A0A5K4F1E9_SCHMA Loading...

Proton-coupled zinc antiporter SLC30A9, mitochondrial

AlphaFold DB , UniProt , Accession A0A5K4F1E9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 540 aa.

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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	31.6	Very low	30.2	Very low	242 Å²	242	154.4 Å²	154.4	100%	1.192	83%	0.829	S	S	*	*				0	141	0	-83.3	170.6	150.4	0	0	108.7
2	Q	28.1	Very low	30	Very low	179 Å²	179	153 Å²	153	84%	0.836	83%	0.83	S	S	*	*			trans	21.3	136.2	165.6	-76.2	166.6	-20	0	0	122.6
3	N	32.7	Very low	29.7	Very low	132 Å²	132	158 Å²	158	71%	0.706	84%	0.84	S	S	*	*			trans	95.4	79.1	153	-59.8	-17.9	0	0	0	118.7	H5	N3-H5 PolarHBondContact O-N 3.28Å
4	A	29.3	Very low	29.6	Very low	99 Å²	99	164.2 Å²	164.2	82%	0.818	85%	0.846	S	S	*	*			trans	-51.9	117.8	139.6	0	0	0	0	0	110.3
5	H	34	Very low	29.6	Very low	159 Å²	159	169.3 Å²	169.3	74%	0.736	85%	0.85	S	S	*	*			trans	-131	97.1	160.2	-98.1	-76.2	0	0	0	110.8	N3 I7	N3-H5 PolarHBondContact O-N 3.28Å; H5-I7 PolarHBondContact O-N 2.94Å
6	L	27.7	Very low	29.7	Very low	158 Å²	158	166 Å²	166	83%	0.827	85%	0.846	S	S	*	*			trans	-54.9	114.8	157.6	-138.4	105.3	0	0	0	108.8
7	I	30.2	Very low	29.6	Very low	156 Å²	156	167.3 Å²	167.3	80%	0.8	85%	0.845	S	S	*	*			trans	-123.4	79.9	161.6	-59	178.8	0	0	0	106.7	H5	H5-I7 PolarHBondContact O-N 2.94Å
8	V	32.7	Very low	29.7	Very low	128 Å²	128	167.2 Å²	167.2	78%	0.776	85%	0.847	S	S	*	*			trans	-97.5	114.9	158.7	174.4	0	0	0	0	106.5
9	S	30.2	Very low	29.7	Very low	111 Å²	111	165.8 Å²	165.8	78%	0.776	84%	0.841	S	S	*	*			trans	-56.6	139	-177.1	-174	0	0	0	0	112.6
10	R	25	Very low	29.8	Very low	248 Å²	248	162.9 Å²	162.9	94%	0.936	84%	0.837	S	S	*	*			trans	-87.3	105.3	-173.7	-166.2	-178.4	-170.2	-178.5	2.9	108.5
11	A	30.4	Very low	29.8	Very low	86 Å²	86	160.4 Å²	160.4	71%	0.711	83%	0.829	S	S	*	*			trans	-154.7	97.2	164.6	0	0	0	0	0	112.8
12	T	28.4	Very low	29.9	Very low	138 Å²	138	157.9 Å²	157.9	85%	0.847	81%	0.812	S	S	*	*			trans	70.6	82.2	136.8	-34.6	0	0	0	0	118.9
13	F	26.3	Very low	30	Very low	218 Å²	218	157.1 Å²	157.1	96%	0.956	81%	0.808	S	S	*	*			trans	-139.4	90.1	156.8	-143.1	-93.7	0	0	0	109.9
14	R	27.4	Very low	29.9	Very low	245 Å²	245	157.4 Å²	157.4	93%	0.925	81%	0.809	S	S	*	*			trans	-158.6	136.3	168.1	-128.5	177.1	-173.4	-158.6	1.6	111.8
15	R	30	Very low	29.9	Very low	240 Å²	240	161 Å²	161	91%	0.906	81%	0.806	S	S	*	*			trans	96.1	126.2	179.9	-63.7	-175.2	170.6	174.3	-2.3	113.8
16	C	30.7	Very low	29.9	Very low	117 Å²	117	158.7 Å²	158.7	79%	0.791	80%	0.803	S	S	*	*			cis	-164.6	124.7	-0.3	-103.1	0	0	0	0	106.6
17	F	27.7	Very low	30.1	Very low	188 Å²	188	157.6 Å²	157.6	83%	0.825	80%	0.803	S	S	*	*			trans	-86.2	122.2	161.9	-117.8	-97.4	0	0	0	107	L19	F17-L19 HydrophobicContact CD1-CD1 4.11Å; F17-L19 HydrophobicContact CE1-CD1 4.21Å
18	N	32.2	Very low	30.3	Very low	165 Å²	165	155.2 Å²	155.2	88%	0.882	80%	0.798	S	S	*	*			trans	-162.2	120.6	143.9	-109.3	-21.6	0	0	0	111.3
19	L	29.3	Very low	30.3	Very low	141 Å²	141	160.9 Å²	160.9	74%	0.738	81%	0.807	S	S	*	*			trans	-71.2	148.9	173.6	-78.3	80.5	0	0	0	110.5	F17	F17-L19 HydrophobicContact CD1-CD1 4.11Å; F17-L19 HydrophobicContact CE1-CD1 4.21Å
20	S	32.5	Very low	30.1	Very low	107 Å²	107	160 Å²	160	75%	0.748	80%	0.801	S	S	*	*				-173	111.5	122.3	-162.8	0	0	0	0	112.9
21	T	30.4	Very low	30.5	Very low	112 Å²	112	155.4 Å²	155.4	69%	0.687	80%	0.8	S	S	*	*			trans	13	132.1	147	57.1	0	0	0	0	121.8
22	K	32.6	Very low	30.3	Very low	188 Å²	188	155.7 Å²	155.7	82%	0.817	79%	0.79	S	S	*	*				177.4	127	104.5	-92.2	174.3	-177.9	-176.5	0	113.5
23	H	30.5	Very low	30.3	Very low	163 Å²	163	153.2 Å²	153.2	76%	0.755	77%	0.767	S	S	*	*			trans	22.1	146.2	143.9	-66	-76.9	0	0	0	121.3
24	L	30.9	Very low	30.3	Very low	139 Å²	139	147.8 Å²	147.8	73%	0.728	75%	0.747	S	S	*	*			cis	-162.8	148.5	33	-96.7	110	0	0	0	110
25	F	29.5	Very low	30.2	Very low	173 Å²	173	146.4 Å²	146.4	76%	0.759	74%	0.742	S	S	*	*			trans	43.1	135.1	136.2	-70.3	-108.5	0	0	0	119.9
26	T	33.2	Very low	30	Very low	111 Å²	111	141.1 Å²	141.1	68%	0.681	73%	0.73	S	S	*	*			cis	-175.9	132.4	32	20.8	0	0	0	0	113
27	T	31.5	Very low	30	Very low	135 Å²	135	140.7 Å²	140.7	83%	0.828	73%	0.729	S	S	*	*			trans	53.2	149.6	140.6	50.5	0	0	0	0	126.6
28	P	34.5	Very low	30	Very low	106 Å²	106	143.7 Å²	143.7	69%	0.688	74%	0.735	S	S	*	*			trans	-126.6	174.7	-150.8	40.2	-21.5	0	0	0	116.3
29	Y	32.2	Very low	29.9	Very low	248 Å²	248	143.3 Å²	143.3	97%	0.973	73%	0.728	S	S	*	*			trans	-140.5	136.7	157.9	-86.5	-81.3	0	0	0	112.2
30	S	27.4	Very low	29.8	Very low	93 Å²	93	142 Å²	142	65%	0.65	73%	0.725	S	S	*	*			trans	-114.9	148.2	-163.8	163.5	0	0	0	0	111.5
31	V	33.3	Very low	29.5	Very low	151 Å²	151	146.7 Å²	146.7	92%	0.915	73%	0.727	S	S	*	*			trans	-146.7	132.7	149.3	-170.4	0	0	0	0	111
32	N	26.4	Very low	29.5	Very low	92 Å²	92	149.2 Å²	149.2	49%	0.492	74%	0.735	S	S	.	*			trans	-111.8	137.8	-167.5	-113.2	-33.6	0	0	0	112.1
33	K	28.2	Very low	29.4	Very low	86 Å²	86	146.8 Å²	146.8	37%	0.374	73%	0.73	S	S	.	*				58.6	145	125.1	-77.6	-163.4	-69.7	111.8	0	127.5	T182 G183	K33-T182 VanDerWaalsContact CE-O 3.24Å; K33-T182 WeakPolarHBondContact CE-O 3.49Å; K33-T182 VanDerWaalsContact NZ-CB 3.29Å; K33-T182 PolarHBondContact NZ-O 3.41Å; K33-G183 VanDerWaalsContact CE-N 3.31Å
34	I	25.9	Very low	29.3	Very low	103 Å²	103	146.2 Å²	146.2	53%	0.528	73%	0.732	S	S	.	*				127.6	134.4	121.9	-80.7	130.7	0	0	0	115.1	I36	I34-I36 HydrophobicContact CG2-CD1 4.29Å; I34-I36 HydrophobicContact CG2-CG1 4.07Å
35	W	24.2	Very low	29.3	Very low	217 Å²	217	149.4 Å²	149.4	82%	0.822	74%	0.741	S	S	*	*			trans	-125.8	138.8	162.7	-95.9	86	0	0	0	110
36	I	27.4	Very low	29.5	Very low	128 Å²	128	146.5 Å²	146.5	66%	0.656	73%	0.733	S	S	*	*			trans	-136.5	139.4	174.1	-67.4	175.6	0	0	0	108.1	I34 V186	I34-I36 HydrophobicContact CG2-CD1 4.29Å; I34-I36 HydrophobicContact CG2-CG1 4.07Å; I36-V186 HydrophobicContact CG1-CG2 4.22Å
37	S	29.7	Very low	29.5	Very low	109 Å²	109	150.1 Å²	150.1	76%	0.762	73%	0.734	S	S	*	*			trans	-104.3	155.7	175	68.9	0	0	0	0	112.3
38	R	28.4	Very low	29.6	Very low	251 Å²	251	149.6 Å²	149.6	95%	0.947	73%	0.726	S	S	*	*			trans	-144.2	169	165.2	-98	-170	177.1	-161.5	-0.1	110.9
39	Q	29.6	Very low	29.5	Very low	157 Å²	157	153.5 Å²	153.5	73%	0.734	73%	0.733	S	S	*	*				-135.9	146.6	-129.8	-156.4	179.6	-2.6	0	0	111.1
40	T	28	Very low	29.5	Very low	112 Å²	112	146.1 Å²	146.1	69%	0.687	72%	0.717	S	S	*	*			trans	62.9	153.9	150.4	24.4	0	0	0	0	119.6
41	R	25.4	Very low	29.9	Very low	206 Å²	206	146.5 Å²	146.5	78%	0.777	72%	0.72	S	S	*	*			cis	-173.3	160.2	3.6	-171.8	-174.8	-74.7	-171.3	-3.1	105.3
42	I	30.9	Very low	29.9	Very low	166 Å²	166	147.8 Å²	147.8	85%	0.851	72%	0.72	S	S	*	*			trans	168.3	154.3	141.8	-83.1	153.1	0	0	0	112.3
43	D	30.4	Very low	30.3	Very low	136 Å²	136	146.9 Å²	146.9	73%	0.727	73%	0.733	S	S	*	*			trans	-82.9	173.3	-151.5	-60.1	-67.2	0	0	0	120.1
44	L	28.5	Very low	30.5	Very low	152 Å²	152	149 Å²	149	80%	0.796	76%	0.755	S	S	*	*			trans	-64	155	179.5	-65.7	108.8	0	0	0	115.8
45	F	31.5	Very low	31	Very low	206 Å²	206	153.9 Å²	153.9	90%	0.904	77%	0.773	S	S	*	*				-172.2	139.1	111.2	-118.9	-94.2	0	0	0	114.8
46	D	33.2	Very low	31.4	Very low	111 Å²	111	148.9 Å²	148.9	59%	0.594	77%	0.771	S	S	*	*			trans	-40.1	166.6	165.3	-107.1	-9.7	0	0	0	116.2
47	R	33.6	Very low	31.7	Very low	188 Å²	188	147.1 Å²	147.1	71%	0.709	77%	0.77	S	S	*	*			cis	-176.7	165.2	13.8	-132.5	175.5	-135.8	-151.4	4.8	111.1
48	N	33.2	Very low	32	Very low	123 Å²	123	148.6 Å²	148.6	66%	0.658	78%	0.775	S	S	*	*			trans	74.2	125.6	148.1	-58.5	-28.5	0	0	0	120.6
49	F	32.2	Very low	32.2	Very low	189 Å²	189	144.4 Å²	144.4	83%	0.829	77%	0.771	S	S	*	*				-175.3	136	80.7	-129.6	-92.4	0	0	0	111.8
50	S	32	Very low	32.5	Very low	92 Å²	92	142.6 Å²	142.6	64%	0.643	78%	0.776	S	S	*	*			trans	-67.9	145.5	167.9	48.4	0	0	0	0	111.8
51	S	35.2	Very low	32.9	Very low	101 Å²	101	143.5 Å²	143.5	71%	0.706	78%	0.784	S	S	*	*				153.8	146.7	82.8	53	0	0	0	0	107.4
52	L	35	Very low	33.2	Very low	178 Å²	178	137.6 Å²	137.6	93%	0.932	79%	0.787	S	S	*	*			trans	170.1	125.7	132.6	-89.7	155.7	0	0	0	109.5
53	G	34.5	Very low	33.4	Very low	74 Å²	74	138.5 Å²	138.5	76%	0.763	79%	0.787	S	S	*	*			trans	-87.9	-172.9	-169.6	0	0	0	0	0	115.9
54	P	32.4	Very low	33.7	Very low	129 Å²	129	141.7 Å²	141.7	84%	0.838	80%	0.795	S	S	*	*			trans	-99.9	164	-162	38	-32.3	0	0	0	113.5
55	K	35.5	Very low	34.3	Very low	207 Å²	207	142.3 Å²	142.3	90%	0.9	80%	0.797	S	S	*	*			trans	-132	133.3	164.7	-80.7	-173.6	176.2	-180	0	111.6
56	S	32.4	Very low	34.5	Very low	111 Å²	111	139.9 Å²	139.9	78%	0.776	79%	0.794	S	S	*	*			trans	-55.4	168.1	163.3	62.3	0	0	0	0	111.6
57	S	33.6	Very low	34.9	Very low	92 Å²	92	138.6 Å²	138.6	64%	0.643	80%	0.799	S	S	*	*			cis	176.6	150.8	38.3	37.2	0	0	0	0	106.8
58	T	36.2	Very low	35.1	Very low	140 Å²	140	138.6 Å²	138.6	86%	0.859	80%	0.804	S	S	*	*				158.5	125.6	116.2	44.4	0	0	0	0	112.2
59	D	32.6	Very low	35.4	Very low	162 Å²	162	138.9 Å²	138.9	87%	0.866	81%	0.81	S	S	*	*			trans	-62.1	154	174.4	-81.7	-48	0	0	0	114.9
60	S	37.5	Very low	35.8	Very low	119 Å²	119	135.5 Å²	135.5	83%	0.832	80%	0.804	S	S	*	*			trans	-150.7	143.3	143.5	-73	0	0	0	0	111
61	P	34.6	Very low	36.1	Very low	131 Å²	131	136 Å²	136	85%	0.851	81%	0.805	S	S	*	*			trans	-103.8	148.3	-154.8	35.9	-26.3	0	0	0	114.5
62	G	31.9	Very low	36.5	Very low	82 Å²	82	140.8 Å²	140.8	85%	0.845	81%	0.813	S	S	*	*			trans	102.6	83	150.6	0	0	0	0	0	116.7
63	E	35.3	Very low	37.1	Very low	185 Å²	185	138.9 Å²	138.9	86%	0.864	80%	0.803	S	S	*	*			trans	-133.1	121.3	158.9	-159.6	168.2	-176.1	0	0	110.5	I65	E63-I65 PolarHBondContact O-N 2.53Å
64	K	36.3	Very low	37.4	Very low	203 Å²	203	145.1 Å²	145.1	88%	0.883	81%	0.809	S	S	*	*			trans	-60	118.6	179.7	-70.2	173.6	176.2	175.5	0	109	N66	K64-N66 VanDerWaalsContact C-N 3.32Å; K64-N66 PolarHBondContact O-N 3.29Å
65	I	40.9	Very low	38	Very low	166 Å²	166	142.3 Å²	142.3	85%	0.851	79%	0.79	S	S	*	*			trans	-66	94.8	173.8	-57.6	174.6	0	0	0	108.4	E63 A67	E63-I65 PolarHBondContact O-N 2.53Å; I65-A67 PolarHBondContact O-N 3.05Å; I65-A67 VanDerWaalsContact O-N 3.15Å
66	N	36.3	Very low	38.4	Very low	155 Å²	155	137.4 Å²	137.4	83%	0.829	78%	0.781	S	S	*	*			trans	-77	93.8	170.3	-140.9	-14.3	0	0	0	106.2	K64 K68	K64-N66 VanDerWaalsContact C-N 3.32Å; K64-N66 PolarHBondContact O-N 3.29Å; N66-K68 PolarHBondContact O-N 3.46Å
67	A	41.6	Very low	39	Very low	84 Å²	84	136.8 Å²	136.8	69%	0.694	77%	0.765	S	S	*	*			trans	-66.3	84.5	177.4	0	0	0	0	0	109.5	I65 V69	I65-A67 PolarHBondContact O-N 3.05Å; I65-A67 VanDerWaalsContact O-N 3.15Å; A67-V69 PolarHBondContact O-N 3.23Å
68	K	37.9	Very low	39.5	Very low	187 Å²	187	137.5 Å²	137.5	81%	0.813	77%	0.77	S	S	*	*			trans	-68.3	98.8	173.1	-165.8	176.9	-174.7	179.9	0	107.1	N66 V70	N66-K68 PolarHBondContact O-N 3.46Å; K68-V70 PolarHBondContact O-N 2.83Å
69	V	39	Very low	39.8	Very low	130 Å²	130	140.2 Å²	140.2	79%	0.788	77%	0.765	S	S	*	*			trans	-57.5	104.8	169.9	178.5	0	0	0	0	107.1	A67 P71	A67-V69 PolarHBondContact O-N 3.23Å; V69-P71 VanDerWaalsContact O-CD 3.27Å; V69-P71 WeakPolarHBondContact O-CD 3.34Å
70	V	40.8	Very low	40.4	Very low	118 Å²	118	137.8 Å²	137.8	72%	0.715	75%	0.753	S	S	*	*			trans	-71.2	114.2	174.4	-178.8	0	0	0	0	106.5	K68 K72	K68-V70 PolarHBondContact O-N 2.83Å; V70-K72 PolarHBondContact O-N 3.3Å
71	P	39.6	Very low	40.8	Very low	102 Å²	102	138.8 Å²	138.8	66%	0.662	75%	0.749	S	S	*	*			trans	-59.5	133.9	177.3	24.4	-32	0	0	0	108.8	V69 I73	V69-P71 VanDerWaalsContact O-CD 3.27Å; V69-P71 WeakPolarHBondContact O-CD 3.34Å; P71-I73 PolarHBondContact O-N 3.47Å
72	K	42.8	Very low	41.2	Very low	201 Å²	201	133.9 Å²	133.9	87%	0.874	72%	0.718	S	S	*	*			trans	-50.7	118	173.6	-149.3	177.2	-171.3	-179.1	0	107.3	V70 K74	V70-K72 PolarHBondContact O-N 3.3Å; K72-K74 PolarHBondContact O-N 3.27Å
73	I	47	Very low	41.8	Very low	139 Å²	139	134.9 Å²	134.9	71%	0.713	71%	0.707	S	S	*	*			trans	-56	111.4	-178.1	-56.7	173.1	0	0	0	106.8	P71 T75	P71-I73 PolarHBondContact O-N 3.47Å; I73-T75 HydrophobicContact CB-CG2 4.43Å; I73-T75 HydrophobicContact CG2-CG2 3.62Å; I73-T75 PolarHBondContact O-N 3.08Å
74	K	42	Very low	42.2	Very low	205 Å²	205	134.1 Å²	134.1	89%	0.891	70%	0.701	S	S	*	*			trans	-74.1	74.3	170.3	-73.9	-174.1	179	-179.4	0	107.2	K72	K72-K74 PolarHBondContact O-N 3.27Å
75	T	45.4	Very low	42.9	Very low	70 Å²	70	127.1 Å²	127.1	43%	0.429	68%	0.678	S	S	.	*			trans	-64.2	141	168.8	46.9	0	0	0	0	108.7	I73 F77	I73-T75 HydrophobicContact CB-CG2 4.43Å; I73-T75 HydrophobicContact CG2-CG2 3.62Å; I73-T75 PolarHBondContact O-N 3.08Å; T75-F77 CarbonylContact O-C 3.52Å; T75-F77 PolarHBondContact O-N 3.09Å; T75-F77 PolarHBondContact OG1-O 3.29Å; T75-F77 VanDerWaalsContact OG1-O 3.14Å
76	S	42.9	Very low	43.7	Very low	104 Å²	104	121 Å²	121	73%	0.727	65%	0.648	S	S	*	*	S	Bend	trans	-58.5	-14.2	166.9	60.2	0	0	0	0	112.6	S78	S76-S78 PolarHBondContact O-N 3.47Å
77	F	45.7	Very low	45.3	Very low	97 Å²	97	118.4 Å²	118.4	43%	0.425	63%	0.629	S	S	.	*			trans	-70.4	90.5	164.3	-60.3	-76.1	0	0	0	109.7	T75 Y79 A492 L496	T75-F77 CarbonylContact O-C 3.52Å; T75-F77 PolarHBondContact O-N 3.09Å; T75-F77 PolarHBondContact OG1-O 3.29Å; T75-F77 VanDerWaalsContact OG1-O 3.14Å; F77-Y79 PolarHBondContact O-N 3.19Å; F77-A492 HydrophobicContact CD2-CB 4.07Å; F77-A492 HydrophobicContact CE2-CB 3.4Å; F77-A492 VanDerWaalsContact CE2-CB 3.4Å; F77-A492 HydrophobicContact CZ-CB 4.24Å; F77-L496 HydrophobicContact CE1-CD1 4.49Å; F77-L496 HydrophobicContact CZ-CD1 4.47Å
78	S	42.3	Very low	47.1	Very low	107 Å²	107	118.2 Å²	118.2	75%	0.748	61%	0.611	S	S	*	*			trans	-61.2	123.9	160	-173.5	0	0	0	0	107.9	S76 D80	S76-S78 PolarHBondContact O-N 3.47Å; S78-D80 VanDerWaalsContact C-N 3.28Å; S78-D80 PolarHBondContact O-N 3.44Å
79	Y	42.8	Very low	49.2	Very low	197 Å²	197	109.4 Å²	109.4	77%	0.773	57%	0.573	S	S	*	*			trans	-67.7	95.9	166.5	-169.5	-90.8	0	0	0	106.3	F77 D81	F77-Y79 PolarHBondContact O-N 3.19Å; Y79-D81 WeakPolarHBondContact CD1-OD1 3.34Å; Y79-D81 WeakPolarHBondContact CE1-OD1 3.3Å; Y79-D81 PolarHBondContact O-N 3.28Å
80	D	45.2	Very low	51.5	Low	111 Å²	111	105.6 Å²	105.6	59%	0.594	55%	0.55	S	S	*	.			trans	-72.9	111.6	168.1	-174.1	18.3	0	0	0	106.3	S78 S82	S78-D80 VanDerWaalsContact C-N 3.28Å; S78-D80 PolarHBondContact O-N 3.44Å; D80-S82 PolarHBondContact O-N 3.49Å; D80-S82 WeakPolarHBondContact OD1-CB 3.39Å; D80-S82 WeakPolarHBondContact OD2-CB 3.33Å; D80-S82 PolarHBondContact OD2-OG 3.46Å
81	D	46.1	Very low	53.7	Low	141 Å²	141	101.6 Å²	101.6	75%	0.754	53%	0.526	S	S	*	.			trans	-61.4	7.8	178.8	-81.1	-31.5	0	0	0	113.4	Y79 V83	Y79-D81 WeakPolarHBondContact CD1-OD1 3.34Å; Y79-D81 WeakPolarHBondContact CE1-OD1 3.3Å; Y79-D81 PolarHBondContact O-N 3.28Å; D81-V83 PolarHBondContact O-N 3.21Å
82	S	42.6	Very low	55.9	Low	28 Å²	28	103.6 Å²	103.6	20%	0.196	53%	0.531	C	S	.	.	S	Bend	trans	-76.4	119.2	179.8	84.1	0	0	0	0	109.8	D80 V86	D80-S82 PolarHBondContact O-N 3.49Å; D80-S82 WeakPolarHBondContact OD1-CB 3.39Å; D80-S82 WeakPolarHBondContact OD2-CB 3.33Å; D80-S82 PolarHBondContact OD2-OG 3.46Å; S82-V86 VanDerWaalsContact OG-CB 3.24Å; S82-V86 WeakPolarHBondContact OG-CB 3.28Å; S82-V86 WeakPolarHBondContact OG-CG1 3.49Å
83	V	44.5	Very low	57.9	Low	102 Å²	102	98.1 Å²	98.1	62%	0.618	50%	0.504	S	S	*	.			trans	-39.1	148.6	179.3	-179.3	0	0	0	0	110.8	D81 S85 V86 K87	D81-V83 PolarHBondContact O-N 3.21Å; V83-S85 WeakPolarHBondContact CG1-OG 3.28Å; V83-S85 CarbonylContact O-C 3.57Å; V83-S85 PolarHBondContact O-N 2.94Å; V83-V86 HydrophobicContact CB-CG2 4.17Å; V83-V86 VanDerWaalsContact O-CA 3.23Å; V83-V86 WeakPolarHBondContact O-CA 3.46Å; V83-V86 WeakPolarHBondContact O-CB 3.49Å; V83-V86 WeakPolarHBondContact O-CG2 3.42Å; V83-V86 PolarHBondContact O-N 3Å; V83-K87 PolarHBondContact O-N 3.19Å
84	K	44.6	Very low	59.7	Low	169 Å²	169	91.5 Å²	91.5	74%	0.735	47%	0.471	S	S	*	.	H	α-helix	trans	-46.1	-29	177.8	-101.2	-176.2	178.9	-179.3	0	115	V86 K87 Y88	K84-V86 PolarHBondContact O-N 2.91Å; K84-K87 PolarHBondContact O-N 3.5Å; K84-Y88 PolarHBondContact O-N 3.24Å; K84-Y88 VanDerWaalsContact O-N 3.1Å
85	S	51	Low	61.9	Low	57 Å²	57	84.6 Å²	84.6	40%	0.399	44%	0.443	S	S	.	.	H	α-helix	trans	-65.2	-9.7	171.6	60.7	0	0	0	0	114.8	V83	V83-S85 WeakPolarHBondContact CG1-OG 3.28Å; V83-S85 CarbonylContact O-C 3.57Å; V83-S85 PolarHBondContact O-N 2.94Å
86	V	57.2	Low	63.7	Low	38 Å²	38	86.8 Å²	86.8	23%	0.23	44%	0.444	C	S	.	.	H	α-helix	trans	-105.7	-32.1	175.8	-165	0	0	0	0	111.3	S82 V83 K84 R128	S82-V86 VanDerWaalsContact OG-CB 3.24Å; S82-V86 WeakPolarHBondContact OG-CB 3.28Å; S82-V86 WeakPolarHBondContact OG-CG1 3.49Å; V83-V86 HydrophobicContact CB-CG2 4.17Å; V83-V86 VanDerWaalsContact O-CA 3.23Å; V83-V86 WeakPolarHBondContact O-CA 3.46Å; V83-V86 WeakPolarHBondContact O-CB 3.49Å; V83-V86 WeakPolarHBondContact O-CG2 3.42Å; V83-V86 PolarHBondContact O-N 3Å; K84-V86 PolarHBondContact O-N 2.91Å; V86-R128 WeakPolarHBondContact O-CB 3.46Å; V86-R128 WeakPolarHBondContact O-CD 3.22Å; V86-R128 WeakPolarHBondContact O-CG 3.5Å
87	K	70.2	Confident	65.6	Low	99 Å²	99	84 Å²	84	43%	0.43	42%	0.419	S	S	.	.	H	α-helix	trans	-76.5	-43.7	173.7	-167.6	167.7	-176.2	171.7	0	113.4	V83 K84 L127 R128	V83-K87 PolarHBondContact O-N 3.19Å; K84-K87 PolarHBondContact O-N 3.5Å; K87-L127 HydrophobicContact CG-CD1 3.89Å; K87-R128 PolarHBondContact O-N 3.44Å
88	Y	79.6	Confident	67.5	Low	80 Å²	80	79.4 Å²	79.4	31%	0.314	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	144.4	-177.2	-66.4	-73.9	0	0	0	112	K84 Y111 V125 F126 L127	K84-Y88 PolarHBondContact O-N 3.24Å; K84-Y88 VanDerWaalsContact O-N 3.1Å; Y88-Y111 HydrophobicContact CE1-CD1 4.22Å; Y88-Y111 HydrophobicContact CE1-CD2 4.1Å; Y88-Y111 AromaticContact CE1-CG 3.86Å; Y88-Y111 HydrophobicContact CE1-CG 3.86Å; Y88-V125 HydrophobicContact CD1-CB 4.49Å; Y88-V125 HydrophobicContact CD1-CG2 3.86Å; Y88-V125 HydrophobicContact CG-CG2 4.06Å; Y88-F126 CarbonylContact C-O 3.59Å; Y88-F126 VanDerWaalsContact CA-O 3.29Å; Y88-F126 WeakPolarHBondContact CA-O 3.47Å; Y88-L127 HydrophobicContact CD1-CD1 4.21Å; Y88-L127 HydrophobicContact CE1-CD1 3.77Å
89	I	82.2	Confident	69.5	Low	2 Å²	2	76.1 Å²	76.1	1%	0.01	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	136.5	178.7	-170.4	163	0	0	0	110.7	R93 A94 Y98 V125 F126 V131	I89-R93 HydrophobicContact CD1-CB 3.83Å; I89-R93 HydrophobicContact CG1-CB 3.49Å; I89-R93 VanDerWaalsContact CG1-CB 3.49Å; I89-A94 HydrophobicContact CD1-CB 4.26Å; I89-A94 HydrophobicContact CG1-CB 4.22Å; I89-A94 HydrophobicContact CG2-CB 4.04Å; I89-Y98 HydrophobicContact CD1-CD2 3.64Å; I89-Y98 HydrophobicContact CD1-CE2 3.34Å; I89-V125 WeakPolarHBondContact O-CA 3.46Å; I89-F126 HydrophobicContact CG2-CB 4.22Å; I89-F126 PolarHBondContact N-O 3.33Å; I89-F126 PolarHBondContact O-N 2.96Å; I89-V131 HydrophobicContact CG2-CB 4.1Å; I89-V131 HydrophobicContact CG2-CG1 4.22Å; I89-V131 HydrophobicContact CG2-CG2 3.63Å
90	T	86.5	Confident	71.7	Confident	50 Å²	50	67.1 Å²	67.1	31%	0.307	34%	0.337	S	S	.	.			trans	-72.7	151.2	176.3	55.5	0	0	0	0	110.4	L92 R93 A94 T123 V125	T90-L92 PolarHBondContact O-N 2.83Å; T90-L92 VanDerWaalsContact O-N 3.16Å; T90-R93 PolarHBondContact O-N 3.28Å; T90-R93 WeakPolarHBondContact OG1-CG 3.24Å; T90-A94 PolarHBondContact O-N 3.45Å; T90-T123 HydrophobicContact CG2-CG2 4.44Å; T90-V125 HydrophobicContact CG2-CG1 4.2Å
91	P	87.2	Confident	73.8	Confident	34 Å²	34	64.7 Å²	64.7	22%	0.221	33%	0.327	C	S	.	.	H	α-helix	trans	-49.7	-44.8	179.4	-23.5	23.9	0	0	0	113	R93 A94 L95 L105 L124 F126	P91-R93 PolarHBondContact O-N 3.2Å; P91-A94 PolarHBondContact O-N 2.82Å; P91-L95 VanDerWaalsContact O-CG 3.31Å; P91-L95 WeakPolarHBondContact O-CG 3.45Å; P91-L95 PolarHBondContact O-N 3.09Å; P91-L105 HydrophobicContact CB-CD1 4.26Å; P91-L124 WeakPolarHBondContact CD-O 3.42Å; P91-L124 HydrophobicContact CG-CB 4.24Å; P91-L124 HydrophobicContact CG-CD2 3.76Å; P91-L124 HydrophobicContact CG-CG 3.93Å; P91-F126 HydrophobicContact CB-CE2 3.9Å; P91-F126 HydrophobicContact CG-CD2 4.26Å; P91-F126 HydrophobicContact CG-CE2 3.71Å
92	L	85.3	Confident	75.9	Confident	145 Å²	145	65.4 Å²	65.4	76%	0.759	32%	0.323	S	S	*	.	H	α-helix	trans	-61.4	-41.7	177.7	-80.6	163	0	0	0	113	T90 R96	T90-L92 PolarHBondContact O-N 2.83Å; T90-L92 VanDerWaalsContact O-N 3.16Å; L92-R96 VanDerWaalsContact O-CB 3.25Å; L92-R96 WeakPolarHBondContact O-CB 3.47Å; L92-R96 PolarHBondContact O-N 2.7Å
93	R	84.8	Confident	78.1	Confident	85 Å²	85	71.2 Å²	71.2	32%	0.321	35%	0.347	S	S	.	.	H	α-helix	trans	-71.4	-36.9	176.4	-74	-176.5	69.6	-151.7	-8.1	111.2	I89 T90 P91 R96 E97	I89-R93 HydrophobicContact CD1-CB 3.83Å; I89-R93 HydrophobicContact CG1-CB 3.49Å; I89-R93 VanDerWaalsContact CG1-CB 3.49Å; T90-R93 PolarHBondContact O-N 3.28Å; T90-R93 WeakPolarHBondContact OG1-CG 3.24Å; P91-R93 PolarHBondContact O-N 3.2Å; R93-R96 PolarHBondContact O-N 2.82Å; R93-E97 IonicContact CZ-OE1 3.58Å; R93-E97 VanDerWaalsContact CZ-OE1 3.22Å; R93-E97 IonicContact NE-OE1 2.8Å; R93-E97 PolarHBondContact NE-OE1 2.96Å; R93-E97 IonicContact NH2-OE1 3.66Å; R93-E97 PolarHBondContact NH2-OE1 3.37Å; R93-E97 IonicContact NH2-OE2 2.73Å; R93-E97 PolarHBondContact NH2-OE2 3.47Å; R93-E97 VanDerWaalsContact O-CB 3.24Å; R93-E97 WeakPolarHBondContact O-CB 3.36Å; R93-E97 WeakPolarHBondContact O-CG 3.49Å; R93-E97 PolarHBondContact O-N 2.88Å
94	A	86.4	Confident	80.3	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-64.2	-47.6	178	0	0	0	0	0	111.6	I89 T90 P91 R96 Y98 L105 V131	I89-A94 HydrophobicContact CD1-CB 4.26Å; I89-A94 HydrophobicContact CG1-CB 4.22Å; I89-A94 HydrophobicContact CG2-CB 4.04Å; T90-A94 PolarHBondContact O-N 3.45Å; P91-A94 PolarHBondContact O-N 2.82Å; A94-R96 VanDerWaalsContact C-N 3.29Å; A94-R96 PolarHBondContact O-N 3.19Å; A94-Y98 VanDerWaalsContact O-CB 3.3Å; A94-Y98 WeakPolarHBondContact O-CB 3.49Å; A94-Y98 PolarHBondContact O-N 2.99Å; A94-Y98 VanDerWaalsContact O-N 3.14Å; A94-L105 HydrophobicContact CB-CD1 4.22Å; A94-L105 HydrophobicContact CB-CD2 3.75Å; A94-V131 HydrophobicContact CB-CG1 3.95Å; A94-V131 HydrophobicContact CB-CG2 4.18Å
95	L	87.4	Confident	82.4	Confident	61 Å²	61	59.8 Å²	59.8	32%	0.319	29%	0.29	S	S	.	.	H	α-helix	trans	-57.3	-43.6	174.6	-66.6	172.4	0	0	0	111.9	P91 M99 L100 T101 L105	P91-L95 VanDerWaalsContact O-CG 3.31Å; P91-L95 WeakPolarHBondContact O-CG 3.45Å; P91-L95 PolarHBondContact O-N 3.09Å; L95-M99 WeakPolarHBondContact O-CA 3.3Å; L95-M99 PolarHBondContact O-N 3.34Å; L95-L100 WeakPolarHBondContact CA-O 3.5Å; L95-L100 WeakPolarHBondContact CD2-O 3.5Å; L95-T101 WeakPolarHBondContact CD2-O 3.46Å; L95-L105 HydrophobicContact CD1-CD1 4.41Å; L95-L105 HydrophobicContact CD2-CD1 3.6Å; L95-L105 HydrophobicContact CD2-CG 4.1Å; L95-L105 HydrophobicContact CG-CD1 3.65Å
96	R	82.9	Confident	84.2	Confident	115 Å²	115	61.1 Å²	61.1	43%	0.434	29%	0.293	S	S	.	.	H	α-helix	trans	-79.7	-51.2	-173.1	-176.2	-174.3	176.1	158.7	11.3	113.8	L92 R93 A94 E156 K160	L92-R96 VanDerWaalsContact O-CB 3.25Å; L92-R96 WeakPolarHBondContact O-CB 3.47Å; L92-R96 PolarHBondContact O-N 2.7Å; R93-R96 PolarHBondContact O-N 2.82Å; A94-R96 VanDerWaalsContact C-N 3.29Å; A94-R96 PolarHBondContact O-N 3.19Å; R96-E156 WeakPolarHBondContact CG-OE1 3.41Å; R96-E156 IonicContact CZ-OE1 2.75Å; R96-E156 IonicContact CZ-OE2 3.35Å; R96-E156 VanDerWaalsContact CZ-OE2 3.27Å; R96-E156 VanDerWaalsContact NE-CD 3.29Å; R96-E156 IonicContact NE-OE1 2.73Å; R96-E156 PolarHBondContact NE-OE1 3.03Å; R96-E156 IonicContact NE-OE2 2.73Å; R96-E156 PolarHBondContact NE-OE2 3.36Å; R96-E156 IonicContact NH2-OE1 2.79Å; R96-E156 PolarHBondContact NH2-OE1 3.08Å; R96-E156 VanDerWaalsContact NH2-OE1 3.16Å; R96-E156 IonicContact NH2-OE2 3.28Å; R96-E156 PolarHBondContact NH2-OE2 3.25Å; R96-K160 VanDerWaalsContact NH2-NZ 3.17Å
97	E	83	Confident	85.6	Confident	46 Å²	46	65.7 Å²	65.7	22%	0.215	31%	0.312	C	S	.	.	H	α-helix	trans	-79.9	-25.5	-173.3	-65	-176.4	-156.4	0	0	112.8	R93 R149	R93-E97 IonicContact CZ-OE1 3.58Å; R93-E97 VanDerWaalsContact CZ-OE1 3.22Å; R93-E97 IonicContact NE-OE1 2.8Å; R93-E97 PolarHBondContact NE-OE1 2.96Å; R93-E97 IonicContact NH2-OE1 3.66Å; R93-E97 PolarHBondContact NH2-OE1 3.37Å; R93-E97 IonicContact NH2-OE2 2.73Å; R93-E97 PolarHBondContact NH2-OE2 3.47Å; R93-E97 VanDerWaalsContact O-CB 3.24Å; R93-E97 WeakPolarHBondContact O-CB 3.36Å; R93-E97 WeakPolarHBondContact O-CG 3.49Å; R93-E97 PolarHBondContact O-N 2.88Å; E97-R149 IonicContact OE2-NH2 3.16Å
98	Y	86.2	Confident	86.6	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.295	C	S	.	.	S	Bend	trans	-112.8	4.2	-177.1	-66.7	-89.5	0	0	0	113.9	I89 A94 L100 R128 V131 E132 A135 H139 F145	I89-Y98 HydrophobicContact CD1-CD2 3.64Å; I89-Y98 HydrophobicContact CD1-CE2 3.34Å; A94-Y98 VanDerWaalsContact O-CB 3.3Å; A94-Y98 WeakPolarHBondContact O-CB 3.49Å; A94-Y98 PolarHBondContact O-N 2.99Å; A94-Y98 VanDerWaalsContact O-N 3.14Å; Y98-L100 PolarHBondContact O-N 3.45Å; Y98-R128 PolarHBondContact OH-NE 2.98Å; Y98-R128 PolarHBondContact OH-NH2 3.47Å; Y98-V131 HydrophobicContact CD1-CG1 4.07Å; Y98-V131 HydrophobicContact CD2-CG1 3.55Å; Y98-V131 HydrophobicContact CE2-CG1 4.09Å; Y98-V131 HydrophobicContact CG-CG1 3.53Å; Y98-E132 HydrophobicContact CD1-CG 4.16Å; Y98-E132 HydrophobicContact CE1-CB 4.39Å; Y98-E132 HydrophobicContact CE1-CG 3.27Å; Y98-E132 PolarHBondContact OH-OE1 3Å; Y98-A135 HydrophobicContact CD1-CB 3.78Å; Y98-A135 HydrophobicContact CG-CB 4.36Å; Y98-H139 PolarHBondContact O-NE2 3.14Å; Y98-F145 AromaticContact CD1-CE1 3.96Å; Y98-F145 HydrophobicContact CD1-CE1 3.96Å; Y98-F145 HydrophobicContact CD1-CE2 4.08Å; Y98-F145 AromaticContact CD1-CZ 3.32Å; Y98-F145 HydrophobicContact CD1-CZ 3.32Å; Y98-F145 HydrophobicContact CE1-CE1 4.06Å; Y98-F145 AromaticContact CE1-CZ 3.84Å; Y98-F145 HydrophobicContact CE1-CZ 3.84Å; Y98-F145 HydrophobicContact CG-CZ 4.07Å
99	M	84.4	Confident	86.9	Confident	38 Å²	38	60.9 Å²	60.9	19%	0.187	30%	0.3	C	S	.	.			trans	55.5	26.3	176.6	-59.4	169.9	-71	0	0	113.3	L95 K138 H139 F145 R148 M152	L95-M99 WeakPolarHBondContact O-CA 3.3Å; L95-M99 PolarHBondContact O-N 3.34Å; M99-K138 PolarHBondContact O-NZ 3.06Å; M99-H139 VanDerWaalsContact CB-NE2 3.31Å; M99-H139 WeakPolarHBondContact CB-NE2 3.46Å; M99-H139 PolarHBondContact O-NE2 2.75Å; M99-F145 HydrophobicContact CE-CD2 3.77Å; M99-F145 HydrophobicContact CE-CE2 3.63Å; M99-R148 HydrophobicContact CE-CB 3.86Å; M99-R148 HydrophobicContact SD-CB 4.28Å; M99-M152 HydrophobicContact SD-CG 3.93Å
100	L	88.5	Confident	87.1	Confident	8 Å²	8	67.2 Å²	67.2	4%	0.042	32%	0.324	C	S	.	.			trans	-78.6	154	175	-64.8	-175.3	0	0	0	110.7	L95 Y98 D104 L105 V131 M134 A135 K138	L95-L100 WeakPolarHBondContact CA-O 3.5Å; L95-L100 WeakPolarHBondContact CD2-O 3.5Å; Y98-L100 PolarHBondContact O-N 3.45Å; L100-D104 HydrophobicContact CB-CB 4.13Å; L100-D104 HydrophobicContact CD2-CB 4.09Å; L100-L105 HydrophobicContact CB-CD2 4.49Å; L100-L105 HydrophobicContact CD1-CD2 3.91Å; L100-V131 HydrophobicContact CD1-CG1 3.83Å; L100-M134 HydrophobicContact CD1-CB 4.16Å; L100-M134 HydrophobicContact CD1-CG 3.99Å; L100-M134 HydrophobicContact CD2-CB 4.37Å; L100-M134 HydrophobicContact CD2-CG 3.79Å; L100-A135 HydrophobicContact CD2-CB 4.25Å; L100-K138 HydrophobicContact CD2-CD 3.94Å
101	T	89.4	Confident	86.9	Confident	60 Å²	60	68.8 Å²	68.8	37%	0.368	33%	0.325	S	S	.	.			trans	-96.4	166.7	171.7	64.2	0	0	0	0	109.8	L95 Q103 D104 L105	L95-T101 WeakPolarHBondContact CD2-O 3.46Å; T101-Q103 PolarHBondContact O-N 2.97Å; T101-D104 WeakPolarHBondContact CB-OD2 3.16Å; T101-D104 PolarHBondContact N-OD2 3.15Å; T101-D104 WeakPolarHBondContact O-CB 3.35Å; T101-D104 PolarHBondContact O-N 3.18Å; T101-D104 VanDerWaalsContact O-N 3.12Å; T101-D104 PolarHBondContact OG1-N 3.15Å; T101-D104 PolarHBondContact OG1-OD1 2.65Å; T101-D104 PolarHBondContact OG1-OD2 3.39Å; T101-L105 PolarHBondContact O-N 2.75Å
102	K	89.2	Confident	86.6	Confident	156 Å²	156	73.3 Å²	73.3	68%	0.678	34%	0.338	S	S	*	.	H	α-helix	trans	-59.6	-35.5	175.8	-167.6	-178.9	177.1	-174	0	111.8	D104 L105 D106	K102-D104 VanDerWaalsContact C-N 3.32Å; K102-D104 PolarHBondContact O-N 2.92Å; K102-L105 PolarHBondContact O-N 3.4Å; K102-D106 PolarHBondContact O-N 3.39Å
103	Q	89.8	Confident	86	Confident	151 Å²	151	69 Å²	69	71%	0.706	32%	0.32	S	S	*	.	H	α-helix	trans	-63.8	-37.3	176.5	-67.6	176.6	-16.3	0	0	112	T101 D106	T101-Q103 PolarHBondContact O-N 2.97Å; Q103-D106 PolarHBondContact O-N 3.26Å
104	D	89.7	Confident	85.1	Confident	24 Å²	24	70.1 Å²	70.1	13%	0.128	32%	0.324	C	S	.	.	H	α-helix	trans	-67.3	-39	176.8	-53.3	-35	0	0	0	111	L100 T101 K102 D106 Q107 M134 K138	L100-D104 HydrophobicContact CB-CB 4.13Å; L100-D104 HydrophobicContact CD2-CB 4.09Å; T101-D104 WeakPolarHBondContact CB-OD2 3.16Å; T101-D104 PolarHBondContact N-OD2 3.15Å; T101-D104 WeakPolarHBondContact O-CB 3.35Å; T101-D104 PolarHBondContact O-N 3.18Å; T101-D104 VanDerWaalsContact O-N 3.12Å; T101-D104 PolarHBondContact OG1-N 3.15Å; T101-D104 PolarHBondContact OG1-OD1 2.65Å; T101-D104 PolarHBondContact OG1-OD2 3.39Å; K102-D104 VanDerWaalsContact C-N 3.32Å; K102-D104 PolarHBondContact O-N 2.92Å; D104-D106 VanDerWaalsContact C-N 3.35Å; D104-Q107 PolarHBondContact O-N 3.04Å; D104-M134 HydrophobicContact CB-CG 4.03Å; D104-M134 HydrophobicContact CB-SD 4.37Å; D104-K138 WeakPolarHBondContact OD2-CD 3.26Å; D104-K138 WeakPolarHBondContact OD2-CE 3.45Å; D104-K138 IonicContact OD2-NZ 2.76Å; D104-K138 PolarHBondContact OD2-NZ 3.37Å
105	L	88.8	Confident	84	Confident	6 Å²	6	70.7 Å²	70.7	3%	0.031	33%	0.328	C	S	.	.	H	α-helix	trans	-71.1	-28.4	177.7	-66.5	-175.3	0	0	0	113.5	P91 A94 L95 L100 T101 K102 Q107 L108 F126 V131	P91-L105 HydrophobicContact CB-CD1 4.26Å; A94-L105 HydrophobicContact CB-CD1 4.22Å; A94-L105 HydrophobicContact CB-CD2 3.75Å; L95-L105 HydrophobicContact CD1-CD1 4.41Å; L95-L105 HydrophobicContact CD2-CD1 3.6Å; L95-L105 HydrophobicContact CD2-CG 4.1Å; L95-L105 HydrophobicContact CG-CD1 3.65Å; L100-L105 HydrophobicContact CB-CD2 4.49Å; L100-L105 HydrophobicContact CD1-CD2 3.91Å; T101-L105 PolarHBondContact O-N 2.75Å; K102-L105 PolarHBondContact O-N 3.4Å; L105-Q107 PolarHBondContact O-N 2.94Å; L105-L108 HydrophobicContact CD2-CD1 3.85Å; L105-L108 PolarHBondContact O-N 2.91Å; L105-L108 VanDerWaalsContact O-N 3.1Å; L105-F126 HydrophobicContact CB-CE1 4.5Å; L105-F126 HydrophobicContact CB-CE2 4.19Å; L105-F126 HydrophobicContact CB-CZ 3.94Å; L105-F126 HydrophobicContact CD1-CE2 4Å; L105-F126 HydrophobicContact CD2-CD2 4.29Å; L105-F126 HydrophobicContact CD2-CE2 4.26Å; L105-F126 HydrophobicContact CG-CE2 4.4Å; L105-F126 WeakPolarHBondContact O-CE1 3.33Å; L105-V131 HydrophobicContact CD2-CG2 4.44Å
106	D	89.1	Confident	82.5	Confident	85 Å²	85	73.3 Å²	73.3	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-67.5	-18.4	177	-76.4	-33.5	0	0	0	112.6	K102 Q103 D104 L108 R110	K102-D106 PolarHBondContact O-N 3.39Å; Q103-D106 PolarHBondContact O-N 3.26Å; D104-D106 VanDerWaalsContact C-N 3.35Å; D106-L108 VanDerWaalsContact C-N 3.35Å; D106-R110 IonicContact OD1-CZ 2.94Å; D106-R110 IonicContact OD1-NH2 3.96Å; D106-R110 PolarHBondContact OD1-NH2 3.24Å
107	Q	88.1	Confident	81.3	Confident	134 Å²	134	75.6 Å²	75.6	63%	0.626	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-12.9	173.8	-59.3	176	19.9	0	0	113.1	D104 L105 M134	D104-Q107 PolarHBondContact O-N 3.04Å; L105-Q107 PolarHBondContact O-N 2.94Å; Q107-M134 HydrophobicContact CB-CE 4.03Å
108	L	89.2	Confident	79.9	Confident	14 Å²	14	76.9 Å²	76.9	7%	0.073	38%	0.384	C	S	.	.	S	Bend	trans	-92.1	146.4	-175	-63.1	-178.2	0	0	0	112.4	L105 D106 R110 F126 D130 V131 M134	L105-L108 HydrophobicContact CD2-CD1 3.85Å; L105-L108 PolarHBondContact O-N 2.91Å; L105-L108 VanDerWaalsContact O-N 3.1Å; D106-L108 VanDerWaalsContact C-N 3.35Å; L108-R110 PolarHBondContact O-N 2.87Å; L108-F126 HydrophobicContact CB-CD1 3.66Å; L108-F126 HydrophobicContact CB-CE1 3.94Å; L108-F126 HydrophobicContact CD1-CD1 4.35Å; L108-D130 HydrophobicContact CD2-CB 3.9Å; L108-V131 HydrophobicContact CD1-CB 4.33Å; L108-V131 HydrophobicContact CD1-CG2 3.48Å; L108-V131 VanDerWaalsContact CD1-CG2 3.48Å; L108-M134 HydrophobicContact CD2-CB 4.24Å; L108-M134 HydrophobicContact CD2-CE 3.93Å
109	P	86.4	Confident	78.5	Confident	65 Å²	65	83.9 Å²	83.9	42%	0.422	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-57.9	131.2	172.4	-21.8	32.4	0	0	0	111.7	Y111 F126	P109-Y111 HydrophobicContact CB-CE2 3.84Å; P109-Y111 WeakPolarHBondContact O-CD2 3.48Å; P109-Y111 WeakPolarHBondContact O-CE2 3.32Å; P109-F126 WeakPolarHBondContact O-CD1 3.39Å
110	R	87.3	Confident	77.1	Confident	135 Å²	135	88 Å²	88	51%	0.509	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-91.6	125	-177.9	-67.1	-178.8	-179	165.5	-0.6	110.5	D106 L108 L124 F126	D106-R110 IonicContact OD1-CZ 2.94Å; D106-R110 IonicContact OD1-NH2 3.96Å; D106-R110 PolarHBondContact OD1-NH2 3.24Å; L108-R110 PolarHBondContact O-N 2.87Å; R110-L124 HydrophobicContact CB-CD1 3.71Å; R110-L124 HydrophobicContact CG-CD1 3.95Å; R110-F126 HydrophobicContact CG-CE1 3.97Å; R110-F126 HydrophobicContact CG-CZ 4.48Å
111	Y	83	Confident	75.7	Confident	82 Å²	82	93.9 Å²	93.9	32%	0.322	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	155.5	174.1	-57.2	-89.5	0	0	0	110	Y88 P109 L124 V125 L127	Y88-Y111 HydrophobicContact CE1-CD1 4.22Å; Y88-Y111 HydrophobicContact CE1-CD2 4.1Å; Y88-Y111 AromaticContact CE1-CG 3.86Å; Y88-Y111 HydrophobicContact CE1-CG 3.86Å; P109-Y111 HydrophobicContact CB-CE2 3.84Å; P109-Y111 WeakPolarHBondContact O-CD2 3.48Å; P109-Y111 WeakPolarHBondContact O-CE2 3.32Å; Y111-L124 WeakPolarHBondContact O-CA 3.49Å; Y111-V125 CarbonylContact C-O 3.52Å; Y111-V125 WeakPolarHBondContact CA-O 3.31Å; Y111-V125 WeakPolarHBondContact CB-O 3.27Å; Y111-V125 PolarHBondContact N-O 3.37Å; Y111-V125 PolarHBondContact O-N 3.36Å; Y111-L127 HydrophobicContact CD2-CB 4.45Å; Y111-L127 HydrophobicContact CE2-CB 3.85Å
112	Y	80.6	Confident	74.8	Confident	130 Å²	130	98.2 Å²	98.2	51%	0.51	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	127.2	-177.7	-71	-85	0	0	0	109.7	K122 T123 L124	Y112-K122 HydrophobicContact CD1-CB 3.95Å; Y112-K122 HydrophobicContact CG-CB 4.3Å; Y112-T123 WeakPolarHBondContact CA-O 3.48Å; Y112-L124 HydrophobicContact CD1-CB 4.48Å; Y112-L124 HydrophobicContact CD1-CD1 4.46Å; Y112-L124 HydrophobicContact CE1-CB 4.25Å; Y112-L124 HydrophobicContact CE1-CD1 3.99Å; Y112-L124 HydrophobicContact CE2-CD1 4.43Å
113	S	70.9	Confident	74.2	Confident	53 Å²	53	92.9 Å²	92.9	37%	0.371	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	156.2	175.7	177.6	0	0	0	0	110.3	K122 T123	S113-K122 CarbonylContact O-C 3.54Å; S113-K122 WeakPolarHBondContact O-CA 3.41Å; S113-T123 PolarHBondContact N-O 2.94Å; S113-T123 PolarHBondContact O-N 2.94Å
114	R	66.7	Low	73.9	Confident	110 Å²	110	88 Å²	88	42%	0.415	45%	0.449	S	S	.	.			trans	-61.4	138.5	170.3	-161.1	-173.1	-175.4	-158.3	1	110.5	N504 G507	R114-N504 WeakPolarHBondContact CD-OD1 3.4Å; R114-G507 VanDerWaalsContact NH1-CA 3.32Å; R114-G507 PolarHBondContact NH2-O 3.34Å; R114-G507 VanDerWaalsContact NH2-O 3.09Å
115	S	64.3	Low	73.8	Confident	12 Å²	12	87.4 Å²	87.4	8%	0.084	45%	0.447	C	S	.	.			trans	-75.9	143.2	169.6	58.6	0	0	0	0	109.6	Y117 E120 T123	S115-Y117 PolarHBondContact O-N 2.88Å; S115-Y117 PolarHBondContact OG-O 2.93Å; S115-E120 PolarHBondContact OG-O 3.32Å; S115-T123 WeakPolarHBondContact CA-OG1 3.47Å
116	P	55.4	Low	73.7	Confident	116 Å²	116	87.3 Å²	87.3	75%	0.753	45%	0.446	S	S	*	.	S	Bend	trans	-71.8	-6.1	172.7	26.9	-31.6	0	0	0	113.1
117	Y	58	Low	73.6	Confident	163 Å²	163	84.8 Å²	84.8	64%	0.639	43%	0.433	S	S	*	.	S	Bend	trans	-110.9	123.1	-179.3	-57.3	-70.1	0	0	0	110	S115 N119 E120	S115-Y117 PolarHBondContact O-N 2.88Å; S115-Y117 PolarHBondContact OG-O 2.93Å; Y117-N119 PolarHBondContact O-N 3.34Å; Y117-E120 PolarHBondContact O-N 3.5Å
118	G	53.8	Low	73.4	Confident	73 Å²	73	80.6 Å²	80.6	75%	0.753	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-13	-169.9	0	0	0	0	0	116.9
119	N	56	Low	73.1	Confident	146 Å²	146	82.4 Å²	82.4	78%	0.781	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	-1	-175.3	-70.6	1.1	0	0	0	114.5	Y117	Y117-N119 PolarHBondContact O-N 3.34Å
120	E	54.6	Low	73.2	Confident	125 Å²	125	80.7 Å²	80.7	58%	0.584	41%	0.412	S	S	*	.	S	Bend	trans	-106.7	137.2	-176	-78.3	-174.1	167.5	0	0	113.7	S115 Y117	S115-E120 PolarHBondContact OG-O 3.32Å; Y117-E120 PolarHBondContact O-N 3.5Å
121	T	60.1	Low	73.3	Confident	131 Å²	131	74.3 Å²	74.3	80%	0.804	39%	0.388	S	S	*	.			trans	-52.4	144	166.7	50.8	0	0	0	0	111	T123	T121-T123 PolarHBondContact O-N 2.96Å
122	K	70.7	Confident	73.5	Confident	151 Å²	151	72.4 Å²	72.4	66%	0.657	38%	0.382	S	S	*	.			trans	-32.4	128.3	179.9	-53.3	176.3	178.5	-179	0	112.9	Y112 S113 L124	Y112-K122 HydrophobicContact CD1-CB 3.95Å; Y112-K122 HydrophobicContact CG-CB 4.3Å; S113-K122 CarbonylContact O-C 3.54Å; S113-K122 WeakPolarHBondContact O-CA 3.41Å; K122-L124 PolarHBondContact O-N 2.95Å
123	T	74.8	Confident	73.8	Confident	44 Å²	44	72.4 Å²	72.4	27%	0.27	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	119.1	177.5	-52.8	0	0	0	0	110	T90 Y112 S113 S115 T121 V125	T90-T123 HydrophobicContact CG2-CG2 4.44Å; Y112-T123 WeakPolarHBondContact CA-O 3.48Å; S113-T123 PolarHBondContact N-O 2.94Å; S113-T123 PolarHBondContact O-N 2.94Å; S115-T123 WeakPolarHBondContact CA-OG1 3.47Å; T121-T123 PolarHBondContact O-N 2.96Å; T123-V125 HydrophobicContact CG2-CG1 4.47Å; T123-V125 PolarHBondContact O-N 3.46Å
124	L	85.3	Confident	74.6	Confident	48 Å²	48	71.3 Å²	71.3	25%	0.251	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	132	172.4	178.7	68.6	0	0	0	110.3	P91 R110 Y111 Y112 K122 F126	P91-L124 WeakPolarHBondContact CD-O 3.42Å; P91-L124 HydrophobicContact CG-CB 4.24Å; P91-L124 HydrophobicContact CG-CD2 3.76Å; P91-L124 HydrophobicContact CG-CG 3.93Å; R110-L124 HydrophobicContact CB-CD1 3.71Å; R110-L124 HydrophobicContact CG-CD1 3.95Å; Y111-L124 WeakPolarHBondContact O-CA 3.49Å; Y112-L124 HydrophobicContact CD1-CB 4.48Å; Y112-L124 HydrophobicContact CD1-CD1 4.46Å; Y112-L124 HydrophobicContact CE1-CB 4.25Å; Y112-L124 HydrophobicContact CE1-CD1 3.99Å; Y112-L124 HydrophobicContact CE2-CD1 4.43Å; K122-L124 PolarHBondContact O-N 2.95Å; L124-F126 HydrophobicContact CD2-CE2 4.36Å; L124-F126 HydrophobicContact CD2-CZ 4.25Å; L124-F126 HydrophobicContact CG-CE2 4.49Å
125	V	86.4	Confident	75.6	Confident	13 Å²	13	66.1 Å²	66.1	8%	0.079	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	155	176	-62.5	0	0	0	0	110.4	Y88 I89 T90 Y111 T123	Y88-V125 HydrophobicContact CD1-CB 4.49Å; Y88-V125 HydrophobicContact CD1-CG2 3.86Å; Y88-V125 HydrophobicContact CG-CG2 4.06Å; I89-V125 WeakPolarHBondContact O-CA 3.46Å; T90-V125 HydrophobicContact CG2-CG1 4.2Å; Y111-V125 CarbonylContact C-O 3.52Å; Y111-V125 WeakPolarHBondContact CA-O 3.31Å; Y111-V125 WeakPolarHBondContact CB-O 3.27Å; Y111-V125 PolarHBondContact N-O 3.37Å; Y111-V125 PolarHBondContact O-N 3.36Å; T123-V125 HydrophobicContact CG2-CG1 4.47Å; T123-V125 PolarHBondContact O-N 3.46Å
126	F	88	Confident	76.7	Confident	4 Å²	4	68.3 Å²	68.3	2%	0.018	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	152.2	175.7	-63.3	-82.1	0	0	0	109.8	Y88 I89 P91 L105 L108 P109 R110 L124 R128 V131	Y88-F126 CarbonylContact C-O 3.59Å; Y88-F126 VanDerWaalsContact CA-O 3.29Å; Y88-F126 WeakPolarHBondContact CA-O 3.47Å; I89-F126 HydrophobicContact CG2-CB 4.22Å; I89-F126 PolarHBondContact N-O 3.33Å; I89-F126 PolarHBondContact O-N 2.96Å; P91-F126 HydrophobicContact CB-CE2 3.9Å; P91-F126 HydrophobicContact CG-CD2 4.26Å; P91-F126 HydrophobicContact CG-CE2 3.71Å; L105-F126 HydrophobicContact CB-CE1 4.5Å; L105-F126 HydrophobicContact CB-CE2 4.19Å; L105-F126 HydrophobicContact CB-CZ 3.94Å; L105-F126 HydrophobicContact CD1-CE2 4Å; L105-F126 HydrophobicContact CD2-CD2 4.29Å; L105-F126 HydrophobicContact CD2-CE2 4.26Å; L105-F126 HydrophobicContact CG-CE2 4.4Å; L105-F126 WeakPolarHBondContact O-CE1 3.33Å; L108-F126 HydrophobicContact CB-CD1 3.66Å; L108-F126 HydrophobicContact CB-CE1 3.94Å; L108-F126 HydrophobicContact CD1-CD1 4.35Å; P109-F126 WeakPolarHBondContact O-CD1 3.39Å; R110-F126 HydrophobicContact CG-CE1 3.97Å; R110-F126 HydrophobicContact CG-CZ 4.48Å; L124-F126 HydrophobicContact CD2-CE2 4.36Å; L124-F126 HydrophobicContact CD2-CZ 4.25Å; L124-F126 HydrophobicContact CG-CE2 4.49Å; F126-R128 PolarHBondContact O-N 2.69Å; F126-V131 HydrophobicContact CB-CG2 3.67Å; F126-V131 HydrophobicContact CG-CG2 4.47Å
127	L	85.5	Confident	78.2	Confident	32 Å²	32	67.2 Å²	67.2	17%	0.168	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	129.3	173	-162.2	71.7	0	0	0	108.7	K87 Y88 Y111 S129 D130 V131	K87-L127 HydrophobicContact CG-CD1 3.89Å; Y88-L127 HydrophobicContact CD1-CD1 4.21Å; Y88-L127 HydrophobicContact CE1-CD1 3.77Å; Y111-L127 HydrophobicContact CD2-CB 4.45Å; Y111-L127 HydrophobicContact CE2-CB 3.85Å; L127-S129 VanDerWaalsContact C-N 3.29Å; L127-S129 WeakPolarHBondContact CD2-OG 3.43Å; L127-S129 WeakPolarHBondContact CG-OG 3.46Å; L127-S129 PolarHBondContact O-N 3.19Å; L127-D130 HydrophobicContact CB-CB 4.43Å; L127-D130 PolarHBondContact O-N 3.31Å; L127-V131 PolarHBondContact O-N 2.94Å; L127-V131 VanDerWaalsContact O-N 3.13Å
128	R	84.8	Confident	79.6	Confident	46 Å²	46	63.4 Å²	63.4	17%	0.174	35%	0.345	C	S	.	.	H	α-helix	trans	-63.8	-35.4	-175.2	-174	-177	171.3	159.1	-15.2	112.1	V86 K87 Y98 F126 D130 V131 E132	V86-R128 WeakPolarHBondContact O-CB 3.46Å; V86-R128 WeakPolarHBondContact O-CD 3.22Å; V86-R128 WeakPolarHBondContact O-CG 3.5Å; K87-R128 PolarHBondContact O-N 3.44Å; Y98-R128 PolarHBondContact OH-NE 2.98Å; Y98-R128 PolarHBondContact OH-NH2 3.47Å; F126-R128 PolarHBondContact O-N 2.69Å; R128-D130 VanDerWaalsContact C-N 3.28Å; R128-D130 PolarHBondContact O-N 3.1Å; R128-V131 PolarHBondContact O-N 3.2Å; R128-E132 HydrophobicContact CG-CG 4.34Å; R128-E132 IonicContact CZ-OE1 3.61Å; R128-E132 IonicContact NE-OE1 3.94Å; R128-E132 PolarHBondContact NE-OE1 3.1Å; R128-E132 IonicContact NH2-OE1 2.6Å; R128-E132 PolarHBondContact NH2-OE1 2.92Å; R128-E132 VanDerWaalsContact O-CB 3.31Å; R128-E132 WeakPolarHBondContact O-CB 3.44Å; R128-E132 WeakPolarHBondContact O-CG 3.18Å; R128-E132 PolarHBondContact O-N 2.94Å
129	S	83.2	Confident	81.1	Confident	51 Å²	51	61.2 Å²	61.2	36%	0.357	32%	0.316	S	S	.	.	H	α-helix	trans	-58.3	-41.8	175.9	54.1	0	0	0	0	111.9	L127 E132 Q133	L127-S129 VanDerWaalsContact C-N 3.29Å; L127-S129 WeakPolarHBondContact CD2-OG 3.43Å; L127-S129 WeakPolarHBondContact CG-OG 3.46Å; L127-S129 PolarHBondContact O-N 3.19Å; S129-E132 PolarHBondContact O-N 2.92Å; S129-Q133 WeakPolarHBondContact O-CB 3.39Å; S129-Q133 VanDerWaalsContact O-CG 3.31Å; S129-Q133 WeakPolarHBondContact O-CG 3.43Å; S129-Q133 PolarHBondContact O-N 3Å
130	D	88.2	Confident	82.4	Confident	30 Å²	30	56 Å²	56	16%	0.16	30%	0.296	C	S	.	.	H	α-helix	trans	-73	-38.2	-177.8	-53.1	-8.7	0	0	0	110.1	L108 L127 R128 M134	L108-D130 HydrophobicContact CD2-CB 3.9Å; L127-D130 HydrophobicContact CB-CB 4.43Å; L127-D130 PolarHBondContact O-N 3.31Å; R128-D130 VanDerWaalsContact C-N 3.28Å; R128-D130 PolarHBondContact O-N 3.1Å; D130-M134 VanDerWaalsContact O-CB 3.3Å; D130-M134 WeakPolarHBondContact O-CB 3.43Å; D130-M134 PolarHBondContact O-N 2.73Å
131	V	89.1	Confident	83.6	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63.5	-40.9	172.1	170.2	0	0	0	0	111.5	I89 A94 Y98 L100 L105 L108 F126 L127 R128 A135	I89-V131 HydrophobicContact CG2-CB 4.1Å; I89-V131 HydrophobicContact CG2-CG1 4.22Å; I89-V131 HydrophobicContact CG2-CG2 3.63Å; A94-V131 HydrophobicContact CB-CG1 3.95Å; A94-V131 HydrophobicContact CB-CG2 4.18Å; Y98-V131 HydrophobicContact CD1-CG1 4.07Å; Y98-V131 HydrophobicContact CD2-CG1 3.55Å; Y98-V131 HydrophobicContact CE2-CG1 4.09Å; Y98-V131 HydrophobicContact CG-CG1 3.53Å; L100-V131 HydrophobicContact CD1-CG1 3.83Å; L105-V131 HydrophobicContact CD2-CG2 4.44Å; L108-V131 HydrophobicContact CD1-CB 4.33Å; L108-V131 HydrophobicContact CD1-CG2 3.48Å; L108-V131 VanDerWaalsContact CD1-CG2 3.48Å; F126-V131 HydrophobicContact CB-CG2 3.67Å; F126-V131 HydrophobicContact CG-CG2 4.47Å; L127-V131 PolarHBondContact O-N 2.94Å; L127-V131 VanDerWaalsContact O-N 3.13Å; R128-V131 PolarHBondContact O-N 3.2Å; V131-A135 VanDerWaalsContact O-CB 3.3Å; V131-A135 WeakPolarHBondContact O-CB 3.42Å; V131-A135 PolarHBondContact O-N 2.67Å
132	E	87.1	Confident	84.6	Confident	43 Å²	43	53.2 Å²	53.2	20%	0.201	28%	0.276	C	S	.	.	H	α-helix	trans	-64.4	-48.6	176.4	-87.8	173.1	-173.1	0	0	111.5	Y98 R128 S129 M134 A135 Y136	Y98-E132 HydrophobicContact CD1-CG 4.16Å; Y98-E132 HydrophobicContact CE1-CB 4.39Å; Y98-E132 HydrophobicContact CE1-CG 3.27Å; Y98-E132 PolarHBondContact OH-OE1 3Å; R128-E132 HydrophobicContact CG-CG 4.34Å; R128-E132 IonicContact CZ-OE1 3.61Å; R128-E132 IonicContact NE-OE1 3.94Å; R128-E132 PolarHBondContact NE-OE1 3.1Å; R128-E132 IonicContact NH2-OE1 2.6Å; R128-E132 PolarHBondContact NH2-OE1 2.92Å; R128-E132 VanDerWaalsContact O-CB 3.31Å; R128-E132 WeakPolarHBondContact O-CB 3.44Å; R128-E132 WeakPolarHBondContact O-CG 3.18Å; R128-E132 PolarHBondContact O-N 2.94Å; S129-E132 PolarHBondContact O-N 2.92Å; E132-M134 VanDerWaalsContact C-N 3.34Å; E132-M134 PolarHBondContact O-N 3.05Å; E132-A135 WeakPolarHBondContact O-CB 3.39Å; E132-A135 PolarHBondContact O-N 2.98Å; E132-A135 VanDerWaalsContact O-N 3.12Å; E132-Y136 HydrophobicContact CB-CE2 3.81Å; E132-Y136 WeakPolarHBondContact O-CD2 3.36Å; E132-Y136 PolarHBondContact O-N 2.9Å
133	Q	86	Confident	85.2	Confident	129 Å²	129	51.5 Å²	51.5	60%	0.603	27%	0.274	S	S	*	.	H	α-helix	trans	-59.7	-44.3	176.1	-73.9	176.8	3.9	0	0	111.8	S129 A135 Y136 S137	S129-Q133 WeakPolarHBondContact O-CB 3.39Å; S129-Q133 VanDerWaalsContact O-CG 3.31Å; S129-Q133 WeakPolarHBondContact O-CG 3.43Å; S129-Q133 PolarHBondContact O-N 3Å; Q133-A135 VanDerWaalsContact C-N 3.29Å; Q133-A135 PolarHBondContact O-N 3.36Å; Q133-Y136 PolarHBondContact O-N 3.43Å; Q133-S137 PolarHBondContact O-N 3.11Å; Q133-S137 PolarHBondContact O-OG 3.39Å
134	M	88.7	Confident	85.5	Confident	31 Å²	31	53.2 Å²	53.2	15%	0.153	28%	0.282	C	S	.	.	H	α-helix	trans	-61.3	-39.2	175.2	-174.5	59.5	67.6	0	0	111.9	L100 D104 Q107 L108 D130 E132 S137 K138	L100-M134 HydrophobicContact CD1-CB 4.16Å; L100-M134 HydrophobicContact CD1-CG 3.99Å; L100-M134 HydrophobicContact CD2-CB 4.37Å; L100-M134 HydrophobicContact CD2-CG 3.79Å; D104-M134 HydrophobicContact CB-CG 4.03Å; D104-M134 HydrophobicContact CB-SD 4.37Å; Q107-M134 HydrophobicContact CB-CE 4.03Å; L108-M134 HydrophobicContact CD2-CB 4.24Å; L108-M134 HydrophobicContact CD2-CE 3.93Å; D130-M134 VanDerWaalsContact O-CB 3.3Å; D130-M134 WeakPolarHBondContact O-CB 3.43Å; D130-M134 PolarHBondContact O-N 2.73Å; E132-M134 VanDerWaalsContact C-N 3.34Å; E132-M134 PolarHBondContact O-N 3.05Å; M134-S137 WeakPolarHBondContact CA-OG 3.39Å; M134-S137 PolarHBondContact O-OG 2.8Å; M134-K138 WeakPolarHBondContact O-CB 3.39Å; M134-K138 PolarHBondContact O-N 3.09Å; M134-K138 VanDerWaalsContact O-N 3.08Å
135	A	87.3	Confident	85.5	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-67.6	-41.6	177.3	0	0	0	0	0	112	Y98 L100 V131 E132 Q133 K138 H139 F145	Y98-A135 HydrophobicContact CD1-CB 3.78Å; Y98-A135 HydrophobicContact CG-CB 4.36Å; L100-A135 HydrophobicContact CD2-CB 4.25Å; V131-A135 VanDerWaalsContact O-CB 3.3Å; V131-A135 WeakPolarHBondContact O-CB 3.42Å; V131-A135 PolarHBondContact O-N 2.67Å; E132-A135 WeakPolarHBondContact O-CB 3.39Å; E132-A135 PolarHBondContact O-N 2.98Å; E132-A135 VanDerWaalsContact O-N 3.12Å; Q133-A135 VanDerWaalsContact C-N 3.29Å; Q133-A135 PolarHBondContact O-N 3.36Å; A135-K138 PolarHBondContact O-N 3.24Å; A135-H139 WeakPolarHBondContact O-CB 3.46Å; A135-H139 PolarHBondContact O-CD2 3.28Å; A135-H139 PolarHBondContact O-N 3.33Å; A135-F145 HydrophobicContact CB-CD2 4.09Å; A135-F145 HydrophobicContact CB-CE2 3.76Å; A135-F145 HydrophobicContact CB-CZ 4.22Å
136	Y	87.8	Confident	85.2	Confident	58 Å²	58	52.1 Å²	52.1	23%	0.227	28%	0.275	C	S	.	.	H	α-helix	trans	-65.3	-44.8	175.5	-54.5	-34	0	0	0	110.8	E132 Q133 K138 H139 G140 Y142 F145	E132-Y136 HydrophobicContact CB-CE2 3.81Å; E132-Y136 WeakPolarHBondContact O-CD2 3.36Å; E132-Y136 PolarHBondContact O-N 2.9Å; Q133-Y136 PolarHBondContact O-N 3.43Å; Y136-K138 PolarHBondContact O-N 2.87Å; Y136-H139 PolarHBondContact O-N 2.91Å; Y136-G140 CarbonylContact C-O 3.56Å; Y136-G140 CarbonylContact O-C 3.49Å; Y136-G140 PolarHBondContact O-N 3.16Å; Y136-Y142 AromaticContact CE1-CD2 3.76Å; Y136-Y142 HydrophobicContact CE1-CD2 3.76Å; Y136-Y142 HydrophobicContact CE1-CE2 4.44Å; Y136-Y142 HydrophobicContact CE2-CD2 4.42Å; Y136-Y142 AromaticContact CZ-CD2 3.66Å; Y136-F145 HydrophobicContact CD1-CB 4.1Å; Y136-F145 HydrophobicContact CD1-CD1 4.17Å; Y136-F145 HydrophobicContact CD1-CG 4.14Å; Y136-F145 HydrophobicContact CE1-CB 4.34Å; Y136-F145 AromaticContact CE1-CD1 3.66Å; Y136-F145 HydrophobicContact CE1-CD1 3.66Å; Y136-F145 HydrophobicContact CE1-CE1 4.25Å; Y136-F145 HydrophobicContact CE1-CG 4.1Å
137	S	87	Confident	85	Confident	93 Å²	93	57.1 Å²	57.1	65%	0.65	30%	0.301	S	S	*	.	H	α-helix	trans	-60.1	-31.6	176	56.2	0	0	0	0	113	Q133 M134	Q133-S137 PolarHBondContact O-N 3.11Å; Q133-S137 PolarHBondContact O-OG 3.39Å; M134-S137 WeakPolarHBondContact CA-OG 3.39Å; M134-S137 PolarHBondContact O-OG 2.8Å
138	K	87.4	Confident	84.9	Confident	83 Å²	83	61.2 Å²	61.2	36%	0.361	31%	0.314	S	S	.	.	H	α-helix	trans	-85.2	-40	-179.1	-174.3	178.9	-178.4	-174.6	0	113.8	M99 L100 D104 M134 A135 Y136	M99-K138 PolarHBondContact O-NZ 3.06Å; L100-K138 HydrophobicContact CD2-CD 3.94Å; D104-K138 WeakPolarHBondContact OD2-CD 3.26Å; D104-K138 WeakPolarHBondContact OD2-CE 3.45Å; D104-K138 IonicContact OD2-NZ 2.76Å; D104-K138 PolarHBondContact OD2-NZ 3.37Å; M134-K138 WeakPolarHBondContact O-CB 3.39Å; M134-K138 PolarHBondContact O-N 3.09Å; M134-K138 VanDerWaalsContact O-N 3.08Å; A135-K138 PolarHBondContact O-N 3.24Å; Y136-K138 PolarHBondContact O-N 2.87Å
139	H	84.9	Confident	84.7	Confident	28 Å²	28	60.2 Å²	60.2	13%	0.13	31%	0.31	C	S	.	.	H	α-helix	trans	-103.5	-8.9	-169.5	-68	-65.9	0	0	0	114.5	Y98 M99 A135 Y136 F145 R148	Y98-H139 PolarHBondContact O-NE2 3.14Å; M99-H139 VanDerWaalsContact CB-NE2 3.31Å; M99-H139 WeakPolarHBondContact CB-NE2 3.46Å; M99-H139 PolarHBondContact O-NE2 2.75Å; A135-H139 WeakPolarHBondContact O-CB 3.46Å; A135-H139 PolarHBondContact O-CD2 3.28Å; A135-H139 PolarHBondContact O-N 3.33Å; Y136-H139 PolarHBondContact O-N 2.91Å; H139-F145 HydrophobicContact CB-CB 4.37Å; H139-F145 HydrophobicContact CB-CD2 4.09Å; H139-R148 PolarHBondContact O-NH1 3.09Å
140	G	83.2	Confident	84.7	Confident	35 Å²	35	64 Å²	64	36%	0.361	32%	0.321	S	S	.	.			trans	107.2	-150.1	178.7	0	0	0	0	0	112.7	Y136	Y136-G140 CarbonylContact C-O 3.56Å; Y136-G140 CarbonylContact O-C 3.49Å; Y136-G140 PolarHBondContact O-N 3.16Å
141	S	81.3	Confident	84.5	Confident	68 Å²	68	67.5 Å²	67.5	48%	0.476	34%	0.339	S	S	.	.	S	Bend	trans	-61	158.7	-179.2	-172.5	0	0	0	0	111.6	D143 D144 F145	S141-D143 PolarHBondContact O-N 3.37Å; S141-D144 PolarHBondContact N-OD2 3.22Å; S141-D144 WeakPolarHBondContact O-CB 3.49Å; S141-D144 PolarHBondContact O-N 3.48Å; S141-F145 PolarHBondContact O-N 3.49Å; S141-F145 VanDerWaalsContact O-N 3.07Å
142	Y	80.6	Confident	84.1	Confident	130 Å²	130	71.2 Å²	71.2	51%	0.51	36%	0.357	S	S	.	.	H	α-helix	trans	-49.7	-42.7	175	174.5	-97.3	0	0	0	111.9	Y136 F145 E146	Y136-Y142 AromaticContact CE1-CD2 3.76Å; Y136-Y142 HydrophobicContact CE1-CD2 3.76Å; Y136-Y142 HydrophobicContact CE1-CE2 4.44Å; Y136-Y142 HydrophobicContact CE2-CD2 4.42Å; Y136-Y142 AromaticContact CZ-CD2 3.66Å; Y142-F145 PolarHBondContact O-N 2.98Å; Y142-E146 HydrophobicContact CE1-CG 4.12Å; Y142-E146 HydrophobicContact CE2-CG 4.14Å; Y142-E146 PolarHBondContact O-N 2.86Å
143	D	82.5	Confident	83.7	Confident	115 Å²	115	73.4 Å²	73.4	62%	0.615	37%	0.366	S	S	*	.	H	α-helix	trans	-66.5	-38.2	-179.6	-64.3	-33.2	0	0	0	112.6	S141 E146 L147	S141-D143 PolarHBondContact O-N 3.37Å; D143-E146 PolarHBondContact O-N 3.04Å; D143-L147 WeakPolarHBondContact O-CB 3.41Å; D143-L147 PolarHBondContact O-N 3.39Å
144	D	81.4	Confident	83.5	Confident	80 Å²	80	71 Å²	71	43%	0.428	36%	0.357	S	S	.	.	H	α-helix	trans	-67.5	-42.2	178.2	-65.7	-34.8	0	0	0	111.2	S141 R148	S141-D144 PolarHBondContact N-OD2 3.22Å; S141-D144 WeakPolarHBondContact O-CB 3.49Å; S141-D144 PolarHBondContact O-N 3.48Å; D144-R148 WeakPolarHBondContact O-CB 3.4Å; D144-R148 WeakPolarHBondContact O-CG 3.3Å; D144-R148 PolarHBondContact O-N 2.97Å
145	F	85.1	Confident	83.1	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-63.5	-48.1	175.8	172.5	-98.2	0	0	0	111.1	Y98 M99 A135 Y136 H139 S141 Y142 L147 R148 R149	Y98-F145 AromaticContact CD1-CE1 3.96Å; Y98-F145 HydrophobicContact CD1-CE1 3.96Å; Y98-F145 HydrophobicContact CD1-CE2 4.08Å; Y98-F145 AromaticContact CD1-CZ 3.32Å; Y98-F145 HydrophobicContact CD1-CZ 3.32Å; Y98-F145 HydrophobicContact CE1-CE1 4.06Å; Y98-F145 AromaticContact CE1-CZ 3.84Å; Y98-F145 HydrophobicContact CE1-CZ 3.84Å; Y98-F145 HydrophobicContact CG-CZ 4.07Å; M99-F145 HydrophobicContact CE-CD2 3.77Å; M99-F145 HydrophobicContact CE-CE2 3.63Å; A135-F145 HydrophobicContact CB-CD2 4.09Å; A135-F145 HydrophobicContact CB-CE2 3.76Å; A135-F145 HydrophobicContact CB-CZ 4.22Å; Y136-F145 HydrophobicContact CD1-CB 4.1Å; Y136-F145 HydrophobicContact CD1-CD1 4.17Å; Y136-F145 HydrophobicContact CD1-CG 4.14Å; Y136-F145 HydrophobicContact CE1-CB 4.34Å; Y136-F145 AromaticContact CE1-CD1 3.66Å; Y136-F145 HydrophobicContact CE1-CD1 3.66Å; Y136-F145 HydrophobicContact CE1-CE1 4.25Å; Y136-F145 HydrophobicContact CE1-CG 4.1Å; H139-F145 HydrophobicContact CB-CB 4.37Å; H139-F145 HydrophobicContact CB-CD2 4.09Å; S141-F145 PolarHBondContact O-N 3.49Å; S141-F145 VanDerWaalsContact O-N 3.07Å; Y142-F145 PolarHBondContact O-N 2.98Å; F145-L147 PolarHBondContact O-N 3.44Å; F145-R148 PolarHBondContact O-N 3.14Å; F145-R149 HydrophobicContact CE1-CB 4.48Å; F145-R149 HydrophobicContact CZ-CB 4.5Å; F145-R149 WeakPolarHBondContact O-CB 3.48Å; F145-R149 PolarHBondContact O-N 3.03Å
146	E	81.2	Confident	82.7	Confident	38 Å²	38	76.9 Å²	76.9	18%	0.178	39%	0.385	C	S	.	.	H	α-helix	trans	-65.9	-36.3	-179.9	-83	-64.2	136.9	0	0	112.5	Y142 D143 R149 K150	Y142-E146 HydrophobicContact CE1-CG 4.12Å; Y142-E146 HydrophobicContact CE2-CG 4.14Å; Y142-E146 PolarHBondContact O-N 2.86Å; D143-E146 PolarHBondContact O-N 3.04Å; E146-R149 PolarHBondContact O-N 3.05Å; E146-R149 WeakPolarHBondContact OE1-CD 3.34Å; E146-R149 IonicContact OE1-CZ 3.19Å; E146-R149 IonicContact OE1-NH1 3.8Å; E146-R149 PolarHBondContact OE1-NH1 2.74Å; E146-K150 WeakPolarHBondContact O-CB 3.47Å; E146-K150 WeakPolarHBondContact O-CG 3.39Å; E146-K150 PolarHBondContact O-N 3.41Å
147	L	83	Confident	82.2	Confident	110 Å²	110	82 Å²	82	58%	0.576	40%	0.404	S	S	*	.	H	α-helix	trans	-61.3	-50.6	172.5	-171.5	84.9	0	0	0	111.2	D143 F145 R149 K150 L151	D143-L147 WeakPolarHBondContact O-CB 3.41Å; D143-L147 PolarHBondContact O-N 3.39Å; F145-L147 PolarHBondContact O-N 3.44Å; L147-R149 VanDerWaalsContact C-N 3.32Å; L147-R149 PolarHBondContact O-N 2.92Å; L147-K150 PolarHBondContact O-N 2.83Å; L147-L151 HydrophobicContact CG-CD1 4.47Å; L147-L151 PolarHBondContact O-N 2.88Å
148	R	82.8	Confident	81.7	Confident	118 Å²	118	86.4 Å²	86.4	45%	0.445	41%	0.407	S	S	.	.	H	α-helix	trans	-61.9	-41	177.4	-76.3	177.9	-179.7	157.2	2.5	111.8	M99 H139 D144 F145 L151 M152	M99-R148 HydrophobicContact CE-CB 3.86Å; M99-R148 HydrophobicContact SD-CB 4.28Å; H139-R148 PolarHBondContact O-NH1 3.09Å; D144-R148 WeakPolarHBondContact O-CB 3.4Å; D144-R148 WeakPolarHBondContact O-CG 3.3Å; D144-R148 PolarHBondContact O-N 2.97Å; F145-R148 PolarHBondContact O-N 3.14Å; R148-L151 PolarHBondContact O-N 2.82Å; R148-M152 WeakPolarHBondContact O-CB 3.49Å; R148-M152 WeakPolarHBondContact O-CG 3.37Å; R148-M152 PolarHBondContact O-N 3.32Å
149	R	81.7	Confident	81.2	Confident	24 Å²	24	86.2 Å²	86.2	9%	0.091	41%	0.413	C	S	.	.	H	α-helix	trans	-62.3	-42.1	177	-172.4	-174.6	-172.8	-166.5	5.5	111.7	E97 F145 E146 L147 K153	E97-R149 IonicContact OE2-NH2 3.16Å; F145-R149 HydrophobicContact CE1-CB 4.48Å; F145-R149 HydrophobicContact CZ-CB 4.5Å; F145-R149 WeakPolarHBondContact O-CB 3.48Å; F145-R149 PolarHBondContact O-N 3.03Å; E146-R149 PolarHBondContact O-N 3.05Å; E146-R149 WeakPolarHBondContact OE1-CD 3.34Å; E146-R149 IonicContact OE1-CZ 3.19Å; E146-R149 IonicContact OE1-NH1 3.8Å; E146-R149 PolarHBondContact OE1-NH1 2.74Å; L147-R149 VanDerWaalsContact C-N 3.32Å; L147-R149 PolarHBondContact O-N 2.92Å; R149-K153 HydrophobicContact CG-CD 4.45Å; R149-K153 WeakPolarHBondContact O-CB 3.44Å; R149-K153 WeakPolarHBondContact O-CG 3.4Å; R149-K153 PolarHBondContact O-N 2.91Å
150	K	82.3	Confident	80.8	Confident	132 Å²	132	90.1 Å²	90.1	57%	0.574	43%	0.429	S	S	*	.	H	α-helix	trans	-62.3	-49.5	174.4	-79	178.3	-178.2	174.6	0	111.5	E146 L147 M152 K153 D154	E146-K150 WeakPolarHBondContact O-CB 3.47Å; E146-K150 WeakPolarHBondContact O-CG 3.39Å; E146-K150 PolarHBondContact O-N 3.41Å; L147-K150 PolarHBondContact O-N 2.83Å; K150-M152 PolarHBondContact O-N 3.32Å; K150-K153 PolarHBondContact O-N 3.09Å; K150-D154 PolarHBondContact O-N 3.07Å
151	L	84.7	Confident	80.5	Confident	103 Å²	103	92.3 Å²	92.3	54%	0.539	44%	0.436	S	S	.	.	H	α-helix	trans	-57.7	-46	177.3	-74.4	167.6	0	0	0	112.1	L147 R148 D154 M155	L147-L151 HydrophobicContact CG-CD1 4.47Å; L147-L151 PolarHBondContact O-N 2.88Å; R148-L151 PolarHBondContact O-N 2.82Å; L151-D154 PolarHBondContact O-N 3.12Å; L151-M155 WeakPolarHBondContact O-CG 3.44Å; L151-M155 PolarHBondContact O-N 3.47Å
152	M	80.8	Confident	80.1	Confident	78 Å²	78	95.5 Å²	95.5	38%	0.384	44%	0.443	S	S	.	.	H	α-helix	trans	-64.2	-42.7	176.5	-76.2	-67.2	-73.8	0	0	112.2	M99 R148 K150 D154 M155 E156	M99-M152 HydrophobicContact SD-CG 3.93Å; R148-M152 WeakPolarHBondContact O-CB 3.49Å; R148-M152 WeakPolarHBondContact O-CG 3.37Å; R148-M152 PolarHBondContact O-N 3.32Å; K150-M152 PolarHBondContact O-N 3.32Å; M152-D154 VanDerWaalsContact C-N 3.29Å; M152-D154 PolarHBondContact O-N 3.36Å; M152-M155 HydrophobicContact CG-CE 4.35Å; M152-M155 PolarHBondContact O-N 2.83Å; M152-M155 HydrophobicContact SD-CE 3.37Å; M152-M155 WeakPolarHBondContact SD-CE 3.21Å; M152-E156 WeakPolarHBondContact O-CB 3.42Å; M152-E156 WeakPolarHBondContact O-CG 3.48Å; M152-E156 PolarHBondContact O-N 2.79Å
153	K	78.9	Confident	79.8	Confident	88 Å²	88	95.2 Å²	95.2	38%	0.383	45%	0.445	S	S	.	.	H	α-helix	trans	-60.7	-38.7	175.6	-82.4	177.8	178.1	173.9	0	112.1	R149 K150 E156 R157	R149-K153 HydrophobicContact CG-CD 4.45Å; R149-K153 WeakPolarHBondContact O-CB 3.44Å; R149-K153 WeakPolarHBondContact O-CG 3.4Å; R149-K153 PolarHBondContact O-N 2.91Å; K150-K153 PolarHBondContact O-N 3.09Å; K153-E156 PolarHBondContact O-N 3.29Å; K153-R157 WeakPolarHBondContact O-CB 3.24Å; K153-R157 VanDerWaalsContact O-CG 3.24Å; K153-R157 WeakPolarHBondContact O-CG 3.47Å; K153-R157 PolarHBondContact O-N 2.99Å
154	D	80.2	Confident	79.3	Confident	78 Å²	78	96.1 Å²	96.1	42%	0.417	44%	0.443	S	S	.	.	H	α-helix	trans	-71.8	-40	178.1	-73.3	-20.2	0	0	0	112	K150 L151 M152 R157 R158	K150-D154 PolarHBondContact O-N 3.07Å; L151-D154 PolarHBondContact O-N 3.12Å; M152-D154 VanDerWaalsContact C-N 3.29Å; M152-D154 PolarHBondContact O-N 3.36Å; D154-R157 PolarHBondContact O-N 3.31Å; D154-R157 IonicContact OD1-NH1 2.85Å; D154-R158 WeakPolarHBondContact O-CG 3.42Å; D154-R158 PolarHBondContact O-N 3.42Å
155	M	80.6	Confident	79	Confident	107 Å²	107	96.8 Å²	96.8	53%	0.527	45%	0.447	S	S	.	.	H	α-helix	trans	-63.8	-40.9	171	-70.7	-165.9	-61.4	0	0	112.2	L151 M152 R157 R158 T159	L151-M155 WeakPolarHBondContact O-CG 3.44Å; L151-M155 PolarHBondContact O-N 3.47Å; M152-M155 HydrophobicContact CG-CE 4.35Å; M152-M155 PolarHBondContact O-N 2.83Å; M152-M155 HydrophobicContact SD-CE 3.37Å; M152-M155 WeakPolarHBondContact SD-CE 3.21Å; M155-R157 VanDerWaalsContact C-N 3.35Å; M155-R158 PolarHBondContact O-N 3.29Å; M155-T159 WeakPolarHBondContact O-CB 3.5Å; M155-T159 WeakPolarHBondContact O-CG2 3.47Å; M155-T159 PolarHBondContact O-N 3.18Å; M155-T159 PolarHBondContact O-OG1 3.16Å
156	E	80.3	Confident	78.5	Confident	48 Å²	48	101.6 Å²	101.6	22%	0.224	47%	0.472	C	S	.	.	H	α-helix	trans	-64.7	-37.1	174.2	-80.4	-161.4	157.6	0	0	112.4	R96 M152 K153 T159 K160	R96-E156 WeakPolarHBondContact CG-OE1 3.41Å; R96-E156 IonicContact CZ-OE1 2.75Å; R96-E156 IonicContact CZ-OE2 3.35Å; R96-E156 VanDerWaalsContact CZ-OE2 3.27Å; R96-E156 VanDerWaalsContact NE-CD 3.29Å; R96-E156 IonicContact NE-OE1 2.73Å; R96-E156 PolarHBondContact NE-OE1 3.03Å; R96-E156 IonicContact NE-OE2 2.73Å; R96-E156 PolarHBondContact NE-OE2 3.36Å; R96-E156 IonicContact NH2-OE1 2.79Å; R96-E156 PolarHBondContact NH2-OE1 3.08Å; R96-E156 VanDerWaalsContact NH2-OE1 3.16Å; R96-E156 IonicContact NH2-OE2 3.28Å; R96-E156 PolarHBondContact NH2-OE2 3.25Å; M152-E156 WeakPolarHBondContact O-CB 3.42Å; M152-E156 WeakPolarHBondContact O-CG 3.48Å; M152-E156 PolarHBondContact O-N 2.79Å; K153-E156 PolarHBondContact O-N 3.29Å; E156-T159 WeakPolarHBondContact CA-OG1 3.44Å; E156-T159 PolarHBondContact O-OG1 3.4Å; E156-K160 WeakPolarHBondContact O-CA 3.29Å; E156-K160 WeakPolarHBondContact O-CB 3.09Å; E156-K160 VanDerWaalsContact O-CG 3.23Å; E156-K160 WeakPolarHBondContact O-CG 3.35Å; E156-K160 PolarHBondContact O-N 3.33Å
157	R	76.8	Confident	78	Confident	166 Å²	166	106.6 Å²	106.6	63%	0.626	49%	0.489	S	S	*	.	H	α-helix	trans	-65.4	-43.4	174.7	-80.8	170.1	172.9	-178.8	-5.3	111	K153 D154 M155 T161	K153-R157 WeakPolarHBondContact O-CB 3.24Å; K153-R157 VanDerWaalsContact O-CG 3.24Å; K153-R157 WeakPolarHBondContact O-CG 3.47Å; K153-R157 PolarHBondContact O-N 2.99Å; D154-R157 PolarHBondContact O-N 3.31Å; D154-R157 IonicContact OD1-NH1 2.85Å; M155-R157 VanDerWaalsContact C-N 3.35Å; R157-T161 WeakPolarHBondContact O-CB 3.47Å; R157-T161 PolarHBondContact O-N 3.24Å; R157-T161 PolarHBondContact O-OG1 3.48Å
158	R	77	Confident	77.4	Confident	186 Å²	186	106.9 Å²	106.9	70%	0.702	49%	0.486	S	S	*	.	H	α-helix	trans	-62.6	-52.7	175.7	-70.5	178.6	-175.2	-166.9	2.3	111.1	D154 M155 K160 T161 E162	D154-R158 WeakPolarHBondContact O-CG 3.42Å; D154-R158 PolarHBondContact O-N 3.42Å; M155-R158 PolarHBondContact O-N 3.29Å; R158-K160 PolarHBondContact O-N 3.42Å; R158-T161 WeakPolarHBondContact O-CB 3.36Å; R158-T161 PolarHBondContact O-N 2.97Å; R158-T161 VanDerWaalsContact O-N 3.08Å; R158-E162 WeakPolarHBondContact O-CG 3.35Å; R158-E162 PolarHBondContact O-N 3Å
159	T	76.7	Confident	76.9	Confident	78 Å²	78	103.7 Å²	103.7	48%	0.479	49%	0.485	S	S	.	.	H	α-helix	trans	-64	-36.3	177.6	48.5	0	0	0	0	113	M155 E156 F163	M155-T159 WeakPolarHBondContact O-CB 3.5Å; M155-T159 WeakPolarHBondContact O-CG2 3.47Å; M155-T159 PolarHBondContact O-N 3.18Å; M155-T159 PolarHBondContact O-OG1 3.16Å; E156-T159 WeakPolarHBondContact CA-OG1 3.44Å; E156-T159 PolarHBondContact O-OG1 3.4Å; T159-F163 WeakPolarHBondContact O-CA 3.45Å; T159-F163 WeakPolarHBondContact O-CB 3.41Å; T159-F163 PolarHBondContact O-N 3.41Å
160	K	76.3	Confident	76.1	Confident	111 Å²	111	106.5 Å²	106.5	48%	0.483	50%	0.501	S	S	.	.	H	α-helix	trans	-64.9	-39	171	-85.3	-178.7	-179.8	166	0	112.1	R96 E156 R158 F164	R96-K160 VanDerWaalsContact NH2-NZ 3.17Å; E156-K160 WeakPolarHBondContact O-CA 3.29Å; E156-K160 WeakPolarHBondContact O-CB 3.09Å; E156-K160 VanDerWaalsContact O-CG 3.23Å; E156-K160 WeakPolarHBondContact O-CG 3.35Å; E156-K160 PolarHBondContact O-N 3.33Å; R158-K160 PolarHBondContact O-N 3.42Å; K160-F164 WeakPolarHBondContact O-CA 3.49Å; K160-F164 WeakPolarHBondContact O-CB 3.23Å; K160-F164 PolarHBondContact O-N 2.93Å
161	T	75.6	Confident	75.2	Confident	81 Å²	81	106.2 Å²	106.2	50%	0.497	50%	0.5	S	S	.	.	H	α-helix	trans	-67.1	-44.5	178.9	-55.4	0	0	0	0	109.8	R157 R158 F164 N165	R157-T161 WeakPolarHBondContact O-CB 3.47Å; R157-T161 PolarHBondContact O-N 3.24Å; R157-T161 PolarHBondContact O-OG1 3.48Å; R158-T161 WeakPolarHBondContact O-CB 3.36Å; R158-T161 PolarHBondContact O-N 2.97Å; R158-T161 VanDerWaalsContact O-N 3.08Å; T161-F164 PolarHBondContact O-N 3.19Å; T161-N165 WeakPolarHBondContact O-CB 3.05Å; T161-N165 PolarHBondContact O-N 2.98Å; T161-N165 PolarHBondContact O-ND2 3.49Å
162	E	73.8	Confident	74.2	Confident	135 Å²	135	109 Å²	109	63%	0.631	50%	0.504	S	S	*	.	H	α-helix	trans	-63.6	-46.3	173.8	-70.4	179.9	169.6	0	0	111.8	R158 F164 N165 L166	R158-E162 WeakPolarHBondContact O-CG 3.35Å; R158-E162 PolarHBondContact O-N 3Å; E162-F164 VanDerWaalsContact C-N 3.34Å; E162-F164 PolarHBondContact O-N 2.89Å; E162-N165 PolarHBondContact O-N 3.05Å; E162-L166 VanDerWaalsContact O-CB 3.25Å; E162-L166 WeakPolarHBondContact O-CB 3.37Å; E162-L166 PolarHBondContact O-N 3.37Å
163	F	74.2	Confident	73.4	Confident	123 Å²	123	110.8 Å²	110.8	54%	0.539	52%	0.515	S	S	.	.	H	α-helix	trans	-66.8	-33	176.6	-171.6	-96.4	0	0	0	112.2	T159 R167	T159-F163 WeakPolarHBondContact O-CA 3.45Å; T159-F163 WeakPolarHBondContact O-CB 3.41Å; T159-F163 PolarHBondContact O-N 3.41Å; F163-R167 HydrophobicContact CD1-CB 4.42Å; F163-R167 HydrophobicContact CE1-CB 4.35Å; F163-R167 WeakPolarHBondContact O-CA 3.42Å; F163-R167 WeakPolarHBondContact O-CB 3.46Å; F163-R167 PolarHBondContact O-N 3.14Å
164	F	72.6	Confident	72.5	Confident	134 Å²	134	110.6 Å²	110.6	59%	0.588	52%	0.515	S	S	*	.	H	α-helix	trans	-69	-43.2	174.3	178.5	-95.6	0	0	0	110.6	K160 T161 E162 R167 K168	K160-F164 WeakPolarHBondContact O-CA 3.49Å; K160-F164 WeakPolarHBondContact O-CB 3.23Å; K160-F164 PolarHBondContact O-N 2.93Å; T161-F164 PolarHBondContact O-N 3.19Å; E162-F164 VanDerWaalsContact C-N 3.34Å; E162-F164 PolarHBondContact O-N 2.89Å; F164-R167 PolarHBondContact O-N 3.05Å; F164-K168 WeakPolarHBondContact O-CB 3.41Å; F164-K168 PolarHBondContact O-N 3.43Å
165	N	75.2	Confident	71.2	Confident	95 Å²	95	110 Å²	110	51%	0.508	52%	0.517	S	S	.	.	H	α-helix	trans	-64.7	-43.8	174.6	-70.7	-21.8	0	0	0	111.3	T161 E162 K168 A169	T161-N165 WeakPolarHBondContact O-CB 3.05Å; T161-N165 PolarHBondContact O-N 2.98Å; T161-N165 PolarHBondContact O-ND2 3.49Å; E162-N165 PolarHBondContact O-N 3.05Å; N165-K168 PolarHBondContact O-N 3.03Å; N165-A169 WeakPolarHBondContact O-CB 3.13Å; N165-A169 PolarHBondContact O-N 3.22Å
166	L	73	Confident	70	Confident	100 Å²	100	109.5 Å²	109.5	52%	0.524	53%	0.525	S	S	.	.	H	α-helix	trans	-65.1	-44.5	175.7	-168	81.8	0	0	0	111.3	E162 K168 A169 L170	E162-L166 VanDerWaalsContact O-CB 3.25Å; E162-L166 WeakPolarHBondContact O-CB 3.37Å; E162-L166 PolarHBondContact O-N 3.37Å; L166-K168 VanDerWaalsContact C-N 3.35Å; L166-A169 PolarHBondContact O-N 2.97Å; L166-L170 HydrophobicContact CD2-CD1 4.08Å; L166-L170 HydrophobicContact CG-CD1 3.96Å; L166-L170 VanDerWaalsContact O-CB 3.26Å; L166-L170 WeakPolarHBondContact O-CB 3.38Å; L166-L170 WeakPolarHBondContact O-CG 3.49Å; L166-L170 PolarHBondContact O-N 3.41Å
167	R	71.2	Confident	68.8	Low	143 Å²	143	112.3 Å²	112.3	54%	0.54	55%	0.545	S	S	.	.	H	α-helix	trans	-68.1	-34.7	177.4	-170.2	176.6	179.6	-172.3	-1.2	110.7	F163 F164 L170 K171	F163-R167 HydrophobicContact CD1-CB 4.42Å; F163-R167 HydrophobicContact CE1-CB 4.35Å; F163-R167 WeakPolarHBondContact O-CA 3.42Å; F163-R167 WeakPolarHBondContact O-CB 3.46Å; F163-R167 PolarHBondContact O-N 3.14Å; F164-R167 PolarHBondContact O-N 3.05Å; R167-L170 CarbonylContact O-C 3.56Å; R167-L170 PolarHBondContact O-N 3.35Å; R167-K171 WeakPolarHBondContact O-CA 3.46Å; R167-K171 WeakPolarHBondContact O-CB 3.47Å; R167-K171 PolarHBondContact O-N 3.17Å
168	K	70.5	Confident	67.5	Low	116 Å²	116	109.6 Å²	109.6	50%	0.504	54%	0.539	S	S	.	.	H	α-helix	trans	-63.4	-48.8	172	-172.7	177	-179.6	-179.9	0	109.9	F164 N165 L166 L170 K171 Y172	F164-K168 WeakPolarHBondContact O-CB 3.41Å; F164-K168 PolarHBondContact O-N 3.43Å; N165-K168 PolarHBondContact O-N 3.03Å; L166-K168 VanDerWaalsContact C-N 3.35Å; K168-L170 PolarHBondContact O-N 2.86Å; K168-K171 PolarHBondContact O-N 3.47Å; K168-Y172 HydrophobicContact CG-CD2 4.28Å; K168-Y172 HydrophobicContact CG-CE2 4.21Å; K168-Y172 VanDerWaalsContact O-CD2 3.28Å; K168-Y172 WeakPolarHBondContact O-CD2 3.26Å; K168-Y172 PolarHBondContact O-N 2.76Å
169	A	72	Confident	66	Low	51 Å²	51	105.2 Å²	105.2	42%	0.421	53%	0.533	S	S	.	.	H	α-helix	trans	-60.9	-43.8	175.3	0	0	0	0	0	112.4	N165 L166 Y172 L173	N165-A169 WeakPolarHBondContact O-CB 3.13Å; N165-A169 PolarHBondContact O-N 3.22Å; L166-A169 PolarHBondContact O-N 2.97Å; A169-Y172 WeakPolarHBondContact O-CB 3.04Å; A169-Y172 PolarHBondContact O-N 2.8Å; A169-L173 PolarHBondContact O-N 3.07Å
170	L	66.5	Low	64.6	Low	83 Å²	83	110.9 Å²	110.9	44%	0.435	55%	0.551	S	S	.	*	H	α-helix	trans	-66.2	-38.4	174.6	-79.3	166.4	0	0	0	111.4	L166 R167 K168 Y172 L173 Q174	L166-L170 HydrophobicContact CD2-CD1 4.08Å; L166-L170 HydrophobicContact CG-CD1 3.96Å; L166-L170 VanDerWaalsContact O-CB 3.26Å; L166-L170 WeakPolarHBondContact O-CB 3.38Å; L166-L170 WeakPolarHBondContact O-CG 3.49Å; L166-L170 PolarHBondContact O-N 3.41Å; R167-L170 CarbonylContact O-C 3.56Å; R167-L170 PolarHBondContact O-N 3.35Å; K168-L170 PolarHBondContact O-N 2.86Å; L170-Y172 VanDerWaalsContact C-N 3.29Å; L170-Y172 PolarHBondContact O-N 2.82Å; L170-L173 CarbonylContact O-C 3.57Å; L170-L173 PolarHBondContact O-N 2.87Å; L170-L173 VanDerWaalsContact O-N 3.13Å; L170-Q174 WeakPolarHBondContact O-CA 3.34Å; L170-Q174 WeakPolarHBondContact O-CB 3.3Å; L170-Q174 PolarHBondContact O-N 3.1Å
171	K	62.1	Low	63.2	Low	126 Å²	126	108.5 Å²	108.5	55%	0.548	55%	0.553	S	S	.	*	H	α-helix	trans	-68.4	-30.2	177.2	-148.2	178.7	-167.6	-173.7	0	110.9	R167 K168 S175	R167-K171 WeakPolarHBondContact O-CA 3.46Å; R167-K171 WeakPolarHBondContact O-CB 3.47Å; R167-K171 PolarHBondContact O-N 3.17Å; K168-K171 PolarHBondContact O-N 3.47Å; K171-S175 WeakPolarHBondContact O-CB 3.39Å; K171-S175 PolarHBondContact O-N 3.36Å; K171-S175 PolarHBondContact O-OG 3.37Å
172	Y	64.5	Low	61.9	Low	162 Å²	162	108.1 Å²	108.1	64%	0.635	55%	0.55	S	S	*	*	H	α-helix	trans	-68.2	-39.9	168.2	-90.9	-79	0	0	0	112.4	K168 A169 L170 S175 S176	K168-Y172 HydrophobicContact CG-CD2 4.28Å; K168-Y172 HydrophobicContact CG-CE2 4.21Å; K168-Y172 VanDerWaalsContact O-CD2 3.28Å; K168-Y172 WeakPolarHBondContact O-CD2 3.26Å; K168-Y172 PolarHBondContact O-N 2.76Å; A169-Y172 WeakPolarHBondContact O-CB 3.04Å; A169-Y172 PolarHBondContact O-N 2.8Å; L170-Y172 VanDerWaalsContact C-N 3.29Å; L170-Y172 PolarHBondContact O-N 2.82Å; Y172-S175 PolarHBondContact O-OG 3.25Å; Y172-S175 VanDerWaalsContact O-OG 3.09Å; Y172-S176 PolarHBondContact O-N 2.92Å; Y172-S176 PolarHBondContact O-OG 3.01Å
173	L	62.4	Low	60.5	Low	115 Å²	115	103.1 Å²	103.1	60%	0.602	53%	0.534	S	S	*	.	H	α-helix	trans	-73.9	-38.8	176	-82.1	158.7	0	0	0	112.7	A169 L170 S176 V177	A169-L173 PolarHBondContact O-N 3.07Å; L170-L173 CarbonylContact O-C 3.57Å; L170-L173 PolarHBondContact O-N 2.87Å; L170-L173 VanDerWaalsContact O-N 3.13Å; L173-S176 CarbonylContact O-C 3.51Å; L173-S176 VanDerWaalsContact O-CB 3.32Å; L173-S176 WeakPolarHBondContact O-CB 3.43Å; L173-S176 PolarHBondContact O-N 3.41Å; L173-V177 WeakPolarHBondContact O-CG2 3.31Å; L173-V177 PolarHBondContact O-N 2.84Å; L173-V177 VanDerWaalsContact O-N 3.12Å
174	Q	60.4	Low	59.3	Low	84 Å²	84	98.8 Å²	98.8	39%	0.393	52%	0.518	S	S	.	.	H	α-helix	trans	-79.6	-33.3	-177.5	-169.5	176.7	-3.9	0	0	110	L170 S176 V177 E178	L170-Q174 WeakPolarHBondContact O-CA 3.34Å; L170-Q174 WeakPolarHBondContact O-CB 3.3Å; L170-Q174 PolarHBondContact O-N 3.1Å; Q174-S176 PolarHBondContact O-N 3.29Å; Q174-V177 PolarHBondContact O-N 3.36Å; Q174-V177 VanDerWaalsContact O-N 3.12Å; Q174-E178 HydrophobicContact CG-CB 4.11Å; Q174-E178 HydrophobicContact CG-CG 3.59Å; Q174-E178 WeakPolarHBondContact CG-OE2 3.12Å; Q174-E178 PolarHBondContact NE2-OE1 2.86Å; Q174-E178 PolarHBondContact NE2-OE2 3.47Å; Q174-E178 WeakPolarHBondContact O-CA 3.31Å; Q174-E178 VanDerWaalsContact O-CB 3.27Å; Q174-E178 WeakPolarHBondContact O-CB 3.48Å; Q174-E178 PolarHBondContact O-N 3.49Å
175	S	53.5	Low	58.1	Low	65 Å²	65	95.5 Å²	95.5	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-65.1	-28.7	166.1	66.3	0	0	0	0	111.9	K171 Y172 V177 T179	K171-S175 WeakPolarHBondContact O-CB 3.39Å; K171-S175 PolarHBondContact O-N 3.36Å; K171-S175 PolarHBondContact O-OG 3.37Å; Y172-S175 PolarHBondContact O-OG 3.25Å; Y172-S175 VanDerWaalsContact O-OG 3.09Å; S175-V177 VanDerWaalsContact C-N 3.35Å; S175-T179 PolarHBondContact O-OG1 2.84Å
176	S	55.5	Low	57	Low	98 Å²	98	93 Å²	93	69%	0.685	50%	0.5	S	S	*	.	H	α-helix	trans	-74.2	-22.1	172.6	-56	0	0	0	0	113.2	Y172 L173 Q174	Y172-S176 PolarHBondContact O-N 2.92Å; Y172-S176 PolarHBondContact O-OG 3.01Å; L173-S176 CarbonylContact O-C 3.51Å; L173-S176 VanDerWaalsContact O-CB 3.32Å; L173-S176 WeakPolarHBondContact O-CB 3.43Å; L173-S176 PolarHBondContact O-N 3.41Å; Q174-S176 PolarHBondContact O-N 3.29Å
177	V	54.2	Low	56.1	Low	107 Å²	107	90.2 Å²	90.2	65%	0.648	48%	0.484	S	S	*	.	H	α-helix	trans	-113.6	-38.2	-173.2	175.2	0	0	0	0	114.2	L173 Q174 S175	L173-V177 WeakPolarHBondContact O-CG2 3.31Å; L173-V177 PolarHBondContact O-N 2.84Å; L173-V177 VanDerWaalsContact O-N 3.12Å; Q174-V177 PolarHBondContact O-N 3.36Å; Q174-V177 VanDerWaalsContact O-N 3.12Å; S175-V177 VanDerWaalsContact C-N 3.35Å
178	E	50.3	Low	55.4	Low	108 Å²	108	87.3 Å²	87.3	51%	0.505	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-87.9	-2	-175.5	-78.1	-171.1	171.2	0	0	115.6	Q174 K180 A181	Q174-E178 HydrophobicContact CG-CB 4.11Å; Q174-E178 HydrophobicContact CG-CG 3.59Å; Q174-E178 WeakPolarHBondContact CG-OE2 3.12Å; Q174-E178 PolarHBondContact NE2-OE1 2.86Å; Q174-E178 PolarHBondContact NE2-OE2 3.47Å; Q174-E178 WeakPolarHBondContact O-CA 3.31Å; Q174-E178 VanDerWaalsContact O-CB 3.27Å; Q174-E178 WeakPolarHBondContact O-CB 3.48Å; Q174-E178 PolarHBondContact O-N 3.49Å; E178-K180 PolarHBondContact O-N 2.73Å; E178-A181 PolarHBondContact O-N 3.2Å; E178-A181 VanDerWaalsContact O-N 3.13Å
179	T	45.9	Very low	54.9	Low	94 Å²	94	86.5 Å²	86.5	58%	0.577	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-55.4	-11.8	167	-53.7	0	0	0	0	112	S175 T184	S175-T179 PolarHBondContact O-OG1 2.84Å; T179-T184 WeakPolarHBondContact O-CG2 2.81Å
180	K	45.9	Very low	54.5	Low	197 Å²	197	89.7 Å²	89.7	86%	0.857	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-93.1	-18.2	177.3	-80.9	179.8	173	178.5	0	117.4	E178	E178-K180 PolarHBondContact O-N 2.73Å
181	A	47	Very low	54.5	Low	62 Å²	62	89 Å²	89	51%	0.512	48%	0.475	S	S	.	.	S	Bend	trans	-100.3	-38.8	-150.1	0	0	0	0	0	119.5	E178	E178-A181 PolarHBondContact O-N 3.2Å; E178-A181 VanDerWaalsContact O-N 3.13Å
182	T	48.7	Very low	54.5	Low	73 Å²	73	89.5 Å²	89.5	45%	0.448	48%	0.476	S	S	.	.	S	Bend	trans	-169.1	-25.8	-177.1	5.4	0	0	0	0	116.8	K33 T184	K33-T182 VanDerWaalsContact CE-O 3.24Å; K33-T182 WeakPolarHBondContact CE-O 3.49Å; K33-T182 VanDerWaalsContact NZ-CB 3.29Å; K33-T182 PolarHBondContact NZ-O 3.41Å; T182-T184 PolarHBondContact O-N 3.13Å
183	G	44.9	Very low	54.5	Low	29 Å²	29	85.1 Å²	85.1	30%	0.299	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-4.7	173.4	0	0	0	0	0	114.3	K33	K33-G183 VanDerWaalsContact CE-N 3.31Å
184	T	49.8	Very low	54.8	Low	33 Å²	33	81.4 Å²	81.4	20%	0.202	45%	0.45	C	S	.	.	H	α-helix	trans	-75.8	-27	-169.9	-13.2	0	0	0	0	112	T179 T182 F187 M188	T179-T184 WeakPolarHBondContact O-CG2 2.81Å; T182-T184 PolarHBondContact O-N 3.13Å; T184-F187 PolarHBondContact O-N 3.29Å; T184-M188 WeakPolarHBondContact CB-SD 3.36Å; T184-M188 HydrophobicContact CG2-CG 3.7Å; T184-M188 HydrophobicContact CG2-SD 3.27Å; T184-M188 WeakPolarHBondContact CG2-SD 3.13Å; T184-M188 WeakPolarHBondContact O-CA 3.24Å; T184-M188 WeakPolarHBondContact O-CB 3.23Å; T184-M188 WeakPolarHBondContact O-CG 2.98Å; T184-M188 PolarHBondContact O-N 2.86Å
185	S	47.5	Very low	55.2	Low	64 Å²	64	79.6 Å²	79.6	45%	0.448	44%	0.441	S	S	.	.	H	α-helix	trans	-62	-60.3	-176.1	60.6	0	0	0	0	113.2	F187 M188 D189	S185-F187 PolarHBondContact O-N 3.36Å; S185-M188 CarbonylContact O-C 3.6Å; S185-M188 PolarHBondContact O-N 3.32Å; S185-M188 VanDerWaalsContact O-N 3.17Å; S185-D189 VanDerWaalsContact O-CB 3.3Å; S185-D189 WeakPolarHBondContact O-CB 3.36Å; S185-D189 PolarHBondContact O-N 3.01Å
186	V	51.7	Low	55.8	Low	44 Å²	44	80.8 Å²	80.8	27%	0.267	45%	0.446	S	S	.	.	H	α-helix	trans	-60.5	-35.2	-179.9	-178.9	0	0	0	0	111.5	I36 K190	I36-V186 HydrophobicContact CG1-CG2 4.22Å; V186-K190 WeakPolarHBondContact O-CB 3.5Å; V186-K190 PolarHBondContact O-N 3.17Å
187	F	53.7	Low	56.3	Low	41 Å²	41	79.5 Å²	79.5	18%	0.18	44%	0.437	C	S	.	.	H	α-helix	trans	-70.7	-43.7	178.3	-124.4	-66.3	0	0	0	113.1	T184 S185 D189 R191 L254 K256	T184-F187 PolarHBondContact O-N 3.29Å; S185-F187 PolarHBondContact O-N 3.36Å; F187-D189 VanDerWaalsContact C-N 3.32Å; F187-R191 WeakPolarHBondContact O-CB 3.14Å; F187-R191 PolarHBondContact O-N 3.14Å; F187-L254 HydrophobicContact CE1-CB 4.13Å; F187-L254 WeakPolarHBondContact CE1-O 3.38Å; F187-L254 WeakPolarHBondContact CZ-O 3.14Å; F187-K256 HydrophobicContact CD2-CD 4.01Å; F187-K256 VanDerWaalsContact CD2-CE 3.49Å; F187-K256 HydrophobicContact CD2-CG 4.28Å; F187-K256 HydrophobicContact CE2-CB 3.72Å; F187-K256 HydrophobicContact CE2-CD 3.41Å; F187-K256 VanDerWaalsContact CE2-CD 3.41Å; F187-K256 HydrophobicContact CE2-CG 3.27Å; F187-K256 HydrophobicContact CZ-CB 4.03Å; F187-K256 HydrophobicContact CZ-CD 4.4Å; F187-K256 HydrophobicContact CZ-CG 3.8Å; F187-K256 VanDerWaalsContact CZ-N 3.29Å
188	M	56.3	Low	57.3	Low	81 Å²	81	75 Å²	75	40%	0.399	41%	0.411	S	S	.	.	H	α-helix	trans	-70.2	-33	176	-73	166.9	75.9	0	0	110.3	T184 S185 R191 K192	T184-M188 WeakPolarHBondContact CB-SD 3.36Å; T184-M188 HydrophobicContact CG2-CG 3.7Å; T184-M188 HydrophobicContact CG2-SD 3.27Å; T184-M188 WeakPolarHBondContact CG2-SD 3.13Å; T184-M188 WeakPolarHBondContact O-CA 3.24Å; T184-M188 WeakPolarHBondContact O-CB 3.23Å; T184-M188 WeakPolarHBondContact O-CG 2.98Å; T184-M188 PolarHBondContact O-N 2.86Å; S185-M188 CarbonylContact O-C 3.6Å; S185-M188 PolarHBondContact O-N 3.32Å; S185-M188 VanDerWaalsContact O-N 3.17Å; M188-R191 PolarHBondContact O-N 3.49Å; M188-K192 WeakPolarHBondContact O-CB 3.38Å; M188-K192 VanDerWaalsContact O-CG 3.29Å; M188-K192 WeakPolarHBondContact O-CG 3.46Å; M188-K192 PolarHBondContact O-N 3.4Å
189	D	60.5	Low	58.4	Low	99 Å²	99	70.5 Å²	70.5	53%	0.529	39%	0.392	S	S	.	.	H	α-helix	trans	-69.9	-46.4	175.4	-70.1	-22.2	0	0	0	110.1	S185 F187 R191 K192 S193	S185-D189 VanDerWaalsContact O-CB 3.3Å; S185-D189 WeakPolarHBondContact O-CB 3.36Å; S185-D189 PolarHBondContact O-N 3.01Å; F187-D189 VanDerWaalsContact C-N 3.32Å; D189-R191 VanDerWaalsContact C-N 3.32Å; D189-R191 PolarHBondContact O-N 3.41Å; D189-K192 PolarHBondContact O-N 3.33Å; D189-S193 WeakPolarHBondContact O-CB 3.27Å; D189-S193 PolarHBondContact O-N 3.19Å
190	K	62.1	Low	60	Low	118 Å²	118	66 Å²	66	51%	0.513	37%	0.365	S	S	.	.	H	α-helix	trans	-59	-43.9	170.3	-104.6	-172.5	174.6	-169.6	0	111.4	V186 L194	V186-K190 WeakPolarHBondContact O-CB 3.5Å; V186-K190 PolarHBondContact O-N 3.17Å; K190-L194 VanDerWaalsContact O-CB 3.31Å; K190-L194 WeakPolarHBondContact O-CB 3.41Å; K190-L194 PolarHBondContact O-N 3Å
191	R	67	Low	61.8	Low	70 Å²	70	63 Å²	63	26%	0.264	35%	0.348	S	S	.	.	H	α-helix	trans	-62.6	-52.1	178.7	-174.4	-176.8	-67.3	-179.6	-4.7	111.2	F187 M188 D189 L194 F195 Y251 L254	F187-R191 WeakPolarHBondContact O-CB 3.14Å; F187-R191 PolarHBondContact O-N 3.14Å; M188-R191 PolarHBondContact O-N 3.49Å; D189-R191 VanDerWaalsContact C-N 3.32Å; D189-R191 PolarHBondContact O-N 3.41Å; R191-L194 PolarHBondContact O-N 3Å; R191-F195 HydrophobicContact CG-CD2 3.79Å; R191-F195 HydrophobicContact CG-CE2 3.73Å; R191-F195 WeakPolarHBondContact O-CD2 3.47Å; R191-F195 PolarHBondContact O-N 3.42Å; R191-Y251 VanDerWaalsContact CZ-OH 3.26Å; R191-Y251 VanDerWaalsContact NE-CE2 3.33Å; R191-Y251 PolarHBondContact NH1-OH 2.82Å; R191-Y251 VanDerWaalsContact NH1-OH 3.07Å; R191-Y251 PolarHBondContact NH2-OH 2.94Å; R191-L254 HydrophobicContact CB-CD1 4.15Å; R191-L254 HydrophobicContact CG-CD1 4.33Å
192	K	62.2	Low	63.5	Low	135 Å²	135	60.2 Å²	60.2	59%	0.587	32%	0.324	S	S	*	.	H	α-helix	trans	-58.3	-51.7	176.3	-80.7	-177.3	177.1	-176.4	0	109.8	M188 D189 L194 F195 T196	M188-K192 WeakPolarHBondContact O-CB 3.38Å; M188-K192 VanDerWaalsContact O-CG 3.29Å; M188-K192 WeakPolarHBondContact O-CG 3.46Å; M188-K192 PolarHBondContact O-N 3.4Å; D189-K192 PolarHBondContact O-N 3.33Å; K192-L194 VanDerWaalsContact C-N 3.26Å; K192-L194 PolarHBondContact O-N 3.31Å; K192-F195 CarbonylContact O-C 3.58Å; K192-F195 PolarHBondContact O-N 3.43Å; K192-F195 VanDerWaalsContact O-N 3.13Å; K192-T196 WeakPolarHBondContact O-CB 3.1Å; K192-T196 VanDerWaalsContact O-CG2 3.28Å; K192-T196 WeakPolarHBondContact O-CG2 3.5Å; K192-T196 PolarHBondContact O-N 2.83Å; K192-T196 PolarHBondContact O-OG1 2.83Å
193	S	65.5	Low	65.1	Low	70 Å²	70	56.7 Å²	56.7	49%	0.49	30%	0.303	S	S	.	.	H	α-helix	trans	-54.8	-40.1	178.8	-177.1	0	0	0	0	112.6	D189 T196 S197	D189-S193 WeakPolarHBondContact O-CB 3.27Å; D189-S193 PolarHBondContact O-N 3.19Å; S193-T196 VanDerWaalsContact CA-OG1 3.28Å; S193-T196 WeakPolarHBondContact CA-OG1 3.31Å; S193-T196 PolarHBondContact O-OG1 3.06Å; S193-T196 VanDerWaalsContact O-OG1 3.11Å; S193-S197 WeakPolarHBondContact O-CB 3.46Å; S193-S197 PolarHBondContact O-N 3.11Å
194	L	67.3	Low	67.1	Low	38 Å²	38	59.8 Å²	59.8	20%	0.199	31%	0.312	C	S	.	.	H	α-helix	trans	-73.7	-37.6	179.6	-164.2	77.9	0	0	0	112.5	K190 R191 K192 S197 P199 G200 L250 L254	K190-L194 VanDerWaalsContact O-CB 3.31Å; K190-L194 WeakPolarHBondContact O-CB 3.41Å; K190-L194 PolarHBondContact O-N 3Å; R191-L194 PolarHBondContact O-N 3Å; K192-L194 VanDerWaalsContact C-N 3.26Å; K192-L194 PolarHBondContact O-N 3.31Å; L194-S197 CarbonylContact C-O 3.53Å; L194-P199 HydrophobicContact CD1-CG 3.99Å; L194-P199 HydrophobicContact CG-CG 4.46Å; L194-G200 WeakPolarHBondContact O-CA 3.44Å; L194-G200 PolarHBondContact O-N 2.91Å; L194-G200 VanDerWaalsContact O-N 3.17Å; L194-L250 HydrophobicContact CD2-CD1 3.63Å; L194-L250 HydrophobicContact CD2-CD2 4.03Å; L194-L250 HydrophobicContact CD2-CG 3.71Å; L194-L254 HydrophobicContact CD2-CD1 3.82Å; L194-L254 HydrophobicContact CD2-CD2 3.98Å; L194-L254 HydrophobicContact CD2-CG 4.04Å
195	F	70.1	Confident	68.9	Low	45 Å²	45	62.3 Å²	62.3	20%	0.197	32%	0.32	C	S	.	.	H	α-helix	trans	-76.6	-24.1	175	-74.4	-68.2	0	0	0	112.8	R191 K192 R201 L204 L250	R191-F195 HydrophobicContact CG-CD2 3.79Å; R191-F195 HydrophobicContact CG-CE2 3.73Å; R191-F195 WeakPolarHBondContact O-CD2 3.47Å; R191-F195 PolarHBondContact O-N 3.42Å; K192-F195 CarbonylContact O-C 3.58Å; K192-F195 PolarHBondContact O-N 3.43Å; K192-F195 VanDerWaalsContact O-N 3.13Å; F195-R201 WeakPolarHBondContact O-CA 3.43Å; F195-R201 PolarHBondContact O-N 3.35Å; F195-L204 HydrophobicContact CD1-CB 4.44Å; F195-L250 HydrophobicContact CE1-CD2 4.16Å
196	T	65.7	Low	70.7	Confident	91 Å²	91	59.3 Å²	59.3	56%	0.558	30%	0.299	S	S	*	.	H	α-helix	trans	-86	-20.3	173.9	56.8	0	0	0	0	112.8	K192 S193	K192-T196 WeakPolarHBondContact O-CB 3.1Å; K192-T196 VanDerWaalsContact O-CG2 3.28Å; K192-T196 WeakPolarHBondContact O-CG2 3.5Å; K192-T196 PolarHBondContact O-N 2.83Å; K192-T196 PolarHBondContact O-OG1 2.83Å; S193-T196 VanDerWaalsContact CA-OG1 3.28Å; S193-T196 WeakPolarHBondContact CA-OG1 3.31Å; S193-T196 PolarHBondContact O-OG1 3.06Å; S193-T196 VanDerWaalsContact O-OG1 3.11Å
197	S	65.8	Low	72.5	Confident	71 Å²	71	59 Å²	59	50%	0.497	30%	0.296	S	S	.	.	S	Bend	trans	-147.4	136.7	-173.7	-61.1	0	0	0	0	112.7	S193 L194	S193-S197 WeakPolarHBondContact O-CB 3.46Å; S193-S197 PolarHBondContact O-N 3.11Å; L194-S197 CarbonylContact C-O 3.53Å
198	G	75.1	Confident	74.2	Confident	11 Å²	11	60 Å²	60	11%	0.113	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	-139.1	178.3	0	0	0	0	0	113.2	G200 R201 E329	G198-G200 VanDerWaalsContact C-N 3.35Å; G198-G200 PolarHBondContact O-N 3.3Å; G198-R201 PolarHBondContact O-N 3.48Å; G198-E329 WeakPolarHBondContact CA-OE1 3.47Å
199	P	74.4	Confident	75.7	Confident	15 Å²	15	57.5 Å²	57.5	10%	0.097	30%	0.299	C	S	.	.	H	α-helix	trans	-61.1	-37.6	-171.3	19.9	-30.8	0	0	0	113.9	L194 R201 V202 V203 D351 T354	L194-P199 HydrophobicContact CD1-CG 3.99Å; L194-P199 HydrophobicContact CG-CG 4.46Å; P199-R201 VanDerWaalsContact C-N 3.28Å; P199-R201 PolarHBondContact O-N 3.21Å; P199-V202 PolarHBondContact O-N 2.82Å; P199-V203 WeakPolarHBondContact O-CG2 3.3Å; P199-V203 PolarHBondContact O-N 2.73Å; P199-V203 VanDerWaalsContact O-N 3.08Å; P199-D351 WeakPolarHBondContact CB-OD2 3.43Å; P199-T354 WeakPolarHBondContact CA-OG1 3.43Å; P199-T354 WeakPolarHBondContact CB-OG1 3.32Å
200	G	79.6	Confident	77	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-68.4	-28.5	-176.8	0	0	0	0	0	113	L194 G198 L204 L250	L194-G200 WeakPolarHBondContact O-CA 3.44Å; L194-G200 PolarHBondContact O-N 2.91Å; L194-G200 VanDerWaalsContact O-N 3.17Å; G198-G200 VanDerWaalsContact C-N 3.35Å; G198-G200 PolarHBondContact O-N 3.3Å; G200-L204 WeakPolarHBondContact O-CB 3.25Å; G200-L204 PolarHBondContact O-N 3.27Å; G200-L250 VanDerWaalsContact CA-CD2 3.41Å
201	R	83.3	Confident	78.3	Confident	132 Å²	132	48.9 Å²	48.9	50%	0.498	27%	0.266	S	S	.	.	H	α-helix	trans	-65.6	-42.9	173.2	-178.9	-179.3	174.2	174.2	1.5	111.3	F195 G198 P199 F205	F195-R201 WeakPolarHBondContact O-CA 3.43Å; F195-R201 PolarHBondContact O-N 3.35Å; G198-R201 PolarHBondContact O-N 3.48Å; P199-R201 VanDerWaalsContact C-N 3.28Å; P199-R201 PolarHBondContact O-N 3.21Å; R201-F205 WeakPolarHBondContact O-CB 3.37Å; R201-F205 PolarHBondContact O-N 3.12Å
202	V	82.2	Confident	79.4	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.024	28%	0.284	C	S	.	.	H	α-helix	trans	-62.9	-50.6	178.4	178.8	0	0	0	0	109.6	P199 L204 F205 A206 A326 E329 T354 V357	P199-V202 PolarHBondContact O-N 2.82Å; V202-L204 PolarHBondContact O-N 3.42Å; V202-F205 PolarHBondContact O-N 3.08Å; V202-A206 VanDerWaalsContact O-CB 3.31Å; V202-A206 WeakPolarHBondContact O-CB 3.33Å; V202-A206 PolarHBondContact O-N 3.29Å; V202-A326 HydrophobicContact CG1-CB 3.82Å; V202-E329 HydrophobicContact CG2-CB 3.48Å; V202-E329 VanDerWaalsContact CG2-CB 3.48Å; V202-E329 HydrophobicContact CG2-CG 3.64Å; V202-T354 HydrophobicContact CG2-CG2 4.45Å; V202-V357 HydrophobicContact CG1-CB 4.48Å; V202-V357 HydrophobicContact CG1-CG1 4.16Å
203	V	82.9	Confident	80.6	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-43	-179	178.3	0	0	0	0	111.8	P199 A206 I207 V246 A247 V357	P199-V203 WeakPolarHBondContact O-CG2 3.3Å; P199-V203 PolarHBondContact O-N 2.73Å; P199-V203 VanDerWaalsContact O-N 3.08Å; V203-A206 PolarHBondContact O-N 2.89Å; V203-I207 HydrophobicContact CG1-CD1 4.16Å; V203-I207 WeakPolarHBondContact O-CG1 3.3Å; V203-I207 PolarHBondContact O-N 3.21Å; V203-V246 HydrophobicContact CG1-CG1 4.4Å; V203-V246 HydrophobicContact CG2-CG1 4.05Å; V203-A247 HydrophobicContact CG1-CB 3.61Å; V203-V357 HydrophobicContact CG2-CG2 4.31Å
204	L	87.2	Confident	81.7	Confident	93 Å²	93	44 Å²	44	49%	0.487	25%	0.246	S	C	.	.	H	α-helix	trans	-66.4	-39.7	179	-176.5	65.1	0	0	0	112.1	F195 G200 V202 I207 A208	F195-L204 HydrophobicContact CD1-CB 4.44Å; G200-L204 WeakPolarHBondContact O-CB 3.25Å; G200-L204 PolarHBondContact O-N 3.27Å; V202-L204 PolarHBondContact O-N 3.42Å; L204-I207 PolarHBondContact O-N 3.12Å; L204-A208 WeakPolarHBondContact O-CB 3.43Å; L204-A208 PolarHBondContact O-N 2.92Å
205	F	87.3	Confident	82.8	Confident	86 Å²	86	44.9 Å²	44.9	38%	0.377	26%	0.259	S	S	.	.	H	α-helix	trans	-66.3	-41.7	176	-173.9	-95.3	0	0	0	111.5	R201 V202 A208 I209 T322 L325	R201-F205 WeakPolarHBondContact O-CB 3.37Å; R201-F205 PolarHBondContact O-N 3.12Å; V202-F205 PolarHBondContact O-N 3.08Å; F205-A208 PolarHBondContact O-N 3.43Å; F205-I209 HydrophobicContact CD1-CD1 3.8Å; F205-I209 HydrophobicContact CD1-CG1 4.24Å; F205-I209 HydrophobicContact CE1-CD1 3.12Å; F205-I209 HydrophobicContact CE1-CG1 3.99Å; F205-I209 HydrophobicContact CE2-CD1 4.26Å; F205-I209 HydrophobicContact CZ-CD1 3.4Å; F205-I209 HydrophobicContact CZ-CG1 4.21Å; F205-I209 PolarHBondContact O-N 2.95Å; F205-T322 HydrophobicContact CD1-CG2 4.47Å; F205-L325 HydrophobicContact CB-CD2 3.54Å; F205-L325 HydrophobicContact CD1-CB 4.36Å; F205-L325 HydrophobicContact CD1-CD2 3.18Å; F205-L325 HydrophobicContact CD1-CG 4.37Å; F205-L325 HydrophobicContact CD2-CD2 4.05Å; F205-L325 HydrophobicContact CE1-CB 4.3Å; F205-L325 HydrophobicContact CE1-CD2 3.73Å; F205-L325 HydrophobicContact CG-CD2 3.32Å; F205-L325 HydrophobicContact CZ-CD2 4.38Å
206	A	85.4	Confident	83.7	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.008	27%	0.274	C	S	.	.	H	α-helix	trans	-58	-49.8	174.8	0	0	0	0	0	110.6	V202 V203 A208 I209 N210 Q243 V357	V202-A206 VanDerWaalsContact O-CB 3.31Å; V202-A206 WeakPolarHBondContact O-CB 3.33Å; V202-A206 PolarHBondContact O-N 3.29Å; V203-A206 PolarHBondContact O-N 2.89Å; A206-A208 VanDerWaalsContact C-N 3.3Å; A206-A208 PolarHBondContact O-N 3.3Å; A206-I209 PolarHBondContact O-N 3.1Å; A206-N210 PolarHBondContact O-N 3.25Å; A206-Q243 HydrophobicContact CB-CG 4.48Å; A206-Q243 PolarHBondContact O-OE1 2.78Å; A206-V357 HydrophobicContact CB-CG1 3.92Å
207	I	88.3	Confident	84.7	Confident	39 Å²	39	42.2 Å²	42.2	20%	0.2	25%	0.251	C	S	.	.	H	α-helix	trans	-56.6	-43.4	175.3	-70.6	171.9	0	0	0	111.7	V203 L204 G211 Q243 V244 A247	V203-I207 HydrophobicContact CG1-CD1 4.16Å; V203-I207 WeakPolarHBondContact O-CG1 3.3Å; V203-I207 PolarHBondContact O-N 3.21Å; L204-I207 PolarHBondContact O-N 3.12Å; I207-G211 PolarHBondContact O-N 3.34Å; I207-Q243 VanDerWaalsContact CA-OE1 3.25Å; I207-Q243 HydrophobicContact CG1-CB 3.64Å; I207-Q243 VanDerWaalsContact N-OE1 3.12Å; I207-V244 HydrophobicContact CD1-CG2 4.34Å; I207-A247 HydrophobicContact CD1-CB 3.47Å; I207-A247 VanDerWaalsContact CD1-CB 3.47Å
208	A	90.3	Very high	85.8	Confident	61 Å²	61	40.2 Å²	40.2	50%	0.504	24%	0.239	S	C	.	.	H	α-helix	trans	-65.4	-43.5	-178.8	0	0	0	0	0	112	L204 F205 A206 L212	L204-A208 WeakPolarHBondContact O-CB 3.43Å; L204-A208 PolarHBondContact O-N 2.92Å; F205-A208 PolarHBondContact O-N 3.43Å; A206-A208 VanDerWaalsContact C-N 3.3Å; A206-A208 PolarHBondContact O-N 3.3Å; A208-L212 WeakPolarHBondContact O-CB 3.3Å; A208-L212 PolarHBondContact O-N 2.89Å
209	I	87.7	Confident	86.5	Confident	28 Å²	28	47 Å²	47	14%	0.144	27%	0.265	C	S	.	.	H	α-helix	trans	-70	-47.2	178.5	-67.8	-165.9	0	0	0	111.3	F205 A206 G211 L212 N213 S321 T322	F205-I209 HydrophobicContact CD1-CD1 3.8Å; F205-I209 HydrophobicContact CD1-CG1 4.24Å; F205-I209 HydrophobicContact CE1-CD1 3.12Å; F205-I209 HydrophobicContact CE1-CG1 3.99Å; F205-I209 HydrophobicContact CE2-CD1 4.26Å; F205-I209 HydrophobicContact CZ-CD1 3.4Å; F205-I209 HydrophobicContact CZ-CG1 4.21Å; F205-I209 PolarHBondContact O-N 2.95Å; A206-I209 PolarHBondContact O-N 3.1Å; I209-G211 VanDerWaalsContact C-N 3.31Å; I209-G211 PolarHBondContact O-N 3.19Å; I209-L212 WeakPolarHBondContact O-CB 3.46Å; I209-L212 PolarHBondContact O-N 2.61Å; I209-L212 VanDerWaalsContact O-N 3.11Å; I209-N213 PolarHBondContact O-N 2.83Å; I209-S321 VanDerWaalsContact CD1-OG 3.3Å; I209-S321 WeakPolarHBondContact CD1-OG 3.24Å; I209-T322 HydrophobicContact CB-CG2 3.67Å; I209-T322 HydrophobicContact CD1-CG2 3.73Å; I209-T322 HydrophobicContact CG1-CG2 4.15Å; I209-T322 HydrophobicContact CG2-CG2 3.69Å
210	N	87.2	Confident	87	Confident	7 Å²	7	47.3 Å²	47.3	4%	0.037	27%	0.272	C	S	.	.	H	α-helix	trans	-66.5	-36.6	179.5	-77	18.1	0	0	0	111.5	A206 L212 N213 V214 T240 Q243	A206-N210 PolarHBondContact O-N 3.25Å; N210-L212 VanDerWaalsContact C-N 3.32Å; N210-L212 PolarHBondContact O-N 2.62Å; N210-N213 WeakPolarHBondContact O-CB 3.37Å; N210-N213 PolarHBondContact O-N 3.36Å; N210-V214 WeakPolarHBondContact O-CG2 2.94Å; N210-V214 PolarHBondContact O-N 2.98Å; N210-T240 PolarHBondContact O-OG1 3.22Å; N210-Q243 VanDerWaalsContact CB-OE1 3.28Å; N210-Q243 VanDerWaalsContact CG-NE2 3.28Å; N210-Q243 PolarHBondContact ND2-NE2 2.93Å; N210-Q243 PolarHBondContact ND2-OE1 3.37Å
211	G	89.8	Confident	87.3	Confident	30 Å²	30	51.6 Å²	51.6	31%	0.309	29%	0.288	S	S	.	.	H	α-helix	trans	-60.3	-40.3	171.1	0	0	0	0	0	112.8	I207 I209 V214 A215	I207-G211 PolarHBondContact O-N 3.34Å; I209-G211 VanDerWaalsContact C-N 3.31Å; I209-G211 PolarHBondContact O-N 3.19Å; G211-V214 PolarHBondContact O-N 3.03Å; G211-A215 PolarHBondContact O-N 2.62Å
212	L	90.1	Very high	87.6	Confident	122 Å²	122	55.5 Å²	55.5	64%	0.639	30%	0.303	S	S	*	.	H	α-helix	trans	-66.3	-40.3	174.1	-175.5	65.2	0	0	0	111.7	A208 I209 N210 A215 A216	A208-L212 WeakPolarHBondContact O-CB 3.3Å; A208-L212 PolarHBondContact O-N 2.89Å; I209-L212 WeakPolarHBondContact O-CB 3.46Å; I209-L212 PolarHBondContact O-N 2.61Å; I209-L212 VanDerWaalsContact O-N 3.11Å; N210-L212 VanDerWaalsContact C-N 3.32Å; N210-L212 PolarHBondContact O-N 2.62Å; L212-A215 PolarHBondContact O-N 3.02Å; L212-A216 WeakPolarHBondContact O-CB 3.48Å; L212-A216 PolarHBondContact O-N 3.43Å
213	N	86.8	Confident	87.8	Confident	25 Å²	25	64.5 Å²	64.5	13%	0.134	34%	0.338	C	S	.	.	H	α-helix	trans	-61.2	-44.4	174.9	-75.8	-13.2	0	0	0	111.8	I209 N210 A215 A216 K217 S318	I209-N213 PolarHBondContact O-N 2.83Å; N210-N213 WeakPolarHBondContact O-CB 3.37Å; N210-N213 PolarHBondContact O-N 3.36Å; N213-A215 VanDerWaalsContact C-N 3.33Å; N213-A215 PolarHBondContact O-N 3.18Å; N213-A216 PolarHBondContact O-N 3.31Å; N213-K217 WeakPolarHBondContact O-CB 3.38Å; N213-K217 WeakPolarHBondContact O-CG 3.48Å; N213-K217 PolarHBondContact O-N 3.48Å; N213-S318 WeakPolarHBondContact ND2-CB 3.26Å; N213-S318 PolarHBondContact ND2-OG 3.09Å; N213-S318 VanDerWaalsContact OD1-CB 3.31Å; N213-S318 WeakPolarHBondContact OD1-CB 3.19Å; N213-S318 PolarHBondContact OD1-OG 3.26Å
214	V	89.2	Confident	87.8	Confident	24 Å²	24	67.4 Å²	67.4	15%	0.145	36%	0.355	C	S	.	.	H	α-helix	trans	-59.2	-46.2	174.3	172.9	0	0	0	0	110.5	N210 G211 A216 K217 A218 S236 L237 T240	N210-V214 WeakPolarHBondContact O-CG2 2.94Å; N210-V214 PolarHBondContact O-N 2.98Å; G211-V214 PolarHBondContact O-N 3.03Å; V214-A216 VanDerWaalsContact C-N 3.35Å; V214-A216 PolarHBondContact O-N 3.21Å; V214-K217 PolarHBondContact O-N 3Å; V214-A218 WeakPolarHBondContact O-CB 3.49Å; V214-A218 PolarHBondContact O-N 2.81Å; V214-S236 WeakPolarHBondContact CG2-O 3.34Å; V214-L237 HydrophobicContact CG1-CD1 4.41Å; V214-L237 HydrophobicContact CG2-CB 4.38Å; V214-T240 VanDerWaalsContact CG2-OG1 3.28Å; V214-T240 WeakPolarHBondContact CG2-OG1 3.34Å
215	A	91.1	Very high	87.5	Confident	57 Å²	57	65.7 Å²	65.7	47%	0.471	36%	0.361	S	S	.	.	H	α-helix	trans	-61.5	-42.5	178.2	0	0	0	0	0	112.2	G211 L212 N213 A218 F219	G211-A215 PolarHBondContact O-N 2.62Å; L212-A215 PolarHBondContact O-N 3.02Å; N213-A215 VanDerWaalsContact C-N 3.33Å; N213-A215 PolarHBondContact O-N 3.18Å; A215-A218 PolarHBondContact O-N 2.91Å; A215-F219 PolarHBondContact O-N 3.4Å
216	A	87.7	Confident	87.1	Confident	62 Å²	62	63 Å²	63	51%	0.512	35%	0.353	S	S	.	.	H	α-helix	trans	-65.2	-47.4	177.6	0	0	0	0	0	112.2	L212 N213 V214 A218 F219 G220	L212-A216 WeakPolarHBondContact O-CB 3.48Å; L212-A216 PolarHBondContact O-N 3.43Å; N213-A216 PolarHBondContact O-N 3.31Å; V214-A216 VanDerWaalsContact C-N 3.35Å; V214-A216 PolarHBondContact O-N 3.21Å; A216-A218 VanDerWaalsContact C-N 3.35Å; A216-F219 PolarHBondContact O-N 3.1Å; A216-G220 PolarHBondContact O-N 3.29Å
217	K	87.3	Confident	86.9	Confident	19 Å²	19	71.9 Å²	71.9	8%	0.083	39%	0.391	C	S	.	.	H	α-helix	trans	-67.1	-34.7	177.3	-69.8	-177.7	179.3	-172.2	0	112.1	N213 V214 G220 W221 E232 M233 S236 S315	N213-K217 WeakPolarHBondContact O-CB 3.38Å; N213-K217 WeakPolarHBondContact O-CG 3.48Å; N213-K217 PolarHBondContact O-N 3.48Å; V214-K217 PolarHBondContact O-N 3Å; K217-G220 PolarHBondContact O-N 3.25Å; K217-W221 WeakPolarHBondContact O-CB 3.36Å; K217-W221 PolarHBondContact O-N 2.74Å; K217-E232 HydrophobicContact CD-CB 4.19Å; K217-E232 WeakPolarHBondContact CD-O 3.31Å; K217-E232 IonicContact NZ-OE2 3.82Å; K217-E232 PolarHBondContact NZ-OE2 2.81Å; K217-M233 HydrophobicContact CB-CB 4.14Å; K217-S236 WeakPolarHBondContact CD-OG 3.48Å; K217-S236 WeakPolarHBondContact CE-OG 3.36Å; K217-S236 PolarHBondContact NZ-OG 2.98Å; K217-S315 PolarHBondContact NZ-OG 3.36Å
218	A	89.1	Confident	86.3	Confident	28 Å²	28	72.8 Å²	72.8	23%	0.231	40%	0.401	C	S	.	.	H	α-helix	trans	-64.5	-41.6	173.5	0	0	0	0	0	112	V214 A215 A216 W221 W222 M233	V214-A218 WeakPolarHBondContact O-CB 3.49Å; V214-A218 PolarHBondContact O-N 2.81Å; A215-A218 PolarHBondContact O-N 2.91Å; A216-A218 VanDerWaalsContact C-N 3.35Å; A218-W221 PolarHBondContact O-N 2.76Å; A218-W222 WeakPolarHBondContact O-CB 3.13Å; A218-W222 PolarHBondContact O-N 3.17Å; A218-M233 HydrophobicContact CB-CG 3.94Å; A218-M233 HydrophobicContact CB-SD 3.62Å
219	F	88.9	Confident	85.9	Confident	153 Å²	153	70.2 Å²	70.2	67%	0.671	38%	0.378	S	S	*	.	H	α-helix	trans	-65.1	-42.2	173.3	-174.1	-97.2	0	0	0	111.6	A215 A216 W221 W222 Y223	A215-F219 PolarHBondContact O-N 3.4Å; A216-F219 PolarHBondContact O-N 3.1Å; F219-W221 PolarHBondContact O-N 2.94Å; F219-W222 PolarHBondContact O-N 3.18Å; F219-Y223 WeakPolarHBondContact O-CB 3.21Å; F219-Y223 PolarHBondContact O-N 2.78Å
220	G	84.9	Confident	85.8	Confident	22 Å²	22	73.1 Å²	73.1	23%	0.227	39%	0.39	C	S	.	.	H	α-helix	trans	-60.8	-42.5	174.2	0	0	0	0	0	112.9	A216 K217 Y223 T224	A216-G220 PolarHBondContact O-N 3.29Å; K217-G220 PolarHBondContact O-N 3.25Å; G220-Y223 PolarHBondContact O-N 3.31Å; G220-T224 WeakPolarHBondContact O-CB 3.42Å; G220-T224 VanDerWaalsContact O-CG2 3.27Å; G220-T224 WeakPolarHBondContact O-CG2 3.33Å; G220-T224 PolarHBondContact O-N 2.73Å; G220-T224 PolarHBondContact O-OG1 3.23Å
221	W	86.4	Confident	85.5	Confident	90 Å²	90	76.4 Å²	76.4	34%	0.341	41%	0.414	S	S	.	.	H	α-helix	trans	-63.4	-47.2	173.1	168.1	63.7	0	0	0	112.1	K217 A218 F219 Y223 T224 G225 M229 F230 M233	K217-W221 WeakPolarHBondContact O-CB 3.36Å; K217-W221 PolarHBondContact O-N 2.74Å; A218-W221 PolarHBondContact O-N 2.76Å; F219-W221 PolarHBondContact O-N 2.94Å; W221-Y223 VanDerWaalsContact C-N 3.26Å; W221-Y223 PolarHBondContact O-N 3.37Å; W221-T224 PolarHBondContact O-N 2.99Å; W221-G225 WeakPolarHBondContact O-CA 3.39Å; W221-G225 PolarHBondContact O-N 2.96Å; W221-M229 HydrophobicContact CB-CB 3.99Å; W221-F230 AromaticContact CD2-CD2 3.99Å; W221-F230 HydrophobicContact CD2-CD2 3.99Å; W221-F230 AromaticContact CE2-CD2 3.59Å; W221-F230 HydrophobicContact CG-CB 4.2Å; W221-F230 HydrophobicContact CG-CD2 4.32Å; W221-F230 AromaticContact CZ2-CD2 3.88Å; W221-F230 HydrophobicContact CZ2-CD2 3.88Å; W221-F230 HydrophobicContact CZ2-CE2 4.3Å; W221-F230 AromaticContact NE1-CD2 3.74Å; W221-M233 HydrophobicContact CE3-SD 4.04Å
222	W	89	Confident	85.1	Confident	214 Å²	214	77.7 Å²	77.7	81%	0.811	41%	0.412	S	S	*	.	H	α-helix	trans	-55.9	-45.2	177.4	-174.5	-54.5	0	0	0	110.9	A218 F219	A218-W222 WeakPolarHBondContact O-CB 3.13Å; A218-W222 PolarHBondContact O-N 3.17Å; F219-W222 PolarHBondContact O-N 3.18Å
223	Y	87.1	Confident	85	Confident	193 Å²	193	73 Å²	73	76%	0.757	39%	0.387	S	S	*	.	H	α-helix	trans	-71.7	-41.6	-177.9	-172.7	-96.9	0	0	0	113.1	F219 G220 W221	F219-Y223 WeakPolarHBondContact O-CB 3.21Å; F219-Y223 PolarHBondContact O-N 2.78Å; G220-Y223 PolarHBondContact O-N 3.31Å; W221-Y223 VanDerWaalsContact C-N 3.26Å; W221-Y223 PolarHBondContact O-N 3.37Å
224	T	84	Confident	85.1	Confident	61 Å²	61	75.8 Å²	75.8	37%	0.374	40%	0.4	S	S	.	.	H	α-helix	trans	-85.9	-25.2	-175.7	58.4	0	0	0	0	113.9	G220 W221 S226 M229 L307	G220-T224 WeakPolarHBondContact O-CB 3.42Å; G220-T224 VanDerWaalsContact O-CG2 3.27Å; G220-T224 WeakPolarHBondContact O-CG2 3.33Å; G220-T224 PolarHBondContact O-N 2.73Å; G220-T224 PolarHBondContact O-OG1 3.23Å; W221-T224 PolarHBondContact O-N 2.99Å; T224-S226 PolarHBondContact O-N 2.71Å; T224-S226 VanDerWaalsContact O-N 3.09Å; T224-S226 PolarHBondContact OG1-N 3.45Å; T224-M229 HydrophobicContact CG2-CG 4.46Å; T224-M229 WeakPolarHBondContact OG1-CG 3.16Å; T224-L307 HydrophobicContact CG2-CD1 4.18Å
225	G	80.5	Confident	84.9	Confident	58 Å²	58	79.2 Å²	79.2	60%	0.598	41%	0.414	S	S	*	.			trans	62	9.1	-170.2	0	0	0	0	0	114.3	W221	W221-G225 WeakPolarHBondContact O-CA 3.39Å; W221-G225 PolarHBondContact O-N 2.96Å
226	S	78.2	Confident	84.7	Confident	30 Å²	30	76.6 Å²	76.6	21%	0.21	39%	0.393	C	S	.	.			trans	-78.3	135.7	-170.4	175.1	0	0	0	0	112.2	T224 S228 M229 F230	T224-S226 PolarHBondContact O-N 2.71Å; T224-S226 VanDerWaalsContact O-N 3.09Å; T224-S226 PolarHBondContact OG1-N 3.45Å; S226-S228 PolarHBondContact O-N 3.22Å; S226-S228 PolarHBondContact OG-N 3.16Å; S226-M229 PolarHBondContact O-N 3.34Å; S226-F230 PolarHBondContact O-N 3.14Å
227	K	81.3	Confident	84.8	Confident	187 Å²	187	76.8 Å²	76.8	81%	0.813	39%	0.385	S	S	*	.	H	α-helix	trans	-61.8	-33.1	173.2	-66.6	180	-177.1	171.3	0	112.2	F230 S231	K227-F230 WeakPolarHBondContact O-CB 3.24Å; K227-F230 PolarHBondContact O-N 2.87Å; K227-S231 PolarHBondContact O-N 2.96Å
228	S	76.4	Confident	84.9	Confident	58 Å²	58	78.4 Å²	78.4	41%	0.406	40%	0.402	S	S	.	.	H	α-helix	trans	-64.4	-46.5	175.4	172	0	0	0	0	110.9	S226 F230 S231 E232	S226-S228 PolarHBondContact O-N 3.22Å; S226-S228 PolarHBondContact OG-N 3.16Å; S228-F230 VanDerWaalsContact C-N 3.31Å; S228-F230 PolarHBondContact O-N 3.05Å; S228-S231 WeakPolarHBondContact O-CB 3.29Å; S228-S231 PolarHBondContact O-N 3.36Å; S228-S231 VanDerWaalsContact O-N 3.17Å; S228-E232 PolarHBondContact O-N 3.25Å
229	M	81.9	Confident	84.8	Confident	6 Å²	6	78.5 Å²	78.5	3%	0.03	40%	0.398	C	S	.	.	H	α-helix	trans	-64	-34.4	175.6	-72.6	-63.6	98.6	0	0	113	W221 T224 S226 E232 M233 L307 V311	W221-M229 HydrophobicContact CB-CB 3.99Å; T224-M229 HydrophobicContact CG2-CG 4.46Å; T224-M229 WeakPolarHBondContact OG1-CG 3.16Å; S226-M229 PolarHBondContact O-N 3.34Å; M229-E232 HydrophobicContact CE-CG 4.22Å; M229-E232 PolarHBondContact O-N 3.35Å; M229-M233 WeakPolarHBondContact O-CB 3.2Å; M229-M233 PolarHBondContact O-N 3.25Å; M229-L307 HydrophobicContact CE-CD2 3.26Å; M229-L307 HydrophobicContact CE-CG 4.17Å; M229-L307 HydrophobicContact CG-CD2 3.71Å; M229-L307 HydrophobicContact SD-CD2 3.71Å; M229-L307 HydrophobicContact SD-CG 4.43Å; M229-V311 HydrophobicContact CE-CB 4.19Å; M229-V311 HydrophobicContact CE-CG1 4.42Å; M229-V311 HydrophobicContact CE-CG2 3.51Å; M229-V311 HydrophobicContact SD-CG2 3.71Å
230	F	85.6	Confident	84.8	Confident	89 Å²	89	72.2 Å²	72.2	39%	0.39	37%	0.372	S	S	.	.	H	α-helix	trans	-62.3	-44.2	173.3	-176	-105.2	0	0	0	111.9	W221 S226 K227 S228 E232 M233 M234	W221-F230 AromaticContact CD2-CD2 3.99Å; W221-F230 HydrophobicContact CD2-CD2 3.99Å; W221-F230 AromaticContact CE2-CD2 3.59Å; W221-F230 HydrophobicContact CG-CB 4.2Å; W221-F230 HydrophobicContact CG-CD2 4.32Å; W221-F230 AromaticContact CZ2-CD2 3.88Å; W221-F230 HydrophobicContact CZ2-CD2 3.88Å; W221-F230 HydrophobicContact CZ2-CE2 4.3Å; W221-F230 AromaticContact NE1-CD2 3.74Å; S226-F230 PolarHBondContact O-N 3.14Å; K227-F230 WeakPolarHBondContact O-CB 3.24Å; K227-F230 PolarHBondContact O-N 2.87Å; S228-F230 VanDerWaalsContact C-N 3.31Å; S228-F230 PolarHBondContact O-N 3.05Å; F230-E232 VanDerWaalsContact C-N 3.35Å; F230-E232 PolarHBondContact O-N 3.49Å; F230-M233 HydrophobicContact CD2-CE 3.58Å; F230-M233 HydrophobicContact CE2-CE 3.48Å; F230-M233 VanDerWaalsContact CE2-CE 3.48Å; F230-M233 HydrophobicContact CZ-CE 4.39Å; F230-M233 PolarHBondContact O-N 2.82Å; F230-M234 HydrophobicContact CD1-CG 4.2Å; F230-M234 HydrophobicContact CE1-CG 3.76Å; F230-M234 HydrophobicContact CE2-CG 4.29Å; F230-M234 HydrophobicContact CE2-SD 4.48Å; F230-M234 HydrophobicContact CZ-CG 3.81Å; F230-M234 HydrophobicContact CZ-SD 4.06Å; F230-M234 WeakPolarHBondContact O-CG 3.01Å; F230-M234 PolarHBondContact O-N 3.29Å
231	S	80.8	Confident	85	Confident	77 Å²	77	77.2 Å²	77.2	54%	0.538	39%	0.391	S	S	.	.	H	α-helix	trans	-60.7	-44.4	176.7	-170.5	0	0	0	0	111.5	K227 S228 M233 M234 H235	K227-S231 PolarHBondContact O-N 2.96Å; S228-S231 WeakPolarHBondContact O-CB 3.29Å; S228-S231 PolarHBondContact O-N 3.36Å; S228-S231 VanDerWaalsContact O-N 3.17Å; S231-M233 PolarHBondContact O-N 3.42Å; S231-M234 PolarHBondContact O-N 3.17Å; S231-H235 PolarHBondContact O-N 2.86Å
232	E	81.3	Confident	85.3	Confident	56 Å²	56	73.6 Å²	73.6	26%	0.262	38%	0.379	S	S	.	.	H	α-helix	trans	-61.9	-41.2	175.9	-82.4	-62.9	137.1	0	0	112.9	K217 S228 M229 F230 H235 S236 V311	K217-E232 HydrophobicContact CD-CB 4.19Å; K217-E232 WeakPolarHBondContact CD-O 3.31Å; K217-E232 IonicContact NZ-OE2 3.82Å; K217-E232 PolarHBondContact NZ-OE2 2.81Å; S228-E232 PolarHBondContact O-N 3.25Å; M229-E232 HydrophobicContact CE-CG 4.22Å; M229-E232 PolarHBondContact O-N 3.35Å; F230-E232 VanDerWaalsContact C-N 3.35Å; F230-E232 PolarHBondContact O-N 3.49Å; E232-H235 PolarHBondContact O-N 2.95Å; E232-S236 PolarHBondContact O-N 3.35Å; E232-V311 HydrophobicContact CB-CG1 4.47Å; E232-V311 HydrophobicContact CG-CG1 4.08Å
233	M	88	Confident	85.4	Confident	23 Å²	23	63.4 Å²	63.4	11%	0.113	34%	0.34	C	S	.	.	H	α-helix	trans	-62.6	-45.3	173.9	180	-160	71.9	0	0	111.4	K217 A218 W221 M229 F230 S231 H235 S236 L237	K217-M233 HydrophobicContact CB-CB 4.14Å; A218-M233 HydrophobicContact CB-CG 3.94Å; A218-M233 HydrophobicContact CB-SD 3.62Å; W221-M233 HydrophobicContact CE3-SD 4.04Å; M229-M233 WeakPolarHBondContact O-CB 3.2Å; M229-M233 PolarHBondContact O-N 3.25Å; F230-M233 HydrophobicContact CD2-CE 3.58Å; F230-M233 HydrophobicContact CE2-CE 3.48Å; F230-M233 VanDerWaalsContact CE2-CE 3.48Å; F230-M233 HydrophobicContact CZ-CE 4.39Å; F230-M233 PolarHBondContact O-N 2.82Å; S231-M233 PolarHBondContact O-N 3.42Å; M233-H235 VanDerWaalsContact C-N 3.31Å; M233-H235 PolarHBondContact O-N 2.73Å; M233-S236 PolarHBondContact O-N 2.75Å; M233-L237 WeakPolarHBondContact O-CB 3.39Å; M233-L237 PolarHBondContact O-N 3.45Å
234	M	88.4	Confident	85.6	Confident	85 Å²	85	57.9 Å²	57.9	42%	0.419	33%	0.326	S	S	.	.	H	α-helix	trans	-65	-34.7	178.9	-74.1	-58.9	-57.8	0	0	112.5	F230 S231 L237 A238	F230-M234 HydrophobicContact CD1-CG 4.2Å; F230-M234 HydrophobicContact CE1-CG 3.76Å; F230-M234 HydrophobicContact CE2-CG 4.29Å; F230-M234 HydrophobicContact CE2-SD 4.48Å; F230-M234 HydrophobicContact CZ-CG 3.81Å; F230-M234 HydrophobicContact CZ-SD 4.06Å; F230-M234 WeakPolarHBondContact O-CG 3.01Å; F230-M234 PolarHBondContact O-N 3.29Å; S231-M234 PolarHBondContact O-N 3.17Å; M234-L237 HydrophobicContact CE-CD2 4.25Å; M234-L237 PolarHBondContact O-N 2.82Å; M234-L237 HydrophobicContact SD-CD2 4.11Å; M234-A238 PolarHBondContact O-N 2.9Å
235	H	84.7	Confident	86	Confident	95 Å²	95	57.4 Å²	57.4	44%	0.44	32%	0.321	S	S	.	.	H	α-helix	trans	-61.3	-55.1	173.9	-170.8	68.3	0	0	0	111.1	S231 E232 M233 L237 A238 D239	S231-H235 PolarHBondContact O-N 2.86Å; E232-H235 PolarHBondContact O-N 2.95Å; M233-H235 VanDerWaalsContact C-N 3.31Å; M233-H235 PolarHBondContact O-N 2.73Å; H235-L237 PolarHBondContact O-N 3.28Å; H235-A238 WeakPolarHBondContact O-CA 2.98Å; H235-A238 WeakPolarHBondContact O-CB 3.37Å; H235-A238 PolarHBondContact O-N 3.19Å; H235-D239 IonicContact CD2-OD2 2.78Å; H235-D239 PolarHBondContact O-N 3.1Å; H235-D239 VanDerWaalsContact O-N 3.09Å
236	S	87.7	Confident	86.5	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-63.9	-27	178	-64.8	0	0	0	0	113.4	V214 K217 E232 M233 T240	V214-S236 WeakPolarHBondContact CG2-O 3.34Å; K217-S236 WeakPolarHBondContact CD-OG 3.48Å; K217-S236 WeakPolarHBondContact CE-OG 3.36Å; K217-S236 PolarHBondContact NZ-OG 2.98Å; E232-S236 PolarHBondContact O-N 3.35Å; M233-S236 PolarHBondContact O-N 2.75Å; S236-T240 WeakPolarHBondContact O-CB 3.4Å; S236-T240 PolarHBondContact O-N 2.77Å; S236-T240 PolarHBondContact O-OG1 2.84Å
237	L	90.2	Very high	87.1	Confident	66 Å²	66	53.9 Å²	53.9	35%	0.346	29%	0.288	S	S	.	.	H	α-helix	trans	-66.8	-42.9	172.7	179.2	62.7	0	0	0	110.9	V214 M233 M234 H235 D239 T240 M241	V214-L237 HydrophobicContact CG1-CD1 4.41Å; V214-L237 HydrophobicContact CG2-CB 4.38Å; M233-L237 WeakPolarHBondContact O-CB 3.39Å; M233-L237 PolarHBondContact O-N 3.45Å; M234-L237 HydrophobicContact CE-CD2 4.25Å; M234-L237 PolarHBondContact O-N 2.82Å; M234-L237 HydrophobicContact SD-CD2 4.11Å; H235-L237 PolarHBondContact O-N 3.28Å; L237-D239 VanDerWaalsContact C-N 3.33Å; L237-D239 PolarHBondContact O-N 3.5Å; L237-T240 PolarHBondContact O-N 2.82Å; L237-M241 WeakPolarHBondContact O-CG 3.31Å; L237-M241 PolarHBondContact O-N 3.36Å
238	A	88.4	Confident	87.5	Confident	53 Å²	53	51.1 Å²	51.1	44%	0.438	27%	0.274	S	S	.	.	H	α-helix	trans	-60	-43.9	174.8	0	0	0	0	0	111.3	M234 H235 T240 M241 N242	M234-A238 PolarHBondContact O-N 2.9Å; H235-A238 WeakPolarHBondContact O-CA 2.98Å; H235-A238 WeakPolarHBondContact O-CB 3.37Å; H235-A238 PolarHBondContact O-N 3.19Å; A238-T240 VanDerWaalsContact C-N 3.34Å; A238-T240 PolarHBondContact O-N 3.38Å; A238-M241 WeakPolarHBondContact O-CB 3.5Å; A238-M241 PolarHBondContact O-N 3.02Å; A238-N242 WeakPolarHBondContact O-CB 3.28Å; A238-N242 PolarHBondContact O-N 3.05Å
239	D	86.3	Confident	88.2	Confident	29 Å²	29	48.4 Å²	48.4	16%	0.155	25%	0.254	C	S	.	.	H	α-helix	trans	-62.7	-41.9	176.6	-55.2	-27.4	0	0	0	111.6	H235 L237 M241 N242 Q243	H235-D239 IonicContact CD2-OD2 2.78Å; H235-D239 PolarHBondContact O-N 3.1Å; H235-D239 VanDerWaalsContact O-N 3.09Å; L237-D239 VanDerWaalsContact C-N 3.33Å; L237-D239 PolarHBondContact O-N 3.5Å; D239-M241 VanDerWaalsContact C-N 3.35Å; D239-M241 PolarHBondContact O-N 3.22Å; D239-N242 WeakPolarHBondContact O-CB 3.28Å; D239-N242 PolarHBondContact O-N 3.16Å; D239-Q243 WeakPolarHBondContact O-CG 3.47Å; D239-Q243 PolarHBondContact O-N 3.39Å
240	T	89	Confident	88.4	Confident	21 Å²	21	48.1 Å²	48.1	13%	0.129	25%	0.253	C	S	.	.	H	α-helix	trans	-63.1	-42.4	176.1	-56.7	0	0	0	0	111.1	N210 V214 S236 L237 A238 N242 Q243 V244	N210-T240 PolarHBondContact O-OG1 3.22Å; V214-T240 VanDerWaalsContact CG2-OG1 3.28Å; V214-T240 WeakPolarHBondContact CG2-OG1 3.34Å; S236-T240 WeakPolarHBondContact O-CB 3.4Å; S236-T240 PolarHBondContact O-N 2.77Å; S236-T240 PolarHBondContact O-OG1 2.84Å; L237-T240 PolarHBondContact O-N 2.82Å; A238-T240 VanDerWaalsContact C-N 3.34Å; A238-T240 PolarHBondContact O-N 3.38Å; T240-N242 VanDerWaalsContact C-N 3.28Å; T240-N242 PolarHBondContact O-N 3.44Å; T240-Q243 PolarHBondContact O-N 3.07Å; T240-V244 VanDerWaalsContact O-CG2 3.3Å; T240-V244 WeakPolarHBondContact O-CG2 3.42Å; T240-V244 PolarHBondContact O-N 2.76Å
241	M	90.7	Very high	88.4	Confident	128 Å²	128	48 Å²	48	63%	0.631	25%	0.251	S	S	*	.	H	α-helix	trans	-61.8	-38.8	175.1	-73.1	-177.5	66.6	0	0	111.7	L237 A238 D239 V244 L245	L237-M241 WeakPolarHBondContact O-CG 3.31Å; L237-M241 PolarHBondContact O-N 3.36Å; A238-M241 WeakPolarHBondContact O-CB 3.5Å; A238-M241 PolarHBondContact O-N 3.02Å; D239-M241 VanDerWaalsContact C-N 3.35Å; D239-M241 PolarHBondContact O-N 3.22Å; M241-V244 PolarHBondContact O-N 2.88Å; M241-L245 PolarHBondContact O-N 3.49Å
242	N	91.5	Very high	88.7	Confident	14 Å²	14	44.6 Å²	44.6	8%	0.075	23%	0.227	C	C	.	.	H	α-helix	trans	-64.2	-43.6	177.5	-161.6	45.5	0	0	0	111.7	A238 D239 T240 V244 L245 V246 S276 M356 E360	A238-N242 WeakPolarHBondContact O-CB 3.28Å; A238-N242 PolarHBondContact O-N 3.05Å; D239-N242 WeakPolarHBondContact O-CB 3.28Å; D239-N242 PolarHBondContact O-N 3.16Å; T240-N242 VanDerWaalsContact C-N 3.28Å; T240-N242 PolarHBondContact O-N 3.44Å; N242-V244 PolarHBondContact O-N 3.37Å; N242-L245 WeakPolarHBondContact O-CB 3.1Å; N242-L245 PolarHBondContact O-N 2.79Å; N242-L245 VanDerWaalsContact O-N 3.15Å; N242-V246 WeakPolarHBondContact O-CG2 3.31Å; N242-V246 PolarHBondContact O-N 3.39Å; N242-S276 WeakPolarHBondContact OD1-CA 3.38Å; N242-S276 WeakPolarHBondContact OD1-CB 3.41Å; N242-S276 PolarHBondContact OD1-OG 3.14Å; N242-M356 WeakPolarHBondContact ND2-CE 3.36Å; N242-E360 VanDerWaalsContact ND2-CD 3.29Å; N242-E360 PolarHBondContact ND2-OE1 3.41Å; N242-E360 PolarHBondContact ND2-OE2 2.77Å
243	Q	91.2	Very high	88.9	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66.1	-36.8	174.7	-68.2	176.5	-11.6	0	0	112.8	A206 I207 N210 D239 T240 L245 V246 A247	A206-Q243 HydrophobicContact CB-CG 4.48Å; A206-Q243 PolarHBondContact O-OE1 2.78Å; I207-Q243 VanDerWaalsContact CA-OE1 3.25Å; I207-Q243 HydrophobicContact CG1-CB 3.64Å; I207-Q243 VanDerWaalsContact N-OE1 3.12Å; N210-Q243 VanDerWaalsContact CB-OE1 3.28Å; N210-Q243 VanDerWaalsContact CG-NE2 3.28Å; N210-Q243 PolarHBondContact ND2-NE2 2.93Å; N210-Q243 PolarHBondContact ND2-OE1 3.37Å; D239-Q243 WeakPolarHBondContact O-CG 3.47Å; D239-Q243 PolarHBondContact O-N 3.39Å; T240-Q243 PolarHBondContact O-N 3.07Å; Q243-L245 VanDerWaalsContact C-N 3.3Å; Q243-L245 PolarHBondContact O-N 2.65Å; Q243-V246 PolarHBondContact O-N 2.73Å; Q243-A247 WeakPolarHBondContact O-CB 3.14Å; Q243-A247 PolarHBondContact O-N 3.17Å
244	V	91.3	Very high	88.6	Confident	76 Å²	76	42.8 Å²	42.8	46%	0.461	22%	0.22	S	C	.	.	H	α-helix	trans	-62.4	-38.6	172.1	170	0	0	0	0	110.9	I207 T240 M241 N242 A247 Y248	I207-V244 HydrophobicContact CD1-CG2 4.34Å; T240-V244 VanDerWaalsContact O-CG2 3.3Å; T240-V244 WeakPolarHBondContact O-CG2 3.42Å; T240-V244 PolarHBondContact O-N 2.76Å; M241-V244 PolarHBondContact O-N 2.88Å; N242-V244 PolarHBondContact O-N 3.37Å; V244-A247 PolarHBondContact O-N 2.93Å; V244-Y248 WeakPolarHBondContact O-CB 3.16Å; V244-Y248 PolarHBondContact O-N 3.39Å
245	L	92.9	Very high	88.1	Confident	51 Å²	51	42.5 Å²	42.5	27%	0.267	22%	0.218	S	C	.	.	H	α-helix	trans	-63.1	-45.3	174.9	177.9	64.5	0	0	0	111.6	M241 N242 Q243 Y248 G249 I275 S276	M241-L245 PolarHBondContact O-N 3.49Å; N242-L245 WeakPolarHBondContact O-CB 3.1Å; N242-L245 PolarHBondContact O-N 2.79Å; N242-L245 VanDerWaalsContact O-N 3.15Å; Q243-L245 VanDerWaalsContact C-N 3.3Å; Q243-L245 PolarHBondContact O-N 2.65Å; L245-Y248 WeakPolarHBondContact O-CB 3.4Å; L245-Y248 PolarHBondContact O-N 3.19Å; L245-G249 PolarHBondContact O-N 3.01Å; L245-I275 HydrophobicContact CD2-CB 4.1Å; L245-I275 HydrophobicContact CD2-CG2 3.66Å; L245-S276 WeakPolarHBondContact CD2-OG 3.2Å
246	V	90.8	Very high	87.8	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.7	-41.6	174.9	175.4	0	0	0	0	111.2	V203 N242 Q243 G249 L250 M356	V203-V246 HydrophobicContact CG1-CG1 4.4Å; V203-V246 HydrophobicContact CG2-CG1 4.05Å; N242-V246 WeakPolarHBondContact O-CG2 3.31Å; N242-V246 PolarHBondContact O-N 3.39Å; Q243-V246 PolarHBondContact O-N 2.73Å; V246-G249 PolarHBondContact O-N 3.43Å; V246-L250 PolarHBondContact O-N 2.71Å; V246-M356 HydrophobicContact CG2-CG 3.81Å
247	A	90.1	Very high	87.4	Confident	15 Å²	15	46.8 Å²	46.8	12%	0.124	24%	0.242	C	C	.	.	H	α-helix	trans	-64.4	-39.3	175.2	0	0	0	0	0	112.7	V203 I207 Q243 V244 G249 L250 Y251	V203-A247 HydrophobicContact CG1-CB 3.61Å; I207-A247 HydrophobicContact CD1-CB 3.47Å; I207-A247 VanDerWaalsContact CD1-CB 3.47Å; Q243-A247 WeakPolarHBondContact O-CB 3.14Å; Q243-A247 PolarHBondContact O-N 3.17Å; V244-A247 PolarHBondContact O-N 2.93Å; A247-G249 VanDerWaalsContact C-N 3.35Å; A247-L250 PolarHBondContact O-N 2.68Å; A247-Y251 VanDerWaalsContact O-CB 3.25Å; A247-Y251 WeakPolarHBondContact O-CB 3.36Å; A247-Y251 PolarHBondContact O-N 3.38Å
248	Y	90.6	Very high	87.2	Confident	129 Å²	129	46.4 Å²	46.4	51%	0.506	24%	0.24	S	C	.	.	H	α-helix	trans	-62.8	-42.8	174.3	174.7	-101.6	0	0	0	111.1	V244 L245 Y251 S252 M268	V244-Y248 WeakPolarHBondContact O-CB 3.16Å; V244-Y248 PolarHBondContact O-N 3.39Å; L245-Y248 WeakPolarHBondContact O-CB 3.4Å; L245-Y248 PolarHBondContact O-N 3.19Å; Y248-Y251 PolarHBondContact O-N 3.11Å; Y248-S252 WeakPolarHBondContact O-CB 3.37Å; Y248-S252 PolarHBondContact O-N 3.41Å; Y248-M268 HydrophobicContact CD1-CE 4.23Å; Y248-M268 HydrophobicContact CE1-CE 3.76Å
249	G	89.9	Confident	86.9	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.5	-42.8	174.5	0	0	0	0	0	113.1	L245 V246 A247 S252 S253 S272	L245-G249 PolarHBondContact O-N 3.01Å; V246-G249 PolarHBondContact O-N 3.43Å; A247-G249 VanDerWaalsContact C-N 3.35Å; G249-S252 PolarHBondContact O-N 2.9Å; G249-S253 VanDerWaalsContact O-CB 3.28Å; G249-S253 WeakPolarHBondContact O-CB 3.43Å; G249-S253 PolarHBondContact O-N 2.77Å; G249-S272 WeakPolarHBondContact CA-OG 3.37Å
250	L	87.7	Confident	86.8	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.7	-47.4	173.4	-172.8	65.6	0	0	0	111.6	L194 F195 G200 V246 A247 S252 S253 R269	L194-L250 HydrophobicContact CD2-CD1 3.63Å; L194-L250 HydrophobicContact CD2-CD2 4.03Å; L194-L250 HydrophobicContact CD2-CG 3.71Å; F195-L250 HydrophobicContact CE1-CD2 4.16Å; G200-L250 VanDerWaalsContact CA-CD2 3.41Å; V246-L250 PolarHBondContact O-N 2.71Å; A247-L250 PolarHBondContact O-N 2.68Å; L250-S252 PolarHBondContact O-N 2.75Å; L250-S253 PolarHBondContact O-N 2.76Å; L250-S253 PolarHBondContact O-OG 2.82Å; L250-R269 HydrophobicContact CD1-CG 4.4Å; L250-R269 VanDerWaalsContact CD1-CZ 3.49Å; L250-R269 VanDerWaalsContact CD1-NE 3.27Å
251	Y	85.6	Confident	86.4	Confident	88 Å²	88	59.5 Å²	59.5	35%	0.345	30%	0.297	S	S	.	.	H	α-helix	trans	-60.1	-46.9	177.5	174.3	-87.3	0	0	0	111.8	R191 A247 Y248 S253 L254	R191-Y251 VanDerWaalsContact CZ-OH 3.26Å; R191-Y251 VanDerWaalsContact NE-CE2 3.33Å; R191-Y251 PolarHBondContact NH1-OH 2.82Å; R191-Y251 VanDerWaalsContact NH1-OH 3.07Å; R191-Y251 PolarHBondContact NH2-OH 2.94Å; A247-Y251 VanDerWaalsContact O-CB 3.25Å; A247-Y251 WeakPolarHBondContact O-CB 3.36Å; A247-Y251 PolarHBondContact O-N 3.38Å; Y248-Y251 PolarHBondContact O-N 3.11Å; Y251-S253 VanDerWaalsContact C-N 3.3Å; Y251-S253 PolarHBondContact O-N 3.23Å; Y251-L254 PolarHBondContact O-N 3.29Å
252	S	86.7	Confident	85.7	Confident	5 Å²	5	57.7 Å²	57.7	4%	0.035	29%	0.294	C	S	.	.	H	α-helix	trans	-69.4	-30.9	-178.5	-174.1	0	0	0	0	111.5	Y248 G249 L250 L254 Q255 Y265	Y248-S252 WeakPolarHBondContact O-CB 3.37Å; Y248-S252 PolarHBondContact O-N 3.41Å; G249-S252 PolarHBondContact O-N 2.9Å; L250-S252 PolarHBondContact O-N 2.75Å; S252-L254 PolarHBondContact O-N 2.92Å; S252-Q255 VanDerWaalsContact O-CB 3.25Å; S252-Q255 WeakPolarHBondContact O-CB 3.47Å; S252-Q255 WeakPolarHBondContact O-CG 3.31Å; S252-Q255 PolarHBondContact O-N 2.93Å; S252-Q255 VanDerWaalsContact O-N 3.08Å; S252-Q255 PolarHBondContact OG-NE2 3.13Å; S252-Y265 WeakPolarHBondContact O-CB 3.19Å
253	S	85.5	Confident	84.9	Confident	8 Å²	8	62.4 Å²	62.4	6%	0.056	31%	0.312	C	S	.	.	H	α-helix	trans	-65.1	-22.4	177.6	78	0	0	0	0	115.1	G249 L250 Y251 Q255 Y265 R269	G249-S253 VanDerWaalsContact O-CB 3.28Å; G249-S253 WeakPolarHBondContact O-CB 3.43Å; G249-S253 PolarHBondContact O-N 2.77Å; L250-S253 PolarHBondContact O-N 2.76Å; L250-S253 PolarHBondContact O-OG 2.82Å; Y251-S253 VanDerWaalsContact C-N 3.3Å; Y251-S253 PolarHBondContact O-N 3.23Å; S253-Q255 PolarHBondContact O-N 2.78Å; S253-Y265 VanDerWaalsContact CA-O 3.28Å; S253-Y265 WeakPolarHBondContact CA-O 3.47Å; S253-R269 WeakPolarHBondContact OG-CD 3.5Å; S253-R269 VanDerWaalsContact OG-CG 3.26Å; S253-R269 WeakPolarHBondContact OG-CG 3.13Å
254	L	80.8	Confident	84.5	Confident	33 Å²	33	62.9 Å²	62.9	17%	0.173	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-16.2	177.1	-71.7	174.9	0	0	0	112.4	F187 R191 L194 Y251 S252	F187-L254 HydrophobicContact CE1-CB 4.13Å; F187-L254 WeakPolarHBondContact CE1-O 3.38Å; F187-L254 WeakPolarHBondContact CZ-O 3.14Å; R191-L254 HydrophobicContact CB-CD1 4.15Å; R191-L254 HydrophobicContact CG-CD1 4.33Å; L194-L254 HydrophobicContact CD2-CD1 3.82Å; L194-L254 HydrophobicContact CD2-CD2 3.98Å; L194-L254 HydrophobicContact CD2-CG 4.04Å; Y251-L254 PolarHBondContact O-N 3.29Å; S252-L254 PolarHBondContact O-N 2.92Å
255	Q	79.3	Confident	84.3	Confident	79 Å²	79	61.4 Å²	61.4	37%	0.369	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-55.3	143.5	-176.4	-69.2	-176.5	60.1	0	0	112.3	S252 S253 Y265	S252-Q255 VanDerWaalsContact O-CB 3.25Å; S252-Q255 WeakPolarHBondContact O-CB 3.47Å; S252-Q255 WeakPolarHBondContact O-CG 3.31Å; S252-Q255 PolarHBondContact O-N 2.93Å; S252-Q255 VanDerWaalsContact O-N 3.08Å; S252-Q255 PolarHBondContact OG-NE2 3.13Å; S253-Q255 PolarHBondContact O-N 2.78Å; Q255-Y265 HydrophobicContact CB-CD2 3.49Å; Q255-Y265 VanDerWaalsContact CB-CD2 3.49Å; Q255-Y265 HydrophobicContact CB-CE2 4.16Å; Q255-Y265 HydrophobicContact CB-CG 3.88Å
256	K	77.5	Confident	83.9	Confident	115 Å²	115	60 Å²	60	50%	0.5	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-74.2	148.8	-173.6	-100.7	170.8	-157.5	175	0	107.5	F187 D258	F187-K256 HydrophobicContact CD2-CD 4.01Å; F187-K256 VanDerWaalsContact CD2-CE 3.49Å; F187-K256 HydrophobicContact CD2-CG 4.28Å; F187-K256 HydrophobicContact CE2-CB 3.72Å; F187-K256 HydrophobicContact CE2-CD 3.41Å; F187-K256 VanDerWaalsContact CE2-CD 3.41Å; F187-K256 HydrophobicContact CE2-CG 3.27Å; F187-K256 HydrophobicContact CZ-CB 4.03Å; F187-K256 HydrophobicContact CZ-CD 4.4Å; F187-K256 HydrophobicContact CZ-CG 3.8Å; F187-K256 VanDerWaalsContact CZ-N 3.29Å; K256-D258 PolarHBondContact O-N 3.47Å
257	P	80.4	Confident	83.8	Confident	73 Å²	73	62.2 Å²	62.2	47%	0.474	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-52.1	139.5	167.6	-22.7	32	0	0	0	111.8	H261 P262	P257-H261 WeakPolarHBondContact CA-O 3.33Å; P257-P262 WeakPolarHBondContact CB-O 3.12Å
258	D	84.2	Confident	83.9	Confident	58 Å²	58	63.6 Å²	63.6	31%	0.31	32%	0.315	S	S	.	.			trans	-128.1	178.2	173.6	75.2	11.7	0	0	0	110.6	K256 T260 H261 P262 Y265	K256-D258 PolarHBondContact O-N 3.47Å; D258-T260 VanDerWaalsContact CG-OG1 3.31Å; D258-T260 PolarHBondContact O-N 2.85Å; D258-T260 WeakPolarHBondContact OD1-CA 3.13Å; D258-T260 WeakPolarHBondContact OD1-CB 3.05Å; D258-T260 PolarHBondContact OD1-N 2.85Å; D258-T260 PolarHBondContact OD1-OG1 3.47Å; D258-T260 PolarHBondContact OD2-OG1 2.81Å; D258-H261 PolarHBondContact N-O 3.44Å; D258-H261 CarbonylContact O-C 3.59Å; D258-H261 PolarHBondContact O-N 2.94Å; D258-H261 PolarHBondContact OD1-N 2.96Å; D258-H261 IonicContact OD1-ND1 3.67Å; D258-P262 WeakPolarHBondContact O-CA 3.32Å; D258-Y265 PolarHBondContact OD2-OH 3.31Å
259	E	82.3	Confident	83.9	Confident	191 Å²	191	58.5 Å²	58.5	89%	0.893	30%	0.295	S	S	*	.	S	Bend	trans	-61.3	-24.5	-178.6	-65.7	176.2	-178.5	0	0	113
260	T	84	Confident	84	Confident	102 Å²	102	58.6 Å²	58.6	63%	0.626	30%	0.295	S	S	*	.	S	Bend	trans	-87.6	-30.8	178.4	60.9	0	0	0	0	112.7	D258	D258-T260 VanDerWaalsContact CG-OG1 3.31Å; D258-T260 PolarHBondContact O-N 2.85Å; D258-T260 WeakPolarHBondContact OD1-CA 3.13Å; D258-T260 WeakPolarHBondContact OD1-CB 3.05Å; D258-T260 PolarHBondContact OD1-N 2.85Å; D258-T260 PolarHBondContact OD1-OG1 3.47Å; D258-T260 PolarHBondContact OD2-OG1 2.81Å
261	H	81.5	Confident	84.3	Confident	85 Å²	85	61 Å²	61	39%	0.394	31%	0.31	S	S	.	.			trans	-127.4	76.5	179.4	-58.5	84.7	0	0	0	109	P257 D258 Y263 G264 Y265	P257-H261 WeakPolarHBondContact CA-O 3.33Å; D258-H261 PolarHBondContact N-O 3.44Å; D258-H261 CarbonylContact O-C 3.59Å; D258-H261 PolarHBondContact O-N 2.94Å; D258-H261 PolarHBondContact OD1-N 2.96Å; D258-H261 IonicContact OD1-ND1 3.67Å; H261-Y263 PolarHBondContact O-N 3.47Å; H261-Y263 VanDerWaalsContact O-N 3.11Å; H261-G264 PolarHBondContact O-N 3.42Å; H261-Y265 HydrophobicContact CB-CE1 4.4Å; H261-Y265 HydrophobicContact CB-CE2 4.04Å; H261-Y265 AromaticContact CE1-CE1 3.95Å; H261-Y265 AromaticContact CG-CE1 3.84Å; H261-Y265 AromaticContact CG-CZ 3.69Å; H261-Y265 AromaticContact ND1-CE1 3.71Å; H261-Y265 AromaticContact ND1-CZ 3.41Å; H261-Y265 PolarHBondContact ND1-OH 3.07Å
262	P	76.7	Confident	84.6	Confident	89 Å²	89	56.8 Å²	56.8	58%	0.578	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-18.9	-173	24.5	-35	0	0	0	113.7	P257 D258	P257-P262 WeakPolarHBondContact CB-O 3.12Å; D258-P262 WeakPolarHBondContact O-CA 3.32Å
263	Y	74.5	Confident	85	Confident	113 Å²	113	56.6 Å²	56.6	44%	0.443	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-0	176.3	-60.4	-69.8	0	0	0	113.5	H261 R453	H261-Y263 PolarHBondContact O-N 3.47Å; H261-Y263 VanDerWaalsContact O-N 3.11Å; Y263-R453 VanDerWaalsContact CE1-CZ 3.41Å; Y263-R453 VanDerWaalsContact CZ-CZ 3.49Å; Y263-R453 PolarHBondContact OH-NH1 3.44Å
264	G	82.7	Confident	85.4	Confident	11 Å²	11	58 Å²	58	11%	0.113	30%	0.299	C	S	.	.			trans	84.1	-170.2	-176.8	0	0	0	0	0	113.9	H261	H261-G264 PolarHBondContact O-N 3.42Å
265	Y	86.6	Confident	86.1	Confident	44 Å²	44	60.7 Å²	60.7	17%	0.173	31%	0.312	C	S	.	.	S	Bend	trans	-107.4	11.4	-171.1	-70.4	-92.1	0	0	0	113.3	S252 S253 Q255 D258 H261 P267 M268	S252-Y265 WeakPolarHBondContact O-CB 3.19Å; S253-Y265 VanDerWaalsContact CA-O 3.28Å; S253-Y265 WeakPolarHBondContact CA-O 3.47Å; Q255-Y265 HydrophobicContact CB-CD2 3.49Å; Q255-Y265 VanDerWaalsContact CB-CD2 3.49Å; Q255-Y265 HydrophobicContact CB-CE2 4.16Å; Q255-Y265 HydrophobicContact CB-CG 3.88Å; D258-Y265 PolarHBondContact OD2-OH 3.31Å; H261-Y265 HydrophobicContact CB-CE1 4.4Å; H261-Y265 HydrophobicContact CB-CE2 4.04Å; H261-Y265 AromaticContact CE1-CE1 3.95Å; H261-Y265 AromaticContact CG-CE1 3.84Å; H261-Y265 AromaticContact CG-CZ 3.69Å; H261-Y265 AromaticContact ND1-CE1 3.71Å; H261-Y265 AromaticContact ND1-CZ 3.41Å; H261-Y265 PolarHBondContact ND1-OH 3.07Å; Y265-P267 VanDerWaalsContact C-N 3.29Å; Y265-P267 VanDerWaalsContact O-N 3.16Å; Y265-M268 WeakPolarHBondContact O-CB 3.46Å; Y265-M268 PolarHBondContact O-N 3.07Å
266	I	85.1	Confident	86.8	Confident	23 Å²	23	56.9 Å²	56.9	12%	0.118	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-42	-177.7	-63.3	152.9	0	0	0	113.3	M268 R269 I447 G448 E451	I266-M268 PolarHBondContact O-N 3.2Å; I266-R269 PolarHBondContact O-N 3.17Å; I266-I447 HydrophobicContact CB-CG2 4.13Å; I266-I447 HydrophobicContact CD1-CG2 4.41Å; I266-I447 HydrophobicContact CG2-CG2 4.2Å; I266-G448 WeakPolarHBondContact CG2-O 3.45Å; I266-E451 HydrophobicContact CD1-CB 4.45Å; I266-E451 HydrophobicContact CD1-CG 4.14Å; I266-E451 WeakPolarHBondContact CD1-OE2 3.46Å
267	P	88.5	Confident	87.7	Confident	45 Å²	45	51.4 Å²	51.4	29%	0.292	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-15.6	177.1	-25	36	0	0	0	114.8	Y265 R269 N270 V271 L413 I447	Y265-P267 VanDerWaalsContact C-N 3.29Å; Y265-P267 VanDerWaalsContact O-N 3.16Å; P267-R269 PolarHBondContact O-N 3.11Å; P267-R269 VanDerWaalsContact O-N 3.11Å; P267-N270 WeakPolarHBondContact O-CB 3.35Å; P267-N270 PolarHBondContact O-N 2.88Å; P267-V271 PolarHBondContact O-N 2.86Å; P267-V271 VanDerWaalsContact O-N 3.07Å; P267-L413 HydrophobicContact CB-CD2 4.16Å; P267-I447 HydrophobicContact CG-CG2 4.12Å
268	M	90.6	Very high	88.4	Confident	45 Å²	45	50.7 Å²	50.7	22%	0.222	27%	0.265	C	S	.	.	H	α-helix	trans	-57.9	-25.5	178.4	-170.6	62.7	-170	0	0	113	Y248 Y265 I266 V271 S272	Y248-M268 HydrophobicContact CD1-CE 4.23Å; Y248-M268 HydrophobicContact CE1-CE 3.76Å; Y265-M268 WeakPolarHBondContact O-CB 3.46Å; Y265-M268 PolarHBondContact O-N 3.07Å; I266-M268 PolarHBondContact O-N 3.2Å; M268-V271 PolarHBondContact O-N 2.79Å; M268-V271 HydrophobicContact SD-CB 4.17Å; M268-V271 HydrophobicContact SD-CG1 4.28Å; M268-S272 PolarHBondContact O-N 2.94Å; M268-S272 PolarHBondContact O-OG 3.33Å
269	R	90.9	Very high	88.9	Confident	22 Å²	22	49.4 Å²	49.4	8%	0.083	26%	0.263	C	S	.	.	H	α-helix	trans	-62.3	-48.8	171.9	-53.5	178.4	63.7	-176.7	2.2	110.9	L250 S253 I266 P267 V271 S272 S273 D351 P352 S353	L250-R269 HydrophobicContact CD1-CG 4.4Å; L250-R269 VanDerWaalsContact CD1-CZ 3.49Å; L250-R269 VanDerWaalsContact CD1-NE 3.27Å; S253-R269 WeakPolarHBondContact OG-CD 3.5Å; S253-R269 VanDerWaalsContact OG-CG 3.26Å; S253-R269 WeakPolarHBondContact OG-CG 3.13Å; I266-R269 PolarHBondContact O-N 3.17Å; P267-R269 PolarHBondContact O-N 3.11Å; P267-R269 VanDerWaalsContact O-N 3.11Å; R269-V271 VanDerWaalsContact C-N 3.32Å; R269-V271 PolarHBondContact O-N 3.09Å; R269-S272 PolarHBondContact O-N 3.48Å; R269-S272 PolarHBondContact O-OG 2.7Å; R269-S273 PolarHBondContact O-N 3.38Å; R269-S273 PolarHBondContact O-OG 3.4Å; R269-D351 IonicContact CZ-OD1 3.22Å; R269-D351 IonicContact NH2-OD1 3.01Å; R269-D351 PolarHBondContact NH2-OD1 3.33Å; R269-D351 IonicContact NH2-OD2 2.75Å; R269-P352 HydrophobicContact CB-CG 3.58Å; R269-S353 PolarHBondContact NE-OG 3.49Å; R269-S353 VanDerWaalsContact NE-OG 3.17Å; R269-S353 PolarHBondContact NH2-OG 3.09Å
270	N	92.1	Very high	89.5	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-63.6	-39.8	177.3	-58.8	-55.5	0	0	0	111	P267 S273 L274 P352 N409 M412 L413	P267-N270 WeakPolarHBondContact O-CB 3.35Å; P267-N270 PolarHBondContact O-N 2.88Å; N270-S273 PolarHBondContact O-N 3.01Å; N270-L274 WeakPolarHBondContact O-CB 3.27Å; N270-L274 PolarHBondContact O-N 3.42Å; N270-P352 VanDerWaalsContact OD1-CB 3.31Å; N270-P352 WeakPolarHBondContact OD1-CB 3.42Å; N270-P352 WeakPolarHBondContact OD1-CG 3.08Å; N270-N409 WeakPolarHBondContact CA-OD1 3.34Å; N270-M412 VanDerWaalsContact ND2-CG 3.31Å; N270-M412 WeakPolarHBondContact ND2-CG 3.49Å; N270-M412 WeakPolarHBondContact OD1-CG 3.35Å; N270-L413 HydrophobicContact CB-CD1 4.32Å; N270-L413 HydrophobicContact CB-CD2 3.88Å; N270-L413 HydrophobicContact CB-CG 3.8Å
271	V	93.9	Very high	90	Very high	50 Å²	50	40.2 Å²	40.2	30%	0.303	21%	0.212	S	C	.	.	H	α-helix	trans	-60.4	-48.4	175.7	178	0	0	0	0	111.1	P267 M268 R269 L274 I275 L413	P267-V271 PolarHBondContact O-N 2.86Å; P267-V271 VanDerWaalsContact O-N 3.07Å; M268-V271 PolarHBondContact O-N 2.79Å; M268-V271 HydrophobicContact SD-CB 4.17Å; M268-V271 HydrophobicContact SD-CG1 4.28Å; R269-V271 VanDerWaalsContact C-N 3.32Å; R269-V271 PolarHBondContact O-N 3.09Å; V271-L274 PolarHBondContact O-N 3.25Å; V271-I275 HydrophobicContact CG1-CD1 3.94Å; V271-I275 VanDerWaalsContact O-CG1 3.31Å; V271-I275 WeakPolarHBondContact O-CG1 3.2Å; V271-I275 PolarHBondContact O-N 3.41Å; V271-L413 HydrophobicContact CG2-CD1 4.42Å; V271-L413 HydrophobicContact CG2-CD2 3.83Å
272	S	93.6	Very high	90.6	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.007	22%	0.222	C	C	.	.	H	α-helix	trans	-63.9	-42.1	178.9	63.6	0	0	0	0	113	G249 M268 R269 L274 I275 S276	G249-S272 WeakPolarHBondContact CA-OG 3.37Å; M268-S272 PolarHBondContact O-N 2.94Å; M268-S272 PolarHBondContact O-OG 3.33Å; R269-S272 PolarHBondContact O-N 3.48Å; R269-S272 PolarHBondContact O-OG 2.7Å; S272-L274 VanDerWaalsContact C-N 3.34Å; S272-I275 PolarHBondContact O-N 3.19Å; S272-S276 WeakPolarHBondContact O-CB 3.38Å; S272-S276 PolarHBondContact O-N 3.3Å; S272-S276 PolarHBondContact O-OG 3.16Å
273	S	93.4	Very high	91.4	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-68	-35	177.4	-68	0	0	0	0	111.6	R269 N270 S276 G277 P352 I405 N409	R269-S273 PolarHBondContact O-N 3.38Å; R269-S273 PolarHBondContact O-OG 3.4Å; N270-S273 PolarHBondContact O-N 3.01Å; S273-S276 WeakPolarHBondContact O-CB 3.47Å; S273-S276 PolarHBondContact O-N 3.25Å; S273-G277 PolarHBondContact O-N 3.05Å; S273-P352 PolarHBondContact OG-O 3.25Å; S273-I405 WeakPolarHBondContact O-CG2 3.33Å; S273-N409 VanDerWaalsContact CB-OD1 3.28Å; S273-N409 WeakPolarHBondContact CB-OD1 3.33Å
274	L	95.1	Very high	92.1	Very high	39 Å²	39	39.6 Å²	39.6	20%	0.204	21%	0.211	C	C	.	.	H	α-helix	trans	-64.3	-48.4	173.6	-180	65.2	0	0	0	111.4	N270 V271 S272 S276 G277 V278 I406 N409 L413	N270-L274 WeakPolarHBondContact O-CB 3.27Å; N270-L274 PolarHBondContact O-N 3.42Å; V271-L274 PolarHBondContact O-N 3.25Å; S272-L274 VanDerWaalsContact C-N 3.34Å; L274-S276 VanDerWaalsContact C-N 3.25Å; L274-S276 PolarHBondContact O-N 2.88Å; L274-G277 PolarHBondContact O-N 2.73Å; L274-V278 WeakPolarHBondContact O-CG2 3.37Å; L274-V278 PolarHBondContact O-N 3.3Å; L274-I406 HydrophobicContact CD1-CB 4.14Å; L274-I406 HydrophobicContact CD1-CG1 4.16Å; L274-I406 HydrophobicContact CD1-CG2 3.88Å; L274-N409 HydrophobicContact CB-CB 4.12Å; L274-L413 HydrophobicContact CD2-CD1 3.76Å
275	I	95.9	Very high	92.7	Very high	88 Å²	88	39.2 Å²	39.2	45%	0.451	21%	0.208	S	C	.	.	H	α-helix	trans	-59.4	-41.3	176.3	-64.9	166.2	0	0	0	110.2	L245 V271 S272 V278 A279	L245-I275 HydrophobicContact CD2-CB 4.1Å; L245-I275 HydrophobicContact CD2-CG2 3.66Å; V271-I275 HydrophobicContact CG1-CD1 3.94Å; V271-I275 VanDerWaalsContact O-CG1 3.31Å; V271-I275 WeakPolarHBondContact O-CG1 3.2Å; V271-I275 PolarHBondContact O-N 3.41Å; S272-I275 PolarHBondContact O-N 3.19Å; I275-V278 PolarHBondContact O-N 2.82Å; I275-A279 WeakPolarHBondContact O-CB 2.89Å; I275-A279 PolarHBondContact O-N 3.33Å
276	S	94.1	Very high	93.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.6	-46.2	176.1	-54.4	0	0	0	0	111.6	N242 L245 S272 S273 L274 V278 A279 I280	N242-S276 WeakPolarHBondContact OD1-CA 3.38Å; N242-S276 WeakPolarHBondContact OD1-CB 3.41Å; N242-S276 PolarHBondContact OD1-OG 3.14Å; L245-S276 WeakPolarHBondContact CD2-OG 3.2Å; S272-S276 WeakPolarHBondContact O-CB 3.38Å; S272-S276 PolarHBondContact O-N 3.3Å; S272-S276 PolarHBondContact O-OG 3.16Å; S273-S276 WeakPolarHBondContact O-CB 3.47Å; S273-S276 PolarHBondContact O-N 3.25Å; L274-S276 VanDerWaalsContact C-N 3.25Å; L274-S276 PolarHBondContact O-N 2.88Å; S276-V278 PolarHBondContact O-N 3.42Å; S276-A279 WeakPolarHBondContact O-CB 3.33Å; S276-A279 PolarHBondContact O-N 3.33Å; S276-I280 WeakPolarHBondContact O-CG1 3.47Å; S276-I280 PolarHBondContact O-N 3.24Å
277	G	95.4	Very high	93.4	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.3	-41.8	175.7	0	0	0	0	0	112.9	S273 L274 I280 F281 A402	S273-G277 PolarHBondContact O-N 3.05Å; L274-G277 PolarHBondContact O-N 2.73Å; G277-I280 PolarHBondContact O-N 3.44Å; G277-F281 WeakPolarHBondContact O-CB 3.38Å; G277-F281 PolarHBondContact O-N 3.27Å; G277-A402 WeakPolarHBondContact O-CB 3.15Å
278	V	96.3	Very high	93.5	Very high	57 Å²	57	41.6 Å²	41.6	35%	0.345	23%	0.23	S	C	.	.	H	α-helix	trans	-62.9	-42.2	174.1	172.3	0	0	0	0	111.1	L274 I275 S276 F281 F282 I406	L274-V278 WeakPolarHBondContact O-CG2 3.37Å; L274-V278 PolarHBondContact O-N 3.3Å; I275-V278 PolarHBondContact O-N 2.82Å; S276-V278 PolarHBondContact O-N 3.42Å; V278-F281 PolarHBondContact O-N 3.43Å; V278-F282 HydrophobicContact CG1-CD2 3.76Å; V278-F282 HydrophobicContact CG1-CE2 3.93Å; V278-F282 WeakPolarHBondContact O-CD2 2.95Å; V278-F282 PolarHBondContact O-N 2.98Å; V278-F282 VanDerWaalsContact O-N 3.07Å; V278-I406 HydrophobicContact CG2-CD1 4.07Å; V278-I406 HydrophobicContact CG2-CG1 4.17Å
279	A	94.5	Very high	93.7	Very high	32 Å²	32	44.4 Å²	44.4	26%	0.264	24%	0.241	S	C	.	.	H	α-helix	trans	-61.9	-46.3	176.4	0	0	0	0	0	111.6	I275 S276 F281 F282 L283	I275-A279 WeakPolarHBondContact O-CB 2.89Å; I275-A279 PolarHBondContact O-N 3.33Å; S276-A279 WeakPolarHBondContact O-CB 3.33Å; S276-A279 PolarHBondContact O-N 3.33Å; A279-F281 VanDerWaalsContact C-N 3.31Å; A279-F281 PolarHBondContact O-N 3.13Å; A279-F282 PolarHBondContact O-N 2.86Å; A279-L283 HydrophobicContact CB-CD1 4.5Å; A279-L283 WeakPolarHBondContact O-CA 3.35Å; A279-L283 WeakPolarHBondContact O-CB 3.22Å; A279-L283 PolarHBondContact O-N 2.78Å
280	I	93.7	Very high	93.9	Very high	20 Å²	20	50.2 Å²	50.2	10%	0.103	26%	0.264	C	S	.	.	I	π-helix	trans	-62	-39.1	176.2	-67.1	169.5	0	0	0	111.3	S276 G277 G284 A285 M356 E360 L398 A402	S276-I280 WeakPolarHBondContact O-CG1 3.47Å; S276-I280 PolarHBondContact O-N 3.24Å; G277-I280 PolarHBondContact O-N 3.44Å; I280-G284 CarbonylContact O-C 3.58Å; I280-G284 WeakPolarHBondContact O-CA 3.36Å; I280-G284 PolarHBondContact O-N 3.41Å; I280-A285 PolarHBondContact O-N 2.83Å; I280-M356 HydrophobicContact CD1-CE 3.32Å; I280-M356 HydrophobicContact CD1-SD 4.32Å; I280-E360 HydrophobicContact CD1-CG 4.16Å; I280-L398 HydrophobicContact CG2-CD2 4.28Å; I280-A402 HydrophobicContact CB-CB 4.27Å; I280-A402 HydrophobicContact CG2-CB 4.01Å
281	F	95.8	Very high	93.7	Very high	80 Å²	80	55.9 Å²	55.9	35%	0.351	29%	0.29	S	S	.	.	I	π-helix	trans	-63.1	-51.8	178.9	-171.5	-95	0	0	0	112	G277 V278 A279 A285 G286 A399 A402 I406	G277-F281 WeakPolarHBondContact O-CB 3.38Å; G277-F281 PolarHBondContact O-N 3.27Å; V278-F281 PolarHBondContact O-N 3.43Å; A279-F281 VanDerWaalsContact C-N 3.31Å; A279-F281 PolarHBondContact O-N 3.13Å; F281-A285 WeakPolarHBondContact O-CB 3.49Å; F281-A285 PolarHBondContact O-N 2.78Å; F281-G286 PolarHBondContact O-N 3.41Å; F281-A399 HydrophobicContact CD2-CB 4.31Å; F281-A399 HydrophobicContact CE2-CB 4.03Å; F281-A402 HydrophobicContact CB-CB 3.83Å; F281-A402 HydrophobicContact CD2-CB 4.16Å; F281-I406 HydrophobicContact CB-CD1 4.33Å
282	F	94.3	Very high	93.5	Very high	137 Å²	137	54 Å²	54	60%	0.601	28%	0.28	S	S	*	.	I	π-helix	trans	-82.3	-46.5	-175.4	-72.9	-73.1	0	0	0	113.4	V278 A279 G286	V278-F282 HydrophobicContact CG1-CD2 3.76Å; V278-F282 HydrophobicContact CG1-CE2 3.93Å; V278-F282 WeakPolarHBondContact O-CD2 2.95Å; V278-F282 PolarHBondContact O-N 2.98Å; V278-F282 VanDerWaalsContact O-N 3.07Å; A279-F282 PolarHBondContact O-N 2.86Å; F282-G286 WeakPolarHBondContact O-CA 3.39Å; F282-G286 PolarHBondContact O-N 2.83Å
283	L	91.6	Very high	93.4	Very high	118 Å²	118	56.3 Å²	56.3	62%	0.618	29%	0.294	S	S	*	.	I	π-helix	trans	-83.8	-37.7	-177.4	-56.8	177.7	0	0	0	112	A279 L287	A279-L283 HydrophobicContact CB-CD1 4.5Å; A279-L283 WeakPolarHBondContact O-CA 3.35Å; A279-L283 WeakPolarHBondContact O-CB 3.22Å; A279-L283 PolarHBondContact O-N 2.78Å; L283-L287 VanDerWaalsContact O-CB 3.25Å; L283-L287 WeakPolarHBondContact O-CB 3.21Å; L283-L287 VanDerWaalsContact O-CD1 3.3Å; L283-L287 WeakPolarHBondContact O-CD1 3.33Å; L283-L287 VanDerWaalsContact O-CG 3.27Å; L283-L287 WeakPolarHBondContact O-CG 3.17Å
284	G	91	Very high	93.3	Very high	18 Å²	18	59.4 Å²	59.4	19%	0.186	31%	0.308	C	S	.	.	I	π-helix	trans	-77.5	-78.2	176.3	0	0	0	0	0	111	I280 G286 T288	I280-G284 CarbonylContact O-C 3.58Å; I280-G284 WeakPolarHBondContact O-CA 3.36Å; I280-G284 PolarHBondContact O-N 3.41Å; G284-G286 PolarHBondContact O-N 2.73Å; G284-T288 WeakPolarHBondContact O-CB 3.25Å; G284-T288 PolarHBondContact O-N 3.16Å; G284-T288 PolarHBondContact O-OG1 3.01Å
285	A	94.4	Very high	92.8	Very high	4 Å²	4	58.8 Å²	58.8	3%	0.033	31%	0.311	C	S	.	.	I	π-helix	trans	-61.5	-45	-174.7	0	0	0	0	0	112.5	I280 F281 T288 F289 S395 L398 A399	I280-A285 PolarHBondContact O-N 2.83Å; F281-A285 WeakPolarHBondContact O-CB 3.49Å; F281-A285 PolarHBondContact O-N 2.78Å; A285-T288 PolarHBondContact O-N 3.33Å; A285-F289 VanDerWaalsContact O-CB 3.26Å; A285-F289 WeakPolarHBondContact O-CB 3.38Å; A285-F289 PolarHBondContact O-N 3.4Å; A285-S395 WeakPolarHBondContact CB-O 3.43Å; A285-S395 PolarHBondContact O-OG 2.89Å; A285-S395 VanDerWaalsContact O-OG 3.07Å; A285-L398 HydrophobicContact CB-CB 3.81Å; A285-A399 HydrophobicContact CB-CB 3.87Å
286	G	94.8	Very high	92.4	Very high	35 Å²	35	58 Å²	58	36%	0.361	31%	0.307	S	S	.	.	I	π-helix	trans	-59.9	-48.5	-179.4	0	0	0	0	0	114.2	F281 F282 G284 Y290	F281-G286 PolarHBondContact O-N 3.41Å; F282-G286 WeakPolarHBondContact O-CA 3.39Å; F282-G286 PolarHBondContact O-N 2.83Å; G284-G286 PolarHBondContact O-N 2.73Å; G286-Y290 WeakPolarHBondContact O-CB 3.42Å; G286-Y290 PolarHBondContact O-N 2.9Å; G286-Y290 VanDerWaalsContact O-N 3.07Å
287	L	91.7	Very high	92.2	Very high	89 Å²	89	64.4 Å²	64.4	47%	0.466	34%	0.34	S	S	.	.	H	α-helix	trans	-71	-40.6	178.7	-63.1	179.8	0	0	0	112	L283 F289 Y290 H291	L283-L287 VanDerWaalsContact O-CB 3.25Å; L283-L287 WeakPolarHBondContact O-CB 3.21Å; L283-L287 VanDerWaalsContact O-CD1 3.3Å; L283-L287 WeakPolarHBondContact O-CD1 3.33Å; L283-L287 VanDerWaalsContact O-CG 3.27Å; L283-L287 WeakPolarHBondContact O-CG 3.17Å; L287-F289 VanDerWaalsContact C-N 3.33Å; L287-F289 PolarHBondContact O-N 2.88Å; L287-Y290 PolarHBondContact O-N 3.28Å; L287-H291 PolarHBondContact O-N 3.36Å
288	T	91.4	Very high	91.6	Very high	37 Å²	37	69.5 Å²	69.5	23%	0.227	36%	0.364	C	S	.	.	H	α-helix	trans	-60.8	-43.6	175.4	-61.2	0	0	0	0	110.9	G284 A285 H291 S292 G391 V394	G284-T288 WeakPolarHBondContact O-CB 3.25Å; G284-T288 PolarHBondContact O-N 3.16Å; G284-T288 PolarHBondContact O-OG1 3.01Å; A285-T288 PolarHBondContact O-N 3.33Å; T288-H291 PolarHBondContact O-N 3.4Å; T288-S292 VanDerWaalsContact O-CB 3.31Å; T288-S292 WeakPolarHBondContact O-CB 3.43Å; T288-S292 PolarHBondContact O-N 2.93Å; T288-S292 PolarHBondContact O-OG 3.35Å; T288-G391 WeakPolarHBondContact CG2-O 3.34Å; T288-V394 HydrophobicContact CG2-CB 4.4Å; T288-V394 HydrophobicContact CG2-CG1 4.25Å
289	F	94.8	Very high	90.7	Very high	105 Å²	105	70.6 Å²	70.6	46%	0.461	37%	0.372	S	S	.	.	H	α-helix	trans	-58.8	-49.2	175.1	-172.8	-107	0	0	0	111.6	A285 L287 H291 S292 V293 I392 S395	A285-F289 VanDerWaalsContact O-CB 3.26Å; A285-F289 WeakPolarHBondContact O-CB 3.38Å; A285-F289 PolarHBondContact O-N 3.4Å; L287-F289 VanDerWaalsContact C-N 3.33Å; L287-F289 PolarHBondContact O-N 2.88Å; F289-H291 PolarHBondContact O-N 3.44Å; F289-S292 PolarHBondContact O-N 3Å; F289-V293 HydrophobicContact CD1-CG2 4.22Å; F289-V293 HydrophobicContact CD2-CG2 4.46Å; F289-V293 HydrophobicContact CE1-CG2 3.84Å; F289-V293 HydrophobicContact CE2-CG2 4.1Å; F289-V293 HydrophobicContact CZ-CG2 3.78Å; F289-V293 WeakPolarHBondContact O-CG2 3.46Å; F289-V293 PolarHBondContact O-N 3.21Å; F289-I392 HydrophobicContact CE2-CG2 4.4Å; F289-S395 WeakPolarHBondContact CB-OG 3.31Å
290	Y	93.4	Very high	89.5	Confident	143 Å²	143	75.3 Å²	75.3	56%	0.561	39%	0.389	S	S	*	.	H	α-helix	trans	-58.2	-50.1	180	175	-102.1	0	0	0	112	G286 L287 S292 V293 Q294	G286-Y290 WeakPolarHBondContact O-CB 3.42Å; G286-Y290 PolarHBondContact O-N 2.9Å; G286-Y290 VanDerWaalsContact O-N 3.07Å; L287-Y290 PolarHBondContact O-N 3.28Å; Y290-S292 VanDerWaalsContact C-N 3.32Å; Y290-S292 PolarHBondContact O-N 3.21Å; Y290-V293 PolarHBondContact O-N 2.9Å; Y290-Q294 WeakPolarHBondContact O-CB 3.42Å; Y290-Q294 PolarHBondContact O-N 3.44Å
291	H	88.7	Confident	88	Confident	120 Å²	120	83.4 Å²	83.4	56%	0.556	43%	0.426	S	S	*	.	H	α-helix	trans	-64.3	-36	177.5	-69.9	164.4	0	0	0	112.7	L287 T288 F289 Q294 G295	L287-H291 PolarHBondContact O-N 3.36Å; T288-H291 PolarHBondContact O-N 3.4Å; F289-H291 PolarHBondContact O-N 3.44Å; H291-Q294 PolarHBondContact O-N 3.06Å; H291-G295 PolarHBondContact O-N 3.03Å
292	S	90.4	Very high	86.4	Confident	11 Å²	11	83.8 Å²	83.8	8%	0.077	43%	0.428	C	S	.	.	H	α-helix	trans	-67.9	-42.4	178.5	-53.5	0	0	0	0	111.5	T288 F289 Y290 G295 I296 G391 I392	T288-S292 VanDerWaalsContact O-CB 3.31Å; T288-S292 WeakPolarHBondContact O-CB 3.43Å; T288-S292 PolarHBondContact O-N 2.93Å; T288-S292 PolarHBondContact O-OG 3.35Å; F289-S292 PolarHBondContact O-N 3Å; Y290-S292 VanDerWaalsContact C-N 3.32Å; Y290-S292 PolarHBondContact O-N 3.21Å; S292-G295 PolarHBondContact O-N 2.66Å; S292-I296 PolarHBondContact O-N 3.33Å; S292-G391 WeakPolarHBondContact OG-CA 3.39Å; S292-G391 PolarHBondContact OG-O 2.76Å; S292-I392 PolarHBondContact OG-N 3.26Å
293	V	92	Very high	84.7	Confident	50 Å²	50	86.2 Å²	86.2	30%	0.303	44%	0.441	S	S	.	.	H	α-helix	trans	-65.6	-41.3	174.4	173.1	0	0	0	0	110.8	F289 Y290 G295 I296 L297	F289-V293 HydrophobicContact CD1-CG2 4.22Å; F289-V293 HydrophobicContact CD2-CG2 4.46Å; F289-V293 HydrophobicContact CE1-CG2 3.84Å; F289-V293 HydrophobicContact CE2-CG2 4.1Å; F289-V293 HydrophobicContact CZ-CG2 3.78Å; F289-V293 WeakPolarHBondContact O-CG2 3.46Å; F289-V293 PolarHBondContact O-N 3.21Å; Y290-V293 PolarHBondContact O-N 2.9Å; V293-G295 VanDerWaalsContact C-N 3.3Å; V293-G295 PolarHBondContact O-N 3.5Å; V293-I296 WeakPolarHBondContact O-CB 3.47Å; V293-I296 PolarHBondContact O-N 3.42Å; V293-I296 VanDerWaalsContact O-N 3.13Å; V293-L297 HydrophobicContact CG1-CD1 4.24Å; V293-L297 PolarHBondContact O-N 2.91Å
294	Q	89.8	Confident	83.6	Confident	64 Å²	64	83 Å²	83	30%	0.299	43%	0.429	S	S	.	.	H	α-helix	trans	-61.6	-39	174.5	-171.6	175.3	-1	0	0	111.5	Y290 H291 I296 L297 E298	Y290-Q294 WeakPolarHBondContact O-CB 3.42Å; Y290-Q294 PolarHBondContact O-N 3.44Å; H291-Q294 PolarHBondContact O-N 3.06Å; Q294-I296 PolarHBondContact O-N 3.08Å; Q294-L297 PolarHBondContact O-N 3.2Å; Q294-L297 VanDerWaalsContact O-N 3.07Å; Q294-E298 PolarHBondContact NE2-OE2 3.32Å; Q294-E298 PolarHBondContact O-N 3.38Å
295	G	84.5	Confident	82.7	Confident	26 Å²	26	84.4 Å²	84.4	27%	0.268	43%	0.433	S	S	.	.	H	α-helix	trans	-63.6	-22.9	175.1	0	0	0	0	0	114.5	H291 S292 V293	H291-G295 PolarHBondContact O-N 3.03Å; S292-G295 PolarHBondContact O-N 2.66Å; V293-G295 VanDerWaalsContact C-N 3.3Å; V293-G295 PolarHBondContact O-N 3.5Å
296	I	87.9	Confident	82	Confident	73 Å²	73	90.4 Å²	90.4	37%	0.374	47%	0.465	S	S	.	.	H	α-helix	trans	-77.2	-40.8	170.8	-60.1	177	0	0	0	110.9	S292 V293 Q294 A388 I392	S292-I296 PolarHBondContact O-N 3.33Å; V293-I296 WeakPolarHBondContact O-CB 3.47Å; V293-I296 PolarHBondContact O-N 3.42Å; V293-I296 VanDerWaalsContact O-N 3.13Å; Q294-I296 PolarHBondContact O-N 3.08Å; I296-A388 HydrophobicContact CD1-CB 4.32Å; I296-A388 HydrophobicContact CG1-CB 3.51Å; I296-I392 HydrophobicContact CD1-CD1 3.72Å
297	L	89.6	Confident	81.1	Confident	133 Å²	133	91.2 Å²	91.2	70%	0.696	46%	0.461	S	S	*	.	H	α-helix	trans	-76.8	-38.1	-176.8	-65.9	172.8	0	0	0	112.6	V293 Q294	V293-L297 HydrophobicContact CG1-CD1 4.24Å; V293-L297 PolarHBondContact O-N 2.91Å; Q294-L297 PolarHBondContact O-N 3.2Å; Q294-L297 VanDerWaalsContact O-N 3.07Å
298	E	84.1	Confident	80.4	Confident	108 Å²	108	88 Å²	88	51%	0.505	45%	0.447	S	S	.	.	S	Bend	trans	-129.9	83.6	-178.4	-68.1	178.6	179	0	0	109.6	Q294 H300	Q294-E298 PolarHBondContact NE2-OE2 3.32Å; Q294-E298 PolarHBondContact O-N 3.38Å; E298-H300 PolarHBondContact O-N 3.48Å
299	P	77.3	Confident	79.8	Confident	79 Å²	79	89.2 Å²	89.2	51%	0.513	45%	0.452	S	S	.	.			trans	-53.2	121.5	171.2	-31.7	39.8	0	0	0	112.1	V384	P299-V384 HydrophobicContact CB-CG2 3.79Å; P299-V384 HydrophobicContact CG-CG2 3.98Å
300	H	69.4	Low	79.3	Confident	132 Å²	132	91 Å²	91	61%	0.611	46%	0.463	S	S	*	.			trans	-109.9	141.2	170.9	-69.8	-36.8	0	0	0	110.2	E298	E298-H300 PolarHBondContact O-N 3.48Å
301	E	61.5	Low	78.7	Confident	190 Å²	190	85.7 Å²	85.7	89%	0.888	45%	0.445	S	S	*	.			trans	-71.8	137.4	177.3	-65.7	-173.3	170.6	0	0	110.9	E303	E301-E303 PolarHBondContact O-N 2.86Å
302	F	61.9	Low	78.4	Confident	87 Å²	87	81.3 Å²	81.3	38%	0.382	43%	0.425	S	S	.	.			trans	-76	112.1	-179.8	-69.9	-87.2	0	0	0	111	S304 V305 T378 V384 D387	F302-S304 VanDerWaalsContact C-N 3.33Å; F302-S304 PolarHBondContact O-N 3.47Å; F302-V305 HydrophobicContact CB-CG2 4.38Å; F302-T378 HydrophobicContact CD2-CG2 4.27Å; F302-T378 HydrophobicContact CE2-CG2 3.75Å; F302-T378 HydrophobicContact CZ-CG2 4.42Å; F302-V384 HydrophobicContact CE2-CG1 4.26Å; F302-D387 HydrophobicContact CE2-CB 4.48Å; F302-D387 HydrophobicContact CZ-CB 3.72Å; F302-D387 VanDerWaalsContact CZ-CG 3.45Å; F302-D387 VanDerWaalsContact CZ-OD2 3.27Å; F302-D387 WeakPolarHBondContact CZ-OD2 3.42Å
303	E	58	Low	78.3	Confident	188 Å²	188	85.9 Å²	85.9	88%	0.879	45%	0.448	S	S	*	.	S	Bend	trans	-74.1	-11	-175.9	-79.2	-174.6	155.7	0	0	114.9	E301	E301-E303 PolarHBondContact O-N 2.86Å
304	S	68.5	Low	78	Confident	52 Å²	52	85.3 Å²	85.3	36%	0.364	45%	0.453	S	S	.	.			trans	-172.9	95.6	168.8	45.6	0	0	0	0	114.9	F302 N306 A308	F302-S304 VanDerWaalsContact C-N 3.33Å; F302-S304 PolarHBondContact O-N 3.47Å; S304-N306 PolarHBondContact O-N 3.3Å; S304-A308 PolarHBondContact O-N 2.75Å
305	V	72.4	Confident	77.8	Confident	46 Å²	46	82.6 Å²	82.6	28%	0.279	44%	0.441	S	S	.	.	H	α-helix	trans	-60.3	-41.6	178.1	-179.4	0	0	0	0	112.4	F302 L307 A308 L309 M375 A379	F302-V305 HydrophobicContact CB-CG2 4.38Å; V305-L307 PolarHBondContact O-N 2.63Å; V305-A308 PolarHBondContact O-N 3.18Å; V305-L309 HydrophobicContact CG1-CD1 3.86Å; V305-L309 HydrophobicContact CG1-CG 4.24Å; V305-L309 WeakPolarHBondContact O-CG 3.41Å; V305-L309 PolarHBondContact O-N 2.89Å; V305-M375 HydrophobicContact CG1-SD 4.48Å; V305-A379 HydrophobicContact CG1-CB 4.42Å
306	N	79.1	Confident	78.1	Confident	130 Å²	130	84 Å²	84	70%	0.695	44%	0.442	S	S	*	.	H	α-helix	trans	-64.1	-41	-174.7	-67.3	-13.7	0	0	0	113	S304 L309 M310	S304-N306 PolarHBondContact O-N 3.3Å; N306-L309 PolarHBondContact O-N 3.23Å; N306-M310 WeakPolarHBondContact O-CG 3.28Å; N306-M310 PolarHBondContact O-N 3.21Å; N306-M310 VanDerWaalsContact O-N 3.09Å
307	L	77	Confident	78.3	Confident	53 Å²	53	87 Å²	87	28%	0.277	46%	0.458	S	S	.	.	H	α-helix	trans	-70.3	-41.2	-179.6	-173.4	115.5	0	0	0	110.8	T224 M229 V305 M310 V311	T224-L307 HydrophobicContact CG2-CD1 4.18Å; M229-L307 HydrophobicContact CE-CD2 3.26Å; M229-L307 HydrophobicContact CE-CG 4.17Å; M229-L307 HydrophobicContact CG-CD2 3.71Å; M229-L307 HydrophobicContact SD-CD2 3.71Å; M229-L307 HydrophobicContact SD-CG 4.43Å; V305-L307 PolarHBondContact O-N 2.63Å; L307-M310 PolarHBondContact O-N 3.39Å; L307-V311 WeakPolarHBondContact O-CG2 3Å; L307-V311 PolarHBondContact O-N 3.01Å
308	A	76	Confident	78.2	Confident	20 Å²	20	81.3 Å²	81.3	17%	0.165	43%	0.43	C	S	.	.	H	α-helix	trans	-58.7	-47.8	174.1	0	0	0	0	0	111.3	S304 V305 M310 V311 M312 M375	S304-A308 PolarHBondContact O-N 2.75Å; V305-A308 PolarHBondContact O-N 3.18Å; A308-M310 PolarHBondContact O-N 3.1Å; A308-V311 PolarHBondContact O-N 3.21Å; A308-M312 VanDerWaalsContact O-CG 3.26Å; A308-M312 WeakPolarHBondContact O-CG 3.26Å; A308-M312 PolarHBondContact O-N 3.08Å; A308-M375 HydrophobicContact CB-CE 3.97Å; A308-M375 HydrophobicContact CB-SD 3.9Å
309	L	79.6	Confident	78.5	Confident	64 Å²	64	76.8 Å²	76.8	34%	0.335	41%	0.408	S	S	.	.	H	α-helix	trans	-60	-41.9	177.4	-72.7	173.6	0	0	0	112.9	V305 N306 V311 M312 L313 M375	V305-L309 HydrophobicContact CG1-CD1 3.86Å; V305-L309 HydrophobicContact CG1-CG 4.24Å; V305-L309 WeakPolarHBondContact O-CG 3.41Å; V305-L309 PolarHBondContact O-N 2.89Å; N306-L309 PolarHBondContact O-N 3.23Å; L309-V311 PolarHBondContact O-N 3.18Å; L309-M312 PolarHBondContact O-N 3.19Å; L309-L313 WeakPolarHBondContact O-CG 3.28Å; L309-L313 PolarHBondContact O-N 3.25Å; L309-M375 HydrophobicContact CD2-SD 4.23Å; L309-M375 HydrophobicContact CG-SD 4.35Å
310	M	83.3	Confident	79.2	Confident	143 Å²	143	74.3 Å²	74.3	70%	0.704	40%	0.397	S	S	*	.	H	α-helix	trans	-62.8	-41.6	176.6	-73.2	-179.2	73.9	0	0	112.1	N306 L307 A308 L313 G314	N306-M310 WeakPolarHBondContact O-CG 3.28Å; N306-M310 PolarHBondContact O-N 3.21Å; N306-M310 VanDerWaalsContact O-N 3.09Å; L307-M310 PolarHBondContact O-N 3.39Å; A308-M310 PolarHBondContact O-N 3.1Å; M310-L313 PolarHBondContact O-N 3.43Å; M310-G314 PolarHBondContact O-N 2.6Å; M310-G314 VanDerWaalsContact O-N 3.11Å
311	V	81.1	Confident	80.3	Confident	30 Å²	30	70.3 Å²	70.3	18%	0.182	38%	0.384	C	S	.	.	H	α-helix	trans	-68.9	-41.3	178.1	173.4	0	0	0	0	111.5	M229 E232 L307 A308 L309 L313 G314 S315	M229-V311 HydrophobicContact CE-CB 4.19Å; M229-V311 HydrophobicContact CE-CG1 4.42Å; M229-V311 HydrophobicContact CE-CG2 3.51Å; M229-V311 HydrophobicContact SD-CG2 3.71Å; E232-V311 HydrophobicContact CB-CG1 4.47Å; E232-V311 HydrophobicContact CG-CG1 4.08Å; L307-V311 WeakPolarHBondContact O-CG2 3Å; L307-V311 PolarHBondContact O-N 3.01Å; A308-V311 PolarHBondContact O-N 3.21Å; L309-V311 PolarHBondContact O-N 3.18Å; V311-L313 VanDerWaalsContact C-N 3.34Å; V311-L313 PolarHBondContact O-N 3.17Å; V311-G314 PolarHBondContact O-N 3.33Å; V311-G314 VanDerWaalsContact O-N 3.14Å; V311-S315 PolarHBondContact O-N 3.34Å; V311-S315 PolarHBondContact O-OG 3.49Å
312	M	83.4	Confident	81.6	Confident	28 Å²	28	61.3 Å²	61.3	14%	0.138	34%	0.342	C	S	.	.	H	α-helix	trans	-60.9	-41.6	175.5	-70.2	-179.4	78.8	0	0	112.2	A308 L309 G314 S315 L316 V368 A371 G372 M375	A308-M312 VanDerWaalsContact O-CG 3.26Å; A308-M312 WeakPolarHBondContact O-CG 3.26Å; A308-M312 PolarHBondContact O-N 3.08Å; L309-M312 PolarHBondContact O-N 3.19Å; M312-G314 VanDerWaalsContact C-N 3.32Å; M312-G314 PolarHBondContact O-N 3.04Å; M312-S315 PolarHBondContact O-N 2.98Å; M312-L316 VanDerWaalsContact O-CB 3.32Å; M312-L316 WeakPolarHBondContact O-CB 3.24Å; M312-L316 PolarHBondContact O-N 2.99Å; M312-V368 HydrophobicContact CB-CG1 4.15Å; M312-V368 HydrophobicContact CE-CG1 4.01Å; M312-V368 VanDerWaalsContact CE-O 3.29Å; M312-V368 WeakPolarHBondContact CE-O 3.32Å; M312-A371 HydrophobicContact CE-CB 3.79Å; M312-G372 VanDerWaalsContact CE-CA 3.41Å; M312-M375 HydrophobicContact SD-CE 4.03Å; M312-M375 HydrophobicContact SD-SD 4.21Å
313	L	87.5	Confident	83.2	Confident	107 Å²	107	58.5 Å²	58.5	56%	0.56	33%	0.331	S	S	*	.	H	α-helix	trans	-62.1	-40.2	174.1	-74.5	171.3	0	0	0	111.8	L309 M310 V311 L316 L317	L309-L313 WeakPolarHBondContact O-CG 3.28Å; L309-L313 PolarHBondContact O-N 3.25Å; M310-L313 PolarHBondContact O-N 3.43Å; V311-L313 VanDerWaalsContact C-N 3.34Å; V311-L313 PolarHBondContact O-N 3.17Å; L313-L316 PolarHBondContact O-N 3.49Å; L313-L317 WeakPolarHBondContact O-CG 3.32Å; L313-L317 PolarHBondContact O-N 3.34Å; L313-L317 VanDerWaalsContact O-N 3.08Å
314	G	87.1	Confident	84.9	Confident	39 Å²	39	51.6 Å²	51.6	40%	0.402	31%	0.306	S	S	.	.	H	α-helix	trans	-63.1	-45.9	174.2	0	0	0	0	0	113.1	M310 V311 M312 L317 S318	M310-G314 PolarHBondContact O-N 2.6Å; M310-G314 VanDerWaalsContact O-N 3.11Å; V311-G314 PolarHBondContact O-N 3.33Å; V311-G314 VanDerWaalsContact O-N 3.14Å; M312-G314 VanDerWaalsContact C-N 3.32Å; M312-G314 PolarHBondContact O-N 3.04Å; G314-L317 PolarHBondContact O-N 2.86Å; G314-S318 WeakPolarHBondContact O-CB 3.21Å; G314-S318 PolarHBondContact O-N 2.68Å; G314-S318 VanDerWaalsContact O-N 3.08Å; G314-S318 PolarHBondContact O-OG 2.83Å
315	S	84.4	Confident	86	Confident	6 Å²	6	50.8 Å²	50.8	4%	0.042	30%	0.297	C	S	.	.	H	α-helix	trans	-60.4	-46.2	174.9	-58	0	0	0	0	110.9	K217 V311 M312 L317 S318 E319	K217-S315 PolarHBondContact NZ-OG 3.36Å; V311-S315 PolarHBondContact O-N 3.34Å; V311-S315 PolarHBondContact O-OG 3.49Å; M312-S315 PolarHBondContact O-N 2.98Å; S315-L317 VanDerWaalsContact C-N 3.35Å; S315-L317 PolarHBondContact O-N 3.28Å; S315-S318 WeakPolarHBondContact CA-OG 3.1Å; S315-S318 PolarHBondContact O-N 3.17Å; S315-S318 PolarHBondContact O-OG 3.47Å; S315-E319 WeakPolarHBondContact O-CB 3.31Å; S315-E319 WeakPolarHBondContact O-CG 3.31Å; S315-E319 PolarHBondContact O-N 3.26Å
316	L	90.3	Very high	86.9	Confident	55 Å²	55	48.6 Å²	48.6	29%	0.288	28%	0.284	S	S	.	.	H	α-helix	trans	-59.6	-42	179.4	-172.5	66.2	0	0	0	112.9	M312 L313 G320 V365 V368 V369	M312-L316 VanDerWaalsContact O-CB 3.32Å; M312-L316 WeakPolarHBondContact O-CB 3.24Å; M312-L316 PolarHBondContact O-N 2.99Å; L313-L316 PolarHBondContact O-N 3.49Å; L316-G320 WeakPolarHBondContact O-CA 3.39Å; L316-G320 PolarHBondContact O-N 3.25Å; L316-V365 HydrophobicContact CD1-CB 4.45Å; L316-V365 HydrophobicContact CD1-CG1 3.88Å; L316-V368 HydrophobicContact CB-CG1 4.05Å; L316-V368 HydrophobicContact CD1-CB 4.38Å; L316-V368 HydrophobicContact CD1-CG1 4.18Å; L316-V369 HydrophobicContact CD1-CG2 4.22Å
317	L	92	Very high	87.6	Confident	137 Å²	137	47.9 Å²	47.9	72%	0.717	27%	0.273	S	S	*	.	H	α-helix	trans	-68.9	-41.2	178.3	-71.2	175.3	0	0	0	112.1	L313 G314 S315 S321	L313-L317 WeakPolarHBondContact O-CG 3.32Å; L313-L317 PolarHBondContact O-N 3.34Å; L313-L317 VanDerWaalsContact O-N 3.08Å; G314-L317 PolarHBondContact O-N 2.86Å; S315-L317 VanDerWaalsContact C-N 3.35Å; S315-L317 PolarHBondContact O-N 3.28Å; L317-S321 WeakPolarHBondContact O-CB 3.41Å; L317-S321 PolarHBondContact O-N 3.29Å; L317-S321 VanDerWaalsContact O-N 3.15Å
318	S	89	Confident	88.3	Confident	14 Å²	14	53.4 Å²	53.4	10%	0.098	29%	0.29	C	S	.	.	H	α-helix	trans	-72.5	-51.2	-178.3	56.8	0	0	0	0	112	N213 G314 S315 G320 S321 T322	N213-S318 WeakPolarHBondContact ND2-CB 3.26Å; N213-S318 PolarHBondContact ND2-OG 3.09Å; N213-S318 VanDerWaalsContact OD1-CB 3.31Å; N213-S318 WeakPolarHBondContact OD1-CB 3.19Å; N213-S318 PolarHBondContact OD1-OG 3.26Å; G314-S318 WeakPolarHBondContact O-CB 3.21Å; G314-S318 PolarHBondContact O-N 2.68Å; G314-S318 VanDerWaalsContact O-N 3.08Å; G314-S318 PolarHBondContact O-OG 2.83Å; S315-S318 WeakPolarHBondContact CA-OG 3.1Å; S315-S318 PolarHBondContact O-N 3.17Å; S315-S318 PolarHBondContact O-OG 3.47Å; S318-G320 VanDerWaalsContact C-N 3.33Å; S318-G320 PolarHBondContact O-N 3Å; S318-S321 WeakPolarHBondContact O-CB 3.31Å; S318-S321 PolarHBondContact O-N 3.26Å; S318-S321 VanDerWaalsContact O-N 3.08Å; S318-S321 PolarHBondContact O-OG 2.69Å; S318-T322 PolarHBondContact O-N 3.12Å
319	E	89.6	Confident	89	Confident	12 Å²	12	53.3 Å²	53.3	6%	0.056	29%	0.286	C	S	.	.	H	α-helix	trans	-64.5	-37	175.2	-66.7	166.6	-168.4	0	0	111.7	S315 S321 T322 L323 A364 V365	S315-E319 WeakPolarHBondContact O-CB 3.31Å; S315-E319 WeakPolarHBondContact O-CG 3.31Å; S315-E319 PolarHBondContact O-N 3.26Å; E319-S321 PolarHBondContact O-N 3.45Å; E319-T322 WeakPolarHBondContact CA-OG1 3.27Å; E319-T322 PolarHBondContact O-N 3.37Å; E319-T322 PolarHBondContact O-OG1 2.82Å; E319-L323 WeakPolarHBondContact O-CB 3.45Å; E319-L323 PolarHBondContact O-N 3.49Å; E319-A364 HydrophobicContact CG-CB 4.35Å; E319-A364 WeakPolarHBondContact OE2-CB 3.45Å; E319-V365 HydrophobicContact CB-CG2 3.88Å
320	G	93.1	Very high	89.5	Confident	27 Å²	27	50.2 Å²	50.2	28%	0.278	27%	0.27	S	S	.	.	H	α-helix	trans	-59.9	-34.2	172.7	0	0	0	0	0	112.5	L316 S318 A324	L316-G320 WeakPolarHBondContact O-CA 3.39Å; L316-G320 PolarHBondContact O-N 3.25Å; S318-G320 VanDerWaalsContact C-N 3.33Å; S318-G320 PolarHBondContact O-N 3Å; G320-A324 WeakPolarHBondContact O-CB 2.95Å; G320-A324 PolarHBondContact O-N 2.71Å
321	S	91.4	Very high	89.9	Confident	48 Å²	48	48.1 Å²	48.1	34%	0.336	26%	0.257	S	S	.	.	H	α-helix	trans	-73.9	-39.6	178	81	0	0	0	0	113	I209 L317 S318 E319 A324 L325	I209-S321 VanDerWaalsContact CD1-OG 3.3Å; I209-S321 WeakPolarHBondContact CD1-OG 3.24Å; L317-S321 WeakPolarHBondContact O-CB 3.41Å; L317-S321 PolarHBondContact O-N 3.29Å; L317-S321 VanDerWaalsContact O-N 3.15Å; S318-S321 WeakPolarHBondContact O-CB 3.31Å; S318-S321 PolarHBondContact O-N 3.26Å; S318-S321 VanDerWaalsContact O-N 3.08Å; S318-S321 PolarHBondContact O-OG 2.69Å; E319-S321 PolarHBondContact O-N 3.45Å; S321-A324 PolarHBondContact O-N 2.93Å; S321-L325 PolarHBondContact O-N 2.75Å
322	T	89.8	Confident	90.2	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.012	28%	0.275	C	S	.	.	H	α-helix	trans	-69	-43.5	175.3	56	0	0	0	0	110.5	F205 I209 S318 E319 A324 L325 A326 D361	F205-T322 HydrophobicContact CD1-CG2 4.47Å; I209-T322 HydrophobicContact CB-CG2 3.67Å; I209-T322 HydrophobicContact CD1-CG2 3.73Å; I209-T322 HydrophobicContact CG1-CG2 4.15Å; I209-T322 HydrophobicContact CG2-CG2 3.69Å; S318-T322 PolarHBondContact O-N 3.12Å; E319-T322 WeakPolarHBondContact CA-OG1 3.27Å; E319-T322 PolarHBondContact O-N 3.37Å; E319-T322 PolarHBondContact O-OG1 2.82Å; T322-A324 VanDerWaalsContact C-N 3.33Å; T322-A324 PolarHBondContact O-N 3.07Å; T322-L325 PolarHBondContact O-N 3.42Å; T322-L325 VanDerWaalsContact O-N 3.1Å; T322-A326 WeakPolarHBondContact O-CB 3.41Å; T322-A326 PolarHBondContact O-N 2.75Å; T322-D361 WeakPolarHBondContact CB-OD2 3.42Å; T322-D361 VanDerWaalsContact OG1-CG 3.22Å; T322-D361 PolarHBondContact OG1-OD2 2.68Å
323	L	93.8	Very high	90.3	Very high	27 Å²	27	52.6 Å²	52.6	14%	0.141	27%	0.269	C	S	.	.	H	α-helix	trans	-54.6	-47.3	172.8	176.8	54.8	0	0	0	111.5	E319 L325 A326 Y327 L358 D361 L362 V365	E319-L323 WeakPolarHBondContact O-CB 3.45Å; E319-L323 PolarHBondContact O-N 3.49Å; L323-L325 VanDerWaalsContact C-N 3.32Å; L323-L325 PolarHBondContact O-N 2.76Å; L323-A326 PolarHBondContact O-N 3.46Å; L323-Y327 VanDerWaalsContact O-CB 3.24Å; L323-Y327 WeakPolarHBondContact O-CB 3.38Å; L323-Y327 PolarHBondContact O-N 3.38Å; L323-L358 HydrophobicContact CD1-CD1 3.45Å; L323-L358 VanDerWaalsContact CD1-CD1 3.45Å; L323-D361 HydrophobicContact CB-CB 3.92Å; L323-D361 HydrophobicContact CD1-CB 4.36Å; L323-D361 PolarHBondContact N-OD2 2.7Å; L323-L362 HydrophobicContact CD1-CB 4.04Å; L323-L362 HydrophobicContact CD2-CD1 4.22Å; L323-V365 HydrophobicContact CD2-CB 4.12Å; L323-V365 HydrophobicContact CD2-CG1 4.36Å; L323-V365 HydrophobicContact CD2-CG2 3.88Å
324	A	94.2	Very high	90.2	Very high	43 Å²	43	47.8 Å²	47.8	36%	0.355	24%	0.244	S	C	.	.	H	α-helix	trans	-62.3	-38	179	0	0	0	0	0	112.4	G320 S321 T322 R328	G320-A324 WeakPolarHBondContact O-CB 2.95Å; G320-A324 PolarHBondContact O-N 2.71Å; S321-A324 PolarHBondContact O-N 2.93Å; T322-A324 VanDerWaalsContact C-N 3.33Å; T322-A324 PolarHBondContact O-N 3.07Å; A324-R328 WeakPolarHBondContact O-CB 3.08Å; A324-R328 WeakPolarHBondContact O-CG 3.13Å; A324-R328 PolarHBondContact O-N 3.48Å; A324-R328 VanDerWaalsContact O-N 3.09Å
325	L	91	Very high	90.1	Very high	35 Å²	35	52.8 Å²	52.8	18%	0.183	26%	0.255	C	S	.	.	H	α-helix	trans	-69.5	-47.7	175.5	-178.1	67	0	0	0	111.5	F205 S321 T322 L323 Y327 R328 E329	F205-L325 HydrophobicContact CB-CD2 3.54Å; F205-L325 HydrophobicContact CD1-CB 4.36Å; F205-L325 HydrophobicContact CD1-CD2 3.18Å; F205-L325 HydrophobicContact CD1-CG 4.37Å; F205-L325 HydrophobicContact CD2-CD2 4.05Å; F205-L325 HydrophobicContact CE1-CB 4.3Å; F205-L325 HydrophobicContact CE1-CD2 3.73Å; F205-L325 HydrophobicContact CG-CD2 3.32Å; F205-L325 HydrophobicContact CZ-CD2 4.38Å; S321-L325 PolarHBondContact O-N 2.75Å; T322-L325 PolarHBondContact O-N 3.42Å; T322-L325 VanDerWaalsContact O-N 3.1Å; L323-L325 VanDerWaalsContact C-N 3.32Å; L323-L325 PolarHBondContact O-N 2.76Å; L325-Y327 VanDerWaalsContact C-N 3.31Å; L325-Y327 PolarHBondContact O-N 3.16Å; L325-R328 PolarHBondContact O-N 2.78Å; L325-E329 PolarHBondContact O-N 2.87Å
326	A	91.4	Very high	89.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.6	-42.9	178.7	0	0	0	0	0	111.1	V202 T322 L323 E329 A330 V357 L358	V202-A326 HydrophobicContact CG1-CB 3.82Å; T322-A326 WeakPolarHBondContact O-CB 3.41Å; T322-A326 PolarHBondContact O-N 2.75Å; L323-A326 PolarHBondContact O-N 3.46Å; A326-E329 PolarHBondContact O-N 3.34Å; A326-A330 WeakPolarHBondContact O-CB 2.98Å; A326-A330 PolarHBondContact O-N 2.9Å; A326-V357 HydrophobicContact CB-CG1 4.32Å; A326-L358 HydrophobicContact CB-CB 4.06Å; A326-L358 HydrophobicContact CB-CD1 4.15Å
327	Y	94.3	Very high	89	Confident	116 Å²	116	58.7 Å²	58.7	46%	0.455	28%	0.275	S	S	.	.	H	α-helix	trans	-64.5	-41.3	175.9	-178.5	-99.1	0	0	0	112.5	L323 L325 E329 A330 K331 V342	L323-Y327 VanDerWaalsContact O-CB 3.24Å; L323-Y327 WeakPolarHBondContact O-CB 3.38Å; L323-Y327 PolarHBondContact O-N 3.38Å; L325-Y327 VanDerWaalsContact C-N 3.31Å; L325-Y327 PolarHBondContact O-N 3.16Å; Y327-E329 VanDerWaalsContact C-N 3.34Å; Y327-E329 PolarHBondContact O-N 2.97Å; Y327-A330 PolarHBondContact O-N 2.99Å; Y327-K331 HydrophobicContact CE1-CD 4.39Å; Y327-K331 VanDerWaalsContact O-CB 3.31Å; Y327-K331 WeakPolarHBondContact O-CB 3.08Å; Y327-K331 PolarHBondContact O-N 2.66Å; Y327-V342 HydrophobicContact CD2-CG1 4.42Å; Y327-V342 HydrophobicContact CE2-CB 4.36Å; Y327-V342 HydrophobicContact CE2-CG1 4.27Å; Y327-V342 HydrophobicContact CE2-CG2 4.14Å
328	R	92.8	Very high	88.4	Confident	168 Å²	168	59.4 Å²	59.4	63%	0.634	28%	0.279	S	S	*	.	H	α-helix	trans	-61.9	-41.6	175.8	-78.2	172.1	-177.5	-173	2.6	111.6	A324 L325 R332	A324-R328 WeakPolarHBondContact O-CB 3.08Å; A324-R328 WeakPolarHBondContact O-CG 3.13Å; A324-R328 PolarHBondContact O-N 3.48Å; A324-R328 VanDerWaalsContact O-N 3.09Å; L325-R328 PolarHBondContact O-N 2.78Å; R328-R332 WeakPolarHBondContact O-CG 3.21Å; R328-R332 PolarHBondContact O-N 2.96Å; R328-R332 VanDerWaalsContact O-N 3.1Å
329	E	89.2	Confident	88	Confident	18 Å²	18	60.2 Å²	60.2	8%	0.084	28%	0.281	C	S	.	.	H	α-helix	trans	-70.3	-43.8	177.1	-170.2	58.7	-152.5	0	0	111.6	G198 V202 L325 A326 Y327 K331 R332 S333 R336	G198-E329 WeakPolarHBondContact CA-OE1 3.47Å; V202-E329 HydrophobicContact CG2-CB 3.48Å; V202-E329 VanDerWaalsContact CG2-CB 3.48Å; V202-E329 HydrophobicContact CG2-CG 3.64Å; L325-E329 PolarHBondContact O-N 2.87Å; A326-E329 PolarHBondContact O-N 3.34Å; Y327-E329 VanDerWaalsContact C-N 3.34Å; Y327-E329 PolarHBondContact O-N 2.97Å; E329-K331 VanDerWaalsContact C-N 3.28Å; E329-K331 PolarHBondContact O-N 3.31Å; E329-R332 WeakPolarHBondContact O-CB 3.48Å; E329-R332 PolarHBondContact O-N 2.88Å; E329-R332 IonicContact OE2-NH1 3.51Å; E329-S333 PolarHBondContact O-N 3.21Å; E329-S333 PolarHBondContact O-OG 3.33Å; E329-R336 IonicContact OE1-NH2 2.61Å; E329-R336 PolarHBondContact OE1-NH2 2.82Å
330	A	90.6	Very high	87.7	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-57.6	-41.1	174.5	0	0	0	0	0	111.7	A326 Y327 R332 S333 S334 V342 W345 L358	A326-A330 WeakPolarHBondContact O-CB 2.98Å; A326-A330 PolarHBondContact O-N 2.9Å; Y327-A330 PolarHBondContact O-N 2.99Å; A330-R332 PolarHBondContact O-N 3.37Å; A330-S333 PolarHBondContact O-N 3.33Å; A330-S334 WeakPolarHBondContact O-CB 3.39Å; A330-S334 PolarHBondContact O-N 3Å; A330-V342 HydrophobicContact CB-CG1 3.93Å; A330-W345 HydrophobicContact CB-CE3 3.98Å; A330-W345 HydrophobicContact CB-CH2 3.99Å; A330-W345 HydrophobicContact CB-CZ3 3.55Å; A330-L358 HydrophobicContact CB-CD2 3.67Å
331	K	92.2	Very high	87.5	Confident	99 Å²	99	69.2 Å²	69.2	43%	0.43	31%	0.314	S	S	.	.	H	α-helix	trans	-64.3	-38.3	174.4	-172.5	173.3	-176.3	172.5	0	112.6	Y327 E329 K335 V342	Y327-K331 HydrophobicContact CE1-CD 4.39Å; Y327-K331 VanDerWaalsContact O-CB 3.31Å; Y327-K331 WeakPolarHBondContact O-CB 3.08Å; Y327-K331 PolarHBondContact O-N 2.66Å; E329-K331 VanDerWaalsContact C-N 3.28Å; E329-K331 PolarHBondContact O-N 3.31Å; K331-K335 WeakPolarHBondContact O-CG 3.49Å; K331-K335 PolarHBondContact O-N 2.85Å; K331-K335 VanDerWaalsContact O-N 3.16Å; K331-V342 HydrophobicContact CB-CG2 4.09Å
332	R	87.8	Confident	87.3	Confident	149 Å²	149	67.7 Å²	67.7	56%	0.562	30%	0.303	S	S	*	.	H	α-helix	trans	-68.6	-45.1	175.4	-74.2	173.3	178.8	174.3	-1.7	111.7	R328 E329 A330 K335 R336	R328-R332 WeakPolarHBondContact O-CG 3.21Å; R328-R332 PolarHBondContact O-N 2.96Å; R328-R332 VanDerWaalsContact O-N 3.1Å; E329-R332 WeakPolarHBondContact O-CB 3.48Å; E329-R332 PolarHBondContact O-N 2.88Å; E329-R332 IonicContact OE2-NH1 3.51Å; A330-R332 PolarHBondContact O-N 3.37Å; R332-K335 PolarHBondContact O-N 2.96Å; R332-R336 WeakPolarHBondContact O-CG 3.44Å; R332-R336 PolarHBondContact O-N 2.96Å
333	S	84.6	Confident	87.4	Confident	2 Å²	2	75.7 Å²	75.7	1%	0.014	33%	0.333	C	S	.	.	H	α-helix	trans	-64.7	-44.2	177.6	-64.3	0	0	0	0	112	E329 A330 K335 R336 Q337	E329-S333 PolarHBondContact O-N 3.21Å; E329-S333 PolarHBondContact O-OG 3.33Å; A330-S333 PolarHBondContact O-N 3.33Å; S333-K335 VanDerWaalsContact C-N 3.33Å; S333-K335 PolarHBondContact O-N 3.48Å; S333-R336 PolarHBondContact O-N 3.33Å; S333-R336 PolarHBondContact OG-NH2 2.79Å; S333-Q337 WeakPolarHBondContact O-CB 3.49Å; S333-Q337 WeakPolarHBondContact O-CG 3.48Å; S333-Q337 PolarHBondContact O-N 3.36Å
334	S	85.9	Confident	87	Confident	6 Å²	6	77.9 Å²	77.9	4%	0.042	34%	0.342	C	S	.	.	H	α-helix	trans	-55	-46.1	172.9	168.6	0	0	0	0	111.7	A330 Q337 N338 F339	A330-S334 WeakPolarHBondContact O-CB 3.39Å; A330-S334 PolarHBondContact O-N 3Å; S334-Q337 PolarHBondContact O-N 2.87Å; S334-N338 PolarHBondContact O-N 3.18Å; S334-F339 PolarHBondContact O-N 2.63Å; S334-F339 WeakPolarHBondContact OG-CB 3.42Å; S334-F339 PolarHBondContact OG-O 3.46Å
335	K	85.6	Confident	86.7	Confident	145 Å²	145	75.9 Å²	75.9	63%	0.63	33%	0.326	S	S	*	.	H	α-helix	trans	-65.3	-42.3	175.5	-75.9	-175.4	176	-164.2	0	113.5	K331 R332 S333 Q337 N338	K331-K335 WeakPolarHBondContact O-CG 3.49Å; K331-K335 PolarHBondContact O-N 2.85Å; K331-K335 VanDerWaalsContact O-N 3.16Å; R332-K335 PolarHBondContact O-N 2.96Å; S333-K335 VanDerWaalsContact C-N 3.33Å; S333-K335 PolarHBondContact O-N 3.48Å; K335-Q337 PolarHBondContact O-N 3.42Å; K335-N338 PolarHBondContact O-N 3.31Å
336	R	79.5	Confident	86.6	Confident	141 Å²	141	75.2 Å²	75.2	53%	0.532	32%	0.322	S	S	.	.	H	α-helix	trans	-61.8	-33.9	178.4	-76.6	-174.5	-67.2	175.2	-4.9	112.6	E329 R332 S333	E329-R336 IonicContact OE1-NH2 2.61Å; E329-R336 PolarHBondContact OE1-NH2 2.82Å; R332-R336 WeakPolarHBondContact O-CG 3.44Å; R332-R336 PolarHBondContact O-N 2.96Å; S333-R336 PolarHBondContact O-N 3.33Å; S333-R336 PolarHBondContact OG-NH2 2.79Å
337	Q	72.4	Confident	86.4	Confident	44 Å²	44	79 Å²	79	21%	0.206	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	13.6	-176.8	-63.9	170.6	5.3	0	0	112.8	S333 S334 K335 F339 V350 E450	S333-Q337 WeakPolarHBondContact O-CB 3.49Å; S333-Q337 WeakPolarHBondContact O-CG 3.48Å; S333-Q337 PolarHBondContact O-N 3.36Å; S334-Q337 PolarHBondContact O-N 2.87Å; K335-Q337 PolarHBondContact O-N 3.42Å; Q337-F339 VanDerWaalsContact C-N 3.29Å; Q337-F339 HydrophobicContact CB-CD2 3.58Å; Q337-F339 HydrophobicContact CB-CE2 3.66Å; Q337-F339 PolarHBondContact O-N 2.97Å; Q337-V350 VanDerWaalsContact OE1-CG1 3.32Å; Q337-E450 PolarHBondContact NE2-OE1 2.95Å
338	N	78.2	Confident	85.8	Confident	152 Å²	152	74.2 Å²	74.2	81%	0.813	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	32.2	178	-59.2	-55.8	0	0	0	115.3	S334 K335	S334-N338 PolarHBondContact O-N 3.18Å; K335-N338 PolarHBondContact O-N 3.31Å
339	F	80.2	Confident	85.3	Confident	30 Å²	30	66.4 Å²	66.4	13%	0.132	29%	0.294	C	S	.	.			trans	-79.2	136.5	171.1	-76	-87.7	0	0	0	111.2	S334 Q337 S341 H344 W345 S348 V350	S334-F339 PolarHBondContact O-N 2.63Å; S334-F339 WeakPolarHBondContact OG-CB 3.42Å; S334-F339 PolarHBondContact OG-O 3.46Å; Q337-F339 VanDerWaalsContact C-N 3.29Å; Q337-F339 HydrophobicContact CB-CD2 3.58Å; Q337-F339 HydrophobicContact CB-CE2 3.66Å; Q337-F339 PolarHBondContact O-N 2.97Å; F339-S341 VanDerWaalsContact C-N 3.3Å; F339-S341 PolarHBondContact O-N 3.08Å; F339-H344 HydrophobicContact CD1-CB 4.15Å; F339-H344 AromaticContact CD1-CG 3.96Å; F339-H344 AromaticContact CD1-ND1 3.21Å; F339-H344 WeakPolarHBondContact CD1-ND1 3.35Å; F339-H344 AromaticContact CE1-ND1 3.52Å; F339-W345 HydrophobicContact CB-CB 4.13Å; F339-W345 HydrophobicContact CD1-CB 4.16Å; F339-W345 HydrophobicContact CD2-CB 4.3Å; F339-W345 AromaticContact CD2-CD1 3.61Å; F339-W345 HydrophobicContact CD2-CG 4.36Å; F339-W345 AromaticContact CE2-CD1 3.84Å; F339-W345 HydrophobicContact CG-CB 3.93Å; F339-W345 HydrophobicContact CG-CG 4.47Å; F339-S348 WeakPolarHBondContact CE1-OG 3.04Å; F339-V350 HydrophobicContact CE2-CG2 4.03Å; F339-V350 HydrophobicContact CZ-CG2 3.84Å
340	Y	83	Confident	84.8	Confident	181 Å²	181	66 Å²	66	71%	0.71	29%	0.293	S	S	*	.	S	Bend	trans	-67.5	-27.7	178.9	68.2	-96.6	0	0	0	113.6	H344	Y340-H344 HydrophobicContact CD1-CB 3.99Å; Y340-H344 AromaticContact CD1-CG 3.88Å; Y340-H344 AromaticContact CD1-ND1 3.79Å; Y340-H344 HydrophobicContact CE1-CB 3.37Å; Y340-H344 AromaticContact CE1-CD2 3.51Å; Y340-H344 AromaticContact CE1-CE1 3.92Å; Y340-H344 AromaticContact CE1-CG 3.12Å; Y340-H344 AromaticContact CE1-ND1 3.39Å; Y340-H344 WeakPolarHBondContact CE1-ND1 3.39Å; Y340-H344 AromaticContact CE1-NE2 3.98Å; Y340-H344 HydrophobicContact CE2-CB 4.04Å; Y340-H344 AromaticContact CZ-CD2 3.83Å; Y340-H344 AromaticContact CZ-CG 3.57Å; Y340-H344 PolarHBondContact OH-CD2 3.47Å
341	S	88.9	Confident	84.6	Confident	47 Å²	47	66.4 Å²	66.4	33%	0.329	30%	0.295	S	S	.	.			trans	-152.5	153.1	-177.6	179.5	0	0	0	0	111.7	F339 R343 H344 W345	F339-S341 VanDerWaalsContact C-N 3.3Å; F339-S341 PolarHBondContact O-N 3.08Å; S341-R343 PolarHBondContact O-N 3.29Å; S341-R343 PolarHBondContact OG-N 3.15Å; S341-H344 PolarHBondContact O-N 3.37Å; S341-H344 VanDerWaalsContact O-N 3.16Å; S341-W345 PolarHBondContact O-N 2.93Å; S341-W345 VanDerWaalsContact O-N 3.14Å
342	V	89	Confident	84.4	Confident	16 Å²	16	61.8 Å²	61.8	10%	0.097	28%	0.275	C	S	.	.	H	α-helix	trans	-58.5	-33.9	172.7	178.5	0	0	0	0	111.1	Y327 A330 K331 W345 L346 L358	Y327-V342 HydrophobicContact CD2-CG1 4.42Å; Y327-V342 HydrophobicContact CE2-CB 4.36Å; Y327-V342 HydrophobicContact CE2-CG1 4.27Å; Y327-V342 HydrophobicContact CE2-CG2 4.14Å; A330-V342 HydrophobicContact CB-CG1 3.93Å; K331-V342 HydrophobicContact CB-CG2 4.09Å; V342-W345 PolarHBondContact O-N 3.29Å; V342-L346 HydrophobicContact CG1-CD1 4.31Å; V342-L346 HydrophobicContact CG1-CG 4.44Å; V342-L346 WeakPolarHBondContact O-CB 3.23Å; V342-L346 WeakPolarHBondContact O-CG 3.34Å; V342-L346 PolarHBondContact O-N 3.11Å; V342-L358 HydrophobicContact CG1-CD2 4.15Å
343	R	90.2	Very high	84.4	Confident	171 Å²	171	54.7 Å²	54.7	65%	0.645	25%	0.249	S	C	*	.	H	α-helix	trans	-60	-48.5	175.9	-175	179.5	172	108	0.4	111	S341 W345 L346 F347	S341-R343 PolarHBondContact O-N 3.29Å; S341-R343 PolarHBondContact OG-N 3.15Å; R343-W345 VanDerWaalsContact C-N 3.3Å; R343-W345 PolarHBondContact O-N 2.76Å; R343-L346 WeakPolarHBondContact O-CB 3.11Å; R343-L346 PolarHBondContact O-N 3.41Å; R343-F347 HydrophobicContact CG-CD2 3.75Å; R343-F347 HydrophobicContact CG-CE2 3.54Å; R343-F347 WeakPolarHBondContact O-CD2 3.24Å; R343-F347 PolarHBondContact O-N 2.87Å
344	H	87.1	Confident	84.6	Confident	73 Å²	73	54.6 Å²	54.6	34%	0.338	25%	0.248	S	C	.	.	H	α-helix	trans	-64.1	-38.8	179.1	-164.4	-125.2	0	0	0	112.4	F339 Y340 S341 F347 S348	F339-H344 HydrophobicContact CD1-CB 4.15Å; F339-H344 AromaticContact CD1-CG 3.96Å; F339-H344 AromaticContact CD1-ND1 3.21Å; F339-H344 WeakPolarHBondContact CD1-ND1 3.35Å; F339-H344 AromaticContact CE1-ND1 3.52Å; Y340-H344 HydrophobicContact CD1-CB 3.99Å; Y340-H344 AromaticContact CD1-CG 3.88Å; Y340-H344 AromaticContact CD1-ND1 3.79Å; Y340-H344 HydrophobicContact CE1-CB 3.37Å; Y340-H344 AromaticContact CE1-CD2 3.51Å; Y340-H344 AromaticContact CE1-CE1 3.92Å; Y340-H344 AromaticContact CE1-CG 3.12Å; Y340-H344 AromaticContact CE1-ND1 3.39Å; Y340-H344 WeakPolarHBondContact CE1-ND1 3.39Å; Y340-H344 AromaticContact CE1-NE2 3.98Å; Y340-H344 HydrophobicContact CE2-CB 4.04Å; Y340-H344 AromaticContact CZ-CD2 3.83Å; Y340-H344 AromaticContact CZ-CG 3.57Å; Y340-H344 PolarHBondContact OH-CD2 3.47Å; S341-H344 PolarHBondContact O-N 3.37Å; S341-H344 VanDerWaalsContact O-N 3.16Å; H344-F347 PolarHBondContact O-N 2.86Å; H344-S348 WeakPolarHBondContact O-CB 3.43Å; H344-S348 PolarHBondContact O-N 2.92Å; H344-S348 PolarHBondContact O-OG 2.85Å
345	W	86.5	Confident	84.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.5	-43.4	175.4	178.2	84.3	0	0	0	111.9	A330 F339 S341 V342 R343 S348 G349 D351 T354 S355	A330-W345 HydrophobicContact CB-CE3 3.98Å; A330-W345 HydrophobicContact CB-CH2 3.99Å; A330-W345 HydrophobicContact CB-CZ3 3.55Å; F339-W345 HydrophobicContact CB-CB 4.13Å; F339-W345 HydrophobicContact CD1-CB 4.16Å; F339-W345 HydrophobicContact CD2-CB 4.3Å; F339-W345 AromaticContact CD2-CD1 3.61Å; F339-W345 HydrophobicContact CD2-CG 4.36Å; F339-W345 AromaticContact CE2-CD1 3.84Å; F339-W345 HydrophobicContact CG-CB 3.93Å; F339-W345 HydrophobicContact CG-CG 4.47Å; S341-W345 PolarHBondContact O-N 2.93Å; S341-W345 VanDerWaalsContact O-N 3.14Å; V342-W345 PolarHBondContact O-N 3.29Å; R343-W345 VanDerWaalsContact C-N 3.3Å; R343-W345 PolarHBondContact O-N 2.76Å; W345-S348 WeakPolarHBondContact O-CB 3.38Å; W345-S348 PolarHBondContact O-N 3.29Å; W345-G349 PolarHBondContact O-N 2.95Å; W345-D351 HydrophobicContact CH2-CB 3.85Å; W345-D351 HydrophobicContact CZ2-CB 3.44Å; W345-D351 VanDerWaalsContact CZ2-CB 3.44Å; W345-T354 HydrophobicContact CH2-CG2 3.96Å; W345-S355 WeakPolarHBondContact CZ3-OG 3.3Å
346	L	89.4	Confident	85.2	Confident	21 Å²	21	47.8 Å²	47.8	11%	0.11	22%	0.218	C	C	.	.	H	α-helix	trans	-59.4	-49.8	174.2	-81.6	171.8	0	0	0	111.8	V342 R343 S348 G349 L358 L359	V342-L346 HydrophobicContact CG1-CD1 4.31Å; V342-L346 HydrophobicContact CG1-CG 4.44Å; V342-L346 WeakPolarHBondContact O-CB 3.23Å; V342-L346 WeakPolarHBondContact O-CG 3.34Å; V342-L346 PolarHBondContact O-N 3.11Å; R343-L346 WeakPolarHBondContact O-CB 3.11Å; R343-L346 PolarHBondContact O-N 3.41Å; L346-S348 PolarHBondContact O-N 3.01Å; L346-G349 PolarHBondContact O-N 3.37Å; L346-G349 VanDerWaalsContact O-N 3.17Å; L346-L358 HydrophobicContact CD1-CD2 4.06Å; L346-L358 HydrophobicContact CD2-CD2 4.01Å; L346-L358 HydrophobicContact CG-CD2 4.3Å; L346-L359 HydrophobicContact CD1-CD2 4.3Å; L346-L359 HydrophobicContact CD2-CD1 4.25Å; L346-L359 HydrophobicContact CD2-CG 4.13Å
347	F	86.4	Confident	85.9	Confident	79 Å²	79	41.1 Å²	41.1	35%	0.346	19%	0.193	S	C	.	.	H	α-helix	trans	-69.3	-14.8	178.4	-75.4	-71.4	0	0	0	113.8	R343 H344 L404 R416	R343-F347 HydrophobicContact CG-CD2 3.75Å; R343-F347 HydrophobicContact CG-CE2 3.54Å; R343-F347 WeakPolarHBondContact O-CD2 3.24Å; R343-F347 PolarHBondContact O-N 2.87Å; H344-F347 PolarHBondContact O-N 2.86Å; F347-L404 HydrophobicContact CD1-CD1 4.2Å; F347-L404 HydrophobicContact CD1-CG 4.5Å; F347-L404 HydrophobicContact CE1-CD1 3.28Å; F347-L404 HydrophobicContact CE1-CG 3.94Å; F347-L404 HydrophobicContact CZ-CD1 3.46Å; F347-L404 VanDerWaalsContact CZ-CD1 3.46Å; F347-R416 PolarHBondContact O-NH1 2.9Å
348	S	81.7	Confident	86.9	Confident	17 Å²	17	39.3 Å²	39.3	12%	0.119	19%	0.185	C	C	.	.	H	α-helix	trans	-81.1	-20.8	174.9	-64.5	0	0	0	0	112.7	F339 H344 W345 L346 V350 R416	F339-S348 WeakPolarHBondContact CE1-OG 3.04Å; H344-S348 WeakPolarHBondContact O-CB 3.43Å; H344-S348 PolarHBondContact O-N 2.92Å; H344-S348 PolarHBondContact O-OG 2.85Å; W345-S348 WeakPolarHBondContact O-CB 3.38Å; W345-S348 PolarHBondContact O-N 3.29Å; L346-S348 PolarHBondContact O-N 3.01Å; S348-V350 PolarHBondContact O-N 2.97Å; S348-R416 PolarHBondContact O-NH1 3.43Å
349	G	82	Confident	87.6	Confident	4 Å²	4	32.7 Å²	32.7	4%	0.041	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	18.1	175.4	0	0	0	0	0	114.4	W345 L346 D351	W345-G349 PolarHBondContact O-N 2.95Å; L346-G349 PolarHBondContact O-N 3.37Å; L346-G349 VanDerWaalsContact O-N 3.17Å; G349-D351 VanDerWaalsContact C-N 3.33Å; G349-D351 PolarHBondContact O-N 3.46Å
350	V	79.5	Confident	88.2	Confident	9 Å²	9	32.2 Å²	32.2	6%	0.055	15%	0.147	C	C	.	.	S	Bend	trans	-61.5	-43	-173.5	-173	0	0	0	0	111.2	Q337 F339 S348 P352 M446 G449	Q337-V350 VanDerWaalsContact OE1-CG1 3.32Å; F339-V350 HydrophobicContact CE2-CG2 4.03Å; F339-V350 HydrophobicContact CZ-CG2 3.84Å; S348-V350 PolarHBondContact O-N 2.97Å; V350-P352 WeakPolarHBondContact O-CD 3.25Å; V350-M446 HydrophobicContact CG1-CE 4.17Å; V350-G449 WeakPolarHBondContact CG1-O 3.48Å; V350-G449 WeakPolarHBondContact O-CA 3.29Å; V350-G449 PolarHBondContact O-N 3Å
351	D	86	Confident	88.7	Confident	9 Å²	9	23.8 Å²	23.8	5%	0.048	12%	0.115	C	C	.	.			trans	-118.4	89.3	176.7	-172	-9.6	0	0	0	110.8	P199 R269 W345 G349 S353 T354 S355	P199-D351 WeakPolarHBondContact CB-OD2 3.43Å; R269-D351 IonicContact CZ-OD1 3.22Å; R269-D351 IonicContact NH2-OD1 3.01Å; R269-D351 PolarHBondContact NH2-OD1 3.33Å; R269-D351 IonicContact NH2-OD2 2.75Å; W345-D351 HydrophobicContact CH2-CB 3.85Å; W345-D351 HydrophobicContact CZ2-CB 3.44Å; W345-D351 VanDerWaalsContact CZ2-CB 3.44Å; G349-D351 VanDerWaalsContact C-N 3.33Å; G349-D351 PolarHBondContact O-N 3.46Å; D351-S353 PolarHBondContact O-N 2.9Å; D351-S353 PolarHBondContact OD1-N 3.1Å; D351-T354 VanDerWaalsContact CG-OG1 3.29Å; D351-T354 PolarHBondContact OD1-N 2.89Å; D351-T354 PolarHBondContact OD1-OG1 2.99Å; D351-T354 WeakPolarHBondContact OD2-CB 3.47Å; D351-T354 PolarHBondContact OD2-OG1 3.5Å; D351-S355 WeakPolarHBondContact O-CB 3.17Å; D351-S355 PolarHBondContact O-N 3.32Å; D351-S355 PolarHBondContact O-OG 3.26Å
352	P	88.3	Confident	89	Confident	2 Å²	2	24.8 Å²	24.8	1%	0.013	12%	0.116	C	C	.	.	H	α-helix	trans	-66	-25.9	-175.4	29.1	-40.2	0	0	0	113.3	R269 N270 S273 V350 M356 N409	R269-P352 HydrophobicContact CB-CG 3.58Å; N270-P352 VanDerWaalsContact OD1-CB 3.31Å; N270-P352 WeakPolarHBondContact OD1-CB 3.42Å; N270-P352 WeakPolarHBondContact OD1-CG 3.08Å; S273-P352 PolarHBondContact OG-O 3.25Å; V350-P352 WeakPolarHBondContact O-CD 3.25Å; P352-M356 WeakPolarHBondContact O-CB 3.39Å; P352-M356 PolarHBondContact O-N 2.82Å; P352-M356 VanDerWaalsContact O-N 3.09Å; P352-N409 WeakPolarHBondContact CB-OD1 3.47Å
353	S	88.9	Confident	89.2	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-77.5	-49.1	-177.1	-48.1	0	0	0	0	110.8	R269 D351 M356 V357	R269-S353 PolarHBondContact NE-OG 3.49Å; R269-S353 VanDerWaalsContact NE-OG 3.17Å; R269-S353 PolarHBondContact NH2-OG 3.09Å; D351-S353 PolarHBondContact O-N 2.9Å; D351-S353 PolarHBondContact OD1-N 3.1Å; S353-M356 PolarHBondContact O-N 2.95Å; S353-V357 PolarHBondContact O-N 3.07Å
354	T	89	Confident	89.3	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-69.1	-38.8	177.3	-54.4	0	0	0	0	111.1	P199 V202 W345 D351 M356 L358	P199-T354 WeakPolarHBondContact CA-OG1 3.43Å; P199-T354 WeakPolarHBondContact CB-OG1 3.32Å; V202-T354 HydrophobicContact CG2-CG2 4.45Å; W345-T354 HydrophobicContact CH2-CG2 3.96Å; D351-T354 VanDerWaalsContact CG-OG1 3.29Å; D351-T354 PolarHBondContact OD1-N 2.89Å; D351-T354 PolarHBondContact OD1-OG1 2.99Å; D351-T354 WeakPolarHBondContact OD2-CB 3.47Å; D351-T354 PolarHBondContact OD2-OG1 3.5Å; T354-M356 VanDerWaalsContact C-N 3.33Å; T354-M356 PolarHBondContact O-N 3.3Å; T354-L358 VanDerWaalsContact O-CB 3.26Å; T354-L358 WeakPolarHBondContact O-CB 3.31Å; T354-L358 PolarHBondContact O-N 3.43Å
355	S	91.6	Very high	89.6	Confident	6 Å²	6	15.1 Å²	15.1	4%	0.042	8%	0.084	C	C	.	.	H	α-helix	trans	-63	-40.6	177.1	-58.3	0	0	0	0	111.8	W345 D351 L358 L359	W345-S355 WeakPolarHBondContact CZ3-OG 3.3Å; D351-S355 WeakPolarHBondContact O-CB 3.17Å; D351-S355 PolarHBondContact O-N 3.32Å; D351-S355 PolarHBondContact O-OG 3.26Å; S355-L358 PolarHBondContact O-N 3.05Å; S355-L359 VanDerWaalsContact O-CB 3.3Å; S355-L359 WeakPolarHBondContact O-CB 3.4Å; S355-L359 WeakPolarHBondContact O-CD1 3.28Å; S355-L359 WeakPolarHBondContact O-CG 3.09Å; S355-L359 PolarHBondContact O-N 3.11Å
356	M	92.5	Very high	90.1	Very high	2 Å²	2	18.5 Å²	18.5	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-59.4	-58.2	176	168.9	41.5	-168.4	0	0	111.3	N242 V246 I280 P352 S353 T354 L358 L359 E360 I405	N242-M356 WeakPolarHBondContact ND2-CE 3.36Å; V246-M356 HydrophobicContact CG2-CG 3.81Å; I280-M356 HydrophobicContact CD1-CE 3.32Å; I280-M356 HydrophobicContact CD1-SD 4.32Å; P352-M356 WeakPolarHBondContact O-CB 3.39Å; P352-M356 PolarHBondContact O-N 2.82Å; P352-M356 VanDerWaalsContact O-N 3.09Å; S353-M356 PolarHBondContact O-N 2.95Å; T354-M356 VanDerWaalsContact C-N 3.33Å; T354-M356 PolarHBondContact O-N 3.3Å; M356-L358 VanDerWaalsContact C-N 3.27Å; M356-L358 PolarHBondContact O-N 3.35Å; M356-L359 PolarHBondContact O-N 3.47Å; M356-L359 VanDerWaalsContact O-N 3.1Å; M356-E360 HydrophobicContact CE-CB 3.88Å; M356-E360 VanDerWaalsContact CE-CD 3.48Å; M356-E360 HydrophobicContact CE-CG 4.12Å; M356-E360 WeakPolarHBondContact CE-OE2 3.2Å; M356-E360 WeakPolarHBondContact O-CB 3.14Å; M356-E360 PolarHBondContact O-N 3.07Å; M356-E360 HydrophobicContact SD-CB 4.25Å; M356-I405 HydrophobicContact SD-CD1 3.5Å; M356-I405 VanDerWaalsContact SD-CD1 3.5Å; M356-I405 HydrophobicContact SD-CG1 4.31Å; M356-I405 HydrophobicContact SD-CG2 4.36Å
357	V	92.2	Very high	90.3	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-56.5	-42.7	179.6	176.2	0	0	0	0	111.4	V202 V203 A206 A326 S353 L359 D361	V202-V357 HydrophobicContact CG1-CB 4.48Å; V202-V357 HydrophobicContact CG1-CG1 4.16Å; V203-V357 HydrophobicContact CG2-CG2 4.31Å; A206-V357 HydrophobicContact CB-CG1 3.92Å; A326-V357 HydrophobicContact CB-CG1 4.32Å; S353-V357 PolarHBondContact O-N 3.07Å; V357-L359 PolarHBondContact O-N 2.97Å; V357-D361 WeakPolarHBondContact O-CB 3.37Å; V357-D361 VanDerWaalsContact O-CG 3.22Å; V357-D361 PolarHBondContact O-N 2.75Å
358	L	93.6	Very high	90.5	Very high	6 Å²	6	15.3 Å²	15.3	3%	0.031	9%	0.091	C	C	.	.	H	α-helix	trans	-61.2	-44.4	178.3	177.2	56.6	0	0	0	112.5	L323 A326 A330 V342 L346 T354 S355 M356 L362	L323-L358 HydrophobicContact CD1-CD1 3.45Å; L323-L358 VanDerWaalsContact CD1-CD1 3.45Å; A326-L358 HydrophobicContact CB-CB 4.06Å; A326-L358 HydrophobicContact CB-CD1 4.15Å; A330-L358 HydrophobicContact CB-CD2 3.67Å; V342-L358 HydrophobicContact CG1-CD2 4.15Å; L346-L358 HydrophobicContact CD1-CD2 4.06Å; L346-L358 HydrophobicContact CD2-CD2 4.01Å; L346-L358 HydrophobicContact CG-CD2 4.3Å; T354-L358 VanDerWaalsContact O-CB 3.26Å; T354-L358 WeakPolarHBondContact O-CB 3.31Å; T354-L358 PolarHBondContact O-N 3.43Å; S355-L358 PolarHBondContact O-N 3.05Å; M356-L358 VanDerWaalsContact C-N 3.27Å; M356-L358 PolarHBondContact O-N 3.35Å; L358-L362 WeakPolarHBondContact O-CB 3.42Å; L358-L362 PolarHBondContact O-N 3.47Å; L358-L362 VanDerWaalsContact O-N 3.07Å
359	L	94.3	Very high	91.1	Very high	14 Å²	14	18.5 Å²	18.5	7%	0.073	11%	0.109	C	C	.	.	H	α-helix	trans	-72.6	-40.2	-177.9	-75.8	168	0	0	0	112	L346 S355 M356 V357 A363 V401 L404 I405	L346-L359 HydrophobicContact CD1-CD2 4.3Å; L346-L359 HydrophobicContact CD2-CD1 4.25Å; L346-L359 HydrophobicContact CD2-CG 4.13Å; S355-L359 VanDerWaalsContact O-CB 3.3Å; S355-L359 WeakPolarHBondContact O-CB 3.4Å; S355-L359 WeakPolarHBondContact O-CD1 3.28Å; S355-L359 WeakPolarHBondContact O-CG 3.09Å; S355-L359 PolarHBondContact O-N 3.11Å; M356-L359 PolarHBondContact O-N 3.47Å; M356-L359 VanDerWaalsContact O-N 3.1Å; V357-L359 PolarHBondContact O-N 2.97Å; L359-A363 WeakPolarHBondContact O-CB 3.2Å; L359-A363 PolarHBondContact O-N 2.93Å; L359-V401 HydrophobicContact CB-CG1 3.84Å; L359-L404 HydrophobicContact CD1-CD2 3.38Å; L359-L404 HydrophobicContact CD2-CD2 4.08Å; L359-L404 HydrophobicContact CG-CD2 4.4Å; L359-I405 HydrophobicContact CB-CD1 4.12Å; L359-I405 HydrophobicContact CB-CG1 4.27Å; L359-I405 HydrophobicContact CD1-CD1 4.44Å; L359-I405 HydrophobicContact CD1-CG1 3.68Å
360	E	92.7	Very high	91.7	Very high	19 Å²	19	20 Å²	20	9%	0.089	12%	0.117	C	C	.	.	H	α-helix	trans	-61.4	-54.8	175.1	-176.6	176.9	-158.3	0	0	111.3	N242 I280 M356 L362 A363 A364	N242-E360 VanDerWaalsContact ND2-CD 3.29Å; N242-E360 PolarHBondContact ND2-OE1 3.41Å; N242-E360 PolarHBondContact ND2-OE2 2.77Å; I280-E360 HydrophobicContact CD1-CG 4.16Å; M356-E360 HydrophobicContact CE-CB 3.88Å; M356-E360 VanDerWaalsContact CE-CD 3.48Å; M356-E360 HydrophobicContact CE-CG 4.12Å; M356-E360 WeakPolarHBondContact CE-OE2 3.2Å; M356-E360 WeakPolarHBondContact O-CB 3.14Å; M356-E360 PolarHBondContact O-N 3.07Å; M356-E360 HydrophobicContact SD-CB 4.25Å; E360-L362 VanDerWaalsContact C-N 3.26Å; E360-L362 PolarHBondContact O-N 3.25Å; E360-A363 WeakPolarHBondContact O-CA 3.4Å; E360-A363 WeakPolarHBondContact O-CB 3.3Å; E360-A363 PolarHBondContact O-N 2.98Å; E360-A364 PolarHBondContact O-N 2.94Å
361	D	92.9	Very high	92.2	Very high	4 Å²	4	20.7 Å²	20.7	2%	0.021	13%	0.125	C	C	.	.	H	α-helix	trans	-64	-34	-179.9	-65.5	-10.6	0	0	0	111.5	T322 L323 V357 A364 V365	T322-D361 WeakPolarHBondContact CB-OD2 3.42Å; T322-D361 VanDerWaalsContact OG1-CG 3.22Å; T322-D361 PolarHBondContact OG1-OD2 2.68Å; L323-D361 HydrophobicContact CB-CB 3.92Å; L323-D361 HydrophobicContact CD1-CB 4.36Å; L323-D361 PolarHBondContact N-OD2 2.7Å; V357-D361 WeakPolarHBondContact O-CB 3.37Å; V357-D361 VanDerWaalsContact O-CG 3.22Å; V357-D361 PolarHBondContact O-N 2.75Å; D361-A364 PolarHBondContact O-N 2.98Å; D361-V365 WeakPolarHBondContact O-CB 3.38Å; D361-V365 VanDerWaalsContact O-CG2 3.31Å; D361-V365 WeakPolarHBondContact O-CG2 3.31Å; D361-V365 PolarHBondContact O-N 2.69Å
362	L	94.6	Very high	92.4	Very high	69 Å²	69	21.1 Å²	21.1	36%	0.361	13%	0.131	S	C	.	.	H	α-helix	trans	-64.2	-43.7	173	179.9	66.9	0	0	0	111.3	L323 L358 E360 A364 I366	L323-L362 HydrophobicContact CD1-CB 4.04Å; L323-L362 HydrophobicContact CD2-CD1 4.22Å; L358-L362 WeakPolarHBondContact O-CB 3.42Å; L358-L362 PolarHBondContact O-N 3.47Å; L358-L362 VanDerWaalsContact O-N 3.07Å; E360-L362 VanDerWaalsContact C-N 3.26Å; E360-L362 PolarHBondContact O-N 3.25Å; L362-A364 VanDerWaalsContact C-N 3.32Å; L362-I366 HydrophobicContact CD1-CD1 3.89Å; L362-I366 HydrophobicContact CD1-CG1 4.33Å; L362-I366 HydrophobicContact CG-CD1 3.91Å; L362-I366 WeakPolarHBondContact O-CB 3.42Å; L362-I366 VanDerWaalsContact O-CG1 3.24Å; L362-I366 WeakPolarHBondContact O-CG1 3.13Å; L362-I366 PolarHBondContact O-N 3.13Å
363	A	94.5	Very high	92.5	Very high	3 Å²	3	24.1 Å²	24.1	3%	0.025	15%	0.152	C	C	.	.	H	α-helix	trans	-63.7	-40.6	176.9	0	0	0	0	0	111.3	L359 E360 G367 I397 L398 V401	L359-A363 WeakPolarHBondContact O-CB 3.2Å; L359-A363 PolarHBondContact O-N 2.93Å; E360-A363 WeakPolarHBondContact O-CA 3.4Å; E360-A363 WeakPolarHBondContact O-CB 3.3Å; E360-A363 PolarHBondContact O-N 2.98Å; A363-G367 WeakPolarHBondContact O-CA 3.33Å; A363-G367 PolarHBondContact O-N 3.19Å; A363-I397 HydrophobicContact CB-CG2 4.16Å; A363-L398 HydrophobicContact CB-CD2 4.09Å; A363-V401 HydrophobicContact CB-CB 4.2Å; A363-V401 HydrophobicContact CB-CG1 4.17Å; A363-V401 HydrophobicContact CB-CG2 3.96Å
364	A	91.8	Very high	92.7	Very high	27 Å²	27	24.6 Å²	24.6	22%	0.223	16%	0.155	C	C	.	.	H	α-helix	trans	-64.9	-49.8	178.8	0	0	0	0	0	111.3	E319 E360 D361 L362 I366 G367 V368	E319-A364 HydrophobicContact CG-CB 4.35Å; E319-A364 WeakPolarHBondContact OE2-CB 3.45Å; E360-A364 PolarHBondContact O-N 2.94Å; D361-A364 PolarHBondContact O-N 2.98Å; L362-A364 VanDerWaalsContact C-N 3.32Å; A364-I366 PolarHBondContact O-N 3.43Å; A364-G367 CarbonylContact O-C 3.44Å; A364-G367 WeakPolarHBondContact O-CA 3.49Å; A364-G367 PolarHBondContact O-N 2.9Å; A364-G367 VanDerWaalsContact O-N 3.1Å; A364-V368 WeakPolarHBondContact O-CG2 3.34Å; A364-V368 PolarHBondContact O-N 3.37Å
365	V	94.1	Very high	92.6	Very high	26 Å²	26	25.8 Å²	25.8	16%	0.158	16%	0.161	C	C	.	.	H	α-helix	trans	-59.8	-47	176.7	168.2	0	0	0	0	112.1	L316 E319 L323 D361 G367 V368 V369	L316-V365 HydrophobicContact CD1-CB 4.45Å; L316-V365 HydrophobicContact CD1-CG1 3.88Å; E319-V365 HydrophobicContact CB-CG2 3.88Å; L323-V365 HydrophobicContact CD2-CB 4.12Å; L323-V365 HydrophobicContact CD2-CG1 4.36Å; L323-V365 HydrophobicContact CD2-CG2 3.88Å; D361-V365 WeakPolarHBondContact O-CB 3.38Å; D361-V365 VanDerWaalsContact O-CG2 3.31Å; D361-V365 WeakPolarHBondContact O-CG2 3.31Å; D361-V365 PolarHBondContact O-N 2.69Å; V365-G367 VanDerWaalsContact C-N 3.31Å; V365-G367 PolarHBondContact O-N 3.12Å; V365-V368 PolarHBondContact O-N 2.64Å; V365-V369 WeakPolarHBondContact O-CG2 3.26Å; V365-V369 PolarHBondContact O-N 3.24Å; V365-V369 VanDerWaalsContact O-N 3.11Å
366	I	95.5	Very high	92.4	Very high	72 Å²	72	27.2 Å²	27.2	37%	0.369	17%	0.174	S	C	.	.	H	α-helix	trans	-64.6	-41	176.6	-64	171	0	0	0	109.9	L362 A364 V369 V370 I397	L362-I366 HydrophobicContact CD1-CD1 3.89Å; L362-I366 HydrophobicContact CD1-CG1 4.33Å; L362-I366 HydrophobicContact CG-CD1 3.91Å; L362-I366 WeakPolarHBondContact O-CB 3.42Å; L362-I366 VanDerWaalsContact O-CG1 3.24Å; L362-I366 WeakPolarHBondContact O-CG1 3.13Å; L362-I366 PolarHBondContact O-N 3.13Å; A364-I366 PolarHBondContact O-N 3.43Å; I366-V369 PolarHBondContact O-N 2.89Å; I366-V370 HydrophobicContact CG2-CG2 4.3Å; I366-V370 WeakPolarHBondContact O-CG2 3.28Å; I366-V370 PolarHBondContact O-N 3.24Å; I366-I397 HydrophobicContact CG2-CD1 3.73Å
367	G	94	Very high	92.3	Very high	7 Å²	7	30.5 Å²	30.5	7%	0.072	19%	0.194	C	C	.	.	H	α-helix	trans	-59.8	-45.9	178.3	0	0	0	0	0	112.4	A363 A364 V365 V369 V370 A371 V394	A363-G367 WeakPolarHBondContact O-CA 3.33Å; A363-G367 PolarHBondContact O-N 3.19Å; A364-G367 CarbonylContact O-C 3.44Å; A364-G367 WeakPolarHBondContact O-CA 3.49Å; A364-G367 PolarHBondContact O-N 2.9Å; A364-G367 VanDerWaalsContact O-N 3.1Å; V365-G367 VanDerWaalsContact C-N 3.31Å; V365-G367 PolarHBondContact O-N 3.12Å; G367-V369 PolarHBondContact O-N 3.02Å; G367-V370 PolarHBondContact O-N 3.49Å; G367-A371 VanDerWaalsContact O-CB 3.29Å; G367-A371 WeakPolarHBondContact O-CB 3.24Å; G367-A371 PolarHBondContact O-N 2.82Å; G367-V394 WeakPolarHBondContact O-CG2 3.32Å
368	V	91.4	Very high	92	Very high	25 Å²	25	31.1 Å²	31.1	15%	0.152	20%	0.197	C	C	.	.	H	α-helix	trans	-63.3	-40	176.1	172.9	0	0	0	0	111.3	M312 L316 A364 V365 G372	M312-V368 HydrophobicContact CB-CG1 4.15Å; M312-V368 HydrophobicContact CE-CG1 4.01Å; M312-V368 VanDerWaalsContact CE-O 3.29Å; M312-V368 WeakPolarHBondContact CE-O 3.32Å; L316-V368 HydrophobicContact CB-CG1 4.05Å; L316-V368 HydrophobicContact CD1-CB 4.38Å; L316-V368 HydrophobicContact CD1-CG1 4.18Å; A364-V368 WeakPolarHBondContact O-CG2 3.34Å; A364-V368 PolarHBondContact O-N 3.37Å; V365-V368 PolarHBondContact O-N 2.64Å; V368-G372 WeakPolarHBondContact O-CA 3.32Å; V368-G372 PolarHBondContact O-N 3.09Å
369	V	93.7	Very high	91.6	Very high	84 Å²	84	33.8 Å²	33.8	51%	0.509	22%	0.22	S	C	.	.	H	α-helix	trans	-64	-45.2	175.5	171.2	0	0	0	0	111.1	L316 V365 I366 G367 S373	L316-V369 HydrophobicContact CD1-CG2 4.22Å; V365-V369 WeakPolarHBondContact O-CG2 3.26Å; V365-V369 PolarHBondContact O-N 3.24Å; V365-V369 VanDerWaalsContact O-N 3.11Å; I366-V369 PolarHBondContact O-N 2.89Å; G367-V369 PolarHBondContact O-N 3.02Å; V369-S373 WeakPolarHBondContact O-CB 3.47Å; V369-S373 PolarHBondContact O-N 3.32Å; V369-S373 PolarHBondContact O-OG 2.98Å
370	V	94.5	Very high	91.3	Very high	35 Å²	35	42 Å²	42	21%	0.212	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-52.9	178.6	170.5	0	0	0	0	110.7	I366 G367 G372 S373 A374 C393 V394 I397	I366-V370 HydrophobicContact CG2-CG2 4.3Å; I366-V370 WeakPolarHBondContact O-CG2 3.28Å; I366-V370 PolarHBondContact O-N 3.24Å; G367-V370 PolarHBondContact O-N 3.49Å; V370-G372 VanDerWaalsContact C-N 3.31Å; V370-G372 PolarHBondContact O-N 3.31Å; V370-S373 PolarHBondContact O-N 2.95Å; V370-S373 PolarHBondContact O-OG 2.72Å; V370-A374 WeakPolarHBondContact O-CB 3.44Å; V370-A374 PolarHBondContact O-N 2.77Å; V370-C393 HydrophobicContact CG1-CB 3.72Å; V370-V394 HydrophobicContact CB-CG2 4.33Å; V370-V394 HydrophobicContact CG1-CG2 4.16Å; V370-I397 HydrophobicContact CG2-CD1 3.99Å
371	A	90.8	Very high	91.1	Very high	25 Å²	25	44.4 Å²	44.4	21%	0.207	27%	0.272	C	S	.	.	H	α-helix	trans	-60.1	-40.7	178	0	0	0	0	0	111.8	M312 G367 A374 M375 V394	M312-A371 HydrophobicContact CE-CB 3.79Å; G367-A371 VanDerWaalsContact O-CB 3.29Å; G367-A371 WeakPolarHBondContact O-CB 3.24Å; G367-A371 PolarHBondContact O-N 2.82Å; A371-A374 PolarHBondContact O-N 3.46Å; A371-M375 WeakPolarHBondContact O-CB 3.25Å; A371-M375 PolarHBondContact O-N 2.78Å; A371-V394 HydrophobicContact CB-CG2 4.2Å
372	G	89.3	Confident	90.6	Very high	17 Å²	17	47.4 Å²	47.4	18%	0.175	30%	0.303	C	S	.	.	H	α-helix	trans	-67.7	-39	-179.8	0	0	0	0	0	111.8	M312 V368 V370 A376	M312-G372 VanDerWaalsContact CE-CA 3.41Å; V368-G372 WeakPolarHBondContact O-CA 3.32Å; V368-G372 PolarHBondContact O-N 3.09Å; V370-G372 VanDerWaalsContact C-N 3.31Å; V370-G372 PolarHBondContact O-N 3.31Å; G372-A376 WeakPolarHBondContact O-CB 3.47Å; G372-A376 PolarHBondContact O-N 2.91Å
373	S	91.4	Very high	90.1	Very high	66 Å²	66	50.4 Å²	50.4	46%	0.462	32%	0.316	S	S	.	.	H	α-helix	trans	-66	-41.4	173.9	72.8	0	0	0	0	112	V369 V370 A376 V377	V369-S373 WeakPolarHBondContact O-CB 3.47Å; V369-S373 PolarHBondContact O-N 3.32Å; V369-S373 PolarHBondContact O-OG 2.98Å; V370-S373 PolarHBondContact O-N 2.95Å; V370-S373 PolarHBondContact O-OG 2.72Å; S373-A376 PolarHBondContact O-N 3.08Å; S373-V377 VanDerWaalsContact O-CG2 3.31Å; S373-V377 WeakPolarHBondContact O-CG2 3.41Å; S373-V377 PolarHBondContact O-N 3.38Å
374	A	91.4	Very high	89.7	Confident	9 Å²	9	52.8 Å²	52.8	7%	0.074	33%	0.33	C	S	.	.	H	α-helix	trans	-63.4	-47.1	176.9	0	0	0	0	0	111.6	V370 A371 A376 V377 T378 P386	V370-A374 WeakPolarHBondContact O-CB 3.44Å; V370-A374 PolarHBondContact O-N 2.77Å; A371-A374 PolarHBondContact O-N 3.46Å; A374-A376 PolarHBondContact O-N 2.92Å; A374-V377 PolarHBondContact O-N 3.11Å; A374-T378 PolarHBondContact O-N 3.42Å; A374-T378 PolarHBondContact O-OG1 2.88Å; A374-P386 WeakPolarHBondContact CB-O 3.47Å
375	M	87.1	Confident	89.5	Confident	25 Å²	25	56 Å²	56	12%	0.123	34%	0.342	C	S	.	.	H	α-helix	trans	-61.2	-41.5	175.3	-175.2	179.8	-66	0	0	112	V305 A308 L309 M312 A371 T378 A379	V305-M375 HydrophobicContact CG1-SD 4.48Å; A308-M375 HydrophobicContact CB-CE 3.97Å; A308-M375 HydrophobicContact CB-SD 3.9Å; L309-M375 HydrophobicContact CD2-SD 4.23Å; L309-M375 HydrophobicContact CG-SD 4.35Å; M312-M375 HydrophobicContact SD-CE 4.03Å; M312-M375 HydrophobicContact SD-SD 4.21Å; A371-M375 WeakPolarHBondContact O-CB 3.25Å; A371-M375 PolarHBondContact O-N 2.78Å; M375-T378 PolarHBondContact O-N 3.3Å; M375-A379 WeakPolarHBondContact O-CB 3.45Å; M375-A379 PolarHBondContact O-N 3.05Å
376	A	87.4	Confident	89.3	Confident	37 Å²	37	56.1 Å²	56.1	31%	0.306	34%	0.344	S	S	.	.	H	α-helix	trans	-62	-44.7	175.5	0	0	0	0	0	111.5	G372 S373 A374 T378 A379 F380	G372-A376 WeakPolarHBondContact O-CB 3.47Å; G372-A376 PolarHBondContact O-N 2.91Å; S373-A376 PolarHBondContact O-N 3.08Å; A374-A376 PolarHBondContact O-N 2.92Å; A376-T378 VanDerWaalsContact C-N 3.35Å; A376-T378 PolarHBondContact O-N 3.3Å; A376-A379 PolarHBondContact O-N 3.3Å; A376-F380 WeakPolarHBondContact O-CD2 3.37Å; A376-F380 PolarHBondContact O-N 2.87Å
377	V	90.9	Very high	88.9	Confident	70 Å²	70	54.8 Å²	54.8	42%	0.424	34%	0.337	S	S	.	.	H	α-helix	trans	-62.9	-41.3	176	175.3	0	0	0	0	111.1	S373 A374 A379 F380 T381 P386	S373-V377 VanDerWaalsContact O-CG2 3.31Å; S373-V377 WeakPolarHBondContact O-CG2 3.41Å; S373-V377 PolarHBondContact O-N 3.38Å; A374-V377 PolarHBondContact O-N 3.11Å; V377-A379 VanDerWaalsContact C-N 3.34Å; V377-A379 PolarHBondContact O-N 2.87Å; V377-F380 PolarHBondContact O-N 2.91Å; V377-T381 HydrophobicContact CG1-CG2 3.98Å; V377-T381 WeakPolarHBondContact O-CB 3.49Å; V377-T381 WeakPolarHBondContact O-CG2 3.46Å; V377-T381 PolarHBondContact O-N 2.82Å; V377-T381 PolarHBondContact O-OG1 3.21Å; V377-P386 HydrophobicContact CB-CB 4.11Å; V377-P386 HydrophobicContact CG1-CB 3.84Å; V377-P386 HydrophobicContact CG1-CG 3.78Å
378	T	87	Confident	88.7	Confident	13 Å²	13	54.8 Å²	54.8	8%	0.08	34%	0.337	C	S	.	.	H	α-helix	trans	-61	-41.7	173.7	-76.5	0	0	0	0	111.9	F302 A374 M375 A376 F380 T381 G382 H383 P386 D387	F302-T378 HydrophobicContact CD2-CG2 4.27Å; F302-T378 HydrophobicContact CE2-CG2 3.75Å; F302-T378 HydrophobicContact CZ-CG2 4.42Å; A374-T378 PolarHBondContact O-N 3.42Å; A374-T378 PolarHBondContact O-OG1 2.88Å; M375-T378 PolarHBondContact O-N 3.3Å; A376-T378 VanDerWaalsContact C-N 3.35Å; A376-T378 PolarHBondContact O-N 3.3Å; T378-F380 VanDerWaalsContact C-N 3.34Å; T378-F380 PolarHBondContact O-N 3.35Å; T378-T381 PolarHBondContact O-N 3.28Å; T378-G382 WeakPolarHBondContact O-CA 3.33Å; T378-G382 PolarHBondContact O-N 3.46Å; T378-H383 WeakPolarHBondContact CB-O 3.21Å; T378-H383 VanDerWaalsContact CG2-O 3.32Å; T378-H383 WeakPolarHBondContact CG2-O 3.43Å; T378-H383 PolarHBondContact OG1-O 3.23Å; T378-P386 WeakPolarHBondContact OG1-CB 3.22Å; T378-P386 WeakPolarHBondContact OG1-CD 3.49Å; T378-D387 PolarHBondContact OG1-N 2.8Å
379	A	84.9	Confident	88.8	Confident	62 Å²	62	57.6 Å²	57.6	51%	0.512	35%	0.35	S	S	.	.	H	α-helix	trans	-64.3	-35.2	176.7	0	0	0	0	0	113	V305 M375 A376 V377	V305-A379 HydrophobicContact CG1-CB 4.42Å; M375-A379 WeakPolarHBondContact O-CB 3.45Å; M375-A379 PolarHBondContact O-N 3.05Å; A376-A379 PolarHBondContact O-N 3.3Å; V377-A379 VanDerWaalsContact C-N 3.34Å; V377-A379 PolarHBondContact O-N 2.87Å
380	F	88.3	Confident	88.8	Confident	188 Å²	188	53.8 Å²	53.8	83%	0.825	33%	0.328	S	S	*	.	H	α-helix	trans	-79.8	-36.2	176.9	-74.8	-65.7	0	0	0	113.8	A376 V377 T378	A376-F380 WeakPolarHBondContact O-CD2 3.37Å; A376-F380 PolarHBondContact O-N 2.87Å; V377-F380 PolarHBondContact O-N 2.91Å; T378-F380 VanDerWaalsContact C-N 3.34Å; T378-F380 PolarHBondContact O-N 3.35Å
381	T	87.8	Confident	88.7	Confident	69 Å²	69	52.8 Å²	52.8	42%	0.423	33%	0.325	S	S	.	.	H	α-helix	trans	-90.4	-22	-174.6	57.5	0	0	0	0	113.4	V377 T378 H383	V377-T381 HydrophobicContact CG1-CG2 3.98Å; V377-T381 WeakPolarHBondContact O-CB 3.49Å; V377-T381 WeakPolarHBondContact O-CG2 3.46Å; V377-T381 PolarHBondContact O-N 2.82Å; V377-T381 PolarHBondContact O-OG1 3.21Å; T378-T381 PolarHBondContact O-N 3.28Å; T381-H383 PolarHBondContact O-N 3.08Å; T381-H383 PolarHBondContact OG1-N 2.85Å
382	G	82.2	Confident	88.9	Confident	66 Å²	66	54.1 Å²	54.1	68%	0.68	33%	0.328	S	S	*	.			trans	71.7	-2.4	-171.7	0	0	0	0	0	114.1	T378	T378-G382 WeakPolarHBondContact O-CA 3.33Å; T378-G382 PolarHBondContact O-N 3.46Å
383	H	84.8	Confident	89.3	Confident	133 Å²	133	56 Å²	56	62%	0.616	34%	0.337	S	S	*	.			trans	-91.8	134.7	177.3	-64.1	-59.7	0	0	0	110.2	T378 T381 L385 P386	T378-H383 WeakPolarHBondContact CB-O 3.21Å; T378-H383 VanDerWaalsContact CG2-O 3.32Å; T378-H383 WeakPolarHBondContact CG2-O 3.43Å; T378-H383 PolarHBondContact OG1-O 3.23Å; T381-H383 PolarHBondContact O-N 3.08Å; T381-H383 PolarHBondContact OG1-N 2.85Å; H383-L385 VanDerWaalsContact C-N 3.31Å; H383-L385 PolarHBondContact O-N 2.67Å; H383-P386 WeakPolarHBondContact O-CD 3.45Å
384	V	84.5	Confident	89.5	Confident	53 Å²	53	53.9 Å²	53.9	32%	0.321	32%	0.322	S	S	.	.	S	Bend	trans	-76.3	-16.5	179.5	-61.9	0	0	0	0	114	P299 F302 P386 D387 A388	P299-V384 HydrophobicContact CB-CG2 3.79Å; P299-V384 HydrophobicContact CG-CG2 3.98Å; F302-V384 HydrophobicContact CE2-CG1 4.26Å; V384-P386 VanDerWaalsContact C-CD 3.48Å; V384-D387 PolarHBondContact O-N 3.38Å; V384-A388 PolarHBondContact O-N 2.97Å
385	L	88.8	Confident	89.7	Confident	93 Å²	93	53.9 Å²	53.9	49%	0.487	32%	0.321	S	S	.	.	H	α-helix	trans	-60.3	-40.7	-173.1	-172.5	66.8	0	0	0	114.3	H383 D387 A388 I389	H383-L385 VanDerWaalsContact C-N 3.31Å; H383-L385 PolarHBondContact O-N 2.67Å; L385-D387 PolarHBondContact O-N 3.33Å; L385-A388 PolarHBondContact O-N 3.32Å; L385-I389 HydrophobicContact CD1-CD1 4.38Å; L385-I389 HydrophobicContact CD2-CD1 4.38Å; L385-I389 HydrophobicContact CG-CD1 3.88Å; L385-I389 HydrophobicContact CG-CG1 4.41Å; L385-I389 WeakPolarHBondContact O-CG1 3.31Å; L385-I389 PolarHBondContact O-N 3.01Å
386	P	89.6	Confident	90.2	Very high	29 Å²	29	55.1 Å²	55.1	19%	0.188	34%	0.336	C	S	.	.	H	α-helix	trans	-57.1	-43.2	176.5	-23	33.6	0	0	0	113.3	A374 V377 T378 H383 V384 I389 G390	A374-P386 WeakPolarHBondContact CB-O 3.47Å; V377-P386 HydrophobicContact CB-CB 4.11Å; V377-P386 HydrophobicContact CG1-CB 3.84Å; V377-P386 HydrophobicContact CG1-CG 3.78Å; T378-P386 WeakPolarHBondContact OG1-CB 3.22Å; T378-P386 WeakPolarHBondContact OG1-CD 3.49Å; H383-P386 WeakPolarHBondContact O-CD 3.45Å; V384-P386 VanDerWaalsContact C-CD 3.48Å; P386-I389 PolarHBondContact O-N 2.91Å; P386-G390 PolarHBondContact O-N 3.46Å
387	D	87.9	Confident	90.7	Very high	44 Å²	44	55.1 Å²	55.1	24%	0.235	33%	0.33	C	S	.	.	H	α-helix	trans	-60.9	-46.5	178.1	-172.1	71.2	0	0	0	112.2	F302 T378 V384 L385 I389 G390 G391	F302-D387 HydrophobicContact CE2-CB 4.48Å; F302-D387 HydrophobicContact CZ-CB 3.72Å; F302-D387 VanDerWaalsContact CZ-CG 3.45Å; F302-D387 VanDerWaalsContact CZ-OD2 3.27Å; F302-D387 WeakPolarHBondContact CZ-OD2 3.42Å; T378-D387 PolarHBondContact OG1-N 2.8Å; V384-D387 PolarHBondContact O-N 3.38Å; L385-D387 PolarHBondContact O-N 3.33Å; D387-I389 PolarHBondContact O-N 3.48Å; D387-G390 CarbonylContact O-C 3.6Å; D387-G390 WeakPolarHBondContact O-CA 3.33Å; D387-G390 PolarHBondContact O-N 3.32Å; D387-G390 VanDerWaalsContact O-N 3.08Å; D387-G391 PolarHBondContact O-N 3.33Å
388	A	89.8	Confident	90.9	Very high	7 Å²	7	53.1 Å²	53.1	6%	0.058	32%	0.317	C	S	.	.	H	α-helix	trans	-64.4	-39.2	177.9	0	0	0	0	0	112.6	I296 V384 L385 G390 G391 I392	I296-A388 HydrophobicContact CD1-CB 4.32Å; I296-A388 HydrophobicContact CG1-CB 3.51Å; V384-A388 PolarHBondContact O-N 2.97Å; L385-A388 PolarHBondContact O-N 3.32Å; A388-G390 VanDerWaalsContact C-N 3.33Å; A388-G391 PolarHBondContact O-N 2.91Å; A388-I392 WeakPolarHBondContact O-CG1 3.5Å; A388-I392 PolarHBondContact O-N 2.71Å; A388-I392 VanDerWaalsContact O-N 3.12Å
389	I	92.6	Very high	91.4	Very high	84 Å²	84	53.8 Å²	53.8	43%	0.431	32%	0.324	S	S	.	.	H	α-helix	trans	-63.6	-41.5	171.9	-67.7	170.3	0	0	0	110.3	L385 P386 D387 G391 I392 C393	L385-I389 HydrophobicContact CD1-CD1 4.38Å; L385-I389 HydrophobicContact CD2-CD1 4.38Å; L385-I389 HydrophobicContact CG-CD1 3.88Å; L385-I389 HydrophobicContact CG-CG1 4.41Å; L385-I389 WeakPolarHBondContact O-CG1 3.31Å; L385-I389 PolarHBondContact O-N 3.01Å; P386-I389 PolarHBondContact O-N 2.91Å; D387-I389 PolarHBondContact O-N 3.48Å; I389-G391 VanDerWaalsContact C-N 3.32Å; I389-G391 PolarHBondContact O-N 3.27Å; I389-I392 PolarHBondContact O-N 3.15Å; I389-I392 VanDerWaalsContact O-N 3.16Å; I389-C393 PolarHBondContact O-N 2.92Å; I389-C393 PolarHBondContact O-SG 2.96Å; I389-C393 VanDerWaalsContact O-SG 3.42Å
390	G	93.3	Very high	92	Very high	4 Å²	4	54.9 Å²	54.9	4%	0.041	33%	0.328	C	S	.	.	H	α-helix	trans	-54.8	-47	174.4	0	0	0	0	0	111.9	P386 D387 A388 I392 C393 V394	P386-G390 PolarHBondContact O-N 3.46Å; D387-G390 CarbonylContact O-C 3.6Å; D387-G390 WeakPolarHBondContact O-CA 3.33Å; D387-G390 PolarHBondContact O-N 3.32Å; D387-G390 VanDerWaalsContact O-N 3.08Å; A388-G390 VanDerWaalsContact C-N 3.33Å; G390-I392 PolarHBondContact O-N 2.95Å; G390-C393 WeakPolarHBondContact O-CB 2.98Å; G390-C393 PolarHBondContact O-N 3.08Å; G390-V394 WeakPolarHBondContact O-CG2 3.09Å; G390-V394 PolarHBondContact O-N 3.38Å
391	G	93	Very high	92.4	Very high	15 Å²	15	47 Å²	47	16%	0.155	30%	0.295	C	S	.	.	H	α-helix	trans	-61.6	-39.8	175.4	0	0	0	0	0	113.8	T288 S292 D387 A388 I389 C393 V394 S395	T288-G391 WeakPolarHBondContact CG2-O 3.34Å; S292-G391 WeakPolarHBondContact OG-CA 3.39Å; S292-G391 PolarHBondContact OG-O 2.76Å; D387-G391 PolarHBondContact O-N 3.33Å; A388-G391 PolarHBondContact O-N 2.91Å; I389-G391 VanDerWaalsContact C-N 3.32Å; I389-G391 PolarHBondContact O-N 3.27Å; G391-C393 VanDerWaalsContact C-N 3.34Å; G391-C393 PolarHBondContact O-N 3.29Å; G391-V394 PolarHBondContact O-N 3.4Å; G391-S395 PolarHBondContact O-N 3.04Å
392	I	95.3	Very high	92.8	Very high	53 Å²	53	43.8 Å²	43.8	27%	0.272	28%	0.275	S	S	.	.	H	α-helix	trans	-62.4	-42.4	173.1	-66.9	172.1	0	0	0	110.8	F289 S292 I296 A388 I389 G390 S395 A396	F289-I392 HydrophobicContact CE2-CG2 4.4Å; S292-I392 PolarHBondContact OG-N 3.26Å; I296-I392 HydrophobicContact CD1-CD1 3.72Å; A388-I392 WeakPolarHBondContact O-CG1 3.5Å; A388-I392 PolarHBondContact O-N 2.71Å; A388-I392 VanDerWaalsContact O-N 3.12Å; I389-I392 PolarHBondContact O-N 3.15Å; I389-I392 VanDerWaalsContact O-N 3.16Å; G390-I392 PolarHBondContact O-N 2.95Å; I392-S395 WeakPolarHBondContact O-CB 3.46Å; I392-S395 PolarHBondContact O-N 3.42Å; I392-A396 PolarHBondContact O-N 3.11Å
393	C	96.7	Very high	93.5	Very high	55 Å²	55	42.1 Å²	42.1	37%	0.372	26%	0.258	S	S	.	.	H	α-helix	trans	-62.9	-43.4	175.7	-69.5	0	0	0	0	112	V370 I389 G390 G391 S395 A396 I397	V370-C393 HydrophobicContact CG1-CB 3.72Å; I389-C393 PolarHBondContact O-N 2.92Å; I389-C393 PolarHBondContact O-SG 2.96Å; I389-C393 VanDerWaalsContact O-SG 3.42Å; G390-C393 WeakPolarHBondContact O-CB 2.98Å; G390-C393 PolarHBondContact O-N 3.08Å; G391-C393 VanDerWaalsContact C-N 3.34Å; G391-C393 PolarHBondContact O-N 3.29Å; C393-S395 VanDerWaalsContact C-N 3.35Å; C393-S395 PolarHBondContact O-N 3.48Å; C393-A396 PolarHBondContact O-N 2.95Å; C393-I397 WeakPolarHBondContact O-CD1 3.46Å; C393-I397 WeakPolarHBondContact O-CG1 3.31Å; C393-I397 PolarHBondContact O-N 3.44Å
394	V	95.4	Very high	94	Very high	22 Å²	22	37.8 Å²	37.8	13%	0.133	24%	0.239	C	C	.	.	H	α-helix	trans	-59.6	-46	174.6	174.1	0	0	0	0	110.7	T288 G367 V370 A371 G390 G391 A396 I397 L398	T288-V394 HydrophobicContact CG2-CB 4.4Å; T288-V394 HydrophobicContact CG2-CG1 4.25Å; G367-V394 WeakPolarHBondContact O-CG2 3.32Å; V370-V394 HydrophobicContact CB-CG2 4.33Å; V370-V394 HydrophobicContact CG1-CG2 4.16Å; A371-V394 HydrophobicContact CB-CG2 4.2Å; G390-V394 WeakPolarHBondContact O-CG2 3.09Å; G390-V394 PolarHBondContact O-N 3.38Å; G391-V394 PolarHBondContact O-N 3.4Å; V394-A396 VanDerWaalsContact C-N 3.32Å; V394-A396 PolarHBondContact O-N 3.42Å; V394-I397 WeakPolarHBondContact O-CB 3.33Å; V394-I397 PolarHBondContact O-N 2.98Å; V394-L398 HydrophobicContact CG1-CD1 4.18Å; V394-L398 HydrophobicContact CG1-CG 4.43Å; V394-L398 WeakPolarHBondContact O-CG 2.96Å; V394-L398 PolarHBondContact O-N 3.34Å
395	S	96.4	Very high	94.5	Very high	9 Å²	9	35.3 Å²	35.3	6%	0.063	22%	0.224	C	C	.	.	H	α-helix	trans	-57.2	-44.5	174.7	167.6	0	0	0	0	112.2	A285 F289 G391 I392 C393 I397 L398 A399	A285-S395 WeakPolarHBondContact CB-O 3.43Å; A285-S395 PolarHBondContact O-OG 2.89Å; A285-S395 VanDerWaalsContact O-OG 3.07Å; F289-S395 WeakPolarHBondContact CB-OG 3.31Å; G391-S395 PolarHBondContact O-N 3.04Å; I392-S395 WeakPolarHBondContact O-CB 3.46Å; I392-S395 PolarHBondContact O-N 3.42Å; C393-S395 VanDerWaalsContact C-N 3.35Å; C393-S395 PolarHBondContact O-N 3.48Å; S395-I397 VanDerWaalsContact C-N 3.32Å; S395-I397 PolarHBondContact O-N 3.5Å; S395-L398 PolarHBondContact O-N 2.93Å; S395-A399 WeakPolarHBondContact O-CB 3.36Å; S395-A399 PolarHBondContact O-N 3.2Å
396	A	97.6	Very high	94.8	Very high	52 Å²	52	33 Å²	33	43%	0.43	21%	0.212	S	C	.	.	H	α-helix	trans	-63.4	-37.3	178.1	0	0	0	0	0	112.5	I392 C393 V394 S400	I392-A396 PolarHBondContact O-N 3.11Å; C393-A396 PolarHBondContact O-N 2.95Å; V394-A396 VanDerWaalsContact C-N 3.32Å; V394-A396 PolarHBondContact O-N 3.42Å; A396-S400 WeakPolarHBondContact O-CB 3.48Å; A396-S400 PolarHBondContact O-N 2.87Å; A396-S400 PolarHBondContact O-OG 2.95Å
397	I	97.2	Very high	95.1	Very high	37 Å²	37	37 Å²	37	19%	0.19	23%	0.228	C	C	.	.	H	α-helix	trans	-63.3	-51.3	174.1	-68	158.2	0	0	0	110.2	A363 I366 V370 C393 V394 S395 A399 S400 V401	A363-I397 HydrophobicContact CB-CG2 4.16Å; I366-I397 HydrophobicContact CG2-CD1 3.73Å; V370-I397 HydrophobicContact CG2-CD1 3.99Å; C393-I397 WeakPolarHBondContact O-CD1 3.46Å; C393-I397 WeakPolarHBondContact O-CG1 3.31Å; C393-I397 PolarHBondContact O-N 3.44Å; V394-I397 WeakPolarHBondContact O-CB 3.33Å; V394-I397 PolarHBondContact O-N 2.98Å; S395-I397 VanDerWaalsContact C-N 3.32Å; S395-I397 PolarHBondContact O-N 3.5Å; I397-A399 PolarHBondContact O-N 2.87Å; I397-S400 PolarHBondContact O-N 3.04Å; I397-V401 WeakPolarHBondContact O-CG2 3.37Å; I397-V401 PolarHBondContact O-N 3.41Å
398	L	96.2	Very high	95.3	Very high	28 Å²	28	35.4 Å²	35.4	15%	0.147	22%	0.22	C	C	.	.	H	α-helix	trans	-59.6	-45.1	178.7	-70.1	176.3	0	0	0	111.7	I280 A285 A363 V394 S395 S400 V401 A402	I280-L398 HydrophobicContact CG2-CD2 4.28Å; A285-L398 HydrophobicContact CB-CB 3.81Å; A363-L398 HydrophobicContact CB-CD2 4.09Å; V394-L398 HydrophobicContact CG1-CD1 4.18Å; V394-L398 HydrophobicContact CG1-CG 4.43Å; V394-L398 WeakPolarHBondContact O-CG 2.96Å; V394-L398 PolarHBondContact O-N 3.34Å; S395-L398 PolarHBondContact O-N 2.93Å; L398-S400 VanDerWaalsContact C-N 3.35Å; L398-S400 PolarHBondContact O-N 3.31Å; L398-V401 PolarHBondContact O-N 3.04Å; L398-A402 WeakPolarHBondContact O-CB 3.24Å; L398-A402 PolarHBondContact O-N 3.46Å
399	A	97.5	Very high	95.4	Very high	27 Å²	27	35.4 Å²	35.4	22%	0.223	22%	0.219	C	C	.	.	H	α-helix	trans	-62.1	-41.7	177.8	0	0	0	0	0	112	F281 A285 S395 I397 G403	F281-A399 HydrophobicContact CD2-CB 4.31Å; F281-A399 HydrophobicContact CE2-CB 4.03Å; A285-A399 HydrophobicContact CB-CB 3.87Å; S395-A399 WeakPolarHBondContact O-CB 3.36Å; S395-A399 PolarHBondContact O-N 3.2Å; I397-A399 PolarHBondContact O-N 2.87Å; A399-G403 PolarHBondContact O-N 3.25Å
400	S	97.4	Very high	95.5	Very high	85 Å²	85	33.7 Å²	33.7	59%	0.594	21%	0.213	S	C	*	.	H	α-helix	trans	-65.6	-45	178.7	-60.5	0	0	0	0	111.8	A396 I397 L398 G403 L404	A396-S400 WeakPolarHBondContact O-CB 3.48Å; A396-S400 PolarHBondContact O-N 2.87Å; A396-S400 PolarHBondContact O-OG 2.95Å; I397-S400 PolarHBondContact O-N 3.04Å; L398-S400 VanDerWaalsContact C-N 3.35Å; L398-S400 PolarHBondContact O-N 3.31Å; S400-G403 PolarHBondContact O-N 2.92Å; S400-L404 PolarHBondContact O-N 2.84Å
401	V	95.9	Very high	95.4	Very high	23 Å²	23	36.9 Å²	36.9	14%	0.139	23%	0.226	C	C	.	.	H	α-helix	trans	-67.3	-45.9	178.5	167.2	0	0	0	0	111.2	L359 A363 I397 L398 G403 L404 I405	L359-V401 HydrophobicContact CB-CG1 3.84Å; A363-V401 HydrophobicContact CB-CB 4.2Å; A363-V401 HydrophobicContact CB-CG1 4.17Å; A363-V401 HydrophobicContact CB-CG2 3.96Å; I397-V401 WeakPolarHBondContact O-CG2 3.37Å; I397-V401 PolarHBondContact O-N 3.41Å; L398-V401 PolarHBondContact O-N 3.04Å; V401-G403 VanDerWaalsContact C-N 3.33Å; V401-G403 PolarHBondContact O-N 3.44Å; V401-L404 PolarHBondContact O-N 3.43Å; V401-I405 HydrophobicContact CG1-CD1 3.77Å; V401-I405 WeakPolarHBondContact O-CG1 3.46Å; V401-I405 PolarHBondContact O-N 2.83Å
402	A	96.3	Very high	95.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.5	-42.2	175.6	0	0	0	0	0	111.8	G277 I280 F281 L398 L404 I405 I406	G277-A402 WeakPolarHBondContact O-CB 3.15Å; I280-A402 HydrophobicContact CB-CB 4.27Å; I280-A402 HydrophobicContact CG2-CB 4.01Å; F281-A402 HydrophobicContact CB-CB 3.83Å; F281-A402 HydrophobicContact CD2-CB 4.16Å; L398-A402 WeakPolarHBondContact O-CB 3.24Å; L398-A402 PolarHBondContact O-N 3.46Å; A402-L404 VanDerWaalsContact C-N 3.34Å; A402-L404 PolarHBondContact O-N 3.44Å; A402-I405 PolarHBondContact O-N 2.73Å; A402-I406 WeakPolarHBondContact O-CB 3.4Å; A402-I406 WeakPolarHBondContact O-CD1 3.46Å; A402-I406 WeakPolarHBondContact O-CG1 3.49Å; A402-I406 PolarHBondContact O-N 3.45Å
403	G	96.8	Very high	94.9	Very high	32 Å²	32	37.3 Å²	37.3	33%	0.33	23%	0.225	S	C	.	.	H	α-helix	trans	-59.7	-41.7	174.5	0	0	0	0	0	112.8	A399 S400 V401 I406 H407	A399-G403 PolarHBondContact O-N 3.25Å; S400-G403 PolarHBondContact O-N 2.92Å; V401-G403 VanDerWaalsContact C-N 3.33Å; V401-G403 PolarHBondContact O-N 3.44Å; G403-I406 PolarHBondContact O-N 3.2Å; G403-H407 WeakPolarHBondContact O-CB 3.36Å; G403-H407 PolarHBondContact O-N 3.46Å
404	L	95.2	Very high	94.6	Very high	42 Å²	42	40.8 Å²	40.8	22%	0.22	24%	0.238	C	C	.	.	H	α-helix	trans	-65.1	-42.6	175.1	-174.5	151.6	0	0	0	112	F347 L359 S400 V401 A402 T408	F347-L404 HydrophobicContact CD1-CD1 4.2Å; F347-L404 HydrophobicContact CD1-CG 4.5Å; F347-L404 HydrophobicContact CE1-CD1 3.28Å; F347-L404 HydrophobicContact CE1-CG 3.94Å; F347-L404 HydrophobicContact CZ-CD1 3.46Å; F347-L404 VanDerWaalsContact CZ-CD1 3.46Å; L359-L404 HydrophobicContact CD1-CD2 3.38Å; L359-L404 HydrophobicContact CD2-CD2 4.08Å; L359-L404 HydrophobicContact CG-CD2 4.4Å; S400-L404 PolarHBondContact O-N 2.84Å; V401-L404 PolarHBondContact O-N 3.43Å; A402-L404 VanDerWaalsContact C-N 3.34Å; A402-L404 PolarHBondContact O-N 3.44Å; L404-T408 HydrophobicContact CD2-CG2 4.26Å; L404-T408 WeakPolarHBondContact O-CB 3.21Å; L404-T408 VanDerWaalsContact O-CG2 3.31Å; L404-T408 WeakPolarHBondContact O-CG2 3.42Å; L404-T408 PolarHBondContact O-N 2.87Å; L404-T408 PolarHBondContact O-OG1 3.04Å
405	I	94.8	Very high	94.2	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-61.6	-48.6	175	-67.1	159.4	0	0	0	109.9	S273 M356 L359 V401 A402 H407 T408 N409	S273-I405 WeakPolarHBondContact O-CG2 3.33Å; M356-I405 HydrophobicContact SD-CD1 3.5Å; M356-I405 VanDerWaalsContact SD-CD1 3.5Å; M356-I405 HydrophobicContact SD-CG1 4.31Å; M356-I405 HydrophobicContact SD-CG2 4.36Å; L359-I405 HydrophobicContact CB-CD1 4.12Å; L359-I405 HydrophobicContact CB-CG1 4.27Å; L359-I405 HydrophobicContact CD1-CD1 4.44Å; L359-I405 HydrophobicContact CD1-CG1 3.68Å; V401-I405 HydrophobicContact CG1-CD1 3.77Å; V401-I405 WeakPolarHBondContact O-CG1 3.46Å; V401-I405 PolarHBondContact O-N 2.83Å; A402-I405 PolarHBondContact O-N 2.73Å; I405-H407 PolarHBondContact O-N 3.2Å; I405-T408 PolarHBondContact O-OG1 2.89Å; I405-T408 VanDerWaalsContact O-OG1 3.11Å; I405-N409 WeakPolarHBondContact CG2-ND2 3.46Å; I405-N409 WeakPolarHBondContact O-CB 3.33Å; I405-N409 PolarHBondContact O-N 3.39Å; I405-N409 PolarHBondContact O-ND2 3.35Å
406	I	96	Very high	93.7	Very high	45 Å²	45	45.2 Å²	45.2	23%	0.231	26%	0.259	C	S	.	.	H	α-helix	trans	-59.8	-48.8	179.8	-70.5	164.3	0	0	0	110.5	L274 V278 F281 A402 G403 T410	L274-I406 HydrophobicContact CD1-CB 4.14Å; L274-I406 HydrophobicContact CD1-CG1 4.16Å; L274-I406 HydrophobicContact CD1-CG2 3.88Å; V278-I406 HydrophobicContact CG2-CD1 4.07Å; V278-I406 HydrophobicContact CG2-CG1 4.17Å; F281-I406 HydrophobicContact CB-CD1 4.33Å; A402-I406 WeakPolarHBondContact O-CB 3.4Å; A402-I406 WeakPolarHBondContact O-CD1 3.46Å; A402-I406 WeakPolarHBondContact O-CG1 3.49Å; A402-I406 PolarHBondContact O-N 3.45Å; G403-I406 PolarHBondContact O-N 3.2Å; I406-T410 VanDerWaalsContact O-CB 3.24Å; I406-T410 WeakPolarHBondContact O-CB 3.48Å; I406-T410 PolarHBondContact O-N 3.43Å; I406-T410 PolarHBondContact O-OG1 3.25Å
407	H	95	Very high	93.2	Very high	112 Å²	112	45.6 Å²	45.6	52%	0.519	26%	0.262	S	S	.	.	H	α-helix	trans	-62.2	-52.3	-179.2	179.3	57	0	0	0	111.8	G403 I405 N409 T410 E411	G403-H407 WeakPolarHBondContact O-CB 3.36Å; G403-H407 PolarHBondContact O-N 3.46Å; I405-H407 PolarHBondContact O-N 3.2Å; H407-N409 VanDerWaalsContact C-N 3.34Å; H407-N409 PolarHBondContact O-N 2.82Å; H407-T410 PolarHBondContact O-N 2.94Å; H407-E411 IonicContact CE1-OE1 3.81Å; H407-E411 WeakPolarHBondContact O-CG 3.42Å; H407-E411 PolarHBondContact O-N 2.87Å
408	T	92.3	Very high	92.6	Very high	11 Å²	11	44.1 Å²	44.1	7%	0.067	26%	0.255	C	S	.	.	H	α-helix	trans	-61	-39.6	-178.4	51.3	0	0	0	0	113.1	L404 I405 M412	L404-T408 HydrophobicContact CD2-CG2 4.26Å; L404-T408 WeakPolarHBondContact O-CB 3.21Å; L404-T408 VanDerWaalsContact O-CG2 3.31Å; L404-T408 WeakPolarHBondContact O-CG2 3.42Å; L404-T408 PolarHBondContact O-N 2.87Å; L404-T408 PolarHBondContact O-OG1 3.04Å; I405-T408 PolarHBondContact O-OG1 2.89Å; I405-T408 VanDerWaalsContact O-OG1 3.11Å; T408-M412 PolarHBondContact O-N 3.44Å
409	N	93.1	Very high	91.8	Very high	6 Å²	6	45.3 Å²	45.3	3%	0.032	26%	0.264	C	S	.	.	H	α-helix	trans	-74.2	-33.2	177.6	-74.3	-82.6	0	0	0	112.5	N270 S273 L274 P352 I405 H407 M412 L413	N270-N409 WeakPolarHBondContact CA-OD1 3.34Å; S273-N409 VanDerWaalsContact CB-OD1 3.28Å; S273-N409 WeakPolarHBondContact CB-OD1 3.33Å; L274-N409 HydrophobicContact CB-CB 4.12Å; P352-N409 WeakPolarHBondContact CB-OD1 3.47Å; I405-N409 WeakPolarHBondContact CG2-ND2 3.46Å; I405-N409 WeakPolarHBondContact O-CB 3.33Å; I405-N409 PolarHBondContact O-N 3.39Å; I405-N409 PolarHBondContact O-ND2 3.35Å; H407-N409 VanDerWaalsContact C-N 3.34Å; H407-N409 PolarHBondContact O-N 2.82Å; N409-M412 PolarHBondContact O-N 2.88Å; N409-L413 VanDerWaalsContact O-CG 3.31Å; N409-L413 WeakPolarHBondContact O-CG 3.28Å; N409-L413 PolarHBondContact O-N 2.83Å
410	T	93.8	Very high	91.3	Very high	49 Å²	49	48.4 Å²	48.4	30%	0.301	28%	0.28	S	S	.	.	H	α-helix	trans	-66.6	-46.4	175.7	-59.8	0	0	0	0	111	I406 H407 M412 L413 I414	I406-T410 VanDerWaalsContact O-CB 3.24Å; I406-T410 WeakPolarHBondContact O-CB 3.48Å; I406-T410 PolarHBondContact O-N 3.43Å; I406-T410 PolarHBondContact O-OG1 3.25Å; H407-T410 PolarHBondContact O-N 2.94Å; T410-M412 PolarHBondContact O-N 3.11Å; T410-L413 PolarHBondContact O-N 2.92Å; T410-L413 VanDerWaalsContact O-N 3.09Å; T410-I414 HydrophobicContact CG2-CD1 3.88Å; T410-I414 HydrophobicContact CG2-CG1 4.45Å; T410-I414 VanDerWaalsContact O-CG1 3.32Å; T410-I414 WeakPolarHBondContact O-CG1 3.35Å; T410-I414 PolarHBondContact O-N 3.47Å
411	E	91.2	Very high	90.6	Very high	71 Å²	71	50.5 Å²	50.5	33%	0.332	28%	0.281	S	S	.	.	H	α-helix	trans	-57	-39.6	174.7	-71.2	-61.4	128	0	0	112	H407 I414 G415 R416	H407-E411 IonicContact CE1-OE1 3.81Å; H407-E411 WeakPolarHBondContact O-CG 3.42Å; H407-E411 PolarHBondContact O-N 2.87Å; E411-I414 PolarHBondContact O-N 3.14Å; E411-G415 PolarHBondContact O-N 3.47Å; E411-R416 PolarHBondContact O-N 3.21Å
412	M	88.3	Confident	89.9	Confident	8 Å²	8	52.4 Å²	52.4	4%	0.039	29%	0.29	C	S	.	.	H	α-helix	trans	-68.5	-38	177.2	-163.4	64.1	166.9	0	0	112.4	N270 T408 N409 T410 G415 M446 G448	N270-M412 VanDerWaalsContact ND2-CG 3.31Å; N270-M412 WeakPolarHBondContact ND2-CG 3.49Å; N270-M412 WeakPolarHBondContact OD1-CG 3.35Å; T408-M412 PolarHBondContact O-N 3.44Å; N409-M412 PolarHBondContact O-N 2.88Å; T410-M412 PolarHBondContact O-N 3.11Å; M412-G415 PolarHBondContact O-N 3.38Å; M412-M446 HydrophobicContact CE-CB 3.39Å; M412-M446 HydrophobicContact CE-CE 4.36Å; M412-M446 HydrophobicContact CE-CG 4.42Å; M412-M446 HydrophobicContact SD-CB 3.68Å; M412-G448 VanDerWaalsContact CE-CA 3.42Å
413	L	89.9	Confident	89.4	Confident	69 Å²	69	54.8 Å²	54.8	36%	0.361	30%	0.301	S	S	.	.	H	α-helix	trans	-70.1	-31.2	176.3	-74.5	167.7	0	0	0	113	P267 N270 V271 L274 N409 T410 G415	P267-L413 HydrophobicContact CB-CD2 4.16Å; N270-L413 HydrophobicContact CB-CD1 4.32Å; N270-L413 HydrophobicContact CB-CD2 3.88Å; N270-L413 HydrophobicContact CB-CG 3.8Å; V271-L413 HydrophobicContact CG2-CD1 4.42Å; V271-L413 HydrophobicContact CG2-CD2 3.83Å; L274-L413 HydrophobicContact CD2-CD1 3.76Å; N409-L413 VanDerWaalsContact O-CG 3.31Å; N409-L413 WeakPolarHBondContact O-CG 3.28Å; N409-L413 PolarHBondContact O-N 2.83Å; T410-L413 PolarHBondContact O-N 2.92Å; T410-L413 VanDerWaalsContact O-N 3.09Å; L413-G415 PolarHBondContact O-N 2.98Å
414	I	90.7	Very high	88.9	Confident	127 Å²	127	57 Å²	57	65%	0.651	30%	0.303	S	S	*	.	H	α-helix	trans	-68.9	-25.9	173.6	-67.5	166.4	0	0	0	111	T410 E411	T410-I414 HydrophobicContact CG2-CD1 3.88Å; T410-I414 HydrophobicContact CG2-CG1 4.45Å; T410-I414 VanDerWaalsContact O-CG1 3.32Å; T410-I414 WeakPolarHBondContact O-CG1 3.35Å; T410-I414 PolarHBondContact O-N 3.47Å; E411-I414 PolarHBondContact O-N 3.14Å
415	G	86.2	Confident	88.4	Confident	25 Å²	25	56.2 Å²	56.2	26%	0.258	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.7	61.6	177.4	0	0	0	0	0	112.4	E411 M412 L413 T445	E411-G415 PolarHBondContact O-N 3.47Å; M412-G415 PolarHBondContact O-N 3.38Å; L413-G415 PolarHBondContact O-N 2.98Å; G415-T445 WeakPolarHBondContact O-CG2 3.49Å
416	R	86.2	Confident	87.9	Confident	99 Å²	99	56.2 Å²	56.2	37%	0.374	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-52.5	137.3	176.4	-170.3	176.2	-177	167	4.2	112.4	F347 S348 E411 T445 M446	F347-R416 PolarHBondContact O-NH1 2.9Å; S348-R416 PolarHBondContact O-NH1 3.43Å; E411-R416 PolarHBondContact O-N 3.21Å; R416-T445 CarbonylContact O-C 3.59Å; R416-T445 WeakPolarHBondContact O-CA 3.34Å; R416-M446 PolarHBondContact O-N 3.43Å
417	A	86.7	Confident	87.4	Confident	60 Å²	60	56.8 Å²	56.8	50%	0.496	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-64.4	154.2	174.6	0	0	0	0	0	112.2	T444	A417-T444 WeakPolarHBondContact CA-O 3.48Å
418	I	84	Confident	87.1	Confident	7 Å²	7	58 Å²	58	4%	0.036	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-70.9	157	174.3	74.8	-174.9	0	0	0	110.2	V420 N422 Q423 I426 T444 M446 I452	I418-V420 PolarHBondContact O-N 3.44Å; I418-N422 HydrophobicContact CD1-CB 4.14Å; I418-N422 HydrophobicContact CG1-CB 4.35Å; I418-Q423 HydrophobicContact CD1-CB 3.95Å; I418-Q423 HydrophobicContact CG1-CB 3.92Å; I418-I426 HydrophobicContact CD1-CD1 3.94Å; I418-T444 HydrophobicContact CD1-CG2 3.81Å; I418-T444 HydrophobicContact CG1-CG2 4.25Å; I418-T444 WeakPolarHBondContact CG1-OG1 3.3Å; I418-M446 HydrophobicContact CB-SD 4.36Å; I418-M446 HydrophobicContact CG2-CG 4.13Å; I418-M446 HydrophobicContact CG2-SD 3.72Å; I418-I452 HydrophobicContact CD1-CG2 4.47Å; I418-I452 HydrophobicContact CG2-CB 4.33Å; I418-I452 HydrophobicContact CG2-CD1 4.05Å; I418-I452 HydrophobicContact CG2-CG1 3.88Å; I418-I452 HydrophobicContact CG2-CG2 3.56Å
419	P	81.2	Confident	86.8	Confident	53 Å²	53	58.3 Å²	58.3	34%	0.344	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-52.6	140.9	173	-26	34.7	0	0	0	111.9	E421 N422 Q423	P419-E421 WeakPolarHBondContact CB-OE2 3.44Å; P419-E421 PolarHBondContact O-N 3.21Å; P419-N422 WeakPolarHBondContact O-CB 3.38Å; P419-N422 PolarHBondContact O-N 3.09Å; P419-Q423 PolarHBondContact O-N 3.29Å; P419-Q423 VanDerWaalsContact O-N 3.1Å
420	V	85.4	Confident	86.4	Confident	91 Å²	91	58 Å²	58	55%	0.552	31%	0.305	S	S	*	.	H	α-helix	trans	-57.1	-36.9	-173.8	179.6	0	0	0	0	111	I418 N422 Q423 E424	I418-V420 PolarHBondContact O-N 3.44Å; V420-N422 VanDerWaalsContact C-N 3.31Å; V420-N422 PolarHBondContact O-N 2.92Å; V420-Q423 PolarHBondContact O-N 3.46Å; V420-E424 HydrophobicContact CG1-CG 4.26Å; V420-E424 WeakPolarHBondContact O-CB 3.46Å; V420-E424 WeakPolarHBondContact O-CG 3.44Å; V420-E424 PolarHBondContact O-N 3.44Å
421	E	83.5	Confident	86.1	Confident	130 Å²	130	60.1 Å²	60.1	61%	0.607	31%	0.314	S	S	*	.	H	α-helix	trans	-62.8	-37.6	179.3	-55.6	75.9	-166.1	0	0	112.1	P419 A425	P419-E421 WeakPolarHBondContact CB-OE2 3.44Å; P419-E421 PolarHBondContact O-N 3.21Å; E421-A425 WeakPolarHBondContact O-CB 3.34Å; E421-A425 PolarHBondContact O-N 3.5Å
422	N	80.8	Confident	85.9	Confident	63 Å²	63	63.2 Å²	63.2	34%	0.337	33%	0.333	S	S	.	.	H	α-helix	trans	-73.9	-38.1	176.8	-71.3	-15.3	0	0	0	111	I418 P419 V420 A425 I426	I418-N422 HydrophobicContact CD1-CB 4.14Å; I418-N422 HydrophobicContact CG1-CB 4.35Å; P419-N422 WeakPolarHBondContact O-CB 3.38Å; P419-N422 PolarHBondContact O-N 3.09Å; V420-N422 VanDerWaalsContact C-N 3.31Å; V420-N422 PolarHBondContact O-N 2.92Å; N422-A425 PolarHBondContact O-N 2.98Å; N422-I426 WeakPolarHBondContact O-CG1 3.32Å; N422-I426 PolarHBondContact O-N 2.9Å; N422-I426 VanDerWaalsContact O-N 3.11Å
423	Q	85.3	Confident	85.9	Confident	49 Å²	49	63.6 Å²	63.6	23%	0.229	34%	0.335	C	S	.	.	H	α-helix	trans	-63.5	-46.4	174.6	-178.4	169.8	-42	0	0	111.3	I418 P419 V420 A425 I426 M427 T444	I418-Q423 HydrophobicContact CD1-CB 3.95Å; I418-Q423 HydrophobicContact CG1-CB 3.92Å; P419-Q423 PolarHBondContact O-N 3.29Å; P419-Q423 VanDerWaalsContact O-N 3.1Å; V420-Q423 PolarHBondContact O-N 3.46Å; Q423-A425 VanDerWaalsContact C-N 3.3Å; Q423-A425 PolarHBondContact O-N 3.18Å; Q423-I426 PolarHBondContact O-N 3.36Å; Q423-M427 HydrophobicContact CG-SD 4.13Å; Q423-M427 WeakPolarHBondContact O-CG 3.47Å; Q423-M427 PolarHBondContact O-N 2.8Å; Q423-T444 HydrophobicContact CG-CG2 4.18Å; Q423-T444 PolarHBondContact OE1-OG1 2.85Å
424	E	87.7	Confident	85.9	Confident	80 Å²	80	67.9 Å²	67.9	37%	0.374	35%	0.351	S	S	.	.	H	α-helix	trans	-61	-38.9	174.6	-74.1	-177.8	-168.1	0	0	112	V420 I426 M427 R428	V420-E424 HydrophobicContact CG1-CG 4.26Å; V420-E424 WeakPolarHBondContact O-CB 3.46Å; V420-E424 WeakPolarHBondContact O-CG 3.44Å; V420-E424 PolarHBondContact O-N 3.44Å; E424-I426 VanDerWaalsContact C-N 3.31Å; E424-I426 PolarHBondContact O-N 3.48Å; E424-M427 PolarHBondContact O-N 3.1Å; E424-R428 WeakPolarHBondContact O-CB 3.11Å; E424-R428 VanDerWaalsContact O-CG 3.24Å; E424-R428 WeakPolarHBondContact O-CG 3.47Å; E424-R428 PolarHBondContact O-N 2.78Å; E424-R428 IonicContact OE2-CZ 2.73Å; E424-R428 IonicContact OE2-NH2 3.79Å; E424-R428 PolarHBondContact OE2-NH2 2.95Å
425	A	84.7	Confident	85.7	Confident	25 Å²	25	61.9 Å²	61.9	21%	0.207	32%	0.32	C	S	.	.	H	α-helix	trans	-61	-40.2	175.9	0	0	0	0	0	112	E421 N422 Q423 V429	E421-A425 WeakPolarHBondContact O-CB 3.34Å; E421-A425 PolarHBondContact O-N 3.5Å; N422-A425 PolarHBondContact O-N 2.98Å; Q423-A425 VanDerWaalsContact C-N 3.3Å; Q423-A425 PolarHBondContact O-N 3.18Å; A425-V429 WeakPolarHBondContact O-CG2 3.29Å; A425-V429 PolarHBondContact O-N 3.41Å
426	I	83.4	Confident	85.8	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-68.1	-45.6	175	-64.6	167.2	0	0	0	110.6	I418 N422 Q423 E424 R428 V429 M430 F454 I517 I524	I418-I426 HydrophobicContact CD1-CD1 3.94Å; N422-I426 WeakPolarHBondContact O-CG1 3.32Å; N422-I426 PolarHBondContact O-N 2.9Å; N422-I426 VanDerWaalsContact O-N 3.11Å; Q423-I426 PolarHBondContact O-N 3.36Å; E424-I426 VanDerWaalsContact C-N 3.31Å; E424-I426 PolarHBondContact O-N 3.48Å; I426-R428 PolarHBondContact O-N 3.25Å; I426-V429 WeakPolarHBondContact O-CB 3.44Å; I426-V429 PolarHBondContact O-N 3.31Å; I426-M430 HydrophobicContact CG2-SD 4.37Å; I426-M430 PolarHBondContact O-N 2.81Å; I426-F454 HydrophobicContact CB-CE2 4.15Å; I426-F454 HydrophobicContact CD1-CD2 3.91Å; I426-F454 HydrophobicContact CD1-CE2 4.36Å; I426-F454 HydrophobicContact CG2-CD2 3.81Å; I426-F454 HydrophobicContact CG2-CE1 4.35Å; I426-F454 HydrophobicContact CG2-CE2 3.38Å; I426-F454 HydrophobicContact CG2-CG 4.48Å; I426-F454 HydrophobicContact CG2-CZ 3.68Å; I426-I517 HydrophobicContact CG1-CG2 4.18Å; I426-I517 HydrophobicContact CG2-CD1 4.41Å; I426-I517 HydrophobicContact CG2-CG2 4.1Å; I426-I524 HydrophobicContact CD1-CD1 3.94Å
427	M	86.9	Confident	85.9	Confident	56 Å²	56	61.1 Å²	61.1	28%	0.276	31%	0.311	S	S	.	.	H	α-helix	trans	-57.2	-47.2	177.4	-76	171	42.8	0	0	111.8	Q423 E424 V429 M430 D431 I442	Q423-M427 HydrophobicContact CG-SD 4.13Å; Q423-M427 WeakPolarHBondContact O-CG 3.47Å; Q423-M427 PolarHBondContact O-N 2.8Å; E424-M427 PolarHBondContact O-N 3.1Å; M427-V429 PolarHBondContact O-N 2.96Å; M427-V429 VanDerWaalsContact O-N 3.17Å; M427-M430 CarbonylContact O-C 3.6Å; M427-M430 WeakPolarHBondContact O-CA 3.44Å; M427-M430 PolarHBondContact O-N 2.87Å; M427-D431 PolarHBondContact O-N 2.91Å; M427-I442 HydrophobicContact CG-CD1 3.64Å; M427-I442 HydrophobicContact SD-CD1 3.87Å
428	R	88.2	Confident	85.9	Confident	138 Å²	138	58.8 Å²	58.8	52%	0.521	29%	0.292	S	S	.	.	H	α-helix	trans	-57.6	-33.6	175.9	-70.7	173.6	-153.3	150.7	6.5	112.3	E424 I426 N432	E424-R428 WeakPolarHBondContact O-CB 3.11Å; E424-R428 VanDerWaalsContact O-CG 3.24Å; E424-R428 WeakPolarHBondContact O-CG 3.47Å; E424-R428 PolarHBondContact O-N 2.78Å; E424-R428 IonicContact OE2-CZ 2.73Å; E424-R428 IonicContact OE2-NH2 3.79Å; E424-R428 PolarHBondContact OE2-NH2 2.95Å; I426-R428 PolarHBondContact O-N 3.25Å; R428-N432 WeakPolarHBondContact O-CB 3.34Å; R428-N432 VanDerWaalsContact O-CG 3.29Å; R428-N432 PolarHBondContact O-N 3.2Å; R428-N432 PolarHBondContact O-ND2 3.46Å
429	V	85.2	Confident	85.9	Confident	17 Å²	17	59.7 Å²	59.7	10%	0.103	30%	0.298	C	S	.	.	H	α-helix	trans	-71	-42.2	175.4	174.7	0	0	0	0	110.6	A425 I426 M427 I433 I517	A425-V429 WeakPolarHBondContact O-CG2 3.29Å; A425-V429 PolarHBondContact O-N 3.41Å; I426-V429 WeakPolarHBondContact O-CB 3.44Å; I426-V429 PolarHBondContact O-N 3.31Å; M427-V429 PolarHBondContact O-N 2.96Å; M427-V429 VanDerWaalsContact O-N 3.17Å; V429-I433 WeakPolarHBondContact O-CD1 3.4Å; V429-I433 WeakPolarHBondContact O-CG1 3.43Å; V429-I517 HydrophobicContact CB-CG1 4.45Å; V429-I517 HydrophobicContact CG1-CG1 3.79Å
430	M	84.8	Confident	86.2	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.6	-46.7	178.3	-66.9	-172.6	72.6	0	0	112.3	I426 M427 N432 I433 I436 T439 F454 A456 V458 I517	I426-M430 HydrophobicContact CG2-SD 4.37Å; I426-M430 PolarHBondContact O-N 2.81Å; M427-M430 CarbonylContact O-C 3.6Å; M427-M430 WeakPolarHBondContact O-CA 3.44Å; M427-M430 PolarHBondContact O-N 2.87Å; M430-N432 PolarHBondContact O-N 3.4Å; M430-I433 WeakPolarHBondContact O-CB 3.46Å; M430-I433 PolarHBondContact O-N 3.07Å; M430-I436 HydrophobicContact CB-CD1 4.24Å; M430-I436 HydrophobicContact CE-CD1 4.21Å; M430-T439 HydrophobicContact CB-CG2 3.97Å; M430-T439 HydrophobicContact CE-CG2 3.55Å; M430-T439 HydrophobicContact SD-CG2 4.22Å; M430-F454 HydrophobicContact CE-CE1 4.4Å; M430-F454 HydrophobicContact SD-CE1 3.6Å; M430-F454 VanDerWaalsContact SD-CE1 3.6Å; M430-F454 HydrophobicContact SD-CZ 3.49Å; M430-F454 WeakPolarHBondContact SD-CZ 3.48Å; M430-A456 HydrophobicContact CE-CB 4.24Å; M430-V458 HydrophobicContact CE-CG2 3.45Å; M430-V458 VanDerWaalsContact CE-CG2 3.45Å; M430-I517 HydrophobicContact CG-CD1 3.95Å
431	D	87	Confident	86.2	Confident	93 Å²	93	62 Å²	62	50%	0.497	30%	0.296	S	S	.	.	H	α-helix	trans	-64.1	-25.5	-179.3	-65.1	-23.5	0	0	0	112.8	M427 I433	M427-D431 PolarHBondContact O-N 2.91Å; D431-I433 PolarHBondContact O-N 3.29Å
432	N	88.2	Confident	86.2	Confident	136 Å²	136	57.7 Å²	57.7	73%	0.727	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-2.7	176.7	-81.7	-45.2	0	0	0	113.8	R428 M430	R428-N432 WeakPolarHBondContact O-CB 3.34Å; R428-N432 VanDerWaalsContact O-CG 3.29Å; R428-N432 PolarHBondContact O-N 3.2Å; R428-N432 PolarHBondContact O-ND2 3.46Å; M430-N432 PolarHBondContact O-N 3.4Å
433	I	88.1	Confident	86.5	Confident	16 Å²	16	59.7 Å²	59.7	8%	0.082	28%	0.282	C	S	.	.			trans	-93.7	111.2	-178.1	-63.7	162.8	0	0	0	109.1	V429 M430 D431 I435 I436 I513	V429-I433 WeakPolarHBondContact O-CD1 3.4Å; V429-I433 WeakPolarHBondContact O-CG1 3.43Å; M430-I433 WeakPolarHBondContact O-CB 3.46Å; M430-I433 PolarHBondContact O-N 3.07Å; D431-I433 PolarHBondContact O-N 3.29Å; I433-I435 PolarHBondContact O-N 2.91Å; I433-I436 HydrophobicContact CB-CD1 4.05Å; I433-I436 HydrophobicContact CB-CG1 4.17Å; I433-I436 HydrophobicContact CD1-CD1 4.2Å; I433-I436 HydrophobicContact CG2-CD1 4.26Å; I433-I436 HydrophobicContact CG2-CG1 4.07Å; I433-I436 WeakPolarHBondContact O-CB 3.08Å; I433-I436 PolarHBondContact O-N 2.94Å; I433-I513 HydrophobicContact CD1-CB 4.18Å; I433-I513 HydrophobicContact CD1-CG1 3.66Å; I433-I513 HydrophobicContact CD1-CG2 3.84Å; I433-I513 HydrophobicContact CG2-CD1 4.24Å; I433-I513 HydrophobicContact CG2-CG1 4.1Å
434	K	88.8	Confident	86.6	Confident	159 Å²	159	57.8 Å²	57.8	69%	0.691	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-29.9	-174.6	-63.5	-173.4	177	-175.8	0	116.2	I436 E464	K434-I436 VanDerWaalsContact C-N 3.29Å; K434-E464 HydrophobicContact CB-CG 4.06Å
435	I	87.8	Confident	86.6	Confident	1 Å²	1	56 Å²	56	1%	0.005	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-20.9	-178	-61.1	176.8	0	0	0	111.3	I433 I460 D461 E464 R468 E509	I433-I435 PolarHBondContact O-N 2.91Å; I435-I460 HydrophobicContact CG2-CD1 4.26Å; I435-I460 HydrophobicContact CG2-CG2 3.8Å; I435-I460 CarbonylContact O-C 3.49Å; I435-I460 WeakPolarHBondContact O-CA 3.34Å; I435-D461 PolarHBondContact O-N 3.49Å; I435-E464 HydrophobicContact CG1-CG 4.04Å; I435-R468 HydrophobicContact CD1-CG 3.93Å; I435-R468 HydrophobicContact CG1-CG 4.48Å; I435-E509 HydrophobicContact CD1-CB 3.82Å; I435-E509 HydrophobicContact CD1-CG 3.32Å; I435-E509 WeakPolarHBondContact CD1-OE2 3.27Å
436	I	87.7	Confident	86.4	Confident	15 Å²	15	55.9 Å²	55.9	8%	0.077	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	116.6	177.6	-61.9	-176.5	0	0	0	107.8	M430 I433 K434 T439 V458 I513	M430-I436 HydrophobicContact CB-CD1 4.24Å; M430-I436 HydrophobicContact CE-CD1 4.21Å; I433-I436 HydrophobicContact CB-CD1 4.05Å; I433-I436 HydrophobicContact CB-CG1 4.17Å; I433-I436 HydrophobicContact CD1-CD1 4.2Å; I433-I436 HydrophobicContact CG2-CD1 4.26Å; I433-I436 HydrophobicContact CG2-CG1 4.07Å; I433-I436 WeakPolarHBondContact O-CB 3.08Å; I433-I436 PolarHBondContact O-N 2.94Å; K434-I436 VanDerWaalsContact C-N 3.29Å; I436-T439 HydrophobicContact CG2-CG2 3.8Å; I436-V458 HydrophobicContact CB-CG1 4.2Å; I436-V458 HydrophobicContact CD1-CG1 3.89Å; I436-V458 HydrophobicContact CG1-CG1 3.72Å; I436-V458 HydrophobicContact CG2-CG1 3.71Å; I436-I513 HydrophobicContact CD1-CD1 4.01Å; I436-I513 HydrophobicContact CG1-CD1 4.3Å
437	R	88.2	Confident	86.1	Confident	94 Å²	94	56.5 Å²	56.5	36%	0.355	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	-35.6	172.6	-171.4	179	-66.8	165.7	1.9	111	D459 D461 E534	R437-D459 HydrophobicContact CB-CB 4.45Å; R437-D459 WeakPolarHBondContact CD-OD2 3.49Å; R437-D459 PolarHBondContact N-O 3.3Å; R437-D461 HydrophobicContact CB-CB 4.4Å; R437-D461 IonicContact CZ-OD1 3.98Å; R437-D461 IonicContact NH2-OD1 3.27Å; R437-D461 PolarHBondContact NH2-OD1 2.78Å; R437-E534 PolarHBondContact NH1-O 3.18Å; R437-E534 IonicContact NH1-OE2 3.93Å; R437-E534 PolarHBondContact NH2-O 3.09Å; R437-E534 VanDerWaalsContact NH2-O 3.12Å
438	G	86.6	Confident	85.4	Confident	11 Å²	11	53.9 Å²	53.9	11%	0.113	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169	160.9	177.2	0	0	0	0	0	113	D459	G438-D459 PolarHBondContact N-O 2.82Å; G438-D459 PolarHBondContact O-N 3.18Å
439	T	85.3	Confident	84.5	Confident	26 Å²	26	47.7 Å²	47.7	16%	0.16	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	133.5	175.6	61.5	0	0	0	0	111.1	M430 I436 E457 V458	M430-T439 HydrophobicContact CB-CG2 3.97Å; M430-T439 HydrophobicContact CE-CG2 3.55Å; M430-T439 HydrophobicContact SD-CG2 4.22Å; I436-T439 HydrophobicContact CG2-CG2 3.8Å; T439-E457 CarbonylContact C-O 3.58Å; T439-E457 WeakPolarHBondContact CA-O 3.47Å; T439-V458 HydrophobicContact CG2-CG2 4.39Å
440	Y	85.6	Confident	83.8	Confident	129 Å²	129	50.7 Å²	50.7	51%	0.506	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	168.8	-173.5	-52.9	-79.5	0	0	0	110.8	I442 E457 D459	Y440-I442 VanDerWaalsContact C-N 3.25Å; Y440-I442 PolarHBondContact O-N 2.93Å; Y440-E457 PolarHBondContact N-O 3.39Å; Y440-E457 WeakPolarHBondContact O-CB 3.35Å; Y440-E457 PolarHBondContact O-N 3.48Å; Y440-D459 HydrophobicContact CD2-CB 4.46Å; Y440-D459 HydrophobicContact CE2-CB 3.85Å
441	D	85.4	Confident	83.2	Confident	64 Å²	64	52.6 Å²	52.6	34%	0.342	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	39.2	48.3	179.6	-166.9	41.9	0	0	0	114.6	K443 E457	D441-K443 PolarHBondContact O-N 3.46Å; D441-K443 WeakPolarHBondContact OD1-CE 3.34Å; D441-K443 IonicContact OD1-NZ 2.74Å; D441-K443 PolarHBondContact OD1-NZ 3.32Å; D441-K443 IonicContact OD2-NZ 3.35Å; D441-K443 PolarHBondContact OD2-NZ 2.85Å; D441-E457 HydrophobicContact CB-CB 4.27Å; D441-E457 HydrophobicContact CB-CG 3.96Å
442	I	85.5	Confident	82.7	Confident	39 Å²	39	48.9 Å²	48.9	20%	0.2	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	119.2	-179.2	-56.6	175.3	0	0	0	109	M427 Y440 T444 F454 K455 A456	M427-I442 HydrophobicContact CG-CD1 3.64Å; M427-I442 HydrophobicContact SD-CD1 3.87Å; Y440-I442 VanDerWaalsContact C-N 3.25Å; Y440-I442 PolarHBondContact O-N 2.93Å; I442-T444 HydrophobicContact CG2-CG2 3.99Å; I442-F454 HydrophobicContact CG2-CE2 3.69Å; I442-F454 HydrophobicContact CG2-CZ 3.88Å; I442-K455 CarbonylContact C-O 3.42Å; I442-K455 WeakPolarHBondContact CA-O 3.33Å; I442-A456 HydrophobicContact CG1-CB 4.08Å
443	K	87	Confident	82.4	Confident	105 Å²	105	45.6 Å²	45.6	46%	0.457	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	116.9	176.3	-73.2	171	177.9	138.6	0	109.2	D441 K455	D441-K443 PolarHBondContact O-N 3.46Å; D441-K443 WeakPolarHBondContact OD1-CE 3.34Å; D441-K443 IonicContact OD1-NZ 2.74Å; D441-K443 PolarHBondContact OD1-NZ 3.32Å; D441-K443 IonicContact OD2-NZ 3.35Å; D441-K443 PolarHBondContact OD2-NZ 2.85Å; K443-K455 HydrophobicContact CB-CB 4.28Å; K443-K455 PolarHBondContact N-O 3.3Å; K443-K455 PolarHBondContact O-N 2.93Å
444	T	86.7	Confident	82.2	Confident	8 Å²	8	44.8 Å²	44.8	5%	0.049	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	132.3	178.5	62.3	0	0	0	0	108.6	A417 I418 Q423 I442 R453 F454	A417-T444 WeakPolarHBondContact CA-O 3.48Å; I418-T444 HydrophobicContact CD1-CG2 3.81Å; I418-T444 HydrophobicContact CG1-CG2 4.25Å; I418-T444 WeakPolarHBondContact CG1-OG1 3.3Å; Q423-T444 HydrophobicContact CG-CG2 4.18Å; Q423-T444 PolarHBondContact OE1-OG1 2.85Å; I442-T444 HydrophobicContact CG2-CG2 3.99Å; T444-R453 CarbonylContact C-O 3.43Å; T444-R453 VanDerWaalsContact CA-O 3.31Å; T444-R453 WeakPolarHBondContact CA-O 3.16Å; T444-F454 HydrophobicContact CG2-CD2 3.43Å; T444-F454 VanDerWaalsContact CG2-CD2 3.43Å; T444-F454 HydrophobicContact CG2-CE2 3.76Å; T444-F454 HydrophobicContact CG2-CG 4.43Å
445	T	86.8	Confident	82.1	Confident	43 Å²	43	40.1 Å²	40.1	26%	0.264	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	147.1	174.9	66	0	0	0	0	111	G415 R416 I452 R453	G415-T445 WeakPolarHBondContact O-CG2 3.49Å; R416-T445 CarbonylContact O-C 3.59Å; R416-T445 WeakPolarHBondContact O-CA 3.34Å; T445-I452 CarbonylContact O-C 3.11Å; T445-R453 PolarHBondContact N-O 2.87Å; T445-R453 PolarHBondContact O-N 3.5Å; T445-R453 WeakPolarHBondContact OG1-CB 3.45Å
446	M	82.1	Confident	81.9	Confident	23 Å²	23	40 Å²	40	11%	0.113	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	129.9	170.6	-60.9	-72.8	-65	0	0	109	V350 M412 R416 I418 I452	V350-M446 HydrophobicContact CG1-CE 4.17Å; M412-M446 HydrophobicContact CE-CB 3.39Å; M412-M446 HydrophobicContact CE-CE 4.36Å; M412-M446 HydrophobicContact CE-CG 4.42Å; M412-M446 HydrophobicContact SD-CB 3.68Å; R416-M446 PolarHBondContact O-N 3.43Å; I418-M446 HydrophobicContact CB-SD 4.36Å; I418-M446 HydrophobicContact CG2-CG 4.13Å; I418-M446 HydrophobicContact CG2-SD 3.72Å; M446-I452 HydrophobicContact SD-CD1 4.32Å; M446-I452 HydrophobicContact SD-CG1 3.71Å
447	I	77.1	Confident	81.9	Confident	13 Å²	13	41.8 Å²	41.8	7%	0.067	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-33.6	178.3	-56.4	178.4	0	0	0	110.7	I266 P267 E451 R453 Q525	I266-I447 HydrophobicContact CB-CG2 4.13Å; I266-I447 HydrophobicContact CD1-CG2 4.41Å; I266-I447 HydrophobicContact CG2-CG2 4.2Å; P267-I447 HydrophobicContact CG-CG2 4.12Å; I447-E451 HydrophobicContact CB-CB 4.47Å; I447-E451 PolarHBondContact N-O 3Å; I447-R453 HydrophobicContact CD1-CB 3.98Å; I447-R453 HydrophobicContact CG1-CB 4.04Å; I447-Q525 HydrophobicContact CD1-CB 4.43Å; I447-Q525 HydrophobicContact CD1-CG 4.39Å
448	G	71.4	Confident	81.7	Confident	2 Å²	2	37.4 Å²	37.4	2%	0.021	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.7	143	-179.4	0	0	0	0	0	111.3	I266 M412 E450 E451	I266-G448 WeakPolarHBondContact CG2-O 3.45Å; M412-G448 VanDerWaalsContact CE-CA 3.42Å; G448-E450 PolarHBondContact O-N 3.21Å; G448-E451 PolarHBondContact O-N 3Å
449	G	69.8	Low	81.8	Confident	8 Å²	8	37.4 Å²	37.4	8%	0.082	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	-133.4	-173.1	0	0	0	0	0	110.6	V350	V350-G449 WeakPolarHBondContact CG1-O 3.48Å; V350-G449 WeakPolarHBondContact O-CA 3.29Å; V350-G449 PolarHBondContact O-N 3Å
450	E	69	Low	81.9	Confident	80 Å²	80	36.3 Å²	36.3	37%	0.374	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	2.8	179.3	-62.7	179	168.4	0	0	112.8	Q337 G448	Q337-E450 PolarHBondContact NE2-OE1 2.95Å; G448-E450 PolarHBondContact O-N 3.21Å
451	E	72.4	Confident	82.1	Confident	40 Å²	40	32 Å²	32	19%	0.187	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	128.2	-176.4	-56.8	-151.7	-171.9	0	0	112.8	I266 I447 G448 F523	I266-E451 HydrophobicContact CD1-CB 4.45Å; I266-E451 HydrophobicContact CD1-CG 4.14Å; I266-E451 WeakPolarHBondContact CD1-OE2 3.46Å; I447-E451 HydrophobicContact CB-CB 4.47Å; I447-E451 PolarHBondContact N-O 3Å; G448-E451 PolarHBondContact O-N 3Å; E451-F523 WeakPolarHBondContact CA-O 3.35Å; E451-F523 HydrophobicContact CB-CB 4.48Å; E451-F523 HydrophobicContact CG-CB 3.86Å
452	I	78.3	Confident	82.2	Confident	14 Å²	14	29.1 Å²	29.1	7%	0.072	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	141.3	-178.4	-65.6	165.4	0	0	0	109.6	I418 T445 M446 F523 I524 Q525	I418-I452 HydrophobicContact CD1-CG2 4.47Å; I418-I452 HydrophobicContact CG2-CB 4.33Å; I418-I452 HydrophobicContact CG2-CD1 4.05Å; I418-I452 HydrophobicContact CG2-CG1 3.88Å; I418-I452 HydrophobicContact CG2-CG2 3.56Å; T445-I452 CarbonylContact O-C 3.11Å; M446-I452 HydrophobicContact SD-CD1 4.32Å; M446-I452 HydrophobicContact SD-CG1 3.71Å; I452-F523 PolarHBondContact N-O 2.88Å; I452-F523 VanDerWaalsContact N-O 3.07Å; I452-I524 HydrophobicContact CB-CG1 4.26Å; I452-I524 HydrophobicContact CG2-CG2 4.45Å; I452-I524 CarbonylContact O-C 3.58Å; I452-I524 WeakPolarHBondContact O-CA 3.4Å; I452-Q525 PolarHBondContact O-N 3.13Å
453	R	81.7	Confident	82.5	Confident	67 Å²	67	33.6 Å²	33.6	25%	0.253	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	126.8	162.6	-170.3	173.3	-63.1	-164.5	3.6	109.3	Y263 T444 T445 I447 Q525	Y263-R453 VanDerWaalsContact CE1-CZ 3.41Å; Y263-R453 VanDerWaalsContact CZ-CZ 3.49Å; Y263-R453 PolarHBondContact OH-NH1 3.44Å; T444-R453 CarbonylContact C-O 3.43Å; T444-R453 VanDerWaalsContact CA-O 3.31Å; T444-R453 WeakPolarHBondContact CA-O 3.16Å; T445-R453 PolarHBondContact N-O 2.87Å; T445-R453 PolarHBondContact O-N 3.5Å; T445-R453 WeakPolarHBondContact OG1-CB 3.45Å; I447-R453 HydrophobicContact CD1-CB 3.98Å; I447-R453 HydrophobicContact CG1-CB 4.04Å; R453-Q525 WeakPolarHBondContact CA-O 3.47Å
454	F	83.9	Confident	82.6	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	123.9	171.9	-175.9	-83.8	0	0	0	109.6	I426 M430 I442 T444 A456 I524 Q525 F526 S527	I426-F454 HydrophobicContact CB-CE2 4.15Å; I426-F454 HydrophobicContact CD1-CD2 3.91Å; I426-F454 HydrophobicContact CD1-CE2 4.36Å; I426-F454 HydrophobicContact CG2-CD2 3.81Å; I426-F454 HydrophobicContact CG2-CE1 4.35Å; I426-F454 HydrophobicContact CG2-CE2 3.38Å; I426-F454 HydrophobicContact CG2-CG 4.48Å; I426-F454 HydrophobicContact CG2-CZ 3.68Å; M430-F454 HydrophobicContact CE-CE1 4.4Å; M430-F454 HydrophobicContact SD-CE1 3.6Å; M430-F454 VanDerWaalsContact SD-CE1 3.6Å; M430-F454 HydrophobicContact SD-CZ 3.49Å; M430-F454 WeakPolarHBondContact SD-CZ 3.48Å; I442-F454 HydrophobicContact CG2-CE2 3.69Å; I442-F454 HydrophobicContact CG2-CZ 3.88Å; T444-F454 HydrophobicContact CG2-CD2 3.43Å; T444-F454 VanDerWaalsContact CG2-CD2 3.43Å; T444-F454 HydrophobicContact CG2-CE2 3.76Å; T444-F454 HydrophobicContact CG2-CG 4.43Å; F454-A456 HydrophobicContact CD1-CB 4.39Å; F454-A456 HydrophobicContact CE1-CB 3.44Å; F454-A456 VanDerWaalsContact CE1-CB 3.44Å; F454-A456 HydrophobicContact CZ-CB 3.8Å; F454-I524 HydrophobicContact CB-CG2 3.75Å; F454-Q525 PolarHBondContact N-O 3.28Å; F454-F526 HydrophobicContact CB-CD1 4.23Å; F454-F526 HydrophobicContact CB-CE1 3.92Å; F454-F526 HydrophobicContact CB-CZ 4.02Å; F454-F526 AromaticContact CD1-CD1 3.63Å; F454-F526 HydrophobicContact CD1-CD1 3.63Å; F454-F526 AromaticContact CD1-CE1 3.11Å; F454-F526 HydrophobicContact CD1-CE1 3.11Å; F454-F526 AromaticContact CD1-CZ 3.88Å; F454-F526 HydrophobicContact CD1-CZ 3.88Å; F454-F526 HydrophobicContact CE1-CD1 4.42Å; F454-F526 AromaticContact CE1-CE1 3.71Å; F454-F526 HydrophobicContact CE1-CE1 3.71Å; F454-F526 HydrophobicContact CG-CD1 4.29Å; F454-F526 AromaticContact CG-CE1 3.67Å; F454-F526 HydrophobicContact CG-CE1 3.67Å; F454-F526 AromaticContact CG-CZ 3.98Å; F454-F526 HydrophobicContact CG-CZ 3.98Å; F454-S527 PolarHBondContact O-N 3.26Å
455	K	86.4	Confident	82.9	Confident	60 Å²	60	30 Å²	30	26%	0.261	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	133.3	171	178.8	-175.4	170.5	-175.3	0	108.9	I442 K443 S527 I529	I442-K455 CarbonylContact C-O 3.42Å; I442-K455 WeakPolarHBondContact CA-O 3.33Å; K443-K455 HydrophobicContact CB-CB 4.28Å; K443-K455 PolarHBondContact N-O 3.3Å; K443-K455 PolarHBondContact O-N 2.93Å; K455-S527 VanDerWaalsContact CA-O 3.27Å; K455-S527 WeakPolarHBondContact CA-O 3.32Å; K455-I529 HydrophobicContact CD-CD1 4.45Å
456	A	84.1	Confident	83.1	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	152.1	170.7	0	0	0	0	0	110.2	M430 I442 F454 V458 S527 I529	M430-A456 HydrophobicContact CE-CB 4.24Å; I442-A456 HydrophobicContact CG1-CB 4.08Å; F454-A456 HydrophobicContact CD1-CB 4.39Å; F454-A456 HydrophobicContact CE1-CB 3.44Å; F454-A456 VanDerWaalsContact CE1-CB 3.44Å; F454-A456 HydrophobicContact CZ-CB 3.8Å; A456-V458 HydrophobicContact CB-CG2 4.44Å; A456-S527 PolarHBondContact N-O 3.43Å; A456-I529 PolarHBondContact O-N 3.46Å
457	E	86	Confident	83.5	Confident	51 Å²	51	34.6 Å²	34.6	24%	0.238	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	123.4	168.8	-71	-176.3	171.1	0	0	108.7	T439 Y440 D441 I529 T531	T439-E457 CarbonylContact C-O 3.58Å; T439-E457 WeakPolarHBondContact CA-O 3.47Å; Y440-E457 PolarHBondContact N-O 3.39Å; Y440-E457 WeakPolarHBondContact O-CB 3.35Å; Y440-E457 PolarHBondContact O-N 3.48Å; D441-E457 HydrophobicContact CB-CB 4.27Å; D441-E457 HydrophobicContact CB-CG 3.96Å; E457-I529 CarbonylContact C-O 3.6Å; E457-I529 VanDerWaalsContact CA-O 3.23Å; E457-I529 WeakPolarHBondContact CA-O 3.43Å; E457-I529 HydrophobicContact CG-CB 4.24Å; E457-I529 HydrophobicContact CG-CG2 4.46Å; E457-T531 HydrophobicContact CB-CG2 3.59Å; E457-T531 HydrophobicContact CG-CG2 3.53Å; E457-T531 VanDerWaalsContact OE2-CG2 3.26Å; E457-T531 WeakPolarHBondContact OE2-CG2 3.43Å
458	V	84.8	Confident	84.1	Confident	3 Å²	3	37.9 Å²	37.9	2%	0.018	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.1	-172	-174.2	0	0	0	0	109.7	M430 I436 T439 A456 I460 I528 I529 T531	M430-V458 HydrophobicContact CE-CG2 3.45Å; M430-V458 VanDerWaalsContact CE-CG2 3.45Å; I436-V458 HydrophobicContact CB-CG1 4.2Å; I436-V458 HydrophobicContact CD1-CG1 3.89Å; I436-V458 HydrophobicContact CG1-CG1 3.72Å; I436-V458 HydrophobicContact CG2-CG1 3.71Å; T439-V458 HydrophobicContact CG2-CG2 4.39Å; A456-V458 HydrophobicContact CB-CG2 4.44Å; V458-I460 HydrophobicContact CG1-CD1 3.83Å; V458-I528 HydrophobicContact CB-CG2 4.3Å; V458-I528 HydrophobicContact CG2-CG2 3.79Å; V458-I529 PolarHBondContact N-O 3.29Å; V458-T531 PolarHBondContact O-N 2.81Å
459	D	87.8	Confident	85	Confident	11 Å²	11	38.3 Å²	38.3	6%	0.059	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	131	169.9	-175.1	26.3	0	0	0	109.9	R437 G438 Y440 N532	R437-D459 HydrophobicContact CB-CB 4.45Å; R437-D459 WeakPolarHBondContact CD-OD2 3.49Å; R437-D459 PolarHBondContact N-O 3.3Å; G438-D459 PolarHBondContact N-O 2.82Å; G438-D459 PolarHBondContact O-N 3.18Å; Y440-D459 HydrophobicContact CD2-CB 4.46Å; Y440-D459 HydrophobicContact CE2-CB 3.85Å; D459-N532 WeakPolarHBondContact OD1-CB 3.46Å
460	I	87.3	Confident	86.1	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.015	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.2	-169.2	-62.7	-66.7	0	0	0	109.5	I435 V458 G462 L465 L506 I530 F533	I435-I460 HydrophobicContact CG2-CD1 4.26Å; I435-I460 HydrophobicContact CG2-CG2 3.8Å; I435-I460 CarbonylContact O-C 3.49Å; I435-I460 WeakPolarHBondContact O-CA 3.34Å; V458-I460 HydrophobicContact CG1-CD1 3.83Å; I460-G462 PolarHBondContact O-N 3.19Å; I460-G462 VanDerWaalsContact O-N 3.09Å; I460-L465 HydrophobicContact CG2-CD2 4.38Å; I460-L506 HydrophobicContact CB-CD1 4.48Å; I460-L506 HydrophobicContact CD1-CD1 4.01Å; I460-L506 HydrophobicContact CG1-CD1 3.98Å; I460-L506 HydrophobicContact CG2-CD1 3.81Å; I460-I530 HydrophobicContact CG1-CG2 4.05Å; I460-F533 HydrophobicContact CB-CD2 4.37Å; I460-F533 HydrophobicContact CG2-CD2 4.29Å; I460-F533 HydrophobicContact CG2-CE2 4.1Å
461	D	89.7	Confident	87.1	Confident	39 Å²	39	43.2 Å²	43.2	21%	0.209	20%	0.195	C	C	.	.			trans	-74.3	102.6	173.1	-170	3	0	0	0	111.1	I435 R437 R463 E464 L465	I435-D461 PolarHBondContact O-N 3.49Å; R437-D461 HydrophobicContact CB-CB 4.4Å; R437-D461 IonicContact CZ-OD1 3.98Å; R437-D461 IonicContact NH2-OD1 3.27Å; R437-D461 PolarHBondContact NH2-OD1 2.78Å; D461-R463 PolarHBondContact O-N 2.93Å; D461-R463 PolarHBondContact OD1-N 3.19Å; D461-R463 VanDerWaalsContact OD1-N 3.1Å; D461-E464 HydrophobicContact CB-CB 4.24Å; D461-E464 PolarHBondContact O-N 3.18Å; D461-L465 WeakPolarHBondContact O-CB 3.42Å; D461-L465 PolarHBondContact O-N 3Å
462	G	88.9	Confident	87.8	Confident	3 Å²	3	46 Å²	46	3%	0.031	22%	0.215	C	C	.	.	H	α-helix	trans	-58	-28.3	178	0	0	0	0	0	113.7	I460 T466	I460-G462 PolarHBondContact O-N 3.19Å; I460-G462 VanDerWaalsContact O-N 3.09Å; G462-T466 VanDerWaalsContact O-CB 3.31Å; G462-T466 WeakPolarHBondContact O-CB 3.45Å; G462-T466 PolarHBondContact O-N 3.45Å; G462-T466 PolarHBondContact O-OG1 3.09Å
463	R	90.6	Very high	88.3	Confident	133 Å²	133	48 Å²	48	50%	0.502	23%	0.226	S	C	.	.	H	α-helix	trans	-71.9	-49.4	178.3	-69.7	-178.2	175.8	-117.9	1.4	111.4	D461 L465 T466 K467 T536 V538	D461-R463 PolarHBondContact O-N 2.93Å; D461-R463 PolarHBondContact OD1-N 3.19Å; D461-R463 VanDerWaalsContact OD1-N 3.1Å; R463-L465 VanDerWaalsContact C-N 3.31Å; R463-L465 PolarHBondContact O-N 3.46Å; R463-T466 PolarHBondContact O-N 2.93Å; R463-K467 WeakPolarHBondContact O-CB 3.13Å; R463-K467 PolarHBondContact O-N 3.33Å; R463-T536 PolarHBondContact NE-O 2.97Å; R463-T536 VanDerWaalsContact NE-O 3.14Å; R463-T536 PolarHBondContact NH2-O 3.4Å; R463-V538 PolarHBondContact NH2-O 3.43Å
464	E	90.9	Very high	88.7	Confident	36 Å²	36	47.6 Å²	47.6	17%	0.168	23%	0.233	C	C	.	.	H	α-helix	trans	-66.2	-36.4	177.9	-170.5	67.6	179	0	0	111.4	K434 I435 D461 K467 R468	K434-E464 HydrophobicContact CB-CG 4.06Å; I435-E464 HydrophobicContact CG1-CG 4.04Å; D461-E464 HydrophobicContact CB-CB 4.24Å; D461-E464 PolarHBondContact O-N 3.18Å; E464-K467 WeakPolarHBondContact O-CB 3.13Å; E464-K467 PolarHBondContact O-N 3.39Å; E464-R468 WeakPolarHBondContact O-CG 3.46Å; E464-R468 PolarHBondContact O-N 3.43Å
465	L	91	Very high	88.9	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.2	-42.7	171.9	178.2	66	0	0	0	112.1	I460 D461 R463 K467 R468 Y469 T505 L506 F533	I460-L465 HydrophobicContact CG2-CD2 4.38Å; D461-L465 WeakPolarHBondContact O-CB 3.42Å; D461-L465 PolarHBondContact O-N 3Å; R463-L465 VanDerWaalsContact C-N 3.31Å; R463-L465 PolarHBondContact O-N 3.46Å; L465-K467 VanDerWaalsContact C-N 3.32Å; L465-R468 WeakPolarHBondContact O-CB 3.38Å; L465-R468 PolarHBondContact O-N 3.5Å; L465-Y469 PolarHBondContact O-N 2.89Å; L465-T505 HydrophobicContact CD1-CG2 3.81Å; L465-L506 HydrophobicContact CD1-CB 4.07Å; L465-L506 HydrophobicContact CD2-CB 3.76Å; L465-L506 HydrophobicContact CD2-CD1 4.3Å; L465-L506 HydrophobicContact CD2-CD2 4.46Å; L465-L506 HydrophobicContact CD2-CG 4.39Å; L465-F533 HydrophobicContact CD2-CE2 3.44Å; L465-F533 VanDerWaalsContact CD2-CE2 3.44Å; L465-F533 HydrophobicContact CD2-CZ 3.57Å
466	T	91.2	Very high	89.1	Confident	52 Å²	52	56 Å²	56	32%	0.319	28%	0.28	S	S	.	.	H	α-helix	trans	-65	-40.2	177.1	-58.8	0	0	0	0	110.9	G462 R463 R468 Y469 L470 L502	G462-T466 VanDerWaalsContact O-CB 3.31Å; G462-T466 WeakPolarHBondContact O-CB 3.45Å; G462-T466 PolarHBondContact O-N 3.45Å; G462-T466 PolarHBondContact O-OG1 3.09Å; R463-T466 PolarHBondContact O-N 2.93Å; T466-R468 PolarHBondContact O-N 3.02Å; T466-Y469 WeakPolarHBondContact O-CB 3.43Å; T466-Y469 PolarHBondContact O-N 3.2Å; T466-Y469 VanDerWaalsContact O-N 3.15Å; T466-L470 HydrophobicContact CG2-CD1 4.16Å; T466-L470 HydrophobicContact CG2-CG 4.32Å; T466-L470 VanDerWaalsContact O-CG 3.3Å; T466-L470 WeakPolarHBondContact O-CG 3.41Å; T466-L470 PolarHBondContact O-N 2.98Å; T466-L502 HydrophobicContact CG2-CD2 4.32Å
467	K	91.7	Very high	89.3	Confident	112 Å²	112	61 Å²	61	49%	0.487	31%	0.307	S	S	.	.	H	α-helix	trans	-58.7	-46.2	173.9	-174.2	-179.8	176.5	-176.8	0	111.9	R463 E464 L465 Y469 L470 E471	R463-K467 WeakPolarHBondContact O-CB 3.13Å; R463-K467 PolarHBondContact O-N 3.33Å; E464-K467 WeakPolarHBondContact O-CB 3.13Å; E464-K467 PolarHBondContact O-N 3.39Å; L465-K467 VanDerWaalsContact C-N 3.32Å; K467-Y469 VanDerWaalsContact C-N 3.3Å; K467-Y469 PolarHBondContact O-N 3.06Å; K467-L470 PolarHBondContact O-N 3.03Å; K467-E471 WeakPolarHBondContact O-CG 3.49Å; K467-E471 PolarHBondContact O-N 3.41Å
468	R	89.3	Confident	89.4	Confident	81 Å²	81	60.1 Å²	60.1	31%	0.306	30%	0.303	S	S	.	.	H	α-helix	trans	-57.6	-41.4	172.9	-75	-84.1	-164	176.3	6.1	112.7	I435 E464 L465 T466 E471 T505	I435-R468 HydrophobicContact CD1-CG 3.93Å; I435-R468 HydrophobicContact CG1-CG 4.48Å; E464-R468 WeakPolarHBondContact O-CG 3.46Å; E464-R468 PolarHBondContact O-N 3.43Å; L465-R468 WeakPolarHBondContact O-CB 3.38Å; L465-R468 PolarHBondContact O-N 3.5Å; T466-R468 PolarHBondContact O-N 3.02Å; R468-E471 WeakPolarHBondContact O-CB 3.34Å; R468-E471 PolarHBondContact O-N 2.8Å; R468-T505 HydrophobicContact CB-CG2 4.29Å
469	Y	91.1	Very high	89.7	Confident	11 Å²	11	64.2 Å²	64.2	4%	0.043	33%	0.325	C	S	.	.	H	α-helix	trans	-68.2	-41.3	176.6	174.2	-125.1	0	0	0	111.7	L465 T466 K467 E471 T472 L473 H498 N501 L502 T505	L465-Y469 PolarHBondContact O-N 2.89Å; T466-Y469 WeakPolarHBondContact O-CB 3.43Å; T466-Y469 PolarHBondContact O-N 3.2Å; T466-Y469 VanDerWaalsContact O-N 3.15Å; K467-Y469 VanDerWaalsContact C-N 3.3Å; K467-Y469 PolarHBondContact O-N 3.06Å; Y469-E471 VanDerWaalsContact C-N 3.26Å; Y469-E471 PolarHBondContact O-N 3.49Å; Y469-T472 WeakPolarHBondContact O-CB 3.44Å; Y469-T472 PolarHBondContact O-N 3.46Å; Y469-T472 PolarHBondContact O-OG1 2.93Å; Y469-L473 HydrophobicContact CD1-CD1 4.31Å; Y469-L473 HydrophobicContact CE1-CD1 3.7Å; Y469-L473 HydrophobicContact CE2-CD1 4.03Å; Y469-L473 HydrophobicContact CE2-CD2 4.37Å; Y469-L473 HydrophobicContact CE2-CG 4.16Å; Y469-H498 HydrophobicContact CE1-CB 4.18Å; Y469-H498 AromaticContact CE1-ND1 3.46Å; Y469-H498 WeakPolarHBondContact CE1-ND1 3.41Å; Y469-H498 AromaticContact CZ-ND1 3.62Å; Y469-H498 PolarHBondContact OH-ND1 3.05Å; Y469-N501 HydrophobicContact CD2-CB 4.22Å; Y469-N501 HydrophobicContact CE1-CB 4.25Å; Y469-N501 HydrophobicContact CE2-CB 3.35Å; Y469-N501 WeakPolarHBondContact OH-CB 3.43Å; Y469-N501 PolarHBondContact OH-ND2 3.31Å; Y469-L502 HydrophobicContact CD1-CD2 3.59Å; Y469-L502 HydrophobicContact CD1-CG 3.79Å; Y469-L502 HydrophobicContact CE1-CG 4.28Å; Y469-L502 HydrophobicContact CG-CD2 3.86Å; Y469-L502 HydrophobicContact CG-CG 4.32Å; Y469-T505 WeakPolarHBondContact CD2-OG1 3.41Å
470	L	91.8	Very high	89.8	Confident	61 Å²	61	68.4 Å²	68.4	32%	0.319	34%	0.344	S	S	.	.	H	α-helix	trans	-62.1	-31.8	175.7	-70.8	171.8	0	0	0	112.4	T466 K467 T472 L473 L475 L478	T466-L470 HydrophobicContact CG2-CD1 4.16Å; T466-L470 HydrophobicContact CG2-CG 4.32Å; T466-L470 VanDerWaalsContact O-CG 3.3Å; T466-L470 WeakPolarHBondContact O-CG 3.41Å; T466-L470 PolarHBondContact O-N 2.98Å; K467-L470 PolarHBondContact O-N 3.03Å; L470-T472 PolarHBondContact O-N 3.36Å; L470-L473 PolarHBondContact O-N 3.45Å; L470-L473 VanDerWaalsContact O-N 3.09Å; L470-L475 HydrophobicContact CD2-CD2 4.22Å; L470-L478 HydrophobicContact CD2-CD2 3.75Å
471	E	89.5	Confident	89.9	Confident	131 Å²	131	71 Å²	71	61%	0.612	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-19.9	171.9	-71	170.8	179.6	0	0	113.2	K467 R468 Y469	K467-E471 WeakPolarHBondContact O-CG 3.49Å; K467-E471 PolarHBondContact O-N 3.41Å; R468-E471 WeakPolarHBondContact O-CB 3.34Å; R468-E471 PolarHBondContact O-N 2.8Å; Y469-E471 VanDerWaalsContact C-N 3.26Å; Y469-E471 PolarHBondContact O-N 3.49Å
472	T	87.8	Confident	89.9	Confident	99 Å²	99	72.6 Å²	72.6	61%	0.607	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-6.1	176.6	71.9	0	0	0	0	113.8	Y469 L470	Y469-T472 WeakPolarHBondContact O-CB 3.44Å; Y469-T472 PolarHBondContact O-N 3.46Å; Y469-T472 PolarHBondContact O-OG1 2.93Å; L470-T472 PolarHBondContact O-N 3.36Å
473	L	88.5	Confident	90	Very high	55 Å²	55	78.5 Å²	78.5	29%	0.288	39%	0.392	S	S	.	.	S	Bend	trans	-115.9	149.3	-177.2	-63.1	178.6	0	0	0	111.1	Y469 L470 L478	Y469-L473 HydrophobicContact CD1-CD1 4.31Å; Y469-L473 HydrophobicContact CE1-CD1 3.7Å; Y469-L473 HydrophobicContact CE2-CD1 4.03Å; Y469-L473 HydrophobicContact CE2-CD2 4.37Å; Y469-L473 HydrophobicContact CE2-CG 4.16Å; L470-L473 PolarHBondContact O-N 3.45Å; L470-L473 VanDerWaalsContact O-N 3.09Å; L473-L478 HydrophobicContact CD1-CD1 4.43Å
474	S	89.4	Confident	90	Very high	58 Å²	58	77.2 Å²	77.2	41%	0.406	40%	0.395	S	S	.	.			trans	-76.5	117.1	163.6	32.3	0	0	0	0	109.3	D476 D477 L478	S474-D476 PolarHBondContact O-N 2.98Å; S474-D477 WeakPolarHBondContact CB-OD2 3.34Å; S474-D477 PolarHBondContact O-N 2.95Å; S474-D477 WeakPolarHBondContact OG-CB 3.35Å; S474-D477 PolarHBondContact OG-OD2 3.39Å; S474-L478 PolarHBondContact O-N 2.74Å
475	L	89.1	Confident	89.9	Confident	115 Å²	115	77.4 Å²	77.4	60%	0.602	40%	0.398	S	S	*	.	H	α-helix	trans	-60	-33.6	179	-71.9	173.2	0	0	0	112.3	L470 L478 L479	L470-L475 HydrophobicContact CD2-CD2 4.22Å; L475-L478 PolarHBondContact O-N 3.35Å; L475-L479 WeakPolarHBondContact O-CB 3.3Å; L475-L479 PolarHBondContact O-N 2.92Å
476	D	89.6	Confident	89.9	Confident	123 Å²	123	86 Å²	86	66%	0.658	44%	0.436	S	S	*	.	H	α-helix	trans	-64.5	-44.9	177	-66.2	-42.7	0	0	0	112	S474 L479 Q480	S474-D476 PolarHBondContact O-N 2.98Å; D476-L479 PolarHBondContact O-N 2.86Å; D476-Q480 WeakPolarHBondContact O-CG 3.26Å; D476-Q480 PolarHBondContact O-N 3.31Å
477	D	88.9	Confident	89.7	Confident	105 Å²	105	86.7 Å²	86.7	56%	0.561	44%	0.44	S	S	*	.	H	α-helix	trans	-67.2	-39.6	178.3	-66	-26.8	0	0	0	111	S474 L479 Q480 E481	S474-D477 WeakPolarHBondContact CB-OD2 3.34Å; S474-D477 PolarHBondContact O-N 2.95Å; S474-D477 WeakPolarHBondContact OG-CB 3.35Å; S474-D477 PolarHBondContact OG-OD2 3.39Å; D477-L479 VanDerWaalsContact C-N 3.32Å; D477-L479 PolarHBondContact O-N 3.28Å; D477-Q480 PolarHBondContact O-N 2.91Å; D477-E481 WeakPolarHBondContact O-CB 3.27Å; D477-E481 PolarHBondContact O-N 3.45Å
478	L	89.4	Confident	89.4	Confident	31 Å²	31	89.2 Å²	89.2	16%	0.162	45%	0.454	C	S	.	.	H	α-helix	trans	-61.3	-43.1	174.6	-172.7	66.5	0	0	0	111	L470 L473 S474 L475 E481 V482 F494 H498	L470-L478 HydrophobicContact CD2-CD2 3.75Å; L473-L478 HydrophobicContact CD1-CD1 4.43Å; S474-L478 PolarHBondContact O-N 2.74Å; L475-L478 PolarHBondContact O-N 3.35Å; L478-E481 PolarHBondContact O-N 3.48Å; L478-V482 VanDerWaalsContact O-CG2 3.28Å; L478-V482 WeakPolarHBondContact O-CG2 3.42Å; L478-V482 PolarHBondContact O-N 3.07Å; L478-F494 HydrophobicContact CD1-CE2 3.87Å; L478-F494 HydrophobicContact CD1-CZ 3.8Å; L478-H498 WeakPolarHBondContact CD1-CE1 3.39Å; L478-H498 WeakPolarHBondContact CD1-NE2 3.25Å
479	L	90.2	Very high	89	Confident	89 Å²	89	92 Å²	92	47%	0.466	47%	0.47	S	S	.	.	H	α-helix	trans	-65.1	-39.2	177.6	-174.5	66	0	0	0	111.7	L475 D476 D477 V482 K483	L475-L479 WeakPolarHBondContact O-CB 3.3Å; L475-L479 PolarHBondContact O-N 2.92Å; D476-L479 PolarHBondContact O-N 2.86Å; D477-L479 VanDerWaalsContact C-N 3.32Å; D477-L479 PolarHBondContact O-N 3.28Å; L479-V482 PolarHBondContact O-N 3.5Å; L479-K483 VanDerWaalsContact O-CG 3.3Å; L479-K483 WeakPolarHBondContact O-CG 3.35Å; L479-K483 PolarHBondContact O-N 3.42Å
480	Q	89.7	Confident	88.7	Confident	99 Å²	99	95.7 Å²	95.7	46%	0.463	49%	0.488	S	S	.	.	H	α-helix	trans	-66.4	-40.9	173.7	-68.1	-62.1	-17	0	0	111.9	D476 D477 V482 K483 N484	D476-Q480 WeakPolarHBondContact O-CG 3.26Å; D476-Q480 PolarHBondContact O-N 3.31Å; D477-Q480 PolarHBondContact O-N 2.91Å; Q480-V482 VanDerWaalsContact C-N 3.34Å; Q480-V482 PolarHBondContact O-N 3.34Å; Q480-K483 PolarHBondContact O-N 3.49Å; Q480-N484 VanDerWaalsContact O-CG 3.3Å; Q480-N484 PolarHBondContact O-N 3.31Å; Q480-N484 VanDerWaalsContact O-N 3.09Å; Q480-N484 PolarHBondContact O-ND2 2.9Å; Q480-N484 VanDerWaalsContact O-ND2 3.08Å
481	E	88.9	Confident	88.4	Confident	59 Å²	59	97.2 Å²	97.2	28%	0.276	50%	0.496	S	S	.	.	H	α-helix	trans	-59.7	-45.9	175.5	-168.7	171.7	176.9	0	0	110.6	D477 L478 K483 N484 V485 F494 K497 H498	D477-E481 WeakPolarHBondContact O-CB 3.27Å; D477-E481 PolarHBondContact O-N 3.45Å; L478-E481 PolarHBondContact O-N 3.48Å; E481-K483 PolarHBondContact O-N 2.84Å; E481-N484 PolarHBondContact O-N 3Å; E481-V485 PolarHBondContact O-N 3.47Å; E481-F494 HydrophobicContact CB-CE2 4.29Å; E481-F494 HydrophobicContact CG-CD2 3.84Å; E481-F494 HydrophobicContact CG-CE2 3.93Å; E481-K497 IonicContact OE1-NZ 2.7Å; E481-K497 PolarHBondContact OE1-NZ 3.49Å; E481-K497 IonicContact OE2-NZ 2.83Å; E481-K497 PolarHBondContact OE2-NZ 2.99Å; E481-H498 IonicContact OE2-NE2 2.79Å
482	V	90.3	Very high	88.1	Confident	71 Å²	71	92 Å²	92	43%	0.43	48%	0.475	S	S	.	.	H	α-helix	trans	-61.4	-43.5	175.7	172.3	0	0	0	0	111.8	L478 L479 Q480 N484 V485 F494	L478-V482 VanDerWaalsContact O-CG2 3.28Å; L478-V482 WeakPolarHBondContact O-CG2 3.42Å; L478-V482 PolarHBondContact O-N 3.07Å; L479-V482 PolarHBondContact O-N 3.5Å; Q480-V482 VanDerWaalsContact C-N 3.34Å; Q480-V482 PolarHBondContact O-N 3.34Å; V482-N484 PolarHBondContact O-N 3.23Å; V482-V485 WeakPolarHBondContact O-CB 3.21Å; V482-V485 PolarHBondContact O-N 3.47Å; V482-F494 HydrophobicContact CG2-CE1 4.07Å; V482-F494 HydrophobicContact CG2-CE2 3.81Å; V482-F494 HydrophobicContact CG2-CZ 3.41Å; V482-F494 VanDerWaalsContact CG2-CZ 3.41Å
483	K	91.5	Very high	87.8	Confident	128 Å²	128	93.3 Å²	93.3	56%	0.557	47%	0.474	S	S	*	.	H	α-helix	trans	-62.8	-27.2	177.4	-75.9	172.4	-179.7	175.8	0	113.3	L479 Q480 E481	L479-K483 VanDerWaalsContact O-CG 3.3Å; L479-K483 WeakPolarHBondContact O-CG 3.35Å; L479-K483 PolarHBondContact O-N 3.42Å; Q480-K483 PolarHBondContact O-N 3.49Å; E481-K483 PolarHBondContact O-N 2.84Å
484	N	89.8	Confident	87.8	Confident	106 Å²	106	91.9 Å²	91.9	57%	0.567	47%	0.466	S	S	*	.	H	α-helix	trans	-83.3	-10.4	179.7	-72	-34.9	0	0	0	113.6	Q480 E481 V482 K486 Q490	Q480-N484 VanDerWaalsContact O-CG 3.3Å; Q480-N484 PolarHBondContact O-N 3.31Å; Q480-N484 VanDerWaalsContact O-N 3.09Å; Q480-N484 PolarHBondContact O-ND2 2.9Å; Q480-N484 VanDerWaalsContact O-ND2 3.08Å; E481-N484 PolarHBondContact O-N 3Å; V482-N484 PolarHBondContact O-N 3.23Å; N484-K486 PolarHBondContact O-N 3.42Å; N484-Q490 PolarHBondContact O-OE1 3.18Å
485	V	90	Very high	87.8	Confident	39 Å²	39	94.9 Å²	94.9	24%	0.236	48%	0.475	C	S	.	.			trans	-73.1	107.4	175.6	176.8	0	0	0	0	109.7	E481 V482 Q490 L491 F494	E481-V485 PolarHBondContact O-N 3.47Å; V482-V485 WeakPolarHBondContact O-CB 3.21Å; V482-V485 PolarHBondContact O-N 3.47Å; V485-Q490 HydrophobicContact CG1-CB 4.03Å; V485-L491 HydrophobicContact CG1-CB 3.66Å; V485-L491 HydrophobicContact CG1-CD1 4.28Å; V485-F494 HydrophobicContact CG2-CB 4.3Å; V485-F494 HydrophobicContact CG2-CG 4.49Å
486	K	89.6	Confident	87.6	Confident	180 Å²	180	94.4 Å²	94.4	78%	0.783	47%	0.472	S	S	*	.			trans	-111	-21	-179.8	-64.1	-176.3	-177.1	-178.9	0	113.8	N484	N484-K486 PolarHBondContact O-N 3.42Å
487	T	87.5	Confident	87.3	Confident	67 Å²	67	92.4 Å²	92.4	41%	0.411	46%	0.458	S	S	.	.	S	Bend	trans	-120.1	153.6	-176.5	67.8	0	0	0	0	111.7	Q489 Q490 L491	T487-Q489 PolarHBondContact O-N 3.08Å; T487-Q490 WeakPolarHBondContact O-CB 3.05Å; T487-Q490 PolarHBondContact O-N 2.84Å; T487-Q490 VanDerWaalsContact O-N 3.08Å; T487-Q490 VanDerWaalsContact OG1-CG 3.28Å; T487-Q490 WeakPolarHBondContact OG1-CG 3.33Å; T487-Q490 PolarHBondContact OG1-N 2.94Å; T487-L491 PolarHBondContact O-N 3.16Å
488	E	85.2	Confident	87.4	Confident	166 Å²	166	88.4 Å²	88.4	78%	0.776	44%	0.435	S	S	*	.	H	α-helix	trans	-57.1	-35.2	175.7	-64.4	-176	170.5	0	0	112.2	L491 A492	E488-L491 PolarHBondContact O-N 3.12Å; E488-A492 WeakPolarHBondContact O-CB 3.34Å; E488-A492 PolarHBondContact O-N 2.96Å
489	Q	80.7	Confident	87.3	Confident	140 Å²	140	88.4 Å²	88.4	65%	0.654	44%	0.443	S	S	*	.	H	α-helix	trans	-65.2	-41	176.3	-68.2	-180	-10	0	0	112.2	T487 A492 H493	T487-Q489 PolarHBondContact O-N 3.08Å; Q489-A492 PolarHBondContact O-N 3.31Å; Q489-H493 WeakPolarHBondContact O-CB 3.15Å; Q489-H493 PolarHBondContact O-N 3.31Å
490	Q	84.9	Confident	86.9	Confident	88 Å²	88	87.7 Å²	87.7	41%	0.411	44%	0.44	S	S	.	.	H	α-helix	trans	-66.4	-39.5	175.4	-74.4	171.2	-13.3	0	0	111.3	N484 V485 T487 H493 F494	N484-Q490 PolarHBondContact O-OE1 3.18Å; V485-Q490 HydrophobicContact CG1-CB 4.03Å; T487-Q490 WeakPolarHBondContact O-CB 3.05Å; T487-Q490 PolarHBondContact O-N 2.84Å; T487-Q490 VanDerWaalsContact O-N 3.08Å; T487-Q490 VanDerWaalsContact OG1-CG 3.28Å; T487-Q490 WeakPolarHBondContact OG1-CG 3.33Å; T487-Q490 PolarHBondContact OG1-N 2.94Å; Q490-H493 PolarHBondContact O-N 3.33Å; Q490-F494 WeakPolarHBondContact O-CB 3.46Å; Q490-F494 PolarHBondContact O-N 3.42Å
491	L	86.4	Confident	86.8	Confident	93 Å²	93	85.4 Å²	85.4	49%	0.487	43%	0.431	S	S	.	.	H	α-helix	trans	-62.5	-45.5	176	180	61.3	0	0	0	111.2	V485 T487 E488 H493 F494 M495	V485-L491 HydrophobicContact CG1-CB 3.66Å; V485-L491 HydrophobicContact CG1-CD1 4.28Å; T487-L491 PolarHBondContact O-N 3.16Å; E488-L491 PolarHBondContact O-N 3.12Å; L491-H493 PolarHBondContact O-N 3.44Å; L491-F494 WeakPolarHBondContact O-CB 3.47Å; L491-F494 PolarHBondContact O-N 2.96Å; L491-M495 HydrophobicContact CD1-CG 4.44Å; L491-M495 WeakPolarHBondContact O-CG 3.31Å; L491-M495 PolarHBondContact O-N 3.31Å
492	A	81.9	Confident	86.8	Confident	21 Å²	21	84.3 Å²	84.3	17%	0.174	43%	0.426	C	S	.	.	H	α-helix	trans	-62.7	-42.6	176.4	0	0	0	0	0	111.8	F77 E488 Q489 M495 L496	F77-A492 HydrophobicContact CD2-CB 4.07Å; F77-A492 HydrophobicContact CE2-CB 3.4Å; F77-A492 VanDerWaalsContact CE2-CB 3.4Å; F77-A492 HydrophobicContact CZ-CB 4.24Å; E488-A492 WeakPolarHBondContact O-CB 3.34Å; E488-A492 PolarHBondContact O-N 2.96Å; Q489-A492 PolarHBondContact O-N 3.31Å; A492-M495 PolarHBondContact O-N 3.5Å; A492-L496 WeakPolarHBondContact O-CB 3.42Å; A492-L496 VanDerWaalsContact O-CG 3.26Å; A492-L496 WeakPolarHBondContact O-CG 3.35Å; A492-L496 PolarHBondContact O-N 3.5Å
493	H	83	Confident	86.5	Confident	126 Å²	126	85.1 Å²	85.1	58%	0.583	43%	0.432	S	S	*	.	H	α-helix	trans	-61.7	-43.7	175.9	-173.4	78	0	0	0	112.1	Q489 Q490 L491 L496 K497	Q489-H493 WeakPolarHBondContact O-CB 3.15Å; Q489-H493 PolarHBondContact O-N 3.31Å; Q490-H493 PolarHBondContact O-N 3.33Å; L491-H493 PolarHBondContact O-N 3.44Å; H493-L496 PolarHBondContact O-N 2.82Å; H493-K497 WeakPolarHBondContact O-CB 3.39Å; H493-K497 PolarHBondContact O-N 2.9Å
494	F	88.6	Confident	86.2	Confident	26 Å²	26	81.1 Å²	81.1	11%	0.114	42%	0.416	C	S	.	.	H	α-helix	trans	-57.3	-51.4	174.3	176	-93.1	0	0	0	111.4	L478 E481 V482 V485 Q490 L491 L496 K497 H498	L478-F494 HydrophobicContact CD1-CE2 3.87Å; L478-F494 HydrophobicContact CD1-CZ 3.8Å; E481-F494 HydrophobicContact CB-CE2 4.29Å; E481-F494 HydrophobicContact CG-CD2 3.84Å; E481-F494 HydrophobicContact CG-CE2 3.93Å; V482-F494 HydrophobicContact CG2-CE1 4.07Å; V482-F494 HydrophobicContact CG2-CE2 3.81Å; V482-F494 HydrophobicContact CG2-CZ 3.41Å; V482-F494 VanDerWaalsContact CG2-CZ 3.41Å; V485-F494 HydrophobicContact CG2-CB 4.3Å; V485-F494 HydrophobicContact CG2-CG 4.49Å; Q490-F494 WeakPolarHBondContact O-CB 3.46Å; Q490-F494 PolarHBondContact O-N 3.42Å; L491-F494 WeakPolarHBondContact O-CB 3.47Å; L491-F494 PolarHBondContact O-N 2.96Å; F494-L496 VanDerWaalsContact C-N 3.33Å; F494-L496 PolarHBondContact O-N 2.95Å; F494-K497 PolarHBondContact O-N 3.27Å; F494-H498 AromaticContact CD2-CD2 3.66Å; F494-H498 AromaticContact CD2-NE2 3.71Å; F494-H498 AromaticContact CE1-CD2 3.93Å; F494-H498 AromaticContact CE2-CD2 3.42Å; F494-H498 VanDerWaalsContact CE2-CD2 3.42Å; F494-H498 WeakPolarHBondContact CE2-CD2 3.26Å; F494-H498 AromaticContact CE2-NE2 3.24Å; F494-H498 WeakPolarHBondContact CE2-NE2 3.39Å; F494-H498 AromaticContact CZ-CD2 3.56Å; F494-H498 AromaticContact CZ-NE2 3.71Å; F494-H498 PolarHBondContact O-CD2 3.35Å; F494-H498 VanDerWaalsContact O-CD2 3.26Å; F494-H498 PolarHBondContact O-N 3.4Å
495	M	88.7	Confident	86	Confident	121 Å²	121	77 Å²	77	60%	0.596	40%	0.395	S	S	*	.	H	α-helix	trans	-61.1	-39.6	178.7	-69.6	-63.1	-70.5	0	0	112.5	L491 A492 G499	L491-M495 HydrophobicContact CD1-CG 4.44Å; L491-M495 WeakPolarHBondContact O-CG 3.31Å; L491-M495 PolarHBondContact O-N 3.31Å; A492-M495 PolarHBondContact O-N 3.5Å; M495-G499 PolarHBondContact O-N 3.5Å
496	L	84.4	Confident	85.9	Confident	104 Å²	104	75.7 Å²	75.7	55%	0.545	39%	0.387	S	S	.	.	H	α-helix	trans	-66.1	-42.7	176.4	-72.4	171.7	0	0	0	112.2	F77 A492 H493 F494 G499 D500	F77-L496 HydrophobicContact CE1-CD1 4.49Å; F77-L496 HydrophobicContact CZ-CD1 4.47Å; A492-L496 WeakPolarHBondContact O-CB 3.42Å; A492-L496 VanDerWaalsContact O-CG 3.26Å; A492-L496 WeakPolarHBondContact O-CG 3.35Å; A492-L496 PolarHBondContact O-N 3.5Å; H493-L496 PolarHBondContact O-N 2.82Å; F494-L496 VanDerWaalsContact C-N 3.33Å; F494-L496 PolarHBondContact O-N 2.95Å; L496-G499 PolarHBondContact O-N 3.21Å; L496-D500 PolarHBondContact O-N 2.89Å
497	K	84.7	Confident	85.6	Confident	82 Å²	82	67.5 Å²	67.5	36%	0.357	35%	0.353	S	S	.	.	H	α-helix	trans	-60.1	-51.4	177.3	176.7	-172.2	170.9	-166.1	0	111.2	E481 H493 F494 D500 N501	E481-K497 IonicContact OE1-NZ 2.7Å; E481-K497 PolarHBondContact OE1-NZ 3.49Å; E481-K497 IonicContact OE2-NZ 2.83Å; E481-K497 PolarHBondContact OE2-NZ 2.99Å; H493-K497 WeakPolarHBondContact O-CB 3.39Å; H493-K497 PolarHBondContact O-N 2.9Å; F494-K497 PolarHBondContact O-N 3.27Å; K497-D500 PolarHBondContact O-N 3.48Å; K497-N501 PolarHBondContact O-N 3.48Å; K497-N501 PolarHBondContact O-ND2 2.63Å
498	H	90	Very high	85.4	Confident	20 Å²	20	66.3 Å²	66.3	9%	0.093	35%	0.348	C	S	.	.	H	α-helix	trans	-71.2	-32.8	179.8	-71.1	-79.6	0	0	0	112.2	Y469 L478 E481 F494 N501 L502	Y469-H498 HydrophobicContact CE1-CB 4.18Å; Y469-H498 AromaticContact CE1-ND1 3.46Å; Y469-H498 WeakPolarHBondContact CE1-ND1 3.41Å; Y469-H498 AromaticContact CZ-ND1 3.62Å; Y469-H498 PolarHBondContact OH-ND1 3.05Å; L478-H498 WeakPolarHBondContact CD1-CE1 3.39Å; L478-H498 WeakPolarHBondContact CD1-NE2 3.25Å; E481-H498 IonicContact OE2-NE2 2.79Å; F494-H498 AromaticContact CD2-CD2 3.66Å; F494-H498 AromaticContact CD2-NE2 3.71Å; F494-H498 AromaticContact CE1-CD2 3.93Å; F494-H498 AromaticContact CE2-CD2 3.42Å; F494-H498 VanDerWaalsContact CE2-CD2 3.42Å; F494-H498 WeakPolarHBondContact CE2-CD2 3.26Å; F494-H498 AromaticContact CE2-NE2 3.24Å; F494-H498 WeakPolarHBondContact CE2-NE2 3.39Å; F494-H498 AromaticContact CZ-CD2 3.56Å; F494-H498 AromaticContact CZ-NE2 3.71Å; F494-H498 PolarHBondContact O-CD2 3.35Å; F494-H498 VanDerWaalsContact O-CD2 3.26Å; F494-H498 PolarHBondContact O-N 3.4Å; H498-N501 PolarHBondContact O-N 3.38Å; H498-L502 WeakPolarHBondContact O-CG 3.39Å; H498-L502 PolarHBondContact O-N 3.36Å
499	G	87.1	Confident	85.4	Confident	32 Å²	32	58.9 Å²	58.9	33%	0.33	31%	0.313	S	S	.	.	H	α-helix	trans	-60.5	-46.1	172.2	0	0	0	0	0	113.4	M495 L496 N501 L502 V503	M495-G499 PolarHBondContact O-N 3.5Å; L496-G499 PolarHBondContact O-N 3.21Å; G499-N501 VanDerWaalsContact C-N 3.34Å; G499-N501 PolarHBondContact O-N 3.04Å; G499-L502 PolarHBondContact O-N 3.43Å; G499-V503 WeakPolarHBondContact O-CG2 3.45Å; G499-V503 PolarHBondContact O-N 2.93Å; G499-V503 VanDerWaalsContact O-N 3.16Å
500	D	81.6	Confident	85.5	Confident	74 Å²	74	54 Å²	54	40%	0.396	29%	0.291	S	S	.	.	H	α-helix	trans	-62.8	-41.9	176.4	-170.6	50.4	0	0	0	111.6	L496 K497 V503 N504	L496-D500 PolarHBondContact O-N 2.89Å; K497-D500 PolarHBondContact O-N 3.48Å; D500-V503 PolarHBondContact O-N 3.42Å; D500-N504 VanDerWaalsContact O-CG 3.25Å; D500-N504 PolarHBondContact O-N 3.23Å; D500-N504 PolarHBondContact O-ND2 3.46Å; D500-N504 VanDerWaalsContact O-ND2 3.11Å; D500-N504 PolarHBondContact OD2-ND2 2.95Å
501	N	87.3	Confident	85.3	Confident	51 Å²	51	53.4 Å²	53.4	27%	0.273	29%	0.291	S	S	.	.	H	α-helix	trans	-68.7	-34.1	178.3	-69.9	-24	0	0	0	113.6	Y469 K497 H498 G499 N504 T505	Y469-N501 HydrophobicContact CD2-CB 4.22Å; Y469-N501 HydrophobicContact CE1-CB 4.25Å; Y469-N501 HydrophobicContact CE2-CB 3.35Å; Y469-N501 WeakPolarHBondContact OH-CB 3.43Å; Y469-N501 PolarHBondContact OH-ND2 3.31Å; K497-N501 PolarHBondContact O-N 3.48Å; K497-N501 PolarHBondContact O-ND2 2.63Å; H498-N501 PolarHBondContact O-N 3.38Å; G499-N501 VanDerWaalsContact C-N 3.34Å; G499-N501 PolarHBondContact O-N 3.04Å; N501-N504 PolarHBondContact O-N 3.49Å; N501-T505 WeakPolarHBondContact O-CB 3.38Å; N501-T505 PolarHBondContact O-N 3.47Å; N501-T505 PolarHBondContact O-OG1 2.72Å
502	L	89	Confident	85.2	Confident	35 Å²	35	53.3 Å²	53.3	18%	0.183	29%	0.286	C	S	.	.	H	α-helix	trans	-61.8	-43.7	171.3	-78.8	168	0	0	0	111.2	T466 Y469 H498 G499 T505 L506	T466-L502 HydrophobicContact CG2-CD2 4.32Å; Y469-L502 HydrophobicContact CD1-CD2 3.59Å; Y469-L502 HydrophobicContact CD1-CG 3.79Å; Y469-L502 HydrophobicContact CE1-CG 4.28Å; Y469-L502 HydrophobicContact CG-CD2 3.86Å; Y469-L502 HydrophobicContact CG-CG 4.32Å; H498-L502 WeakPolarHBondContact O-CG 3.39Å; H498-L502 PolarHBondContact O-N 3.36Å; G499-L502 PolarHBondContact O-N 3.43Å; L502-T505 WeakPolarHBondContact O-CB 3.43Å; L502-T505 PolarHBondContact O-N 2.87Å; L502-L506 PolarHBondContact O-N 3.42Å
503	V	85.8	Confident	85.1	Confident	89 Å²	89	52.6 Å²	52.6	54%	0.539	28%	0.279	S	S	.	.	H	α-helix	trans	-65.3	-38.9	175.6	175.7	0	0	0	0	111.4	G499 D500 T505 L506 G507	G499-V503 WeakPolarHBondContact O-CG2 3.45Å; G499-V503 PolarHBondContact O-N 2.93Å; G499-V503 VanDerWaalsContact O-N 3.16Å; D500-V503 PolarHBondContact O-N 3.42Å; V503-T505 VanDerWaalsContact C-N 3.34Å; V503-L506 WeakPolarHBondContact O-CB 3.47Å; V503-L506 PolarHBondContact O-N 2.9Å; V503-G507 PolarHBondContact O-N 3.22Å
504	N	83.5	Confident	84.8	Confident	43 Å²	43	49.1 Å²	49.1	23%	0.23	26%	0.263	C	S	.	.	H	α-helix	trans	-63	-40.7	173.7	-70.4	-37.7	0	0	0	111.7	R114 D500 N501 G507 S508	R114-N504 WeakPolarHBondContact CD-OD1 3.4Å; D500-N504 VanDerWaalsContact O-CG 3.25Å; D500-N504 PolarHBondContact O-N 3.23Å; D500-N504 PolarHBondContact O-ND2 3.46Å; D500-N504 VanDerWaalsContact O-ND2 3.11Å; D500-N504 PolarHBondContact OD2-ND2 2.95Å; N501-N504 PolarHBondContact O-N 3.49Å; N504-G507 PolarHBondContact O-N 3.28Å; N504-S508 PolarHBondContact O-N 3.07Å
505	T	87.4	Confident	84.3	Confident	19 Å²	19	54.1 Å²	54.1	12%	0.117	29%	0.287	C	S	.	.	H	α-helix	trans	-63.5	-46.1	175.9	-55.4	0	0	0	0	110.6	L465 R468 Y469 N501 L502 V503 G507 S508 E509	L465-T505 HydrophobicContact CD1-CG2 3.81Å; R468-T505 HydrophobicContact CB-CG2 4.29Å; Y469-T505 WeakPolarHBondContact CD2-OG1 3.41Å; N501-T505 WeakPolarHBondContact O-CB 3.38Å; N501-T505 PolarHBondContact O-N 3.47Å; N501-T505 PolarHBondContact O-OG1 2.72Å; L502-T505 WeakPolarHBondContact O-CB 3.43Å; L502-T505 PolarHBondContact O-N 2.87Å; V503-T505 VanDerWaalsContact C-N 3.34Å; T505-G507 VanDerWaalsContact C-N 3.3Å; T505-G507 PolarHBondContact O-N 3.43Å; T505-S508 WeakPolarHBondContact O-CA 3.48Å; T505-S508 WeakPolarHBondContact O-CB 3.45Å; T505-S508 PolarHBondContact O-N 3.29Å; T505-S508 PolarHBondContact O-OG 3.34Å; T505-E509 PolarHBondContact O-N 3.48Å
506	L	87.3	Confident	83.9	Confident	13 Å²	13	54 Å²	54	7%	0.068	28%	0.283	C	S	.	.	H	α-helix	trans	-55.6	-48.4	175.5	175.9	53.7	0	0	0	111.2	I460 L465 L502 V503 S508 E509 I510 I530 F533	I460-L506 HydrophobicContact CB-CD1 4.48Å; I460-L506 HydrophobicContact CD1-CD1 4.01Å; I460-L506 HydrophobicContact CG1-CD1 3.98Å; I460-L506 HydrophobicContact CG2-CD1 3.81Å; L465-L506 HydrophobicContact CD1-CB 4.07Å; L465-L506 HydrophobicContact CD2-CB 3.76Å; L465-L506 HydrophobicContact CD2-CD1 4.3Å; L465-L506 HydrophobicContact CD2-CD2 4.46Å; L465-L506 HydrophobicContact CD2-CG 4.39Å; L502-L506 PolarHBondContact O-N 3.42Å; V503-L506 WeakPolarHBondContact O-CB 3.47Å; V503-L506 PolarHBondContact O-N 2.9Å; L506-S508 PolarHBondContact O-N 3.43Å; L506-E509 PolarHBondContact O-N 2.97Å; L506-E509 VanDerWaalsContact O-N 3.09Å; L506-I510 HydrophobicContact CD1-CD1 4.22Å; L506-I510 HydrophobicContact CD1-CG1 4.38Å; L506-I510 HydrophobicContact CG-CD1 4.11Å; L506-I510 WeakPolarHBondContact O-CG1 3.31Å; L506-I510 PolarHBondContact O-N 3.44Å; L506-I530 HydrophobicContact CD2-CD1 3.86Å; L506-I530 HydrophobicContact CG-CD1 4.26Å; L506-F533 HydrophobicContact CD2-CD2 4.24Å; L506-F533 HydrophobicContact CD2-CE2 4.02Å
507	G	82.4	Confident	83.3	Confident	8 Å²	8	49 Å²	49	8%	0.082	26%	0.257	C	S	.	.	H	α-helix	trans	-67.8	-16.7	178.3	0	0	0	0	0	114.6	R114 V503 N504 T505 N511	R114-G507 VanDerWaalsContact NH1-CA 3.32Å; R114-G507 PolarHBondContact NH2-O 3.34Å; R114-G507 VanDerWaalsContact NH2-O 3.09Å; V503-G507 PolarHBondContact O-N 3.22Å; N504-G507 PolarHBondContact O-N 3.28Å; T505-G507 VanDerWaalsContact C-N 3.3Å; T505-G507 PolarHBondContact O-N 3.43Å; G507-N511 PolarHBondContact O-OD1 3.31Å
508	S	84.1	Confident	82.7	Confident	42 Å²	42	49.5 Å²	49.5	29%	0.294	26%	0.259	S	S	.	.	H	α-helix	trans	-80.2	-36.6	169.4	80.8	0	0	0	0	111.6	N504 T505 L506 N511 K512	N504-S508 PolarHBondContact O-N 3.07Å; T505-S508 WeakPolarHBondContact O-CA 3.48Å; T505-S508 WeakPolarHBondContact O-CB 3.45Å; T505-S508 PolarHBondContact O-N 3.29Å; T505-S508 PolarHBondContact O-OG 3.34Å; L506-S508 PolarHBondContact O-N 3.43Å; S508-N511 PolarHBondContact O-N 3.02Å; S508-K512 WeakPolarHBondContact O-CG 3.49Å; S508-K512 PolarHBondContact O-N 2.92Å
509	E	85.4	Confident	81.3	Confident	10 Å²	10	54 Å²	54	5%	0.047	29%	0.288	C	S	.	.	H	α-helix	trans	-69.2	-37.8	178.1	-68.5	-66.3	138.3	0	0	111.2	I435 T505 L506 N511 K512 I513	I435-E509 HydrophobicContact CD1-CB 3.82Å; I435-E509 HydrophobicContact CD1-CG 3.32Å; I435-E509 WeakPolarHBondContact CD1-OE2 3.27Å; T505-E509 PolarHBondContact O-N 3.48Å; L506-E509 PolarHBondContact O-N 2.97Å; L506-E509 VanDerWaalsContact O-N 3.09Å; E509-N511 VanDerWaalsContact C-N 3.34Å; E509-N511 PolarHBondContact O-N 3.35Å; E509-K512 WeakPolarHBondContact O-CB 3.5Å; E509-K512 PolarHBondContact O-N 3.46Å; E509-K512 VanDerWaalsContact O-N 3.16Å; E509-K512 IonicContact OE1-NZ 3.87Å; E509-K512 PolarHBondContact OE1-NZ 2.8Å; E509-I513 WeakPolarHBondContact O-CG1 3.49Å; E509-I513 PolarHBondContact O-N 2.72Å
510	I	82.7	Confident	80	Confident	36 Å²	36	61.1 Å²	61.1	19%	0.185	31%	0.305	C	S	.	.	H	α-helix	trans	-58.3	-44.3	172.1	-67.2	167.3	0	0	0	111.8	L506 K512 I513 E514 I528 I530	L506-I510 HydrophobicContact CD1-CD1 4.22Å; L506-I510 HydrophobicContact CD1-CG1 4.38Å; L506-I510 HydrophobicContact CG-CD1 4.11Å; L506-I510 WeakPolarHBondContact O-CG1 3.31Å; L506-I510 PolarHBondContact O-N 3.44Å; I510-K512 VanDerWaalsContact C-N 3.31Å; I510-K512 PolarHBondContact O-N 3.33Å; I510-I513 WeakPolarHBondContact O-CB 3.15Å; I510-I513 PolarHBondContact O-N 3.38Å; I510-E514 PolarHBondContact O-N 2.93Å; I510-I528 HydrophobicContact CG2-CD1 4.22Å; I510-I530 HydrophobicContact CD1-CD1 3.42Å; I510-I530 VanDerWaalsContact CD1-CD1 3.42Å; I510-I530 HydrophobicContact CD1-CG1 4.12Å
511	N	80	Confident	78.8	Confident	77 Å²	77	59.1 Å²	59.1	41%	0.412	29%	0.293	S	S	.	.	H	α-helix	trans	-62.5	-39.2	177.3	-68.9	-7.2	0	0	0	111.6	G507 S508 E509 E514 E515	G507-N511 PolarHBondContact O-OD1 3.31Å; S508-N511 PolarHBondContact O-N 3.02Å; E509-N511 VanDerWaalsContact C-N 3.34Å; E509-N511 PolarHBondContact O-N 3.35Å; N511-E514 PolarHBondContact O-N 3.46Å; N511-E515 WeakPolarHBondContact O-CB 3.35Å; N511-E515 PolarHBondContact O-N 3.37Å
512	K	84	Confident	77	Confident	90 Å²	90	62.2 Å²	62.2	39%	0.391	31%	0.309	S	S	.	.	H	α-helix	trans	-66.1	-38.4	175	-66.7	174.7	-170	167.9	0	112.1	S508 E509 I510 E515 K516	S508-K512 WeakPolarHBondContact O-CG 3.49Å; S508-K512 PolarHBondContact O-N 2.92Å; E509-K512 WeakPolarHBondContact O-CB 3.5Å; E509-K512 PolarHBondContact O-N 3.46Å; E509-K512 VanDerWaalsContact O-N 3.16Å; E509-K512 IonicContact OE1-NZ 3.87Å; E509-K512 PolarHBondContact OE1-NZ 2.8Å; I510-K512 VanDerWaalsContact C-N 3.31Å; I510-K512 PolarHBondContact O-N 3.33Å; K512-E515 PolarHBondContact O-N 3.04Å; K512-K516 WeakPolarHBondContact O-CB 3.36Å; K512-K516 WeakPolarHBondContact O-CG 3.33Å; K512-K516 PolarHBondContact O-N 3.17Å
513	I	81.2	Confident	75.4	Confident	6 Å²	6	65.4 Å²	65.4	3%	0.031	32%	0.321	C	S	.	.	H	α-helix	trans	-61.2	-48.9	174.8	-65.9	161.6	0	0	0	109.4	I433 I436 E509 I510 E515 K516 I517 I528	I433-I513 HydrophobicContact CD1-CB 4.18Å; I433-I513 HydrophobicContact CD1-CG1 3.66Å; I433-I513 HydrophobicContact CD1-CG2 3.84Å; I433-I513 HydrophobicContact CG2-CD1 4.24Å; I433-I513 HydrophobicContact CG2-CG1 4.1Å; I436-I513 HydrophobicContact CD1-CD1 4.01Å; I436-I513 HydrophobicContact CG1-CD1 4.3Å; E509-I513 WeakPolarHBondContact O-CG1 3.49Å; E509-I513 PolarHBondContact O-N 2.72Å; I510-I513 WeakPolarHBondContact O-CB 3.15Å; I510-I513 PolarHBondContact O-N 3.38Å; I513-E515 VanDerWaalsContact C-N 3.35Å; I513-E515 PolarHBondContact O-N 3.38Å; I513-K516 PolarHBondContact O-N 3.31Å; I513-I517 HydrophobicContact CG2-CD1 3.87Å; I513-I517 WeakPolarHBondContact O-CG1 3.49Å; I513-I517 PolarHBondContact O-N 3.39Å; I513-I517 VanDerWaalsContact O-N 3.14Å; I513-I528 HydrophobicContact CG2-CD1 4.25Å
514	E	76	Confident	74.1	Confident	54 Å²	54	61.5 Å²	61.5	25%	0.252	30%	0.298	S	S	.	.	H	α-helix	trans	-59.3	-44.3	178.3	-172.2	-177.9	-176.9	0	0	111.9	I510 N511 I517 K518 F526	I510-E514 PolarHBondContact O-N 2.93Å; N511-E514 PolarHBondContact O-N 3.46Å; E514-I517 PolarHBondContact O-N 3.37Å; E514-K518 VanDerWaalsContact CD-NZ 3.34Å; E514-K518 HydrophobicContact CG-CD 4.18Å; E514-K518 WeakPolarHBondContact O-CB 3.37Å; E514-K518 WeakPolarHBondContact O-CG 3.46Å; E514-K518 PolarHBondContact O-N 3.24Å; E514-K518 WeakPolarHBondContact OE1-CE 3.42Å; E514-K518 IonicContact OE1-NZ 3.88Å; E514-K518 PolarHBondContact OE1-NZ 3.49Å; E514-F526 HydrophobicContact CG-CB 4.12Å; E514-F526 HydrophobicContact CG-CD2 4.27Å; E514-F526 HydrophobicContact CG-CG 4.29Å
515	E	78.3	Confident	72.8	Confident	131 Å²	131	62 Å²	62	61%	0.612	30%	0.298	S	S	*	.	H	α-helix	trans	-62	-47.4	177.1	-171.6	176.2	-168	0	0	111.9	N511 K512 I513 I517 K518 V519	N511-E515 WeakPolarHBondContact O-CB 3.35Å; N511-E515 PolarHBondContact O-N 3.37Å; K512-E515 PolarHBondContact O-N 3.04Å; I513-E515 VanDerWaalsContact C-N 3.35Å; I513-E515 PolarHBondContact O-N 3.38Å; E515-I517 VanDerWaalsContact C-N 3.28Å; E515-I517 PolarHBondContact O-N 3.23Å; E515-K518 PolarHBondContact O-N 3.06Å; E515-V519 VanDerWaalsContact O-CG2 3.3Å; E515-V519 WeakPolarHBondContact O-CG2 3.27Å; E515-V519 PolarHBondContact O-N 3.36Å; E515-V519 VanDerWaalsContact O-N 3.07Å
516	K	79.2	Confident	71.5	Confident	118 Å²	118	62.7 Å²	62.7	51%	0.513	30%	0.3	S	S	.	.	H	α-helix	trans	-58.1	-38.4	178.5	-79	179.1	178	-176.8	0	112.8	K512 I513	K512-K516 WeakPolarHBondContact O-CB 3.36Å; K512-K516 WeakPolarHBondContact O-CG 3.33Å; K512-K516 PolarHBondContact O-N 3.17Å; I513-K516 PolarHBondContact O-N 3.31Å
517	I	73.2	Confident	70	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-78.7	-39.2	-178.9	-54.9	164.1	0	0	0	111.2	I426 V429 M430 I513 E514 E515 V519 R520 H521 I524 F526	I426-I517 HydrophobicContact CG1-CG2 4.18Å; I426-I517 HydrophobicContact CG2-CD1 4.41Å; I426-I517 HydrophobicContact CG2-CG2 4.1Å; V429-I517 HydrophobicContact CB-CG1 4.45Å; V429-I517 HydrophobicContact CG1-CG1 3.79Å; M430-I517 HydrophobicContact CG-CD1 3.95Å; I513-I517 HydrophobicContact CG2-CD1 3.87Å; I513-I517 WeakPolarHBondContact O-CG1 3.49Å; I513-I517 PolarHBondContact O-N 3.39Å; I513-I517 VanDerWaalsContact O-N 3.14Å; E514-I517 PolarHBondContact O-N 3.37Å; E515-I517 VanDerWaalsContact C-N 3.28Å; E515-I517 PolarHBondContact O-N 3.23Å; I517-V519 VanDerWaalsContact C-N 3.27Å; I517-V519 PolarHBondContact O-N 2.91Å; I517-R520 PolarHBondContact O-N 3.38Å; I517-R520 VanDerWaalsContact O-N 3.14Å; I517-H521 PolarHBondContact O-N 3.21Å; I517-I524 HydrophobicContact CG2-CD1 3.88Å; I517-F526 HydrophobicContact CB-CE2 3.82Å; I517-F526 HydrophobicContact CB-CZ 3.67Å; I517-F526 HydrophobicContact CD1-CE1 3.65Å; I517-F526 HydrophobicContact CD1-CE2 4.37Å; I517-F526 HydrophobicContact CD1-CZ 3.49Å; I517-F526 VanDerWaalsContact CD1-CZ 3.49Å; I517-F526 HydrophobicContact CG1-CZ 4.17Å; I517-F526 HydrophobicContact CG2-CE2 3.63Å; I517-F526 HydrophobicContact CG2-CZ 3.37Å
518	K	70.3	Confident	68.9	Low	92 Å²	92	66.3 Å²	66.3	40%	0.4	32%	0.322	S	S	.	.	H	α-helix	trans	-60.9	-32.4	175.1	-78	179.3	-178.1	170.9	0	113.4	E514 E515 R520 H521	E514-K518 VanDerWaalsContact CD-NZ 3.34Å; E514-K518 HydrophobicContact CG-CD 4.18Å; E514-K518 WeakPolarHBondContact O-CB 3.37Å; E514-K518 WeakPolarHBondContact O-CG 3.46Å; E514-K518 PolarHBondContact O-N 3.24Å; E514-K518 WeakPolarHBondContact OE1-CE 3.42Å; E514-K518 IonicContact OE1-NZ 3.88Å; E514-K518 PolarHBondContact OE1-NZ 3.49Å; E515-K518 PolarHBondContact O-N 3.06Å; K518-R520 VanDerWaalsContact C-N 3.26Å; K518-R520 PolarHBondContact O-N 2.86Å; K518-H521 CarbonylContact O-C 3.52Å; K518-H521 PolarHBondContact O-N 3.4Å
519	V	60.5	Low	67.7	Low	113 Å²	113	67.4 Å²	67.4	69%	0.685	32%	0.324	S	S	*	.	H	α-helix	trans	-64.6	-32.1	177.6	170.4	0	0	0	0	111.8	E515 I517	E515-V519 VanDerWaalsContact O-CG2 3.3Å; E515-V519 WeakPolarHBondContact O-CG2 3.27Å; E515-V519 PolarHBondContact O-N 3.36Å; E515-V519 VanDerWaalsContact O-N 3.07Å; I517-V519 VanDerWaalsContact C-N 3.27Å; I517-V519 PolarHBondContact O-N 2.91Å
520	R	60.2	Low	66.4	Low	182 Å²	182	70.3 Å²	70.3	69%	0.687	34%	0.339	S	S	*	.	H	α-helix	trans	-86.9	-27.4	179.7	-74.2	-171.7	176.1	-150.5	-1.5	113.8	I517 K518	I517-R520 PolarHBondContact O-N 3.38Å; I517-R520 VanDerWaalsContact O-N 3.14Å; K518-R520 VanDerWaalsContact C-N 3.26Å; K518-R520 PolarHBondContact O-N 2.86Å
521	H	56.6	Low	64.9	Low	32 Å²	32	71.1 Å²	71.1	15%	0.148	35%	0.345	C	S	.	.	S	Bend	trans	-128.8	108.2	-177.6	-61.2	-77.4	0	0	0	109.4	I517 K518 F523 I524	I517-H521 PolarHBondContact O-N 3.21Å; K518-H521 CarbonylContact O-C 3.52Å; K518-H521 PolarHBondContact O-N 3.4Å; H521-F523 PolarHBondContact O-N 3.48Å; H521-I524 HydrophobicContact CB-CD1 3.31Å; H521-I524 HydrophobicContact CB-CG1 3.76Å
522	L	50.2	Low	63.4	Low	117 Å²	117	71.9 Å²	71.9	61%	0.613	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	120.1	175.8	-82.4	121.3	0	0	0	109.1
523	F	55.9	Low	61.7	Low	101 Å²	101	72.1 Å²	72.1	44%	0.443	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	60.7	174.3	-51.5	-80.3	0	0	0	117.2	E451 I452 H521	E451-F523 WeakPolarHBondContact CA-O 3.35Å; E451-F523 HydrophobicContact CB-CB 4.48Å; E451-F523 HydrophobicContact CG-CB 3.86Å; I452-F523 PolarHBondContact N-O 2.88Å; I452-F523 VanDerWaalsContact N-O 3.07Å; H521-F523 PolarHBondContact O-N 3.48Å
524	I	57.6	Low	59.3	Low	8 Å²	8	77.3 Å²	77.3	4%	0.041	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	127	162.8	-54.1	175.2	0	0	0	110.8	I426 I452 F454 I517 H521 F526	I426-I524 HydrophobicContact CD1-CD1 3.94Å; I452-I524 HydrophobicContact CB-CG1 4.26Å; I452-I524 HydrophobicContact CG2-CG2 4.45Å; I452-I524 CarbonylContact O-C 3.58Å; I452-I524 WeakPolarHBondContact O-CA 3.4Å; F454-I524 HydrophobicContact CB-CG2 3.75Å; I517-I524 HydrophobicContact CG2-CD1 3.88Å; H521-I524 HydrophobicContact CB-CD1 3.31Å; H521-I524 HydrophobicContact CB-CG1 3.76Å; I524-F526 HydrophobicContact CB-CD2 3.81Å; I524-F526 HydrophobicContact CB-CE2 3.59Å; I524-F526 HydrophobicContact CD1-CE2 3.79Å; I524-F526 HydrophobicContact CD1-CZ 4.25Å; I524-F526 HydrophobicContact CG1-CE2 4.29Å; I524-F526 HydrophobicContact CG2-CD2 3.36Å; I524-F526 HydrophobicContact CG2-CE2 3.24Å; I524-F526 HydrophobicContact CG2-CG 4.18Å; I524-F526 HydrophobicContact CG2-CZ 3.98Å
525	Q	57.1	Low	57.2	Low	53 Å²	53	77.3 Å²	77.3	25%	0.248	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	111.2	160.3	-68.4	-174.4	1.1	0	0	108.9	I447 I452 R453 F454	I447-Q525 HydrophobicContact CD1-CB 4.43Å; I447-Q525 HydrophobicContact CD1-CG 4.39Å; I452-Q525 PolarHBondContact O-N 3.13Å; R453-Q525 WeakPolarHBondContact CA-O 3.47Å; F454-Q525 PolarHBondContact N-O 3.28Å
526	F	59.2	Low	54.7	Low	33 Å²	33	74.1 Å²	74.1	15%	0.145	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	139.3	-177.7	-96.8	-87.7	0	0	0	112.3	F454 E514 I517 I524 I528	F454-F526 HydrophobicContact CB-CD1 4.23Å; F454-F526 HydrophobicContact CB-CE1 3.92Å; F454-F526 HydrophobicContact CB-CZ 4.02Å; F454-F526 AromaticContact CD1-CD1 3.63Å; F454-F526 HydrophobicContact CD1-CD1 3.63Å; F454-F526 AromaticContact CD1-CE1 3.11Å; F454-F526 HydrophobicContact CD1-CE1 3.11Å; F454-F526 AromaticContact CD1-CZ 3.88Å; F454-F526 HydrophobicContact CD1-CZ 3.88Å; F454-F526 HydrophobicContact CE1-CD1 4.42Å; F454-F526 AromaticContact CE1-CE1 3.71Å; F454-F526 HydrophobicContact CE1-CE1 3.71Å; F454-F526 HydrophobicContact CG-CD1 4.29Å; F454-F526 AromaticContact CG-CE1 3.67Å; F454-F526 HydrophobicContact CG-CE1 3.67Å; F454-F526 AromaticContact CG-CZ 3.98Å; F454-F526 HydrophobicContact CG-CZ 3.98Å; E514-F526 HydrophobicContact CG-CB 4.12Å; E514-F526 HydrophobicContact CG-CD2 4.27Å; E514-F526 HydrophobicContact CG-CG 4.29Å; I517-F526 HydrophobicContact CB-CE2 3.82Å; I517-F526 HydrophobicContact CB-CZ 3.67Å; I517-F526 HydrophobicContact CD1-CE1 3.65Å; I517-F526 HydrophobicContact CD1-CE2 4.37Å; I517-F526 HydrophobicContact CD1-CZ 3.49Å; I517-F526 VanDerWaalsContact CD1-CZ 3.49Å; I517-F526 HydrophobicContact CG1-CZ 4.17Å; I517-F526 HydrophobicContact CG2-CE2 3.63Å; I517-F526 HydrophobicContact CG2-CZ 3.37Å; I524-F526 HydrophobicContact CB-CD2 3.81Å; I524-F526 HydrophobicContact CB-CE2 3.59Å; I524-F526 HydrophobicContact CD1-CE2 3.79Å; I524-F526 HydrophobicContact CD1-CZ 4.25Å; I524-F526 HydrophobicContact CG1-CE2 4.29Å; I524-F526 HydrophobicContact CG2-CD2 3.36Å; I524-F526 HydrophobicContact CG2-CE2 3.24Å; I524-F526 HydrophobicContact CG2-CG 4.18Å; I524-F526 HydrophobicContact CG2-CZ 3.98Å; F526-I528 HydrophobicContact CD1-CD1 4.31Å; F526-I528 HydrophobicContact CD1-CG1 4.13Å
527	S	56.5	Low	52.2	Low	58 Å²	58	77.2 Å²	77.2	41%	0.406	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	100.3	164.5	-172.2	0	0	0	0	108.9	F454 K455 A456	F454-S527 PolarHBondContact O-N 3.26Å; K455-S527 VanDerWaalsContact CA-O 3.27Å; K455-S527 WeakPolarHBondContact CA-O 3.32Å; A456-S527 PolarHBondContact N-O 3.43Å
528	I	58.5	Low	50.1	Low	40 Å²	40	81.6 Å²	81.6	21%	0.205	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	122	176.4	-63.6	172	0	0	0	107.8	V458 I510 I513 F526	V458-I528 HydrophobicContact CB-CG2 4.3Å; V458-I528 HydrophobicContact CG2-CG2 3.79Å; I510-I528 HydrophobicContact CG2-CD1 4.22Å; I513-I528 HydrophobicContact CG2-CD1 4.25Å; F526-I528 HydrophobicContact CD1-CD1 4.31Å; F526-I528 HydrophobicContact CD1-CG1 4.13Å
529	I	58.4	Low	48	Very low	65 Å²	65	83.2 Å²	83.2	33%	0.333	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	126.2	170.2	-58.3	-168.9	0	0	0	106.9	K455 A456 E457 V458	K455-I529 HydrophobicContact CD-CD1 4.45Å; A456-I529 PolarHBondContact O-N 3.46Å; E457-I529 CarbonylContact C-O 3.6Å; E457-I529 VanDerWaalsContact CA-O 3.23Å; E457-I529 WeakPolarHBondContact CA-O 3.43Å; E457-I529 HydrophobicContact CG-CB 4.24Å; E457-I529 HydrophobicContact CG-CG2 4.46Å; V458-I529 PolarHBondContact N-O 3.29Å
530	I	59.6	Low	46.5	Very low	71 Å²	71	88.6 Å²	88.6	36%	0.364	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	115.5	175.6	-50.6	173.1	0	0	0	106.5	I460 L506 I510	I460-I530 HydrophobicContact CG1-CG2 4.05Å; L506-I530 HydrophobicContact CD2-CD1 3.86Å; L506-I530 HydrophobicContact CG-CD1 4.26Å; I510-I530 HydrophobicContact CD1-CD1 3.42Å; I510-I530 VanDerWaalsContact CD1-CD1 3.42Å; I510-I530 HydrophobicContact CD1-CG1 4.12Å
531	T	51.2	Low	45.8	Very low	53 Å²	53	83.9 Å²	83.9	33%	0.325	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	-39.5	-175.5	28.9	0	0	0	0	113.3	E457 V458	E457-T531 HydrophobicContact CB-CG2 3.59Å; E457-T531 HydrophobicContact CG-CG2 3.53Å; E457-T531 VanDerWaalsContact OE2-CG2 3.26Å; E457-T531 WeakPolarHBondContact OE2-CG2 3.43Å; V458-T531 PolarHBondContact O-N 2.81Å
532	N	48.3	Very low	45.2	Very low	92 Å²	92	86.6 Å²	86.6	49%	0.492	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	146.3	-176.9	-81.5	-25.7	0	0	0	112.6	D459	D459-N532 WeakPolarHBondContact OD1-CB 3.46Å
533	F	48.6	Very low	44.9	Very low	96 Å²	96	84.9 Å²	84.9	42%	0.421	45%	0.452	S	S	.	.			trans	-130.7	76.5	171	-160.2	-89.3	0	0	0	107.4	I460 L465 L506 A535	I460-F533 HydrophobicContact CB-CD2 4.37Å; I460-F533 HydrophobicContact CG2-CD2 4.29Å; I460-F533 HydrophobicContact CG2-CE2 4.1Å; L465-F533 HydrophobicContact CD2-CE2 3.44Å; L465-F533 VanDerWaalsContact CD2-CE2 3.44Å; L465-F533 HydrophobicContact CD2-CZ 3.57Å; L506-F533 HydrophobicContact CD2-CD2 4.24Å; L506-F533 HydrophobicContact CD2-CE2 4.02Å; F533-A535 PolarHBondContact O-N 3.36Å
534	E	30.7	Very low	44.3	Very low	115 Å²	115	84 Å²	84	54%	0.537	45%	0.453	S	S	.	.			trans	-84.9	100.6	176.2	-87.1	-168.8	163.3	0	0	110.7	R437 T536	R437-E534 PolarHBondContact NH1-O 3.18Å; R437-E534 IonicContact NH1-OE2 3.93Å; R437-E534 PolarHBondContact NH2-O 3.09Å; R437-E534 VanDerWaalsContact NH2-O 3.12Å; E534-T536 VanDerWaalsContact C-N 3.28Å; E534-T536 PolarHBondContact O-N 3.34Å; E534-T536 VanDerWaalsContact O-N 3.1Å
535	A	30.7	Very low	43.5	Very low	54 Å²	54	88.8 Å²	88.8	45%	0.446	48%	0.478	S	S	.	.			trans	-76.3	83.5	159.2	0	0	0	0	0	108.5	F533 F537	F533-A535 PolarHBondContact O-N 3.36Å; A535-F537 VanDerWaalsContact C-N 3.35Å; A535-F537 HydrophobicContact CB-CD2 4.37Å; A535-F537 HydrophobicContact CB-CE2 4.12Å; A535-F537 PolarHBondContact O-N 3.49Å
536	T	27.3	Very low	42.6	Very low	64 Å²	64	91.1 Å²	91.1	39%	0.393	49%	0.494	S	S	.	.			trans	-68.3	95.5	171.9	-29	0	0	0	0	107.8	R463 E534 V538	R463-T536 PolarHBondContact NE-O 2.97Å; R463-T536 VanDerWaalsContact NE-O 3.14Å; R463-T536 PolarHBondContact NH2-O 3.4Å; E534-T536 VanDerWaalsContact C-N 3.28Å; E534-T536 PolarHBondContact O-N 3.34Å; E534-T536 VanDerWaalsContact O-N 3.1Å; T536-V538 HydrophobicContact CG2-CG2 3.95Å; T536-V538 PolarHBondContact O-N 3.21Å
537	F	26.1	Very low	41.4	Very low	182 Å²	182	95.3 Å²	95.3	80%	0.798	52%	0.519	S	S	*	.			trans	-73.9	80	163.3	-75.4	-88.2	0	0	0	107.6	A535 T539	A535-F537 VanDerWaalsContact C-N 3.35Å; A535-F537 HydrophobicContact CB-CD2 4.37Å; A535-F537 HydrophobicContact CB-CE2 4.12Å; A535-F537 PolarHBondContact O-N 3.49Å; F537-T539 PolarHBondContact O-N 2.78Å
538	V	28.2	Very low	40.2	Very low	92 Å²	92	98.2 Å²	98.2	56%	0.558	53%	0.527	S	S	*	.			trans	-67.5	106.6	157	-175.3	0	0	0	0	105.4	R463 T536 D540	R463-V538 PolarHBondContact NH2-O 3.43Å; T536-V538 HydrophobicContact CG2-CG2 3.95Å; T536-V538 PolarHBondContact O-N 3.21Å; V538-D540 PolarHBondContact O-N 3.07Å
539	T	26.6	Very low	38.7	Very low	127 Å²	127	103 Å²	103	78%	0.779	55%	0.554	S	S	*	*			trans	-72.7	107.4	161.4	48.2	0	0	0	0	106.6	F537	F537-T539 PolarHBondContact O-N 2.78Å
540	D	28.7	Very low	36.9	Very low	225 Å²	225	106.5 Å²	106.5	100%	1.203	57%	0.574	S	S	*	*			trans	-79.2	0	150.9	-82	-23.8	0	0	0	108.8	V538	V538-D540 PolarHBondContact O-N 3.07Å

Retrieved 540 of 540 residues in 791.2 ms (Link to these results)

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