2 Å²	74.2	16%	0.162	44%	0.44	C	S	.	.	I	π-helix	trans	-100.8	-28.5	-166	-61.3	-79	0	0	0	113.4	E770 Y773 I1014 T1021	E770-H1018 IonicContact OE2-CE1 3.49Å; E770-H1018 PolarHBondContact OE2-CE1 2.93Å; Y773-H1018 AromaticContact CD2-CD2 3.96Å; Y773-H1018 AromaticContact CD2-CG 3.96Å; I1014-H1018 HydrophobicContact CG2-CB 4.49Å; I1014-H1018 PolarHBondContact O-N 2.9Å; H1018-T1021 PolarHBondContact O-OG1 2.8Å
1019	L	74.1	Confident	67.5	Low	35 Å²	35	70.9 Å²	70.9	18%	0.183	43%	0.432	C	S	.	.	I	π-helix	trans	-106.2	-23.7	-172.5	-62.1	174.8	0	0	0	114.2	Y773 I778 H1015 T1021 S1022	Y773-L1019 WeakPolarHBondContact O-CD2 3.49Å; I778-L1019 HydrophobicContact CD1-CD1 3.43Å; I778-L1019 VanDerWaalsContact CD1-CD1 3.43Å; I778-L1019 HydrophobicContact CG1-CD1 4.43Å; H1015-L1019 PolarHBondContact O-N 3.1Å; L1019-T1021 VanDerWaalsContact C-N 3.27Å; L1019-T1021 PolarHBondContact O-N 3.25Å; L1019-S1022 PolarHBondContact O-OG 2.79Å
1020	S	65.8	Low	66.1	Low	41 Å²	41	73.4 Å²	73.4	29%	0.287	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-69.7	-18.4	-179	58.4	0	0	0	0	114.1	H1015 S1016 S1022 K1023	H1015-S1020 WeakPolarHBondContact O-CB 3.22Å; H1015-S1020 PolarHBondContact O-N 3.07Å; S1016-S1020 VanDerWaalsContact C-OG 3.3Å; S1016-S1020 PolarHBondContact O-OG 3.02Å; S1020-S1022 PolarHBondContact O-N 2.91Å; S1020-K1023 PolarHBondContact O-N 3.02Å
1021	T	52.6	Low	64.6	Low	100 Å²	100	77.7 Å²	77.7	61%	0.613	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-68.4	-12.7	178.2	47.9	0	0	0	0	113.7	H1018 L1019 K1023	H1018-T1021 PolarHBondContact O-OG1 2.8Å; L1019-T1021 VanDerWaalsContact C-N 3.27Å; L1019-T1021 PolarHBondContact O-N 3.25Å; T1021-K1023 PolarHBondContact O-N 2.87Å
1022	S	44.7	Very low	63	Low	109 Å²	109	81.4 Å²	81.4	76%	0.762	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-72	-9.4	173.7	61.2	0	0	0	0	114.3	L1019 S1020	L1019-S1022 PolarHBondContact O-OG 2.79Å; S1020-S1022 PolarHBondContact O-N 2.91Å
1023	K	39.2	Very low	61.2	Low	186 Å²	186	80.8 Å²	80.8	81%	0.809	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-128.7	64	169.7	-70.3	-172.2	-179.1	176.7	0	111.9	S1020 T1021 S1025	S1020-K1023 PolarHBondContact O-N 3.02Å; T1021-K1023 PolarHBondContact O-N 2.87Å; K1023-S1025 VanDerWaalsContact C-N 3.26Å; K1023-S1025 PolarHBondContact O-N 3.31Å
1024	G	34.7	Very low	59.2	Low	83 Å²	83	84.5 Å²	84.5	86%	0.856	52%	0.516	S	S	*	.	S	Bend	trans	44.4	40.5	150.7	0	0	0	0	0	117.3
1025	S	30.2	Very low	57	Low	85 Å²	85	91 Å²	91	59%	0.594	56%	0.556	S	S	*	*			trans	-129.9	99.1	166.9	-170.6	0	0	0	0	108.4	K1023 V1027	K1023-S1025 VanDerWaalsContact C-N 3.26Å; K1023-S1025 PolarHBondContact O-N 3.31Å; S1025-V1027 PolarHBondContact O-N 2.88Å
1026	V	36	Very low	54.5	Low	136 Å²	136	90.3 Å²	90.3	82%	0.824	56%	0.564	S	S	*	*			trans	-54.8	129.4	163.2	177.4	0	0	0	0	107.6
1027	V	35.5	Very low	51.7	Low	190 Å²	190	93.9 Å²	93.9	100%	1.152	58%	0.583	S	S	*	*			trans	-77.2	0	160.4	175	0	0	0	0	108.6	S1025	S1025-V1027 PolarHBondContact O-N 2.88Å

Retrieved 1,027 of 1,027 residues in 1423.4 ms (Link to these results)

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