A0A096NC58_PAPAN Loading...

LON peptidase N-terminal domain and ring finger 3

AlphaFold DB , UniProt , Accession A0A096NC58, Species PAPAN (Papio anubis, Olive baboon), Gene LONRF3, Length 811 aa.

						>A0A096NC58_PAPAN|A0A096NC58|LONRF3
MESLRTEQMLSLPAEVSSNNLEPAERGASAAQVDMGPHREAAAESPAPLPTREPEQDQSPGTSTPESKVLLTQADALASRGRIREALEVYRQLSERQQLVAEQLEQLVRCLAEKVPQGEVLAPAPPGEGSTASGAVAAEEIGAAAAAAATEVWDGFKCRKCHGFLSDPVSLSCGHTFCKLCLERGRAADRRCALCGVKLSALMVATGRARGSRRAGQQPPPPLRVNVVLSGLLGKLFPGPARASQLRHEGNRLYRERQVEAALLKYNEAVKLAPNDHLLYSNRSQIYFTLESHENALHDAEIACKLRPMGFKAHFRKAQALATLGKVEEALREFLYCVSLDGKNKRARCEAQRLLLSFFSPSVPGDSQEHSPDILKLLAPHPRLKENVESMTTEVTSHNLPRLLQDNLELPHCSSQEEAAARGDGSSLMDPAKVKGDGQQHHMKDQEEEEEKWDATSPKAASSKTGKCQEKKRKHCQIESQEDTGMPNKASKQDPPTDQGDTPALSLPLASFDASDLECALCMRLFYEPVTTPCGHTFCLKCLERCLDHNAKCPLCKDGLSQCLASRKYSKNVIMEELIAKFLPEELKERRKLYEEEMEELSNLNKNVPIFVCTMAYPTVPCPLHIFEPCYRLMIRRCIETGTRQFGMCLGDPVKGFAEYGCILEIRNVQFFADGRSVVDSIGKRRFRVLHQSQRDGYNTADIEYIEDQKVQGEDCAELMGLHNCVYQQASLWFHSLKSSLKNRILNHFGPMPEKDADPQMNPNGPAWCWWMLAVLPLESRAQLPFLAMRSLKDRLNGIRRVLAFISRNQN
					

Structure Viewer

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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	28.6	Very low	27.3	Very low	243 Å²	243	162.4 Å²	162.4	100%	1.197	83%	0.829	S	S	*	*				0	155.3	0	-67.4	172.5	-176.2	0	0	108
2	E	28.4	Very low	28	Very low	188 Å²	188	158.8 Å²	158.8	88%	0.879	81%	0.813	S	S	*	*			trans	-58.2	168.7	167.3	-70.1	143	128.8	0	0	111.8
3	S	25.8	Very low	28	Very low	97 Å²	97	155.9 Å²	155.9	68%	0.678	81%	0.81	S	S	*	*			cis	-175	150.3	-16.6	164.5	0	0	0	0	106.2
4	L	27.6	Very low	27.9	Very low	171 Å²	171	152 Å²	152	90%	0.895	81%	0.812	S	S	*	*			trans	-168.3	150.7	141	-106.2	160.8	0	0	0	110.9
5	R	27.5	Very low	27.9	Very low	203 Å²	203	154.8 Å²	154.8	77%	0.766	82%	0.819	S	S	*	*			trans	-93	139.1	-169.9	-60.4	174	-177	164.3	0.6	111.7	E7	R5-E7 PolarHBondContact O-N 2.79Å
6	T	28.8	Very low	27.9	Very low	152 Å²	152	153.5 Å²	153.5	93%	0.933	82%	0.818	S	S	*	*			trans	-92.6	66.6	174.2	-37.5	0	0	0	0	111.4
7	E	26.9	Very low	27.7	Very low	153 Å²	153	150.5 Å²	150.5	72%	0.715	81%	0.812	S	S	*	*			trans	-103.5	103.9	170.3	-74.7	-171.5	111	0	0	111.2	R5	R5-E7 PolarHBondContact O-N 2.79Å
8	Q	27.3	Very low	27.7	Very low	171 Å²	171	147.8 Å²	147.8	80%	0.799	81%	0.807	S	S	*	*			trans	-168	99.7	158.4	-107.2	159.6	51.5	0	0	106.8
9	M	26.6	Very low	27.7	Very low	171 Å²	171	147.8 Å²	147.8	84%	0.842	81%	0.806	S	S	*	*				48.6	121.3	75	-71.2	-157.5	70	0	0	114.6	S11	M9-S11 PolarHBondContact O-N 2.75Å
10	L	29.1	Very low	27.7	Very low	136 Å²	136	148 Å²	148	71%	0.712	81%	0.806	S	S	*	*			trans	-55.4	89.4	-179.2	-71	158.8	0	0	0	113.9	L12 R744	L10-L12 PolarHBondContact O-N 2.64Å; L10-R744 PolarHBondContact O-NH2 2.69Å
11	S	24.1	Very low	27.6	Very low	101 Å²	101	149.1 Å²	149.1	71%	0.706	81%	0.811	S	S	*	*			trans	-83.2	87.1	172.1	41.4	0	0	0	0	111.6	M9	M9-S11 PolarHBondContact O-N 2.75Å
12	L	34.6	Very low	27.6	Very low	120 Å²	120	146.2 Å²	146.2	63%	0.628	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-81.1	147.7	163.6	-67.6	171.3	0	0	0	109.6	L10	L10-L12 PolarHBondContact O-N 2.64Å
13	P	28.7	Very low	27.6	Very low	121 Å²	121	143.1 Å²	143.1	79%	0.786	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-65.7	147	179.2	27.9	-34.8	0	0	0	111.8
14	A	25.9	Very low	27.5	Very low	101 Å²	101	143.7 Å²	143.7	84%	0.835	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-69	150.3	-177.9	0	0	0	0	0	113
15	E	28.3	Very low	27.4	Very low	194 Å²	194	142.7 Å²	142.7	91%	0.907	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-71	147.4	-179.2	-62	-177.4	148.2	0	0	112.5
16	V	27.9	Very low	27.4	Very low	134 Å²	134	143.8 Å²	143.8	81%	0.812	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-82.8	126.3	166.4	175.6	0	0	0	0	107.9	S18	V16-S18 PolarHBondContact O-N 2.78Å; V16-S18 VanDerWaalsContact O-N 3.13Å
17	S	25.5	Very low	27.2	Very low	102 Å²	102	140.4 Å²	140.4	71%	0.713	79%	0.791	S	S	*	*			trans	-56.6	115.8	-177	-172.2	0	0	0	0	112.4	N19	S17-N19 PolarHBondContact O-N 2.76Å
18	S	27.5	Very low	27.2	Very low	103 Å²	103	138 Å²	138	72%	0.72	80%	0.797	S	S	*	*			trans	-81.4	102	174.8	-66.2	0	0	0	0	110.4	V16 N20	V16-S18 PolarHBondContact O-N 2.78Å; V16-S18 VanDerWaalsContact O-N 3.13Å; S18-N20 PolarHBondContact O-N 2.77Å
19	N	26.5	Very low	27.1	Very low	148 Å²	148	135.8 Å²	135.8	79%	0.791	80%	0.801	S	S	*	*			trans	-74.3	108	171.5	-78.7	-3.1	0	0	0	110.1	S17	S17-N19 PolarHBondContact O-N 2.76Å
20	N	27.4	Very low	27.2	Very low	150 Å²	150	131.6 Å²	131.6	80%	0.802	79%	0.793	S	S	*	*			trans	-63.7	134.8	172.6	-67.5	-27.9	0	0	0	111	S18	S18-N20 PolarHBondContact O-N 2.77Å
21	L	27.2	Very low	27.1	Very low	173 Å²	173	129.3 Å²	129.3	91%	0.906	79%	0.794	S	S	*	*			trans	-141.8	86.8	166.3	-101.9	167.6	0	0	0	108
22	E	27.3	Very low	27.1	Very low	182 Å²	182	133 Å²	133	85%	0.85	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-81.9	157.1	169.3	-85.2	-161	128.4	0	0	111.5
23	P	29.1	Very low	26.7	Very low	123 Å²	123	133.2 Å²	133.2	80%	0.799	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-83	143.5	-169	32.9	-35.6	0	0	0	113.2
24	A	24.1	Very low	26.5	Very low	109 Å²	109	133.9 Å²	133.9	90%	0.901	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-102	124.4	163.7	0	0	0	0	0	109.6
25	E	25.6	Very low	26.4	Very low	149 Å²	149	136.9 Å²	136.9	70%	0.696	80%	0.802	S	S	*	*			trans	-126.7	144.6	177.6	-148.9	-170.5	-115.5	0	0	111
26	R	27.2	Very low	26.4	Very low	226 Å²	226	130.8 Å²	130.8	85%	0.853	79%	0.791	S	S	*	*			trans	77.6	110.9	166.3	-50	-176.7	-165.8	-156	-4.3	119.4
27	G	24.5	Very low	26.9	Very low	81 Å²	81	130.7 Å²	130.7	84%	0.835	79%	0.794	S	S	*	*			trans	-146.2	146.3	144.4	0	0	0	0	0	107.4
28	A	26.5	Very low	26.9	Very low	102 Å²	102	134.3 Å²	134.3	84%	0.843	80%	0.799	S	S	*	*			trans	-143.3	169.1	-164.1	0	0	0	0	0	114.9
29	S	26.4	Very low	27	Very low	126 Å²	126	138.6 Å²	138.6	88%	0.881	80%	0.799	S	S	*	*			trans	73	152.6	-177.4	-128.5	0	0	0	0	114.7
30	A	27.3	Very low	27	Very low	83 Å²	83	138.6 Å²	138.6	69%	0.686	80%	0.795	S	S	*	*			cis	-143.7	147.3	-3.4	0	0	0	0	0	108.2
31	A	26.7	Very low	27	Very low	88 Å²	88	136 Å²	136	73%	0.727	79%	0.794	S	S	*	*				69.9	133.1	81.8	0	0	0	0	0	117.1
32	Q	25	Very low	27	Very low	178 Å²	178	131.9 Å²	131.9	83%	0.832	79%	0.785	S	S	*	*			trans	69.8	135.9	172.6	-67.2	176.5	-78.1	0	0	116.1
33	V	26.6	Very low	26.9	Very low	125 Å²	125	127.8 Å²	127.8	76%	0.758	78%	0.782	S	S	*	*				68.2	117.9	55.7	179.6	0	0	0	0	109.2
34	D	23.8	Very low	26.8	Very low	135 Å²	135	130.9 Å²	130.9	72%	0.722	79%	0.786	S	S	*	*				-162	-172.4	58.9	-156.8	14.6	0	0	0	116
35	M	24.7	Very low	26.9	Very low	163 Å²	163	131 Å²	131	80%	0.803	78%	0.78	S	S	*	*			trans	1.6	147.4	158.6	-68	-67.8	175.7	0	0	122
36	G	27.8	Very low	27.5	Very low	67 Å²	67	130.4 Å²	130.4	69%	0.691	79%	0.789	S	S	*	*			trans	-103.5	-179.7	157.8	0	0	0	0	0	113.3
37	P	38.3	Very low	27.6	Very low	132 Å²	132	124.2 Å²	124.2	86%	0.857	79%	0.786	S	S	*	*			trans	-113.4	159.4	-178.7	37.6	-27.6	0	0	0	116.1
38	H	25.9	Very low	28.3	Very low	178 Å²	178	126 Å²	126	82%	0.824	78%	0.783	S	S	*	*			trans	-84.5	-168.3	168.2	-67.1	-86.6	0	0	0	111.5
39	R	28.4	Very low	28.3	Very low	192 Å²	192	128.8 Å²	128.8	73%	0.725	78%	0.783	S	S	*	*			cis	-169.1	172.3	15	-145.5	162.5	-172.2	-134.1	10.6	112.3
40	E	27.2	Very low	28.9	Very low	149 Å²	149	128.1 Å²	128.1	70%	0.696	78%	0.775	S	S	*	*			trans	64.1	150.5	152.1	-85.9	131.1	-157.5	0	0	120.3
41	A	27.1	Very low	28.8	Very low	95 Å²	95	130.9 Å²	130.9	79%	0.785	78%	0.784	S	S	*	*			cis	-154	-173	-9.4	0	0	0	0	0	108.3
42	A	26.9	Very low	28.9	Very low	87 Å²	87	136.6 Å²	136.6	72%	0.719	79%	0.787	S	S	*	*			cis	-149.4	166.8	4.5	0	0	0	0	0	109.6
43	A	26.6	Very low	29.4	Very low	95 Å²	95	135 Å²	135	79%	0.785	78%	0.779	S	S	*	*				58.2	140.7	91.1	0	0	0	0	0	116.6
44	E	26	Very low	29.7	Very low	189 Å²	189	135.1 Å²	135.1	88%	0.883	78%	0.783	S	S	*	*			cis	-130.2	-169.9	18.6	-66.2	-173.6	123.4	0	0	114.9
45	S	27.3	Very low	30	Very low	112 Å²	112	137.1 Å²	137.1	78%	0.783	79%	0.788	S	S	*	*			trans	-132.1	-179.4	-175.9	-51	0	0	0	0	112.3
46	P	36.8	Very low	30.7	Very low	135 Å²	135	137.5 Å²	137.5	88%	0.877	79%	0.788	S	S	*	*				-142.6	-170.7	106.2	35.6	-18.6	0	0	0	115.1
47	A	29.8	Very low	30.7	Very low	97 Å²	97	142.3 Å²	142.3	80%	0.802	80%	0.798	S	S	*	*			trans	-103.7	169.7	-152.3	0	0	0	0	0	117
48	P	39.5	Very low	30.3	Very low	117 Å²	117	144.5 Å²	144.5	76%	0.76	80%	0.796	S	S	*	*			trans	-113	-170.2	-171.3	43.5	-34.7	0	0	0	115.2
49	L	26.3	Very low	30.4	Very low	161 Å²	161	141.5 Å²	141.5	84%	0.843	80%	0.795	S	S	*	*			trans	115.3	155.8	170	-68.3	172.6	0	0	0	113.9
50	P	38.8	Very low	30.9	Very low	112 Å²	112	137.7 Å²	137.7	73%	0.727	80%	0.795	S	S	*	*			cis	-126.5	157.6	3	39.8	-25.7	0	0	0	116.2
51	T	26.3	Very low	31.6	Very low	142 Å²	142	134.2 Å²	134.2	87%	0.871	80%	0.8	S	S	*	*			trans	-154.4	126.3	154.9	10.2	0	0	0	0	112.9
52	R	29.1	Very low	32.3	Very low	207 Å²	207	136.1 Å²	136.1	78%	0.781	80%	0.802	S	S	*	*			trans	-90	156.4	149.3	-60.1	173.4	76.8	171.7	1.7	106
53	E	35.3	Very low	33.6	Very low	144 Å²	144	135 Å²	135	67%	0.673	79%	0.789	S	S	*	*			cis	-161.9	147.3	-7.3	-114.3	158.7	-146.6	0	0	104.7
54	P	31.1	Very low	35.6	Very low	129 Å²	129	132.7 Å²	132.7	84%	0.838	77%	0.765	S	S	*	*			trans	-121.5	128.8	166.3	34.9	-23.4	0	0	0	112.6
55	E	31.3	Very low	37.9	Very low	176 Å²	176	128.9 Å²	128.9	82%	0.822	76%	0.757	S	S	*	*			trans	-80.1	135.1	164.8	-68.1	-169	103.7	0	0	111
56	Q	38.7	Very low	40.2	Very low	172 Å²	172	129.5 Å²	129.5	80%	0.804	75%	0.747	S	S	*	*			trans	39.8	102.5	147.7	-54.4	-176.8	41.1	0	0	119.2
57	D	27.3	Very low	42.1	Very low	167 Å²	167	123.3 Å²	123.3	89%	0.893	71%	0.707	S	S	*	*				-143.9	150.8	122.8	-154.4	-10.1	0	0	0	109.3
58	Q	31.3	Very low	44.6	Very low	178 Å²	178	124.5 Å²	124.5	83%	0.832	69%	0.694	S	S	*	*			trans	-112.4	137	-169.8	-68	-168.6	14.5	0	0	113.6
59	S	27	Very low	46.9	Very low	115 Å²	115	123.3 Å²	123.3	80%	0.804	69%	0.685	S	S	*	*			trans	-108.7	140.9	175.2	56.9	0	0	0	0	112.3
60	P	39.9	Very low	49.8	Very low	112 Å²	112	117.1 Å²	117.1	73%	0.727	65%	0.652	S	S	*	*			trans	-84.1	150.1	-178.5	33	-34.9	0	0	0	112.6
61	G	40.5	Very low	52.1	Low	77 Å²	77	113 Å²	113	79%	0.794	62%	0.624	S	S	*	*			trans	117	32.3	154.2	0	0	0	0	0	119.5
62	T	42.2	Very low	55.1	Low	134 Å²	134	110.6 Å²	110.6	82%	0.822	61%	0.609	S	S	*	*			trans	-100.2	116.4	160.7	49.3	0	0	0	0	111	T64	T62-T64 PolarHBondContact O-N 3.13Å
63	S	54.1	Low	58.1	Low	65 Å²	65	105.1 Å²	105.1	46%	0.455	59%	0.592	S	S	.	*			trans	-68.4	115.7	179	62.7	0	0	0	0	110.7	K68	S63-K68 WeakPolarHBondContact OG-CE 3.45Å
64	T	68.9	Low	60.7	Low	46 Å²	46	98.2 Å²	98.2	28%	0.282	56%	0.56	S	S	.	*			trans	-68.1	158.3	176.8	65	0	0	0	0	111.1	T62 E66 S67 K68	T62-T64 PolarHBondContact O-N 3.13Å; T64-E66 PolarHBondContact O-N 3.09Å; T64-S67 PolarHBondContact O-N 2.89Å; T64-S67 PolarHBondContact O-OG 2.84Å; T64-S67 PolarHBondContact OG1-N 3.31Å; T64-S67 VanDerWaalsContact OG1-N 3.09Å; T64-K68 PolarHBondContact O-N 3.02Å
65	P	73.8	Confident	63.5	Low	108 Å²	108	94 Å²	94	70%	0.701	53%	0.531	S	S	*	.	H	α-helix	trans	-56.6	-37.7	172.1	-24.9	35.3	0	0	0	112.1	K68 V69	P65-K68 PolarHBondContact O-N 3.35Å; P65-V69 PolarHBondContact O-N 3.18Å
66	E	76.8	Confident	66.3	Low	126 Å²	126	87.6 Å²	87.6	59%	0.589	51%	0.508	S	S	*	.	H	α-helix	trans	-63.4	-41.5	176.9	-59.8	-178.9	173.3	0	0	112.8	T64 K68 V69 L70	T64-E66 PolarHBondContact O-N 3.09Å; E66-K68 PolarHBondContact O-N 2.9Å; E66-V69 PolarHBondContact O-N 3.14Å; E66-V69 VanDerWaalsContact O-N 3.14Å; E66-L70 WeakPolarHBondContact O-CG 3.35Å; E66-L70 PolarHBondContact O-N 3.1Å
67	S	76.8	Confident	68.7	Low	5 Å²	5	80.2 Å²	80.2	4%	0.035	47%	0.474	C	S	.	.	H	α-helix	trans	-65.2	-31.3	179.9	90.7	0	0	0	0	111.8	T64 L71	T64-S67 PolarHBondContact O-N 2.89Å; T64-S67 PolarHBondContact O-OG 2.84Å; T64-S67 PolarHBondContact OG1-N 3.31Å; T64-S67 VanDerWaalsContact OG1-N 3.09Å; S67-L71 VanDerWaalsContact O-CB 3.26Å; S67-L71 WeakPolarHBondContact O-CB 3.39Å; S67-L71 PolarHBondContact O-N 3.26Å
68	K	82.5	Confident	71.6	Confident	121 Å²	121	72.3 Å²	72.3	53%	0.526	43%	0.431	S	S	.	.	H	α-helix	trans	-69.4	-41.2	172.5	-63.3	-179.8	-176.2	177.3	0	112	S63 T64 P65 E66 L71 T72	S63-K68 WeakPolarHBondContact OG-CE 3.45Å; T64-K68 PolarHBondContact O-N 3.02Å; P65-K68 PolarHBondContact O-N 3.35Å; E66-K68 PolarHBondContact O-N 2.9Å; K68-L71 PolarHBondContact O-N 2.91Å; K68-T72 WeakPolarHBondContact O-CG2 3.33Å; K68-T72 PolarHBondContact O-N 3.39Å; K68-T72 PolarHBondContact O-OG1 3.04Å
69	V	86.6	Confident	74.3	Confident	92 Å²	92	66.6 Å²	66.6	56%	0.558	41%	0.411	S	S	*	.	H	α-helix	trans	-62.2	-50.4	174.8	174.5	0	0	0	0	110.3	P65 E66 L71 T72 Q73	P65-V69 PolarHBondContact O-N 3.18Å; E66-V69 PolarHBondContact O-N 3.14Å; E66-V69 VanDerWaalsContact O-N 3.14Å; V69-L71 VanDerWaalsContact C-N 3.33Å; V69-L71 PolarHBondContact O-N 2.89Å; V69-T72 PolarHBondContact O-N 3.32Å; V69-T72 PolarHBondContact O-OG1 3.22Å; V69-Q73 WeakPolarHBondContact O-CB 3.47Å; V69-Q73 PolarHBondContact O-N 2.89Å
70	L	86.9	Confident	77.2	Confident	32 Å²	32	70.5 Å²	70.5	17%	0.168	41%	0.408	C	S	.	.	H	α-helix	trans	-59.7	-40.1	177.1	-72.2	170.8	0	0	0	112.5	E66 Q73 A74 V89 L93	E66-L70 WeakPolarHBondContact O-CG 3.35Å; E66-L70 PolarHBondContact O-N 3.1Å; L70-Q73 WeakPolarHBondContact O-CB 3.45Å; L70-Q73 PolarHBondContact O-N 2.97Å; L70-A74 PolarHBondContact O-N 3.49Å; L70-V89 HydrophobicContact CB-CG1 4.22Å; L70-V89 HydrophobicContact CD2-CG1 4.26Å; L70-V89 WeakPolarHBondContact O-CG1 3.46Å; L70-L93 HydrophobicContact CB-CD1 4.32Å; L70-L93 HydrophobicContact CB-CD2 3.88Å; L70-L93 HydrophobicContact CB-CG 4.21Å; L70-L93 HydrophobicContact CD1-CD2 4.4Å
71	L	88.6	Confident	79.2	Confident	25 Å²	25	66.7 Å²	66.7	13%	0.131	39%	0.389	C	S	.	.	H	α-helix	trans	-63.9	-48.8	175.7	177.1	60.1	0	0	0	111.7	S67 K68 V69 Q73 A74 D75 Y90 L93 Q103	S67-L71 VanDerWaalsContact O-CB 3.26Å; S67-L71 WeakPolarHBondContact O-CB 3.39Å; S67-L71 PolarHBondContact O-N 3.26Å; K68-L71 PolarHBondContact O-N 2.91Å; V69-L71 VanDerWaalsContact C-N 3.33Å; V69-L71 PolarHBondContact O-N 2.89Å; L71-Q73 PolarHBondContact O-N 3.39Å; L71-A74 WeakPolarHBondContact O-CB 3.45Å; L71-A74 PolarHBondContact O-N 3.29Å; L71-A74 VanDerWaalsContact O-N 3.1Å; L71-D75 PolarHBondContact O-N 3.33Å; L71-Y90 HydrophobicContact CD1-CD1 4.36Å; L71-Y90 HydrophobicContact CD1-CE1 3.78Å; L71-L93 HydrophobicContact CB-CD1 4.08Å; L71-L93 HydrophobicContact CD1-CD1 4.39Å; L71-Q103 HydrophobicContact CD1-CB 3.96Å; L71-Q103 HydrophobicContact CD2-CB 3.92Å; L71-Q103 HydrophobicContact CD2-CG 3.7Å
72	T	89.2	Confident	81.4	Confident	91 Å²	91	68.7 Å²	68.7	56%	0.558	37%	0.373	S	S	*	.	H	α-helix	trans	-64.1	-29.1	177.1	58.1	0	0	0	0	112.8	K68 V69 A76	K68-T72 WeakPolarHBondContact O-CG2 3.33Å; K68-T72 PolarHBondContact O-N 3.39Å; K68-T72 PolarHBondContact O-OG1 3.04Å; V69-T72 PolarHBondContact O-N 3.32Å; V69-T72 PolarHBondContact O-OG1 3.22Å; T72-A76 VanDerWaalsContact O-CB 3.22Å; T72-A76 WeakPolarHBondContact O-CB 3.5Å; T72-A76 PolarHBondContact O-N 3.3Å
73	Q	91.3	Very high	83.5	Confident	92 Å²	92	62.5 Å²	62.5	43%	0.43	34%	0.335	S	S	.	.	H	α-helix	trans	-67.1	-46.2	169.9	177.3	179.5	-12	0	0	111.7	V69 L70 L71 A76 L77	V69-Q73 WeakPolarHBondContact O-CB 3.47Å; V69-Q73 PolarHBondContact O-N 2.89Å; L70-Q73 WeakPolarHBondContact O-CB 3.45Å; L70-Q73 PolarHBondContact O-N 2.97Å; L71-Q73 PolarHBondContact O-N 3.39Å; Q73-A76 PolarHBondContact O-N 2.92Å; Q73-L77 HydrophobicContact CG-CD1 4.06Å; Q73-L77 WeakPolarHBondContact O-CB 3.41Å; Q73-L77 VanDerWaalsContact O-CG 3.27Å; Q73-L77 WeakPolarHBondContact O-CG 3.26Å; Q73-L77 PolarHBondContact O-N 2.93Å
74	A	89.8	Confident	84.9	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-60.7	-46.9	176.6	0	0	0	0	0	111.6	L70 L71 A76 L77 A78 V89 Y90	L70-A74 PolarHBondContact O-N 3.49Å; L71-A74 WeakPolarHBondContact O-CB 3.45Å; L71-A74 PolarHBondContact O-N 3.29Å; L71-A74 VanDerWaalsContact O-N 3.1Å; A74-A76 VanDerWaalsContact C-N 3.34Å; A74-A76 PolarHBondContact O-N 2.86Å; A74-L77 PolarHBondContact O-N 3.23Å; A74-A78 WeakPolarHBondContact O-CB 3.34Å; A74-A78 PolarHBondContact O-N 2.9Å; A74-V89 HydrophobicContact CB-CB 3.94Å; A74-V89 HydrophobicContact CB-CG1 3.85Å; A74-Y90 HydrophobicContact CB-CD1 3.8Å; A74-Y90 HydrophobicContact CB-CD2 4.11Å; A74-Y90 HydrophobicContact CB-CE1 3.57Å; A74-Y90 HydrophobicContact CB-CE2 3.87Å; A74-Y90 HydrophobicContact CB-CG 4.07Å
75	D	90.6	Very high	85.8	Confident	40 Å²	40	69.1 Å²	69.1	21%	0.214	35%	0.348	C	S	.	.	H	α-helix	trans	-59.6	-42.4	175.5	-72.5	-16.2	0	0	0	111.7	L71 A78 S79 Y90 Q106	L71-D75 PolarHBondContact O-N 3.33Å; D75-A78 PolarHBondContact O-N 3.23Å; D75-S79 VanDerWaalsContact O-CB 3.28Å; D75-S79 WeakPolarHBondContact O-CB 3.27Å; D75-S79 PolarHBondContact O-N 3.3Å; D75-S79 PolarHBondContact O-OG 3.07Å; D75-Y90 PolarHBondContact OD1-OH 2.98Å; D75-Q106 HydrophobicContact CB-CB 4.39Å; D75-Q106 HydrophobicContact CB-CG 4.19Å
76	A	88.9	Confident	86.4	Confident	41 Å²	41	64 Å²	64	34%	0.339	32%	0.315	S	S	.	.	H	α-helix	trans	-67.9	-37.3	177.4	0	0	0	0	0	112.7	T72 Q73 A74 R80	T72-A76 VanDerWaalsContact O-CB 3.22Å; T72-A76 WeakPolarHBondContact O-CB 3.5Å; T72-A76 PolarHBondContact O-N 3.3Å; Q73-A76 PolarHBondContact O-N 2.92Å; A74-A76 VanDerWaalsContact C-N 3.34Å; A74-A76 PolarHBondContact O-N 2.86Å; A76-R80 WeakPolarHBondContact O-CB 3.25Å; A76-R80 VanDerWaalsContact O-CG 3.26Å; A76-R80 WeakPolarHBondContact O-CG 3.48Å; A76-R80 PolarHBondContact O-N 3.21Å
77	L	90	Very high	86.9	Confident	18 Å²	18	59 Å²	59	9%	0.094	29%	0.292	C	S	.	.	H	α-helix	trans	-66.5	-44.1	173.9	-71.9	168	0	0	0	111.3	Q73 A74 R80 G81 R82 E85 A86 V89	Q73-L77 HydrophobicContact CG-CD1 4.06Å; Q73-L77 WeakPolarHBondContact O-CB 3.41Å; Q73-L77 VanDerWaalsContact O-CG 3.27Å; Q73-L77 WeakPolarHBondContact O-CG 3.26Å; Q73-L77 PolarHBondContact O-N 2.93Å; A74-L77 PolarHBondContact O-N 3.23Å; L77-R80 CarbonylContact O-C 3.59Å; L77-R80 PolarHBondContact O-N 2.93Å; L77-G81 PolarHBondContact O-N 3.4Å; L77-R82 HydrophobicContact CB-CB 4.46Å; L77-R82 HydrophobicContact CD2-CB 4.25Å; L77-R82 WeakPolarHBondContact O-CB 3.47Å; L77-R82 PolarHBondContact O-N 3.06Å; L77-E85 HydrophobicContact CD1-CB 4.04Å; L77-E85 HydrophobicContact CD2-CB 4.35Å; L77-A86 HydrophobicContact CB-CB 3.89Å; L77-V89 HydrophobicContact CD1-CG2 4.14Å
78	A	87.8	Confident	87.4	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60.4	-47.5	175.3	0	0	0	0	0	111.1	A74 D75 R80 G81 I83 A86 C110	A74-A78 WeakPolarHBondContact O-CB 3.34Å; A74-A78 PolarHBondContact O-N 2.9Å; D75-A78 PolarHBondContact O-N 3.23Å; A78-R80 VanDerWaalsContact C-N 3.27Å; A78-R80 PolarHBondContact O-N 3.42Å; A78-G81 WeakPolarHBondContact O-CA 3.47Å; A78-G81 PolarHBondContact O-N 3.17Å; A78-I83 HydrophobicContact CB-CD1 4.48Å; A78-A86 HydrophobicContact CB-CB 3.87Å; A78-C110 HydrophobicContact CB-CB 4.48Å
79	S	88.5	Confident	87.6	Confident	58 Å²	58	56.8 Å²	56.8	41%	0.406	28%	0.283	S	S	.	.	H	α-helix	trans	-60.9	-32.1	177.8	-55.2	0	0	0	0	113.3	D75 G81 Q106	D75-S79 VanDerWaalsContact O-CB 3.28Å; D75-S79 WeakPolarHBondContact O-CB 3.27Å; D75-S79 PolarHBondContact O-N 3.3Å; D75-S79 PolarHBondContact O-OG 3.07Å; S79-G81 PolarHBondContact O-N 3.14Å; S79-Q106 PolarHBondContact OG-NE2 3.09Å
80	R	88.3	Confident	87.7	Confident	197 Å²	197	52.4 Å²	52.4	74%	0.743	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	9.6	174.2	-69.7	173.4	-179.4	-172.8	1.3	113.1	A76 L77 A78 R82	A76-R80 WeakPolarHBondContact O-CB 3.25Å; A76-R80 VanDerWaalsContact O-CG 3.26Å; A76-R80 WeakPolarHBondContact O-CG 3.48Å; A76-R80 PolarHBondContact O-N 3.21Å; L77-R80 CarbonylContact O-C 3.59Å; L77-R80 PolarHBondContact O-N 2.93Å; A78-R80 VanDerWaalsContact C-N 3.27Å; A78-R80 PolarHBondContact O-N 3.42Å; R80-R82 HydrophobicContact CB-CG 4.45Å; R80-R82 PolarHBondContact O-N 3.35Å
81	G	81.5	Confident	87.7	Confident	32 Å²	32	55.5 Å²	55.5	33%	0.33	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	2.2	178.9	0	0	0	0	0	115.3	L77 A78 S79 I83 K114	L77-G81 PolarHBondContact O-N 3.4Å; A78-G81 WeakPolarHBondContact O-CA 3.47Å; A78-G81 PolarHBondContact O-N 3.17Å; S79-G81 PolarHBondContact O-N 3.14Å; G81-I83 PolarHBondContact O-N 3.23Å; G81-K114 PolarHBondContact O-NZ 3.41Å
82	R	86.5	Confident	87.6	Confident	120 Å²	120	57.3 Å²	57.3	45%	0.453	27%	0.274	S	S	.	.			trans	-79.9	53.4	-179.1	-60.4	177.5	74.6	176.4	8.5	111.1	L77 R80 R84 E85 A86	L77-R82 HydrophobicContact CB-CB 4.46Å; L77-R82 HydrophobicContact CD2-CB 4.25Å; L77-R82 WeakPolarHBondContact O-CB 3.47Å; L77-R82 PolarHBondContact O-N 3.06Å; R80-R82 HydrophobicContact CB-CG 4.45Å; R80-R82 PolarHBondContact O-N 3.35Å; R82-R84 VanDerWaalsContact C-N 3.3Å; R82-R84 PolarHBondContact O-N 3.33Å; R82-E85 VanDerWaalsContact CZ-CD 3.44Å; R82-E85 IonicContact CZ-OE1 3.67Å; R82-E85 IonicContact CZ-OE2 3.66Å; R82-E85 VanDerWaalsContact NE-CD 3.26Å; R82-E85 IonicContact NE-OE1 2.78Å; R82-E85 PolarHBondContact NE-OE1 3.07Å; R82-E85 IonicContact NE-OE2 3.63Å; R82-E85 PolarHBondContact NE-OE2 3.41Å; R82-E85 VanDerWaalsContact NE-OE2 3.13Å; R82-E85 IonicContact NH1-OE2 3.87Å; R82-E85 IonicContact NH2-OE1 3.75Å; R82-E85 PolarHBondContact NH2-OE1 2.9Å; R82-E85 IonicContact NH2-OE2 2.75Å; R82-E85 PolarHBondContact NH2-OE2 2.89Å; R82-E85 PolarHBondContact O-N 3.23Å; R82-E85 VanDerWaalsContact O-N 3.07Å; R82-A86 PolarHBondContact O-N 2.94Å; R82-A86 VanDerWaalsContact O-N 3.1Å
83	I	85.6	Confident	87.4	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-58.1	-37.5	-168.5	-50	-60.4	0	0	0	112.5	A78 G81 E85 A86 L87 L107 C110 L111 K114 L375	A78-I83 HydrophobicContact CB-CD1 4.48Å; G81-I83 PolarHBondContact O-N 3.23Å; I83-E85 VanDerWaalsContact C-N 3.28Å; I83-E85 PolarHBondContact O-N 3.1Å; I83-A86 PolarHBondContact O-N 3.21Å; I83-L87 HydrophobicContact CG2-CD1 3.95Å; I83-L87 HydrophobicContact CG2-CG 3.96Å; I83-L87 WeakPolarHBondContact O-CB 2.99Å; I83-L87 VanDerWaalsContact O-CG 3.26Å; I83-L87 WeakPolarHBondContact O-CG 3.4Å; I83-L87 PolarHBondContact O-N 2.95Å; I83-L107 HydrophobicContact CG2-CD1 4.28Å; I83-C110 HydrophobicContact CD1-CB 4.02Å; I83-L111 HydrophobicContact CG2-CD2 3.87Å; I83-K114 HydrophobicContact CG1-CD 4.18Å; I83-L375 HydrophobicContact CB-CD2 3.98Å; I83-L375 HydrophobicContact CG2-CD2 3.68Å
84	R	84.8	Confident	87.2	Confident	171 Å²	171	49.2 Å²	49.2	65%	0.645	23%	0.231	S	C	*	.	H	α-helix	trans	-52.6	-46.1	175.9	-78.9	-175.7	177.5	-92.1	-15.1	112.3	R82 E88 D373 L375	R82-R84 VanDerWaalsContact C-N 3.3Å; R82-R84 PolarHBondContact O-N 3.33Å; R84-E88 PolarHBondContact O-N 3.4Å; R84-D373 IonicContact NH2-OD2 3.96Å; R84-L375 HydrophobicContact CB-CD1 4.34Å; R84-L375 HydrophobicContact CG-CD1 3.18Å
85	E	86.3	Confident	86.9	Confident	79 Å²	79	53.9 Å²	53.9	37%	0.369	25%	0.253	S	S	.	.	H	α-helix	trans	-78.1	-34.5	-177.7	-59.4	169.6	-130.6	0	0	111.7	L77 R82 I83 E88 V89	L77-E85 HydrophobicContact CD1-CB 4.04Å; L77-E85 HydrophobicContact CD2-CB 4.35Å; R82-E85 VanDerWaalsContact CZ-CD 3.44Å; R82-E85 IonicContact CZ-OE1 3.67Å; R82-E85 IonicContact CZ-OE2 3.66Å; R82-E85 VanDerWaalsContact NE-CD 3.26Å; R82-E85 IonicContact NE-OE1 2.78Å; R82-E85 PolarHBondContact NE-OE1 3.07Å; R82-E85 IonicContact NE-OE2 3.63Å; R82-E85 PolarHBondContact NE-OE2 3.41Å; R82-E85 VanDerWaalsContact NE-OE2 3.13Å; R82-E85 IonicContact NH1-OE2 3.87Å; R82-E85 IonicContact NH2-OE1 3.75Å; R82-E85 PolarHBondContact NH2-OE1 2.9Å; R82-E85 IonicContact NH2-OE2 2.75Å; R82-E85 PolarHBondContact NH2-OE2 2.89Å; R82-E85 PolarHBondContact O-N 3.23Å; R82-E85 VanDerWaalsContact O-N 3.07Å; I83-E85 VanDerWaalsContact C-N 3.28Å; I83-E85 PolarHBondContact O-N 3.1Å; E85-E88 PolarHBondContact O-N 3.3Å; E85-V89 WeakPolarHBondContact O-CG2 3.5Å; E85-V89 PolarHBondContact O-N 3.41Å; E85-V89 VanDerWaalsContact O-N 3.14Å
86	A	87.4	Confident	86.6	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.6	-48.1	174.2	0	0	0	0	0	111.5	L77 A78 R82 I83 E88 V89 Y90	L77-A86 HydrophobicContact CB-CB 3.89Å; A78-A86 HydrophobicContact CB-CB 3.87Å; R82-A86 PolarHBondContact O-N 2.94Å; R82-A86 VanDerWaalsContact O-N 3.1Å; I83-A86 PolarHBondContact O-N 3.21Å; A86-E88 VanDerWaalsContact C-N 3.26Å; A86-E88 PolarHBondContact O-N 3.36Å; A86-V89 PolarHBondContact O-N 3.23Å; A86-V89 VanDerWaalsContact O-N 3.17Å; A86-Y90 HydrophobicContact CB-CD2 4.41Å; A86-Y90 HydrophobicContact CB-CE2 4.08Å; A86-Y90 WeakPolarHBondContact O-CD2 3.43Å; A86-Y90 PolarHBondContact O-N 3.24Å
87	L	87.2	Confident	86.2	Confident	20 Å²	20	63.7 Å²	63.7	11%	0.105	29%	0.285	C	S	.	.	H	α-helix	trans	-56	-40.9	176.6	-70.5	173.4	0	0	0	111.9	I83 Y90 R91 L107 F359 I374 L375	I83-L87 HydrophobicContact CG2-CD1 3.95Å; I83-L87 HydrophobicContact CG2-CG 3.96Å; I83-L87 WeakPolarHBondContact O-CB 2.99Å; I83-L87 VanDerWaalsContact O-CG 3.26Å; I83-L87 WeakPolarHBondContact O-CG 3.4Å; I83-L87 PolarHBondContact O-N 2.95Å; L87-Y90 PolarHBondContact O-N 3.17Å; L87-R91 WeakPolarHBondContact O-CB 3.26Å; L87-R91 PolarHBondContact O-N 3.44Å; L87-L107 HydrophobicContact CD2-CD1 4Å; L87-L107 HydrophobicContact CD2-CD2 3.83Å; L87-F359 HydrophobicContact CD2-CE1 4.02Å; L87-F359 HydrophobicContact CD2-CZ 3.69Å; L87-I374 HydrophobicContact CD1-CB 4.06Å; L87-I374 HydrophobicContact CD1-CG2 4.21Å; L87-I374 HydrophobicContact CD2-CD1 3.99Å; L87-I374 HydrophobicContact CD2-CG2 4.31Å; L87-L375 HydrophobicContact CD1-CD2 4.27Å; L87-L375 HydrophobicContact CD1-CG 4.18Å
88	E	86.3	Confident	85.8	Confident	68 Å²	68	65.2 Å²	65.2	32%	0.318	29%	0.292	S	S	.	.	H	α-helix	trans	-65.5	-41.6	177.5	175.7	54.8	-160.2	0	0	112.5	R84 E85 A86 R91 Q92	R84-E88 PolarHBondContact O-N 3.4Å; E85-E88 PolarHBondContact O-N 3.3Å; A86-E88 VanDerWaalsContact C-N 3.26Å; A86-E88 PolarHBondContact O-N 3.36Å; E88-R91 WeakPolarHBondContact O-CB 3.45Å; E88-R91 PolarHBondContact O-N 2.91Å; E88-R91 IonicContact OE1-CZ 2.63Å; E88-R91 IonicContact OE1-NE 2.7Å; E88-R91 IonicContact OE1-NH2 2.84Å; E88-R91 PolarHBondContact OE1-NH2 3.08Å; E88-R91 IonicContact OE2-CZ 2.64Å; E88-R91 VanDerWaalsContact OE2-CZ 3.29Å; E88-R91 IonicContact OE2-NE 3.94Å; E88-R91 PolarHBondContact OE2-NE 2.92Å; E88-R91 IonicContact OE2-NH2 3.57Å; E88-R91 PolarHBondContact OE2-NH2 3Å; E88-Q92 WeakPolarHBondContact O-CG 3.48Å; E88-Q92 PolarHBondContact O-N 3.07Å; E88-Q92 PolarHBondContact OE1-NE2 2.89Å
89	V	88.1	Confident	85.7	Confident	12 Å²	12	65.9 Å²	65.9	7%	0.073	30%	0.295	C	S	.	.	H	α-helix	trans	-70.4	-36.2	175.7	-177.2	0	0	0	0	111.7	L70 A74 L77 E85 A86 Q92 L93	L70-V89 HydrophobicContact CB-CG1 4.22Å; L70-V89 HydrophobicContact CD2-CG1 4.26Å; L70-V89 WeakPolarHBondContact O-CG1 3.46Å; A74-V89 HydrophobicContact CB-CB 3.94Å; A74-V89 HydrophobicContact CB-CG1 3.85Å; L77-V89 HydrophobicContact CD1-CG2 4.14Å; E85-V89 WeakPolarHBondContact O-CG2 3.5Å; E85-V89 PolarHBondContact O-N 3.41Å; E85-V89 VanDerWaalsContact O-N 3.14Å; A86-V89 PolarHBondContact O-N 3.23Å; A86-V89 VanDerWaalsContact O-N 3.17Å; V89-Q92 PolarHBondContact O-N 3.3Å; V89-L93 HydrophobicContact CG1-CD1 4.49Å; V89-L93 WeakPolarHBondContact O-CG 3.42Å; V89-L93 PolarHBondContact O-N 2.89Å
90	Y	88.6	Confident	85.7	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.6	-38.7	171.7	-67.3	-63.6	0	0	0	111.9	L71 A74 D75 A86 L87 L93 S94 L99 L104 L107	L71-Y90 HydrophobicContact CD1-CD1 4.36Å; L71-Y90 HydrophobicContact CD1-CE1 3.78Å; A74-Y90 HydrophobicContact CB-CD1 3.8Å; A74-Y90 HydrophobicContact CB-CD2 4.11Å; A74-Y90 HydrophobicContact CB-CE1 3.57Å; A74-Y90 HydrophobicContact CB-CE2 3.87Å; A74-Y90 HydrophobicContact CB-CG 4.07Å; D75-Y90 PolarHBondContact OD1-OH 2.98Å; A86-Y90 HydrophobicContact CB-CD2 4.41Å; A86-Y90 HydrophobicContact CB-CE2 4.08Å; A86-Y90 WeakPolarHBondContact O-CD2 3.43Å; A86-Y90 PolarHBondContact O-N 3.24Å; L87-Y90 PolarHBondContact O-N 3.17Å; Y90-L93 WeakPolarHBondContact O-CB 3.08Å; Y90-L93 PolarHBondContact O-N 3.05Å; Y90-S94 PolarHBondContact O-N 2.87Å; Y90-L99 HydrophobicContact CD1-CD1 4Å; Y90-L104 HydrophobicContact CD1-CD2 3.48Å; Y90-L104 VanDerWaalsContact CD1-CD2 3.48Å; Y90-L104 HydrophobicContact CD2-CD2 4.27Å; Y90-L104 HydrophobicContact CE1-CD2 3.74Å; Y90-L104 HydrophobicContact CG-CD2 3.78Å; Y90-L107 HydrophobicContact CD2-CB 4.44Å; Y90-L107 HydrophobicContact CD2-CD1 4.38Å; Y90-L107 HydrophobicContact CD2-CD2 3.83Å; Y90-L107 HydrophobicContact CD2-CG 4.43Å; Y90-L107 HydrophobicContact CE2-CB 3.7Å; Y90-L107 HydrophobicContact CE2-CD1 3.98Å; Y90-L107 HydrophobicContact CE2-CD2 3.95Å; Y90-L107 HydrophobicContact CE2-CG 4.06Å
91	R	86.4	Confident	85.6	Confident	98 Å²	98	58.3 Å²	58.3	37%	0.37	27%	0.271	S	S	.	.	H	α-helix	trans	-58	-49.5	173	-175.9	-180	70.1	93.7	-4.2	111.3	L87 E88 L93 S94 E95 F359	L87-R91 WeakPolarHBondContact O-CB 3.26Å; L87-R91 PolarHBondContact O-N 3.44Å; E88-R91 WeakPolarHBondContact O-CB 3.45Å; E88-R91 PolarHBondContact O-N 2.91Å; E88-R91 IonicContact OE1-CZ 2.63Å; E88-R91 IonicContact OE1-NE 2.7Å; E88-R91 IonicContact OE1-NH2 2.84Å; E88-R91 PolarHBondContact OE1-NH2 3.08Å; E88-R91 IonicContact OE2-CZ 2.64Å; E88-R91 VanDerWaalsContact OE2-CZ 3.29Å; E88-R91 IonicContact OE2-NE 3.94Å; E88-R91 PolarHBondContact OE2-NE 2.92Å; E88-R91 IonicContact OE2-NH2 3.57Å; E88-R91 PolarHBondContact OE2-NH2 3Å; R91-L93 VanDerWaalsContact C-N 3.27Å; R91-L93 PolarHBondContact O-N 3.42Å; R91-S94 WeakPolarHBondContact O-CB 3.47Å; R91-S94 PolarHBondContact O-N 3.08Å; R91-E95 HydrophobicContact CG-CG 4.49Å; R91-E95 WeakPolarHBondContact CG-OE1 3.5Å; R91-E95 IonicContact CZ-OE1 2.72Å; R91-E95 IonicContact NE-OE1 2.64Å; R91-E95 IonicContact NH1-OE1 2.75Å; R91-E95 PolarHBondContact NH1-OE1 2.99Å; R91-E95 IonicContact NH1-OE2 2.64Å; R91-E95 WeakPolarHBondContact O-CG 3.19Å; R91-E95 PolarHBondContact O-N 2.73Å; R91-F359 HydrophobicContact CB-CD1 4.18Å
92	Q	86.1	Confident	85.8	Confident	63 Å²	63	64.2 Å²	64.2	29%	0.294	29%	0.29	S	S	.	.	H	α-helix	trans	-62	-30.1	177.6	-67.8	172.5	20	0	0	113.5	E88 V89 R96	E88-Q92 WeakPolarHBondContact O-CG 3.48Å; E88-Q92 PolarHBondContact O-N 3.07Å; E88-Q92 PolarHBondContact OE1-NE2 2.89Å; V89-Q92 PolarHBondContact O-N 3.3Å; Q92-R96 WeakPolarHBondContact O-CD 3.22Å; Q92-R96 VanDerWaalsContact O-CG 3.25Å; Q92-R96 WeakPolarHBondContact O-CG 3.31Å
93	L	85.9	Confident	86	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-73	-36.2	172.1	-76.2	164.9	0	0	0	112.5	L70 L71 V89 Y90 R91 R96 Q98 L99	L70-L93 HydrophobicContact CB-CD1 4.32Å; L70-L93 HydrophobicContact CB-CD2 3.88Å; L70-L93 HydrophobicContact CB-CG 4.21Å; L70-L93 HydrophobicContact CD1-CD2 4.4Å; L71-L93 HydrophobicContact CB-CD1 4.08Å; L71-L93 HydrophobicContact CD1-CD1 4.39Å; V89-L93 HydrophobicContact CG1-CD1 4.49Å; V89-L93 WeakPolarHBondContact O-CG 3.42Å; V89-L93 PolarHBondContact O-N 2.89Å; Y90-L93 WeakPolarHBondContact O-CB 3.08Å; Y90-L93 PolarHBondContact O-N 3.05Å; R91-L93 VanDerWaalsContact C-N 3.27Å; R91-L93 PolarHBondContact O-N 3.42Å; L93-R96 PolarHBondContact O-N 2.61Å; L93-Q98 HydrophobicContact CD2-CB 4.43Å; L93-Q98 WeakPolarHBondContact O-CA 3.48Å; L93-Q98 PolarHBondContact O-N 3.46Å; L93-L99 HydrophobicContact CB-CB 4.09Å; L93-L99 HydrophobicContact CB-CD1 4.41Å; L93-L99 PolarHBondContact O-N 2.6Å
94	S	85.9	Confident	86.2	Confident	10 Å²	10	61 Å²	61	7%	0.07	28%	0.28	C	S	.	.	H	α-helix	trans	-70.7	-43	178.4	-167.5	0	0	0	0	112.5	Y90 R91 R96 Q97 F359	Y90-S94 PolarHBondContact O-N 2.87Å; R91-S94 WeakPolarHBondContact O-CB 3.47Å; R91-S94 PolarHBondContact O-N 3.08Å; S94-R96 PolarHBondContact O-N 3.33Å; S94-Q97 WeakPolarHBondContact O-CA 3.26Å; S94-Q97 PolarHBondContact O-N 3.44Å; S94-F359 VanDerWaalsContact CB-CB 3.43Å; S94-F359 VanDerWaalsContact CB-O 3.22Å; S94-F359 WeakPolarHBondContact CB-O 3.47Å; S94-F359 WeakPolarHBondContact OG-CB 3.29Å; S94-F359 PolarHBondContact OG-O 3.06Å
95	E	83.8	Confident	86.4	Confident	98 Å²	98	57.2 Å²	57.2	46%	0.458	27%	0.27	S	S	.	.	H	α-helix	trans	-59.3	-29.6	175.3	-72.7	168.7	177.1	0	0	112.5	R91 Q97	R91-E95 HydrophobicContact CG-CG 4.49Å; R91-E95 WeakPolarHBondContact CG-OE1 3.5Å; R91-E95 IonicContact CZ-OE1 2.72Å; R91-E95 IonicContact NE-OE1 2.64Å; R91-E95 IonicContact NH1-OE1 2.75Å; R91-E95 PolarHBondContact NH1-OE1 2.99Å; R91-E95 IonicContact NH1-OE2 2.64Å; R91-E95 WeakPolarHBondContact O-CG 3.19Å; R91-E95 PolarHBondContact O-N 2.73Å; E95-Q97 VanDerWaalsContact C-N 3.29Å
96	R	84.5	Confident	86.5	Confident	124 Å²	124	56.1 Å²	56.1	47%	0.468	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	2.6	173.9	-65.3	172	-173.8	-143.7	0.3	113.9	Q92 L93 S94 Q98	Q92-R96 WeakPolarHBondContact O-CD 3.22Å; Q92-R96 VanDerWaalsContact O-CG 3.25Å; Q92-R96 WeakPolarHBondContact O-CG 3.31Å; L93-R96 PolarHBondContact O-N 2.61Å; S94-R96 PolarHBondContact O-N 3.33Å; R96-Q98 HydrophobicContact CB-CB 4.25Å; R96-Q98 HydrophobicContact CB-CG 4.11Å; R96-Q98 WeakPolarHBondContact O-CG 3.28Å; R96-Q98 PolarHBondContact O-N 3.44Å
97	Q	80.1	Confident	86.6	Confident	163 Å²	163	56.1 Å²	56.1	76%	0.762	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	29.7	-170.9	-54.5	-176.6	6.8	0	0	113.6	S94 E95	S94-Q97 WeakPolarHBondContact O-CA 3.26Å; S94-Q97 PolarHBondContact O-N 3.44Å; E95-Q97 VanDerWaalsContact C-N 3.29Å
98	Q	83.3	Confident	86.7	Confident	51 Å²	51	55.2 Å²	55.2	24%	0.238	26%	0.26	C	S	.	.			trans	-106.7	3.2	-175.3	-76.5	166.6	7.5	0	0	113.5	L93 R96	L93-Q98 HydrophobicContact CD2-CB 4.43Å; L93-Q98 WeakPolarHBondContact O-CA 3.48Å; L93-Q98 PolarHBondContact O-N 3.46Å; R96-Q98 HydrophobicContact CB-CB 4.25Å; R96-Q98 HydrophobicContact CB-CG 4.11Å; R96-Q98 WeakPolarHBondContact O-CG 3.28Å; R96-Q98 PolarHBondContact O-N 3.44Å
99	L	85.8	Confident	86.8	Confident	13 Å²	13	56.3 Å²	56.3	7%	0.068	26%	0.261	C	S	.	.			trans	-105.3	130.9	178.5	-172.2	69.1	0	0	0	111.2	Y90 L93 Q103 L104 L356 F359	Y90-L99 HydrophobicContact CD1-CD1 4Å; L93-L99 HydrophobicContact CB-CB 4.09Å; L93-L99 HydrophobicContact CB-CD1 4.41Å; L93-L99 PolarHBondContact O-N 2.6Å; L99-Q103 HydrophobicContact CD1-CB 4.25Å; L99-L104 HydrophobicContact CD1-CD2 4.03Å; L99-L104 HydrophobicContact CD1-CG 4.33Å; L99-L104 HydrophobicContact CD2-CD1 4.28Å; L99-L104 HydrophobicContact CD2-CD2 4.13Å; L99-L104 HydrophobicContact CD2-CG 4.43Å; L99-L356 HydrophobicContact CB-CD1 4.2Å; L99-L356 HydrophobicContact CD2-CD1 3.74Å; L99-L356 HydrophobicContact CG-CD1 3.87Å; L99-F359 HydrophobicContact CD2-CB 4.48Å; L99-F359 HydrophobicContact CD2-CD2 3.79Å; L99-F359 HydrophobicContact CD2-CE2 4.46Å; L99-F359 HydrophobicContact CD2-CG 4.46Å
100	V	86.5	Confident	86.7	Confident	73 Å²	73	56 Å²	56	44%	0.442	26%	0.26	S	S	.	.			trans	-118.7	152.5	167.7	-61.5	0	0	0	0	110.9	E102 Q103	V100-E102 PolarHBondContact O-N 2.91Å; V100-E102 VanDerWaalsContact O-N 3.08Å; V100-Q103 HydrophobicContact CG2-CG 3.78Å; V100-Q103 WeakPolarHBondContact O-CB 3.41Å; V100-Q103 PolarHBondContact O-N 3.41Å
101	A	86.6	Confident	86.7	Confident	24 Å²	24	56 Å²	56	20%	0.198	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-53.6	-37.8	-172.5	0	0	0	0	0	113	Q103 L104 Q352 L356	A101-Q103 PolarHBondContact O-N 3.21Å; A101-L104 WeakPolarHBondContact O-CB 3.45Å; A101-L104 PolarHBondContact O-N 3.06Å; A101-Q352 HydrophobicContact CB-CB 4.1Å; A101-Q352 VanDerWaalsContact O-CB 3.26Å; A101-Q352 WeakPolarHBondContact O-CB 3.48Å; A101-Q352 VanDerWaalsContact O-CG 3.25Å; A101-Q352 WeakPolarHBondContact O-CG 3.19Å; A101-Q352 PolarHBondContact O-NE2 2.8Å; A101-L356 HydrophobicContact CB-CB 4.44Å; A101-L356 HydrophobicContact CB-CD2 4.09Å
102	E	86.9	Confident	86.7	Confident	155 Å²	155	51.6 Å²	51.6	72%	0.724	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-59.3	-32.9	-179.9	-61.9	173.6	144.4	0	0	112.9	V100 L104 E105 Q352	V100-E102 PolarHBondContact O-N 2.91Å; V100-E102 VanDerWaalsContact O-N 3.08Å; E102-L104 PolarHBondContact O-N 3.35Å; E102-E105 PolarHBondContact O-N 3.3Å; E102-Q352 PolarHBondContact O-NE2 3.27Å
103	Q	90	Very high	86.7	Confident	58 Å²	58	54.5 Å²	54.5	27%	0.271	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-70.1	-15.1	177.6	-64.7	167	-26.9	0	0	112.9	L71 L99 V100 A101 E105	L71-Q103 HydrophobicContact CD1-CB 3.96Å; L71-Q103 HydrophobicContact CD2-CB 3.92Å; L71-Q103 HydrophobicContact CD2-CG 3.7Å; L99-Q103 HydrophobicContact CD1-CB 4.25Å; V100-Q103 HydrophobicContact CG2-CG 3.78Å; V100-Q103 WeakPolarHBondContact O-CB 3.41Å; V100-Q103 PolarHBondContact O-N 3.41Å; A101-Q103 PolarHBondContact O-N 3.21Å; Q103-E105 VanDerWaalsContact C-N 3.27Å; Q103-E105 PolarHBondContact O-N 3.08Å
104	L	89.3	Confident	86.5	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-85.2	11.7	177.2	-61.2	173.7	0	0	0	113.3	Y90 L99 A101 E102 Q106 L107 V108 Q352 L355 L356 F359	Y90-L104 HydrophobicContact CD1-CD2 3.48Å; Y90-L104 VanDerWaalsContact CD1-CD2 3.48Å; Y90-L104 HydrophobicContact CD2-CD2 4.27Å; Y90-L104 HydrophobicContact CE1-CD2 3.74Å; Y90-L104 HydrophobicContact CG-CD2 3.78Å; L99-L104 HydrophobicContact CD1-CD2 4.03Å; L99-L104 HydrophobicContact CD1-CG 4.33Å; L99-L104 HydrophobicContact CD2-CD1 4.28Å; L99-L104 HydrophobicContact CD2-CD2 4.13Å; L99-L104 HydrophobicContact CD2-CG 4.43Å; A101-L104 WeakPolarHBondContact O-CB 3.45Å; A101-L104 PolarHBondContact O-N 3.06Å; E102-L104 PolarHBondContact O-N 3.35Å; L104-Q106 VanDerWaalsContact C-N 3.31Å; L104-Q106 PolarHBondContact O-N 3.31Å; L104-L107 HydrophobicContact CD2-CB 4.44Å; L104-L107 HydrophobicContact CD2-CD2 3.99Å; L104-L107 PolarHBondContact O-N 3.38Å; L104-V108 WeakPolarHBondContact O-CG2 3.07Å; L104-V108 PolarHBondContact O-N 2.94Å; L104-Q352 HydrophobicContact CB-CG 4.18Å; L104-L355 HydrophobicContact CD1-CB 3.85Å; L104-L356 HydrophobicContact CD1-CB 4.18Å; L104-F359 HydrophobicContact CD1-CD2 4.17Å; L104-F359 HydrophobicContact CD1-CE2 3.98Å; L104-F359 HydrophobicContact CD2-CE2 3.95Å
105	E	88.6	Confident	86.3	Confident	90 Å²	90	59.8 Å²	59.8	42%	0.421	28%	0.281	S	S	.	.	H	α-helix	trans	-59.5	-41	179.8	-169.8	166.8	-153.4	0	0	111.7	E102 Q103 V108 R109 R348 Q352	E102-E105 PolarHBondContact O-N 3.3Å; Q103-E105 VanDerWaalsContact C-N 3.27Å; Q103-E105 PolarHBondContact O-N 3.08Å; E105-V108 PolarHBondContact O-N 3.48Å; E105-R109 WeakPolarHBondContact O-CB 3.36Å; E105-R109 PolarHBondContact O-N 3.27Å; E105-R348 IonicContact OE1-CZ 2.89Å; E105-R348 IonicContact OE1-NH1 2.7Å; E105-R348 PolarHBondContact OE1-NH1 2.82Å; E105-R348 IonicContact OE1-NH2 2.84Å; E105-R348 PolarHBondContact OE1-NH2 3.03Å; E105-Q352 VanDerWaalsContact N-NE2 3.18Å
106	Q	89	Confident	85.6	Confident	57 Å²	57	58.5 Å²	58.5	27%	0.266	28%	0.281	S	S	.	.	H	α-helix	trans	-70.6	-39.2	-180	-167.9	71.4	-32.2	0	0	112.2	D75 S79 L104 R109 C110	D75-Q106 HydrophobicContact CB-CB 4.39Å; D75-Q106 HydrophobicContact CB-CG 4.19Å; S79-Q106 PolarHBondContact OG-NE2 3.09Å; L104-Q106 VanDerWaalsContact C-N 3.31Å; L104-Q106 PolarHBondContact O-N 3.31Å; Q106-R109 VanDerWaalsContact CD-NH2 3.27Å; Q106-R109 PolarHBondContact O-N 2.9Å; Q106-C110 PolarHBondContact O-N 2.92Å
107	L	89.1	Confident	84.6	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-49.4	172.5	-179.4	64.3	0	0	0	111	I83 L87 Y90 L104 R109 C110 L111 L355 F359	I83-L107 HydrophobicContact CG2-CD1 4.28Å; L87-L107 HydrophobicContact CD2-CD1 4Å; L87-L107 HydrophobicContact CD2-CD2 3.83Å; Y90-L107 HydrophobicContact CD2-CB 4.44Å; Y90-L107 HydrophobicContact CD2-CD1 4.38Å; Y90-L107 HydrophobicContact CD2-CD2 3.83Å; Y90-L107 HydrophobicContact CD2-CG 4.43Å; Y90-L107 HydrophobicContact CE2-CB 3.7Å; Y90-L107 HydrophobicContact CE2-CD1 3.98Å; Y90-L107 HydrophobicContact CE2-CD2 3.95Å; Y90-L107 HydrophobicContact CE2-CG 4.06Å; L104-L107 HydrophobicContact CD2-CB 4.44Å; L104-L107 HydrophobicContact CD2-CD2 3.99Å; L104-L107 PolarHBondContact O-N 3.38Å; L107-R109 VanDerWaalsContact C-N 3.29Å; L107-R109 PolarHBondContact O-N 3.24Å; L107-C110 PolarHBondContact O-N 2.99Å; L107-L111 HydrophobicContact CD1-CD1 3.98Å; L107-L111 HydrophobicContact CD1-CD2 4.45Å; L107-L111 HydrophobicContact CD1-CG 3.96Å; L107-L111 HydrophobicContact CD2-CD1 4.28Å; L107-L111 HydrophobicContact CG-CD1 3.72Å; L107-L111 HydrophobicContact CG-CG 4.15Å; L107-L111 WeakPolarHBondContact O-CB 3.22Å; L107-L111 VanDerWaalsContact O-CG 3.24Å; L107-L111 WeakPolarHBondContact O-CG 3.45Å; L107-L111 PolarHBondContact O-N 2.98Å; L107-L355 HydrophobicContact CD2-CD1 4.15Å; L107-L355 HydrophobicContact CD2-CD2 4.31Å; L107-L355 HydrophobicContact CG-CD1 4.45Å; L107-F359 HydrophobicContact CD2-CE2 4.07Å; L107-F359 HydrophobicContact CD2-CZ 3.91Å
108	V	89.4	Confident	83.2	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-57.9	-41.4	177.5	164.7	0	0	0	0	111.6	L104 E105 A112 L335 V338 R348 A351 Q352 L355	L104-V108 WeakPolarHBondContact O-CG2 3.07Å; L104-V108 PolarHBondContact O-N 2.94Å; E105-V108 PolarHBondContact O-N 3.48Å; V108-A112 VanDerWaalsContact O-CB 3.26Å; V108-A112 WeakPolarHBondContact O-CB 3.48Å; V108-A112 PolarHBondContact O-N 3.08Å; V108-L335 HydrophobicContact CG1-CD2 4.21Å; V108-V338 HydrophobicContact CG1-CG1 4.29Å; V108-V338 HydrophobicContact CG1-CG2 4.48Å; V108-R348 HydrophobicContact CG1-CB 4.37Å; V108-R348 HydrophobicContact CG1-CG 4.24Å; V108-A351 HydrophobicContact CG1-CB 4.05Å; V108-A351 HydrophobicContact CG2-CB 3.86Å; V108-Q352 HydrophobicContact CG2-CG 3.85Å; V108-L355 HydrophobicContact CG2-CD1 3.45Å; V108-L355 VanDerWaalsContact CG2-CD1 3.45Å
109	R	88.3	Confident	80.9	Confident	91 Å²	91	58.7 Å²	58.7	34%	0.343	30%	0.3	S	S	.	.	H	α-helix	trans	-60.5	-53.4	175.1	-173.3	-175.1	65.7	74.9	4.1	111.4	E105 Q106 L107 L111 A112 E113	E105-R109 WeakPolarHBondContact O-CB 3.36Å; E105-R109 PolarHBondContact O-N 3.27Å; Q106-R109 VanDerWaalsContact CD-NH2 3.27Å; Q106-R109 PolarHBondContact O-N 2.9Å; L107-R109 VanDerWaalsContact C-N 3.29Å; L107-R109 PolarHBondContact O-N 3.24Å; R109-L111 VanDerWaalsContact C-N 3.32Å; R109-L111 PolarHBondContact O-N 2.82Å; R109-A112 PolarHBondContact O-N 3.33Å; R109-E113 VanDerWaalsContact CG-OE1 3.31Å; R109-E113 WeakPolarHBondContact CG-OE1 3.43Å; R109-E113 IonicContact CZ-OE1 3.12Å; R109-E113 IonicContact CZ-OE2 2.73Å; R109-E113 IonicContact NH1-OE1 3.12Å; R109-E113 PolarHBondContact NH1-OE1 3.23Å; R109-E113 IonicContact NH1-OE2 3.29Å; R109-E113 PolarHBondContact NH1-OE2 3Å; R109-E113 WeakPolarHBondContact O-CB 3.36Å; R109-E113 VanDerWaalsContact O-CG 3.32Å; R109-E113 WeakPolarHBondContact O-CG 3.46Å; R109-E113 PolarHBondContact O-N 3.37Å
110	C	87.8	Confident	78.4	Confident	7 Å²	7	64.4 Å²	64.4	5%	0.047	34%	0.335	C	S	.	.	H	α-helix	trans	-71.4	-21.8	-177.8	-69.4	0	0	0	0	114.3	A78 I83 Q106 L107 K114	A78-C110 HydrophobicContact CB-CB 4.48Å; I83-C110 HydrophobicContact CD1-CB 4.02Å; Q106-C110 PolarHBondContact O-N 2.92Å; L107-C110 PolarHBondContact O-N 2.99Å; C110-K114 WeakPolarHBondContact O-CG 3.39Å
111	L	87.3	Confident	75.6	Confident	0 Å²	0	69 Å²	69	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-74.2	-47.7	168.6	-72	173.2	0	0	0	110.8	I83 L107 R109 E113 K114 V115 L335 L355 I374 L378	I83-L111 HydrophobicContact CG2-CD2 3.87Å; L107-L111 HydrophobicContact CD1-CD1 3.98Å; L107-L111 HydrophobicContact CD1-CD2 4.45Å; L107-L111 HydrophobicContact CD1-CG 3.96Å; L107-L111 HydrophobicContact CD2-CD1 4.28Å; L107-L111 HydrophobicContact CG-CD1 3.72Å; L107-L111 HydrophobicContact CG-CG 4.15Å; L107-L111 WeakPolarHBondContact O-CB 3.22Å; L107-L111 VanDerWaalsContact O-CG 3.24Å; L107-L111 WeakPolarHBondContact O-CG 3.45Å; L107-L111 PolarHBondContact O-N 2.98Å; R109-L111 VanDerWaalsContact C-N 3.32Å; R109-L111 PolarHBondContact O-N 2.82Å; L111-E113 VanDerWaalsContact C-N 3.32Å; L111-E113 PolarHBondContact O-N 2.96Å; L111-K114 PolarHBondContact O-N 3.34Å; L111-V115 PolarHBondContact O-N 3.49Å; L111-L335 HydrophobicContact CB-CD1 4.07Å; L111-L335 HydrophobicContact CB-CD2 3.76Å; L111-L335 HydrophobicContact CD1-CD1 4.27Å; L111-L335 HydrophobicContact CD1-CD2 4.37Å; L111-L355 HydrophobicContact CD1-CD1 3.77Å; L111-L355 HydrophobicContact CD1-CD2 3.97Å; L111-I374 HydrophobicContact CD1-CG2 4.48Å; L111-I374 HydrophobicContact CD2-CG2 4.32Å; L111-L378 HydrophobicContact CD2-CD1 3.76Å; L111-L378 HydrophobicContact CD2-CD2 4.32Å; L111-L378 HydrophobicContact CD2-CG 4.49Å
112	A	86.7	Confident	72.8	Confident	5 Å²	5	71.9 Å²	71.9	4%	0.041	38%	0.38	C	S	.	.	H	α-helix	trans	-61.1	-39	178.4	0	0	0	0	0	112.4	V108 R109 K114 V115 V338 S339	V108-A112 VanDerWaalsContact O-CB 3.26Å; V108-A112 WeakPolarHBondContact O-CB 3.48Å; V108-A112 PolarHBondContact O-N 3.08Å; R109-A112 PolarHBondContact O-N 3.33Å; A112-K114 PolarHBondContact O-N 2.82Å; A112-V115 PolarHBondContact O-N 2.81Å; A112-V338 HydrophobicContact CB-CB 4.02Å; A112-V338 HydrophobicContact CB-CG1 3.72Å; A112-S339 WeakPolarHBondContact O-CB 3.24Å
113	E	85.9	Confident	70.1	Confident	123 Å²	123	70.6 Å²	70.6	58%	0.575	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-17.8	173.6	-76.1	165.4	-178.5	0	0	113.9	R109 L111	R109-E113 VanDerWaalsContact CG-OE1 3.31Å; R109-E113 WeakPolarHBondContact CG-OE1 3.43Å; R109-E113 IonicContact CZ-OE1 3.12Å; R109-E113 IonicContact CZ-OE2 2.73Å; R109-E113 IonicContact NH1-OE1 3.12Å; R109-E113 PolarHBondContact NH1-OE1 3.23Å; R109-E113 IonicContact NH1-OE2 3.29Å; R109-E113 PolarHBondContact NH1-OE2 3Å; R109-E113 WeakPolarHBondContact O-CB 3.36Å; R109-E113 VanDerWaalsContact O-CG 3.32Å; R109-E113 WeakPolarHBondContact O-CG 3.46Å; R109-E113 PolarHBondContact O-N 3.37Å; L111-E113 VanDerWaalsContact C-N 3.32Å; L111-E113 PolarHBondContact O-N 2.96Å
114	K	82.1	Confident	67.1	Low	101 Å²	101	72.1 Å²	72.1	44%	0.439	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-2.9	176.8	-69.7	-170.2	-178.9	-162.7	0	114.3	G81 I83 C110 L111 A112 P116	G81-K114 PolarHBondContact O-NZ 3.41Å; I83-K114 HydrophobicContact CG1-CD 4.18Å; C110-K114 WeakPolarHBondContact O-CG 3.39Å; L111-K114 PolarHBondContact O-N 3.34Å; A112-K114 PolarHBondContact O-N 2.82Å; K114-P116 WeakPolarHBondContact O-CD 3.37Å
115	V	80.6	Confident	64.3	Low	22 Å²	22	77.7 Å²	77.7	13%	0.133	44%	0.444	C	S	.	.	S	Bend	trans	-78.6	121	176.8	-171	0	0	0	0	109.3	L111 A112 Q117 L335 Y336 L378	L111-V115 PolarHBondContact O-N 3.49Å; A112-V115 PolarHBondContact O-N 2.81Å; V115-Q117 PolarHBondContact O-N 3.46Å; V115-L335 HydrophobicContact CG2-CB 4.09Å; V115-Y336 HydrophobicContact CG1-CD2 3.68Å; V115-Y336 HydrophobicContact CG1-CG 4.44Å; V115-L378 HydrophobicContact CG2-CD2 4.08Å
116	P	69.1	Low	61.6	Low	72 Å²	72	79.6 Å²	79.6	47%	0.468	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-59	124.2	-179.1	-25.2	35.3	0	0	0	112.3	K114 P380	K114-P116 WeakPolarHBondContact O-CD 3.37Å; P116-P380 HydrophobicContact CG-CB 4.45Å
117	Q	64	Low	58.7	Low	106 Å²	106	80.5 Å²	80.5	50%	0.495	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-85.1	116.6	164.8	-61.2	-173.1	7.3	0	0	106.9	V115 E119 M309 S339	V115-Q117 PolarHBondContact O-N 3.46Å; Q117-E119 PolarHBondContact O-N 3.41Å; Q117-M309 HydrophobicContact CB-CE 4.37Å; Q117-S339 PolarHBondContact NE2-O 3.41Å; Q117-S339 VanDerWaalsContact NE2-O 3.13Å
118	G	51.4	Low	55.7	Low	46 Å²	46	90.2 Å²	90.2	47%	0.474	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-57.3	126.1	-173.1	0	0	0	0	0	112.2	M309	G118-M309 WeakPolarHBondContact O-CE 3.45Å
119	E	34.7	Very low	52.6	Low	190 Å²	190	93.8 Å²	93.8	89%	0.888	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-65.2	135.9	-176.9	-64.9	-174	140.9	0	0	111.6	Q117	Q117-E119 PolarHBondContact O-N 3.41Å
120	V	32.2	Very low	49.6	Very low	132 Å²	132	94.7 Å²	94.7	80%	0.8	59%	0.591	S	S	*	*			trans	-114.9	120	163.1	177.1	0	0	0	0	106	A122	V120-A122 PolarHBondContact O-N 2.92Å
121	L	29.6	Very low	46.6	Very low	169 Å²	169	100.4 Å²	100.4	89%	0.885	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-56.4	127.7	176.4	-81.3	136.4	0	0	0	110.1
122	A	27.3	Very low	43.6	Very low	86 Å²	86	104.9 Å²	104.9	71%	0.711	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-71.6	142.9	174.7	0	0	0	0	0	110.4	V120	V120-A122 PolarHBondContact O-N 2.92Å
123	P	29.1	Very low	40.7	Very low	127 Å²	127	111 Å²	111	83%	0.825	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-64.2	136.5	171.6	28	-33.9	0	0	0	110.1
124	A	28.2	Very low	37.8	Very low	90 Å²	90	108.7 Å²	108.7	74%	0.744	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-65.5	149.1	179	0	0	0	0	0	111.7
125	P	30.7	Very low	34.9	Very low	117 Å²	117	108.3 Å²	108.3	76%	0.76	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-67.6	149.5	175.4	29.6	-35.2	0	0	0	111.2	G127	P125-G127 PolarHBondContact O-N 2.72Å
126	P	30.3	Very low	32.2	Very low	130 Å²	130	114.1 Å²	114.1	84%	0.844	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-68.8	117.5	175.9	28.6	-33.5	0	0	0	110.4
127	G	28.3	Very low	30.1	Very low	77 Å²	77	115.5 Å²	115.5	79%	0.794	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-81.4	136.6	171.5	0	0	0	0	0	111.7	P125	P125-G127 PolarHBondContact O-N 2.72Å
128	E	26.4	Very low	28.2	Very low	204 Å²	204	114.9 Å²	114.9	95%	0.953	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-71.9	148.1	170.5	-60.5	179.3	137	0	0	110
129	G	25.1	Very low	26.8	Very low	75 Å²	75	121.7 Å²	121.7	77%	0.773	82%	0.816	S	S	*	*			trans	-108.4	169.2	-165.4	0	0	0	0	0	115.9
130	S	25.5	Very low	26.3	Very low	110 Å²	110	122.1 Å²	122.1	77%	0.769	82%	0.818	S	S	*	*			trans	-159.6	123.6	146.7	-126.1	0	0	0	0	114.5
131	T	23.4	Very low	26	Very low	126 Å²	126	124.5 Å²	124.5	77%	0.773	82%	0.824	S	S	*	*			trans	38.6	120	139	62.4	0	0	0	0	122.5
132	A	26	Very low	25.8	Very low	95 Å²	95	119.6 Å²	119.6	79%	0.785	81%	0.814	S	S	*	*				113.2	116.2	116.7	0	0	0	0	0	121.5
133	S	25.1	Very low	25.7	Very low	133 Å²	133	121.1 Å²	121.1	93%	0.93	83%	0.827	S	S	*	*			trans	77.3	125.2	134	-156.9	0	0	0	0	121.4
134	G	24.3	Very low	25.5	Very low	75 Å²	75	119.6 Å²	119.6	77%	0.773	83%	0.826	S	S	*	*			trans	150.8	114.3	162.3	0	0	0	0	0	114.1
135	A	22.1	Very low	25.3	Very low	93 Å²	93	120.4 Å²	120.4	77%	0.769	83%	0.832	S	S	*	*			trans	-80.5	171.7	166	0	0	0	0	0	109.9
136	V	23.8	Very low	25.1	Very low	143 Å²	143	120 Å²	120	87%	0.867	84%	0.838	S	S	*	*			cis	-160.6	180	38	-140.1	0	0	0	0	111.7
137	A	24.8	Very low	24.8	Very low	102 Å²	102	118.3 Å²	118.3	84%	0.843	84%	0.836	S	S	*	*			trans	83.5	162.1	164.6	0	0	0	0	0	117.3
138	A	23.1	Very low	24.7	Very low	93 Å²	93	119.3 Å²	119.3	77%	0.769	84%	0.836	S	S	*	*			trans	-146.1	179	-159.4	0	0	0	0	0	112.4
139	E	22.5	Very low	24.9	Very low	189 Å²	189	113.9 Å²	113.9	88%	0.883	83%	0.826	S	S	*	*			trans	68.4	99.1	175	-56.7	-165.6	143.8	0	0	117.3
140	E	24.5	Very low	25.1	Very low	199 Å²	199	116.4 Å²	116.4	93%	0.93	83%	0.827	S	S	*	*				-154.6	151.4	106.2	-114.5	-174.1	167.7	0	0	110.5
141	I	26.9	Very low	25.5	Very low	181 Å²	181	119.1 Å²	119.1	93%	0.928	83%	0.827	S	S	*	*			trans	-115.4	110.1	-176.3	-63.7	176.2	0	0	0	109.4
142	G	24.6	Very low	26.8	Very low	66 Å²	66	116 Å²	116	68%	0.68	81%	0.808	S	S	*	*			trans	-161	112.1	179.1	0	0	0	0	0	114.8	A144	G142-A144 PolarHBondContact O-N 3.42Å
143	A	25.9	Very low	28.8	Very low	119 Å²	119	113.6 Å²	113.6	98%	0.983	78%	0.779	S	S	*	*	S	Bend	trans	50.2	50.1	152.6	0	0	0	0	0	119.4
144	A	24.3	Very low	31	Very low	95 Å²	95	110.3 Å²	110.3	79%	0.785	75%	0.751	S	S	*	*			trans	-130.3	9.7	173.2	0	0	0	0	0	115.9	G142	G142-A144 PolarHBondContact O-N 3.42Å
145	A	24.4	Very low	33.5	Very low	106 Å²	106	107.1 Å²	107.1	88%	0.876	72%	0.718	S	S	*	*	S	Bend	trans	-108.7	10.4	-168.7	0	0	0	0	0	115.9
146	A	25.2	Very low	36.6	Very low	108 Å²	108	103.1 Å²	103.1	89%	0.893	68%	0.683	S	S	*	*	S	Bend	trans	-114.7	18	-172.8	0	0	0	0	0	114.6
147	A	25.1	Very low	39.6	Very low	96 Å²	96	99.8 Å²	99.8	79%	0.793	66%	0.657	S	S	*	*			trans	-113.7	0	-175.6	0	0	0	0	0	114.7	A149	A147-A149 VanDerWaalsContact C-N 3.31Å; A147-A149 PolarHBondContact O-N 3.16Å
148	A	26.3	Very low	42.7	Very low	97 Å²	97	95 Å²	95	80%	0.802	62%	0.617	S	S	*	*			trans	-87.4	69.4	171.3	0	0	0	0	0	110.2	T150	A148-T150 PolarHBondContact O-N 3.02Å
149	A	29.7	Very low	45.7	Very low	90 Å²	90	96.2 Å²	96.2	74%	0.744	60%	0.602	S	S	*	*			trans	-60.3	121.7	175.7	0	0	0	0	0	110	A147 E151	A147-A149 VanDerWaalsContact C-N 3.31Å; A147-A149 PolarHBondContact O-N 3.16Å; A149-E151 PolarHBondContact O-N 3.11Å
150	T	30.5	Very low	48.6	Very low	128 Å²	128	90.8 Å²	90.8	79%	0.785	58%	0.575	S	S	*	*			trans	-50.4	118.9	-172.1	-44	0	0	0	0	111.8	A148 V152	A148-T150 PolarHBondContact O-N 3.02Å; T150-V152 VanDerWaalsContact C-N 3.32Å; T150-V152 PolarHBondContact O-N 3.41Å
151	E	33.8	Very low	51.5	Low	167 Å²	167	82.6 Å²	82.6	78%	0.78	54%	0.539	S	S	*	.			trans	-67.5	85.6	-176.3	-77.4	-156.4	145.6	0	0	112.9	A149 W153 K581	A149-E151 PolarHBondContact O-N 3.11Å; E151-W153 PolarHBondContact O-N 3.46Å; E151-W153 VanDerWaalsContact O-N 3.15Å; E151-K581 PolarHBondContact O-NZ 3.19Å
152	V	50.8	Low	54.2	Low	62 Å²	62	77.4 Å²	77.4	38%	0.376	51%	0.511	S	S	.	.			trans	-50.2	115.5	168	168.3	0	0	0	0	109.4	T150 D154 L505	T150-V152 VanDerWaalsContact C-N 3.32Å; T150-V152 PolarHBondContact O-N 3.41Å; V152-D154 PolarHBondContact O-N 3.4Å; V152-L505 HydrophobicContact CG1-CB 3.69Å
153	W	66.8	Low	57.1	Low	43 Å²	43	74.4 Å²	74.4	16%	0.163	48%	0.48	C	S	.	.			trans	-72	113.7	-173.5	179	53.2	0	0	0	111.9	E151 G155 F156 I574 E577 L578 K581 F582	E151-W153 PolarHBondContact O-N 3.46Å; E151-W153 VanDerWaalsContact O-N 3.15Å; W153-G155 VanDerWaalsContact C-N 3.26Å; W153-G155 PolarHBondContact O-N 3.24Å; W153-F156 AromaticContact CE3-CD2 3.84Å; W153-F156 HydrophobicContact CE3-CD2 3.84Å; W153-F156 AromaticContact CE3-CE2 3.73Å; W153-F156 HydrophobicContact CE3-CE2 3.73Å; W153-F156 HydrophobicContact CE3-CZ 4.39Å; W153-F156 HydrophobicContact CH2-CE1 4.35Å; W153-F156 HydrophobicContact CH2-CE2 4.45Å; W153-F156 HydrophobicContact CH2-CZ 4.36Å; W153-F156 HydrophobicContact CZ3-CD1 4.16Å; W153-F156 AromaticContact CZ3-CD2 3.66Å; W153-F156 HydrophobicContact CZ3-CD2 3.66Å; W153-F156 AromaticContact CZ3-CE1 3.93Å; W153-F156 HydrophobicContact CZ3-CE1 3.93Å; W153-F156 AromaticContact CZ3-CE2 3.33Å; W153-F156 HydrophobicContact CZ3-CE2 3.33Å; W153-F156 HydrophobicContact CZ3-CG 4.09Å; W153-F156 AromaticContact CZ3-CZ 3.54Å; W153-F156 HydrophobicContact CZ3-CZ 3.54Å; W153-I574 HydrophobicContact CH2-CG2 4.05Å; W153-E577 HydrophobicContact CZ2-CB 3.72Å; W153-L578 HydrophobicContact CH2-CB 3.61Å; W153-L578 HydrophobicContact CH2-CD1 3.83Å; W153-L578 HydrophobicContact CH2-CG 3.69Å; W153-L578 HydrophobicContact CZ2-CB 4.32Å; W153-L578 HydrophobicContact CZ3-CB 4.16Å; W153-L578 HydrophobicContact CZ3-CD1 3.82Å; W153-L578 HydrophobicContact CZ3-CG 3.7Å; W153-K581 HydrophobicContact CB-CD 4.28Å; W153-K581 HydrophobicContact CG-CD 4Å; W153-F582 HydrophobicContact CB-CZ 4.15Å; W153-F582 AromaticContact CD2-CE2 3.87Å; W153-F582 HydrophobicContact CD2-CE2 3.87Å; W153-F582 HydrophobicContact CD2-CZ 4.07Å; W153-F582 AromaticContact CE3-CE2 3.51Å; W153-F582 HydrophobicContact CE3-CE2 3.51Å; W153-F582 AromaticContact CE3-CZ 3.93Å; W153-F582 HydrophobicContact CE3-CZ 3.93Å; W153-F582 HydrophobicContact CG-CE2 4.43Å; W153-F582 HydrophobicContact CG-CZ 4.17Å; W153-F582 AromaticContact CZ3-CE2 3.88Å; W153-F582 HydrophobicContact CZ3-CE2 3.88Å
154	D	71.2	Confident	60.1	Low	65 Å²	65	69.5 Å²	69.5	35%	0.348	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-76.4	-5.2	-173.9	-155.4	58.1	0	0	0	114.8	V152 F156 K157	V152-D154 PolarHBondContact O-N 3.4Å; D154-F156 PolarHBondContact O-N 2.91Å; D154-K157 PolarHBondContact O-N 3.07Å; D154-K157 WeakPolarHBondContact OD1-CD 3.36Å; D154-K157 WeakPolarHBondContact OD1-CE 3.47Å; D154-K157 WeakPolarHBondContact OD1-CG 3.33Å; D154-K157 IonicContact OD1-NZ 2.8Å; D154-K157 PolarHBondContact OD1-NZ 2.94Å
155	G	76.8	Confident	63.3	Low	7 Å²	7	65.1 Å²	65.1	7%	0.072	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-57.7	-26.8	-171.9	0	0	0	0	0	114.5	W153 K157 I574	W153-G155 VanDerWaalsContact C-N 3.26Å; W153-G155 PolarHBondContact O-N 3.24Å; G155-K157 VanDerWaalsContact C-N 3.35Å; G155-K157 PolarHBondContact O-N 3.3Å; G155-I574 WeakPolarHBondContact O-CD1 3.1Å
156	F	87.3	Confident	66.4	Low	10 Å²	10	60.6 Å²	60.6	4%	0.044	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-81.1	-1.6	175.1	-64.9	-53.8	0	0	0	115.4	W153 D154 F164 L165 L233 F237 I574 L578	W153-F156 AromaticContact CE3-CD2 3.84Å; W153-F156 HydrophobicContact CE3-CD2 3.84Å; W153-F156 AromaticContact CE3-CE2 3.73Å; W153-F156 HydrophobicContact CE3-CE2 3.73Å; W153-F156 HydrophobicContact CE3-CZ 4.39Å; W153-F156 HydrophobicContact CH2-CE1 4.35Å; W153-F156 HydrophobicContact CH2-CE2 4.45Å; W153-F156 HydrophobicContact CH2-CZ 4.36Å; W153-F156 HydrophobicContact CZ3-CD1 4.16Å; W153-F156 AromaticContact CZ3-CD2 3.66Å; W153-F156 HydrophobicContact CZ3-CD2 3.66Å; W153-F156 AromaticContact CZ3-CE1 3.93Å; W153-F156 HydrophobicContact CZ3-CE1 3.93Å; W153-F156 AromaticContact CZ3-CE2 3.33Å; W153-F156 HydrophobicContact CZ3-CE2 3.33Å; W153-F156 HydrophobicContact CZ3-CG 4.09Å; W153-F156 AromaticContact CZ3-CZ 3.54Å; W153-F156 HydrophobicContact CZ3-CZ 3.54Å; D154-F156 PolarHBondContact O-N 2.91Å; F156-F164 HydrophobicContact CB-CD2 4.33Å; F156-F164 HydrophobicContact CB-CE2 4.16Å; F156-L165 WeakPolarHBondContact O-CB 3.34Å; F156-L165 VanDerWaalsContact O-CG 3.29Å; F156-L165 WeakPolarHBondContact O-CG 3.38Å; F156-L165 PolarHBondContact O-N 3.47Å; F156-L233 HydrophobicContact CB-CD2 4.1Å; F156-L233 HydrophobicContact CD1-CD2 3.34Å; F156-L233 HydrophobicContact CD1-CG 4.33Å; F156-L233 HydrophobicContact CE1-CD2 3.69Å; F156-L233 HydrophobicContact CE1-CG 4.33Å; F156-L233 HydrophobicContact CG-CD2 3.76Å; F156-L233 HydrophobicContact CZ-CD2 4.4Å; F156-F237 HydrophobicContact CD2-CD2 4.39Å; F156-F237 AromaticContact CD2-CE2 3.67Å; F156-F237 HydrophobicContact CD2-CE2 3.67Å; F156-F237 HydrophobicContact CD2-CZ 4.07Å; F156-F237 HydrophobicContact CE2-CD2 4.18Å; F156-F237 AromaticContact CE2-CE2 3.28Å; F156-F237 HydrophobicContact CE2-CE2 3.28Å; F156-F237 AromaticContact CE2-CZ 3.88Å; F156-F237 HydrophobicContact CE2-CZ 3.88Å; F156-F237 HydrophobicContact CZ-CE2 4.09Å; F156-I574 HydrophobicContact CD1-CG2 4.47Å; F156-L578 HydrophobicContact CE1-CD1 3.7Å; F156-L578 HydrophobicContact CZ-CD1 3.5Å; F156-L578 VanDerWaalsContact CZ-CD1 3.5Å; F156-L578 HydrophobicContact CZ-CG 4.48Å
157	K	87.6	Confident	69.5	Low	72 Å²	72	58.9 Å²	58.9	31%	0.313	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-84.2	121.7	175.2	-63.1	-159.8	-167.5	122.7	0	111.5	D154 G155 R159 H162 G163	D154-K157 PolarHBondContact O-N 3.07Å; D154-K157 WeakPolarHBondContact OD1-CD 3.36Å; D154-K157 WeakPolarHBondContact OD1-CE 3.47Å; D154-K157 WeakPolarHBondContact OD1-CG 3.33Å; D154-K157 IonicContact OD1-NZ 2.8Å; D154-K157 PolarHBondContact OD1-NZ 2.94Å; G155-K157 VanDerWaalsContact C-N 3.35Å; G155-K157 PolarHBondContact O-N 3.3Å; K157-R159 PolarHBondContact O-N 2.9Å; K157-R159 VanDerWaalsContact O-N 3.1Å; K157-H162 WeakPolarHBondContact CD-O 3.36Å; K157-G163 WeakPolarHBondContact CA-O 3.48Å
158	C	89.3	Confident	72.8	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.007	30%	0.301	C	S	.	.			trans	-65.1	110.3	178.2	171.9	0	0	0	0	110.8	K160 C161 H162 G163 L165 C178	C158-K160 PolarHBondContact O-N 3.04Å; C158-C161 PolarHBondContact O-N 2.99Å; C158-C161 VanDerWaalsContact O-N 3.1Å; C158-H162 VanDerWaalsContact O-CA 3.31Å; C158-H162 WeakPolarHBondContact O-CA 3.24Å; C158-H162 PolarHBondContact O-N 3.27Å; C158-G163 PolarHBondContact N-O 2.97Å; C158-L165 HydrophobicContact CB-CD2 3.77Å; C158-L165 HydrophobicContact CB-CG 4.16Å; C158-C178 WeakPolarHBondContact CB-SG 3.3Å; C158-C178 PolarHBondContact SG-N 3.3Å
159	R	86.3	Confident	76	Confident	120 Å²	120	49.9 Å²	49.9	45%	0.453	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	13.9	-176.4	-55.5	-66.2	-175.6	104.6	3.8	116.2	K157 F177 L194	K157-R159 PolarHBondContact O-N 2.9Å; K157-R159 VanDerWaalsContact O-N 3.1Å; R159-F177 HydrophobicContact CB-CE1 4.27Å; R159-L194 HydrophobicContact CB-CD1 4.13Å; R159-L194 HydrophobicContact CB-CD2 4.14Å; R159-L194 HydrophobicContact CB-CG 4.48Å; R159-L194 HydrophobicContact CG-CD1 4.09Å; R159-L194 HydrophobicContact CG-CD2 4.37Å
160	K	84.2	Confident	78.9	Confident	74 Å²	74	46.3 Å²	46.3	32%	0.322	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-30.1	170.4	-86.4	-166.5	175.2	-165.4	0	115	C158 F177 C181 A193	C158-K160 PolarHBondContact O-N 3.04Å; K160-F177 HydrophobicContact CB-CD1 4.3Å; K160-F177 HydrophobicContact CD-CD1 4.26Å; K160-F177 HydrophobicContact CG-CD1 3.85Å; K160-F177 HydrophobicContact CG-CE1 4.07Å; K160-C181 HydrophobicContact CB-CB 3.97Å; K160-C181 HydrophobicContact CD-CB 4.09Å; K160-C181 WeakPolarHBondContact CD-O 3.38Å; K160-C181 PolarHBondContact NZ-O 3.14Å; K160-A193 HydrophobicContact CG-CB 4.14Å
161	C	83.6	Confident	81.7	Confident	27 Å²	27	40.7 Å²	40.7	18%	0.182	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-15.7	175.6	62	0	0	0	0	112.8	C158 G163 L278	C158-C161 PolarHBondContact O-N 2.99Å; C158-C161 VanDerWaalsContact O-N 3.1Å; C161-G163 PolarHBondContact O-N 3.35Å; C161-L278 HydrophobicContact CB-CD1 3.96Å
162	H	84.2	Confident	84.1	Confident	73 Å²	73	35 Å²	35	34%	0.338	18%	0.177	S	C	.	.			trans	58.1	16.1	-176.5	-49	-89.1	0	0	0	115.6	K157 C158 R307	K157-H162 WeakPolarHBondContact CD-O 3.36Å; C158-H162 VanDerWaalsContact O-CA 3.31Å; C158-H162 WeakPolarHBondContact O-CA 3.24Å; C158-H162 PolarHBondContact O-N 3.27Å; H162-R307 VanDerWaalsContact CG-NH2 3.3Å
163	G	85	Confident	85.9	Confident	3 Å²	3	32.8 Å²	32.8	3%	0.031	16%	0.164	C	C	.	.	S	Bend	trans	-94.1	174.7	162.2	0	0	0	0	0	111.8	K157 C158 C161	K157-G163 WeakPolarHBondContact CA-O 3.48Å; C158-G163 PolarHBondContact N-O 2.97Å; C161-G163 PolarHBondContact O-N 3.35Å
164	F	90	Very high	87	Confident	15 Å²	15	30.8 Å²	30.8	7%	0.066	16%	0.157	C	C	.	.	B	Isolated β-bridge	trans	-52.9	139.4	175.8	-170.8	-99.9	0	0	0	112.3	F156 L233 F237 P240 A241	F156-F164 HydrophobicContact CB-CD2 4.33Å; F156-F164 HydrophobicContact CB-CE2 4.16Å; F164-L233 HydrophobicContact CE1-CB 4.22Å; F164-L233 HydrophobicContact CE1-CD2 3.83Å; F164-L233 HydrophobicContact CE2-CD2 3.86Å; F164-L233 HydrophobicContact CZ-CB 4.09Å; F164-L233 HydrophobicContact CZ-CD2 3.33Å; F164-L233 HydrophobicContact CZ-CG 4.29Å; F164-F237 HydrophobicContact CE2-CB 3.85Å; F164-F237 HydrophobicContact CE2-CD1 4.48Å; F164-F237 AromaticContact CE2-CD2 3.97Å; F164-F237 HydrophobicContact CE2-CD2 3.97Å; F164-F237 AromaticContact CE2-CG 3.84Å; F164-F237 HydrophobicContact CE2-CG 3.84Å; F164-F237 HydrophobicContact CZ-CB 3.57Å; F164-F237 HydrophobicContact CZ-CD2 4.01Å; F164-F237 AromaticContact CZ-CG 3.96Å; F164-F237 HydrophobicContact CZ-CG 3.96Å; F164-P240 HydrophobicContact CD1-CB 4.02Å; F164-P240 HydrophobicContact CD2-CB 3.92Å; F164-P240 HydrophobicContact CE1-CB 4.16Å; F164-P240 HydrophobicContact CE2-CB 4.05Å; F164-P240 HydrophobicContact CG-CB 3.91Å; F164-P240 HydrophobicContact CZ-CB 4.17Å; F164-A241 HydrophobicContact CE1-CB 4.02Å
165	L	90.6	Very high	88	Confident	3 Å²	3	29.8 Å²	29.8	2%	0.016	15%	0.15	C	C	.	.			trans	-61.8	136.3	178.2	-87.6	166.8	0	0	0	111.7	F156 C158 P168 T176 L233 I574	F156-L165 WeakPolarHBondContact O-CB 3.34Å; F156-L165 VanDerWaalsContact O-CG 3.29Å; F156-L165 WeakPolarHBondContact O-CG 3.38Å; F156-L165 PolarHBondContact O-N 3.47Å; C158-L165 HydrophobicContact CB-CD2 3.77Å; C158-L165 HydrophobicContact CB-CG 4.16Å; L165-P168 HydrophobicContact CD2-CB 4.35Å; L165-T176 HydrophobicContact CD1-CG2 4.31Å; L165-T176 HydrophobicContact CD2-CG2 4.34Å; L165-L233 HydrophobicContact CB-CD1 3.79Å; L165-L233 HydrophobicContact CB-CD2 4.28Å; L165-I574 HydrophobicContact CD1-CD1 3.5Å
166	S	89.5	Confident	88.8	Confident	12 Å²	12	29.9 Å²	29.9	8%	0.084	15%	0.149	C	C	.	.	S	Bend	trans	-149.4	134	178.2	172.9	0	0	0	0	108	C178 S244 H248	S166-C178 PolarHBondContact N-SG 3.44Å; S166-C178 VanDerWaalsContact N-SG 3.43Å; S166-C178 VanDerWaalsContact O-CA 3.24Å; S166-C178 WeakPolarHBondContact O-CA 3.25Å; S166-C178 WeakPolarHBondContact O-CB 3.26Å; S166-S244 WeakPolarHBondContact CB-OG 3.48Å; S166-S244 PolarHBondContact OG-OG 3.12Å; S166-H248 PolarHBondContact OG-CD2 3.36Å
167	D	91.6	Very high	89	Confident	71 Å²	71	29.4 Å²	29.4	38%	0.38	15%	0.147	S	C	.	.	S	Bend	trans	45.1	61.8	-161.2	-64.9	-0.8	0	0	0	110.8	V169 K179 V225	D167-V169 PolarHBondContact O-N 3.17Å; D167-K179 HydrophobicContact CB-CB 3.57Å; D167-K179 HydrophobicContact CB-CD 4.33Å; D167-K179 WeakPolarHBondContact O-CB 3.36Å; D167-K179 PolarHBondContact O-N 2.75Å; D167-V225 HydrophobicContact CB-CG2 3.73Å
168	P	93.9	Very high	89.2	Confident	1 Å²	1	26 Å²	26	1%	0.006	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	119.1	-175.7	27.2	-37.4	0	0	0	111	L165 T176 V225 N226 L229 L233	L165-P168 HydrophobicContact CD2-CB 4.35Å; P168-T176 HydrophobicContact CB-CG2 3.72Å; P168-V225 HydrophobicContact CG-CG1 4.06Å; P168-V225 CarbonylContact O-C 3.27Å; P168-V225 WeakPolarHBondContact O-CA 3.39Å; P168-N226 WeakPolarHBondContact O-CB 3.12Å; P168-N226 PolarHBondContact O-N 3.33Å; P168-L229 HydrophobicContact CB-CB 4.25Å; P168-L229 HydrophobicContact CG-CB 3.92Å; P168-L233 HydrophobicContact CB-CD1 4.24Å; P168-L233 HydrophobicContact CG-CD1 3.78Å
169	V	92.7	Very high	89.2	Confident	4 Å²	4	28.3 Å²	28.3	2%	0.024	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	114.9	175.8	175.9	0	0	0	0	108.5	D167 T176 F177 K179 L182 L223	D167-V169 PolarHBondContact O-N 3.17Å; V169-T176 WeakPolarHBondContact O-CA 3.21Å; V169-F177 PolarHBondContact N-O 2.9Å; V169-F177 PolarHBondContact O-N 2.99Å; V169-K179 HydrophobicContact CG2-CB 3.65Å; V169-K179 HydrophobicContact CG2-CG 4.1Å; V169-L182 HydrophobicContact CB-CD1 3.74Å; V169-L182 HydrophobicContact CG1-CD1 3.67Å; V169-L223 HydrophobicContact CG1-CB 4.2Å; V169-L223 HydrophobicContact CG1-CD1 4.46Å; V169-L223 HydrophobicContact CG1-CD2 4.32Å; V169-L223 HydrophobicContact CG2-CB 4.14Å
170	S	92.2	Very high	89.1	Confident	14 Å²	14	25 Å²	25	10%	0.098	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	127	174	-53	0	0	0	0	110.1	T176 N226 N572	S170-T176 WeakPolarHBondContact CA-OG1 3.48Å; S170-T176 WeakPolarHBondContact CB-OG1 3.46Å; S170-T176 PolarHBondContact OG-OG1 2.96Å; S170-N226 PolarHBondContact OG-ND2 2.67Å; S170-N572 PolarHBondContact OG-ND2 2.96Å
171	L	88.9	Confident	89.2	Confident	10 Å²	10	22.7 Å²	22.7	5%	0.052	13%	0.126	C	C	.	.			trans	-83.4	156.9	174.2	-56.6	-175.9	0	0	0	109.8	C173 G174 H175 F177 L182 C192 L199 L202	L171-C173 VanDerWaalsContact CB-SG 3.59Å; L171-C173 PolarHBondContact O-N 3.4Å; L171-G174 PolarHBondContact O-N 3.25Å; L171-H175 PolarHBondContact N-O 3.46Å; L171-F177 HydrophobicContact CD1-CD2 4.08Å; L171-F177 HydrophobicContact CD1-CE2 3.84Å; L171-F177 HydrophobicContact CG-CD2 4.35Å; L171-F177 HydrophobicContact CG-CE2 4.46Å; L171-L182 HydrophobicContact CD2-CD1 3.88Å; L171-C192 HydrophobicContact CD1-CB 3.9Å; L171-L199 HydrophobicContact CD1-CD1 4.01Å; L171-L199 HydrophobicContact CD1-CG 4.27Å; L171-L199 HydrophobicContact CD2-CD2 3.81Å; L171-L199 HydrophobicContact CD2-CG 4.02Å; L171-L202 HydrophobicContact CB-CD1 3.96Å; L171-L202 HydrophobicContact CD2-CD1 4.21Å
172	S	84.4	Confident	89.3	Confident	49 Å²	49	21.5 Å²	21.5	34%	0.343	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-6.4	177.5	97.3	0	0	0	0	114.1	G174 L202 S570	S172-G174 VanDerWaalsContact C-N 3.29Å; S172-L202 WeakPolarHBondContact OG-CD2 3.5Å; S172-S570 WeakPolarHBondContact O-CB 3.43Å; S172-S570 PolarHBondContact O-OG 3.27Å; S172-S570 VanDerWaalsContact O-OG 3.13Å
173	C	88.1	Confident	89.2	Confident	14 Å²	14	21.1 Å²	21.1	10%	0.095	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	26.2	169.1	64.1	0	0	0	0	112.3	L171 H175 C195 V197	L171-C173 VanDerWaalsContact CB-SG 3.59Å; L171-C173 PolarHBondContact O-N 3.4Å; C173-H175 PolarHBondContact O-N 2.94Å; C173-H175 PolarHBondContact O-ND1 3.29Å; C173-C195 VanDerWaalsContact SG-SG 3.64Å; C173-V197 HydrophobicContact CB-CB 4.15Å; C173-V197 HydrophobicContact CB-CG1 4.26Å; C173-V197 HydrophobicContact CB-CG2 4.05Å
174	G	90.7	Very high	88.8	Confident	2 Å²	2	27.9 Å²	27.9	2%	0.021	14%	0.141	C	C	.	.	S	Bend	trans	77.6	-34.7	174.6	0	0	0	0	0	116.4	L171 S172 K571 N572 V573	L171-G174 PolarHBondContact O-N 3.25Å; S172-G174 VanDerWaalsContact C-N 3.29Å; G174-K571 WeakPolarHBondContact CA-O 3.39Å; G174-N572 WeakPolarHBondContact O-CA 3.45Å; G174-N572 PolarHBondContact O-OD1 3.44Å; G174-V573 PolarHBondContact O-N 2.83Å
175	H	91.9	Very high	87.5	Confident	44 Å²	44	28.3 Å²	28.3	20%	0.204	15%	0.149	C	C	.	.			trans	-70.7	140.7	-173.8	-63.4	91.3	0	0	0	113.2	L171 C173 F177 L194	L171-H175 PolarHBondContact N-O 3.46Å; C173-H175 PolarHBondContact O-N 2.94Å; C173-H175 PolarHBondContact O-ND1 3.29Å; H175-F177 HydrophobicContact CB-CE2 3.82Å; H175-F177 HydrophobicContact CB-CZ 4.25Å; H175-L194 HydrophobicContact CB-CD1 4.33Å; H175-L194 WeakPolarHBondContact CD2-CD1 3.49Å
176	T	92.9	Very high	85.9	Confident	9 Å²	9	37.3 Å²	37.3	6%	0.055	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	140.3	-175.4	-62.7	0	0	0	0	111.9	L165 P168 V169 S170 L229 I574	L165-T176 HydrophobicContact CD1-CG2 4.31Å; L165-T176 HydrophobicContact CD2-CG2 4.34Å; P168-T176 HydrophobicContact CB-CG2 3.72Å; V169-T176 WeakPolarHBondContact O-CA 3.21Å; S170-T176 WeakPolarHBondContact CA-OG1 3.48Å; S170-T176 WeakPolarHBondContact CB-OG1 3.46Å; S170-T176 PolarHBondContact OG-OG1 2.96Å; T176-L229 HydrophobicContact CG2-CD1 3.96Å; T176-I574 HydrophobicContact CG2-CD1 4.14Å
177	F	92	Very high	84.2	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	158.7	-178.6	-56.5	-91.8	0	0	0	110.9	R159 K160 V169 L171 H175 K179 L182 A193 L194	R159-F177 HydrophobicContact CB-CE1 4.27Å; K160-F177 HydrophobicContact CB-CD1 4.3Å; K160-F177 HydrophobicContact CD-CD1 4.26Å; K160-F177 HydrophobicContact CG-CD1 3.85Å; K160-F177 HydrophobicContact CG-CE1 4.07Å; V169-F177 PolarHBondContact N-O 2.9Å; V169-F177 PolarHBondContact O-N 2.99Å; L171-F177 HydrophobicContact CD1-CD2 4.08Å; L171-F177 HydrophobicContact CD1-CE2 3.84Å; L171-F177 HydrophobicContact CG-CD2 4.35Å; L171-F177 HydrophobicContact CG-CE2 4.46Å; H175-F177 HydrophobicContact CB-CE2 3.82Å; H175-F177 HydrophobicContact CB-CZ 4.25Å; F177-K179 PolarHBondContact O-N 2.85Å; F177-L182 HydrophobicContact CB-CD1 4.2Å; F177-L182 HydrophobicContact CB-CD2 3.91Å; F177-L182 HydrophobicContact CB-CG 3.94Å; F177-L182 HydrophobicContact CD2-CD2 3.9Å; F177-L182 HydrophobicContact CG-CD2 3.99Å; F177-A193 HydrophobicContact CE1-CB 4.1Å; F177-A193 HydrophobicContact CZ-CB 4.25Å; F177-L194 HydrophobicContact CE1-CD1 4.17Å; F177-L194 HydrophobicContact CE1-CG 4.42Å; F177-L194 HydrophobicContact CZ-CD1 3.84Å; F177-L194 HydrophobicContact CZ-CG 4.09Å
178	C	90.6	Very high	82	Confident	1 Å²	1	42 Å²	42	1%	0.007	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	134.8	170	-53.1	0	0	0	0	110.7	C158 S166 L180 C181 L182	C158-C178 WeakPolarHBondContact CB-SG 3.3Å; C158-C178 PolarHBondContact SG-N 3.3Å; S166-C178 PolarHBondContact N-SG 3.44Å; S166-C178 VanDerWaalsContact N-SG 3.43Å; S166-C178 VanDerWaalsContact O-CA 3.24Å; S166-C178 WeakPolarHBondContact O-CA 3.25Å; S166-C178 WeakPolarHBondContact O-CB 3.26Å; C178-L180 PolarHBondContact O-N 3.17Å; C178-C181 HydrophobicContact CB-CB 4.23Å; C178-C181 WeakPolarHBondContact O-CA 3.31Å; C178-C181 WeakPolarHBondContact O-CB 3.32Å; C178-C181 PolarHBondContact O-N 3.23Å; C178-L182 PolarHBondContact O-N 3.38Å
179	K	89.6	Confident	80.1	Confident	49 Å²	49	46.3 Å²	46.3	21%	0.213	26%	0.256	C	S	.	.	H	α-helix	trans	-45.1	-54.7	178.1	179.7	166	174.1	165.3	0	113.3	D167 V169 F177 C181 L182 E183 L223 V225	D167-K179 HydrophobicContact CB-CB 3.57Å; D167-K179 HydrophobicContact CB-CD 4.33Å; D167-K179 WeakPolarHBondContact O-CB 3.36Å; D167-K179 PolarHBondContact O-N 2.75Å; V169-K179 HydrophobicContact CG2-CB 3.65Å; V169-K179 HydrophobicContact CG2-CG 4.1Å; F177-K179 PolarHBondContact O-N 2.85Å; K179-C181 PolarHBondContact O-N 2.92Å; K179-C181 VanDerWaalsContact O-N 3.15Å; K179-L182 WeakPolarHBondContact O-CB 3.48Å; K179-L182 PolarHBondContact O-N 2.87Å; K179-E183 WeakPolarHBondContact CE-OE1 3.27Å; K179-E183 HydrophobicContact CG-CG 4.36Å; K179-E183 WeakPolarHBondContact CG-OE1 3.37Å; K179-E183 WeakPolarHBondContact O-CG 3.26Å; K179-E183 PolarHBondContact O-N 3.33Å; K179-L223 VanDerWaalsContact CE-O 3.29Å; K179-L223 WeakPolarHBondContact CE-O 3.48Å; K179-L223 HydrophobicContact CG-CB 4.33Å; K179-L223 PolarHBondContact NZ-O 2.99Å; K179-V225 HydrophobicContact CD-CG2 4.31Å
180	L	85.7	Confident	79.1	Confident	51 Å²	51	48.8 Å²	48.8	27%	0.267	26%	0.264	S	S	.	.	H	α-helix	trans	-61.7	-24.6	179.8	-68.5	169.9	0	0	0	113.5	C178 L182 R184 H248	C178-L180 PolarHBondContact O-N 3.17Å; L180-L182 VanDerWaalsContact C-N 3.35Å; L180-R184 WeakPolarHBondContact O-CB 3.47Å; L180-R184 VanDerWaalsContact O-CD 3.25Å; L180-R184 WeakPolarHBondContact O-CD 3.32Å; L180-R184 WeakPolarHBondContact O-CG 3.19Å; L180-R184 PolarHBondContact O-N 2.88Å; L180-H248 HydrophobicContact CD1-CB 4.22Å
181	C	86.1	Confident	78.4	Confident	24 Å²	24	54.2 Å²	54.2	16%	0.162	28%	0.283	C	S	.	.	H	α-helix	trans	-80.8	-14.6	175.7	-66.4	0	0	0	0	113.3	K160 C178 K179	K160-C181 HydrophobicContact CB-CB 3.97Å; K160-C181 HydrophobicContact CD-CB 4.09Å; K160-C181 WeakPolarHBondContact CD-O 3.38Å; K160-C181 PolarHBondContact NZ-O 3.14Å; C178-C181 HydrophobicContact CB-CB 4.23Å; C178-C181 WeakPolarHBondContact O-CA 3.31Å; C178-C181 WeakPolarHBondContact O-CB 3.32Å; C178-C181 PolarHBondContact O-N 3.23Å; K179-C181 PolarHBondContact O-N 2.92Å; K179-C181 VanDerWaalsContact O-N 3.15Å
182	L	84.9	Confident	78.3	Confident	3 Å²	3	54 Å²	54	2%	0.016	28%	0.282	C	S	.	.	H	α-helix	trans	-90.3	-42.1	169	-61.9	174.6	0	0	0	110.9	V169 L171 F177 C178 K179 L180 G185 L199 L223	V169-L182 HydrophobicContact CB-CD1 3.74Å; V169-L182 HydrophobicContact CG1-CD1 3.67Å; L171-L182 HydrophobicContact CD2-CD1 3.88Å; F177-L182 HydrophobicContact CB-CD1 4.2Å; F177-L182 HydrophobicContact CB-CD2 3.91Å; F177-L182 HydrophobicContact CB-CG 3.94Å; F177-L182 HydrophobicContact CD2-CD2 3.9Å; F177-L182 HydrophobicContact CG-CD2 3.99Å; C178-L182 PolarHBondContact O-N 3.38Å; K179-L182 WeakPolarHBondContact O-CB 3.48Å; K179-L182 PolarHBondContact O-N 2.87Å; L180-L182 VanDerWaalsContact C-N 3.35Å; L182-G185 PolarHBondContact O-N 3.49Å; L182-L199 HydrophobicContact CD2-CD2 4.36Å; L182-L223 HydrophobicContact CB-CD1 3.43Å; L182-L223 VanDerWaalsContact CB-CD1 3.43Å; L182-L223 HydrophobicContact CD1-CD1 3.83Å; L182-L223 HydrophobicContact CG-CD1 4.3Å
183	E	82.3	Confident	78.2	Confident	64 Å²	64	54.5 Å²	54.5	30%	0.299	29%	0.289	S	S	.	.	H	α-helix	trans	-66.5	-40	-176.9	-68	174	158.2	0	0	113.2	K179 G185 R190 L223	K179-E183 WeakPolarHBondContact CE-OE1 3.27Å; K179-E183 HydrophobicContact CG-CG 4.36Å; K179-E183 WeakPolarHBondContact CG-OE1 3.37Å; K179-E183 WeakPolarHBondContact O-CG 3.26Å; K179-E183 PolarHBondContact O-N 3.33Å; E183-G185 PolarHBondContact O-N 3.43Å; E183-R190 PolarHBondContact O-NH2 2.95Å; E183-L223 HydrophobicContact CG-CD1 3.99Å
184	R	75.7	Confident	78.1	Confident	146 Å²	146	57.9 Å²	57.9	55%	0.551	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-4.2	178.7	-71.3	170.1	-175.8	-163.9	-3.1	115	L180	L180-R184 WeakPolarHBondContact O-CB 3.47Å; L180-R184 VanDerWaalsContact O-CD 3.25Å; L180-R184 WeakPolarHBondContact O-CD 3.32Å; L180-R184 WeakPolarHBondContact O-CG 3.19Å; L180-R184 PolarHBondContact O-N 2.88Å
185	G	63.3	Low	77.9	Confident	24 Å²	24	60.6 Å²	60.6	25%	0.247	32%	0.324	C	S	.	.	S	Bend	trans	-83.6	134.3	176	0	0	0	0	0	113	L182 E183 A187 R190	L182-G185 PolarHBondContact O-N 3.49Å; E183-G185 PolarHBondContact O-N 3.43Å; G185-A187 PolarHBondContact O-N 3.43Å; G185-R190 PolarHBondContact O-NE 3.34Å; G185-R190 VanDerWaalsContact O-NE 3.13Å
186	R	57.1	Low	77.6	Confident	192 Å²	192	60 Å²	60	73%	0.725	33%	0.33	S	S	*	.			trans	-50.1	138	172	-69	-169.8	-61.4	-141	1.5	110.4	A188 D189 R190	R186-A188 VanDerWaalsContact C-N 3.28Å; R186-A188 PolarHBondContact O-N 3.23Å; R186-A188 VanDerWaalsContact O-N 3.16Å; R186-D189 IonicContact CZ-OD2 3.9Å; R186-D189 IonicContact NE-OD2 3.46Å; R186-D189 PolarHBondContact NE-OD2 3.35Å; R186-D189 IonicContact NH2-OD2 3.4Å; R186-D189 PolarHBondContact NH2-OD2 2.93Å; R186-D189 PolarHBondContact O-N 3.03Å; R186-R190 WeakPolarHBondContact O-CG 3.48Å
187	A	53.7	Low	77.1	Confident	84 Å²	84	62.5 Å²	62.5	69%	0.694	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-55.4	-38.9	-169.2	0	0	0	0	0	114.1	G185	G185-A187 PolarHBondContact O-N 3.43Å
188	A	45.3	Very low	76.3	Confident	97 Å²	97	68 Å²	68	80%	0.802	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-67.9	-31.3	177.9	0	0	0	0	0	113.9	R186 R190	R186-A188 VanDerWaalsContact C-N 3.28Å; R186-A188 PolarHBondContact O-N 3.23Å; R186-A188 VanDerWaalsContact O-N 3.16Å; A188-R190 VanDerWaalsContact C-N 3.34Å; A188-R190 PolarHBondContact O-N 3.02Å
189	D	55.2	Low	75.4	Confident	92 Å²	92	68.1 Å²	68.1	49%	0.492	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-91.8	8.4	-173.5	-63.6	-40.7	0	0	0	112.8	R186 R191	R186-D189 IonicContact CZ-OD2 3.9Å; R186-D189 IonicContact NE-OD2 3.46Å; R186-D189 PolarHBondContact NE-OD2 3.35Å; R186-D189 IonicContact NH2-OD2 3.4Å; R186-D189 PolarHBondContact NH2-OD2 2.93Å; R186-D189 PolarHBondContact O-N 3.03Å; D189-R191 VanDerWaalsContact C-N 3.34Å; D189-R191 PolarHBondContact O-N 3.36Å
190	R	70.1	Confident	73.8	Confident	56 Å²	56	70.2 Å²	70.2	21%	0.211	39%	0.39	C	S	.	.			trans	-73.1	84	-175.4	-67.3	-173.9	169.3	-167.9	-5.8	111.7	E183 G185 R186 A188 L199	E183-R190 PolarHBondContact O-NH2 2.95Å; G185-R190 PolarHBondContact O-NE 3.34Å; G185-R190 VanDerWaalsContact O-NE 3.13Å; R186-R190 WeakPolarHBondContact O-CG 3.48Å; A188-R190 VanDerWaalsContact C-N 3.34Å; A188-R190 PolarHBondContact O-N 3.02Å; R190-L199 HydrophobicContact CB-CB 4.06Å; R190-L199 HydrophobicContact CB-CD1 4.44Å; R190-L199 WeakPolarHBondContact O-CD1 3.16Å; R190-L199 PolarHBondContact O-N 3.14Å
191	R	78.9	Confident	72.1	Confident	128 Å²	128	70.6 Å²	70.6	48%	0.483	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-119.6	158.3	170	-67.9	174.2	178.9	-102.9	16.6	111.5	D189 A193 G196 V197 K198	D189-R191 VanDerWaalsContact C-N 3.34Å; D189-R191 PolarHBondContact O-N 3.36Å; R191-A193 PolarHBondContact O-N 3.16Å; R191-G196 VanDerWaalsContact CD-O 3.3Å; R191-G196 WeakPolarHBondContact CD-O 3.39Å; R191-G196 WeakPolarHBondContact CG-O 3.35Å; R191-G196 PolarHBondContact NH1-O 2.71Å; R191-V197 CarbonylContact C-O 3.6Å; R191-V197 VanDerWaalsContact CA-O 3.22Å; R191-V197 WeakPolarHBondContact CA-O 3.48Å; R191-K198 HydrophobicContact CG-CG 4.25Å
192	C	85.3	Confident	70.4	Confident	4 Å²	4	70.8 Å²	70.8	3%	0.027	40%	0.4	C	S	.	.			trans	-61.2	130.3	163.8	-179.1	0	0	0	0	109	L171 L194 G196 V197	L171-C192 HydrophobicContact CD1-CB 3.9Å; C192-L194 PolarHBondContact O-N 3.28Å; C192-G196 WeakPolarHBondContact O-CA 3.47Å; C192-G196 PolarHBondContact O-N 2.97Å; C192-V197 PolarHBondContact N-O 2.75Å
193	A	82.9	Confident	68.6	Low	61 Å²	61	72.3 Å²	72.3	50%	0.504	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-11.8	-178	0	0	0	0	0	113.8	K160 F177 R191	K160-A193 HydrophobicContact CG-CB 4.14Å; F177-A193 HydrophobicContact CE1-CB 4.1Å; F177-A193 HydrophobicContact CZ-CB 4.25Å; R191-A193 PolarHBondContact O-N 3.16Å
194	L	85	Confident	66.6	Low	85 Å²	85	70.4 Å²	70.4	45%	0.445	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-38.5	-174.1	-62.5	167.5	0	0	0	112.3	R159 H175 F177 C192	R159-L194 HydrophobicContact CB-CD1 4.13Å; R159-L194 HydrophobicContact CB-CD2 4.14Å; R159-L194 HydrophobicContact CB-CG 4.48Å; R159-L194 HydrophobicContact CG-CD1 4.09Å; R159-L194 HydrophobicContact CG-CD2 4.37Å; H175-L194 HydrophobicContact CB-CD1 4.33Å; H175-L194 WeakPolarHBondContact CD2-CD1 3.49Å; F177-L194 HydrophobicContact CE1-CD1 4.17Å; F177-L194 HydrophobicContact CE1-CG 4.42Å; F177-L194 HydrophobicContact CZ-CD1 3.84Å; F177-L194 HydrophobicContact CZ-CG 4.09Å; C192-L194 PolarHBondContact O-N 3.28Å
195	C	87.9	Confident	64.8	Low	59 Å²	59	67.7 Å²	67.7	40%	0.399	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.6	8.9	-177.8	65.2	0	0	0	0	115	C173 V197	C173-C195 VanDerWaalsContact SG-SG 3.64Å; C195-V197 PolarHBondContact O-N 2.83Å
196	G	84.3	Confident	63.6	Low	32 Å²	32	71.9 Å²	71.9	33%	0.33	43%	0.43	S	S	.	.			trans	69	-5.5	172.2	0	0	0	0	0	117.2	R191 C192 K198	R191-G196 VanDerWaalsContact CD-O 3.3Å; R191-G196 WeakPolarHBondContact CD-O 3.39Å; R191-G196 WeakPolarHBondContact CG-O 3.35Å; R191-G196 PolarHBondContact NH1-O 2.71Å; C192-G196 WeakPolarHBondContact O-CA 3.47Å; C192-G196 PolarHBondContact O-N 2.97Å; G196-K198 PolarHBondContact O-N 2.78Å
197	V	82.6	Confident	62.6	Low	61 Å²	61	66.1 Å²	66.1	37%	0.37	43%	0.43	S	S	.	.			trans	-57.3	132	179	176.5	0	0	0	0	111.2	C173 R191 C192 C195	C173-V197 HydrophobicContact CB-CB 4.15Å; C173-V197 HydrophobicContact CB-CG1 4.26Å; C173-V197 HydrophobicContact CB-CG2 4.05Å; R191-V197 CarbonylContact C-O 3.6Å; R191-V197 VanDerWaalsContact CA-O 3.22Å; R191-V197 WeakPolarHBondContact CA-O 3.48Å; C192-V197 PolarHBondContact N-O 2.75Å; C195-V197 PolarHBondContact O-N 2.83Å
198	K	76.4	Confident	61.7	Low	115 Å²	115	73.8 Å²	73.8	50%	0.5	44%	0.441	S	S	.	.	B	Isolated β-bridge	trans	-71.6	129.2	-179	-64.4	-178.6	179.8	179.2	0	111.5	R191 G196 S200 A201	R191-K198 HydrophobicContact CG-CG 4.25Å; G196-K198 PolarHBondContact O-N 2.78Å; K198-S200 PolarHBondContact O-N 2.64Å; K198-A201 PolarHBondContact O-N 3.26Å
199	L	71.1	Confident	61.1	Low	4 Å²	4	74 Å²	74	2%	0.021	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-68	-20.9	173.5	-82.1	83.2	0	0	0	113.2	L171 L182 R190 A201 L202	L171-L199 HydrophobicContact CD1-CD1 4.01Å; L171-L199 HydrophobicContact CD1-CG 4.27Å; L171-L199 HydrophobicContact CD2-CD2 3.81Å; L171-L199 HydrophobicContact CD2-CG 4.02Å; L182-L199 HydrophobicContact CD2-CD2 4.36Å; R190-L199 HydrophobicContact CB-CB 4.06Å; R190-L199 HydrophobicContact CB-CD1 4.44Å; R190-L199 WeakPolarHBondContact O-CD1 3.16Å; R190-L199 PolarHBondContact O-N 3.14Å; L199-A201 PolarHBondContact O-N 2.92Å; L199-A201 VanDerWaalsContact O-N 3.16Å; L199-L202 HydrophobicContact CB-CD1 4.46Å; L199-L202 HydrophobicContact CG-CD1 4.19Å; L199-L202 WeakPolarHBondContact O-CB 3.3Å; L199-L202 PolarHBondContact O-N 3.23Å
200	S	56.1	Low	60.2	Low	93 Å²	93	81.8 Å²	81.8	65%	0.65	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-63.9	-17.6	178	61.3	0	0	0	0	113.5	K198 L202	K198-S200 PolarHBondContact O-N 2.64Å; S200-L202 VanDerWaalsContact C-N 3.33Å
201	A	50.9	Low	58.6	Low	59 Å²	59	82.3 Å²	82.3	49%	0.488	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-85.4	-1.9	172.5	0	0	0	0	0	113.5	K198 L199 Q562	K198-A201 PolarHBondContact O-N 3.26Å; L199-A201 PolarHBondContact O-N 2.92Å; L199-A201 VanDerWaalsContact O-N 3.16Å; A201-Q562 PolarHBondContact O-NE2 2.99Å
202	L	49.6	Very low	56.9	Low	28 Å²	28	82.7 Å²	82.7	15%	0.147	51%	0.51	C	S	.	.	S	Bend	trans	-113.4	7.2	-166.7	-46.3	-172.9	0	0	0	113.6	L171 S172 L199 S200	L171-L202 HydrophobicContact CB-CD1 3.96Å; L171-L202 HydrophobicContact CD2-CD1 4.21Å; S172-L202 WeakPolarHBondContact OG-CD2 3.5Å; L199-L202 HydrophobicContact CB-CD1 4.46Å; L199-L202 HydrophobicContact CG-CD1 4.19Å; L199-L202 WeakPolarHBondContact O-CB 3.3Å; L199-L202 PolarHBondContact O-N 3.23Å; S200-L202 VanDerWaalsContact C-N 3.33Å
203	M	46	Very low	54.6	Low	35 Å²	35	93.8 Å²	93.8	17%	0.172	55%	0.551	C	S	.	*			trans	-118.2	99.9	-162.8	-79.8	176.7	169.4	0	0	110.5	A205 P220 P221 L223	M203-A205 PolarHBondContact O-N 3.25Å; M203-P220 HydrophobicContact CE-CB 4.26Å; M203-P220 HydrophobicContact SD-CB 3.56Å; M203-P220 VanDerWaalsContact SD-CB 3.56Å; M203-P221 HydrophobicContact CB-CG 3.64Å; M203-P221 HydrophobicContact CG-CG 4.06Å; M203-L223 HydrophobicContact CE-CD2 3.67Å; M203-L223 HydrophobicContact CE-CG 4.42Å
204	V	40.9	Very low	52.5	Low	24 Å²	24	102.8 Å²	102.8	15%	0.145	57%	0.572	C	S	.	*			trans	-67.1	121.4	-176.9	178.3	0	0	0	0	110.9	T206 P221 P533	V204-T206 PolarHBondContact O-N 3.05Å; V204-T206 VanDerWaalsContact O-N 3.08Å; V204-P221 WeakPolarHBondContact O-CG 3.28Å; V204-P533 HydrophobicContact CG2-CB 4.18Å; V204-P533 HydrophobicContact CG2-CG 4.41Å
205	A	38.6	Very low	50.4	Low	88 Å²	88	104.3 Å²	104.3	73%	0.727	60%	0.597	S	S	*	*			trans	-67.9	101.8	163.4	0	0	0	0	0	109.2	M203 G207	M203-A205 PolarHBondContact O-N 3.25Å; A205-G207 PolarHBondContact O-N 3.41Å
206	T	37.5	Very low	48	Very low	113 Å²	113	104.2 Å²	104.2	69%	0.693	61%	0.606	S	S	*	*			trans	-67.1	120.4	176.5	42.4	0	0	0	0	109.9	V204	V204-T206 PolarHBondContact O-N 3.05Å; V204-T206 VanDerWaalsContact O-N 3.08Å
207	G	36.2	Very low	46.1	Very low	70 Å²	70	112.1 Å²	112.1	72%	0.722	63%	0.634	S	S	*	*			trans	-75.3	140.8	-164.3	0	0	0	0	0	115.1	A205	A205-G207 PolarHBondContact O-N 3.41Å
208	R	35.6	Very low	44.2	Very low	245 Å²	245	117.6 Å²	117.6	93%	0.925	66%	0.656	S	S	*	*			trans	71.2	81.9	161.5	-57.2	-178.4	176.5	-176.2	-0.8	117.6
209	A	31.8	Very low	42.8	Very low	102 Å²	102	117.4 Å²	117.4	84%	0.843	67%	0.667	S	S	*	*				-85.5	137.8	122.8	0	0	0	0	0	108.5
210	R	37.7	Very low	42	Very low	256 Å²	256	120.5 Å²	120.5	97%	0.966	69%	0.687	S	S	*	*			trans	-80.2	117.1	170	-88.1	-178.7	169.9	166.8	-4.7	108.6
211	G	35	Very low	42.2	Very low	66 Å²	66	118.1 Å²	118.1	68%	0.68	67%	0.669	S	S	*	*			trans	167.7	111.4	172.9	0	0	0	0	0	111.6	R213	G211-R213 PolarHBondContact O-N 3.14Å; G211-R213 VanDerWaalsContact O-N 3.14Å
212	S	43.5	Very low	43.4	Very low	136 Å²	136	119.9 Å²	119.9	95%	0.951	68%	0.676	S	S	*	*			trans	-71.6	107.3	174.8	-169.1	0	0	0	0	109.4
213	R	37.8	Very low	45.1	Very low	238 Å²	238	119.6 Å²	119.6	90%	0.898	67%	0.674	S	S	*	*			trans	-127.9	145.2	168.5	-69.7	-169.1	176.6	-165.5	-0.2	108.6	G211	G211-R213 PolarHBondContact O-N 3.14Å; G211-R213 VanDerWaalsContact O-N 3.14Å
214	R	38.3	Very low	47.2	Very low	249 Å²	249	124 Å²	124	94%	0.94	69%	0.689	S	S	*	*			trans	-58.8	155.7	-169.8	-65.8	176.2	176.9	167.4	-2.1	111.9	G216	R214-G216 PolarHBondContact O-N 3.13Å
215	A	40.3	Very low	49.7	Very low	117 Å²	117	124.5 Å²	124.5	97%	0.967	69%	0.692	S	S	*	*	S	Bend	trans	-60.9	94.9	176.9	0	0	0	0	0	111.3
216	G	37.2	Very low	52.4	Low	58 Å²	58	120.3 Å²	120.3	60%	0.598	66%	0.657	S	S	*	*			trans	-148.2	104.5	-179.1	0	0	0	0	0	110.1	R214 Q218	R214-G216 PolarHBondContact O-N 3.13Å; G216-Q218 PolarHBondContact O-N 3.04Å; G216-Q218 VanDerWaalsContact O-N 3.09Å
217	Q	45.7	Very low	55.1	Low	197 Å²	197	118.8 Å²	118.8	92%	0.921	65%	0.648	S	S	*	*			trans	20.3	73.4	165.7	-57.6	-175.3	18.8	0	0	116.4
218	Q	41.8	Very low	57.9	Low	176 Å²	176	117.1 Å²	117.1	82%	0.822	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-63	135.3	157.6	-77.6	-171.6	-28.4	0	0	108.5	G216	G216-Q218 PolarHBondContact O-N 3.04Å; G216-Q218 VanDerWaalsContact O-N 3.09Å
219	P	47.4	Very low	60.7	Low	111 Å²	111	105.5 Å²	105.5	72%	0.721	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-61.6	141.5	175	26.7	-33.8	0	0	0	109.4
220	P	54	Low	63.6	Low	69 Å²	69	102.9 Å²	102.9	45%	0.448	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-58.2	141.1	179.1	22.5	-32.1	0	0	0	110.7	M203	M203-P220 HydrophobicContact CE-CB 4.26Å; M203-P220 HydrophobicContact SD-CB 3.56Å; M203-P220 VanDerWaalsContact SD-CB 3.56Å
221	P	60.7	Low	66.1	Low	44 Å²	44	92.9 Å²	92.9	29%	0.286	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-56.2	145	-178.5	25	-36.3	0	0	0	111.3	M203 V204 L223	M203-P221 HydrophobicContact CB-CG 3.64Å; M203-P221 HydrophobicContact CG-CG 4.06Å; V204-P221 WeakPolarHBondContact O-CG 3.28Å; P221-L223 PolarHBondContact O-N 3.32Å
222	P	75.4	Confident	68.8	Low	95 Å²	95	90 Å²	90	62%	0.617	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-64.7	134.5	-172.1	26.4	-34.9	0	0	0	111.2	R224	P222-R224 PolarHBondContact O-N 3.35Å
223	L	85.6	Confident	71	Confident	22 Å²	22	83.8 Å²	83.8	12%	0.115	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-64.1	133	178.4	-68.2	-179.9	0	0	0	110.8	V169 K179 L182 E183 M203 P221	V169-L223 HydrophobicContact CG1-CB 4.2Å; V169-L223 HydrophobicContact CG1-CD1 4.46Å; V169-L223 HydrophobicContact CG1-CD2 4.32Å; V169-L223 HydrophobicContact CG2-CB 4.14Å; K179-L223 VanDerWaalsContact CE-O 3.29Å; K179-L223 WeakPolarHBondContact CE-O 3.48Å; K179-L223 HydrophobicContact CG-CB 4.33Å; K179-L223 PolarHBondContact NZ-O 2.99Å; L182-L223 HydrophobicContact CB-CD1 3.43Å; L182-L223 VanDerWaalsContact CB-CD1 3.43Å; L182-L223 HydrophobicContact CD1-CD1 3.83Å; L182-L223 HydrophobicContact CG-CD1 4.3Å; E183-L223 HydrophobicContact CG-CD1 3.99Å; M203-L223 HydrophobicContact CE-CD2 3.67Å; M203-L223 HydrophobicContact CE-CG 4.42Å; P221-L223 PolarHBondContact O-N 3.32Å
224	R	90.4	Very high	73.4	Confident	127 Å²	127	74.1 Å²	74.1	48%	0.479	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-101.8	135.6	-175.3	-58.4	-68.6	-65.1	-161.5	-1.2	109.8	P222 P533 C534	P222-R224 PolarHBondContact O-N 3.35Å; R224-P533 WeakPolarHBondContact CB-O 3.49Å; R224-P533 WeakPolarHBondContact CG-O 3.24Å; R224-C534 WeakPolarHBondContact CB-O 3.47Å; R224-C534 PolarHBondContact NE-O 3.07Å
225	V	93.4	Very high	75.8	Confident	35 Å²	35	66.7 Å²	66.7	21%	0.212	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-78	138.6	-179.3	177.5	0	0	0	0	109.5	D167 P168 K179 V227 G535	D167-V225 HydrophobicContact CB-CG2 3.73Å; P168-V225 HydrophobicContact CG-CG1 4.06Å; P168-V225 CarbonylContact O-C 3.27Å; P168-V225 WeakPolarHBondContact O-CA 3.39Å; K179-V225 HydrophobicContact CD-CG2 4.31Å; V225-V227 PolarHBondContact O-N 3.13Å; V225-G535 WeakPolarHBondContact O-CA 3.4Å
226	N	95.5	Very high	77.9	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	36%	0.36	C	S	.	.			trans	-65.8	108.4	169.5	-178.6	-30.3	0	0	0	108.7	P168 S170 V228 L229 S230 T531 G535 T537 N572	P168-N226 WeakPolarHBondContact O-CB 3.12Å; P168-N226 PolarHBondContact O-N 3.33Å; S170-N226 PolarHBondContact OG-ND2 2.67Å; N226-V228 VanDerWaalsContact C-N 3.33Å; N226-V228 PolarHBondContact O-N 2.95Å; N226-V228 PolarHBondContact OD1-N 3.13Å; N226-L229 HydrophobicContact CB-CB 4.18Å; N226-L229 HydrophobicContact CB-CD1 4.42Å; N226-L229 WeakPolarHBondContact ND2-CD1 3.31Å; N226-L229 PolarHBondContact OD1-N 2.93Å; N226-L229 VanDerWaalsContact OD1-N 3.13Å; N226-S230 VanDerWaalsContact O-CB 3.25Å; N226-S230 WeakPolarHBondContact O-CB 3.34Å; N226-S230 PolarHBondContact O-N 3.48Å; N226-T531 HydrophobicContact CB-CG2 4.2Å; N226-T531 PolarHBondContact ND2-OG1 3.41Å; N226-T531 VanDerWaalsContact ND2-OG1 3.1Å; N226-G535 CarbonylContact C-O 3.56Å; N226-G535 VanDerWaalsContact CA-O 3.32Å; N226-G535 WeakPolarHBondContact CA-O 3.38Å; N226-T537 PolarHBondContact ND2-OG1 3.31Å; N226-T537 PolarHBondContact OD1-OG1 2.82Å; N226-N572 PolarHBondContact ND2-ND2 3.27Å
227	V	94.6	Very high	80.2	Confident	81 Å²	81	59.1 Å²	59.1	49%	0.491	34%	0.335	S	S	.	.	H	α-helix	trans	-61.8	-42.5	-171.7	-179.5	0	0	0	0	111.1	V225 S230 G231 G535	V225-V227 PolarHBondContact O-N 3.13Å; V227-S230 PolarHBondContact O-N 3.21Å; V227-G231 PolarHBondContact O-N 3.38Å; V227-G535 PolarHBondContact N-O 3Å
228	V	94.6	Very high	82.2	Confident	35 Å²	35	53.9 Å²	53.9	21%	0.212	32%	0.318	C	S	.	.	H	α-helix	trans	-66.5	-53.7	-178.5	-176.8	0	0	0	0	110.5	N226 S230 G231 L232 L517 F526 M575	N226-V228 VanDerWaalsContact C-N 3.33Å; N226-V228 PolarHBondContact O-N 2.95Å; N226-V228 PolarHBondContact OD1-N 3.13Å; V228-S230 VanDerWaalsContact C-N 3.27Å; V228-S230 PolarHBondContact O-N 3.28Å; V228-G231 PolarHBondContact O-N 3.42Å; V228-L232 WeakPolarHBondContact O-CB 3.37Å; V228-L232 PolarHBondContact O-N 3.42Å; V228-L517 HydrophobicContact CG1-CD2 4.37Å; V228-F526 HydrophobicContact CG1-CE2 4.14Å; V228-F526 HydrophobicContact CG2-CE2 4.42Å; V228-F526 HydrophobicContact CG2-CZ 4.25Å; V228-M575 HydrophobicContact CG1-CE 3.88Å; V228-M575 HydrophobicContact CG1-SD 4.36Å
229	L	93.3	Very high	84.5	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-60.8	-36.4	177.6	-73.8	178.5	0	0	0	112	P168 T176 N226 L232 L233 I574 M575	P168-L229 HydrophobicContact CB-CB 4.25Å; P168-L229 HydrophobicContact CG-CB 3.92Å; T176-L229 HydrophobicContact CG2-CD1 3.96Å; N226-L229 HydrophobicContact CB-CB 4.18Å; N226-L229 HydrophobicContact CB-CD1 4.42Å; N226-L229 WeakPolarHBondContact ND2-CD1 3.31Å; N226-L229 PolarHBondContact OD1-N 2.93Å; N226-L229 VanDerWaalsContact OD1-N 3.13Å; L229-L232 PolarHBondContact O-N 2.99Å; L229-L233 WeakPolarHBondContact O-CB 3.49Å; L229-L233 WeakPolarHBondContact O-CD1 3.46Å; L229-L233 WeakPolarHBondContact O-CG 3.38Å; L229-L233 PolarHBondContact O-N 3.15Å; L229-I574 HydrophobicContact CD1-CB 4.39Å; L229-I574 HydrophobicContact CD1-CG2 4.43Å; L229-I574 HydrophobicContact CD2-CG2 4.02Å; L229-M575 HydrophobicContact CD1-SD 4.46Å; L229-M575 HydrophobicContact CD2-CG 4.38Å; L229-M575 HydrophobicContact CD2-SD 3.49Å; L229-M575 WeakPolarHBondContact CD2-SD 3.33Å; L229-M575 HydrophobicContact CG-CG 4.45Å; L229-M575 HydrophobicContact CG-SD 3.7Å
230	S	92.9	Very high	86.5	Confident	48 Å²	48	42.5 Å²	42.5	34%	0.336	26%	0.263	S	S	.	.	H	α-helix	trans	-70.3	-35.3	179.6	-164.8	0	0	0	0	113.2	N226 V227 V228 G234	N226-S230 VanDerWaalsContact O-CB 3.25Å; N226-S230 WeakPolarHBondContact O-CB 3.34Å; N226-S230 PolarHBondContact O-N 3.48Å; V227-S230 PolarHBondContact O-N 3.21Å; V228-S230 VanDerWaalsContact C-N 3.27Å; V228-S230 PolarHBondContact O-N 3.28Å; S230-G234 PolarHBondContact O-N 3.38Å
231	G	91.4	Very high	88.1	Confident	46 Å²	46	39.9 Å²	39.9	47%	0.474	25%	0.247	S	C	.	.	H	α-helix	trans	-67.8	-47.9	171.5	0	0	0	0	0	111.3	V227 V228 L233 G234 K235	V227-G231 PolarHBondContact O-N 3.38Å; V228-G231 PolarHBondContact O-N 3.42Å; G231-L233 PolarHBondContact O-N 2.79Å; G231-G234 WeakPolarHBondContact O-CA 3.45Å; G231-G234 PolarHBondContact O-N 3.45Å; G231-G234 VanDerWaalsContact O-N 3.09Å; G231-K235 PolarHBondContact O-N 3.36Å
232	L	90.1	Very high	89.5	Confident	5 Å²	5	42.1 Å²	42.1	3%	0.026	25%	0.25	C	C	.	.	H	α-helix	trans	-62	-44.6	-177.8	-167.5	63.5	0	0	0	112.9	V228 L229 G234 K235 L236 F512 D516 L517 L578	V228-L232 WeakPolarHBondContact O-CB 3.37Å; V228-L232 PolarHBondContact O-N 3.42Å; L229-L232 PolarHBondContact O-N 2.99Å; L232-G234 PolarHBondContact O-N 3.46Å; L232-K235 PolarHBondContact O-N 2.94Å; L232-L236 HydrophobicContact CD1-CD1 3.65Å; L232-L236 HydrophobicContact CD1-CG 3.93Å; L232-L236 HydrophobicContact CD2-CD1 4.48Å; L232-L236 HydrophobicContact CG-CD1 3.74Å; L232-L236 HydrophobicContact CG-CG 4.26Å; L232-L236 WeakPolarHBondContact O-CB 3.36Å; L232-L236 WeakPolarHBondContact O-CG 3.23Å; L232-L236 PolarHBondContact O-N 3.12Å; L232-F512 HydrophobicContact CD1-CD2 4.15Å; L232-F512 HydrophobicContact CD1-CE2 4.2Å; L232-D516 HydrophobicContact CD1-CB 3.86Å; L232-L517 HydrophobicContact CD2-CD2 4.02Å; L232-L578 HydrophobicContact CD2-CD1 3.5Å; L232-L578 VanDerWaalsContact CD2-CD1 3.5Å; L232-L578 HydrophobicContact CD2-CD2 4.16Å
233	L	89.4	Confident	90.4	Very high	5 Å²	5	37.6 Å²	37.6	3%	0.026	22%	0.22	C	C	.	.	H	α-helix	trans	-58.3	-37.6	173.6	-72	163.8	0	0	0	112	F156 F164 L165 P168 L229 G231 F237	F156-L233 HydrophobicContact CB-CD2 4.1Å; F156-L233 HydrophobicContact CD1-CD2 3.34Å; F156-L233 HydrophobicContact CD1-CG 4.33Å; F156-L233 HydrophobicContact CE1-CD2 3.69Å; F156-L233 HydrophobicContact CE1-CG 4.33Å; F156-L233 HydrophobicContact CG-CD2 3.76Å; F156-L233 HydrophobicContact CZ-CD2 4.4Å; F164-L233 HydrophobicContact CE1-CB 4.22Å; F164-L233 HydrophobicContact CE1-CD2 3.83Å; F164-L233 HydrophobicContact CE2-CD2 3.86Å; F164-L233 HydrophobicContact CZ-CB 4.09Å; F164-L233 HydrophobicContact CZ-CD2 3.33Å; F164-L233 HydrophobicContact CZ-CG 4.29Å; L165-L233 HydrophobicContact CB-CD1 3.79Å; L165-L233 HydrophobicContact CB-CD2 4.28Å; P168-L233 HydrophobicContact CB-CD1 4.24Å; P168-L233 HydrophobicContact CG-CD1 3.78Å; L229-L233 WeakPolarHBondContact O-CB 3.49Å; L229-L233 WeakPolarHBondContact O-CD1 3.46Å; L229-L233 WeakPolarHBondContact O-CG 3.38Å; L229-L233 PolarHBondContact O-N 3.15Å; G231-L233 PolarHBondContact O-N 2.79Å; L233-F237 CarbonylContact O-C 2.98Å; L233-F237 PolarHBondContact O-N 3.34Å; L233-F237 VanDerWaalsContact O-N 3.14Å
234	G	88.6	Confident	90.6	Very high	35 Å²	35	36.6 Å²	36.6	36%	0.361	22%	0.215	S	C	.	.	H	α-helix	trans	-73.5	-37.6	177.8	0	0	0	0	0	113.7	S230 G231 L232	S230-G234 PolarHBondContact O-N 3.38Å; G231-G234 WeakPolarHBondContact O-CA 3.45Å; G231-G234 PolarHBondContact O-N 3.45Å; G231-G234 VanDerWaalsContact O-N 3.09Å; L232-G234 PolarHBondContact O-N 3.46Å
235	K	88.3	Confident	90.5	Very high	93 Å²	93	34.9 Å²	34.9	40%	0.404	21%	0.212	S	C	.	.	H	α-helix	trans	-69	-49.3	177.3	-171.9	-171.7	-176.9	-169.1	0	111.8	G231 L232 S511 D516	G231-K235 PolarHBondContact O-N 3.36Å; L232-K235 PolarHBondContact O-N 2.94Å; K235-S511 WeakPolarHBondContact CE-O 3.46Å; K235-S511 PolarHBondContact NZ-O 2.94Å; K235-S511 VanDerWaalsContact NZ-O 3.12Å; K235-D516 WeakPolarHBondContact CD-OD1 3.24Å; K235-D516 IonicContact NZ-OD1 3.32Å; K235-D516 PolarHBondContact NZ-OD1 2.95Å; K235-D516 IonicContact NZ-OD2 2.69Å; K235-D516 PolarHBondContact NZ-OD2 3.17Å
236	L	84.4	Confident	90.5	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-83.9	-29.1	-171.9	-59	-178.8	0	0	0	113.6	L232 L507 F512	L232-L236 HydrophobicContact CD1-CD1 3.65Å; L232-L236 HydrophobicContact CD1-CG 3.93Å; L232-L236 HydrophobicContact CD2-CD1 4.48Å; L232-L236 HydrophobicContact CG-CD1 3.74Å; L232-L236 HydrophobicContact CG-CG 4.26Å; L232-L236 WeakPolarHBondContact O-CB 3.36Å; L232-L236 WeakPolarHBondContact O-CG 3.23Å; L232-L236 PolarHBondContact O-N 3.12Å; L236-L507 HydrophobicContact CB-CD2 4.25Å; L236-L507 HydrophobicContact CD1-CD2 3.82Å; L236-L507 HydrophobicContact CG-CD2 4.47Å; L236-F512 HydrophobicContact CD1-CD2 3.87Å; L236-F512 HydrophobicContact CD2-CB 3.79Å; L236-F512 HydrophobicContact CD2-CD2 4.15Å; L236-F512 HydrophobicContact CD2-CG 4.45Å
237	F	86.6	Confident	90.4	Very high	14 Å²	14	33.6 Å²	33.6	6%	0.061	20%	0.204	C	C	.	.			trans	-135.6	60.8	-175.3	-55.7	-86.9	0	0	0	112.3	F156 F164 L233 G239 P240 A241 L505 L507	F156-F237 HydrophobicContact CD2-CD2 4.39Å; F156-F237 AromaticContact CD2-CE2 3.67Å; F156-F237 HydrophobicContact CD2-CE2 3.67Å; F156-F237 HydrophobicContact CD2-CZ 4.07Å; F156-F237 HydrophobicContact CE2-CD2 4.18Å; F156-F237 AromaticContact CE2-CE2 3.28Å; F156-F237 HydrophobicContact CE2-CE2 3.28Å; F156-F237 AromaticContact CE2-CZ 3.88Å; F156-F237 HydrophobicContact CE2-CZ 3.88Å; F156-F237 HydrophobicContact CZ-CE2 4.09Å; F164-F237 HydrophobicContact CE2-CB 3.85Å; F164-F237 HydrophobicContact CE2-CD1 4.48Å; F164-F237 AromaticContact CE2-CD2 3.97Å; F164-F237 HydrophobicContact CE2-CD2 3.97Å; F164-F237 AromaticContact CE2-CG 3.84Å; F164-F237 HydrophobicContact CE2-CG 3.84Å; F164-F237 HydrophobicContact CZ-CB 3.57Å; F164-F237 HydrophobicContact CZ-CD2 4.01Å; F164-F237 AromaticContact CZ-CG 3.96Å; F164-F237 HydrophobicContact CZ-CG 3.96Å; L233-F237 CarbonylContact O-C 2.98Å; L233-F237 PolarHBondContact O-N 3.34Å; L233-F237 VanDerWaalsContact O-N 3.14Å; F237-G239 VanDerWaalsContact C-N 3.28Å; F237-G239 PolarHBondContact O-N 2.94Å; F237-P240 HydrophobicContact CB-CB 4.11Å; F237-P240 HydrophobicContact CB-CG 4.01Å; F237-P240 WeakPolarHBondContact O-CD 3.28Å; F237-A241 WeakPolarHBondContact O-CB 3.33Å; F237-A241 PolarHBondContact O-N 3.38Å; F237-L505 HydrophobicContact CD1-CD2 3.71Å; F237-L505 HydrophobicContact CE1-CB 4.47Å; F237-L505 HydrophobicContact CE1-CD2 3.97Å; F237-L507 HydrophobicContact CE1-CD2 4.34Å; F237-L507 HydrophobicContact CE2-CD2 3.71Å; F237-L507 HydrophobicContact CZ-CD2 3.38Å; F237-L507 HydrophobicContact CZ-CG 3.82Å
238	P	87.4	Confident	90.1	Very high	87 Å²	87	31.4 Å²	31.4	57%	0.565	19%	0.188	S	C	*	.	H	α-helix	trans	-56.5	-39.4	-176.4	21.6	-33.2	0	0	0	113	R242	P238-R242 WeakPolarHBondContact O-CB 3.42Å; P238-R242 PolarHBondContact O-N 2.86Å
239	G	89.5	Confident	90	Very high	20 Å²	20	32.2 Å²	32.2	21%	0.206	19%	0.19	C	C	.	.	H	α-helix	trans	-60.5	-64.3	174.5	0	0	0	0	0	113	F237 A241 R242 A243 L272	F237-G239 VanDerWaalsContact C-N 3.28Å; F237-G239 PolarHBondContact O-N 2.94Å; G239-A241 VanDerWaalsContact C-N 3.31Å; G239-A241 PolarHBondContact O-N 3.34Å; G239-R242 PolarHBondContact O-N 2.9Å; G239-R242 VanDerWaalsContact O-N 3.17Å; G239-A243 WeakPolarHBondContact O-CB 3.34Å; G239-A243 PolarHBondContact O-N 3.19Å; G239-L272 CarbonylContact C-O 3.54Å
240	P	89.3	Confident	90	Very high	27 Å²	27	32.1 Å²	32.1	18%	0.175	19%	0.189	C	C	.	.	H	α-helix	trans	-55.9	-37.9	176.4	-28.9	35.4	0	0	0	114.8	F164 F237 S244 L505	F164-P240 HydrophobicContact CD1-CB 4.02Å; F164-P240 HydrophobicContact CD2-CB 3.92Å; F164-P240 HydrophobicContact CE1-CB 4.16Å; F164-P240 HydrophobicContact CE2-CB 4.05Å; F164-P240 HydrophobicContact CG-CB 3.91Å; F164-P240 HydrophobicContact CZ-CB 4.17Å; F237-P240 HydrophobicContact CB-CB 4.11Å; F237-P240 HydrophobicContact CB-CG 4.01Å; F237-P240 WeakPolarHBondContact O-CD 3.28Å; P240-S244 PolarHBondContact O-N 3.08Å; P240-L505 HydrophobicContact CB-CD2 4.44Å; P240-L505 HydrophobicContact CG-CD2 3.65Å
241	A	88.9	Confident	90	Very high	14 Å²	14	31.2 Å²	31.2	12%	0.116	18%	0.181	C	C	.	.	H	α-helix	trans	-63.7	-48.8	175	0	0	0	0	0	111.3	F164 F237 G239 S244 Q245	F164-A241 HydrophobicContact CE1-CB 4.02Å; F237-A241 WeakPolarHBondContact O-CB 3.33Å; F237-A241 PolarHBondContact O-N 3.38Å; G239-A241 VanDerWaalsContact C-N 3.31Å; G239-A241 PolarHBondContact O-N 3.34Å; A241-S244 PolarHBondContact O-N 3.08Å; A241-Q245 WeakPolarHBondContact O-CG 3.44Å; A241-Q245 PolarHBondContact O-N 2.76Å
242	R	90.6	Very high	90	Very high	92 Å²	92	34.8 Å²	34.8	35%	0.347	18%	0.18	S	C	.	.	H	α-helix	trans	-66.8	-38.9	177.5	-174	62.4	-174	135.5	9.4	111.9	P238 G239 S244 Q245 L246 E249 L272	P238-R242 WeakPolarHBondContact O-CB 3.42Å; P238-R242 PolarHBondContact O-N 2.86Å; G239-R242 PolarHBondContact O-N 2.9Å; G239-R242 VanDerWaalsContact O-N 3.17Å; R242-S244 VanDerWaalsContact C-N 3.31Å; R242-S244 PolarHBondContact O-N 3.41Å; R242-Q245 VanDerWaalsContact CD-OE1 3.23Å; R242-Q245 WeakPolarHBondContact O-CB 2.99Å; R242-Q245 PolarHBondContact O-N 3.11Å; R242-L246 HydrophobicContact CG-CD1 4.17Å; R242-L246 WeakPolarHBondContact O-CB 3.43Å; R242-L246 WeakPolarHBondContact O-CG 3.3Å; R242-L246 PolarHBondContact O-N 2.69Å; R242-E249 IonicContact CZ-OE1 2.93Å; R242-E249 IonicContact NH1-OE1 3.8Å; R242-E249 PolarHBondContact NH1-OE1 2.94Å; R242-E249 IonicContact NH2-OE1 2.69Å; R242-L272 HydrophobicContact CB-CD1 4.04Å; R242-L272 HydrophobicContact CG-CD1 3.69Å
243	A	92.8	Very high	90.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.8	-39.6	173.4	0	0	0	0	0	112	G239 R247 A269 L272 A273 L279	G239-A243 WeakPolarHBondContact O-CB 3.34Å; G239-A243 PolarHBondContact O-N 3.19Å; A243-R247 WeakPolarHBondContact O-CB 3.49Å; A243-R247 PolarHBondContact O-N 3Å; A243-A269 HydrophobicContact CB-CB 4.42Å; A243-L272 HydrophobicContact CB-CB 4.03Å; A243-A273 HydrophobicContact CB-CB 3.54Å; A243-L279 HydrophobicContact CB-CD1 4.36Å
244	S	89.9	Confident	90.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-72.2	-32.6	175.3	-168.7	0	0	0	0	113.2	S166 P240 A241 R242 R247 H248	S166-S244 WeakPolarHBondContact CB-OG 3.48Å; S166-S244 PolarHBondContact OG-OG 3.12Å; P240-S244 PolarHBondContact O-N 3.08Å; A241-S244 PolarHBondContact O-N 3.08Å; R242-S244 VanDerWaalsContact C-N 3.31Å; R242-S244 PolarHBondContact O-N 3.41Å; S244-R247 VanDerWaalsContact OG-CZ 3.32Å; S244-R247 PolarHBondContact OG-NH1 3.3Å; S244-R247 PolarHBondContact OG-NH2 2.93Å; S244-H248 PolarHBondContact O-CD2 3.33Å; S244-H248 PolarHBondContact O-N 2.88Å; S244-H248 VanDerWaalsContact O-N 3.09Å
245	Q	88.5	Confident	90.7	Very high	91 Å²	91	45.3 Å²	45.3	43%	0.425	21%	0.21	S	C	.	.	H	α-helix	trans	-61.6	-51.8	169.7	-68.7	172.1	3.5	0	0	110.8	A241 R242 R247 H248 E249	A241-Q245 WeakPolarHBondContact O-CG 3.44Å; A241-Q245 PolarHBondContact O-N 2.76Å; R242-Q245 VanDerWaalsContact CD-OE1 3.23Å; R242-Q245 WeakPolarHBondContact O-CB 2.99Å; R242-Q245 PolarHBondContact O-N 3.11Å; Q245-R247 VanDerWaalsContact C-N 3.31Å; Q245-R247 PolarHBondContact O-N 3.32Å; Q245-H248 CarbonylContact O-C 3.6Å; Q245-H248 WeakPolarHBondContact O-CA 3.37Å; Q245-H248 WeakPolarHBondContact O-CB 3.47Å; Q245-H248 PolarHBondContact O-N 3.05Å; Q245-E249 PolarHBondContact O-N 3.13Å
246	L	94	Very high	91	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-59.7	-39.1	177.1	-69.8	167.1	0	0	0	112.1	R242 H248 E249 G250 K265 E268 A269 L272	R242-L246 HydrophobicContact CG-CD1 4.17Å; R242-L246 WeakPolarHBondContact O-CB 3.43Å; R242-L246 WeakPolarHBondContact O-CG 3.3Å; R242-L246 PolarHBondContact O-N 2.69Å; L246-H248 PolarHBondContact O-N 3.01Å; L246-E249 PolarHBondContact O-N 2.86Å; L246-G250 PolarHBondContact O-N 3.38Å; L246-K265 HydrophobicContact CD2-CD 3.55Å; L246-E268 HydrophobicContact CD1-CB 3.83Å; L246-E268 HydrophobicContact CD2-CB 4.4Å; L246-E268 VanDerWaalsContact CD2-OE2 3.32Å; L246-E268 WeakPolarHBondContact CD2-OE2 3.23Å; L246-A269 HydrophobicContact CB-CB 3.76Å; L246-A269 HydrophobicContact CD1-CB 4.26Å; L246-L272 HydrophobicContact CD1-CD1 3.79Å
247	R	93	Very high	91.5	Very high	6 Å²	6	56 Å²	56	2%	0.023	25%	0.252	C	S	.	.	H	α-helix	trans	-58	-34.9	169.6	175.6	158.5	43.3	58.2	-11.8	111.9	A243 S244 Q245 N251 Y266 D276 L279	A243-R247 WeakPolarHBondContact O-CB 3.49Å; A243-R247 PolarHBondContact O-N 3Å; S244-R247 VanDerWaalsContact OG-CZ 3.32Å; S244-R247 PolarHBondContact OG-NH1 3.3Å; S244-R247 PolarHBondContact OG-NH2 2.93Å; Q245-R247 VanDerWaalsContact C-N 3.31Å; Q245-R247 PolarHBondContact O-N 3.32Å; R247-N251 VanDerWaalsContact O-CB 3.22Å; R247-N251 WeakPolarHBondContact O-CB 3.36Å; R247-N251 PolarHBondContact O-N 3.37Å; R247-N251 VanDerWaalsContact O-N 3.09Å; R247-N251 PolarHBondContact O-ND2 3.3Å; R247-Y266 HydrophobicContact CB-CE1 4.25Å; R247-Y266 HydrophobicContact CG-CE1 4Å; R247-Y266 PolarHBondContact O-OH 3.07Å; R247-D276 IonicContact CZ-OD2 3.22Å; R247-D276 VanDerWaalsContact CZ-OD2 3.28Å; R247-D276 IonicContact NE-OD2 2.75Å; R247-D276 PolarHBondContact NE-OD2 2.9Å; R247-D276 IonicContact NH2-OD2 2.75Å; R247-D276 PolarHBondContact NH2-OD2 2.9Å; R247-L279 HydrophobicContact CB-CD2 3.68Å; R247-L279 HydrophobicContact CG-CD2 4.15Å
248	H	88.9	Confident	91.9	Very high	35 Å²	35	60 Å²	60	16%	0.162	27%	0.271	C	S	.	.	H	α-helix	trans	-80.6	-34.6	177	-68.5	-36.6	0	0	0	113.3	S166 L180 S244 Q245 L246 N251 R252	S166-H248 PolarHBondContact OG-CD2 3.36Å; L180-H248 HydrophobicContact CD1-CB 4.22Å; S244-H248 PolarHBondContact O-CD2 3.33Å; S244-H248 PolarHBondContact O-N 2.88Å; S244-H248 VanDerWaalsContact O-N 3.09Å; Q245-H248 CarbonylContact O-C 3.6Å; Q245-H248 WeakPolarHBondContact O-CA 3.37Å; Q245-H248 WeakPolarHBondContact O-CB 3.47Å; Q245-H248 PolarHBondContact O-N 3.05Å; L246-H248 PolarHBondContact O-N 3.01Å; H248-N251 PolarHBondContact O-N 3.38Å; H248-R252 PolarHBondContact O-N 2.84Å; H248-R252 VanDerWaalsContact O-N 3.14Å
249	E	91.8	Very high	92.3	Very high	52 Å²	52	56.7 Å²	56.7	24%	0.243	25%	0.249	C	C	.	.	H	α-helix	trans	-60.8	-52.4	168.9	-66.7	172.6	-143.9	0	0	111.1	R242 Q245 L246 N251 R252 L253	R242-E249 IonicContact CZ-OE1 2.93Å; R242-E249 IonicContact NH1-OE1 3.8Å; R242-E249 PolarHBondContact NH1-OE1 2.94Å; R242-E249 IonicContact NH2-OE1 2.69Å; Q245-E249 PolarHBondContact O-N 3.13Å; L246-E249 PolarHBondContact O-N 2.86Å; E249-N251 VanDerWaalsContact C-N 3.35Å; E249-N251 PolarHBondContact O-N 2.77Å; E249-R252 WeakPolarHBondContact O-CA 3.49Å; E249-R252 VanDerWaalsContact O-CB 3.25Å; E249-R252 WeakPolarHBondContact O-CB 3.37Å; E249-R252 PolarHBondContact O-N 2.9Å; E249-L253 PolarHBondContact O-N 3.12Å
250	G	94.6	Very high	92.6	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.1	-36.2	176	0	0	0	0	0	113.3	L246 R252 Y254	L246-G250 PolarHBondContact O-N 3.38Å; G250-R252 PolarHBondContact O-N 3.39Å; G250-Y254 VanDerWaalsContact O-CB 3.3Å; G250-Y254 WeakPolarHBondContact O-CB 3.47Å; G250-Y254 PolarHBondContact O-N 2.96Å
251	N	91.6	Very high	92.9	Very high	29 Å²	29	61.6 Å²	61.6	16%	0.155	27%	0.27	C	S	.	.	H	α-helix	trans	-64.9	-14	168.8	-95.6	-80.2	0	0	0	113.6	R247 H248 E249 R255 Y266 N282	R247-N251 VanDerWaalsContact O-CB 3.22Å; R247-N251 WeakPolarHBondContact O-CB 3.36Å; R247-N251 PolarHBondContact O-N 3.37Å; R247-N251 VanDerWaalsContact O-N 3.09Å; R247-N251 PolarHBondContact O-ND2 3.3Å; H248-N251 PolarHBondContact O-N 3.38Å; E249-N251 VanDerWaalsContact C-N 3.35Å; E249-N251 PolarHBondContact O-N 2.77Å; N251-R255 PolarHBondContact O-NE 2.87Å; N251-R255 PolarHBondContact O-NH2 3.07Å; N251-Y266 PolarHBondContact ND2-OH 3.38Å; N251-N282 PolarHBondContact ND2-ND2 2.97Å
252	R	92.1	Very high	93.3	Very high	121 Å²	121	61 Å²	61	46%	0.457	27%	0.265	S	S	.	.	H	α-helix	trans	-90.1	-54.8	173.5	-169.4	-170	63.1	-146.1	-7.7	110.3	H248 E249 G250 Y254 R255 E256	H248-R252 PolarHBondContact O-N 2.84Å; H248-R252 VanDerWaalsContact O-N 3.14Å; E249-R252 WeakPolarHBondContact O-CA 3.49Å; E249-R252 VanDerWaalsContact O-CB 3.25Å; E249-R252 WeakPolarHBondContact O-CB 3.37Å; E249-R252 PolarHBondContact O-N 2.9Å; G250-R252 PolarHBondContact O-N 3.39Å; R252-Y254 VanDerWaalsContact C-N 3.27Å; R252-Y254 PolarHBondContact O-N 3.27Å; R252-R255 VanDerWaalsContact CA-NH2 3.3Å; R252-R255 WeakPolarHBondContact O-CA 3.39Å; R252-R255 WeakPolarHBondContact O-CB 3.45Å; R252-R255 PolarHBondContact O-N 2.98Å; R252-E256 WeakPolarHBondContact CD-OE1 3.43Å; R252-E256 WeakPolarHBondContact CG-OE1 3.45Å; R252-E256 WeakPolarHBondContact CG-OE2 3.31Å; R252-E256 IonicContact NE-OE1 3.72Å; R252-E256 IonicContact NE-OE2 3.92Å; R252-E256 PolarHBondContact O-N 2.95Å
253	L	95.7	Very high	93.6	Very high	22 Å²	22	57.8 Å²	57.8	12%	0.115	26%	0.255	C	S	.	.	H	α-helix	trans	-53	-43.1	178.2	-63.5	168.9	0	0	0	112.2	E249 R255 E256 R257 Q258 A261 A262 K265	E249-L253 PolarHBondContact O-N 3.12Å; L253-R255 VanDerWaalsContact C-N 3.33Å; L253-R255 PolarHBondContact O-N 3.26Å; L253-E256 CarbonylContact O-C 3.48Å; L253-E256 VanDerWaalsContact O-C 3.32Å; L253-E256 WeakPolarHBondContact O-CA 3.41Å; L253-E256 WeakPolarHBondContact O-CB 3.41Å; L253-E256 PolarHBondContact O-N 2.97Å; L253-R257 PolarHBondContact O-N 3.26Å; L253-R257 VanDerWaalsContact O-N 3.12Å; L253-Q258 HydrophobicContact CB-CB 4.31Å; L253-Q258 PolarHBondContact O-N 3.33Å; L253-A261 HydrophobicContact CD1-CB 4.07Å; L253-A261 HydrophobicContact CD2-CB 4.49Å; L253-A262 HydrophobicContact CB-CB 3.92Å; L253-K265 HydrophobicContact CD1-CG 3.88Å
254	Y	94.5	Very high	93.8	Very high	80 Å²	80	63.1 Å²	63.1	31%	0.314	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-32	176.3	-176.5	-97.8	0	0	0	113.9	G250 R252 R257 V259 I286 T289	G250-Y254 VanDerWaalsContact O-CB 3.3Å; G250-Y254 WeakPolarHBondContact O-CB 3.47Å; G250-Y254 PolarHBondContact O-N 2.96Å; R252-Y254 VanDerWaalsContact C-N 3.27Å; R252-Y254 PolarHBondContact O-N 3.27Å; Y254-R257 PolarHBondContact O-N 3.09Å; Y254-V259 HydrophobicContact CD2-CG1 4.47Å; Y254-I286 HydrophobicContact CD2-CD1 4.42Å; Y254-I286 HydrophobicContact CD2-CG1 3.66Å; Y254-I286 HydrophobicContact CE2-CG1 3.96Å; Y254-I286 HydrophobicContact CG-CG1 4.46Å; Y254-T289 HydrophobicContact CE2-CG2 4.21Å; Y254-T289 PolarHBondContact OH-OG1 3.14Å; Y254-T289 VanDerWaalsContact OH-OG1 3.07Å
255	R	92.6	Very high	94.2	Very high	164 Å²	164	65.6 Å²	65.6	62%	0.619	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-28.1	172.6	-75	179.7	-71.3	118	-1.2	112.4	N251 R252 L253 R257	N251-R255 PolarHBondContact O-NE 2.87Å; N251-R255 PolarHBondContact O-NH2 3.07Å; R252-R255 VanDerWaalsContact CA-NH2 3.3Å; R252-R255 WeakPolarHBondContact O-CA 3.39Å; R252-R255 WeakPolarHBondContact O-CB 3.45Å; R252-R255 PolarHBondContact O-N 2.98Å; L253-R255 VanDerWaalsContact C-N 3.33Å; L253-R255 PolarHBondContact O-N 3.26Å; R255-R257 PolarHBondContact O-N 2.93Å
256	E	95.1	Very high	94.6	Very high	98 Å²	98	61.4 Å²	61.4	46%	0.458	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	7.5	172.4	-70.3	154.3	-179.7	0	0	112	R252 L253 Q258	R252-E256 WeakPolarHBondContact CD-OE1 3.43Å; R252-E256 WeakPolarHBondContact CG-OE1 3.45Å; R252-E256 WeakPolarHBondContact CG-OE2 3.31Å; R252-E256 IonicContact NE-OE1 3.72Å; R252-E256 IonicContact NE-OE2 3.92Å; R252-E256 PolarHBondContact O-N 2.95Å; L253-E256 CarbonylContact O-C 3.48Å; L253-E256 VanDerWaalsContact O-C 3.32Å; L253-E256 WeakPolarHBondContact O-CA 3.41Å; L253-E256 WeakPolarHBondContact O-CB 3.41Å; L253-E256 PolarHBondContact O-N 2.97Å; E256-Q258 PolarHBondContact O-N 3.18Å
257	R	93.8	Very high	94.7	Very high	221 Å²	221	63.4 Å²	63.4	83%	0.834	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	16.4	-177.9	-59.1	180	176.8	-104.8	6.2	115.3	L253 Y254 R255 V259	L253-R257 PolarHBondContact O-N 3.26Å; L253-R257 VanDerWaalsContact O-N 3.12Å; Y254-R257 PolarHBondContact O-N 3.09Å; R255-R257 PolarHBondContact O-N 2.93Å; R257-V259 PolarHBondContact O-N 3.35Å
258	Q	96.2	Very high	94.9	Very high	99 Å²	99	66.6 Å²	66.6	46%	0.463	30%	0.299	S	S	.	.			trans	-89.6	79.8	173.9	-59.9	-178.8	6.5	0	0	108.9	L253 E256 A261 A262	L253-Q258 HydrophobicContact CB-CB 4.31Å; L253-Q258 PolarHBondContact O-N 3.33Å; E256-Q258 PolarHBondContact O-N 3.18Å; Q258-A261 HydrophobicContact CB-CB 4.08Å; Q258-A262 WeakPolarHBondContact O-CB 3.3Å; Q258-A262 PolarHBondContact O-N 3.11Å
259	V	95.9	Very high	95.2	Very high	18 Å²	18	65 Å²	65	11%	0.109	29%	0.292	C	S	.	.	H	α-helix	trans	-74.3	-37.8	-166.1	-174.9	0	0	0	0	111.6	Y254 R257 A262 L263 I286 T289 L290	Y254-V259 HydrophobicContact CD2-CG1 4.47Å; R257-V259 PolarHBondContact O-N 3.35Å; V259-A262 WeakPolarHBondContact O-CB 3.4Å; V259-A262 PolarHBondContact O-N 3Å; V259-L263 PolarHBondContact O-N 3.49Å; V259-I286 HydrophobicContact CG1-CG2 3.84Å; V259-T289 HydrophobicContact CG1-CG2 4.18Å; V259-T289 HydrophobicContact CG2-CG2 4.17Å; V259-L290 HydrophobicContact CB-CD2 4.15Å; V259-L290 HydrophobicContact CG1-CD1 4.1Å; V259-L290 HydrophobicContact CG1-CD2 3.68Å; V259-L290 HydrophobicContact CG1-CG 3.67Å
260	E	95.3	Very high	95.4	Very high	116 Å²	116	63.1 Å²	63.1	54%	0.542	28%	0.284	S	S	.	.	H	α-helix	trans	-72.3	-44.2	-179.7	-50.9	67.5	-145.6	0	0	110.1	A262 L263 L264 L290	E260-A262 VanDerWaalsContact C-N 3.28Å; E260-A262 PolarHBondContact O-N 3.18Å; E260-L263 WeakPolarHBondContact O-CB 3.46Å; E260-L263 PolarHBondContact O-N 2.92Å; E260-L263 VanDerWaalsContact O-N 3.11Å; E260-L264 PolarHBondContact O-N 2.86Å; E260-L290 HydrophobicContact CG-CD2 4.45Å; E260-L290 WeakPolarHBondContact OE1-CD2 3.48Å
261	A	96.1	Very high	95.4	Very high	34 Å²	34	71.7 Å²	71.7	28%	0.281	32%	0.321	S	S	.	.	H	α-helix	trans	-63.2	-35.7	173.5	0	0	0	0	0	111.6	L253 Q258 K265	L253-A261 HydrophobicContact CD1-CB 4.07Å; L253-A261 HydrophobicContact CD2-CB 4.49Å; Q258-A261 HydrophobicContact CB-CB 4.08Å; A261-K265 PolarHBondContact O-N 3.26Å
262	A	97.1	Very high	95.4	Very high	0 Å²	0	74 Å²	74	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-65.3	-42.9	170.9	0	0	0	0	0	111.8	L253 Q258 V259 E260 L264 K265 Y266 I286	L253-A262 HydrophobicContact CB-CB 3.92Å; Q258-A262 WeakPolarHBondContact O-CB 3.3Å; Q258-A262 PolarHBondContact O-N 3.11Å; V259-A262 WeakPolarHBondContact O-CB 3.4Å; V259-A262 PolarHBondContact O-N 3Å; E260-A262 VanDerWaalsContact C-N 3.28Å; E260-A262 PolarHBondContact O-N 3.18Å; A262-L264 PolarHBondContact O-N 3.42Å; A262-K265 PolarHBondContact O-N 3.38Å; A262-Y266 VanDerWaalsContact O-CD2 3.3Å; A262-Y266 WeakPolarHBondContact O-CD2 3.4Å; A262-Y266 PolarHBondContact O-N 3.08Å; A262-I286 HydrophobicContact CB-CD1 3.84Å
263	L	97.1	Very high	95.3	Very high	26 Å²	26	68.8 Å²	68.8	14%	0.136	32%	0.316	C	S	.	.	H	α-helix	trans	-57.3	-46.9	177.2	-178	54.6	0	0	0	111.8	V259 E260 K265 Y266 N267 R283 I286 Y287 L290	V259-L263 PolarHBondContact O-N 3.49Å; E260-L263 WeakPolarHBondContact O-CB 3.46Å; E260-L263 PolarHBondContact O-N 2.92Å; E260-L263 VanDerWaalsContact O-N 3.11Å; L263-K265 VanDerWaalsContact C-N 3.31Å; L263-K265 PolarHBondContact O-N 3.41Å; L263-Y266 PolarHBondContact O-N 2.88Å; L263-Y266 VanDerWaalsContact O-N 3.13Å; L263-N267 PolarHBondContact O-N 2.82Å; L263-R283 HydrophobicContact CD1-CG 3.62Å; L263-I286 HydrophobicContact CB-CG2 3.72Å; L263-I286 HydrophobicContact CD1-CG2 4.09Å; L263-I286 HydrophobicContact CG-CG2 4.36Å; L263-Y287 HydrophobicContact CD1-CD1 4.48Å; L263-Y287 HydrophobicContact CD1-CE1 3.97Å; L263-Y287 HydrophobicContact CD1-CE2 4.1Å; L263-Y287 HydrophobicContact CD2-CD1 4.41Å; L263-Y287 HydrophobicContact CD2-CE1 3.88Å; L263-L290 HydrophobicContact CD2-CD1 3.83Å
264	L	96.9	Very high	95.1	Very high	111 Å²	111	69.8 Å²	69.8	58%	0.581	32%	0.324	S	S	*	.	H	α-helix	trans	-55.5	-45.9	176	-67.8	175.5	0	0	0	111.7	E260 A262 Y266 N267 E268	E260-L264 PolarHBondContact O-N 2.86Å; A262-L264 PolarHBondContact O-N 3.42Å; L264-Y266 VanDerWaalsContact C-N 3.34Å; L264-Y266 PolarHBondContact O-N 3.25Å; L264-N267 PolarHBondContact O-N 3.42Å; L264-N267 VanDerWaalsContact O-N 3.15Å; L264-E268 PolarHBondContact O-N 3.17Å
265	K	97.7	Very high	94.8	Very high	52 Å²	52	70 Å²	70	23%	0.226	33%	0.331	C	S	.	.	H	α-helix	trans	-67	-30.3	178.3	-67.2	-68.5	164.7	-135.7	0	113.8	L246 L253 A261 A262 L263 E268 A269	L246-K265 HydrophobicContact CD2-CD 3.55Å; L253-K265 HydrophobicContact CD1-CG 3.88Å; A261-K265 PolarHBondContact O-N 3.26Å; A262-K265 PolarHBondContact O-N 3.38Å; L263-K265 VanDerWaalsContact C-N 3.31Å; L263-K265 PolarHBondContact O-N 3.41Å; K265-E268 IonicContact NZ-OE1 3.26Å; K265-E268 PolarHBondContact NZ-OE1 3.25Å; K265-E268 IonicContact NZ-OE2 3.24Å; K265-E268 PolarHBondContact NZ-OE2 3.13Å; K265-A269 WeakPolarHBondContact O-CB 3.36Å; K265-A269 PolarHBondContact O-N 3.35Å
266	Y	96.6	Very high	94.6	Very high	4 Å²	4	63.1 Å²	63.1	2%	0.016	31%	0.306	C	S	.	.	H	α-helix	trans	-74.6	-33.7	170.2	-82	-76.7	0	0	0	113.1	R247 N251 A262 L263 L264 A269 V270 L279 N282 R283 I286	R247-Y266 HydrophobicContact CB-CE1 4.25Å; R247-Y266 HydrophobicContact CG-CE1 4Å; R247-Y266 PolarHBondContact O-OH 3.07Å; N251-Y266 PolarHBondContact ND2-OH 3.38Å; A262-Y266 VanDerWaalsContact O-CD2 3.3Å; A262-Y266 WeakPolarHBondContact O-CD2 3.4Å; A262-Y266 PolarHBondContact O-N 3.08Å; L263-Y266 PolarHBondContact O-N 2.88Å; L263-Y266 VanDerWaalsContact O-N 3.13Å; L264-Y266 VanDerWaalsContact C-N 3.34Å; L264-Y266 PolarHBondContact O-N 3.25Å; Y266-A269 PolarHBondContact O-N 3.18Å; Y266-V270 WeakPolarHBondContact O-CB 3.42Å; Y266-V270 VanDerWaalsContact O-CG2 3.32Å; Y266-V270 WeakPolarHBondContact O-CG2 3.47Å; Y266-V270 PolarHBondContact O-N 2.97Å; Y266-L279 HydrophobicContact CD1-CD2 4.04Å; Y266-L279 HydrophobicContact CE1-CD2 4.09Å; Y266-N282 HydrophobicContact CD1-CB 4.36Å; Y266-N282 HydrophobicContact CE1-CB 3.54Å; Y266-N282 HydrophobicContact CE2-CB 4.25Å; Y266-N282 VanDerWaalsContact CZ-CB 3.46Å; Y266-N282 VanDerWaalsContact OH-CB 3.31Å; Y266-N282 WeakPolarHBondContact OH-CB 3.15Å; Y266-N282 PolarHBondContact OH-ND2 3.3Å; Y266-N282 VanDerWaalsContact OH-ND2 3.1Å; Y266-R283 HydrophobicContact CG-CB 4.27Å; Y266-I286 HydrophobicContact CD2-CD1 3.28Å; Y266-I286 HydrophobicContact CE2-CD1 3.5Å; Y266-I286 VanDerWaalsContact CE2-CD1 3.5Å; Y266-I286 HydrophobicContact CG-CD1 4.3Å
267	N	96.9	Very high	94.4	Very high	43 Å²	43	59.5 Å²	59.5	23%	0.23	29%	0.289	C	S	.	.	H	α-helix	trans	-67.1	-37.8	173.8	-72.4	-19	0	0	0	112.2	L263 L264 K271 R283	L263-N267 PolarHBondContact O-N 2.82Å; L264-N267 PolarHBondContact O-N 3.42Å; L264-N267 VanDerWaalsContact O-N 3.15Å; N267-K271 WeakPolarHBondContact O-CG 3.48Å; N267-R283 WeakPolarHBondContact OD1-CD 3.39Å; N267-R283 PolarHBondContact OD1-NH1 3.25Å
268	E	96.7	Very high	94.3	Very high	74 Å²	74	50.3 Å²	50.3	35%	0.346	26%	0.256	S	S	.	.	H	α-helix	trans	-61.4	-47.5	167.7	-71	167.9	-139.5	0	0	111.2	L246 L264 K265 K271	L246-E268 HydrophobicContact CD1-CB 3.83Å; L246-E268 HydrophobicContact CD2-CB 4.4Å; L246-E268 VanDerWaalsContact CD2-OE2 3.32Å; L246-E268 WeakPolarHBondContact CD2-OE2 3.23Å; L264-E268 PolarHBondContact O-N 3.17Å; K265-E268 IonicContact NZ-OE1 3.26Å; K265-E268 PolarHBondContact NZ-OE1 3.25Å; K265-E268 IonicContact NZ-OE2 3.24Å; K265-E268 PolarHBondContact NZ-OE2 3.13Å; E268-K271 PolarHBondContact O-N 3.03Å
269	A	95.3	Very high	94.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.6	-41.5	-176.4	0	0	0	0	0	113.5	A243 L246 K265 Y266 K271 L272 A273 L279	A243-A269 HydrophobicContact CB-CB 4.42Å; L246-A269 HydrophobicContact CB-CB 3.76Å; L246-A269 HydrophobicContact CD1-CB 4.26Å; K265-A269 WeakPolarHBondContact O-CB 3.36Å; K265-A269 PolarHBondContact O-N 3.35Å; Y266-A269 PolarHBondContact O-N 3.18Å; A269-K271 VanDerWaalsContact C-N 3.3Å; A269-K271 PolarHBondContact O-N 2.7Å; A269-L272 PolarHBondContact O-N 3.07Å; A269-A273 PolarHBondContact O-N 3.07Å; A269-A273 VanDerWaalsContact O-N 3.1Å; A269-L279 HydrophobicContact CB-CD1 4.06Å; A269-L279 HydrophobicContact CB-CD2 3.59Å; A269-L279 HydrophobicContact CB-CG 4.46Å; A269-L279 WeakPolarHBondContact O-CD1 3.45Å
270	V	95.1	Very high	94.3	Very high	14 Å²	14	45.9 Å²	45.9	9%	0.085	23%	0.233	C	C	.	.	H	α-helix	trans	-61.7	-38.3	-179.9	165.5	0	0	0	0	111.2	Y266 L272 A273 P274 L279 Y280	Y266-V270 WeakPolarHBondContact O-CB 3.42Å; Y266-V270 VanDerWaalsContact O-CG2 3.32Å; Y266-V270 WeakPolarHBondContact O-CG2 3.47Å; Y266-V270 PolarHBondContact O-N 2.97Å; V270-L272 PolarHBondContact O-N 3.36Å; V270-A273 CarbonylContact O-C 3.58Å; V270-A273 PolarHBondContact O-N 3.44Å; V270-P274 WeakPolarHBondContact O-CA 3.37Å; V270-P274 WeakPolarHBondContact O-CD 3.34Å; V270-P274 VanDerWaalsContact O-N 3.12Å; V270-L279 HydrophobicContact CG2-CB 3.74Å; V270-L279 HydrophobicContact CG2-CD1 4.32Å; V270-Y280 HydrophobicContact CG1-CE1 4Å; V270-Y280 HydrophobicContact CG1-CE2 4.2Å; V270-Y280 WeakPolarHBondContact CG1-OH 3.44Å; V270-Y280 HydrophobicContact CG2-CE2 4.37Å
271	K	95	Very high	94.3	Very high	180 Å²	180	40.5 Å²	40.5	78%	0.783	21%	0.209	S	C	*	.	H	α-helix	trans	-62	-28.9	174.6	-68.8	175.3	179.5	-172.5	0	113.3	N267 E268 A269	N267-K271 WeakPolarHBondContact O-CG 3.48Å; E268-K271 PolarHBondContact O-N 3.03Å; A269-K271 VanDerWaalsContact C-N 3.3Å; A269-K271 PolarHBondContact O-N 2.7Å
272	L	92.4	Very high	94.2	Very high	76 Å²	76	40.1 Å²	40.1	40%	0.398	20%	0.202	S	C	.	.	H	α-helix	trans	-93.1	-15	-177.8	-64.4	176.9	0	0	0	114.1	G239 R242 A243 L246 A269 V270	G239-L272 CarbonylContact C-O 3.54Å; R242-L272 HydrophobicContact CB-CD1 4.04Å; R242-L272 HydrophobicContact CG-CD1 3.69Å; A243-L272 HydrophobicContact CB-CB 4.03Å; L246-L272 HydrophobicContact CD1-CD1 3.79Å; A269-L272 PolarHBondContact O-N 3.07Å; V270-L272 PolarHBondContact O-N 3.36Å
273	A	89.6	Confident	94.2	Very high	13 Å²	13	41.7 Å²	41.7	11%	0.107	21%	0.208	C	C	.	.			trans	-156	70	177.8	0	0	0	0	0	111.7	A243 A269 V270 N275 D276 L279	A243-A273 HydrophobicContact CB-CB 3.54Å; A269-A273 PolarHBondContact O-N 3.07Å; A269-A273 VanDerWaalsContact O-N 3.1Å; V270-A273 CarbonylContact O-C 3.58Å; V270-A273 PolarHBondContact O-N 3.44Å; A273-N275 PolarHBondContact O-N 3.24Å; A273-D276 HydrophobicContact CB-CB 4.33Å; A273-D276 PolarHBondContact O-N 3.08Å; A273-L279 HydrophobicContact CB-CD1 4.1Å; A273-L279 WeakPolarHBondContact O-CD1 3.05Å
274	P	90.5	Very high	94.2	Very high	43 Å²	43	40.5 Å²	40.5	28%	0.279	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-2.8	-177	28.6	-36.7	0	0	0	114.2	V270 Y280 P503	V270-P274 WeakPolarHBondContact O-CA 3.37Å; V270-P274 WeakPolarHBondContact O-CD 3.34Å; V270-P274 VanDerWaalsContact O-N 3.12Å; P274-Y280 WeakPolarHBondContact O-CE2 3.42Å; P274-Y280 PolarHBondContact O-OH 3.11Å; P274-P503 HydrophobicContact CG-CG 3.59Å
275	N	88.4	Confident	94.2	Very high	85 Å²	85	36.7 Å²	36.7	46%	0.455	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	1.1	175	-69	-45.8	0	0	0	114.2	A273 H277 P503	A273-N275 PolarHBondContact O-N 3.24Å; N275-H277 PolarHBondContact O-N 3.22Å; N275-P503 PolarHBondContact ND2-O 3.01Å
276	D	88.9	Confident	94.1	Very high	18 Å²	18	34.3 Å²	34.3	10%	0.096	17%	0.171	C	C	.	.			trans	-82.7	99	171.3	-178.3	6.7	0	0	0	111.1	R247 A273 L278 L279	R247-D276 IonicContact CZ-OD2 3.22Å; R247-D276 VanDerWaalsContact CZ-OD2 3.28Å; R247-D276 IonicContact NE-OD2 2.75Å; R247-D276 PolarHBondContact NE-OD2 2.9Å; R247-D276 IonicContact NH2-OD2 2.75Å; R247-D276 PolarHBondContact NH2-OD2 2.9Å; A273-D276 HydrophobicContact CB-CB 4.33Å; A273-D276 PolarHBondContact O-N 3.08Å; D276-L278 PolarHBondContact O-N 3.3Å; D276-L278 VanDerWaalsContact OD1-CB 3.23Å; D276-L278 WeakPolarHBondContact OD1-CB 3.33Å; D276-L278 WeakPolarHBondContact OD1-CG 3.43Å; D276-L278 PolarHBondContact OD1-N 2.86Å; D276-L279 HydrophobicContact CB-CD1 3.89Å; D276-L279 HydrophobicContact CB-CG 3.89Å; D276-L279 WeakPolarHBondContact O-CB 3.39Å; D276-L279 PolarHBondContact O-N 3.29Å
277	H	90.4	Very high	94.2	Very high	22 Å²	22	36 Å²	36	10%	0.102	18%	0.177	C	C	.	.	H	α-helix	trans	-53.9	-20.9	176.4	73.8	76.6	0	0	0	114.4	N275 L279 S281 L306 R307	N275-H277 PolarHBondContact O-N 3.22Å; H277-L279 VanDerWaalsContact C-N 3.32Å; H277-S281 WeakPolarHBondContact O-CB 3.37Å; H277-S281 PolarHBondContact O-N 3.35Å; H277-S281 VanDerWaalsContact O-N 3.15Å; H277-L306 HydrophobicContact CB-CB 3.78Å; H277-L306 HydrophobicContact CB-CD1 4.38Å; H277-R307 HydrophobicContact CB-CB 4.18Å; H277-R307 PolarHBondContact NE2-NH1 3.01Å
278	L	91.9	Very high	94.1	Very high	28 Å²	28	35.7 Å²	35.7	15%	0.147	17%	0.174	C	C	.	.	H	α-helix	trans	-73.4	-22.2	175.5	-62.3	178.2	0	0	0	113.2	C161 D276 N282	C161-L278 HydrophobicContact CB-CD1 3.96Å; D276-L278 PolarHBondContact O-N 3.3Å; D276-L278 VanDerWaalsContact OD1-CB 3.23Å; D276-L278 WeakPolarHBondContact OD1-CB 3.33Å; D276-L278 WeakPolarHBondContact OD1-CG 3.43Å; D276-L278 PolarHBondContact OD1-N 2.86Å; L278-N282 VanDerWaalsContact O-CB 3.32Å; L278-N282 WeakPolarHBondContact O-CB 3.17Å; L278-N282 PolarHBondContact O-N 3.41Å; L278-N282 PolarHBondContact O-ND2 3.06Å; L278-N282 VanDerWaalsContact O-ND2 3.14Å
279	L	94.8	Very high	94.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-72.2	-63.5	177.7	-62.1	177.9	0	0	0	110	A243 R247 Y266 A269 V270 A273 D276 H277 S281 N282 R283	A243-L279 HydrophobicContact CB-CD1 4.36Å; R247-L279 HydrophobicContact CB-CD2 3.68Å; R247-L279 HydrophobicContact CG-CD2 4.15Å; Y266-L279 HydrophobicContact CD1-CD2 4.04Å; Y266-L279 HydrophobicContact CE1-CD2 4.09Å; A269-L279 HydrophobicContact CB-CD1 4.06Å; A269-L279 HydrophobicContact CB-CD2 3.59Å; A269-L279 HydrophobicContact CB-CG 4.46Å; A269-L279 WeakPolarHBondContact O-CD1 3.45Å; V270-L279 HydrophobicContact CG2-CB 3.74Å; V270-L279 HydrophobicContact CG2-CD1 4.32Å; A273-L279 HydrophobicContact CB-CD1 4.1Å; A273-L279 WeakPolarHBondContact O-CD1 3.05Å; D276-L279 HydrophobicContact CB-CD1 3.89Å; D276-L279 HydrophobicContact CB-CG 3.89Å; D276-L279 WeakPolarHBondContact O-CB 3.39Å; D276-L279 PolarHBondContact O-N 3.29Å; H277-L279 VanDerWaalsContact C-N 3.32Å; L279-S281 VanDerWaalsContact C-N 3.3Å; L279-S281 PolarHBondContact O-N 2.9Å; L279-N282 PolarHBondContact O-N 2.88Å; L279-R283 WeakPolarHBondContact O-CB 3.2Å; L279-R283 PolarHBondContact O-N 3.15Å
280	Y	96.5	Very high	94.1	Very high	24 Å²	24	38 Å²	38	9%	0.094	19%	0.191	C	C	.	.	H	α-helix	trans	-51.4	-47.7	175	-64.3	-90.8	0	0	0	111.7	V270 P274 N282 R283 S284 D299 I302 L306	V270-Y280 HydrophobicContact CG1-CE1 4Å; V270-Y280 HydrophobicContact CG1-CE2 4.2Å; V270-Y280 WeakPolarHBondContact CG1-OH 3.44Å; V270-Y280 HydrophobicContact CG2-CE2 4.37Å; P274-Y280 WeakPolarHBondContact O-CE2 3.42Å; P274-Y280 PolarHBondContact O-OH 3.11Å; Y280-N282 VanDerWaalsContact C-N 3.31Å; Y280-N282 PolarHBondContact O-N 3.37Å; Y280-R283 PolarHBondContact O-N 2.7Å; Y280-S284 WeakPolarHBondContact O-CB 3.48Å; Y280-S284 PolarHBondContact O-N 2.75Å; Y280-D299 WeakPolarHBondContact CB-O 3.04Å; Y280-D299 WeakPolarHBondContact CD1-OD1 3.37Å; Y280-I302 HydrophobicContact CD1-CB 3.82Å; Y280-I302 HydrophobicContact CD1-CD1 3.86Å; Y280-I302 HydrophobicContact CD1-CG1 4.46Å; Y280-I302 HydrophobicContact CD1-CG2 3.53Å; Y280-I302 HydrophobicContact CD2-CG2 4Å; Y280-I302 HydrophobicContact CE1-CB 4.25Å; Y280-I302 HydrophobicContact CE1-CD1 3.73Å; Y280-I302 HydrophobicContact CE1-CG2 3.65Å; Y280-I302 HydrophobicContact CE2-CG2 4.13Å; Y280-I302 HydrophobicContact CG-CB 4.19Å; Y280-I302 HydrophobicContact CG-CG2 3.7Å; Y280-L306 HydrophobicContact CD2-CD1 3.93Å; Y280-L306 HydrophobicContact CE2-CD1 4.07Å
281	S	95.3	Very high	94.1	Very high	4 Å²	4	45 Å²	45	3%	0.028	22%	0.222	C	C	.	.	H	α-helix	trans	-60	-40	178.4	-164.9	0	0	0	0	112.2	H277 L279 R316	H277-S281 WeakPolarHBondContact O-CB 3.37Å; H277-S281 PolarHBondContact O-N 3.35Å; H277-S281 VanDerWaalsContact O-N 3.15Å; L279-S281 VanDerWaalsContact C-N 3.3Å; L279-S281 PolarHBondContact O-N 2.9Å; S281-R316 WeakPolarHBondContact O-CD 3.22Å; S281-R316 PolarHBondContact O-NE 3.25Å; S281-R316 PolarHBondContact O-NH1 3.09Å; S281-R316 WeakPolarHBondContact OG-CD 3.3Å; S281-R316 PolarHBondContact OG-NH1 3.41Å
282	N	94.9	Very high	94.1	Very high	25 Å²	25	38.3 Å²	38.3	13%	0.134	20%	0.199	C	C	.	.	H	α-helix	trans	-78.4	-30.3	177.9	-70.1	-19.2	0	0	0	113.3	N251 Y266 L278 L279 Y280 Q285 I286 R316	N251-N282 PolarHBondContact ND2-ND2 2.97Å; Y266-N282 HydrophobicContact CD1-CB 4.36Å; Y266-N282 HydrophobicContact CE1-CB 3.54Å; Y266-N282 HydrophobicContact CE2-CB 4.25Å; Y266-N282 VanDerWaalsContact CZ-CB 3.46Å; Y266-N282 VanDerWaalsContact OH-CB 3.31Å; Y266-N282 WeakPolarHBondContact OH-CB 3.15Å; Y266-N282 PolarHBondContact OH-ND2 3.3Å; Y266-N282 VanDerWaalsContact OH-ND2 3.1Å; L278-N282 VanDerWaalsContact O-CB 3.32Å; L278-N282 WeakPolarHBondContact O-CB 3.17Å; L278-N282 PolarHBondContact O-N 3.41Å; L278-N282 PolarHBondContact O-ND2 3.06Å; L278-N282 VanDerWaalsContact O-ND2 3.14Å; L279-N282 PolarHBondContact O-N 2.88Å; Y280-N282 VanDerWaalsContact C-N 3.31Å; Y280-N282 PolarHBondContact O-N 3.37Å; N282-Q285 WeakPolarHBondContact O-CB 3.32Å; N282-Q285 PolarHBondContact O-N 2.82Å; N282-I286 PolarHBondContact O-N 2.9Å; N282-R316 PolarHBondContact OD1-NH1 3.47Å; N282-R316 PolarHBondContact OD1-NH2 2.91Å; N282-R316 VanDerWaalsContact OD1-NH2 3.08Å
283	R	97.3	Very high	94.2	Very high	33 Å²	33	36.8 Å²	36.8	13%	0.125	19%	0.189	C	C	.	.	H	α-helix	trans	-71.6	-37.1	175.7	-169.7	179.3	63.4	173.8	1.5	111.7	L263 Y266 N267 L279 Y280 Q285 I286 Y287 D299	L263-R283 HydrophobicContact CD1-CG 3.62Å; Y266-R283 HydrophobicContact CG-CB 4.27Å; N267-R283 WeakPolarHBondContact OD1-CD 3.39Å; N267-R283 PolarHBondContact OD1-NH1 3.25Å; L279-R283 WeakPolarHBondContact O-CB 3.2Å; L279-R283 PolarHBondContact O-N 3.15Å; Y280-R283 PolarHBondContact O-N 2.7Å; R283-Q285 VanDerWaalsContact C-N 3.27Å; R283-Q285 PolarHBondContact O-N 3.2Å; R283-I286 WeakPolarHBondContact O-CA 3.43Å; R283-I286 WeakPolarHBondContact O-CB 3.46Å; R283-I286 PolarHBondContact O-N 2.69Å; R283-Y287 HydrophobicContact CG-CD2 3.93Å; R283-Y287 HydrophobicContact CG-CE2 3.62Å; R283-Y287 WeakPolarHBondContact O-CD2 3.46Å; R283-Y287 PolarHBondContact O-N 3.22Å; R283-D299 WeakPolarHBondContact CB-OD2 3.19Å; R283-D299 WeakPolarHBondContact CG-OD2 3.44Å; R283-D299 IonicContact CZ-OD1 2.8Å; R283-D299 IonicContact CZ-OD2 3.22Å; R283-D299 IonicContact NE-OD1 2.67Å; R283-D299 PolarHBondContact NE-OD1 3.31Å; R283-D299 IonicContact NE-OD2 2.61Å; R283-D299 PolarHBondContact NE-OD2 2.77Å; R283-D299 IonicContact NH2-OD1 3.34Å; R283-D299 PolarHBondContact NH2-OD1 3.42Å; R283-D299 IonicContact NH2-OD2 2.76Å
284	S	97.1	Very high	94.5	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.007	22%	0.218	C	C	.	.	H	α-helix	trans	-50	-45.4	165.2	166.9	0	0	0	0	112.3	Y280 I286 Y287 F288 A296 D299	Y280-S284 WeakPolarHBondContact O-CB 3.48Å; Y280-S284 PolarHBondContact O-N 2.75Å; S284-I286 VanDerWaalsContact C-N 3.29Å; S284-I286 PolarHBondContact O-N 3.18Å; S284-Y287 PolarHBondContact O-N 2.89Å; S284-F288 WeakPolarHBondContact O-CB 3.31Å; S284-F288 PolarHBondContact O-N 2.94Å; S284-A296 WeakPolarHBondContact CB-O 3.31Å; S284-A296 WeakPolarHBondContact O-CB 3.46Å; S284-A296 PolarHBondContact OG-O 2.98Å; S284-D299 PolarHBondContact N-OD2 3.49Å
285	Q	96.3	Very high	94.8	Very high	31 Å²	31	44.7 Å²	44.7	15%	0.145	22%	0.223	C	C	.	.	H	α-helix	trans	-63.4	-35.9	177.2	-166.5	70.8	75.7	0	0	112.8	N282 R283 T289	N282-Q285 WeakPolarHBondContact O-CB 3.32Å; N282-Q285 PolarHBondContact O-N 2.82Å; R283-Q285 VanDerWaalsContact C-N 3.27Å; R283-Q285 PolarHBondContact O-N 3.2Å; Q285-T289 PolarHBondContact O-N 3.2Å; Q285-T289 VanDerWaalsContact O-N 3.07Å; Q285-T289 PolarHBondContact O-OG1 3.1Å
286	I	96.4	Very high	95.2	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.015	20%	0.201	C	C	.	.	H	α-helix	trans	-71.1	-47.7	179.3	-71.8	165.6	0	0	0	109.7	Y254 V259 A262 L263 Y266 N282 R283 S284 F288 T289 L290	Y254-I286 HydrophobicContact CD2-CD1 4.42Å; Y254-I286 HydrophobicContact CD2-CG1 3.66Å; Y254-I286 HydrophobicContact CE2-CG1 3.96Å; Y254-I286 HydrophobicContact CG-CG1 4.46Å; V259-I286 HydrophobicContact CG1-CG2 3.84Å; A262-I286 HydrophobicContact CB-CD1 3.84Å; L263-I286 HydrophobicContact CB-CG2 3.72Å; L263-I286 HydrophobicContact CD1-CG2 4.09Å; L263-I286 HydrophobicContact CG-CG2 4.36Å; Y266-I286 HydrophobicContact CD2-CD1 3.28Å; Y266-I286 HydrophobicContact CE2-CD1 3.5Å; Y266-I286 VanDerWaalsContact CE2-CD1 3.5Å; Y266-I286 HydrophobicContact CG-CD1 4.3Å; N282-I286 PolarHBondContact O-N 2.9Å; R283-I286 WeakPolarHBondContact O-CA 3.43Å; R283-I286 WeakPolarHBondContact O-CB 3.46Å; R283-I286 PolarHBondContact O-N 2.69Å; S284-I286 VanDerWaalsContact C-N 3.29Å; S284-I286 PolarHBondContact O-N 3.18Å; I286-F288 VanDerWaalsContact C-N 3.29Å; I286-F288 PolarHBondContact O-N 3.28Å; I286-T289 CarbonylContact O-C 3.52Å; I286-T289 WeakPolarHBondContact O-CA 3.49Å; I286-T289 WeakPolarHBondContact O-CB 3.23Å; I286-T289 PolarHBondContact O-N 3.1Å; I286-L290 HydrophobicContact CG2-CD1 4.05Å; I286-L290 WeakPolarHBondContact O-CG 3.46Å; I286-L290 PolarHBondContact O-N 3.19Å
287	Y	97.7	Very high	95.6	Very high	38 Å²	38	40.9 Å²	40.9	15%	0.149	20%	0.202	C	C	.	.	H	α-helix	trans	-57.2	-40.6	172	-75.8	-58	0	0	0	112.6	L263 R283 S284 T289 L290 E291 S292 N295 D299	L263-Y287 HydrophobicContact CD1-CD1 4.48Å; L263-Y287 HydrophobicContact CD1-CE1 3.97Å; L263-Y287 HydrophobicContact CD1-CE2 4.1Å; L263-Y287 HydrophobicContact CD2-CD1 4.41Å; L263-Y287 HydrophobicContact CD2-CE1 3.88Å; R283-Y287 HydrophobicContact CG-CD2 3.93Å; R283-Y287 HydrophobicContact CG-CE2 3.62Å; R283-Y287 WeakPolarHBondContact O-CD2 3.46Å; R283-Y287 PolarHBondContact O-N 3.22Å; S284-Y287 PolarHBondContact O-N 2.89Å; Y287-T289 VanDerWaalsContact C-N 3.26Å; Y287-T289 PolarHBondContact O-N 3.49Å; Y287-L290 CarbonylContact O-C 3.59Å; Y287-L290 PolarHBondContact O-N 3.01Å; Y287-L290 VanDerWaalsContact O-N 3.11Å; Y287-E291 PolarHBondContact O-N 3.28Å; Y287-S292 PolarHBondContact O-N 2.75Å; Y287-N295 HydrophobicContact CD1-CB 3.68Å; Y287-N295 HydrophobicContact CD2-CB 3.82Å; Y287-N295 HydrophobicContact CE1-CB 3.94Å; Y287-N295 HydrophobicContact CE2-CB 4.07Å; Y287-N295 HydrophobicContact CG-CB 3.62Å; Y287-D299 WeakPolarHBondContact CD2-OD2 3.32Å; Y287-D299 WeakPolarHBondContact CE2-OD2 3.39Å
288	F	95.9	Very high	95.9	Very high	38 Å²	38	45.1 Å²	45.1	17%	0.167	22%	0.222	C	C	.	.	H	α-helix	trans	-62.8	-32.6	174.1	-170.2	-80	0	0	0	112.5	S284 I286 L290 E291 H293 A296 Q319 A320 T323	S284-F288 WeakPolarHBondContact O-CB 3.31Å; S284-F288 PolarHBondContact O-N 2.94Å; I286-F288 VanDerWaalsContact C-N 3.29Å; I286-F288 PolarHBondContact O-N 3.28Å; F288-L290 VanDerWaalsContact C-N 3.3Å; F288-E291 PolarHBondContact O-N 2.73Å; F288-H293 AromaticContact CD2-ND1 3.6Å; F288-H293 AromaticContact CE2-CE1 3.85Å; F288-H293 AromaticContact CE2-ND1 3.56Å; F288-A296 HydrophobicContact CB-CB 3.94Å; F288-Q319 HydrophobicContact CD2-CG 4.27Å; F288-Q319 HydrophobicContact CE1-CG 4.28Å; F288-Q319 HydrophobicContact CE2-CB 4.27Å; F288-Q319 HydrophobicContact CE2-CG 3.64Å; F288-Q319 HydrophobicContact CZ-CG 3.67Å; F288-Q319 VanDerWaalsContact CZ-NE2 3.31Å; F288-A320 HydrophobicContact CD2-CB 4.49Å; F288-T323 HydrophobicContact CE2-CG2 3.63Å; F288-T323 WeakPolarHBondContact CE2-OG1 3.34Å; F288-T323 HydrophobicContact CZ-CG2 3.6Å
289	T	95.6	Very high	96.2	Very high	62 Å²	62	43.9 Å²	43.9	38%	0.38	22%	0.215	S	C	.	.	H	α-helix	trans	-78.5	-18.2	177.3	-50.6	0	0	0	0	112.3	Y254 V259 Q285 I286 Y287	Y254-T289 HydrophobicContact CE2-CG2 4.21Å; Y254-T289 PolarHBondContact OH-OG1 3.14Å; Y254-T289 VanDerWaalsContact OH-OG1 3.07Å; V259-T289 HydrophobicContact CG1-CG2 4.18Å; V259-T289 HydrophobicContact CG2-CG2 4.17Å; Q285-T289 PolarHBondContact O-N 3.2Å; Q285-T289 VanDerWaalsContact O-N 3.07Å; Q285-T289 PolarHBondContact O-OG1 3.1Å; I286-T289 CarbonylContact O-C 3.52Å; I286-T289 WeakPolarHBondContact O-CA 3.49Å; I286-T289 WeakPolarHBondContact O-CB 3.23Å; I286-T289 PolarHBondContact O-N 3.1Å; Y287-T289 VanDerWaalsContact C-N 3.26Å; Y287-T289 PolarHBondContact O-N 3.49Å
290	L	95.7	Very high	96.2	Very high	60 Å²	60	43.9 Å²	43.9	31%	0.314	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	18.5	173.3	-62.8	170.1	0	0	0	111.8	V259 E260 L263 I286 Y287 F288 S292	V259-L290 HydrophobicContact CB-CD2 4.15Å; V259-L290 HydrophobicContact CG1-CD1 4.1Å; V259-L290 HydrophobicContact CG1-CD2 3.68Å; V259-L290 HydrophobicContact CG1-CG 3.67Å; E260-L290 HydrophobicContact CG-CD2 4.45Å; E260-L290 WeakPolarHBondContact OE1-CD2 3.48Å; L263-L290 HydrophobicContact CD2-CD1 3.83Å; I286-L290 HydrophobicContact CG2-CD1 4.05Å; I286-L290 WeakPolarHBondContact O-CG 3.46Å; I286-L290 PolarHBondContact O-N 3.19Å; Y287-L290 CarbonylContact O-C 3.59Å; Y287-L290 PolarHBondContact O-N 3.01Å; Y287-L290 VanDerWaalsContact O-N 3.11Å; F288-L290 VanDerWaalsContact C-N 3.3Å; L290-S292 PolarHBondContact O-N 2.91Å
291	E	94.9	Very high	96.2	Very high	160 Å²	160	45.8 Å²	45.8	75%	0.748	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	57	10.3	179.1	-58.8	178.7	173.7	0	0	114.9	Y287 F288 H293	Y287-E291 PolarHBondContact O-N 3.28Å; F288-E291 PolarHBondContact O-N 2.73Å; E291-H293 VanDerWaalsContact C-N 3.26Å; E291-H293 PolarHBondContact O-CD2 3.03Å; E291-H293 PolarHBondContact O-N 3.33Å
292	S	95.5	Very high	96.2	Very high	40 Å²	40	47.7 Å²	47.7	28%	0.28	23%	0.234	S	C	.	.			trans	-86	66.5	-180	-160.7	0	0	0	0	110.2	Y287 L290 E294 N295 A296	Y287-S292 PolarHBondContact O-N 2.75Å; L290-S292 PolarHBondContact O-N 2.91Å; S292-E294 VanDerWaalsContact C-N 3.3Å; S292-E294 PolarHBondContact O-N 2.9Å; S292-N295 PolarHBondContact O-N 2.98Å; S292-N295 PolarHBondContact OG-ND2 2.93Å; S292-A296 PolarHBondContact O-N 2.82Å
293	H	95.5	Very high	96.2	Very high	45 Å²	45	46.5 Å²	46.5	21%	0.208	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-30.5	-168.1	-60.3	-63.2	0	0	0	114.1	F288 E291 A296 L297 T323 L324	F288-H293 AromaticContact CD2-ND1 3.6Å; F288-H293 AromaticContact CE2-CE1 3.85Å; F288-H293 AromaticContact CE2-ND1 3.56Å; E291-H293 VanDerWaalsContact C-N 3.26Å; E291-H293 PolarHBondContact O-CD2 3.03Å; E291-H293 PolarHBondContact O-N 3.33Å; H293-A296 WeakPolarHBondContact O-CB 3.14Å; H293-A296 PolarHBondContact O-N 2.64Å; H293-L297 WeakPolarHBondContact O-CB 3.37Å; H293-L297 PolarHBondContact O-N 3.28Å; H293-T323 PolarHBondContact ND1-OG1 3.15Å; H293-T323 VanDerWaalsContact ND1-OG1 3.15Å; H293-L324 HydrophobicContact CB-CD1 4.32Å; H293-L324 HydrophobicContact CB-CD2 3.83Å; H293-L324 HydrophobicContact CB-CG 3.86Å
294	E	96	Very high	96	Very high	149 Å²	149	45.4 Å²	45.4	70%	0.696	23%	0.226	S	C	*	.	H	α-helix	trans	-67.2	-47.6	175.6	-60.6	-176	148.1	0	0	112.2	S292 A296 L297 H298 L324	S292-E294 VanDerWaalsContact C-N 3.3Å; S292-E294 PolarHBondContact O-N 2.9Å; E294-A296 VanDerWaalsContact C-N 3.27Å; E294-A296 PolarHBondContact O-N 2.79Å; E294-L297 WeakPolarHBondContact O-CB 3.17Å; E294-L297 PolarHBondContact O-N 3.18Å; E294-L297 VanDerWaalsContact O-N 3.17Å; E294-H298 PolarHBondContact O-N 2.87Å; E294-L324 HydrophobicContact CG-CD2 4.02Å
295	N	95.7	Very high	95.8	Very high	72 Å²	72	53.1 Å²	53.1	39%	0.385	26%	0.259	S	S	.	.	H	α-helix	trans	-63.4	-36.2	173.6	-72.5	-58.7	0	0	0	111.3	Y287 S292 L297 H298 D299	Y287-N295 HydrophobicContact CD1-CB 3.68Å; Y287-N295 HydrophobicContact CD2-CB 3.82Å; Y287-N295 HydrophobicContact CE1-CB 3.94Å; Y287-N295 HydrophobicContact CE2-CB 4.07Å; Y287-N295 HydrophobicContact CG-CB 3.62Å; S292-N295 PolarHBondContact O-N 2.98Å; S292-N295 PolarHBondContact OG-ND2 2.93Å; N295-L297 VanDerWaalsContact C-N 3.34Å; N295-H298 PolarHBondContact O-N 3.26Å; N295-D299 PolarHBondContact O-N 3.3Å; N295-D299 VanDerWaalsContact O-N 3.08Å
296	A	97.1	Very high	95.5	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.8	-37.8	174.2	0	0	0	0	0	112.7	S284 F288 S292 H293 E294 A300 A320	S284-A296 WeakPolarHBondContact CB-O 3.31Å; S284-A296 WeakPolarHBondContact O-CB 3.46Å; S284-A296 PolarHBondContact OG-O 2.98Å; F288-A296 HydrophobicContact CB-CB 3.94Å; S292-A296 PolarHBondContact O-N 2.82Å; H293-A296 WeakPolarHBondContact O-CB 3.14Å; H293-A296 PolarHBondContact O-N 2.64Å; E294-A296 VanDerWaalsContact C-N 3.27Å; E294-A296 PolarHBondContact O-N 2.79Å; A296-A300 VanDerWaalsContact O-CB 3.3Å; A296-A300 WeakPolarHBondContact O-CB 3.44Å; A296-A300 PolarHBondContact O-N 2.97Å; A296-A320 HydrophobicContact CB-CB 4.17Å
297	L	97.3	Very high	95	Very high	24 Å²	24	57.4 Å²	57.4	13%	0.126	28%	0.278	C	S	.	.	H	α-helix	trans	-67.1	-52.5	174	175.8	56.2	0	0	0	110.9	H293 E294 N295 D299 A300 E301 K317 A320 L321 L324	H293-L297 WeakPolarHBondContact O-CB 3.37Å; H293-L297 PolarHBondContact O-N 3.28Å; E294-L297 WeakPolarHBondContact O-CB 3.17Å; E294-L297 PolarHBondContact O-N 3.18Å; E294-L297 VanDerWaalsContact O-N 3.17Å; N295-L297 VanDerWaalsContact C-N 3.34Å; L297-D299 PolarHBondContact O-N 3.37Å; L297-A300 CarbonylContact O-C 3.59Å; L297-A300 WeakPolarHBondContact O-CA 3.47Å; L297-A300 WeakPolarHBondContact O-CB 3.41Å; L297-A300 PolarHBondContact O-N 3.16Å; L297-E301 HydrophobicContact CD1-CG 4Å; L297-E301 HydrophobicContact CG-CG 4.49Å; L297-E301 WeakPolarHBondContact O-CG 3.48Å; L297-E301 PolarHBondContact O-N 2.93Å; L297-K317 HydrophobicContact CD1-CD 4.48Å; L297-K317 HydrophobicContact CD1-CG 3.65Å; L297-A320 HydrophobicContact CB-CB 3.95Å; L297-L321 HydrophobicContact CD1-CD2 3.79Å; L297-L321 HydrophobicContact CD1-CG 3.82Å; L297-L321 HydrophobicContact CD2-CD2 3.84Å; L297-L324 HydrophobicContact CB-CD1 4.15Å; L297-L324 HydrophobicContact CD2-CD1 3.75Å
298	H	97	Very high	94.5	Very high	111 Å²	111	59.3 Å²	59.3	51%	0.514	30%	0.295	S	S	.	.	H	α-helix	trans	-54.8	-49.4	-179	-178.4	81.2	0	0	0	112.4	E294 N295 A300 E301 I302	E294-H298 PolarHBondContact O-N 2.87Å; N295-H298 PolarHBondContact O-N 3.26Å; H298-A300 VanDerWaalsContact C-N 3.33Å; H298-A300 PolarHBondContact O-N 3.5Å; H298-E301 PolarHBondContact O-N 2.83Å; H298-I302 WeakPolarHBondContact O-CG1 3.37Å; H298-I302 PolarHBondContact O-N 3.49Å
299	D	97.2	Very high	94	Very high	2 Å²	2	61.5 Å²	61.5	1%	0.011	31%	0.306	C	S	.	.	H	α-helix	trans	-63	-37	174.8	-94.7	-6.6	0	0	0	112.8	Y280 R283 S284 Y287 N295 L297 E301 A303	Y280-D299 WeakPolarHBondContact CB-O 3.04Å; Y280-D299 WeakPolarHBondContact CD1-OD1 3.37Å; R283-D299 WeakPolarHBondContact CB-OD2 3.19Å; R283-D299 WeakPolarHBondContact CG-OD2 3.44Å; R283-D299 IonicContact CZ-OD1 2.8Å; R283-D299 IonicContact CZ-OD2 3.22Å; R283-D299 IonicContact NE-OD1 2.67Å; R283-D299 PolarHBondContact NE-OD1 3.31Å; R283-D299 IonicContact NE-OD2 2.61Å; R283-D299 PolarHBondContact NE-OD2 2.77Å; R283-D299 IonicContact NH2-OD1 3.34Å; R283-D299 PolarHBondContact NH2-OD1 3.42Å; R283-D299 IonicContact NH2-OD2 2.76Å; S284-D299 PolarHBondContact N-OD2 3.49Å; Y287-D299 WeakPolarHBondContact CD2-OD2 3.32Å; Y287-D299 WeakPolarHBondContact CE2-OD2 3.39Å; N295-D299 PolarHBondContact O-N 3.3Å; N295-D299 VanDerWaalsContact O-N 3.08Å; L297-D299 PolarHBondContact O-N 3.37Å; D299-E301 VanDerWaalsContact C-N 3.34Å; D299-A303 WeakPolarHBondContact O-CB 3.22Å; D299-A303 PolarHBondContact O-N 2.76Å
300	A	96.2	Very high	93.5	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-67.9	-36.8	177.3	0	0	0	0	0	111.6	A296 L297 H298 A303 C304 R316 K317	A296-A300 VanDerWaalsContact O-CB 3.3Å; A296-A300 WeakPolarHBondContact O-CB 3.44Å; A296-A300 PolarHBondContact O-N 2.97Å; L297-A300 CarbonylContact O-C 3.59Å; L297-A300 WeakPolarHBondContact O-CA 3.47Å; L297-A300 WeakPolarHBondContact O-CB 3.41Å; L297-A300 PolarHBondContact O-N 3.16Å; H298-A300 VanDerWaalsContact C-N 3.33Å; H298-A300 PolarHBondContact O-N 3.5Å; A300-A303 PolarHBondContact O-N 3.13Å; A300-C304 PolarHBondContact O-N 2.82Å; A300-C304 PolarHBondContact O-SG 3.38Å; A300-R316 HydrophobicContact CB-CB 4.3Å; A300-K317 VanDerWaalsContact CB-CA 3.49Å; A300-K317 HydrophobicContact CB-CB 3.71Å; A300-K317 HydrophobicContact CB-CG 4.25Å
301	E	96.1	Very high	93.3	Very high	64 Å²	64	59.1 Å²	59.1	30%	0.299	29%	0.291	S	S	.	.	H	α-helix	trans	-66.3	-44	174.7	-68.4	-158.3	136.8	0	0	112.4	L297 H298 D299 A303 C304 K305 K317	L297-E301 HydrophobicContact CD1-CG 4Å; L297-E301 HydrophobicContact CG-CG 4.49Å; L297-E301 WeakPolarHBondContact O-CG 3.48Å; L297-E301 PolarHBondContact O-N 2.93Å; H298-E301 PolarHBondContact O-N 2.83Å; D299-E301 VanDerWaalsContact C-N 3.34Å; E301-A303 VanDerWaalsContact C-N 3.29Å; E301-A303 PolarHBondContact O-N 2.83Å; E301-C304 PolarHBondContact O-N 2.8Å; E301-C304 VanDerWaalsContact O-N 3.11Å; E301-K305 WeakPolarHBondContact O-CG 3.48Å; E301-K305 PolarHBondContact O-N 3.21Å; E301-K317 HydrophobicContact CG-CD 3.87Å; E301-K317 HydrophobicContact CG-CG 4.2Å; E301-K317 WeakPolarHBondContact OE1-CE 3.44Å; E301-K317 IonicContact OE1-NZ 3.72Å; E301-K317 PolarHBondContact OE1-NZ 3.11Å
302	I	95.3	Very high	93	Very high	43 Å²	43	57.2 Å²	57.2	22%	0.221	28%	0.28	C	S	.	.	H	α-helix	trans	-59.3	-43.7	172.7	-64.2	167.7	0	0	0	110.2	Y280 H298 C304 K305 L306	Y280-I302 HydrophobicContact CD1-CB 3.82Å; Y280-I302 HydrophobicContact CD1-CD1 3.86Å; Y280-I302 HydrophobicContact CD1-CG1 4.46Å; Y280-I302 HydrophobicContact CD1-CG2 3.53Å; Y280-I302 HydrophobicContact CD2-CG2 4Å; Y280-I302 HydrophobicContact CE1-CB 4.25Å; Y280-I302 HydrophobicContact CE1-CD1 3.73Å; Y280-I302 HydrophobicContact CE1-CG2 3.65Å; Y280-I302 HydrophobicContact CE2-CG2 4.13Å; Y280-I302 HydrophobicContact CG-CB 4.19Å; Y280-I302 HydrophobicContact CG-CG2 3.7Å; H298-I302 WeakPolarHBondContact O-CG1 3.37Å; H298-I302 PolarHBondContact O-N 3.49Å; I302-C304 VanDerWaalsContact C-N 3.28Å; I302-C304 PolarHBondContact O-N 3.05Å; I302-K305 PolarHBondContact O-N 3.39Å; I302-L306 HydrophobicContact CG2-CD1 3.8Å; I302-L306 HydrophobicContact CG2-CG 4.19Å; I302-L306 WeakPolarHBondContact O-CB 3.3Å; I302-L306 WeakPolarHBondContact O-CG 3.33Å; I302-L306 PolarHBondContact O-N 3.39Å
303	A	94.1	Very high	92.9	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64	-29.1	176.4	0	0	0	0	0	113.9	D299 A300 E301 R307 A313	D299-A303 WeakPolarHBondContact O-CB 3.22Å; D299-A303 PolarHBondContact O-N 2.76Å; A300-A303 PolarHBondContact O-N 3.13Å; E301-A303 VanDerWaalsContact C-N 3.29Å; E301-A303 PolarHBondContact O-N 2.83Å; A303-R307 PolarHBondContact O-N 3.47Å; A303-A313 HydrophobicContact CB-CB 3.69Å
304	C	93.6	Very high	92.8	Very high	11 Å²	11	53.5 Å²	53.5	7%	0.074	26%	0.259	C	S	.	.	H	α-helix	trans	-77	-41.3	172.6	-64.3	0	0	0	0	111.8	A300 E301 I302 R307 P308 A313 H314	A300-C304 PolarHBondContact O-N 2.82Å; A300-C304 PolarHBondContact O-SG 3.38Å; E301-C304 PolarHBondContact O-N 2.8Å; E301-C304 VanDerWaalsContact O-N 3.11Å; I302-C304 VanDerWaalsContact C-N 3.28Å; I302-C304 PolarHBondContact O-N 3.05Å; C304-R307 CarbonylContact O-C 3.56Å; C304-R307 PolarHBondContact O-N 3.12Å; C304-R307 VanDerWaalsContact O-N 3.13Å; C304-P308 WeakPolarHBondContact O-CA 3.09Å; C304-P308 WeakPolarHBondContact O-CD 3.43Å; C304-A313 VanDerWaalsContact SG-C 3.56Å; C304-A313 VanDerWaalsContact SG-CB 3.56Å; C304-H314 VanDerWaalsContact SG-CE1 3.54Å
305	K	93	Very high	92.8	Very high	162 Å²	162	47.2 Å²	47.2	70%	0.704	23%	0.229	S	C	*	.	H	α-helix	trans	-61.2	-45.9	175.3	-72.1	177.6	179.1	-174.9	0	111.1	E301 I302 R307	E301-K305 WeakPolarHBondContact O-CG 3.48Å; E301-K305 PolarHBondContact O-N 3.21Å; I302-K305 PolarHBondContact O-N 3.39Å; K305-R307 PolarHBondContact O-N 3.07Å
306	L	88.8	Confident	92.7	Very high	60 Å²	60	45.4 Å²	45.4	31%	0.314	22%	0.217	S	C	.	.	S	Bend	trans	-69.3	-16.9	174.5	-67.8	174.4	0	0	0	113.7	H277 Y280 I302	H277-L306 HydrophobicContact CB-CB 3.78Å; H277-L306 HydrophobicContact CB-CD1 4.38Å; Y280-L306 HydrophobicContact CD2-CD1 3.93Å; Y280-L306 HydrophobicContact CE2-CD1 4.07Å; I302-L306 HydrophobicContact CG2-CD1 3.8Å; I302-L306 HydrophobicContact CG2-CG 4.19Å; I302-L306 WeakPolarHBondContact O-CB 3.3Å; I302-L306 WeakPolarHBondContact O-CG 3.33Å; I302-L306 PolarHBondContact O-N 3.39Å
307	R	86.9	Confident	92.7	Very high	64 Å²	64	46 Å²	46	24%	0.242	22%	0.22	C	C	.	.			trans	-155.4	86.6	176.9	-166	-170.6	-166.9	76.8	16.8	113.2	H162 H277 A303 C304 K305 M309 G310	H162-R307 VanDerWaalsContact CG-NH2 3.3Å; H277-R307 HydrophobicContact CB-CB 4.18Å; H277-R307 PolarHBondContact NE2-NH1 3.01Å; A303-R307 PolarHBondContact O-N 3.47Å; C304-R307 CarbonylContact O-C 3.56Å; C304-R307 PolarHBondContact O-N 3.12Å; C304-R307 VanDerWaalsContact O-N 3.13Å; K305-R307 PolarHBondContact O-N 3.07Å; R307-M309 VanDerWaalsContact C-N 3.25Å; R307-M309 PolarHBondContact O-N 3.15Å; R307-G310 WeakPolarHBondContact O-CA 3.13Å; R307-G310 PolarHBondContact O-N 2.87Å
308	P	87.9	Confident	92.6	Very high	78 Å²	78	44.9 Å²	44.9	51%	0.506	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-26.1	180	-27.7	36.8	0	0	0	115	C304 G310 H314 Y336	C304-P308 WeakPolarHBondContact O-CA 3.09Å; C304-P308 WeakPolarHBondContact O-CD 3.43Å; P308-G310 VanDerWaalsContact C-N 3.28Å; P308-G310 PolarHBondContact O-N 3.01Å; P308-H314 PolarHBondContact O-NE2 2.96Å; P308-H314 VanDerWaalsContact O-NE2 3.12Å; P308-Y336 WeakPolarHBondContact O-CE1 3.32Å; P308-Y336 PolarHBondContact O-OH 3.23Å; P308-Y336 VanDerWaalsContact O-OH 3.08Å
309	M	85.8	Confident	92.5	Very high	84 Å²	84	41 Å²	41	41%	0.414	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	29.6	173.7	-60.2	-61.7	-167.2	0	0	112.4	Q117 G118 R307 L340	Q117-M309 HydrophobicContact CB-CE 4.37Å; G118-M309 WeakPolarHBondContact O-CE 3.45Å; R307-M309 VanDerWaalsContact C-N 3.25Å; R307-M309 PolarHBondContact O-N 3.15Å; M309-L340 HydrophobicContact CB-CD2 4.46Å; M309-L340 HydrophobicContact SD-CD2 3.69Å
310	G	85.1	Confident	92.4	Very high	8 Å²	8	40.9 Å²	40.9	8%	0.082	20%	0.195	C	C	.	.			trans	-101.7	72	-168.6	0	0	0	0	0	114.1	R307 P308 K312 A313 H314	R307-G310 WeakPolarHBondContact O-CA 3.13Å; R307-G310 PolarHBondContact O-N 2.87Å; P308-G310 VanDerWaalsContact C-N 3.28Å; P308-G310 PolarHBondContact O-N 3.01Å; G310-K312 PolarHBondContact O-N 3.05Å; G310-A313 WeakPolarHBondContact O-CA 3.36Å; G310-A313 WeakPolarHBondContact O-CB 3.44Å; G310-A313 PolarHBondContact O-N 2.75Å; G310-H314 PolarHBondContact O-CD2 3.35Å; G310-H314 PolarHBondContact O-N 2.89Å
311	F	89.5	Confident	92.4	Very high	64 Å²	64	40.9 Å²	40.9	28%	0.281	20%	0.195	S	C	.	.	H	α-helix	trans	-46.5	-33.3	-170.3	79	-90.6	0	0	0	116.2	F315 C337 L340 D341	F311-F315 WeakPolarHBondContact O-CB 3.38Å; F311-F315 PolarHBondContact O-N 3.22Å; F311-C337 PolarHBondContact O-SG 2.88Å; F311-L340 HydrophobicContact CB-CB 3.73Å; F311-L340 HydrophobicContact CB-CD1 4.19Å; F311-D341 HydrophobicContact CB-CB 4.37Å; F311-D341 HydrophobicContact CD1-CB 4.34Å; F311-D341 HydrophobicContact CD2-CB 3.89Å; F311-D341 HydrophobicContact CE2-CB 4.14Å; F311-D341 WeakPolarHBondContact CE2-OD2 3.34Å; F311-D341 HydrophobicContact CG-CB 3.98Å; F311-D341 HydrophobicContact CZ-CB 4.46Å
312	K	90.5	Very high	92.2	Very high	121 Å²	121	39.1 Å²	39.1	53%	0.526	19%	0.191	S	C	.	.	H	α-helix	trans	-71.7	-29.8	176.8	-64.8	178.7	-177.5	168.7	0	114.3	G310 R316	G310-K312 PolarHBondContact O-N 3.05Å; K312-R316 WeakPolarHBondContact O-CD 3.3Å; K312-R316 VanDerWaalsContact O-CG 3.31Å; K312-R316 WeakPolarHBondContact O-CG 3.25Å; K312-R316 PolarHBondContact O-N 2.76Å
313	A	92.2	Very high	92.1	Very high	3 Å²	3	40.2 Å²	40.2	3%	0.025	20%	0.2	C	C	.	.	H	α-helix	trans	-70.2	-49.1	172.5	0	0	0	0	0	109.8	A303 C304 G310 F315 R316 K317	A303-A313 HydrophobicContact CB-CB 3.69Å; C304-A313 VanDerWaalsContact SG-C 3.56Å; C304-A313 VanDerWaalsContact SG-CB 3.56Å; G310-A313 WeakPolarHBondContact O-CA 3.36Å; G310-A313 WeakPolarHBondContact O-CB 3.44Å; G310-A313 PolarHBondContact O-N 2.75Å; A313-F315 VanDerWaalsContact C-N 3.35Å; A313-F315 PolarHBondContact O-N 3.31Å; A313-R316 PolarHBondContact O-N 2.82Å; A313-R316 VanDerWaalsContact O-N 3.07Å; A313-K317 PolarHBondContact O-N 2.9Å
314	H	94.1	Very high	92.1	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.019	22%	0.216	C	C	.	.	H	α-helix	trans	-59.1	-41.8	175.6	-63.9	-77.2	0	0	0	112.7	C304 P308 G310 R316 K317 A318 E333 Y336 C337	C304-H314 VanDerWaalsContact SG-CE1 3.54Å; P308-H314 PolarHBondContact O-NE2 2.96Å; P308-H314 VanDerWaalsContact O-NE2 3.12Å; G310-H314 PolarHBondContact O-CD2 3.35Å; G310-H314 PolarHBondContact O-N 2.89Å; H314-R316 VanDerWaalsContact C-N 3.33Å; H314-R316 PolarHBondContact O-N 3.23Å; H314-K317 PolarHBondContact O-N 3.04Å; H314-A318 VanDerWaalsContact O-CB 3.23Å; H314-A318 WeakPolarHBondContact O-CB 3.37Å; H314-A318 PolarHBondContact O-N 3.25Å; H314-E333 IonicContact CE1-OE2 3.79Å; H314-E333 IonicContact CG-OE2 3.83Å; H314-E333 IonicContact ND1-OE2 2.81Å; H314-E333 PolarHBondContact ND1-OE2 2.78Å; H314-Y336 HydrophobicContact CB-CD1 4.41Å; H314-Y336 AromaticContact CD2-CD1 3.9Å; H314-Y336 AromaticContact CD2-CE1 3.85Å; H314-Y336 AromaticContact CE1-CD1 3.72Å; H314-Y336 AromaticContact CE1-CE1 3.59Å; H314-Y336 AromaticContact CG-CD1 3.67Å; H314-Y336 AromaticContact ND1-CD1 3.54Å; H314-Y336 AromaticContact ND1-CE1 3.91Å; H314-Y336 AromaticContact NE2-CD1 3.97Å; H314-Y336 AromaticContact NE2-CE1 3.57Å; H314-C337 HydrophobicContact CB-CB 4.25Å
315	F	94.8	Very high	91.9	Very high	16 Å²	16	45.3 Å²	45.3	7%	0.07	24%	0.24	C	C	.	.	H	α-helix	trans	-55.4	-46.2	172.6	-176.8	-96.7	0	0	0	112.7	F311 A313 Q319 F334 R346 A347	F311-F315 WeakPolarHBondContact O-CB 3.38Å; F311-F315 PolarHBondContact O-N 3.22Å; A313-F315 VanDerWaalsContact C-N 3.35Å; A313-F315 PolarHBondContact O-N 3.31Å; F315-Q319 WeakPolarHBondContact O-CB 3.3Å; F315-Q319 PolarHBondContact O-N 3.03Å; F315-F334 HydrophobicContact CD2-CD1 4.15Å; F315-F334 AromaticContact CD2-CE1 3.75Å; F315-F334 HydrophobicContact CD2-CE1 3.75Å; F315-F334 HydrophobicContact CE2-CD1 4.36Å; F315-F334 AromaticContact CE2-CE1 3.7Å; F315-F334 HydrophobicContact CE2-CE1 3.7Å; F315-F334 HydrophobicContact CZ-CE1 4.44Å; F315-R346 HydrophobicContact CE2-CB 3.8Å; F315-R346 HydrophobicContact CZ-CB 3.96Å; F315-A347 HydrophobicContact CD2-CB 3.95Å; F315-A347 HydrophobicContact CE2-CB 4.31Å
316	R	95.3	Very high	91.8	Very high	35 Å²	35	42 Å²	42	13%	0.132	23%	0.225	C	C	.	.	H	α-helix	trans	-72.6	-36.7	-177.9	-72.8	167.5	166.6	166.1	-18.9	112	S281 N282 A300 K312 A313 H314 Q319 A320	S281-R316 WeakPolarHBondContact O-CD 3.22Å; S281-R316 PolarHBondContact O-NE 3.25Å; S281-R316 PolarHBondContact O-NH1 3.09Å; S281-R316 WeakPolarHBondContact OG-CD 3.3Å; S281-R316 PolarHBondContact OG-NH1 3.41Å; N282-R316 PolarHBondContact OD1-NH1 3.47Å; N282-R316 PolarHBondContact OD1-NH2 2.91Å; N282-R316 VanDerWaalsContact OD1-NH2 3.08Å; A300-R316 HydrophobicContact CB-CB 4.3Å; K312-R316 WeakPolarHBondContact O-CD 3.3Å; K312-R316 VanDerWaalsContact O-CG 3.31Å; K312-R316 WeakPolarHBondContact O-CG 3.25Å; K312-R316 PolarHBondContact O-N 2.76Å; A313-R316 PolarHBondContact O-N 2.82Å; A313-R316 VanDerWaalsContact O-N 3.07Å; H314-R316 VanDerWaalsContact C-N 3.33Å; H314-R316 PolarHBondContact O-N 3.23Å; R316-Q319 PolarHBondContact O-N 3.19Å; R316-A320 PolarHBondContact O-N 3.33Å
317	K	95.8	Very high	91.8	Very high	12 Å²	12	41.5 Å²	41.5	5%	0.052	23%	0.225	C	C	.	.	H	α-helix	trans	-60.5	-52.1	172.2	-166.6	-172.2	169.7	174.5	0	110.4	L297 A300 E301 A313 H314 Q319 A320 L321 E333	L297-K317 HydrophobicContact CD1-CD 4.48Å; L297-K317 HydrophobicContact CD1-CG 3.65Å; A300-K317 VanDerWaalsContact CB-CA 3.49Å; A300-K317 HydrophobicContact CB-CB 3.71Å; A300-K317 HydrophobicContact CB-CG 4.25Å; E301-K317 HydrophobicContact CG-CD 3.87Å; E301-K317 HydrophobicContact CG-CG 4.2Å; E301-K317 WeakPolarHBondContact OE1-CE 3.44Å; E301-K317 IonicContact OE1-NZ 3.72Å; E301-K317 PolarHBondContact OE1-NZ 3.11Å; A313-K317 PolarHBondContact O-N 2.9Å; H314-K317 PolarHBondContact O-N 3.04Å; K317-Q319 VanDerWaalsContact C-N 3.29Å; K317-Q319 PolarHBondContact O-N 3.45Å; K317-A320 PolarHBondContact O-N 3.01Å; K317-L321 HydrophobicContact CD-CD1 4.38Å; K317-L321 HydrophobicContact CG-CD1 4.02Å; K317-L321 HydrophobicContact CG-CG 4.45Å; K317-L321 WeakPolarHBondContact O-CB 3.41Å; K317-L321 VanDerWaalsContact O-CG 3.28Å; K317-L321 WeakPolarHBondContact O-CG 3.48Å; K317-L321 PolarHBondContact O-N 3.1Å; K317-E333 HydrophobicContact CD-CG 3.98Å; K317-E333 WeakPolarHBondContact CD-OE1 3.25Å; K317-E333 IonicContact NZ-OE1 3.97Å; K317-E333 PolarHBondContact NZ-OE1 2.92Å; K317-E333 VanDerWaalsContact NZ-OE1 3.11Å
318	A	94.8	Very high	91.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.4	-39.1	178	0	0	0	0	0	112.4	H314 A322 A330 E333 F334	H314-A318 VanDerWaalsContact O-CB 3.23Å; H314-A318 WeakPolarHBondContact O-CB 3.37Å; H314-A318 PolarHBondContact O-N 3.25Å; A318-A322 WeakPolarHBondContact O-CB 3.33Å; A318-A322 PolarHBondContact O-N 2.78Å; A318-A330 WeakPolarHBondContact CB-O 3.47Å; A318-A330 WeakPolarHBondContact O-CB 3.34Å; A318-E333 HydrophobicContact CB-CB 3.73Å; A318-F334 HydrophobicContact CB-CB 4.27Å; A318-F334 HydrophobicContact CB-CD1 3.57Å; A318-F334 HydrophobicContact CB-CD2 3.51Å; A318-F334 HydrophobicContact CB-CE1 3.63Å; A318-F334 HydrophobicContact CB-CE2 3.57Å; A318-F334 HydrophobicContact CB-CG 3.49Å; A318-F334 VanDerWaalsContact CB-CG 3.49Å; A318-F334 HydrophobicContact CB-CZ 3.63Å
319	Q	95.4	Very high	91.8	Very high	29 Å²	29	41.4 Å²	41.4	14%	0.136	22%	0.22	C	C	.	.	H	α-helix	trans	-63.2	-45.7	175.3	-158.9	-172.9	-5.3	0	0	112	F288 F315 R316 K317 A322 T323 F334	F288-Q319 HydrophobicContact CD2-CG 4.27Å; F288-Q319 HydrophobicContact CE1-CG 4.28Å; F288-Q319 HydrophobicContact CE2-CB 4.27Å; F288-Q319 HydrophobicContact CE2-CG 3.64Å; F288-Q319 HydrophobicContact CZ-CG 3.67Å; F288-Q319 VanDerWaalsContact CZ-NE2 3.31Å; F315-Q319 WeakPolarHBondContact O-CB 3.3Å; F315-Q319 PolarHBondContact O-N 3.03Å; R316-Q319 PolarHBondContact O-N 3.19Å; K317-Q319 VanDerWaalsContact C-N 3.29Å; K317-Q319 PolarHBondContact O-N 3.45Å; Q319-A322 PolarHBondContact O-N 2.91Å; Q319-T323 PolarHBondContact O-N 3.37Å; Q319-T323 PolarHBondContact O-OG1 3.41Å; Q319-F334 HydrophobicContact CB-CZ 4.4Å
320	A	95.9	Very high	92.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67.1	-40.8	177.8	0	0	0	0	0	112.7	F288 A296 L297 R316 K317 A322 T323 L324	F288-A320 HydrophobicContact CD2-CB 4.49Å; A296-A320 HydrophobicContact CB-CB 4.17Å; L297-A320 HydrophobicContact CB-CB 3.95Å; R316-A320 PolarHBondContact O-N 3.33Å; K317-A320 PolarHBondContact O-N 3.01Å; A320-A322 VanDerWaalsContact C-N 3.34Å; A320-A322 PolarHBondContact O-N 3.17Å; A320-T323 WeakPolarHBondContact CA-OG1 3.36Å; A320-T323 PolarHBondContact O-N 2.84Å; A320-T323 PolarHBondContact O-OG1 2.88Å; A320-L324 WeakPolarHBondContact O-CG 3.42Å; A320-L324 PolarHBondContact O-N 3.41Å; A320-L324 VanDerWaalsContact O-N 3.08Å
321	L	95.3	Very high	92.4	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.1	-42.5	173.9	-71.6	168.3	0	0	0	112.1	L297 K317 T323 L324 G325 K326 E329 A330 E333	L297-L321 HydrophobicContact CD1-CD2 3.79Å; L297-L321 HydrophobicContact CD1-CG 3.82Å; L297-L321 HydrophobicContact CD2-CD2 3.84Å; K317-L321 HydrophobicContact CD-CD1 4.38Å; K317-L321 HydrophobicContact CG-CD1 4.02Å; K317-L321 HydrophobicContact CG-CG 4.45Å; K317-L321 WeakPolarHBondContact O-CB 3.41Å; K317-L321 VanDerWaalsContact O-CG 3.28Å; K317-L321 WeakPolarHBondContact O-CG 3.48Å; K317-L321 PolarHBondContact O-N 3.1Å; L321-T323 VanDerWaalsContact C-N 3.34Å; L321-T323 PolarHBondContact O-N 2.86Å; L321-L324 CarbonylContact O-C 3.6Å; L321-L324 PolarHBondContact O-N 2.92Å; L321-L324 VanDerWaalsContact O-N 3.16Å; L321-G325 PolarHBondContact O-N 3.13Å; L321-K326 HydrophobicContact CB-CB 4.19Å; L321-K326 HydrophobicContact CD2-CB 3.89Å; L321-K326 HydrophobicContact CD2-CD 3.56Å; L321-K326 HydrophobicContact CD2-CG 4.36Å; L321-K326 PolarHBondContact O-N 3.37Å; L321-E329 HydrophobicContact CD1-CB 3.68Å; L321-E329 HydrophobicContact CD2-CB 4.07Å; L321-E329 VanDerWaalsContact CD2-OE2 3.3Å; L321-E329 WeakPolarHBondContact CD2-OE2 3.49Å; L321-E329 HydrophobicContact CG-CB 4.36Å; L321-A330 HydrophobicContact CB-CB 3.75Å; L321-E333 HydrophobicContact CD1-CG 4.03Å
322	A	92.8	Very high	92.4	Very high	27 Å²	27	37.8 Å²	37.8	22%	0.223	20%	0.198	C	C	.	.	H	α-helix	trans	-63.8	-37.2	179.1	0	0	0	0	0	112.6	A318 Q319 A320 A330 F334	A318-A322 WeakPolarHBondContact O-CB 3.33Å; A318-A322 PolarHBondContact O-N 2.78Å; Q319-A322 PolarHBondContact O-N 2.91Å; A320-A322 VanDerWaalsContact C-N 3.34Å; A320-A322 PolarHBondContact O-N 3.17Å; A322-A330 HydrophobicContact CB-CB 3.92Å; A322-F334 HydrophobicContact CB-CE2 4.43Å
323	T	92.7	Very high	92.5	Very high	66 Å²	66	32.2 Å²	32.2	41%	0.405	17%	0.174	S	C	.	.	H	α-helix	trans	-73.3	-25.2	173.9	41.4	0	0	0	0	113.7	F288 H293 Q319 A320 L321 G325	F288-T323 HydrophobicContact CE2-CG2 3.63Å; F288-T323 WeakPolarHBondContact CE2-OG1 3.34Å; F288-T323 HydrophobicContact CZ-CG2 3.6Å; H293-T323 PolarHBondContact ND1-OG1 3.15Å; H293-T323 VanDerWaalsContact ND1-OG1 3.15Å; Q319-T323 PolarHBondContact O-N 3.37Å; Q319-T323 PolarHBondContact O-OG1 3.41Å; A320-T323 WeakPolarHBondContact CA-OG1 3.36Å; A320-T323 PolarHBondContact O-N 2.84Å; A320-T323 PolarHBondContact O-OG1 2.88Å; L321-T323 VanDerWaalsContact C-N 3.34Å; L321-T323 PolarHBondContact O-N 2.86Å; T323-G325 VanDerWaalsContact C-N 3.27Å; T323-G325 PolarHBondContact O-N 3.05Å
324	L	93.4	Very high	92.5	Very high	63 Å²	63	32.1 Å²	32.1	33%	0.33	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	14.2	175.6	-68.4	167.6	0	0	0	113	H293 E294 L297 A320 L321 K326	H293-L324 HydrophobicContact CB-CD1 4.32Å; H293-L324 HydrophobicContact CB-CD2 3.83Å; H293-L324 HydrophobicContact CB-CG 3.86Å; E294-L324 HydrophobicContact CG-CD2 4.02Å; L297-L324 HydrophobicContact CB-CD1 4.15Å; L297-L324 HydrophobicContact CD2-CD1 3.75Å; A320-L324 WeakPolarHBondContact O-CG 3.42Å; A320-L324 PolarHBondContact O-N 3.41Å; A320-L324 VanDerWaalsContact O-N 3.08Å; L321-L324 CarbonylContact O-C 3.6Å; L321-L324 PolarHBondContact O-N 2.92Å; L321-L324 VanDerWaalsContact O-N 3.16Å; L324-K326 PolarHBondContact O-N 2.92Å; L324-K326 VanDerWaalsContact O-N 3.14Å
325	G	89.2	Confident	92.4	Very high	56 Å²	56	32.1 Å²	32.1	58%	0.577	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.7	2.8	-179.6	0	0	0	0	0	115.4	L321 T323 V327	L321-G325 PolarHBondContact O-N 3.13Å; T323-G325 VanDerWaalsContact C-N 3.27Å; T323-G325 PolarHBondContact O-N 3.05Å; G325-V327 WeakPolarHBondContact O-CG2 3.36Å; G325-V327 PolarHBondContact O-N 3.48Å
326	K	91	Very high	92.2	Very high	91 Å²	91	32.8 Å²	32.8	40%	0.396	18%	0.175	S	C	.	.			trans	-81.3	61.2	-179.3	-69	-177.9	155.1	-133	0	111.8	L321 L324 E328 E329 A330	L321-K326 HydrophobicContact CB-CB 4.19Å; L321-K326 HydrophobicContact CD2-CB 3.89Å; L321-K326 HydrophobicContact CD2-CD 3.56Å; L321-K326 HydrophobicContact CD2-CG 4.36Å; L321-K326 PolarHBondContact O-N 3.37Å; L324-K326 PolarHBondContact O-N 2.92Å; L324-K326 VanDerWaalsContact O-N 3.14Å; K326-E328 PolarHBondContact O-N 3.28Å; K326-E329 HydrophobicContact CB-CB 4.37Å; K326-E329 WeakPolarHBondContact CD-OE1 3.41Å; K326-E329 IonicContact NZ-OE1 3.7Å; K326-E329 PolarHBondContact NZ-OE1 3.41Å; K326-E329 IonicContact NZ-OE2 2.87Å; K326-E329 PolarHBondContact O-N 3.07Å; K326-A330 WeakPolarHBondContact O-CB 3.15Å; K326-A330 PolarHBondContact O-N 3.1Å
327	V	88.6	Confident	92.1	Very high	50 Å²	50	31.1 Å²	31.1	30%	0.303	17%	0.169	S	C	.	.	H	α-helix	trans	-54.6	-44.5	-170.2	-169.9	0	0	0	0	112.7	G325 A330 L331 L354 F358	G325-V327 WeakPolarHBondContact O-CG2 3.36Å; G325-V327 PolarHBondContact O-N 3.48Å; V327-A330 PolarHBondContact O-N 2.88Å; V327-L331 WeakPolarHBondContact O-CB 3.47Å; V327-L331 PolarHBondContact O-N 3.05Å; V327-L354 HydrophobicContact CG1-CD2 3.76Å; V327-F358 HydrophobicContact CB-CE2 4.48Å; V327-F358 HydrophobicContact CB-CZ 3.95Å; V327-F358 HydrophobicContact CG1-CD2 4.35Å; V327-F358 HydrophobicContact CG1-CE1 4.19Å; V327-F358 HydrophobicContact CG1-CE2 3.53Å; V327-F358 HydrophobicContact CG1-CZ 3.43Å; V327-F358 VanDerWaalsContact CG1-CZ 3.43Å
328	E	86.6	Confident	91.8	Very high	77 Å²	77	31 Å²	31	36%	0.36	17%	0.169	S	C	.	.	H	α-helix	trans	-66.1	-47.3	-179.2	-68.8	-167.9	170.9	0	0	113.1	K326 A330 L331 R332 F358 P372 L377	K326-E328 PolarHBondContact O-N 3.28Å; E328-A330 VanDerWaalsContact C-N 3.32Å; E328-L331 PolarHBondContact O-N 3.15Å; E328-R332 PolarHBondContact O-N 2.88Å; E328-F358 HydrophobicContact CB-CZ 4.37Å; E328-F358 HydrophobicContact CG-CE1 3.93Å; E328-F358 HydrophobicContact CG-CZ 3.74Å; E328-P372 WeakPolarHBondContact OE1-CB 3.38Å; E328-L377 HydrophobicContact CB-CD1 4.17Å; E328-L377 HydrophobicContact CB-CD2 3.95Å; E328-L377 HydrophobicContact CG-CD1 4.17Å; E328-L377 HydrophobicContact CG-CD2 4.14Å; E328-L377 WeakPolarHBondContact OE2-CD2 3.43Å
329	E	89.3	Confident	91.6	Very high	63 Å²	63	32.1 Å²	32.1	29%	0.294	18%	0.177	S	C	.	.	H	α-helix	trans	-63.6	-41.6	177.3	-61.3	-178.9	-140	0	0	110.5	L321 K326 R332 E333	L321-E329 HydrophobicContact CD1-CB 3.68Å; L321-E329 HydrophobicContact CD2-CB 4.07Å; L321-E329 VanDerWaalsContact CD2-OE2 3.3Å; L321-E329 WeakPolarHBondContact CD2-OE2 3.49Å; L321-E329 HydrophobicContact CG-CB 4.36Å; K326-E329 HydrophobicContact CB-CB 4.37Å; K326-E329 WeakPolarHBondContact CD-OE1 3.41Å; K326-E329 IonicContact NZ-OE1 3.7Å; K326-E329 PolarHBondContact NZ-OE1 3.41Å; K326-E329 IonicContact NZ-OE2 2.87Å; K326-E329 PolarHBondContact O-N 3.07Å; E329-R332 PolarHBondContact O-N 3.3Å; E329-E333 WeakPolarHBondContact O-CG 3.47Å; E329-E333 PolarHBondContact O-N 3.34Å
330	A	92.2	Very high	91.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.3	-48.8	177	0	0	0	0	0	111.6	A318 L321 A322 K326 V327 E328 R332 E333 F334 L354	A318-A330 WeakPolarHBondContact CB-O 3.47Å; A318-A330 WeakPolarHBondContact O-CB 3.34Å; L321-A330 HydrophobicContact CB-CB 3.75Å; A322-A330 HydrophobicContact CB-CB 3.92Å; K326-A330 WeakPolarHBondContact O-CB 3.15Å; K326-A330 PolarHBondContact O-N 3.1Å; V327-A330 PolarHBondContact O-N 2.88Å; E328-A330 VanDerWaalsContact C-N 3.32Å; A330-R332 VanDerWaalsContact C-N 3.34Å; A330-R332 PolarHBondContact O-N 3.26Å; A330-E333 PolarHBondContact O-N 3.43Å; A330-F334 HydrophobicContact CB-CE2 4.49Å; A330-F334 WeakPolarHBondContact O-CD2 3.4Å; A330-F334 PolarHBondContact O-N 3.01Å; A330-L354 HydrophobicContact CB-CD1 3.97Å
331	L	90.9	Very high	90.7	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-59.2	-44.6	177.5	174.7	59.9	0	0	0	111.3	V327 E328 E333 F334 L335 A351 L354 L355 F358 L377	V327-L331 WeakPolarHBondContact O-CB 3.47Å; V327-L331 PolarHBondContact O-N 3.05Å; E328-L331 PolarHBondContact O-N 3.15Å; L331-E333 PolarHBondContact O-N 2.98Å; L331-F334 PolarHBondContact O-N 3.27Å; L331-L335 HydrophobicContact CD1-CD1 3.94Å; L331-L335 HydrophobicContact CD1-CG 3.94Å; L331-L335 HydrophobicContact CG-CD1 3.97Å; L331-L335 HydrophobicContact CG-CG 4.4Å; L331-L335 WeakPolarHBondContact O-CB 3.36Å; L331-L335 VanDerWaalsContact O-CG 3.32Å; L331-L335 WeakPolarHBondContact O-CG 2.97Å; L331-L335 PolarHBondContact O-N 3.35Å; L331-A351 HydrophobicContact CD1-CB 4.05Å; L331-L354 HydrophobicContact CB-CB 4.34Å; L331-L354 HydrophobicContact CB-CD1 4.28Å; L331-L354 HydrophobicContact CD1-CB 4.35Å; L331-L355 HydrophobicContact CD1-CD1 4.22Å; L331-L355 HydrophobicContact CD1-CD2 4.39Å; L331-L355 HydrophobicContact CD1-CG 3.83Å; L331-L355 HydrophobicContact CD2-CD2 3.68Å; L331-L355 HydrophobicContact CD2-CG 3.94Å; L331-F358 HydrophobicContact CB-CE2 4.13Å; L331-F358 HydrophobicContact CD2-CD2 3.75Å; L331-F358 HydrophobicContact CD2-CE2 3.51Å; L331-F358 HydrophobicContact CG-CE2 4.45Å; L331-L377 HydrophobicContact CD2-CD1 4.45Å
332	R	89.4	Confident	90.1	Very high	79 Å²	79	36.8 Å²	36.8	30%	0.298	21%	0.213	S	C	.	.	H	α-helix	trans	-59.4	-47.6	178	-171.1	-171.9	-66.1	113	-7.3	112.1	E328 E329 A330 L335 Y336 L377	E328-R332 PolarHBondContact O-N 2.88Å; E329-R332 PolarHBondContact O-N 3.3Å; A330-R332 VanDerWaalsContact C-N 3.34Å; A330-R332 PolarHBondContact O-N 3.26Å; R332-L335 PolarHBondContact O-N 3.26Å; R332-Y336 PolarHBondContact O-N 3.14Å; R332-L377 PolarHBondContact NE-O 2.78Å
333	E	92.3	Very high	89.6	Confident	5 Å²	5	44.3 Å²	44.3	2%	0.023	24%	0.24	C	C	.	.	H	α-helix	trans	-72.1	-29.4	-179.8	-62.9	-77.8	-175.6	0	0	112	H314 K317 A318 L321 E329 A330 L331 C337 R383	H314-E333 IonicContact CE1-OE2 3.79Å; H314-E333 IonicContact CG-OE2 3.83Å; H314-E333 IonicContact ND1-OE2 2.81Å; H314-E333 PolarHBondContact ND1-OE2 2.78Å; K317-E333 HydrophobicContact CD-CG 3.98Å; K317-E333 WeakPolarHBondContact CD-OE1 3.25Å; K317-E333 IonicContact NZ-OE1 3.97Å; K317-E333 PolarHBondContact NZ-OE1 2.92Å; K317-E333 VanDerWaalsContact NZ-OE1 3.11Å; A318-E333 HydrophobicContact CB-CB 3.73Å; L321-E333 HydrophobicContact CD1-CG 4.03Å; E329-E333 WeakPolarHBondContact O-CG 3.47Å; E329-E333 PolarHBondContact O-N 3.34Å; A330-E333 PolarHBondContact O-N 3.43Å; L331-E333 PolarHBondContact O-N 2.98Å; E333-C337 WeakPolarHBondContact O-CB 3.36Å; E333-C337 PolarHBondContact O-N 2.93Å; E333-R383 IonicContact OE1-CZ 3.13Å; E333-R383 VanDerWaalsContact OE1-CZ 3.31Å; E333-R383 IonicContact OE1-NH1 3.7Å; E333-R383 PolarHBondContact OE1-NH1 3.29Å; E333-R383 IonicContact OE1-NH2 3.29Å; E333-R383 PolarHBondContact OE1-NH2 2.85Å; E333-R383 IonicContact OE2-NH1 2.77Å
334	F	93.7	Very high	89.3	Confident	1 Å²	1	42.4 Å²	42.4	0%	0.004	23%	0.228	C	C	.	.	H	α-helix	trans	-68.6	-44.2	168.9	-79.7	-57.5	0	0	0	112.3	F315 A318 Q319 A322 A330 L331 Y336 C337 V338 A347 E350 A351 L354	F315-F334 HydrophobicContact CD2-CD1 4.15Å; F315-F334 AromaticContact CD2-CE1 3.75Å; F315-F334 HydrophobicContact CD2-CE1 3.75Å; F315-F334 HydrophobicContact CE2-CD1 4.36Å; F315-F334 AromaticContact CE2-CE1 3.7Å; F315-F334 HydrophobicContact CE2-CE1 3.7Å; F315-F334 HydrophobicContact CZ-CE1 4.44Å; A318-F334 HydrophobicContact CB-CB 4.27Å; A318-F334 HydrophobicContact CB-CD1 3.57Å; A318-F334 HydrophobicContact CB-CD2 3.51Å; A318-F334 HydrophobicContact CB-CE1 3.63Å; A318-F334 HydrophobicContact CB-CE2 3.57Å; A318-F334 HydrophobicContact CB-CG 3.49Å; A318-F334 VanDerWaalsContact CB-CG 3.49Å; A318-F334 HydrophobicContact CB-CZ 3.63Å; Q319-F334 HydrophobicContact CB-CZ 4.4Å; A322-F334 HydrophobicContact CB-CE2 4.43Å; A330-F334 HydrophobicContact CB-CE2 4.49Å; A330-F334 WeakPolarHBondContact O-CD2 3.4Å; A330-F334 PolarHBondContact O-N 3.01Å; L331-F334 PolarHBondContact O-N 3.27Å; F334-Y336 VanDerWaalsContact C-N 3.31Å; F334-Y336 PolarHBondContact O-N 2.96Å; F334-C337 WeakPolarHBondContact O-CA 3.49Å; F334-C337 VanDerWaalsContact O-CB 3.31Å; F334-C337 WeakPolarHBondContact O-CB 3.4Å; F334-C337 PolarHBondContact O-N 2.95Å; F334-C337 VanDerWaalsContact O-N 3.13Å; F334-V338 WeakPolarHBondContact O-CG2 3.18Å; F334-V338 PolarHBondContact O-N 3.47Å; F334-A347 HydrophobicContact CD1-CB 4.24Å; F334-E350 HydrophobicContact CD1-CB 4Å; F334-E350 HydrophobicContact CD2-CB 3.89Å; F334-E350 HydrophobicContact CE1-CB 3.71Å; F334-E350 HydrophobicContact CE1-CG 3.97Å; F334-E350 HydrophobicContact CE2-CB 3.6Å; F334-E350 HydrophobicContact CE2-CG 4.27Å; F334-E350 HydrophobicContact CG-CB 4.11Å; F334-E350 HydrophobicContact CZ-CB 3.5Å; F334-E350 HydrophobicContact CZ-CG 3.73Å; F334-A351 HydrophobicContact CB-CB 4.11Å; F334-L354 HydrophobicContact CD2-CD1 3.51Å; F334-L354 HydrophobicContact CE2-CD1 3.78Å
335	L	91.3	Very high	89.1	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-61.3	-39.8	176.3	-72.2	170.9	0	0	0	111.6	V108 L111 V115 L331 R332 V338 S339 A351 L378	V108-L335 HydrophobicContact CG1-CD2 4.21Å; L111-L335 HydrophobicContact CB-CD1 4.07Å; L111-L335 HydrophobicContact CB-CD2 3.76Å; L111-L335 HydrophobicContact CD1-CD1 4.27Å; L111-L335 HydrophobicContact CD1-CD2 4.37Å; V115-L335 HydrophobicContact CG2-CB 4.09Å; L331-L335 HydrophobicContact CD1-CD1 3.94Å; L331-L335 HydrophobicContact CD1-CG 3.94Å; L331-L335 HydrophobicContact CG-CD1 3.97Å; L331-L335 HydrophobicContact CG-CG 4.4Å; L331-L335 WeakPolarHBondContact O-CB 3.36Å; L331-L335 VanDerWaalsContact O-CG 3.32Å; L331-L335 WeakPolarHBondContact O-CG 2.97Å; L331-L335 PolarHBondContact O-N 3.35Å; R332-L335 PolarHBondContact O-N 3.26Å; L335-V338 PolarHBondContact O-N 3Å; L335-S339 PolarHBondContact O-N 2.86Å; L335-A351 HydrophobicContact CD2-CB 4.32Å; L335-L378 HydrophobicContact CD1-CD2 4.33Å
336	Y	90.8	Very high	89.2	Confident	30 Å²	30	50.7 Å²	50.7	12%	0.118	24%	0.241	C	C	.	.	H	α-helix	trans	-67.9	-36.3	172.8	-169.9	-113.2	0	0	0	112.7	V115 P308 H314 R332 F334 V338 S339 L340	V115-Y336 HydrophobicContact CG1-CD2 3.68Å; V115-Y336 HydrophobicContact CG1-CG 4.44Å; P308-Y336 WeakPolarHBondContact O-CE1 3.32Å; P308-Y336 PolarHBondContact O-OH 3.23Å; P308-Y336 VanDerWaalsContact O-OH 3.08Å; H314-Y336 HydrophobicContact CB-CD1 4.41Å; H314-Y336 AromaticContact CD2-CD1 3.9Å; H314-Y336 AromaticContact CD2-CE1 3.85Å; H314-Y336 AromaticContact CE1-CD1 3.72Å; H314-Y336 AromaticContact CE1-CE1 3.59Å; H314-Y336 AromaticContact CG-CD1 3.67Å; H314-Y336 AromaticContact ND1-CD1 3.54Å; H314-Y336 AromaticContact ND1-CE1 3.91Å; H314-Y336 AromaticContact NE2-CD1 3.97Å; H314-Y336 AromaticContact NE2-CE1 3.57Å; R332-Y336 PolarHBondContact O-N 3.14Å; F334-Y336 VanDerWaalsContact C-N 3.31Å; F334-Y336 PolarHBondContact O-N 2.96Å; Y336-V338 VanDerWaalsContact C-N 3.27Å; Y336-V338 PolarHBondContact O-N 3.35Å; Y336-S339 PolarHBondContact O-N 3.02Å; Y336-S339 PolarHBondContact O-OG 2.86Å; Y336-S339 VanDerWaalsContact O-OG 3.12Å; Y336-L340 HydrophobicContact CD1-CD1 3.96Å; Y336-L340 HydrophobicContact CE1-CD1 3.61Å; Y336-L340 HydrophobicContact CE1-CG 4.27Å; Y336-L340 WeakPolarHBondContact O-CG 3.44Å; Y336-L340 PolarHBondContact O-N 3.43Å; Y336-L340 VanDerWaalsContact O-N 3.07Å
337	C	91.9	Very high	89.1	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.8	-38.1	169.9	-175.2	0	0	0	0	112.3	F311 H314 E333 F334 D341 N344 A347	F311-C337 PolarHBondContact O-SG 2.88Å; H314-C337 HydrophobicContact CB-CB 4.25Å; E333-C337 WeakPolarHBondContact O-CB 3.36Å; E333-C337 PolarHBondContact O-N 2.93Å; F334-C337 WeakPolarHBondContact O-CA 3.49Å; F334-C337 VanDerWaalsContact O-CB 3.31Å; F334-C337 WeakPolarHBondContact O-CB 3.4Å; F334-C337 PolarHBondContact O-N 2.95Å; F334-C337 VanDerWaalsContact O-N 3.13Å; C337-D341 PolarHBondContact O-N 2.91Å; C337-N344 PolarHBondContact SG-ND2 3.28Å; C337-A347 HydrophobicContact CB-CB 4.12Å
338	V	91.3	Very high	89.3	Confident	8 Å²	8	46 Å²	46	5%	0.048	22%	0.216	C	C	.	.	H	α-helix	trans	-72.9	-34.8	177.1	175.1	0	0	0	0	112.2	V108 A112 F334 L335 Y336 L340 D341 G342 A347 R348	V108-V338 HydrophobicContact CG1-CG1 4.29Å; V108-V338 HydrophobicContact CG1-CG2 4.48Å; A112-V338 HydrophobicContact CB-CB 4.02Å; A112-V338 HydrophobicContact CB-CG1 3.72Å; F334-V338 WeakPolarHBondContact O-CG2 3.18Å; F334-V338 PolarHBondContact O-N 3.47Å; L335-V338 PolarHBondContact O-N 3Å; Y336-V338 VanDerWaalsContact C-N 3.27Å; Y336-V338 PolarHBondContact O-N 3.35Å; V338-L340 VanDerWaalsContact C-N 3.32Å; V338-D341 CarbonylContact O-C 3.55Å; V338-D341 VanDerWaalsContact O-C 3.27Å; V338-G342 VanDerWaalsContact O-CA 3.28Å; V338-G342 WeakPolarHBondContact O-CA 3.11Å; V338-G342 PolarHBondContact O-N 2.8Å; V338-A347 HydrophobicContact CG2-CB 3.66Å; V338-R348 HydrophobicContact CB-CG 4.3Å; V338-R348 HydrophobicContact CG1-CG 3.74Å; V338-R348 HydrophobicContact CG2-CB 4.4Å; V338-R348 HydrophobicContact CG2-CG 3.5Å; V338-R348 VanDerWaalsContact CG2-CG 3.5Å
339	S	90.3	Very high	89.5	Confident	24 Å²	24	45.6 Å²	45.6	17%	0.168	22%	0.22	C	C	.	.	H	α-helix	trans	-70.4	-29.9	175.6	78.7	0	0	0	0	112.3	A112 Q117 L335 Y336	A112-S339 WeakPolarHBondContact O-CB 3.24Å; Q117-S339 PolarHBondContact NE2-O 3.41Å; Q117-S339 VanDerWaalsContact NE2-O 3.13Å; L335-S339 PolarHBondContact O-N 2.86Å; Y336-S339 PolarHBondContact O-N 3.02Å; Y336-S339 PolarHBondContact O-OG 2.86Å; Y336-S339 VanDerWaalsContact O-OG 3.12Å
340	L	87.1	Confident	89.7	Confident	44 Å²	44	45 Å²	45	23%	0.23	22%	0.217	C	C	.	.	H	α-helix	trans	-79.9	-34.2	172.7	-65.8	176.8	0	0	0	114.1	M309 F311 Y336 V338	M309-L340 HydrophobicContact CB-CD2 4.46Å; M309-L340 HydrophobicContact SD-CD2 3.69Å; F311-L340 HydrophobicContact CB-CB 3.73Å; F311-L340 HydrophobicContact CB-CD1 4.19Å; Y336-L340 HydrophobicContact CD1-CD1 3.96Å; Y336-L340 HydrophobicContact CE1-CD1 3.61Å; Y336-L340 HydrophobicContact CE1-CG 4.27Å; Y336-L340 WeakPolarHBondContact O-CG 3.44Å; Y336-L340 PolarHBondContact O-N 3.43Å; Y336-L340 VanDerWaalsContact O-N 3.07Å; V338-L340 VanDerWaalsContact C-N 3.32Å
341	D	84.3	Confident	89.6	Confident	41 Å²	41	45 Å²	45	22%	0.219	22%	0.217	C	C	.	.			trans	-144	87.8	172.9	-179	17.5	0	0	0	112.3	F311 C337 V338 K343 N344	F311-D341 HydrophobicContact CB-CB 4.37Å; F311-D341 HydrophobicContact CD1-CB 4.34Å; F311-D341 HydrophobicContact CD2-CB 3.89Å; F311-D341 HydrophobicContact CE2-CB 4.14Å; F311-D341 WeakPolarHBondContact CE2-OD2 3.34Å; F311-D341 HydrophobicContact CG-CB 3.98Å; F311-D341 HydrophobicContact CZ-CB 4.46Å; C337-D341 PolarHBondContact O-N 2.91Å; V338-D341 CarbonylContact O-C 3.55Å; V338-D341 VanDerWaalsContact O-C 3.27Å; D341-K343 PolarHBondContact O-N 3.42Å; D341-K343 VanDerWaalsContact OD1-CB 3.3Å; D341-K343 WeakPolarHBondContact OD1-CB 3.18Å; D341-K343 PolarHBondContact OD1-N 3.15Å; D341-N344 HydrophobicContact CB-CB 4.32Å; D341-N344 VanDerWaalsContact O-CB 3.23Å; D341-N344 WeakPolarHBondContact O-CB 3.45Å; D341-N344 PolarHBondContact O-N 3.09Å
342	G	82.6	Confident	89.7	Confident	43 Å²	43	45.3 Å²	45.3	44%	0.443	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-11.8	177	0	0	0	0	0	114.9	V338 N344 R348	V338-G342 VanDerWaalsContact O-CA 3.28Å; V338-G342 WeakPolarHBondContact O-CA 3.11Å; V338-G342 PolarHBondContact O-N 2.8Å; G342-N344 VanDerWaalsContact C-N 3.33Å; G342-R348 PolarHBondContact O-NE 3.19Å
343	K	83.3	Confident	89.8	Confident	184 Å²	184	47 Å²	47	80%	0.8	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	-9.7	174.3	-57.9	171.6	-176.9	168	0	112.1	D341 K345	D341-K343 PolarHBondContact O-N 3.42Å; D341-K343 VanDerWaalsContact OD1-CB 3.3Å; D341-K343 WeakPolarHBondContact OD1-CB 3.18Å; D341-K343 PolarHBondContact OD1-N 3.15Å; K343-K345 VanDerWaalsContact C-N 3.32Å; K343-K345 PolarHBondContact O-N 2.86Å
344	N	85.6	Confident	89.6	Confident	26 Å²	26	46.9 Å²	46.9	14%	0.139	23%	0.225	C	C	.	.			trans	-73.1	81.6	176.9	-172.7	-2	0	0	0	111.6	C337 D341 G342 R346 A347 R348	C337-N344 PolarHBondContact SG-ND2 3.28Å; D341-N344 HydrophobicContact CB-CB 4.32Å; D341-N344 VanDerWaalsContact O-CB 3.23Å; D341-N344 WeakPolarHBondContact O-CB 3.45Å; D341-N344 PolarHBondContact O-N 3.09Å; G342-N344 VanDerWaalsContact C-N 3.33Å; N344-R346 PolarHBondContact O-N 3.31Å; N344-R346 VanDerWaalsContact O-N 3.14Å; N344-R346 PolarHBondContact OD1-N 3.3Å; N344-A347 HydrophobicContact CB-CB 4.16Å; N344-A347 WeakPolarHBondContact ND2-CB 3.4Å; N344-A347 PolarHBondContact O-N 2.82Å; N344-A347 VanDerWaalsContact O-N 3.13Å; N344-A347 PolarHBondContact OD1-N 2.89Å; N344-R348 PolarHBondContact O-N 3.39Å
345	K	88.8	Confident	89.4	Confident	152 Å²	152	46.9 Å²	46.9	66%	0.661	23%	0.225	S	C	*	.	H	α-helix	trans	-49.6	-39.4	177.3	-68.1	-163.3	173.6	-159.5	0	113.1	K343 R348 C349	K343-K345 VanDerWaalsContact C-N 3.32Å; K343-K345 PolarHBondContact O-N 2.86Å; K345-R348 PolarHBondContact O-N 2.85Å; K345-C349 PolarHBondContact O-N 3.3Å; K345-C349 PolarHBondContact O-SG 3.33Å
346	R	91.2	Very high	89.2	Confident	141 Å²	141	48.7 Å²	48.7	53%	0.532	23%	0.234	S	C	.	.	H	α-helix	trans	-64.9	-43.5	-178.9	-68.7	-169.8	68.2	-159.8	-3.3	112.3	F315 N344 R348 C349 E350	F315-R346 HydrophobicContact CE2-CB 3.8Å; F315-R346 HydrophobicContact CZ-CB 3.96Å; N344-R346 PolarHBondContact O-N 3.31Å; N344-R346 VanDerWaalsContact O-N 3.14Å; N344-R346 PolarHBondContact OD1-N 3.3Å; R346-R348 VanDerWaalsContact C-N 3.27Å; R346-R348 PolarHBondContact O-N 3.37Å; R346-C349 PolarHBondContact O-N 3.41Å; R346-E350 WeakPolarHBondContact O-CG 3.29Å; R346-E350 PolarHBondContact O-N 2.98Å
347	A	90.8	Very high	89	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.3	-37.7	176.3	0	0	0	0	0	111.8	F315 F334 C337 V338 N344 A351	F315-A347 HydrophobicContact CD2-CB 3.95Å; F315-A347 HydrophobicContact CE2-CB 4.31Å; F334-A347 HydrophobicContact CD1-CB 4.24Å; C337-A347 HydrophobicContact CB-CB 4.12Å; V338-A347 HydrophobicContact CG2-CB 3.66Å; N344-A347 HydrophobicContact CB-CB 4.16Å; N344-A347 WeakPolarHBondContact ND2-CB 3.4Å; N344-A347 PolarHBondContact O-N 2.82Å; N344-A347 VanDerWaalsContact O-N 3.13Å; N344-A347 PolarHBondContact OD1-N 2.89Å; A347-A351 WeakPolarHBondContact O-CB 3.5Å; A347-A351 PolarHBondContact O-N 2.74Å
348	R	91.7	Very high	88.6	Confident	43 Å²	43	52 Å²	52	16%	0.162	26%	0.257	C	S	.	.	H	α-helix	trans	-66.5	-46.2	175.8	-63.9	-164.2	-73.5	101.8	-39.7	112.1	E105 V108 V338 G342 N344 K345 R346 E350 A351 Q352	E105-R348 IonicContact OE1-CZ 2.89Å; E105-R348 IonicContact OE1-NH1 2.7Å; E105-R348 PolarHBondContact OE1-NH1 2.82Å; E105-R348 IonicContact OE1-NH2 2.84Å; E105-R348 PolarHBondContact OE1-NH2 3.03Å; V108-R348 HydrophobicContact CG1-CB 4.37Å; V108-R348 HydrophobicContact CG1-CG 4.24Å; V338-R348 HydrophobicContact CB-CG 4.3Å; V338-R348 HydrophobicContact CG1-CG 3.74Å; V338-R348 HydrophobicContact CG2-CB 4.4Å; V338-R348 HydrophobicContact CG2-CG 3.5Å; V338-R348 VanDerWaalsContact CG2-CG 3.5Å; G342-R348 PolarHBondContact O-NE 3.19Å; N344-R348 PolarHBondContact O-N 3.39Å; K345-R348 PolarHBondContact O-N 2.85Å; R346-R348 VanDerWaalsContact C-N 3.27Å; R346-R348 PolarHBondContact O-N 3.37Å; R348-E350 PolarHBondContact O-N 2.91Å; R348-A351 PolarHBondContact O-N 2.93Å; R348-Q352 VanDerWaalsContact O-CB 3.3Å; R348-Q352 WeakPolarHBondContact O-CB 3.17Å; R348-Q352 WeakPolarHBondContact O-CG 3.21Å; R348-Q352 PolarHBondContact O-N 3.41Å; R348-Q352 PolarHBondContact O-OE1 3.17Å
349	C	91.6	Very high	88.1	Confident	68 Å²	68	52.2 Å²	52.2	46%	0.459	26%	0.257	S	S	.	.	H	α-helix	trans	-62.5	-38.2	177.5	-64.5	0	0	0	0	113.2	K345 R346 R353	K345-C349 PolarHBondContact O-N 3.3Å; K345-C349 PolarHBondContact O-SG 3.33Å; R346-C349 PolarHBondContact O-N 3.41Å; C349-R353 WeakPolarHBondContact O-CB 2.99Å; C349-R353 PolarHBondContact O-N 3.27Å
350	E	92.3	Very high	87.5	Confident	50 Å²	50	54.2 Å²	54.2	23%	0.234	27%	0.271	C	S	.	.	H	α-helix	trans	-70.6	-41.8	174.1	-64.5	-61.7	161.9	0	0	112.1	F334 R346 R348 Q352 R353 L354	F334-E350 HydrophobicContact CD1-CB 4Å; F334-E350 HydrophobicContact CD2-CB 3.89Å; F334-E350 HydrophobicContact CE1-CB 3.71Å; F334-E350 HydrophobicContact CE1-CG 3.97Å; F334-E350 HydrophobicContact CE2-CB 3.6Å; F334-E350 HydrophobicContact CE2-CG 4.27Å; F334-E350 HydrophobicContact CG-CB 4.11Å; F334-E350 HydrophobicContact CZ-CB 3.5Å; F334-E350 HydrophobicContact CZ-CG 3.73Å; R346-E350 WeakPolarHBondContact O-CG 3.29Å; R346-E350 PolarHBondContact O-N 2.98Å; R348-E350 PolarHBondContact O-N 2.91Å; E350-Q352 VanDerWaalsContact C-N 3.33Å; E350-Q352 PolarHBondContact O-N 2.99Å; E350-R353 PolarHBondContact O-N 2.93Å; E350-R353 IonicContact OE2-CZ 2.78Å; E350-R353 VanDerWaalsContact OE2-CZ 3.24Å; E350-R353 IonicContact OE2-NE 2.95Å; E350-R353 PolarHBondContact OE2-NE 3.47Å; E350-R353 IonicContact OE2-NH2 2.76Å; E350-R353 PolarHBondContact OE2-NH2 3.4Å; E350-L354 WeakPolarHBondContact O-CB 3.32Å; E350-L354 VanDerWaalsContact O-CG 3.27Å; E350-L354 WeakPolarHBondContact O-CG 3.32Å; E350-L354 PolarHBondContact O-N 2.67Å
351	A	91	Very high	86.2	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-42.7	173.8	0	0	0	0	0	112	V108 L331 F334 L335 A347 R348 L354 L355	V108-A351 HydrophobicContact CG1-CB 4.05Å; V108-A351 HydrophobicContact CG2-CB 3.86Å; L331-A351 HydrophobicContact CD1-CB 4.05Å; F334-A351 HydrophobicContact CB-CB 4.11Å; L335-A351 HydrophobicContact CD2-CB 4.32Å; A347-A351 WeakPolarHBondContact O-CB 3.5Å; A347-A351 PolarHBondContact O-N 2.74Å; R348-A351 PolarHBondContact O-N 2.93Å; A351-L354 PolarHBondContact O-N 3.33Å; A351-L355 WeakPolarHBondContact O-CB 3.33Å; A351-L355 WeakPolarHBondContact O-CD1 3.32Å; A351-L355 WeakPolarHBondContact O-CG 3.1Å; A351-L355 PolarHBondContact O-N 2.96Å
352	Q	91.9	Very high	84.8	Confident	9 Å²	9	60.4 Å²	60.4	4%	0.042	32%	0.318	C	S	.	.	H	α-helix	trans	-58.5	-47.8	173.3	-79.4	173.3	-56.7	0	0	111.9	A101 E102 L104 E105 V108 R348 E350 L355 L356	A101-Q352 HydrophobicContact CB-CB 4.1Å; A101-Q352 VanDerWaalsContact O-CB 3.26Å; A101-Q352 WeakPolarHBondContact O-CB 3.48Å; A101-Q352 VanDerWaalsContact O-CG 3.25Å; A101-Q352 WeakPolarHBondContact O-CG 3.19Å; A101-Q352 PolarHBondContact O-NE2 2.8Å; E102-Q352 PolarHBondContact O-NE2 3.27Å; L104-Q352 HydrophobicContact CB-CG 4.18Å; E105-Q352 VanDerWaalsContact N-NE2 3.18Å; V108-Q352 HydrophobicContact CG2-CG 3.85Å; R348-Q352 VanDerWaalsContact O-CB 3.3Å; R348-Q352 WeakPolarHBondContact O-CB 3.17Å; R348-Q352 WeakPolarHBondContact O-CG 3.21Å; R348-Q352 PolarHBondContact O-N 3.41Å; R348-Q352 PolarHBondContact O-OE1 3.17Å; E350-Q352 VanDerWaalsContact C-N 3.33Å; E350-Q352 PolarHBondContact O-N 2.99Å; Q352-L355 PolarHBondContact O-N 2.87Å; Q352-L356 PolarHBondContact O-N 3.31Å
353	R	91.6	Very high	83	Confident	113 Å²	113	64.4 Å²	64.4	43%	0.426	33%	0.334	S	S	.	.	H	α-helix	trans	-64.3	-42.2	179.1	-174	-173.1	62.2	72.1	0.9	112.2	C349 E350 L356 S357	C349-R353 WeakPolarHBondContact O-CB 2.99Å; C349-R353 PolarHBondContact O-N 3.27Å; E350-R353 PolarHBondContact O-N 2.93Å; E350-R353 IonicContact OE2-CZ 2.78Å; E350-R353 VanDerWaalsContact OE2-CZ 3.24Å; E350-R353 IonicContact OE2-NE 2.95Å; E350-R353 PolarHBondContact OE2-NE 3.47Å; E350-R353 IonicContact OE2-NH2 2.76Å; E350-R353 PolarHBondContact OE2-NH2 3.4Å; R353-L356 PolarHBondContact O-N 3.04Å; R353-S357 PolarHBondContact O-N 2.93Å; R353-S357 VanDerWaalsContact O-N 3.11Å; R353-S357 PolarHBondContact O-OG 3.13Å
354	L	89.4	Confident	81	Confident	4 Å²	4	61.8 Å²	61.8	2%	0.021	34%	0.336	C	S	.	.	H	α-helix	trans	-68.2	-42.7	178.1	-67.3	168.4	0	0	0	111.5	V327 A330 L331 F334 E350 A351 L356 S357 F358	V327-L354 HydrophobicContact CG1-CD2 3.76Å; A330-L354 HydrophobicContact CB-CD1 3.97Å; L331-L354 HydrophobicContact CB-CB 4.34Å; L331-L354 HydrophobicContact CB-CD1 4.28Å; L331-L354 HydrophobicContact CD1-CB 4.35Å; F334-L354 HydrophobicContact CD2-CD1 3.51Å; F334-L354 HydrophobicContact CE2-CD1 3.78Å; E350-L354 WeakPolarHBondContact O-CB 3.32Å; E350-L354 VanDerWaalsContact O-CG 3.27Å; E350-L354 WeakPolarHBondContact O-CG 3.32Å; E350-L354 PolarHBondContact O-N 2.67Å; A351-L354 PolarHBondContact O-N 3.33Å; L354-L356 VanDerWaalsContact C-N 3.33Å; L354-L356 PolarHBondContact O-N 3.23Å; L354-S357 WeakPolarHBondContact CA-OG 3.16Å; L354-S357 PolarHBondContact O-N 3.46Å; L354-S357 VanDerWaalsContact O-N 3.16Å; L354-S357 PolarHBondContact O-OG 2.88Å; L354-F358 WeakPolarHBondContact O-CD2 3.22Å; L354-F358 PolarHBondContact O-N 2.94Å
355	L	88.3	Confident	78.8	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-59.9	-41.9	172.6	-77.5	162.1	0	0	0	112	L104 L107 V108 L111 L331 A351 Q352 S357 F358 F359 I374	L104-L355 HydrophobicContact CD1-CB 3.85Å; L107-L355 HydrophobicContact CD2-CD1 4.15Å; L107-L355 HydrophobicContact CD2-CD2 4.31Å; L107-L355 HydrophobicContact CG-CD1 4.45Å; V108-L355 HydrophobicContact CG2-CD1 3.45Å; V108-L355 VanDerWaalsContact CG2-CD1 3.45Å; L111-L355 HydrophobicContact CD1-CD1 3.77Å; L111-L355 HydrophobicContact CD1-CD2 3.97Å; L331-L355 HydrophobicContact CD1-CD1 4.22Å; L331-L355 HydrophobicContact CD1-CD2 4.39Å; L331-L355 HydrophobicContact CD1-CG 3.83Å; L331-L355 HydrophobicContact CD2-CD2 3.68Å; L331-L355 HydrophobicContact CD2-CG 3.94Å; A351-L355 WeakPolarHBondContact O-CB 3.33Å; A351-L355 WeakPolarHBondContact O-CD1 3.32Å; A351-L355 WeakPolarHBondContact O-CG 3.1Å; A351-L355 PolarHBondContact O-N 2.96Å; Q352-L355 PolarHBondContact O-N 2.87Å; L355-S357 VanDerWaalsContact C-N 3.32Å; L355-S357 PolarHBondContact O-N 2.94Å; L355-F358 WeakPolarHBondContact O-CB 3.42Å; L355-F358 PolarHBondContact O-N 3.47Å; L355-F358 VanDerWaalsContact O-N 3.08Å; L355-F359 HydrophobicContact CB-CE2 4.27Å; L355-F359 WeakPolarHBondContact O-CD2 2.93Å; L355-F359 PolarHBondContact O-N 3.4Å; L355-I374 HydrophobicContact CD2-CD1 4.11Å; L355-I374 HydrophobicContact CD2-CG2 4.37Å
356	L	87.8	Confident	76.1	Confident	42 Å²	42	64.3 Å²	64.3	22%	0.22	37%	0.373	C	S	.	.	H	α-helix	trans	-58.1	-44.1	173.6	-175.3	64.6	0	0	0	111.4	L99 A101 L104 Q352 R353 L354 F358 F359 S360	L99-L356 HydrophobicContact CB-CD1 4.2Å; L99-L356 HydrophobicContact CD2-CD1 3.74Å; L99-L356 HydrophobicContact CG-CD1 3.87Å; A101-L356 HydrophobicContact CB-CB 4.44Å; A101-L356 HydrophobicContact CB-CD2 4.09Å; L104-L356 HydrophobicContact CD1-CB 4.18Å; Q352-L356 PolarHBondContact O-N 3.31Å; R353-L356 PolarHBondContact O-N 3.04Å; L354-L356 VanDerWaalsContact C-N 3.33Å; L354-L356 PolarHBondContact O-N 3.23Å; L356-F358 VanDerWaalsContact C-N 3.27Å; L356-F358 PolarHBondContact O-N 2.82Å; L356-F359 CarbonylContact O-C 3.31Å; L356-F359 PolarHBondContact O-N 3.16Å; L356-S360 PolarHBondContact O-N 2.7Å; L356-S360 VanDerWaalsContact O-N 3.08Å; L356-S360 PolarHBondContact O-OG 3.41Å
357	S	85.6	Confident	73.5	Confident	56 Å²	56	62.6 Å²	62.6	39%	0.392	38%	0.383	S	S	.	.	H	α-helix	trans	-65.9	-23.6	175.5	52.3	0	0	0	0	114.6	R353 L354 L355 F359	R353-S357 PolarHBondContact O-N 2.93Å; R353-S357 VanDerWaalsContact O-N 3.11Å; R353-S357 PolarHBondContact O-OG 3.13Å; L354-S357 WeakPolarHBondContact CA-OG 3.16Å; L354-S357 PolarHBondContact O-N 3.46Å; L354-S357 VanDerWaalsContact O-N 3.16Å; L354-S357 PolarHBondContact O-OG 2.88Å; L355-S357 VanDerWaalsContact C-N 3.32Å; L355-S357 PolarHBondContact O-N 2.94Å; S357-F359 VanDerWaalsContact C-N 3.31Å
358	F	83.6	Confident	71.1	Confident	44 Å²	44	71.7 Å²	71.7	19%	0.193	43%	0.425	C	S	.	.	H	α-helix	trans	-75.3	-18.3	169.7	-75.8	-67.9	0	0	0	113.5	V327 E328 L331 L354 L355 L356 P372 I374	V327-F358 HydrophobicContact CB-CE2 4.48Å; V327-F358 HydrophobicContact CB-CZ 3.95Å; V327-F358 HydrophobicContact CG1-CD2 4.35Å; V327-F358 HydrophobicContact CG1-CE1 4.19Å; V327-F358 HydrophobicContact CG1-CE2 3.53Å; V327-F358 HydrophobicContact CG1-CZ 3.43Å; V327-F358 VanDerWaalsContact CG1-CZ 3.43Å; E328-F358 HydrophobicContact CB-CZ 4.37Å; E328-F358 HydrophobicContact CG-CE1 3.93Å; E328-F358 HydrophobicContact CG-CZ 3.74Å; L331-F358 HydrophobicContact CB-CE2 4.13Å; L331-F358 HydrophobicContact CD2-CD2 3.75Å; L331-F358 HydrophobicContact CD2-CE2 3.51Å; L331-F358 HydrophobicContact CG-CE2 4.45Å; L354-F358 WeakPolarHBondContact O-CD2 3.22Å; L354-F358 PolarHBondContact O-N 2.94Å; L355-F358 WeakPolarHBondContact O-CB 3.42Å; L355-F358 PolarHBondContact O-N 3.47Å; L355-F358 VanDerWaalsContact O-N 3.08Å; L356-F358 VanDerWaalsContact C-N 3.27Å; L356-F358 PolarHBondContact O-N 2.82Å; F358-P372 HydrophobicContact CD1-CB 3.88Å; F358-P372 HydrophobicContact CD1-CG 3.77Å; F358-P372 HydrophobicContact CE1-CB 3.8Å; F358-P372 HydrophobicContact CE1-CG 3.7Å; F358-I374 HydrophobicContact CB-CD1 4.25Å
359	F	82.4	Confident	68.4	Low	13 Å²	13	78.9 Å²	78.9	6%	0.057	46%	0.461	C	S	.	.	H	α-helix	trans	-98.8	-4.8	173.8	-54.6	-55.2	0	0	0	113.2	L87 R91 S94 L99 L104 L107 L355 L356 S357 I374	L87-F359 HydrophobicContact CD2-CE1 4.02Å; L87-F359 HydrophobicContact CD2-CZ 3.69Å; R91-F359 HydrophobicContact CB-CD1 4.18Å; S94-F359 VanDerWaalsContact CB-CB 3.43Å; S94-F359 VanDerWaalsContact CB-O 3.22Å; S94-F359 WeakPolarHBondContact CB-O 3.47Å; S94-F359 WeakPolarHBondContact OG-CB 3.29Å; S94-F359 PolarHBondContact OG-O 3.06Å; L99-F359 HydrophobicContact CD2-CB 4.48Å; L99-F359 HydrophobicContact CD2-CD2 3.79Å; L99-F359 HydrophobicContact CD2-CE2 4.46Å; L99-F359 HydrophobicContact CD2-CG 4.46Å; L104-F359 HydrophobicContact CD1-CD2 4.17Å; L104-F359 HydrophobicContact CD1-CE2 3.98Å; L104-F359 HydrophobicContact CD2-CE2 3.95Å; L107-F359 HydrophobicContact CD2-CE2 4.07Å; L107-F359 HydrophobicContact CD2-CZ 3.91Å; L355-F359 HydrophobicContact CB-CE2 4.27Å; L355-F359 WeakPolarHBondContact O-CD2 2.93Å; L355-F359 PolarHBondContact O-N 3.4Å; L356-F359 CarbonylContact O-C 3.31Å; L356-F359 PolarHBondContact O-N 3.16Å; S357-F359 VanDerWaalsContact C-N 3.31Å; F359-I374 HydrophobicContact CE1-CD1 4.28Å; F359-I374 HydrophobicContact CZ-CD1 4.5Å
360	S	77.3	Confident	65.8	Low	65 Å²	65	83.8 Å²	83.8	46%	0.455	48%	0.476	S	S	.	.	S	Bend	trans	-71.1	135	172.3	-68.3	0	0	0	0	110.2	L356 S362	L356-S360 PolarHBondContact O-N 2.7Å; L356-S360 VanDerWaalsContact O-N 3.08Å; L356-S360 PolarHBondContact O-OG 3.41Å; S360-S362 PolarHBondContact O-N 3.19Å
361	P	60.3	Low	63.5	Low	103 Å²	103	86.6 Å²	86.6	67%	0.669	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-64.6	131	172.8	27.2	-33.5	0	0	0	110.3
362	S	53.2	Low	61.7	Low	112 Å²	112	88.6 Å²	88.6	78%	0.783	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-68	147.2	170.1	42.1	0	0	0	0	110.7	S360	S360-S362 PolarHBondContact O-N 3.19Å
363	V	44.8	Very low	60.3	Low	127 Å²	127	90.6 Å²	90.6	77%	0.77	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-65.8	128.9	178.6	-179.2	0	0	0	0	109	G365	V363-G365 PolarHBondContact O-N 2.75Å
364	P	41	Very low	59.1	Low	130 Å²	130	85.8 Å²	85.8	84%	0.844	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	105.7	179.3	27.4	-34	0	0	0	110
365	G	41.2	Very low	58	Low	69 Å²	69	87.5 Å²	87.5	71%	0.711	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	179.5	-39.4	-179	0	0	0	0	0	113.1	V363	V363-G365 PolarHBondContact O-N 2.75Å
366	D	32	Very low	56.9	Low	162 Å²	162	94.3 Å²	94.3	87%	0.866	55%	0.547	S	S	*	.			trans	-85.4	137.4	176.3	-145.4	-17.8	0	0	0	111.6
367	S	36.2	Very low	55.6	Low	105 Å²	105	92.9 Å²	92.9	73%	0.734	54%	0.539	S	S	*	.			trans	-111.2	115.4	-168	-68.4	0	0	0	0	111.6
368	Q	40.4	Very low	54.2	Low	191 Å²	191	91.5 Å²	91.5	89%	0.893	53%	0.527	S	S	*	.			trans	68.6	79.8	164.6	-167.6	-178.5	-5.6	0	0	116.2
369	E	33.9	Very low	52.9	Low	194 Å²	194	92.1 Å²	92.1	91%	0.907	54%	0.541	S	S	*	.			trans	-143.5	171.9	146.7	-125.7	171.3	-132.6	0	0	112.4
370	H	38.1	Very low	51.2	Low	170 Å²	170	96.8 Å²	96.8	79%	0.787	57%	0.572	S	S	*	*			trans	-66.1	134.6	-159	-79.8	-67.1	0	0	0	115.1	P372	H370-P372 WeakPolarHBondContact O-CD 3.34Å
371	S	43.3	Very low	49.5	Very low	110 Å²	110	100.5 Å²	100.5	77%	0.769	58%	0.582	S	S	*	*			trans	-57	117.6	152.3	172.3	0	0	0	0	109.2	D373	S371-D373 PolarHBondContact O-N 3.26Å; S371-D373 VanDerWaalsContact O-N 3.08Å
372	P	52.8	Low	48.4	Very low	42 Å²	42	100.5 Å²	100.5	27%	0.273	58%	0.582	S	S	.	*			trans	-63.1	111.5	-177.6	-29.6	41.3	0	0	0	111.9	E328 F358 H370 I374	E328-P372 WeakPolarHBondContact OE1-CB 3.38Å; F358-P372 HydrophobicContact CD1-CB 3.88Å; F358-P372 HydrophobicContact CD1-CG 3.77Å; F358-P372 HydrophobicContact CE1-CB 3.8Å; F358-P372 HydrophobicContact CE1-CG 3.7Å; H370-P372 WeakPolarHBondContact O-CD 3.34Å; P372-I374 VanDerWaalsContact C-N 3.3Å; P372-I374 PolarHBondContact O-N 2.68Å
373	D	64.3	Low	48	Very low	50 Å²	50	102.4 Å²	102.4	27%	0.267	57%	0.572	S	S	.	*			trans	-74.1	90.3	170.8	-172.4	-13.3	0	0	0	108.1	R84 S371 L375 K376 L377	R84-D373 IonicContact NH2-OD2 3.96Å; S371-D373 PolarHBondContact O-N 3.26Å; S371-D373 VanDerWaalsContact O-N 3.08Å; D373-L375 PolarHBondContact O-N 3Å; D373-L375 VanDerWaalsContact OD1-CB 3.31Å; D373-L375 WeakPolarHBondContact OD1-CB 2.99Å; D373-L375 PolarHBondContact OD1-N 3.01Å; D373-K376 HydrophobicContact CB-CB 4.2Å; D373-K376 HydrophobicContact CB-CD 3.88Å; D373-K376 HydrophobicContact CB-CG 3.86Å; D373-K376 WeakPolarHBondContact O-CA 3.01Å; D373-K376 WeakPolarHBondContact O-CB 3.46Å; D373-K376 PolarHBondContact O-N 3.49Å; D373-K376 WeakPolarHBondContact OD2-CE 3.49Å; D373-L377 PolarHBondContact O-N 2.89Å
374	I	66.3	Low	47.7	Very low	13 Å²	13	104.4 Å²	104.4	7%	0.067	58%	0.578	C	S	.	*	T	Hydrogen-bonded Turn	trans	-50.7	-21.9	178.6	-67.8	167	0	0	0	111.7	L87 L111 L355 F358 F359 P372 L377	L87-I374 HydrophobicContact CD1-CB 4.06Å; L87-I374 HydrophobicContact CD1-CG2 4.21Å; L87-I374 HydrophobicContact CD2-CD1 3.99Å; L87-I374 HydrophobicContact CD2-CG2 4.31Å; L111-I374 HydrophobicContact CD1-CG2 4.48Å; L111-I374 HydrophobicContact CD2-CG2 4.32Å; L355-I374 HydrophobicContact CD2-CD1 4.11Å; L355-I374 HydrophobicContact CD2-CG2 4.37Å; F358-I374 HydrophobicContact CB-CD1 4.25Å; F359-I374 HydrophobicContact CE1-CD1 4.28Å; F359-I374 HydrophobicContact CZ-CD1 4.5Å; P372-I374 VanDerWaalsContact C-N 3.3Å; P372-I374 PolarHBondContact O-N 2.68Å; I374-L377 WeakPolarHBondContact O-CB 3.41Å; I374-L377 PolarHBondContact O-N 3.03Å
375	L	64.8	Low	47	Very low	39 Å²	39	107.1 Å²	107.1	20%	0.204	58%	0.576	C	S	.	*	T	Hydrogen-bonded Turn	trans	-85.3	-26.6	177.4	-55	168.7	0	0	0	113.2	I83 R84 L87 D373 L377 L378	I83-L375 HydrophobicContact CB-CD2 3.98Å; I83-L375 HydrophobicContact CG2-CD2 3.68Å; R84-L375 HydrophobicContact CB-CD1 4.34Å; R84-L375 HydrophobicContact CG-CD1 3.18Å; L87-L375 HydrophobicContact CD1-CD2 4.27Å; L87-L375 HydrophobicContact CD1-CG 4.18Å; D373-L375 PolarHBondContact O-N 3Å; D373-L375 VanDerWaalsContact OD1-CB 3.31Å; D373-L375 WeakPolarHBondContact OD1-CB 2.99Å; D373-L375 PolarHBondContact OD1-N 3.01Å; L375-L377 VanDerWaalsContact C-N 3.26Å; L375-L378 HydrophobicContact CD2-CD1 3.94Å; L375-L378 PolarHBondContact O-N 2.73Å
376	K	66	Low	46.3	Very low	144 Å²	144	112.8 Å²	112.8	63%	0.626	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-30.4	164.4	-67.3	179.8	-167.5	173.9	0	111.1	D373 L378 A379	D373-K376 HydrophobicContact CB-CB 4.2Å; D373-K376 HydrophobicContact CB-CD 3.88Å; D373-K376 HydrophobicContact CB-CG 3.86Å; D373-K376 WeakPolarHBondContact O-CA 3.01Å; D373-K376 WeakPolarHBondContact O-CB 3.46Å; D373-K376 PolarHBondContact O-N 3.49Å; D373-K376 WeakPolarHBondContact OD2-CE 3.49Å; K376-L378 PolarHBondContact O-N 3.1Å; K376-A379 WeakPolarHBondContact O-CB 3.32Å; K376-A379 PolarHBondContact O-N 3.45Å; K376-A379 VanDerWaalsContact O-N 3.09Å
377	L	60.6	Low	46.1	Very low	12 Å²	12	110.4 Å²	110.4	6%	0.063	57%	0.572	C	S	.	*	T	Hydrogen-bonded Turn	trans	-63.1	-24.2	174.5	-53.9	-175.6	0	0	0	113	E328 L331 R332 D373 I374 L375	E328-L377 HydrophobicContact CB-CD1 4.17Å; E328-L377 HydrophobicContact CB-CD2 3.95Å; E328-L377 HydrophobicContact CG-CD1 4.17Å; E328-L377 HydrophobicContact CG-CD2 4.14Å; E328-L377 WeakPolarHBondContact OE2-CD2 3.43Å; L331-L377 HydrophobicContact CD2-CD1 4.45Å; R332-L377 PolarHBondContact NE-O 2.78Å; D373-L377 PolarHBondContact O-N 2.89Å; I374-L377 WeakPolarHBondContact O-CB 3.41Å; I374-L377 PolarHBondContact O-N 3.03Å; L375-L377 VanDerWaalsContact C-N 3.26Å
378	L	56.8	Low	45.8	Very low	26 Å²	26	112.3 Å²	112.3	14%	0.136	58%	0.578	C	S	.	*	T	Hydrogen-bonded Turn	trans	-87.6	-7	176	-55.8	173.6	0	0	0	114.1	L111 V115 L335 L375 K376	L111-L378 HydrophobicContact CD2-CD1 3.76Å; L111-L378 HydrophobicContact CD2-CD2 4.32Å; L111-L378 HydrophobicContact CD2-CG 4.49Å; V115-L378 HydrophobicContact CG2-CD2 4.08Å; L335-L378 HydrophobicContact CD1-CD2 4.33Å; L375-L378 HydrophobicContact CD2-CD1 3.94Å; L375-L378 PolarHBondContact O-N 2.73Å; K376-L378 PolarHBondContact O-N 3.1Å
379	A	55.4	Low	45.2	Very low	57 Å²	57	111 Å²	111	47%	0.471	57%	0.572	S	S	.	*	S	Bend	trans	-67.1	143.1	-177.8	0	0	0	0	0	111.3	K376 H381	K376-A379 WeakPolarHBondContact O-CB 3.32Å; K376-A379 PolarHBondContact O-N 3.45Å; K376-A379 VanDerWaalsContact O-N 3.09Å; A379-H381 PolarHBondContact O-N 3.43Å
380	P	46.1	Very low	44.9	Very low	111 Å²	111	106.7 Å²	106.7	72%	0.721	56%	0.564	S	S	*	*			trans	-68.4	105.5	179.2	27.3	-33.6	0	0	0	110.9	P116	P116-P380 HydrophobicContact CG-CB 4.45Å
381	H	41.9	Very low	44.6	Very low	144 Å²	144	107.2 Å²	107.2	67%	0.667	57%	0.568	S	S	*	*			trans	-77	140.9	169.9	-157	-80.5	0	0	0	110	A379 R383	A379-H381 PolarHBondContact O-N 3.43Å; H381-R383 PolarHBondContact O-N 2.91Å; H381-R383 VanDerWaalsContact O-N 3.14Å
382	P	38.1	Very low	43.9	Very low	103 Å²	103	107.9 Å²	107.9	67%	0.669	57%	0.568	S	S	*	*			trans	-56.3	121.8	169.7	23.1	-33.6	0	0	0	110.2
383	R	44.3	Very low	42.7	Very low	152 Å²	152	112.1 Å²	112.1	57%	0.574	59%	0.593	S	S	*	*			trans	-132	22.4	175.1	-81.7	-164.1	170.8	-176.8	-0	113.2	E333 H381	E333-R383 IonicContact OE1-CZ 3.13Å; E333-R383 VanDerWaalsContact OE1-CZ 3.31Å; E333-R383 IonicContact OE1-NH1 3.7Å; E333-R383 PolarHBondContact OE1-NH1 3.29Å; E333-R383 IonicContact OE1-NH2 3.29Å; E333-R383 PolarHBondContact OE1-NH2 2.85Å; E333-R383 IonicContact OE2-NH1 2.77Å; H381-R383 PolarHBondContact O-N 2.91Å; H381-R383 VanDerWaalsContact O-N 3.14Å
384	L	37.5	Very low	40.8	Very low	169 Å²	169	118.8 Å²	118.8	89%	0.885	62%	0.623	S	S	*	*	S	Bend	trans	-138.8	20.7	179	-75.7	176.8	0	0	0	113.6
385	K	27.7	Very low	39	Very low	186 Å²	186	125.1 Å²	125.1	81%	0.809	66%	0.662	S	S	*	*			trans	-155.4	57.2	178.4	-139.7	177.8	-168.2	-175.1	0	115.6
386	E	26.7	Very low	37.1	Very low	188 Å²	188	129.8 Å²	129.8	88%	0.879	69%	0.692	S	S	*	*			trans	-117.4	132.8	156.7	-72.3	-179.8	152	0	0	107.6
387	N	27.1	Very low	35.1	Very low	113 Å²	113	127.3 Å²	127.3	60%	0.604	69%	0.693	S	S	*	*			trans	-75.9	158.2	-169.5	-69.3	9.5	0	0	0	112.1	E389	N387-E389 HydrophobicContact CB-CB 4.3Å; N387-E389 HydrophobicContact CB-CG 4.39Å; N387-E389 PolarHBondContact ND2-OE2 3Å; N387-E389 PolarHBondContact O-N 3.16Å
388	V	30	Very low	33.5	Very low	145 Å²	145	134.4 Å²	134.4	88%	0.879	73%	0.725	S	S	*	*	S	Bend	trans	-79.9	-0.2	174.2	178	0	0	0	0	111.9	S390	V388-S390 VanDerWaalsContact C-N 3.33Å; V388-S390 PolarHBondContact O-N 3.44Å; V388-S390 VanDerWaalsContact O-N 3.07Å
389	E	26.5	Very low	32	Very low	163 Å²	163	140.6 Å²	140.6	76%	0.762	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	51.9	-169.8	-61.4	170	135	0	0	113.3	N387	N387-E389 HydrophobicContact CB-CB 4.3Å; N387-E389 HydrophobicContact CB-CG 4.39Å; N387-E389 PolarHBondContact ND2-OE2 3Å; N387-E389 PolarHBondContact O-N 3.16Å
390	S	28.7	Very low	30.4	Very low	104 Å²	104	145.5 Å²	145.5	73%	0.727	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.7	20.3	172.5	88.8	0	0	0	0	116.1	V388	V388-S390 VanDerWaalsContact C-N 3.33Å; V388-S390 PolarHBondContact O-N 3.44Å; V388-S390 VanDerWaalsContact O-N 3.07Å
391	M	32.2	Very low	29.6	Very low	180 Å²	180	145.8 Å²	145.8	89%	0.887	78%	0.778	S	S	*	*	S	Bend	trans	-133	45.6	173.7	-68.4	-145.6	87	0	0	114.1
392	T	28.7	Very low	28.7	Very low	124 Å²	124	149.5 Å²	149.5	76%	0.761	79%	0.786	S	S	*	*	S	Bend	trans	-137.9	139.2	156.1	46.3	0	0	0	0	110
393	T	27	Very low	28.2	Very low	131 Å²	131	153 Å²	153	80%	0.804	80%	0.798	S	S	*	*			trans	53.8	81.6	165	58.6	0	0	0	0	118.6
394	E	24.7	Very low	27.2	Very low	191 Å²	191	152.1 Å²	152.1	89%	0.893	81%	0.805	S	S	*	*			trans	-132.1	87.5	132	-79.6	-154.7	155.5	0	0	109.8
395	V	27.9	Very low	26.7	Very low	146 Å²	146	151.4 Å²	151.4	89%	0.885	80%	0.797	S	S	*	*			trans	-136.3	84.8	162.3	-177.8	0	0	0	0	107.6
396	T	25	Very low	26.5	Very low	136 Å²	136	147.6 Å²	147.6	83%	0.834	79%	0.785	S	S	*	*			trans	-129.9	133.6	167.2	35.4	0	0	0	0	109.1
397	S	25.1	Very low	26.4	Very low	93 Å²	93	144.6 Å²	144.6	65%	0.65	78%	0.775	S	S	*	*			trans	-66.6	142.1	176.8	46.6	0	0	0	0	111.4
398	H	25.6	Very low	26.3	Very low	160 Å²	160	145.3 Å²	145.3	74%	0.741	78%	0.778	S	S	*	*				163.8	105.7	114	-83.2	-64	0	0	0	111.9
399	N	25.2	Very low	25.9	Very low	157 Å²	157	146.6 Å²	146.6	84%	0.84	78%	0.775	S	S	*	*				169.2	136.3	102.9	-88	-54.9	0	0	0	112.2
400	L	23.4	Very low	25.7	Very low	159 Å²	159	146.7 Å²	146.7	83%	0.832	78%	0.78	S	S	*	*			trans	-121.8	121.4	171.6	-174.4	81.4	0	0	0	108.2
401	P	27.7	Very low	25.8	Very low	118 Å²	118	146.8 Å²	146.8	77%	0.766	78%	0.778	S	S	*	*			trans	-65.1	135.8	168.2	-20.7	33.9	0	0	0	110.7
402	R	24.6	Very low	25.4	Very low	221 Å²	221	146.2 Å²	146.2	83%	0.834	77%	0.772	S	S	*	*			trans	-67.7	140.8	-177.6	-63.9	171.5	173.8	173.7	-4.6	112.2
403	L	26.4	Very low	25	Very low	176 Å²	176	145 Å²	145	92%	0.921	77%	0.768	S	S	*	*				-123.4	135.1	128.7	-85	173	0	0	0	108.8
404	L	24.5	Very low	24.7	Very low	135 Å²	135	143.6 Å²	143.6	71%	0.707	76%	0.764	S	S	*	*			trans	-79.2	166.1	164.4	-70.5	157.2	0	0	0	106.9
405	Q	25.4	Very low	24.7	Very low	154 Å²	154	139.6 Å²	139.6	72%	0.72	76%	0.757	S	S	*	*			cis	-169.9	146.6	45	-174.3	151.1	-19.4	0	0	114.4
406	D	24.5	Very low	24.4	Very low	106 Å²	106	140 Å²	140	57%	0.567	75%	0.749	S	S	*	*			trans	66.6	129.7	150.2	-71	-4.1	0	0	0	124.8
407	N	24.8	Very low	24.4	Very low	125 Å²	125	141 Å²	141	67%	0.668	74%	0.744	S	S	*	*			trans	76.6	140	133.5	-66.3	-14.4	0	0	0	120.6
408	L	24.4	Very low	24.4	Very low	127 Å²	127	145 Å²	145	67%	0.665	75%	0.753	S	S	*	*			cis	-153.7	157.4	-0	-108.5	157.6	0	0	0	111.9
409	E	22.1	Very low	24.3	Very low	172 Å²	172	141.3 Å²	141.3	80%	0.804	75%	0.75	S	S	*	*			trans	64.2	123.7	150.1	-79.7	161.1	-175.9	0	0	124.8
410	L	21.2	Very low	24.3	Very low	166 Å²	166	138.5 Å²	138.5	87%	0.869	75%	0.748	S	S	*	*			trans	-86.4	-174.2	155	-73.1	163.9	0	0	0	109.2
411	P	31.7	Very low	24.4	Very low	106 Å²	106	135.2 Å²	135.2	69%	0.688	74%	0.744	S	S	*	*			cis	-135	-149.2	9.6	41.3	-17.8	0	0	0	112.4
412	H	23.2	Very low	24.2	Very low	167 Å²	167	141.9 Å²	141.9	77%	0.773	75%	0.754	S	S	*	*			cis	-157.1	171.9	3.4	-130.9	-37.7	0	0	0	113.1
413	C	19.9	Very low	24.2	Very low	99 Å²	99	135.1 Å²	135.1	67%	0.669	75%	0.754	S	S	*	*			trans	-23.8	171.4	149.6	-66.3	0	0	0	0	120.4
414	S	21.2	Very low	24.1	Very low	102 Å²	102	135.4 Å²	135.4	71%	0.713	76%	0.756	S	S	*	*			cis	145.4	128.7	-26.9	66.3	0	0	0	0	112.2
415	S	23.9	Very low	24.1	Very low	107 Å²	107	132.8 Å²	132.8	75%	0.748	76%	0.762	S	S	*	*			trans	-166.7	151.8	161.9	59.6	0	0	0	0	108.6
416	Q	23.5	Very low	24	Very low	154 Å²	154	130.8 Å²	130.8	72%	0.72	77%	0.765	S	S	*	*			cis	64.9	134.8	48.2	-73.4	171.4	-79.2	0	0	112.4
417	E	24.4	Very low	24	Very low	156 Å²	156	130.7 Å²	130.7	73%	0.729	77%	0.772	S	S	*	*			cis	-158.6	-170.9	10.3	-139.4	152.9	-142.8	0	0	114.9
418	E	24.8	Very low	24	Very low	179 Å²	179	131.3 Å²	131.3	84%	0.836	78%	0.775	S	S	*	*			trans	-25.4	169.6	167.6	-77.6	-164.5	178.5	0	0	121.8
419	A	24	Very low	24	Very low	82 Å²	82	132.9 Å²	132.9	68%	0.678	78%	0.781	S	S	*	*			cis	-174.5	-178.9	-17.4	0	0	0	0	0	112.2
420	A	24.6	Very low	24.3	Very low	97 Å²	97	131.7 Å²	131.7	80%	0.802	78%	0.78	S	S	*	*			trans	89	130.2	144.4	0	0	0	0	0	124.2
421	A	25.1	Very low	25	Very low	91 Å²	91	129.4 Å²	129.4	75%	0.752	78%	0.775	S	S	*	*			trans	84.3	108.1	134.3	0	0	0	0	0	124.4
422	R	24.8	Very low	24.7	Very low	257 Å²	257	127.9 Å²	127.9	97%	0.97	77%	0.771	S	S	*	*				54.4	133.4	128.5	-60.8	-174.2	179.4	-159.6	0.7	122.1
423	G	24.3	Very low	24.9	Very low	80 Å²	80	129.5 Å²	129.5	83%	0.825	78%	0.776	S	S	*	*			trans	-178.7	116.7	154.6	0	0	0	0	0	113.1
424	D	23.3	Very low	25.1	Very low	181 Å²	181	130.5 Å²	130.5	97%	0.968	78%	0.779	S	S	*	*			trans	-79.7	153.1	171	-77.4	-69.9	0	0	0	111.7
425	G	24.4	Very low	25.3	Very low	81 Å²	81	135.6 Å²	135.6	84%	0.835	79%	0.788	S	S	*	*			trans	-178.2	127.1	171.4	0	0	0	0	0	112.2
426	S	24.6	Very low	25.3	Very low	111 Å²	111	133.4 Å²	133.4	78%	0.776	78%	0.783	S	S	*	*			trans	-118.2	168.8	-172.9	66.4	0	0	0	0	112.9
427	S	24.3	Very low	25.4	Very low	104 Å²	104	134.5 Å²	134.5	73%	0.727	79%	0.793	S	S	*	*			trans	73.9	158.6	163	89.8	0	0	0	0	116.3
428	L	24.9	Very low	25.4	Very low	139 Å²	139	130.3 Å²	130.3	73%	0.728	79%	0.792	S	S	*	*			cis	-166.7	175.7	-22.4	-114.8	172.7	0	0	0	108
429	M	24.8	Very low	25.6	Very low	160 Å²	160	130.5 Å²	130.5	79%	0.788	79%	0.792	S	S	*	*			trans	75.4	128.2	164.8	-40.5	-49.3	179.2	0	0	119.3
430	D	28	Very low	25.8	Very low	147 Å²	147	132.9 Å²	132.9	79%	0.786	79%	0.79	S	S	*	*			trans	-77.6	156.8	155.4	-141.7	-50.2	0	0	0	109.1	A432	D430-A432 PolarHBondContact OD1-N 2.93Å
431	P	34.8	Very low	25.8	Very low	118 Å²	118	134.9 Å²	134.9	77%	0.766	78%	0.782	S	S	*	*				-156.5	127.1	102.4	36.2	-15.3	0	0	0	119.1
432	A	25.5	Very low	25.8	Very low	74 Å²	74	138.3 Å²	138.3	61%	0.612	78%	0.782	S	S	*	*				76.5	127.5	119	0	0	0	0	0	124.8	D430	D430-A432 PolarHBondContact OD1-N 2.93Å
433	K	27.2	Very low	25.8	Very low	201 Å²	201	132.4 Å²	132.4	87%	0.874	77%	0.767	S	S	*	*			trans	73.4	156.4	153.9	-60.6	173.8	176.6	176.6	0	116.7
434	V	25.1	Very low	25.8	Very low	119 Å²	119	136.5 Å²	136.5	72%	0.721	76%	0.762	S	S	*	*			cis	-151.9	150.2	33.5	170.6	0	0	0	0	113
435	K	25.3	Very low	25.7	Very low	210 Å²	210	132.4 Å²	132.4	91%	0.913	74%	0.74	S	S	*	*			trans	67.2	150.8	165.4	-81.9	169.6	179.2	-176.1	0	118.8
436	G	25	Very low	25.7	Very low	61 Å²	61	135.2 Å²	135.2	63%	0.629	73%	0.732	S	S	*	*			cis	176.6	155.9	-7	0	0	0	0	0	114.1
437	D	23.7	Very low	25.6	Very low	177 Å²	177	138.3 Å²	138.3	95%	0.947	73%	0.734	S	S	*	*			trans	60.2	142.9	169.4	-48.5	-30.9	0	0	0	119.1
438	G	26	Very low	25.5	Very low	67 Å²	67	141.3 Å²	141.3	69%	0.691	74%	0.737	S	S	*	*			cis	174.2	158	-10.4	0	0	0	0	0	113.7
439	Q	27.7	Very low	25.4	Very low	183 Å²	183	143.2 Å²	143.2	86%	0.855	74%	0.742	S	S	*	*			trans	69	145.6	163.8	-69.4	-176.9	-17.6	0	0	120.1
440	Q	28	Very low	25.3	Very low	132 Å²	132	143.4 Å²	143.4	62%	0.617	74%	0.741	S	S	*	*			cis	-169.5	160	-24.7	-143.4	166.3	-9.4	0	0	112.7
441	H	26	Very low	25.1	Very low	140 Å²	140	142 Å²	142	65%	0.648	73%	0.729	S	S	*	*			trans	68.2	147.7	162.8	-58.6	-62.4	0	0	0	119.4
442	H	23.6	Very low	24.5	Very low	163 Å²	163	142.5 Å²	142.5	76%	0.755	72%	0.72	S	S	*	*			cis	-144.4	160.3	-5.8	-140.7	-72.6	0	0	0	112.9
443	M	25.2	Very low	24.3	Very low	133 Å²	133	148 Å²	148	66%	0.655	73%	0.725	S	S	*	*			trans	-87.7	156.7	-177.4	-54.4	161.8	69.3	0	0	115.2	D445	M443-D445 WeakPolarHBondContact CE-OD2 3.44Å
444	K	24	Very low	24	Very low	165 Å²	165	144.4 Å²	144.4	72%	0.717	72%	0.715	S	S	*	*				159.5	160.2	114.8	-89.1	-140.8	151.3	-157.7	0	112.8
445	D	22.3	Very low	23.9	Very low	95 Å²	95	142.4 Å²	142.4	51%	0.508	71%	0.711	S	S	.	*			cis	171.3	156.2	-39.9	-91.2	-8	0	0	0	107.9	M443	M443-D445 WeakPolarHBondContact CE-OD2 3.44Å
446	Q	23.8	Very low	23.7	Very low	141 Å²	141	139.5 Å²	139.5	66%	0.659	71%	0.711	S	S	*	*			trans	69.7	132.2	164	-66.5	163.6	-52.6	0	0	117.9
447	E	22.5	Very low	23.5	Very low	175 Å²	175	141.5 Å²	141.5	82%	0.818	72%	0.716	S	S	*	*			cis	106.6	168.4	15.4	-65.3	179	137.9	0	0	115.6
448	E	23.1	Very low	24.1	Very low	168 Å²	168	138.2 Å²	138.2	79%	0.785	70%	0.704	S	S	*	*			trans	77	124.6	-176.4	-58.6	173.4	-165.2	0	0	114.8
449	E	21.8	Very low	24	Very low	178 Å²	178	144.7 Å²	144.7	83%	0.832	71%	0.713	S	S	*	*			cis	78.4	152	36.8	-60.5	-170.5	156.6	0	0	114.2
450	E	22.9	Very low	23.9	Very low	164 Å²	164	140.5 Å²	140.5	77%	0.766	71%	0.709	S	S	*	*			cis	-139	-162.2	-27.3	-126.9	-141.1	112.2	0	0	107
451	E	23.9	Very low	23.6	Very low	118 Å²	118	138.6 Å²	138.6	55%	0.551	72%	0.717	S	S	*	*			cis	-141	-149.5	8.1	-149.2	-171.8	175.9	0	0	105.4
452	K	22.7	Very low	23.5	Very low	129 Å²	129	137.4 Å²	137.4	56%	0.561	72%	0.724	S	S	*	*			cis	-166.7	-171	-7.2	-140.5	-176.5	-176.4	72.3	0	103.8
453	W	20.1	Very low	23.6	Very low	189 Å²	189	133.9 Å²	133.9	72%	0.716	72%	0.718	S	S	*	*			cis	-160.1	159.6	-28.4	-141	-138	0	0	0	103.3
454	D	21.4	Very low	23.5	Very low	125 Å²	125	136.6 Å²	136.6	67%	0.668	73%	0.726	S	S	*	*			cis	-142.8	-172.3	-0.7	-158.1	166.3	0	0	0	108.1
455	A	23.1	Very low	23.7	Very low	78 Å²	78	135.6 Å²	135.6	65%	0.645	73%	0.734	S	S	*	*			trans	-106.3	155.4	-168.4	0	0	0	0	0	115.4
456	T	20.9	Very low	23.8	Very low	148 Å²	148	135 Å²	135	91%	0.908	75%	0.75	S	S	*	*			trans	-151	147.7	131.6	-22.9	0	0	0	0	110.7
457	S	21.5	Very low	23.8	Very low	104 Å²	104	138 Å²	138	73%	0.727	76%	0.761	S	S	*	*			trans	-152.8	162.8	-179.2	-154.3	0	0	0	0	108.7
458	P	34.9	Very low	23.8	Very low	107 Å²	107	136.1 Å²	136.1	70%	0.695	77%	0.765	S	S	*	*				-153.8	142.5	83.3	36.5	-16.3	0	0	0	118
459	K	25.3	Very low	23.9	Very low	203 Å²	203	136.3 Å²	136.3	88%	0.883	77%	0.766	S	S	*	*			trans	64	141.5	139.7	-63.1	168.1	-175.5	173.4	0	119
460	A	23.9	Very low	24	Very low	95 Å²	95	137.2 Å²	137.2	79%	0.785	77%	0.77	S	S	*	*			cis	-165.9	-173.9	-13.5	0	0	0	0	0	107.2
461	A	23	Very low	24.1	Very low	93 Å²	93	138.8 Å²	138.8	77%	0.769	78%	0.775	S	S	*	*			cis	-157.8	-175.1	8.1	0	0	0	0	0	112.3
462	S	23.7	Very low	24.2	Very low	114 Å²	114	143.2 Å²	143.2	80%	0.797	79%	0.792	S	S	*	*			trans	-10.8	152.1	151.1	-85.8	0	0	0	0	121.1
463	S	24.7	Very low	24.3	Very low	90 Å²	90	148.9 Å²	148.9	63%	0.629	81%	0.81	S	S	*	*			cis	-179	158.2	-9.2	51.3	0	0	0	0	113.4
464	K	24.8	Very low	24.5	Very low	190 Å²	190	149.5 Å²	149.5	83%	0.826	82%	0.818	S	S	*	*			trans	63.5	114.9	147.8	-75.1	174.4	-179.4	178.8	0	121.2
465	T	27.4	Very low	24.5	Very low	143 Å²	143	151.7 Å²	151.7	88%	0.877	82%	0.823	S	S	*	*			trans	30.9	116.9	134.6	57.6	0	0	0	0	120.2
466	G	24.8	Very low	24.4	Very low	82 Å²	82	153.4 Å²	153.4	85%	0.845	83%	0.829	S	S	*	*			trans	-140.8	148.5	170	0	0	0	0	0	113.7
467	K	23.7	Very low	24.6	Very low	206 Å²	206	154.5 Å²	154.5	90%	0.896	82%	0.824	S	S	*	*			trans	-67.8	145.1	178.8	-62.3	168.1	-179.2	173.4	0	111.1
468	C	22.6	Very low	24.7	Very low	134 Å²	134	157.9 Å²	157.9	91%	0.905	83%	0.833	S	S	*	*			trans	-85	122.3	166.9	-164.9	0	0	0	0	109.7
469	Q	23.9	Very low	24.1	Very low	172 Å²	172	161 Å²	161	80%	0.804	84%	0.838	S	S	*	*			trans	-115	151.3	170.1	-81.5	-175.2	-45.4	0	0	110.2
470	E	25.1	Very low	24	Very low	197 Å²	197	157 Å²	157	92%	0.921	84%	0.835	S	S	*	*			trans	-61.4	144.7	179	-56.9	168.2	115.8	0	0	111.9
471	K	25.4	Very low	24	Very low	198 Å²	198	159.8 Å²	159.8	86%	0.861	83%	0.832	S	S	*	*			trans	-133.7	111	168.6	-71.9	-170.4	176.6	-179.5	0	110.7
472	K	25	Very low	24	Very low	210 Å²	210	163 Å²	163	91%	0.913	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-56	137.4	170.6	-64.9	179.1	177	-178.8	0	109.7
473	R	25.7	Very low	23.9	Very low	248 Å²	248	164.3 Å²	164.3	94%	0.936	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-90.9	140.7	175.3	-144.4	172	-172.7	175.1	0.6	109.5
474	K	23.3	Very low	23.9	Very low	202 Å²	202	166.4 Å²	166.4	88%	0.878	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-76.1	148.7	-173.3	-64.2	-177.7	176.1	-174.3	0	112
475	H	22	Very low	23.8	Very low	171 Å²	171	161.2 Å²	161.2	79%	0.792	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-98.9	153.6	163.3	-177.3	70.9	0	0	0	108.7
476	C	21.8	Very low	23.6	Very low	114 Å²	114	161.6 Å²	161.6	77%	0.77	83%	0.832	S	S	*	*			trans	-116.3	133.4	176.2	-73.7	0	0	0	0	109.4
477	Q	24.4	Very low	23.8	Very low	171 Å²	171	163.6 Å²	163.6	80%	0.799	83%	0.83	S	S	*	*			trans	-94.3	156.5	175	-66.9	166.3	-67.6	0	0	110.3
478	I	23.7	Very low	23.8	Very low	176 Å²	176	160.7 Å²	160.7	90%	0.903	83%	0.825	S	S	*	*			trans	-122.4	139.4	152.7	-67.3	178.1	0	0	0	105.2
479	E	22.3	Very low	23.9	Very low	173 Å²	173	164.2 Å²	164.2	81%	0.808	83%	0.825	S	S	*	*			trans	-96	154.1	-166.4	-62.6	171.1	127.5	0	0	113
480	S	22.3	Very low	24.1	Very low	117 Å²	117	160.7 Å²	160.7	82%	0.818	83%	0.825	S	S	*	*			trans	-149.6	118	151.6	59.6	0	0	0	0	109.2
481	Q	24.2	Very low	24.1	Very low	155 Å²	155	157.1 Å²	157.1	72%	0.724	82%	0.822	S	S	*	*			trans	-66.2	165	168.3	-66.6	158.2	-98.9	0	0	109.8
482	E	23.6	Very low	24.1	Very low	160 Å²	160	156.3 Å²	156.3	75%	0.748	82%	0.818	S	S	*	*			cis	-156.8	168.6	16.8	-153.2	135.4	-126.2	0	0	114.1
483	D	21.9	Very low	24.1	Very low	142 Å²	142	154.7 Å²	154.7	76%	0.759	81%	0.814	S	S	*	*			trans	105	153.6	142.6	-133	-12.8	0	0	0	121.2
484	T	23.8	Very low	24	Very low	133 Å²	133	149.3 Å²	149.3	82%	0.816	80%	0.803	S	S	*	*			trans	-60.3	154.8	-153.9	36.2	0	0	0	0	120
485	G	23.3	Very low	24.6	Very low	81 Å²	81	145.1 Å²	145.1	84%	0.835	80%	0.797	S	S	*	*			trans	162.4	86.9	158.9	0	0	0	0	0	116.3
486	M	24	Very low	24.9	Very low	151 Å²	151	143.1 Å²	143.1	74%	0.744	80%	0.799	S	S	*	*			trans	-139.3	135.8	168.6	-129.7	-71.2	164.1	0	0	110.2
487	P	27.1	Very low	25.1	Very low	124 Å²	124	143.7 Å²	143.7	81%	0.805	80%	0.8	S	S	*	*				-143.7	144.6	125.8	36.2	-22.4	0	0	0	114.9
488	N	24.9	Very low	25.7	Very low	145 Å²	145	142.8 Å²	142.8	78%	0.775	80%	0.8	S	S	*	*			trans	-70.8	144.8	166.4	-68.6	-60	0	0	0	111.6
489	K	24	Very low	25.9	Very low	209 Å²	209	142.4 Å²	142.4	91%	0.909	79%	0.794	S	S	*	*			trans	-153.2	139.1	146.1	-150	169.7	-174.5	177.8	0	111.9
490	A	28	Very low	26.4	Very low	98 Å²	98	138 Å²	138	81%	0.81	80%	0.795	S	S	*	*			trans	-108.2	155.1	176.3	0	0	0	0	0	111.3
491	S	25.6	Very low	26.7	Very low	122 Å²	122	139.8 Å²	139.8	85%	0.853	80%	0.796	S	S	*	*			trans	-150.8	157.1	155.2	-165.7	0	0	0	0	110.3
492	K	25.8	Very low	27.1	Very low	181 Å²	181	138.1 Å²	138.1	79%	0.787	80%	0.796	S	S	*	*			trans	-94.1	160.9	170.6	-60.8	174.9	174.5	-178.1	0	110
493	Q	24.8	Very low	27.8	Very low	176 Å²	176	133.9 Å²	133.9	82%	0.822	78%	0.783	S	S	*	*				-172	117.5	117.6	-103.8	169.1	-22.2	0	0	112.8
494	D	23.4	Very low	28.5	Very low	134 Å²	134	130 Å²	130	72%	0.717	77%	0.77	S	S	*	*			trans	56	154.2	133.8	-50.6	-18.5	0	0	0	122.3
495	P	35.1	Very low	29.7	Very low	115 Å²	115	126.4 Å²	126.4	75%	0.747	75%	0.745	S	S	*	*			trans	-105.4	154	-158.5	39.1	-33.6	0	0	0	115.6
496	P	28.5	Very low	31.1	Very low	128 Å²	128	126.3 Å²	126.3	83%	0.831	73%	0.732	S	S	*	*			trans	-85.8	128.2	167.9	33.1	-31.3	0	0	0	113.1
497	T	26.2	Very low	32.6	Very low	127 Å²	127	120.9 Å²	120.9	78%	0.779	71%	0.706	S	S	*	*			trans	-30.3	144.2	166	-40.8	0	0	0	0	117.9
498	D	37	Very low	34.1	Very low	151 Å²	151	118 Å²	118	81%	0.807	69%	0.687	S	S	*	*			trans	-59.8	135.1	167.3	-175.8	22.1	0	0	0	112.8
499	Q	29.2	Very low	35.4	Very low	168 Å²	168	117.4 Å²	117.4	79%	0.785	68%	0.684	S	S	*	*			trans	-143.5	135.4	170.7	-69.5	-165.5	-3.2	0	0	110	D501	Q499-D501 PolarHBondContact O-N 3.48Å
500	G	32	Very low	37	Very low	80 Å²	80	112.9 Å²	112.9	83%	0.825	69%	0.685	S	S	*	*			trans	-73.2	113.1	-166.6	0	0	0	0	0	115
501	D	29.1	Very low	38.7	Very low	156 Å²	156	110.3 Å²	110.3	83%	0.834	66%	0.661	S	S	*	*			trans	-67.1	131.8	174.8	-96.8	-40.1	0	0	0	113.4	Q499	Q499-D501 PolarHBondContact O-N 3.48Å
502	T	30.9	Very low	40.9	Very low	119 Å²	119	106 Å²	106	73%	0.73	63%	0.627	S	S	*	*			trans	-91.1	119.5	160.8	-59.8	0	0	0	0	108.5	A504	T502-A504 VanDerWaalsContact C-N 3.3Å; T502-A504 PolarHBondContact O-N 3.48Å
503	P	38.5	Very low	43.5	Very low	72 Å²	72	101.2 Å²	101.2	47%	0.468	61%	0.61	S	S	.	*			trans	-78.5	71.2	-165.3	31.2	-37.7	0	0	0	113.9	P274 N275	P274-P503 HydrophobicContact CG-CG 3.59Å; N275-P503 PolarHBondContact ND2-O 3.01Å
504	A	38	Very low	46.3	Very low	59 Å²	59	94.2 Å²	94.2	49%	0.488	58%	0.582	S	S	.	*			trans	-72.7	156.1	155	0	0	0	0	0	109.8	T502 S506	T502-A504 VanDerWaalsContact C-N 3.3Å; T502-A504 PolarHBondContact O-N 3.48Å; A504-S506 PolarHBondContact O-N 3.48Å
505	L	48.1	Very low	49.3	Very low	58 Å²	58	90.6 Å²	90.6	30%	0.304	57%	0.567	S	S	.	*			trans	-84	58.6	179.3	-67	168.1	0	0	0	111.5	V152 F237 P240	V152-L505 HydrophobicContact CG1-CB 3.69Å; F237-L505 HydrophobicContact CD1-CD2 3.71Å; F237-L505 HydrophobicContact CE1-CB 4.47Å; F237-L505 HydrophobicContact CE1-CD2 3.97Å; P240-L505 HydrophobicContact CB-CD2 4.44Å; P240-L505 HydrophobicContact CG-CD2 3.65Å
506	S	52.1	Low	51.9	Low	80 Å²	80	87.1 Å²	87.1	56%	0.559	54%	0.542	S	S	*	.			trans	-63.7	148.5	155.4	45.7	0	0	0	0	109.1	A504	A504-S506 PolarHBondContact O-N 3.48Å
507	L	56.2	Low	55	Low	37 Å²	37	81 Å²	81	19%	0.194	50%	0.503	C	S	.	.			trans	-81.6	134.4	172.4	-93.6	158.5	0	0	0	109.4	L236 F237 L509 F582	L236-L507 HydrophobicContact CB-CD2 4.25Å; L236-L507 HydrophobicContact CD1-CD2 3.82Å; L236-L507 HydrophobicContact CG-CD2 4.47Å; F237-L507 HydrophobicContact CE1-CD2 4.34Å; F237-L507 HydrophobicContact CE2-CD2 3.71Å; F237-L507 HydrophobicContact CZ-CD2 3.38Å; F237-L507 HydrophobicContact CZ-CG 3.82Å; L507-L509 PolarHBondContact O-N 3.14Å; L507-F582 HydrophobicContact CD1-CD1 3.79Å; L507-F582 HydrophobicContact CD1-CD2 4.13Å; L507-F582 HydrophobicContact CD1-CE1 3.23Å; L507-F582 HydrophobicContact CD1-CE2 3.64Å; L507-F582 HydrophobicContact CD1-CG 4.22Å; L507-F582 HydrophobicContact CD1-CZ 3.16Å
508	P	58.9	Low	58.3	Low	63 Å²	63	78.4 Å²	78.4	41%	0.409	48%	0.482	S	S	.	.			trans	-68.6	84.8	165.4	-13.6	29.2	0	0	0	108.5	A510 S511	P508-A510 PolarHBondContact O-N 3.09Å; P508-S511 PolarHBondContact O-N 3.33Å; P508-S511 PolarHBondContact O-OG 3.28Å
509	L	52.7	Low	61.2	Low	133 Å²	133	71.2 Å²	71.2	70%	0.696	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.5	-170	-148	74.2	0	0	0	112.8	L507 S511	L507-L509 PolarHBondContact O-N 3.14Å; L509-S511 VanDerWaalsContact C-N 3.34Å; L509-S511 PolarHBondContact O-N 2.89Å
510	A	56.8	Low	64.3	Low	113 Å²	113	65.8 Å²	65.8	93%	0.934	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-2.5	175.4	0	0	0	0	0	115.5	P508	P508-A510 PolarHBondContact O-N 3.09Å
511	S	63.1	Low	67.4	Low	44 Å²	44	64.2 Å²	64.2	31%	0.308	40%	0.4	S	S	.	.	S	Bend	trans	-118.7	-1.6	-179.4	75.5	0	0	0	0	115.1	K235 P508 L509	K235-S511 WeakPolarHBondContact CE-O 3.46Å; K235-S511 PolarHBondContact NZ-O 2.94Å; K235-S511 VanDerWaalsContact NZ-O 3.12Å; P508-S511 PolarHBondContact O-N 3.33Å; P508-S511 PolarHBondContact O-OG 3.28Å; L509-S511 VanDerWaalsContact C-N 3.34Å; L509-S511 PolarHBondContact O-N 2.89Å
512	F	72.8	Confident	70.5	Confident	31 Å²	31	58.5 Å²	58.5	14%	0.136	37%	0.372	C	S	.	.			trans	-98.8	124.7	179.1	177.2	-108.4	0	0	0	110.4	L232 L236 L517 L578 F582 L583	L232-F512 HydrophobicContact CD1-CD2 4.15Å; L232-F512 HydrophobicContact CD1-CE2 4.2Å; L236-F512 HydrophobicContact CD1-CD2 3.87Å; L236-F512 HydrophobicContact CD2-CB 3.79Å; L236-F512 HydrophobicContact CD2-CD2 4.15Å; L236-F512 HydrophobicContact CD2-CG 4.45Å; F512-L517 HydrophobicContact CE2-CD1 3.79Å; F512-L517 HydrophobicContact CE2-CG 4.39Å; F512-L517 HydrophobicContact CZ-CD1 3.55Å; F512-L578 HydrophobicContact CE2-CD2 3.54Å; F512-L578 HydrophobicContact CZ-CD2 3.49Å; F512-L578 VanDerWaalsContact CZ-CD2 3.49Å; F512-F582 HydrophobicContact CD1-CB 4Å; F512-F582 HydrophobicContact CE1-CB 3.33Å; F512-F582 HydrophobicContact CE1-CG 4.38Å; F512-F582 HydrophobicContact CZ-CB 3.9Å; F512-L583 HydrophobicContact CE1-CD1 4.24Å; F512-L583 HydrophobicContact CE1-CD2 3.79Å; F512-L583 HydrophobicContact CE1-CG 3.73Å; F512-L583 HydrophobicContact CZ-CD1 4.11Å; F512-L583 HydrophobicContact CZ-CD2 4.46Å; F512-L583 HydrophobicContact CZ-CG 4.03Å
513	D	79.1	Confident	73.5	Confident	81 Å²	81	59.1 Å²	59.1	43%	0.433	37%	0.368	S	S	.	.			trans	-127.8	145.1	-175.1	176.9	7.7	0	0	0	109.7	S515 D516	D513-S515 PolarHBondContact O-N 3.11Å; D513-S515 VanDerWaalsContact O-N 3.15Å; D513-S515 PolarHBondContact OD1-N 3.13Å; D513-S515 VanDerWaalsContact OD1-N 3.12Å; D513-S515 WeakPolarHBondContact OD2-CB 3.42Å; D513-S515 PolarHBondContact OD2-OG 2.83Å; D513-D516 PolarHBondContact N-OD2 2.95Å; D513-D516 WeakPolarHBondContact O-CB 3.49Å; D513-D516 PolarHBondContact O-N 3.43Å
514	A	84.3	Confident	76.2	Confident	29 Å²	29	60.3 Å²	60.3	24%	0.24	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-55.3	-28.8	173	0	0	0	0	0	112.6	D516 L517 L583	A514-D516 PolarHBondContact O-N 3.47Å; A514-L517 CarbonylContact O-C 3.58Å; A514-L517 PolarHBondContact O-N 3Å; A514-L583 HydrophobicContact CB-CD1 4Å; A514-L583 HydrophobicContact CB-CD2 4.1Å
515	S	87.3	Confident	79	Confident	58 Å²	58	58.2 Å²	58.2	41%	0.406	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-61.4	-27.7	174.7	77	0	0	0	0	113.8	D513 L517 E518	D513-S515 PolarHBondContact O-N 3.11Å; D513-S515 VanDerWaalsContact O-N 3.15Å; D513-S515 PolarHBondContact OD1-N 3.13Å; D513-S515 VanDerWaalsContact OD1-N 3.12Å; D513-S515 WeakPolarHBondContact OD2-CB 3.42Å; D513-S515 PolarHBondContact OD2-OG 2.83Å; S515-L517 PolarHBondContact O-N 2.63Å; S515-E518 PolarHBondContact O-N 2.84Å
516	D	89.4	Confident	81.3	Confident	42 Å²	42	55.6 Å²	55.6	23%	0.225	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-65.5	-18.1	174.5	-64.7	-49	0	0	0	112.5	L232 K235 D513 A514	L232-D516 HydrophobicContact CD1-CB 3.86Å; K235-D516 WeakPolarHBondContact CD-OD1 3.24Å; K235-D516 IonicContact NZ-OD1 3.32Å; K235-D516 PolarHBondContact NZ-OD1 2.95Å; K235-D516 IonicContact NZ-OD2 2.69Å; K235-D516 PolarHBondContact NZ-OD2 3.17Å; D513-D516 PolarHBondContact N-OD2 2.95Å; D513-D516 WeakPolarHBondContact O-CB 3.49Å; D513-D516 PolarHBondContact O-N 3.43Å; A514-D516 PolarHBondContact O-N 3.47Å
517	L	93.8	Very high	83.4	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-120.2	24.8	-174.7	-62.9	176	0	0	0	112.5	V228 L232 F512 A514 S515 L525 F526 M575 L578 I579 L583	V228-L517 HydrophobicContact CG1-CD2 4.37Å; L232-L517 HydrophobicContact CD2-CD2 4.02Å; F512-L517 HydrophobicContact CE2-CD1 3.79Å; F512-L517 HydrophobicContact CE2-CG 4.39Å; F512-L517 HydrophobicContact CZ-CD1 3.55Å; A514-L517 CarbonylContact O-C 3.58Å; A514-L517 PolarHBondContact O-N 3Å; S515-L517 PolarHBondContact O-N 2.63Å; L517-L525 HydrophobicContact CB-CD1 3.76Å; L517-L525 WeakPolarHBondContact O-CA 3.33Å; L517-F526 VanDerWaalsContact C-CD2 3.44Å; L517-F526 HydrophobicContact CB-CD2 4.14Å; L517-F526 HydrophobicContact CD2-CD2 4.45Å; L517-F526 WeakPolarHBondContact O-CD2 3.12Å; L517-F526 WeakPolarHBondContact O-CG 3.33Å; L517-F526 PolarHBondContact O-N 3.36Å; L517-M575 HydrophobicContact CD2-CE 3.57Å; L517-M575 HydrophobicContact CD2-SD 4.48Å; L517-L578 HydrophobicContact CD1-CD2 3.76Å; L517-I579 HydrophobicContact CD1-CG1 3.86Å; L517-L583 HydrophobicContact CB-CD1 4.44Å; L517-L583 HydrophobicContact CD1-CD1 3.79Å
518	E	95.4	Very high	85.2	Confident	72 Å²	72	52.8 Å²	52.8	34%	0.336	31%	0.306	S	S	.	.	B	Isolated β-bridge	trans	-77.2	140.1	170.1	-81.2	-173.6	-139.8	0	0	113.2	S515 A520 M523 R524 F526	S515-E518 PolarHBondContact O-N 2.84Å; E518-A520 PolarHBondContact O-N 3.03Å; E518-M523 WeakPolarHBondContact OE2-CA 3.14Å; E518-R524 WeakPolarHBondContact CA-O 3.48Å; E518-F526 VanDerWaalsContact O-CZ 3.3Å; E518-F526 WeakPolarHBondContact O-CZ 3.34Å
519	C	96.8	Very high	87	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.287	C	S	.	.			trans	-82.3	115.3	166.4	-177.6	0	0	0	0	111.1	L521 C522 M523 R524 F526 C539	C519-L521 PolarHBondContact O-N 3.23Å; C519-C522 PolarHBondContact O-N 2.85Å; C519-M523 PolarHBondContact O-N 3.09Å; C519-R524 PolarHBondContact N-O 3.49Å; C519-F526 HydrophobicContact CB-CD1 3.65Å; C519-F526 HydrophobicContact CB-CE1 3.56Å; C519-F526 HydrophobicContact CB-CZ 4.41Å; C519-C539 HydrophobicContact CB-CB 4.49Å; C519-C539 WeakPolarHBondContact CB-SG 3.5Å; C519-C539 PolarHBondContact SG-N 2.91Å
520	A	95.7	Very high	89.1	Confident	55 Å²	55	43.9 Å²	43.9	46%	0.455	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	14.1	175.6	0	0	0	0	0	116.5	E518 L555	E518-A520 PolarHBondContact O-N 3.03Å; A520-L555 HydrophobicContact CB-CD1 4.49Å; A520-L555 HydrophobicContact CB-CD2 4.33Å
521	L	95.4	Very high	90.8	Very high	46 Å²	46	39.1 Å²	39.1	24%	0.241	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.2	-17.7	172.2	-64.8	177.3	0	0	0	113.5	C519 F538 C542 P554	C519-L521 PolarHBondContact O-N 3.23Å; L521-F538 HydrophobicContact CD1-CB 4.22Å; L521-F538 HydrophobicContact CD1-CD1 3.34Å; L521-F538 HydrophobicContact CD1-CE1 3.86Å; L521-F538 HydrophobicContact CD1-CG 3.92Å; L521-F538 HydrophobicContact CD2-CE1 4.46Å; L521-F538 HydrophobicContact CG-CD1 3.66Å; L521-F538 HydrophobicContact CG-CE1 3.94Å; L521-C542 HydrophobicContact CB-CB 3.79Å; L521-C542 HydrophobicContact CD1-CB 3.75Å; L521-C542 HydrophobicContact CG-CB 4.44Å; L521-P554 HydrophobicContact CD1-CG 4.26Å; L521-P554 HydrophobicContact CD2-CB 3.76Å; L521-P554 HydrophobicContact CD2-CG 3.97Å
522	C	94.4	Very high	92.2	Very high	37 Å²	37	37.2 Å²	37.2	25%	0.25	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.3	-7.2	177.7	63.4	0	0	0	0	114.4	C519 R524	C519-C522 PolarHBondContact O-N 2.85Å; C522-R524 VanDerWaalsContact C-N 3.29Å; C522-R524 PolarHBondContact O-N 3.36Å
523	M	94.8	Very high	92.9	Very high	131 Å²	131	37.9 Å²	37.9	65%	0.645	21%	0.209	S	C	*	.	S	Bend	trans	51.2	50.3	-179.1	-46.2	-51.5	-65.8	0	0	111.5	E518 C519	E518-M523 WeakPolarHBondContact OE2-CA 3.14Å; C519-M523 PolarHBondContact O-N 3.09Å
524	R	94.9	Very high	93.4	Very high	97 Å²	97	34.3 Å²	34.3	37%	0.366	19%	0.191	S	C	.	.	S	Bend	trans	-148.7	157.3	178.9	-64.8	-178.7	-173.8	166.6	-0.3	107.8	E518 C519 C522 E597	E518-R524 WeakPolarHBondContact CA-O 3.48Å; C519-R524 PolarHBondContact N-O 3.49Å; C522-R524 VanDerWaalsContact C-N 3.29Å; C522-R524 PolarHBondContact O-N 3.36Å; R524-E597 IonicContact CZ-OE1 2.8Å; R524-E597 IonicContact NH1-OE1 3.01Å; R524-E597 PolarHBondContact NH1-OE1 3.08Å; R524-E597 IonicContact NH1-OE2 2.71Å; R524-E597 IonicContact NH2-OE1 3.87Å; R524-E597 PolarHBondContact NH2-OE1 2.78Å
525	L	96.3	Very high	93.8	Very high	16 Å²	16	33 Å²	33	8%	0.084	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-44.5	137.5	171.3	-179	61.5	0	0	0	112.3	L517 Y527 I579 L583 E586 L587 R590	L517-L525 HydrophobicContact CB-CD1 3.76Å; L517-L525 WeakPolarHBondContact O-CA 3.33Å; L525-Y527 PolarHBondContact O-N 2.74Å; L525-I579 HydrophobicContact CD1-CG1 4.33Å; L525-I579 HydrophobicContact CD1-CG2 4.11Å; L525-I579 HydrophobicContact CD2-CG2 3.97Å; L525-I579 HydrophobicContact CG-CG2 4.25Å; L525-L583 HydrophobicContact CD1-CD1 3.61Å; L525-L583 HydrophobicContact CD2-CB 4.45Å; L525-L583 HydrophobicContact CD2-CD1 4.47Å; L525-E586 HydrophobicContact CD2-CB 3.71Å; L525-L587 HydrophobicContact CD2-CB 4.47Å; L525-R590 HydrophobicContact CD2-CB 4.47Å
526	F	96.9	Very high	94.2	Very high	3 Å²	3	31.8 Å²	31.8	1%	0.013	17%	0.168	C	C	.	.			trans	-53.3	123.3	175.5	-78.8	-61.8	0	0	0	111.9	V228 L517 E518 C519 P529 T537 M575 I579	V228-F526 HydrophobicContact CG1-CE2 4.14Å; V228-F526 HydrophobicContact CG2-CE2 4.42Å; V228-F526 HydrophobicContact CG2-CZ 4.25Å; L517-F526 VanDerWaalsContact C-CD2 3.44Å; L517-F526 HydrophobicContact CB-CD2 4.14Å; L517-F526 HydrophobicContact CD2-CD2 4.45Å; L517-F526 WeakPolarHBondContact O-CD2 3.12Å; L517-F526 WeakPolarHBondContact O-CG 3.33Å; L517-F526 PolarHBondContact O-N 3.36Å; E518-F526 VanDerWaalsContact O-CZ 3.3Å; E518-F526 WeakPolarHBondContact O-CZ 3.34Å; C519-F526 HydrophobicContact CB-CD1 3.65Å; C519-F526 HydrophobicContact CB-CE1 3.56Å; C519-F526 HydrophobicContact CB-CZ 4.41Å; F526-P529 HydrophobicContact CB-CB 4.04Å; F526-P529 HydrophobicContact CB-CG 4.44Å; F526-P529 HydrophobicContact CD1-CB 4.26Å; F526-P529 HydrophobicContact CG-CB 4.17Å; F526-T537 HydrophobicContact CD1-CG2 4.38Å; F526-T537 HydrophobicContact CE1-CG2 3.97Å; F526-T537 WeakPolarHBondContact CE1-O 3.37Å; F526-T537 HydrophobicContact CZ-CG2 4.11Å; F526-M575 HydrophobicContact CD2-CE 3.5Å; F526-M575 VanDerWaalsContact CD2-CE 3.5Å; F526-M575 HydrophobicContact CE2-CE 3.66Å; F526-M575 HydrophobicContact CG-CE 4.34Å; F526-I579 HydrophobicContact CB-CD1 3.69Å
527	Y	95.6	Very high	94.5	Very high	20 Å²	20	30 Å²	30	8%	0.078	16%	0.159	C	C	.	.	S	Bend	trans	-116.4	123.8	168.7	-166.8	-107.1	0	0	0	109	L525 C539 L587 R590 R591 Y594	L525-Y527 PolarHBondContact O-N 2.74Å; Y527-C539 PolarHBondContact N-SG 2.95Å; Y527-C539 VanDerWaalsContact O-CA 3.26Å; Y527-C539 WeakPolarHBondContact O-CA 3.17Å; Y527-C539 VanDerWaalsContact O-CB 3.26Å; Y527-C539 WeakPolarHBondContact O-CB 3.19Å; Y527-L587 HydrophobicContact CD2-CD1 4.4Å; Y527-R590 HydrophobicContact CD2-CG 3.97Å; Y527-R590 HydrophobicContact CG-CG 4.23Å; Y527-R591 HydrophobicContact CE2-CB 4.06Å; Y527-R591 PolarHBondContact OH-NH1 3.48Å; Y527-R591 VanDerWaalsContact OH-NH1 3.16Å; Y527-Y594 HydrophobicContact CD1-CD1 4.45Å; Y527-Y594 AromaticContact CD1-CD2 3.91Å; Y527-Y594 HydrophobicContact CD1-CD2 3.91Å; Y527-Y594 HydrophobicContact CD1-CE2 4.41Å; Y527-Y594 AromaticContact CD1-CG 3.93Å; Y527-Y594 HydrophobicContact CD1-CG 3.93Å; Y527-Y594 AromaticContact CE1-CD1 3.49Å; Y527-Y594 HydrophobicContact CE1-CD1 3.49Å; Y527-Y594 VanDerWaalsContact CE1-CD1 3.49Å; Y527-Y594 AromaticContact CE1-CD2 3.73Å; Y527-Y594 HydrophobicContact CE1-CD2 3.73Å; Y527-Y594 AromaticContact CE1-CE1 3.91Å; Y527-Y594 HydrophobicContact CE1-CE1 3.91Å; Y527-Y594 HydrophobicContact CE1-CE2 4.11Å; Y527-Y594 AromaticContact CE1-CG 3.39Å; Y527-Y594 HydrophobicContact CE1-CG 3.39Å; Y527-Y594 AromaticContact CZ-CD1 3.88Å
528	E	95.3	Very high	94.6	Very high	38 Å²	38	30 Å²	30	18%	0.178	16%	0.159	C	C	.	.	S	Bend	trans	48.8	63	-170.2	-50.8	-166.2	127.8	0	0	112.2	V530 L540 K571	E528-V530 PolarHBondContact O-N 3.17Å; E528-L540 HydrophobicContact CB-CB 3.91Å; E528-L540 WeakPolarHBondContact O-CB 3.17Å; E528-L540 PolarHBondContact O-N 3.29Å; E528-L540 WeakPolarHBondContact OE2-CD2 3.35Å; E528-K571 HydrophobicContact CB-CD 4.05Å; E528-K571 HydrophobicContact CB-CG 4.38Å; E528-K571 VanDerWaalsContact CD-CE 3.49Å; E528-K571 HydrophobicContact CG-CD 4.24Å; E528-K571 WeakPolarHBondContact OE1-CE 3.5Å; E528-K571 IonicContact OE1-NZ 3.63Å; E528-K571 PolarHBondContact OE1-NZ 3.49Å
529	P	96.9	Very high	94.7	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.013	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	124.6	-175	22.4	-32.6	0	0	0	112.2	F526 T537 F538 K571 N572 M575 E576 I579	F526-P529 HydrophobicContact CB-CB 4.04Å; F526-P529 HydrophobicContact CB-CG 4.44Å; F526-P529 HydrophobicContact CD1-CB 4.26Å; F526-P529 HydrophobicContact CG-CB 4.17Å; P529-T537 HydrophobicContact CB-CG2 3.93Å; P529-F538 CarbonylContact C-O 3.37Å; P529-F538 WeakPolarHBondContact CA-O 3.31Å; P529-K571 CarbonylContact O-C 3.52Å; P529-K571 WeakPolarHBondContact O-CA 3.26Å; P529-N572 PolarHBondContact O-N 3.13Å; P529-M575 HydrophobicContact CB-CB 3.83Å; P529-M575 HydrophobicContact CB-CG 4.35Å; P529-M575 HydrophobicContact CG-CB 3.47Å; P529-M575 VanDerWaalsContact CG-CB 3.47Å; P529-M575 HydrophobicContact CG-CG 4.48Å; P529-E576 HydrophobicContact CG-CG 3.91Å; P529-I579 HydrophobicContact CG-CD1 4.17Å
530	V	95	Very high	94.5	Very high	7 Å²	7	27.9 Å²	27.9	4%	0.042	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	125.7	175.9	177	0	0	0	0	109.4	E528 T537 F538 L540 L543 Y569	E528-V530 PolarHBondContact O-N 3.17Å; V530-T537 WeakPolarHBondContact O-CA 3.02Å; V530-F538 PolarHBondContact N-O 2.73Å; V530-F538 PolarHBondContact O-N 2.9Å; V530-L540 HydrophobicContact CG2-CB 4.04Å; V530-L540 HydrophobicContact CG2-CD1 3.96Å; V530-L543 HydrophobicContact CB-CD2 4.42Å; V530-L543 HydrophobicContact CG1-CD2 4Å; V530-Y569 HydrophobicContact CG1-CD1 4.26Å
531	T	93.9	Very high	94.2	Very high	12 Å²	12	27.7 Å²	27.7	7%	0.074	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	124.3	174.9	-52.1	0	0	0	0	110.6	N226 T537 N572	N226-T531 HydrophobicContact CB-CG2 4.2Å; N226-T531 PolarHBondContact ND2-OG1 3.41Å; N226-T531 VanDerWaalsContact ND2-OG1 3.1Å; T531-T537 PolarHBondContact OG1-OG1 2.7Å; T531-N572 PolarHBondContact OG1-ND2 3.3Å
532	T	91.9	Very high	94.1	Very high	4 Å²	4	26.3 Å²	26.3	3%	0.025	13%	0.133	C	C	.	.			trans	-77.7	155.7	179	55.4	0	0	0	0	112.1	C534 G535 H536 F538 L543 L560	T532-C534 PolarHBondContact O-N 2.83Å; T532-C534 PolarHBondContact OG1-SG 2.77Å; T532-G535 PolarHBondContact O-N 3.34Å; T532-H536 PolarHBondContact N-O 3.19Å; T532-H536 PolarHBondContact OG1-N 2.64Å; T532-H536 PolarHBondContact OG1-O 2.75Å; T532-F538 HydrophobicContact CG2-CD2 3.91Å; T532-F538 HydrophobicContact CG2-CE2 3.93Å; T532-L543 HydrophobicContact CG2-CD1 3.89Å; T532-L543 HydrophobicContact CG2-CD2 3.72Å; T532-L543 HydrophobicContact CG2-CG 4.5Å; T532-L560 HydrophobicContact CG2-CD1 3.87Å; T532-L560 HydrophobicContact CG2-CD2 4.35Å
533	P	87.8	Confident	93.9	Very high	45 Å²	45	24.6 Å²	24.6	29%	0.292	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-18.2	179.1	-27.1	35.6	0	0	0	115.8	V204 R224	V204-P533 HydrophobicContact CG2-CB 4.18Å; V204-P533 HydrophobicContact CG2-CG 4.41Å; R224-P533 WeakPolarHBondContact CB-O 3.49Å; R224-P533 WeakPolarHBondContact CG-O 3.24Å
534	C	90.1	Very high	93.6	Very high	7 Å²	7	19.2 Å²	19.2	5%	0.047	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-6.7	175.1	59.6	0	0	0	0	114.6	R224 T532 H536 C556 D558	R224-C534 WeakPolarHBondContact CB-O 3.47Å; R224-C534 PolarHBondContact NE-O 3.07Å; T532-C534 PolarHBondContact O-N 2.83Å; T532-C534 PolarHBondContact OG1-SG 2.77Å; C534-H536 PolarHBondContact SG-ND1 3.02Å; C534-H536 VanDerWaalsContact SG-ND1 3.4Å; C534-C556 PolarHBondContact SG-SG 2.92Å; C534-D558 HydrophobicContact CB-CB 3.82Å; C534-D558 WeakPolarHBondContact CB-OD2 3.3Å
535	G	92.2	Very high	93.2	Very high	2 Å²	2	19.5 Å²	19.5	2%	0.021	10%	0.096	C	C	.	.	S	Bend	trans	104.4	0.9	177.6	0	0	0	0	0	115.8	V225 N226 V227 T532	V225-G535 WeakPolarHBondContact O-CA 3.4Å; N226-G535 CarbonylContact C-O 3.56Å; N226-G535 VanDerWaalsContact CA-O 3.32Å; N226-G535 WeakPolarHBondContact CA-O 3.38Å; V227-G535 PolarHBondContact N-O 3Å; T532-G535 PolarHBondContact O-N 3.34Å
536	H	95.1	Very high	92.8	Very high	31 Å²	31	20.5 Å²	20.5	14%	0.144	10%	0.103	C	C	.	.			trans	-97.5	138	-175.9	-61.5	85.8	0	0	0	111.6	T532 C534 F538 L555 C556	T532-H536 PolarHBondContact N-O 3.19Å; T532-H536 PolarHBondContact OG1-N 2.64Å; T532-H536 PolarHBondContact OG1-O 2.75Å; C534-H536 PolarHBondContact SG-ND1 3.02Å; C534-H536 VanDerWaalsContact SG-ND1 3.4Å; H536-F538 HydrophobicContact CB-CE2 3.66Å; H536-F538 HydrophobicContact CB-CZ 3.75Å; H536-L555 HydrophobicContact CB-CD1 4.22Å; H536-C556 VanDerWaalsContact CE1-CB 3.5Å; H536-C556 WeakPolarHBondContact CE1-CB 3.44Å; H536-C556 PolarHBondContact CE1-SG 3.35Å; H536-C556 PolarHBondContact ND1-SG 3.2Å
537	T	96.4	Very high	92.3	Very high	5 Å²	5	20.5 Å²	20.5	3%	0.031	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	138.2	-177.4	-55.6	0	0	0	0	110.9	N226 F526 P529 V530 T531 M575	N226-T537 PolarHBondContact ND2-OG1 3.31Å; N226-T537 PolarHBondContact OD1-OG1 2.82Å; F526-T537 HydrophobicContact CD1-CG2 4.38Å; F526-T537 HydrophobicContact CE1-CG2 3.97Å; F526-T537 WeakPolarHBondContact CE1-O 3.37Å; F526-T537 HydrophobicContact CZ-CG2 4.11Å; P529-T537 HydrophobicContact CB-CG2 3.93Å; V530-T537 WeakPolarHBondContact O-CA 3.02Å; T531-T537 PolarHBondContact OG1-OG1 2.7Å; T537-M575 HydrophobicContact CG2-CE 4.31Å
538	F	96.8	Very high	91.6	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	156.6	-176.6	-57.4	-73	0	0	0	110.3	L521 P529 V530 T532 H536 L543 P554 L555	L521-F538 HydrophobicContact CD1-CB 4.22Å; L521-F538 HydrophobicContact CD1-CD1 3.34Å; L521-F538 HydrophobicContact CD1-CE1 3.86Å; L521-F538 HydrophobicContact CD1-CG 3.92Å; L521-F538 HydrophobicContact CD2-CE1 4.46Å; L521-F538 HydrophobicContact CG-CD1 3.66Å; L521-F538 HydrophobicContact CG-CE1 3.94Å; P529-F538 CarbonylContact C-O 3.37Å; P529-F538 WeakPolarHBondContact CA-O 3.31Å; V530-F538 PolarHBondContact N-O 2.73Å; V530-F538 PolarHBondContact O-N 2.9Å; T532-F538 HydrophobicContact CG2-CD2 3.91Å; T532-F538 HydrophobicContact CG2-CE2 3.93Å; H536-F538 HydrophobicContact CB-CE2 3.66Å; H536-F538 HydrophobicContact CB-CZ 3.75Å; F538-L543 HydrophobicContact CB-CB 3.98Å; F538-L543 HydrophobicContact CD2-CD1 3.94Å; F538-L543 HydrophobicContact CE2-CD1 4.38Å; F538-P554 HydrophobicContact CZ-CG 4.39Å; F538-L555 HydrophobicContact CE1-CD1 3.7Å; F538-L555 HydrophobicContact CE1-CG 3.91Å; F538-L555 HydrophobicContact CZ-CD1 3.77Å; F538-L555 HydrophobicContact CZ-CG 3.89Å
539	C	96.1	Very high	91	Very high	4 Å²	4	23.3 Å²	23.3	3%	0.027	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	139.4	161.5	-56.6	0	0	0	0	109.5	C519 Y527 K541 C542 L543	C519-C539 HydrophobicContact CB-CB 4.49Å; C519-C539 WeakPolarHBondContact CB-SG 3.5Å; C519-C539 PolarHBondContact SG-N 2.91Å; Y527-C539 PolarHBondContact N-SG 2.95Å; Y527-C539 VanDerWaalsContact O-CA 3.26Å; Y527-C539 WeakPolarHBondContact O-CA 3.17Å; Y527-C539 VanDerWaalsContact O-CB 3.26Å; Y527-C539 WeakPolarHBondContact O-CB 3.19Å; C539-K541 PolarHBondContact O-N 2.92Å; C539-C542 HydrophobicContact CB-CB 4.07Å; C539-C542 PolarHBondContact O-N 3.18Å; C539-L543 PolarHBondContact O-N 3.09Å
540	L	92.9	Very high	90.4	Very high	23 Å²	23	27.4 Å²	27.4	12%	0.12	14%	0.139	C	C	.	.	H	α-helix	trans	-45.6	-57.7	179.8	173.8	61.3	0	0	0	112.1	E528 V530 C542 L543 E544 Y569	E528-L540 HydrophobicContact CB-CB 3.91Å; E528-L540 WeakPolarHBondContact O-CB 3.17Å; E528-L540 PolarHBondContact O-N 3.29Å; E528-L540 WeakPolarHBondContact OE2-CD2 3.35Å; V530-L540 HydrophobicContact CG2-CB 4.04Å; V530-L540 HydrophobicContact CG2-CD1 3.96Å; L540-C542 VanDerWaalsContact C-N 3.29Å; L540-C542 PolarHBondContact O-N 3.03Å; L540-L543 PolarHBondContact O-N 2.97Å; L540-E544 HydrophobicContact CD1-CG 4.1Å; L540-E544 WeakPolarHBondContact O-CG 3.41Å; L540-E544 PolarHBondContact O-N 3.29Å; L540-Y569 HydrophobicContact CD1-CD1 4.47Å; L540-Y569 HydrophobicContact CD1-CD2 3.6Å; L540-Y569 HydrophobicContact CD1-CE2 4.44Å; L540-Y569 HydrophobicContact CD1-CG 3.61Å
541	K	89.6	Confident	89.9	Confident	52 Å²	52	28.9 Å²	28.9	23%	0.226	15%	0.152	C	C	.	.	H	α-helix	trans	-65.8	-27.2	-176.8	-58.6	-51.4	175.1	-165.5	0	114.4	C539 E544 R545 Y594 E640	C539-K541 PolarHBondContact O-N 2.92Å; K541-E544 VanDerWaalsContact CD-OE2 3.3Å; K541-E544 WeakPolarHBondContact CD-OE2 3.47Å; K541-E544 IonicContact NZ-OE2 3.49Å; K541-E544 PolarHBondContact NZ-OE2 3.21Å; K541-R545 WeakPolarHBondContact O-CB 3.45Å; K541-R545 PolarHBondContact O-N 3.4Å; K541-Y594 HydrophobicContact CG-CE2 4.17Å; K541-E640 VanDerWaalsContact NZ-CD 3.31Å; K541-E640 IonicContact NZ-OE1 2.69Å; K541-E640 PolarHBondContact NZ-OE1 3.3Å
542	C	92.4	Very high	89.8	Confident	17 Å²	17	33.4 Å²	33.4	12%	0.115	17%	0.171	C	C	.	.	H	α-helix	trans	-73	-43	174.5	-61.5	0	0	0	0	111.3	L521 C539 L540 R545 C546	L521-C542 HydrophobicContact CB-CB 3.79Å; L521-C542 HydrophobicContact CD1-CB 3.75Å; L521-C542 HydrophobicContact CG-CB 4.44Å; C539-C542 HydrophobicContact CB-CB 4.07Å; C539-C542 PolarHBondContact O-N 3.18Å; L540-C542 VanDerWaalsContact C-N 3.29Å; L540-C542 PolarHBondContact O-N 3.03Å; C542-R545 PolarHBondContact O-N 3.13Å; C542-C546 PolarHBondContact O-N 3.28Å; C542-C546 VanDerWaalsContact O-N 3.08Å; C542-C546 PolarHBondContact O-SG 3.42Å
543	L	91.8	Very high	89.7	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-62.4	-47.2	173.9	178.7	60	0	0	0	111.2	V530 T532 F538 C539 L540 R545 C546 L547 L560 Y569	V530-L543 HydrophobicContact CB-CD2 4.42Å; V530-L543 HydrophobicContact CG1-CD2 4Å; T532-L543 HydrophobicContact CG2-CD1 3.89Å; T532-L543 HydrophobicContact CG2-CD2 3.72Å; T532-L543 HydrophobicContact CG2-CG 4.5Å; F538-L543 HydrophobicContact CB-CB 3.98Å; F538-L543 HydrophobicContact CD2-CD1 3.94Å; F538-L543 HydrophobicContact CE2-CD1 4.38Å; C539-L543 PolarHBondContact O-N 3.09Å; L540-L543 PolarHBondContact O-N 2.97Å; L543-R545 PolarHBondContact O-N 3.32Å; L543-C546 PolarHBondContact O-N 2.78Å; L543-L547 HydrophobicContact CD1-CD1 3.94Å; L543-L547 HydrophobicContact CD1-CG 4.05Å; L543-L547 HydrophobicContact CG-CD1 3.87Å; L543-L547 HydrophobicContact CG-CG 4.36Å; L543-L547 WeakPolarHBondContact O-CB 3.39Å; L543-L547 VanDerWaalsContact O-CG 3.31Å; L543-L547 WeakPolarHBondContact O-CG 3.15Å; L543-L547 PolarHBondContact O-N 2.99Å; L543-L560 HydrophobicContact CD1-CD1 4.14Å; L543-Y569 HydrophobicContact CD2-CD1 4.21Å; L543-Y569 HydrophobicContact CD2-CE1 4.18Å
544	E	87.9	Confident	90	Very high	18 Å²	18	33.4 Å²	33.4	8%	0.084	17%	0.171	C	C	.	.	H	α-helix	trans	-59.2	-44.4	177.9	-69.2	-173.3	109.6	0	0	111.8	L540 K541 C546 L547 D548 Y569	L540-E544 HydrophobicContact CD1-CG 4.1Å; L540-E544 WeakPolarHBondContact O-CG 3.41Å; L540-E544 PolarHBondContact O-N 3.29Å; K541-E544 VanDerWaalsContact CD-OE2 3.3Å; K541-E544 WeakPolarHBondContact CD-OE2 3.47Å; K541-E544 IonicContact NZ-OE2 3.49Å; K541-E544 PolarHBondContact NZ-OE2 3.21Å; E544-C546 PolarHBondContact O-N 3.26Å; E544-L547 PolarHBondContact O-N 2.93Å; E544-D548 PolarHBondContact O-N 2.9Å; E544-Y569 HydrophobicContact CG-CD2 4.22Å; E544-Y569 HydrophobicContact CG-CE2 3.62Å; E544-Y569 VanDerWaalsContact OE1-CE2 3.3Å; E544-Y569 WeakPolarHBondContact OE1-CE2 3.48Å
545	R	86.9	Confident	90.2	Very high	103 Å²	103	37.3 Å²	37.3	39%	0.389	19%	0.191	S	C	.	.	H	α-helix	trans	-61.9	-41.5	175.8	-170.7	173.4	70.6	160.1	-2.8	112.2	K541 C542 L543 D548 H549 L633 D696	K541-R545 WeakPolarHBondContact O-CB 3.45Å; K541-R545 PolarHBondContact O-N 3.4Å; C542-R545 PolarHBondContact O-N 3.13Å; L543-R545 PolarHBondContact O-N 3.32Å; R545-D548 PolarHBondContact O-N 3.2Å; R545-H549 PolarHBondContact O-CD2 2.99Å; R545-L633 HydrophobicContact CG-CD1 4.3Å; R545-L633 HydrophobicContact CG-CD2 4.28Å; R545-D696 IonicContact CZ-OD1 3.37Å; R545-D696 IonicContact NH1-OD1 2.75Å; R545-D696 PolarHBondContact NH1-OD1 3.18Å
546	C	87.7	Confident	90.2	Very high	37 Å²	37	39.2 Å²	39.2	25%	0.25	20%	0.203	C	C	.	.	H	α-helix	trans	-65	-40.8	175.7	-73.1	0	0	0	0	112.6	C542 L543 E544 D548 H549 N550 P554	C542-C546 PolarHBondContact O-N 3.28Å; C542-C546 VanDerWaalsContact O-N 3.08Å; C542-C546 PolarHBondContact O-SG 3.42Å; L543-C546 PolarHBondContact O-N 2.78Å; E544-C546 PolarHBondContact O-N 3.26Å; C546-D548 VanDerWaalsContact C-N 3.27Å; C546-D548 PolarHBondContact O-N 2.86Å; C546-H549 PolarHBondContact O-N 3.17Å; C546-N550 PolarHBondContact O-N 2.88Å; C546-P554 HydrophobicContact CB-CG 3.76Å
547	L	85.7	Confident	90.1	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-68.1	-23.6	178.6	-71.2	177.2	0	0	0	113.2	L543 E544 H549 L560 C563 L564 Y569 R632	L543-L547 HydrophobicContact CD1-CD1 3.94Å; L543-L547 HydrophobicContact CD1-CG 4.05Å; L543-L547 HydrophobicContact CG-CD1 3.87Å; L543-L547 HydrophobicContact CG-CG 4.36Å; L543-L547 WeakPolarHBondContact O-CB 3.39Å; L543-L547 VanDerWaalsContact O-CG 3.31Å; L543-L547 WeakPolarHBondContact O-CG 3.15Å; L543-L547 PolarHBondContact O-N 2.99Å; E544-L547 PolarHBondContact O-N 2.93Å; L547-H549 PolarHBondContact O-N 3.24Å; L547-L560 HydrophobicContact CD2-CB 3.77Å; L547-L560 HydrophobicContact CD2-CD1 4.05Å; L547-C563 HydrophobicContact CD1-CB 4.31Å; L547-L564 HydrophobicContact CB-CD1 4.32Å; L547-L564 HydrophobicContact CB-CD2 3.95Å; L547-L564 HydrophobicContact CB-CG 3.96Å; L547-L564 HydrophobicContact CD1-CG 4.45Å; L547-L564 HydrophobicContact CD2-CD1 4.26Å; L547-L564 HydrophobicContact CD2-CG 4.27Å; L547-L564 HydrophobicContact CG-CG 4.45Å; L547-Y569 HydrophobicContact CD1-CE1 4.04Å; L547-Y569 WeakPolarHBondContact CD1-OH 3.29Å; L547-R632 PolarHBondContact O-NH2 2.9Å
548	D	81.8	Confident	89.7	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.011	24%	0.242	C	C	.	.	H	α-helix	trans	-65.5	-26.3	172.8	-81.4	-44	0	0	0	113.5	E544 R545 C546 R567 P629 R632 R636	E544-D548 PolarHBondContact O-N 2.9Å; R545-D548 PolarHBondContact O-N 3.2Å; C546-D548 VanDerWaalsContact C-N 3.27Å; C546-D548 PolarHBondContact O-N 2.86Å; D548-R567 IonicContact OD1-NH2 3.31Å; D548-P629 WeakPolarHBondContact O-CB 3.5Å; D548-R632 VanDerWaalsContact O-CZ 3.22Å; D548-R632 PolarHBondContact O-NE 3.49Å; D548-R632 PolarHBondContact O-NH2 3.46Å; D548-R632 IonicContact OD1-CZ 2.76Å; D548-R632 IonicContact OD1-NE 2.69Å; D548-R632 PolarHBondContact OD1-NE 2.96Å; D548-R632 IonicContact OD1-NH2 3.11Å; D548-R632 PolarHBondContact OD1-NH2 2.9Å; D548-R636 IonicContact OD2-CZ 2.71Å; D548-R636 VanDerWaalsContact OD2-CZ 3.29Å; D548-R636 IonicContact OD2-NE 2.78Å; D548-R636 PolarHBondContact OD2-NE 2.7Å; D548-R636 IonicContact OD2-NH2 2.75Å; D548-R636 PolarHBondContact OD2-NH2 3.41Å
549	H	82.5	Confident	89.2	Confident	116 Å²	116	49.5 Å²	49.5	54%	0.537	26%	0.26	S	S	.	.	H	α-helix	trans	-99.5	-35.5	174.9	-61.9	-90.6	0	0	0	114.1	R545 C546 L547 P629	R545-H549 PolarHBondContact O-CD2 2.99Å; C546-H549 PolarHBondContact O-N 3.17Å; L547-H549 PolarHBondContact O-N 3.24Å; H549-P629 HydrophobicContact CB-CB 4.48Å; H549-P629 VanDerWaalsContact ND1-CB 3.29Å; H549-P629 WeakPolarHBondContact ND1-CB 3.2Å
550	N	83.8	Confident	88.7	Confident	87 Å²	87	49.3 Å²	49.3	47%	0.465	26%	0.259	S	S	.	.			trans	-148.6	124.5	-171.7	-171.1	-5	0	0	0	112.1	C546 K552	C546-N550 PolarHBondContact O-N 2.88Å; N550-K552 PolarHBondContact O-N 2.93Å; N550-K552 WeakPolarHBondContact OD1-CG 3.43Å
551	A	85.4	Confident	87.9	Confident	39 Å²	39	51.4 Å²	51.4	32%	0.322	28%	0.275	S	S	.	.	S	Bend	trans	-73.9	37.2	-179.5	0	0	0	0	0	114.3	L560 L564	A551-L560 PolarHBondContact O-N 3.03Å; A551-L564 HydrophobicContact CB-CD1 3.49Å; A551-L564 VanDerWaalsContact CB-CD1 3.49Å
552	K	90.3	Very high	87	Confident	106 Å²	106	52.3 Å²	52.3	46%	0.461	28%	0.281	S	S	.	.	B	Isolated β-bridge	trans	-137	150.8	-174.2	-66.8	179.1	-179.2	-178.8	0	111.5	N550 P554 K557 D558	N550-K552 PolarHBondContact O-N 2.93Å; N550-K552 WeakPolarHBondContact OD1-CG 3.43Å; K552-P554 WeakPolarHBondContact O-CD 3.47Å; K552-K557 WeakPolarHBondContact CD-O 3.42Å; K552-D558 CarbonylContact C-O 3.57Å; K552-D558 WeakPolarHBondContact CA-O 3.3Å
553	C	91.6	Very high	86.1	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.007	28%	0.281	C	S	.	.			trans	-62.2	127.2	173	179.6	0	0	0	0	110.4	L555 C556 K557 D558 L560	C553-L555 PolarHBondContact O-N 3.32Å; C553-C556 VanDerWaalsContact CB-SG 3.58Å; C553-K557 WeakPolarHBondContact O-CA 3.46Å; C553-K557 PolarHBondContact O-N 2.84Å; C553-D558 PolarHBondContact N-O 3.41Å; C553-L560 HydrophobicContact CB-CD1 3.88Å; C553-L560 HydrophobicContact CB-CG 4.25Å
554	P	93.3	Very high	85.2	Confident	49 Å²	49	52.7 Å²	52.7	32%	0.318	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-31.7	179.4	-29.7	37.7	0	0	0	114.7	L521 F538 C546 K552	L521-P554 HydrophobicContact CD1-CG 4.26Å; L521-P554 HydrophobicContact CD2-CB 3.76Å; L521-P554 HydrophobicContact CD2-CG 3.97Å; F538-P554 HydrophobicContact CZ-CG 4.39Å; C546-P554 HydrophobicContact CB-CG 3.76Å; K552-P554 WeakPolarHBondContact O-CD 3.47Å
555	L	93.9	Very high	84.1	Confident	88 Å²	88	54.7 Å²	54.7	46%	0.461	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-56.5	-175	-61.5	175.4	0	0	0	112.4	A520 H536 F538 C553	A520-L555 HydrophobicContact CB-CD1 4.49Å; A520-L555 HydrophobicContact CB-CD2 4.33Å; H536-L555 HydrophobicContact CB-CD1 4.22Å; F538-L555 HydrophobicContact CE1-CD1 3.7Å; F538-L555 HydrophobicContact CE1-CG 3.91Å; F538-L555 HydrophobicContact CZ-CD1 3.77Å; F538-L555 HydrophobicContact CZ-CG 3.89Å; C553-L555 PolarHBondContact O-N 3.32Å
556	C	93.5	Very high	83.3	Confident	42 Å²	42	52.5 Å²	52.5	28%	0.284	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-4.1	-175.9	64.8	0	0	0	0	115.6	C534 H536 C553 D558	C534-C556 PolarHBondContact SG-SG 2.92Å; H536-C556 VanDerWaalsContact CE1-CB 3.5Å; H536-C556 WeakPolarHBondContact CE1-CB 3.44Å; H536-C556 PolarHBondContact CE1-SG 3.35Å; H536-C556 PolarHBondContact ND1-SG 3.2Å; C553-C556 VanDerWaalsContact CB-SG 3.58Å; C556-D558 PolarHBondContact O-N 3.3Å; C556-D558 VanDerWaalsContact O-N 3.11Å; C556-D558 PolarHBondContact SG-OD2 2.88Å
557	K	92.2	Very high	82.5	Confident	157 Å²	157	53.2 Å²	53.2	68%	0.683	30%	0.3	S	S	*	.			trans	64.6	5.5	179.9	-51.2	172.5	-173.2	172.6	0	115.8	K552 C553	K552-K557 WeakPolarHBondContact CD-O 3.42Å; C553-K557 WeakPolarHBondContact O-CA 3.46Å; C553-K557 PolarHBondContact O-N 2.84Å
558	D	88.4	Confident	82	Confident	59 Å²	59	61.3 Å²	61.3	32%	0.316	34%	0.335	S	S	.	.			trans	-56.5	147.1	170.7	-76.3	-38.1	0	0	0	112.2	C534 K552 C553 C556	C534-D558 HydrophobicContact CB-CB 3.82Å; C534-D558 WeakPolarHBondContact CB-OD2 3.3Å; K552-D558 CarbonylContact C-O 3.57Å; K552-D558 WeakPolarHBondContact CA-O 3.3Å; C553-D558 PolarHBondContact N-O 3.41Å; C556-D558 PolarHBondContact O-N 3.3Å; C556-D558 VanDerWaalsContact O-N 3.11Å; C556-D558 PolarHBondContact SG-OD2 2.88Å
559	G	85.9	Confident	82.1	Confident	36 Å²	36	63.2 Å²	63.2	37%	0.371	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-70.7	130.2	-178.6	0	0	0	0	0	113.7
560	L	85.3	Confident	82.4	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.005	34%	0.335	C	S	.	.			trans	-119.1	20	-179.6	-63.5	-176.9	0	0	0	113	T532 L543 L547 A551 C553 Q562 C563 L564	T532-L560 HydrophobicContact CG2-CD1 3.87Å; T532-L560 HydrophobicContact CG2-CD2 4.35Å; L543-L560 HydrophobicContact CD1-CD1 4.14Å; L547-L560 HydrophobicContact CD2-CB 3.77Å; L547-L560 HydrophobicContact CD2-CD1 4.05Å; A551-L560 PolarHBondContact O-N 3.03Å; C553-L560 HydrophobicContact CB-CD1 3.88Å; C553-L560 HydrophobicContact CB-CG 4.25Å; L560-Q562 PolarHBondContact O-N 2.72Å; L560-Q562 VanDerWaalsContact O-N 3.13Å; L560-C563 HydrophobicContact CB-CB 4.47Å; L560-C563 WeakPolarHBondContact O-CA 3.32Å; L560-C563 VanDerWaalsContact O-CB 3.31Å; L560-C563 WeakPolarHBondContact O-CB 3.21Å; L560-C563 PolarHBondContact O-N 2.9Å; L560-L564 PolarHBondContact O-N 3.18Å
561	S	75.6	Confident	82.9	Confident	66 Å²	66	59.8 Å²	59.8	46%	0.462	33%	0.329	S	S	.	.	H	α-helix	trans	-54.5	-32.4	-179.3	52.3	0	0	0	0	114	C563 L564 A565	S561-C563 VanDerWaalsContact C-N 3.33Å; S561-C563 PolarHBondContact O-N 3.18Å; S561-L564 WeakPolarHBondContact O-CB 3.4Å; S561-L564 PolarHBondContact O-N 3.31Å; S561-A565 WeakPolarHBondContact O-CB 3.26Å; S561-A565 PolarHBondContact O-N 2.94Å
562	Q	71	Confident	83.4	Confident	72 Å²	72	58 Å²	58	34%	0.336	31%	0.313	S	S	.	.	H	α-helix	trans	-69.3	-29.3	175.6	-167.7	171.6	22.6	0	0	113.1	A201 L560 S566	A201-Q562 PolarHBondContact O-NE2 2.99Å; L560-Q562 PolarHBondContact O-N 2.72Å; L560-Q562 VanDerWaalsContact O-N 3.13Å; Q562-S566 WeakPolarHBondContact O-CB 3.44Å; Q562-S566 PolarHBondContact O-N 2.83Å; Q562-S566 PolarHBondContact O-OG 3.12Å
563	C	73	Confident	83.6	Confident	19 Å²	19	55.1 Å²	55.1	13%	0.128	31%	0.305	C	S	.	.	H	α-helix	trans	-70.5	-43.4	173.2	-57.9	0	0	0	0	109.9	L547 L560 S561 S566 R567 Y569	L547-C563 HydrophobicContact CD1-CB 4.31Å; L560-C563 HydrophobicContact CB-CB 4.47Å; L560-C563 WeakPolarHBondContact O-CA 3.32Å; L560-C563 VanDerWaalsContact O-CB 3.31Å; L560-C563 WeakPolarHBondContact O-CB 3.21Å; L560-C563 PolarHBondContact O-N 2.9Å; S561-C563 VanDerWaalsContact C-N 3.33Å; S561-C563 PolarHBondContact O-N 3.18Å; C563-S566 PolarHBondContact O-OG 3.15Å; C563-R567 WeakPolarHBondContact O-CA 3.25Å; C563-R567 PolarHBondContact O-N 3.12Å; C563-Y569 HydrophobicContact CB-CE1 4.11Å
564	L	72.7	Confident	83.7	Confident	7 Å²	7	55.8 Å²	55.8	4%	0.037	31%	0.308	C	S	.	.	H	α-helix	trans	-60.3	-46.9	173.6	-94.2	166.5	0	0	0	113.3	L547 A551 L560 S561 S566 R567	L547-L564 HydrophobicContact CB-CD1 4.32Å; L547-L564 HydrophobicContact CB-CD2 3.95Å; L547-L564 HydrophobicContact CB-CG 3.96Å; L547-L564 HydrophobicContact CD1-CG 4.45Å; L547-L564 HydrophobicContact CD2-CD1 4.26Å; L547-L564 HydrophobicContact CD2-CG 4.27Å; L547-L564 HydrophobicContact CG-CG 4.45Å; A551-L564 HydrophobicContact CB-CD1 3.49Å; A551-L564 VanDerWaalsContact CB-CD1 3.49Å; L560-L564 PolarHBondContact O-N 3.18Å; S561-L564 WeakPolarHBondContact O-CB 3.4Å; S561-L564 PolarHBondContact O-N 3.31Å; L564-S566 VanDerWaalsContact C-N 3.34Å; L564-S566 PolarHBondContact O-N 3.19Å; L564-R567 VanDerWaalsContact O-CG 3.25Å; L564-R567 WeakPolarHBondContact O-CG 3.49Å
565	A	66.8	Low	83.7	Confident	59 Å²	59	53.4 Å²	53.4	49%	0.488	29%	0.293	S	S	.	.	H	α-helix	trans	-71.6	-26.2	-176.6	0	0	0	0	0	113.6	S561 A673	S561-A565 WeakPolarHBondContact O-CB 3.26Å; S561-A565 PolarHBondContact O-N 2.94Å; A565-A673 HydrophobicContact CB-CB 3.72Å
566	S	68.8	Low	83.7	Confident	58 Å²	58	52.5 Å²	52.5	41%	0.406	29%	0.286	S	S	.	.	H	α-helix	trans	-93.1	-28.8	177.3	59.7	0	0	0	0	113.9	Q562 C563 L564 K568	Q562-S566 WeakPolarHBondContact O-CB 3.44Å; Q562-S566 PolarHBondContact O-N 2.83Å; Q562-S566 PolarHBondContact O-OG 3.12Å; C563-S566 PolarHBondContact O-OG 3.15Å; L564-S566 VanDerWaalsContact C-N 3.34Å; L564-S566 PolarHBondContact O-N 3.19Å; S566-K568 WeakPolarHBondContact O-CG 3.38Å; S566-K568 PolarHBondContact O-N 2.64Å
567	R	71.8	Confident	83.6	Confident	52 Å²	52	53.9 Å²	53.9	20%	0.196	29%	0.289	C	S	.	.			trans	45.4	23.6	-168.8	-62.2	-165	170.2	-128.3	-3.2	114.2	D548 C563 L564 F671	D548-R567 IonicContact OD1-NH2 3.31Å; C563-R567 WeakPolarHBondContact O-CA 3.25Å; C563-R567 PolarHBondContact O-N 3.12Å; L564-R567 VanDerWaalsContact O-CG 3.25Å; L564-R567 WeakPolarHBondContact O-CG 3.49Å; R567-F671 VanDerWaalsContact CZ-CD1 3.41Å
568	K	74.1	Confident	83.6	Confident	171 Å²	171	46.4 Å²	46.4	74%	0.743	26%	0.256	S	S	*	.			trans	-105.7	88.8	-178.5	-79.4	179.7	-177.9	-175.7	0	109.9	S566	S566-K568 WeakPolarHBondContact O-CG 3.38Å; S566-K568 PolarHBondContact O-N 2.64Å
569	Y	83.8	Confident	83.8	Confident	43 Å²	43	43.8 Å²	43.8	17%	0.169	24%	0.242	C	C	.	.			trans	-93.1	128.2	172.9	-47.3	-78.8	0	0	0	108.7	V530 L540 L543 E544 L547 C563	V530-Y569 HydrophobicContact CG1-CD1 4.26Å; L540-Y569 HydrophobicContact CD1-CD1 4.47Å; L540-Y569 HydrophobicContact CD1-CD2 3.6Å; L540-Y569 HydrophobicContact CD1-CE2 4.44Å; L540-Y569 HydrophobicContact CD1-CG 3.61Å; L543-Y569 HydrophobicContact CD2-CD1 4.21Å; L543-Y569 HydrophobicContact CD2-CE1 4.18Å; E544-Y569 HydrophobicContact CG-CD2 4.22Å; E544-Y569 HydrophobicContact CG-CE2 3.62Å; E544-Y569 VanDerWaalsContact OE1-CE2 3.3Å; E544-Y569 WeakPolarHBondContact OE1-CE2 3.48Å; L547-Y569 HydrophobicContact CD1-CE1 4.04Å; L547-Y569 WeakPolarHBondContact CD1-OH 3.29Å; C563-Y569 HydrophobicContact CB-CE1 4.11Å
570	S	89.6	Confident	84.1	Confident	54 Å²	54	44.6 Å²	44.6	38%	0.378	25%	0.245	S	C	.	.			trans	-107.6	137.9	164.7	-55.8	0	0	0	0	109.5	S172	S172-S570 WeakPolarHBondContact O-CB 3.43Å; S172-S570 PolarHBondContact O-OG 3.27Å; S172-S570 VanDerWaalsContact O-OG 3.13Å
571	K	95	Very high	84.3	Confident	76 Å²	76	48.9 Å²	48.9	33%	0.33	26%	0.264	S	S	.	.			trans	-65.2	145.2	175.8	-47.1	-173.6	-174.4	-174.6	0	110.3	G174 E528 P529 V573 E576	G174-K571 WeakPolarHBondContact CA-O 3.39Å; E528-K571 HydrophobicContact CB-CD 4.05Å; E528-K571 HydrophobicContact CB-CG 4.38Å; E528-K571 VanDerWaalsContact CD-CE 3.49Å; E528-K571 HydrophobicContact CG-CD 4.24Å; E528-K571 WeakPolarHBondContact OE1-CE 3.5Å; E528-K571 IonicContact OE1-NZ 3.63Å; E528-K571 PolarHBondContact OE1-NZ 3.49Å; P529-K571 CarbonylContact O-C 3.52Å; P529-K571 WeakPolarHBondContact O-CA 3.26Å; K571-V573 PolarHBondContact O-N 3.34Å; K571-E576 HydrophobicContact CB-CG 4.49Å; K571-E576 WeakPolarHBondContact CB-OE2 3.48Å; K571-E576 WeakPolarHBondContact CD-OE1 3.44Å; K571-E576 WeakPolarHBondContact CD-OE2 3.48Å; K571-E576 IonicContact NZ-OE1 2.75Å; K571-E576 PolarHBondContact NZ-OE1 3.34Å
572	N	95.1	Very high	84.9	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	25%	0.251	C	S	.	.			trans	-80.2	107.4	-180	-176.4	-26.5	0	0	0	109.4	S170 G174 N226 P529 T531 I574 M575 E576	S170-N572 PolarHBondContact OG-ND2 2.96Å; G174-N572 WeakPolarHBondContact O-CA 3.45Å; G174-N572 PolarHBondContact O-OD1 3.44Å; N226-N572 PolarHBondContact ND2-ND2 3.27Å; P529-N572 PolarHBondContact O-N 3.13Å; T531-N572 PolarHBondContact OG1-ND2 3.3Å; N572-I574 VanDerWaalsContact C-N 3.32Å; N572-I574 PolarHBondContact O-N 2.89Å; N572-I574 PolarHBondContact OD1-N 2.88Å; N572-M575 HydrophobicContact CB-CB 4.02Å; N572-M575 HydrophobicContact CB-CG 3.79Å; N572-M575 VanDerWaalsContact CG-CG 3.45Å; N572-M575 WeakPolarHBondContact O-CB 3.3Å; N572-M575 PolarHBondContact O-N 3.14Å; N572-M575 PolarHBondContact OD1-N 2.72Å; N572-E576 PolarHBondContact O-N 3.44Å
573	V	94.2	Very high	85.9	Confident	47 Å²	47	44.8 Å²	44.8	29%	0.285	24%	0.237	S	C	.	.	H	α-helix	trans	-56.5	-44.8	-171.1	-174.6	0	0	0	0	111.7	G174 K571 M575 E576 E577	G174-V573 PolarHBondContact O-N 2.83Å; K571-V573 PolarHBondContact O-N 3.34Å; V573-M575 VanDerWaalsContact C-N 3.32Å; V573-M575 PolarHBondContact O-N 3.48Å; V573-E576 PolarHBondContact O-N 2.8Å; V573-E577 HydrophobicContact CG1-CG 4.43Å; V573-E577 WeakPolarHBondContact CG1-OE1 3.35Å; V573-E577 WeakPolarHBondContact O-CB 2.92Å; V573-E577 WeakPolarHBondContact O-CG 3.39Å; V573-E577 PolarHBondContact O-N 3.13Å
574	I	93	Very high	86.9	Confident	14 Å²	14	47.1 Å²	47.1	7%	0.072	25%	0.252	C	S	.	.	H	α-helix	trans	-65.5	-37.9	179.3	-58.5	-174.1	0	0	0	110.7	W153 G155 F156 L165 T176 L229 N572 L578	W153-I574 HydrophobicContact CH2-CG2 4.05Å; G155-I574 WeakPolarHBondContact O-CD1 3.1Å; F156-I574 HydrophobicContact CD1-CG2 4.47Å; L165-I574 HydrophobicContact CD1-CD1 3.5Å; T176-I574 HydrophobicContact CG2-CD1 4.14Å; L229-I574 HydrophobicContact CD1-CB 4.39Å; L229-I574 HydrophobicContact CD1-CG2 4.43Å; L229-I574 HydrophobicContact CD2-CG2 4.02Å; N572-I574 VanDerWaalsContact C-N 3.32Å; N572-I574 PolarHBondContact O-N 2.89Å; N572-I574 PolarHBondContact OD1-N 2.88Å; I574-L578 WeakPolarHBondContact O-CB 3.41Å; I574-L578 PolarHBondContact O-N 2.93Å
575	M	93.4	Very high	87.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-66.9	-42.9	178.1	-62.8	-72.8	-59.9	0	0	111.3	V228 L229 L517 F526 P529 T537 N572 V573 L578 I579	V228-M575 HydrophobicContact CG1-CE 3.88Å; V228-M575 HydrophobicContact CG1-SD 4.36Å; L229-M575 HydrophobicContact CD1-SD 4.46Å; L229-M575 HydrophobicContact CD2-CG 4.38Å; L229-M575 HydrophobicContact CD2-SD 3.49Å; L229-M575 WeakPolarHBondContact CD2-SD 3.33Å; L229-M575 HydrophobicContact CG-CG 4.45Å; L229-M575 HydrophobicContact CG-SD 3.7Å; L517-M575 HydrophobicContact CD2-CE 3.57Å; L517-M575 HydrophobicContact CD2-SD 4.48Å; F526-M575 HydrophobicContact CD2-CE 3.5Å; F526-M575 VanDerWaalsContact CD2-CE 3.5Å; F526-M575 HydrophobicContact CE2-CE 3.66Å; F526-M575 HydrophobicContact CG-CE 4.34Å; P529-M575 HydrophobicContact CB-CB 3.83Å; P529-M575 HydrophobicContact CB-CG 4.35Å; P529-M575 HydrophobicContact CG-CB 3.47Å; P529-M575 VanDerWaalsContact CG-CB 3.47Å; P529-M575 HydrophobicContact CG-CG 4.48Å; T537-M575 HydrophobicContact CG2-CE 4.31Å; N572-M575 HydrophobicContact CB-CB 4.02Å; N572-M575 HydrophobicContact CB-CG 3.79Å; N572-M575 VanDerWaalsContact CG-CG 3.45Å; N572-M575 WeakPolarHBondContact O-CB 3.3Å; N572-M575 PolarHBondContact O-N 3.14Å; N572-M575 PolarHBondContact OD1-N 2.72Å; V573-M575 VanDerWaalsContact C-N 3.32Å; V573-M575 PolarHBondContact O-N 3.48Å; M575-L578 PolarHBondContact O-N 2.89Å; M575-I579 WeakPolarHBondContact O-CB 3.5Å; M575-I579 VanDerWaalsContact O-CD1 3.24Å; M575-I579 WeakPolarHBondContact O-CD1 3.33Å; M575-I579 WeakPolarHBondContact O-CG1 3.39Å; M575-I579 PolarHBondContact O-N 2.85Å
576	E	94.2	Very high	89.2	Confident	68 Å²	68	52.7 Å²	52.7	32%	0.318	27%	0.268	S	S	.	.	H	α-helix	trans	-65.9	-44.2	176.1	-75.7	-171.2	120.1	0	0	112.4	P529 K571 N572 V573 L578 A580	P529-E576 HydrophobicContact CG-CG 3.91Å; K571-E576 HydrophobicContact CB-CG 4.49Å; K571-E576 WeakPolarHBondContact CB-OE2 3.48Å; K571-E576 WeakPolarHBondContact CD-OE1 3.44Å; K571-E576 WeakPolarHBondContact CD-OE2 3.48Å; K571-E576 IonicContact NZ-OE1 2.75Å; K571-E576 PolarHBondContact NZ-OE1 3.34Å; N572-E576 PolarHBondContact O-N 3.44Å; V573-E576 PolarHBondContact O-N 2.8Å; E576-L578 VanDerWaalsContact C-N 3.3Å; E576-L578 PolarHBondContact O-N 2.88Å; E576-A580 WeakPolarHBondContact O-CB 3.49Å; E576-A580 PolarHBondContact O-N 2.84Å
577	E	92.4	Very high	90.4	Very high	71 Å²	71	51.5 Å²	51.5	33%	0.332	26%	0.257	S	S	.	.	H	α-helix	trans	-58.1	-41.7	174.6	-74.3	176	-165.1	0	0	112.1	W153 V573 K581	W153-E577 HydrophobicContact CZ2-CB 3.72Å; V573-E577 HydrophobicContact CG1-CG 4.43Å; V573-E577 WeakPolarHBondContact CG1-OE1 3.35Å; V573-E577 WeakPolarHBondContact O-CB 2.92Å; V573-E577 WeakPolarHBondContact O-CG 3.39Å; V573-E577 PolarHBondContact O-N 3.13Å; E577-K581 WeakPolarHBondContact O-CB 3.46Å; E577-K581 PolarHBondContact O-N 3.46Å
578	L	90.5	Very high	91.6	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-70.8	-47.2	-177.5	-156.5	163.5	0	0	0	111.4	W153 F156 L232 F512 L517 I574 M575 E576 A580 K581 F582	W153-L578 HydrophobicContact CH2-CB 3.61Å; W153-L578 HydrophobicContact CH2-CD1 3.83Å; W153-L578 HydrophobicContact CH2-CG 3.69Å; W153-L578 HydrophobicContact CZ2-CB 4.32Å; W153-L578 HydrophobicContact CZ3-CB 4.16Å; W153-L578 HydrophobicContact CZ3-CD1 3.82Å; W153-L578 HydrophobicContact CZ3-CG 3.7Å; F156-L578 HydrophobicContact CE1-CD1 3.7Å; F156-L578 HydrophobicContact CZ-CD1 3.5Å; F156-L578 VanDerWaalsContact CZ-CD1 3.5Å; F156-L578 HydrophobicContact CZ-CG 4.48Å; L232-L578 HydrophobicContact CD2-CD1 3.5Å; L232-L578 VanDerWaalsContact CD2-CD1 3.5Å; L232-L578 HydrophobicContact CD2-CD2 4.16Å; F512-L578 HydrophobicContact CE2-CD2 3.54Å; F512-L578 HydrophobicContact CZ-CD2 3.49Å; F512-L578 VanDerWaalsContact CZ-CD2 3.49Å; L517-L578 HydrophobicContact CD1-CD2 3.76Å; I574-L578 WeakPolarHBondContact O-CB 3.41Å; I574-L578 PolarHBondContact O-N 2.93Å; M575-L578 PolarHBondContact O-N 2.89Å; E576-L578 VanDerWaalsContact C-N 3.3Å; E576-L578 PolarHBondContact O-N 2.88Å; L578-A580 VanDerWaalsContact C-N 3.33Å; L578-A580 PolarHBondContact O-N 3.34Å; L578-K581 PolarHBondContact O-N 2.84Å; L578-F582 HydrophobicContact CD2-CD2 3.92Å; L578-F582 HydrophobicContact CG-CD2 3.98Å; L578-F582 HydrophobicContact CG-CE2 4.31Å; L578-F582 VanDerWaalsContact O-CD2 3.22Å; L578-F582 WeakPolarHBondContact O-CD2 3.37Å; L578-F582 PolarHBondContact O-N 3.34Å
579	I	93	Very high	92.6	Very high	3 Å²	3	52.7 Å²	52.7	2%	0.015	27%	0.265	C	S	.	.	H	α-helix	trans	-61	-45.3	175.9	-62.6	158.6	0	0	0	109.8	L517 L525 F526 P529 M575 K581 L583 L587	L517-I579 HydrophobicContact CD1-CG1 3.86Å; L525-I579 HydrophobicContact CD1-CG1 4.33Å; L525-I579 HydrophobicContact CD1-CG2 4.11Å; L525-I579 HydrophobicContact CD2-CG2 3.97Å; L525-I579 HydrophobicContact CG-CG2 4.25Å; F526-I579 HydrophobicContact CB-CD1 3.69Å; P529-I579 HydrophobicContact CG-CD1 4.17Å; M575-I579 WeakPolarHBondContact O-CB 3.5Å; M575-I579 VanDerWaalsContact O-CD1 3.24Å; M575-I579 WeakPolarHBondContact O-CD1 3.33Å; M575-I579 WeakPolarHBondContact O-CG1 3.39Å; M575-I579 PolarHBondContact O-N 2.85Å; I579-K581 PolarHBondContact O-N 2.99Å; I579-L583 HydrophobicContact CG2-CB 4.49Å; I579-L583 CarbonylContact O-C 3.58Å; I579-L583 VanDerWaalsContact O-C 3.31Å; I579-L583 WeakPolarHBondContact O-CA 3.07Å; I579-L583 PolarHBondContact O-N 3.24Å; I579-L587 HydrophobicContact CG2-CB 3.98Å; I579-L587 HydrophobicContact CG2-CD1 3.96Å; I579-L587 HydrophobicContact CG2-CD2 4.18Å; I579-L587 HydrophobicContact CG2-CG 4.24Å
580	A	92.4	Very high	93.2	Very high	53 Å²	53	51.6 Å²	51.6	44%	0.438	26%	0.261	S	S	.	.	H	α-helix	trans	-68.3	-32.4	-178.9	0	0	0	0	0	114	E576 L578 L587	E576-A580 WeakPolarHBondContact O-CB 3.49Å; E576-A580 PolarHBondContact O-N 2.84Å; L578-A580 VanDerWaalsContact C-N 3.33Å; L578-A580 PolarHBondContact O-N 3.34Å; A580-L587 HydrophobicContact CB-CD2 3.97Å
581	K	89.3	Confident	93.4	Very high	92 Å²	92	54 Å²	54	40%	0.4	26%	0.262	S	S	.	.	H	α-helix	trans	-84.1	-26.4	179.3	-171.2	165.9	172.3	158.5	0	113.6	E151 W153 E577 L578 I579	E151-K581 PolarHBondContact O-NZ 3.19Å; W153-K581 HydrophobicContact CB-CD 4.28Å; W153-K581 HydrophobicContact CG-CD 4Å; E577-K581 WeakPolarHBondContact O-CB 3.46Å; E577-K581 PolarHBondContact O-N 3.46Å; L578-K581 PolarHBondContact O-N 2.84Å; I579-K581 PolarHBondContact O-N 2.99Å
582	F	87.9	Confident	93.5	Very high	43 Å²	43	56.2 Å²	56.2	19%	0.189	27%	0.271	C	S	.	.	H	α-helix	trans	-123.1	-13.5	-171	-52.5	-64	0	0	0	115.9	W153 L507 F512 L578 P584	W153-F582 HydrophobicContact CB-CZ 4.15Å; W153-F582 AromaticContact CD2-CE2 3.87Å; W153-F582 HydrophobicContact CD2-CE2 3.87Å; W153-F582 HydrophobicContact CD2-CZ 4.07Å; W153-F582 AromaticContact CE3-CE2 3.51Å; W153-F582 HydrophobicContact CE3-CE2 3.51Å; W153-F582 AromaticContact CE3-CZ 3.93Å; W153-F582 HydrophobicContact CE3-CZ 3.93Å; W153-F582 HydrophobicContact CG-CE2 4.43Å; W153-F582 HydrophobicContact CG-CZ 4.17Å; W153-F582 AromaticContact CZ3-CE2 3.88Å; W153-F582 HydrophobicContact CZ3-CE2 3.88Å; L507-F582 HydrophobicContact CD1-CD1 3.79Å; L507-F582 HydrophobicContact CD1-CD2 4.13Å; L507-F582 HydrophobicContact CD1-CE1 3.23Å; L507-F582 HydrophobicContact CD1-CE2 3.64Å; L507-F582 HydrophobicContact CD1-CG 4.22Å; L507-F582 HydrophobicContact CD1-CZ 3.16Å; F512-F582 HydrophobicContact CD1-CB 4Å; F512-F582 HydrophobicContact CE1-CB 3.33Å; F512-F582 HydrophobicContact CE1-CG 4.38Å; F512-F582 HydrophobicContact CZ-CB 3.9Å; L578-F582 HydrophobicContact CD2-CD2 3.92Å; L578-F582 HydrophobicContact CG-CD2 3.98Å; L578-F582 HydrophobicContact CG-CE2 4.31Å; L578-F582 VanDerWaalsContact O-CD2 3.22Å; L578-F582 WeakPolarHBondContact O-CD2 3.37Å; L578-F582 PolarHBondContact O-N 3.34Å; F582-P584 VanDerWaalsContact C-CD 3.46Å
583	L	92.4	Very high	93.4	Very high	8 Å²	8	59.6 Å²	59.6	4%	0.042	29%	0.289	C	S	.	.			trans	-131.9	55.1	173.3	-59	174.5	0	0	0	111.3	F512 A514 L517 L525 I579 E586 L587	F512-L583 HydrophobicContact CE1-CD1 4.24Å; F512-L583 HydrophobicContact CE1-CD2 3.79Å; F512-L583 HydrophobicContact CE1-CG 3.73Å; F512-L583 HydrophobicContact CZ-CD1 4.11Å; F512-L583 HydrophobicContact CZ-CD2 4.46Å; F512-L583 HydrophobicContact CZ-CG 4.03Å; A514-L583 HydrophobicContact CB-CD1 4Å; A514-L583 HydrophobicContact CB-CD2 4.1Å; L517-L583 HydrophobicContact CB-CD1 4.44Å; L517-L583 HydrophobicContact CD1-CD1 3.79Å; L525-L583 HydrophobicContact CD1-CD1 3.61Å; L525-L583 HydrophobicContact CD2-CB 4.45Å; L525-L583 HydrophobicContact CD2-CD1 4.47Å; I579-L583 HydrophobicContact CG2-CB 4.49Å; I579-L583 CarbonylContact O-C 3.58Å; I579-L583 VanDerWaalsContact O-C 3.31Å; I579-L583 WeakPolarHBondContact O-CA 3.07Å; I579-L583 PolarHBondContact O-N 3.24Å; L583-E586 WeakPolarHBondContact CA-OE2 3.34Å; L583-E586 HydrophobicContact CB-CB 4.3Å; L583-E586 WeakPolarHBondContact CB-OE2 3.44Å; L583-L587 WeakPolarHBondContact O-CB 3.49Å; L583-L587 PolarHBondContact O-N 2.77Å
584	P	93.6	Very high	93.3	Very high	68 Å²	68	59.3 Å²	59.3	44%	0.442	28%	0.283	S	S	.	.	H	α-helix	trans	-68.6	-36	-169.8	28	-35.4	0	0	0	113.4	F582 K588	F582-P584 VanDerWaalsContact C-CD 3.46Å; P584-K588 VanDerWaalsContact O-CB 3.31Å; P584-K588 WeakPolarHBondContact O-CB 3.4Å; P584-K588 PolarHBondContact O-N 3.39Å; P584-K588 VanDerWaalsContact O-N 3.13Å
585	E	93.8	Very high	93.3	Very high	107 Å²	107	63.4 Å²	63.4	50%	0.5	30%	0.302	S	S	.	.	H	α-helix	trans	-80	-39.2	-178.5	-69.2	-64.9	122.7	0	0	110.9	L587 K588 E589	E585-L587 VanDerWaalsContact C-N 3.31Å; E585-L587 PolarHBondContact O-N 2.82Å; E585-K588 CarbonylContact O-C 3.55Å; E585-K588 WeakPolarHBondContact O-CB 3.18Å; E585-K588 PolarHBondContact O-N 3.16Å; E585-K588 VanDerWaalsContact O-N 3.11Å; E585-K588 WeakPolarHBondContact OE1-CD 3.35Å; E585-K588 IonicContact OE1-NZ 3.68Å; E585-K588 PolarHBondContact OE1-NZ 3.28Å; E585-K588 WeakPolarHBondContact OE2-CD 3.16Å; E585-K588 IonicContact OE2-NZ 2.85Å; E585-K588 PolarHBondContact OE2-NZ 2.85Å; E585-E589 PolarHBondContact O-N 3.34Å
586	E	94.7	Very high	93.3	Very high	77 Å²	77	67.3 Å²	67.3	36%	0.36	32%	0.32	S	S	.	.	H	α-helix	trans	-65.5	-34.7	173.1	-53.5	89	153.6	0	0	111.2	L525 L583 K588 R590	L525-E586 HydrophobicContact CD2-CB 3.71Å; L583-E586 WeakPolarHBondContact CA-OE2 3.34Å; L583-E586 HydrophobicContact CB-CB 4.3Å; L583-E586 WeakPolarHBondContact CB-OE2 3.44Å; E586-K588 VanDerWaalsContact C-N 3.35Å; E586-R590 WeakPolarHBondContact O-CB 3.35Å; E586-R590 PolarHBondContact O-N 3.17Å
587	L	95.2	Very high	93.1	Very high	33 Å²	33	67 Å²	67	17%	0.173	32%	0.319	C	S	.	.	H	α-helix	trans	-65.4	-37.9	171.5	177.1	59.9	0	0	0	112	L525 Y527 I579 A580 L583 E585 R590 R591	L525-L587 HydrophobicContact CD2-CB 4.47Å; Y527-L587 HydrophobicContact CD2-CD1 4.4Å; I579-L587 HydrophobicContact CG2-CB 3.98Å; I579-L587 HydrophobicContact CG2-CD1 3.96Å; I579-L587 HydrophobicContact CG2-CD2 4.18Å; I579-L587 HydrophobicContact CG2-CG 4.24Å; A580-L587 HydrophobicContact CB-CD2 3.97Å; L583-L587 WeakPolarHBondContact O-CB 3.49Å; L583-L587 PolarHBondContact O-N 2.77Å; E585-L587 VanDerWaalsContact C-N 3.31Å; E585-L587 PolarHBondContact O-N 2.82Å; L587-R590 PolarHBondContact O-N 3.11Å; L587-R591 VanDerWaalsContact O-CB 3.24Å; L587-R591 WeakPolarHBondContact O-CB 3.35Å; L587-R591 PolarHBondContact O-N 2.87Å
588	K	96	Very high	93	Very high	116 Å²	116	65.4 Å²	65.4	50%	0.504	31%	0.312	S	S	.	.	H	α-helix	trans	-71.3	-41.9	178.4	169.3	-169.6	175.4	-166.5	0	111.6	P584 E585 E586 R591 K592	P584-K588 VanDerWaalsContact O-CB 3.31Å; P584-K588 WeakPolarHBondContact O-CB 3.4Å; P584-K588 PolarHBondContact O-N 3.39Å; P584-K588 VanDerWaalsContact O-N 3.13Å; E585-K588 CarbonylContact O-C 3.55Å; E585-K588 WeakPolarHBondContact O-CB 3.18Å; E585-K588 PolarHBondContact O-N 3.16Å; E585-K588 VanDerWaalsContact O-N 3.11Å; E585-K588 WeakPolarHBondContact OE1-CD 3.35Å; E585-K588 IonicContact OE1-NZ 3.68Å; E585-K588 PolarHBondContact OE1-NZ 3.28Å; E585-K588 WeakPolarHBondContact OE2-CD 3.16Å; E585-K588 IonicContact OE2-NZ 2.85Å; E585-K588 PolarHBondContact OE2-NZ 2.85Å; E586-K588 VanDerWaalsContact C-N 3.35Å; K588-R591 WeakPolarHBondContact O-CB 3.25Å; K588-R591 PolarHBondContact O-N 3.07Å; K588-K592 WeakPolarHBondContact O-CB 3.47Å; K588-K592 PolarHBondContact O-N 3.04Å
589	E	95.4	Very high	93.1	Very high	131 Å²	131	72.2 Å²	72.2	61%	0.612	34%	0.344	S	S	*	.	H	α-helix	trans	-61.5	-47.2	167.6	-70.9	-170.7	165.1	0	0	111.4	E585 R591 K592 L593	E585-E589 PolarHBondContact O-N 3.34Å; E589-R591 PolarHBondContact O-N 2.9Å; E589-K592 PolarHBondContact O-N 3.25Å; E589-L593 WeakPolarHBondContact O-CG 3.07Å; E589-L593 PolarHBondContact O-N 2.81Å
590	R	95.3	Very high	93.1	Very high	20 Å²	20	76 Å²	76	8%	0.075	36%	0.361	C	S	.	.	H	α-helix	trans	-61.5	-34.6	179	-179.2	64.3	-160.8	100.6	-12.1	112.2	L525 Y527 E586 L587 Y594	L525-R590 HydrophobicContact CD2-CB 4.47Å; Y527-R590 HydrophobicContact CD2-CG 3.97Å; Y527-R590 HydrophobicContact CG-CG 4.23Å; E586-R590 WeakPolarHBondContact O-CB 3.35Å; E586-R590 PolarHBondContact O-N 3.17Å; L587-R590 PolarHBondContact O-N 3.11Å; R590-Y594 PolarHBondContact O-N 3.24Å
591	R	95.5	Very high	93	Very high	106 Å²	106	74.9 Å²	74.9	40%	0.4	35%	0.348	S	S	.	.	H	α-helix	trans	-66.1	-52.6	171.7	174.8	-178.2	-53	-67.5	-5.1	111.3	Y527 L587 K588 E589 L593 Y594 E595	Y527-R591 HydrophobicContact CE2-CB 4.06Å; Y527-R591 PolarHBondContact OH-NH1 3.48Å; Y527-R591 VanDerWaalsContact OH-NH1 3.16Å; L587-R591 VanDerWaalsContact O-CB 3.24Å; L587-R591 WeakPolarHBondContact O-CB 3.35Å; L587-R591 PolarHBondContact O-N 2.87Å; K588-R591 WeakPolarHBondContact O-CB 3.25Å; K588-R591 PolarHBondContact O-N 3.07Å; E589-R591 PolarHBondContact O-N 2.9Å; R591-L593 VanDerWaalsContact C-N 3.32Å; R591-L593 PolarHBondContact O-N 3.44Å; R591-Y594 CarbonylContact O-C 3.5Å; R591-Y594 WeakPolarHBondContact O-CA 3.41Å; R591-Y594 WeakPolarHBondContact O-CB 3.28Å; R591-Y594 PolarHBondContact O-N 3.23Å; R591-E595 WeakPolarHBondContact CD-OE1 3.43Å; R591-E595 VanDerWaalsContact CG-CD 3.5Å; R591-E595 HydrophobicContact CG-CG 4.46Å; R591-E595 WeakPolarHBondContact CG-OE1 3.4Å; R591-E595 PolarHBondContact O-N 3.31Å
592	K	96	Very high	93.2	Very high	121 Å²	121	72.5 Å²	72.5	53%	0.526	34%	0.342	S	S	.	.	H	α-helix	trans	-54.9	-46.7	178.1	-177.7	174.1	-179.6	-70.5	0	111.6	K588 E589 Y594 E595 E596	K588-K592 WeakPolarHBondContact O-CB 3.47Å; K588-K592 PolarHBondContact O-N 3.04Å; E589-K592 PolarHBondContact O-N 3.25Å; K592-Y594 VanDerWaalsContact C-N 3.28Å; K592-Y594 PolarHBondContact O-N 3.1Å; K592-E595 PolarHBondContact O-N 3.07Å; K592-E595 VanDerWaalsContact O-N 3.17Å; K592-E596 WeakPolarHBondContact CE-OE1 3.28Å; K592-E596 IonicContact NZ-OE1 3.42Å; K592-E596 PolarHBondContact NZ-OE1 2.92Å; K592-E596 IonicContact NZ-OE2 3.44Å; K592-E596 WeakPolarHBondContact O-CB 3.31Å; K592-E596 WeakPolarHBondContact O-CG 3.49Å; K592-E596 PolarHBondContact O-N 3.26Å
593	L	93.4	Very high	93.5	Very high	73 Å²	73	73.8 Å²	73.8	38%	0.382	35%	0.351	S	S	.	.	H	α-helix	trans	-61.8	-31.6	174.7	-70.7	172	0	0	0	113.4	E589 R591 E597	E589-L593 WeakPolarHBondContact O-CG 3.07Å; E589-L593 PolarHBondContact O-N 2.81Å; R591-L593 VanDerWaalsContact C-N 3.32Å; R591-L593 PolarHBondContact O-N 3.44Å; L593-E597 VanDerWaalsContact O-CB 3.27Å; L593-E597 WeakPolarHBondContact O-CB 3.46Å; L593-E597 WeakPolarHBondContact O-CG 3.47Å; L593-E597 PolarHBondContact O-N 3.35Å; L593-E597 VanDerWaalsContact O-N 3.08Å
594	Y	92.1	Very high	93.6	Very high	40 Å²	40	75.3 Å²	75.3	16%	0.157	36%	0.359	C	S	.	.	H	α-helix	trans	-73.6	-40.7	173.9	173.6	-94.9	0	0	0	111.7	Y527 K541 R590 R591 K592 E597 M598	Y527-Y594 HydrophobicContact CD1-CD1 4.45Å; Y527-Y594 AromaticContact CD1-CD2 3.91Å; Y527-Y594 HydrophobicContact CD1-CD2 3.91Å; Y527-Y594 HydrophobicContact CD1-CE2 4.41Å; Y527-Y594 AromaticContact CD1-CG 3.93Å; Y527-Y594 HydrophobicContact CD1-CG 3.93Å; Y527-Y594 AromaticContact CE1-CD1 3.49Å; Y527-Y594 HydrophobicContact CE1-CD1 3.49Å; Y527-Y594 VanDerWaalsContact CE1-CD1 3.49Å; Y527-Y594 AromaticContact CE1-CD2 3.73Å; Y527-Y594 HydrophobicContact CE1-CD2 3.73Å; Y527-Y594 AromaticContact CE1-CE1 3.91Å; Y527-Y594 HydrophobicContact CE1-CE1 3.91Å; Y527-Y594 HydrophobicContact CE1-CE2 4.11Å; Y527-Y594 AromaticContact CE1-CG 3.39Å; Y527-Y594 HydrophobicContact CE1-CG 3.39Å; Y527-Y594 AromaticContact CZ-CD1 3.88Å; K541-Y594 HydrophobicContact CG-CE2 4.17Å; R590-Y594 PolarHBondContact O-N 3.24Å; R591-Y594 CarbonylContact O-C 3.5Å; R591-Y594 WeakPolarHBondContact O-CA 3.41Å; R591-Y594 WeakPolarHBondContact O-CB 3.28Å; R591-Y594 PolarHBondContact O-N 3.23Å; K592-Y594 VanDerWaalsContact C-N 3.28Å; K592-Y594 PolarHBondContact O-N 3.1Å; Y594-E597 PolarHBondContact O-N 3.03Å; Y594-M598 HydrophobicContact CD1-CG 4.18Å; Y594-M598 HydrophobicContact CD2-CG 4.45Å; Y594-M598 HydrophobicContact CE1-CG 3.71Å; Y594-M598 HydrophobicContact CE2-CE 4.11Å; Y594-M598 HydrophobicContact CE2-CG 4.01Å; Y594-M598 HydrophobicContact CE2-SD 4.17Å; Y594-M598 VanDerWaalsContact O-CG 3.29Å; Y594-M598 WeakPolarHBondContact O-CG 3.5Å; Y594-M598 PolarHBondContact O-N 2.73Å
595	E	92.3	Very high	93.7	Very high	100 Å²	100	75.6 Å²	75.6	47%	0.467	36%	0.357	S	S	.	.	H	α-helix	trans	-65.6	-43.1	178.4	-73.2	159.4	-174.9	0	0	110.7	R591 K592 M598 E599	R591-E595 WeakPolarHBondContact CD-OE1 3.43Å; R591-E595 VanDerWaalsContact CG-CD 3.5Å; R591-E595 HydrophobicContact CG-CG 4.46Å; R591-E595 WeakPolarHBondContact CG-OE1 3.4Å; R591-E595 PolarHBondContact O-N 3.31Å; K592-E595 PolarHBondContact O-N 3.07Å; K592-E595 VanDerWaalsContact O-N 3.17Å; E595-M598 PolarHBondContact O-N 3.42Å; E595-E599 PolarHBondContact O-N 2.89Å
596	E	93.9	Very high	93.8	Very high	82 Å²	82	76.6 Å²	76.6	38%	0.383	36%	0.36	S	S	.	.	H	α-helix	trans	-61.4	-45.3	171	-70	168.6	167.4	0	0	112.4	K592 M598 E599 E600	K592-E596 WeakPolarHBondContact CE-OE1 3.28Å; K592-E596 IonicContact NZ-OE1 3.42Å; K592-E596 PolarHBondContact NZ-OE1 2.92Å; K592-E596 IonicContact NZ-OE2 3.44Å; K592-E596 WeakPolarHBondContact O-CB 3.31Å; K592-E596 WeakPolarHBondContact O-CG 3.49Å; K592-E596 PolarHBondContact O-N 3.26Å; E596-M598 PolarHBondContact O-N 3.12Å; E596-E599 PolarHBondContact O-N 2.95Å; E596-E600 WeakPolarHBondContact O-CB 3.1Å; E596-E600 PolarHBondContact O-N 2.93Å; E596-E600 VanDerWaalsContact O-N 3.08Å
597	E	91	Very high	93.8	Very high	63 Å²	63	75.5 Å²	75.5	29%	0.294	36%	0.357	S	S	.	.	H	α-helix	trans	-61	-31	174.4	-81.1	171.4	175.1	0	0	112.5	R524 L593 Y594 L601	R524-E597 IonicContact CZ-OE1 2.8Å; R524-E597 IonicContact NH1-OE1 3.01Å; R524-E597 PolarHBondContact NH1-OE1 3.08Å; R524-E597 IonicContact NH1-OE2 2.71Å; R524-E597 IonicContact NH2-OE1 3.87Å; R524-E597 PolarHBondContact NH2-OE1 2.78Å; L593-E597 VanDerWaalsContact O-CB 3.27Å; L593-E597 WeakPolarHBondContact O-CB 3.46Å; L593-E597 WeakPolarHBondContact O-CG 3.47Å; L593-E597 PolarHBondContact O-N 3.35Å; L593-E597 VanDerWaalsContact O-N 3.08Å; Y594-E597 PolarHBondContact O-N 3.03Å; E597-L601 WeakPolarHBondContact O-CD1 3.13Å; E597-L601 WeakPolarHBondContact O-CG 3.31Å; E597-L601 PolarHBondContact O-N 3.45Å
598	M	90.3	Very high	93.9	Very high	37 Å²	37	74 Å²	74	18%	0.182	35%	0.348	C	S	.	.	H	α-helix	trans	-82.8	-38.5	177.4	-70.6	-56.8	97.4	0	0	113	Y594 E595 E596 L601 S602 T641	Y594-M598 HydrophobicContact CD1-CG 4.18Å; Y594-M598 HydrophobicContact CD2-CG 4.45Å; Y594-M598 HydrophobicContact CE1-CG 3.71Å; Y594-M598 HydrophobicContact CE2-CE 4.11Å; Y594-M598 HydrophobicContact CE2-CG 4.01Å; Y594-M598 HydrophobicContact CE2-SD 4.17Å; Y594-M598 VanDerWaalsContact O-CG 3.29Å; Y594-M598 WeakPolarHBondContact O-CG 3.5Å; Y594-M598 PolarHBondContact O-N 2.73Å; E595-M598 PolarHBondContact O-N 3.42Å; E596-M598 PolarHBondContact O-N 3.12Å; M598-L601 HydrophobicContact CE-CD1 3.93Å; M598-L601 CarbonylContact O-C 3.51Å; M598-L601 PolarHBondContact O-N 2.87Å; M598-S602 WeakPolarHBondContact O-CB 3.4Å; M598-S602 PolarHBondContact O-N 3.18Å; M598-T641 HydrophobicContact SD-CG2 4.07Å
599	E	91.8	Very high	94	Very high	144 Å²	144	69.2 Å²	69.2	67%	0.673	33%	0.329	S	S	*	.	H	α-helix	trans	-63.1	-45.1	176.5	-175.2	175.5	-168.7	0	0	110.6	E595 E596 L601 S602 N603	E595-E599 PolarHBondContact O-N 2.89Å; E596-E599 PolarHBondContact O-N 2.95Å; E599-L601 VanDerWaalsContact C-N 3.28Å; E599-L601 PolarHBondContact O-N 3.44Å; E599-S602 PolarHBondContact O-N 3.42Å; E599-S602 PolarHBondContact O-OG 3.46Å; E599-N603 PolarHBondContact O-N 3.47Å
600	E	91.8	Very high	94.1	Very high	81 Å²	81	63 Å²	63	38%	0.379	30%	0.3	S	S	.	.	H	α-helix	trans	-58.8	-39.1	175.4	-162.6	-118.4	141.4	0	0	111.9	E596 N607 R695	E596-E600 WeakPolarHBondContact O-CB 3.1Å; E596-E600 PolarHBondContact O-N 2.93Å; E596-E600 VanDerWaalsContact O-N 3.08Å; E600-N607 PolarHBondContact OE1-ND2 3.22Å; E600-R695 IonicContact OE1-CZ 2.94Å; E600-R695 IonicContact OE1-NH1 2.78Å; E600-R695 PolarHBondContact OE1-NH1 3.05Å; E600-R695 IonicContact OE1-NH2 2.64Å; E600-R695 IonicContact OE2-CZ 2.89Å; E600-R695 VanDerWaalsContact OE2-CZ 3.26Å; E600-R695 IonicContact OE2-NH1 3.28Å; E600-R695 PolarHBondContact OE2-NH1 3.02Å; E600-R695 IonicContact OE2-NH2 3.33Å; E600-R695 PolarHBondContact OE2-NH2 3.47Å
601	L	90.6	Very high	94.2	Very high	31 Å²	31	63 Å²	63	16%	0.162	30%	0.301	C	S	.	.	H	α-helix	trans	-80.1	-11.8	175.1	-76.1	172.8	0	0	0	114.5	E597 M598 E599 T641	E597-L601 WeakPolarHBondContact O-CD1 3.13Å; E597-L601 WeakPolarHBondContact O-CG 3.31Å; E597-L601 PolarHBondContact O-N 3.45Å; M598-L601 HydrophobicContact CE-CD1 3.93Å; M598-L601 CarbonylContact O-C 3.51Å; M598-L601 PolarHBondContact O-N 2.87Å; E599-L601 VanDerWaalsContact C-N 3.28Å; E599-L601 PolarHBondContact O-N 3.44Å; L601-T641 HydrophobicContact CB-CG2 3.75Å
602	S	93.8	Very high	94.2	Very high	41 Å²	41	59.6 Å²	59.6	29%	0.287	29%	0.292	S	S	.	.	H	α-helix	trans	-88.1	-8.5	174.2	78.2	0	0	0	0	113.5	M598 E599 L604 T643	M598-S602 WeakPolarHBondContact O-CB 3.4Å; M598-S602 PolarHBondContact O-N 3.18Å; E599-S602 PolarHBondContact O-N 3.42Å; E599-S602 PolarHBondContact O-OG 3.46Å; S602-L604 PolarHBondContact O-N 3.4Å; S602-T643 WeakPolarHBondContact O-CG2 3.32Å
603	N	94.5	Very high	94	Very high	70 Å²	70	57 Å²	57	37%	0.374	29%	0.288	S	S	.	.			trans	-65.9	125.2	-174.3	-160.4	-61.3	0	0	0	111.3	E599 N605 K606	E599-N603 PolarHBondContact O-N 3.47Å; N603-N605 PolarHBondContact OD1-N 2.73Å; N603-K606 PolarHBondContact OD1-N 3.2Å
604	L	94.4	Very high	93.9	Very high	41 Å²	41	56.7 Å²	56.7	22%	0.215	29%	0.289	C	S	.	.	S	Bend	trans	-95.9	7.1	-178.9	-68.9	179.5	0	0	0	113.8	S602 V608 T643 Q645 Y705	S602-L604 PolarHBondContact O-N 3.4Å; L604-V608 WeakPolarHBondContact O-CG2 3.48Å; L604-T643 HydrophobicContact CD2-CG2 4.27Å; L604-T643 HydrophobicContact CG-CG2 4.44Å; L604-Q645 HydrophobicContact CD2-CB 3.84Å; L604-Y705 PolarHBondContact O-OH 3.03Å
605	N	96.4	Very high	93.9	Very high	74 Å²	74	56 Å²	56	40%	0.396	29%	0.288	S	S	.	.	S	Bend	trans	-126	-19.6	176.1	-79.2	100.4	0	0	0	114.3	N603 D702 I703 Y705	N603-N605 PolarHBondContact OD1-N 2.73Å; N605-D702 CarbonylContact O-C 3.6Å; N605-D702 WeakPolarHBondContact O-CA 3.39Å; N605-I703 PolarHBondContact ND2-O 2.95Å; N605-I703 PolarHBondContact O-N 2.9Å; N605-Y705 WeakPolarHBondContact ND2-CE2 3.47Å
606	K	95.5	Very high	94	Very high	128 Å²	128	51.5 Å²	51.5	56%	0.557	27%	0.268	S	S	*	.	S	Bend	trans	-124	144.1	176.2	-68	-173	174.9	-175.6	0	111.4	N603 V608 D702	N603-K606 PolarHBondContact OD1-N 3.2Å; K606-V608 PolarHBondContact O-N 3.09Å; K606-D702 WeakPolarHBondContact CA-OD1 3.47Å
607	N	95.3	Very high	94.1	Very high	54 Å²	54	47.8 Å²	47.8	29%	0.289	25%	0.25	S	S	.	.	S	Bend	trans	49.6	27.5	-178.5	-75.7	-47.7	0	0	0	114.8	E600 T700 A701 D702	E600-N607 PolarHBondContact OE1-ND2 3.22Å; N607-T700 VanDerWaalsContact O-CG2 3.32Å; N607-T700 WeakPolarHBondContact O-CG2 3.36Å; N607-A701 PolarHBondContact N-O 2.81Å; N607-D702 PolarHBondContact N-OD1 2.91Å
608	V	97.4	Very high	94.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	128.3	-176.7	-177.2	0	0	0	0	109.3	L604 K606 I610 I663 T700 A701 I703	L604-V608 WeakPolarHBondContact O-CG2 3.48Å; K606-V608 PolarHBondContact O-N 3.09Å; V608-I610 WeakPolarHBondContact O-CG1 3.24Å; V608-I610 PolarHBondContact O-N 3.18Å; V608-I663 HydrophobicContact CG1-CD1 4.03Å; V608-T700 CarbonylContact O-C 3.47Å; V608-T700 VanDerWaalsContact O-CA 3.22Å; V608-T700 WeakPolarHBondContact O-CA 3.34Å; V608-A701 WeakPolarHBondContact CB-O 3.46Å; V608-A701 PolarHBondContact N-O 3.45Å; V608-A701 PolarHBondContact O-N 3.02Å; V608-I703 HydrophobicContact CB-CD1 4.26Å; V608-I703 HydrophobicContact CG1-CD1 4.18Å; V608-I703 HydrophobicContact CG2-CD1 3.84Å; V608-I703 HydrophobicContact CG2-CG1 3.89Å
609	P	97.5	Very high	94.5	Very high	16 Å²	16	45.5 Å²	45.5	10%	0.104	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	126.3	-179.8	21.8	-31	0	0	0	111.3	M634 F646 G647 Y698	P609-M634 HydrophobicContact CB-CG 3.45Å; P609-M634 VanDerWaalsContact CB-CG 3.45Å; P609-M634 HydrophobicContact CB-SD 3.79Å; P609-M634 HydrophobicContact CG-CG 4.44Å; P609-F646 HydrophobicContact CB-CB 4.33Å; P609-F646 HydrophobicContact CG-CB 3.94Å; P609-G647 PolarHBondContact O-N 3.34Å; P609-Y698 HydrophobicContact CB-CD2 4.32Å; P609-Y698 HydrophobicContact CB-CE2 3.86Å
610	I	97.7	Very high	94.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	117.6	-179.9	-53.2	-55.5	0	0	0	110.4	V608 V612 G647 C649 F657 F687 N699 A701	V608-I610 WeakPolarHBondContact O-CG1 3.24Å; V608-I610 PolarHBondContact O-N 3.18Å; I610-V612 HydrophobicContact CG2-CG2 3.91Å; I610-G647 WeakPolarHBondContact CA-O 3.2Å; I610-C649 HydrophobicContact CG2-CB 4.02Å; I610-F657 HydrophobicContact CB-CE2 4.44Å; I610-F657 HydrophobicContact CB-CZ 4.35Å; I610-F657 HydrophobicContact CG1-CE2 4.09Å; I610-F657 HydrophobicContact CG1-CZ 4.07Å; I610-F657 HydrophobicContact CG2-CD2 4.06Å; I610-F657 HydrophobicContact CG2-CE2 4Å; I610-F657 HydrophobicContact CG2-CG 4.37Å; I610-F657 HydrophobicContact CG2-CZ 4.28Å; I610-F687 HydrophobicContact CD1-CE2 4.24Å; I610-F687 HydrophobicContact CD1-CZ 3.89Å; I610-N699 HydrophobicContact CB-CB 4.24Å; I610-N699 PolarHBondContact N-O 3.08Å; I610-A701 HydrophobicContact CD1-CB 3.99Å; I610-A701 HydrophobicContact CG1-CB 3.72Å
611	F	97.3	Very high	94.7	Very high	21 Å²	21	37.4 Å²	37.4	9%	0.092	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	131.8	163.1	-159.6	-98.9	0	0	0	108.9	C613 L624 I626 Y631 M634 F646 G647 M648 C649	F611-C613 HydrophobicContact CD1-CB 3.65Å; F611-C613 HydrophobicContact CE1-CB 3.45Å; F611-C613 VanDerWaalsContact CE1-CB 3.45Å; F611-L624 HydrophobicContact CD1-CD1 4.29Å; F611-L624 HydrophobicContact CE1-CD1 4.34Å; F611-I626 HydrophobicContact CD2-CD1 4.28Å; F611-I626 HydrophobicContact CE2-CD1 3.47Å; F611-I626 VanDerWaalsContact CE2-CD1 3.47Å; F611-I626 HydrophobicContact CZ-CD1 3.6Å; F611-Y631 AromaticContact CD2-CD1 3.43Å; F611-Y631 HydrophobicContact CD2-CD1 3.43Å; F611-Y631 VanDerWaalsContact CD2-CD1 3.43Å; F611-Y631 HydrophobicContact CD2-CD2 4.16Å; F611-Y631 AromaticContact CD2-CE1 3.67Å; F611-Y631 HydrophobicContact CD2-CE1 3.67Å; F611-Y631 HydrophobicContact CD2-CE2 4.38Å; F611-Y631 AromaticContact CD2-CG 3.7Å; F611-Y631 HydrophobicContact CD2-CG 3.7Å; F611-Y631 AromaticContact CE2-CD1 3.73Å; F611-Y631 HydrophobicContact CE2-CD1 3.73Å; F611-Y631 AromaticContact CE2-CD2 3.61Å; F611-Y631 HydrophobicContact CE2-CD2 3.61Å; F611-Y631 HydrophobicContact CE2-CE1 4.12Å; F611-Y631 HydrophobicContact CE2-CE2 4.02Å; F611-Y631 AromaticContact CE2-CG 3.45Å; F611-Y631 HydrophobicContact CE2-CG 3.45Å; F611-Y631 VanDerWaalsContact CE2-CG 3.45Å; F611-Y631 HydrophobicContact CG-CE1 4.49Å; F611-Y631 HydrophobicContact CZ-CD2 4.49Å; F611-M634 HydrophobicContact CB-CE 4.23Å; F611-M634 HydrophobicContact CD2-CE 4.05Å; F611-F646 HydrophobicContact CB-CD2 3.93Å; F611-F646 HydrophobicContact CB-CE2 3.86Å; F611-F646 HydrophobicContact CG-CE2 4.48Å; F611-G647 PolarHBondContact N-O 3.5Å; F611-M648 HydrophobicContact CB-CE 4.37Å; F611-M648 HydrophobicContact CB-SD 4.29Å; F611-M648 HydrophobicContact CD1-CE 3.56Å; F611-M648 HydrophobicContact CD1-SD 3.77Å; F611-M648 HydrophobicContact CE1-CE 4.29Å; F611-M648 HydrophobicContact CG-CE 4.35Å; F611-M648 WeakPolarHBondContact O-CA 3.37Å; F611-C649 PolarHBondContact O-N 3.18Å
612	V	95.1	Very high	94.9	Very high	34 Å²	34	36.7 Å²	36.7	21%	0.206	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	105.6	-177.5	-177.6	0	0	0	0	108.8	I610 C649 G651 F657 N699	I610-V612 HydrophobicContact CG2-CG2 3.91Å; V612-C649 WeakPolarHBondContact CA-O 3.36Å; V612-G651 VanDerWaalsContact CG1-CA 3.43Å; V612-F657 HydrophobicContact CG1-CB 3.96Å; V612-F657 HydrophobicContact CG2-CB 3.71Å; V612-F657 HydrophobicContact CG2-CD1 3.94Å; V612-F657 HydrophobicContact CG2-CG 3.97Å; V612-N699 WeakPolarHBondContact CG2-ND2 3.47Å
613	C	91.9	Very high	94.8	Very high	68 Å²	68	38.2 Å²	38.2	46%	0.459	22%	0.216	S	C	.	.	S	Bend	trans	-156.5	-72.2	-174.5	-170.8	0	0	0	0	113.3	F611 M648 C649	F611-C613 HydrophobicContact CD1-CB 3.65Å; F611-C613 HydrophobicContact CE1-CB 3.45Å; F611-C613 VanDerWaalsContact CE1-CB 3.45Å; C613-M648 HydrophobicContact CB-SD 4.03Å; C613-C649 PolarHBondContact N-O 2.76Å; C613-C649 VanDerWaalsContact N-O 3.07Å
614	T	90.9	Very high	94.9	Very high	65 Å²	65	35.7 Å²	35.7	40%	0.399	20%	0.202	S	C	.	.	S	Bend	trans	-133.9	169.2	-170.1	46.3	0	0	0	0	111.7	M648	T614-M648 VanDerWaalsContact O-CG 3.24Å; T614-M648 WeakPolarHBondContact O-CG 3.46Å
615	M	92.1	Very high	94.8	Very high	25 Å²	25	37.9 Å²	37.9	12%	0.123	21%	0.211	C	C	.	.			trans	-69.3	131.8	168.3	-69.4	-59.9	-62.5	0	0	110	Y617 L650 Q783 L784 L787	M615-Y617 HydrophobicContact CB-CE2 4.27Å; M615-Y617 HydrophobicContact CE-CE1 4.39Å; M615-L650 HydrophobicContact SD-CB 3.98Å; M615-L650 HydrophobicContact SD-CD2 4.26Å; M615-Q783 HydrophobicContact CE-CB 4.31Å; M615-Q783 HydrophobicContact CG-CB 4.06Å; M615-L784 HydrophobicContact CE-CB 4.37Å; M615-L784 HydrophobicContact CE-CD1 4.17Å; M615-L784 HydrophobicContact SD-CB 4.38Å; M615-L784 HydrophobicContact SD-CD1 4.25Å; M615-L787 HydrophobicContact CE-CB 4.1Å; M615-L787 HydrophobicContact CE-CD2 3.87Å
616	A	95.2	Very high	94.7	Very high	6 Å²	6	34.5 Å²	34.5	5%	0.05	19%	0.193	C	C	.	.			trans	-123.1	151.5	169.3	0	0	0	0	0	110.1	M648 C662 L664	A616-M648 HydrophobicContact CB-CB 3.88Å; A616-M648 HydrophobicContact CB-CG 3.69Å; A616-C662 HydrophobicContact CB-CB 4.2Å; A616-C662 VanDerWaalsContact O-CB 3.32Å; A616-C662 WeakPolarHBondContact O-CB 3.2Å; A616-L664 HydrophobicContact CB-CD1 4.5Å; A616-L664 HydrophobicContact CB-CD2 3.88Å; A616-L664 HydrophobicContact CB-CG 4.36Å
617	Y	95.9	Very high	94.4	Very high	5 Å²	5	33.9 Å²	33.9	2%	0.02	19%	0.19	C	C	.	.			trans	-134.3	149.7	-173.4	-60.6	-77.8	0	0	0	112.1	M615 V620 G683 W770 L773 A774 Q783 L787	M615-Y617 HydrophobicContact CB-CE2 4.27Å; M615-Y617 HydrophobicContact CE-CE1 4.39Å; Y617-V620 PolarHBondContact O-N 3.29Å; Y617-G683 WeakPolarHBondContact O-CA 3.45Å; Y617-W770 HydrophobicContact CD1-CD2 4.44Å; Y617-W770 AromaticContact CD1-CE3 3.39Å; Y617-W770 HydrophobicContact CD1-CE3 3.39Å; Y617-W770 AromaticContact CD1-CZ3 3.75Å; Y617-W770 HydrophobicContact CD1-CZ3 3.75Å; Y617-W770 HydrophobicContact CE1-CE3 4.07Å; Y617-W770 HydrophobicContact CE1-CZ3 4.17Å; Y617-W770 HydrophobicContact CG-CE3 4.12Å; Y617-L773 HydrophobicContact CE1-CB 4.09Å; Y617-L773 PolarHBondContact OH-O 3.31Å; Y617-A774 HydrophobicContact CD2-CB 3.81Å; Y617-A774 HydrophobicContact CE2-CB 3.93Å; Y617-Q783 VanDerWaalsContact OH-CB 3.23Å; Y617-Q783 WeakPolarHBondContact OH-CB 3.3Å; Y617-Q783 WeakPolarHBondContact OH-CG 3.37Å; Y617-Q783 PolarHBondContact OH-NE2 3.3Å; Y617-L787 HydrophobicContact CD1-CD1 3.76Å; Y617-L787 HydrophobicContact CE1-CD1 4.26Å
618	P	96	Very high	94.2	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.006	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-50	140.4	170.7	-26.9	35.7	0	0	0	112.2	V620 R686 N764 W770	P618-V620 PolarHBondContact O-N 3.06Å; P618-R686 HydrophobicContact CG-CG 3.59Å; P618-N764 HydrophobicContact CB-CB 3.9Å; P618-N764 HydrophobicContact CG-CB 3.85Å; P618-W770 HydrophobicContact CB-CG 4.31Å; P618-W770 HydrophobicContact CG-CD2 4.36Å; P618-W770 HydrophobicContact CG-CZ2 4.47Å; P618-W770 VanDerWaalsContact O-CB 3.25Å; P618-W770 WeakPolarHBondContact O-CB 3.23Å
619	T	93.3	Very high	93.7	Very high	50 Å²	50	37.4 Å²	37.4	31%	0.307	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	64	-8.6	-178.9	70.6	0	0	0	0	117.1	I682 G683 A767	T619-I682 WeakPolarHBondContact O-CD1 3.33Å; T619-G683 PolarHBondContact N-O 3.29Å; T619-A767 HydrophobicContact CG2-CB 4.08Å
620	V	94.1	Very high	93.4	Very high	11 Å²	11	37.7 Å²	37.7	7%	0.067	21%	0.211	C	C	.	.			trans	-88.3	131.3	179.8	-176.5	0	0	0	0	110.5	Y617 P618 G683 F749 W770 A774	Y617-V620 PolarHBondContact O-N 3.29Å; P618-V620 PolarHBondContact O-N 3.06Å; V620-G683 PolarHBondContact O-N 3.29Å; V620-F749 HydrophobicContact CG1-CD1 3.99Å; V620-F749 HydrophobicContact CG1-CE1 4.36Å; V620-W770 HydrophobicContact CG2-CB 4.06Å; V620-A774 HydrophobicContact CG1-CB 4.08Å; V620-A774 HydrophobicContact CG2-CB 4.36Å
621	P	93.9	Very high	93.2	Very high	45 Å²	45	39.3 Å²	39.3	29%	0.292	22%	0.218	S	C	.	.	B	Isolated β-bridge	trans	-62.5	144	171.9	-22.6	34.3	0	0	0	112.6	S681	P621-S681 WeakPolarHBondContact CA-O 3.18Å
622	C	93.8	Very high	92.8	Very high	16 Å²	16	39.3 Å²	39.3	11%	0.108	22%	0.217	C	C	.	.			trans	-140	82.3	179	-166.1	0	0	0	0	109.7	L664 S681	C622-L664 HydrophobicContact CB-CD1 4.11Å; C622-L664 HydrophobicContact CB-CD2 3.71Å; C622-S681 PolarHBondContact N-O 2.94Å; C622-S681 PolarHBondContact O-OG 3.3Å
623	P	93.6	Very high	92.6	Very high	72 Å²	72	37.8 Å²	37.8	47%	0.468	21%	0.208	S	C	.	.			trans	-74.7	127	176.1	29.7	-33	0	0	0	110.7	V679	P623-V679 WeakPolarHBondContact CA-O 3.19Å
624	L	94.9	Very high	92.7	Very high	17 Å²	17	34.6 Å²	34.6	9%	0.089	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136.1	-177	-57.1	177.4	0	0	0	111.7	F611 I626 F646 M648 L664 V678 V679	F611-L624 HydrophobicContact CD1-CD1 4.29Å; F611-L624 HydrophobicContact CE1-CD1 4.34Å; L624-I626 HydrophobicContact CB-CD1 3.83Å; L624-I626 HydrophobicContact CB-CG1 4.26Å; L624-I626 HydrophobicContact CD1-CD1 4.3Å; L624-F646 HydrophobicContact CD1-CE2 3.92Å; L624-F646 HydrophobicContact CD1-CZ 3.69Å; L624-M648 HydrophobicContact CD1-CE 3.71Å; L624-M648 HydrophobicContact CD2-CE 3.85Å; L624-M648 HydrophobicContact CG-CE 4.4Å; L624-L664 HydrophobicContact CD1-CD1 4.35Å; L624-V678 CarbonylContact O-C 3.48Å; L624-V678 WeakPolarHBondContact O-CA 3.22Å; L624-V679 HydrophobicContact CB-CB 4.42Å; L624-V679 PolarHBondContact N-O 3.25Å; L624-V679 PolarHBondContact O-N 3.45Å
625	H	93.9	Very high	92.8	Very high	88 Å²	88	31.5 Å²	31.5	41%	0.407	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	104.8	169.4	171.2	-106.9	0	0	0	109.7	F627 R676	H625-F627 AromaticContact ND1-CD1 3.92Å; H625-R676 PolarHBondContact NE2-NH1 3.4Å
626	I	93.3	Very high	92.6	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.01	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	117.6	-173	-53.4	-61.9	0	0	0	109.4	F611 L624 R632 I635 R676 S677 V679	F611-I626 HydrophobicContact CD2-CD1 4.28Å; F611-I626 HydrophobicContact CE2-CD1 3.47Å; F611-I626 VanDerWaalsContact CE2-CD1 3.47Å; F611-I626 HydrophobicContact CZ-CD1 3.6Å; L624-I626 HydrophobicContact CB-CD1 3.83Å; L624-I626 HydrophobicContact CB-CG1 4.26Å; L624-I626 HydrophobicContact CD1-CD1 4.3Å; I626-R632 HydrophobicContact CG2-CG 4.14Å; I626-I635 HydrophobicContact CG1-CG1 4.29Å; I626-R676 CarbonylContact O-C 3.59Å; I626-R676 WeakPolarHBondContact O-CA 3.33Å; I626-S677 PolarHBondContact N-O 2.91Å; I626-S677 PolarHBondContact O-N 3.4Å; I626-V679 HydrophobicContact CG1-CG2 3.74Å
627	F	90.5	Very high	92.4	Very high	115 Å²	115	32.2 Å²	32.2	50%	0.504	17%	0.167	S	C	.	.			trans	-120.9	-27.8	-178.8	57.6	-87.9	0	0	0	114.1	H625 R632 R676	H625-F627 AromaticContact ND1-CD1 3.92Å; F627-R632 WeakPolarHBondContact O-CD 3.44Å; F627-R676 HydrophobicContact CB-CG 3.82Å
628	E	89.8	Confident	92.3	Very high	84 Å²	84	32.1 Å²	32.1	39%	0.393	17%	0.167	S	C	.	.	S	Bend	trans	-74.3	137.3	-177.1	-54.8	-171	160.9	0	0	112.5	C630 Y631 R632	E628-C630 PolarHBondContact O-N 3.37Å; E628-Y631 HydrophobicContact CB-CD2 4.07Å; E628-Y631 PolarHBondContact O-N 3.31Å; E628-Y631 WeakPolarHBondContact OE2-CD2 3.43Å; E628-Y631 VanDerWaalsContact OE2-CE2 3.29Å; E628-Y631 WeakPolarHBondContact OE2-CE2 3.4Å; E628-R632 WeakPolarHBondContact O-CG 3.44Å; E628-R632 PolarHBondContact O-N 3Å
629	P	87.5	Confident	92.1	Very high	44 Å²	44	35.5 Å²	35.5	29%	0.286	19%	0.185	S	C	.	.	H	α-helix	trans	-54.6	-40.1	-177.5	-32.7	38.7	0	0	0	116.2	D548 H549 R632 L633	D548-P629 WeakPolarHBondContact O-CB 3.5Å; H549-P629 HydrophobicContact CB-CB 4.48Å; H549-P629 VanDerWaalsContact ND1-CB 3.29Å; H549-P629 WeakPolarHBondContact ND1-CB 3.2Å; P629-R632 WeakPolarHBondContact O-CB 3.43Å; P629-R632 PolarHBondContact O-N 3.28Å; P629-L633 PolarHBondContact O-N 3.08Å
630	C	91.3	Very high	91.8	Very high	22 Å²	22	35.7 Å²	35.7	15%	0.149	18%	0.182	C	C	.	.	H	α-helix	trans	-66.6	-42.2	-179.9	52.5	0	0	0	0	111.8	E628 L633 M634 Y698	E628-C630 PolarHBondContact O-N 3.37Å; C630-L633 WeakPolarHBondContact O-CB 3.38Å; C630-L633 PolarHBondContact O-N 3.41Å; C630-M634 WeakPolarHBondContact O-CB 3.4Å; C630-M634 PolarHBondContact O-N 3.33Å; C630-Y698 WeakPolarHBondContact O-CD1 3.49Å
631	Y	92.6	Very high	91.7	Very high	34 Å²	34	36.4 Å²	36.4	13%	0.133	19%	0.187	C	C	.	.	H	α-helix	trans	-74.7	-28.2	176.2	-63.4	-55.2	0	0	0	113.1	F611 E628 M634 I635	F611-Y631 AromaticContact CD2-CD1 3.43Å; F611-Y631 HydrophobicContact CD2-CD1 3.43Å; F611-Y631 VanDerWaalsContact CD2-CD1 3.43Å; F611-Y631 HydrophobicContact CD2-CD2 4.16Å; F611-Y631 AromaticContact CD2-CE1 3.67Å; F611-Y631 HydrophobicContact CD2-CE1 3.67Å; F611-Y631 HydrophobicContact CD2-CE2 4.38Å; F611-Y631 AromaticContact CD2-CG 3.7Å; F611-Y631 HydrophobicContact CD2-CG 3.7Å; F611-Y631 AromaticContact CE2-CD1 3.73Å; F611-Y631 HydrophobicContact CE2-CD1 3.73Å; F611-Y631 AromaticContact CE2-CD2 3.61Å; F611-Y631 HydrophobicContact CE2-CD2 3.61Å; F611-Y631 HydrophobicContact CE2-CE1 4.12Å; F611-Y631 HydrophobicContact CE2-CE2 4.02Å; F611-Y631 AromaticContact CE2-CG 3.45Å; F611-Y631 HydrophobicContact CE2-CG 3.45Å; F611-Y631 VanDerWaalsContact CE2-CG 3.45Å; F611-Y631 HydrophobicContact CG-CE1 4.49Å; F611-Y631 HydrophobicContact CZ-CD2 4.49Å; E628-Y631 HydrophobicContact CB-CD2 4.07Å; E628-Y631 PolarHBondContact O-N 3.31Å; E628-Y631 WeakPolarHBondContact OE2-CD2 3.43Å; E628-Y631 VanDerWaalsContact OE2-CE2 3.29Å; E628-Y631 WeakPolarHBondContact OE2-CE2 3.4Å; Y631-M634 HydrophobicContact CD1-CE 4.29Å; Y631-M634 HydrophobicContact CD1-SD 3.83Å; Y631-M634 HydrophobicContact CE1-SD 4.33Å; Y631-M634 WeakPolarHBondContact O-CB 3.2Å; Y631-M634 PolarHBondContact O-N 2.75Å; Y631-I635 WeakPolarHBondContact O-CG1 3.15Å; Y631-I635 PolarHBondContact O-N 2.88Å
632	R	90.2	Very high	91.6	Very high	21 Å²	21	36.8 Å²	36.8	8%	0.079	20%	0.199	C	C	.	.	H	α-helix	trans	-60.4	-45.8	167.5	-72.9	163.4	46.5	156.3	4.6	111.5	L547 D548 I626 F627 E628 P629 R636 D674 G675	L547-R632 PolarHBondContact O-NH2 2.9Å; D548-R632 VanDerWaalsContact O-CZ 3.22Å; D548-R632 PolarHBondContact O-NE 3.49Å; D548-R632 PolarHBondContact O-NH2 3.46Å; D548-R632 IonicContact OD1-CZ 2.76Å; D548-R632 IonicContact OD1-NE 2.69Å; D548-R632 PolarHBondContact OD1-NE 2.96Å; D548-R632 IonicContact OD1-NH2 3.11Å; D548-R632 PolarHBondContact OD1-NH2 2.9Å; I626-R632 HydrophobicContact CG2-CG 4.14Å; F627-R632 WeakPolarHBondContact O-CD 3.44Å; E628-R632 WeakPolarHBondContact O-CG 3.44Å; E628-R632 PolarHBondContact O-N 3Å; P629-R632 WeakPolarHBondContact O-CB 3.43Å; P629-R632 PolarHBondContact O-N 3.28Å; R632-R636 WeakPolarHBondContact O-CB 3.27Å; R632-R636 PolarHBondContact O-N 2.93Å; R632-D674 PolarHBondContact NH1-O 2.75Å; R632-G675 WeakPolarHBondContact CD-O 3.5Å; R632-G675 VanDerWaalsContact CZ-C 3.48Å; R632-G675 PolarHBondContact NE-O 3.08Å; R632-G675 VanDerWaalsContact NE-O 3.08Å; R632-G675 PolarHBondContact NH1-O 3.28Å
633	L	89.7	Confident	91.7	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.016	20%	0.201	C	C	.	.	H	α-helix	trans	-62.2	-44.5	172.9	171.3	64.9	0	0	0	111.7	R545 P629 C630 R636 R637 D696 Y698	R545-L633 HydrophobicContact CG-CD1 4.3Å; R545-L633 HydrophobicContact CG-CD2 4.28Å; P629-L633 PolarHBondContact O-N 3.08Å; C630-L633 WeakPolarHBondContact O-CB 3.38Å; C630-L633 PolarHBondContact O-N 3.41Å; L633-R636 VanDerWaalsContact CD1-NH2 3.32Å; L633-R636 PolarHBondContact O-N 3.36Å; L633-R637 HydrophobicContact CD1-CG 4.25Å; L633-R637 WeakPolarHBondContact O-CG 3.34Å; L633-R637 PolarHBondContact O-N 2.61Å; L633-D696 HydrophobicContact CD2-CB 3.52Å; L633-Y698 HydrophobicContact CD2-CE1 4.43Å; L633-Y698 HydrophobicContact CG-CE1 4.43Å
634	M	93.6	Very high	91.9	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-57	-53.8	178	-171.6	-162.7	79.3	0	0	111.8	P609 F611 C630 Y631 R636 R637 C638 F646 Y698	P609-M634 HydrophobicContact CB-CG 3.45Å; P609-M634 VanDerWaalsContact CB-CG 3.45Å; P609-M634 HydrophobicContact CB-SD 3.79Å; P609-M634 HydrophobicContact CG-CG 4.44Å; F611-M634 HydrophobicContact CB-CE 4.23Å; F611-M634 HydrophobicContact CD2-CE 4.05Å; C630-M634 WeakPolarHBondContact O-CB 3.4Å; C630-M634 PolarHBondContact O-N 3.33Å; Y631-M634 HydrophobicContact CD1-CE 4.29Å; Y631-M634 HydrophobicContact CD1-SD 3.83Å; Y631-M634 HydrophobicContact CE1-SD 4.33Å; Y631-M634 WeakPolarHBondContact O-CB 3.2Å; Y631-M634 PolarHBondContact O-N 2.75Å; M634-R636 VanDerWaalsContact C-N 3.34Å; M634-R636 PolarHBondContact O-N 3.08Å; M634-R637 PolarHBondContact O-N 2.57Å; M634-C638 PolarHBondContact O-N 3.28Å; M634-C638 PolarHBondContact O-SG 3.43Å; M634-F646 HydrophobicContact CE-CB 4.27Å; M634-F646 HydrophobicContact CE-CD2 3.76Å; M634-F646 HydrophobicContact CE-CE2 4.32Å; M634-F646 HydrophobicContact CE-CG 4.06Å; M634-Y698 HydrophobicContact CB-CD1 3.86Å; M634-Y698 HydrophobicContact CB-CD2 4.15Å; M634-Y698 HydrophobicContact CB-CE1 4Å; M634-Y698 HydrophobicContact CB-CE2 4.31Å; M634-Y698 HydrophobicContact CB-CG 3.94Å; M634-Y698 HydrophobicContact CG-CD1 4.36Å; M634-Y698 HydrophobicContact CG-CD2 3.74Å; M634-Y698 HydrophobicContact CG-CE1 4.41Å; M634-Y698 HydrophobicContact CG-CE2 3.83Å; M634-Y698 HydrophobicContact CG-CG 4.04Å; M634-Y698 HydrophobicContact SD-CD2 4.11Å; M634-Y698 HydrophobicContact SD-CG 4.42Å
635	I	93.1	Very high	92	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62.9	-40.7	179	-68.2	-64.1	0	0	0	111.1	I626 Y631 C638 I639 F646 I666 V669 V679	I626-I635 HydrophobicContact CG1-CG1 4.29Å; Y631-I635 WeakPolarHBondContact O-CG1 3.15Å; Y631-I635 PolarHBondContact O-N 2.88Å; I635-C638 PolarHBondContact O-N 2.97Å; I635-I639 HydrophobicContact CG2-CD1 4.31Å; I635-I639 WeakPolarHBondContact O-CG1 3.48Å; I635-I639 PolarHBondContact O-N 2.94Å; I635-F646 HydrophobicContact CD1-CD1 4.07Å; I635-F646 HydrophobicContact CD1-CE1 3.89Å; I635-F646 HydrophobicContact CD1-CG 4.49Å; I635-F646 HydrophobicContact CD1-CZ 4.14Å; I635-I666 HydrophobicContact CD1-CD1 4Å; I635-I666 HydrophobicContact CG2-CD1 4.32Å; I635-V669 HydrophobicContact CG2-CG1 4.41Å; I635-V669 HydrophobicContact CG2-CG2 4.1Å; I635-V679 HydrophobicContact CD1-CG1 4.35Å; I635-V679 HydrophobicContact CD1-CG2 4.19Å; I635-V679 HydrophobicContact CG1-CG2 4.13Å; I635-V679 HydrophobicContact CG2-CG2 3.8Å
636	R	88.7	Confident	92.2	Very high	11 Å²	11	35.8 Å²	35.8	4%	0.042	18%	0.183	C	C	.	.	H	α-helix	trans	-61.1	-45.3	175.6	178.2	168.1	59.3	78.1	-2.4	111.5	D548 R632 L633 M634 C638 I639 E640	D548-R636 IonicContact OD2-CZ 2.71Å; D548-R636 VanDerWaalsContact OD2-CZ 3.29Å; D548-R636 IonicContact OD2-NE 2.78Å; D548-R636 PolarHBondContact OD2-NE 2.7Å; D548-R636 IonicContact OD2-NH2 2.75Å; D548-R636 PolarHBondContact OD2-NH2 3.41Å; R632-R636 WeakPolarHBondContact O-CB 3.27Å; R632-R636 PolarHBondContact O-N 2.93Å; L633-R636 VanDerWaalsContact CD1-NH2 3.32Å; L633-R636 PolarHBondContact O-N 3.36Å; M634-R636 VanDerWaalsContact C-N 3.34Å; M634-R636 PolarHBondContact O-N 3.08Å; R636-C638 VanDerWaalsContact C-N 3.34Å; R636-C638 PolarHBondContact O-N 3.25Å; R636-I639 PolarHBondContact O-N 3.36Å; R636-I639 VanDerWaalsContact O-N 3.1Å; R636-E640 WeakPolarHBondContact CD-OE1 3.49Å; R636-E640 HydrophobicContact CG-CG 4.13Å; R636-E640 WeakPolarHBondContact CG-OE1 3.5Å; R636-E640 IonicContact CZ-OE1 3.77Å; R636-E640 IonicContact NE-OE1 2.66Å; R636-E640 VanDerWaalsContact NH1-CD 3.34Å; R636-E640 IonicContact NH1-OE1 3.88Å; R636-E640 PolarHBondContact NH1-OE1 3.21Å; R636-E640 IonicContact NH1-OE2 3.63Å; R636-E640 PolarHBondContact NH1-OE2 3.39Å; R636-E640 VanDerWaalsContact NH1-OE2 3.12Å; R636-E640 VanDerWaalsContact O-CG 3.3Å; R636-E640 WeakPolarHBondContact O-CG 3.42Å; R636-E640 PolarHBondContact O-N 2.89Å
637	R	90.9	Very high	92.4	Very high	34 Å²	34	35.7 Å²	35.7	13%	0.128	18%	0.182	C	C	.	.	H	α-helix	trans	-57.6	-43.8	174.9	-80.7	177.2	167.6	161.2	0.1	112.4	L633 M634 I639 E640 T641 D696 Y698	L633-R637 HydrophobicContact CD1-CG 4.25Å; L633-R637 WeakPolarHBondContact O-CG 3.34Å; L633-R637 PolarHBondContact O-N 2.61Å; M634-R637 PolarHBondContact O-N 2.57Å; R637-I639 PolarHBondContact O-N 2.79Å; R637-E640 PolarHBondContact O-N 2.96Å; R637-E640 VanDerWaalsContact O-N 3.09Å; R637-T641 PolarHBondContact O-N 3.37Å; R637-T641 PolarHBondContact O-OG1 3.15Å; R637-T641 VanDerWaalsContact O-OG1 3.09Å; R637-D696 IonicContact CZ-OD2 3.62Å; R637-D696 IonicContact NH1-OD2 3.67Å; R637-D696 PolarHBondContact NH1-OD2 3.18Å; R637-D696 IonicContact NH2-OD1 2.69Å; R637-D696 IonicContact NH2-OD2 3.42Å; R637-D696 PolarHBondContact NH2-OD2 3.41Å; R637-Y698 WeakPolarHBondContact CD-OH 3.35Å; R637-Y698 PolarHBondContact NH1-OH 3.11Å
638	C	94	Very high	92.8	Very high	4 Å²	4	30.3 Å²	30.3	3%	0.027	16%	0.159	C	C	.	.	H	α-helix	trans	-61.2	-28.6	177.8	-59.5	0	0	0	0	112.9	M634 I635 R636 R644 I666	M634-C638 PolarHBondContact O-N 3.28Å; M634-C638 PolarHBondContact O-SG 3.43Å; I635-C638 PolarHBondContact O-N 2.97Å; R636-C638 VanDerWaalsContact C-N 3.34Å; R636-C638 PolarHBondContact O-N 3.25Å; C638-R644 VanDerWaalsContact O-CA 3.24Å; C638-R644 WeakPolarHBondContact O-CA 3.39Å; C638-R644 PolarHBondContact O-N 3.04Å; C638-I666 HydrophobicContact CB-CD1 3.67Å
639	I	91.4	Very high	93.1	Very high	72 Å²	72	26.4 Å²	26.4	37%	0.369	14%	0.141	S	C	.	.	H	α-helix	trans	-79.6	-43	173	-61.2	163.3	0	0	0	110.5	I635 R636 R637 G642 V669 F671	I635-I639 HydrophobicContact CG2-CD1 4.31Å; I635-I639 WeakPolarHBondContact O-CG1 3.48Å; I635-I639 PolarHBondContact O-N 2.94Å; R636-I639 PolarHBondContact O-N 3.36Å; R636-I639 VanDerWaalsContact O-N 3.1Å; R637-I639 PolarHBondContact O-N 2.79Å; I639-G642 PolarHBondContact O-N 3.49Å; I639-V669 HydrophobicContact CD1-CB 4.19Å; I639-V669 HydrophobicContact CD1-CG2 3.72Å; I639-F671 HydrophobicContact CD1-CZ 4.17Å
640	E	88.1	Confident	93.4	Very high	54 Å²	54	25.5 Å²	25.5	25%	0.252	13%	0.133	S	C	.	.	H	α-helix	trans	-65.6	-39	-176.9	-72.7	170.7	166.2	0	0	113.6	K541 R636 R637 G642	K541-E640 VanDerWaalsContact NZ-CD 3.31Å; K541-E640 IonicContact NZ-OE1 2.69Å; K541-E640 PolarHBondContact NZ-OE1 3.3Å; R636-E640 WeakPolarHBondContact CD-OE1 3.49Å; R636-E640 HydrophobicContact CG-CG 4.13Å; R636-E640 WeakPolarHBondContact CG-OE1 3.5Å; R636-E640 IonicContact CZ-OE1 3.77Å; R636-E640 IonicContact NE-OE1 2.66Å; R636-E640 VanDerWaalsContact NH1-CD 3.34Å; R636-E640 IonicContact NH1-OE1 3.88Å; R636-E640 PolarHBondContact NH1-OE1 3.21Å; R636-E640 IonicContact NH1-OE2 3.63Å; R636-E640 PolarHBondContact NH1-OE2 3.39Å; R636-E640 VanDerWaalsContact NH1-OE2 3.12Å; R636-E640 VanDerWaalsContact O-CG 3.3Å; R636-E640 WeakPolarHBondContact O-CG 3.42Å; R636-E640 PolarHBondContact O-N 2.89Å; R637-E640 PolarHBondContact O-N 2.96Å; R637-E640 VanDerWaalsContact O-N 3.09Å; E640-G642 PolarHBondContact O-N 3.37Å
641	T	90.8	Very high	93.6	Very high	26 Å²	26	26.4 Å²	26.4	16%	0.16	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	1.2	175.4	59.8	0	0	0	0	113.4	M598 L601 R637 T643	M598-T641 HydrophobicContact SD-CG2 4.07Å; L601-T641 HydrophobicContact CB-CG2 3.75Å; R637-T641 PolarHBondContact O-N 3.37Å; R637-T641 PolarHBondContact O-OG1 3.15Å; R637-T641 VanDerWaalsContact O-OG1 3.09Å; T641-T643 PolarHBondContact O-N 3.36Å
642	G	92.9	Very high	93.5	Very high	53 Å²	53	27.3 Å²	27.3	55%	0.546	15%	0.153	S	C	.	.	S	Bend	trans	71.8	-12.1	180	0	0	0	0	0	115.8	I639 E640 R644	I639-G642 PolarHBondContact O-N 3.49Å; E640-G642 PolarHBondContact O-N 3.37Å; G642-R644 PolarHBondContact O-N 2.85Å
643	T	95.6	Very high	93.4	Very high	25 Å²	25	31.6 Å²	31.6	15%	0.153	18%	0.184	C	C	.	.			trans	-60.5	-34.6	-177.5	65.6	0	0	0	0	113	S602 L604 T641 Q645	S602-T643 WeakPolarHBondContact O-CG2 3.32Å; L604-T643 HydrophobicContact CD2-CG2 4.27Å; L604-T643 HydrophobicContact CG-CG2 4.44Å; T641-T643 PolarHBondContact O-N 3.36Å; T643-Q645 WeakPolarHBondContact O-CG 3.42Å; T643-Q645 PolarHBondContact O-N 3.41Å; T643-Q645 PolarHBondContact O-NE2 2.88Å; T643-Q645 PolarHBondContact OG1-N 3.07Å
644	R	96.8	Very high	93.3	Very high	115 Å²	115	38 Å²	38	43%	0.434	22%	0.223	S	C	.	.			trans	51	25	-174.7	-63.2	171.4	60.5	157	2.6	112.9	C638 G642 E665 I666 R667	C638-R644 VanDerWaalsContact O-CA 3.24Å; C638-R644 WeakPolarHBondContact O-CA 3.39Å; C638-R644 PolarHBondContact O-N 3.04Å; G642-R644 PolarHBondContact O-N 2.85Å; R644-E665 CarbonylContact O-C 3.58Å; R644-E665 WeakPolarHBondContact O-CA 3.44Å; R644-I666 HydrophobicContact CB-CB 4.33Å; R644-I666 PolarHBondContact NE-O 3.2Å; R644-I666 PolarHBondContact NH2-O 3.06Å; R644-I666 PolarHBondContact O-N 3.12Å; R644-R667 PolarHBondContact NH2-O 3.02Å
645	Q	97.6	Very high	93.1	Very high	32 Å²	32	43 Å²	43	15%	0.15	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	138.8	-170.7	-84.6	168.9	75.7	0	0	111.9	L604 T643 I663 L664 E665	L604-Q645 HydrophobicContact CD2-CB 3.84Å; T643-Q645 WeakPolarHBondContact O-CG 3.42Å; T643-Q645 PolarHBondContact O-N 3.41Å; T643-Q645 PolarHBondContact O-NE2 2.88Å; T643-Q645 PolarHBondContact OG1-N 3.07Å; Q645-I663 HydrophobicContact CB-CG2 3.78Å; Q645-I663 HydrophobicContact CG-CG2 3.69Å; Q645-L664 WeakPolarHBondContact CA-O 3.4Å; Q645-E665 HydrophobicContact CG-CB 4.3Å
646	F	98.1	Very high	93	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	154.4	174.1	66.6	-77	0	0	0	110	P609 F611 L624 M634 I635 I663 L664 I666	P609-F646 HydrophobicContact CB-CB 4.33Å; P609-F646 HydrophobicContact CG-CB 3.94Å; F611-F646 HydrophobicContact CB-CD2 3.93Å; F611-F646 HydrophobicContact CB-CE2 3.86Å; F611-F646 HydrophobicContact CG-CE2 4.48Å; L624-F646 HydrophobicContact CD1-CE2 3.92Å; L624-F646 HydrophobicContact CD1-CZ 3.69Å; M634-F646 HydrophobicContact CE-CB 4.27Å; M634-F646 HydrophobicContact CE-CD2 3.76Å; M634-F646 HydrophobicContact CE-CE2 4.32Å; M634-F646 HydrophobicContact CE-CG 4.06Å; I635-F646 HydrophobicContact CD1-CD1 4.07Å; I635-F646 HydrophobicContact CD1-CE1 3.89Å; I635-F646 HydrophobicContact CD1-CG 4.49Å; I635-F646 HydrophobicContact CD1-CZ 4.14Å; F646-I663 CarbonylContact O-C 3.6Å; F646-I663 WeakPolarHBondContact O-CA 3.19Å; F646-L664 HydrophobicContact CD1-CB 4.29Å; F646-L664 HydrophobicContact CE1-CB 3.78Å; F646-L664 HydrophobicContact CE1-CD1 4.43Å; F646-L664 HydrophobicContact CE2-CB 4.25Å; F646-L664 HydrophobicContact CE2-CD1 3.72Å; F646-L664 HydrophobicContact CZ-CB 3.75Å; F646-L664 HydrophobicContact CZ-CD1 3.56Å; F646-L664 HydrophobicContact CZ-CG 4.28Å; F646-L664 PolarHBondContact N-O 3.48Å; F646-L664 VanDerWaalsContact N-O 3.12Å; F646-L664 PolarHBondContact O-N 2.89Å; F646-I666 HydrophobicContact CD1-CD1 4.01Å; F646-I666 HydrophobicContact CD1-CG1 3.88Å; F646-I666 HydrophobicContact CE1-CD1 4.16Å; F646-I666 HydrophobicContact CE1-CG1 3.65Å
647	G	97.9	Very high	93.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	145	175.1	0	0	0	0	0	112.4	P609 I610 F611	P609-G647 PolarHBondContact O-N 3.34Å; I610-G647 WeakPolarHBondContact CA-O 3.2Å; F611-G647 PolarHBondContact N-O 3.5Å
648	M	97.6	Very high	93.5	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	126.7	167.1	177.5	71	74.9	0	0	109.3	F611 C613 T614 A616 L624 G661 C662 L664	F611-M648 HydrophobicContact CB-CE 4.37Å; F611-M648 HydrophobicContact CB-SD 4.29Å; F611-M648 HydrophobicContact CD1-CE 3.56Å; F611-M648 HydrophobicContact CD1-SD 3.77Å; F611-M648 HydrophobicContact CE1-CE 4.29Å; F611-M648 HydrophobicContact CG-CE 4.35Å; F611-M648 WeakPolarHBondContact O-CA 3.37Å; C613-M648 HydrophobicContact CB-SD 4.03Å; T614-M648 VanDerWaalsContact O-CG 3.24Å; T614-M648 WeakPolarHBondContact O-CG 3.46Å; A616-M648 HydrophobicContact CB-CB 3.88Å; A616-M648 HydrophobicContact CB-CG 3.69Å; L624-M648 HydrophobicContact CD1-CE 3.71Å; L624-M648 HydrophobicContact CD2-CE 3.85Å; L624-M648 HydrophobicContact CG-CE 4.4Å; M648-G661 WeakPolarHBondContact O-CA 3.33Å; M648-C662 PolarHBondContact N-O 3.33Å; M648-C662 PolarHBondContact O-N 3.2Å; M648-C662 VanDerWaalsContact O-N 3.07Å; M648-L664 HydrophobicContact CB-CD1 3.76Å; M648-L664 HydrophobicContact CB-CG 4.1Å; M648-L664 HydrophobicContact CE-CD1 3.64Å; M648-L664 HydrophobicContact CG-CD1 4.34Å
649	C	96.6	Very high	93.6	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.014	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	154.3	172.4	-72.8	0	0	0	0	111.5	I610 F611 V612 C613 F657 F687	I610-C649 HydrophobicContact CG2-CB 4.02Å; F611-C649 PolarHBondContact O-N 3.18Å; V612-C649 WeakPolarHBondContact CA-O 3.36Å; C613-C649 PolarHBondContact N-O 2.76Å; C613-C649 VanDerWaalsContact N-O 3.07Å; C649-F657 HydrophobicContact CB-CB 3.97Å; C649-F657 HydrophobicContact CB-CD2 3.88Å; C649-F657 HydrophobicContact CB-CG 4.3Å; C649-F687 VanDerWaalsContact SG-CZ 3.6Å
650	L	95.1	Very high	93.8	Very high	25 Å²	25	45.4 Å²	45.4	13%	0.131	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	144.1	165.5	-169.3	67.8	0	0	0	109.9	M615 F657 A658	M615-L650 HydrophobicContact SD-CB 3.98Å; M615-L650 HydrophobicContact SD-CD2 4.26Å; L650-F657 WeakPolarHBondContact O-CA 3.33Å; L650-A658 HydrophobicContact CB-CB 4.3Å; L650-A658 WeakPolarHBondContact O-CB 3.38Å; L650-A658 PolarHBondContact O-N 3.02Å
651	G	93.5	Very high	94.3	Very high	41 Å²	41	42.9 Å²	42.9	42%	0.423	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	140.3	174.5	0	0	0	0	0	112.8	V612	V612-G651 VanDerWaalsContact CG1-CA 3.43Å
652	D	91.2	Very high	94.6	Very high	52 Å²	52	41.7 Å²	41.7	28%	0.278	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	120.2	176.3	-173	-62.3	0	0	0	109.2	V654 K655 G656	D652-V654 PolarHBondContact O-N 3.29Å; D652-V654 VanDerWaalsContact O-N 3.09Å; D652-V654 WeakPolarHBondContact OD1-CA 3.4Å; D652-V654 PolarHBondContact OD1-N 3.34Å; D652-K655 HydrophobicContact CB-CB 4.08Å; D652-K655 PolarHBondContact OD1-N 2.99Å; D652-G656 PolarHBondContact N-O 2.89Å; D652-G656 CarbonylContact O-C 3.32Å; D652-G656 VanDerWaalsContact O-C 3.32Å; D652-G656 WeakPolarHBondContact O-CA 3.41Å; D652-G656 PolarHBondContact O-N 2.8Å
653	P	87.6	Confident	94.9	Very high	111 Å²	111	39.1 Å²	39.1	72%	0.721	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-14.2	-176.8	-25	35.2	0	0	0	115.9
654	V	88.7	Confident	95	Very high	139 Å²	139	38 Å²	38	84%	0.842	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.8	-40.9	-177.6	-177	0	0	0	0	111.1	D652	D652-V654 PolarHBondContact O-N 3.29Å; D652-V654 VanDerWaalsContact O-N 3.09Å; D652-V654 WeakPolarHBondContact OD1-CA 3.4Å; D652-V654 PolarHBondContact OD1-N 3.34Å
655	K	88	Confident	95	Very high	105 Å²	105	35 Å²	35	46%	0.457	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	1.3	-178.5	-64.9	176.6	175.5	170.8	0	114	D652 F657 E659 Q692	D652-K655 HydrophobicContact CB-CB 4.08Å; D652-K655 PolarHBondContact OD1-N 2.99Å; K655-F657 PolarHBondContact O-N 3.49Å; K655-E659 IonicContact NZ-OE1 2.64Å; K655-E659 PolarHBondContact NZ-OE1 2.98Å; K655-Q692 PolarHBondContact O-NE2 2.83Å; K655-Q692 PolarHBondContact O-OE1 2.82Å
656	G	91.3	Very high	95	Very high	44 Å²	44	33.6 Å²	33.6	45%	0.454	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	78.3	-58.1	-172.3	0	0	0	0	0	112.6	D652	D652-G656 PolarHBondContact N-O 2.89Å; D652-G656 CarbonylContact O-C 3.32Å; D652-G656 VanDerWaalsContact O-C 3.32Å; D652-G656 WeakPolarHBondContact O-CA 3.41Å; D652-G656 PolarHBondContact O-N 2.8Å
657	F	95.7	Very high	94.9	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.009	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	160.5	173	59.5	-89.1	0	0	0	113.8	I610 V612 C649 L650 K655 V689 Q692 N699 A701	I610-F657 HydrophobicContact CB-CE2 4.44Å; I610-F657 HydrophobicContact CB-CZ 4.35Å; I610-F657 HydrophobicContact CG1-CE2 4.09Å; I610-F657 HydrophobicContact CG1-CZ 4.07Å; I610-F657 HydrophobicContact CG2-CD2 4.06Å; I610-F657 HydrophobicContact CG2-CE2 4Å; I610-F657 HydrophobicContact CG2-CG 4.37Å; I610-F657 HydrophobicContact CG2-CZ 4.28Å; V612-F657 HydrophobicContact CG1-CB 3.96Å; V612-F657 HydrophobicContact CG2-CB 3.71Å; V612-F657 HydrophobicContact CG2-CD1 3.94Å; V612-F657 HydrophobicContact CG2-CG 3.97Å; C649-F657 HydrophobicContact CB-CB 3.97Å; C649-F657 HydrophobicContact CB-CD2 3.88Å; C649-F657 HydrophobicContact CB-CG 4.3Å; L650-F657 WeakPolarHBondContact O-CA 3.33Å; K655-F657 PolarHBondContact O-N 3.49Å; F657-V689 HydrophobicContact CD2-CG2 4.28Å; F657-V689 HydrophobicContact CE2-CG1 4.28Å; F657-V689 HydrophobicContact CE2-CG2 3.84Å; F657-Q692 HydrophobicContact CE1-CB 4.22Å; F657-Q692 HydrophobicContact CE1-CG 3.97Å; F657-Q692 HydrophobicContact CE2-CG 3.92Å; F657-Q692 HydrophobicContact CZ-CB 3.99Å; F657-Q692 VanDerWaalsContact CZ-CD 3.47Å; F657-Q692 HydrophobicContact CZ-CG 3.51Å; F657-Q692 PolarHBondContact O-NE2 3.27Å; F657-Q692 VanDerWaalsContact O-NE2 3.07Å; F657-N699 HydrophobicContact CD1-CB 4.34Å; F657-N699 HydrophobicContact CE1-CB 3.84Å; F657-A701 HydrophobicContact CE2-CB 4.21Å; F657-A701 HydrophobicContact CZ-CB 4.14Å
658	A	95.4	Very high	94.8	Very high	4 Å²	4	43.4 Å²	43.4	3%	0.033	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	150.1	-174.5	0	0	0	0	0	113.9	L650 Y660 L784	L650-A658 HydrophobicContact CB-CB 4.3Å; L650-A658 WeakPolarHBondContact O-CB 3.38Å; L650-A658 PolarHBondContact O-N 3.02Å; A658-Y660 PolarHBondContact O-N 3.47Å; A658-Y660 VanDerWaalsContact O-N 3.17Å; A658-L784 HydrophobicContact CB-CD1 4.14Å; A658-L784 HydrophobicContact CB-CD2 3.85Å
659	E	95.4	Very high	94.5	Very high	71 Å²	71	44.4 Å²	44.4	33%	0.332	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	-13.1	179.3	-70.4	-179.1	-147.9	0	0	114.9	K655 R688 V689	K655-E659 IonicContact NZ-OE1 2.64Å; K655-E659 PolarHBondContact NZ-OE1 2.98Å; E659-R688 CarbonylContact O-C 3.56Å; E659-R688 WeakPolarHBondContact O-CA 3.24Å; E659-R688 IonicContact OE2-NH2 3.75Å; E659-V689 PolarHBondContact O-N 3.47Å
660	Y	96.9	Very high	94.2	Very high	51 Å²	51	49.7 Å²	49.7	20%	0.2	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	141.6	-178.8	-64.5	-87.2	0	0	0	110.7	A658 F687 R688 I706 A788	A658-Y660 PolarHBondContact O-N 3.47Å; A658-Y660 VanDerWaalsContact O-N 3.17Å; Y660-F687 WeakPolarHBondContact CA-O 3.44Å; Y660-R688 HydrophobicContact CD1-CB 3.94Å; Y660-R688 HydrophobicContact CD1-CG 4.07Å; Y660-R688 HydrophobicContact CE1-CB 3.69Å; Y660-R688 HydrophobicContact CE1-CG 3.6Å; Y660-R688 PolarHBondContact OH-NE 3.49Å; Y660-I706 HydrophobicContact CD1-CD1 3.78Å; Y660-I706 HydrophobicContact CE1-CD1 4.01Å; Y660-A788 HydrophobicContact CD1-CB 3.86Å; Y660-A788 HydrophobicContact CD2-CB 3.7Å; Y660-A788 HydrophobicContact CE1-CB 3.95Å; Y660-A788 HydrophobicContact CE2-CB 3.82Å; Y660-A788 HydrophobicContact CG-CB 3.72Å
661	G	97.3	Very high	93.6	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	-176.9	-178.2	0	0	0	0	0	112.8	M648 R686 F687	M648-G661 WeakPolarHBondContact O-CA 3.33Å; G661-R686 WeakPolarHBondContact O-CA 3.34Å; G661-F687 PolarHBondContact N-O 2.97Å; G661-F687 VanDerWaalsContact N-O 3.08Å; G661-F687 WeakPolarHBondContact O-CD1 3.36Å; G661-F687 PolarHBondContact O-N 2.89Å
662	C	97.8	Very high	93.1	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	135	176	-171.3	0	0	0	0	110.7	A616 M648 L664 R685 F687	A616-C662 HydrophobicContact CB-CB 4.2Å; A616-C662 VanDerWaalsContact O-CB 3.32Å; A616-C662 WeakPolarHBondContact O-CB 3.2Å; M648-C662 PolarHBondContact N-O 3.33Å; M648-C662 PolarHBondContact O-N 3.2Å; M648-C662 VanDerWaalsContact O-N 3.07Å; C662-L664 PolarHBondContact O-N 3.42Å; C662-R685 CarbonylContact C-O 3.51Å; C662-R685 WeakPolarHBondContact CA-O 3.39Å; C662-R685 PolarHBondContact SG-O 3.43Å; C662-F687 VanDerWaalsContact C-CE1 3.49Å
663	I	98.1	Very high	92.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	123	168.6	-63.3	-55.1	0	0	0	108.8	V608 Q645 F646 G683 K684 R685 F687 I703 Y705	V608-I663 HydrophobicContact CG1-CD1 4.03Å; Q645-I663 HydrophobicContact CB-CG2 3.78Å; Q645-I663 HydrophobicContact CG-CG2 3.69Å; F646-I663 CarbonylContact O-C 3.6Å; F646-I663 WeakPolarHBondContact O-CA 3.19Å; I663-G683 WeakPolarHBondContact O-CA 3.41Å; I663-K684 PolarHBondContact O-N 3.42Å; I663-R685 PolarHBondContact N-O 3.39Å; I663-F687 HydrophobicContact CD1-CD1 3.77Å; I663-F687 HydrophobicContact CD1-CE1 3.82Å; I663-F687 HydrophobicContact CG1-CD1 3.91Å; I663-F687 HydrophobicContact CG1-CE1 4.34Å; I663-I703 HydrophobicContact CD1-CD1 3.85Å; I663-I703 HydrophobicContact CG1-CD1 4.45Å; I663-Y705 HydrophobicContact CG1-CE1 3.75Å
664	L	98.3	Very high	91.7	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	133.5	168.9	-65.8	176.4	0	0	0	109.5	A616 C622 L624 Q645 F646 M648 C662 I682	A616-L664 HydrophobicContact CB-CD1 4.5Å; A616-L664 HydrophobicContact CB-CD2 3.88Å; A616-L664 HydrophobicContact CB-CG 4.36Å; C622-L664 HydrophobicContact CB-CD1 4.11Å; C622-L664 HydrophobicContact CB-CD2 3.71Å; L624-L664 HydrophobicContact CD1-CD1 4.35Å; Q645-L664 WeakPolarHBondContact CA-O 3.4Å; F646-L664 HydrophobicContact CD1-CB 4.29Å; F646-L664 HydrophobicContact CE1-CB 3.78Å; F646-L664 HydrophobicContact CE1-CD1 4.43Å; F646-L664 HydrophobicContact CE2-CB 4.25Å; F646-L664 HydrophobicContact CE2-CD1 3.72Å; F646-L664 HydrophobicContact CZ-CB 3.75Å; F646-L664 HydrophobicContact CZ-CD1 3.56Å; F646-L664 HydrophobicContact CZ-CG 4.28Å; F646-L664 PolarHBondContact N-O 3.48Å; F646-L664 VanDerWaalsContact N-O 3.12Å; F646-L664 PolarHBondContact O-N 2.89Å; M648-L664 HydrophobicContact CB-CD1 3.76Å; M648-L664 HydrophobicContact CB-CG 4.1Å; M648-L664 HydrophobicContact CE-CD1 3.64Å; M648-L664 HydrophobicContact CG-CD1 4.34Å; C662-L664 PolarHBondContact O-N 3.42Å; L664-I682 CarbonylContact C-O 3.32Å; L664-I682 WeakPolarHBondContact CA-O 3.27Å
665	E	97.9	Very high	91	Very high	53 Å²	53	46.8 Å²	46.8	25%	0.248	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	126.6	167.5	175.9	-175.2	-86.9	0	0	110.1	R644 Q645 R667 S681 I682 K684	R644-E665 CarbonylContact O-C 3.58Å; R644-E665 WeakPolarHBondContact O-CA 3.44Å; Q645-E665 HydrophobicContact CG-CB 4.3Å; E665-R667 PolarHBondContact O-N 3.24Å; E665-S681 CarbonylContact O-C 3.58Å; E665-S681 WeakPolarHBondContact O-CA 3.44Å; E665-S681 VanDerWaalsContact O-CB 3.28Å; E665-S681 WeakPolarHBondContact O-CB 3.42Å; E665-I682 HydrophobicContact CB-CG2 4.36Å; E665-I682 PolarHBondContact N-O 3.4Å; E665-I682 PolarHBondContact O-N 3.34Å; E665-K684 HydrophobicContact CB-CG 3.77Å; E665-K684 VanDerWaalsContact CD-CE 3.49Å; E665-K684 IonicContact OE1-NZ 2.97Å; E665-K684 PolarHBondContact OE1-NZ 3.46Å; E665-K684 WeakPolarHBondContact OE2-CE 3.25Å; E665-K684 IonicContact OE2-NZ 2.7Å; E665-K684 PolarHBondContact OE2-NZ 3.36Å
666	I	97.8	Very high	90.9	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.015	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	111.3	175.5	-60.7	166	0	0	0	109.3	I635 C638 R644 F646 V669 V679	I635-I666 HydrophobicContact CD1-CD1 4Å; I635-I666 HydrophobicContact CG2-CD1 4.32Å; C638-I666 HydrophobicContact CB-CD1 3.67Å; R644-I666 HydrophobicContact CB-CB 4.33Å; R644-I666 PolarHBondContact NE-O 3.2Å; R644-I666 PolarHBondContact NH2-O 3.06Å; R644-I666 PolarHBondContact O-N 3.12Å; F646-I666 HydrophobicContact CD1-CD1 4.01Å; F646-I666 HydrophobicContact CD1-CG1 3.88Å; F646-I666 HydrophobicContact CE1-CD1 4.16Å; F646-I666 HydrophobicContact CE1-CG1 3.65Å; I666-V669 HydrophobicContact CG2-CG2 3.42Å; I666-V669 VanDerWaalsContact CG2-CG2 3.42Å; I666-V679 HydrophobicContact CG1-CG1 4.02Å; I666-V679 HydrophobicContact CG2-CG1 4.08Å
667	R	95.9	Very high	90.7	Very high	119 Å²	119	44.4 Å²	44.4	45%	0.449	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-44.4	175.5	-75.3	176.8	158.4	-173	-6.6	112.3	R644 E665 D680 I682	R644-R667 PolarHBondContact NH2-O 3.02Å; E665-R667 PolarHBondContact O-N 3.24Å; R667-D680 HydrophobicContact CB-CB 4.32Å; R667-D680 WeakPolarHBondContact CB-OD2 3.44Å; R667-D680 WeakPolarHBondContact CD-OD2 3.37Å; R667-D680 PolarHBondContact N-O 2.81Å; R667-I682 HydrophobicContact CG-CG2 4.19Å; R667-I682 VanDerWaalsContact NH2-CD1 3.31Å
668	N	94.1	Very high	90.6	Very high	87 Å²	87	46.7 Å²	46.7	47%	0.465	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	153.1	-179.8	-169.1	10.6	0	0	0	110.6	D680	N668-D680 HydrophobicContact CB-CB 4.18Å; N668-D680 PolarHBondContact N-O 2.88Å; N668-D680 PolarHBondContact O-N 2.73Å
669	V	92	Very high	90.7	Very high	22 Å²	22	46.5 Å²	46.5	13%	0.133	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	121	171.5	-173.6	0	0	0	0	110.3	I635 I639 I666 F671 V678 V679	I635-V669 HydrophobicContact CG2-CG1 4.41Å; I635-V669 HydrophobicContact CG2-CG2 4.1Å; I639-V669 HydrophobicContact CD1-CB 4.19Å; I639-V669 HydrophobicContact CD1-CG2 3.72Å; I666-V669 HydrophobicContact CG2-CG2 3.42Å; I666-V669 VanDerWaalsContact CG2-CG2 3.42Å; V669-F671 HydrophobicContact CB-CE2 4.13Å; V669-F671 HydrophobicContact CB-CZ 4.17Å; V669-F671 HydrophobicContact CG1-CD1 4.19Å; V669-F671 HydrophobicContact CG1-CD2 4.21Å; V669-F671 HydrophobicContact CG1-CE1 3.73Å; V669-F671 HydrophobicContact CG1-CE2 3.76Å; V669-F671 HydrophobicContact CG1-CG 4.42Å; V669-F671 HydrophobicContact CG1-CZ 3.5Å; V669-V678 CarbonylContact C-O 3.43Å; V669-V678 WeakPolarHBondContact CA-O 3.49Å; V669-V679 HydrophobicContact CG1-CG2 4.14Å; V669-V679 HydrophobicContact CG2-CG1 4.26Å; V669-V679 HydrophobicContact CG2-CG2 4.13Å
670	Q	89.8	Confident	90.7	Very high	114 Å²	114	45.8 Å²	45.8	53%	0.533	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	120.5	172.3	-59.4	-176.2	12.4	0	0	108.8	S677 V678	Q670-S677 CarbonylContact O-C 3.47Å; Q670-S677 WeakPolarHBondContact O-CA 3.5Å; Q670-S677 WeakPolarHBondContact O-CB 3.37Å; Q670-V678 PolarHBondContact N-O 2.83Å; Q670-V678 PolarHBondContact O-N 2.68Å
671	F	83.4	Confident	90.7	Very high	77 Å²	77	43.4 Å²	43.4	34%	0.338	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	138.1	178	-62.8	-79.8	0	0	0	111.2	R567 I639 V669	R567-F671 VanDerWaalsContact CZ-CD1 3.41Å; I639-F671 HydrophobicContact CD1-CZ 4.17Å; V669-F671 HydrophobicContact CB-CE2 4.13Å; V669-F671 HydrophobicContact CB-CZ 4.17Å; V669-F671 HydrophobicContact CG1-CD1 4.19Å; V669-F671 HydrophobicContact CG1-CD2 4.21Å; V669-F671 HydrophobicContact CG1-CE1 3.73Å; V669-F671 HydrophobicContact CG1-CE2 3.76Å; V669-F671 HydrophobicContact CG1-CG 4.42Å; V669-F671 HydrophobicContact CG1-CZ 3.5Å
672	F	83.2	Confident	90.6	Very high	80 Å²	80	44.2 Å²	44.2	35%	0.351	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-100.2	163.4	176	-58.3	-66.8	0	0	0	112.3	D674 G675 R676 V678	F672-D674 VanDerWaalsContact C-N 3.26Å; F672-D674 WeakPolarHBondContact CB-OD1 3.48Å; F672-D674 PolarHBondContact O-N 2.88Å; F672-G675 WeakPolarHBondContact O-CA 3.34Å; F672-G675 PolarHBondContact O-N 2.8Å; F672-R676 HydrophobicContact CD2-CB 3.93Å; F672-R676 PolarHBondContact N-O 2.82Å; F672-V678 HydrophobicContact CE2-CG2 3.83Å; F672-V678 HydrophobicContact CZ-CG2 3.9Å
673	A	73.9	Confident	90.5	Very high	68 Å²	68	44.3 Å²	44.3	56%	0.562	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-17.9	-176.7	0	0	0	0	0	114.8	A565 G675	A565-A673 HydrophobicContact CB-CB 3.72Å; A673-G675 VanDerWaalsContact C-N 3.28Å
674	D	75.8	Confident	90.4	Very high	82 Å²	82	48.2 Å²	48.2	44%	0.439	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-4.7	168.7	57.1	24.3	0	0	0	112.8	R632 F672 R676	R632-D674 PolarHBondContact NH1-O 2.75Å; F672-D674 VanDerWaalsContact C-N 3.26Å; F672-D674 WeakPolarHBondContact CB-OD1 3.48Å; F672-D674 PolarHBondContact O-N 2.88Å; D674-R676 WeakPolarHBondContact OD1-CB 3.5Å; D674-R676 WeakPolarHBondContact OD1-CG 3.46Å; D674-R676 PolarHBondContact OD1-N 3.4Å; D674-R676 IonicContact OD1-NE 3.68Å; D674-R676 PolarHBondContact OD1-NE 3.17Å; D674-R676 IonicContact OD2-CZ 2.75Å; D674-R676 VanDerWaalsContact OD2-CZ 3.22Å; D674-R676 IonicContact OD2-NE 3.77Å; D674-R676 PolarHBondContact OD2-NE 2.95Å; D674-R676 IonicContact OD2-NH2 2.64Å; D674-R676 PolarHBondContact OD2-NH2 3.42Å
675	G	73.6	Confident	90.3	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.251	C	S	.	.	S	Bend	trans	87	0.2	179	0	0	0	0	0	115.3	R632 F672 A673	R632-G675 WeakPolarHBondContact CD-O 3.5Å; R632-G675 VanDerWaalsContact CZ-C 3.48Å; R632-G675 PolarHBondContact NE-O 3.08Å; R632-G675 VanDerWaalsContact NE-O 3.08Å; R632-G675 PolarHBondContact NH1-O 3.28Å; F672-G675 WeakPolarHBondContact O-CA 3.34Å; F672-G675 PolarHBondContact O-N 2.8Å; A673-G675 VanDerWaalsContact C-N 3.28Å
676	R	84.9	Confident	90.3	Very high	97 Å²	97	49.2 Å²	49.2	37%	0.366	24%	0.239	S	C	.	.			trans	-62.7	162.8	166	-63.2	-175.9	-71.5	149.8	-11	110.5	H625 I626 F627 F672 D674	H625-R676 PolarHBondContact NE2-NH1 3.4Å; I626-R676 CarbonylContact O-C 3.59Å; I626-R676 WeakPolarHBondContact O-CA 3.33Å; F627-R676 HydrophobicContact CB-CG 3.82Å; F672-R676 HydrophobicContact CD2-CB 3.93Å; F672-R676 PolarHBondContact N-O 2.82Å; D674-R676 WeakPolarHBondContact OD1-CB 3.5Å; D674-R676 WeakPolarHBondContact OD1-CG 3.46Å; D674-R676 PolarHBondContact OD1-N 3.4Å; D674-R676 IonicContact OD1-NE 3.68Å; D674-R676 PolarHBondContact OD1-NE 3.17Å; D674-R676 IonicContact OD2-CZ 2.75Å; D674-R676 VanDerWaalsContact OD2-CZ 3.22Å; D674-R676 IonicContact OD2-NE 3.77Å; D674-R676 PolarHBondContact OD2-NE 2.95Å; D674-R676 IonicContact OD2-NH2 2.64Å; D674-R676 PolarHBondContact OD2-NH2 3.42Å
677	S	88.6	Confident	90.3	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.007	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	149.1	171.4	52.1	0	0	0	0	114	I626 Q670	I626-S677 PolarHBondContact N-O 2.91Å; I626-S677 PolarHBondContact O-N 3.4Å; Q670-S677 CarbonylContact O-C 3.47Å; Q670-S677 WeakPolarHBondContact O-CA 3.5Å; Q670-S677 WeakPolarHBondContact O-CB 3.37Å
678	V	93.8	Very high	90.4	Very high	50 Å²	50	48 Å²	48	30%	0.303	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	129.3	159	-177.8	0	0	0	0	107.9	L624 V669 Q670 F672	L624-V678 CarbonylContact O-C 3.48Å; L624-V678 WeakPolarHBondContact O-CA 3.22Å; V669-V678 CarbonylContact C-O 3.43Å; V669-V678 WeakPolarHBondContact CA-O 3.49Å; Q670-V678 PolarHBondContact N-O 2.83Å; Q670-V678 PolarHBondContact O-N 2.68Å; F672-V678 HydrophobicContact CE2-CG2 3.83Å; F672-V678 HydrophobicContact CZ-CG2 3.9Å
679	V	95.5	Very high	90.6	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	114	174.8	-179.7	0	0	0	0	107.5	P623 L624 I626 I635 I666 V669	P623-V679 WeakPolarHBondContact CA-O 3.19Å; L624-V679 HydrophobicContact CB-CB 4.42Å; L624-V679 PolarHBondContact N-O 3.25Å; L624-V679 PolarHBondContact O-N 3.45Å; I626-V679 HydrophobicContact CG1-CG2 3.74Å; I635-V679 HydrophobicContact CD1-CG1 4.35Å; I635-V679 HydrophobicContact CD1-CG2 4.19Å; I635-V679 HydrophobicContact CG1-CG2 4.13Å; I635-V679 HydrophobicContact CG2-CG2 3.8Å; I666-V679 HydrophobicContact CG1-CG1 4.02Å; I666-V679 HydrophobicContact CG2-CG1 4.08Å; V669-V679 HydrophobicContact CG1-CG2 4.14Å; V669-V679 HydrophobicContact CG2-CG1 4.26Å; V669-V679 HydrophobicContact CG2-CG2 4.13Å
680	D	95.5	Very high	90.8	Very high	57 Å²	57	49 Å²	49	31%	0.305	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	126.3	163.6	174.4	31.4	0	0	0	108.1	R667 N668	R667-D680 HydrophobicContact CB-CB 4.32Å; R667-D680 WeakPolarHBondContact CB-OD2 3.44Å; R667-D680 WeakPolarHBondContact CD-OD2 3.37Å; R667-D680 PolarHBondContact N-O 2.81Å; N668-D680 HydrophobicContact CB-CB 4.18Å; N668-D680 PolarHBondContact N-O 2.88Å; N668-D680 PolarHBondContact O-N 2.73Å
681	S	96.8	Very high	91.2	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	162	-179.9	83.1	0	0	0	0	112.5	P621 C622 E665	P621-S681 WeakPolarHBondContact CA-O 3.18Å; C622-S681 PolarHBondContact N-O 2.94Å; C622-S681 PolarHBondContact O-OG 3.3Å; E665-S681 CarbonylContact O-C 3.58Å; E665-S681 WeakPolarHBondContact O-CA 3.44Å; E665-S681 VanDerWaalsContact O-CB 3.28Å; E665-S681 WeakPolarHBondContact O-CB 3.42Å
682	I	96.1	Very high	91.8	Very high	18 Å²	18	48.3 Å²	48.3	9%	0.092	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	139	178.1	-173.1	167.7	0	0	0	110.5	T619 L664 E665 R667	T619-I682 WeakPolarHBondContact O-CD1 3.33Å; L664-I682 CarbonylContact C-O 3.32Å; L664-I682 WeakPolarHBondContact CA-O 3.27Å; E665-I682 HydrophobicContact CB-CG2 4.36Å; E665-I682 PolarHBondContact N-O 3.4Å; E665-I682 PolarHBondContact O-N 3.34Å; R667-I682 HydrophobicContact CG-CG2 4.19Å; R667-I682 VanDerWaalsContact NH2-CD1 3.31Å
683	G	96.6	Very high	92.4	Very high	2 Å²	2	47 Å²	47	2%	0.021	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	140.3	174.6	0	0	0	0	0	112.7	Y617 T619 V620 I663	Y617-G683 WeakPolarHBondContact O-CA 3.45Å; T619-G683 PolarHBondContact N-O 3.29Å; V620-G683 PolarHBondContact O-N 3.29Å; I663-G683 WeakPolarHBondContact O-CA 3.41Å
684	K	95.6	Very high	93.4	Very high	83 Å²	83	49.7 Å²	49.7	36%	0.361	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	-63.6	-178	-72.3	-68.4	175	106.3	0	112.8	I663 E665	I663-K684 PolarHBondContact O-N 3.42Å; E665-K684 HydrophobicContact CB-CG 3.77Å; E665-K684 VanDerWaalsContact CD-CE 3.49Å; E665-K684 IonicContact OE1-NZ 2.97Å; E665-K684 PolarHBondContact OE1-NZ 3.46Å; E665-K684 WeakPolarHBondContact OE2-CE 3.25Å; E665-K684 IonicContact OE2-NZ 2.7Å; E665-K684 PolarHBondContact OE2-NZ 3.36Å
685	R	96.2	Very high	94.1	Very high	74 Å²	74	48.6 Å²	48.6	28%	0.279	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	145.5	-171.5	-67.3	-179.8	-70.2	147.4	3.5	110	C662 I663 Y705	C662-R685 CarbonylContact C-O 3.51Å; C662-R685 WeakPolarHBondContact CA-O 3.39Å; C662-R685 PolarHBondContact SG-O 3.43Å; I663-R685 PolarHBondContact N-O 3.39Å; R685-Y705 HydrophobicContact CB-CD1 4.02Å; R685-Y705 HydrophobicContact CB-CE1 4.17Å; R685-Y705 VanDerWaalsContact NH1-CD2 3.35Å; R685-Y705 VanDerWaalsContact NH2-CZ 3.3Å; R685-Y705 PolarHBondContact NH2-OH 3.39Å
686	R	97.5	Very high	94.8	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	151.6	172.8	-60.4	169.1	-60.9	149.1	-2.1	110.1	P618 G661 I706 D708 N764 L787 M789	P618-R686 HydrophobicContact CG-CG 3.59Å; G661-R686 WeakPolarHBondContact O-CA 3.34Å; R686-I706 HydrophobicContact CB-CD1 4.08Å; R686-I706 HydrophobicContact CB-CG1 3.5Å; R686-I706 PolarHBondContact NH2-O 3.26Å; R686-I706 PolarHBondContact O-N 2.8Å; R686-D708 IonicContact CZ-OD1 3.85Å; R686-D708 IonicContact NH1-OD1 3.43Å; R686-D708 PolarHBondContact NH1-OD1 3.45Å; R686-D708 IonicContact NH2-OD1 2.88Å; R686-D708 PolarHBondContact NH2-OD1 3.08Å; R686-N764 WeakPolarHBondContact CG-OD1 3.43Å; R686-N764 PolarHBondContact N-OD1 2.87Å; R686-N764 VanDerWaalsContact N-OD1 3.08Å; R686-N764 PolarHBondContact NE-OD1 2.99Å; R686-N764 VanDerWaalsContact NE-OD1 3.11Å; R686-L787 WeakPolarHBondContact CD-O 3.49Å; R686-L787 HydrophobicContact CG-CD1 3.81Å; R686-L787 HydrophobicContact CG-CG 4.3Å; R686-L787 PolarHBondContact NH1-O 3.01Å; R686-M789 PolarHBondContact NH1-O 3.25Å
687	F	97.9	Very high	95.1	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	159.7	176.6	67.9	-95.3	0	0	0	112	I610 C649 Y660 G661 C662 I663 V689 I703 E704 Y705	I610-F687 HydrophobicContact CD1-CE2 4.24Å; I610-F687 HydrophobicContact CD1-CZ 3.89Å; C649-F687 VanDerWaalsContact SG-CZ 3.6Å; Y660-F687 WeakPolarHBondContact CA-O 3.44Å; G661-F687 PolarHBondContact N-O 2.97Å; G661-F687 VanDerWaalsContact N-O 3.08Å; G661-F687 WeakPolarHBondContact O-CD1 3.36Å; G661-F687 PolarHBondContact O-N 2.89Å; C662-F687 VanDerWaalsContact C-CE1 3.49Å; I663-F687 HydrophobicContact CD1-CD1 3.77Å; I663-F687 HydrophobicContact CD1-CE1 3.82Å; I663-F687 HydrophobicContact CG1-CD1 3.91Å; I663-F687 HydrophobicContact CG1-CE1 4.34Å; F687-V689 HydrophobicContact CD2-CG2 4.38Å; F687-V689 HydrophobicContact CE2-CG2 3.91Å; F687-I703 HydrophobicContact CB-CB 4.14Å; F687-I703 HydrophobicContact CB-CD1 3.91Å; F687-I703 HydrophobicContact CB-CG1 4.45Å; F687-I703 HydrophobicContact CD1-CD1 4.23Å; F687-I703 HydrophobicContact CD2-CB 3.87Å; F687-I703 HydrophobicContact CD2-CD1 4.22Å; F687-I703 HydrophobicContact CD2-CG2 3.51Å; F687-I703 HydrophobicContact CE2-CG2 3.84Å; F687-I703 HydrophobicContact CG-CB 4.22Å; F687-I703 HydrophobicContact CG-CD1 3.87Å; F687-I703 HydrophobicContact CG-CG2 4.23Å; F687-E704 CarbonylContact C-O 3.56Å; F687-E704 WeakPolarHBondContact CA-O 3.46Å; F687-E704 WeakPolarHBondContact CB-O 3.24Å; F687-Y705 HydrophobicContact CB-CD1 4.29Å; F687-Y705 HydrophobicContact CB-CE1 4.49Å
688	R	97.8	Very high	95.4	Very high	95 Å²	95	49 Å²	49	36%	0.358	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	137.2	165.9	-172.2	-178.6	-175.2	-171.5	3	109.3	E659 Y660 I703 E704 I706	E659-R688 CarbonylContact O-C 3.56Å; E659-R688 WeakPolarHBondContact O-CA 3.24Å; E659-R688 IonicContact OE2-NH2 3.75Å; Y660-R688 HydrophobicContact CD1-CB 3.94Å; Y660-R688 HydrophobicContact CD1-CG 4.07Å; Y660-R688 HydrophobicContact CE1-CB 3.69Å; Y660-R688 HydrophobicContact CE1-CG 3.6Å; Y660-R688 PolarHBondContact OH-NE 3.49Å; R688-I703 VanDerWaalsContact O-CA 3.3Å; R688-I703 WeakPolarHBondContact O-CA 3.43Å; R688-E704 HydrophobicContact CB-CB 4.49Å; R688-E704 PolarHBondContact N-O 3.39Å; R688-E704 PolarHBondContact O-N 3.36Å; R688-I706 HydrophobicContact CB-CG2 4.01Å
689	V	97.9	Very high	95.5	Very high	15 Å²	15	48.5 Å²	48.5	9%	0.091	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	126.9	172.2	178.2	0	0	0	0	109.4	F657 E659 F687 Q692 A701	F657-V689 HydrophobicContact CD2-CG2 4.28Å; F657-V689 HydrophobicContact CE2-CG1 4.28Å; F657-V689 HydrophobicContact CE2-CG2 3.84Å; E659-V689 PolarHBondContact O-N 3.47Å; F687-V689 HydrophobicContact CD2-CG2 4.38Å; F687-V689 HydrophobicContact CE2-CG2 3.91Å; V689-Q692 HydrophobicContact CG1-CG 3.62Å; V689-A701 HydrophobicContact CG1-CB 4.22Å
690	L	97.4	Very high	95.6	Very high	116 Å²	116	48.5 Å²	48.5	61%	0.607	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	-42.6	173.3	-59.3	178	0	0	0	111.4	D702 E704	L690-D702 HydrophobicContact CB-CB 4.49Å; L690-D702 WeakPolarHBondContact CB-O 3.3Å; L690-D702 PolarHBondContact N-O 3.12Å; L690-E704 HydrophobicContact CD1-CB 4.21Å; L690-E704 HydrophobicContact CD2-CB 4.05Å; L690-E704 HydrophobicContact CG-CB 4.21Å
691	H	96.9	Very high	95.7	Very high	113 Å²	113	45.8 Å²	45.8	52%	0.523	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	146.6	179.8	-179.2	-101.6	0	0	0	109.8	A701 D702	H691-A701 CarbonylContact O-C 3.55Å; H691-A701 WeakPolarHBondContact O-CA 3.38Å; H691-A701 WeakPolarHBondContact O-CB 3.35Å; H691-D702 HydrophobicContact CB-CB 4.17Å; H691-D702 PolarHBondContact N-O 3.13Å; H691-D702 PolarHBondContact O-N 2.82Å
692	Q	96.5	Very high	95.8	Very high	64 Å²	64	47.8 Å²	47.8	30%	0.299	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	143.5	178.1	-61.7	-166.5	14.8	0	0	111	K655 F657 V689	K655-Q692 PolarHBondContact O-NE2 2.83Å; K655-Q692 PolarHBondContact O-OE1 2.82Å; F657-Q692 HydrophobicContact CE1-CB 4.22Å; F657-Q692 HydrophobicContact CE1-CG 3.97Å; F657-Q692 HydrophobicContact CE2-CG 3.92Å; F657-Q692 HydrophobicContact CZ-CB 3.99Å; F657-Q692 VanDerWaalsContact CZ-CD 3.47Å; F657-Q692 HydrophobicContact CZ-CG 3.51Å; F657-Q692 PolarHBondContact O-NE2 3.27Å; F657-Q692 VanDerWaalsContact O-NE2 3.07Å; V689-Q692 HydrophobicContact CG1-CG 3.62Å
693	S	95.6	Very high	95.9	Very high	51 Å²	51	47.1 Å²	47.1	36%	0.357	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	-179.3	-178.9	-174.5	0	0	0	0	110.4	T700	S693-T700 WeakPolarHBondContact CB-OG1 3.42Å; S693-T700 PolarHBondContact N-O 2.82Å; S693-T700 PolarHBondContact O-N 3.31Å; S693-T700 VanDerWaalsContact O-O 3.1Å
694	Q	93.9	Very high	95.9	Very high	125 Å²	125	50.3 Å²	50.3	58%	0.584	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-142.5	136.1	177.7	-159.7	-173.1	19.3	0	0	110.5	G697 Y698	Q694-G697 PolarHBondContact NE2-O 3.35Å; Q694-Y698 WeakPolarHBondContact CA-O 3.42Å; Q694-Y698 WeakPolarHBondContact CG-O 3.45Å
695	R	91.3	Very high	96	Very high	59 Å²	59	48.3 Å²	48.3	22%	0.223	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	132.2	-179.8	-168.6	175	-172.7	159.8	5.9	111	E600 G697 Y698 T700	E600-R695 IonicContact OE1-CZ 2.94Å; E600-R695 IonicContact OE1-NH1 2.78Å; E600-R695 PolarHBondContact OE1-NH1 3.05Å; E600-R695 IonicContact OE1-NH2 2.64Å; E600-R695 IonicContact OE2-CZ 2.89Å; E600-R695 VanDerWaalsContact OE2-CZ 3.26Å; E600-R695 IonicContact OE2-NH1 3.28Å; E600-R695 PolarHBondContact OE2-NH1 3.02Å; E600-R695 IonicContact OE2-NH2 3.33Å; E600-R695 PolarHBondContact OE2-NH2 3.47Å; R695-G697 PolarHBondContact O-N 3.11Å; R695-Y698 PolarHBondContact N-O 3.11Å; R695-Y698 WeakPolarHBondContact O-CD1 3.41Å; R695-Y698 WeakPolarHBondContact O-CE1 3.37Å; R695-Y698 PolarHBondContact O-N 2.89Å; R695-T700 HydrophobicContact CB-CG2 3.97Å
696	D	89.1	Confident	96	Very high	57 Å²	57	44.9 Å²	44.9	31%	0.305	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.9	32.5	-176.6	-63.6	-96.5	0	0	0	114.6	R545 L633 R637 Y698	R545-D696 IonicContact CZ-OD1 3.37Å; R545-D696 IonicContact NH1-OD1 2.75Å; R545-D696 PolarHBondContact NH1-OD1 3.18Å; L633-D696 HydrophobicContact CD2-CB 3.52Å; R637-D696 IonicContact CZ-OD2 3.62Å; R637-D696 IonicContact NH1-OD2 3.67Å; R637-D696 PolarHBondContact NH1-OD2 3.18Å; R637-D696 IonicContact NH2-OD1 2.69Å; R637-D696 IonicContact NH2-OD2 3.42Å; R637-D696 PolarHBondContact NH2-OD2 3.41Å; D696-Y698 HydrophobicContact CB-CE1 4.27Å
697	G	90.6	Very high	95.9	Very high	44 Å²	44	49.7 Å²	49.7	45%	0.454	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	0.5	177.7	0	0	0	0	0	116.7	Q694 R695	Q694-G697 PolarHBondContact NE2-O 3.35Å; R695-G697 PolarHBondContact O-N 3.11Å
698	Y	93.9	Very high	95.8	Very high	5 Å²	5	50.6 Å²	50.6	2%	0.02	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	157.4	169.2	64.1	-95.9	0	0	0	111.2	P609 C630 L633 M634 R637 Q694 R695 D696 T700	P609-Y698 HydrophobicContact CB-CD2 4.32Å; P609-Y698 HydrophobicContact CB-CE2 3.86Å; C630-Y698 WeakPolarHBondContact O-CD1 3.49Å; L633-Y698 HydrophobicContact CD2-CE1 4.43Å; L633-Y698 HydrophobicContact CG-CE1 4.43Å; M634-Y698 HydrophobicContact CB-CD1 3.86Å; M634-Y698 HydrophobicContact CB-CD2 4.15Å; M634-Y698 HydrophobicContact CB-CE1 4Å; M634-Y698 HydrophobicContact CB-CE2 4.31Å; M634-Y698 HydrophobicContact CB-CG 3.94Å; M634-Y698 HydrophobicContact CG-CD1 4.36Å; M634-Y698 HydrophobicContact CG-CD2 3.74Å; M634-Y698 HydrophobicContact CG-CE1 4.41Å; M634-Y698 HydrophobicContact CG-CE2 3.83Å; M634-Y698 HydrophobicContact CG-CG 4.04Å; M634-Y698 HydrophobicContact SD-CD2 4.11Å; M634-Y698 HydrophobicContact SD-CG 4.42Å; R637-Y698 WeakPolarHBondContact CD-OH 3.35Å; R637-Y698 PolarHBondContact NH1-OH 3.11Å; Q694-Y698 WeakPolarHBondContact CA-O 3.42Å; Q694-Y698 WeakPolarHBondContact CG-O 3.45Å; R695-Y698 PolarHBondContact N-O 3.11Å; R695-Y698 WeakPolarHBondContact O-CD1 3.41Å; R695-Y698 WeakPolarHBondContact O-CE1 3.37Å; R695-Y698 PolarHBondContact O-N 2.89Å; D696-Y698 HydrophobicContact CB-CE1 4.27Å; Y698-T700 HydrophobicContact CD2-CG2 4.2Å; Y698-T700 HydrophobicContact CE2-CG2 3.78Å
699	N	96.7	Very high	95.6	Very high	40 Å²	40	52.1 Å²	52.1	21%	0.214	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	147.3	-176.4	-63.3	-29.2	0	0	0	111.5	I610 V612 F657	I610-N699 HydrophobicContact CB-CB 4.24Å; I610-N699 PolarHBondContact N-O 3.08Å; V612-N699 WeakPolarHBondContact CG2-ND2 3.47Å; F657-N699 HydrophobicContact CD1-CB 4.34Å; F657-N699 HydrophobicContact CE1-CB 3.84Å
700	T	97.4	Very high	95.4	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	158.7	173.1	54.6	0	0	0	0	110.9	N607 V608 S693 R695 Y698	N607-T700 VanDerWaalsContact O-CG2 3.32Å; N607-T700 WeakPolarHBondContact O-CG2 3.36Å; V608-T700 CarbonylContact O-C 3.47Å; V608-T700 VanDerWaalsContact O-CA 3.22Å; V608-T700 WeakPolarHBondContact O-CA 3.34Å; S693-T700 WeakPolarHBondContact CB-OG1 3.42Å; S693-T700 PolarHBondContact N-O 2.82Å; S693-T700 PolarHBondContact O-N 3.31Å; S693-T700 VanDerWaalsContact O-O 3.1Å; R695-T700 HydrophobicContact CB-CG2 3.97Å; Y698-T700 HydrophobicContact CD2-CG2 4.2Å; Y698-T700 HydrophobicContact CE2-CG2 3.78Å
701	A	97.8	Very high	95.2	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.008	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	149.5	175.1	0	0	0	0	0	113	N607 V608 I610 F657 V689 H691 I703	N607-A701 PolarHBondContact N-O 2.81Å; V608-A701 WeakPolarHBondContact CB-O 3.46Å; V608-A701 PolarHBondContact N-O 3.45Å; V608-A701 PolarHBondContact O-N 3.02Å; I610-A701 HydrophobicContact CD1-CB 3.99Å; I610-A701 HydrophobicContact CG1-CB 3.72Å; F657-A701 HydrophobicContact CE2-CB 4.21Å; F657-A701 HydrophobicContact CZ-CB 4.14Å; V689-A701 HydrophobicContact CG1-CB 4.22Å; H691-A701 CarbonylContact O-C 3.55Å; H691-A701 WeakPolarHBondContact O-CA 3.38Å; H691-A701 WeakPolarHBondContact O-CB 3.35Å; A701-I703 HydrophobicContact CB-CG2 3.8Å
702	D	98.2	Very high	94.9	Very high	42 Å²	42	55.4 Å²	55.4	23%	0.225	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	135.4	159	-65.4	-2	0	0	0	107.8	N605 K606 N607 L690 H691	N605-D702 CarbonylContact O-C 3.6Å; N605-D702 WeakPolarHBondContact O-CA 3.39Å; K606-D702 WeakPolarHBondContact CA-OD1 3.47Å; N607-D702 PolarHBondContact N-OD1 2.91Å; L690-D702 HydrophobicContact CB-CB 4.49Å; L690-D702 WeakPolarHBondContact CB-O 3.3Å; L690-D702 PolarHBondContact N-O 3.12Å; H691-D702 HydrophobicContact CB-CB 4.17Å; H691-D702 PolarHBondContact N-O 3.13Å; H691-D702 PolarHBondContact O-N 2.82Å
703	I	98.2	Very high	94.6	Very high	3 Å²	3	55.1 Å²	55.1	2%	0.015	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	142.5	-166.1	68.7	172	0	0	0	114.4	N605 V608 I663 F687 R688 A701 Y705	N605-I703 PolarHBondContact ND2-O 2.95Å; N605-I703 PolarHBondContact O-N 2.9Å; V608-I703 HydrophobicContact CB-CD1 4.26Å; V608-I703 HydrophobicContact CG1-CD1 4.18Å; V608-I703 HydrophobicContact CG2-CD1 3.84Å; V608-I703 HydrophobicContact CG2-CG1 3.89Å; I663-I703 HydrophobicContact CD1-CD1 3.85Å; I663-I703 HydrophobicContact CG1-CD1 4.45Å; F687-I703 HydrophobicContact CB-CB 4.14Å; F687-I703 HydrophobicContact CB-CD1 3.91Å; F687-I703 HydrophobicContact CB-CG1 4.45Å; F687-I703 HydrophobicContact CD1-CD1 4.23Å; F687-I703 HydrophobicContact CD2-CB 3.87Å; F687-I703 HydrophobicContact CD2-CD1 4.22Å; F687-I703 HydrophobicContact CD2-CG2 3.51Å; F687-I703 HydrophobicContact CE2-CG2 3.84Å; F687-I703 HydrophobicContact CG-CB 4.22Å; F687-I703 HydrophobicContact CG-CD1 3.87Å; F687-I703 HydrophobicContact CG-CG2 4.23Å; R688-I703 VanDerWaalsContact O-CA 3.3Å; R688-I703 WeakPolarHBondContact O-CA 3.43Å; A701-I703 HydrophobicContact CB-CG2 3.8Å; I703-Y705 HydrophobicContact CD1-CE1 4.11Å
704	E	97.9	Very high	94	Very high	69 Å²	69	61.3 Å²	61.3	32%	0.322	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	132.4	166.1	-175.4	-154.4	-166.2	0	0	108.6	F687 R688 L690 R790	F687-E704 CarbonylContact C-O 3.56Å; F687-E704 WeakPolarHBondContact CA-O 3.46Å; F687-E704 WeakPolarHBondContact CB-O 3.24Å; R688-E704 HydrophobicContact CB-CB 4.49Å; R688-E704 PolarHBondContact N-O 3.39Å; R688-E704 PolarHBondContact O-N 3.36Å; L690-E704 HydrophobicContact CD1-CB 4.21Å; L690-E704 HydrophobicContact CD2-CB 4.05Å; L690-E704 HydrophobicContact CG-CB 4.21Å; E704-R790 IonicContact OE1-CZ 2.74Å; E704-R790 IonicContact OE1-NH1 3.51Å; E704-R790 IonicContact OE1-NH2 2.68Å; E704-R790 PolarHBondContact OE1-NH2 3.08Å; E704-R790 IonicContact OE2-NH2 3.26Å; E704-R790 PolarHBondContact OE2-NH2 3.02Å
705	Y	97.6	Very high	93.8	Very high	42 Å²	42	59.2 Å²	59.2	17%	0.165	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	138.5	171	-73.4	-65.5	0	0	0	111	L604 N605 I663 R685 F687 I703	L604-Y705 PolarHBondContact O-OH 3.03Å; N605-Y705 WeakPolarHBondContact ND2-CE2 3.47Å; I663-Y705 HydrophobicContact CG1-CE1 3.75Å; R685-Y705 HydrophobicContact CB-CD1 4.02Å; R685-Y705 HydrophobicContact CB-CE1 4.17Å; R685-Y705 VanDerWaalsContact NH1-CD2 3.35Å; R685-Y705 VanDerWaalsContact NH2-CZ 3.3Å; R685-Y705 PolarHBondContact NH2-OH 3.39Å; F687-Y705 HydrophobicContact CB-CD1 4.29Å; F687-Y705 HydrophobicContact CB-CE1 4.49Å; I703-Y705 HydrophobicContact CD1-CE1 4.11Å
706	I	96.4	Very high	93.7	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.01	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	129.2	179.3	73.8	171.8	0	0	0	111.5	Y660 R686 R688	Y660-I706 HydrophobicContact CD1-CD1 3.78Å; Y660-I706 HydrophobicContact CE1-CD1 4.01Å; R686-I706 HydrophobicContact CB-CD1 4.08Å; R686-I706 HydrophobicContact CB-CG1 3.5Å; R686-I706 PolarHBondContact NH2-O 3.26Å; R686-I706 PolarHBondContact O-N 2.8Å; R688-I706 HydrophobicContact CB-CG2 4.01Å
707	E	95.6	Very high	93.8	Very high	101 Å²	101	59 Å²	59	47%	0.472	32%	0.324	S	S	.	.			trans	-121.9	162.1	-178.1	-56.4	-162.4	154.5	0	0	110.4	P763 R790	E707-P763 CarbonylContact C-O 3.54Å; E707-P763 VanDerWaalsContact CA-O 3.24Å; E707-P763 WeakPolarHBondContact CA-O 3.3Å; E707-P763 HydrophobicContact CB-CB 4.09Å; E707-P763 WeakPolarHBondContact CB-O 3.34Å; E707-P763 HydrophobicContact CG-CB 3.93Å; E707-P763 WeakPolarHBondContact OE1-CB 3.19Å; E707-R790 WeakPolarHBondContact O-CB 3.43Å; E707-R790 WeakPolarHBondContact O-CG 3.35Å
708	D	94.9	Very high	94	Very high	19 Å²	19	61.8 Å²	61.8	10%	0.102	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-79.8	135.2	177.3	-79.2	-0.2	0	0	0	111.6	R686 K710 P763 R790 R795	R686-D708 IonicContact CZ-OD1 3.85Å; R686-D708 IonicContact NH1-OD1 3.43Å; R686-D708 PolarHBondContact NH1-OD1 3.45Å; R686-D708 IonicContact NH2-OD1 2.88Å; R686-D708 PolarHBondContact NH2-OD1 3.08Å; D708-K710 PolarHBondContact O-N 3.37Å; D708-P763 PolarHBondContact N-O 2.93Å; D708-R790 CarbonylContact C-O 3.48Å; D708-R790 WeakPolarHBondContact CA-O 3.22Å; D708-R795 IonicContact OD1-CZ 3.76Å; D708-R795 IonicContact OD1-NH2 2.67Å; D708-R795 PolarHBondContact OD1-NH2 3.23Å; D708-R795 IonicContact OD2-CZ 2.91Å; D708-R795 IonicContact OD2-NH2 3.55Å; D708-R795 PolarHBondContact OD2-NH2 2.9Å
709	Q	94.3	Very high	94	Very high	126 Å²	126	61.6 Å²	61.6	59%	0.589	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-69.5	119	177.3	-68.1	173.8	-3.7	0	0	109.2	R790	Q709-R790 HydrophobicContact CG-CB 4.23Å; Q709-R790 PolarHBondContact N-O 3.1Å
710	K	93.9	Very high	93.9	Very high	123 Å²	123	62.4 Å²	62.4	54%	0.535	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-75.7	136	178.5	-59.7	-159.5	-176.6	-152.9	0	111	D708 Q760	D708-K710 PolarHBondContact O-N 3.37Å; K710-Q760 WeakPolarHBondContact CE-O 3.49Å; K710-Q760 PolarHBondContact NZ-O 3.34Å
711	V	93.3	Very high	93.8	Very high	40 Å²	40	64.3 Å²	64.3	24%	0.242	35%	0.348	C	S	.	.			trans	-110.1	139.2	-174.3	178.6	0	0	0	0	109	D715 L719 Q760	V711-D715 HydrophobicContact CG1-CB 3.27Å; V711-L719 HydrophobicContact CB-CD2 4.11Å; V711-L719 HydrophobicContact CG2-CD2 4.2Å; V711-Q760 PolarHBondContact O-NE2 2.84Å
712	Q	90.8	Very high	93.7	Very high	150 Å²	150	65 Å²	65	70%	0.701	35%	0.351	S	S	*	.			trans	-126.9	165.7	-173.3	-61.6	-65.6	-8	0	0	111.1
713	G	88.8	Confident	93.6	Very high	58 Å²	58	63 Å²	63	60%	0.598	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	-143.5	176.1	0	0	0	0	0	113.6	D715 C716	G713-D715 VanDerWaalsContact C-N 3.35Å; G713-D715 PolarHBondContact O-N 3.46Å; G713-C716 VanDerWaalsContact O-CB 3.24Å; G713-C716 WeakPolarHBondContact O-CB 3.28Å; G713-C716 PolarHBondContact O-N 3.19Å
714	E	84.1	Confident	93.5	Very high	181 Å²	181	65.5 Å²	65.5	85%	0.846	35%	0.354	S	S	*	.	H	α-helix	trans	-61.9	-38.4	-174.9	-60.3	-174.8	159.3	0	0	112.9	C716 A717 E718	E714-C716 PolarHBondContact O-N 3.04Å; E714-A717 WeakPolarHBondContact O-CB 3.27Å; E714-A717 PolarHBondContact O-N 2.93Å; E714-E718 PolarHBondContact O-N 3.32Å
715	D	88.3	Confident	93.5	Very high	82 Å²	82	65.1 Å²	65.1	44%	0.439	36%	0.358	S	S	.	.	H	α-helix	trans	-59.9	-26.9	174.8	-84.4	-67.3	0	0	0	112.8	V711 G713 L719 K793	V711-D715 HydrophobicContact CG1-CB 3.27Å; G713-D715 VanDerWaalsContact C-N 3.35Å; G713-D715 PolarHBondContact O-N 3.46Å; D715-L719 WeakPolarHBondContact O-CB 3.41Å; D715-L719 PolarHBondContact O-N 2.87Å; D715-K793 IonicContact OD1-NZ 3.63Å; D715-K793 PolarHBondContact OD1-NZ 3.17Å
716	C	90.8	Very high	93.5	Very high	38 Å²	38	63.1 Å²	63.1	26%	0.257	35%	0.351	S	S	.	.	H	α-helix	trans	-70.7	-37.6	175.1	-172.9	0	0	0	0	111.3	G713 E714 L719 M720 Q760	G713-C716 VanDerWaalsContact O-CB 3.24Å; G713-C716 WeakPolarHBondContact O-CB 3.28Å; G713-C716 PolarHBondContact O-N 3.19Å; E714-C716 PolarHBondContact O-N 3.04Å; C716-L719 PolarHBondContact O-N 3.06Å; C716-M720 WeakPolarHBondContact O-CB 3.13Å; C716-M720 PolarHBondContact O-N 2.75Å; C716-Q760 PolarHBondContact SG-NE2 3.4Å
717	A	90.6	Very high	93.5	Very high	72 Å²	72	65.2 Å²	65.2	60%	0.595	36%	0.359	S	S	*	.	H	α-helix	trans	-68.2	-40.6	173.8	0	0	0	0	0	111.6	E714 M720 G721	E714-A717 WeakPolarHBondContact O-CB 3.27Å; E714-A717 PolarHBondContact O-N 2.93Å; A717-M720 PolarHBondContact O-N 3.49Å; A717-G721 PolarHBondContact O-N 3.04Å
718	E	93.6	Very high	93.5	Very high	103 Å²	103	66.6 Å²	66.6	48%	0.481	37%	0.365	S	S	.	.	H	α-helix	trans	-63.5	-44.8	173.2	-161.3	-148.1	127.2	0	0	111.4	E714 M720 G721 L722 K793	E714-E718 PolarHBondContact O-N 3.32Å; E718-M720 VanDerWaalsContact C-N 3.33Å; E718-M720 PolarHBondContact O-N 2.93Å; E718-G721 PolarHBondContact O-N 2.88Å; E718-G721 VanDerWaalsContact O-N 3.17Å; E718-L722 WeakPolarHBondContact O-CB 3.29Å; E718-L722 PolarHBondContact O-N 3.34Å; E718-K793 VanDerWaalsContact CD-NZ 3.31Å; E718-K793 WeakPolarHBondContact OE1-CE 3.4Å; E718-K793 IonicContact OE1-NZ 2.85Å; E718-K793 PolarHBondContact OE1-NZ 2.81Å; E718-K793 VanDerWaalsContact OE2-CE 3.27Å; E718-K793 WeakPolarHBondContact OE2-CE 3.35Å; E718-K793 IonicContact OE2-NZ 2.93Å; E718-K793 PolarHBondContact OE2-NZ 2.83Å
719	L	95	Very high	93.5	Very high	2 Å²	2	67.9 Å²	67.9	1%	0.01	37%	0.37	C	S	.	.	H	α-helix	trans	-59.6	-42	176.4	178.1	60.9	0	0	0	111.7	V711 D715 C716 L722 H723 Q760 L792 K793 L796	V711-L719 HydrophobicContact CB-CD2 4.11Å; V711-L719 HydrophobicContact CG2-CD2 4.2Å; D715-L719 WeakPolarHBondContact O-CB 3.41Å; D715-L719 PolarHBondContact O-N 2.87Å; C716-L719 PolarHBondContact O-N 3.06Å; L719-L722 PolarHBondContact O-N 2.9Å; L719-H723 WeakPolarHBondContact O-CB 3.39Å; L719-H723 PolarHBondContact O-N 2.75Å; L719-Q760 HydrophobicContact CD2-CG 3.99Å; L719-L792 HydrophobicContact CD1-CB 4.36Å; L719-L792 HydrophobicContact CD1-CD2 4.38Å; L719-L792 HydrophobicContact CD1-CG 4.19Å; L719-K793 HydrophobicContact CD1-CB 4.12Å; L719-L796 HydrophobicContact CD1-CD1 3.82Å
720	M	94.4	Very high	93.6	Very high	57 Å²	57	61.9 Å²	61.9	28%	0.281	34%	0.342	S	S	.	.	H	α-helix	trans	-64.1	-42.9	174.3	-177	61.6	76.5	0	0	111.7	C716 A717 E718 H723 N724 A757 P759	C716-M720 WeakPolarHBondContact O-CB 3.13Å; C716-M720 PolarHBondContact O-N 2.75Å; A717-M720 PolarHBondContact O-N 3.49Å; E718-M720 VanDerWaalsContact C-N 3.33Å; E718-M720 PolarHBondContact O-N 2.93Å; M720-H723 PolarHBondContact O-N 2.91Å; M720-N724 WeakPolarHBondContact O-CB 3.31Å; M720-N724 VanDerWaalsContact O-CG 3.3Å; M720-N724 PolarHBondContact O-N 2.7Å; M720-N724 PolarHBondContact O-ND2 3.06Å; M720-A757 WeakPolarHBondContact CE-O 3.17Å; M720-P759 VanDerWaalsContact CE-CD 3.41Å; M720-P759 HydrophobicContact CE-CG 4.18Å; M720-P759 HydrophobicContact SD-CG 4.45Å
721	G	95	Very high	93.7	Very high	40 Å²	40	57.6 Å²	57.6	41%	0.412	33%	0.328	S	S	.	.	H	α-helix	trans	-59.9	-46.9	174.2	0	0	0	0	0	112.6	A717 E718 N724 C725	A717-G721 PolarHBondContact O-N 3.04Å; E718-G721 PolarHBondContact O-N 2.88Å; E718-G721 VanDerWaalsContact O-N 3.17Å; G721-N724 PolarHBondContact O-N 3.48Å; G721-C725 WeakPolarHBondContact O-CB 3.47Å; G721-C725 PolarHBondContact O-N 3.39Å
722	L	96.3	Very high	93.7	Very high	15 Å²	15	61 Å²	61	8%	0.079	34%	0.344	C	S	.	.	H	α-helix	trans	-62.6	-45.7	175.6	-178.7	65.2	0	0	0	111.6	E718 L719 N724 C725 V726 K793 L796	E718-L722 WeakPolarHBondContact O-CB 3.29Å; E718-L722 PolarHBondContact O-N 3.34Å; L719-L722 PolarHBondContact O-N 2.9Å; L722-N724 PolarHBondContact O-N 3.32Å; L722-C725 PolarHBondContact O-N 3.26Å; L722-V726 HydrophobicContact CD1-CG2 3.87Å; L722-V726 HydrophobicContact CG-CG2 4.32Å; L722-V726 WeakPolarHBondContact O-CG2 3.43Å; L722-V726 PolarHBondContact O-N 3.47Å; L722-K793 HydrophobicContact CD2-CG 4.15Å; L722-L796 HydrophobicContact CD2-CB 3.86Å; L722-L796 HydrophobicContact CD2-CD1 4.34Å; L722-L796 HydrophobicContact CG-CB 4.04Å; L722-L796 HydrophobicContact CG-CD1 4.32Å
723	H	96.8	Very high	93.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-55.9	-50.1	176.8	173.8	-115.2	0	0	0	111.7	L719 M720 C725 V726 Y727 D756 P759 W768 L796	L719-H723 WeakPolarHBondContact O-CB 3.39Å; L719-H723 PolarHBondContact O-N 2.75Å; M720-H723 PolarHBondContact O-N 2.91Å; H723-C725 PolarHBondContact O-N 2.88Å; H723-V726 PolarHBondContact O-N 2.69Å; H723-Y727 WeakPolarHBondContact O-CB 3.32Å; H723-Y727 PolarHBondContact O-N 2.93Å; H723-D756 PolarHBondContact CE1-O 3.46Å; H723-P759 HydrophobicContact CB-CB 4.47Å; H723-P759 HydrophobicContact CB-CG 4.31Å; H723-W768 AromaticContact CD2-CE2 3.88Å; H723-W768 AromaticContact CD2-CZ2 3.57Å; H723-W768 AromaticContact CD2-NE1 3.57Å; H723-W768 AromaticContact CE1-NE1 3.94Å; H723-W768 AromaticContact NE2-CD1 3.98Å; H723-W768 AromaticContact NE2-CE2 3.66Å; H723-W768 AromaticContact NE2-CZ2 3.85Å; H723-W768 AromaticContact NE2-NE1 2.89Å; H723-W768 PolarHBondContact NE2-NE1 3.31Å; H723-L796 HydrophobicContact CB-CD1 4.04Å
724	N	96.2	Very high	94	Very high	55 Å²	55	52.1 Å²	52.1	29%	0.294	29%	0.287	S	S	.	.	H	α-helix	trans	-58.9	-47.5	176.1	-74.1	-48.1	0	0	0	112.3	M720 G721 L722 Q728 K755	M720-N724 WeakPolarHBondContact O-CB 3.31Å; M720-N724 VanDerWaalsContact O-CG 3.3Å; M720-N724 PolarHBondContact O-N 2.7Å; M720-N724 PolarHBondContact O-ND2 3.06Å; G721-N724 PolarHBondContact O-N 3.48Å; L722-N724 PolarHBondContact O-N 3.32Å; N724-Q728 PolarHBondContact O-N 2.99Å; N724-Q728 VanDerWaalsContact O-N 3.07Å; N724-K755 WeakPolarHBondContact OD1-CD 3.47Å; N724-K755 WeakPolarHBondContact OD1-CE 3.35Å; N724-K755 PolarHBondContact OD1-NZ 2.79Å
725	C	96.6	Very high	94.4	Very high	62 Å²	62	49.1 Å²	49.1	42%	0.419	27%	0.272	S	S	.	.	H	α-helix	trans	-63.2	-45.1	-179.2	-178	0	0	0	0	112.5	G721 L722 H723 Q728 Q729	G721-C725 WeakPolarHBondContact O-CB 3.47Å; G721-C725 PolarHBondContact O-N 3.39Å; L722-C725 PolarHBondContact O-N 3.26Å; H723-C725 PolarHBondContact O-N 2.88Å; C725-Q728 PolarHBondContact O-N 3.21Å; C725-Q729 PolarHBondContact O-N 3.27Å
726	V	97.1	Very high	94.6	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-74.5	-33.6	-178.1	-175.9	0	0	0	0	111.2	L722 H723 Q729 A730 W768 L796 I799 R800	L722-V726 HydrophobicContact CD1-CG2 3.87Å; L722-V726 HydrophobicContact CG-CG2 4.32Å; L722-V726 WeakPolarHBondContact O-CG2 3.43Å; L722-V726 PolarHBondContact O-N 3.47Å; H723-V726 PolarHBondContact O-N 2.69Å; V726-Q729 PolarHBondContact O-N 3.41Å; V726-A730 VanDerWaalsContact O-CB 3.28Å; V726-A730 WeakPolarHBondContact O-CB 3.46Å; V726-A730 PolarHBondContact O-N 2.99Å; V726-W768 HydrophobicContact CB-CH2 4.07Å; V726-W768 HydrophobicContact CG1-CH2 3.87Å; V726-W768 HydrophobicContact CG1-CZ3 4.35Å; V726-L796 HydrophobicContact CB-CD2 4.24Å; V726-L796 HydrophobicContact CG1-CD2 4.37Å; V726-I799 HydrophobicContact CG1-CB 4.33Å; V726-I799 HydrophobicContact CG1-CG2 3.86Å; V726-R800 HydrophobicContact CG1-CB 4.39Å; V726-R800 HydrophobicContact CG2-CB 3.82Å; V726-R800 HydrophobicContact CG2-CG 4.28Å
727	Y	97.1	Very high	94.6	Very high	46 Å²	46	47.8 Å²	47.8	18%	0.18	27%	0.269	C	S	.	.	H	α-helix	trans	-60.4	-45	170.3	-177.8	-88.8	0	0	0	111.5	H723 Q729 A730 S731 M752 P753 K755 W768	H723-Y727 WeakPolarHBondContact O-CB 3.32Å; H723-Y727 PolarHBondContact O-N 2.93Å; Y727-Q729 PolarHBondContact O-N 2.95Å; Y727-A730 PolarHBondContact O-N 3.2Å; Y727-S731 WeakPolarHBondContact O-CB 3.41Å; Y727-S731 PolarHBondContact O-N 3.34Å; Y727-M752 HydrophobicContact CD2-CE 4.49Å; Y727-M752 HydrophobicContact CE1-CE 4.33Å; Y727-M752 HydrophobicContact CE2-CE 3.76Å; Y727-P753 PolarHBondContact OH-O 3Å; Y727-K755 HydrophobicContact CD1-CB 3.91Å; Y727-K755 HydrophobicContact CD1-CD 4.1Å; Y727-K755 HydrophobicContact CD1-CG 4.13Å; Y727-K755 HydrophobicContact CD2-CB 3.69Å; Y727-K755 HydrophobicContact CD2-CG 3.89Å; Y727-K755 HydrophobicContact CE1-CB 3.83Å; Y727-K755 HydrophobicContact CE2-CB 3.61Å; Y727-K755 HydrophobicContact CE2-CG 4.33Å; Y727-K755 HydrophobicContact CG-CB 3.85Å; Y727-K755 HydrophobicContact CG-CD 4.08Å; Y727-K755 HydrophobicContact CG-CG 3.78Å; Y727-W768 HydrophobicContact CD2-CB 4.33Å; Y727-W768 AromaticContact CD2-CD1 3.8Å; Y727-W768 AromaticContact CD2-CD2 3.59Å; Y727-W768 HydrophobicContact CD2-CD2 3.59Å; Y727-W768 AromaticContact CD2-CE2 3.71Å; Y727-W768 HydrophobicContact CD2-CE3 4.11Å; Y727-W768 AromaticContact CD2-CG 3.66Å; Y727-W768 HydrophobicContact CD2-CG 3.66Å; Y727-W768 HydrophobicContact CD2-CZ2 4.31Å; Y727-W768 AromaticContact CD2-NE1 3.81Å; Y727-W768 HydrophobicContact CE2-CB 4.16Å; Y727-W768 HydrophobicContact CE2-CD2 4.3Å; Y727-W768 AromaticContact CE2-CG 3.95Å; Y727-W768 HydrophobicContact CE2-CG 3.95Å
728	Q	95.8	Very high	94.7	Very high	129 Å²	129	52.6 Å²	52.6	60%	0.603	28%	0.276	S	S	*	.	H	α-helix	trans	-63.5	-42.7	177.5	-170.5	176.1	7	0	0	111.6	N724 C725 S731 L732	N724-Q728 PolarHBondContact O-N 2.99Å; N724-Q728 VanDerWaalsContact O-N 3.07Å; C725-Q728 PolarHBondContact O-N 3.21Å; Q728-S731 PolarHBondContact O-N 2.9Å; Q728-L732 HydrophobicContact CG-CD1 4.25Å; Q728-L732 WeakPolarHBondContact O-CB 3.32Å; Q728-L732 VanDerWaalsContact O-CG 3.3Å; Q728-L732 WeakPolarHBondContact O-CG 3.24Å; Q728-L732 PolarHBondContact O-N 2.93Å
729	Q	95.4	Very high	94.6	Very high	47 Å²	47	52 Å²	52	22%	0.22	28%	0.283	C	S	.	.	H	α-helix	trans	-62.4	-43.2	175.1	-170.8	-173.6	-0.8	0	0	112.3	C725 V726 Y727 L732 W733 L803	C725-Q729 PolarHBondContact O-N 3.27Å; V726-Q729 PolarHBondContact O-N 3.41Å; Y727-Q729 PolarHBondContact O-N 2.95Å; Q729-L732 PolarHBondContact O-N 3.33Å; Q729-W733 WeakPolarHBondContact O-CB 3.29Å; Q729-W733 PolarHBondContact O-N 3.41Å; Q729-L803 HydrophobicContact CG-CB 4.33Å; Q729-L803 HydrophobicContact CG-CD1 4.24Å
730	A	95.8	Very high	94.5	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-62.2	-44.7	176.4	0	0	0	0	0	111.9	V726 Y727 W733 F734 W768 M772 L803	V726-A730 VanDerWaalsContact O-CB 3.28Å; V726-A730 WeakPolarHBondContact O-CB 3.46Å; V726-A730 PolarHBondContact O-N 2.99Å; Y727-A730 PolarHBondContact O-N 3.2Å; A730-W733 PolarHBondContact O-N 2.86Å; A730-F734 WeakPolarHBondContact O-CB 3.33Å; A730-F734 PolarHBondContact O-N 3.15Å; A730-W768 HydrophobicContact CB-CE3 4.42Å; A730-W768 HydrophobicContact CB-CZ3 3.99Å; A730-M772 HydrophobicContact CB-CE 3.78Å; A730-M772 HydrophobicContact CB-CG 4.03Å; A730-M772 HydrophobicContact CB-SD 3.85Å; A730-L803 HydrophobicContact CB-CD1 3.99Å
731	S	95.2	Very high	94.3	Very high	32 Å²	32	56.9 Å²	56.9	22%	0.224	32%	0.317	C	S	.	.	H	α-helix	trans	-62	-46.3	175.9	-172.3	0	0	0	0	112	Y727 Q728 W733 F734 H735	Y727-S731 WeakPolarHBondContact O-CB 3.41Å; Y727-S731 PolarHBondContact O-N 3.34Å; Q728-S731 PolarHBondContact O-N 2.9Å; S731-W733 PolarHBondContact O-N 3.49Å; S731-F734 PolarHBondContact O-N 3.44Å; S731-H735 WeakPolarHBondContact O-CB 3.36Å; S731-H735 PolarHBondContact O-N 2.94Å; S731-H735 PolarHBondContact O-ND1 2.88Å
732	L	94.3	Very high	94.2	Very high	113 Å²	113	57 Å²	57	59%	0.592	31%	0.306	S	S	*	.	H	α-helix	trans	-60.4	-46	177.1	-74	169.1	0	0	0	111.5	Q728 Q729 F734 H735 S736	Q728-L732 HydrophobicContact CG-CD1 4.25Å; Q728-L732 WeakPolarHBondContact O-CB 3.32Å; Q728-L732 VanDerWaalsContact O-CG 3.3Å; Q728-L732 WeakPolarHBondContact O-CG 3.24Å; Q728-L732 PolarHBondContact O-N 2.93Å; Q729-L732 PolarHBondContact O-N 3.33Å; L732-F734 PolarHBondContact O-N 3.02Å; L732-H735 CarbonylContact O-C 3.53Å; L732-H735 PolarHBondContact O-N 3.37Å; L732-H735 VanDerWaalsContact O-N 3.15Å; L732-S736 PolarHBondContact O-N 3.23Å; L732-S736 PolarHBondContact O-OG 3.07Å
733	W	93.6	Very high	94	Very high	10 Å²	10	60.5 Å²	60.5	4%	0.038	33%	0.325	C	S	.	.	H	α-helix	trans	-60	-44.8	175.4	172.8	83.9	0	0	0	112.5	Q729 A730 S731 H735 S736 L737 M772 V775 L776 L803	Q729-W733 WeakPolarHBondContact O-CB 3.29Å; Q729-W733 PolarHBondContact O-N 3.41Å; A730-W733 PolarHBondContact O-N 2.86Å; S731-W733 PolarHBondContact O-N 3.49Å; W733-H735 PolarHBondContact O-N 3.21Å; W733-S736 PolarHBondContact O-N 3.47Å; W733-S736 PolarHBondContact O-OG 2.9Å; W733-L737 HydrophobicContact CD2-CD2 4.4Å; W733-L737 HydrophobicContact CH2-CD1 4.05Å; W733-L737 HydrophobicContact CZ2-CD1 4.36Å; W733-L737 HydrophobicContact CZ2-CD2 3.98Å; W733-L737 HydrophobicContact CZ3-CD1 4.16Å; W733-L737 WeakPolarHBondContact O-CG 3.27Å; W733-L737 PolarHBondContact O-N 3.03Å; W733-M772 HydrophobicContact CE3-CE 3.69Å; W733-M772 HydrophobicContact CE3-SD 4.46Å; W733-M772 HydrophobicContact CZ3-CE 3.73Å; W733-M772 HydrophobicContact CZ3-SD 4.33Å; W733-V775 HydrophobicContact CH2-CG1 4.1Å; W733-V775 HydrophobicContact CZ3-CG1 4.11Å; W733-L776 HydrophobicContact CH2-CD2 3.9Å; W733-L776 HydrophobicContact CZ2-CD2 3.94Å; W733-L776 HydrophobicContact CZ3-CD2 4.32Å; W733-L803 HydrophobicContact CB-CD2 3.87Å; W733-L803 HydrophobicContact CD2-CD2 3.73Å; W733-L803 HydrophobicContact CE3-CD2 4.09Å; W733-L803 HydrophobicContact CG-CD2 3.63Å
734	F	92.7	Very high	93.8	Very high	11 Å²	11	65.8 Å²	65.8	5%	0.048	35%	0.345	C	S	.	.	H	α-helix	trans	-65.6	-27.6	176.9	-178.5	-118.4	0	0	0	112.7	A730 S731 L732 L737 K742 I745 L746 W771	A730-F734 WeakPolarHBondContact O-CB 3.33Å; A730-F734 PolarHBondContact O-N 3.15Å; S731-F734 PolarHBondContact O-N 3.44Å; L732-F734 PolarHBondContact O-N 3.02Å; F734-L737 HydrophobicContact CD2-CD1 3.91Å; F734-L737 HydrophobicContact CE2-CD1 4.47Å; F734-K742 HydrophobicContact CD2-CG 4.45Å; F734-K742 HydrophobicContact CE1-CD 4.44Å; F734-K742 HydrophobicContact CE1-CG 4.27Å; F734-K742 HydrophobicContact CE2-CG 3.7Å; F734-K742 HydrophobicContact CZ-CD 4.24Å; F734-K742 HydrophobicContact CZ-CG 3.59Å; F734-K742 WeakPolarHBondContact O-CE 3.48Å; F734-I745 HydrophobicContact CE2-CB 4.25Å; F734-I745 HydrophobicContact CE2-CD1 4.23Å; F734-I745 HydrophobicContact CE2-CG2 3.83Å; F734-I745 HydrophobicContact CZ-CG2 4.43Å; F734-L746 HydrophobicContact CE1-CD2 4.42Å; F734-L746 HydrophobicContact CZ-CD2 3.9Å; F734-L746 HydrophobicContact CZ-CG 4.12Å; F734-W771 HydrophobicContact CD1-CH2 4.4Å; F734-W771 AromaticContact CD2-CH2 3.78Å; F734-W771 HydrophobicContact CD2-CH2 3.78Å; F734-W771 HydrophobicContact CD2-CZ3 4.38Å; F734-W771 HydrophobicContact CE1-CH2 4.27Å; F734-W771 AromaticContact CE2-CH2 3.66Å; F734-W771 HydrophobicContact CE2-CH2 3.66Å; F734-W771 HydrophobicContact CE2-CZ2 4.38Å; F734-W771 HydrophobicContact CG-CH2 4.16Å; F734-W771 AromaticContact CZ-CH2 3.91Å; F734-W771 HydrophobicContact CZ-CH2 3.91Å; F734-W771 HydrophobicContact CZ-CZ2 4.37Å
735	H	91.9	Very high	93.6	Very high	117 Å²	117	63.8 Å²	63.8	54%	0.542	33%	0.334	S	S	.	.	H	α-helix	trans	-80.6	-25.1	174.4	-76.3	82.7	0	0	0	113.9	S731 L732 W733 L737 K742	S731-H735 WeakPolarHBondContact O-CB 3.36Å; S731-H735 PolarHBondContact O-N 2.94Å; S731-H735 PolarHBondContact O-ND1 2.88Å; L732-H735 CarbonylContact O-C 3.53Å; L732-H735 PolarHBondContact O-N 3.37Å; L732-H735 VanDerWaalsContact O-N 3.15Å; W733-H735 PolarHBondContact O-N 3.21Å; H735-L737 VanDerWaalsContact C-N 3.34Å; H735-K742 PolarHBondContact CD2-NZ 2.99Å; H735-K742 PolarHBondContact NE2-NZ 3.35Å; H735-K742 VanDerWaalsContact NE2-NZ 3.18Å
736	S	91.9	Very high	93.3	Very high	80 Å²	80	63.7 Å²	63.7	56%	0.559	33%	0.329	S	S	*	.	H	α-helix	trans	-82.3	-5.4	172.5	61.3	0	0	0	0	114.3	L732 W733	L732-S736 PolarHBondContact O-N 3.23Å; L732-S736 PolarHBondContact O-OG 3.07Å; W733-S736 PolarHBondContact O-N 3.47Å; W733-S736 PolarHBondContact O-OG 2.9Å
737	L	91.1	Very high	92.9	Very high	12 Å²	12	70.7 Å²	70.7	6%	0.063	37%	0.366	C	S	.	.	S	Bend	trans	-68.4	137.7	175.2	-60.7	-172.8	0	0	0	112.1	W733 F734 H735 S739 L741 I745	W733-L737 HydrophobicContact CD2-CD2 4.4Å; W733-L737 HydrophobicContact CH2-CD1 4.05Å; W733-L737 HydrophobicContact CZ2-CD1 4.36Å; W733-L737 HydrophobicContact CZ2-CD2 3.98Å; W733-L737 HydrophobicContact CZ3-CD1 4.16Å; W733-L737 WeakPolarHBondContact O-CG 3.27Å; W733-L737 PolarHBondContact O-N 3.03Å; F734-L737 HydrophobicContact CD2-CD1 3.91Å; F734-L737 HydrophobicContact CE2-CD1 4.47Å; H735-L737 VanDerWaalsContact C-N 3.34Å; L737-S739 PolarHBondContact O-N 3.02Å; L737-L741 HydrophobicContact CD1-CD2 4.23Å; L737-L741 HydrophobicContact CD1-CG 4.37Å; L737-L741 HydrophobicContact CD2-CD2 4.25Å; L737-I745 HydrophobicContact CD1-CD1 3.5Å
738	K	92.1	Very high	92.4	Very high	174 Å²	174	73.4 Å²	73.4	76%	0.757	38%	0.381	S	S	*	.			trans	-53.8	136.5	171.9	-64.2	179	-179.5	177.1	0	110.6	S740 L741 K742	K738-S740 PolarHBondContact O-N 2.95Å; K738-L741 PolarHBondContact O-N 3.41Å; K738-K742 PolarHBondContact O-N 3Å
739	S	92.9	Very high	92.1	Very high	89 Å²	89	69.6 Å²	69.6	62%	0.622	36%	0.362	S	S	*	.	H	α-helix	trans	-53.6	-35	-171.6	-40.9	0	0	0	0	114.3	L737 K742 N743	L737-S739 PolarHBondContact O-N 3.02Å; S739-K742 PolarHBondContact O-N 3.28Å; S739-N743 WeakPolarHBondContact O-CB 3.43Å; S739-N743 PolarHBondContact O-N 3.47Å; S739-N743 PolarHBondContact O-OD1 2.85Å
740	S	92.6	Very high	91.8	Very high	89 Å²	89	68.5 Å²	68.5	62%	0.622	36%	0.363	S	S	*	.	H	α-helix	trans	-65.1	-37.8	176.2	52.5	0	0	0	0	113.4	K738 R744	K738-S740 PolarHBondContact O-N 2.95Å; S740-R744 WeakPolarHBondContact O-CG 3.43Å; S740-R744 PolarHBondContact O-N 2.66Å
741	L	89.9	Confident	91.7	Very high	74 Å²	74	73.2 Å²	73.2	39%	0.387	39%	0.394	S	S	.	.	H	α-helix	trans	-74.4	-42	173.4	179.2	58.9	0	0	0	110.7	L737 K738 N743 R744 I745	L737-L741 HydrophobicContact CD1-CD2 4.23Å; L737-L741 HydrophobicContact CD1-CG 4.37Å; L737-L741 HydrophobicContact CD2-CD2 4.25Å; K738-L741 PolarHBondContact O-N 3.41Å; L741-N743 VanDerWaalsContact C-N 3.34Å; L741-N743 PolarHBondContact O-N 2.69Å; L741-R744 PolarHBondContact O-N 3.25Å; L741-I745 HydrophobicContact CD1-CD1 4.16Å; L741-I745 HydrophobicContact CD1-CG1 4.39Å; L741-I745 HydrophobicContact CG-CD1 3.95Å; L741-I745 WeakPolarHBondContact O-CG1 3.41Å; L741-I745 PolarHBondContact O-N 3.29Å
742	K	91.9	Very high	91.6	Very high	42 Å²	42	73 Å²	73	18%	0.183	39%	0.39	C	S	.	.	H	α-helix	trans	-57.5	-46.1	177.2	-161.5	175.3	-172	176.8	0	111.5	F734 H735 K738 S739 I745 L746	F734-K742 HydrophobicContact CD2-CG 4.45Å; F734-K742 HydrophobicContact CE1-CD 4.44Å; F734-K742 HydrophobicContact CE1-CG 4.27Å; F734-K742 HydrophobicContact CE2-CG 3.7Å; F734-K742 HydrophobicContact CZ-CD 4.24Å; F734-K742 HydrophobicContact CZ-CG 3.59Å; F734-K742 WeakPolarHBondContact O-CE 3.48Å; H735-K742 PolarHBondContact CD2-NZ 2.99Å; H735-K742 PolarHBondContact NE2-NZ 3.35Å; H735-K742 VanDerWaalsContact NE2-NZ 3.18Å; K738-K742 PolarHBondContact O-N 3Å; S739-K742 PolarHBondContact O-N 3.28Å; K742-I745 PolarHBondContact O-N 3.2Å; K742-L746 HydrophobicContact CG-CD1 4.4Å; K742-L746 VanDerWaalsContact O-CG 3.32Å; K742-L746 WeakPolarHBondContact O-CG 3.43Å; K742-L746 PolarHBondContact O-N 2.87Å
743	N	93.1	Very high	91.7	Very high	89 Å²	89	69.4 Å²	69.4	48%	0.476	37%	0.373	S	S	.	.	H	α-helix	trans	-65.9	-39.4	177.4	-67.6	2.9	0	0	0	112.3	S739 L741 I745 L746 N747	S739-N743 WeakPolarHBondContact O-CB 3.43Å; S739-N743 PolarHBondContact O-N 3.47Å; S739-N743 PolarHBondContact O-OD1 2.85Å; L741-N743 VanDerWaalsContact C-N 3.34Å; L741-N743 PolarHBondContact O-N 2.69Å; N743-I745 VanDerWaalsContact C-N 3.31Å; N743-I745 PolarHBondContact O-N 3.28Å; N743-L746 PolarHBondContact O-N 3.37Å; N743-N747 WeakPolarHBondContact O-CB 3.2Å; N743-N747 VanDerWaalsContact O-CG 3.23Å; N743-N747 PolarHBondContact O-N 3.15Å; N743-N747 PolarHBondContact O-OD1 2.71Å
744	R	92	Very high	91.6	Very high	111 Å²	111	76.9 Å²	76.9	42%	0.419	41%	0.409	S	S	.	.	H	α-helix	trans	-60.5	-39.8	173.6	-77.8	177.5	68.7	165.6	6.1	112.4	L10 S740 L741 H748	L10-R744 PolarHBondContact O-NH2 2.69Å; S740-R744 WeakPolarHBondContact O-CG 3.43Å; S740-R744 PolarHBondContact O-N 2.66Å; L741-R744 PolarHBondContact O-N 3.25Å; R744-H748 PolarHBondContact O-N 3.42Å
745	I	91.6	Very high	91.6	Very high	13 Å²	13	80.8 Å²	80.8	7%	0.067	43%	0.425	C	S	.	.	H	α-helix	trans	-65.4	-51	176.2	-69.4	160.9	0	0	0	110.2	F734 L737 L741 K742 N743 N747 H748 F749 W771 V775	F734-I745 HydrophobicContact CE2-CB 4.25Å; F734-I745 HydrophobicContact CE2-CD1 4.23Å; F734-I745 HydrophobicContact CE2-CG2 3.83Å; F734-I745 HydrophobicContact CZ-CG2 4.43Å; L737-I745 HydrophobicContact CD1-CD1 3.5Å; L741-I745 HydrophobicContact CD1-CD1 4.16Å; L741-I745 HydrophobicContact CD1-CG1 4.39Å; L741-I745 HydrophobicContact CG-CD1 3.95Å; L741-I745 WeakPolarHBondContact O-CG1 3.41Å; L741-I745 PolarHBondContact O-N 3.29Å; K742-I745 PolarHBondContact O-N 3.2Å; N743-I745 VanDerWaalsContact C-N 3.31Å; N743-I745 PolarHBondContact O-N 3.28Å; I745-N747 VanDerWaalsContact C-N 3.32Å; I745-N747 PolarHBondContact O-N 2.82Å; I745-H748 PolarHBondContact O-N 3Å; I745-H748 VanDerWaalsContact O-N 3.15Å; I745-F749 HydrophobicContact CG2-CD2 4.38Å; I745-F749 PolarHBondContact O-N 2.83Å; I745-W771 HydrophobicContact CG2-CH2 3.71Å; I745-W771 HydrophobicContact CG2-CZ2 3.52Å; I745-V775 HydrophobicContact CD1-CG1 3.68Å; I745-V775 HydrophobicContact CG1-CG1 3.98Å; I745-V775 HydrophobicContact CG2-CB 4.49Å; I745-V775 HydrophobicContact CG2-CG1 3.82Å; I745-V775 HydrophobicContact CG2-CG2 3.75Å
746	L	92.3	Very high	91.6	Very high	60 Å²	60	76.9 Å²	76.9	31%	0.314	41%	0.409	S	S	.	.	H	α-helix	trans	-58.4	-41.7	179.8	-69.5	172.3	0	0	0	112.5	F734 K742 N743 H748 G750 P751	F734-L746 HydrophobicContact CE1-CD2 4.42Å; F734-L746 HydrophobicContact CZ-CD2 3.9Å; F734-L746 HydrophobicContact CZ-CG 4.12Å; K742-L746 HydrophobicContact CG-CD1 4.4Å; K742-L746 VanDerWaalsContact O-CG 3.32Å; K742-L746 WeakPolarHBondContact O-CG 3.43Å; K742-L746 PolarHBondContact O-N 2.87Å; N743-L746 PolarHBondContact O-N 3.37Å; L746-H748 VanDerWaalsContact C-N 3.29Å; L746-H748 PolarHBondContact O-N 2.95Å; L746-G750 WeakPolarHBondContact O-CA 3.42Å; L746-G750 PolarHBondContact O-N 2.77Å; L746-P751 HydrophobicContact CD2-CB 4.28Å
747	N	88.6	Confident	91.5	Very high	146 Å²	146	77.7 Å²	77.7	78%	0.781	42%	0.42	S	S	*	.	H	α-helix	trans	-69.6	-21.9	180	-71.3	10.5	0	0	0	113.8	N743 I745	N743-N747 WeakPolarHBondContact O-CB 3.2Å; N743-N747 VanDerWaalsContact O-CG 3.23Å; N743-N747 PolarHBondContact O-N 3.15Å; N743-N747 PolarHBondContact O-OD1 2.71Å; I745-N747 VanDerWaalsContact C-N 3.32Å; I745-N747 PolarHBondContact O-N 2.82Å
748	H	86.2	Confident	91.4	Very high	103 Å²	103	80.5 Å²	80.5	48%	0.477	44%	0.435	S	S	.	.	H	α-helix	trans	-106.1	-41.5	-175.9	-166.9	81.4	0	0	0	113.5	R744 I745 L746	R744-H748 PolarHBondContact O-N 3.42Å; I745-H748 PolarHBondContact O-N 3Å; I745-H748 VanDerWaalsContact O-N 3.15Å; L746-H748 VanDerWaalsContact C-N 3.29Å; L746-H748 PolarHBondContact O-N 2.95Å
749	F	88.2	Confident	91.4	Very high	50 Å²	50	72.3 Å²	72.3	22%	0.219	40%	0.4	C	S	.	.	H	α-helix	trans	-109.1	-5.3	-176.3	-61.5	-75.4	0	0	0	113.7	V620 I745 W771 A774 V775	V620-F749 HydrophobicContact CG1-CD1 3.99Å; V620-F749 HydrophobicContact CG1-CE1 4.36Å; I745-F749 HydrophobicContact CG2-CD2 4.38Å; I745-F749 PolarHBondContact O-N 2.83Å; F749-W771 PolarHBondContact O-NE1 3.4Å; F749-A774 HydrophobicContact CD1-CB 4.21Å; F749-A774 HydrophobicContact CE1-CB 3.8Å; F749-A774 HydrophobicContact CZ-CB 4.36Å; F749-A774 WeakPolarHBondContact CZ-O 3.38Å; F749-V775 HydrophobicContact CB-CG2 4.14Å; F749-V775 HydrophobicContact CD2-CG2 3.6Å; F749-V775 HydrophobicContact CE2-CG2 4.03Å; F749-V775 HydrophobicContact CG-CG2 3.87Å
750	G	90.1	Very high	91.3	Very high	23 Å²	23	69 Å²	69	24%	0.237	38%	0.375	C	S	.	.			trans	74.2	-175.5	-170.5	0	0	0	0	0	113.3	L746 W771	L746-G750 WeakPolarHBondContact O-CA 3.42Å; L746-G750 PolarHBondContact O-N 2.77Å; G750-W771 WeakPolarHBondContact O-CZ2 3.48Å; G750-W771 PolarHBondContact O-NE1 2.85Å
751	P	92.7	Very high	91.2	Very high	100 Å²	100	70.8 Å²	70.8	65%	0.649	38%	0.375	S	S	*	.	S	Bend	trans	-63.7	153.7	172.4	29.6	-35.4	0	0	0	111.6	L746 P753 W771	L746-P751 HydrophobicContact CD2-CB 4.28Å; P751-P753 WeakPolarHBondContact O-CD 3.43Å; P751-W771 PolarHBondContact O-NE1 3.07Å
752	M	94.3	Very high	91.2	Very high	26 Å²	26	69 Å²	69	13%	0.128	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-59.9	128.4	169.3	-170.5	176.4	75.6	0	0	109.1	Y727 W768 W771 M772	Y727-M752 HydrophobicContact CD2-CE 4.49Å; Y727-M752 HydrophobicContact CE1-CE 4.33Å; Y727-M752 HydrophobicContact CE2-CE 3.76Å; M752-W768 HydrophobicContact CG-CB 4.44Å; M752-W771 HydrophobicContact CB-CD2 4.11Å; M752-W771 HydrophobicContact CB-CE3 3.84Å; M752-W771 HydrophobicContact CB-CH2 3.75Å; M752-W771 HydrophobicContact CB-CZ2 4Å; M752-W771 HydrophobicContact CB-CZ3 3.67Å; M752-W771 HydrophobicContact CG-CD2 4.11Å; M752-W771 HydrophobicContact CG-CE3 3.58Å; M752-W771 HydrophobicContact CG-CH2 4.32Å; M752-W771 HydrophobicContact CG-CZ3 3.71Å; M752-W771 HydrophobicContact SD-CE3 4.3Å; M752-W771 HydrophobicContact SD-CZ3 4.08Å; M752-M772 HydrophobicContact SD-CG 4.39Å; M752-M772 HydrophobicContact SD-SD 3.98Å
753	P	94.9	Very high	91.2	Very high	38 Å²	38	69.2 Å²	69.2	25%	0.247	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-57.1	150.5	176.7	-25.6	33.6	0	0	0	112.4	Y727 P751 A767 W768 W771	Y727-P753 PolarHBondContact OH-O 3Å; P751-P753 WeakPolarHBondContact O-CD 3.43Å; P753-A767 HydrophobicContact CB-CB 4.01Å; P753-A767 HydrophobicContact CG-CB 4.15Å; P753-W768 HydrophobicContact CB-CB 4.15Å; P753-W768 HydrophobicContact CG-CB 4.49Å; P753-W771 HydrophobicContact CG-CB 4.08Å; P753-W771 HydrophobicContact CG-CG 4.36Å
754	E	93.4	Very high	91.2	Very high	168 Å²	168	65.1 Å²	65.1	79%	0.785	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-62.7	159.1	172.5	-64.4	-173.6	178.2	0	0	111.6	D756	E754-D756 PolarHBondContact O-N 2.85Å
755	K	92.6	Very high	91.3	Very high	92 Å²	92	59.9 Å²	59.9	40%	0.4	33%	0.33	S	S	.	.			trans	-74.7	115.2	179.9	-172.1	-165.9	69.4	176.3	0	110.5	N724 Y727 A757	N724-K755 WeakPolarHBondContact OD1-CD 3.47Å; N724-K755 WeakPolarHBondContact OD1-CE 3.35Å; N724-K755 PolarHBondContact OD1-NZ 2.79Å; Y727-K755 HydrophobicContact CD1-CB 3.91Å; Y727-K755 HydrophobicContact CD1-CD 4.1Å; Y727-K755 HydrophobicContact CD1-CG 4.13Å; Y727-K755 HydrophobicContact CD2-CB 3.69Å; Y727-K755 HydrophobicContact CD2-CG 3.89Å; Y727-K755 HydrophobicContact CE1-CB 3.83Å; Y727-K755 HydrophobicContact CE2-CB 3.61Å; Y727-K755 HydrophobicContact CE2-CG 4.33Å; Y727-K755 HydrophobicContact CG-CB 3.85Å; Y727-K755 HydrophobicContact CG-CD 4.08Å; Y727-K755 HydrophobicContact CG-CG 3.78Å; K755-A757 PolarHBondContact O-N 2.83Å
756	D	90.3	Very high	91.4	Very high	36 Å²	36	59.2 Å²	59.2	19%	0.193	33%	0.327	C	S	.	.			trans	-50.9	135.2	174.5	-58.7	-101.5	0	0	0	112.3	H723 E754 P766 A767	H723-D756 PolarHBondContact CE1-O 3.46Å; E754-D756 PolarHBondContact O-N 2.85Å; D756-P766 WeakPolarHBondContact OD2-CA 3.5Å; D756-P766 VanDerWaalsContact OD2-CB 3.28Å; D756-P766 WeakPolarHBondContact OD2-CB 3.35Å; D756-A767 PolarHBondContact OD2-N 3.01Å
757	A	89.8	Confident	91.5	Very high	97 Å²	97	57.3 Å²	57.3	80%	0.802	32%	0.319	S	S	*	.	S	Bend	trans	-72.8	-34.3	178.6	0	0	0	0	0	112.5	M720 K755	M720-A757 WeakPolarHBondContact CE-O 3.17Å; K755-A757 PolarHBondContact O-N 2.83Å
758	D	90.9	Very high	91.9	Very high	70 Å²	70	50.3 Å²	50.3	37%	0.374	28%	0.282	S	S	.	.	S	Bend	trans	-120.3	110.7	162.7	169.2	22.9	0	0	0	108.5	Q760 M761	D758-Q760 PolarHBondContact O-N 2.8Å; D758-Q760 VanDerWaalsContact O-N 3.17Å; D758-Q760 WeakPolarHBondContact OD1-CA 3.47Å; D758-Q760 WeakPolarHBondContact OD1-CB 3.22Å; D758-Q760 PolarHBondContact OD1-N 2.95Å; D758-M761 HydrophobicContact CB-CB 4.17Å; D758-M761 WeakPolarHBondContact O-CB 3.36Å; D758-M761 PolarHBondContact O-N 3.01Å; D758-M761 WeakPolarHBondContact OD2-CA 3.32Å; D758-M761 PolarHBondContact OD2-N 2.95Å; D758-M761 VanDerWaalsContact OD2-N 3.16Å
759	P	90.3	Very high	92.3	Very high	3 Å²	3	45.4 Å²	45.4	2%	0.019	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-9.6	179.3	29.2	-34.8	0	0	0	114	M720 H723 P766 L792	M720-P759 VanDerWaalsContact CE-CD 3.41Å; M720-P759 HydrophobicContact CE-CG 4.18Å; M720-P759 HydrophobicContact SD-CG 4.45Å; H723-P759 HydrophobicContact CB-CB 4.47Å; H723-P759 HydrophobicContact CB-CG 4.31Å; P759-P766 HydrophobicContact CB-CG 3.67Å; P759-P766 WeakPolarHBondContact O-CD 3.29Å; P759-L792 HydrophobicContact CB-CD2 3.99Å
760	Q	92.1	Very high	92.7	Very high	20 Å²	20	43 Å²	43	9%	0.093	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	4.1	179.8	-50.1	-165.2	89.9	0	0	113.1	K710 V711 C716 L719 D758	K710-Q760 WeakPolarHBondContact CE-O 3.49Å; K710-Q760 PolarHBondContact NZ-O 3.34Å; V711-Q760 PolarHBondContact O-NE2 2.84Å; C716-Q760 PolarHBondContact SG-NE2 3.4Å; L719-Q760 HydrophobicContact CD2-CG 3.99Å; D758-Q760 PolarHBondContact O-N 2.8Å; D758-Q760 VanDerWaalsContact O-N 3.17Å; D758-Q760 WeakPolarHBondContact OD1-CA 3.47Å; D758-Q760 WeakPolarHBondContact OD1-CB 3.22Å; D758-Q760 PolarHBondContact OD1-N 2.95Å
761	M	90.5	Very high	93	Very high	126 Å²	126	42.2 Å²	42.2	62%	0.621	24%	0.239	S	C	*	.	S	Bend	trans	-67.1	-50.9	-179.4	-172.4	-81.3	-74.2	0	0	110.9	D758	D758-M761 HydrophobicContact CB-CB 4.17Å; D758-M761 WeakPolarHBondContact O-CB 3.36Å; D758-M761 PolarHBondContact O-N 3.01Å; D758-M761 WeakPolarHBondContact OD2-CA 3.32Å; D758-M761 PolarHBondContact OD2-N 2.95Å; D758-M761 VanDerWaalsContact OD2-N 3.16Å
762	N	90.6	Very high	93.1	Very high	36 Å²	36	37.5 Å²	37.5	19%	0.193	21%	0.208	C	C	.	.	S	Bend	trans	-74.2	127.1	175.5	-177	-16.3	0	0	0	110.5	N764 G765	N762-N764 PolarHBondContact O-N 2.8Å; N762-N764 VanDerWaalsContact O-N 3.07Å; N762-N764 PolarHBondContact OD1-N 2.88Å; N762-G765 PolarHBondContact ND2-O 2.81Å; N762-G765 PolarHBondContact O-N 2.93Å
763	P	91.9	Very high	93.1	Very high	46 Å²	46	36.2 Å²	36.2	30%	0.299	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-11.4	177.2	24.7	-34	0	0	0	114.5	E707 D708	E707-P763 CarbonylContact C-O 3.54Å; E707-P763 VanDerWaalsContact CA-O 3.24Å; E707-P763 WeakPolarHBondContact CA-O 3.3Å; E707-P763 HydrophobicContact CB-CB 4.09Å; E707-P763 WeakPolarHBondContact CB-O 3.34Å; E707-P763 HydrophobicContact CG-CB 3.93Å; E707-P763 WeakPolarHBondContact OE1-CB 3.19Å; D708-P763 PolarHBondContact N-O 2.93Å
764	N	93	Very high	93.1	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.016	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	4.7	171.5	-68.2	-94.8	0	0	0	112.9	P618 R686 N762 W770	P618-N764 HydrophobicContact CB-CB 3.9Å; P618-N764 HydrophobicContact CG-CB 3.85Å; R686-N764 WeakPolarHBondContact CG-OD1 3.43Å; R686-N764 PolarHBondContact N-OD1 2.87Å; R686-N764 VanDerWaalsContact N-OD1 3.08Å; R686-N764 PolarHBondContact NE-OD1 2.99Å; R686-N764 VanDerWaalsContact NE-OD1 3.11Å; N762-N764 PolarHBondContact O-N 2.8Å; N762-N764 VanDerWaalsContact O-N 3.07Å; N762-N764 PolarHBondContact OD1-N 2.88Å; N764-W770 VanDerWaalsContact O-CE2 3.27Å; N764-W770 VanDerWaalsContact O-CZ2 3.27Å; N764-W770 WeakPolarHBondContact O-CZ2 3.2Å; N764-W770 PolarHBondContact O-NE1 3.45Å
765	G	92.4	Very high	93	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.01	16%	0.164	C	C	.	.			trans	77.2	-176	-175.3	0	0	0	0	0	114.4	N762	N762-G765 PolarHBondContact ND2-O 2.81Å; N762-G765 PolarHBondContact O-N 2.93Å
766	P	95.1	Very high	93	Very high	0 Å²	0	24 Å²	24	0%	0	15%	0.147	C	C	.	.			trans	-61.3	138.5	-170.3	-25.2	35.5	0	0	0	113.9	D756 P759 W768 C769 W770 L792	D756-P766 WeakPolarHBondContact OD2-CA 3.5Å; D756-P766 VanDerWaalsContact OD2-CB 3.28Å; D756-P766 WeakPolarHBondContact OD2-CB 3.35Å; P759-P766 HydrophobicContact CB-CG 3.67Å; P759-P766 WeakPolarHBondContact O-CD 3.29Å; P766-W768 VanDerWaalsContact C-N 3.32Å; P766-W768 HydrophobicContact CB-CG 4.4Å; P766-W768 PolarHBondContact O-N 2.83Å; P766-C769 HydrophobicContact CB-CB 4.46Å; P766-C769 WeakPolarHBondContact O-CB 3.47Å; P766-C769 PolarHBondContact O-N 2.75Å; P766-W770 VanDerWaalsContact O-CD1 3.32Å; P766-L792 HydrophobicContact CG-CD1 4.3Å; P766-L792 HydrophobicContact CG-CD2 4.09Å
767	A	94.4	Very high	92.8	Very high	19 Å²	19	27.1 Å²	27.1	16%	0.157	17%	0.169	C	C	.	.	H	α-helix	trans	-62.6	-39.1	-178.3	0	0	0	0	0	112.2	T619 P753 D756 C769 W770 W771	T619-A767 HydrophobicContact CG2-CB 4.08Å; P753-A767 HydrophobicContact CB-CB 4.01Å; P753-A767 HydrophobicContact CG-CB 4.15Å; D756-A767 PolarHBondContact OD2-N 3.01Å; A767-C769 VanDerWaalsContact C-N 3.28Å; A767-C769 PolarHBondContact O-N 2.89Å; A767-W770 PolarHBondContact O-N 3.31Å; A767-W771 PolarHBondContact O-N 3.43Å; A767-W771 VanDerWaalsContact O-N 3.12Å
768	W	95.6	Very high	92.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.8	-29.3	179.4	73.5	-95.1	0	0	0	113	H723 V726 Y727 A730 M752 P753 P766 W770 W771 M772 L796	H723-W768 AromaticContact CD2-CE2 3.88Å; H723-W768 AromaticContact CD2-CZ2 3.57Å; H723-W768 AromaticContact CD2-NE1 3.57Å; H723-W768 AromaticContact CE1-NE1 3.94Å; H723-W768 AromaticContact NE2-CD1 3.98Å; H723-W768 AromaticContact NE2-CE2 3.66Å; H723-W768 AromaticContact NE2-CZ2 3.85Å; H723-W768 AromaticContact NE2-NE1 2.89Å; H723-W768 PolarHBondContact NE2-NE1 3.31Å; V726-W768 HydrophobicContact CB-CH2 4.07Å; V726-W768 HydrophobicContact CG1-CH2 3.87Å; V726-W768 HydrophobicContact CG1-CZ3 4.35Å; Y727-W768 HydrophobicContact CD2-CB 4.33Å; Y727-W768 AromaticContact CD2-CD1 3.8Å; Y727-W768 AromaticContact CD2-CD2 3.59Å; Y727-W768 HydrophobicContact CD2-CD2 3.59Å; Y727-W768 AromaticContact CD2-CE2 3.71Å; Y727-W768 HydrophobicContact CD2-CE3 4.11Å; Y727-W768 AromaticContact CD2-CG 3.66Å; Y727-W768 HydrophobicContact CD2-CG 3.66Å; Y727-W768 HydrophobicContact CD2-CZ2 4.31Å; Y727-W768 AromaticContact CD2-NE1 3.81Å; Y727-W768 HydrophobicContact CE2-CB 4.16Å; Y727-W768 HydrophobicContact CE2-CD2 4.3Å; Y727-W768 AromaticContact CE2-CG 3.95Å; Y727-W768 HydrophobicContact CE2-CG 3.95Å; A730-W768 HydrophobicContact CB-CE3 4.42Å; A730-W768 HydrophobicContact CB-CZ3 3.99Å; M752-W768 HydrophobicContact CG-CB 4.44Å; P753-W768 HydrophobicContact CB-CB 4.15Å; P753-W768 HydrophobicContact CG-CB 4.49Å; P766-W768 VanDerWaalsContact C-N 3.32Å; P766-W768 HydrophobicContact CB-CG 4.4Å; P766-W768 PolarHBondContact O-N 2.83Å; W768-W770 VanDerWaalsContact C-N 3.29Å; W768-W770 PolarHBondContact O-N 3.44Å; W768-W771 PolarHBondContact O-N 2.96Å; W768-M772 HydrophobicContact CE3-CG 3.88Å; W768-M772 HydrophobicContact CZ3-CG 4.25Å; W768-M772 WeakPolarHBondContact O-CB 3.33Å; W768-M772 VanDerWaalsContact O-CG 3.27Å; W768-M772 WeakPolarHBondContact O-CG 3.29Å; W768-M772 PolarHBondContact O-N 3.37Å; W768-L796 HydrophobicContact CH2-CD2 3.68Å; W768-L796 HydrophobicContact CZ2-CD2 3.71Å
769	C	96.1	Very high	92.5	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.1	-40.2	176	-73.1	0	0	0	0	111.1	P766 A767 L773 I799	P766-C769 HydrophobicContact CB-CB 4.46Å; P766-C769 WeakPolarHBondContact O-CB 3.47Å; P766-C769 PolarHBondContact O-N 2.75Å; A767-C769 VanDerWaalsContact C-N 3.28Å; A767-C769 PolarHBondContact O-N 2.89Å; C769-L773 VanDerWaalsContact O-CG 3.31Å; C769-L773 WeakPolarHBondContact O-CG 3.17Å; C769-L773 PolarHBondContact O-N 2.81Å; C769-I799 HydrophobicContact CB-CD1 4.1Å
770	W	96	Very high	92.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-75.2	-41.1	-179.8	-63.3	118.6	0	0	0	112.6	Y617 P618 V620 N764 P766 A767 W768 M772 L773 A774 F786 L787	Y617-W770 HydrophobicContact CD1-CD2 4.44Å; Y617-W770 AromaticContact CD1-CE3 3.39Å; Y617-W770 HydrophobicContact CD1-CE3 3.39Å; Y617-W770 AromaticContact CD1-CZ3 3.75Å; Y617-W770 HydrophobicContact CD1-CZ3 3.75Å; Y617-W770 HydrophobicContact CE1-CE3 4.07Å; Y617-W770 HydrophobicContact CE1-CZ3 4.17Å; Y617-W770 HydrophobicContact CG-CE3 4.12Å; P618-W770 HydrophobicContact CB-CG 4.31Å; P618-W770 HydrophobicContact CG-CD2 4.36Å; P618-W770 HydrophobicContact CG-CZ2 4.47Å; P618-W770 VanDerWaalsContact O-CB 3.25Å; P618-W770 WeakPolarHBondContact O-CB 3.23Å; V620-W770 HydrophobicContact CG2-CB 4.06Å; N764-W770 VanDerWaalsContact O-CE2 3.27Å; N764-W770 VanDerWaalsContact O-CZ2 3.27Å; N764-W770 WeakPolarHBondContact O-CZ2 3.2Å; N764-W770 PolarHBondContact O-NE1 3.45Å; P766-W770 VanDerWaalsContact O-CD1 3.32Å; A767-W770 PolarHBondContact O-N 3.31Å; W768-W770 VanDerWaalsContact C-N 3.29Å; W768-W770 PolarHBondContact O-N 3.44Å; W770-M772 VanDerWaalsContact C-N 3.32Å; W770-M772 PolarHBondContact O-N 3.4Å; W770-L773 HydrophobicContact CE3-CD1 3.74Å; W770-L773 HydrophobicContact CZ3-CD1 3.79Å; W770-L773 PolarHBondContact O-N 3.48Å; W770-A774 PolarHBondContact O-N 2.87Å; W770-F786 WeakPolarHBondContact CH2-O 3.38Å; W770-L787 HydrophobicContact CH2-CD1 4.42Å; W770-L787 HydrophobicContact CZ3-CD1 4.09Å
771	W	96	Very high	91.9	Very high	6 Å²	6	38.4 Å²	38.4	2%	0.023	20%	0.202	C	C	.	.	H	α-helix	trans	-57.1	-46.3	170.2	-173.5	98.7	0	0	0	111.2	F734 I745 F749 G750 P751 M752 P753 A767 W768 L773 A774 V775	F734-W771 HydrophobicContact CD1-CH2 4.4Å; F734-W771 AromaticContact CD2-CH2 3.78Å; F734-W771 HydrophobicContact CD2-CH2 3.78Å; F734-W771 HydrophobicContact CD2-CZ3 4.38Å; F734-W771 HydrophobicContact CE1-CH2 4.27Å; F734-W771 AromaticContact CE2-CH2 3.66Å; F734-W771 HydrophobicContact CE2-CH2 3.66Å; F734-W771 HydrophobicContact CE2-CZ2 4.38Å; F734-W771 HydrophobicContact CG-CH2 4.16Å; F734-W771 AromaticContact CZ-CH2 3.91Å; F734-W771 HydrophobicContact CZ-CH2 3.91Å; F734-W771 HydrophobicContact CZ-CZ2 4.37Å; I745-W771 HydrophobicContact CG2-CH2 3.71Å; I745-W771 HydrophobicContact CG2-CZ2 3.52Å; F749-W771 PolarHBondContact O-NE1 3.4Å; G750-W771 WeakPolarHBondContact O-CZ2 3.48Å; G750-W771 PolarHBondContact O-NE1 2.85Å; P751-W771 PolarHBondContact O-NE1 3.07Å; M752-W771 HydrophobicContact CB-CD2 4.11Å; M752-W771 HydrophobicContact CB-CE3 3.84Å; M752-W771 HydrophobicContact CB-CH2 3.75Å; M752-W771 HydrophobicContact CB-CZ2 4Å; M752-W771 HydrophobicContact CB-CZ3 3.67Å; M752-W771 HydrophobicContact CG-CD2 4.11Å; M752-W771 HydrophobicContact CG-CE3 3.58Å; M752-W771 HydrophobicContact CG-CH2 4.32Å; M752-W771 HydrophobicContact CG-CZ3 3.71Å; M752-W771 HydrophobicContact SD-CE3 4.3Å; M752-W771 HydrophobicContact SD-CZ3 4.08Å; P753-W771 HydrophobicContact CG-CB 4.08Å; P753-W771 HydrophobicContact CG-CG 4.36Å; A767-W771 PolarHBondContact O-N 3.43Å; A767-W771 VanDerWaalsContact O-N 3.12Å; W768-W771 PolarHBondContact O-N 2.96Å; W771-L773 PolarHBondContact O-N 2.88Å; W771-A774 PolarHBondContact O-N 3.25Å; W771-V775 HydrophobicContact CD2-CG2 3.91Å; W771-V775 HydrophobicContact CE3-CB 4.31Å; W771-V775 HydrophobicContact CE3-CG2 3.98Å; W771-V775 HydrophobicContact CH2-CG1 4.24Å; W771-V775 HydrophobicContact CH2-CG2 4.06Å; W771-V775 HydrophobicContact CZ2-CG2 3.99Å; W771-V775 HydrophobicContact CZ3-CB 4.23Å; W771-V775 HydrophobicContact CZ3-CG1 4.16Å; W771-V775 HydrophobicContact CZ3-CG2 4.05Å; W771-V775 WeakPolarHBondContact O-CB 2.97Å; W771-V775 VanDerWaalsContact O-CG2 3.29Å; W771-V775 WeakPolarHBondContact O-CG2 3.11Å; W771-V775 PolarHBondContact O-N 3.28Å
772	M	95.6	Very high	91.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.7	-45	176.1	-77.9	-60.1	-58.9	0	0	112.4	A730 W733 M752 W768 W770 A774 V775 L776 L803	A730-M772 HydrophobicContact CB-CE 3.78Å; A730-M772 HydrophobicContact CB-CG 4.03Å; A730-M772 HydrophobicContact CB-SD 3.85Å; W733-M772 HydrophobicContact CE3-CE 3.69Å; W733-M772 HydrophobicContact CE3-SD 4.46Å; W733-M772 HydrophobicContact CZ3-CE 3.73Å; W733-M772 HydrophobicContact CZ3-SD 4.33Å; M752-M772 HydrophobicContact SD-CG 4.39Å; M752-M772 HydrophobicContact SD-SD 3.98Å; W768-M772 HydrophobicContact CE3-CG 3.88Å; W768-M772 HydrophobicContact CZ3-CG 4.25Å; W768-M772 WeakPolarHBondContact O-CB 3.33Å; W768-M772 VanDerWaalsContact O-CG 3.27Å; W768-M772 WeakPolarHBondContact O-CG 3.29Å; W768-M772 PolarHBondContact O-N 3.37Å; W770-M772 VanDerWaalsContact C-N 3.32Å; W770-M772 PolarHBondContact O-N 3.4Å; M772-A774 VanDerWaalsContact C-N 3.27Å; M772-A774 PolarHBondContact O-N 2.94Å; M772-V775 PolarHBondContact O-N 2.84Å; M772-L776 HydrophobicContact CE-CD1 4.28Å; M772-L776 HydrophobicContact CE-CD2 4.26Å; M772-L776 HydrophobicContact CE-CG 4.16Å; M772-L776 WeakPolarHBondContact O-CB 3.39Å; M772-L776 WeakPolarHBondContact O-CD1 3.39Å; M772-L776 WeakPolarHBondContact O-CG 3.45Å; M772-L776 PolarHBondContact O-N 2.97Å; M772-L803 HydrophobicContact CE-CD1 4.36Å; M772-L803 HydrophobicContact CE-CD2 3.78Å; M772-L803 HydrophobicContact CE-CG 4.48Å
773	L	94.8	Very high	91.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65	-28.7	178.2	-74.6	166.2	0	0	0	113.6	Y617 C769 W770 W771 L778 Q783 F786 R795 I799	Y617-L773 HydrophobicContact CE1-CB 4.09Å; Y617-L773 PolarHBondContact OH-O 3.31Å; C769-L773 VanDerWaalsContact O-CG 3.31Å; C769-L773 WeakPolarHBondContact O-CG 3.17Å; C769-L773 PolarHBondContact O-N 2.81Å; W770-L773 HydrophobicContact CE3-CD1 3.74Å; W770-L773 HydrophobicContact CZ3-CD1 3.79Å; W770-L773 PolarHBondContact O-N 3.48Å; W771-L773 PolarHBondContact O-N 2.88Å; L773-L778 HydrophobicContact CD2-CD1 4.48Å; L773-Q783 PolarHBondContact O-NE2 2.74Å; L773-F786 HydrophobicContact CD1-CB 3.79Å; L773-F786 HydrophobicContact CD1-CD1 4.26Å; L773-F786 HydrophobicContact CD1-CG 4.24Å; L773-F786 HydrophobicContact CD2-CB 3.89Å; L773-F786 HydrophobicContact CD2-CD1 3.69Å; L773-F786 HydrophobicContact CD2-CD2 3.89Å; L773-F786 HydrophobicContact CD2-CE1 4.09Å; L773-F786 HydrophobicContact CD2-CE2 4.29Å; L773-F786 HydrophobicContact CD2-CG 3.57Å; L773-F786 HydrophobicContact CD2-CZ 4.37Å; L773-F786 HydrophobicContact CG-CB 4.5Å; L773-R795 HydrophobicContact CD1-CG 4.35Å; L773-I799 HydrophobicContact CD1-CD1 4.15Å; L773-I799 HydrophobicContact CD2-CD1 4.38Å; L773-I799 HydrophobicContact CD2-CG1 3.96Å; L773-I799 HydrophobicContact CG-CD1 4.05Å; L773-I799 HydrophobicContact CG-CG1 4.16Å
774	A	92.9	Very high	91.8	Very high	19 Å²	19	33.5 Å²	33.5	16%	0.157	18%	0.181	C	C	.	.	H	α-helix	trans	-77.2	-32	173.6	0	0	0	0	0	113.5	Y617 V620 F749 W770 W771 M772	Y617-A774 HydrophobicContact CD2-CB 3.81Å; Y617-A774 HydrophobicContact CE2-CB 3.93Å; V620-A774 HydrophobicContact CG1-CB 4.08Å; V620-A774 HydrophobicContact CG2-CB 4.36Å; F749-A774 HydrophobicContact CD1-CB 4.21Å; F749-A774 HydrophobicContact CE1-CB 3.8Å; F749-A774 HydrophobicContact CZ-CB 4.36Å; F749-A774 WeakPolarHBondContact CZ-O 3.38Å; W770-A774 PolarHBondContact O-N 2.87Å; W771-A774 PolarHBondContact O-N 3.25Å; M772-A774 VanDerWaalsContact C-N 3.27Å; M772-A774 PolarHBondContact O-N 2.94Å
775	V	92.7	Very high	91.9	Very high	16 Å²	16	36.5 Å²	36.5	10%	0.097	20%	0.201	C	C	.	.	H	α-helix	trans	-88.4	-26	-177.1	168.8	0	0	0	0	113.1	W733 I745 F749 W771 M772	W733-V775 HydrophobicContact CH2-CG1 4.1Å; W733-V775 HydrophobicContact CZ3-CG1 4.11Å; I745-V775 HydrophobicContact CD1-CG1 3.68Å; I745-V775 HydrophobicContact CG1-CG1 3.98Å; I745-V775 HydrophobicContact CG2-CB 4.49Å; I745-V775 HydrophobicContact CG2-CG1 3.82Å; I745-V775 HydrophobicContact CG2-CG2 3.75Å; F749-V775 HydrophobicContact CB-CG2 4.14Å; F749-V775 HydrophobicContact CD2-CG2 3.6Å; F749-V775 HydrophobicContact CE2-CG2 4.03Å; F749-V775 HydrophobicContact CG-CG2 3.87Å; W771-V775 HydrophobicContact CD2-CG2 3.91Å; W771-V775 HydrophobicContact CE3-CB 4.31Å; W771-V775 HydrophobicContact CE3-CG2 3.98Å; W771-V775 HydrophobicContact CH2-CG1 4.24Å; W771-V775 HydrophobicContact CH2-CG2 4.06Å; W771-V775 HydrophobicContact CZ2-CG2 3.99Å; W771-V775 HydrophobicContact CZ3-CB 4.23Å; W771-V775 HydrophobicContact CZ3-CG1 4.16Å; W771-V775 HydrophobicContact CZ3-CG2 4.05Å; W771-V775 WeakPolarHBondContact O-CB 2.97Å; W771-V775 VanDerWaalsContact O-CG2 3.29Å; W771-V775 WeakPolarHBondContact O-CG2 3.11Å; W771-V775 PolarHBondContact O-N 3.28Å; M772-V775 PolarHBondContact O-N 2.84Å
776	L	91.5	Very high	92	Very high	5 Å²	5	37.4 Å²	37.4	3%	0.026	21%	0.205	C	C	.	.	S	Bend	trans	-67.7	136.6	177.7	-76.5	165.3	0	0	0	111.4	W733 M772 L778 V802 L803 I806	W733-L776 HydrophobicContact CH2-CD2 3.9Å; W733-L776 HydrophobicContact CZ2-CD2 3.94Å; W733-L776 HydrophobicContact CZ3-CD2 4.32Å; M772-L776 HydrophobicContact CE-CD1 4.28Å; M772-L776 HydrophobicContact CE-CD2 4.26Å; M772-L776 HydrophobicContact CE-CG 4.16Å; M772-L776 WeakPolarHBondContact O-CB 3.39Å; M772-L776 WeakPolarHBondContact O-CD1 3.39Å; M772-L776 WeakPolarHBondContact O-CG 3.45Å; M772-L776 PolarHBondContact O-N 2.97Å; L776-L778 HydrophobicContact CB-CD1 4.26Å; L776-L778 HydrophobicContact CB-CG 4.2Å; L776-L778 PolarHBondContact O-N 3.23Å; L776-V802 HydrophobicContact CD1-CG1 4.05Å; L776-V802 HydrophobicContact CD2-CG1 4.14Å; L776-L803 HydrophobicContact CD2-CD2 3.98Å; L776-I806 HydrophobicContact CD2-CD1 3.64Å
777	P	85.9	Confident	92	Very high	103 Å²	103	37.5 Å²	37.5	67%	0.669	21%	0.206	S	C	*	.			trans	-76.7	68.3	-179.2	33.4	-37.1	0	0	0	111.5	I806	P777-I806 HydrophobicContact CG-CD1 4.12Å
778	L	87.9	Confident	92	Very high	43 Å²	43	37.8 Å²	37.8	23%	0.225	21%	0.208	C	C	.	.			trans	-106	144.1	177.3	-67.1	174.8	0	0	0	110.3	L773 L776 Q783 F786 V802	L773-L778 HydrophobicContact CD2-CD1 4.48Å; L776-L778 HydrophobicContact CB-CD1 4.26Å; L776-L778 HydrophobicContact CB-CG 4.2Å; L776-L778 PolarHBondContact O-N 3.23Å; L778-Q783 HydrophobicContact CB-CG 3.76Å; L778-Q783 HydrophobicContact CD1-CG 4.39Å; L778-F786 HydrophobicContact CD1-CE2 4.32Å; L778-V802 HydrophobicContact CD1-CG1 4.32Å; L778-V802 HydrophobicContact CD1-CG2 4.48Å; L778-V802 HydrophobicContact CD2-CG1 3.92Å; L778-V802 HydrophobicContact CD2-CG2 4.24Å; L778-V802 HydrophobicContact CG-CG1 4.35Å
779	E	87.7	Confident	92	Very high	150 Å²	150	40.4 Å²	40.4	70%	0.701	22%	0.221	S	C	*	.			trans	-64.6	144.7	168.6	-65.5	-172.7	175.8	0	0	111.1	R781 A782 Q783	E779-R781 PolarHBondContact O-N 3.11Å; E779-A782 WeakPolarHBondContact O-CA 3.35Å; E779-A782 WeakPolarHBondContact O-CB 3.4Å; E779-A782 PolarHBondContact O-N 3.47Å; E779-Q783 PolarHBondContact O-N 2.92Å
780	S	84.3	Confident	92	Very high	51 Å²	51	44.5 Å²	44.5	36%	0.357	24%	0.236	S	C	.	.	H	α-helix	trans	-55	-29.7	-179	-40.3	0	0	0	0	113.8	Q783 L784	S780-Q783 PolarHBondContact O-N 3.13Å; S780-L784 PolarHBondContact O-N 3.07Å
781	R	84.9	Confident	92	Very high	182 Å²	182	45.9 Å²	45.9	69%	0.687	25%	0.246	S	C	*	.	H	α-helix	trans	-71.8	-35.2	174.5	-69.9	-177	173.4	-169.1	-2.1	113	E779 P785	E779-R781 PolarHBondContact O-N 3.11Å; R781-P785 VanDerWaalsContact O-CD 3.27Å; R781-P785 WeakPolarHBondContact O-CD 3.38Å
782	A	89.1	Confident	92	Very high	48 Å²	48	46 Å²	46	40%	0.397	25%	0.247	S	C	.	.	H	α-helix	trans	-77	-24.4	173.9	0	0	0	0	0	112.3	E779 F786	E779-A782 WeakPolarHBondContact O-CA 3.35Å; E779-A782 WeakPolarHBondContact O-CB 3.4Å; E779-A782 PolarHBondContact O-N 3.47Å; A782-F786 WeakPolarHBondContact O-CD2 3.42Å
783	Q	90	Very high	92	Very high	18 Å²	18	48.3 Å²	48.3	8%	0.084	26%	0.257	C	S	.	.	H	α-helix	trans	-71.9	-35.7	173.1	-79.1	-179.3	-32.4	0	0	113.7	M615 Y617 L773 L778 E779 S780 F786	M615-Q783 HydrophobicContact CE-CB 4.31Å; M615-Q783 HydrophobicContact CG-CB 4.06Å; Y617-Q783 VanDerWaalsContact OH-CB 3.23Å; Y617-Q783 WeakPolarHBondContact OH-CB 3.3Å; Y617-Q783 WeakPolarHBondContact OH-CG 3.37Å; Y617-Q783 PolarHBondContact OH-NE2 3.3Å; L773-Q783 PolarHBondContact O-NE2 2.74Å; L778-Q783 HydrophobicContact CB-CG 3.76Å; L778-Q783 HydrophobicContact CD1-CG 4.39Å; E779-Q783 PolarHBondContact O-N 2.92Å; S780-Q783 PolarHBondContact O-N 3.13Å; Q783-F786 WeakPolarHBondContact O-CB 3.15Å; Q783-F786 PolarHBondContact O-N 3.43Å; Q783-F786 VanDerWaalsContact O-N 3.13Å
784	L	91.9	Very high	92	Very high	39 Å²	39	52.6 Å²	52.6	20%	0.204	28%	0.28	C	S	.	.	H	α-helix	trans	-57.3	-43.3	-174.3	-177.8	66	0	0	0	114.6	M615 A658 S780 F786 L787 A788	M615-L784 HydrophobicContact CE-CB 4.37Å; M615-L784 HydrophobicContact CE-CD1 4.17Å; M615-L784 HydrophobicContact SD-CB 4.38Å; M615-L784 HydrophobicContact SD-CD1 4.25Å; A658-L784 HydrophobicContact CB-CD1 4.14Å; A658-L784 HydrophobicContact CB-CD2 3.85Å; S780-L784 PolarHBondContact O-N 3.07Å; L784-F786 VanDerWaalsContact C-N 3.29Å; L784-F786 PolarHBondContact O-N 2.75Å; L784-L787 WeakPolarHBondContact O-CB 3.34Å; L784-L787 PolarHBondContact O-N 3.12Å; L784-L787 VanDerWaalsContact O-N 3.1Å; L784-A788 PolarHBondContact O-N 3.19Å
785	P	94.3	Very high	92.2	Very high	67 Å²	67	51.7 Å²	51.7	44%	0.435	27%	0.272	S	S	.	.	H	α-helix	trans	-56.5	-37.8	174.2	-28.2	35.9	0	0	0	114.2	R781 L787 A788 M789	R781-P785 VanDerWaalsContact O-CD 3.27Å; R781-P785 WeakPolarHBondContact O-CD 3.38Å; P785-L787 VanDerWaalsContact C-N 3.25Å; P785-L787 PolarHBondContact O-N 2.59Å; P785-A788 PolarHBondContact O-N 3.49Å; P785-M789 HydrophobicContact CB-CE 4.5Å; P785-M789 WeakPolarHBondContact O-CG 3.45Å; P785-M789 PolarHBondContact O-N 3.06Å
786	F	95	Very high	92.4	Very high	20 Å²	20	51 Å²	51	9%	0.088	27%	0.268	C	S	.	.	H	α-helix	trans	-66	-27.5	178.3	-73.1	-84.5	0	0	0	113.2	W770 L773 L778 A782 Q783 L784 M789 R795 I799 V802	W770-F786 WeakPolarHBondContact CH2-O 3.38Å; L773-F786 HydrophobicContact CD1-CB 3.79Å; L773-F786 HydrophobicContact CD1-CD1 4.26Å; L773-F786 HydrophobicContact CD1-CG 4.24Å; L773-F786 HydrophobicContact CD2-CB 3.89Å; L773-F786 HydrophobicContact CD2-CD1 3.69Å; L773-F786 HydrophobicContact CD2-CD2 3.89Å; L773-F786 HydrophobicContact CD2-CE1 4.09Å; L773-F786 HydrophobicContact CD2-CE2 4.29Å; L773-F786 HydrophobicContact CD2-CG 3.57Å; L773-F786 HydrophobicContact CD2-CZ 4.37Å; L773-F786 HydrophobicContact CG-CB 4.5Å; L778-F786 HydrophobicContact CD1-CE2 4.32Å; A782-F786 WeakPolarHBondContact O-CD2 3.42Å; Q783-F786 WeakPolarHBondContact O-CB 3.15Å; Q783-F786 PolarHBondContact O-N 3.43Å; Q783-F786 VanDerWaalsContact O-N 3.13Å; L784-F786 VanDerWaalsContact C-N 3.29Å; L784-F786 PolarHBondContact O-N 2.75Å; F786-M789 HydrophobicContact CD1-CE 4.39Å; F786-M789 HydrophobicContact CD1-SD 4.13Å; F786-R795 HydrophobicContact CD1-CG 3.96Å; F786-R795 PolarHBondContact O-NH1 2.82Å; F786-I799 HydrophobicContact CE1-CG1 4.17Å; F786-V802 HydrophobicContact CZ-CG2 4.2Å
787	L	94.4	Very high	92.7	Very high	2 Å²	2	52 Å²	52	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-72	-44.2	173.2	-165.3	71.8	0	0	0	110.6	M615 Y617 R686 W770 L784 P785 M789	M615-L787 HydrophobicContact CE-CB 4.1Å; M615-L787 HydrophobicContact CE-CD2 3.87Å; Y617-L787 HydrophobicContact CD1-CD1 3.76Å; Y617-L787 HydrophobicContact CE1-CD1 4.26Å; R686-L787 WeakPolarHBondContact CD-O 3.49Å; R686-L787 HydrophobicContact CG-CD1 3.81Å; R686-L787 HydrophobicContact CG-CG 4.3Å; R686-L787 PolarHBondContact NH1-O 3.01Å; W770-L787 HydrophobicContact CH2-CD1 4.42Å; W770-L787 HydrophobicContact CZ3-CD1 4.09Å; L784-L787 WeakPolarHBondContact O-CB 3.34Å; L784-L787 PolarHBondContact O-N 3.12Å; L784-L787 VanDerWaalsContact O-N 3.1Å; P785-L787 VanDerWaalsContact C-N 3.25Å; P785-L787 PolarHBondContact O-N 2.59Å; L787-M789 PolarHBondContact O-N 3.2Å
788	A	95.2	Very high	93.1	Very high	24 Å²	24	47.9 Å²	47.9	20%	0.198	25%	0.249	C	C	.	.	H	α-helix	trans	-70.3	-26.6	-177.3	0	0	0	0	0	114.7	Y660 L784 P785 R790	Y660-A788 HydrophobicContact CD1-CB 3.86Å; Y660-A788 HydrophobicContact CD2-CB 3.7Å; Y660-A788 HydrophobicContact CE1-CB 3.95Å; Y660-A788 HydrophobicContact CE2-CB 3.82Å; Y660-A788 HydrophobicContact CG-CB 3.72Å; L784-A788 PolarHBondContact O-N 3.19Å; P785-A788 PolarHBondContact O-N 3.49Å; A788-R790 PolarHBondContact O-N 3.34Å
789	M	95.6	Very high	93.5	Very high	56 Å²	56	45.8 Å²	45.8	28%	0.276	24%	0.238	S	C	.	.			trans	-56.8	121.7	179.3	-76.6	167.1	-167.8	0	0	112.4	R686 P785 F786 L787 R795	R686-M789 PolarHBondContact NH1-O 3.25Å; P785-M789 HydrophobicContact CB-CE 4.5Å; P785-M789 WeakPolarHBondContact O-CG 3.45Å; P785-M789 PolarHBondContact O-N 3.06Å; F786-M789 HydrophobicContact CD1-CE 4.39Å; F786-M789 HydrophobicContact CD1-SD 4.13Å; L787-M789 PolarHBondContact O-N 3.2Å; M789-R795 PolarHBondContact O-NH1 2.85Å; M789-R795 PolarHBondContact O-NH2 3.28Å; M789-R795 VanDerWaalsContact O-NH2 3.15Å; M789-R795 HydrophobicContact SD-CB 4.25Å; M789-R795 HydrophobicContact SD-CG 4.36Å
790	R	95.9	Very high	93.9	Very high	85 Å²	85	43.6 Å²	43.6	32%	0.321	22%	0.224	S	C	.	.			trans	-89.9	-3.7	168.4	-59.2	-171	-173.9	-172	0.9	113.4	E704 E707 D708 Q709 A788	E704-R790 IonicContact OE1-CZ 2.74Å; E704-R790 IonicContact OE1-NH1 3.51Å; E704-R790 IonicContact OE1-NH2 2.68Å; E704-R790 PolarHBondContact OE1-NH2 3.08Å; E704-R790 IonicContact OE2-NH2 3.26Å; E704-R790 PolarHBondContact OE2-NH2 3.02Å; E707-R790 WeakPolarHBondContact O-CB 3.43Å; E707-R790 WeakPolarHBondContact O-CG 3.35Å; D708-R790 CarbonylContact C-O 3.48Å; D708-R790 WeakPolarHBondContact CA-O 3.22Å; Q709-R790 HydrophobicContact CG-CB 4.23Å; Q709-R790 PolarHBondContact N-O 3.1Å; A788-R790 PolarHBondContact O-N 3.34Å
791	S	96.1	Very high	94.4	Very high	30 Å²	30	50.1 Å²	50.1	21%	0.21	24%	0.24	C	C	.	.			trans	-101.2	117.6	176	167.3	0	0	0	0	110.7	D794 R795	S791-D794 WeakPolarHBondContact CB-OD2 3.43Å; S791-D794 PolarHBondContact OG-N 2.86Å; S791-D794 PolarHBondContact OG-OD2 2.88Å; S791-R795 PolarHBondContact O-N 3.4Å; S791-R795 VanDerWaalsContact O-N 3.12Å
792	L	95.6	Very high	94.8	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.042	22%	0.215	C	C	.	.	H	α-helix	trans	-71.2	-34.4	176	-176.7	60	0	0	0	112	L719 P759 P766 D794 R795 L796	L719-L792 HydrophobicContact CD1-CB 4.36Å; L719-L792 HydrophobicContact CD1-CD2 4.38Å; L719-L792 HydrophobicContact CD1-CG 4.19Å; P759-L792 HydrophobicContact CB-CD2 3.99Å; P766-L792 HydrophobicContact CG-CD1 4.3Å; P766-L792 HydrophobicContact CG-CD2 4.09Å; L792-D794 VanDerWaalsContact C-N 3.27Å; L792-D794 PolarHBondContact O-N 3.45Å; L792-R795 PolarHBondContact O-N 3.25Å; L792-L796 HydrophobicContact CD1-CD1 4.32Å; L792-L796 HydrophobicContact CD1-CG 4.14Å; L792-L796 HydrophobicContact CG-CD1 3.96Å; L792-L796 HydrophobicContact CG-CG 4.29Å; L792-L796 WeakPolarHBondContact O-CB 3.35Å; L792-L796 WeakPolarHBondContact O-CG 3.3Å; L792-L796 PolarHBondContact O-N 3.2Å
793	K	95.8	Very high	95	Very high	49 Å²	49	40.3 Å²	40.3	21%	0.213	20%	0.196	C	C	.	.	H	α-helix	trans	-57.4	-41.5	175.5	-162.2	173.9	-171.4	175.9	0	110.6	D715 E718 L719 L722 N797	D715-K793 IonicContact OD1-NZ 3.63Å; D715-K793 PolarHBondContact OD1-NZ 3.17Å; E718-K793 VanDerWaalsContact CD-NZ 3.31Å; E718-K793 WeakPolarHBondContact OE1-CE 3.4Å; E718-K793 IonicContact OE1-NZ 2.85Å; E718-K793 PolarHBondContact OE1-NZ 2.81Å; E718-K793 VanDerWaalsContact OE2-CE 3.27Å; E718-K793 WeakPolarHBondContact OE2-CE 3.35Å; E718-K793 IonicContact OE2-NZ 2.93Å; E718-K793 PolarHBondContact OE2-NZ 2.83Å; L719-K793 HydrophobicContact CD1-CB 4.12Å; L722-K793 HydrophobicContact CD2-CG 4.15Å; K793-N797 WeakPolarHBondContact O-CB 3.39Å; K793-N797 PolarHBondContact O-N 3.44Å; K793-N797 VanDerWaalsContact O-N 3.11Å; K793-N797 PolarHBondContact O-ND2 3.07Å
794	D	95.9	Very high	95.1	Very high	90 Å²	90	41 Å²	41	48%	0.481	20%	0.204	S	C	.	.	H	α-helix	trans	-76.6	-39	177.8	-64.2	-56.1	0	0	0	112.9	S791 L792 L796 N797 G798	S791-D794 WeakPolarHBondContact CB-OD2 3.43Å; S791-D794 PolarHBondContact OG-N 2.86Å; S791-D794 PolarHBondContact OG-OD2 2.88Å; L792-D794 VanDerWaalsContact C-N 3.27Å; L792-D794 PolarHBondContact O-N 3.45Å; D794-L796 PolarHBondContact O-N 3.33Å; D794-N797 PolarHBondContact O-N 2.96Å; D794-G798 PolarHBondContact O-N 3.33Å
795	R	96.6	Very high	95	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.5	-47.2	175.1	-154.8	-162.8	-37.2	-62.5	-11.5	111.3	D708 L773 F786 M789 S791 L792 G798 I799	D708-R795 IonicContact OD1-CZ 3.76Å; D708-R795 IonicContact OD1-NH2 2.67Å; D708-R795 PolarHBondContact OD1-NH2 3.23Å; D708-R795 IonicContact OD2-CZ 2.91Å; D708-R795 IonicContact OD2-NH2 3.55Å; D708-R795 PolarHBondContact OD2-NH2 2.9Å; L773-R795 HydrophobicContact CD1-CG 4.35Å; F786-R795 HydrophobicContact CD1-CG 3.96Å; F786-R795 PolarHBondContact O-NH1 2.82Å; M789-R795 PolarHBondContact O-NH1 2.85Å; M789-R795 PolarHBondContact O-NH2 3.28Å; M789-R795 VanDerWaalsContact O-NH2 3.15Å; M789-R795 HydrophobicContact SD-CB 4.25Å; M789-R795 HydrophobicContact SD-CG 4.36Å; S791-R795 PolarHBondContact O-N 3.4Å; S791-R795 VanDerWaalsContact O-N 3.12Å; L792-R795 PolarHBondContact O-N 3.25Å; R795-G798 PolarHBondContact O-N 3.49Å; R795-I799 HydrophobicContact CG-CD1 4.39Å; R795-I799 WeakPolarHBondContact O-CG1 3.29Å; R795-I799 PolarHBondContact O-N 2.93Å
796	L	97	Very high	94.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.9	-42.2	175.5	-72	168.4	0	0	0	111.8	L719 L722 H723 V726 W768 L792 D794 I799 R800	L719-L796 HydrophobicContact CD1-CD1 3.82Å; L722-L796 HydrophobicContact CD2-CB 3.86Å; L722-L796 HydrophobicContact CD2-CD1 4.34Å; L722-L796 HydrophobicContact CG-CB 4.04Å; L722-L796 HydrophobicContact CG-CD1 4.32Å; H723-L796 HydrophobicContact CB-CD1 4.04Å; V726-L796 HydrophobicContact CB-CD2 4.24Å; V726-L796 HydrophobicContact CG1-CD2 4.37Å; W768-L796 HydrophobicContact CH2-CD2 3.68Å; W768-L796 HydrophobicContact CZ2-CD2 3.71Å; L792-L796 HydrophobicContact CD1-CD1 4.32Å; L792-L796 HydrophobicContact CD1-CG 4.14Å; L792-L796 HydrophobicContact CG-CD1 3.96Å; L792-L796 HydrophobicContact CG-CG 4.29Å; L792-L796 WeakPolarHBondContact O-CB 3.35Å; L792-L796 WeakPolarHBondContact O-CG 3.3Å; L792-L796 PolarHBondContact O-N 3.2Å; D794-L796 PolarHBondContact O-N 3.33Å; L796-I799 PolarHBondContact O-N 3.23Å; L796-R800 VanDerWaalsContact O-CB 3.29Å; L796-R800 WeakPolarHBondContact O-CB 3.43Å; L796-R800 PolarHBondContact O-N 3.4Å
797	N	96.9	Very high	94.1	Very high	28 Å²	28	44.3 Å²	44.3	15%	0.15	22%	0.217	C	C	.	.	H	α-helix	trans	-64.2	-37.9	175.3	-88.8	-57.7	0	0	0	113.1	K793 D794 R800 R801	K793-N797 WeakPolarHBondContact O-CB 3.39Å; K793-N797 PolarHBondContact O-N 3.44Å; K793-N797 VanDerWaalsContact O-N 3.11Å; K793-N797 PolarHBondContact O-ND2 3.07Å; D794-N797 PolarHBondContact O-N 2.96Å; N797-R800 PolarHBondContact OD1-NE 2.96Å; N797-R800 PolarHBondContact OD1-NH2 3.18Å; N797-R801 VanDerWaalsContact O-CG 3.29Å; N797-R801 WeakPolarHBondContact O-CG 3.43Å; N797-R801 PolarHBondContact O-N 3.08Å; N797-R801 VanDerWaalsContact O-N 3.08Å
798	G	95.6	Very high	93.5	Very high	15 Å²	15	53.5 Å²	53.5	16%	0.155	25%	0.252	C	S	.	.	H	α-helix	trans	-65.6	-47.1	173.3	0	0	0	0	0	112.2	D794 R795 R800 R801 V802	D794-G798 PolarHBondContact O-N 3.33Å; R795-G798 PolarHBondContact O-N 3.49Å; G798-R800 VanDerWaalsContact C-N 3.33Å; G798-R800 PolarHBondContact O-N 3Å; G798-R801 PolarHBondContact O-N 2.85Å; G798-V802 WeakPolarHBondContact O-CG2 3.46Å; G798-V802 PolarHBondContact O-N 3.03Å
799	I	95.9	Very high	92.4	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-58.8	-44.9	175.6	-67.7	166.6	0	0	0	110.5	V726 C769 L773 F786 R795 L796 R801 V802 L803	V726-I799 HydrophobicContact CG1-CB 4.33Å; V726-I799 HydrophobicContact CG1-CG2 3.86Å; C769-I799 HydrophobicContact CB-CD1 4.1Å; L773-I799 HydrophobicContact CD1-CD1 4.15Å; L773-I799 HydrophobicContact CD2-CD1 4.38Å; L773-I799 HydrophobicContact CD2-CG1 3.96Å; L773-I799 HydrophobicContact CG-CD1 4.05Å; L773-I799 HydrophobicContact CG-CG1 4.16Å; F786-I799 HydrophobicContact CE1-CG1 4.17Å; R795-I799 HydrophobicContact CG-CD1 4.39Å; R795-I799 WeakPolarHBondContact O-CG1 3.29Å; R795-I799 PolarHBondContact O-N 2.93Å; L796-I799 PolarHBondContact O-N 3.23Å; I799-R801 VanDerWaalsContact C-N 3.35Å; I799-R801 PolarHBondContact O-N 2.95Å; I799-V802 PolarHBondContact O-N 3.44Å; I799-L803 HydrophobicContact CG2-CD1 3.84Å; I799-L803 HydrophobicContact CG2-CG 4.37Å; I799-L803 WeakPolarHBondContact O-CB 3.5Å; I799-L803 WeakPolarHBondContact O-CG 3.42Å; I799-L803 PolarHBondContact O-N 2.98Å
800	R	96.3	Very high	90.8	Very high	103 Å²	103	59.5 Å²	59.5	39%	0.389	28%	0.278	S	S	.	.	H	α-helix	trans	-55.5	-45	174.7	-179.2	161.2	69.7	146.1	-3.3	112.8	V726 L796 N797 G798 A804	V726-R800 HydrophobicContact CG1-CB 4.39Å; V726-R800 HydrophobicContact CG2-CB 3.82Å; V726-R800 HydrophobicContact CG2-CG 4.28Å; L796-R800 VanDerWaalsContact O-CB 3.29Å; L796-R800 WeakPolarHBondContact O-CB 3.43Å; L796-R800 PolarHBondContact O-N 3.4Å; N797-R800 PolarHBondContact OD1-NE 2.96Å; N797-R800 PolarHBondContact OD1-NH2 3.18Å; G798-R800 VanDerWaalsContact C-N 3.33Å; G798-R800 PolarHBondContact O-N 3Å; R800-A804 VanDerWaalsContact O-CB 3.3Å; R800-A804 WeakPolarHBondContact O-CB 3.2Å; R800-A804 PolarHBondContact O-N 3.48Å
801	R	94.5	Very high	88.4	Confident	188 Å²	188	65 Å²	65	71%	0.709	31%	0.314	S	S	*	.	H	α-helix	trans	-66.3	-43.2	177.7	-72.2	171.4	-173.8	-174.6	4.3	111.8	N797 G798 I799 A804 F805	N797-R801 VanDerWaalsContact O-CG 3.29Å; N797-R801 WeakPolarHBondContact O-CG 3.43Å; N797-R801 PolarHBondContact O-N 3.08Å; N797-R801 VanDerWaalsContact O-N 3.08Å; G798-R801 PolarHBondContact O-N 2.85Å; I799-R801 VanDerWaalsContact C-N 3.35Å; I799-R801 PolarHBondContact O-N 2.95Å; R801-A804 PolarHBondContact O-N 3.22Å; R801-F805 WeakPolarHBondContact O-CB 3.45Å; R801-F805 PolarHBondContact O-N 2.96Å
802	V	94.1	Very high	88	Confident	24 Å²	24	66.8 Å²	66.8	15%	0.145	32%	0.319	C	S	.	.	H	α-helix	trans	-62.8	-47.5	176.8	170.7	0	0	0	0	111.2	L776 L778 F786 G798 I799 A804 F805 I806	L776-V802 HydrophobicContact CD1-CG1 4.05Å; L776-V802 HydrophobicContact CD2-CG1 4.14Å; L778-V802 HydrophobicContact CD1-CG1 4.32Å; L778-V802 HydrophobicContact CD1-CG2 4.48Å; L778-V802 HydrophobicContact CD2-CG1 3.92Å; L778-V802 HydrophobicContact CD2-CG2 4.24Å; L778-V802 HydrophobicContact CG-CG1 4.35Å; F786-V802 HydrophobicContact CZ-CG2 4.2Å; G798-V802 WeakPolarHBondContact O-CG2 3.46Å; G798-V802 PolarHBondContact O-N 3.03Å; I799-V802 PolarHBondContact O-N 3.44Å; V802-A804 VanDerWaalsContact C-N 3.35Å; V802-A804 PolarHBondContact O-N 2.9Å; V802-F805 PolarHBondContact O-N 2.96Å; V802-I806 HydrophobicContact CG1-CD1 3.68Å; V802-I806 HydrophobicContact CG1-CG1 4.46Å; V802-I806 WeakPolarHBondContact O-CG1 3.27Å; V802-I806 PolarHBondContact O-N 3.07Å
803	L	93.3	Very high	87.6	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-60.6	-42.6	176.4	-75.1	169.4	0	0	0	112.2	Q729 A730 W733 M772 L776 I799 F805 I806 S807	Q729-L803 HydrophobicContact CG-CB 4.33Å; Q729-L803 HydrophobicContact CG-CD1 4.24Å; A730-L803 HydrophobicContact CB-CD1 3.99Å; W733-L803 HydrophobicContact CB-CD2 3.87Å; W733-L803 HydrophobicContact CD2-CD2 3.73Å; W733-L803 HydrophobicContact CE3-CD2 4.09Å; W733-L803 HydrophobicContact CG-CD2 3.63Å; M772-L803 HydrophobicContact CE-CD1 4.36Å; M772-L803 HydrophobicContact CE-CD2 3.78Å; M772-L803 HydrophobicContact CE-CG 4.48Å; L776-L803 HydrophobicContact CD2-CD2 3.98Å; I799-L803 HydrophobicContact CG2-CD1 3.84Å; I799-L803 HydrophobicContact CG2-CG 4.37Å; I799-L803 WeakPolarHBondContact O-CB 3.5Å; I799-L803 WeakPolarHBondContact O-CG 3.42Å; I799-L803 PolarHBondContact O-N 2.98Å; L803-F805 VanDerWaalsContact C-N 3.35Å; L803-I806 PolarHBondContact O-N 2.89Å; L803-S807 WeakPolarHBondContact O-CB 3.36Å; L803-S807 PolarHBondContact O-N 2.83Å; L803-S807 PolarHBondContact O-OG 3.09Å
804	A	91.4	Very high	87.1	Confident	32 Å²	32	71.1 Å²	71.1	26%	0.264	34%	0.341	S	S	.	.	H	α-helix	trans	-65.8	-35.3	176.9	0	0	0	0	0	112.7	R800 R801 V802 R808	R800-A804 VanDerWaalsContact O-CB 3.3Å; R800-A804 WeakPolarHBondContact O-CB 3.2Å; R800-A804 PolarHBondContact O-N 3.48Å; R801-A804 PolarHBondContact O-N 3.22Å; V802-A804 VanDerWaalsContact C-N 3.35Å; V802-A804 PolarHBondContact O-N 2.9Å; A804-R808 WeakPolarHBondContact O-CD 3.21Å; A804-R808 WeakPolarHBondContact O-CG 3.21Å; A804-R808 PolarHBondContact O-N 2.86Å
805	F	89.7	Confident	86.6	Confident	130 Å²	130	69.9 Å²	69.9	57%	0.57	33%	0.332	S	S	*	.	H	α-helix	trans	-68.7	-48.3	174.3	178.5	-105.3	0	0	0	111.8	R801 V802 L803 S807 R808 N809	R801-F805 WeakPolarHBondContact O-CB 3.45Å; R801-F805 PolarHBondContact O-N 2.96Å; V802-F805 PolarHBondContact O-N 2.96Å; L803-F805 VanDerWaalsContact C-N 3.35Å; F805-S807 PolarHBondContact O-N 2.84Å; F805-R808 PolarHBondContact O-N 2.64Å; F805-N809 WeakPolarHBondContact CE1-ND2 3.35Å; F805-N809 WeakPolarHBondContact CZ-ND2 3.48Å; F805-N809 PolarHBondContact O-N 3.43Å
806	I	87.1	Confident	86	Confident	21 Å²	21	74.3 Å²	74.3	11%	0.108	35%	0.353	C	S	.	.	H	α-helix	trans	-62.3	-43.6	179.4	-67.5	166.4	0	0	0	111	L776 P777 V802 L803 R808 N809 Q810	L776-I806 HydrophobicContact CD2-CD1 3.64Å; P777-I806 HydrophobicContact CG-CD1 4.12Å; V802-I806 HydrophobicContact CG1-CD1 3.68Å; V802-I806 HydrophobicContact CG1-CG1 4.46Å; V802-I806 WeakPolarHBondContact O-CG1 3.27Å; V802-I806 PolarHBondContact O-N 3.07Å; L803-I806 PolarHBondContact O-N 2.89Å; I806-R808 PolarHBondContact O-N 3.27Å; I806-N809 PolarHBondContact O-N 3.45Å; I806-N809 VanDerWaalsContact O-N 3.07Å; I806-Q810 HydrophobicContact CG2-CG 4.34Å; I806-Q810 WeakPolarHBondContact O-CG 3.35Å; I806-Q810 PolarHBondContact O-N 3.31Å
807	S	83.4	Confident	85.2	Confident	45 Å²	45	79.3 Å²	79.3	32%	0.315	38%	0.377	S	S	.	.	H	α-helix	trans	-65.5	-25.2	179.6	-52.9	0	0	0	0	113.1	L803 F805	L803-S807 WeakPolarHBondContact O-CB 3.36Å; L803-S807 PolarHBondContact O-N 2.83Å; L803-S807 PolarHBondContact O-OG 3.09Å; F805-S807 PolarHBondContact O-N 2.84Å
808	R	82.6	Confident	84.4	Confident	195 Å²	195	82.9 Å²	82.9	74%	0.736	39%	0.393	S	S	*	.	H	α-helix	trans	-78.8	-18.7	174.1	-75.2	169.7	-177.7	-172.6	-0.3	113.8	A804 F805 I806	A804-R808 WeakPolarHBondContact O-CD 3.21Å; A804-R808 WeakPolarHBondContact O-CG 3.21Å; A804-R808 PolarHBondContact O-N 2.86Å; F805-R808 PolarHBondContact O-N 2.64Å; I806-R808 PolarHBondContact O-N 3.27Å
809	N	70.7	Confident	83.5	Confident	102 Å²	102	88.2 Å²	88.2	55%	0.545	41%	0.411	S	S	.	.	S	Bend	trans	-106	7.3	-179.1	-57.1	-11.4	0	0	0	112.1	F805 I806	F805-N809 WeakPolarHBondContact CE1-ND2 3.35Å; F805-N809 WeakPolarHBondContact CZ-ND2 3.48Å; F805-N809 PolarHBondContact O-N 3.43Å; I806-N809 PolarHBondContact O-N 3.45Å; I806-N809 VanDerWaalsContact O-N 3.07Å
810	Q	61.8	Low	82.5	Confident	104 Å²	104	95.5 Å²	95.5	49%	0.486	45%	0.446	S	S	.	.			trans	-107.3	-10.7	174.1	-74.6	-176.4	-5.6	0	0	113.1	I806	I806-Q810 HydrophobicContact CG2-CG 4.34Å; I806-Q810 WeakPolarHBondContact O-CG 3.35Å; I806-Q810 PolarHBondContact O-N 3.31Å
811	N	45.4	Very low	81.3	Confident	202 Å²	202	94.8 Å²	94.8	100%	1.08	45%	0.451	S	S	*	.			trans	-101.6	0	167.6	-67.3	-12.8	0	0	0	109.5

Retrieved 811 of 811 residues in 205.8 ms (Link to these results)

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