A0A096MUC0_PAPAN Loading...

Golgi resident protein GCP60

Involved in the maintenance of Golgi structure by interacting with giantin, affecting protein transport between the endoplasmic reticulum and Golgi. Involved in hormone-induced steroid biosynthesis in testicular Leydig cells. Recruits PI4KB to the Golgi apparatus membrane; enhances the enzyme activity of PI4KB activity via its membrane recruitment thereby increasing the local concentration of the substrate in the vicinity of the kinase.

AlphaFold DB , UniProt , Accession A0A096MUC0, Species PAPAN (Papio anubis, Olive baboon), Gene ACBD3, Length 528 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	36.7	Very low	31.9	Very low	234 Å²	234	144.8 Å²	144.8	100%	1.153	80%	0.799	S	S	*	*				0	117.9	0	-48.3	-178.2	-143.2	0	0	104.7
2	A	32.4	Very low	31.6	Very low	98 Å²	98	143.3 Å²	143.3	81%	0.81	80%	0.796	S	S	*	*				62.2	134	56	0	0	0	0	0	112.3
3	A	30.2	Very low	31.3	Very low	86 Å²	86	141.7 Å²	141.7	71%	0.711	80%	0.801	S	S	*	*			cis	176.6	-177.1	-20.4	0	0	0	0	0	106.6
4	V	34.5	Very low	31.2	Very low	133 Å²	133	139.9 Å²	139.9	81%	0.806	79%	0.794	S	S	*	*			trans	77.6	138.3	163.2	-173.2	0	0	0	0	116
5	L	34.7	Very low	31.3	Very low	145 Å²	145	141.7 Å²	141.7	76%	0.759	80%	0.8	S	S	*	*			cis	-175	179.7	-39.8	-113.6	168.4	0	0	0	110.7
6	N	28	Very low	31.3	Very low	142 Å²	142	137.2 Å²	137.2	76%	0.759	80%	0.795	S	S	*	*			trans	91.3	117.9	172	-55.4	-14.7	0	0	0	114.6
7	A	31.6	Very low	30.9	Very low	92 Å²	92	138.9 Å²	138.9	76%	0.76	80%	0.8	S	S	*	*				79.1	136.4	57.2	0	0	0	0	0	111.3
8	E	34.3	Very low	30.9	Very low	172 Å²	172	137.8 Å²	137.8	80%	0.804	80%	0.796	S	S	*	*			cis	-139.7	-179.9	25.9	-77.1	-175.1	98.4	0	0	111
9	R	31.3	Very low	30.6	Very low	183 Å²	183	139.1 Å²	139.1	69%	0.691	80%	0.799	S	S	*	*			cis	-166.1	134.7	-27.3	163.5	177.1	174.9	159	-4.8	105.9	E11	R9-E11 HydrophobicContact CG-CG 4.33Å; R9-E11 IonicContact CZ-OE1 3.28Å; R9-E11 IonicContact NE-OE1 2.85Å; R9-E11 PolarHBondContact NE-OE1 3.08Å; R9-E11 IonicContact NH2-OE1 3.53Å; R9-E11 PolarHBondContact NH2-OE1 3.3Å
10	L	27.3	Very low	30.5	Very low	165 Å²	165	137.9 Å²	137.9	86%	0.864	80%	0.799	S	S	*	*			trans	-103.9	140.9	172.5	-96.9	159.6	0	0	0	109.5
11	E	30.2	Very low	30.9	Very low	143 Å²	143	137.1 Å²	137.1	67%	0.668	80%	0.799	S	S	*	*			trans	-122.2	121.8	171.4	-57.2	-154.4	140	0	0	109.9	R9	R9-E11 HydrophobicContact CG-CG 4.33Å; R9-E11 IonicContact CZ-OE1 3.28Å; R9-E11 IonicContact NE-OE1 2.85Å; R9-E11 PolarHBondContact NE-OE1 3.08Å; R9-E11 IonicContact NH2-OE1 3.53Å; R9-E11 PolarHBondContact NH2-OE1 3.3Å
12	V	28.2	Very low	30.6	Very low	126 Å²	126	132.7 Å²	132.7	76%	0.764	78%	0.78	S	S	*	*			trans	-132.3	120.6	173.5	-179.8	0	0	0	0	106.1
13	S	27.8	Very low	31.2	Very low	123 Å²	123	133.5 Å²	133.5	86%	0.86	78%	0.777	S	S	*	*			trans	-79.5	146	178.5	-160.4	0	0	0	0	110.8
14	V	30.2	Very low	31.5	Very low	117 Å²	117	138.2 Å²	138.2	71%	0.709	78%	0.784	S	S	*	*			trans	-130.8	135.4	-179.7	175.8	0	0	0	0	108.6
15	D	32.8	Very low	31.4	Very low	166 Å²	166	141.1 Å²	141.1	89%	0.888	79%	0.789	S	S	*	*			trans	144.2	135.6	158.6	-79	-23.6	0	0	0	108.9
16	G	29.9	Very low	31.3	Very low	70 Å²	70	145.5 Å²	145.5	72%	0.722	80%	0.795	S	S	*	*			cis	-167.7	178.5	-3.4	0	0	0	0	0	111.7
17	L	26	Very low	31.9	Very low	167 Å²	167	145.1 Å²	145.1	87%	0.874	80%	0.8	S	S	*	*			trans	-67.5	160.8	170.5	-59.9	104.7	0	0	0	109.6
18	T	29.3	Very low	31.8	Very low	118 Å²	118	144.5 Å²	144.5	72%	0.724	80%	0.803	S	S	*	*				-162.1	147.8	50.7	51.7	0	0	0	0	115.2
19	L	26.7	Very low	31.7	Very low	163 Å²	163	140.9 Å²	140.9	85%	0.853	80%	0.803	S	S	*	*			trans	31.9	132.3	135.7	-58.2	170.5	0	0	0	121.7
20	S	28.8	Very low	31.9	Very low	114 Å²	114	142 Å²	142	80%	0.797	82%	0.816	S	S	*	*			trans	-66.2	167.3	160.8	-34.6	0	0	0	0	112.5
21	P	37.4	Very low	32.2	Very low	123 Å²	123	138 Å²	138	80%	0.799	81%	0.814	S	S	*	*				-144.3	174.6	72.2	40.6	-23.2	0	0	0	116.5
22	D	31.2	Very low	32.5	Very low	141 Å²	141	135.6 Å²	135.6	75%	0.754	82%	0.819	S	S	*	*			trans	-73.6	154.5	164.3	-159	-9.4	0	0	0	110.7
23	P	45	Very low	33.2	Very low	115 Å²	115	135.7 Å²	135.7	75%	0.747	82%	0.822	S	S	*	*				-145.4	157.9	117	38.8	-25.3	0	0	0	116.6
24	E	36.6	Very low	33.6	Very low	185 Å²	185	137.1 Å²	137.1	86%	0.864	82%	0.819	S	S	*	*			trans	-61.4	144.7	168.6	-55	177.1	89.3	0	0	113.6
25	E	31.7	Very low	34	Very low	193 Å²	193	138.7 Å²	138.7	90%	0.902	82%	0.823	S	S	*	*			trans	-159.6	147.9	133.2	-122.7	179.3	-179.4	0	0	113.4
26	R	33.8	Very low	34.9	Very low	237 Å²	237	136.5 Å²	136.5	89%	0.894	82%	0.818	S	S	*	*			trans	-112.7	145.4	164.7	-72.5	177.1	169.9	176.7	-2.4	107.5
27	P	39.8	Very low	36	Very low	134 Å²	134	138.1 Å²	138.1	87%	0.87	82%	0.816	S	S	*	*				-152.7	176.2	99.3	38.8	-21.9	0	0	0	115.1
28	G	29.9	Very low	36.9	Very low	79 Å²	79	136.3 Å²	136.3	81%	0.814	81%	0.814	S	S	*	*			trans	131.4	129.4	164.4	0	0	0	0	0	113.7
29	A	32.2	Very low	37.8	Very low	97 Å²	97	138.6 Å²	138.6	80%	0.802	82%	0.821	S	S	*	*			trans	-145.5	147.9	177.5	0	0	0	0	0	110.6
30	E	34.1	Very low	39	Very low	206 Å²	206	136.1 Å²	136.1	96%	0.963	82%	0.815	S	S	*	*			trans	171.8	161.2	136.7	-94.5	-156.9	126.2	0	0	109.8
31	G	35.1	Very low	40.1	Very low	80 Å²	80	136.4 Å²	136.4	83%	0.825	81%	0.814	S	S	*	*			trans	126.3	68.1	169.7	0	0	0	0	0	116.4
32	A	36.7	Very low	40.6	Very low	94 Å²	94	136.7 Å²	136.7	78%	0.777	82%	0.816	S	S	*	*			trans	-124.3	143.7	170.2	0	0	0	0	0	111.8
33	P	43.1	Very low	40.8	Very low	128 Å²	128	135.7 Å²	135.7	83%	0.831	82%	0.82	S	S	*	*			trans	-117.9	170	148.8	12.2	9.1	0	0	0	111.8
34	L	36.2	Very low	40.4	Very low	152 Å²	152	138.2 Å²	138.2	80%	0.796	83%	0.826	S	S	*	*			trans	-120.7	138	-156.7	-68.5	160.3	0	0	0	114.8
35	L	38	Very low	40.8	Very low	150 Å²	150	135.4 Å²	135.4	79%	0.785	82%	0.824	S	S	*	*			trans	66.4	165.7	141.2	-68.5	176.3	0	0	0	117.3
36	P	51.5	Low	40.9	Very low	120 Å²	120	129.7 Å²	129.7	78%	0.779	82%	0.816	S	S	*	*			cis	-125	174.3	20.2	38.5	-19.5	0	0	0	117.2
37	P	52.2	Low	41.1	Very low	104 Å²	104	124.8 Å²	124.8	68%	0.675	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-89.2	165.3	-172.7	36	-37.4	0	0	0	115.2
38	P	45.7	Very low	40.7	Very low	129 Å²	129	122.5 Å²	122.5	84%	0.838	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-77.6	160.9	177.4	32.4	-36.1	0	0	0	114.3
39	L	47.8	Very low	40.8	Very low	166 Å²	166	130.8 Å²	130.8	87%	0.869	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-87.2	155.5	-175.6	-71	163.6	0	0	0	113.7
40	P	51.8	Low	40.8	Very low	112 Å²	112	129.3 Å²	129.3	73%	0.727	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-81.3	153.9	175.2	34	-35.7	0	0	0	113.3
41	P	53	Low	41.3	Very low	119 Å²	119	126 Å²	126	77%	0.773	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-75.9	158.9	170.8	32.5	-34.9	0	0	0	112.8
42	P	47.1	Very low	41	Very low	130 Å²	130	126 Å²	126	84%	0.844	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-89.3	163.3	-168.7	35.7	-37.5	0	0	0	115.4
43	S	35	Very low	40.8	Very low	120 Å²	120	126.1 Å²	126.1	84%	0.839	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-87.2	164	179.9	-56.4	0	0	0	0	115.1
44	L	38	Very low	40.3	Very low	168 Å²	168	125.8 Å²	125.8	88%	0.88	82%	0.818	S	S	*	*			trans	-41.5	142.7	175.2	-64.1	160.3	0	0	0	117
45	P	43.4	Very low	40.4	Very low	126 Å²	126	122.1 Å²	122.1	82%	0.818	82%	0.818	S	S	*	*			trans	-86.4	156.2	140	36.1	-30.2	0	0	0	110.8
46	G	34.9	Very low	40.2	Very low	72 Å²	72	124.3 Å²	124.3	74%	0.742	82%	0.824	S	S	*	*			trans	-135	-176.7	-175.2	0	0	0	0	0	115.7
47	S	37.4	Very low	39.5	Very low	135 Å²	135	127.4 Å²	127.4	94%	0.944	83%	0.828	S	S	*	*			trans	66.5	82.9	169	-61.5	0	0	0	0	117.9
48	G	30.9	Very low	38.8	Very low	86 Å²	86	128 Å²	128	89%	0.887	83%	0.832	S	S	*	*			trans	-105.5	139.4	156.2	0	0	0	0	0	111.1
49	R	32.9	Very low	38.5	Very low	252 Å²	252	129.2 Å²	129.2	95%	0.951	83%	0.827	S	S	*	*			trans	-102	139.7	-176	-168.9	-179.2	-175.7	-164.9	2.5	110.1
50	G	32.6	Very low	38.2	Very low	67 Å²	67	127 Å²	127	69%	0.691	82%	0.822	S	S	*	*			trans	-64	175.1	177	0	0	0	0	0	114.2
51	P	44.1	Very low	37.8	Very low	136 Å²	136	124.5 Å²	124.5	88%	0.883	82%	0.817	S	S	*	*				-132.1	173.4	60.9	39	-25.6	0	0	0	115.1
52	G	29.8	Very low	37.1	Very low	81 Å²	81	126.7 Å²	126.7	84%	0.835	82%	0.816	S	S	*	*			trans	-99.5	-179.7	-169.5	0	0	0	0	0	116.7
53	A	31.8	Very low	36.8	Very low	95 Å²	95	124.6 Å²	124.6	79%	0.785	81%	0.81	S	S	*	*			trans	-153.1	165.8	158.8	0	0	0	0	0	108.7
54	S	32.1	Very low	37.4	Very low	121 Å²	121	120.9 Å²	120.9	85%	0.846	79%	0.787	S	S	*	*			trans	-9.6	137.7	168.5	52.6	0	0	0	0	118.9
55	G	37.5	Very low	37.7	Very low	76 Å²	76	115.3 Å²	115.3	78%	0.784	77%	0.765	S	S	*	*			cis	123.4	90.3	1.9	0	0	0	0	0	112.7
56	E	34.5	Very low	38.2	Very low	195 Å²	195	110.8 Å²	110.8	91%	0.911	74%	0.742	S	S	*	*			trans	-139.3	129.5	166.5	-86.2	169.9	125.3	0	0	107.3
57	Q	37	Very low	40.1	Very low	185 Å²	185	108.4 Å²	108.4	86%	0.864	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-96.9	141.7	160.4	-69.8	-172.9	-104.3	0	0	107.4
58	P	37.2	Very low	41.9	Very low	118 Å²	118	102 Å²	102	77%	0.766	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-67.1	138.5	167	29.6	-33.1	0	0	0	109.8
59	E	39.5	Very low	44.3	Very low	154 Å²	154	98.9 Å²	98.9	72%	0.72	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-63.5	150.1	174.9	-77.5	-69.5	139.5	0	0	111.3	G61	E59-G61 PolarHBondContact O-N 3.32Å
60	P	42.3	Very low	46.9	Very low	120 Å²	120	91 Å²	91	78%	0.779	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-9	-172.2	-22.4	34.6	0	0	0	116.3
61	G	43.2	Very low	49.6	Very low	59 Å²	59	89.8 Å²	89.8	61%	0.608	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-28.8	-169.6	0	0	0	0	0	116.7	E59	E59-G61 PolarHBondContact O-N 3.32Å
62	E	38.5	Very low	51.6	Low	164 Å²	164	83.9 Å²	83.9	77%	0.766	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-17.1	-169.7	-67	-167.2	130.1	0	0	114.5
63	A	40	Very low	54.5	Low	86 Å²	86	85.1 Å²	85.1	71%	0.711	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-35.7	-175.9	0	0	0	0	0	113.3	G66	A63-G66 PolarHBondContact O-N 3.33Å; A63-G66 VanDerWaalsContact O-N 3.08Å
64	A	47.2	Very low	57.3	Low	43 Å²	43	86.5 Å²	86.5	36%	0.355	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-57	-53	174.5	0	0	0	0	0	109.8	G66 G67 A342 D343	A64-G66 PolarHBondContact O-N 2.81Å; A64-G67 PolarHBondContact O-N 3.02Å; A64-G67 VanDerWaalsContact O-N 3.09Å; A64-A342 CarbonylContact C-O 3.5Å; A64-A342 CarbonylContact O-C 3.52Å; A64-A342 VanDerWaalsContact O-C 3.26Å; A64-D343 CarbonylContact C-O 3.46Å; A64-D343 WeakPolarHBondContact CA-O 3.43Å; A64-D343 WeakPolarHBondContact CB-O 3.49Å; A64-D343 WeakPolarHBondContact O-CB 3.46Å; A64-D343 PolarHBondContact O-N 2.69Å
65	A	45.1	Very low	60.1	Low	50 Å²	50	80.9 Å²	80.9	41%	0.413	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-60.7	13.5	170.4	0	0	0	0	0	116	H341 A342	A65-H341 CarbonylContact O-C 3.47Å; A65-H341 WeakPolarHBondContact O-CB 3.48Å; A65-A342 VanDerWaalsContact C-CB 3.49Å; A65-A342 VanDerWaalsContact CA-O 3.31Å; A65-A342 WeakPolarHBondContact CA-O 3.5Å; A65-A342 PolarHBondContact N-O 3.25Å
66	G	54.6	Low	62.6	Low	32 Å²	32	82 Å²	82	33%	0.33	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-101	-35.8	165	0	0	0	0	0	116.5	A63 A64 H341	A63-G66 PolarHBondContact O-N 3.33Å; A63-G66 VanDerWaalsContact O-N 3.08Å; A64-G66 PolarHBondContact O-N 2.81Å; G66-H341 PolarHBondContact O-ND1 2.86Å
67	G	74.1	Confident	65.3	Low	21 Å²	21	80.1 Å²	80.1	22%	0.216	45%	0.452	C	S	.	.	S	Bend	trans	-76.7	-64.4	-167	0	0	0	0	0	119.6	A64 A69 E70 E71 A342 D343	A64-G67 PolarHBondContact O-N 3.02Å; A64-G67 VanDerWaalsContact O-N 3.09Å; G67-A69 VanDerWaalsContact C-N 3.35Å; G67-A69 PolarHBondContact O-N 3Å; G67-A69 VanDerWaalsContact O-N 3.16Å; G67-E70 CarbonylContact O-C 3.6Å; G67-E70 VanDerWaalsContact O-CA 3.26Å; G67-E70 WeakPolarHBondContact O-CA 3.33Å; G67-E70 WeakPolarHBondContact O-CB 3.25Å; G67-E70 PolarHBondContact O-N 3.44Å; G67-E71 PolarHBondContact O-N 2.93Å; G67-A342 VanDerWaalsContact C-CB 3.49Å; G67-D343 WeakPolarHBondContact CA-OD2 3.44Å
68	A	75.2	Confident	67.9	Low	0 Å²	0	78.2 Å²	78.2	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-62.2	-33.4	-160.7	0	0	0	0	0	114.2	E70 E71 A72 D156 V159 A342 D343	A68-E70 VanDerWaalsContact C-N 3.34Å; A68-E71 CarbonylContact O-C 3.43Å; A68-E71 PolarHBondContact O-N 3.33Å; A68-A72 WeakPolarHBondContact O-CA 3.5Å; A68-A72 WeakPolarHBondContact O-CB 3.13Å; A68-A72 PolarHBondContact O-N 3.38Å; A68-D156 HydrophobicContact CB-CB 4.4Å; A68-D156 WeakPolarHBondContact CB-OD1 2.82Å; A68-V159 HydrophobicContact CB-CG2 4.23Å; A68-A342 HydrophobicContact CB-CB 4.2Å; A68-D343 WeakPolarHBondContact CA-OD2 3.34Å; A68-D343 HydrophobicContact CB-CB 3.86Å; A68-D343 WeakPolarHBondContact CB-OD1 3.44Å; A68-D343 VanDerWaalsContact N-N 3.13Å; A68-D343 PolarHBondContact N-OD2 3.16Å
69	A	81.7	Confident	70.4	Confident	21 Å²	21	73.5 Å²	73.5	17%	0.174	40%	0.403	C	S	.	.	H	α-helix	trans	-85.5	-7.8	174.3	0	0	0	0	0	113.3	G67 A72 R73 H341	G67-A69 VanDerWaalsContact C-N 3.35Å; G67-A69 PolarHBondContact O-N 3Å; G67-A69 VanDerWaalsContact O-N 3.16Å; A69-A72 HydrophobicContact CB-CB 4.4Å; A69-R73 WeakPolarHBondContact O-CB 3.26Å; A69-R73 WeakPolarHBondContact O-CD 3.42Å; A69-R73 WeakPolarHBondContact O-CG 3.34Å; A69-R73 PolarHBondContact O-N 3.03Å; A69-H341 HydrophobicContact CB-CB 4.1Å; A69-H341 VanDerWaalsContact CB-CD2 3.49Å; A69-H341 WeakPolarHBondContact CB-CD2 3.28Å
70	E	87.7	Confident	72.8	Confident	87 Å²	87	67.6 Å²	67.6	41%	0.407	38%	0.383	S	S	.	.	H	α-helix	trans	-75.6	-47.1	156.9	-148.8	-161.7	130.4	0	0	110	G67 A68 A72 R73 R74 H341	G67-E70 CarbonylContact O-C 3.6Å; G67-E70 VanDerWaalsContact O-CA 3.26Å; G67-E70 WeakPolarHBondContact O-CA 3.33Å; G67-E70 WeakPolarHBondContact O-CB 3.25Å; G67-E70 PolarHBondContact O-N 3.44Å; A68-E70 VanDerWaalsContact C-N 3.34Å; E70-A72 VanDerWaalsContact C-N 3.27Å; E70-A72 PolarHBondContact O-N 3.36Å; E70-R73 PolarHBondContact O-N 3.49Å; E70-R73 VanDerWaalsContact O-N 3.17Å; E70-R74 WeakPolarHBondContact O-CB 3.26Å; E70-R74 VanDerWaalsContact O-CG 3.22Å; E70-R74 WeakPolarHBondContact O-CG 3.46Å; E70-R74 PolarHBondContact O-N 3.13Å; E70-R74 IonicContact OE1-CZ 2.75Å; E70-R74 IonicContact OE1-NE 2.74Å; E70-R74 PolarHBondContact OE1-NE 3Å; E70-R74 IonicContact OE1-NH2 3.2Å; E70-R74 PolarHBondContact OE1-NH2 3.46Å; E70-R74 IonicContact OE2-NH2 3.16Å; E70-H341 PolarHBondContact N-CE1 2.67Å; E70-H341 PolarHBondContact N-ND1 2.78Å
71	E	88.7	Confident	75.3	Confident	41 Å²	41	62.4 Å²	62.4	19%	0.192	35%	0.349	C	S	.	.	H	α-helix	trans	-60.1	-34.5	172	-75.2	-70.8	104.1	0	0	112.4	G67 A68 R74 L75 V159 K163	G67-E71 PolarHBondContact O-N 2.93Å; A68-E71 CarbonylContact O-C 3.43Å; A68-E71 PolarHBondContact O-N 3.33Å; E71-R74 PolarHBondContact O-N 3.03Å; E71-R74 WeakPolarHBondContact OE1-CD 3.46Å; E71-R74 IonicContact OE1-CZ 3.91Å; E71-R74 IonicContact OE1-NE 2.92Å; E71-R74 IonicContact OE1-NH1 2.66Å; E71-R74 PolarHBondContact OE1-NH1 3.48Å; E71-L75 VanDerWaalsContact O-CB 3.29Å; E71-L75 WeakPolarHBondContact O-CB 3.21Å; E71-L75 WeakPolarHBondContact O-CG 3.45Å; E71-L75 PolarHBondContact O-N 2.89Å; E71-V159 HydrophobicContact CB-CG1 3.89Å; E71-V159 HydrophobicContact CB-CG2 4.44Å; E71-K163 WeakPolarHBondContact OE2-CE 3.41Å; E71-K163 IonicContact OE2-NZ 3.28Å; E71-K163 PolarHBondContact OE2-NZ 2.97Å
72	A	87.1	Confident	77.7	Confident	12 Å²	12	60.5 Å²	60.5	10%	0.099	33%	0.329	C	S	.	.	H	α-helix	trans	-68.1	-42.1	174.6	0	0	0	0	0	111.1	A68 A69 E70 L75 E76 L83	A68-A72 WeakPolarHBondContact O-CA 3.5Å; A68-A72 WeakPolarHBondContact O-CB 3.13Å; A68-A72 PolarHBondContact O-N 3.38Å; A69-A72 HydrophobicContact CB-CB 4.4Å; E70-A72 VanDerWaalsContact C-N 3.27Å; E70-A72 PolarHBondContact O-N 3.36Å; A72-L75 PolarHBondContact O-N 3.46Å; A72-E76 WeakPolarHBondContact O-CB 3.41Å; A72-E76 PolarHBondContact O-N 3.49Å; A72-L83 HydrophobicContact CB-CB 4.05Å; A72-L83 HydrophobicContact CB-CD1 4.47Å; A72-L83 HydrophobicContact CB-CD2 3.93Å; A72-L83 HydrophobicContact CB-CG 4.38Å
73	R	89.4	Confident	80.4	Confident	108 Å²	108	53.7 Å²	53.7	41%	0.408	30%	0.298	S	S	.	.	H	α-helix	trans	-66	-38.4	172.9	-76.9	169.6	-178.8	162.9	11.3	111.6	A69 E70 E76 Q77 H341	A69-R73 WeakPolarHBondContact O-CB 3.26Å; A69-R73 WeakPolarHBondContact O-CD 3.42Å; A69-R73 WeakPolarHBondContact O-CG 3.34Å; A69-R73 PolarHBondContact O-N 3.03Å; E70-R73 PolarHBondContact O-N 3.49Å; E70-R73 VanDerWaalsContact O-N 3.17Å; R73-E76 PolarHBondContact O-N 3.22Å; R73-Q77 VanDerWaalsContact O-CB 3.29Å; R73-Q77 WeakPolarHBondContact O-CB 3.32Å; R73-Q77 WeakPolarHBondContact O-CG 3.16Å; R73-Q77 PolarHBondContact O-N 3.47Å; R73-H341 PolarHBondContact NH1-NE2 3.47Å
74	R	91.1	Very high	82.9	Confident	124 Å²	124	55.2 Å²	55.2	47%	0.468	29%	0.29	S	S	.	.	H	α-helix	trans	-65.1	-40.2	173.7	-68.5	162.5	176.6	-163.9	3.6	110.9	E70 E71 R78	E70-R74 WeakPolarHBondContact O-CB 3.26Å; E70-R74 VanDerWaalsContact O-CG 3.22Å; E70-R74 WeakPolarHBondContact O-CG 3.46Å; E70-R74 PolarHBondContact O-N 3.13Å; E70-R74 IonicContact OE1-CZ 2.75Å; E70-R74 IonicContact OE1-NE 2.74Å; E70-R74 PolarHBondContact OE1-NE 3Å; E70-R74 IonicContact OE1-NH2 3.2Å; E70-R74 PolarHBondContact OE1-NH2 3.46Å; E70-R74 IonicContact OE2-NH2 3.16Å; E71-R74 PolarHBondContact O-N 3.03Å; E71-R74 WeakPolarHBondContact OE1-CD 3.46Å; E71-R74 IonicContact OE1-CZ 3.91Å; E71-R74 IonicContact OE1-NE 2.92Å; E71-R74 IonicContact OE1-NH1 2.66Å; E71-R74 PolarHBondContact OE1-NH1 3.48Å; R74-R78 VanDerWaalsContact O-CB 3.24Å; R74-R78 WeakPolarHBondContact O-CB 3.42Å; R74-R78 PolarHBondContact O-N 3.43Å
75	L	89.9	Confident	85.2	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.016	29%	0.293	C	S	.	.	H	α-helix	trans	-65.7	-47.2	172.8	-76.1	167.8	0	0	0	111.1	E71 A72 Q77 R78 W79 L83 L86 V159 V162	E71-L75 VanDerWaalsContact O-CB 3.29Å; E71-L75 WeakPolarHBondContact O-CB 3.21Å; E71-L75 WeakPolarHBondContact O-CG 3.45Å; E71-L75 PolarHBondContact O-N 2.89Å; A72-L75 PolarHBondContact O-N 3.46Å; L75-Q77 PolarHBondContact O-N 2.9Å; L75-R78 PolarHBondContact O-N 2.89Å; L75-R78 VanDerWaalsContact O-N 3.13Å; L75-W79 VanDerWaalsContact CD2-NE1 3.26Å; L75-W79 VanDerWaalsContact O-CB 3.28Å; L75-W79 WeakPolarHBondContact O-CB 3.37Å; L75-W79 PolarHBondContact O-N 3.45Å; L75-L83 HydrophobicContact CD1-CD1 4.16Å; L75-L86 HydrophobicContact CB-CD2 3.94Å; L75-L86 HydrophobicContact CD2-CD2 4.23Å; L75-L86 HydrophobicContact CG-CD2 4.47Å; L75-V159 HydrophobicContact CD1-CB 4.4Å; L75-V159 HydrophobicContact CD1-CG1 4.23Å; L75-V159 HydrophobicContact CD1-CG2 4.03Å; L75-V162 HydrophobicContact CD1-CG1 4.45Å; L75-V162 HydrophobicContact CD2-CG1 4.02Å
76	E	91.4	Very high	87.6	Confident	98 Å²	98	55 Å²	55	46%	0.458	27%	0.273	S	S	.	.	H	α-helix	trans	-60.4	-45.9	178.4	179.1	176.5	-138.3	0	0	111.6	A72 R73 R78 W79 G80 F81	A72-E76 WeakPolarHBondContact O-CB 3.41Å; A72-E76 PolarHBondContact O-N 3.49Å; R73-E76 PolarHBondContact O-N 3.22Å; E76-R78 VanDerWaalsContact C-N 3.34Å; E76-R78 PolarHBondContact O-N 3.08Å; E76-W79 PolarHBondContact O-N 3.19Å; E76-G80 WeakPolarHBondContact O-CA 3.42Å; E76-G80 PolarHBondContact O-N 2.85Å; E76-F81 VanDerWaalsContact CA-O 3.29Å; E76-F81 WeakPolarHBondContact CA-O 3.35Å
77	Q	90.2	Very high	89.6	Confident	157 Å²	157	54.2 Å²	54.2	73%	0.734	26%	0.26	S	S	*	.	H	α-helix	trans	-61.4	-39.2	173	-72.2	167	18.8	0	0	112.4	R73 L75	R73-Q77 VanDerWaalsContact O-CB 3.29Å; R73-Q77 WeakPolarHBondContact O-CB 3.32Å; R73-Q77 WeakPolarHBondContact O-CG 3.16Å; R73-Q77 PolarHBondContact O-N 3.47Å; L75-Q77 PolarHBondContact O-N 2.9Å
78	R	90.8	Very high	90.5	Very high	145 Å²	145	54.4 Å²	54.4	55%	0.547	26%	0.262	S	S	.	.	H	α-helix	trans	-74.3	-38.4	-179.9	-170.4	172.3	80.2	-156.4	9.6	113.1	R74 L75 E76	R74-R78 VanDerWaalsContact O-CB 3.24Å; R74-R78 WeakPolarHBondContact O-CB 3.42Å; R74-R78 PolarHBondContact O-N 3.43Å; L75-R78 PolarHBondContact O-N 2.89Å; L75-R78 VanDerWaalsContact O-N 3.13Å; E76-R78 VanDerWaalsContact C-N 3.34Å; E76-R78 PolarHBondContact O-N 3.08Å
79	W	90.8	Very high	91.5	Very high	19 Å²	19	54.6 Å²	54.6	7%	0.072	26%	0.263	C	S	.	.	H	α-helix	trans	-107.3	-20.3	-167.9	-64.3	117.2	0	0	0	114.6	L75 E76 F81 L86 N166 S173 V176 K180	L75-W79 VanDerWaalsContact CD2-NE1 3.26Å; L75-W79 VanDerWaalsContact O-CB 3.28Å; L75-W79 WeakPolarHBondContact O-CB 3.37Å; L75-W79 PolarHBondContact O-N 3.45Å; E76-W79 PolarHBondContact O-N 3.19Å; W79-F81 WeakPolarHBondContact O-CD2 3.46Å; W79-L86 HydrophobicContact CB-CD1 3.95Å; W79-L86 HydrophobicContact CB-CD2 4.14Å; W79-L86 HydrophobicContact CD2-CD1 4.31Å; W79-L86 HydrophobicContact CG-CD1 3.87Å; W79-L86 HydrophobicContact CG-CD2 3.86Å; W79-N166 WeakPolarHBondContact CH2-OD1 3.31Å; W79-N166 WeakPolarHBondContact CZ2-OD1 3.47Å; W79-S173 WeakPolarHBondContact CZ3-OG 3Å; W79-V176 HydrophobicContact CB-CG1 4.06Å; W79-V176 HydrophobicContact CD2-CG1 4.09Å; W79-V176 HydrophobicContact CE3-CB 3.91Å; W79-V176 HydrophobicContact CE3-CG1 3.59Å; W79-V176 HydrophobicContact CG-CG1 4.35Å; W79-V176 HydrophobicContact CZ3-CB 4.1Å; W79-V176 HydrophobicContact CZ3-CG1 4.29Å; W79-K180 WeakPolarHBondContact O-CD 3.2Å
80	G	90.8	Very high	92	Very high	29 Å²	29	53.6 Å²	53.6	30%	0.299	26%	0.255	S	S	.	.	S	Bend	trans	77.6	18.5	-175.7	0	0	0	0	0	115.1	E76	E76-G80 WeakPolarHBondContact O-CA 3.42Å; E76-G80 PolarHBondContact O-N 2.85Å
81	F	93.8	Very high	92.3	Very high	12 Å²	12	50.5 Å²	50.5	5%	0.053	24%	0.241	C	C	.	.	S	Bend	trans	-134.6	139.4	-177.1	-72.6	-78.7	0	0	0	110.7	E76 W79 E85 L86 L89 V176 H179 K180 K183	E76-F81 VanDerWaalsContact CA-O 3.29Å; E76-F81 WeakPolarHBondContact CA-O 3.35Å; W79-F81 WeakPolarHBondContact O-CD2 3.46Å; F81-E85 WeakPolarHBondContact CA-OE2 3.21Å; F81-E85 HydrophobicContact CB-CB 4.15Å; F81-E85 HydrophobicContact CD1-CB 3.97Å; F81-L86 HydrophobicContact CB-CB 3.95Å; F81-L89 HydrophobicContact CD1-CD1 3.9Å; F81-L89 HydrophobicContact CD2-CD1 3.92Å; F81-L89 HydrophobicContact CE1-CD1 3.76Å; F81-L89 HydrophobicContact CE2-CD1 3.79Å; F81-L89 HydrophobicContact CG-CD1 3.97Å; F81-L89 HydrophobicContact CZ-CD1 3.71Å; F81-V176 HydrophobicContact CD2-CG1 3.69Å; F81-V176 HydrophobicContact CE2-CG1 3.77Å; F81-H179 HydrophobicContact CE2-CB 4.49Å; F81-H179 HydrophobicContact CZ-CB 3.95Å; F81-K180 HydrophobicContact CE2-CB 3.86Å; F81-K180 HydrophobicContact CZ-CB 4.34Å; F81-K183 HydrophobicContact CD1-CD 4.14Å; F81-K183 HydrophobicContact CE1-CD 3.61Å; F81-K183 HydrophobicContact CZ-CD 4.32Å
82	G	93.6	Very high	92.4	Very high	18 Å²	18	54.5 Å²	54.5	19%	0.186	25%	0.254	C	S	.	.			trans	-62.5	155.4	169.2	0	0	0	0	0	110.7	E84 E85 L86	G82-E84 VanDerWaalsContact C-N 3.31Å; G82-E84 PolarHBondContact O-N 3Å; G82-E85 PolarHBondContact N-OE2 3.45Å; G82-E85 WeakPolarHBondContact O-CB 3.35Å; G82-E85 PolarHBondContact O-N 2.98Å; G82-L86 WeakPolarHBondContact O-CB 3.16Å; G82-L86 PolarHBondContact O-N 2.86Å
83	L	94.6	Very high	92.6	Very high	22 Å²	22	54.3 Å²	54.3	12%	0.115	25%	0.251	C	S	.	.	H	α-helix	trans	-52.9	-45.1	-173	179.7	63.1	0	0	0	113.4	A72 L75 L86 Y87 E155 M158 V159	A72-L83 HydrophobicContact CB-CB 4.05Å; A72-L83 HydrophobicContact CB-CD1 4.47Å; A72-L83 HydrophobicContact CB-CD2 3.93Å; A72-L83 HydrophobicContact CB-CG 4.38Å; L75-L83 HydrophobicContact CD1-CD1 4.16Å; L83-L86 PolarHBondContact O-N 2.96Å; L83-Y87 VanDerWaalsContact O-CB 3.24Å; L83-Y87 WeakPolarHBondContact O-CB 3.47Å; L83-Y87 PolarHBondContact O-N 3.3Å; L83-E155 HydrophobicContact CD2-CB 3.92Å; L83-E155 HydrophobicContact CD2-CG 4.2Å; L83-E155 WeakPolarHBondContact CD2-O 3.35Å; L83-M158 HydrophobicContact CD1-CB 3.94Å; L83-M158 HydrophobicContact CD2-CB 4.14Å; L83-M158 HydrophobicContact CD2-SD 4.46Å; L83-M158 HydrophobicContact CG-CB 3.94Å; L83-M158 HydrophobicContact CG-SD 4.11Å; L83-V159 HydrophobicContact CD1-CG2 3.69Å; L83-V159 HydrophobicContact CD2-CG2 3.99Å
84	E	94.1	Very high	92.6	Very high	118 Å²	118	49.1 Å²	49.1	55%	0.551	23%	0.232	S	C	*	.	H	α-helix	trans	-67.9	-36.7	179.3	-56.6	-163	126.3	0	0	112.6	G82 G88 K154 M158	G82-E84 VanDerWaalsContact C-N 3.31Å; G82-E84 PolarHBondContact O-N 3Å; E84-G88 PolarHBondContact O-N 3.03Å; E84-K154 IonicContact OE1-NZ 2.67Å; E84-K154 PolarHBondContact OE1-NZ 3.46Å; E84-M158 HydrophobicContact CB-SD 4.42Å; E84-M158 HydrophobicContact CG-CE 4.04Å; E84-M158 HydrophobicContact CG-SD 3.97Å
85	E	94.2	Very high	92.4	Very high	89 Å²	89	46.7 Å²	46.7	42%	0.416	23%	0.225	S	C	.	.	H	α-helix	trans	-64.7	-45.4	174	-60.6	-176.7	120.8	0	0	110.9	F81 G82 G88 L89 K183	F81-E85 WeakPolarHBondContact CA-OE2 3.21Å; F81-E85 HydrophobicContact CB-CB 4.15Å; F81-E85 HydrophobicContact CD1-CB 3.97Å; G82-E85 PolarHBondContact N-OE2 3.45Å; G82-E85 WeakPolarHBondContact O-CB 3.35Å; G82-E85 PolarHBondContact O-N 2.98Å; E85-G88 CarbonylContact O-C 3.26Å; E85-G88 PolarHBondContact O-N 2.79Å; E85-L89 WeakPolarHBondContact O-CG 3.42Å; E85-L89 PolarHBondContact O-N 3.15Å; E85-K183 IonicContact OE1-NZ 2.97Å; E85-K183 PolarHBondContact OE1-NZ 3.46Å; E85-K183 IonicContact OE2-NZ 2.76Å; E85-K183 PolarHBondContact OE2-NZ 3.43Å
86	L	95.8	Very high	92.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67.4	-40.3	-178.7	-178.2	62.8	0	0	0	111.7	L75 W79 F81 G82 L83 L89 A90 V162 F172 V176	L75-L86 HydrophobicContact CB-CD2 3.94Å; L75-L86 HydrophobicContact CD2-CD2 4.23Å; L75-L86 HydrophobicContact CG-CD2 4.47Å; W79-L86 HydrophobicContact CB-CD1 3.95Å; W79-L86 HydrophobicContact CB-CD2 4.14Å; W79-L86 HydrophobicContact CD2-CD1 4.31Å; W79-L86 HydrophobicContact CG-CD1 3.87Å; W79-L86 HydrophobicContact CG-CD2 3.86Å; F81-L86 HydrophobicContact CB-CB 3.95Å; G82-L86 WeakPolarHBondContact O-CB 3.16Å; G82-L86 PolarHBondContact O-N 2.86Å; L83-L86 PolarHBondContact O-N 2.96Å; L86-L89 WeakPolarHBondContact O-CB 3.44Å; L86-L89 PolarHBondContact O-N 3.37Å; L86-A90 WeakPolarHBondContact O-CB 3.22Å; L86-A90 PolarHBondContact O-N 3.24Å; L86-V162 HydrophobicContact CD2-CG1 3.81Å; L86-V162 HydrophobicContact CG-CG1 4Å; L86-V162 HydrophobicContact CG-CG2 4.17Å; L86-F172 HydrophobicContact CD1-CZ 4.21Å; L86-V176 HydrophobicContact CD1-CG1 3.81Å; L86-V176 HydrophobicContact CD1-CG2 3.96Å
87	Y	96.3	Very high	91.6	Very high	14 Å²	14	49 Å²	49	6%	0.055	24%	0.235	C	C	.	.	H	α-helix	trans	-65.7	-40	170.6	172.2	-104	0	0	0	111.6	L83 L89 A90 L91 H116 V119 M158 F161	L83-Y87 VanDerWaalsContact O-CB 3.24Å; L83-Y87 WeakPolarHBondContact O-CB 3.47Å; L83-Y87 PolarHBondContact O-N 3.3Å; Y87-L89 VanDerWaalsContact C-N 3.28Å; Y87-L89 PolarHBondContact O-N 3.47Å; Y87-A90 WeakPolarHBondContact O-CB 3.31Å; Y87-A90 PolarHBondContact O-N 3.04Å; Y87-L91 HydrophobicContact CE1-CD2 4.39Å; Y87-L91 WeakPolarHBondContact O-CB 3.41Å; Y87-L91 PolarHBondContact O-N 3.22Å; Y87-H116 AromaticContact CZ-ND1 3.99Å; Y87-H116 PolarHBondContact OH-ND1 2.91Å; Y87-V119 HydrophobicContact CD1-CG1 4.42Å; Y87-V119 HydrophobicContact CE1-CB 4.38Å; Y87-V119 HydrophobicContact CE1-CG1 3.55Å; Y87-V119 HydrophobicContact CE2-CG2 4.15Å; Y87-V119 WeakPolarHBondContact OH-CB 3.5Å; Y87-V119 WeakPolarHBondContact OH-CG1 3.4Å; Y87-M158 HydrophobicContact CD1-CE 3.8Å; Y87-M158 HydrophobicContact CD1-CG 3.8Å; Y87-M158 HydrophobicContact CD1-SD 3.83Å; Y87-M158 HydrophobicContact CD2-CB 3.94Å; Y87-M158 HydrophobicContact CD2-CG 3.76Å; Y87-M158 HydrophobicContact CE1-CE 4.12Å; Y87-M158 HydrophobicContact CE1-CG 4.21Å; Y87-M158 HydrophobicContact CE2-CG 4.19Å; Y87-M158 HydrophobicContact CG-CB 3.96Å; Y87-M158 HydrophobicContact CG-CE 4.43Å; Y87-M158 HydrophobicContact CG-CG 3.54Å; Y87-M158 HydrophobicContact CG-SD 3.87Å; Y87-F161 HydrophobicContact CD2-CB 4.17Å; Y87-F161 AromaticContact CD2-CD1 3.85Å; Y87-F161 HydrophobicContact CD2-CD1 3.85Å; Y87-F161 HydrophobicContact CD2-CG 4.09Å; Y87-F161 HydrophobicContact CE2-CB 4.01Å; Y87-F161 AromaticContact CE2-CD1 3.82Å; Y87-F161 HydrophobicContact CE2-CD1 3.82Å; Y87-F161 HydrophobicContact CE2-CD2 4.18Å; Y87-F161 HydrophobicContact CE2-CE1 4.36Å; Y87-F161 AromaticContact CE2-CG 3.74Å; Y87-F161 HydrophobicContact CE2-CG 3.74Å
88	G	94	Very high	91.1	Very high	25 Å²	25	43.2 Å²	43.2	26%	0.258	21%	0.209	S	C	.	.	H	α-helix	trans	-63.9	-29.7	172.8	0	0	0	0	0	113.8	E84 E85 R92	E84-G88 PolarHBondContact O-N 3.03Å; E85-G88 CarbonylContact O-C 3.26Å; E85-G88 PolarHBondContact O-N 2.79Å; G88-R92 WeakPolarHBondContact O-CG 3.38Å; G88-R92 PolarHBondContact O-N 3.37Å; G88-R92 PolarHBondContact O-NE 2.97Å
89	L	94.8	Very high	90	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.021	21%	0.206	C	C	.	.	H	α-helix	trans	-72.4	-46.6	168	-76.3	164.6	0	0	0	111.4	F81 E85 L86 Y87 L91 R92 F93 Y175 H179	F81-L89 HydrophobicContact CD1-CD1 3.9Å; F81-L89 HydrophobicContact CD2-CD1 3.92Å; F81-L89 HydrophobicContact CE1-CD1 3.76Å; F81-L89 HydrophobicContact CE2-CD1 3.79Å; F81-L89 HydrophobicContact CG-CD1 3.97Å; F81-L89 HydrophobicContact CZ-CD1 3.71Å; E85-L89 WeakPolarHBondContact O-CG 3.42Å; E85-L89 PolarHBondContact O-N 3.15Å; L86-L89 WeakPolarHBondContact O-CB 3.44Å; L86-L89 PolarHBondContact O-N 3.37Å; Y87-L89 VanDerWaalsContact C-N 3.28Å; Y87-L89 PolarHBondContact O-N 3.47Å; L89-L91 PolarHBondContact O-N 3.34Å; L89-R92 VanDerWaalsContact CD2-NH2 3.35Å; L89-R92 PolarHBondContact O-N 3.44Å; L89-F93 WeakPolarHBondContact O-CB 3.5Å; L89-F93 PolarHBondContact O-N 2.9Å; L89-Y175 HydrophobicContact CB-CE1 4.15Å; L89-Y175 HydrophobicContact CD2-CE1 3.81Å; L89-H179 HydrophobicContact CD1-CB 4.49Å; L89-H179 HydrophobicContact CD2-CB 4.11Å; L89-H179 WeakPolarHBondContact CD2-CD2 3.14Å
90	A	94.2	Very high	89.1	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.1	-48.5	178	0	0	0	0	0	112.2	L86 Y87 R92 F93 F94 F161 V162 L165 F172	L86-A90 WeakPolarHBondContact O-CB 3.22Å; L86-A90 PolarHBondContact O-N 3.24Å; Y87-A90 WeakPolarHBondContact O-CB 3.31Å; Y87-A90 PolarHBondContact O-N 3.04Å; A90-R92 VanDerWaalsContact C-N 3.34Å; A90-R92 PolarHBondContact O-N 3.29Å; A90-F93 PolarHBondContact O-N 2.95Å; A90-F94 WeakPolarHBondContact O-CB 3.39Å; A90-F94 PolarHBondContact O-N 3.44Å; A90-F161 HydrophobicContact CB-CD1 3.88Å; A90-F161 HydrophobicContact CB-CE1 3.74Å; A90-V162 HydrophobicContact CB-CG2 3.93Å; A90-L165 HydrophobicContact CB-CD2 3.58Å; A90-L165 WeakPolarHBondContact O-CD2 3.35Å; A90-F172 HydrophobicContact CB-CE1 4.45Å; A90-F172 HydrophobicContact CB-CE2 3.86Å; A90-F172 HydrophobicContact CB-CZ 3.63Å
91	L	92.9	Very high	87.6	Confident	22 Å²	22	46.6 Å²	46.6	12%	0.115	24%	0.242	C	C	.	.	H	α-helix	trans	-65.7	-35	-179.4	-175	64.1	0	0	0	112.4	Y87 L89 K95 H116 F161 W515	Y87-L91 HydrophobicContact CE1-CD2 4.39Å; Y87-L91 WeakPolarHBondContact O-CB 3.41Å; Y87-L91 PolarHBondContact O-N 3.22Å; L89-L91 PolarHBondContact O-N 3.34Å; L91-K95 HydrophobicContact CD1-CD 4.41Å; L91-K95 HydrophobicContact CG-CD 4.19Å; L91-K95 WeakPolarHBondContact O-CB 3.38Å; L91-K95 WeakPolarHBondContact O-CD 3.33Å; L91-K95 VanDerWaalsContact O-CG 3.23Å; L91-K95 WeakPolarHBondContact O-CG 3.33Å; L91-K95 PolarHBondContact O-N 3.43Å; L91-K95 VanDerWaalsContact O-N 3.07Å; L91-H116 VanDerWaalsContact CD2-CE1 3.42Å; L91-H116 WeakPolarHBondContact CD2-CE1 3.39Å; L91-F161 HydrophobicContact CB-CE1 4.44Å; L91-F161 HydrophobicContact CD1-CE2 4.4Å; L91-F161 HydrophobicContact CD1-CZ 3.93Å; L91-W515 HydrophobicContact CD1-CH2 3.96Å; L91-W515 HydrophobicContact CD1-CZ3 4.05Å
92	R	91.4	Very high	86.4	Confident	125 Å²	125	46.6 Å²	46.6	47%	0.472	24%	0.243	S	C	.	.	H	α-helix	trans	-67.1	-50.3	172.3	-80.3	-177.3	-72.6	168	-3.5	111.4	G88 L89 A90 F94 K95 E96	G88-R92 WeakPolarHBondContact O-CG 3.38Å; G88-R92 PolarHBondContact O-N 3.37Å; G88-R92 PolarHBondContact O-NE 2.97Å; L89-R92 VanDerWaalsContact CD2-NH2 3.35Å; L89-R92 PolarHBondContact O-N 3.44Å; A90-R92 VanDerWaalsContact C-N 3.34Å; A90-R92 PolarHBondContact O-N 3.29Å; R92-F94 VanDerWaalsContact C-N 3.31Å; R92-F94 PolarHBondContact O-N 2.89Å; R92-K95 PolarHBondContact O-N 3.3Å; R92-E96 WeakPolarHBondContact O-CB 3.37Å; R92-E96 WeakPolarHBondContact O-CG 3.33Å; R92-E96 PolarHBondContact O-N 3.4Å
93	F	91.7	Very high	85.3	Confident	8 Å²	8	53.1 Å²	53.1	4%	0.035	27%	0.268	C	S	.	.	H	α-helix	trans	-55.4	-46.8	176.5	-175.3	-89.5	0	0	0	111.4	L89 A90 E96 K97 F102 L165 C169 L171 F172 Y175	L89-F93 WeakPolarHBondContact O-CB 3.5Å; L89-F93 PolarHBondContact O-N 2.9Å; A90-F93 PolarHBondContact O-N 2.95Å; F93-E96 PolarHBondContact O-N 3.37Å; F93-K97 HydrophobicContact CD1-CB 4.5Å; F93-K97 HydrophobicContact CD1-CG 4.41Å; F93-K97 HydrophobicContact CD2-CG 3.95Å; F93-K97 HydrophobicContact CE1-CB 4.31Å; F93-K97 HydrophobicContact CE1-CG 4.36Å; F93-K97 HydrophobicContact CE2-CG 3.92Å; F93-K97 HydrophobicContact CG-CG 4.21Å; F93-K97 HydrophobicContact CZ-CB 4.38Å; F93-K97 HydrophobicContact CZ-CG 4.12Å; F93-K97 VanDerWaalsContact O-CB 3.22Å; F93-K97 WeakPolarHBondContact O-CB 3.22Å; F93-K97 VanDerWaalsContact O-CG 3.25Å; F93-K97 WeakPolarHBondContact O-CG 3.28Å; F93-K97 PolarHBondContact O-N 3.47Å; F93-F102 HydrophobicContact CD1-CE1 4.02Å; F93-F102 AromaticContact CE1-CD1 3.98Å; F93-F102 HydrophobicContact CE1-CD1 3.98Å; F93-F102 AromaticContact CE1-CE1 3.56Å; F93-F102 HydrophobicContact CE1-CE1 3.56Å; F93-F102 HydrophobicContact CE1-CZ 4.49Å; F93-L165 HydrophobicContact CB-CD2 4.47Å; F93-L165 HydrophobicContact CD1-CD1 4.29Å; F93-L165 HydrophobicContact CD1-CD2 4.1Å; F93-L165 HydrophobicContact CD1-CG 4.39Å; F93-C169 HydrophobicContact CE1-CB 4.01Å; F93-C169 HydrophobicContact CZ-CB 4.5Å; F93-L171 HydrophobicContact CZ-CB 4.08Å; F93-F172 HydrophobicContact CB-CD2 3.9Å; F93-F172 HydrophobicContact CB-CE2 4.33Å; F93-F172 HydrophobicContact CD1-CB 4.07Å; F93-F172 HydrophobicContact CD1-CD2 4.01Å; F93-F172 HydrophobicContact CD1-CG 4.44Å; F93-F172 HydrophobicContact CD2-CD2 4.29Å; F93-F172 HydrophobicContact CE1-CB 3.9Å; F93-F172 HydrophobicContact CG-CB 4.48Å; F93-F172 AromaticContact CG-CD2 3.81Å; F93-F172 HydrophobicContact CG-CD2 3.81Å; F93-F172 HydrophobicContact CZ-CB 4.16Å; F93-Y175 HydrophobicContact CB-CD1 3.94Å; F93-Y175 HydrophobicContact CB-CE1 3.83Å; F93-Y175 AromaticContact CD2-CD1 3.62Å; F93-Y175 HydrophobicContact CD2-CD1 3.62Å; F93-Y175 HydrophobicContact CD2-CD2 4.08Å; F93-Y175 HydrophobicContact CD2-CE1 4.2Å; F93-Y175 AromaticContact CD2-CG 3.55Å; F93-Y175 HydrophobicContact CD2-CG 3.55Å; F93-Y175 HydrophobicContact CE2-CG 4.15Å; F93-Y175 HydrophobicContact CG-CD1 4.14Å; F93-Y175 HydrophobicContact CG-CE1 4.48Å; F93-Y175 HydrophobicContact CG-CG 4.5Å
94	F	89.4	Confident	84.6	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-57.3	-56.3	175.7	-174	-107.3	0	0	0	111.8	A90 R92 E96 K97 D98 F102 K109 L112 F161 L165 W515	A90-F94 WeakPolarHBondContact O-CB 3.39Å; A90-F94 PolarHBondContact O-N 3.44Å; R92-F94 VanDerWaalsContact C-N 3.31Å; R92-F94 PolarHBondContact O-N 2.89Å; F94-E96 PolarHBondContact O-N 3.04Å; F94-E96 VanDerWaalsContact O-N 3.17Å; F94-K97 PolarHBondContact O-N 3.49Å; F94-D98 WeakPolarHBondContact O-CB 3.47Å; F94-D98 PolarHBondContact O-N 3.19Å; F94-F102 HydrophobicContact CD2-CE2 4.39Å; F94-F102 AromaticContact CD2-CZ 3.87Å; F94-F102 HydrophobicContact CD2-CZ 3.87Å; F94-F102 HydrophobicContact CE2-CE2 4.48Å; F94-F102 HydrophobicContact CE2-CZ 4.36Å; F94-K109 HydrophobicContact CZ-CG 4.28Å; F94-L112 HydrophobicContact CD2-CD1 3.83Å; F94-L112 HydrophobicContact CE2-CB 4.26Å; F94-L112 HydrophobicContact CE2-CD1 3.42Å; F94-L112 VanDerWaalsContact CE2-CD1 3.42Å; F94-L112 HydrophobicContact CE2-CG 4.45Å; F94-L112 HydrophobicContact CZ-CB 4.11Å; F94-L112 HydrophobicContact CZ-CD1 4.1Å; F94-F161 HydrophobicContact CB-CZ 4.13Å; F94-F161 HydrophobicContact CD1-CZ 4.34Å; F94-F161 HydrophobicContact CG-CZ 4.22Å; F94-L165 HydrophobicContact CB-CD1 4.1Å; F94-L165 HydrophobicContact CB-CD2 4.43Å; F94-L165 HydrophobicContact CD2-CD1 3.74Å; F94-L165 HydrophobicContact CG-CD1 4.38Å; F94-W515 AromaticContact CD1-CZ2 3.91Å; F94-W515 HydrophobicContact CD1-CZ2 3.91Å; F94-W515 AromaticContact CE1-CE2 3.67Å; F94-W515 AromaticContact CE1-CZ2 3.5Å; F94-W515 HydrophobicContact CE1-CZ2 3.5Å; F94-W515 VanDerWaalsContact CE1-CZ2 3.5Å; F94-W515 AromaticContact CE1-NE1 3.53Å
95	K	85.5	Confident	84.2	Confident	73 Å²	73	50.8 Å²	50.8	32%	0.317	26%	0.263	S	S	.	.	H	α-helix	trans	-60.3	-26.1	-179.2	-74.1	171.2	177.4	177.6	0	114.9	L91 R92 W515 R516	L91-K95 HydrophobicContact CD1-CD 4.41Å; L91-K95 HydrophobicContact CG-CD 4.19Å; L91-K95 WeakPolarHBondContact O-CB 3.38Å; L91-K95 WeakPolarHBondContact O-CD 3.33Å; L91-K95 VanDerWaalsContact O-CG 3.23Å; L91-K95 WeakPolarHBondContact O-CG 3.33Å; L91-K95 PolarHBondContact O-N 3.43Å; L91-K95 VanDerWaalsContact O-N 3.07Å; R92-K95 PolarHBondContact O-N 3.3Å; K95-W515 HydrophobicContact CD-CE3 4.23Å; K95-W515 HydrophobicContact CG-CD2 4.19Å; K95-W515 HydrophobicContact CG-CE3 3.99Å; K95-W515 HydrophobicContact CG-CZ3 4.42Å; K95-R516 PolarHBondContact O-NH2 3.14Å
96	E	84.4	Confident	83.6	Confident	86 Å²	86	51.9 Å²	51.9	40%	0.402	27%	0.265	S	S	.	.	H	α-helix	trans	-90.7	-34.3	179.2	-77.3	-176	-149.7	0	0	114.4	R92 F93 F94	R92-E96 WeakPolarHBondContact O-CB 3.37Å; R92-E96 WeakPolarHBondContact O-CG 3.33Å; R92-E96 PolarHBondContact O-N 3.4Å; F93-E96 PolarHBondContact O-N 3.37Å; F94-E96 PolarHBondContact O-N 3.04Å; F94-E96 VanDerWaalsContact O-N 3.17Å
97	K	81.6	Confident	83.2	Confident	64 Å²	64	58.5 Å²	58.5	28%	0.278	30%	0.296	S	S	.	.	H	α-helix	trans	-112.8	-15.6	-164.7	-51.4	-51.8	172.4	-152.9	0	114.2	F93 F94 G99 K100 A101 F102	F93-K97 HydrophobicContact CD1-CB 4.5Å; F93-K97 HydrophobicContact CD1-CG 4.41Å; F93-K97 HydrophobicContact CD2-CG 3.95Å; F93-K97 HydrophobicContact CE1-CB 4.31Å; F93-K97 HydrophobicContact CE1-CG 4.36Å; F93-K97 HydrophobicContact CE2-CG 3.92Å; F93-K97 HydrophobicContact CG-CG 4.21Å; F93-K97 HydrophobicContact CZ-CB 4.38Å; F93-K97 HydrophobicContact CZ-CG 4.12Å; F93-K97 VanDerWaalsContact O-CB 3.22Å; F93-K97 WeakPolarHBondContact O-CB 3.22Å; F93-K97 VanDerWaalsContact O-CG 3.25Å; F93-K97 WeakPolarHBondContact O-CG 3.28Å; F93-K97 PolarHBondContact O-N 3.47Å; F94-K97 PolarHBondContact O-N 3.49Å; K97-G99 PolarHBondContact O-N 3.41Å; K97-K100 PolarHBondContact O-N 2.84Å; K97-A101 HydrophobicContact CB-CB 4.13Å; K97-A101 PolarHBondContact O-N 2.96Å; K97-F102 HydrophobicContact CB-CD1 4.09Å; K97-F102 HydrophobicContact CB-CE1 3.83Å; K97-F102 PolarHBondContact O-N 2.84Å
98	D	78.7	Confident	82.9	Confident	35 Å²	35	60 Å²	60	19%	0.187	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-50.3	125.6	165.6	170.6	40.7	0	0	0	110.6	F94 K100 K109	F94-D98 WeakPolarHBondContact O-CB 3.47Å; F94-D98 PolarHBondContact O-N 3.19Å; D98-K100 PolarHBondContact O-N 3.42Å; D98-K109 IonicContact OD1-NZ 3.51Å; D98-K109 PolarHBondContact OD1-NZ 2.87Å; D98-K109 WeakPolarHBondContact OD2-CE 3.47Å; D98-K109 IonicContact OD2-NZ 3.99Å; D98-K109 PolarHBondContact OD2-NZ 3.43Å
99	G	68.3	Low	82.6	Confident	47 Å²	47	61.7 Å²	61.7	49%	0.485	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	14.8	-177.3	0	0	0	0	0	115.1	K97 F102	K97-G99 PolarHBondContact O-N 3.41Å; G99-F102 PolarHBondContact N-O 3.27Å; G99-F102 VanDerWaalsContact N-O 3.15Å
100	K	71.1	Confident	82.3	Confident	163 Å²	163	62 Å²	62	71%	0.709	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.3	-50.8	178.5	-64.1	-171.6	-172.9	174.2	0	114.3	K97 D98	K97-K100 PolarHBondContact O-N 2.84Å; D98-K100 PolarHBondContact O-N 3.42Å
101	A	60.3	Low	82.3	Confident	53 Å²	53	64.3 Å²	64.3	44%	0.438	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-13.2	-179.4	0	0	0	0	0	113.2	K97	K97-A101 HydrophobicContact CB-CB 4.13Å; K97-A101 PolarHBondContact O-N 2.96Å
102	F	66.9	Low	82.3	Confident	13 Å²	13	63.2 Å²	63.2	6%	0.057	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-148.9	160.1	163.8	67.9	-81.8	0	0	0	110.3	F93 F94 K97 G99 L165 C168 C169	F93-F102 HydrophobicContact CD1-CE1 4.02Å; F93-F102 AromaticContact CE1-CD1 3.98Å; F93-F102 HydrophobicContact CE1-CD1 3.98Å; F93-F102 AromaticContact CE1-CE1 3.56Å; F93-F102 HydrophobicContact CE1-CE1 3.56Å; F93-F102 HydrophobicContact CE1-CZ 4.49Å; F94-F102 HydrophobicContact CD2-CE2 4.39Å; F94-F102 AromaticContact CD2-CZ 3.87Å; F94-F102 HydrophobicContact CD2-CZ 3.87Å; F94-F102 HydrophobicContact CE2-CE2 4.48Å; F94-F102 HydrophobicContact CE2-CZ 4.36Å; K97-F102 HydrophobicContact CB-CD1 4.09Å; K97-F102 HydrophobicContact CB-CE1 3.83Å; K97-F102 PolarHBondContact O-N 2.84Å; G99-F102 PolarHBondContact N-O 3.27Å; G99-F102 VanDerWaalsContact N-O 3.15Å; F102-L165 HydrophobicContact CE1-CD1 4.43Å; F102-L165 HydrophobicContact CE2-CD1 4.34Å; F102-L165 HydrophobicContact CZ-CD1 3.74Å; F102-C168 HydrophobicContact CD2-CB 4.49Å; F102-C168 HydrophobicContact CE2-CB 4.44Å; F102-C169 HydrophobicContact CB-CB 3.98Å; F102-C169 HydrophobicContact CD1-CB 3.63Å; F102-C169 VanDerWaalsContact CD1-SG 3.57Å; F102-C169 HydrophobicContact CD2-CB 4.05Å; F102-C169 HydrophobicContact CE1-CB 4.09Å; F102-C169 HydrophobicContact CE2-CB 4.49Å; F102-C169 HydrophobicContact CG-CB 3.62Å
103	H	71.9	Confident	82.2	Confident	155 Å²	155	57.8 Å²	57.8	72%	0.718	29%	0.29	S	S	*	.			trans	-124.3	92.5	174.4	-58	93	0	0	0	106.6
104	S	78.8	Confident	82.3	Confident	17 Å²	17	57.5 Å²	57.5	12%	0.119	29%	0.289	C	S	.	.			trans	-64.2	153.9	168.7	55.6	0	0	0	0	109.5	E108	S104-E108 VanDerWaalsContact CA-OE2 3.28Å; S104-E108 WeakPolarHBondContact CA-OE2 3.43Å; S104-E108 WeakPolarHBondContact CB-OE2 3.3Å
105	T	85.2	Confident	82.5	Confident	73 Å²	73	57.6 Å²	57.6	45%	0.448	29%	0.289	S	S	.	.			trans	-62.5	164.9	174	77.5	0	0	0	0	110.8	E107 E108 K109	T105-E107 VanDerWaalsContact C-N 3.31Å; T105-E107 PolarHBondContact O-N 3.45Å; T105-E107 PolarHBondContact OG1-N 2.93Å; T105-E108 HydrophobicContact CG2-CG 4.43Å; T105-E108 PolarHBondContact N-OE2 3.48Å; T105-E108 PolarHBondContact O-N 3.39Å; T105-E108 WeakPolarHBondContact OG1-CG 3.39Å; T105-E108 PolarHBondContact OG1-N 2.97Å; T105-K109 VanDerWaalsContact O-CB 3.26Å; T105-K109 WeakPolarHBondContact O-CB 3.35Å; T105-K109 PolarHBondContact O-N 3.01Å
106	Y	82.7	Confident	82.9	Confident	113 Å²	113	54.5 Å²	54.5	44%	0.443	28%	0.276	S	S	.	.	H	α-helix	trans	-56.9	-46.7	173.5	175.7	-113.5	0	0	0	111.3	K109 L110 L138 D141	Y106-K109 WeakPolarHBondContact O-CB 3.34Å; Y106-K109 PolarHBondContact O-N 2.9Å; Y106-L110 HydrophobicContact CE1-CD2 4.24Å; Y106-L110 HydrophobicContact CE2-CD1 4.34Å; Y106-L110 VanDerWaalsContact O-CB 3.32Å; Y106-L110 WeakPolarHBondContact O-CB 3.48Å; Y106-L110 PolarHBondContact O-N 3.39Å; Y106-L138 HydrophobicContact CE2-CD2 3.92Å; Y106-L138 VanDerWaalsContact OH-CD2 3.29Å; Y106-L138 WeakPolarHBondContact OH-CD2 3.46Å; Y106-D141 VanDerWaalsContact CE1-OD2 3.25Å; Y106-D141 WeakPolarHBondContact CE1-OD2 3.31Å; Y106-D141 VanDerWaalsContact OH-CB 3.28Å; Y106-D141 WeakPolarHBondContact OH-CB 3.4Å; Y106-D141 PolarHBondContact OH-OD2 3.34Å
107	E	87.6	Confident	83	Confident	139 Å²	139	54.9 Å²	54.9	65%	0.65	28%	0.276	S	S	*	.	H	α-helix	trans	-59.5	-49.2	176	-175.2	-168.1	160.7	0	0	112.7	T105 K109 L110 K111	T105-E107 VanDerWaalsContact C-N 3.31Å; T105-E107 PolarHBondContact O-N 3.45Å; T105-E107 PolarHBondContact OG1-N 2.93Å; E107-K109 VanDerWaalsContact C-N 3.28Å; E107-K109 PolarHBondContact O-N 3.27Å; E107-L110 WeakPolarHBondContact O-CB 3.45Å; E107-L110 PolarHBondContact O-N 3.37Å; E107-L110 VanDerWaalsContact O-N 3.17Å; E107-K111 PolarHBondContact O-N 3.42Å
108	E	89.3	Confident	83.6	Confident	46 Å²	46	51.9 Å²	51.9	22%	0.215	26%	0.263	C	S	.	.	H	α-helix	trans	-59.8	-40.2	176.5	-72.8	179	136.9	0	0	111.7	S104 T105 L112 L164 C168	S104-E108 VanDerWaalsContact CA-OE2 3.28Å; S104-E108 WeakPolarHBondContact CA-OE2 3.43Å; S104-E108 WeakPolarHBondContact CB-OE2 3.3Å; T105-E108 HydrophobicContact CG2-CG 4.43Å; T105-E108 PolarHBondContact N-OE2 3.48Å; T105-E108 PolarHBondContact O-N 3.39Å; T105-E108 WeakPolarHBondContact OG1-CG 3.39Å; T105-E108 PolarHBondContact OG1-N 2.97Å; E108-L112 WeakPolarHBondContact O-CB 3.37Å; E108-L112 VanDerWaalsContact O-CG 3.27Å; E108-L112 WeakPolarHBondContact O-CG 3.48Å; E108-L112 PolarHBondContact O-N 2.88Å; E108-L164 HydrophobicContact CG-CD1 4.4Å; E108-C168 PolarHBondContact OE1-SG 3.21Å
109	K	87.8	Confident	84.3	Confident	59 Å²	59	50.9 Å²	50.9	26%	0.257	26%	0.258	S	S	.	.	H	α-helix	trans	-66.8	-39.9	177.1	-173	167.2	-167.4	149.6	0	111.7	F94 D98 T105 Y106 E107 V113	F94-K109 HydrophobicContact CZ-CG 4.28Å; D98-K109 IonicContact OD1-NZ 3.51Å; D98-K109 PolarHBondContact OD1-NZ 2.87Å; D98-K109 WeakPolarHBondContact OD2-CE 3.47Å; D98-K109 IonicContact OD2-NZ 3.99Å; D98-K109 PolarHBondContact OD2-NZ 3.43Å; T105-K109 VanDerWaalsContact O-CB 3.26Å; T105-K109 WeakPolarHBondContact O-CB 3.35Å; T105-K109 PolarHBondContact O-N 3.01Å; Y106-K109 WeakPolarHBondContact O-CB 3.34Å; Y106-K109 PolarHBondContact O-N 2.9Å; E107-K109 VanDerWaalsContact C-N 3.28Å; E107-K109 PolarHBondContact O-N 3.27Å; K109-V113 WeakPolarHBondContact O-CB 3.44Å; K109-V113 VanDerWaalsContact O-CG2 3.25Å; K109-V113 WeakPolarHBondContact O-CG2 3.41Å; K109-V113 PolarHBondContact O-N 2.95Å
110	L	89.4	Confident	85.2	Confident	11 Å²	11	53 Å²	53	6%	0.058	26%	0.258	C	S	.	.	H	α-helix	trans	-63.4	-47	176.7	-152.9	67.1	0	0	0	110.5	Y106 E107 V113 A114 D141 R142 E145	Y106-L110 HydrophobicContact CE1-CD2 4.24Å; Y106-L110 HydrophobicContact CE2-CD1 4.34Å; Y106-L110 VanDerWaalsContact O-CB 3.32Å; Y106-L110 WeakPolarHBondContact O-CB 3.48Å; Y106-L110 PolarHBondContact O-N 3.39Å; E107-L110 WeakPolarHBondContact O-CB 3.45Å; E107-L110 PolarHBondContact O-N 3.37Å; E107-L110 VanDerWaalsContact O-N 3.17Å; L110-V113 WeakPolarHBondContact O-CB 3.49Å; L110-V113 PolarHBondContact O-N 2.92Å; L110-A114 PolarHBondContact O-N 3.26Å; L110-D141 HydrophobicContact CD1-CB 4.06Å; L110-D141 HydrophobicContact CD2-CB 3.79Å; L110-R142 HydrophobicContact CD1-CB 4.29Å; L110-R142 HydrophobicContact CD1-CG 3.5Å; L110-E145 HydrophobicContact CB-CG 4.07Å; L110-E145 HydrophobicContact CD2-CB 4.43Å; L110-E145 HydrophobicContact CD2-CG 3.35Å; L110-E145 HydrophobicContact CG-CB 4.18Å; L110-E145 HydrophobicContact CG-CG 3.51Å
111	K	92.8	Very high	85.9	Confident	48 Å²	48	51.3 Å²	51.3	21%	0.209	25%	0.254	C	S	.	.	H	α-helix	trans	-67.1	-39.8	176.7	-170.4	157.6	-175.3	159.1	0	113	E107 V113 A114 L115 L164 E346	E107-K111 PolarHBondContact O-N 3.42Å; K111-V113 VanDerWaalsContact C-N 3.3Å; K111-V113 PolarHBondContact O-N 3.46Å; K111-A114 PolarHBondContact O-N 3.37Å; K111-L115 HydrophobicContact CG-CD1 4.01Å; K111-L115 HydrophobicContact CG-CG 4.47Å; K111-L115 WeakPolarHBondContact O-CB 3.32Å; K111-L115 WeakPolarHBondContact O-CD1 3.35Å; K111-L115 WeakPolarHBondContact O-CG 3.43Å; K111-L115 PolarHBondContact O-N 3.27Å; K111-L164 HydrophobicContact CB-CD2 3.99Å; K111-L164 HydrophobicContact CD-CD2 4.32Å; K111-L164 HydrophobicContact CG-CD2 3.87Å; K111-E346 IonicContact NZ-OE1 2.67Å; K111-E346 PolarHBondContact NZ-OE1 2.99Å
112	L	92.8	Very high	87.2	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.7	-35.2	172.1	-74.5	169	0	0	0	112.3	F94 E108 H116 F161 L164 L165	F94-L112 HydrophobicContact CD2-CD1 3.83Å; F94-L112 HydrophobicContact CE2-CB 4.26Å; F94-L112 HydrophobicContact CE2-CD1 3.42Å; F94-L112 VanDerWaalsContact CE2-CD1 3.42Å; F94-L112 HydrophobicContact CE2-CG 4.45Å; F94-L112 HydrophobicContact CZ-CB 4.11Å; F94-L112 HydrophobicContact CZ-CD1 4.1Å; E108-L112 WeakPolarHBondContact O-CB 3.37Å; E108-L112 VanDerWaalsContact O-CG 3.27Å; E108-L112 WeakPolarHBondContact O-CG 3.48Å; E108-L112 PolarHBondContact O-N 2.88Å; L112-H116 WeakPolarHBondContact O-CB 3.42Å; L112-H116 PolarHBondContact O-N 3.37Å; L112-F161 HydrophobicContact CB-CD2 4.32Å; L112-F161 HydrophobicContact CB-CE2 4Å; L112-F161 HydrophobicContact CD2-CD1 4.34Å; L112-F161 HydrophobicContact CD2-CD2 3.61Å; L112-F161 HydrophobicContact CD2-CE1 4.46Å; L112-F161 HydrophobicContact CD2-CE2 3.77Å; L112-F161 HydrophobicContact CD2-CG 3.91Å; L112-F161 HydrophobicContact CD2-CZ 4.19Å; L112-F161 HydrophobicContact CG-CE2 4.49Å; L112-F161 WeakPolarHBondContact O-CD2 3.34Å; L112-F161 VanDerWaalsContact O-CE2 3.27Å; L112-F161 WeakPolarHBondContact O-CE2 3.31Å; L112-L164 HydrophobicContact CD1-CG 4.46Å; L112-L164 HydrophobicContact CD2-CB 4.01Å; L112-L164 HydrophobicContact CD2-CD2 3.84Å; L112-L164 HydrophobicContact CD2-CG 3.87Å; L112-L164 HydrophobicContact CG-CD2 3.71Å; L112-L164 HydrophobicContact CG-CG 3.97Å; L112-L165 HydrophobicContact CD1-CD1 4.47Å; L112-L165 HydrophobicContact CD2-CB 4.37Å
113	V	90.6	Very high	88.3	Confident	11 Å²	11	52 Å²	52	7%	0.067	26%	0.26	C	S	.	.	H	α-helix	trans	-67.8	-46.8	172.7	164.1	0	0	0	0	111.7	K109 L110 K111 L115 H116 K117 L514 W515	K109-V113 WeakPolarHBondContact O-CB 3.44Å; K109-V113 VanDerWaalsContact O-CG2 3.25Å; K109-V113 WeakPolarHBondContact O-CG2 3.41Å; K109-V113 PolarHBondContact O-N 2.95Å; L110-V113 WeakPolarHBondContact O-CB 3.49Å; L110-V113 PolarHBondContact O-N 2.92Å; K111-V113 VanDerWaalsContact C-N 3.3Å; K111-V113 PolarHBondContact O-N 3.46Å; V113-L115 PolarHBondContact O-N 2.91Å; V113-H116 PolarHBondContact O-N 2.93Å; V113-K117 PolarHBondContact O-N 3.5Å; V113-L514 HydrophobicContact CB-CD2 4.28Å; V113-L514 HydrophobicContact CG1-CD2 3.56Å; V113-L514 HydrophobicContact CG2-CD1 3.55Å; V113-L514 HydrophobicContact CG2-CD2 3.67Å; V113-L514 HydrophobicContact CG2-CG 4.1Å; V113-W515 HydrophobicContact CG2-CZ2 3.96Å
114	A	92.2	Very high	89	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.008	23%	0.234	C	C	.	.	H	α-helix	trans	-58	-48.3	177.3	0	0	0	0	0	111.2	L110 K111 H116 K117 Q118 E145 W146 L149	L110-A114 PolarHBondContact O-N 3.26Å; K111-A114 PolarHBondContact O-N 3.37Å; A114-H116 VanDerWaalsContact C-N 3.32Å; A114-H116 PolarHBondContact O-N 3.04Å; A114-K117 WeakPolarHBondContact O-CB 3.21Å; A114-K117 PolarHBondContact O-N 3.48Å; A114-K117 VanDerWaalsContact O-N 3.11Å; A114-Q118 PolarHBondContact O-N 3.34Å; A114-E145 HydrophobicContact CB-CB 3.89Å; A114-W146 HydrophobicContact CB-CB 4.13Å; A114-L149 VanDerWaalsContact C-CD1 3.45Å; A114-L149 HydrophobicContact CB-CD1 3.85Å; A114-L149 HydrophobicContact CB-CG 4.36Å; A114-L149 WeakPolarHBondContact O-CD1 3.37Å
115	L	94.8	Very high	89.1	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-60.7	-39.6	175.7	-68.8	162.8	0	0	0	111.6	K111 V113 Q118 V119 L149 M152 A157 E160 F161 L164	K111-L115 HydrophobicContact CG-CD1 4.01Å; K111-L115 HydrophobicContact CG-CG 4.47Å; K111-L115 WeakPolarHBondContact O-CB 3.32Å; K111-L115 WeakPolarHBondContact O-CD1 3.35Å; K111-L115 WeakPolarHBondContact O-CG 3.43Å; K111-L115 PolarHBondContact O-N 3.27Å; V113-L115 PolarHBondContact O-N 2.91Å; L115-Q118 PolarHBondContact O-N 2.91Å; L115-V119 WeakPolarHBondContact O-CG2 3.41Å; L115-V119 PolarHBondContact O-N 3.49Å; L115-V119 VanDerWaalsContact O-N 3.09Å; L115-L149 HydrophobicContact CD2-CD1 3.99Å; L115-L149 HydrophobicContact CD2-CD2 4.15Å; L115-L149 HydrophobicContact CG-CD1 4.2Å; L115-M152 HydrophobicContact CD2-SD 3.67Å; L115-A157 HydrophobicContact CD2-CB 4.04Å; L115-E160 HydrophobicContact CD1-CB 4.25Å; L115-E160 HydrophobicContact CD2-CB 4.07Å; L115-F161 HydrophobicContact CB-CB 4.19Å; L115-F161 HydrophobicContact CB-CD2 4.14Å; L115-F161 HydrophobicContact CD1-CB 4.43Å; L115-L164 HydrophobicContact CD1-CD2 4.16Å
116	H	93.1	Very high	88.6	Confident	9 Å²	9	48.9 Å²	48.9	4%	0.042	25%	0.245	C	C	.	.	H	α-helix	trans	-65.4	-37.6	173.9	-177.7	58.4	0	0	0	113.1	Y87 L91 L112 V113 A114 L120 F161 R399 W515	Y87-H116 AromaticContact CZ-ND1 3.99Å; Y87-H116 PolarHBondContact OH-ND1 2.91Å; L91-H116 VanDerWaalsContact CD2-CE1 3.42Å; L91-H116 WeakPolarHBondContact CD2-CE1 3.39Å; L112-H116 WeakPolarHBondContact O-CB 3.42Å; L112-H116 PolarHBondContact O-N 3.37Å; V113-H116 PolarHBondContact O-N 2.93Å; A114-H116 VanDerWaalsContact C-N 3.32Å; A114-H116 PolarHBondContact O-N 3.04Å; H116-L120 VanDerWaalsContact NE2-CD1 3.32Å; H116-L120 WeakPolarHBondContact NE2-CD1 3.32Å; H116-L120 WeakPolarHBondContact O-CG 3.46Å; H116-L120 PolarHBondContact O-N 2.99Å; H116-F161 HydrophobicContact CB-CE2 4.3Å; H116-R399 PolarHBondContact NE2-NH1 3.37Å; H116-W515 HydrophobicContact CB-CH2 3.97Å; H116-W515 AromaticContact CD2-CH2 3.27Å; H116-W515 WeakPolarHBondContact CD2-CH2 3.28Å; H116-W515 AromaticContact CD2-CZ3 3.32Å; H116-W515 WeakPolarHBondContact CD2-CZ3 3.39Å; H116-W515 AromaticContact CG-CH2 3.62Å; H116-W515 AromaticContact NE2-CH2 3.95Å; H116-W515 AromaticContact NE2-CZ3 3.53Å
117	K	88	Confident	88	Confident	93 Å²	93	49.4 Å²	49.4	40%	0.404	26%	0.256	S	S	.	.	H	α-helix	trans	-64.7	-45.9	173.1	-82.6	-153.2	169.4	-159.9	0	111.2	V113 A114 V119 L120 M121 W146	V113-K117 PolarHBondContact O-N 3.5Å; A114-K117 WeakPolarHBondContact O-CB 3.21Å; A114-K117 PolarHBondContact O-N 3.48Å; A114-K117 VanDerWaalsContact O-N 3.11Å; K117-V119 VanDerWaalsContact C-N 3.28Å; K117-V119 PolarHBondContact O-N 3.06Å; K117-L120 PolarHBondContact O-N 3.19Å; K117-M121 PolarHBondContact O-N 3.38Å; K117-W146 HydrophobicContact CB-CD2 3.79Å; K117-W146 HydrophobicContact CB-CE3 4.24Å; K117-W146 HydrophobicContact CB-CG 4.09Å; K117-W146 HydrophobicContact CB-CZ2 4.35Å; K117-W146 HydrophobicContact CD-CD2 3.71Å; K117-W146 HydrophobicContact CD-CE3 3.25Å; K117-W146 HydrophobicContact CD-CG 4.44Å; K117-W146 HydrophobicContact CD-CH2 4.2Å; K117-W146 HydrophobicContact CD-CZ3 3.54Å; K117-W146 HydrophobicContact CG-CD2 4.42Å; K117-W146 HydrophobicContact CG-CE3 4.39Å
118	Q	92.8	Very high	86.9	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-55.7	-41.2	176.9	-162.3	77.8	6.1	0	0	112.4	A114 L115 L120 G122 L149 G150 M152 A157	A114-Q118 PolarHBondContact O-N 3.34Å; L115-Q118 PolarHBondContact O-N 2.91Å; Q118-L120 VanDerWaalsContact C-N 3.31Å; Q118-L120 PolarHBondContact O-N 3.48Å; Q118-G122 WeakPolarHBondContact CA-O 3.47Å; Q118-G122 VanDerWaalsContact O-CA 3.23Å; Q118-G122 WeakPolarHBondContact O-CA 3.42Å; Q118-G122 PolarHBondContact O-N 2.94Å; Q118-G122 PolarHBondContact OE1-O 3.39Å; Q118-L149 HydrophobicContact CB-CD1 3.84Å; Q118-L149 HydrophobicContact CG-CD1 4.25Å; Q118-G150 PolarHBondContact NE2-O 3.42Å; Q118-M152 HydrophobicContact CG-CB 4.28Å; Q118-M152 HydrophobicContact CG-CG 4.43Å; Q118-M152 PolarHBondContact NE2-O 3.32Å; Q118-A157 HydrophobicContact CB-CB 3.78Å; Q118-A157 HydrophobicContact CG-CB 3.87Å
119	V	92.9	Very high	85.3	Confident	14 Å²	14	45.9 Å²	45.9	9%	0.085	25%	0.248	C	C	.	.	H	α-helix	trans	-67.5	-27.3	176.9	172.9	0	0	0	0	113.6	Y87 L115 K117 K154 A157 M158	Y87-V119 HydrophobicContact CD1-CG1 4.42Å; Y87-V119 HydrophobicContact CE1-CB 4.38Å; Y87-V119 HydrophobicContact CE1-CG1 3.55Å; Y87-V119 HydrophobicContact CE2-CG2 4.15Å; Y87-V119 WeakPolarHBondContact OH-CB 3.5Å; Y87-V119 WeakPolarHBondContact OH-CG1 3.4Å; L115-V119 WeakPolarHBondContact O-CG2 3.41Å; L115-V119 PolarHBondContact O-N 3.49Å; L115-V119 VanDerWaalsContact O-N 3.09Å; K117-V119 VanDerWaalsContact C-N 3.28Å; K117-V119 PolarHBondContact O-N 3.06Å; V119-K154 HydrophobicContact CG1-CG 4.28Å; V119-A157 HydrophobicContact CG2-CB 3.57Å; V119-M158 HydrophobicContact CG1-CE 3.53Å; V119-M158 HydrophobicContact CG1-CG 4.05Å; V119-M158 HydrophobicContact CG2-CG 3.69Å
120	L	88.9	Confident	83.8	Confident	91 Å²	91	45.1 Å²	45.1	48%	0.476	25%	0.248	S	C	.	.	H	α-helix	trans	-94.6	-42.5	-177.8	-71	-176.6	0	0	0	113.7	H116 K117 Q118 R399	H116-L120 VanDerWaalsContact NE2-CD1 3.32Å; H116-L120 WeakPolarHBondContact NE2-CD1 3.32Å; H116-L120 WeakPolarHBondContact O-CG 3.46Å; H116-L120 PolarHBondContact O-N 2.99Å; K117-L120 PolarHBondContact O-N 3.19Å; Q118-L120 VanDerWaalsContact C-N 3.31Å; Q118-L120 PolarHBondContact O-N 3.48Å; L120-R399 VanDerWaalsContact CD1-NH2 3.31Å
121	M	85.5	Confident	82.3	Confident	128 Å²	128	52.5 Å²	52.5	63%	0.631	28%	0.282	S	S	*	.	H	α-helix	trans	-109.6	-13.8	-169.6	-52	-57.2	-69.6	0	0	112.7	K117 W146	K117-M121 PolarHBondContact O-N 3.38Å; M121-W146 HydrophobicContact CB-CH2 3.99Å; M121-W146 HydrophobicContact CB-CZ2 3.69Å; M121-W146 HydrophobicContact CG-CH2 4.24Å; M121-W146 HydrophobicContact CG-CZ2 4.3Å
122	G	87.8	Confident	80.8	Confident	22 Å²	22	51.9 Å²	51.9	23%	0.227	28%	0.283	C	S	.	.			trans	79	-158.9	-168.1	0	0	0	0	0	112.9	Q118 W146	Q118-G122 WeakPolarHBondContact CA-O 3.47Å; Q118-G122 VanDerWaalsContact O-CA 3.23Å; Q118-G122 WeakPolarHBondContact O-CA 3.42Å; Q118-G122 PolarHBondContact O-N 2.94Å; Q118-G122 PolarHBondContact OE1-O 3.39Å; G122-W146 PolarHBondContact O-NE1 3.5Å
123	P	90	Very high	79	Confident	59 Å²	59	54.5 Å²	54.5	38%	0.383	31%	0.31	S	S	.	.	S	Bend	trans	-51.2	145.7	175.2	-29	38.2	0	0	0	113.2	N125 G150	P123-N125 PolarHBondContact O-N 2.93Å; P123-N125 VanDerWaalsContact O-N 3.13Å; P123-G150 WeakPolarHBondContact CA-O 3.33Å; P123-G150 VanDerWaalsContact CB-O 3.31Å; P123-G150 WeakPolarHBondContact CB-O 3.44Å
124	Y	85.1	Confident	77.3	Confident	45 Å²	45	62.7 Å²	62.7	18%	0.176	35%	0.345	C	S	.	.			trans	-61	115.1	168.7	175.5	-95.5	0	0	0	109.9	P126 C129 R143 W146 A147	Y124-P126 HydrophobicContact CE1-CB 4.01Å; Y124-C129 HydrophobicContact CD2-CB 4.48Å; Y124-C129 HydrophobicContact CE2-CB 3.51Å; Y124-R143 HydrophobicContact CE2-CG 3.78Å; Y124-R143 VanDerWaalsContact OH-CD 3.31Å; Y124-R143 WeakPolarHBondContact OH-CD 3.42Å; Y124-R143 PolarHBondContact OH-NH1 3.34Å; Y124-W146 AromaticContact CD2-CD2 3.93Å; Y124-W146 HydrophobicContact CD2-CD2 3.93Å; Y124-W146 AromaticContact CD2-CE3 3.58Å; Y124-W146 HydrophobicContact CD2-CE3 3.58Å; Y124-W146 HydrophobicContact CD2-CG 4.49Å; Y124-W146 HydrophobicContact CD2-CH2 4.37Å; Y124-W146 AromaticContact CD2-CZ3 3.82Å; Y124-W146 HydrophobicContact CD2-CZ3 3.82Å; Y124-W146 HydrophobicContact CE2-CE3 4.35Å; Y124-W146 HydrophobicContact CE2-CZ3 4.43Å; Y124-W146 HydrophobicContact CG-CD2 4.49Å; Y124-A147 HydrophobicContact CD1-CB 3.78Å; Y124-A147 HydrophobicContact CE1-CB 4.33Å; Y124-A147 HydrophobicContact CG-CB 4.04Å
125	N	81.5	Confident	75.4	Confident	61 Å²	61	71.5 Å²	71.5	33%	0.326	38%	0.383	S	S	.	.			trans	-101.2	121.4	165.9	-173.7	11.3	0	0	0	109.1	P123 D127 T128	P123-N125 PolarHBondContact O-N 2.93Å; P123-N125 VanDerWaalsContact O-N 3.13Å; N125-D127 PolarHBondContact O-N 3.47Å; N125-D127 PolarHBondContact OD1-N 3.26Å; N125-D127 PolarHBondContact OD1-OD2 3.43Å; N125-T128 HydrophobicContact CB-CG2 4.32Å; N125-T128 PolarHBondContact O-N 3.05Å; N125-T128 PolarHBondContact O-OG1 2.98Å
126	P	74.9	Confident	74.2	Confident	73 Å²	73	73.8 Å²	73.8	47%	0.474	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-56.3	-38.4	171.6	22.8	-33.5	0	0	0	112.1	Y124 T128 C129	Y124-P126 HydrophobicContact CE1-CB 4.01Å; P126-T128 PolarHBondContact O-N 2.83Å; P126-C129 CarbonylContact O-C 3.44Å; P126-C129 PolarHBondContact O-N 3.14Å
127	D	70.4	Confident	73.2	Confident	125 Å²	125	77.6 Å²	77.6	67%	0.668	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-69.5	0.3	-178	-34.9	-29.7	0	0	0	113.3	N125	N125-D127 PolarHBondContact O-N 3.47Å; N125-D127 PolarHBondContact OD1-N 3.26Å; N125-D127 PolarHBondContact OD1-OD2 3.43Å
128	T	64.9	Low	72.4	Confident	93 Å²	93	76.7 Å²	76.7	57%	0.571	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-124.9	20.1	171.6	66.3	0	0	0	0	112	N125 P126	N125-T128 HydrophobicContact CB-CG2 4.32Å; N125-T128 PolarHBondContact O-N 3.05Å; N125-T128 PolarHBondContact O-OG1 2.98Å; P126-T128 PolarHBondContact O-N 2.83Å
129	C	54.7	Low	71.5	Confident	18 Å²	18	77 Å²	77	12%	0.122	42%	0.422	C	S	.	.	S	Bend	trans	-148	82.7	-174	-87.9	0	0	0	0	110.3	Y124 P126 R143 W146	Y124-C129 HydrophobicContact CD2-CB 4.48Å; Y124-C129 HydrophobicContact CE2-CB 3.51Å; P126-C129 CarbonylContact O-C 3.44Å; P126-C129 PolarHBondContact O-N 3.14Å; C129-R143 PolarHBondContact O-NH1 3.49Å; C129-R143 PolarHBondContact O-NH2 3.3Å; C129-W146 VanDerWaalsContact SG-CZ3 3.59Å
130	P	57.6	Low	70.8	Confident	42 Å²	42	80.2 Å²	80.2	27%	0.273	44%	0.439	S	S	.	.			trans	-62.2	156.5	-177.5	28.5	-36.8	0	0	0	111.6	R143 D452	P130-R143 PolarHBondContact O-NH1 3.36Å; P130-R143 VanDerWaalsContact O-NH1 3.14Å; P130-R143 PolarHBondContact O-NH2 2.97Å; P130-D452 HydrophobicContact CB-CB 4.02Å; P130-D452 WeakPolarHBondContact CB-O 3.45Å; P130-D452 HydrophobicContact CG-CB 4.21Å; P130-D452 WeakPolarHBondContact CG-O 3.47Å
131	E	56.6	Low	70.5	Confident	166 Å²	166	77 Å²	77	78%	0.776	42%	0.422	S	S	*	.			trans	-60.6	145.8	-156.8	-66.7	-160.4	158.7	0	0	114.6	G133 D452	E131-G133 PolarHBondContact O-N 2.89Å; E131-D452 PolarHBondContact N-OD2 3.28Å
132	V	61.1	Low	70.3	Confident	36 Å²	36	73 Å²	73	22%	0.218	40%	0.4	C	S	.	.			trans	-82.8	110.2	170.3	-170.7	0	0	0	0	108.4	F134 D136 N140 R143	V132-F134 PolarHBondContact O-N 3.22Å; V132-D136 HydrophobicContact CG1-CB 3.75Å; V132-D136 WeakPolarHBondContact CG1-O 3.23Å; V132-N140 HydrophobicContact CB-CB 4.44Å; V132-N140 HydrophobicContact CG1-CB 4.31Å; V132-R143 HydrophobicContact CG2-CB 4.45Å
133	G	55.3	Low	70.1	Confident	55 Å²	55	74.4 Å²	74.4	57%	0.567	40%	0.398	S	S	*	.			trans	-50.2	135.8	174	0	0	0	0	0	111.8	E131 F135 D136	E131-G133 PolarHBondContact O-N 2.89Å; G133-F135 PolarHBondContact O-N 3.44Å; G133-D136 PolarHBondContact O-N 3Å
134	F	54.9	Low	70	Confident	183 Å²	183	76.1 Å²	76.1	80%	0.803	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46	-26.1	-167.3	-178.4	-100.1	0	0	0	116.4	V132	V132-F134 PolarHBondContact O-N 3.22Å
135	F	53.3	Low	70.3	Confident	186 Å²	186	75.9 Å²	75.9	82%	0.816	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-16.6	-179.5	-63.7	-75.7	0	0	0	115.4	G133 V137	G133-F135 PolarHBondContact O-N 3.44Å; F135-V137 VanDerWaalsContact C-N 3.26Å; F135-V137 PolarHBondContact O-N 3.34Å
136	D	68.1	Low	70.8	Confident	49 Å²	49	73.2 Å²	73.2	26%	0.262	38%	0.383	S	S	.	.			trans	-82.9	72.6	170.2	-176.3	19.2	0	0	0	111.1	V132 G133 L138 G139 N140 R142	V132-D136 HydrophobicContact CG1-CB 3.75Å; V132-D136 WeakPolarHBondContact CG1-O 3.23Å; G133-D136 PolarHBondContact O-N 3Å; D136-L138 PolarHBondContact O-N 2.87Å; D136-L138 WeakPolarHBondContact OD1-CB 3.37Å; D136-L138 PolarHBondContact OD1-N 2.94Å; D136-G139 PolarHBondContact O-N 3.44Å; D136-G139 VanDerWaalsContact O-N 3.07Å; D136-G139 PolarHBondContact OD1-N 3.41Å; D136-G139 WeakPolarHBondContact OD2-CA 3.44Å; D136-G139 PolarHBondContact OD2-N 2.91Å; D136-G139 VanDerWaalsContact OD2-N 3.08Å; D136-N140 PolarHBondContact O-N 3.42Å; D136-R142 IonicContact OD1-NH2 2.71Å; D136-R142 IonicContact OD2-NH2 3.52Å; D136-R142 PolarHBondContact OD2-NH2 2.89Å
137	V	72.4	Confident	71.6	Confident	89 Å²	89	71.9 Å²	71.9	54%	0.539	38%	0.378	S	S	.	.	H	α-helix	trans	-52.2	-37.1	173.4	-176.9	0	0	0	0	111.3	F135 N140 D141	F135-V137 VanDerWaalsContact C-N 3.26Å; F135-V137 PolarHBondContact O-N 3.34Å; V137-N140 PolarHBondContact O-N 3.25Å; V137-D141 VanDerWaalsContact O-CB 3.31Å; V137-D141 WeakPolarHBondContact O-CB 3.45Å; V137-D141 PolarHBondContact O-N 3.01Å
138	L	71.7	Confident	72.7	Confident	75 Å²	75	68 Å²	68	39%	0.393	36%	0.363	S	S	.	.	H	α-helix	trans	-71	-37.6	-179.7	-57.8	179.2	0	0	0	111.5	Y106 D136 R142	Y106-L138 HydrophobicContact CE2-CD2 3.92Å; Y106-L138 VanDerWaalsContact OH-CD2 3.29Å; Y106-L138 WeakPolarHBondContact OH-CD2 3.46Å; D136-L138 PolarHBondContact O-N 2.87Å; D136-L138 WeakPolarHBondContact OD1-CB 3.37Å; D136-L138 PolarHBondContact OD1-N 2.94Å; L138-R142 VanDerWaalsContact C-NE 3.32Å; L138-R142 WeakPolarHBondContact O-CB 3.2Å; L138-R142 WeakPolarHBondContact O-CD 3.24Å; L138-R142 WeakPolarHBondContact O-CG 3.31Å; L138-R142 PolarHBondContact O-N 3.34Å; L138-R142 PolarHBondContact O-NE 3.19Å
139	G	72.9	Confident	74	Confident	7 Å²	7	64.4 Å²	64.4	7%	0.072	34%	0.34	C	S	.	.	H	α-helix	trans	-65.2	-43.5	172.6	0	0	0	0	0	112.6	D136 R142 R143	D136-G139 PolarHBondContact O-N 3.44Å; D136-G139 VanDerWaalsContact O-N 3.07Å; D136-G139 PolarHBondContact OD1-N 3.41Å; D136-G139 WeakPolarHBondContact OD2-CA 3.44Å; D136-G139 PolarHBondContact OD2-N 2.91Å; D136-G139 VanDerWaalsContact OD2-N 3.08Å; G139-R142 PolarHBondContact O-N 3.49Å; G139-R143 WeakPolarHBondContact O-CB 3.37Å; G139-R143 PolarHBondContact O-N 3.49Å
140	N	78.4	Confident	75.8	Confident	82 Å²	82	64.9 Å²	64.9	44%	0.439	35%	0.349	S	S	.	.	H	α-helix	trans	-65.7	-45.1	179.9	-166.3	5	0	0	0	110.7	V132 D136 V137 R142 R143 R144	V132-N140 HydrophobicContact CB-CB 4.44Å; V132-N140 HydrophobicContact CG1-CB 4.31Å; D136-N140 PolarHBondContact O-N 3.42Å; V137-N140 PolarHBondContact O-N 3.25Å; N140-R142 PolarHBondContact O-N 2.93Å; N140-R143 WeakPolarHBondContact O-CB 3.49Å; N140-R143 PolarHBondContact O-N 2.9Å; N140-R144 WeakPolarHBondContact O-CB 3.49Å; N140-R144 PolarHBondContact O-N 2.91Å
141	D	83.6	Confident	77.5	Confident	24 Å²	24	70.2 Å²	70.2	13%	0.128	38%	0.375	C	S	.	.	H	α-helix	trans	-55.4	-48.4	170.1	-84.8	-15	0	0	0	112.7	Y106 L110 V137 R143 R144 E145	Y106-D141 VanDerWaalsContact CE1-OD2 3.25Å; Y106-D141 WeakPolarHBondContact CE1-OD2 3.31Å; Y106-D141 VanDerWaalsContact OH-CB 3.28Å; Y106-D141 WeakPolarHBondContact OH-CB 3.4Å; Y106-D141 PolarHBondContact OH-OD2 3.34Å; L110-D141 HydrophobicContact CD1-CB 4.06Å; L110-D141 HydrophobicContact CD2-CB 3.79Å; V137-D141 VanDerWaalsContact O-CB 3.31Å; V137-D141 WeakPolarHBondContact O-CB 3.45Å; V137-D141 PolarHBondContact O-N 3.01Å; D141-R143 VanDerWaalsContact C-N 3.28Å; D141-R143 PolarHBondContact O-N 3.42Å; D141-R144 PolarHBondContact O-N 2.91Å; D141-R144 IonicContact OD1-CZ 2.74Å; D141-R144 IonicContact OD1-NH1 2.76Å; D141-R144 PolarHBondContact OD1-NH1 3.33Å; D141-R144 IonicContact OD1-NH2 3.19Å; D141-R144 PolarHBondContact OD1-NH2 3.5Å; D141-E145 PolarHBondContact O-N 3.13Å; D141-E145 VanDerWaalsContact O-N 3.1Å
142	R	81.7	Confident	79.2	Confident	44 Å²	44	62.9 Å²	62.9	17%	0.166	34%	0.341	C	S	.	.	H	α-helix	trans	-63.2	-33.4	178.3	-75.9	172.4	-65.8	152.5	-1.3	112.6	L110 D136 L138 G139 N140 W146 S511	L110-R142 HydrophobicContact CD1-CB 4.29Å; L110-R142 HydrophobicContact CD1-CG 3.5Å; D136-R142 IonicContact OD1-NH2 2.71Å; D136-R142 IonicContact OD2-NH2 3.52Å; D136-R142 PolarHBondContact OD2-NH2 2.89Å; L138-R142 VanDerWaalsContact C-NE 3.32Å; L138-R142 WeakPolarHBondContact O-CB 3.2Å; L138-R142 WeakPolarHBondContact O-CD 3.24Å; L138-R142 WeakPolarHBondContact O-CG 3.31Å; L138-R142 PolarHBondContact O-N 3.34Å; L138-R142 PolarHBondContact O-NE 3.19Å; G139-R142 PolarHBondContact O-N 3.49Å; N140-R142 PolarHBondContact O-N 2.93Å; R142-W146 PolarHBondContact O-N 2.93Å; R142-S511 PolarHBondContact NH1-O 3.17Å
143	R	83.5	Confident	80.8	Confident	50 Å²	50	63 Å²	63	19%	0.189	34%	0.343	C	S	.	.	H	α-helix	trans	-70.8	-49.4	175.1	177.2	169.1	-62.7	-154.4	4.2	111.2	Y124 C129 P130 V132 G139 N140 D141 E145 W146 A147	Y124-R143 HydrophobicContact CE2-CG 3.78Å; Y124-R143 VanDerWaalsContact OH-CD 3.31Å; Y124-R143 WeakPolarHBondContact OH-CD 3.42Å; Y124-R143 PolarHBondContact OH-NH1 3.34Å; C129-R143 PolarHBondContact O-NH1 3.49Å; C129-R143 PolarHBondContact O-NH2 3.3Å; P130-R143 PolarHBondContact O-NH1 3.36Å; P130-R143 VanDerWaalsContact O-NH1 3.14Å; P130-R143 PolarHBondContact O-NH2 2.97Å; V132-R143 HydrophobicContact CG2-CB 4.45Å; G139-R143 WeakPolarHBondContact O-CB 3.37Å; G139-R143 PolarHBondContact O-N 3.49Å; N140-R143 WeakPolarHBondContact O-CB 3.49Å; N140-R143 PolarHBondContact O-N 2.9Å; D141-R143 VanDerWaalsContact C-N 3.28Å; D141-R143 PolarHBondContact O-N 3.42Å; R143-E145 VanDerWaalsContact C-N 3.35Å; R143-E145 PolarHBondContact O-N 2.88Å; R143-W146 PolarHBondContact O-N 3.04Å; R143-W146 VanDerWaalsContact O-N 3.14Å; R143-A147 WeakPolarHBondContact O-CB 3.48Å; R143-A147 PolarHBondContact O-N 3.03Å
144	R	88	Confident	82.6	Confident	96 Å²	96	64.1 Å²	64.1	36%	0.362	33%	0.332	S	S	.	.	H	α-helix	trans	-57.7	-45.1	-179.1	-168.7	-179.2	63.8	-108.4	-9.4	111.6	N140 D141 W146 A147 A148	N140-R144 WeakPolarHBondContact O-CB 3.49Å; N140-R144 PolarHBondContact O-N 2.91Å; D141-R144 PolarHBondContact O-N 2.91Å; D141-R144 IonicContact OD1-CZ 2.74Å; D141-R144 IonicContact OD1-NH1 2.76Å; D141-R144 PolarHBondContact OD1-NH1 3.33Å; D141-R144 IonicContact OD1-NH2 3.19Å; D141-R144 PolarHBondContact OD1-NH2 3.5Å; R144-W146 PolarHBondContact O-N 2.8Å; R144-A147 PolarHBondContact O-N 3.24Å; R144-A148 VanDerWaalsContact O-CB 3.28Å; R144-A148 WeakPolarHBondContact O-CB 3.34Å; R144-A148 PolarHBondContact O-N 3.33Å
145	E	91.6	Very high	84.5	Confident	39 Å²	39	58.8 Å²	58.8	18%	0.182	31%	0.31	C	S	.	.	H	α-helix	trans	-66.2	-36.2	176.1	-71.7	-56.5	124.2	0	0	113.5	L110 A114 D141 R143 A148 L149	L110-E145 HydrophobicContact CB-CG 4.07Å; L110-E145 HydrophobicContact CD2-CB 4.43Å; L110-E145 HydrophobicContact CD2-CG 3.35Å; L110-E145 HydrophobicContact CG-CB 4.18Å; L110-E145 HydrophobicContact CG-CG 3.51Å; A114-E145 HydrophobicContact CB-CB 3.89Å; D141-E145 PolarHBondContact O-N 3.13Å; D141-E145 VanDerWaalsContact O-N 3.1Å; R143-E145 VanDerWaalsContact C-N 3.35Å; R143-E145 PolarHBondContact O-N 2.88Å; E145-A148 PolarHBondContact O-N 2.98Å; E145-L149 PolarHBondContact O-N 3.48Å
146	W	91.9	Very high	86.4	Confident	6 Å²	6	50 Å²	50	2%	0.023	27%	0.271	C	S	.	.	H	α-helix	trans	-72.4	-41.8	177	-176.4	20.9	0	0	0	111.7	A114 K117 M121 G122 Y124 C129 R142 R143 R144 A148 L149	A114-W146 HydrophobicContact CB-CB 4.13Å; K117-W146 HydrophobicContact CB-CD2 3.79Å; K117-W146 HydrophobicContact CB-CE3 4.24Å; K117-W146 HydrophobicContact CB-CG 4.09Å; K117-W146 HydrophobicContact CB-CZ2 4.35Å; K117-W146 HydrophobicContact CD-CD2 3.71Å; K117-W146 HydrophobicContact CD-CE3 3.25Å; K117-W146 HydrophobicContact CD-CG 4.44Å; K117-W146 HydrophobicContact CD-CH2 4.2Å; K117-W146 HydrophobicContact CD-CZ3 3.54Å; K117-W146 HydrophobicContact CG-CD2 4.42Å; K117-W146 HydrophobicContact CG-CE3 4.39Å; M121-W146 HydrophobicContact CB-CH2 3.99Å; M121-W146 HydrophobicContact CB-CZ2 3.69Å; M121-W146 HydrophobicContact CG-CH2 4.24Å; M121-W146 HydrophobicContact CG-CZ2 4.3Å; G122-W146 PolarHBondContact O-NE1 3.5Å; Y124-W146 AromaticContact CD2-CD2 3.93Å; Y124-W146 HydrophobicContact CD2-CD2 3.93Å; Y124-W146 AromaticContact CD2-CE3 3.58Å; Y124-W146 HydrophobicContact CD2-CE3 3.58Å; Y124-W146 HydrophobicContact CD2-CG 4.49Å; Y124-W146 HydrophobicContact CD2-CH2 4.37Å; Y124-W146 AromaticContact CD2-CZ3 3.82Å; Y124-W146 HydrophobicContact CD2-CZ3 3.82Å; Y124-W146 HydrophobicContact CE2-CE3 4.35Å; Y124-W146 HydrophobicContact CE2-CZ3 4.43Å; Y124-W146 HydrophobicContact CG-CD2 4.49Å; C129-W146 VanDerWaalsContact SG-CZ3 3.59Å; R142-W146 PolarHBondContact O-N 2.93Å; R143-W146 PolarHBondContact O-N 3.04Å; R143-W146 VanDerWaalsContact O-N 3.14Å; R144-W146 PolarHBondContact O-N 2.8Å; W146-A148 VanDerWaalsContact C-N 3.27Å; W146-A148 PolarHBondContact O-N 2.75Å; W146-L149 WeakPolarHBondContact O-CB 3.35Å; W146-L149 PolarHBondContact O-N 3.29Å; W146-L149 VanDerWaalsContact O-N 3.11Å
147	A	90.6	Very high	87.7	Confident	44 Å²	44	47.7 Å²	47.7	36%	0.364	26%	0.259	S	S	.	.	H	α-helix	trans	-58.8	-37.8	171.3	0	0	0	0	0	112.2	Y124 R143 R144 L149 G150	Y124-A147 HydrophobicContact CD1-CB 3.78Å; Y124-A147 HydrophobicContact CE1-CB 4.33Å; Y124-A147 HydrophobicContact CG-CB 4.04Å; R143-A147 WeakPolarHBondContact O-CB 3.48Å; R143-A147 PolarHBondContact O-N 3.03Å; R144-A147 PolarHBondContact O-N 3.24Å; A147-L149 PolarHBondContact O-N 3.24Å; A147-G150 PolarHBondContact O-N 3.47Å
148	A	93.4	Very high	88.9	Confident	43 Å²	43	43.8 Å²	43.8	36%	0.355	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-12.4	176.8	0	0	0	0	0	114.8	R144 E145 W146	R144-A148 VanDerWaalsContact O-CB 3.28Å; R144-A148 WeakPolarHBondContact O-CB 3.34Å; R144-A148 PolarHBondContact O-N 3.33Å; E145-A148 PolarHBondContact O-N 2.98Å; W146-A148 VanDerWaalsContact C-N 3.27Å; W146-A148 PolarHBondContact O-N 2.75Å
149	L	92.6	Very high	90	Very high	18 Å²	18	40.2 Å²	40.2	9%	0.094	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-22.8	169.2	-57	-176.5	0	0	0	112.5	A114 L115 Q118 E145 W146 A147 N151 M152	A114-L149 VanDerWaalsContact C-CD1 3.45Å; A114-L149 HydrophobicContact CB-CD1 3.85Å; A114-L149 HydrophobicContact CB-CG 4.36Å; A114-L149 WeakPolarHBondContact O-CD1 3.37Å; L115-L149 HydrophobicContact CD2-CD1 3.99Å; L115-L149 HydrophobicContact CD2-CD2 4.15Å; L115-L149 HydrophobicContact CG-CD1 4.2Å; Q118-L149 HydrophobicContact CB-CD1 3.84Å; Q118-L149 HydrophobicContact CG-CD1 4.25Å; E145-L149 PolarHBondContact O-N 3.48Å; W146-L149 WeakPolarHBondContact O-CB 3.35Å; W146-L149 PolarHBondContact O-N 3.29Å; W146-L149 VanDerWaalsContact O-N 3.11Å; A147-L149 PolarHBondContact O-N 3.24Å; L149-N151 PolarHBondContact O-N 3.1Å; L149-M152 HydrophobicContact CB-CB 4.33Å; L149-M152 HydrophobicContact CB-SD 4.4Å; L149-M152 HydrophobicContact CD1-SD 4.42Å; L149-M152 HydrophobicContact CD2-CE 3.96Å; L149-M152 HydrophobicContact CD2-SD 4.16Å; L149-M152 VanDerWaalsContact O-CB 3.26Å; L149-M152 WeakPolarHBondContact O-CB 3.44Å; L149-M152 PolarHBondContact O-N 3.3Å
150	G	92.9	Very high	91.1	Very high	29 Å²	29	42.2 Å²	42.2	30%	0.299	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	-129.5	178.9	0	0	0	0	0	113.1	Q118 P123 A147 M152	Q118-G150 PolarHBondContact NE2-O 3.42Å; P123-G150 WeakPolarHBondContact CA-O 3.33Å; P123-G150 VanDerWaalsContact CB-O 3.31Å; P123-G150 WeakPolarHBondContact CB-O 3.44Å; A147-G150 PolarHBondContact O-N 3.47Å; G150-M152 PolarHBondContact O-N 3.17Å
151	N	92.1	Very high	91.9	Very high	154 Å²	154	38.3 Å²	38.3	82%	0.824	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	22.6	-176.5	-66.6	-15.7	0	0	0	114.6	L149 S153	L149-N151 PolarHBondContact O-N 3.1Å; N151-S153 PolarHBondContact O-N 2.89Å
152	M	93.8	Very high	92.5	Very high	12 Å²	12	37.1 Å²	37.1	6%	0.059	20%	0.196	C	C	.	.			trans	-55	132.8	174.1	177.7	179.6	-70.5	0	0	111.4	L115 Q118 L149 G150 D156 A157	L115-M152 HydrophobicContact CD2-SD 3.67Å; Q118-M152 HydrophobicContact CG-CB 4.28Å; Q118-M152 HydrophobicContact CG-CG 4.43Å; Q118-M152 PolarHBondContact NE2-O 3.32Å; L149-M152 HydrophobicContact CB-CB 4.33Å; L149-M152 HydrophobicContact CB-SD 4.4Å; L149-M152 HydrophobicContact CD1-SD 4.42Å; L149-M152 HydrophobicContact CD2-CE 3.96Å; L149-M152 HydrophobicContact CD2-SD 4.16Å; L149-M152 VanDerWaalsContact O-CB 3.26Å; L149-M152 WeakPolarHBondContact O-CB 3.44Å; L149-M152 PolarHBondContact O-N 3.3Å; G150-M152 PolarHBondContact O-N 3.17Å; M152-D156 HydrophobicContact CG-CB 3.65Å; M152-D156 HydrophobicContact SD-CB 4.47Å; M152-A157 HydrophobicContact CG-CB 4.32Å; M152-A157 HydrophobicContact SD-CB 3.93Å
153	S	94.2	Very high	93.1	Very high	37 Å²	37	37.1 Å²	37.1	26%	0.259	20%	0.197	S	C	.	.			trans	-73.6	163.7	-179.7	110.2	0	0	0	0	112.2	N151 E155 D156 A157	N151-S153 PolarHBondContact O-N 2.89Å; S153-E155 VanDerWaalsContact C-N 3.34Å; S153-E155 PolarHBondContact O-N 3.17Å; S153-E155 PolarHBondContact OG-N 3.2Å; S153-D156 WeakPolarHBondContact CA-OD2 3.23Å; S153-D156 VanDerWaalsContact CB-CG 3.45Å; S153-D156 WeakPolarHBondContact CB-OD1 3.34Å; S153-D156 WeakPolarHBondContact CB-OD2 3.45Å; S153-D156 PolarHBondContact N-OD2 2.87Å; S153-D156 WeakPolarHBondContact O-CB 3.37Å; S153-D156 PolarHBondContact O-N 3.33Å; S153-D156 PolarHBondContact OG-OD1 3Å; S153-D156 PolarHBondContact OG-OD2 2.98Å; S153-A157 PolarHBondContact O-N 2.95Å
154	K	93.4	Very high	93.6	Very high	79 Å²	79	35.3 Å²	35.3	34%	0.343	19%	0.191	S	C	.	.	H	α-helix	trans	-58.9	-45.7	177.9	168.9	177.9	158.8	-87.3	0	111.3	E84 V119 D156 A157 M158	E84-K154 IonicContact OE1-NZ 2.67Å; E84-K154 PolarHBondContact OE1-NZ 3.46Å; V119-K154 HydrophobicContact CG1-CG 4.28Å; K154-D156 VanDerWaalsContact C-N 3.29Å; K154-D156 PolarHBondContact O-N 3.36Å; K154-A157 PolarHBondContact O-N 2.89Å; K154-M158 HydrophobicContact CG-CE 4.15Å; K154-M158 WeakPolarHBondContact O-CG 3.24Å; K154-M158 PolarHBondContact O-N 3.3Å; K154-M158 VanDerWaalsContact O-N 3.11Å
155	E	94	Very high	93.8	Very high	71 Å²	71	30.7 Å²	30.7	33%	0.332	17%	0.174	S	C	.	.	H	α-helix	trans	-63.9	-38.8	-179.2	-73.1	56.4	-129.5	0	0	110.8	L83 S153 M158 V159	L83-E155 HydrophobicContact CD2-CB 3.92Å; L83-E155 HydrophobicContact CD2-CG 4.2Å; L83-E155 WeakPolarHBondContact CD2-O 3.35Å; S153-E155 VanDerWaalsContact C-N 3.34Å; S153-E155 PolarHBondContact O-N 3.17Å; S153-E155 PolarHBondContact OG-N 3.2Å; E155-M158 WeakPolarHBondContact O-CB 3.36Å; E155-M158 PolarHBondContact O-N 2.85Å; E155-V159 WeakPolarHBondContact O-CG2 3.43Å; E155-V159 PolarHBondContact O-N 3.38Å
156	D	94	Very high	93.8	Very high	3 Å²	3	31 Å²	31	2%	0.016	18%	0.177	C	C	.	.	H	α-helix	trans	-66.4	-46.3	-179	-41.5	-11.4	0	0	0	111	A68 M152 S153 K154 M158 V159 E160 D343 S344	A68-D156 HydrophobicContact CB-CB 4.4Å; A68-D156 WeakPolarHBondContact CB-OD1 2.82Å; M152-D156 HydrophobicContact CG-CB 3.65Å; M152-D156 HydrophobicContact SD-CB 4.47Å; S153-D156 WeakPolarHBondContact CA-OD2 3.23Å; S153-D156 VanDerWaalsContact CB-CG 3.45Å; S153-D156 WeakPolarHBondContact CB-OD1 3.34Å; S153-D156 WeakPolarHBondContact CB-OD2 3.45Å; S153-D156 PolarHBondContact N-OD2 2.87Å; S153-D156 WeakPolarHBondContact O-CB 3.37Å; S153-D156 PolarHBondContact O-N 3.33Å; S153-D156 PolarHBondContact OG-OD1 3Å; S153-D156 PolarHBondContact OG-OD2 2.98Å; K154-D156 VanDerWaalsContact C-N 3.29Å; K154-D156 PolarHBondContact O-N 3.36Å; D156-M158 VanDerWaalsContact C-N 3.26Å; D156-M158 PolarHBondContact O-N 2.79Å; D156-V159 WeakPolarHBondContact O-CA 3.34Å; D156-V159 WeakPolarHBondContact O-CB 3.31Å; D156-V159 PolarHBondContact O-N 3.38Å; D156-E160 PolarHBondContact O-N 2.93Å; D156-D343 WeakPolarHBondContact OD1-CA 3.36Å; D156-D343 PolarHBondContact OD1-N 3.44Å; D156-D343 WeakPolarHBondContact OD2-CA 3.38Å; D156-S344 WeakPolarHBondContact CB-OG 3.42Å; D156-S344 VanDerWaalsContact CG-N 3.31Å; D156-S344 PolarHBondContact OD2-N 3.07Å
157	A	95.8	Very high	93.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.7	-32.3	177.5	0	0	0	0	0	111.5	L115 Q118 V119 M152 S153 K154 F161	L115-A157 HydrophobicContact CD2-CB 4.04Å; Q118-A157 HydrophobicContact CB-CB 3.78Å; Q118-A157 HydrophobicContact CG-CB 3.87Å; V119-A157 HydrophobicContact CG2-CB 3.57Å; M152-A157 HydrophobicContact CG-CB 4.32Å; M152-A157 HydrophobicContact SD-CB 3.93Å; S153-A157 PolarHBondContact O-N 2.95Å; K154-A157 PolarHBondContact O-N 2.89Å; A157-F161 WeakPolarHBondContact O-CB 3.4Å; A157-F161 PolarHBondContact O-N 3.16Å
158	M	96.2	Very high	93.7	Very high	7 Å²	7	37.9 Å²	37.9	3%	0.034	20%	0.197	C	C	.	.	H	α-helix	trans	-66	-45.5	167.8	-67.8	-170	-174.4	0	0	112.3	L83 E84 Y87 V119 K154 E155 D156 F161 V162	L83-M158 HydrophobicContact CD1-CB 3.94Å; L83-M158 HydrophobicContact CD2-CB 4.14Å; L83-M158 HydrophobicContact CD2-SD 4.46Å; L83-M158 HydrophobicContact CG-CB 3.94Å; L83-M158 HydrophobicContact CG-SD 4.11Å; E84-M158 HydrophobicContact CB-SD 4.42Å; E84-M158 HydrophobicContact CG-CE 4.04Å; E84-M158 HydrophobicContact CG-SD 3.97Å; Y87-M158 HydrophobicContact CD1-CE 3.8Å; Y87-M158 HydrophobicContact CD1-CG 3.8Å; Y87-M158 HydrophobicContact CD1-SD 3.83Å; Y87-M158 HydrophobicContact CD2-CB 3.94Å; Y87-M158 HydrophobicContact CD2-CG 3.76Å; Y87-M158 HydrophobicContact CE1-CE 4.12Å; Y87-M158 HydrophobicContact CE1-CG 4.21Å; Y87-M158 HydrophobicContact CE2-CG 4.19Å; Y87-M158 HydrophobicContact CG-CB 3.96Å; Y87-M158 HydrophobicContact CG-CE 4.43Å; Y87-M158 HydrophobicContact CG-CG 3.54Å; Y87-M158 HydrophobicContact CG-SD 3.87Å; V119-M158 HydrophobicContact CG1-CE 3.53Å; V119-M158 HydrophobicContact CG1-CG 4.05Å; V119-M158 HydrophobicContact CG2-CG 3.69Å; K154-M158 HydrophobicContact CG-CE 4.15Å; K154-M158 WeakPolarHBondContact O-CG 3.24Å; K154-M158 PolarHBondContact O-N 3.3Å; K154-M158 VanDerWaalsContact O-N 3.11Å; E155-M158 WeakPolarHBondContact O-CB 3.36Å; E155-M158 PolarHBondContact O-N 2.85Å; D156-M158 VanDerWaalsContact C-N 3.26Å; D156-M158 PolarHBondContact O-N 2.79Å; M158-F161 PolarHBondContact O-N 2.96Å; M158-V162 WeakPolarHBondContact O-CB 3.28Å; M158-V162 VanDerWaalsContact O-CG2 3.26Å; M158-V162 WeakPolarHBondContact O-CG2 3.46Å; M158-V162 PolarHBondContact O-N 3.5Å
159	V	95.6	Very high	93.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58.9	-50.7	179.4	164.9	0	0	0	0	110.9	A68 E71 L75 L83 E155 D156 V162 K163	A68-V159 HydrophobicContact CB-CG2 4.23Å; E71-V159 HydrophobicContact CB-CG1 3.89Å; E71-V159 HydrophobicContact CB-CG2 4.44Å; L75-V159 HydrophobicContact CD1-CB 4.4Å; L75-V159 HydrophobicContact CD1-CG1 4.23Å; L75-V159 HydrophobicContact CD1-CG2 4.03Å; L83-V159 HydrophobicContact CD1-CG2 3.69Å; L83-V159 HydrophobicContact CD2-CG2 3.99Å; E155-V159 WeakPolarHBondContact O-CG2 3.43Å; E155-V159 PolarHBondContact O-N 3.38Å; D156-V159 WeakPolarHBondContact O-CA 3.34Å; D156-V159 WeakPolarHBondContact O-CB 3.31Å; D156-V159 PolarHBondContact O-N 3.38Å; V159-V162 PolarHBondContact O-N 3.4Å; V159-K163 HydrophobicContact CG1-CD 3.87Å; V159-K163 VanDerWaalsContact O-CG 3.31Å; V159-K163 WeakPolarHBondContact O-CG 3.17Å; V159-K163 PolarHBondContact O-N 3.47Å
160	E	96	Very high	93	Very high	48 Å²	48	42.2 Å²	42.2	22%	0.224	21%	0.21	C	C	.	.	H	α-helix	trans	-72.2	-33.1	178.9	-74	-53.3	133.8	0	0	113	L115 D156 V162 K163 L164	L115-E160 HydrophobicContact CD1-CB 4.25Å; L115-E160 HydrophobicContact CD2-CB 4.07Å; D156-E160 PolarHBondContact O-N 2.93Å; E160-V162 VanDerWaalsContact C-N 3.33Å; E160-V162 PolarHBondContact O-N 3.47Å; E160-K163 PolarHBondContact O-N 3Å; E160-K163 WeakPolarHBondContact OE1-CD 3.25Å; E160-K163 WeakPolarHBondContact OE1-CE 3.32Å; E160-K163 IonicContact OE1-NZ 3.66Å; E160-K163 PolarHBondContact OE1-NZ 3.34Å; E160-L164 WeakPolarHBondContact O-CB 3.36Å; E160-L164 PolarHBondContact O-N 3.27Å
161	F	95.9	Very high	92.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.7	-45.1	171.4	-175.3	-78.9	0	0	0	111.1	Y87 A90 L91 F94 L112 L115 H116 A157 M158 L165	Y87-F161 HydrophobicContact CD2-CB 4.17Å; Y87-F161 AromaticContact CD2-CD1 3.85Å; Y87-F161 HydrophobicContact CD2-CD1 3.85Å; Y87-F161 HydrophobicContact CD2-CG 4.09Å; Y87-F161 HydrophobicContact CE2-CB 4.01Å; Y87-F161 AromaticContact CE2-CD1 3.82Å; Y87-F161 HydrophobicContact CE2-CD1 3.82Å; Y87-F161 HydrophobicContact CE2-CD2 4.18Å; Y87-F161 HydrophobicContact CE2-CE1 4.36Å; Y87-F161 AromaticContact CE2-CG 3.74Å; Y87-F161 HydrophobicContact CE2-CG 3.74Å; A90-F161 HydrophobicContact CB-CD1 3.88Å; A90-F161 HydrophobicContact CB-CE1 3.74Å; L91-F161 HydrophobicContact CB-CE1 4.44Å; L91-F161 HydrophobicContact CD1-CE2 4.4Å; L91-F161 HydrophobicContact CD1-CZ 3.93Å; F94-F161 HydrophobicContact CB-CZ 4.13Å; F94-F161 HydrophobicContact CD1-CZ 4.34Å; F94-F161 HydrophobicContact CG-CZ 4.22Å; L112-F161 HydrophobicContact CB-CD2 4.32Å; L112-F161 HydrophobicContact CB-CE2 4Å; L112-F161 HydrophobicContact CD2-CD1 4.34Å; L112-F161 HydrophobicContact CD2-CD2 3.61Å; L112-F161 HydrophobicContact CD2-CE1 4.46Å; L112-F161 HydrophobicContact CD2-CE2 3.77Å; L112-F161 HydrophobicContact CD2-CG 3.91Å; L112-F161 HydrophobicContact CD2-CZ 4.19Å; L112-F161 HydrophobicContact CG-CE2 4.49Å; L112-F161 WeakPolarHBondContact O-CD2 3.34Å; L112-F161 VanDerWaalsContact O-CE2 3.27Å; L112-F161 WeakPolarHBondContact O-CE2 3.31Å; L115-F161 HydrophobicContact CB-CB 4.19Å; L115-F161 HydrophobicContact CB-CD2 4.14Å; L115-F161 HydrophobicContact CD1-CB 4.43Å; H116-F161 HydrophobicContact CB-CE2 4.3Å; A157-F161 WeakPolarHBondContact O-CB 3.4Å; A157-F161 PolarHBondContact O-N 3.16Å; M158-F161 PolarHBondContact O-N 2.96Å; F161-L165 HydrophobicContact CE1-CD2 4.28Å; F161-L165 VanDerWaalsContact O-CB 3.26Å; F161-L165 WeakPolarHBondContact O-CB 3.41Å; F161-L165 PolarHBondContact O-N 3.25Å
162	V	95.4	Very high	92.9	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66.2	-43	177.8	168.7	0	0	0	0	111.6	L75 L86 A90 M158 V159 E160 N166 F172	L75-V162 HydrophobicContact CD1-CG1 4.45Å; L75-V162 HydrophobicContact CD2-CG1 4.02Å; L86-V162 HydrophobicContact CD2-CG1 3.81Å; L86-V162 HydrophobicContact CG-CG1 4Å; L86-V162 HydrophobicContact CG-CG2 4.17Å; A90-V162 HydrophobicContact CB-CG2 3.93Å; M158-V162 WeakPolarHBondContact O-CB 3.28Å; M158-V162 VanDerWaalsContact O-CG2 3.26Å; M158-V162 WeakPolarHBondContact O-CG2 3.46Å; M158-V162 PolarHBondContact O-N 3.5Å; V159-V162 PolarHBondContact O-N 3.4Å; E160-V162 VanDerWaalsContact C-N 3.33Å; E160-V162 PolarHBondContact O-N 3.47Å; V162-N166 VanDerWaalsContact O-CB 3.29Å; V162-N166 WeakPolarHBondContact O-CB 3.36Å; V162-N166 PolarHBondContact O-N 2.95Å; V162-N166 VanDerWaalsContact O-N 3.14Å; V162-F172 HydrophobicContact CG1-CE1 4.25Å
163	K	93.9	Very high	92.7	Very high	43 Å²	43	38.7 Å²	38.7	19%	0.187	19%	0.188	C	C	.	.	H	α-helix	trans	-64.2	-46	176.5	-74.3	164.3	176.5	177.3	0	111.9	E71 V159 E160 R167	E71-K163 WeakPolarHBondContact OE2-CE 3.41Å; E71-K163 IonicContact OE2-NZ 3.28Å; E71-K163 PolarHBondContact OE2-NZ 2.97Å; V159-K163 HydrophobicContact CG1-CD 3.87Å; V159-K163 VanDerWaalsContact O-CG 3.31Å; V159-K163 WeakPolarHBondContact O-CG 3.17Å; V159-K163 PolarHBondContact O-N 3.47Å; E160-K163 PolarHBondContact O-N 3Å; E160-K163 WeakPolarHBondContact OE1-CD 3.25Å; E160-K163 WeakPolarHBondContact OE1-CE 3.32Å; E160-K163 IonicContact OE1-NZ 3.66Å; E160-K163 PolarHBondContact OE1-NZ 3.34Å; K163-R167 PolarHBondContact O-N 2.9Å; K163-R167 VanDerWaalsContact O-N 3.12Å
164	L	94.1	Very high	92.6	Very high	12 Å²	12	41.2 Å²	41.2	6%	0.063	20%	0.202	C	C	.	.	H	α-helix	trans	-65.4	-49.9	179.9	-179.7	55.6	0	0	0	110.7	E108 K111 L112 L115 E160 N166 R167 C168	E108-L164 HydrophobicContact CG-CD1 4.4Å; K111-L164 HydrophobicContact CB-CD2 3.99Å; K111-L164 HydrophobicContact CD-CD2 4.32Å; K111-L164 HydrophobicContact CG-CD2 3.87Å; L112-L164 HydrophobicContact CD1-CG 4.46Å; L112-L164 HydrophobicContact CD2-CB 4.01Å; L112-L164 HydrophobicContact CD2-CD2 3.84Å; L112-L164 HydrophobicContact CD2-CG 3.87Å; L112-L164 HydrophobicContact CG-CD2 3.71Å; L112-L164 HydrophobicContact CG-CG 3.97Å; L115-L164 HydrophobicContact CD1-CD2 4.16Å; E160-L164 WeakPolarHBondContact O-CB 3.36Å; E160-L164 PolarHBondContact O-N 3.27Å; L164-N166 VanDerWaalsContact C-N 3.29Å; L164-N166 PolarHBondContact O-N 3.23Å; L164-R167 CarbonylContact O-C 3.03Å; L164-R167 WeakPolarHBondContact O-CA 3.3Å; L164-R167 VanDerWaalsContact O-CB 3.27Å; L164-R167 WeakPolarHBondContact O-CB 3.35Å; L164-R167 PolarHBondContact O-N 3.14Å; L164-C168 PolarHBondContact O-N 2.68Å; L164-C168 PolarHBondContact O-SG 2.87Å
165	L	92.8	Very high	92.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.6	-42	177.6	-176.5	68	0	0	0	112.5	A90 F93 F94 F102 L112 F161 R167 C168 C169 F172	A90-L165 HydrophobicContact CB-CD2 3.58Å; A90-L165 WeakPolarHBondContact O-CD2 3.35Å; F93-L165 HydrophobicContact CB-CD2 4.47Å; F93-L165 HydrophobicContact CD1-CD1 4.29Å; F93-L165 HydrophobicContact CD1-CD2 4.1Å; F93-L165 HydrophobicContact CD1-CG 4.39Å; F94-L165 HydrophobicContact CB-CD1 4.1Å; F94-L165 HydrophobicContact CB-CD2 4.43Å; F94-L165 HydrophobicContact CD2-CD1 3.74Å; F94-L165 HydrophobicContact CG-CD1 4.38Å; F102-L165 HydrophobicContact CE1-CD1 4.43Å; F102-L165 HydrophobicContact CE2-CD1 4.34Å; F102-L165 HydrophobicContact CZ-CD1 3.74Å; L112-L165 HydrophobicContact CD1-CD1 4.47Å; L112-L165 HydrophobicContact CD2-CB 4.37Å; F161-L165 HydrophobicContact CE1-CD2 4.28Å; F161-L165 VanDerWaalsContact O-CB 3.26Å; F161-L165 WeakPolarHBondContact O-CB 3.41Å; F161-L165 PolarHBondContact O-N 3.25Å; L165-R167 PolarHBondContact O-N 3.01Å; L165-C168 PolarHBondContact O-N 2.71Å; L165-C169 PolarHBondContact O-N 3.48Å; L165-F172 HydrophobicContact CD2-CD1 4.45Å; L165-F172 HydrophobicContact CD2-CD2 3.86Å; L165-F172 HydrophobicContact CD2-CE2 4.09Å; L165-F172 HydrophobicContact CD2-CG 4.06Å; L165-F172 HydrophobicContact CD2-CZ 4.46Å; L165-F172 HydrophobicContact CG-CG 4.31Å
166	N	92.1	Very high	92.6	Very high	46 Å²	46	36 Å²	36	25%	0.246	18%	0.177	C	C	.	.	H	α-helix	trans	-65.7	-26.3	176.3	-174.4	82.6	0	0	0	113	W79 V162 L164 F172	W79-N166 WeakPolarHBondContact CH2-OD1 3.31Å; W79-N166 WeakPolarHBondContact CZ2-OD1 3.47Å; V162-N166 VanDerWaalsContact O-CB 3.29Å; V162-N166 WeakPolarHBondContact O-CB 3.36Å; V162-N166 PolarHBondContact O-N 2.95Å; V162-N166 VanDerWaalsContact O-N 3.14Å; L164-N166 VanDerWaalsContact C-N 3.29Å; L164-N166 PolarHBondContact O-N 3.23Å; N166-F172 HydrophobicContact CB-CD1 3.93Å
167	R	90.9	Very high	92.5	Very high	167 Å²	167	38.1 Å²	38.1	63%	0.63	20%	0.195	S	C	*	.	H	α-helix	trans	-75.9	-45.3	173	-168.2	-172.2	-62.2	126.7	-0	110.9	K163 L164 L165 C169	K163-R167 PolarHBondContact O-N 2.9Å; K163-R167 VanDerWaalsContact O-N 3.12Å; L164-R167 CarbonylContact O-C 3.03Å; L164-R167 WeakPolarHBondContact O-CA 3.3Å; L164-R167 VanDerWaalsContact O-CB 3.27Å; L164-R167 WeakPolarHBondContact O-CB 3.35Å; L164-R167 PolarHBondContact O-N 3.14Å; L165-R167 PolarHBondContact O-N 3.01Å; R167-C169 VanDerWaalsContact C-N 3.34Å; R167-C169 PolarHBondContact O-N 3.36Å
168	C	89.2	Confident	92.4	Very high	26 Å²	26	41.8 Å²	41.8	18%	0.176	22%	0.221	C	C	.	.	H	α-helix	trans	-67.3	-31.7	178.3	-53.6	0	0	0	0	112.9	F102 E108 L164 L165	F102-C168 HydrophobicContact CD2-CB 4.49Å; F102-C168 HydrophobicContact CE2-CB 4.44Å; E108-C168 PolarHBondContact OE1-SG 3.21Å; L164-C168 PolarHBondContact O-N 2.68Å; L164-C168 PolarHBondContact O-SG 2.87Å; L165-C168 PolarHBondContact O-N 2.71Å
169	C	87.6	Confident	92.3	Very high	7 Å²	7	43.7 Å²	43.7	5%	0.047	23%	0.23	C	C	.	.			trans	-147	104.9	-178.8	-167.6	0	0	0	0	113.2	F93 F102 L165 R167 L171 F172	F93-C169 HydrophobicContact CE1-CB 4.01Å; F93-C169 HydrophobicContact CZ-CB 4.5Å; F102-C169 HydrophobicContact CB-CB 3.98Å; F102-C169 HydrophobicContact CD1-CB 3.63Å; F102-C169 VanDerWaalsContact CD1-SG 3.57Å; F102-C169 HydrophobicContact CD2-CB 4.05Å; F102-C169 HydrophobicContact CE1-CB 4.09Å; F102-C169 HydrophobicContact CE2-CB 4.49Å; F102-C169 HydrophobicContact CG-CB 3.62Å; L165-C169 PolarHBondContact O-N 3.48Å; R167-C169 VanDerWaalsContact C-N 3.34Å; R167-C169 PolarHBondContact O-N 3.36Å; C169-L171 PolarHBondContact O-N 3.04Å; C169-L171 VanDerWaalsContact O-N 3.13Å; C169-F172 VanDerWaalsContact O-CB 3.28Å; C169-F172 WeakPolarHBondContact O-CB 3.19Å; C169-F172 PolarHBondContact O-N 2.93Å
170	H	83	Confident	92.2	Very high	145 Å²	145	46.9 Å²	46.9	67%	0.671	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-18.7	176	65.6	76.4	0	0	0	114	F172 S173	H170-F172 PolarHBondContact O-N 3Å; H170-S173 VanDerWaalsContact O-CB 3.27Å; H170-S173 WeakPolarHBondContact O-CB 3.36Å; H170-S173 PolarHBondContact O-N 2.8Å; H170-S173 VanDerWaalsContact O-N 3.12Å
171	L	89.8	Confident	92	Very high	74 Å²	74	49.8 Å²	49.8	39%	0.387	26%	0.259	S	S	.	.	H	α-helix	trans	-69.8	-15.6	174.3	-60.9	174.2	0	0	0	112.7	F93 C169 S173 T174 Y175	F93-L171 HydrophobicContact CZ-CB 4.08Å; C169-L171 PolarHBondContact O-N 3.04Å; C169-L171 VanDerWaalsContact O-N 3.13Å; L171-S173 PolarHBondContact O-N 3.03Å; L171-T174 PolarHBondContact O-N 3.17Å; L171-T174 PolarHBondContact O-OG1 2.89Å; L171-Y175 WeakPolarHBondContact O-CB 3.24Å; L171-Y175 PolarHBondContact O-N 3.41Å
172	F	92.6	Very high	91.8	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.3	-35.6	167.8	176.8	-115.8	0	0	0	111.2	L86 A90 F93 V162 L165 N166 C169 H170 Y175 V176	L86-F172 HydrophobicContact CD1-CZ 4.21Å; A90-F172 HydrophobicContact CB-CE1 4.45Å; A90-F172 HydrophobicContact CB-CE2 3.86Å; A90-F172 HydrophobicContact CB-CZ 3.63Å; F93-F172 HydrophobicContact CB-CD2 3.9Å; F93-F172 HydrophobicContact CB-CE2 4.33Å; F93-F172 HydrophobicContact CD1-CB 4.07Å; F93-F172 HydrophobicContact CD1-CD2 4.01Å; F93-F172 HydrophobicContact CD1-CG 4.44Å; F93-F172 HydrophobicContact CD2-CD2 4.29Å; F93-F172 HydrophobicContact CE1-CB 3.9Å; F93-F172 HydrophobicContact CG-CB 4.48Å; F93-F172 AromaticContact CG-CD2 3.81Å; F93-F172 HydrophobicContact CG-CD2 3.81Å; F93-F172 HydrophobicContact CZ-CB 4.16Å; V162-F172 HydrophobicContact CG1-CE1 4.25Å; L165-F172 HydrophobicContact CD2-CD1 4.45Å; L165-F172 HydrophobicContact CD2-CD2 3.86Å; L165-F172 HydrophobicContact CD2-CE2 4.09Å; L165-F172 HydrophobicContact CD2-CG 4.06Å; L165-F172 HydrophobicContact CD2-CZ 4.46Å; L165-F172 HydrophobicContact CG-CG 4.31Å; N166-F172 HydrophobicContact CB-CD1 3.93Å; C169-F172 VanDerWaalsContact O-CB 3.28Å; C169-F172 WeakPolarHBondContact O-CB 3.19Å; C169-F172 PolarHBondContact O-N 2.93Å; H170-F172 PolarHBondContact O-N 3Å; F172-Y175 HydrophobicContact CD2-CD1 4.06Å; F172-Y175 HydrophobicContact CE2-CD1 4.18Å; F172-Y175 WeakPolarHBondContact O-CB 3.42Å; F172-Y175 PolarHBondContact O-N 3.07Å; F172-V176 HydrophobicContact CD1-CG2 4.39Å; F172-V176 HydrophobicContact CD2-CG2 3.99Å; F172-V176 HydrophobicContact CE1-CG2 3.87Å; F172-V176 HydrophobicContact CE2-CG2 3.38Å; F172-V176 HydrophobicContact CG-CG2 4.46Å; F172-V176 HydrophobicContact CZ-CG2 3.32Å; F172-V176 WeakPolarHBondContact O-CG2 3.26Å; F172-V176 PolarHBondContact O-N 2.94Å
173	S	90.9	Very high	91.5	Very high	48 Å²	48	57.1 Å²	57.1	34%	0.336	29%	0.293	S	S	.	.	H	α-helix	trans	-63.2	-45.7	178.8	-173.8	0	0	0	0	112.5	W79 H170 L171 Y175 V176 A177	W79-S173 WeakPolarHBondContact CZ3-OG 3Å; H170-S173 VanDerWaalsContact O-CB 3.27Å; H170-S173 WeakPolarHBondContact O-CB 3.36Å; H170-S173 PolarHBondContact O-N 2.8Å; H170-S173 VanDerWaalsContact O-N 3.12Å; L171-S173 PolarHBondContact O-N 3.03Å; S173-Y175 VanDerWaalsContact C-N 3.34Å; S173-V176 PolarHBondContact O-N 3.25Å; S173-A177 WeakPolarHBondContact O-CB 3.24Å; S173-A177 PolarHBondContact O-N 3.15Å
174	T	92.1	Very high	91.4	Very high	90 Å²	90	60.3 Å²	60.3	55%	0.552	31%	0.308	S	S	*	.	H	α-helix	trans	-69.3	-32.5	176.4	48.1	0	0	0	0	112.4	L171 S178	L171-T174 PolarHBondContact O-N 3.17Å; L171-T174 PolarHBondContact O-OG1 2.89Å; T174-S178 WeakPolarHBondContact O-CB 3.46Å; T174-S178 PolarHBondContact O-N 2.86Å
175	Y	92.7	Very high	91.4	Very high	40 Å²	40	66 Å²	66	16%	0.157	33%	0.334	C	S	.	.	H	α-helix	trans	-63.7	-48.2	173.3	172.3	-104.3	0	0	0	112.5	L89 F93 L171 F172 S173 S178 H179	L89-Y175 HydrophobicContact CB-CE1 4.15Å; L89-Y175 HydrophobicContact CD2-CE1 3.81Å; F93-Y175 HydrophobicContact CB-CD1 3.94Å; F93-Y175 HydrophobicContact CB-CE1 3.83Å; F93-Y175 AromaticContact CD2-CD1 3.62Å; F93-Y175 HydrophobicContact CD2-CD1 3.62Å; F93-Y175 HydrophobicContact CD2-CD2 4.08Å; F93-Y175 HydrophobicContact CD2-CE1 4.2Å; F93-Y175 AromaticContact CD2-CG 3.55Å; F93-Y175 HydrophobicContact CD2-CG 3.55Å; F93-Y175 HydrophobicContact CE2-CG 4.15Å; F93-Y175 HydrophobicContact CG-CD1 4.14Å; F93-Y175 HydrophobicContact CG-CE1 4.48Å; F93-Y175 HydrophobicContact CG-CG 4.5Å; L171-Y175 WeakPolarHBondContact O-CB 3.24Å; L171-Y175 PolarHBondContact O-N 3.41Å; F172-Y175 HydrophobicContact CD2-CD1 4.06Å; F172-Y175 HydrophobicContact CE2-CD1 4.18Å; F172-Y175 WeakPolarHBondContact O-CB 3.42Å; F172-Y175 PolarHBondContact O-N 3.07Å; S173-Y175 VanDerWaalsContact C-N 3.34Å; Y175-S178 PolarHBondContact O-N 2.9Å; Y175-H179 AromaticContact CD2-CD2 3.95Å; Y175-H179 AromaticContact CE1-CD2 3.9Å; Y175-H179 AromaticContact CE2-CD2 3.46Å; Y175-H179 VanDerWaalsContact CE2-CD2 3.46Å; Y175-H179 WeakPolarHBondContact CE2-CD2 3.4Å; Y175-H179 AromaticContact CE2-NE2 3.18Å; Y175-H179 WeakPolarHBondContact CE2-NE2 3.31Å; Y175-H179 AromaticContact CZ-CD2 3.43Å; Y175-H179 VanDerWaalsContact CZ-CD2 3.43Å; Y175-H179 AromaticContact CZ-NE2 3.31Å; Y175-H179 VanDerWaalsContact CZ-NE2 3.31Å; Y175-H179 PolarHBondContact O-N 3.34Å; Y175-H179 VanDerWaalsContact O-N 3.12Å; Y175-H179 PolarHBondContact OH-NE2 3.48Å
176	V	94	Very high	91.3	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-64.6	-42.4	176	177	0	0	0	0	111.1	W79 F81 L86 F172 S173 S178 H179 K180	W79-V176 HydrophobicContact CB-CG1 4.06Å; W79-V176 HydrophobicContact CD2-CG1 4.09Å; W79-V176 HydrophobicContact CE3-CB 3.91Å; W79-V176 HydrophobicContact CE3-CG1 3.59Å; W79-V176 HydrophobicContact CG-CG1 4.35Å; W79-V176 HydrophobicContact CZ3-CB 4.1Å; W79-V176 HydrophobicContact CZ3-CG1 4.29Å; F81-V176 HydrophobicContact CD2-CG1 3.69Å; F81-V176 HydrophobicContact CE2-CG1 3.77Å; L86-V176 HydrophobicContact CD1-CG1 3.81Å; L86-V176 HydrophobicContact CD1-CG2 3.96Å; F172-V176 HydrophobicContact CD1-CG2 4.39Å; F172-V176 HydrophobicContact CD2-CG2 3.99Å; F172-V176 HydrophobicContact CE1-CG2 3.87Å; F172-V176 HydrophobicContact CE2-CG2 3.38Å; F172-V176 HydrophobicContact CG-CG2 4.46Å; F172-V176 HydrophobicContact CZ-CG2 3.32Å; F172-V176 WeakPolarHBondContact O-CG2 3.26Å; F172-V176 PolarHBondContact O-N 2.94Å; S173-V176 PolarHBondContact O-N 3.25Å; V176-S178 VanDerWaalsContact C-N 3.31Å; V176-S178 PolarHBondContact O-N 2.88Å; V176-H179 PolarHBondContact O-N 2.88Å; V176-K180 PolarHBondContact O-N 2.89Å
177	A	92.5	Very high	91.2	Very high	47 Å²	47	73 Å²	73	39%	0.388	37%	0.366	S	S	.	.	H	α-helix	trans	-60.3	-39.1	176.3	0	0	0	0	0	112.5	S173 K180 I181	S173-A177 WeakPolarHBondContact O-CB 3.24Å; S173-A177 PolarHBondContact O-N 3.15Å; A177-K180 WeakPolarHBondContact O-CB 3.4Å; A177-K180 PolarHBondContact O-N 3.47Å; A177-I181 WeakPolarHBondContact O-CG1 3.39Å; A177-I181 PolarHBondContact O-N 3.44Å
178	S	93.8	Very high	91.4	Very high	77 Å²	77	70.9 Å²	70.9	54%	0.538	36%	0.361	S	S	.	.	H	α-helix	trans	-63.5	-45.7	175.2	-169	0	0	0	0	112	T174 Y175 V176 K180 I181 E182	T174-S178 WeakPolarHBondContact O-CB 3.46Å; T174-S178 PolarHBondContact O-N 2.86Å; Y175-S178 PolarHBondContact O-N 2.9Å; V176-S178 VanDerWaalsContact C-N 3.31Å; V176-S178 PolarHBondContact O-N 2.88Å; S178-K180 VanDerWaalsContact C-N 3.3Å; S178-K180 PolarHBondContact O-N 3.38Å; S178-I181 PolarHBondContact O-N 2.87Å; S178-E182 PolarHBondContact O-N 3.36Å; S178-E182 VanDerWaalsContact O-N 3.13Å
179	H	93	Very high	91.6	Very high	47 Å²	47	76.2 Å²	76.2	22%	0.218	38%	0.381	C	S	.	.	H	α-helix	trans	-68.6	-27.2	176.6	-80.8	-57.9	0	0	0	113	F81 L89 Y175 V176 E182 K183	F81-H179 HydrophobicContact CE2-CB 4.49Å; F81-H179 HydrophobicContact CZ-CB 3.95Å; L89-H179 HydrophobicContact CD1-CB 4.49Å; L89-H179 HydrophobicContact CD2-CB 4.11Å; L89-H179 WeakPolarHBondContact CD2-CD2 3.14Å; Y175-H179 AromaticContact CD2-CD2 3.95Å; Y175-H179 AromaticContact CE1-CD2 3.9Å; Y175-H179 AromaticContact CE2-CD2 3.46Å; Y175-H179 VanDerWaalsContact CE2-CD2 3.46Å; Y175-H179 WeakPolarHBondContact CE2-CD2 3.4Å; Y175-H179 AromaticContact CE2-NE2 3.18Å; Y175-H179 WeakPolarHBondContact CE2-NE2 3.31Å; Y175-H179 AromaticContact CZ-CD2 3.43Å; Y175-H179 VanDerWaalsContact CZ-CD2 3.43Å; Y175-H179 AromaticContact CZ-NE2 3.31Å; Y175-H179 VanDerWaalsContact CZ-NE2 3.31Å; Y175-H179 PolarHBondContact O-N 3.34Å; Y175-H179 VanDerWaalsContact O-N 3.12Å; Y175-H179 PolarHBondContact OH-NE2 3.48Å; V176-H179 PolarHBondContact O-N 2.88Å; H179-E182 IonicContact CE1-OE2 2.69Å; H179-E182 PolarHBondContact CE1-OE2 3.01Å; H179-E182 IonicContact CG-OE2 2.66Å; H179-E182 IonicContact ND1-OE2 2.76Å; H179-E182 PolarHBondContact ND1-OE2 3.17Å; H179-E182 PolarHBondContact O-N 2.99Å; H179-K183 WeakPolarHBondContact O-CB 3.29Å; H179-K183 PolarHBondContact O-N 2.65Å
180	K	93.3	Very high	91.9	Very high	67 Å²	67	83.4 Å²	83.4	29%	0.291	41%	0.408	S	S	.	.	H	α-helix	trans	-63	-49	173.2	-176.6	-179.9	177.7	164.7	0	110.9	W79 F81 V176 A177 S178 E182 K183 E184	W79-K180 WeakPolarHBondContact O-CD 3.2Å; F81-K180 HydrophobicContact CE2-CB 3.86Å; F81-K180 HydrophobicContact CZ-CB 4.34Å; V176-K180 PolarHBondContact O-N 2.89Å; A177-K180 WeakPolarHBondContact O-CB 3.4Å; A177-K180 PolarHBondContact O-N 3.47Å; S178-K180 VanDerWaalsContact C-N 3.3Å; S178-K180 PolarHBondContact O-N 3.38Å; K180-E182 VanDerWaalsContact C-N 3.3Å; K180-E182 PolarHBondContact O-N 2.89Å; K180-K183 PolarHBondContact O-N 2.76Å; K180-E184 WeakPolarHBondContact CE-OE1 3.32Å; K180-E184 IonicContact NZ-OE1 3.03Å; K180-E184 WeakPolarHBondContact O-CG 3.38Å; K180-E184 PolarHBondContact O-N 3.39Å
181	I	92.8	Very high	92.4	Very high	109 Å²	109	82 Å²	82	56%	0.559	40%	0.399	S	S	*	.	H	α-helix	trans	-59.7	-43.7	177.5	-64.4	164	0	0	0	110.3	A177 S178 K183 E184 E185	A177-I181 WeakPolarHBondContact O-CG1 3.39Å; A177-I181 PolarHBondContact O-N 3.44Å; S178-I181 PolarHBondContact O-N 2.87Å; I181-K183 PolarHBondContact O-N 2.89Å; I181-E184 PolarHBondContact O-N 2.98Å; I181-E185 WeakPolarHBondContact O-CB 3.45Å; I181-E185 PolarHBondContact O-N 3.15Å
182	E	91.4	Very high	92.6	Very high	84 Å²	84	83.4 Å²	83.4	39%	0.393	40%	0.404	S	S	.	.	H	α-helix	trans	-59.3	-45.6	175.2	-178	-175.5	-161	0	0	112.4	S178 H179 K180 E185 Q186	S178-E182 PolarHBondContact O-N 3.36Å; S178-E182 VanDerWaalsContact O-N 3.13Å; H179-E182 IonicContact CE1-OE2 2.69Å; H179-E182 PolarHBondContact CE1-OE2 3.01Å; H179-E182 IonicContact CG-OE2 2.66Å; H179-E182 IonicContact ND1-OE2 2.76Å; H179-E182 PolarHBondContact ND1-OE2 3.17Å; H179-E182 PolarHBondContact O-N 2.99Å; K180-E182 VanDerWaalsContact C-N 3.3Å; K180-E182 PolarHBondContact O-N 2.89Å; E182-E185 PolarHBondContact O-N 2.85Å; E182-Q186 WeakPolarHBondContact O-CB 3.26Å; E182-Q186 VanDerWaalsContact O-CG 3.27Å; E182-Q186 WeakPolarHBondContact O-CG 3.28Å; E182-Q186 PolarHBondContact O-N 3.44Å; E182-Q186 PolarHBondContact OE1-NE2 3.4Å
183	K	89.3	Confident	92.7	Very high	71 Å²	71	87.8 Å²	87.8	31%	0.309	43%	0.425	S	S	.	.	H	α-helix	trans	-62.8	-43.2	177.5	-178.8	171.8	172.9	177.9	0	111.7	F81 E85 H179 K180 I181 E187	F81-K183 HydrophobicContact CD1-CD 4.14Å; F81-K183 HydrophobicContact CE1-CD 3.61Å; F81-K183 HydrophobicContact CZ-CD 4.32Å; E85-K183 IonicContact OE1-NZ 2.97Å; E85-K183 PolarHBondContact OE1-NZ 3.46Å; E85-K183 IonicContact OE2-NZ 2.76Å; E85-K183 PolarHBondContact OE2-NZ 3.43Å; H179-K183 WeakPolarHBondContact O-CB 3.29Å; H179-K183 PolarHBondContact O-N 2.65Å; K180-K183 PolarHBondContact O-N 2.76Å; I181-K183 PolarHBondContact O-N 2.89Å; K183-E187 WeakPolarHBondContact O-CB 3.45Å; K183-E187 PolarHBondContact O-N 3.24Å
184	E	92	Very high	92.9	Very high	110 Å²	110	90.4 Å²	90.4	51%	0.514	43%	0.431	S	S	.	.	H	α-helix	trans	-66.1	-40.2	177.1	-71.6	174.7	-180	0	0	112.1	K180 I181 K188	K180-E184 WeakPolarHBondContact CE-OE1 3.32Å; K180-E184 IonicContact NZ-OE1 3.03Å; K180-E184 WeakPolarHBondContact O-CG 3.38Å; K180-E184 PolarHBondContact O-N 3.39Å; I181-E184 PolarHBondContact O-N 2.98Å; E184-K188 WeakPolarHBondContact O-CB 3.46Å; E184-K188 PolarHBondContact O-N 3.4Å
185	E	93.2	Very high	93.1	Very high	130 Å²	130	90.8 Å²	90.8	61%	0.607	43%	0.427	S	S	*	.	H	α-helix	trans	-66.6	-44.7	175.1	-172.9	179.9	174.6	0	0	112	I181 E182 E187 K188 K189	I181-E185 WeakPolarHBondContact O-CB 3.45Å; I181-E185 PolarHBondContact O-N 3.15Å; E182-E185 PolarHBondContact O-N 2.85Å; E185-E187 PolarHBondContact O-N 2.93Å; E185-K188 PolarHBondContact O-N 3.3Å; E185-K189 WeakPolarHBondContact O-CB 3.35Å; E185-K189 PolarHBondContact O-N 3.07Å
186	Q	90.3	Very high	93.2	Very high	119 Å²	119	94.6 Å²	94.6	56%	0.556	44%	0.441	S	S	*	.	H	α-helix	trans	-62	-41.7	176.5	-73.1	179.5	20.6	0	0	111.8	E182 K189 R190	E182-Q186 WeakPolarHBondContact O-CB 3.26Å; E182-Q186 VanDerWaalsContact O-CG 3.27Å; E182-Q186 WeakPolarHBondContact O-CG 3.28Å; E182-Q186 PolarHBondContact O-N 3.44Å; E182-Q186 PolarHBondContact OE1-NE2 3.4Å; Q186-K189 PolarHBondContact O-N 2.88Å; Q186-R190 WeakPolarHBondContact O-CB 3.41Å; Q186-R190 PolarHBondContact O-N 3.3Å
187	E	91.2	Very high	93.3	Very high	74 Å²	74	100.9 Å²	100.9	35%	0.346	47%	0.465	S	S	.	.	H	α-helix	trans	-66.8	-42.7	176.2	-172.6	178.7	156.7	0	0	112	K183 E185 R190 K191	K183-E187 WeakPolarHBondContact O-CB 3.45Å; K183-E187 PolarHBondContact O-N 3.24Å; E185-E187 PolarHBondContact O-N 2.93Å; E187-R190 PolarHBondContact O-N 3.36Å; E187-K191 HydrophobicContact CG-CD 4.47Å; E187-K191 WeakPolarHBondContact O-CG 3.36Å; E187-K191 PolarHBondContact O-N 2.9Å; E187-K191 VanDerWaalsContact O-N 3.08Å; E187-K191 WeakPolarHBondContact OE1-CE 3.36Å; E187-K191 IonicContact OE1-NZ 2.99Å; E187-K191 PolarHBondContact OE1-NZ 2.67Å
188	K	94.6	Very high	93.4	Very high	124 Å²	124	106.1 Å²	106.1	54%	0.539	48%	0.475	S	S	.	.	H	α-helix	trans	-58	-50.7	174.2	176.8	-176.9	166.6	-174.6	0	111	E184 E185 R190 K191 E192	E184-K188 WeakPolarHBondContact O-CB 3.46Å; E184-K188 PolarHBondContact O-N 3.4Å; E185-K188 PolarHBondContact O-N 3.3Å; K188-R190 VanDerWaalsContact C-N 3.3Å; K188-R190 PolarHBondContact O-N 2.89Å; K188-K191 WeakPolarHBondContact O-CB 3.48Å; K188-K191 PolarHBondContact O-N 2.76Å; K188-K191 VanDerWaalsContact O-N 3.09Å; K188-E192 WeakPolarHBondContact CE-OE1 3.22Å; K188-E192 HydrophobicContact CG-CG 4.45Å; K188-E192 IonicContact NZ-OE1 2.71Å; K188-E192 PolarHBondContact O-N 2.74Å
189	K	94	Very high	93.6	Very high	137 Å²	137	109.6 Å²	109.6	60%	0.596	48%	0.476	S	S	*	.	H	α-helix	trans	-59.3	-39.7	179.6	-175.1	177.9	179.9	179.5	0	112.1	E185 Q186 E192 E193	E185-K189 WeakPolarHBondContact O-CB 3.35Å; E185-K189 PolarHBondContact O-N 3.07Å; Q186-K189 PolarHBondContact O-N 2.88Å; K189-E192 PolarHBondContact O-N 3.42Å; K189-E193 WeakPolarHBondContact O-CB 3.33Å; K189-E193 PolarHBondContact O-N 3.05Å
190	R	93	Very high	93.7	Very high	159 Å²	159	111.7 Å²	111.7	60%	0.6	49%	0.486	S	S	*	.	H	α-helix	trans	-62.1	-42.2	174.6	-173.1	178.1	69.1	-152.4	-1.2	112	Q186 E187 K188 E193 E194	Q186-R190 WeakPolarHBondContact O-CB 3.41Å; Q186-R190 PolarHBondContact O-N 3.3Å; E187-R190 PolarHBondContact O-N 3.36Å; K188-R190 VanDerWaalsContact C-N 3.3Å; K188-R190 PolarHBondContact O-N 2.89Å; R190-E193 PolarHBondContact O-N 2.9Å; R190-E194 WeakPolarHBondContact O-CB 3.38Å; R190-E194 PolarHBondContact O-N 3.28Å
191	K	94.3	Very high	93.8	Very high	114 Å²	114	114.4 Å²	114.4	50%	0.496	50%	0.499	S	S	.	.	H	α-helix	trans	-66.8	-43	176.4	-70.2	170.8	-177.1	168.8	0	112	E187 K188 E193 E194 E195	E187-K191 HydrophobicContact CG-CD 4.47Å; E187-K191 WeakPolarHBondContact O-CG 3.36Å; E187-K191 PolarHBondContact O-N 2.9Å; E187-K191 VanDerWaalsContact O-N 3.08Å; E187-K191 WeakPolarHBondContact OE1-CE 3.36Å; E187-K191 IonicContact OE1-NZ 2.99Å; E187-K191 PolarHBondContact OE1-NZ 2.67Å; K188-K191 WeakPolarHBondContact O-CB 3.48Å; K188-K191 PolarHBondContact O-N 2.76Å; K188-K191 VanDerWaalsContact O-N 3.09Å; K191-E193 VanDerWaalsContact C-N 3.34Å; K191-E193 PolarHBondContact O-N 2.97Å; K191-E194 PolarHBondContact O-N 2.74Å; K191-E195 WeakPolarHBondContact O-CB 3.37Å; K191-E195 PolarHBondContact O-N 2.76Å
192	E	94.7	Very high	93.9	Very high	105 Å²	105	112.7 Å²	112.7	49%	0.491	49%	0.489	S	S	.	.	H	α-helix	trans	-63.9	-38.2	176.5	-71.3	176.9	161.5	0	0	111.9	K188 K189 R196	K188-E192 WeakPolarHBondContact CE-OE1 3.22Å; K188-E192 HydrophobicContact CG-CG 4.45Å; K188-E192 IonicContact NZ-OE1 2.71Å; K188-E192 PolarHBondContact O-N 2.74Å; K189-E192 PolarHBondContact O-N 3.42Å; E192-R196 VanDerWaalsContact O-CB 3.24Å; E192-R196 WeakPolarHBondContact O-CB 2.8Å; E192-R196 PolarHBondContact O-N 2.95Å
193	E	94.4	Very high	94.1	Very high	92 Å²	92	114.5 Å²	114.5	43%	0.43	50%	0.497	S	S	.	.	H	α-helix	trans	-70.1	-40.4	174.8	178.4	137.3	-103.9	0	0	113.1	K189 R190 K191 R196 R197	K189-E193 WeakPolarHBondContact O-CB 3.33Å; K189-E193 PolarHBondContact O-N 3.05Å; R190-E193 PolarHBondContact O-N 2.9Å; K191-E193 VanDerWaalsContact C-N 3.34Å; K191-E193 PolarHBondContact O-N 2.97Å; E193-R196 PolarHBondContact O-N 2.6Å; E193-R196 IonicContact OE1-CZ 3.21Å; E193-R196 IonicContact OE1-NH1 3.73Å; E193-R196 PolarHBondContact OE1-NH1 3.38Å; E193-R196 IonicContact OE1-NH2 3.33Å; E193-R196 PolarHBondContact OE1-NH2 3.32Å; E193-R197 WeakPolarHBondContact O-CB 3.5Å; E193-R197 PolarHBondContact O-N 3.29Å
194	E	94.3	Very high	94.4	Very high	103 Å²	103	118.7 Å²	118.7	48%	0.481	51%	0.511	S	S	.	.	H	α-helix	trans	-65.6	-42.8	174.8	177	154.8	-125.7	0	0	112.1	R190 K191 R197 R198	R190-E194 WeakPolarHBondContact O-CB 3.38Å; R190-E194 PolarHBondContact O-N 3.28Å; K191-E194 PolarHBondContact O-N 2.74Å; E194-R197 PolarHBondContact O-N 2.95Å; E194-R197 IonicContact OE1-NH2 3.51Å; E194-R197 PolarHBondContact OE1-NH2 3.16Å; E194-R198 WeakPolarHBondContact O-CB 3.45Å; E194-R198 PolarHBondContact O-N 2.92Å
195	E	95.4	Very high	94.6	Very high	98 Å²	98	118.6 Å²	118.6	46%	0.458	51%	0.511	S	S	.	.	H	α-helix	trans	-65.1	-41.3	174	-164.4	-171.9	-177	0	0	111.4	K191 R198 R199	K191-E195 WeakPolarHBondContact O-CB 3.37Å; K191-E195 PolarHBondContact O-N 2.76Å; E195-R198 PolarHBondContact O-N 2.91Å; E195-R199 VanDerWaalsContact O-CG 3.31Å; E195-R199 WeakPolarHBondContact O-CG 3.23Å; E195-R199 PolarHBondContact O-N 2.92Å; E195-R199 IonicContact OE1-CZ 2.8Å; E195-R199 IonicContact OE1-NE 3.03Å; E195-R199 PolarHBondContact OE1-NE 2.86Å; E195-R199 IonicContact OE1-NH2 3.15Å; E195-R199 PolarHBondContact OE1-NH2 3.18Å; E195-R199 IonicContact OE2-CZ 3.07Å; E195-R199 IonicContact OE2-NH2 3.37Å; E195-R199 PolarHBondContact OE2-NH2 3.05Å
196	R	95.6	Very high	94.8	Very high	120 Å²	120	120.4 Å²	120.4	45%	0.453	51%	0.512	S	S	.	.	H	α-helix	trans	-59.4	-50.2	175	-166.2	-167.8	72.1	-121.9	-2.8	111.1	E192 E193 R198 R199 E200	E192-R196 VanDerWaalsContact O-CB 3.24Å; E192-R196 WeakPolarHBondContact O-CB 2.8Å; E192-R196 PolarHBondContact O-N 2.95Å; E193-R196 PolarHBondContact O-N 2.6Å; E193-R196 IonicContact OE1-CZ 3.21Å; E193-R196 IonicContact OE1-NH1 3.73Å; E193-R196 PolarHBondContact OE1-NH1 3.38Å; E193-R196 IonicContact OE1-NH2 3.33Å; E193-R196 PolarHBondContact OE1-NH2 3.32Å; R196-R198 VanDerWaalsContact C-N 3.31Å; R196-R198 PolarHBondContact O-N 2.76Å; R196-R199 PolarHBondContact O-N 2.89Å; R196-R199 VanDerWaalsContact O-N 3.16Å; R196-E200 WeakPolarHBondContact CD-OE1 3.49Å; R196-E200 VanDerWaalsContact CG-OE1 3.31Å; R196-E200 WeakPolarHBondContact CG-OE1 3.14Å; R196-E200 IonicContact NE-OE1 2.71Å; R196-E200 PolarHBondContact NE-OE1 3.41Å; R196-E200 WeakPolarHBondContact O-CG 3.49Å; R196-E200 PolarHBondContact O-N 3.4Å
197	R	95.6	Very high	95.1	Very high	132 Å²	132	119.4 Å²	119.4	50%	0.498	51%	0.51	S	S	.	.	H	α-helix	trans	-57.4	-44	176.8	-173.8	-174.7	70.9	-135.3	-6.5	111.4	E193 E194 E200 E201	E193-R197 WeakPolarHBondContact O-CB 3.5Å; E193-R197 PolarHBondContact O-N 3.29Å; E194-R197 PolarHBondContact O-N 2.95Å; E194-R197 IonicContact OE1-NH2 3.51Å; E194-R197 PolarHBondContact OE1-NH2 3.16Å; R197-E200 PolarHBondContact O-N 3.45Å; R197-E201 WeakPolarHBondContact O-CB 3.19Å; R197-E201 PolarHBondContact O-N 2.83Å
198	R	96.4	Very high	95.3	Very high	157 Å²	157	121.4 Å²	121.4	59%	0.592	52%	0.519	S	S	*	.	H	α-helix	trans	-62.6	-42.5	176.8	-179.6	-178.7	162.2	-176.4	-7.2	112.1	E194 E195 R196 E201 E202	E194-R198 WeakPolarHBondContact O-CB 3.45Å; E194-R198 PolarHBondContact O-N 2.92Å; E195-R198 PolarHBondContact O-N 2.91Å; R196-R198 VanDerWaalsContact C-N 3.31Å; R196-R198 PolarHBondContact O-N 2.76Å; R198-E201 PolarHBondContact O-N 3.22Å; R198-E202 IonicContact CZ-OE1 2.72Å; R198-E202 IonicContact NE-OE1 3.41Å; R198-E202 PolarHBondContact NE-OE1 3.32Å; R198-E202 IonicContact NH2-OE1 3.87Å; R198-E202 PolarHBondContact NH2-OE1 3.01Å; R198-E202 WeakPolarHBondContact O-CG 3.48Å; R198-E202 PolarHBondContact O-N 2.9Å
199	R	95.9	Very high	95.4	Very high	149 Å²	149	120.9 Å²	120.9	56%	0.562	52%	0.519	S	S	*	.	H	α-helix	trans	-64.7	-42.7	175.8	-68.9	171.9	-175.1	-173.7	5.5	111.6	E195 R196 E201 E202 E203	E195-R199 VanDerWaalsContact O-CG 3.31Å; E195-R199 WeakPolarHBondContact O-CG 3.23Å; E195-R199 PolarHBondContact O-N 2.92Å; E195-R199 IonicContact OE1-CZ 2.8Å; E195-R199 IonicContact OE1-NE 3.03Å; E195-R199 PolarHBondContact OE1-NE 2.86Å; E195-R199 IonicContact OE1-NH2 3.15Å; E195-R199 PolarHBondContact OE1-NH2 3.18Å; E195-R199 IonicContact OE2-CZ 3.07Å; E195-R199 IonicContact OE2-NH2 3.37Å; E195-R199 PolarHBondContact OE2-NH2 3.05Å; R196-R199 PolarHBondContact O-N 2.89Å; R196-R199 VanDerWaalsContact O-N 3.16Å; R199-E201 VanDerWaalsContact C-N 3.27Å; R199-E201 PolarHBondContact O-N 2.97Å; R199-E202 PolarHBondContact O-N 3.11Å; R199-E203 VanDerWaalsContact O-CB 3.32Å; R199-E203 WeakPolarHBondContact O-CB 3.33Å; R199-E203 PolarHBondContact O-N 3.19Å
200	E	95.2	Very high	95.4	Very high	91 Å²	91	120 Å²	120	43%	0.425	52%	0.517	S	S	.	.	H	α-helix	trans	-61.3	-33.5	174.2	-70.1	170.3	-153.6	0	0	112.3	R196 R197 R204	R196-E200 WeakPolarHBondContact CD-OE1 3.49Å; R196-E200 VanDerWaalsContact CG-OE1 3.31Å; R196-E200 WeakPolarHBondContact CG-OE1 3.14Å; R196-E200 IonicContact NE-OE1 2.71Å; R196-E200 PolarHBondContact NE-OE1 3.41Å; R196-E200 WeakPolarHBondContact O-CG 3.49Å; R196-E200 PolarHBondContact O-N 3.4Å; R197-E200 PolarHBondContact O-N 3.45Å; E200-R204 VanDerWaalsContact O-CB 3.24Å; E200-R204 WeakPolarHBondContact O-CB 3.1Å; E200-R204 PolarHBondContact O-N 2.8Å; E200-R204 VanDerWaalsContact O-N 3.07Å
201	E	95.4	Very high	95.6	Very high	125 Å²	125	117.7 Å²	117.7	58%	0.584	51%	0.513	S	S	*	.	H	α-helix	trans	-75.7	-46.8	176.6	-171.8	165.2	-154.6	0	0	112.1	R197 R198 R199 E203 R204 E205	R197-E201 WeakPolarHBondContact O-CB 3.19Å; R197-E201 PolarHBondContact O-N 2.83Å; R198-E201 PolarHBondContact O-N 3.22Å; R199-E201 VanDerWaalsContact C-N 3.27Å; R199-E201 PolarHBondContact O-N 2.97Å; E201-E203 VanDerWaalsContact C-N 3.31Å; E201-E203 PolarHBondContact O-N 3.23Å; E201-R204 PolarHBondContact O-N 3.32Å; E201-E205 PolarHBondContact O-N 2.91Å
202	E	96.1	Very high	95.6	Very high	72 Å²	72	115.5 Å²	115.5	34%	0.336	51%	0.505	S	S	.	.	H	α-helix	trans	-61.6	-35.8	173.5	-73.6	-176.4	-161.5	0	0	112.3	R198 R199 R206	R198-E202 IonicContact CZ-OE1 2.72Å; R198-E202 IonicContact NE-OE1 3.41Å; R198-E202 PolarHBondContact NE-OE1 3.32Å; R198-E202 IonicContact NH2-OE1 3.87Å; R198-E202 PolarHBondContact NH2-OE1 3.01Å; R198-E202 WeakPolarHBondContact O-CG 3.48Å; R198-E202 PolarHBondContact O-N 2.9Å; R199-E202 PolarHBondContact O-N 3.11Å; E202-R206 VanDerWaalsContact O-CD 3.25Å; E202-R206 WeakPolarHBondContact O-CD 3.27Å; E202-R206 WeakPolarHBondContact O-CG 3.19Å; E202-R206 PolarHBondContact O-N 2.9Å; E202-R206 VanDerWaalsContact O-N 3.15Å
203	E	95.8	Very high	95.7	Very high	122 Å²	122	116.4 Å²	116.4	57%	0.57	51%	0.507	S	S	*	.	H	α-helix	trans	-69.1	-44	173.8	-174.7	175.1	180	0	0	111.6	R199 E201 E205 R206 L207	R199-E203 VanDerWaalsContact O-CB 3.32Å; R199-E203 WeakPolarHBondContact O-CB 3.33Å; R199-E203 PolarHBondContact O-N 3.19Å; E201-E203 VanDerWaalsContact C-N 3.31Å; E201-E203 PolarHBondContact O-N 3.23Å; E203-E205 PolarHBondContact O-N 2.69Å; E203-R206 PolarHBondContact O-N 3.18Å; E203-L207 HydrophobicContact CG-CD1 4.23Å; E203-L207 WeakPolarHBondContact O-CG 3.38Å; E203-L207 PolarHBondContact O-N 3.25Å
204	R	96.1	Very high	95.8	Very high	159 Å²	159	118.3 Å²	118.3	60%	0.6	51%	0.51	S	S	*	.	H	α-helix	trans	-61.1	-42	176.2	-176.8	-177.6	-57.5	-83.9	-5.3	112	E200 E201 L207 Q208	E200-R204 VanDerWaalsContact O-CB 3.24Å; E200-R204 WeakPolarHBondContact O-CB 3.1Å; E200-R204 PolarHBondContact O-N 2.8Å; E200-R204 VanDerWaalsContact O-N 3.07Å; E201-R204 PolarHBondContact O-N 3.32Å; R204-L207 PolarHBondContact O-N 2.75Å; R204-Q208 WeakPolarHBondContact O-CG 3.31Å; R204-Q208 PolarHBondContact O-N 3.39Å
205	E	96.1	Very high	95.9	Very high	108 Å²	108	119.7 Å²	119.7	51%	0.505	51%	0.511	S	S	.	.	H	α-helix	trans	-64.5	-45.1	176.8	-160.9	-163.6	160.2	0	0	110.9	E201 E203 L207 Q208 Q209	E201-E205 PolarHBondContact O-N 2.91Å; E203-E205 PolarHBondContact O-N 2.69Å; E205-L207 VanDerWaalsContact C-N 3.33Å; E205-L207 PolarHBondContact O-N 3.24Å; E205-Q208 PolarHBondContact O-N 2.82Å; E205-Q208 VanDerWaalsContact O-N 3.17Å; E205-Q209 HydrophobicContact CG-CG 4.49Å; E205-Q209 WeakPolarHBondContact O-CG 3.5Å; E205-Q209 PolarHBondContact O-N 2.81Å; E205-Q209 PolarHBondContact OE1-NE2 3.28Å
206	R	96.7	Very high	95.9	Very high	168 Å²	168	122 Å²	122	63%	0.634	52%	0.515	S	S	*	.	H	α-helix	trans	-56.8	-45.4	175.3	-72.5	162.1	-174.3	-91.8	1.3	112.1	E202 E203 Q209 E210	E202-R206 VanDerWaalsContact O-CD 3.25Å; E202-R206 WeakPolarHBondContact O-CD 3.27Å; E202-R206 WeakPolarHBondContact O-CG 3.19Å; E202-R206 PolarHBondContact O-N 2.9Å; E202-R206 VanDerWaalsContact O-N 3.15Å; E203-R206 PolarHBondContact O-N 3.18Å; R206-Q209 PolarHBondContact O-N 3.45Å; R206-E210 WeakPolarHBondContact O-CB 3.41Å; R206-E210 PolarHBondContact O-N 3.12Å
207	L	96.7	Very high	95.9	Very high	98 Å²	98	121.3 Å²	121.3	51%	0.513	52%	0.517	S	S	.	.	H	α-helix	trans	-63.9	-39.2	177.5	-71.3	169.5	0	0	0	112.1	E203 R204 E205 E210 E211	E203-L207 HydrophobicContact CG-CD1 4.23Å; E203-L207 WeakPolarHBondContact O-CG 3.38Å; E203-L207 PolarHBondContact O-N 3.25Å; R204-L207 PolarHBondContact O-N 2.75Å; E205-L207 VanDerWaalsContact C-N 3.33Å; E205-L207 PolarHBondContact O-N 3.24Å; L207-E210 PolarHBondContact O-N 2.84Å; L207-E211 WeakPolarHBondContact O-CB 3.11Å; L207-E211 PolarHBondContact O-N 3.08Å
208	Q	95.4	Very high	95.8	Very high	116 Å²	116	119.3 Å²	119.3	54%	0.542	51%	0.514	S	S	.	.	H	α-helix	trans	-67.5	-41.5	174.9	-74.2	178.4	-3.2	0	0	112.5	R204 E205 E211 E212	R204-Q208 WeakPolarHBondContact O-CG 3.31Å; R204-Q208 PolarHBondContact O-N 3.39Å; E205-Q208 PolarHBondContact O-N 2.82Å; E205-Q208 VanDerWaalsContact O-N 3.17Å; Q208-E211 PolarHBondContact O-N 2.9Å; Q208-E212 WeakPolarHBondContact O-CB 3.45Å; Q208-E212 PolarHBondContact O-N 2.97Å
209	Q	95.8	Very high	95.8	Very high	113 Å²	113	117.9 Å²	117.9	53%	0.528	51%	0.514	S	S	.	.	H	α-helix	trans	-64.1	-39.9	174.8	-69.9	-178.4	16.1	0	0	111.6	E205 R206 K213	E205-Q209 HydrophobicContact CG-CG 4.49Å; E205-Q209 WeakPolarHBondContact O-CG 3.5Å; E205-Q209 PolarHBondContact O-N 2.81Å; E205-Q209 PolarHBondContact OE1-NE2 3.28Å; R206-Q209 PolarHBondContact O-N 3.45Å; Q209-K213 VanDerWaalsContact O-CB 3.23Å; Q209-K213 WeakPolarHBondContact O-CB 3.48Å; Q209-K213 PolarHBondContact O-N 2.88Å
210	E	95.4	Very high	95.7	Very high	120 Å²	120	115.5 Å²	115.5	56%	0.561	51%	0.509	S	S	*	.	H	α-helix	trans	-67.6	-45.8	175.6	-168.3	-173.4	139.9	0	0	111.8	R206 L207 K213 R214	R206-E210 WeakPolarHBondContact O-CB 3.41Å; R206-E210 PolarHBondContact O-N 3.12Å; L207-E210 PolarHBondContact O-N 2.84Å; E210-K213 PolarHBondContact O-N 3.5Å; E210-R214 VanDerWaalsContact O-CB 3.31Å; E210-R214 WeakPolarHBondContact O-CB 3.41Å; E210-R214 PolarHBondContact O-N 3.42Å
211	E	95.7	Very high	95.8	Very high	109 Å²	109	116.6 Å²	116.6	51%	0.509	51%	0.509	S	S	.	.	H	α-helix	trans	-63.9	-43.1	177.2	179.6	168.2	-143.3	0	0	112	L207 Q208 R214 R215	L207-E211 WeakPolarHBondContact O-CB 3.11Å; L207-E211 PolarHBondContact O-N 3.08Å; Q208-E211 PolarHBondContact O-N 2.9Å; E211-R214 PolarHBondContact O-N 2.82Å; E211-R215 WeakPolarHBondContact O-CB 3.37Å; E211-R215 PolarHBondContact O-N 3.01Å
212	E	95	Very high	95.8	Very high	69 Å²	69	115.2 Å²	115.2	32%	0.322	51%	0.505	S	S	.	.	H	α-helix	trans	-63.1	-44.9	174.1	172.2	161.7	-135.1	0	0	111.6	Q208 R214 R215 R216	Q208-E212 WeakPolarHBondContact O-CB 3.45Å; Q208-E212 PolarHBondContact O-N 2.97Å; E212-R214 VanDerWaalsContact C-N 3.33Å; E212-R214 PolarHBondContact O-N 2.95Å; E212-R215 PolarHBondContact O-N 3.39Å; E212-R215 IonicContact OE1-NH2 3.29Å; E212-R215 PolarHBondContact OE1-NH2 3.09Å; E212-R216 VanDerWaalsContact CD-CZ 3.48Å; E212-R216 HydrophobicContact CG-CG 4.27Å; E212-R216 WeakPolarHBondContact O-CG 3.21Å; E212-R216 PolarHBondContact O-N 2.88Å; E212-R216 IonicContact OE1-CZ 2.67Å; E212-R216 IonicContact OE1-NE 2.81Å; E212-R216 PolarHBondContact OE1-NE 3.08Å; E212-R216 VanDerWaalsContact OE1-NE 3.15Å; E212-R216 IonicContact OE1-NH2 3.04Å; E212-R216 PolarHBondContact OE1-NH2 3.5Å; E212-R216 IonicContact OE2-CZ 3.01Å; E212-R216 IonicContact OE2-NH2 2.79Å; E212-R216 PolarHBondContact OE2-NH2 3.43Å
213	K	96.3	Very high	95.8	Very high	123 Å²	123	119.2 Å²	119.2	54%	0.535	52%	0.517	S	S	.	.	H	α-helix	trans	-57.3	-48.5	175.9	178.4	-175.2	164.7	-172.2	0	110.7	Q209 E210 R215 R216 E217	Q209-K213 VanDerWaalsContact O-CB 3.23Å; Q209-K213 WeakPolarHBondContact O-CB 3.48Å; Q209-K213 PolarHBondContact O-N 2.88Å; E210-K213 PolarHBondContact O-N 3.5Å; K213-R215 VanDerWaalsContact C-N 3.31Å; K213-R215 PolarHBondContact O-N 2.71Å; K213-R216 PolarHBondContact O-N 2.94Å; K213-R216 VanDerWaalsContact O-N 3.17Å; K213-E217 WeakPolarHBondContact CE-OE1 3.21Å; K213-E217 HydrophobicContact CG-CG 4.5Å; K213-E217 IonicContact NZ-OE1 3.61Å; K213-E217 WeakPolarHBondContact O-CG 3.19Å; K213-E217 PolarHBondContact O-N 3.04Å
214	R	96.3	Very high	95.8	Very high	132 Å²	132	120.5 Å²	120.5	50%	0.498	52%	0.517	S	S	.	.	H	α-helix	trans	-62.4	-37.8	179.7	-162.6	177.7	69.9	-115.7	-5.3	111.8	E210 E211 E212 E218	E210-R214 VanDerWaalsContact O-CB 3.31Å; E210-R214 WeakPolarHBondContact O-CB 3.41Å; E210-R214 PolarHBondContact O-N 3.42Å; E211-R214 PolarHBondContact O-N 2.82Å; E212-R214 VanDerWaalsContact C-N 3.33Å; E212-R214 PolarHBondContact O-N 2.95Å; R214-E218 WeakPolarHBondContact O-CB 3.36Å; R214-E218 PolarHBondContact O-N 2.92Å
215	R	96.5	Very high	95.7	Very high	132 Å²	132	117.1 Å²	117.1	50%	0.498	51%	0.508	S	S	.	.	H	α-helix	trans	-64.1	-44	172.9	-169.8	-177.5	74.3	-116.4	-1.3	112	E211 E212 K213 E218 E219	E211-R215 WeakPolarHBondContact O-CB 3.37Å; E211-R215 PolarHBondContact O-N 3.01Å; E212-R215 PolarHBondContact O-N 3.39Å; E212-R215 IonicContact OE1-NH2 3.29Å; E212-R215 PolarHBondContact OE1-NH2 3.09Å; K213-R215 VanDerWaalsContact C-N 3.31Å; K213-R215 PolarHBondContact O-N 2.71Å; R215-E218 PolarHBondContact O-N 2.85Å; R215-E219 WeakPolarHBondContact O-CB 3.27Å; R215-E219 PolarHBondContact O-N 3.29Å
216	R	95.6	Very high	95.7	Very high	146 Å²	146	118.6 Å²	118.6	55%	0.551	52%	0.515	S	S	*	.	H	α-helix	trans	-65.4	-40.6	176.7	-69.4	174.1	-175.3	-173	6.5	112	E212 K213 E218 E219 E220	E212-R216 VanDerWaalsContact CD-CZ 3.48Å; E212-R216 HydrophobicContact CG-CG 4.27Å; E212-R216 WeakPolarHBondContact O-CG 3.21Å; E212-R216 PolarHBondContact O-N 2.88Å; E212-R216 IonicContact OE1-CZ 2.67Å; E212-R216 IonicContact OE1-NE 2.81Å; E212-R216 PolarHBondContact OE1-NE 3.08Å; E212-R216 VanDerWaalsContact OE1-NE 3.15Å; E212-R216 IonicContact OE1-NH2 3.04Å; E212-R216 PolarHBondContact OE1-NH2 3.5Å; E212-R216 IonicContact OE2-CZ 3.01Å; E212-R216 IonicContact OE2-NH2 2.79Å; E212-R216 PolarHBondContact OE2-NH2 3.43Å; K213-R216 PolarHBondContact O-N 2.94Å; K213-R216 VanDerWaalsContact O-N 3.17Å; R216-E218 VanDerWaalsContact C-N 3.35Å; R216-E219 PolarHBondContact O-N 2.67Å; R216-E220 WeakPolarHBondContact O-CB 3.27Å; R216-E220 PolarHBondContact O-N 2.94Å
217	E	95.5	Very high	95.5	Very high	106 Å²	106	114.4 Å²	114.4	50%	0.495	50%	0.502	S	S	.	.	H	α-helix	trans	-65.3	-36.7	175.3	-72.8	176	165.1	0	0	112	K213 R221	K213-E217 WeakPolarHBondContact CE-OE1 3.21Å; K213-E217 HydrophobicContact CG-CG 4.5Å; K213-E217 IonicContact NZ-OE1 3.61Å; K213-E217 WeakPolarHBondContact O-CG 3.19Å; K213-E217 PolarHBondContact O-N 3.04Å; E217-R221 WeakPolarHBondContact O-CB 3.47Å; E217-R221 PolarHBondContact O-N 3.3Å
218	E	95.1	Very high	95.4	Very high	91 Å²	91	115.5 Å²	115.5	43%	0.425	51%	0.505	S	S	.	.	H	α-helix	trans	-71.3	-42.8	174.1	179.5	140.7	-101	0	0	113	R214 R215 R216 R221 L222	R214-E218 WeakPolarHBondContact O-CB 3.36Å; R214-E218 PolarHBondContact O-N 2.92Å; R215-E218 PolarHBondContact O-N 2.85Å; R216-E218 VanDerWaalsContact C-N 3.35Å; E218-R221 WeakPolarHBondContact O-CB 3.41Å; E218-R221 PolarHBondContact O-N 3.35Å; E218-R221 IonicContact OE1-CZ 3.23Å; E218-R221 IonicContact OE1-NH1 3.32Å; E218-R221 PolarHBondContact OE1-NH1 3.36Å; E218-R221 IonicContact OE1-NH2 3.22Å; E218-R221 PolarHBondContact OE1-NH2 3.01Å; E218-L222 HydrophobicContact CG-CD1 4.17Å; E218-L222 WeakPolarHBondContact O-CB 3.34Å; E218-L222 WeakPolarHBondContact O-CG 3.23Å; E218-L222 PolarHBondContact O-N 2.91Å
219	E	95.2	Very high	95.4	Very high	127 Å²	127	118.7 Å²	118.7	59%	0.593	51%	0.512	S	S	*	.	H	α-helix	trans	-61.7	-43	174.8	-173	179.1	171.1	0	0	111.3	R215 R216 R223	R215-E219 WeakPolarHBondContact O-CB 3.27Å; R215-E219 PolarHBondContact O-N 3.29Å; R216-E219 PolarHBondContact O-N 2.67Å; E219-R223 VanDerWaalsContact O-CB 3.31Å; E219-R223 WeakPolarHBondContact O-CB 3.21Å; E219-R223 PolarHBondContact O-N 3.17Å
220	E	94.9	Very high	95.4	Very high	99 Å²	99	120.9 Å²	120.9	46%	0.463	52%	0.515	S	S	.	.	H	α-helix	trans	-66.4	-38.1	174.8	-158.3	-166.7	176.3	0	0	112	R216 R223 R224	R216-E220 WeakPolarHBondContact O-CB 3.27Å; R216-E220 PolarHBondContact O-N 2.94Å; E220-R223 PolarHBondContact O-N 2.9Å; E220-R224 VanDerWaalsContact O-CG 3.24Å; E220-R224 WeakPolarHBondContact O-CG 3.46Å; E220-R224 PolarHBondContact O-N 2.88Å; E220-R224 IonicContact OE1-CZ 2.75Å; E220-R224 VanDerWaalsContact OE1-CZ 3.3Å; E220-R224 IonicContact OE1-NE 2.71Å; E220-R224 PolarHBondContact OE1-NE 3.1Å; E220-R224 IonicContact OE1-NH2 3.31Å; E220-R224 PolarHBondContact OE1-NH2 2.81Å; E220-R224 IonicContact OE2-CZ 3.23Å; E220-R224 IonicContact OE2-NH2 2.75Å; E220-R224 PolarHBondContact OE2-NH2 3.15Å; E220-R224 VanDerWaalsContact OE2-NH2 3.07Å
221	R	96.3	Very high	95.4	Very high	114 Å²	114	123.1 Å²	123.1	43%	0.43	52%	0.519	S	S	.	.	H	α-helix	trans	-61.9	-51.5	175.3	-168.8	-172.9	74.4	-122.6	-1.7	111.3	E217 E218 R223 R224 E225	E217-R221 WeakPolarHBondContact O-CB 3.47Å; E217-R221 PolarHBondContact O-N 3.3Å; E218-R221 WeakPolarHBondContact O-CB 3.41Å; E218-R221 PolarHBondContact O-N 3.35Å; E218-R221 IonicContact OE1-CZ 3.23Å; E218-R221 IonicContact OE1-NH1 3.32Å; E218-R221 PolarHBondContact OE1-NH1 3.36Å; E218-R221 IonicContact OE1-NH2 3.22Å; E218-R221 PolarHBondContact OE1-NH2 3.01Å; R221-R223 VanDerWaalsContact C-N 3.31Å; R221-R223 PolarHBondContact O-N 2.87Å; R221-R224 PolarHBondContact O-N 2.61Å; R221-R224 VanDerWaalsContact O-N 3.16Å; R221-E225 WeakPolarHBondContact CG-OE1 3.43Å; R221-E225 IonicContact NE-OE1 2.8Å; R221-E225 WeakPolarHBondContact O-CG 3.39Å; R221-E225 PolarHBondContact O-N 2.86Å
222	L	96.3	Very high	95.3	Very high	95 Å²	95	122.7 Å²	122.7	50%	0.497	52%	0.519	S	S	.	.	H	α-helix	trans	-58.9	-42.5	177.6	-73.1	170	0	0	0	111.7	E218 R224 E225 E226	E218-L222 HydrophobicContact CG-CD1 4.17Å; E218-L222 WeakPolarHBondContact O-CB 3.34Å; E218-L222 WeakPolarHBondContact O-CG 3.23Å; E218-L222 PolarHBondContact O-N 2.91Å; L222-R224 PolarHBondContact O-N 2.86Å; L222-E225 PolarHBondContact O-N 3.33Å; L222-E226 PolarHBondContact O-N 3.03Å
223	R	96.3	Very high	95.2	Very high	156 Å²	156	125.6 Å²	125.6	59%	0.589	53%	0.532	S	S	*	.	H	α-helix	trans	-62.8	-41.4	175.8	179.7	179.1	165.5	176	-3.6	112.5	E219 E220 R221 E226 E227	E219-R223 VanDerWaalsContact O-CB 3.31Å; E219-R223 WeakPolarHBondContact O-CB 3.21Å; E219-R223 PolarHBondContact O-N 3.17Å; E220-R223 PolarHBondContact O-N 2.9Å; R221-R223 VanDerWaalsContact C-N 3.31Å; R221-R223 PolarHBondContact O-N 2.87Å; R223-E226 PolarHBondContact O-N 3.08Å; R223-E227 HydrophobicContact CG-CG 4.49Å; R223-E227 IonicContact CZ-OE1 2.83Å; R223-E227 VanDerWaalsContact CZ-OE1 3.28Å; R223-E227 IonicContact NE-OE1 2.8Å; R223-E227 PolarHBondContact NE-OE1 2.83Å; R223-E227 IonicContact NH2-OE1 3.51Å; R223-E227 PolarHBondContact NH2-OE1 2.81Å; R223-E227 WeakPolarHBondContact O-CB 3.43Å; R223-E227 WeakPolarHBondContact O-CG 3.45Å; R223-E227 PolarHBondContact O-N 2.92Å
224	R	94.9	Very high	95.1	Very high	150 Å²	150	124.4 Å²	124.4	57%	0.566	53%	0.529	S	S	*	.	H	α-helix	trans	-64.1	-41.9	175.6	-70.9	167.3	-176.7	-175.8	4.6	111.2	E220 R221 L222 E226 E227 E228	E220-R224 VanDerWaalsContact O-CG 3.24Å; E220-R224 WeakPolarHBondContact O-CG 3.46Å; E220-R224 PolarHBondContact O-N 2.88Å; E220-R224 IonicContact OE1-CZ 2.75Å; E220-R224 VanDerWaalsContact OE1-CZ 3.3Å; E220-R224 IonicContact OE1-NE 2.71Å; E220-R224 PolarHBondContact OE1-NE 3.1Å; E220-R224 IonicContact OE1-NH2 3.31Å; E220-R224 PolarHBondContact OE1-NH2 2.81Å; E220-R224 IonicContact OE2-CZ 3.23Å; E220-R224 IonicContact OE2-NH2 2.75Å; E220-R224 PolarHBondContact OE2-NH2 3.15Å; E220-R224 VanDerWaalsContact OE2-NH2 3.07Å; R221-R224 PolarHBondContact O-N 2.61Å; R221-R224 VanDerWaalsContact O-N 3.16Å; L222-R224 PolarHBondContact O-N 2.86Å; R224-E226 VanDerWaalsContact C-N 3.35Å; R224-E227 PolarHBondContact O-N 2.96Å; R224-E228 WeakPolarHBondContact O-CB 3.43Å; R224-E228 PolarHBondContact O-N 2.83Å
225	E	94.2	Very high	95	Very high	88 Å²	88	124.9 Å²	124.9	41%	0.411	54%	0.537	S	S	.	.	H	α-helix	trans	-62.9	-37.8	174.5	-69.6	175.4	-143.5	0	0	112.3	R221 L222 R229	R221-E225 WeakPolarHBondContact CG-OE1 3.43Å; R221-E225 IonicContact NE-OE1 2.8Å; R221-E225 WeakPolarHBondContact O-CG 3.39Å; R221-E225 PolarHBondContact O-N 2.86Å; L222-E225 PolarHBondContact O-N 3.33Å; E225-R229 WeakPolarHBondContact O-CB 3.41Å; E225-R229 VanDerWaalsContact O-CG 3.23Å; E225-R229 WeakPolarHBondContact O-CG 3.46Å; E225-R229 PolarHBondContact O-N 3.01Å
226	E	94.7	Very high	94.8	Very high	139 Å²	139	125.7 Å²	125.7	65%	0.65	54%	0.54	S	S	*	.	H	α-helix	trans	-69.8	-45.9	174.9	-172.6	178.3	-162.9	0	0	112.2	L222 R223 R224 E228 R229 R230	L222-E226 PolarHBondContact O-N 3.03Å; R223-E226 PolarHBondContact O-N 3.08Å; R224-E226 VanDerWaalsContact C-N 3.35Å; E226-E228 VanDerWaalsContact C-N 3.28Å; E226-E228 PolarHBondContact O-N 2.89Å; E226-R229 PolarHBondContact O-N 2.81Å; E226-R230 VanDerWaalsContact O-CB 3.32Å; E226-R230 WeakPolarHBondContact O-CB 3.14Å; E226-R230 PolarHBondContact O-N 2.95Å
227	E	94.5	Very high	94.8	Very high	79 Å²	79	123 Å²	123	37%	0.369	54%	0.536	S	S	.	.	H	α-helix	trans	-61.9	-34.4	175.4	-74.5	-172.5	-157.1	0	0	111.9	R223 R224 R231	R223-E227 HydrophobicContact CG-CG 4.49Å; R223-E227 IonicContact CZ-OE1 2.83Å; R223-E227 VanDerWaalsContact CZ-OE1 3.28Å; R223-E227 IonicContact NE-OE1 2.8Å; R223-E227 PolarHBondContact NE-OE1 2.83Å; R223-E227 IonicContact NH2-OE1 3.51Å; R223-E227 PolarHBondContact NH2-OE1 2.81Å; R223-E227 WeakPolarHBondContact O-CB 3.43Å; R223-E227 WeakPolarHBondContact O-CG 3.45Å; R223-E227 PolarHBondContact O-N 2.92Å; R224-E227 PolarHBondContact O-N 2.96Å; E227-R231 VanDerWaalsContact O-CD 3.31Å; E227-R231 WeakPolarHBondContact O-CD 3.48Å; E227-R231 WeakPolarHBondContact O-CG 3.19Å; E227-R231 PolarHBondContact O-N 2.99Å
228	E	94.4	Very high	94.8	Very high	122 Å²	122	127 Å²	127	57%	0.57	55%	0.546	S	S	*	.	H	α-helix	trans	-69.8	-50.1	172.7	-175.3	174.9	-175.9	0	0	112.1	R224 E226 R230 R231 I232	R224-E228 WeakPolarHBondContact O-CB 3.43Å; R224-E228 PolarHBondContact O-N 2.83Å; E226-E228 VanDerWaalsContact C-N 3.28Å; E226-E228 PolarHBondContact O-N 2.89Å; E228-R230 VanDerWaalsContact C-N 3.26Å; E228-R230 PolarHBondContact O-N 2.86Å; E228-R231 WeakPolarHBondContact O-CB 3.17Å; E228-R231 PolarHBondContact O-N 3.5Å; E228-R231 VanDerWaalsContact O-N 3.1Å; E228-I232 HydrophobicContact CG-CD1 4.01Å; E228-I232 WeakPolarHBondContact O-CG1 3.41Å; E228-I232 PolarHBondContact O-N 2.91Å
229	R	94.7	Very high	94.7	Very high	182 Å²	182	128.2 Å²	128.2	69%	0.687	56%	0.555	S	S	*	*	H	α-helix	trans	-54.1	-44.4	175.9	-80.1	170.6	169.4	-81.4	-2.2	111.9	E225 E226 I232 E233	E225-R229 WeakPolarHBondContact O-CB 3.41Å; E225-R229 VanDerWaalsContact O-CG 3.23Å; E225-R229 WeakPolarHBondContact O-CG 3.46Å; E225-R229 PolarHBondContact O-N 3.01Å; E226-R229 PolarHBondContact O-N 2.81Å; R229-I232 PolarHBondContact O-N 2.89Å; R229-E233 PolarHBondContact O-N 2.87Å
230	R	94.9	Very high	94.5	Very high	159 Å²	159	125.8 Å²	125.8	60%	0.6	54%	0.544	S	S	*	.	H	α-helix	trans	-63.8	-41.6	177.8	-178.2	178.1	164.8	175.9	-3.6	112.2	E226 E228 I232 E233 E234	E226-R230 VanDerWaalsContact O-CB 3.32Å; E226-R230 WeakPolarHBondContact O-CB 3.14Å; E226-R230 PolarHBondContact O-N 2.95Å; E228-R230 VanDerWaalsContact C-N 3.26Å; E228-R230 PolarHBondContact O-N 2.86Å; R230-I232 VanDerWaalsContact C-N 3.35Å; R230-I232 PolarHBondContact O-N 2.84Å; R230-E233 PolarHBondContact O-N 3.31Å; R230-E234 HydrophobicContact CG-CG 4.41Å; R230-E234 IonicContact CZ-OE1 2.97Å; R230-E234 VanDerWaalsContact CZ-OE1 3.23Å; R230-E234 IonicContact NE-OE1 3.95Å; R230-E234 PolarHBondContact NE-OE1 2.88Å; R230-E234 IonicContact NH2-OE1 3.48Å; R230-E234 PolarHBondContact NH2-OE1 3.48Å; R230-E234 WeakPolarHBondContact O-CB 3.38Å; R230-E234 WeakPolarHBondContact O-CG 3.42Å; R230-E234 PolarHBondContact O-N 2.96Å
231	R	95.3	Very high	94.5	Very high	167 Å²	167	125.7 Å²	125.7	63%	0.63	54%	0.543	S	S	*	.	H	α-helix	trans	-61.2	-43.1	174.7	-73.1	161.8	-174.5	-95.7	3.1	111.7	E227 E228 E233 E234 E235	E227-R231 VanDerWaalsContact O-CD 3.31Å; E227-R231 WeakPolarHBondContact O-CD 3.48Å; E227-R231 WeakPolarHBondContact O-CG 3.19Å; E227-R231 PolarHBondContact O-N 2.99Å; E228-R231 WeakPolarHBondContact O-CB 3.17Å; E228-R231 PolarHBondContact O-N 3.5Å; E228-R231 VanDerWaalsContact O-N 3.1Å; R231-E233 VanDerWaalsContact C-N 3.33Å; R231-E233 PolarHBondContact O-N 3.34Å; R231-E234 PolarHBondContact O-N 2.86Å; R231-E235 WeakPolarHBondContact O-CB 3.28Å; R231-E235 PolarHBondContact O-N 2.93Å
232	I	94.2	Very high	94.2	Very high	100 Å²	100	125.4 Å²	125.4	51%	0.513	55%	0.547	S	S	.	.	H	α-helix	trans	-62.7	-40.3	177.1	-66.3	165.8	0	0	0	110.8	E228 R229 R230 R236	E228-I232 HydrophobicContact CG-CD1 4.01Å; E228-I232 WeakPolarHBondContact O-CG1 3.41Å; E228-I232 PolarHBondContact O-N 2.91Å; R229-I232 PolarHBondContact O-N 2.89Å; R230-I232 VanDerWaalsContact C-N 3.35Å; R230-I232 PolarHBondContact O-N 2.84Å; I232-R236 WeakPolarHBondContact O-CB 3.4Å; I232-R236 PolarHBondContact O-N 3.06Å
233	E	93.4	Very high	94	Very high	130 Å²	130	125.4 Å²	125.4	61%	0.607	54%	0.543	S	S	*	.	H	α-helix	trans	-69.8	-43.6	176.5	-175.4	164.3	-144.1	0	0	112.9	R229 R230 R231 E235 R236 L237	R229-E233 PolarHBondContact O-N 2.87Å; R230-E233 PolarHBondContact O-N 3.31Å; R231-E233 VanDerWaalsContact C-N 3.33Å; R231-E233 PolarHBondContact O-N 3.34Å; E233-E235 PolarHBondContact O-N 2.74Å; E233-R236 PolarHBondContact O-N 3.39Å; E233-L237 WeakPolarHBondContact O-CB 3.42Å; E233-L237 PolarHBondContact O-N 2.8Å
234	E	94.2	Very high	93.8	Very high	98 Å²	98	123 Å²	123	46%	0.458	54%	0.538	S	S	.	.	H	α-helix	trans	-62.5	-40.2	175.5	-74.2	-179.7	-178.4	0	0	111.7	R230 R231 R238	R230-E234 HydrophobicContact CG-CG 4.41Å; R230-E234 IonicContact CZ-OE1 2.97Å; R230-E234 VanDerWaalsContact CZ-OE1 3.23Å; R230-E234 IonicContact NE-OE1 3.95Å; R230-E234 PolarHBondContact NE-OE1 2.88Å; R230-E234 IonicContact NH2-OE1 3.48Å; R230-E234 PolarHBondContact NH2-OE1 3.48Å; R230-E234 WeakPolarHBondContact O-CB 3.38Å; R230-E234 WeakPolarHBondContact O-CG 3.42Å; R230-E234 PolarHBondContact O-N 2.96Å; R231-E234 PolarHBondContact O-N 2.86Å; E234-R238 WeakPolarHBondContact O-CB 3.46Å; E234-R238 PolarHBondContact O-N 2.71Å
235	E	93.2	Very high	93.7	Very high	142 Å²	142	122.2 Å²	122.2	66%	0.664	54%	0.541	S	S	*	.	H	α-helix	trans	-66.8	-45.7	173.8	-177.7	169.1	-155.6	0	0	112	R231 E233 L237 R238 L239	R231-E235 WeakPolarHBondContact O-CB 3.28Å; R231-E235 PolarHBondContact O-N 2.93Å; E233-E235 PolarHBondContact O-N 2.74Å; E235-L237 VanDerWaalsContact C-N 3.33Å; E235-L237 PolarHBondContact O-N 2.86Å; E235-R238 PolarHBondContact O-N 2.82Å; E235-L239 WeakPolarHBondContact O-CB 3.48Å; E235-L239 PolarHBondContact O-N 2.8Å
236	R	93.7	Very high	93.6	Very high	150 Å²	150	119.8 Å²	119.8	57%	0.566	53%	0.531	S	S	*	.	H	α-helix	trans	-57.3	-46.4	175.7	179.5	-175.4	168.7	-68.3	-26.5	111.2	I232 E233 L239 E240	I232-R236 WeakPolarHBondContact O-CB 3.4Å; I232-R236 PolarHBondContact O-N 3.06Å; E233-R236 PolarHBondContact O-N 3.39Å; R236-L239 PolarHBondContact O-N 2.91Å; R236-E240 IonicContact CZ-OE2 3.81Å; R236-E240 IonicContact NH1-OE2 3.34Å; R236-E240 IonicContact NH2-OE2 2.76Å; R236-E240 PolarHBondContact NH2-OE2 2.99Å; R236-E240 WeakPolarHBondContact O-CB 3.24Å; R236-E240 PolarHBondContact O-N 2.62Å
237	L	95.6	Very high	93.3	Very high	89 Å²	89	116 Å²	116	47%	0.466	51%	0.513	S	S	.	.	H	α-helix	trans	-63.8	-41.8	178.3	179.8	61.7	0	0	0	111.6	E233 E235 E240 Q241	E233-L237 WeakPolarHBondContact O-CB 3.42Å; E233-L237 PolarHBondContact O-N 2.8Å; E235-L237 VanDerWaalsContact C-N 3.33Å; E235-L237 PolarHBondContact O-N 2.86Å; L237-E240 PolarHBondContact O-N 2.8Å; L237-Q241 WeakPolarHBondContact O-CG 3.08Å; L237-Q241 PolarHBondContact O-N 3.11Å
238	R	94.6	Very high	93.2	Very high	191 Å²	191	115.1 Å²	115.1	72%	0.721	52%	0.52	S	S	*	.	H	α-helix	trans	-63	-43.2	176.7	-175.7	179.6	-178.6	179.4	0.8	112.2	E234 E235 Q241 Q242	E234-R238 WeakPolarHBondContact O-CB 3.46Å; E234-R238 PolarHBondContact O-N 2.71Å; E235-R238 PolarHBondContact O-N 2.82Å; R238-Q241 PolarHBondContact O-N 2.85Å; R238-Q242 PolarHBondContact O-N 2.94Å
239	L	92.3	Very high	93.2	Very high	116 Å²	116	111.8 Å²	111.8	61%	0.607	51%	0.513	S	S	*	.	H	α-helix	trans	-66	-39.4	176.1	-176.3	63.7	0	0	0	111.6	E235 R236 Q242 K243	E235-L239 WeakPolarHBondContact O-CB 3.48Å; E235-L239 PolarHBondContact O-N 2.8Å; R236-L239 PolarHBondContact O-N 2.91Å; L239-Q242 PolarHBondContact O-N 2.88Å; L239-K243 WeakPolarHBondContact O-CB 3.44Å; L239-K243 PolarHBondContact O-N 2.76Å
240	E	91.9	Very high	93.1	Very high	76 Å²	76	103.7 Å²	103.7	36%	0.355	48%	0.483	S	S	.	.	H	α-helix	trans	-65.3	-41.7	175.6	-176.9	154.1	-157.4	0	0	111.9	R236 L237 K243 Q244	R236-E240 IonicContact CZ-OE2 3.81Å; R236-E240 IonicContact NH1-OE2 3.34Å; R236-E240 IonicContact NH2-OE2 2.76Å; R236-E240 PolarHBondContact NH2-OE2 2.99Å; R236-E240 WeakPolarHBondContact O-CB 3.24Å; R236-E240 PolarHBondContact O-N 2.62Å; L237-E240 PolarHBondContact O-N 2.8Å; E240-K243 PolarHBondContact O-N 3.06Å; E240-Q244 WeakPolarHBondContact O-CG 3.01Å; E240-Q244 PolarHBondContact O-N 2.78Å
241	Q	94.3	Very high	92.9	Very high	97 Å²	97	97.9 Å²	97.9	45%	0.453	46%	0.464	S	S	.	.	H	α-helix	trans	-61.9	-44	171.6	-73	177.5	16.7	0	0	112.4	L237 R238 K243 Q244 Q245	L237-Q241 WeakPolarHBondContact O-CG 3.08Å; L237-Q241 PolarHBondContact O-N 3.11Å; R238-Q241 PolarHBondContact O-N 2.85Å; Q241-K243 PolarHBondContact O-N 3.36Å; Q241-Q244 PolarHBondContact O-N 2.99Å; Q241-Q245 WeakPolarHBondContact O-CG 3.47Å; Q241-Q245 PolarHBondContact O-N 2.62Å
242	Q	91.6	Very high	92.7	Very high	108 Å²	108	94.1 Å²	94.1	51%	0.505	46%	0.464	S	S	.	.	H	α-helix	trans	-62.3	-42.6	177.2	-172.4	178.8	-1.4	0	0	111.5	R238 L239 Q244 Q245 I246	R238-Q242 PolarHBondContact O-N 2.94Å; L239-Q242 PolarHBondContact O-N 2.88Å; Q242-Q244 PolarHBondContact O-N 2.83Å; Q242-Q245 PolarHBondContact O-N 2.86Å; Q242-I246 HydrophobicContact CG-CD1 4.12Å; Q242-I246 WeakPolarHBondContact O-CG1 3.18Å; Q242-I246 PolarHBondContact O-N 2.95Å
243	K	91	Very high	92.6	Very high	94 Å²	94	96.6 Å²	96.6	41%	0.409	47%	0.473	S	S	.	.	H	α-helix	trans	-57.9	-46.4	171.9	168.7	172.8	179.4	-172.3	0	111.5	L239 E240 Q241 I246 M247 Y285	L239-K243 WeakPolarHBondContact O-CB 3.44Å; L239-K243 PolarHBondContact O-N 2.76Å; E240-K243 PolarHBondContact O-N 3.06Å; Q241-K243 PolarHBondContact O-N 3.36Å; K243-I246 PolarHBondContact O-N 2.88Å; K243-M247 HydrophobicContact CG-CE 3.94Å; K243-M247 HydrophobicContact CG-CG 4.44Å; K243-M247 HydrophobicContact CG-SD 4.13Å; K243-M247 WeakPolarHBondContact O-CG 3.36Å; K243-M247 PolarHBondContact O-N 2.9Å; K243-Y285 HydrophobicContact CG-CE2 4.35Å; K243-Y285 WeakPolarHBondContact CG-OH 3.37Å
244	Q	91.7	Very high	92.4	Very high	107 Å²	107	91 Å²	91	50%	0.5	45%	0.447	S	S	.	.	H	α-helix	trans	-62.4	-41.6	178.1	-72.2	177.4	19.2	0	0	112.5	E240 Q241 Q242 M247 A248	E240-Q244 WeakPolarHBondContact O-CG 3.01Å; E240-Q244 PolarHBondContact O-N 2.78Å; Q241-Q244 PolarHBondContact O-N 2.99Å; Q242-Q244 PolarHBondContact O-N 2.83Å; Q244-M247 HydrophobicContact CG-CE 4.24Å; Q244-M247 PolarHBondContact O-N 3.42Å; Q244-A248 WeakPolarHBondContact O-CB 2.84Å; Q244-A248 PolarHBondContact O-N 3.3Å
245	Q	93.4	Very high	92.3	Very high	132 Å²	132	88 Å²	88	62%	0.617	44%	0.44	S	S	*	.	H	α-helix	trans	-63	-44.6	175.8	-71.6	174.4	6.6	0	0	112.1	Q241 Q242 A248 A249	Q241-Q245 WeakPolarHBondContact O-CG 3.47Å; Q241-Q245 PolarHBondContact O-N 2.62Å; Q242-Q245 PolarHBondContact O-N 2.86Å; Q245-A248 PolarHBondContact O-N 2.76Å; Q245-A249 WeakPolarHBondContact O-CB 3.48Å; Q245-A249 PolarHBondContact O-N 2.93Å
246	I	91.4	Very high	92.3	Very high	38 Å²	38	85.7 Å²	85.7	20%	0.195	44%	0.435	C	S	.	.	H	α-helix	trans	-62.2	-48	175.8	-67.4	163.9	0	0	0	110.5	Q242 K243 A248 A249 L250 Y285 Y288 M289	Q242-I246 HydrophobicContact CG-CD1 4.12Å; Q242-I246 WeakPolarHBondContact O-CG1 3.18Å; Q242-I246 PolarHBondContact O-N 2.95Å; K243-I246 PolarHBondContact O-N 2.88Å; I246-A248 VanDerWaalsContact C-N 3.35Å; I246-A248 PolarHBondContact O-N 2.96Å; I246-A249 PolarHBondContact O-N 3.5Å; I246-L250 WeakPolarHBondContact O-CB 3.35Å; I246-L250 PolarHBondContact O-N 3.47Å; I246-Y285 HydrophobicContact CB-CE2 4.2Å; I246-Y285 HydrophobicContact CG2-CD2 4.02Å; I246-Y285 HydrophobicContact CG2-CE2 3.71Å; I246-Y288 HydrophobicContact CG2-CD1 3.88Å; I246-Y288 HydrophobicContact CG2-CE1 3.69Å; I246-M289 HydrophobicContact CD1-SD 4.46Å
247	M	89.3	Confident	92.3	Very high	58 Å²	58	84.9 Å²	84.9	29%	0.286	44%	0.438	S	S	.	.	H	α-helix	trans	-59.5	-43.8	176.7	-70.8	-174.3	-48.3	0	0	111.7	K243 Q244 L250 N251 Y285	K243-M247 HydrophobicContact CG-CE 3.94Å; K243-M247 HydrophobicContact CG-CG 4.44Å; K243-M247 HydrophobicContact CG-SD 4.13Å; K243-M247 WeakPolarHBondContact O-CG 3.36Å; K243-M247 PolarHBondContact O-N 2.9Å; Q244-M247 HydrophobicContact CG-CE 4.24Å; Q244-M247 PolarHBondContact O-N 3.42Å; M247-L250 PolarHBondContact O-N 3.44Å; M247-N251 WeakPolarHBondContact O-CB 3.18Å; M247-N251 PolarHBondContact O-N 2.95Å; M247-N251 PolarHBondContact O-ND2 3.36Å; M247-N251 PolarHBondContact O-OD1 3.49Å; M247-Y285 HydrophobicContact CB-CD2 4.49Å; M247-Y285 HydrophobicContact CG-CD2 3.38Å; M247-Y285 HydrophobicContact CG-CE2 3.67Å; M247-Y285 HydrophobicContact CG-CG 3.89Å; M247-Y285 HydrophobicContact SD-CD2 4.46Å
248	A	92.4	Very high	92.2	Very high	62 Å²	62	81.8 Å²	81.8	51%	0.512	42%	0.421	S	S	.	.	H	α-helix	trans	-64.1	-43.6	178.6	0	0	0	0	0	112.7	Q244 Q245 I246 S252	Q244-A248 WeakPolarHBondContact O-CB 2.84Å; Q244-A248 PolarHBondContact O-N 3.3Å; Q245-A248 PolarHBondContact O-N 2.76Å; I246-A248 VanDerWaalsContact C-N 3.35Å; I246-A248 PolarHBondContact O-N 2.96Å; A248-S252 WeakPolarHBondContact O-CB 3.11Å; A248-S252 PolarHBondContact O-N 2.8Å; A248-S252 PolarHBondContact O-OG 2.91Å
249	A	93.4	Very high	92.1	Very high	51 Å²	51	78.3 Å²	78.3	42%	0.421	41%	0.413	S	S	.	.	H	α-helix	trans	-70.7	-31.4	178.2	0	0	0	0	0	113.1	Q245 I246 S252 Q253	Q245-A249 WeakPolarHBondContact O-CB 3.48Å; Q245-A249 PolarHBondContact O-N 2.93Å; I246-A249 PolarHBondContact O-N 3.5Å; A249-S252 PolarHBondContact O-OG 3.2Å; A249-S252 VanDerWaalsContact O-OG 3.04Å; A249-Q253 PolarHBondContact O-NE2 3.2Å
250	L	92.5	Very high	92.2	Very high	12 Å²	12	78.3 Å²	78.3	6%	0.063	41%	0.41	C	S	.	.	H	α-helix	trans	-74.3	-43.2	174.6	-165.9	70.4	0	0	0	110.8	I246 M247 S252 Q253 T254 H284 Y288	I246-L250 WeakPolarHBondContact O-CB 3.35Å; I246-L250 PolarHBondContact O-N 3.47Å; M247-L250 PolarHBondContact O-N 3.44Å; L250-S252 PolarHBondContact O-N 2.93Å; L250-Q253 PolarHBondContact O-N 3.29Å; L250-T254 PolarHBondContact O-N 3.41Å; L250-T254 PolarHBondContact O-OG1 3.25Å; L250-H284 VanDerWaalsContact CD1-CE1 3.41Å; L250-H284 WeakPolarHBondContact CD1-CE1 3.42Å; L250-H284 HydrophobicContact CD2-CB 4.48Å; L250-H284 WeakPolarHBondContact CG-ND1 3.41Å; L250-Y288 HydrophobicContact CD1-CD1 4.47Å; L250-Y288 HydrophobicContact CD1-CD2 4.42Å; L250-Y288 HydrophobicContact CD1-CG 4.17Å; L250-Y288 HydrophobicContact CD2-CD1 4.47Å; L250-Y288 HydrophobicContact CD2-CG 4.41Å
251	N	90.6	Very high	92.2	Very high	37 Å²	37	79.8 Å²	79.8	20%	0.198	41%	0.413	C	S	.	.	H	α-helix	trans	-64.5	-37.3	177.2	-71.5	-4.1	0	0	0	112.1	M247 Q253 T254 A255 Q281	M247-N251 WeakPolarHBondContact O-CB 3.18Å; M247-N251 PolarHBondContact O-N 2.95Å; M247-N251 PolarHBondContact O-ND2 3.36Å; M247-N251 PolarHBondContact O-OD1 3.49Å; N251-Q253 VanDerWaalsContact C-N 3.26Å; N251-Q253 PolarHBondContact O-N 2.64Å; N251-T254 PolarHBondContact O-N 2.72Å; N251-A255 WeakPolarHBondContact O-CA 3.42Å; N251-A255 WeakPolarHBondContact O-CB 3.32Å; N251-A255 PolarHBondContact O-N 3.13Å; N251-Q281 VanDerWaalsContact ND2-CD 3.29Å; N251-Q281 PolarHBondContact ND2-OE1 3.43Å; N251-Q281 WeakPolarHBondContact OD1-CB 3.44Å; N251-Q281 WeakPolarHBondContact OD1-CG 3.49Å
252	S	91.6	Very high	92.2	Very high	89 Å²	89	75.2 Å²	75.2	62%	0.622	39%	0.391	S	S	*	.	H	α-helix	trans	-65.2	-30.4	178.2	66.6	0	0	0	0	112.8	A248 A249 L250	A248-S252 WeakPolarHBondContact O-CB 3.11Å; A248-S252 PolarHBondContact O-N 2.8Å; A248-S252 PolarHBondContact O-OG 2.91Å; A249-S252 PolarHBondContact O-OG 3.2Å; A249-S252 VanDerWaalsContact O-OG 3.04Å; L250-S252 PolarHBondContact O-N 2.93Å
253	Q	91.9	Very high	92.3	Very high	151 Å²	151	72 Å²	72	71%	0.706	38%	0.384	S	S	*	.	H	α-helix	trans	-73.7	-40.6	175	-69.7	170.4	80	0	0	112.3	A249 L250 N251	A249-Q253 PolarHBondContact O-NE2 3.2Å; L250-Q253 PolarHBondContact O-N 3.29Å; N251-Q253 VanDerWaalsContact C-N 3.26Å; N251-Q253 PolarHBondContact O-N 2.64Å
254	T	90.7	Very high	92.4	Very high	12 Å²	12	73.9 Å²	73.9	7%	0.074	39%	0.394	C	S	.	.	H	α-helix	trans	-99.1	-7.9	-175.3	61.7	0	0	0	0	115.5	L250 N251 V256 Q257 F258 H284	L250-T254 PolarHBondContact O-N 3.41Å; L250-T254 PolarHBondContact O-OG1 3.25Å; N251-T254 PolarHBondContact O-N 2.72Å; T254-V256 VanDerWaalsContact C-N 3.31Å; T254-V256 PolarHBondContact O-N 3.45Å; T254-Q257 PolarHBondContact O-N 3.39Å; T254-F258 HydrophobicContact CG2-CE1 4.3Å; T254-F258 HydrophobicContact CG2-CE2 4.32Å; T254-F258 HydrophobicContact CG2-CZ 3.93Å; T254-F258 PolarHBondContact O-N 2.91Å; T254-F258 WeakPolarHBondContact OG1-CD2 3.15Å; T254-F258 WeakPolarHBondContact OG1-CE2 3.43Å; T254-F258 WeakPolarHBondContact OG1-CZ 3.42Å; T254-H284 WeakPolarHBondContact CG2-CE1 3.46Å
255	A	91.9	Very high	92.3	Very high	37 Å²	37	73.4 Å²	73.4	31%	0.306	39%	0.391	S	S	.	.	H	α-helix	trans	-49	-49.3	-174.4	0	0	0	0	0	112.9	N251 Q257 F258 Q259	N251-A255 WeakPolarHBondContact O-CA 3.42Å; N251-A255 WeakPolarHBondContact O-CB 3.32Å; N251-A255 PolarHBondContact O-N 3.13Å; A255-Q257 PolarHBondContact O-N 2.89Å; A255-F258 PolarHBondContact O-N 3.31Å; A255-Q259 WeakPolarHBondContact O-CB 3.42Å; A255-Q259 PolarHBondContact O-N 2.74Å
256	V	93.4	Very high	92.2	Very high	92 Å²	92	71.2 Å²	71.2	56%	0.558	38%	0.378	S	S	*	.	H	α-helix	trans	-63.1	-41.6	-179.1	-179.9	0	0	0	0	111.5	T254 Q260	T254-V256 VanDerWaalsContact C-N 3.31Å; T254-V256 PolarHBondContact O-N 3.45Å; V256-Q260 WeakPolarHBondContact O-CB 3.26Å; V256-Q260 VanDerWaalsContact O-CG 3.26Å; V256-Q260 WeakPolarHBondContact O-CG 3.41Å; V256-Q260 PolarHBondContact O-N 3.12Å
257	Q	92.4	Very high	92.2	Very high	134 Å²	134	74.2 Å²	74.2	63%	0.626	40%	0.4	S	S	*	.	H	α-helix	trans	-69.4	-45.2	-179.9	-171.7	179.4	9.6	0	0	111.6	T254 A255 Q260 Y261	T254-Q257 PolarHBondContact O-N 3.39Å; A255-Q257 PolarHBondContact O-N 2.89Å; Q257-Q260 PolarHBondContact O-N 3.37Å; Q257-Y261 WeakPolarHBondContact O-CB 3.17Å; Q257-Y261 PolarHBondContact O-N 2.61Å
258	F	94.6	Very high	92.2	Very high	24 Å²	24	74.4 Å²	74.4	11%	0.105	42%	0.417	C	S	.	.	H	α-helix	trans	-68.5	-36.9	178.3	-65.2	-10.2	0	0	0	111.9	T254 A255 Y261 A262 I277 L280 Q281 H284	T254-F258 HydrophobicContact CG2-CE1 4.3Å; T254-F258 HydrophobicContact CG2-CE2 4.32Å; T254-F258 HydrophobicContact CG2-CZ 3.93Å; T254-F258 PolarHBondContact O-N 2.91Å; T254-F258 WeakPolarHBondContact OG1-CD2 3.15Å; T254-F258 WeakPolarHBondContact OG1-CE2 3.43Å; T254-F258 WeakPolarHBondContact OG1-CZ 3.42Å; A255-F258 PolarHBondContact O-N 3.31Å; F258-Y261 PolarHBondContact O-N 2.96Å; F258-A262 VanDerWaalsContact O-CB 3.26Å; F258-A262 WeakPolarHBondContact O-CB 3.47Å; F258-A262 PolarHBondContact O-N 2.86Å; F258-I277 HydrophobicContact CB-CG1 4.48Å; F258-L280 HydrophobicContact CD1-CB 4.41Å; F258-L280 HydrophobicContact CD2-CB 4.06Å; F258-L280 HydrophobicContact CE2-CB 4.14Å; F258-L280 HydrophobicContact CG-CB 4.2Å; F258-L280 HydrophobicContact CZ-CB 4.37Å; F258-Q281 HydrophobicContact CD2-CG 3.72Å; F258-Q281 HydrophobicContact CE2-CG 3.89Å; F258-H284 HydrophobicContact CE2-CB 4.22Å; F258-H284 HydrophobicContact CZ-CB 3.87Å; F258-H284 AromaticContact CZ-CG 3.98Å; F258-H284 AromaticContact CZ-ND1 3.99Å
259	Q	92.7	Very high	92.2	Very high	117 Å²	117	74.6 Å²	74.6	55%	0.547	41%	0.409	S	S	.	.	H	α-helix	trans	-65.7	-43.8	174.7	-172.7	178.5	16.1	0	0	111.8	A255 A262 A263 I277	A255-Q259 WeakPolarHBondContact O-CB 3.42Å; A255-Q259 PolarHBondContact O-N 2.74Å; Q259-A262 PolarHBondContact O-N 2.95Å; Q259-A263 VanDerWaalsContact O-CB 3.28Å; Q259-A263 WeakPolarHBondContact O-CB 3.36Å; Q259-A263 PolarHBondContact O-N 2.98Å; Q259-I277 HydrophobicContact CB-CD1 4.44Å
260	Q	92.6	Very high	92.2	Very high	117 Å²	117	80.6 Å²	80.6	55%	0.547	42%	0.422	S	S	.	.	H	α-helix	trans	-63.1	-44.7	174.9	-75.1	177.6	22.2	0	0	112	V256 Q257 A263 Q264	V256-Q260 WeakPolarHBondContact O-CB 3.26Å; V256-Q260 VanDerWaalsContact O-CG 3.26Å; V256-Q260 WeakPolarHBondContact O-CG 3.41Å; V256-Q260 PolarHBondContact O-N 3.12Å; Q257-Q260 PolarHBondContact O-N 3.37Å; Q260-A263 PolarHBondContact O-N 2.88Å; Q260-Q264 WeakPolarHBondContact O-CG 3.36Å; Q260-Q264 PolarHBondContact O-N 3.29Å; Q260-Q264 VanDerWaalsContact O-N 3.13Å
261	Y	93.2	Very high	92.3	Very high	107 Å²	107	87.2 Å²	87.2	42%	0.42	45%	0.453	S	S	.	.	H	α-helix	trans	-62.2	-46.6	177	179.6	-102	0	0	0	111.6	Q257 F258 A263 Q264 Q265 L276 L280	Q257-Y261 WeakPolarHBondContact O-CB 3.17Å; Q257-Y261 PolarHBondContact O-N 2.61Å; F258-Y261 PolarHBondContact O-N 2.96Å; Y261-A263 PolarHBondContact O-N 2.99Å; Y261-Q264 WeakPolarHBondContact O-CB 3.36Å; Y261-Q264 PolarHBondContact O-N 2.89Å; Y261-Q264 VanDerWaalsContact O-N 3.16Å; Y261-Q265 HydrophobicContact CD1-CG 4.24Å; Y261-Q265 HydrophobicContact CE1-CG 3.82Å; Y261-Q265 HydrophobicContact CE2-CG 4.14Å; Y261-Q265 WeakPolarHBondContact O-CG 3.37Å; Y261-Q265 PolarHBondContact O-N 2.95Å; Y261-L276 HydrophobicContact CD1-CD2 4.18Å; Y261-L276 HydrophobicContact CE1-CD2 4.07Å; Y261-L280 HydrophobicContact CD1-CD1 3.68Å; Y261-L280 HydrophobicContact CE1-CD1 4.06Å
262	A	94.5	Very high	92.4	Very high	0 Å²	0	89.2 Å²	89.2	0%	0	46%	0.461	C	S	.	.	H	α-helix	trans	-63.7	-40.4	178.3	0	0	0	0	0	112.7	F258 Q259 Q264 Q265 Y266 Q273 L276 I277	F258-A262 VanDerWaalsContact O-CB 3.26Å; F258-A262 WeakPolarHBondContact O-CB 3.47Å; F258-A262 PolarHBondContact O-N 2.86Å; Q259-A262 PolarHBondContact O-N 2.95Å; A262-Q264 PolarHBondContact O-N 3.46Å; A262-Q265 PolarHBondContact O-N 3.39Å; A262-Y266 PolarHBondContact O-N 2.84Å; A262-Q273 HydrophobicContact CB-CB 4.08Å; A262-Q273 HydrophobicContact CB-CG 4.11Å; A262-L276 HydrophobicContact CB-CD2 4.05Å; A262-I277 HydrophobicContact CB-CD1 4.03Å; A262-I277 HydrophobicContact CB-CG1 3.72Å
263	A	92.6	Very high	92.4	Very high	42 Å²	42	85.8 Å²	85.8	35%	0.347	44%	0.435	S	S	.	.	H	α-helix	trans	-64.1	-26.9	175.4	0	0	0	0	0	113.3	Q259 Q260 Y261 P267	Q259-A263 VanDerWaalsContact O-CB 3.28Å; Q259-A263 WeakPolarHBondContact O-CB 3.36Å; Q259-A263 PolarHBondContact O-N 2.98Å; Q260-A263 PolarHBondContact O-N 2.88Å; Y261-A263 PolarHBondContact O-N 2.99Å; A263-P267 WeakPolarHBondContact O-CA 3.41Å
264	Q	92.9	Very high	92.5	Very high	132 Å²	132	84.3 Å²	84.3	62%	0.617	43%	0.428	S	S	*	.	H	α-helix	trans	-77.8	-40.9	172.2	-69.4	170.1	27	0	0	112.5	Q260 Y261 A262	Q260-Q264 WeakPolarHBondContact O-CG 3.36Å; Q260-Q264 PolarHBondContact O-N 3.29Å; Q260-Q264 VanDerWaalsContact O-N 3.13Å; Y261-Q264 WeakPolarHBondContact O-CB 3.36Å; Y261-Q264 PolarHBondContact O-N 2.89Å; Y261-Q264 VanDerWaalsContact O-N 3.16Å; A262-Q264 PolarHBondContact O-N 3.46Å
265	Q	90.9	Very high	92.7	Very high	97 Å²	97	88.9 Å²	88.9	45%	0.453	45%	0.451	S	S	.	.	H	α-helix	trans	-72.9	-36.1	180	-62.6	-52.1	-55.1	0	0	112.8	Y261 A262 L276	Y261-Q265 HydrophobicContact CD1-CG 4.24Å; Y261-Q265 HydrophobicContact CE1-CG 3.82Å; Y261-Q265 HydrophobicContact CE2-CG 4.14Å; Y261-Q265 WeakPolarHBondContact O-CG 3.37Å; Y261-Q265 PolarHBondContact O-N 2.95Å; A262-Q265 PolarHBondContact O-N 3.39Å; Q265-L276 HydrophobicContact CB-CD2 4.15Å; Q265-L276 HydrophobicContact CG-CD2 4.26Å
266	Y	91.8	Very high	92.8	Very high	87 Å²	87	88.4 Å²	88.4	34%	0.341	44%	0.443	S	S	.	.	S	Bend	trans	-131.8	68.2	-177.3	-61.2	-64	0	0	0	112.6	A262 G268 N269 Q272 Q273 L276	A262-Y266 PolarHBondContact O-N 2.84Å; Y266-G268 PolarHBondContact O-N 3.34Å; Y266-N269 PolarHBondContact O-N 2.85Å; Y266-Q272 VanDerWaalsContact CD1-CD 3.47Å; Y266-Q272 HydrophobicContact CD1-CG 3.9Å; Y266-Q272 HydrophobicContact CD2-CB 4.42Å; Y266-Q272 HydrophobicContact CD2-CG 3.83Å; Y266-Q272 HydrophobicContact CE1-CG 3.97Å; Y266-Q272 HydrophobicContact CE2-CG 3.87Å; Y266-Q272 HydrophobicContact CG-CB 4.24Å; Y266-Q272 HydrophobicContact CG-CG 3.84Å; Y266-Q273 PolarHBondContact O-NE2 3.02Å; Y266-L276 HydrophobicContact CD2-CD2 4.06Å; Y266-L276 HydrophobicContact CE2-CB 4.37Å; Y266-L276 HydrophobicContact CE2-CD2 3.93Å
267	P	91.3	Very high	92.8	Very high	101 Å²	101	84.7 Å²	84.7	66%	0.656	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	130.4	-179.4	-24.5	34.8	0	0	0	112.5	A263 N269	A263-P267 WeakPolarHBondContact O-CA 3.41Å; P267-N269 PolarHBondContact O-N 3.25Å; P267-N269 VanDerWaalsContact O-N 3.08Å
268	G	87.9	Confident	92.8	Very high	62 Å²	62	87 Å²	87	64%	0.639	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	-17.5	178.5	0	0	0	0	0	116.8	Y266 Y270	Y266-G268 PolarHBondContact O-N 3.34Å; G268-Y270 PolarHBondContact O-N 3.48Å
269	N	93.6	Very high	92.7	Very high	66 Å²	66	91.7 Å²	91.7	35%	0.353	45%	0.445	S	S	.	.			trans	-91.6	87.7	179	-172.4	-10.7	0	0	0	112	Y266 P267 E271 Q272 Q273	Y266-N269 PolarHBondContact O-N 2.85Å; P267-N269 PolarHBondContact O-N 3.25Å; P267-N269 VanDerWaalsContact O-N 3.08Å; N269-E271 PolarHBondContact O-N 2.95Å; N269-E271 PolarHBondContact OD1-N 3.19Å; N269-Q272 HydrophobicContact CB-CB 4.28Å; N269-Q272 VanDerWaalsContact ND2-CB 3.34Å; N269-Q272 WeakPolarHBondContact ND2-CB 3.31Å; N269-Q272 PolarHBondContact ND2-OE1 2.82Å; N269-Q272 PolarHBondContact O-N 2.87Å; N269-Q272 PolarHBondContact OD1-N 2.92Å; N269-Q273 VanDerWaalsContact O-CG 3.25Å; N269-Q273 WeakPolarHBondContact O-CG 3.32Å; N269-Q273 PolarHBondContact O-N 2.8Å
270	Y	92.5	Very high	92.8	Very high	177 Å²	177	88.2 Å²	88.2	69%	0.694	43%	0.43	S	S	*	.	H	α-helix	trans	-60.9	-35.8	-178.3	-65.4	-75.9	0	0	0	114.5	G268 Q273 Q274	G268-Y270 PolarHBondContact O-N 3.48Å; Y270-Q273 PolarHBondContact O-N 2.67Å; Y270-Q274 WeakPolarHBondContact O-CG 3.1Å; Y270-Q274 PolarHBondContact O-N 2.73Å
271	E	94.1	Very high	92.8	Very high	151 Å²	151	84.7 Å²	84.7	71%	0.706	41%	0.414	S	S	*	.	H	α-helix	trans	-68.3	-47.2	-178.8	-176.8	171.3	-143.9	0	0	110.9	N269 Q273 Q274 I275	N269-E271 PolarHBondContact O-N 2.95Å; N269-E271 PolarHBondContact OD1-N 3.19Å; E271-Q273 VanDerWaalsContact C-N 3.31Å; E271-Q273 PolarHBondContact O-N 3.36Å; E271-Q274 PolarHBondContact O-N 3.24Å; E271-Q274 VanDerWaalsContact O-N 3.15Å; E271-I275 HydrophobicContact CG-CD1 4.27Å; E271-I275 WeakPolarHBondContact O-CG1 3.36Å; E271-I275 PolarHBondContact O-N 2.88Å
272	Q	92.6	Very high	92.7	Very high	79 Å²	79	84.5 Å²	84.5	37%	0.369	42%	0.417	S	S	.	.	H	α-helix	trans	-68.3	-31.4	178.1	-161.6	166.9	18.8	0	0	112.2	Y266 N269 L276	Y266-Q272 VanDerWaalsContact CD1-CD 3.47Å; Y266-Q272 HydrophobicContact CD1-CG 3.9Å; Y266-Q272 HydrophobicContact CD2-CB 4.42Å; Y266-Q272 HydrophobicContact CD2-CG 3.83Å; Y266-Q272 HydrophobicContact CE1-CG 3.97Å; Y266-Q272 HydrophobicContact CE2-CG 3.87Å; Y266-Q272 HydrophobicContact CG-CB 4.24Å; Y266-Q272 HydrophobicContact CG-CG 3.84Å; N269-Q272 HydrophobicContact CB-CB 4.28Å; N269-Q272 VanDerWaalsContact ND2-CB 3.34Å; N269-Q272 WeakPolarHBondContact ND2-CB 3.31Å; N269-Q272 PolarHBondContact ND2-OE1 2.82Å; N269-Q272 PolarHBondContact O-N 2.87Å; N269-Q272 PolarHBondContact OD1-N 2.92Å; Q272-L276 WeakPolarHBondContact O-CB 3.49Å; Q272-L276 PolarHBondContact O-N 3.22Å; Q272-L276 VanDerWaalsContact O-N 3.08Å
273	Q	92.6	Very high	92.7	Very high	16 Å²	16	89 Å²	89	8%	0.075	44%	0.438	C	S	.	.	H	α-helix	trans	-60.4	-47.9	168	-73.6	172.9	26.6	0	0	112.1	A262 Y266 N269 Y270 E271 I275 L276 I277	A262-Q273 HydrophobicContact CB-CB 4.08Å; A262-Q273 HydrophobicContact CB-CG 4.11Å; Y266-Q273 PolarHBondContact O-NE2 3.02Å; N269-Q273 VanDerWaalsContact O-CG 3.25Å; N269-Q273 WeakPolarHBondContact O-CG 3.32Å; N269-Q273 PolarHBondContact O-N 2.8Å; Y270-Q273 PolarHBondContact O-N 2.67Å; E271-Q273 VanDerWaalsContact C-N 3.31Å; E271-Q273 PolarHBondContact O-N 3.36Å; Q273-I275 PolarHBondContact O-N 3.07Å; Q273-L276 PolarHBondContact O-N 3Å; Q273-I277 WeakPolarHBondContact O-CB 3.37Å; Q273-I277 WeakPolarHBondContact O-CD1 3.34Å; Q273-I277 WeakPolarHBondContact O-CG1 3.42Å; Q273-I277 PolarHBondContact O-N 2.97Å
274	Q	92.9	Very high	92.7	Very high	121 Å²	121	89.5 Å²	89.5	57%	0.565	43%	0.433	S	S	*	.	H	α-helix	trans	-64.9	-38.2	-179.4	-69.8	-64.4	-17.9	0	0	112.5	Y270 E271 I277 R278	Y270-Q274 WeakPolarHBondContact O-CG 3.1Å; Y270-Q274 PolarHBondContact O-N 2.73Å; E271-Q274 PolarHBondContact O-N 3.24Å; E271-Q274 VanDerWaalsContact O-N 3.15Å; Q274-I277 PolarHBondContact O-N 3.14Å; Q274-R278 WeakPolarHBondContact O-CB 3.19Å; Q274-R278 PolarHBondContact O-N 2.86Å
275	I	94.9	Very high	92.7	Very high	107 Å²	107	84.9 Å²	84.9	55%	0.549	41%	0.41	S	S	.	.	H	α-helix	trans	-61.7	-47.4	174.3	-66.2	166.5	0	0	0	110.6	E271 Q273 R278 Q279	E271-I275 HydrophobicContact CG-CD1 4.27Å; E271-I275 WeakPolarHBondContact O-CG1 3.36Å; E271-I275 PolarHBondContact O-N 2.88Å; Q273-I275 PolarHBondContact O-N 3.07Å; I275-R278 PolarHBondContact O-N 3.38Å; I275-Q279 PolarHBondContact O-N 3.03Å
276	L	94.1	Very high	92.8	Very high	27 Å²	27	84.9 Å²	84.9	14%	0.141	41%	0.41	C	S	.	.	H	α-helix	trans	-64.3	-43.4	177.6	-178.3	66.5	0	0	0	112.1	Y261 A262 Q265 Y266 Q272 Q273 R278 Q279 L280	Y261-L276 HydrophobicContact CD1-CD2 4.18Å; Y261-L276 HydrophobicContact CE1-CD2 4.07Å; A262-L276 HydrophobicContact CB-CD2 4.05Å; Q265-L276 HydrophobicContact CB-CD2 4.15Å; Q265-L276 HydrophobicContact CG-CD2 4.26Å; Y266-L276 HydrophobicContact CD2-CD2 4.06Å; Y266-L276 HydrophobicContact CE2-CB 4.37Å; Y266-L276 HydrophobicContact CE2-CD2 3.93Å; Q272-L276 WeakPolarHBondContact O-CB 3.49Å; Q272-L276 PolarHBondContact O-N 3.22Å; Q272-L276 VanDerWaalsContact O-N 3.08Å; Q273-L276 PolarHBondContact O-N 3Å; L276-R278 VanDerWaalsContact C-N 3.33Å; L276-R278 PolarHBondContact O-N 3.14Å; L276-Q279 PolarHBondContact O-N 2.78Å; L276-L280 HydrophobicContact CD1-CD1 4.31Å; L276-L280 HydrophobicContact CD1-CG 4.34Å; L276-L280 HydrophobicContact CD2-CD1 4.48Å; L276-L280 HydrophobicContact CG-CD1 3.94Å; L276-L280 HydrophobicContact CG-CG 4.39Å; L276-L280 WeakPolarHBondContact O-CG 2.95Å; L276-L280 PolarHBondContact O-N 2.73Å
277	I	93.4	Very high	92.8	Very high	14 Å²	14	86.4 Å²	86.4	7%	0.072	42%	0.42	C	S	.	.	H	α-helix	trans	-58.1	-46.7	176.5	-70.8	163.3	0	0	0	110.1	F258 Q259 A262 Q273 Q274 Q279 L280 Q281	F258-I277 HydrophobicContact CB-CG1 4.48Å; Q259-I277 HydrophobicContact CB-CD1 4.44Å; A262-I277 HydrophobicContact CB-CD1 4.03Å; A262-I277 HydrophobicContact CB-CG1 3.72Å; Q273-I277 WeakPolarHBondContact O-CB 3.37Å; Q273-I277 WeakPolarHBondContact O-CD1 3.34Å; Q273-I277 WeakPolarHBondContact O-CG1 3.42Å; Q273-I277 PolarHBondContact O-N 2.97Å; Q274-I277 PolarHBondContact O-N 3.14Å; I277-Q279 PolarHBondContact O-N 3.24Å; I277-L280 PolarHBondContact O-N 2.94Å; I277-Q281 HydrophobicContact CG2-CG 4.29Å; I277-Q281 WeakPolarHBondContact O-CB 3.35Å; I277-Q281 WeakPolarHBondContact O-CG 3.48Å; I277-Q281 PolarHBondContact O-N 2.82Å
278	R	92.3	Very high	92.9	Very high	184 Å²	184	85.8 Å²	85.8	69%	0.694	41%	0.405	S	S	*	.	H	α-helix	trans	-59.7	-43.6	176.6	-178.4	177.6	174.8	172.1	-0.3	112.1	Q274 I275 L276 Q281 E282	Q274-R278 WeakPolarHBondContact O-CB 3.19Å; Q274-R278 PolarHBondContact O-N 2.86Å; I275-R278 PolarHBondContact O-N 3.38Å; L276-R278 VanDerWaalsContact C-N 3.33Å; L276-R278 PolarHBondContact O-N 3.14Å; R278-Q281 PolarHBondContact O-N 3.07Å; R278-E282 WeakPolarHBondContact O-CB 3.48Å; R278-E282 PolarHBondContact O-N 2.67Å
279	Q	94.2	Very high	93.1	Very high	122 Å²	122	86 Å²	86	57%	0.57	39%	0.39	S	S	*	.	H	α-helix	trans	-64.7	-40.7	178	-170.8	179.7	10	0	0	112.2	I275 L276 I277 E282 Q283	I275-Q279 PolarHBondContact O-N 3.03Å; L276-Q279 PolarHBondContact O-N 2.78Å; I277-Q279 PolarHBondContact O-N 3.24Å; Q279-E282 PolarHBondContact O-N 3.23Å; Q279-Q283 WeakPolarHBondContact O-CB 3.43Å; Q279-Q283 VanDerWaalsContact O-CG 3.31Å; Q279-Q283 WeakPolarHBondContact O-CG 3.18Å; Q279-Q283 PolarHBondContact O-N 2.88Å
280	L	93.6	Very high	93	Very high	44 Å²	44	90 Å²	90	23%	0.23	41%	0.407	C	S	.	.	H	α-helix	trans	-67.3	-39.3	176.1	-69.8	170	0	0	0	112.1	F258 Y261 L276 I277 H284	F258-L280 HydrophobicContact CD1-CB 4.41Å; F258-L280 HydrophobicContact CD2-CB 4.06Å; F258-L280 HydrophobicContact CE2-CB 4.14Å; F258-L280 HydrophobicContact CG-CB 4.2Å; F258-L280 HydrophobicContact CZ-CB 4.37Å; Y261-L280 HydrophobicContact CD1-CD1 3.68Å; Y261-L280 HydrophobicContact CE1-CD1 4.06Å; L276-L280 HydrophobicContact CD1-CD1 4.31Å; L276-L280 HydrophobicContact CD1-CG 4.34Å; L276-L280 HydrophobicContact CD2-CD1 4.48Å; L276-L280 HydrophobicContact CG-CD1 3.94Å; L276-L280 HydrophobicContact CG-CG 4.39Å; L276-L280 WeakPolarHBondContact O-CG 2.95Å; L276-L280 PolarHBondContact O-N 2.73Å; I277-L280 PolarHBondContact O-N 2.94Å; L280-H284 WeakPolarHBondContact O-CB 3.48Å; L280-H284 PolarHBondContact O-N 3.26Å
281	Q	92.5	Very high	93	Very high	43 Å²	43	87.5 Å²	87.5	20%	0.201	40%	0.402	C	S	.	.	H	α-helix	trans	-62.8	-42.6	173.7	-72.3	174.4	-13	0	0	111.9	N251 F258 I277 R278 H284 Y285	N251-Q281 VanDerWaalsContact ND2-CD 3.29Å; N251-Q281 PolarHBondContact ND2-OE1 3.43Å; N251-Q281 WeakPolarHBondContact OD1-CB 3.44Å; N251-Q281 WeakPolarHBondContact OD1-CG 3.49Å; F258-Q281 HydrophobicContact CD2-CG 3.72Å; F258-Q281 HydrophobicContact CE2-CG 3.89Å; I277-Q281 HydrophobicContact CG2-CG 4.29Å; I277-Q281 WeakPolarHBondContact O-CB 3.35Å; I277-Q281 WeakPolarHBondContact O-CG 3.48Å; I277-Q281 PolarHBondContact O-N 2.82Å; R278-Q281 PolarHBondContact O-N 3.07Å; Q281-H284 PolarHBondContact O-N 3.36Å; Q281-Y285 WeakPolarHBondContact O-CB 3.46Å; Q281-Y285 PolarHBondContact O-N 3.48Å
282	E	91.7	Very high	92.9	Very high	103 Å²	103	83.3 Å²	83.3	48%	0.481	38%	0.384	S	S	.	.	H	α-helix	trans	-67.5	-43.9	176.8	-179.9	158.3	-150	0	0	112.4	R278 Q279 H284 Y285 Q286	R278-E282 WeakPolarHBondContact O-CB 3.48Å; R278-E282 PolarHBondContact O-N 2.67Å; Q279-E282 PolarHBondContact O-N 3.23Å; E282-H284 PolarHBondContact O-N 2.99Å; E282-Y285 PolarHBondContact O-N 3.33Å; E282-Q286 VanDerWaalsContact O-CG 3.28Å; E282-Q286 WeakPolarHBondContact O-CG 3.41Å; E282-Q286 PolarHBondContact O-N 3.42Å
283	Q	93.3	Very high	92.8	Very high	95 Å²	95	87 Å²	87	44%	0.444	40%	0.396	S	S	.	.	H	α-helix	trans	-58	-46	172	-77.2	-79	-74.3	0	0	112	Q279 Q286 Q287	Q279-Q283 WeakPolarHBondContact O-CB 3.43Å; Q279-Q283 VanDerWaalsContact O-CG 3.31Å; Q279-Q283 WeakPolarHBondContact O-CG 3.18Å; Q279-Q283 PolarHBondContact O-N 2.88Å; Q283-Q286 PolarHBondContact O-N 3.32Å; Q283-Q287 WeakPolarHBondContact O-CG 3.45Å; Q283-Q287 PolarHBondContact O-N 3.43Å
284	H	93.4	Very high	92.8	Very high	51 Å²	51	93.1 Å²	93.1	24%	0.236	42%	0.424	C	S	.	.	H	α-helix	trans	-67.1	-38.9	-179.6	-172.5	-135.3	0	0	0	112	L250 T254 F258 L280 Q281 E282 Q287 Y288	L250-H284 VanDerWaalsContact CD1-CE1 3.41Å; L250-H284 WeakPolarHBondContact CD1-CE1 3.42Å; L250-H284 HydrophobicContact CD2-CB 4.48Å; L250-H284 WeakPolarHBondContact CG-ND1 3.41Å; T254-H284 WeakPolarHBondContact CG2-CE1 3.46Å; F258-H284 HydrophobicContact CE2-CB 4.22Å; F258-H284 HydrophobicContact CZ-CB 3.87Å; F258-H284 AromaticContact CZ-CG 3.98Å; F258-H284 AromaticContact CZ-ND1 3.99Å; L280-H284 WeakPolarHBondContact O-CB 3.48Å; L280-H284 PolarHBondContact O-N 3.26Å; Q281-H284 PolarHBondContact O-N 3.36Å; E282-H284 PolarHBondContact O-N 2.99Å; H284-Q287 PolarHBondContact O-N 2.92Å; H284-Y288 WeakPolarHBondContact O-CB 3.23Å; H284-Y288 PolarHBondContact O-N 3.31Å
285	Y	93.6	Very high	92.8	Very high	35 Å²	35	91 Å²	91	14%	0.137	42%	0.419	C	S	.	.	H	α-helix	trans	-61.4	-43.6	171.4	175.8	-93.9	0	0	0	112	K243 I246 M247 Q281 E282 Q287 Y288 M289	K243-Y285 HydrophobicContact CG-CE2 4.35Å; K243-Y285 WeakPolarHBondContact CG-OH 3.37Å; I246-Y285 HydrophobicContact CB-CE2 4.2Å; I246-Y285 HydrophobicContact CG2-CD2 4.02Å; I246-Y285 HydrophobicContact CG2-CE2 3.71Å; M247-Y285 HydrophobicContact CB-CD2 4.49Å; M247-Y285 HydrophobicContact CG-CD2 3.38Å; M247-Y285 HydrophobicContact CG-CE2 3.67Å; M247-Y285 HydrophobicContact CG-CG 3.89Å; M247-Y285 HydrophobicContact SD-CD2 4.46Å; Q281-Y285 WeakPolarHBondContact O-CB 3.46Å; Q281-Y285 PolarHBondContact O-N 3.48Å; E282-Y285 PolarHBondContact O-N 3.33Å; Y285-Q287 PolarHBondContact O-N 2.73Å; Y285-Y288 PolarHBondContact O-N 3.36Å; Y285-M289 HydrophobicContact CD1-CG 4.11Å; Y285-M289 HydrophobicContact CD2-CG 4.21Å; Y285-M289 HydrophobicContact CE1-CG 3.61Å; Y285-M289 HydrophobicContact CE2-CG 3.76Å; Y285-M289 HydrophobicContact CE2-SD 3.98Å; Y285-M289 HydrophobicContact CG-CG 4.38Å; Y285-M289 VanDerWaalsContact CZ-CG 3.41Å; Y285-M289 WeakPolarHBondContact O-CB 3.38Å; Y285-M289 VanDerWaalsContact O-CG 3.3Å; Y285-M289 WeakPolarHBondContact O-CG 3.46Å; Y285-M289 PolarHBondContact O-N 3.39Å
286	Q	92.9	Very high	92.5	Very high	97 Å²	97	91.9 Å²	91.9	45%	0.453	42%	0.421	S	S	.	.	H	α-helix	trans	-61	-43.8	176.6	-71.4	169.8	12.1	0	0	112	E282 Q283 Q290	E282-Q286 VanDerWaalsContact O-CG 3.28Å; E282-Q286 WeakPolarHBondContact O-CG 3.41Å; E282-Q286 PolarHBondContact O-N 3.42Å; Q283-Q286 PolarHBondContact O-N 3.32Å; Q286-Q290 WeakPolarHBondContact O-CB 3.49Å; Q286-Q290 PolarHBondContact O-N 2.95Å
287	Q	90.9	Very high	92.3	Very high	120 Å²	120	93.7 Å²	93.7	56%	0.561	43%	0.431	S	S	*	.	H	α-helix	trans	-62.6	-46.9	175.7	-70.5	172	-1.2	0	0	112	Q283 H284 Y285 M289 Q290 Q291	Q283-Q287 WeakPolarHBondContact O-CG 3.45Å; Q283-Q287 PolarHBondContact O-N 3.43Å; H284-Q287 PolarHBondContact O-N 2.92Å; Y285-Q287 PolarHBondContact O-N 2.73Å; Q287-M289 PolarHBondContact O-N 3.17Å; Q287-Q290 PolarHBondContact O-N 3.12Å; Q287-Q291 PolarHBondContact O-N 3.32Å
288	Y	93.3	Very high	92.2	Very high	87 Å²	87	95.6 Å²	95.6	34%	0.341	45%	0.449	S	S	.	.	H	α-helix	trans	-62.2	-43.7	178.5	178.9	-110.9	0	0	0	112.4	I246 L250 H284 Y285 Q290 Q291 L292	I246-Y288 HydrophobicContact CG2-CD1 3.88Å; I246-Y288 HydrophobicContact CG2-CE1 3.69Å; L250-Y288 HydrophobicContact CD1-CD1 4.47Å; L250-Y288 HydrophobicContact CD1-CD2 4.42Å; L250-Y288 HydrophobicContact CD1-CG 4.17Å; L250-Y288 HydrophobicContact CD2-CD1 4.47Å; L250-Y288 HydrophobicContact CD2-CG 4.41Å; H284-Y288 WeakPolarHBondContact O-CB 3.23Å; H284-Y288 PolarHBondContact O-N 3.31Å; Y285-Y288 PolarHBondContact O-N 3.36Å; Y288-Q290 VanDerWaalsContact C-N 3.35Å; Y288-Q290 PolarHBondContact O-N 3.06Å; Y288-Q291 PolarHBondContact O-N 2.94Å; Y288-L292 HydrophobicContact CD1-CD1 3.92Å; Y288-L292 HydrophobicContact CE1-CD1 3.35Å; Y288-L292 HydrophobicContact CE1-CG 4.12Å; Y288-L292 HydrophobicContact CE2-CD1 4.48Å; Y288-L292 HydrophobicContact CE2-CG 4.4Å; Y288-L292 PolarHBondContact O-N 3.32Å
289	M	92.8	Very high	92	Very high	66 Å²	66	93 Å²	93	33%	0.325	44%	0.444	S	S	.	.	H	α-helix	trans	-65.1	-35.5	176	-70.8	-56	-57.1	0	0	112.9	I246 Y285 Q287 L292 Y293	I246-M289 HydrophobicContact CD1-SD 4.46Å; Y285-M289 HydrophobicContact CD1-CG 4.11Å; Y285-M289 HydrophobicContact CD2-CG 4.21Å; Y285-M289 HydrophobicContact CE1-CG 3.61Å; Y285-M289 HydrophobicContact CE2-CG 3.76Å; Y285-M289 HydrophobicContact CE2-SD 3.98Å; Y285-M289 HydrophobicContact CG-CG 4.38Å; Y285-M289 VanDerWaalsContact CZ-CG 3.41Å; Y285-M289 WeakPolarHBondContact O-CB 3.38Å; Y285-M289 VanDerWaalsContact O-CG 3.3Å; Y285-M289 WeakPolarHBondContact O-CG 3.46Å; Y285-M289 PolarHBondContact O-N 3.39Å; Q287-M289 PolarHBondContact O-N 3.17Å; M289-L292 PolarHBondContact O-N 3.38Å; M289-L292 HydrophobicContact SD-CD1 3.89Å; M289-Y293 WeakPolarHBondContact O-CB 3.4Å; M289-Y293 PolarHBondContact O-N 3.48Å
290	Q	92.4	Very high	91.6	Very high	150 Å²	150	92.7 Å²	92.7	70%	0.701	44%	0.443	S	S	*	.	H	α-helix	trans	-65	-40.6	174.1	-175	174.5	96.2	0	0	111.6	Q286 Q287 Y288 Y293 Q294	Q286-Q290 WeakPolarHBondContact O-CB 3.49Å; Q286-Q290 PolarHBondContact O-N 2.95Å; Q287-Q290 PolarHBondContact O-N 3.12Å; Y288-Q290 VanDerWaalsContact C-N 3.35Å; Y288-Q290 PolarHBondContact O-N 3.06Å; Q290-Y293 PolarHBondContact O-N 2.97Å; Q290-Q294 PolarHBondContact O-N 2.99Å; Q290-Q294 VanDerWaalsContact O-N 3.14Å
291	Q	92.6	Very high	91.2	Very high	125 Å²	125	96 Å²	96	58%	0.584	46%	0.457	S	S	*	.	H	α-helix	trans	-65.4	-45.8	175	-169	-179.4	25.3	0	0	111.7	Q287 Y288 Y293 Q294 V295	Q287-Q291 PolarHBondContact O-N 3.32Å; Y288-Q291 PolarHBondContact O-N 2.94Å; Q291-Y293 VanDerWaalsContact C-N 3.34Å; Q291-Y293 PolarHBondContact O-N 3.33Å; Q291-Q294 PolarHBondContact O-N 2.89Å; Q291-V295 WeakPolarHBondContact O-CG2 3.45Å; Q291-V295 PolarHBondContact O-N 3.25Å
292	L	91	Very high	90.9	Very high	64 Å²	64	96.1 Å²	96.1	34%	0.335	47%	0.466	S	S	.	.	H	α-helix	trans	-55.8	-47	174.9	-88	173.7	0	0	0	112.1	Y288 M289 Q294 V295 Q296	Y288-L292 HydrophobicContact CD1-CD1 3.92Å; Y288-L292 HydrophobicContact CE1-CD1 3.35Å; Y288-L292 HydrophobicContact CE1-CG 4.12Å; Y288-L292 HydrophobicContact CE2-CD1 4.48Å; Y288-L292 HydrophobicContact CE2-CG 4.4Å; Y288-L292 PolarHBondContact O-N 3.32Å; M289-L292 PolarHBondContact O-N 3.38Å; M289-L292 HydrophobicContact SD-CD1 3.89Å; L292-Q294 VanDerWaalsContact C-N 3.34Å; L292-Q294 PolarHBondContact O-N 2.97Å; L292-V295 PolarHBondContact O-N 3.22Å; L292-Q296 WeakPolarHBondContact O-CB 3.49Å; L292-Q296 PolarHBondContact O-N 3.25Å
293	Y	91.4	Very high	90.4	Very high	156 Å²	156	93.9 Å²	93.9	61%	0.612	47%	0.465	S	S	*	.	H	α-helix	trans	-61.8	-40.8	179.3	-178.5	-108.2	0	0	0	112.3	M289 Q290 Q291 Q296 L297	M289-Y293 WeakPolarHBondContact O-CB 3.4Å; M289-Y293 PolarHBondContact O-N 3.48Å; Q290-Y293 PolarHBondContact O-N 2.97Å; Q291-Y293 VanDerWaalsContact C-N 3.34Å; Q291-Y293 PolarHBondContact O-N 3.33Å; Y293-Q296 PolarHBondContact O-N 3.49Å; Y293-L297 WeakPolarHBondContact O-CB 3.32Å; Y293-L297 PolarHBondContact O-N 2.82Å
294	Q	91.4	Very high	89.8	Confident	145 Å²	145	94 Å²	94	68%	0.678	47%	0.468	S	S	*	.	H	α-helix	trans	-64.9	-39.2	176.5	-172.4	172	83.6	0	0	112.3	Q290 Q291 L292 A298	Q290-Q294 PolarHBondContact O-N 2.99Å; Q290-Q294 VanDerWaalsContact O-N 3.14Å; Q291-Q294 PolarHBondContact O-N 2.89Å; L292-Q294 VanDerWaalsContact C-N 3.34Å; L292-Q294 PolarHBondContact O-N 2.97Å; Q294-A298 PolarHBondContact O-N 3.42Å
295	V	93.7	Very high	89.2	Confident	76 Å²	76	98.1 Å²	98.1	46%	0.461	49%	0.487	S	S	.	.	H	α-helix	trans	-66.2	-43.3	173.9	172.8	0	0	0	0	111.3	Q291 L292 L297 A298 Q299	Q291-V295 WeakPolarHBondContact O-CG2 3.45Å; Q291-V295 PolarHBondContact O-N 3.25Å; L292-V295 PolarHBondContact O-N 3.22Å; V295-L297 PolarHBondContact O-N 3.09Å; V295-A298 PolarHBondContact O-N 3.4Å; V295-Q299 WeakPolarHBondContact O-CG 2.85Å; V295-Q299 PolarHBondContact O-N 2.71Å
296	Q	89.2	Confident	88.2	Confident	126 Å²	126	103.7 Å²	103.7	59%	0.589	51%	0.512	S	S	*	.	H	α-helix	trans	-63.9	-40.2	178.6	-173.6	176.7	-0.6	0	0	112	L292 Y293 Q299 Q300	L292-Q296 WeakPolarHBondContact O-CB 3.49Å; L292-Q296 PolarHBondContact O-N 3.25Å; Y293-Q296 PolarHBondContact O-N 3.49Å; Q296-Q299 PolarHBondContact O-N 2.72Å; Q296-Q300 WeakPolarHBondContact O-CB 3.28Å; Q296-Q300 PolarHBondContact O-N 3.29Å
297	L	89.9	Confident	86.8	Confident	65 Å²	65	105.3 Å²	105.3	34%	0.34	52%	0.52	S	S	.	.	H	α-helix	trans	-62.7	-43.8	176	-174.5	61.9	0	0	0	111.8	Y293 V295 Q300 Q301	Y293-L297 WeakPolarHBondContact O-CB 3.32Å; Y293-L297 PolarHBondContact O-N 2.82Å; V295-L297 PolarHBondContact O-N 3.09Å; L297-Q300 PolarHBondContact O-N 2.86Å; L297-Q301 WeakPolarHBondContact O-CG 3.25Å; L297-Q301 PolarHBondContact O-N 3.21Å
298	A	90.8	Very high	85.3	Confident	54 Å²	54	107.2 Å²	107.2	45%	0.446	53%	0.529	S	S	.	.	H	α-helix	trans	-63.2	-40.6	175.6	0	0	0	0	0	112.2	Q294 V295 Q301 A302	Q294-A298 PolarHBondContact O-N 3.42Å; V295-A298 PolarHBondContact O-N 3.4Å; A298-Q301 PolarHBondContact O-N 3Å; A298-A302 PolarHBondContact O-N 3.35Å; A298-A302 VanDerWaalsContact O-N 3.13Å
299	Q	88.7	Confident	83.7	Confident	130 Å²	130	110.7 Å²	110.7	61%	0.607	55%	0.548	S	S	*	.	H	α-helix	trans	-65	-40.2	174.1	-73.7	-174.5	-3.2	0	0	112.6	V295 Q296 A302 A303	V295-Q299 WeakPolarHBondContact O-CG 2.85Å; V295-Q299 PolarHBondContact O-N 2.71Å; Q296-Q299 PolarHBondContact O-N 2.72Å; Q299-A302 PolarHBondContact O-N 3.09Å; Q299-A303 WeakPolarHBondContact O-CB 3.29Å; Q299-A303 PolarHBondContact O-N 2.88Å
300	Q	85.6	Confident	81.9	Confident	115 Å²	115	112.5 Å²	112.5	54%	0.537	56%	0.562	S	S	.	*	H	α-helix	trans	-64.5	-41.4	177.7	-174	178.8	82	0	0	111.8	Q296 L297 A303 L304	Q296-Q300 WeakPolarHBondContact O-CB 3.28Å; Q296-Q300 PolarHBondContact O-N 3.29Å; L297-Q300 PolarHBondContact O-N 2.86Å; Q300-A303 PolarHBondContact O-N 3.37Å; Q300-L304 HydrophobicContact CG-CD1 4.3Å; Q300-L304 WeakPolarHBondContact O-CG 3.22Å; Q300-L304 PolarHBondContact O-N 3.27Å
301	Q	84.6	Confident	80.1	Confident	112 Å²	112	111.1 Å²	111.1	52%	0.523	56%	0.564	S	S	.	*	H	α-helix	trans	-61.3	-43.7	174.7	-71	175.3	1.2	0	0	111.7	L297 A298 A303 L304 Q305	L297-Q301 WeakPolarHBondContact O-CG 3.25Å; L297-Q301 PolarHBondContact O-N 3.21Å; A298-Q301 PolarHBondContact O-N 3Å; Q301-A303 VanDerWaalsContact C-N 3.34Å; Q301-A303 PolarHBondContact O-N 2.61Å; Q301-L304 PolarHBondContact O-N 2.8Å; Q301-Q305 WeakPolarHBondContact O-CG 3.46Å; Q301-Q305 PolarHBondContact O-N 3.17Å
302	A	85.6	Confident	78.2	Confident	47 Å²	47	111.6 Å²	111.6	39%	0.388	58%	0.575	S	S	.	*	H	α-helix	trans	-66.8	-31.2	175.5	0	0	0	0	0	113.4	A298 Q299 K306	A298-A302 PolarHBondContact O-N 3.35Å; A298-A302 VanDerWaalsContact O-N 3.13Å; Q299-A302 PolarHBondContact O-N 3.09Å; A302-K306 PolarHBondContact O-N 3.09Å
303	A	82.4	Confident	76.4	Confident	56 Å²	56	113 Å²	113	46%	0.463	60%	0.597	S	S	.	*	H	α-helix	trans	-72.3	-41.2	176	0	0	0	0	0	112.3	Q299 Q300 Q301 K306 Q307	Q299-A303 WeakPolarHBondContact O-CB 3.29Å; Q299-A303 PolarHBondContact O-N 2.88Å; Q300-A303 PolarHBondContact O-N 3.37Å; Q301-A303 VanDerWaalsContact C-N 3.34Å; Q301-A303 PolarHBondContact O-N 2.61Å; A303-K306 PolarHBondContact O-N 3.39Å; A303-Q307 PolarHBondContact O-N 2.72Å
304	L	80.8	Confident	73.8	Confident	98 Å²	98	109.2 Å²	109.2	51%	0.513	60%	0.604	S	S	.	*	H	α-helix	trans	-64.7	-40	176.8	-73.5	169.1	0	0	0	112	Q300 Q301 K306 Q307 Q308	Q300-L304 HydrophobicContact CG-CD1 4.3Å; Q300-L304 WeakPolarHBondContact O-CG 3.22Å; Q300-L304 PolarHBondContact O-N 3.27Å; Q301-L304 PolarHBondContact O-N 2.8Å; L304-K306 VanDerWaalsContact C-N 3.29Å; L304-K306 PolarHBondContact O-N 2.83Å; L304-Q307 PolarHBondContact O-N 3.38Å; L304-Q308 PolarHBondContact O-N 2.9Å
305	Q	79.1	Confident	71.1	Confident	137 Å²	137	108 Å²	108	64%	0.64	61%	0.612	S	S	*	*	H	α-helix	trans	-56.1	-43.6	172.8	-74.3	174.4	-6.1	0	0	111.8	Q301 Q308	Q301-Q305 WeakPolarHBondContact O-CG 3.46Å; Q301-Q305 PolarHBondContact O-N 3.17Å; Q305-Q308 PolarHBondContact O-N 3.38Å
306	K	74.3	Confident	68.3	Low	151 Å²	151	108.7 Å²	108.7	66%	0.657	62%	0.62	S	S	*	*	H	α-helix	trans	-70.3	-31.8	176.9	-73.2	-176.6	173.7	-173.9	0	114.2	A302 A303 L304 Q308	A302-K306 PolarHBondContact O-N 3.09Å; A303-K306 PolarHBondContact O-N 3.39Å; L304-K306 VanDerWaalsContact C-N 3.29Å; L304-K306 PolarHBondContact O-N 2.83Å; K306-Q308 VanDerWaalsContact C-N 3.32Å
307	Q	63.3	Low	65.4	Low	131 Å²	131	110.2 Å²	110.2	61%	0.612	63%	0.631	S	S	*	*	H	α-helix	trans	-70.5	-30.7	173.8	-92.2	-173.4	-11.7	0	0	112.4	A303 L304 E309 V310 V311	A303-Q307 PolarHBondContact O-N 2.72Å; L304-Q307 PolarHBondContact O-N 3.38Å; Q307-E309 PolarHBondContact O-N 3.44Å; Q307-V310 PolarHBondContact O-N 2.81Å; Q307-V311 PolarHBondContact O-N 2.71Å
308	Q	59.5	Low	63.7	Low	160 Å²	160	111.4 Å²	111.4	75%	0.748	64%	0.643	S	S	*	*	H	α-helix	trans	-67.8	-20	-179.7	-157.1	159.8	42.7	0	0	113.1	L304 Q305 K306 V310	L304-Q308 PolarHBondContact O-N 2.9Å; Q305-Q308 PolarHBondContact O-N 3.38Å; K306-Q308 VanDerWaalsContact C-N 3.32Å; Q308-V310 VanDerWaalsContact C-N 3.34Å
309	E	58.5	Low	60.8	Low	160 Å²	160	115.4 Å²	115.4	75%	0.748	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-19.3	170	-62.8	-176.8	114	0	0	113.7	Q307	Q307-E309 PolarHBondContact O-N 3.44Å
310	V	55.8	Low	58.1	Low	104 Å²	104	113.7 Å²	113.7	63%	0.63	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-31.5	-167.7	-178.5	0	0	0	0	113.4	Q307 Q308 V312	Q307-V310 PolarHBondContact O-N 2.81Å; Q308-V310 VanDerWaalsContact C-N 3.34Å; V310-V312 PolarHBondContact O-N 3.5Å; V310-V312 VanDerWaalsContact O-N 3.14Å
311	V	53.6	Low	55.4	Low	122 Å²	122	113.2 Å²	113.2	74%	0.739	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-6.5	-169.2	178	0	0	0	0	114.1	Q307 A313	Q307-V311 PolarHBondContact O-N 2.71Å; V311-A313 PolarHBondContact O-N 2.85Å
312	V	53.2	Low	52.8	Low	135 Å²	135	116.6 Å²	116.6	82%	0.818	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-14.6	177.9	-175.7	0	0	0	0	112.7	V310	V310-V312 PolarHBondContact O-N 3.5Å; V310-V312 VanDerWaalsContact O-N 3.14Å
313	A	52.6	Low	50	Low	94 Å²	94	119.7 Å²	119.7	78%	0.777	70%	0.701	S	S	*	*	S	Bend	trans	-109.1	65.8	-166.7	0	0	0	0	0	116.3	V311	V311-A313 PolarHBondContact O-N 2.85Å
314	G	37.6	Very low	47.3	Very low	75 Å²	75	124.1 Å²	124.1	77%	0.773	72%	0.717	S	S	*	*			trans	115.7	149.2	141.8	0	0	0	0	0	120.7
315	S	35.3	Very low	44.8	Very low	121 Å²	121	123 Å²	123	85%	0.846	72%	0.722	S	S	*	*			trans	-151.1	171.5	164.4	69	0	0	0	0	106.8
316	S	34.2	Very low	42.3	Very low	89 Å²	89	123.4 Å²	123.4	62%	0.622	73%	0.734	S	S	*	*			cis	-174.3	169.4	21.9	57.5	0	0	0	0	112.2
317	L	29.3	Very low	40.6	Very low	158 Å²	158	122.6 Å²	122.6	83%	0.827	74%	0.741	S	S	*	*			trans	67.3	-179.3	149.5	-96.1	77.4	0	0	0	119.4
318	P	52.4	Low	39.1	Very low	90 Å²	90	122.1 Å²	122.1	58%	0.584	75%	0.749	S	S	*	*			cis	-149.7	-174.9	-44.8	44.3	-26.6	0	0	0	119.3
319	T	30.8	Very low	37.5	Very low	138 Å²	138	120.8 Å²	120.8	85%	0.847	76%	0.758	S	S	*	*			trans	66.2	172.9	149.3	73.6	0	0	0	0	121.3
320	S	31.3	Very low	36	Very low	94 Å²	94	120.1 Å²	120.1	66%	0.657	76%	0.759	S	S	*	*			cis	-162.3	153.4	6.5	100.4	0	0	0	0	117.1
321	S	29.7	Very low	35.1	Very low	106 Å²	106	121.1 Å²	121.1	74%	0.741	77%	0.765	S	S	*	*			trans	65.2	171.8	142.1	-35	0	0	0	0	122.1
322	K	28.9	Very low	33.8	Very low	182 Å²	182	124.1 Å²	124.1	79%	0.791	77%	0.774	S	S	*	*			cis	-164.7	145.4	-5.8	-139.8	-171.1	169.8	-175.1	0	116.7
323	V	27.9	Very low	32.7	Very low	112 Å²	112	122.6 Å²	122.6	68%	0.679	77%	0.769	S	S	*	*			trans	51.6	137.8	150.1	-72.7	0	0	0	0	129
324	N	25.9	Very low	31.6	Very low	149 Å²	149	125.1 Å²	125.1	80%	0.797	77%	0.774	S	S	*	*				101.5	109.2	128.5	-89.1	29	0	0	0	126.6
325	A	27.4	Very low	31.1	Very low	75 Å²	75	128.8 Å²	128.8	62%	0.62	78%	0.776	S	S	*	*				90.4	117	113	0	0	0	0	0	125.8
326	T	27	Very low	30.7	Very low	145 Å²	145	126.1 Å²	126.1	89%	0.89	77%	0.768	S	S	*	*			trans	80.3	162.8	140	44.3	0	0	0	0	123
327	V	38.4	Very low	30.5	Very low	135 Å²	135	130.6 Å²	130.6	82%	0.818	78%	0.779	S	S	*	*			trans	-118.7	160.1	-151.5	-138.6	0	0	0	0	113.8
328	P	31.4	Very low	30.4	Very low	120 Å²	120	126.3 Å²	126.3	78%	0.779	77%	0.766	S	S	*	*			trans	-125.5	176.3	152.5	38.3	-25.6	0	0	0	114.2
329	S	25.6	Very low	29.3	Very low	133 Å²	133	130.8 Å²	130.8	93%	0.93	78%	0.777	S	S	*	*			trans	-109.3	-166.6	-166.7	-51	0	0	0	0	115.2
330	D	28.8	Very low	29.1	Very low	146 Å²	146	128.2 Å²	128.2	78%	0.781	76%	0.761	S	S	*	*			trans	-110.7	168.5	-155.7	-161.7	17.1	0	0	0	116.3
331	V	35.3	Very low	28.9	Very low	124 Å²	124	126.1 Å²	126.1	75%	0.752	74%	0.74	S	S	*	*			trans	14.6	138.8	171.7	-73.2	0	0	0	0	124.8
332	M	27.9	Very low	28.8	Very low	186 Å²	186	122 Å²	122	92%	0.916	71%	0.713	S	S	*	*			trans	-150.4	157.2	149.6	-80.3	-170.9	71.5	0	0	108.1
333	S	29.1	Very low	28.7	Very low	103 Å²	103	114.5 Å²	114.5	72%	0.72	68%	0.681	S	S	*	*			cis	-164.8	164.9	-22.2	-172.5	0	0	0	0	108.2
334	V	29.1	Very low	28.7	Very low	146 Å²	146	110.6 Å²	110.6	89%	0.885	66%	0.659	S	S	*	*			trans	-115.3	152.4	178	167.9	0	0	0	0	110.8
335	N	27.3	Very low	28.9	Very low	152 Å²	152	107.7 Å²	107.7	81%	0.813	65%	0.651	S	S	*	*			trans	-134	128.9	-171.2	-170.1	36.7	0	0	0	113.8
336	G	27.9	Very low	29	Very low	65 Å²	65	109 Å²	109	67%	0.67	64%	0.644	S	S	*	*			trans	63	153	152.9	0	0	0	0	0	120.7
337	Q	28.6	Very low	29.1	Very low	183 Å²	183	107.8 Å²	107.8	86%	0.855	63%	0.626	S	S	*	*			cis	-164.7	147.5	-9.9	-133.1	-179.4	-66.1	0	0	111.5
338	A	27	Very low	28.6	Very low	69 Å²	69	107.2 Å²	107.2	57%	0.57	62%	0.615	S	S	*	*			trans	58.9	122.8	139	0	0	0	0	0	121.6
339	K	28.8	Very low	28.3	Very low	183 Å²	183	108.2 Å²	108.2	80%	0.796	61%	0.613	S	S	*	*				89.5	151.8	82.4	-75.9	-170.9	174.3	-170	0	113.2
340	T	27.1	Very low	28.4	Very low	84 Å²	84	109 Å²	109	52%	0.515	60%	0.602	S	S	.	*			cis	-172.2	148.8	-8.7	29.7	0	0	0	0	110.5
341	H	27	Very low	29.5	Very low	50 Å²	50	107 Å²	107	23%	0.231	60%	0.596	C	S	.	*				57.8	151.9	129.2	-61.7	-136.5	0	0	0	120.6	A65 G66 A69 E70 R73	A65-H341 CarbonylContact O-C 3.47Å; A65-H341 WeakPolarHBondContact O-CB 3.48Å; G66-H341 PolarHBondContact O-ND1 2.86Å; A69-H341 HydrophobicContact CB-CB 4.1Å; A69-H341 VanDerWaalsContact CB-CD2 3.49Å; A69-H341 WeakPolarHBondContact CB-CD2 3.28Å; E70-H341 PolarHBondContact N-CE1 2.67Å; E70-H341 PolarHBondContact N-ND1 2.78Å; R73-H341 PolarHBondContact NH1-NE2 3.47Å
342	A	28.4	Very low	29.1	Very low	19 Å²	19	110.6 Å²	110.6	16%	0.157	61%	0.605	C	S	.	*			cis	172.9	177.5	-4.5	0	0	0	0	0	117.5	A64 A65 G67 A68	A64-A342 CarbonylContact C-O 3.5Å; A64-A342 CarbonylContact O-C 3.52Å; A64-A342 VanDerWaalsContact O-C 3.26Å; A65-A342 VanDerWaalsContact C-CB 3.49Å; A65-A342 VanDerWaalsContact CA-O 3.31Å; A65-A342 WeakPolarHBondContact CA-O 3.5Å; A65-A342 PolarHBondContact N-O 3.25Å; G67-A342 VanDerWaalsContact C-CB 3.49Å; A68-A342 HydrophobicContact CB-CB 4.2Å
343	D	27.3	Very low	29.1	Very low	25 Å²	25	106.3 Å²	106.3	13%	0.134	60%	0.599	C	S	.	*			trans	15.4	132.4	160.9	-98.2	-24.6	0	0	0	124.6	A64 G67 A68 D156	A64-D343 CarbonylContact C-O 3.46Å; A64-D343 WeakPolarHBondContact CA-O 3.43Å; A64-D343 WeakPolarHBondContact CB-O 3.49Å; A64-D343 WeakPolarHBondContact O-CB 3.46Å; A64-D343 PolarHBondContact O-N 2.69Å; G67-D343 WeakPolarHBondContact CA-OD2 3.44Å; A68-D343 WeakPolarHBondContact CA-OD2 3.34Å; A68-D343 HydrophobicContact CB-CB 3.86Å; A68-D343 WeakPolarHBondContact CB-OD1 3.44Å; A68-D343 VanDerWaalsContact N-N 3.13Å; A68-D343 PolarHBondContact N-OD2 3.16Å; D156-D343 WeakPolarHBondContact OD1-CA 3.36Å; D156-D343 PolarHBondContact OD1-N 3.44Å; D156-D343 WeakPolarHBondContact OD2-CA 3.38Å
344	S	27.6	Very low	29	Very low	31 Å²	31	105.3 Å²	105.3	22%	0.217	60%	0.598	C	S	.	*				47	152.6	101.4	-60.5	0	0	0	0	120	D156	D156-S344 WeakPolarHBondContact CB-OG 3.42Å; D156-S344 VanDerWaalsContact CG-N 3.31Å; D156-S344 PolarHBondContact OD2-N 3.07Å
345	S	29.8	Very low	29.1	Very low	88 Å²	88	106.7 Å²	106.7	62%	0.615	59%	0.594	S	S	*	*			cis	176.4	-179.1	-13	61.8	0	0	0	0	107.8
346	E	29.6	Very low	29.1	Very low	101 Å²	101	107.8 Å²	107.8	47%	0.472	60%	0.595	S	S	.	*			cis	-143.4	172.6	-4.2	-75.2	-159.9	125.3	0	0	107.2	K111	K111-E346 IonicContact NZ-OE1 2.67Å; K111-E346 PolarHBondContact NZ-OE1 2.99Å
347	K	28.5	Very low	29.1	Very low	120 Å²	120	108.8 Å²	108.8	52%	0.522	60%	0.597	S	S	.	*			trans	71.1	154.6	140.4	-86.5	178.5	174.8	-84.5	0	119.5
348	E	28.2	Very low	29.3	Very low	123 Å²	123	108.6 Å²	108.6	58%	0.575	60%	0.6	S	S	*	*			cis	-173.7	169.8	-11.9	-161.5	164.1	-144.1	0	0	112.2
349	L	25.5	Very low	29.8	Very low	141 Å²	141	112.1 Å²	112.1	74%	0.738	61%	0.605	S	S	*	*			trans	97.2	95.8	154.1	-59	175.7	0	0	0	122.6
350	E	27.2	Very low	30.2	Very low	150 Å²	150	111.1 Å²	111.1	70%	0.701	61%	0.608	S	S	*	*				62.7	159	110.1	-67	-65.7	100.2	0	0	124.2
351	P	53	Low	30.4	Very low	103 Å²	103	109.6 Å²	109.6	67%	0.669	61%	0.61	S	S	*	*			trans	-134.6	-161	-148.7	46.7	-29.4	0	0	0	116.5
352	E	25.8	Very low	30.8	Very low	200 Å²	200	113.6 Å²	113.6	94%	0.935	64%	0.64	S	S	*	*			trans	-149.9	172.6	159.3	-90.2	-139	117.5	0	0	113.2
353	A	28.1	Very low	31.2	Very low	96 Å²	96	121.1 Å²	121.1	79%	0.793	67%	0.669	S	S	*	*			trans	-116.8	-159.4	-171.1	0	0	0	0	0	112.6
354	A	27.6	Very low	31.8	Very low	83 Å²	83	128.1 Å²	128.1	69%	0.686	70%	0.701	S	S	*	*			cis	-166.2	178.2	11	0	0	0	0	0	114.4
355	E	29.7	Very low	32.9	Very low	174 Å²	174	132.6 Å²	132.6	81%	0.813	73%	0.732	S	S	*	*			trans	83.4	132.3	144	-78.8	-179.1	-170.8	0	0	126.4
356	E	29	Very low	34.4	Very low	176 Å²	176	134.8 Å²	134.8	82%	0.822	74%	0.737	S	S	*	*			trans	39.8	137	145.9	-53.1	-160.3	153	0	0	124.9
357	A	27.8	Very low	36.6	Very low	86 Å²	86	132.6 Å²	132.6	71%	0.711	73%	0.731	S	S	*	*				159.7	147.5	89.6	0	0	0	0	0	117.3
358	L	31.7	Very low	39.3	Very low	178 Å²	178	133.4 Å²	133.4	93%	0.932	75%	0.745	S	S	*	*			trans	72.4	124.7	156	-61	179.8	0	0	0	123.7
359	E	38.6	Very low	42.3	Very low	143 Å²	143	130.1 Å²	130.1	67%	0.668	73%	0.732	S	S	*	*			trans	-90.5	144.6	162.9	170.3	-170.3	-174.1	0	0	111.4
360	N	36.7	Very low	45.5	Very low	162 Å²	162	125.1 Å²	125.1	87%	0.866	71%	0.71	S	S	*	*			trans	177.5	118.4	132.8	-105.3	-89.5	0	0	0	112.3
361	G	30.6	Very low	48.8	Very low	53 Å²	53	122.3 Å²	122.3	55%	0.546	71%	0.713	S	S	.	*			trans	-159.9	161	177.6	0	0	0	0	0	112.2	K363	G361-K363 PolarHBondContact O-N 2.99Å
362	P	36.9	Very low	50.8	Low	134 Å²	134	119.5 Å²	119.5	87%	0.87	69%	0.694	S	S	*	*			trans	-71	129.7	-169.9	28.4	-34.5	0	0	0	112.6	E364	P362-E364 PolarHBondContact O-N 3.12Å
363	K	36.6	Very low	54.2	Low	176 Å²	176	113 Å²	113	77%	0.765	67%	0.671	S	S	*	*			trans	-77.8	108.3	176.9	-68.1	-176	178.4	-178.8	0	111.2	G361	G361-K363 PolarHBondContact O-N 2.99Å
364	E	40.4	Very low	57.5	Low	173 Å²	173	111.8 Å²	111.8	81%	0.808	65%	0.65	S	S	*	*			trans	-57.6	150.5	144.5	-60.8	-170.7	155.8	0	0	108.6	P362 L366	P362-E364 PolarHBondContact O-N 3.12Å; E364-L366 VanDerWaalsContact C-N 3.31Å; E364-L366 PolarHBondContact O-N 3.4Å
365	S	49.8	Very low	60.8	Low	124 Å²	124	112.9 Å²	112.9	87%	0.867	64%	0.636	S	S	*	*			trans	-75.8	85.3	-177.3	57.3	0	0	0	0	110.4
366	L	61.2	Low	64.1	Low	135 Å²	135	107.3 Å²	107.3	71%	0.707	61%	0.614	S	S	*	*			trans	-48.4	137.8	176.8	-64.8	174.4	0	0	0	110.9	E364 V368	E364-L366 VanDerWaalsContact C-N 3.31Å; E364-L366 PolarHBondContact O-N 3.4Å; L366-V368 PolarHBondContact O-N 3.28Å
367	P	76.1	Confident	67.3	Low	55 Å²	55	101.5 Å²	101.5	36%	0.357	59%	0.585	S	S	.	*			trans	-59.8	138.1	179	24.4	-32.6	0	0	0	110.6	I369 W435	P367-I369 PolarHBondContact O-N 3.15Å; P367-I369 VanDerWaalsContact O-N 3.09Å; P367-W435 HydrophobicContact CB-CH2 3.47Å; P367-W435 VanDerWaalsContact CB-CH2 3.47Å; P367-W435 HydrophobicContact CB-CZ2 3.82Å; P367-W435 HydrophobicContact CB-CZ3 4.38Å; P367-W435 HydrophobicContact CG-CH2 3.42Å; P367-W435 VanDerWaalsContact CG-CH2 3.42Å; P367-W435 HydrophobicContact CG-CZ2 3.3Å; P367-W435 HydrophobicContact CG-CZ3 4.28Å
368	V	84.6	Confident	70.5	Confident	136 Å²	136	101.3 Å²	101.3	82%	0.824	58%	0.576	S	S	*	*			trans	-82.3	94.6	-177.2	-176.2	0	0	0	0	109.3	L366	L366-V368 PolarHBondContact O-N 3.28Å
369	I	91.9	Very high	73.6	Confident	55 Å²	55	97.4 Å²	97.4	28%	0.282	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-70.4	132.2	175.5	-53.3	-177.8	0	0	0	109.2	P367 D477 I479 P499	P367-I369 PolarHBondContact O-N 3.15Å; P367-I369 VanDerWaalsContact O-N 3.09Å; I369-D477 HydrophobicContact CD1-CB 3.51Å; I369-D477 WeakPolarHBondContact CD1-OD2 3.18Å; I369-I479 HydrophobicContact CG2-CD1 3.62Å; I369-P499 HydrophobicContact CG1-CB 4.17Å
370	A	92.8	Very high	76.3	Confident	35 Å²	35	91.6 Å²	91.6	29%	0.289	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-83	154.2	178.5	0	0	0	0	0	110.8	H496 Q497	A370-H496 PolarHBondContact N-NE2 3.26Å; A370-H496 PolarHBondContact O-CD2 2.99Å; A370-H496 PolarHBondContact O-NE2 3.36Å; A370-Q497 HydrophobicContact CB-CB 4.04Å
371	A	95.1	Very high	79.2	Confident	91 Å²	91	91.1 Å²	91.1	75%	0.752	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-67.5	131.7	166.9	0	0	0	0	0	109.4
372	P	96.5	Very high	82.4	Confident	44 Å²	44	93.8 Å²	93.8	29%	0.286	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-68.3	154.5	173.2	32.9	-39.5	0	0	0	110.9	W418 I479 V480 S495 H496	P372-W418 HydrophobicContact CB-CH2 4.38Å; P372-I479 HydrophobicContact CB-CG2 4.1Å; P372-I479 HydrophobicContact CG-CG2 4.33Å; P372-I479 VanDerWaalsContact CG-O 3.31Å; P372-I479 WeakPolarHBondContact CG-O 3.24Å; P372-V480 HydrophobicContact CB-CG2 3.96Å; P372-V480 HydrophobicContact CG-CG2 3.82Å; P372-S495 CarbonylContact C-O 3.49Å; P372-S495 WeakPolarHBondContact CA-O 3.4Å; P372-H496 HydrophobicContact CB-CB 4.44Å
373	S	97.1	Very high	85.3	Confident	64 Å²	64	87.8 Å²	87.8	45%	0.448	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	137	166.6	-66.7	0	0	0	0	109.6	G494 S495	S373-G494 CarbonylContact O-C 3.6Å; S373-G494 WeakPolarHBondContact O-CA 3.45Å; S373-S495 PolarHBondContact N-O 2.88Å; S373-S495 PolarHBondContact O-N 3.4Å
374	M	96.7	Very high	88.2	Confident	70 Å²	70	80.8 Å²	80.8	35%	0.345	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	138.4	178.9	-74.6	-70	-68.8	0	0	109.9	W418 F429 Y492 A493	M374-W418 HydrophobicContact SD-CZ2 3.61Å; M374-W418 PolarHBondContact SD-NE1 2.65Å; M374-W418 VanDerWaalsContact SD-NE1 3.44Å; M374-F429 HydrophobicContact CE-CD1 4.48Å; M374-F429 HydrophobicContact CE-CE1 4.44Å; M374-Y492 HydrophobicContact CE-CD1 4.49Å; M374-A493 WeakPolarHBondContact CA-O 3.31Å
375	W	97.9	Very high	90.8	Very high	106 Å²	106	78.6 Å²	78.6	40%	0.402	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	170.4	178.3	61.5	92.6	0	0	0	111.2	F417 A493	W375-F417 HydrophobicContact CH2-CD1 4.02Å; W375-F417 AromaticContact CH2-CE1 3.95Å; W375-F417 HydrophobicContact CH2-CE1 3.95Å; W375-F417 HydrophobicContact CZ2-CD1 4.4Å; W375-F417 HydrophobicContact CZ2-CE1 4.5Å; W375-A493 HydrophobicContact CD2-CB 4.4Å; W375-A493 HydrophobicContact CZ2-CB 4.07Å; W375-A493 PolarHBondContact N-O 2.86Å; W375-A493 PolarHBondContact O-N 3.47Å
376	T	97.3	Very high	93.1	Very high	57 Å²	57	79 Å²	79	35%	0.35	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	166.2	173.7	59.4	0	0	0	0	111.5	E490 V491 Y492	T376-E490 WeakPolarHBondContact CB-OE2 3.5Å; T376-E490 PolarHBondContact OG1-OE2 3.4Å; T376-V491 CarbonylContact C-O 3.51Å; T376-V491 VanDerWaalsContact CA-O 3.23Å; T376-V491 WeakPolarHBondContact CA-O 3.32Å; T376-Y492 HydrophobicContact CG2-CD1 3.89Å; T376-Y492 HydrophobicContact CG2-CD2 3.92Å; T376-Y492 HydrophobicContact CG2-CE1 3.8Å; T376-Y492 HydrophobicContact CG2-CE2 3.86Å; T376-Y492 HydrophobicContact CG2-CG 3.96Å
377	R	96.6	Very high	94.7	Very high	54 Å²	54	73 Å²	73	20%	0.204	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	138.8	168.7	60.3	177.5	-172.6	68	1.1	112.3	Q379 E419 V491	R377-Q379 VanDerWaalsContact C-N 3.33Å; R377-Q379 PolarHBondContact NH1-O 3.46Å; R377-Q379 PolarHBondContact O-N 2.91Å; R377-E419 IonicContact CZ-OE1 3.92Å; R377-E419 VanDerWaalsContact CZ-OE1 3.31Å; R377-E419 IonicContact NE-OE1 2.73Å; R377-E419 PolarHBondContact NE-OE1 3.03Å; R377-E419 IonicContact NH2-OE1 3.14Å; R377-E419 PolarHBondContact NH2-OE1 3.08Å; R377-V491 HydrophobicContact CG-CB 3.86Å; R377-V491 HydrophobicContact CG-CG2 4.44Å; R377-V491 PolarHBondContact N-O 3.37Å; R377-V491 PolarHBondContact O-N 3.11Å
378	P	95.9	Very high	95.5	Very high	82 Å²	82	76.7 Å²	76.7	53%	0.532	41%	0.405	S	S	.	.	S	Bend	trans	-78.1	-8.6	-170.6	28.5	-35.8	0	0	0	115.2	I380 E490	P378-I380 PolarHBondContact O-N 3.03Å; P378-E490 WeakPolarHBondContact CA-OE1 3.42Å; P378-E490 WeakPolarHBondContact CB-OE1 3.28Å; P378-E490 WeakPolarHBondContact CD-OE1 3.27Å
379	Q	95.8	Very high	95.8	Very high	96 Å²	96	78 Å²	78	45%	0.449	40%	0.402	S	S	.	.			trans	-78.6	61	-180	-58.9	79.3	10.2	0	0	111.9	R377 D382 F383	R377-Q379 VanDerWaalsContact C-N 3.33Å; R377-Q379 PolarHBondContact NH1-O 3.46Å; R377-Q379 PolarHBondContact O-N 2.91Å; Q379-D382 HydrophobicContact CB-CB 4.37Å; Q379-F383 WeakPolarHBondContact O-CB 3.24Å; Q379-F383 PolarHBondContact O-N 3.07Å
380	I	97.1	Very high	95.7	Very high	22 Å²	22	79 Å²	79	11%	0.113	41%	0.408	C	S	.	.	H	α-helix	trans	-74.6	-33.8	-177.6	-171.8	169.3	0	0	0	113.5	P378 K384 A421 C487 H488 V491	P378-I380 PolarHBondContact O-N 3.03Å; I380-K384 HydrophobicContact CG1-CD 4.48Å; I380-K384 WeakPolarHBondContact O-CG 3.09Å; I380-K384 PolarHBondContact O-N 3.25Å; I380-K384 VanDerWaalsContact O-N 3.1Å; I380-A421 HydrophobicContact CD1-CB 4Å; I380-A421 HydrophobicContact CG1-CB 3.94Å; I380-C487 WeakPolarHBondContact CD1-O 3.27Å; I380-H488 WeakPolarHBondContact CD1-O 3.16Å; I380-V491 HydrophobicContact CB-CG2 3.95Å; I380-V491 HydrophobicContact CG1-CG2 4.14Å
381	K	96.8	Very high	95.3	Very high	152 Å²	152	81 Å²	81	66%	0.661	43%	0.425	S	S	*	.	H	α-helix	trans	-67.8	-57	178	-65.2	-177.5	179	-179.1	0	111	F383 K384 E385	K381-F383 PolarHBondContact O-N 2.99Å; K381-F383 VanDerWaalsContact O-N 3.11Å; K381-K384 PolarHBondContact O-N 3.35Å; K381-E385 WeakPolarHBondContact O-CG 3.13Å; K381-E385 PolarHBondContact O-N 3.2Å
382	D	97.2	Very high	95	Very high	109 Å²	109	82.9 Å²	82.9	58%	0.583	42%	0.422	S	S	*	.	H	α-helix	trans	-53.1	-33.7	176.9	-47.5	30.7	0	0	0	112.1	Q379 K386	Q379-D382 HydrophobicContact CB-CB 4.37Å; D382-K386 VanDerWaalsContact O-CB 3.3Å; D382-K386 WeakPolarHBondContact O-CB 3.49Å; D382-K386 PolarHBondContact O-N 3.37Å
383	F	97.6	Very high	94.9	Very high	8 Å²	8	81.7 Å²	81.7	4%	0.035	42%	0.415	C	S	.	.	H	α-helix	trans	-68.3	-56.3	173.1	176.6	-117.7	0	0	0	111.8	Q379 K381 E385 K386 I387 E419 A421 V491 Y521 R523	Q379-F383 WeakPolarHBondContact O-CB 3.24Å; Q379-F383 PolarHBondContact O-N 3.07Å; K381-F383 PolarHBondContact O-N 2.99Å; K381-F383 VanDerWaalsContact O-N 3.11Å; F383-E385 VanDerWaalsContact C-N 3.35Å; F383-E385 PolarHBondContact O-N 3.44Å; F383-K386 WeakPolarHBondContact O-CB 3.39Å; F383-K386 PolarHBondContact O-N 3.46Å; F383-I387 HydrophobicContact CD1-CG1 4.47Å; F383-I387 HydrophobicContact CD2-CD1 4.22Å; F383-I387 HydrophobicContact CD2-CG1 3.68Å; F383-I387 HydrophobicContact CE1-CG1 4.22Å; F383-I387 HydrophobicContact CE2-CD1 3.72Å; F383-I387 HydrophobicContact CE2-CG1 3.4Å; F383-I387 VanDerWaalsContact CE2-CG1 3.4Å; F383-I387 HydrophobicContact CG-CG1 4.24Å; F383-I387 HydrophobicContact CZ-CD1 4.27Å; F383-I387 HydrophobicContact CZ-CG1 3.7Å; F383-I387 WeakPolarHBondContact O-CG1 3.48Å; F383-I387 PolarHBondContact O-N 2.96Å; F383-E419 HydrophobicContact CE2-CB 3.77Å; F383-E419 HydrophobicContact CZ-CB 3.86Å; F383-A421 HydrophobicContact CD1-CB 3.76Å; F383-A421 HydrophobicContact CE1-CB 3.74Å; F383-V491 HydrophobicContact CB-CG2 3.73Å; F383-V491 HydrophobicContact CD1-CB 4.38Å; F383-V491 HydrophobicContact CD1-CG1 3.74Å; F383-V491 HydrophobicContact CD1-CG2 3.66Å; F383-V491 HydrophobicContact CD2-CG1 4.42Å; F383-V491 HydrophobicContact CE1-CG1 3.75Å; F383-V491 HydrophobicContact CE1-CG2 4.47Å; F383-V491 HydrophobicContact CE2-CG1 4.39Å; F383-V491 HydrophobicContact CG-CG1 4.08Å; F383-V491 HydrophobicContact CG-CG2 3.84Å; F383-V491 HydrophobicContact CZ-CG1 4.07Å; F383-Y521 WeakPolarHBondContact CE1-O 3.05Å; F383-R523 HydrophobicContact CE2-CB 4.37Å
384	K	97.2	Very high	94.8	Very high	29 Å²	29	80.8 Å²	80.8	13%	0.126	41%	0.407	C	S	.	.	H	α-helix	trans	-58.6	-45	-179.7	-69.3	178.3	179.6	-178.7	0	112.3	I380 K381 K386 I387 Q388 T422 D423 Y521	I380-K384 HydrophobicContact CG1-CD 4.48Å; I380-K384 WeakPolarHBondContact O-CG 3.09Å; I380-K384 PolarHBondContact O-N 3.25Å; I380-K384 VanDerWaalsContact O-N 3.1Å; K381-K384 PolarHBondContact O-N 3.35Å; K384-K386 PolarHBondContact O-N 2.85Å; K384-I387 PolarHBondContact O-N 2.95Å; K384-Q388 WeakPolarHBondContact O-CB 3.38Å; K384-Q388 PolarHBondContact O-N 3.29Å; K384-T422 VanDerWaalsContact CE-O 3.23Å; K384-T422 WeakPolarHBondContact CE-O 3.15Å; K384-T422 PolarHBondContact NZ-O 2.81Å; K384-D423 IonicContact NZ-OD1 3.36Å; K384-D423 PolarHBondContact NZ-OD1 3.07Å; K384-Y521 HydrophobicContact CB-CD1 4.05Å; K384-Y521 HydrophobicContact CB-CE1 4.11Å; K384-Y521 HydrophobicContact CB-CG 4.34Å; K384-Y521 HydrophobicContact CD-CD2 4.02Å; K384-Y521 HydrophobicContact CD-CE2 3.88Å; K384-Y521 HydrophobicContact CD-CG 4.5Å; K384-Y521 HydrophobicContact CG-CD1 4.01Å; K384-Y521 HydrophobicContact CG-CD2 3.78Å; K384-Y521 HydrophobicContact CG-CE1 4.25Å; K384-Y521 HydrophobicContact CG-CE2 4.05Å; K384-Y521 HydrophobicContact CG-CG 3.78Å
385	E	96.7	Very high	94.8	Very high	127 Å²	127	78.4 Å²	78.4	59%	0.593	40%	0.396	S	S	*	.	H	α-helix	trans	-60.7	-27.6	177	-70.6	175.6	-157.1	0	0	112.9	K381 F383 Q389	K381-E385 WeakPolarHBondContact O-CG 3.13Å; K381-E385 PolarHBondContact O-N 3.2Å; F383-E385 VanDerWaalsContact C-N 3.35Å; F383-E385 PolarHBondContact O-N 3.44Å; E385-Q389 PolarHBondContact O-NE2 3.13Å
386	K	96.2	Very high	94.7	Very high	133 Å²	133	78.1 Å²	78.1	58%	0.578	41%	0.405	S	S	*	.	H	α-helix	trans	-83.3	-40.8	173.8	-176.8	174.9	178.7	-179.9	0	112.7	D382 F383 K384	D382-K386 VanDerWaalsContact O-CB 3.3Å; D382-K386 WeakPolarHBondContact O-CB 3.49Å; D382-K386 PolarHBondContact O-N 3.37Å; F383-K386 WeakPolarHBondContact O-CB 3.39Å; F383-K386 PolarHBondContact O-N 3.46Å; K384-K386 PolarHBondContact O-N 2.85Å
387	I	95.6	Very high	94.5	Very high	9 Å²	9	75.4 Å²	75.4	5%	0.046	39%	0.389	C	S	.	.	H	α-helix	trans	-72.7	-37.4	-178.9	-64.2	-54.8	0	0	0	111.7	F383 K384 Q389 D390 S393 V394 Y521 R523	F383-I387 HydrophobicContact CD1-CG1 4.47Å; F383-I387 HydrophobicContact CD2-CD1 4.22Å; F383-I387 HydrophobicContact CD2-CG1 3.68Å; F383-I387 HydrophobicContact CE1-CG1 4.22Å; F383-I387 HydrophobicContact CE2-CD1 3.72Å; F383-I387 HydrophobicContact CE2-CG1 3.4Å; F383-I387 VanDerWaalsContact CE2-CG1 3.4Å; F383-I387 HydrophobicContact CG-CG1 4.24Å; F383-I387 HydrophobicContact CZ-CD1 4.27Å; F383-I387 HydrophobicContact CZ-CG1 3.7Å; F383-I387 WeakPolarHBondContact O-CG1 3.48Å; F383-I387 PolarHBondContact O-N 2.96Å; K384-I387 PolarHBondContact O-N 2.95Å; I387-Q389 PolarHBondContact O-N 3.36Å; I387-D390 PolarHBondContact O-N 2.76Å; I387-S393 VanDerWaalsContact CG2-O 3.28Å; I387-S393 WeakPolarHBondContact CG2-O 3.39Å; I387-V394 HydrophobicContact CG2-CG2 3.93Å; I387-Y521 HydrophobicContact CB-CD1 4.42Å; I387-Y521 HydrophobicContact CG2-CD1 4.3Å; I387-R523 HydrophobicContact CD1-CB 3.86Å; I387-R523 HydrophobicContact CD1-CG 4.24Å
388	Q	93.2	Very high	93.8	Very high	132 Å²	132	73 Å²	73	62%	0.617	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-7.9	178.9	-168.1	172.1	36.6	0	0	114.4	K384 D390 Y521	K384-Q388 WeakPolarHBondContact O-CB 3.38Å; K384-Q388 PolarHBondContact O-N 3.29Å; Q388-D390 VanDerWaalsContact C-N 3.26Å; Q388-Y521 HydrophobicContact CB-CE1 4.31Å
389	Q	91.5	Very high	93.2	Very high	163 Å²	163	74.3 Å²	74.3	76%	0.762	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-15	172	-60.9	172	33.8	0	0	112.4	E385 I387	E385-Q389 PolarHBondContact O-NE2 3.13Å; I387-Q389 PolarHBondContact O-N 3.36Å
390	D	90	Very high	92.3	Very high	75 Å²	75	70.8 Å²	70.8	40%	0.401	37%	0.365	S	S	.	.	S	Bend	trans	-121.5	117.8	175.6	174.6	24.9	0	0	0	109.6	I387 Q388 D392 S393	I387-D390 PolarHBondContact O-N 2.76Å; Q388-D390 VanDerWaalsContact C-N 3.26Å; D390-D392 PolarHBondContact OD1-N 2.66Å; D390-S393 PolarHBondContact O-N 2.94Å; D390-S393 WeakPolarHBondContact OD2-CB 3.41Å; D390-S393 PolarHBondContact OD2-OG 2.86Å
391	A	84	Confident	91.7	Very high	79 Å²	79	71.9 Å²	71.9	65%	0.653	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-69.6	-34.4	-175.5	0	0	0	0	0	112.3	S393 V394	A391-S393 PolarHBondContact O-N 2.99Å; A391-V394 PolarHBondContact O-N 3.29Å; A391-V394 VanDerWaalsContact O-N 3.12Å
392	D	88	Confident	91.3	Very high	129 Å²	129	64.7 Å²	64.7	69%	0.69	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-74.5	-14.6	-176.3	-62.7	-17.4	0	0	0	111.9	D390 Y522	D390-D392 PolarHBondContact OD1-N 2.66Å; D392-Y522 VanDerWaalsContact O-CE1 3.29Å; D392-Y522 WeakPolarHBondContact O-CE1 3.39Å; D392-Y522 PolarHBondContact O-OH 3.08Å
393	S	94.2	Very high	91.1	Very high	19 Å²	19	59.5 Å²	59.5	13%	0.133	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-90.4	4	172.7	-66.7	0	0	0	0	113.9	I387 D390 A391 Y522	I387-S393 VanDerWaalsContact CG2-O 3.28Å; I387-S393 WeakPolarHBondContact CG2-O 3.39Å; D390-S393 PolarHBondContact O-N 2.94Å; D390-S393 WeakPolarHBondContact OD2-CB 3.41Å; D390-S393 PolarHBondContact OD2-OG 2.86Å; A391-S393 PolarHBondContact O-N 2.99Å; S393-Y522 WeakPolarHBondContact CB-O 3.27Å; S393-Y522 VanDerWaalsContact O-CD1 3.26Å; S393-Y522 WeakPolarHBondContact O-CD1 3.05Å; S393-Y522 PolarHBondContact O-N 2.75Å
394	V	96.3	Very high	91.1	Very high	45 Å²	45	59.5 Å²	59.5	27%	0.273	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	104.6	174.7	-174.5	0	0	0	0	111.1	I387 A391 V520 Y521	I387-V394 HydrophobicContact CG2-CG2 3.93Å; A391-V394 PolarHBondContact O-N 3.29Å; A391-V394 VanDerWaalsContact O-N 3.12Å; V394-V520 WeakPolarHBondContact CA-O 3.32Å; V394-Y521 HydrophobicContact CG1-CD1 4.22Å; V394-Y521 HydrophobicContact CG1-CE1 4.15Å; V394-Y521 HydrophobicContact CG2-CD1 3.65Å; V394-Y521 HydrophobicContact CG2-CE1 4.05Å; V394-Y521 HydrophobicContact CG2-CG 4.45Å
395	I	95.4	Very high	91	Very high	21 Å²	21	58.1 Å²	58.1	11%	0.108	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	150	179.4	60.6	-178.4	0	0	0	111.2	V397 V403 V405 V445 F508 V520 Y522	I395-V397 HydrophobicContact CD1-CG2 4.42Å; I395-V397 HydrophobicContact CG1-CG2 4.5Å; I395-V403 HydrophobicContact CD1-CB 4.45Å; I395-V403 HydrophobicContact CD1-CG1 3.86Å; I395-V405 HydrophobicContact CD1-CG2 4.17Å; I395-V445 HydrophobicContact CG2-CG1 4.21Å; I395-V445 HydrophobicContact CG2-CG2 4.48Å; I395-F508 HydrophobicContact CD1-CD2 3.76Å; I395-F508 HydrophobicContact CD1-CE2 4.11Å; I395-F508 HydrophobicContact CD1-CG 4.42Å; I395-V520 HydrophobicContact CD1-CB 4.31Å; I395-V520 HydrophobicContact CG1-CB 3.76Å; I395-V520 HydrophobicContact CG1-CG1 4.37Å; I395-V520 HydrophobicContact CG1-CG2 4.48Å; I395-V520 PolarHBondContact N-O 3.21Å; I395-V520 PolarHBondContact O-N 3.45Å; I395-Y522 HydrophobicContact CD1-CD1 4.36Å; I395-Y522 HydrophobicContact CG1-CD1 4.34Å; I395-Y522 HydrophobicContact CG2-CE1 3.93Å
396	T	96	Very high	91	Very high	99 Å²	99	54.3 Å²	54.3	61%	0.607	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	118.8	168.2	-62.6	0	0	0	0	108.6	K518	T396-K518 WeakPolarHBondContact CA-O 3.37Å
397	V	93.4	Very high	91	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	110.9	171.8	-171.9	0	0	0	0	107.4	I395 E401 V403 I427 F508 N510 S517 K518 V520	I395-V397 HydrophobicContact CD1-CG2 4.42Å; I395-V397 HydrophobicContact CG1-CG2 4.5Å; V397-E401 HydrophobicContact CG1-CB 4.28Å; V397-V403 HydrophobicContact CB-CG2 4.25Å; V397-V403 HydrophobicContact CG1-CG2 4.02Å; V397-V403 HydrophobicContact CG2-CB 4Å; V397-V403 HydrophobicContact CG2-CG2 3.83Å; V397-I427 HydrophobicContact CB-CD1 4.18Å; V397-I427 HydrophobicContact CG1-CD1 4.42Å; V397-I427 HydrophobicContact CG2-CD1 3.98Å; V397-F508 HydrophobicContact CG2-CB 4.13Å; V397-N510 HydrophobicContact CB-CB 4.31Å; V397-N510 HydrophobicContact CG1-CB 3.43Å; V397-N510 VanDerWaalsContact CG1-CB 3.43Å; V397-N510 PolarHBondContact O-ND2 3.22Å; V397-S517 CarbonylContact O-C 3.4Å; V397-S517 WeakPolarHBondContact O-CA 3.21Å; V397-S517 WeakPolarHBondContact O-CB 3.27Å; V397-K518 PolarHBondContact N-O 2.9Å; V397-K518 PolarHBondContact O-N 3.15Å; V397-V520 HydrophobicContact CG2-CG2 3.79Å
398	G	82	Confident	91.1	Very high	4 Å²	4	48.8 Å²	48.8	4%	0.041	26%	0.263	C	S	.	.			trans	-77.8	-176.6	-178	0	0	0	0	0	113.6	G400 E401 N510	G398-G400 PolarHBondContact O-N 3.43Å; G398-E401 WeakPolarHBondContact CA-OE1 3.24Å; G398-E401 VanDerWaalsContact CA-OE2 3.24Å; G398-E401 WeakPolarHBondContact CA-OE2 3.44Å; G398-E401 VanDerWaalsContact N-CD 3.32Å; G398-E401 PolarHBondContact N-OE2 3.42Å; G398-E401 PolarHBondContact O-N 3.35Å; G398-N510 PolarHBondContact O-ND2 2.61Å
399	R	83.1	Confident	91.2	Very high	110 Å²	110	43 Å²	43	42%	0.415	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	117.6	-168	52.5	169.1	-169	145.8	7.7	111.1	H116 L120 E401 S513	H116-R399 PolarHBondContact NE2-NH1 3.37Å; L120-R399 VanDerWaalsContact CD1-NH2 3.31Å; R399-E401 VanDerWaalsContact C-N 3.26Å; R399-S513 WeakPolarHBondContact CA-O 3.26Å; R399-S513 WeakPolarHBondContact CB-O 3.31Å
400	G	77.8	Confident	91.3	Very high	22 Å²	22	37.4 Å²	37.4	23%	0.227	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	87	-12.5	-176.6	0	0	0	0	0	114.6	G398 N510 S511	G398-G400 PolarHBondContact O-N 3.43Å; G400-N510 PolarHBondContact N-O 3.36Å; G400-S511 WeakPolarHBondContact O-CA 3.45Å
401	E	83.8	Confident	91.4	Very high	44 Å²	44	40.8 Å²	40.8	21%	0.206	22%	0.224	C	C	.	.			trans	-75.8	157.1	-179.7	-68.2	155.8	-133	0	0	112.6	V397 G398 R399 V447 S448 N510 S511	V397-E401 HydrophobicContact CG1-CB 4.28Å; G398-E401 WeakPolarHBondContact CA-OE1 3.24Å; G398-E401 VanDerWaalsContact CA-OE2 3.24Å; G398-E401 WeakPolarHBondContact CA-OE2 3.44Å; G398-E401 VanDerWaalsContact N-CD 3.32Å; G398-E401 PolarHBondContact N-OE2 3.42Å; G398-E401 PolarHBondContact O-N 3.35Å; R399-E401 VanDerWaalsContact C-N 3.26Å; E401-V447 HydrophobicContact CG-CG1 4.46Å; E401-S448 WeakPolarHBondContact CA-O 3.45Å; E401-N510 CarbonylContact O-C 3.56Å; E401-N510 WeakPolarHBondContact O-CA 3.27Å; E401-N510 WeakPolarHBondContact O-CB 3.49Å; E401-N510 PolarHBondContact O-N 3.14Å; E401-S511 PolarHBondContact O-N 2.67Å
402	V	88.5	Confident	91.8	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.006	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	127	165.5	-178	0	0	0	0	108.4	S448 K507 F508 D509	V402-S448 PolarHBondContact N-O 3.13Å; V402-S448 PolarHBondContact O-N 3.14Å; V402-K507 HydrophobicContact CG1-CB 4.39Å; V402-K507 HydrophobicContact CG1-CD 4.21Å; V402-F508 WeakPolarHBondContact CA-O 3.29Å; V402-D509 HydrophobicContact CG1-CB 4.31Å; V402-D509 HydrophobicContact CG2-CB 4.21Å
403	V	92.9	Very high	92.1	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	123.7	178.2	176.7	0	0	0	0	110.2	I395 V397 V445 H446 V447 F508	I395-V403 HydrophobicContact CD1-CB 4.45Å; I395-V403 HydrophobicContact CD1-CG1 3.86Å; V397-V403 HydrophobicContact CB-CG2 4.25Å; V397-V403 HydrophobicContact CG1-CG2 4.02Å; V397-V403 HydrophobicContact CG2-CB 4Å; V397-V403 HydrophobicContact CG2-CG2 3.83Å; V403-V445 HydrophobicContact CG1-CG1 3.4Å; V403-V445 VanDerWaalsContact CG1-CG1 3.4Å; V403-H446 CarbonylContact C-O 3.46Å; V403-H446 WeakPolarHBondContact CA-O 3.19Å; V403-V447 HydrophobicContact CG2-CB 4.36Å; V403-V447 HydrophobicContact CG2-CG1 4.09Å; V403-V447 HydrophobicContact CG2-CG2 4.01Å; V403-F508 PolarHBondContact N-O 2.72Å; V403-F508 PolarHBondContact O-N 3.19Å
404	T	96.4	Very high	92.2	Very high	7 Å²	7	37.5 Å²	37.5	4%	0.043	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	114.2	178.5	-47.7	0	0	0	0	109.8	R406 H446 L505 L506 K507	T404-R406 HydrophobicContact CG2-CG 4.22Å; T404-H446 PolarHBondContact N-O 2.92Å; T404-H446 PolarHBondContact O-N 2.92Å; T404-L505 HydrophobicContact CG2-CB 3.94Å; T404-L505 HydrophobicContact CG2-CD2 4.29Å; T404-L506 WeakPolarHBondContact CA-O 3.44Å; T404-K507 HydrophobicContact CG2-CD 3.99Å; T404-K507 WeakPolarHBondContact OG1-CD 3.2Å; T404-K507 WeakPolarHBondContact OG1-CE 3.48Å; T404-K507 PolarHBondContact OG1-NZ 3.45Å; T404-K507 VanDerWaalsContact OG1-NZ 3.12Å
405	V	96.1	Very high	92.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	111.4	168.2	-175.2	0	0	0	0	108.7	I395 V407 V443 V445 L506 F508 Y522	I395-V405 HydrophobicContact CD1-CG2 4.17Å; V405-V407 HydrophobicContact CG1-CG2 4.01Å; V405-V443 HydrophobicContact CG1-CG1 3.54Å; V405-V445 HydrophobicContact CG2-CG1 4.44Å; V405-V445 HydrophobicContact CG2-CG2 4.26Å; V405-L506 HydrophobicContact CB-CB 4.21Å; V405-L506 PolarHBondContact N-O 3.45Å; V405-L506 PolarHBondContact O-N 2.97Å; V405-F508 HydrophobicContact CG2-CD2 4.06Å; V405-F508 HydrophobicContact CG2-CE2 3.88Å; V405-Y522 HydrophobicContact CG1-CE2 3.85Å; V405-Y522 HydrophobicContact CG2-CE2 4.3Å
406	R	96.3	Very high	92.3	Very high	47 Å²	47	38.4 Å²	38.4	18%	0.177	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	120.6	179.8	-61	-176.6	63.1	86.9	6.2	109.5	T404 E434 V443 S444 V503 Y504 L505	T404-R406 HydrophobicContact CG2-CG 4.22Å; R406-E434 IonicContact CZ-OE1 2.71Å; R406-E434 IonicContact CZ-OE2 3.62Å; R406-E434 IonicContact NH1-OE2 2.88Å; R406-E434 PolarHBondContact NH1-OE2 2.99Å; R406-E434 IonicContact NH2-OE1 2.67Å; R406-E434 PolarHBondContact NH2-OE1 2.98Å; R406-E434 IonicContact NH2-OE2 3.15Å; R406-E434 PolarHBondContact NH2-OE2 3.31Å; R406-V443 WeakPolarHBondContact O-CA 3.37Å; R406-S444 PolarHBondContact N-O 3.17Å; R406-S444 PolarHBondContact O-N 3.49Å; R406-S444 VanDerWaalsContact O-N 3.08Å; R406-V503 HydrophobicContact CB-CG1 3.92Å; R406-Y504 CarbonylContact C-O 3.58Å; R406-Y504 WeakPolarHBondContact CA-O 3.37Å; R406-L505 HydrophobicContact CB-CD2 4.39Å; R406-L505 HydrophobicContact CG-CD2 3.81Å
407	V	96.6	Very high	92.5	Very high	12 Å²	12	35.7 Å²	35.7	7%	0.073	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	97.7	-175	-174	0	0	0	0	110.2	V405 L416 V443 Y504 L506 V524	V405-V407 HydrophobicContact CG1-CG2 4.01Å; V407-L416 HydrophobicContact CG1-CD1 3.85Å; V407-V443 HydrophobicContact CG1-CG2 4.25Å; V407-V443 HydrophobicContact CG2-CG1 4.22Å; V407-V443 HydrophobicContact CG2-CG2 4.27Å; V407-Y504 PolarHBondContact N-O 3.47Å; V407-Y504 PolarHBondContact O-N 3.21Å; V407-L506 HydrophobicContact CG2-CD1 4.41Å; V407-V524 HydrophobicContact CG1-CG2 4.42Å; V407-V524 HydrophobicContact CG2-CB 4.49Å; V407-V524 HydrophobicContact CG2-CG1 4.29Å; V407-V524 HydrophobicContact CG2-CG2 4.09Å
408	P	96.7	Very high	92.7	Very high	14 Å²	14	35.8 Å²	35.8	9%	0.091	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	147.6	178.8	-21	32.9	0	0	0	113.5	S438 A442 G502 V503	P408-S438 WeakPolarHBondContact CG-OG 3.35Å; P408-A442 VanDerWaalsContact CD-O 3.26Å; P408-A442 WeakPolarHBondContact CD-O 3.46Å; P408-G502 WeakPolarHBondContact CA-O 3.38Å; P408-V503 HydrophobicContact CB-CG2 4.31Å; P408-V503 HydrophobicContact CG-CG1 4.46Å; P408-V503 HydrophobicContact CG-CG2 4.34Å
409	T	95.8	Very high	93.5	Very high	11 Å²	11	36.8 Å²	36.8	7%	0.067	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-66.2	131.3	172.8	53.9	0	0	0	0	111.5	F433 Y498 G502 Y504	T409-F433 HydrophobicContact CG2-CE2 3.74Å; T409-F433 HydrophobicContact CG2-CZ 4.09Å; T409-Y498 HydrophobicContact CG2-CD1 4.12Å; T409-Y498 HydrophobicContact CG2-CD2 3.98Å; T409-Y498 HydrophobicContact CG2-CE1 4.16Å; T409-Y498 HydrophobicContact CG2-CE2 4.04Å; T409-Y498 HydrophobicContact CG2-CG 4.01Å; T409-G502 PolarHBondContact N-O 2.61Å; T409-G502 PolarHBondContact OG1-N 2.77Å; T409-G502 PolarHBondContact OG1-O 3.06Å; T409-Y504 HydrophobicContact CG2-CD2 4.34Å; T409-Y504 HydrophobicContact CG2-CE2 4.04Å
410	H	94.3	Very high	94.2	Very high	46 Å²	46	31.6 Å²	31.6	21%	0.213	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-88	140.1	176.9	-170.7	-96.1	0	0	0	111.5	E412 G413 Y498 Y526	H410-E412 IonicContact CE1-OE2 2.8Å; H410-E412 PolarHBondContact ND1-N 3.09Å; H410-E412 PolarHBondContact O-N 3.39Å; H410-G413 PolarHBondContact O-N 3.37Å; H410-Y498 PolarHBondContact N-OH 3.31Å; H410-Y526 HydrophobicContact CB-CD1 3.74Å; H410-Y526 HydrophobicContact CB-CD2 4.31Å; H410-Y526 HydrophobicContact CB-CE1 3.71Å; H410-Y526 HydrophobicContact CB-CE2 4.31Å; H410-Y526 HydrophobicContact CB-CG 4.06Å; H410-Y526 AromaticContact CD2-CE1 3.83Å; H410-Y526 AromaticContact CD2-CZ 3.95Å; H410-Y526 AromaticContact CE1-CZ 3.61Å; H410-Y526 PolarHBondContact CE1-OH 2.88Å; H410-Y526 AromaticContact CG-CE1 3.53Å; H410-Y526 AromaticContact CG-CZ 3.51Å; H410-Y526 AromaticContact ND1-CE1 3.83Å; H410-Y526 AromaticContact ND1-CE2 3.56Å; H410-Y526 AromaticContact ND1-CZ 3.27Å; H410-Y526 VanDerWaalsContact ND1-CZ 3.27Å; H410-Y526 PolarHBondContact ND1-OH 2.84Å; H410-Y526 PolarHBondContact NE2-OH 3.38Å
411	E	91.3	Very high	95.2	Very high	145 Å²	145	30.5 Å²	30.5	68%	0.678	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-26.5	-174.8	-62.2	-168.8	154.9	0	0	114.1	R501	E411-R501 IonicContact OE1-CZ 2.98Å; E411-R501 VanDerWaalsContact OE1-CZ 3.22Å; E411-R501 IonicContact OE1-NH1 2.78Å; E411-R501 PolarHBondContact OE1-NH1 3.11Å; E411-R501 IonicContact OE1-NH2 2.73Å; E411-R501 PolarHBondContact OE1-NH2 2.89Å
412	E	93.1	Very high	95.9	Very high	100 Å²	100	28.4 Å²	28.4	47%	0.467	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	4.5	173.7	-54.7	-166.9	125.1	0	0	114.1	H410 R528	H410-E412 IonicContact CE1-OE2 2.8Å; H410-E412 PolarHBondContact ND1-N 3.09Å; H410-E412 PolarHBondContact O-N 3.39Å; E412-R528 VanDerWaalsContact O-CG 3.28Å; E412-R528 WeakPolarHBondContact O-CG 3.21Å; E412-R528 IonicContact OE1-CZ 2.71Å; E412-R528 IonicContact OE1-NH1 3.53Å; E412-R528 IonicContact OE1-NH2 2.62Å; E412-R528 PolarHBondContact OE1-NH2 3.28Å; E412-R528 IonicContact OE2-CZ 3.89Å; E412-R528 IonicContact OE2-NE 3.19Å; E412-R528 IonicContact OE2-NH2 2.8Å; E412-R528 PolarHBondContact OE2-NH2 3.11Å
413	G	94.1	Very high	96.2	Very high	13 Å²	13	30.7 Å²	30.7	13%	0.134	15%	0.151	C	C	.	.			trans	-101.1	151.1	-176.4	0	0	0	0	0	113.6	H410 Y498 T527	H410-G413 PolarHBondContact O-N 3.37Å; G413-Y498 VanDerWaalsContact C-CE2 3.41Å; G413-Y498 WeakPolarHBondContact O-CD2 3.34Å; G413-Y498 VanDerWaalsContact O-CE2 3.27Å; G413-Y498 WeakPolarHBondContact O-CE2 3.16Å; G413-T527 CarbonylContact C-O 3.58Å; G413-T527 WeakPolarHBondContact CA-O 3.28Å
414	S	95.5	Very high	96	Very high	45 Å²	45	36.1 Å²	36.1	32%	0.315	18%	0.18	S	C	.	.	S	Bend	trans	-120.5	-18.6	173.7	-53.4	0	0	0	0	112.9	Q497 Y498 T527 R528	S414-Q497 WeakPolarHBondContact O-CG 3.28Å; S414-Y498 PolarHBondContact O-N 3.46Å; S414-T527 PolarHBondContact N-O 2.67Å; S414-R528 WeakPolarHBondContact CB-OXT 3.4Å; S414-R528 PolarHBondContact OG-OXT 3.44Å
415	Y	97.3	Very high	95.9	Very high	83 Å²	83	40.1 Å²	40.1	33%	0.325	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	145.2	-177.7	-69.2	-94.3	0	0	0	111.5	F417 H496 Q497 Y526 T527	Y415-F417 HydrophobicContact CG-CE2 4.47Å; Y415-H496 WeakPolarHBondContact CA-O 3.36Å; Y415-Q497 VanDerWaalsContact CD1-CA 3.42Å; Y415-Q497 HydrophobicContact CD1-CB 3.85Å; Y415-Q497 HydrophobicContact CD1-CG 4.27Å; Y415-Q497 HydrophobicContact CE1-CB 3.44Å; Y415-Q497 VanDerWaalsContact CE1-CB 3.44Å; Y415-Q497 HydrophobicContact CE1-CG 3.74Å; Y415-Q497 HydrophobicContact CE2-CG 4.32Å; Y415-Q497 PolarHBondContact OH-OE1 2.82Å; Y415-Q497 VanDerWaalsContact OH-OE1 3.06Å; Y415-Y526 WeakPolarHBondContact O-CA 3.12Å; Y415-Y526 WeakPolarHBondContact O-CB 3.49Å; Y415-T527 PolarHBondContact N-O 3.01Å; Y415-T527 PolarHBondContact O-N 2.91Å; Y415-T527 VanDerWaalsContact O-N 3.15Å
416	L	98.1	Very high	95.7	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	140.5	160.1	-177.9	63.8	0	0	0	109.4	V407 W418 S495 H496 Y498 Y504 L506 V524	V407-L416 HydrophobicContact CG1-CD1 3.85Å; L416-W418 HydrophobicContact CD2-CE3 4.12Å; L416-W418 HydrophobicContact CD2-CZ3 4.43Å; L416-W418 HydrophobicContact CG-CE3 4.09Å; L416-W418 HydrophobicContact CG-CZ3 4.48Å; L416-S495 CarbonylContact O-C 3.45Å; L416-S495 WeakPolarHBondContact O-CA 3.11Å; L416-S495 WeakPolarHBondContact O-CB 3.28Å; L416-H496 PolarHBondContact N-O 3.19Å; L416-H496 PolarHBondContact O-N 3.17Å; L416-Y498 HydrophobicContact CB-CE1 4.04Å; L416-Y504 HydrophobicContact CB-CD2 4.27Å; L416-Y504 HydrophobicContact CB-CE1 4.34Å; L416-Y504 HydrophobicContact CB-CE2 3.97Å; L416-Y504 HydrophobicContact CD2-CD1 3.68Å; L416-Y504 HydrophobicContact CD2-CD2 3.77Å; L416-Y504 HydrophobicContact CD2-CE1 4.18Å; L416-Y504 HydrophobicContact CD2-CE2 4.28Å; L416-Y504 HydrophobicContact CD2-CG 3.43Å; L416-Y504 VanDerWaalsContact CD2-CG 3.43Å; L416-L506 HydrophobicContact CD2-CD1 4.06Å; L416-V524 HydrophobicContact CD1-CB 4.34Å
417	F	98.4	Very high	95.8	Very high	43 Å²	43	38.9 Å²	38.9	19%	0.189	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	144.1	166.2	-76	-104.9	0	0	0	110.2	W375 Y415 G494 V524 Y525 T527	W375-F417 HydrophobicContact CH2-CD1 4.02Å; W375-F417 AromaticContact CH2-CE1 3.95Å; W375-F417 HydrophobicContact CH2-CE1 3.95Å; W375-F417 HydrophobicContact CZ2-CD1 4.4Å; W375-F417 HydrophobicContact CZ2-CE1 4.5Å; Y415-F417 HydrophobicContact CG-CE2 4.47Å; F417-G494 WeakPolarHBondContact CA-O 3.42Å; F417-V524 WeakPolarHBondContact O-CA 3.13Å; F417-Y525 HydrophobicContact CB-CD1 4.26Å; F417-Y525 HydrophobicContact CB-CD2 3.93Å; F417-Y525 HydrophobicContact CB-CE1 3.89Å; F417-Y525 HydrophobicContact CB-CE2 3.54Å; F417-Y525 HydrophobicContact CB-CG 4.27Å; F417-Y525 HydrophobicContact CD1-CE2 4.34Å; F417-Y525 HydrophobicContact CD2-CE2 4.28Å; F417-Y525 HydrophobicContact CG-CD2 4.44Å; F417-Y525 AromaticContact CG-CE2 3.82Å; F417-Y525 HydrophobicContact CG-CE2 3.82Å; F417-Y525 PolarHBondContact N-O 2.75Å; F417-Y525 PolarHBondContact O-N 2.74Å; F417-Y525 VanDerWaalsContact O-N 3.08Å; F417-T527 HydrophobicContact CD2-CG2 3.87Å; F417-T527 HydrophobicContact CE2-CG2 3.73Å
418	W	98.5	Very high	95.7	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.008	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	149.5	174.2	58	88.9	0	0	0	112.1	P372 M374 L416 F429 V431 V480 A493 G494 S495 H496 L506 R523 V524	P372-W418 HydrophobicContact CB-CH2 4.38Å; M374-W418 HydrophobicContact SD-CZ2 3.61Å; M374-W418 PolarHBondContact SD-NE1 2.65Å; M374-W418 VanDerWaalsContact SD-NE1 3.44Å; L416-W418 HydrophobicContact CD2-CE3 4.12Å; L416-W418 HydrophobicContact CD2-CZ3 4.43Å; L416-W418 HydrophobicContact CG-CE3 4.09Å; L416-W418 HydrophobicContact CG-CZ3 4.48Å; W418-F429 AromaticContact CD1-CE1 3.94Å; W418-F429 AromaticContact CD1-CZ 3.64Å; W418-F429 HydrophobicContact CG-CZ 4.2Å; W418-F429 AromaticContact NE1-CE1 3.54Å; W418-F429 AromaticContact NE1-CZ 3.69Å; W418-V431 HydrophobicContact CH2-CG2 4.47Å; W418-V431 HydrophobicContact CZ2-CG2 4.25Å; W418-V480 HydrophobicContact CH2-CG2 4.4Å; W418-V480 HydrophobicContact CZ2-CG2 4.05Å; W418-A493 CarbonylContact O-C 3.59Å; W418-A493 WeakPolarHBondContact O-CA 3.2Å; W418-A493 WeakPolarHBondContact O-CB 3.38Å; W418-G494 PolarHBondContact N-O 3.36Å; W418-G494 PolarHBondContact O-N 3.06Å; W418-S495 VanDerWaalsContact CH2-C 3.45Å; W418-H496 HydrophobicContact CH2-CB 4Å; W418-H496 HydrophobicContact CZ3-CB 4Å; W418-L506 HydrophobicContact CB-CD2 4.01Å; W418-R523 CarbonylContact C-O 3.56Å; W418-R523 WeakPolarHBondContact CA-O 3.31Å; W418-V524 HydrophobicContact CB-CG1 4.17Å
419	E	98.5	Very high	95.8	Very high	24 Å²	24	37.6 Å²	37.6	11%	0.112	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	137.7	169.2	-55.1	-179.1	79.1	0	0	108.4	R377 F383 V491 Y492 A493 Y522 R523	R377-E419 IonicContact CZ-OE1 3.92Å; R377-E419 VanDerWaalsContact CZ-OE1 3.31Å; R377-E419 IonicContact NE-OE1 2.73Å; R377-E419 PolarHBondContact NE-OE1 3.03Å; R377-E419 IonicContact NH2-OE1 3.14Å; R377-E419 PolarHBondContact NH2-OE1 3.08Å; F383-E419 HydrophobicContact CE2-CB 3.77Å; F383-E419 HydrophobicContact CZ-CB 3.86Å; E419-V491 HydrophobicContact CB-CG1 4.29Å; E419-Y492 CarbonylContact C-O 3.56Å; E419-Y492 WeakPolarHBondContact CA-O 3.31Å; E419-A493 HydrophobicContact CG-CB 4.19Å; E419-Y522 CarbonylContact O-C 3.56Å; E419-Y522 VanDerWaalsContact O-CA 3.31Å; E419-Y522 WeakPolarHBondContact O-CA 3.35Å; E419-R523 HydrophobicContact CB-CB 4.37Å; E419-R523 PolarHBondContact N-O 2.66Å; E419-R523 PolarHBondContact O-N 2.91Å; E419-R523 IonicContact OE2-CZ 3.3Å; E419-R523 IonicContact OE2-NH1 2.68Å; E419-R523 PolarHBondContact OE2-NH1 2.92Å
420	F	98.6	Very high	95.8	Very high	1 Å²	1	37.1 Å²	37.1	0%	0.004	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	155	174.8	68.5	-84.7	0	0	0	114.6	I427 F429 R485 C487 V491 Y492 F508 Y521	F420-I427 HydrophobicContact CE2-CG2 4.48Å; F420-F429 HydrophobicContact CD1-CD2 4.11Å; F420-F429 HydrophobicContact CD1-CE1 4.47Å; F420-F429 AromaticContact CD1-CE2 3.98Å; F420-F429 HydrophobicContact CD1-CE2 3.98Å; F420-F429 HydrophobicContact CD1-CG 4.4Å; F420-F429 HydrophobicContact CD1-CZ 4.16Å; F420-F429 HydrophobicContact CE1-CB 4.29Å; F420-F429 AromaticContact CE1-CD1 3.51Å; F420-F429 HydrophobicContact CE1-CD1 3.51Å; F420-F429 AromaticContact CE1-CD2 3.69Å; F420-F429 HydrophobicContact CE1-CD2 3.69Å; F420-F429 AromaticContact CE1-CE1 3.62Å; F420-F429 HydrophobicContact CE1-CE1 3.62Å; F420-F429 AromaticContact CE1-CE2 3.79Å; F420-F429 HydrophobicContact CE1-CE2 3.79Å; F420-F429 AromaticContact CE1-CG 3.53Å; F420-F429 HydrophobicContact CE1-CG 3.53Å; F420-F429 AromaticContact CE1-CZ 3.75Å; F420-F429 HydrophobicContact CE1-CZ 3.75Å; F420-F429 HydrophobicContact CE2-CB 3.92Å; F420-F429 HydrophobicContact CE2-CD2 4.2Å; F420-F429 HydrophobicContact CE2-CG 4Å; F420-F429 HydrophobicContact CZ-CB 3.53Å; F420-F429 AromaticContact CZ-CD1 3.54Å; F420-F429 HydrophobicContact CZ-CD1 3.54Å; F420-F429 AromaticContact CZ-CD2 3.74Å; F420-F429 HydrophobicContact CZ-CD2 3.74Å; F420-F429 HydrophobicContact CZ-CE1 4.16Å; F420-F429 HydrophobicContact CZ-CE2 4.32Å; F420-F429 AromaticContact CZ-CG 3.29Å; F420-F429 HydrophobicContact CZ-CG 3.29Å; F420-R485 HydrophobicContact CE2-CB 4.41Å; F420-R485 HydrophobicContact CZ-CB 4.49Å; F420-R485 HydrophobicContact CZ-CG 4.2Å; F420-C487 HydrophobicContact CD2-CB 3.97Å; F420-C487 HydrophobicContact CE2-CB 3.78Å; F420-V491 WeakPolarHBondContact O-CG1 3.45Å; F420-Y492 HydrophobicContact CE2-CG 4.46Å; F420-Y492 VanDerWaalsContact CZ-CB 3.44Å; F420-Y492 HydrophobicContact CZ-CG 4.12Å; F420-Y492 PolarHBondContact N-O 3.49Å; F420-Y492 PolarHBondContact O-N 3.19Å; F420-F508 HydrophobicContact CB-CE1 3.92Å; F420-F508 HydrophobicContact CB-CZ 4.12Å; F420-F508 HydrophobicContact CD1-CE1 4.4Å; F420-F508 AromaticContact CD2-CE1 3.91Å; F420-F508 HydrophobicContact CD2-CE1 3.91Å; F420-F508 AromaticContact CG-CE1 3.83Å; F420-F508 HydrophobicContact CG-CE1 3.83Å; F420-F508 HydrophobicContact CG-CZ 4.38Å; F420-Y521 CarbonylContact C-O 3.59Å; F420-Y521 WeakPolarHBondContact CA-O 3.25Å
421	A	98.6	Very high	96	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	157.8	176.4	0	0	0	0	0	112	I380 F383 C487 V491 V520 Y521	I380-A421 HydrophobicContact CD1-CB 4Å; I380-A421 HydrophobicContact CG1-CB 3.94Å; F383-A421 HydrophobicContact CD1-CB 3.76Å; F383-A421 HydrophobicContact CE1-CB 3.74Å; A421-C487 CarbonylContact C-O 3.52Å; A421-C487 WeakPolarHBondContact CA-O 3.48Å; A421-C487 WeakPolarHBondContact CB-O 3.26Å; A421-V491 HydrophobicContact CB-CG2 4.36Å; A421-V520 WeakPolarHBondContact O-CA 3.01Å; A421-Y521 PolarHBondContact N-O 3.22Å; A421-Y521 PolarHBondContact O-N 3.01Å
422	T	98.2	Very high	96.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	167.1	177.9	50.7	0	0	0	0	112.6	K384 Y425 I427 C487 H488 K518 S519 V520	K384-T422 VanDerWaalsContact CE-O 3.23Å; K384-T422 WeakPolarHBondContact CE-O 3.15Å; K384-T422 PolarHBondContact NZ-O 2.81Å; T422-Y425 WeakPolarHBondContact CB-O 3.45Å; T422-Y425 PolarHBondContact OG1-O 3.5Å; T422-I427 HydrophobicContact CG2-CB 4.1Å; T422-I427 HydrophobicContact CG2-CG2 3.93Å; T422-C487 PolarHBondContact N-O 2.85Å; T422-C487 PolarHBondContact OG1-SG 3.4Å; T422-H488 WeakPolarHBondContact O-CA 3.44Å; T422-H488 PolarHBondContact OG1-N 3.34Å; T422-K518 HydrophobicContact CG2-CB 4.34Å; T422-S519 VanDerWaalsContact CA-O 3.27Å; T422-S519 WeakPolarHBondContact CA-O 2.89Å; T422-V520 HydrophobicContact CG2-CG2 3.92Å
423	D	94.3	Very high	96.4	Very high	48 Å²	48	26 Å²	26	26%	0.257	13%	0.127	S	C	.	.	S	Bend	trans	-78.9	-51.2	-173.1	-88.4	-31.4	0	0	0	117.4	K384 S519 Y521	K384-D423 IonicContact NZ-OD1 3.36Å; K384-D423 PolarHBondContact NZ-OD1 3.07Å; D423-S519 VanDerWaalsContact OD2-CB 3.22Å; D423-S519 WeakPolarHBondContact OD2-CB 3.47Å; D423-S519 PolarHBondContact OD2-OG 3.03Å; D423-Y521 WeakPolarHBondContact OD1-CE2 3.32Å; D423-Y521 PolarHBondContact OD1-OH 3.37Å; D423-Y521 WeakPolarHBondContact OD2-CE2 3.36Å; D423-Y521 PolarHBondContact OD2-OH 3.09Å
424	N	89.7	Confident	96.4	Very high	115 Å²	115	26 Å²	26	62%	0.615	12%	0.123	S	C	*	.	S	Bend	trans	-138.5	-3.7	-169.3	-48.8	133.5	0	0	0	114.6
425	Y	93.1	Very high	96.3	Very high	91 Å²	91	27.1 Å²	27.1	36%	0.357	12%	0.121	S	C	.	.	S	Bend	trans	-153.5	155.6	-168.7	-56.4	-65.9	0	0	0	109.9	T422 H488 R516	T422-Y425 WeakPolarHBondContact CB-O 3.45Å; T422-Y425 PolarHBondContact OG1-O 3.5Å; Y425-H488 VanDerWaalsContact C-ND1 3.27Å; Y425-R516 HydrophobicContact CD2-CB 4.04Å; Y425-R516 HydrophobicContact CD2-CG 4.17Å; Y425-R516 HydrophobicContact CE2-CB 4.07Å; Y425-R516 HydrophobicContact CE2-CG 3.81Å
426	D	94	Very high	95.9	Very high	21 Å²	21	25.3 Å²	25.3	11%	0.112	12%	0.118	C	C	.	.			trans	-61.7	165.2	172.4	65.5	-55.1	0	0	0	113.1	R484 R485 H488 Y512 K518	D426-R484 IonicContact OD1-NH2 2.97Å; D426-R484 PolarHBondContact OD1-NH2 2.9Å; D426-R484 IonicContact OD2-CZ 3.86Å; D426-R484 IonicContact OD2-NE 3.72Å; D426-R484 PolarHBondContact OD2-NE 2.87Å; D426-R484 IonicContact OD2-NH2 2.67Å; D426-R484 PolarHBondContact OD2-NH2 2.88Å; D426-R485 VanDerWaalsContact CA-O 3.28Å; D426-R485 WeakPolarHBondContact CA-O 3.29Å; D426-R485 VanDerWaalsContact CB-O 3.29Å; D426-R485 WeakPolarHBondContact CB-O 3.4Å; D426-H488 PolarHBondContact N-ND1 2.86Å; D426-H488 VanDerWaalsContact N-ND1 3.2Å; D426-Y512 VanDerWaalsContact C-OH 3.29Å; D426-Y512 PolarHBondContact O-OH 2.96Å; D426-Y512 VanDerWaalsContact O-OH 3.14Å; D426-Y512 PolarHBondContact OD2-OH 3.02Å; D426-K518 WeakPolarHBondContact O-CD 2.96Å; D426-K518 WeakPolarHBondContact O-CE 3.14Å
427	I	96.4	Very high	95.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	153	168.5	-158.8	170.5	0	0	0	109.8	V397 F420 T422 R484 R485 F508 D509 Y512 K518 V520	V397-I427 HydrophobicContact CB-CD1 4.18Å; V397-I427 HydrophobicContact CG1-CD1 4.42Å; V397-I427 HydrophobicContact CG2-CD1 3.98Å; F420-I427 HydrophobicContact CE2-CG2 4.48Å; T422-I427 HydrophobicContact CG2-CB 4.1Å; T422-I427 HydrophobicContact CG2-CG2 3.93Å; I427-R484 CarbonylContact O-C 3.6Å; I427-R484 WeakPolarHBondContact O-CA 3.29Å; I427-R485 PolarHBondContact N-O 3.32Å; I427-R485 PolarHBondContact O-N 3.18Å; I427-F508 HydrophobicContact CD1-CB 4.04Å; I427-F508 HydrophobicContact CG2-CD1 4.48Å; I427-D509 WeakPolarHBondContact CG1-O 3.42Å; I427-Y512 WeakPolarHBondContact CA-OH 3.21Å; I427-Y512 PolarHBondContact N-OH 3.42Å; I427-K518 HydrophobicContact CB-CG 4.47Å; I427-K518 HydrophobicContact CD1-CB 4.04Å; I427-K518 HydrophobicContact CD1-CG 3.99Å; I427-K518 HydrophobicContact CG1-CG 4.21Å; I427-V520 HydrophobicContact CD1-CG2 3.52Å
428	G	95.9	Very high	94.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	135.3	165.9	0	0	0	0	0	110.3	D509	G428-D509 WeakPolarHBondContact CA-O 3.5Å; G428-D509 PolarHBondContact N-O 2.81Å; G428-D509 PolarHBondContact O-N 2.67Å
429	F	98.2	Very high	93.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	127.3	174.3	179.8	-95.6	0	0	0	111.3	M374 W418 F420 V431 Y483 R485 L506 F508	M374-F429 HydrophobicContact CE-CD1 4.48Å; M374-F429 HydrophobicContact CE-CE1 4.44Å; W418-F429 AromaticContact CD1-CE1 3.94Å; W418-F429 AromaticContact CD1-CZ 3.64Å; W418-F429 HydrophobicContact CG-CZ 4.2Å; W418-F429 AromaticContact NE1-CE1 3.54Å; W418-F429 AromaticContact NE1-CZ 3.69Å; F420-F429 HydrophobicContact CD1-CD2 4.11Å; F420-F429 HydrophobicContact CD1-CE1 4.47Å; F420-F429 AromaticContact CD1-CE2 3.98Å; F420-F429 HydrophobicContact CD1-CE2 3.98Å; F420-F429 HydrophobicContact CD1-CG 4.4Å; F420-F429 HydrophobicContact CD1-CZ 4.16Å; F420-F429 HydrophobicContact CE1-CB 4.29Å; F420-F429 AromaticContact CE1-CD1 3.51Å; F420-F429 HydrophobicContact CE1-CD1 3.51Å; F420-F429 AromaticContact CE1-CD2 3.69Å; F420-F429 HydrophobicContact CE1-CD2 3.69Å; F420-F429 AromaticContact CE1-CE1 3.62Å; F420-F429 HydrophobicContact CE1-CE1 3.62Å; F420-F429 AromaticContact CE1-CE2 3.79Å; F420-F429 HydrophobicContact CE1-CE2 3.79Å; F420-F429 AromaticContact CE1-CG 3.53Å; F420-F429 HydrophobicContact CE1-CG 3.53Å; F420-F429 AromaticContact CE1-CZ 3.75Å; F420-F429 HydrophobicContact CE1-CZ 3.75Å; F420-F429 HydrophobicContact CE2-CB 3.92Å; F420-F429 HydrophobicContact CE2-CD2 4.2Å; F420-F429 HydrophobicContact CE2-CG 4Å; F420-F429 HydrophobicContact CZ-CB 3.53Å; F420-F429 AromaticContact CZ-CD1 3.54Å; F420-F429 HydrophobicContact CZ-CD1 3.54Å; F420-F429 AromaticContact CZ-CD2 3.74Å; F420-F429 HydrophobicContact CZ-CD2 3.74Å; F420-F429 HydrophobicContact CZ-CE1 4.16Å; F420-F429 HydrophobicContact CZ-CE2 4.32Å; F420-F429 AromaticContact CZ-CG 3.29Å; F420-F429 HydrophobicContact CZ-CG 3.29Å; F429-V431 HydrophobicContact CE1-CG2 3.62Å; F429-V431 HydrophobicContact CE2-CG2 4.49Å; F429-V431 HydrophobicContact CZ-CG2 3.53Å; F429-Y483 PolarHBondContact N-O 3.2Å; F429-Y483 PolarHBondContact O-N 3.22Å; F429-R485 HydrophobicContact CB-CG 3.95Å; F429-L506 HydrophobicContact CE2-CB 4.25Å; F429-L506 HydrophobicContact CE2-CD2 4.22Å; F429-L506 HydrophobicContact CE2-CG 4.12Å; F429-L506 HydrophobicContact CZ-CD2 4.33Å; F429-L506 HydrophobicContact CZ-CG 4.15Å; F429-F508 AromaticContact CD2-CD1 3.82Å; F429-F508 HydrophobicContact CD2-CD1 3.82Å; F429-F508 AromaticContact CD2-CE1 3.52Å; F429-F508 HydrophobicContact CD2-CE1 3.52Å; F429-F508 HydrophobicContact CD2-CZ 4.13Å; F429-F508 HydrophobicContact CE2-CD1 4.43Å; F429-F508 AromaticContact CE2-CE1 3.81Å; F429-F508 HydrophobicContact CE2-CE1 3.81Å; F429-F508 AromaticContact CE2-CZ 3.95Å; F429-F508 HydrophobicContact CE2-CZ 3.95Å
430	G	96.4	Very high	92.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	171.5	169.5	0	0	0	0	0	111.8	V480 K507	G430-V480 CarbonylContact C-O 3.43Å; G430-V480 WeakPolarHBondContact CA-O 3.13Å; G430-K507 PolarHBondContact N-O 3.42Å; G430-K507 PolarHBondContact O-N 3.26Å
431	V	97.6	Very high	92	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	125.6	-176.5	-176.1	0	0	0	0	108.8	W418 F429 I479 V480 Y504 L505 L506	W418-V431 HydrophobicContact CH2-CG2 4.47Å; W418-V431 HydrophobicContact CZ2-CG2 4.25Å; F429-V431 HydrophobicContact CE1-CG2 3.62Å; F429-V431 HydrophobicContact CE2-CG2 4.49Å; F429-V431 HydrophobicContact CZ-CG2 3.53Å; V431-I479 HydrophobicContact CB-CB 4.28Å; V431-I479 HydrophobicContact CG1-CB 4.16Å; V431-I479 WeakPolarHBondContact O-CA 3.23Å; V431-I479 WeakPolarHBondContact O-CB 3.43Å; V431-I479 PolarHBondContact O-N 3.39Å; V431-V480 HydrophobicContact CB-CB 3.94Å; V431-V480 HydrophobicContact CB-CG2 4.05Å; V431-V480 HydrophobicContact CG2-CB 4.05Å; V431-V480 HydrophobicContact CG2-CG2 4.04Å; V431-V480 PolarHBondContact N-O 3.41Å; V431-V480 PolarHBondContact O-N 3.01Å; V431-Y504 HydrophobicContact CG1-CD1 3.79Å; V431-L505 WeakPolarHBondContact CA-O 3.38Å; V431-L506 HydrophobicContact CG1-CD1 4.26Å; V431-L506 HydrophobicContact CG2-CG 4.29Å
432	Y	96.3	Very high	91.4	Very high	57 Å²	57	45.8 Å²	45.8	22%	0.224	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	163.5	169.7	-60.7	-91.9	0	0	0	110.3	D477 E478 V482 Y504 L505 K507	Y432-D477 CarbonylContact C-O 3.4Å; Y432-D477 VanDerWaalsContact CA-O 3.26Å; Y432-D477 WeakPolarHBondContact CA-O 3.49Å; Y432-E478 HydrophobicContact CD1-CB 3.92Å; Y432-E478 HydrophobicContact CD1-CG 4.19Å; Y432-E478 HydrophobicContact CE1-CB 3.64Å; Y432-E478 HydrophobicContact CE1-CG 3.63Å; Y432-E478 PolarHBondContact OH-OE2 3.41Å; Y432-V482 HydrophobicContact CE2-CG2 3.97Å; Y432-Y504 CarbonylContact O-C 3.46Å; Y432-Y504 WeakPolarHBondContact O-CA 3.17Å; Y432-L505 PolarHBondContact N-O 3.05Å; Y432-L505 PolarHBondContact O-N 3.19Å; Y432-K507 HydrophobicContact CD2-CG 3.97Å; Y432-K507 HydrophobicContact CE2-CG 4.18Å
433	F	96.3	Very high	91	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	123.7	171.8	-171.7	-91.5	0	0	0	110	T409 W435 L476 D477 I479 P499 Y504	T409-F433 HydrophobicContact CG2-CE2 3.74Å; T409-F433 HydrophobicContact CG2-CZ 4.09Å; F433-W435 HydrophobicContact CD1-CD2 4.04Å; F433-W435 AromaticContact CD1-CE2 3.75Å; F433-W435 HydrophobicContact CD1-CG 4.3Å; F433-W435 HydrophobicContact CD1-CZ2 4.08Å; F433-W435 AromaticContact CD1-NE1 3.9Å; F433-W435 AromaticContact CE1-CD2 3.75Å; F433-W435 HydrophobicContact CE1-CD2 3.75Å; F433-W435 AromaticContact CE1-CE2 3.81Å; F433-W435 AromaticContact CE1-CE3 3.9Å; F433-W435 HydrophobicContact CE1-CE3 3.9Å; F433-W435 HydrophobicContact CE1-CG 4.27Å; F433-W435 HydrophobicContact CE1-CH2 4.16Å; F433-W435 HydrophobicContact CE1-CZ2 4.01Å; F433-W435 HydrophobicContact CE1-CZ3 4.12Å; F433-L476 WeakPolarHBondContact O-CA 3.34Å; F433-D477 PolarHBondContact N-O 2.99Å; F433-D477 PolarHBondContact O-N 3.44Å; F433-I479 HydrophobicContact CB-CD1 3.87Å; F433-I479 HydrophobicContact CB-CG1 3.83Å; F433-P499 HydrophobicContact CD1-CG 3.7Å; F433-P499 HydrophobicContact CD2-CG 3.91Å; F433-P499 HydrophobicContact CE1-CG 3.67Å; F433-P499 HydrophobicContact CE2-CG 3.87Å; F433-P499 HydrophobicContact CG-CG 3.82Å; F433-P499 HydrophobicContact CZ-CG 3.74Å; F433-Y504 HydrophobicContact CD2-CD1 4.1Å; F433-Y504 AromaticContact CD2-CD2 3.83Å; F433-Y504 HydrophobicContact CD2-CD2 3.83Å; F433-Y504 HydrophobicContact CD2-CE1 4.04Å; F433-Y504 AromaticContact CD2-CE2 3.73Å; F433-Y504 HydrophobicContact CD2-CE2 3.73Å; F433-Y504 HydrophobicContact CD2-CG 4.02Å; F433-Y504 AromaticContact CD2-CZ 3.85Å; F433-Y504 AromaticContact CE2-CD2 3.92Å; F433-Y504 HydrophobicContact CE2-CD2 3.92Å; F433-Y504 AromaticContact CE2-CE2 3.65Å; F433-Y504 HydrophobicContact CE2-CE2 3.65Å
434	E	94.5	Very high	90.8	Very high	14 Å²	14	49 Å²	49	7%	0.065	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	123.2	-179.1	-171.2	-164.7	105.3	0	0	109.9	R406 T436 P474 L475 L476 G502 V503 L505	R406-E434 IonicContact CZ-OE1 2.71Å; R406-E434 IonicContact CZ-OE2 3.62Å; R406-E434 IonicContact NH1-OE2 2.88Å; R406-E434 PolarHBondContact NH1-OE2 2.99Å; R406-E434 IonicContact NH2-OE1 2.67Å; R406-E434 PolarHBondContact NH2-OE1 2.98Å; R406-E434 IonicContact NH2-OE2 3.15Å; R406-E434 PolarHBondContact NH2-OE2 3.31Å; E434-T436 WeakPolarHBondContact CG-OG1 3.49Å; E434-T436 PolarHBondContact O-N 3.35Å; E434-T436 WeakPolarHBondContact OE1-CB 3.48Å; E434-T436 PolarHBondContact OE1-OG1 2.96Å; E434-P474 HydrophobicContact CG-CB 3.8Å; E434-P474 HydrophobicContact CG-CG 3.77Å; E434-L475 WeakPolarHBondContact CA-O 3.31Å; E434-L476 HydrophobicContact CB-CD2 3.67Å; E434-L476 HydrophobicContact CG-CD2 3.9Å; E434-G502 CarbonylContact O-C 3.49Å; E434-G502 WeakPolarHBondContact O-CA 3.43Å; E434-V503 HydrophobicContact CB-CB 4.33Å; E434-V503 WeakPolarHBondContact CB-O 3.2Å; E434-V503 PolarHBondContact N-O 3.16Å; E434-V503 PolarHBondContact O-N 3.42Å; E434-L505 HydrophobicContact CB-CD1 4.3Å; E434-L505 HydrophobicContact CB-CG 4.37Å
435	W	93.2	Very high	90.8	Very high	69 Å²	69	46.4 Å²	46.4	26%	0.261	26%	0.262	S	S	.	.			trans	-80.8	60.6	-177.3	-66.7	92.2	0	0	0	112.6	P367 F433 L475 D477 P499	P367-W435 HydrophobicContact CB-CH2 3.47Å; P367-W435 VanDerWaalsContact CB-CH2 3.47Å; P367-W435 HydrophobicContact CB-CZ2 3.82Å; P367-W435 HydrophobicContact CB-CZ3 4.38Å; P367-W435 HydrophobicContact CG-CH2 3.42Å; P367-W435 VanDerWaalsContact CG-CH2 3.42Å; P367-W435 HydrophobicContact CG-CZ2 3.3Å; P367-W435 HydrophobicContact CG-CZ3 4.28Å; F433-W435 HydrophobicContact CD1-CD2 4.04Å; F433-W435 AromaticContact CD1-CE2 3.75Å; F433-W435 HydrophobicContact CD1-CG 4.3Å; F433-W435 HydrophobicContact CD1-CZ2 4.08Å; F433-W435 AromaticContact CD1-NE1 3.9Å; F433-W435 AromaticContact CE1-CD2 3.75Å; F433-W435 HydrophobicContact CE1-CD2 3.75Å; F433-W435 AromaticContact CE1-CE2 3.81Å; F433-W435 AromaticContact CE1-CE3 3.9Å; F433-W435 HydrophobicContact CE1-CE3 3.9Å; F433-W435 HydrophobicContact CE1-CG 4.27Å; F433-W435 HydrophobicContact CE1-CH2 4.16Å; F433-W435 HydrophobicContact CE1-CZ2 4.01Å; F433-W435 HydrophobicContact CE1-CZ3 4.12Å; W435-L475 HydrophobicContact CB-CB 4.14Å; W435-L475 HydrophobicContact CG-CB 4.22Å; W435-L475 HydrophobicContact CG-CD2 4.44Å; W435-L475 PolarHBondContact N-O 2.74Å; W435-D477 PolarHBondContact NE1-OD2 3.44Å; W435-P499 HydrophobicContact CH2-CB 3.9Å; W435-P499 HydrophobicContact CH2-CG 4.13Å; W435-P499 HydrophobicContact CZ2-CB 4.01Å; W435-P499 HydrophobicContact CZ2-CG 4.08Å
436	T	89.3	Confident	90.2	Very high	44 Å²	44	46.5 Å²	46.5	27%	0.27	27%	0.266	S	S	.	.			trans	-118.2	130.5	-179.7	-56.4	0	0	0	0	112	E434 S438 P474 G502	E434-T436 WeakPolarHBondContact CG-OG1 3.49Å; E434-T436 PolarHBondContact O-N 3.35Å; E434-T436 WeakPolarHBondContact OE1-CB 3.48Å; E434-T436 PolarHBondContact OE1-OG1 2.96Å; T436-S438 VanDerWaalsContact C-N 3.35Å; T436-S438 PolarHBondContact O-N 2.76Å; T436-P474 WeakPolarHBondContact OG1-CB 3.44Å; T436-G502 WeakPolarHBondContact O-CA 3.46Å
437	D	83.9	Confident	89.4	Confident	124 Å²	124	49.8 Å²	49.8	66%	0.663	29%	0.286	S	S	*	.			trans	-69.5	88.4	167	-86	-29.3	0	0	0	110.9	R501	D437-R501 WeakPolarHBondContact OD1-CD 3.4Å; D437-R501 WeakPolarHBondContact OD1-CG 3.34Å; D437-R501 IonicContact OD1-NE 2.72Å
438	S	82.4	Confident	88.2	Confident	30 Å²	30	50.3 Å²	50.3	21%	0.21	29%	0.29	C	S	.	.			trans	-62.1	131.7	175.6	-177.6	0	0	0	0	111.4	P408 T436 N440	P408-S438 WeakPolarHBondContact CG-OG 3.35Å; T436-S438 VanDerWaalsContact C-N 3.35Å; T436-S438 PolarHBondContact O-N 2.76Å; S438-N440 WeakPolarHBondContact CB-O 3.5Å; S438-N440 PolarHBondContact O-N 3.02Å; S438-N440 PolarHBondContact OG-O 3.36Å
439	P	78.3	Confident	86.3	Confident	128 Å²	128	58.1 Å²	58.1	83%	0.831	33%	0.326	S	S	*	.	S	Bend	trans	-71.7	-9.7	-178.3	30.3	-36.8	0	0	0	113.7
440	N	81.6	Confident	83.8	Confident	92 Å²	92	59.8 Å²	59.8	49%	0.492	34%	0.338	S	S	.	.	S	Bend	trans	-149.5	172.2	172.9	68.1	51.7	0	0	0	110.9	S438 A442	S438-N440 WeakPolarHBondContact CB-O 3.5Å; S438-N440 PolarHBondContact O-N 3.02Å; S438-N440 PolarHBondContact OG-O 3.36Å; N440-A442 VanDerWaalsContact OD1-CB 3.24Å; N440-A442 WeakPolarHBondContact OD1-CB 3.2Å; N440-A442 PolarHBondContact OD1-N 2.87Å
441	T	83.9	Confident	81.2	Confident	74 Å²	74	62.6 Å²	62.6	45%	0.454	36%	0.358	S	S	.	.			trans	-104.9	29.7	176.3	64.1	0	0	0	0	112.7
442	A	85.6	Confident	78.6	Confident	55 Å²	55	66.6 Å²	66.6	46%	0.455	38%	0.379	S	S	.	.			trans	-81.7	138.4	176.9	0	0	0	0	0	110.5	P408 N440	P408-A442 VanDerWaalsContact CD-O 3.26Å; P408-A442 WeakPolarHBondContact CD-O 3.46Å; N440-A442 VanDerWaalsContact OD1-CB 3.24Å; N440-A442 WeakPolarHBondContact OD1-CB 3.2Å; N440-A442 PolarHBondContact OD1-N 2.87Å
443	V	90.6	Very high	75.8	Confident	66 Å²	66	68.2 Å²	68.2	40%	0.4	39%	0.392	S	S	.	.			trans	-74.7	139.8	169.1	178.6	0	0	0	0	108.6	V405 R406 V407 V524	V405-V443 HydrophobicContact CG1-CG1 3.54Å; R406-V443 WeakPolarHBondContact O-CA 3.37Å; V407-V443 HydrophobicContact CG1-CG2 4.25Å; V407-V443 HydrophobicContact CG2-CG1 4.22Å; V407-V443 HydrophobicContact CG2-CG2 4.27Å; V443-V524 HydrophobicContact CG2-CG2 4.15Å
444	S	89.4	Confident	72.8	Confident	49 Å²	49	73 Å²	73	34%	0.343	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	149.1	175.2	52.6	0	0	0	0	111.4	R406	R406-S444 PolarHBondContact N-O 3.17Å; R406-S444 PolarHBondContact O-N 3.49Å; R406-S444 VanDerWaalsContact O-N 3.08Å
445	V	89.6	Confident	70.2	Confident	61 Å²	61	78.1 Å²	78.1	37%	0.37	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	125.9	-175.6	-174.4	0	0	0	0	108.8	I395 V403 V405	I395-V445 HydrophobicContact CG2-CG1 4.21Å; I395-V445 HydrophobicContact CG2-CG2 4.48Å; V403-V445 HydrophobicContact CG1-CG1 3.4Å; V403-V445 VanDerWaalsContact CG1-CG1 3.4Å; V405-V445 HydrophobicContact CG2-CG1 4.44Å; V405-V445 HydrophobicContact CG2-CG2 4.26Å
446	H	81.4	Confident	67.6	Low	93 Å²	93	83.1 Å²	83.1	43%	0.431	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	135.8	178.5	-64.5	62.8	0	0	0	108.7	V403 T404	V403-H446 CarbonylContact C-O 3.46Å; V403-H446 WeakPolarHBondContact CA-O 3.19Å; T404-H446 PolarHBondContact N-O 2.92Å; T404-H446 PolarHBondContact O-N 2.92Å
447	V	77.7	Confident	65.2	Low	89 Å²	89	89.8 Å²	89.8	54%	0.539	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	122.2	-179.3	-175.8	0	0	0	0	108	E401 V403	E401-V447 HydrophobicContact CG-CG1 4.46Å; V403-V447 HydrophobicContact CG2-CB 4.36Å; V403-V447 HydrophobicContact CG2-CG1 4.09Å; V403-V447 HydrophobicContact CG2-CG2 4.01Å
448	S	69.9	Low	63	Low	12 Å²	12	85.8 Å²	85.8	8%	0.084	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	135.5	176	-60.4	0	0	0	0	109.2	E401 V402 S450 D453	E401-S448 WeakPolarHBondContact CA-O 3.45Å; V402-S448 PolarHBondContact N-O 3.13Å; V402-S448 PolarHBondContact O-N 3.14Å; S448-S450 WeakPolarHBondContact CB-O 3.1Å; S448-S450 PolarHBondContact O-N 2.9Å; S448-D453 PolarHBondContact OG-OD2 3.31Å
449	E	55.7	Low	61.2	Low	163 Å²	163	93.3 Å²	93.3	76%	0.762	51%	0.505	S	S	*	.	S	Bend	trans	-79	1.5	179.6	-62.5	-162.2	144.2	0	0	113.2
450	S	46.3	Very low	59.5	Low	36 Å²	36	95 Å²	95	25%	0.252	51%	0.507	S	S	.	.	S	Bend	trans	-144.1	171.8	167.4	-167.1	0	0	0	0	109.8	S448 D452	S448-S450 WeakPolarHBondContact CB-O 3.1Å; S448-S450 PolarHBondContact O-N 2.9Å; S450-D452 VanDerWaalsContact C-N 3.27Å; S450-D452 PolarHBondContact O-N 3.49Å
451	S	42.7	Very low	57.6	Low	59 Å²	59	93.9 Å²	93.9	41%	0.413	50%	0.5	S	S	.	.	S	Bend	trans	-79.5	-2.9	-176.9	-168	0	0	0	0	115.2
452	D	41.7	Very low	55.7	Low	83 Å²	83	93.2 Å²	93.2	44%	0.444	50%	0.499	S	S	.	.			trans	-143.2	77.4	-159.5	-171.5	38.8	0	0	0	108.8	P130 E131 S450	P130-D452 HydrophobicContact CB-CB 4.02Å; P130-D452 WeakPolarHBondContact CB-O 3.45Å; P130-D452 HydrophobicContact CG-CB 4.21Å; P130-D452 WeakPolarHBondContact CG-O 3.47Å; E131-D452 PolarHBondContact N-OD2 3.28Å; S450-D452 VanDerWaalsContact C-N 3.27Å; S450-D452 PolarHBondContact O-N 3.49Å
453	D	37.1	Very low	54.1	Low	91 Å²	91	95.8 Å²	95.8	49%	0.487	51%	0.513	S	S	.	.			trans	-150	55.9	-166.7	-176	31.9	0	0	0	109.7	S448	S448-D453 PolarHBondContact OG-OD2 3.31Å
454	D	33.8	Very low	51.9	Low	100 Å²	100	100 Å²	100	54%	0.535	53%	0.529	S	S	.	.	S	Bend	trans	-131.2	10.7	-179.6	-81.3	-66.4	0	0	0	111.4	K507	D454-K507 IonicContact OD2-NZ 2.65Å; D454-K507 PolarHBondContact OD2-NZ 3.1Å
455	E	40.7	Very low	49.7	Very low	122 Å²	122	102 Å²	102	57%	0.57	53%	0.532	S	S	*	.	S	Bend	trans	-129.9	-23.5	-173.5	-64.3	-133.2	138.5	0	0	118.9	E457 K473	E455-E457 PolarHBondContact O-N 3.37Å; E455-K473 VanDerWaalsContact OE1-CD 3.24Å; E455-K473 WeakPolarHBondContact OE1-CD 3.39Å; E455-K473 WeakPolarHBondContact OE1-CE 3.26Å; E455-K473 IonicContact OE1-NZ 2.74Å; E455-K473 PolarHBondContact OE1-NZ 3.17Å; E455-K473 IonicContact OE2-NZ 4Å; E455-K473 PolarHBondContact OE2-NZ 2.75Å
456	E	38.6	Very low	47.5	Very low	175 Å²	175	104 Å²	104	82%	0.818	54%	0.536	S	S	*	.			trans	-96	69.4	-164	-63.1	-156	155.2	0	0	116.4
457	E	37.9	Very low	45.6	Very low	183 Å²	183	103.5 Å²	103.5	86%	0.855	55%	0.548	S	S	*	.			trans	-127.6	61.8	161.4	-159.2	-177	-135.5	0	0	111.3	E455	E455-E457 PolarHBondContact O-N 3.37Å
458	E	38.3	Very low	43.9	Very low	41 Å²	41	106 Å²	106	19%	0.192	55%	0.552	C	S	.	*			trans	-138.7	31.3	-175.2	-86.4	-154.7	-154.9	0	0	117.9	N460 I461 K466 K469	E458-N460 PolarHBondContact O-N 3.13Å; E458-I461 HydrophobicContact CG-CD1 4.32Å; E458-K466 WeakPolarHBondContact OE2-CE 3.36Å; E458-K469 VanDerWaalsContact CD-NZ 3.29Å; E458-K469 HydrophobicContact CG-CD 4.46Å; E458-K469 WeakPolarHBondContact OE1-CD 3.38Å; E458-K469 WeakPolarHBondContact OE1-CE 3.12Å; E458-K469 WeakPolarHBondContact OE1-CG 3.5Å; E458-K469 IonicContact OE1-NZ 3.49Å; E458-K469 PolarHBondContact OE1-NZ 2.74Å
459	E	44.6	Very low	42.5	Very low	188 Å²	188	109.6 Å²	109.6	88%	0.879	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	61.3	171.7	-73.4	-125.2	120.9	0	0	114
460	N	43.2	Very low	41.8	Very low	163 Å²	163	107.1 Å²	107.1	87%	0.872	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	173.3	59.6	148.6	-102	-72.7	0	0	0	114.1	E458	E458-N460 PolarHBondContact O-N 3.13Å
461	I	40.8	Very low	41.7	Very low	68 Å²	68	109.2 Å²	109.2	35%	0.349	58%	0.577	S	S	.	*			trans	-141.3	153.6	169.2	24.3	173.7	0	0	0	112.8	E458 E465 K469	E458-I461 HydrophobicContact CG-CD1 4.32Å; I461-E465 HydrophobicContact CB-CB 4.49Å; I461-E465 WeakPolarHBondContact CG2-OE2 3.13Å; I461-K469 HydrophobicContact CD1-CD 3.52Å
462	S	44.7	Very low	42.1	Very low	61 Å²	61	112.9 Å²	112.9	43%	0.427	59%	0.592	S	S	.	*			trans	-78.4	162.7	-166.9	72.6	0	0	0	0	113.8	E464 E465 K466	S462-E464 PolarHBondContact O-N 3.15Å; S462-E464 VanDerWaalsContact O-N 3.15Å; S462-E465 PolarHBondContact O-N 3.25Å; S462-E465 PolarHBondContact OG-OE2 3.17Å; S462-K466 PolarHBondContact O-N 3.13Å
463	S	51.3	Low	42.9	Very low	108 Å²	108	112.9 Å²	112.9	76%	0.755	59%	0.588	S	S	*	*	H	α-helix	trans	-61.9	-21.6	-177.2	44.6	0	0	0	0	114.7	E465	S463-E465 VanDerWaalsContact C-N 3.33Å
464	E	43.9	Very low	44.7	Very low	156 Å²	156	111.4 Å²	111.4	73%	0.729	58%	0.584	S	S	*	*	H	α-helix	trans	-82.5	-7.9	174	-65.7	-171.3	109.1	0	0	113.7	S462	S462-E464 PolarHBondContact O-N 3.15Å; S462-E464 VanDerWaalsContact O-N 3.15Å
465	E	44.3	Very low	47.2	Very low	89 Å²	89	111.6 Å²	111.6	42%	0.416	58%	0.584	S	S	.	*	H	α-helix	trans	-100.8	-31.2	176.2	-70.6	179.8	108.3	0	0	113	I461 S462 S463 A467 K468 K469	I461-E465 HydrophobicContact CB-CB 4.49Å; I461-E465 WeakPolarHBondContact CG2-OE2 3.13Å; S462-E465 PolarHBondContact O-N 3.25Å; S462-E465 PolarHBondContact OG-OE2 3.17Å; S463-E465 VanDerWaalsContact C-N 3.33Å; E465-A467 PolarHBondContact O-N 3.29Å; E465-K468 WeakPolarHBondContact O-CA 3.25Å; E465-K468 WeakPolarHBondContact O-CB 3.4Å; E465-K468 PolarHBondContact O-N 3.21Å; E465-K469 PolarHBondContact O-N 3.48Å
466	K	42.2	Very low	49.6	Very low	105 Å²	105	109.9 Å²	109.9	46%	0.457	58%	0.578	S	S	.	*	H	α-helix	trans	-55.4	-36.6	173	-70.4	-156.3	166.6	-165.1	0	112.5	E458 S462 K468 K469 N470	E458-K466 WeakPolarHBondContact OE2-CE 3.36Å; S462-K466 PolarHBondContact O-N 3.13Å; K466-K468 PolarHBondContact O-N 2.83Å; K466-K469 PolarHBondContact O-N 3.21Å; K466-N470 PolarHBondContact O-N 2.73Å; K466-N470 VanDerWaalsContact O-N 3.13Å
467	A	42.6	Very low	52.1	Low	82 Å²	82	103.8 Å²	103.8	68%	0.678	55%	0.551	S	S	*	*	H	α-helix	trans	-65.8	-17.2	174.3	0	0	0	0	0	114.7	E465	E465-A467 PolarHBondContact O-N 3.29Å
468	K	42.4	Very low	54.8	Low	141 Å²	141	100 Å²	100	61%	0.613	53%	0.534	S	S	*	.	H	α-helix	trans	-99.5	-28.1	174.1	-66.9	168.9	-176.8	157.8	0	112.4	E465 K466 A471 N472	E465-K468 WeakPolarHBondContact O-CA 3.25Å; E465-K468 WeakPolarHBondContact O-CB 3.4Å; E465-K468 PolarHBondContact O-N 3.21Å; K466-K468 PolarHBondContact O-N 2.83Å; K468-A471 PolarHBondContact O-N 2.78Å; K468-N472 PolarHBondContact O-ND2 3.43Å
469	K	40.3	Very low	57.5	Low	87 Å²	87	98.6 Å²	98.6	38%	0.378	53%	0.528	S	S	.	.	H	α-helix	trans	-79.5	-35.8	-177.3	-145.2	152.1	168.7	-80.4	0	112.1	E458 I461 E465 K466 A471 N472	E458-K469 VanDerWaalsContact CD-NZ 3.29Å; E458-K469 HydrophobicContact CG-CD 4.46Å; E458-K469 WeakPolarHBondContact OE1-CD 3.38Å; E458-K469 WeakPolarHBondContact OE1-CE 3.12Å; E458-K469 WeakPolarHBondContact OE1-CG 3.5Å; E458-K469 IonicContact OE1-NZ 3.49Å; E458-K469 PolarHBondContact OE1-NZ 2.74Å; I461-K469 HydrophobicContact CD1-CD 3.52Å; E465-K469 PolarHBondContact O-N 3.48Å; K466-K469 PolarHBondContact O-N 3.21Å; K469-A471 PolarHBondContact O-N 3.45Å; K469-A471 VanDerWaalsContact O-N 3.09Å; K469-N472 PolarHBondContact O-N 2.9Å
470	N	40.3	Very low	59.9	Low	111 Å²	111	89.9 Å²	89.9	59%	0.594	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-13.1	167.9	-85.9	8.7	0	0	0	114.6	K466 N472	K466-N470 PolarHBondContact O-N 2.73Å; K466-N470 VanDerWaalsContact O-N 3.13Å; N470-N472 VanDerWaalsContact C-N 3.35Å
471	A	45	Very low	62.2	Low	81 Å²	81	84.1 Å²	84.1	67%	0.669	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	2.6	173.3	0	0	0	0	0	113.8	K468 K469	K468-A471 PolarHBondContact O-N 2.78Å; K469-A471 PolarHBondContact O-N 3.45Å; K469-A471 VanDerWaalsContact O-N 3.09Å
472	N	50.3	Low	64.6	Low	135 Å²	135	82.8 Å²	82.8	72%	0.722	45%	0.453	S	S	*	.	S	Bend	trans	-123.8	1.8	-176.6	-74.3	-81.2	0	0	0	114.2	K468 K469 N470	K468-N472 PolarHBondContact O-ND2 3.43Å; K469-N472 PolarHBondContact O-N 2.9Å; N470-N472 VanDerWaalsContact C-N 3.35Å
473	K	58.9	Low	66.7	Low	84 Å²	84	86.8 Å²	86.8	37%	0.365	46%	0.46	S	S	.	.	S	Bend	trans	-71.7	130.2	168.7	-74.6	172.8	168.9	175.9	0	108.7	E455	E455-K473 VanDerWaalsContact OE1-CD 3.24Å; E455-K473 WeakPolarHBondContact OE1-CD 3.39Å; E455-K473 WeakPolarHBondContact OE1-CE 3.26Å; E455-K473 IonicContact OE1-NZ 2.74Å; E455-K473 PolarHBondContact OE1-NZ 3.17Å; E455-K473 IonicContact OE2-NZ 4Å; E455-K473 PolarHBondContact OE2-NZ 2.75Å
474	P	74.8	Confident	68.7	Low	59 Å²	59	88.2 Å²	88.2	38%	0.383	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-69.3	142.6	-177.9	29.6	-34.7	0	0	0	110.6	E434 T436	E434-P474 HydrophobicContact CG-CB 3.8Å; E434-P474 HydrophobicContact CG-CG 3.77Å; T436-P474 WeakPolarHBondContact OG1-CB 3.44Å
475	L	87.3	Confident	71.1	Confident	104 Å²	104	83 Å²	83	55%	0.545	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-64.8	138.6	176.2	-178.9	66.1	0	0	0	109.7	E434 W435	E434-L475 WeakPolarHBondContact CA-O 3.31Å; W435-L475 HydrophobicContact CB-CB 4.14Å; W435-L475 HydrophobicContact CG-CB 4.22Å; W435-L475 HydrophobicContact CG-CD2 4.44Å; W435-L475 PolarHBondContact N-O 2.74Å
476	L	90.7	Very high	73.5	Confident	86 Å²	86	82.6 Å²	82.6	45%	0.45	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.6	177.6	-76.5	166.8	0	0	0	110.1	F433 E434 L505	F433-L476 WeakPolarHBondContact O-CA 3.34Å; E434-L476 HydrophobicContact CB-CD2 3.67Å; E434-L476 HydrophobicContact CG-CD2 3.9Å; L476-L505 HydrophobicContact CD2-CD1 3.59Å
477	D	91.3	Very high	76	Confident	47 Å²	47	77.6 Å²	77.6	25%	0.251	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	139.4	171.6	-79.2	-69.7	0	0	0	111.1	I369 Y432 F433 W435	I369-D477 HydrophobicContact CD1-CB 3.51Å; I369-D477 WeakPolarHBondContact CD1-OD2 3.18Å; Y432-D477 CarbonylContact C-O 3.4Å; Y432-D477 VanDerWaalsContact CA-O 3.26Å; Y432-D477 WeakPolarHBondContact CA-O 3.49Å; F433-D477 PolarHBondContact N-O 2.99Å; F433-D477 PolarHBondContact O-N 3.44Å; W435-D477 PolarHBondContact NE1-OD2 3.44Å
478	E	94	Very high	78.6	Confident	105 Å²	105	76.2 Å²	76.2	49%	0.491	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	122.3	171.7	-171.9	173.7	86.3	0	0	110.6	Y432 P481	Y432-E478 HydrophobicContact CD1-CB 3.92Å; Y432-E478 HydrophobicContact CD1-CG 4.19Å; Y432-E478 HydrophobicContact CE1-CB 3.64Å; Y432-E478 HydrophobicContact CE1-CG 3.63Å; Y432-E478 PolarHBondContact OH-OE2 3.41Å; E478-P481 VanDerWaalsContact CD-CA 3.49Å; E478-P481 WeakPolarHBondContact OE1-CB 3.29Å
479	I	95.4	Very high	81	Confident	11 Å²	11	76.1 Å²	76.1	6%	0.056	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-47.9	175.4	-52.1	-51.3	0	0	0	109.9	I369 P372 V431 F433 H496	I369-I479 HydrophobicContact CG2-CD1 3.62Å; P372-I479 HydrophobicContact CB-CG2 4.1Å; P372-I479 HydrophobicContact CG-CG2 4.33Å; P372-I479 VanDerWaalsContact CG-O 3.31Å; P372-I479 WeakPolarHBondContact CG-O 3.24Å; V431-I479 HydrophobicContact CB-CB 4.28Å; V431-I479 HydrophobicContact CG1-CB 4.16Å; V431-I479 WeakPolarHBondContact O-CA 3.23Å; V431-I479 WeakPolarHBondContact O-CB 3.43Å; V431-I479 PolarHBondContact O-N 3.39Å; F433-I479 HydrophobicContact CB-CD1 3.87Å; F433-I479 HydrophobicContact CB-CG1 3.83Å; I479-H496 HydrophobicContact CG2-CB 3.89Å; I479-H496 VanDerWaalsContact CG2-CG 3.45Å; I479-H496 WeakPolarHBondContact CG2-ND1 3.49Å
480	V	94.6	Very high	83.6	Confident	5 Å²	5	75 Å²	75	3%	0.03	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	115.9	175.8	179.8	0	0	0	0	108.3	P372 W418 G430 V431	P372-V480 HydrophobicContact CB-CG2 3.96Å; P372-V480 HydrophobicContact CG-CG2 3.82Å; W418-V480 HydrophobicContact CH2-CG2 4.4Å; W418-V480 HydrophobicContact CZ2-CG2 4.05Å; G430-V480 CarbonylContact C-O 3.43Å; G430-V480 WeakPolarHBondContact CA-O 3.13Å; V431-V480 HydrophobicContact CB-CB 3.94Å; V431-V480 HydrophobicContact CB-CG2 4.05Å; V431-V480 HydrophobicContact CG2-CB 4.05Å; V431-V480 HydrophobicContact CG2-CG2 4.04Å; V431-V480 PolarHBondContact N-O 3.41Å; V431-V480 PolarHBondContact O-N 3.01Å
481	P	91.6	Very high	86.4	Confident	42 Å²	42	69.8 Å²	69.8	27%	0.273	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	141.4	174.6	19	-31	0	0	0	112.3	E478 Y483 R485	E478-P481 VanDerWaalsContact CD-CA 3.49Å; E478-P481 WeakPolarHBondContact OE1-CB 3.29Å; P481-Y483 HydrophobicContact CB-CD2 4.25Å; P481-Y483 HydrophobicContact CB-CE2 3.82Å; P481-Y483 HydrophobicContact CG-CD2 4.1Å; P481-Y483 HydrophobicContact CG-CE2 3.58Å; P481-Y483 PolarHBondContact O-N 2.8Å; P481-Y483 VanDerWaalsContact O-N 3.09Å; P481-R485 PolarHBondContact O-NH2 2.91Å
482	V	91.9	Very high	88.9	Confident	39 Å²	39	68.1 Å²	68.1	24%	0.236	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	107.9	177.8	-176.9	0	0	0	0	109.5	Y432 D509	Y432-V482 HydrophobicContact CE2-CG2 3.97Å; V482-D509 HydrophobicContact CG1-CB 3.81Å
483	Y	88.6	Confident	91.2	Very high	145 Å²	145	61.8 Å²	61.8	57%	0.569	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.9	151	171.2	-64.7	-52.8	0	0	0	110.7	F429 P481 R485	F429-Y483 PolarHBondContact N-O 3.2Å; F429-Y483 PolarHBondContact O-N 3.22Å; P481-Y483 HydrophobicContact CB-CD2 4.25Å; P481-Y483 HydrophobicContact CB-CE2 3.82Å; P481-Y483 HydrophobicContact CG-CD2 4.1Å; P481-Y483 HydrophobicContact CG-CE2 3.58Å; P481-Y483 PolarHBondContact O-N 2.8Å; P481-Y483 VanDerWaalsContact O-N 3.09Å; Y483-R485 WeakPolarHBondContact O-CD 3.42Å; Y483-R485 WeakPolarHBondContact O-CG 3.26Å; Y483-R485 PolarHBondContact O-NE 3.37Å; Y483-R485 VanDerWaalsContact O-NE 3.14Å
484	R	93.1	Very high	93.1	Very high	139 Å²	139	57.8 Å²	57.8	53%	0.525	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	132.8	175.4	-65.4	174.7	59.7	-172.9	-1.3	110.7	D426 I427 Y512	D426-R484 IonicContact OD1-NH2 2.97Å; D426-R484 PolarHBondContact OD1-NH2 2.9Å; D426-R484 IonicContact OD2-CZ 3.86Å; D426-R484 IonicContact OD2-NE 3.72Å; D426-R484 PolarHBondContact OD2-NE 2.87Å; D426-R484 IonicContact OD2-NH2 2.67Å; D426-R484 PolarHBondContact OD2-NH2 2.88Å; I427-R484 CarbonylContact O-C 3.6Å; I427-R484 WeakPolarHBondContact O-CA 3.29Å; R484-Y512 HydrophobicContact CG-CD1 4.33Å; R484-Y512 HydrophobicContact CG-CE1 3.83Å; R484-Y512 HydrophobicContact CG-CE2 4.43Å; R484-Y512 VanDerWaalsContact CZ-CE2 3.47Å; R484-Y512 VanDerWaalsContact NE-CE2 3.25Å
485	R	93.8	Very high	94.2	Very high	47 Å²	47	55.6 Å²	55.6	18%	0.177	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	130.9	-177.4	-47.7	-58.6	175.4	169.5	3.9	110	F420 D426 I427 F429 P481 Y483 C487 Y492	F420-R485 HydrophobicContact CE2-CB 4.41Å; F420-R485 HydrophobicContact CZ-CB 4.49Å; F420-R485 HydrophobicContact CZ-CG 4.2Å; D426-R485 VanDerWaalsContact CA-O 3.28Å; D426-R485 WeakPolarHBondContact CA-O 3.29Å; D426-R485 VanDerWaalsContact CB-O 3.29Å; D426-R485 WeakPolarHBondContact CB-O 3.4Å; I427-R485 PolarHBondContact N-O 3.32Å; I427-R485 PolarHBondContact O-N 3.18Å; F429-R485 HydrophobicContact CB-CG 3.95Å; P481-R485 PolarHBondContact O-NH2 2.91Å; Y483-R485 WeakPolarHBondContact O-CD 3.42Å; Y483-R485 WeakPolarHBondContact O-CG 3.26Å; Y483-R485 PolarHBondContact O-NE 3.37Å; Y483-R485 VanDerWaalsContact O-NE 3.14Å; R485-C487 HydrophobicContact CB-CB 4.48Å; R485-C487 PolarHBondContact O-N 3.14Å; R485-C487 PolarHBondContact O-SG 3.5Å; R485-Y492 HydrophobicContact CB-CD1 4.03Å; R485-Y492 HydrophobicContact CB-CD2 4.35Å; R485-Y492 HydrophobicContact CB-CE1 3.83Å; R485-Y492 HydrophobicContact CB-CE2 4.15Å; R485-Y492 HydrophobicContact CB-CG 4.28Å; R485-Y492 HydrophobicContact CG-CD1 4.19Å; R485-Y492 HydrophobicContact CG-CE1 4.16Å
486	D	94.3	Very high	94.7	Very high	79 Å²	79	50.7 Å²	50.7	42%	0.422	24%	0.237	S	C	.	.			trans	-76.9	45.4	177.8	-61.1	-65.7	0	0	0	112.5	H488 E489	D486-H488 PolarHBondContact O-N 2.84Å; D486-H488 IonicContact OD1-CE1 3.7Å; D486-E489 PolarHBondContact O-N 3.49Å
487	C	95.2	Very high	95.1	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	11.4	-177.4	63.1	0	0	0	0	114.6	I380 F420 A421 T422 R485 E490 Y492	I380-C487 WeakPolarHBondContact CD1-O 3.27Å; F420-C487 HydrophobicContact CD2-CB 3.97Å; F420-C487 HydrophobicContact CE2-CB 3.78Å; A421-C487 CarbonylContact C-O 3.52Å; A421-C487 WeakPolarHBondContact CA-O 3.48Å; A421-C487 WeakPolarHBondContact CB-O 3.26Å; T422-C487 PolarHBondContact N-O 2.85Å; T422-C487 PolarHBondContact OG1-SG 3.4Å; R485-C487 HydrophobicContact CB-CB 4.48Å; R485-C487 PolarHBondContact O-N 3.14Å; R485-C487 PolarHBondContact O-SG 3.5Å; C487-E490 CarbonylContact C-O 3.52Å; C487-E490 WeakPolarHBondContact CA-O 3.29Å; C487-Y492 HydrophobicContact CB-CD2 3.44Å; C487-Y492 VanDerWaalsContact CB-CD2 3.44Å; C487-Y492 HydrophobicContact CB-CE2 4Å; C487-Y492 HydrophobicContact CB-CG 4.18Å
488	H	96.1	Very high	95.3	Very high	54 Å²	54	50.2 Å²	50.2	25%	0.25	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-13.9	166.4	63.4	-67.9	0	0	0	112.6	I380 T422 Y425 D426 D486	I380-H488 WeakPolarHBondContact CD1-O 3.16Å; T422-H488 WeakPolarHBondContact O-CA 3.44Å; T422-H488 PolarHBondContact OG1-N 3.34Å; Y425-H488 VanDerWaalsContact C-ND1 3.27Å; D426-H488 PolarHBondContact N-ND1 2.86Å; D426-H488 VanDerWaalsContact N-ND1 3.2Å; D486-H488 PolarHBondContact O-N 2.84Å; D486-H488 IonicContact OD1-CE1 3.7Å
489	E	93.9	Very high	95.3	Very high	138 Å²	138	46.3 Å²	46.3	65%	0.645	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-47.4	174.6	-54.7	-161.1	145.1	0	0	111.5	D486	D486-E489 PolarHBondContact O-N 3.49Å
490	E	95.4	Very high	95.2	Very high	65 Å²	65	47.2 Å²	47.2	30%	0.304	23%	0.225	S	C	.	.	S	Bend	trans	-126	159.4	176.2	-63.4	-156.1	112.2	0	0	112.2	T376 P378 C487	T376-E490 WeakPolarHBondContact CB-OE2 3.5Å; T376-E490 PolarHBondContact OG1-OE2 3.4Å; P378-E490 WeakPolarHBondContact CA-OE1 3.42Å; P378-E490 WeakPolarHBondContact CB-OE1 3.28Å; P378-E490 WeakPolarHBondContact CD-OE1 3.27Å; C487-E490 CarbonylContact C-O 3.52Å; C487-E490 WeakPolarHBondContact CA-O 3.29Å
491	V	98.3	Very high	95.1	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	125.7	168.1	-170.7	0	0	0	0	108.5	T376 R377 I380 F383 E419 F420 A421	T376-V491 CarbonylContact C-O 3.51Å; T376-V491 VanDerWaalsContact CA-O 3.23Å; T376-V491 WeakPolarHBondContact CA-O 3.32Å; R377-V491 HydrophobicContact CG-CB 3.86Å; R377-V491 HydrophobicContact CG-CG2 4.44Å; R377-V491 PolarHBondContact N-O 3.37Å; R377-V491 PolarHBondContact O-N 3.11Å; I380-V491 HydrophobicContact CB-CG2 3.95Å; I380-V491 HydrophobicContact CG1-CG2 4.14Å; F383-V491 HydrophobicContact CB-CG2 3.73Å; F383-V491 HydrophobicContact CD1-CB 4.38Å; F383-V491 HydrophobicContact CD1-CG1 3.74Å; F383-V491 HydrophobicContact CD1-CG2 3.66Å; F383-V491 HydrophobicContact CD2-CG1 4.42Å; F383-V491 HydrophobicContact CE1-CG1 3.75Å; F383-V491 HydrophobicContact CE1-CG2 4.47Å; F383-V491 HydrophobicContact CE2-CG1 4.39Å; F383-V491 HydrophobicContact CG-CG1 4.08Å; F383-V491 HydrophobicContact CG-CG2 3.84Å; F383-V491 HydrophobicContact CZ-CG1 4.07Å; E419-V491 HydrophobicContact CB-CG1 4.29Å; F420-V491 WeakPolarHBondContact O-CG1 3.45Å; A421-V491 HydrophobicContact CB-CG2 4.36Å
492	Y	98.4	Very high	95.2	Very high	47 Å²	47	50.8 Å²	50.8	18%	0.184	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	140.6	171.2	-82.2	-111.7	0	0	0	109.5	M374 T376 E419 F420 R485 C487	M374-Y492 HydrophobicContact CE-CD1 4.49Å; T376-Y492 HydrophobicContact CG2-CD1 3.89Å; T376-Y492 HydrophobicContact CG2-CD2 3.92Å; T376-Y492 HydrophobicContact CG2-CE1 3.8Å; T376-Y492 HydrophobicContact CG2-CE2 3.86Å; T376-Y492 HydrophobicContact CG2-CG 3.96Å; E419-Y492 CarbonylContact C-O 3.56Å; E419-Y492 WeakPolarHBondContact CA-O 3.31Å; F420-Y492 HydrophobicContact CE2-CG 4.46Å; F420-Y492 VanDerWaalsContact CZ-CB 3.44Å; F420-Y492 HydrophobicContact CZ-CG 4.12Å; F420-Y492 PolarHBondContact N-O 3.49Å; F420-Y492 PolarHBondContact O-N 3.19Å; R485-Y492 HydrophobicContact CB-CD1 4.03Å; R485-Y492 HydrophobicContact CB-CD2 4.35Å; R485-Y492 HydrophobicContact CB-CE1 3.83Å; R485-Y492 HydrophobicContact CB-CE2 4.15Å; R485-Y492 HydrophobicContact CB-CG 4.28Å; R485-Y492 HydrophobicContact CG-CD1 4.19Å; R485-Y492 HydrophobicContact CG-CE1 4.16Å; C487-Y492 HydrophobicContact CB-CD2 3.44Å; C487-Y492 VanDerWaalsContact CB-CD2 3.44Å; C487-Y492 HydrophobicContact CB-CE2 4Å; C487-Y492 HydrophobicContact CB-CG 4.18Å
493	A	98.3	Very high	95.4	Very high	1 Å²	1	49 Å²	49	1%	0.008	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	160.6	179.6	0	0	0	0	0	110.9	M374 W375 W418 E419	M374-A493 WeakPolarHBondContact CA-O 3.31Å; W375-A493 HydrophobicContact CD2-CB 4.4Å; W375-A493 HydrophobicContact CZ2-CB 4.07Å; W375-A493 PolarHBondContact N-O 2.86Å; W375-A493 PolarHBondContact O-N 3.47Å; W418-A493 CarbonylContact O-C 3.59Å; W418-A493 WeakPolarHBondContact O-CA 3.2Å; W418-A493 WeakPolarHBondContact O-CB 3.38Å; E419-A493 HydrophobicContact CG-CB 4.19Å
494	G	97.9	Very high	95.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.6	176.3	177.4	0	0	0	0	0	113.3	S373 F417 W418	S373-G494 CarbonylContact O-C 3.6Å; S373-G494 WeakPolarHBondContact O-CA 3.45Å; F417-G494 WeakPolarHBondContact CA-O 3.42Å; W418-G494 PolarHBondContact N-O 3.36Å; W418-G494 PolarHBondContact O-N 3.06Å
495	S	98.3	Very high	96	Very high	13 Å²	13	35.7 Å²	35.7	9%	0.091	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	153.3	173.1	60.1	0	0	0	0	112.6	P372 S373 L416 W418	P372-S495 CarbonylContact C-O 3.49Å; P372-S495 WeakPolarHBondContact CA-O 3.4Å; S373-S495 PolarHBondContact N-O 2.88Å; S373-S495 PolarHBondContact O-N 3.4Å; L416-S495 CarbonylContact O-C 3.45Å; L416-S495 WeakPolarHBondContact O-CA 3.11Å; L416-S495 WeakPolarHBondContact O-CB 3.28Å; W418-S495 VanDerWaalsContact CH2-C 3.45Å
496	H	98.4	Very high	96.2	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.009	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	140.9	171.8	-177.4	-134	0	0	0	109.4	A370 P372 Y415 L416 W418 I479 Y504	A370-H496 PolarHBondContact N-NE2 3.26Å; A370-H496 PolarHBondContact O-CD2 2.99Å; A370-H496 PolarHBondContact O-NE2 3.36Å; P372-H496 HydrophobicContact CB-CB 4.44Å; Y415-H496 WeakPolarHBondContact CA-O 3.36Å; L416-H496 PolarHBondContact N-O 3.19Å; L416-H496 PolarHBondContact O-N 3.17Å; W418-H496 HydrophobicContact CH2-CB 4Å; W418-H496 HydrophobicContact CZ3-CB 4Å; I479-H496 HydrophobicContact CG2-CB 3.89Å; I479-H496 VanDerWaalsContact CG2-CG 3.45Å; I479-H496 WeakPolarHBondContact CG2-ND1 3.49Å; H496-Y504 HydrophobicContact CB-CE1 3.93Å; H496-Y504 AromaticContact ND1-CE1 3.4Å; H496-Y504 WeakPolarHBondContact ND1-CE1 3.45Å; H496-Y504 AromaticContact ND1-CZ 3.66Å; H496-Y504 PolarHBondContact ND1-OH 3.01Å; H496-Y504 VanDerWaalsContact ND1-OH 3.11Å
497	Q	97.6	Very high	96.3	Very high	90 Å²	90	30.6 Å²	30.6	42%	0.421	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	144.8	169.9	-166.7	168.6	-19.4	0	0	109.2	A370 S414 Y415 P499 Y504	A370-Q497 HydrophobicContact CB-CB 4.04Å; S414-Q497 WeakPolarHBondContact O-CG 3.28Å; Y415-Q497 VanDerWaalsContact CD1-CA 3.42Å; Y415-Q497 HydrophobicContact CD1-CB 3.85Å; Y415-Q497 HydrophobicContact CD1-CG 4.27Å; Y415-Q497 HydrophobicContact CE1-CB 3.44Å; Y415-Q497 VanDerWaalsContact CE1-CB 3.44Å; Y415-Q497 HydrophobicContact CE1-CG 3.74Å; Y415-Q497 HydrophobicContact CE2-CG 4.32Å; Y415-Q497 PolarHBondContact OH-OE1 2.82Å; Y415-Q497 VanDerWaalsContact OH-OE1 3.06Å; Q497-P499 VanDerWaalsContact O-CD 3.28Å; Q497-P499 WeakPolarHBondContact O-CD 3.26Å; Q497-Y504 PolarHBondContact O-OH 2.89Å
498	Y	96.6	Very high	96.4	Very high	32 Å²	32	30.6 Å²	30.6	13%	0.125	15%	0.147	C	C	.	.			trans	-64.6	118.5	174.2	-70.4	-0.9	0	0	0	109.4	T409 H410 G413 S414 L416 G500 Y504 Y526	T409-Y498 HydrophobicContact CG2-CD1 4.12Å; T409-Y498 HydrophobicContact CG2-CD2 3.98Å; T409-Y498 HydrophobicContact CG2-CE1 4.16Å; T409-Y498 HydrophobicContact CG2-CE2 4.04Å; T409-Y498 HydrophobicContact CG2-CG 4.01Å; H410-Y498 PolarHBondContact N-OH 3.31Å; G413-Y498 VanDerWaalsContact C-CE2 3.41Å; G413-Y498 WeakPolarHBondContact O-CD2 3.34Å; G413-Y498 VanDerWaalsContact O-CE2 3.27Å; G413-Y498 WeakPolarHBondContact O-CE2 3.16Å; S414-Y498 PolarHBondContact O-N 3.46Å; L416-Y498 HydrophobicContact CB-CE1 4.04Å; Y498-G500 VanDerWaalsContact C-N 3.26Å; Y498-Y504 AromaticContact CD1-CE2 3.68Å; Y498-Y504 HydrophobicContact CD1-CE2 3.68Å; Y498-Y504 WeakPolarHBondContact CD1-OH 3.13Å; Y498-Y504 AromaticContact CE1-CE2 3.79Å; Y498-Y504 HydrophobicContact CE1-CE2 3.79Å; Y498-Y526 VanDerWaalsContact OH-CB 3.31Å; Y498-Y526 WeakPolarHBondContact OH-CB 3.44Å
499	P	93.5	Very high	96.3	Very high	24 Å²	24	29 Å²	29	16%	0.156	14%	0.14	C	C	.	.			trans	-76.1	-20.3	175.8	33.4	-35.1	0	0	0	111.5	I369 F433 W435 Q497	I369-P499 HydrophobicContact CG1-CB 4.17Å; F433-P499 HydrophobicContact CD1-CG 3.7Å; F433-P499 HydrophobicContact CD2-CG 3.91Å; F433-P499 HydrophobicContact CE1-CG 3.67Å; F433-P499 HydrophobicContact CE2-CG 3.87Å; F433-P499 HydrophobicContact CG-CG 3.82Å; F433-P499 HydrophobicContact CZ-CG 3.74Å; W435-P499 HydrophobicContact CH2-CB 3.9Å; W435-P499 HydrophobicContact CH2-CG 4.13Å; W435-P499 HydrophobicContact CZ2-CB 4.01Å; W435-P499 HydrophobicContact CZ2-CG 4.08Å; Q497-P499 VanDerWaalsContact O-CD 3.28Å; Q497-P499 WeakPolarHBondContact O-CD 3.26Å
500	G	92.6	Very high	96.3	Very high	29 Å²	29	22.4 Å²	22.4	30%	0.299	11%	0.109	S	C	.	.	S	Bend	trans	-180	-155.8	176	0	0	0	0	0	110.5	Y498	Y498-G500 VanDerWaalsContact C-N 3.26Å
501	R	92.7	Very high	95.5	Very high	121 Å²	121	20.3 Å²	20.3	46%	0.457	10%	0.102	S	C	.	.	S	Bend	trans	-86.5	135.2	170	-169.7	166.8	-172.7	145.4	13.6	109.1	E411 D437	E411-R501 IonicContact OE1-CZ 2.98Å; E411-R501 VanDerWaalsContact OE1-CZ 3.22Å; E411-R501 IonicContact OE1-NH1 2.78Å; E411-R501 PolarHBondContact OE1-NH1 3.11Å; E411-R501 IonicContact OE1-NH2 2.73Å; E411-R501 PolarHBondContact OE1-NH2 2.89Å; D437-R501 WeakPolarHBondContact OD1-CD 3.4Å; D437-R501 WeakPolarHBondContact OD1-CG 3.34Å; D437-R501 IonicContact OD1-NE 2.72Å
502	G	94.2	Very high	94.5	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.01	11%	0.107	C	C	.	.	S	Bend	trans	172.9	-161.3	-174.2	0	0	0	0	0	113.8	P408 T409 E434 T436	P408-G502 WeakPolarHBondContact CA-O 3.38Å; T409-G502 PolarHBondContact N-O 2.61Å; T409-G502 PolarHBondContact OG1-N 2.77Å; T409-G502 PolarHBondContact OG1-O 3.06Å; E434-G502 CarbonylContact O-C 3.49Å; E434-G502 WeakPolarHBondContact O-CA 3.43Å; T436-G502 WeakPolarHBondContact O-CA 3.46Å
503	V	96.4	Very high	93.3	Very high	2 Å²	2	20.3 Å²	20.3	1%	0.012	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	123.1	179.4	-174	0	0	0	0	110.1	R406 P408 E434 L505	R406-V503 HydrophobicContact CB-CG1 3.92Å; P408-V503 HydrophobicContact CB-CG2 4.31Å; P408-V503 HydrophobicContact CG-CG1 4.46Å; P408-V503 HydrophobicContact CG-CG2 4.34Å; E434-V503 HydrophobicContact CB-CB 4.33Å; E434-V503 WeakPolarHBondContact CB-O 3.2Å; E434-V503 PolarHBondContact N-O 3.16Å; E434-V503 PolarHBondContact O-N 3.42Å; V503-L505 HydrophobicContact CG1-CD2 4.04Å
504	Y	97.4	Very high	91.5	Very high	1 Å²	1	22.3 Å²	22.3	0%	0.004	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	135.5	169.5	-75.2	-97.5	0	0	0	110.2	R406 V407 T409 L416 V431 Y432 F433 H496 Q497 Y498	R406-Y504 CarbonylContact C-O 3.58Å; R406-Y504 WeakPolarHBondContact CA-O 3.37Å; V407-Y504 PolarHBondContact N-O 3.47Å; V407-Y504 PolarHBondContact O-N 3.21Å; T409-Y504 HydrophobicContact CG2-CD2 4.34Å; T409-Y504 HydrophobicContact CG2-CE2 4.04Å; L416-Y504 HydrophobicContact CB-CD2 4.27Å; L416-Y504 HydrophobicContact CB-CE1 4.34Å; L416-Y504 HydrophobicContact CB-CE2 3.97Å; L416-Y504 HydrophobicContact CD2-CD1 3.68Å; L416-Y504 HydrophobicContact CD2-CD2 3.77Å; L416-Y504 HydrophobicContact CD2-CE1 4.18Å; L416-Y504 HydrophobicContact CD2-CE2 4.28Å; L416-Y504 HydrophobicContact CD2-CG 3.43Å; L416-Y504 VanDerWaalsContact CD2-CG 3.43Å; V431-Y504 HydrophobicContact CG1-CD1 3.79Å; Y432-Y504 CarbonylContact O-C 3.46Å; Y432-Y504 WeakPolarHBondContact O-CA 3.17Å; F433-Y504 HydrophobicContact CD2-CD1 4.1Å; F433-Y504 AromaticContact CD2-CD2 3.83Å; F433-Y504 HydrophobicContact CD2-CD2 3.83Å; F433-Y504 HydrophobicContact CD2-CE1 4.04Å; F433-Y504 AromaticContact CD2-CE2 3.73Å; F433-Y504 HydrophobicContact CD2-CE2 3.73Å; F433-Y504 HydrophobicContact CD2-CG 4.02Å; F433-Y504 AromaticContact CD2-CZ 3.85Å; F433-Y504 AromaticContact CE2-CD2 3.92Å; F433-Y504 HydrophobicContact CE2-CD2 3.92Å; F433-Y504 AromaticContact CE2-CE2 3.65Å; F433-Y504 HydrophobicContact CE2-CE2 3.65Å; H496-Y504 HydrophobicContact CB-CE1 3.93Å; H496-Y504 AromaticContact ND1-CE1 3.4Å; H496-Y504 WeakPolarHBondContact ND1-CE1 3.45Å; H496-Y504 AromaticContact ND1-CZ 3.66Å; H496-Y504 PolarHBondContact ND1-OH 3.01Å; H496-Y504 VanDerWaalsContact ND1-OH 3.11Å; Q497-Y504 PolarHBondContact O-OH 2.89Å; Y498-Y504 AromaticContact CD1-CE2 3.68Å; Y498-Y504 HydrophobicContact CD1-CE2 3.68Å; Y498-Y504 WeakPolarHBondContact CD1-OH 3.13Å; Y498-Y504 AromaticContact CE1-CE2 3.79Å; Y498-Y504 HydrophobicContact CE1-CE2 3.79Å
505	L	97.2	Very high	90.1	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.016	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	98.7	177.1	-48.8	-177.6	0	0	0	108.8	T404 R406 V431 Y432 E434 L476 V503 K507	T404-L505 HydrophobicContact CG2-CB 3.94Å; T404-L505 HydrophobicContact CG2-CD2 4.29Å; R406-L505 HydrophobicContact CB-CD2 4.39Å; R406-L505 HydrophobicContact CG-CD2 3.81Å; V431-L505 WeakPolarHBondContact CA-O 3.38Å; Y432-L505 PolarHBondContact N-O 3.05Å; Y432-L505 PolarHBondContact O-N 3.19Å; E434-L505 HydrophobicContact CB-CD1 4.3Å; E434-L505 HydrophobicContact CB-CG 4.37Å; L476-L505 HydrophobicContact CD2-CD1 3.59Å; V503-L505 HydrophobicContact CG1-CD2 4.04Å; L505-K507 PolarHBondContact O-N 2.94Å
506	L	97.9	Very high	89.3	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.01	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	105.5	172.8	-82.5	65.1	0	0	0	107.8	T404 V405 V407 L416 W418 F429 V431 F508 V524	T404-L506 WeakPolarHBondContact CA-O 3.44Å; V405-L506 HydrophobicContact CB-CB 4.21Å; V405-L506 PolarHBondContact N-O 3.45Å; V405-L506 PolarHBondContact O-N 2.97Å; V407-L506 HydrophobicContact CG2-CD1 4.41Å; L416-L506 HydrophobicContact CD2-CD1 4.06Å; W418-L506 HydrophobicContact CB-CD2 4.01Å; F429-L506 HydrophobicContact CE2-CB 4.25Å; F429-L506 HydrophobicContact CE2-CD2 4.22Å; F429-L506 HydrophobicContact CE2-CG 4.12Å; F429-L506 HydrophobicContact CZ-CD2 4.33Å; F429-L506 HydrophobicContact CZ-CG 4.15Å; V431-L506 HydrophobicContact CG1-CD1 4.26Å; V431-L506 HydrophobicContact CG2-CG 4.29Å; L506-F508 HydrophobicContact CB-CE2 4.39Å; L506-V524 HydrophobicContact CD2-CG1 3.66Å
507	K	96.8	Very high	88.9	Confident	17 Å²	17	31.4 Å²	31.4	7%	0.074	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	109.9	-179	-64.7	-90.5	-178.9	179.6	0	108.7	V402 T404 G430 Y432 D454 L505	V402-K507 HydrophobicContact CG1-CB 4.39Å; V402-K507 HydrophobicContact CG1-CD 4.21Å; T404-K507 HydrophobicContact CG2-CD 3.99Å; T404-K507 WeakPolarHBondContact OG1-CD 3.2Å; T404-K507 WeakPolarHBondContact OG1-CE 3.48Å; T404-K507 PolarHBondContact OG1-NZ 3.45Å; T404-K507 VanDerWaalsContact OG1-NZ 3.12Å; G430-K507 PolarHBondContact N-O 3.42Å; G430-K507 PolarHBondContact O-N 3.26Å; Y432-K507 HydrophobicContact CD2-CG 3.97Å; Y432-K507 HydrophobicContact CE2-CG 4.18Å; D454-K507 IonicContact OD2-NZ 2.65Å; D454-K507 PolarHBondContact OD2-NZ 3.1Å; L505-K507 PolarHBondContact O-N 2.94Å
508	F	97.4	Very high	88.9	Confident	1 Å²	1	27.4 Å²	27.4	0%	0.004	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	98	171.4	-70.1	-73.2	0	0	0	109.2	I395 V397 V402 V403 V405 F420 I427 F429 L506 V520 Y522	I395-F508 HydrophobicContact CD1-CD2 3.76Å; I395-F508 HydrophobicContact CD1-CE2 4.11Å; I395-F508 HydrophobicContact CD1-CG 4.42Å; V397-F508 HydrophobicContact CG2-CB 4.13Å; V402-F508 WeakPolarHBondContact CA-O 3.29Å; V403-F508 PolarHBondContact N-O 2.72Å; V403-F508 PolarHBondContact O-N 3.19Å; V405-F508 HydrophobicContact CG2-CD2 4.06Å; V405-F508 HydrophobicContact CG2-CE2 3.88Å; F420-F508 HydrophobicContact CB-CE1 3.92Å; F420-F508 HydrophobicContact CB-CZ 4.12Å; F420-F508 HydrophobicContact CD1-CE1 4.4Å; F420-F508 AromaticContact CD2-CE1 3.91Å; F420-F508 HydrophobicContact CD2-CE1 3.91Å; F420-F508 AromaticContact CG-CE1 3.83Å; F420-F508 HydrophobicContact CG-CE1 3.83Å; F420-F508 HydrophobicContact CG-CZ 4.38Å; I427-F508 HydrophobicContact CD1-CB 4.04Å; I427-F508 HydrophobicContact CG2-CD1 4.48Å; F429-F508 AromaticContact CD2-CD1 3.82Å; F429-F508 HydrophobicContact CD2-CD1 3.82Å; F429-F508 AromaticContact CD2-CE1 3.52Å; F429-F508 HydrophobicContact CD2-CE1 3.52Å; F429-F508 HydrophobicContact CD2-CZ 4.13Å; F429-F508 HydrophobicContact CE2-CD1 4.43Å; F429-F508 AromaticContact CE2-CE1 3.81Å; F429-F508 HydrophobicContact CE2-CE1 3.81Å; F429-F508 AromaticContact CE2-CZ 3.95Å; F429-F508 HydrophobicContact CE2-CZ 3.95Å; L506-F508 HydrophobicContact CB-CE2 4.39Å; F508-V520 HydrophobicContact CD1-CG1 3.84Å; F508-V520 HydrophobicContact CD1-CG2 4.46Å; F508-V520 HydrophobicContact CE1-CG1 3.62Å; F508-V520 HydrophobicContact CE2-CG1 4.48Å; F508-V520 HydrophobicContact CG-CG1 4.38Å; F508-V520 HydrophobicContact CZ-CG1 3.96Å; F508-Y522 HydrophobicContact CE2-CG 4.44Å; F508-Y522 HydrophobicContact CZ-CG 4.46Å
509	D	92.8	Very high	88.9	Confident	19 Å²	19	27.8 Å²	27.8	10%	0.102	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	119.3	-170.4	165.5	31.3	0	0	0	112	V402 I427 G428 V482 S511 Y512	V402-D509 HydrophobicContact CG1-CB 4.31Å; V402-D509 HydrophobicContact CG2-CB 4.21Å; I427-D509 WeakPolarHBondContact CG1-O 3.42Å; G428-D509 WeakPolarHBondContact CA-O 3.5Å; G428-D509 PolarHBondContact N-O 2.81Å; G428-D509 PolarHBondContact O-N 2.67Å; V482-D509 HydrophobicContact CG1-CB 3.81Å; D509-S511 WeakPolarHBondContact OD1-CB 3.22Å; D509-S511 PolarHBondContact OD1-N 2.89Å; D509-S511 PolarHBondContact OD1-OG 3.34Å; D509-Y512 WeakPolarHBondContact O-CE1 3.34Å
510	N	93.4	Very high	89.1	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.138	C	C	.	.			trans	-120.4	17.1	173	-160	39.7	0	0	0	112.6	V397 G398 G400 E401 Y512 S513 R516 K518	V397-N510 HydrophobicContact CB-CB 4.31Å; V397-N510 HydrophobicContact CG1-CB 3.43Å; V397-N510 VanDerWaalsContact CG1-CB 3.43Å; V397-N510 PolarHBondContact O-ND2 3.22Å; G398-N510 PolarHBondContact O-ND2 2.61Å; G400-N510 PolarHBondContact N-O 3.36Å; E401-N510 CarbonylContact O-C 3.56Å; E401-N510 WeakPolarHBondContact O-CA 3.27Å; E401-N510 WeakPolarHBondContact O-CB 3.49Å; E401-N510 PolarHBondContact O-N 3.14Å; N510-Y512 PolarHBondContact O-N 2.97Å; N510-S513 PolarHBondContact O-N 2.71Å; N510-S513 WeakPolarHBondContact OD1-CB 3.36Å; N510-R516 PolarHBondContact ND2-O 2.86Å; N510-K518 WeakPolarHBondContact OD1-CE 3.47Å; N510-K518 PolarHBondContact OD1-NZ 3.28Å
511	S	79.4	Confident	89.4	Confident	22 Å²	22	26 Å²	26	15%	0.154	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-39.6	-178.9	65.3	0	0	0	0	112.8	R142 G400 E401 D509 S513	R142-S511 PolarHBondContact NH1-O 3.17Å; G400-S511 WeakPolarHBondContact O-CA 3.45Å; E401-S511 PolarHBondContact O-N 2.67Å; D509-S511 WeakPolarHBondContact OD1-CB 3.22Å; D509-S511 PolarHBondContact OD1-N 2.89Å; D509-S511 PolarHBondContact OD1-OG 3.34Å; S511-S513 VanDerWaalsContact C-N 3.29Å; S511-S513 PolarHBondContact O-N 3.12Å
512	Y	77.6	Confident	89.6	Confident	29 Å²	29	21 Å²	21	11%	0.114	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-16.1	178	69.3	-85.6	0	0	0	114.2	D426 I427 R484 D509 N510 L514	D426-Y512 VanDerWaalsContact C-OH 3.29Å; D426-Y512 PolarHBondContact O-OH 2.96Å; D426-Y512 VanDerWaalsContact O-OH 3.14Å; D426-Y512 PolarHBondContact OD2-OH 3.02Å; I427-Y512 WeakPolarHBondContact CA-OH 3.21Å; I427-Y512 PolarHBondContact N-OH 3.42Å; R484-Y512 HydrophobicContact CG-CD1 4.33Å; R484-Y512 HydrophobicContact CG-CE1 3.83Å; R484-Y512 HydrophobicContact CG-CE2 4.43Å; R484-Y512 VanDerWaalsContact CZ-CE2 3.47Å; R484-Y512 VanDerWaalsContact NE-CE2 3.25Å; D509-Y512 WeakPolarHBondContact O-CE1 3.34Å; N510-Y512 PolarHBondContact O-N 2.97Å; Y512-L514 PolarHBondContact O-N 3.46Å
513	S	74.1	Confident	89.8	Confident	18 Å²	18	25.1 Å²	25.1	13%	0.126	12%	0.124	C	C	.	.			trans	-96.1	86.9	-169.6	-144.1	0	0	0	0	113.6	R399 N510 S511 W515 K518	R399-S513 WeakPolarHBondContact CA-O 3.26Å; R399-S513 WeakPolarHBondContact CB-O 3.31Å; N510-S513 PolarHBondContact O-N 2.71Å; N510-S513 WeakPolarHBondContact OD1-CB 3.36Å; S511-S513 VanDerWaalsContact C-N 3.29Å; S511-S513 PolarHBondContact O-N 3.12Å; S513-W515 PolarHBondContact O-N 3.46Å; S513-W515 VanDerWaalsContact O-N 3.07Å; S513-K518 VanDerWaalsContact CB-NZ 3.27Å; S513-K518 PolarHBondContact OG-NZ 2.93Å
514	L	59.9	Low	89.8	Confident	43 Å²	43	26.5 Å²	26.5	23%	0.225	13%	0.132	C	C	.	.	S	Bend	trans	-46.2	-36.1	-179.9	-57.9	168.5	0	0	0	116.1	V113 Y512	V113-L514 HydrophobicContact CB-CD2 4.28Å; V113-L514 HydrophobicContact CG1-CD2 3.56Å; V113-L514 HydrophobicContact CG2-CD1 3.55Å; V113-L514 HydrophobicContact CG2-CD2 3.67Å; V113-L514 HydrophobicContact CG2-CG 4.1Å; Y512-L514 PolarHBondContact O-N 3.46Å
515	W	68.6	Low	89.7	Confident	39 Å²	39	30.2 Å²	30.2	15%	0.148	15%	0.146	C	C	.	.	S	Bend	trans	-136.3	-1.5	-161.8	-52.7	123.1	0	0	0	115.3	L91 F94 K95 V113 H116 S513	L91-W515 HydrophobicContact CD1-CH2 3.96Å; L91-W515 HydrophobicContact CD1-CZ3 4.05Å; F94-W515 AromaticContact CD1-CZ2 3.91Å; F94-W515 HydrophobicContact CD1-CZ2 3.91Å; F94-W515 AromaticContact CE1-CE2 3.67Å; F94-W515 AromaticContact CE1-CZ2 3.5Å; F94-W515 HydrophobicContact CE1-CZ2 3.5Å; F94-W515 VanDerWaalsContact CE1-CZ2 3.5Å; F94-W515 AromaticContact CE1-NE1 3.53Å; K95-W515 HydrophobicContact CD-CE3 4.23Å; K95-W515 HydrophobicContact CG-CD2 4.19Å; K95-W515 HydrophobicContact CG-CE3 3.99Å; K95-W515 HydrophobicContact CG-CZ3 4.42Å; V113-W515 HydrophobicContact CG2-CZ2 3.96Å; H116-W515 HydrophobicContact CB-CH2 3.97Å; H116-W515 AromaticContact CD2-CH2 3.27Å; H116-W515 WeakPolarHBondContact CD2-CH2 3.28Å; H116-W515 AromaticContact CD2-CZ3 3.32Å; H116-W515 WeakPolarHBondContact CD2-CZ3 3.39Å; H116-W515 AromaticContact CG-CH2 3.62Å; H116-W515 AromaticContact NE2-CH2 3.95Å; H116-W515 AromaticContact NE2-CZ3 3.53Å; S513-W515 PolarHBondContact O-N 3.46Å; S513-W515 VanDerWaalsContact O-N 3.07Å
516	R	81.4	Confident	89.7	Confident	100 Å²	100	34.7 Å²	34.7	38%	0.377	16%	0.164	S	C	.	.			trans	-133.3	108.5	-172.5	-55.8	-64.7	171.2	-164.1	-11.6	110.1	K95 Y425 N510 K518	K95-R516 PolarHBondContact O-NH2 3.14Å; Y425-R516 HydrophobicContact CD2-CB 4.04Å; Y425-R516 HydrophobicContact CD2-CG 4.17Å; Y425-R516 HydrophobicContact CE2-CB 4.07Å; Y425-R516 HydrophobicContact CE2-CG 3.81Å; N510-R516 PolarHBondContact ND2-O 2.86Å; R516-K518 PolarHBondContact O-NZ 2.82Å
517	S	90.3	Very high	89.5	Confident	67 Å²	67	36.9 Å²	36.9	47%	0.469	18%	0.177	S	C	.	.			trans	-59.8	160.9	157.8	-44.7	0	0	0	0	110.3	V397	V397-S517 CarbonylContact O-C 3.4Å; V397-S517 WeakPolarHBondContact O-CA 3.21Å; V397-S517 WeakPolarHBondContact O-CB 3.27Å
518	K	95.9	Very high	89.2	Confident	5 Å²	5	45.7 Å²	45.7	2%	0.022	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	126	176.2	-52.2	-65.8	-179	-67	0	109.2	T396 V397 T422 D426 I427 N510 S513 R516 V520	T396-K518 WeakPolarHBondContact CA-O 3.37Å; V397-K518 PolarHBondContact N-O 2.9Å; V397-K518 PolarHBondContact O-N 3.15Å; T422-K518 HydrophobicContact CG2-CB 4.34Å; D426-K518 WeakPolarHBondContact O-CD 2.96Å; D426-K518 WeakPolarHBondContact O-CE 3.14Å; I427-K518 HydrophobicContact CB-CG 4.47Å; I427-K518 HydrophobicContact CD1-CB 4.04Å; I427-K518 HydrophobicContact CD1-CG 3.99Å; I427-K518 HydrophobicContact CG1-CG 4.21Å; N510-K518 WeakPolarHBondContact OD1-CE 3.47Å; N510-K518 PolarHBondContact OD1-NZ 3.28Å; S513-K518 VanDerWaalsContact CB-NZ 3.27Å; S513-K518 PolarHBondContact OG-NZ 2.93Å; R516-K518 PolarHBondContact O-NZ 2.82Å; K518-V520 HydrophobicContact CB-CG2 4.24Å
519	S	97.3	Very high	88.7	Confident	40 Å²	40	47.9 Å²	47.9	28%	0.28	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	122.8	154.6	-21.8	0	0	0	0	107.2	T422 D423	T422-S519 VanDerWaalsContact CA-O 3.27Å; T422-S519 WeakPolarHBondContact CA-O 2.89Å; D423-S519 VanDerWaalsContact OD2-CB 3.22Å; D423-S519 WeakPolarHBondContact OD2-CB 3.47Å; D423-S519 PolarHBondContact OD2-OG 3.03Å
520	V	98.1	Very high	88.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	119.1	172.7	-178.1	0	0	0	0	108.1	V394 I395 V397 A421 T422 I427 F508 K518	V394-V520 WeakPolarHBondContact CA-O 3.32Å; I395-V520 HydrophobicContact CD1-CB 4.31Å; I395-V520 HydrophobicContact CG1-CB 3.76Å; I395-V520 HydrophobicContact CG1-CG1 4.37Å; I395-V520 HydrophobicContact CG1-CG2 4.48Å; I395-V520 PolarHBondContact N-O 3.21Å; I395-V520 PolarHBondContact O-N 3.45Å; V397-V520 HydrophobicContact CG2-CG2 3.79Å; A421-V520 WeakPolarHBondContact O-CA 3.01Å; T422-V520 HydrophobicContact CG2-CG2 3.92Å; I427-V520 HydrophobicContact CD1-CG2 3.52Å; F508-V520 HydrophobicContact CD1-CG1 3.84Å; F508-V520 HydrophobicContact CD1-CG2 4.46Å; F508-V520 HydrophobicContact CE1-CG1 3.62Å; F508-V520 HydrophobicContact CE2-CG1 4.48Å; F508-V520 HydrophobicContact CG-CG1 4.38Å; F508-V520 HydrophobicContact CZ-CG1 3.96Å; K518-V520 HydrophobicContact CB-CG2 4.24Å
521	Y	98.3	Very high	88.3	Confident	17 Å²	17	52.2 Å²	52.2	7%	0.067	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	118	169.7	-55.4	-103.1	0	0	0	105.8	F383 K384 I387 Q388 V394 F420 A421 D423	F383-Y521 WeakPolarHBondContact CE1-O 3.05Å; K384-Y521 HydrophobicContact CB-CD1 4.05Å; K384-Y521 HydrophobicContact CB-CE1 4.11Å; K384-Y521 HydrophobicContact CB-CG 4.34Å; K384-Y521 HydrophobicContact CD-CD2 4.02Å; K384-Y521 HydrophobicContact CD-CE2 3.88Å; K384-Y521 HydrophobicContact CD-CG 4.5Å; K384-Y521 HydrophobicContact CG-CD1 4.01Å; K384-Y521 HydrophobicContact CG-CD2 3.78Å; K384-Y521 HydrophobicContact CG-CE1 4.25Å; K384-Y521 HydrophobicContact CG-CE2 4.05Å; K384-Y521 HydrophobicContact CG-CG 3.78Å; I387-Y521 HydrophobicContact CB-CD1 4.42Å; I387-Y521 HydrophobicContact CG2-CD1 4.3Å; Q388-Y521 HydrophobicContact CB-CE1 4.31Å; V394-Y521 HydrophobicContact CG1-CD1 4.22Å; V394-Y521 HydrophobicContact CG1-CE1 4.15Å; V394-Y521 HydrophobicContact CG2-CD1 3.65Å; V394-Y521 HydrophobicContact CG2-CE1 4.05Å; V394-Y521 HydrophobicContact CG2-CG 4.45Å; F420-Y521 CarbonylContact C-O 3.59Å; F420-Y521 WeakPolarHBondContact CA-O 3.25Å; A421-Y521 PolarHBondContact N-O 3.22Å; A421-Y521 PolarHBondContact O-N 3.01Å; D423-Y521 WeakPolarHBondContact OD1-CE2 3.32Å; D423-Y521 PolarHBondContact OD1-OH 3.37Å; D423-Y521 WeakPolarHBondContact OD2-CE2 3.36Å; D423-Y521 PolarHBondContact OD2-OH 3.09Å
522	Y	98.3	Very high	88.8	Confident	16 Å²	16	53.9 Å²	53.9	6%	0.063	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	164.8	-178	80.4	-73.1	0	0	0	111.4	D392 S393 I395 V405 E419 F508 V524	D392-Y522 VanDerWaalsContact O-CE1 3.29Å; D392-Y522 WeakPolarHBondContact O-CE1 3.39Å; D392-Y522 PolarHBondContact O-OH 3.08Å; S393-Y522 WeakPolarHBondContact CB-O 3.27Å; S393-Y522 VanDerWaalsContact O-CD1 3.26Å; S393-Y522 WeakPolarHBondContact O-CD1 3.05Å; S393-Y522 PolarHBondContact O-N 2.75Å; I395-Y522 HydrophobicContact CD1-CD1 4.36Å; I395-Y522 HydrophobicContact CG1-CD1 4.34Å; I395-Y522 HydrophobicContact CG2-CE1 3.93Å; V405-Y522 HydrophobicContact CG1-CE2 3.85Å; V405-Y522 HydrophobicContact CG2-CE2 4.3Å; E419-Y522 CarbonylContact O-C 3.56Å; E419-Y522 VanDerWaalsContact O-CA 3.31Å; E419-Y522 WeakPolarHBondContact O-CA 3.35Å; F508-Y522 HydrophobicContact CE2-CG 4.44Å; F508-Y522 HydrophobicContact CZ-CG 4.46Å; Y522-V524 HydrophobicContact CD2-CG1 4.49Å
523	R	96.9	Very high	89.5	Confident	87 Å²	87	55.5 Å²	55.5	33%	0.328	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	134.4	174.5	-173.8	177.7	172.7	-116.8	-9.7	109.4	F383 I387 W418 E419 Y525	F383-R523 HydrophobicContact CE2-CB 4.37Å; I387-R523 HydrophobicContact CD1-CB 3.86Å; I387-R523 HydrophobicContact CD1-CG 4.24Å; W418-R523 CarbonylContact C-O 3.56Å; W418-R523 WeakPolarHBondContact CA-O 3.31Å; E419-R523 HydrophobicContact CB-CB 4.37Å; E419-R523 PolarHBondContact N-O 2.66Å; E419-R523 PolarHBondContact O-N 2.91Å; E419-R523 IonicContact OE2-CZ 3.3Å; E419-R523 IonicContact OE2-NH1 2.68Å; E419-R523 PolarHBondContact OE2-NH1 2.92Å; R523-Y525 HydrophobicContact CG-CD1 4.41Å
524	V	96.9	Very high	90.5	Very high	31 Å²	31	58 Å²	58	19%	0.188	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	146.4	173.5	-69.2	0	0	0	0	110.8	V407 L416 F417 W418 V443 L506 Y522	V407-V524 HydrophobicContact CG1-CG2 4.42Å; V407-V524 HydrophobicContact CG2-CB 4.49Å; V407-V524 HydrophobicContact CG2-CG1 4.29Å; V407-V524 HydrophobicContact CG2-CG2 4.09Å; L416-V524 HydrophobicContact CD1-CB 4.34Å; F417-V524 WeakPolarHBondContact O-CA 3.13Å; W418-V524 HydrophobicContact CB-CG1 4.17Å; V443-V524 HydrophobicContact CG2-CG2 4.15Å; L506-V524 HydrophobicContact CD2-CG1 3.66Å; Y522-V524 HydrophobicContact CD2-CG1 4.49Å
525	Y	96	Very high	92.7	Very high	79 Å²	79	59.1 Å²	59.1	31%	0.31	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	155.2	173.9	55.8	-81.9	0	0	0	110.4	F417 R523 T527	F417-Y525 HydrophobicContact CB-CD1 4.26Å; F417-Y525 HydrophobicContact CB-CD2 3.93Å; F417-Y525 HydrophobicContact CB-CE1 3.89Å; F417-Y525 HydrophobicContact CB-CE2 3.54Å; F417-Y525 HydrophobicContact CB-CG 4.27Å; F417-Y525 HydrophobicContact CD1-CE2 4.34Å; F417-Y525 HydrophobicContact CD2-CE2 4.28Å; F417-Y525 HydrophobicContact CG-CD2 4.44Å; F417-Y525 AromaticContact CG-CE2 3.82Å; F417-Y525 HydrophobicContact CG-CE2 3.82Å; F417-Y525 PolarHBondContact N-O 2.75Å; F417-Y525 PolarHBondContact O-N 2.74Å; F417-Y525 VanDerWaalsContact O-N 3.08Å; R523-Y525 HydrophobicContact CG-CD1 4.41Å; Y525-T527 HydrophobicContact CD2-CG2 4.46Å; Y525-T527 HydrophobicContact CE2-CG2 4.5Å
526	Y	96.3	Very high	94.5	Very high	96 Å²	96	60.6 Å²	60.6	38%	0.376	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	161.2	173.3	68.3	-95.9	0	0	0	111.6	H410 Y415 Y498	H410-Y526 HydrophobicContact CB-CD1 3.74Å; H410-Y526 HydrophobicContact CB-CD2 4.31Å; H410-Y526 HydrophobicContact CB-CE1 3.71Å; H410-Y526 HydrophobicContact CB-CE2 4.31Å; H410-Y526 HydrophobicContact CB-CG 4.06Å; H410-Y526 AromaticContact CD2-CE1 3.83Å; H410-Y526 AromaticContact CD2-CZ 3.95Å; H410-Y526 AromaticContact CE1-CZ 3.61Å; H410-Y526 PolarHBondContact CE1-OH 2.88Å; H410-Y526 AromaticContact CG-CE1 3.53Å; H410-Y526 AromaticContact CG-CZ 3.51Å; H410-Y526 AromaticContact ND1-CE1 3.83Å; H410-Y526 AromaticContact ND1-CE2 3.56Å; H410-Y526 AromaticContact ND1-CZ 3.27Å; H410-Y526 VanDerWaalsContact ND1-CZ 3.27Å; H410-Y526 PolarHBondContact ND1-OH 2.84Å; H410-Y526 PolarHBondContact NE2-OH 3.38Å; Y415-Y526 WeakPolarHBondContact O-CA 3.12Å; Y415-Y526 WeakPolarHBondContact O-CB 3.49Å; Y498-Y526 VanDerWaalsContact OH-CB 3.31Å; Y498-Y526 WeakPolarHBondContact OH-CB 3.44Å
527	T	94.3	Very high	95.6	Very high	48 Å²	48	57.3 Å²	57.3	29%	0.294	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	158.5	166.5	69.1	0	0	0	0	110.4	G413 S414 Y415 F417 Y525	G413-T527 CarbonylContact C-O 3.58Å; G413-T527 WeakPolarHBondContact CA-O 3.28Å; S414-T527 PolarHBondContact N-O 2.67Å; Y415-T527 PolarHBondContact N-O 3.01Å; Y415-T527 PolarHBondContact O-N 2.91Å; Y415-T527 VanDerWaalsContact O-N 3.15Å; F417-T527 HydrophobicContact CD2-CG2 3.87Å; F417-T527 HydrophobicContact CE2-CG2 3.73Å; Y525-T527 HydrophobicContact CD2-CG2 4.46Å; Y525-T527 HydrophobicContact CE2-CG2 4.5Å
528	R	89.2	Confident	96.1	Very high	202 Å²	202	56.5 Å²	56.5	76%	0.762	25%	0.245	S	C	*	.			trans	-75.9	0	169.7	-52.4	-146.3	179.8	169.1	-3.9	111	E412 S414	E412-R528 VanDerWaalsContact O-CG 3.28Å; E412-R528 WeakPolarHBondContact O-CG 3.21Å; E412-R528 IonicContact OE1-CZ 2.71Å; E412-R528 IonicContact OE1-NH1 3.53Å; E412-R528 IonicContact OE1-NH2 2.62Å; E412-R528 PolarHBondContact OE1-NH2 3.28Å; E412-R528 IonicContact OE2-CZ 3.89Å; E412-R528 IonicContact OE2-NE 3.19Å; E412-R528 IonicContact OE2-NH2 2.8Å; E412-R528 PolarHBondContact OE2-NH2 3.11Å; S414-R528 WeakPolarHBondContact CB-OXT 3.4Å; S414-R528 PolarHBondContact OG-OXT 3.44Å

Retrieved 528 of 528 residues in 113.9 ms (Link to these results)

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