A0A5K4EX03_SCHMA Loading...

DH domain-containing protein

AlphaFold DB (A0A3Q0KSA2), UniProt , Accession A0A5K4EX03, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 710 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.1	Very low	26.5	Very low	157 Å²	157	132.6 Å²	132.6	77%	0.773	70%	0.696	S	S	*	*				0	92.5	0	-68.6	-172.4	114.2	0	0	110.8	E252	M1-E252 WeakPolarHBondContact CE-OE2 3.33Å; M1-E252 VanDerWaalsContact SD-OE2 3.33Å
2	R	24.3	Very low	26.5	Very low	205 Å²	205	132.7 Å²	132.7	77%	0.774	70%	0.696	S	S	*	*			trans	-132.9	112.6	162.1	-79.5	-179.4	171.8	179.8	-4.2	106.7
3	S	26.5	Very low	27	Very low	78 Å²	78	131.8 Å²	131.8	55%	0.545	70%	0.703	S	S	.	*			trans	-67.1	129.6	175.5	37.4	0	0	0	0	109.7	N5 E245	S3-N5 VanDerWaalsContact C-N 3.32Å; S3-N5 PolarHBondContact O-N 3.22Å; S3-E245 WeakPolarHBondContact CA-OE1 3.43Å
4	C	27	Very low	27.1	Very low	71 Å²	71	135.5 Å²	135.5	48%	0.48	71%	0.714	S	S	.	*			trans	-84.2	76.2	-175.5	-73	0	0	0	0	110.7	L6 E245	C4-L6 PolarHBondContact O-N 3.26Å; C4-E245 PolarHBondContact N-OE1 3.39Å
5	N	26	Very low	27.2	Very low	138 Å²	138	138.9 Å²	138.9	74%	0.738	73%	0.725	S	S	*	*			trans	-65.5	98.4	169.8	-72.8	-35.9	0	0	0	110.2	S3 S7	S3-N5 VanDerWaalsContact C-N 3.32Å; S3-N5 PolarHBondContact O-N 3.22Å; N5-S7 PolarHBondContact O-N 2.99Å
6	L	26.5	Very low	27.4	Very low	120 Å²	120	138.3 Å²	138.3	63%	0.628	73%	0.729	S	S	*	*			trans	-71	95.8	166.1	-90.4	85.7	0	0	0	109.7	C4 V200	C4-L6 PolarHBondContact O-N 3.26Å; L6-V200 HydrophobicContact CD2-CG2 4.34Å
7	S	24.1	Very low	27.4	Very low	102 Å²	102	137.8 Å²	137.8	71%	0.713	73%	0.732	S	S	*	*			trans	-147.4	98	164.8	179.7	0	0	0	0	108.6	N5	N5-S7 PolarHBondContact O-N 2.99Å
8	Y	30.4	Very low	27.6	Very low	220 Å²	220	138.7 Å²	138.7	86%	0.863	74%	0.737	S	S	*	*			trans	-134.9	128.1	166.1	-98.8	-83.6	0	0	0	109.5
9	G	25.8	Very low	27.7	Very low	71 Å²	71	139.7 Å²	139.7	73%	0.732	74%	0.743	S	S	*	*			trans	-87.9	166.8	-173.6	0	0	0	0	0	113.6
10	F	25.5	Very low	28.2	Very low	157 Å²	157	141.7 Å²	141.7	69%	0.689	75%	0.748	S	S	*	*			trans	-63.8	148.8	172.9	-100.1	-104.1	0	0	0	112.5	L12	F10-L12 HydrophobicContact CD1-CD2 4.37Å; F10-L12 HydrophobicContact CD1-CG 4.19Å; F10-L12 HydrophobicContact CE1-CD2 4.44Å
11	I	27	Very low	28.5	Very low	140 Å²	140	142.4 Å²	142.4	72%	0.718	75%	0.752	S	S	*	*			trans	-127.7	114.5	148.2	-60.7	178.6	0	0	0	105.5
12	L	27.2	Very low	28.8	Very low	133 Å²	133	142.6 Å²	142.6	70%	0.696	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-81.9	144.7	162	-73.9	166	0	0	0	107.8	F10 E14	F10-L12 HydrophobicContact CD1-CD2 4.37Å; F10-L12 HydrophobicContact CD1-CG 4.19Å; F10-L12 HydrophobicContact CE1-CD2 4.44Å; L12-E14 PolarHBondContact O-N 3.47Å
13	P	32.2	Very low	29.3	Very low	121 Å²	121	139 Å²	139	79%	0.786	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-71.3	124.6	170.7	-9.2	25.6	0	0	0	109.5
14	E	29.2	Very low	29.8	Very low	184 Å²	184	140.3 Å²	140.3	86%	0.86	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-72.8	146.7	164.2	-72	-179.2	142.1	0	0	110.2	L12 T16	L12-E14 PolarHBondContact O-N 3.47Å; E14-T16 PolarHBondContact O-N 2.95Å
15	E	27.7	Very low	30.3	Very low	187 Å²	187	141.2 Å²	141.2	87%	0.874	77%	0.773	S	S	*	*			trans	-71.5	115.4	176.6	-64	179.8	140.7	0	0	110.3	T17	E15-T17 PolarHBondContact O-N 3.11Å
16	T	31	Very low	30.9	Very low	129 Å²	129	144.2 Å²	144.2	79%	0.791	78%	0.78	S	S	*	*			trans	-82.8	94.8	175.1	53.3	0	0	0	0	111.1	E14	E14-T16 PolarHBondContact O-N 2.95Å
17	T	26.9	Very low	31.3	Very low	129 Å²	129	143.1 Å²	143.1	79%	0.791	78%	0.782	S	S	*	*			trans	-81.4	105.9	160.2	52.8	0	0	0	0	109.8	E15	E15-T17 PolarHBondContact O-N 3.11Å
18	N	32.2	Very low	31.9	Very low	154 Å²	154	149 Å²	149	82%	0.824	79%	0.789	S	S	*	*			trans	-125.4	109.1	165.7	-80.5	-15.5	0	0	0	109
19	N	29.6	Very low	32.2	Very low	159 Å²	159	148 Å²	148	85%	0.85	79%	0.789	S	S	*	*			trans	-82.2	138	153.7	-67	-36.4	0	0	0	107.3
20	E	36.2	Very low	32.5	Very low	179 Å²	179	150.8 Å²	150.8	84%	0.836	79%	0.794	S	S	*	*				180	114.2	125.8	-99	171.6	-162.2	0	0	109.7
21	D	34.2	Very low	33.2	Very low	157 Å²	157	148.3 Å²	148.3	84%	0.84	80%	0.796	S	S	*	*			trans	39.2	112.2	139.2	-53.5	-14.2	0	0	0	120.9
22	D	35.5	Very low	33.7	Very low	161 Å²	161	146.7 Å²	146.7	86%	0.861	80%	0.797	S	S	*	*				-149.5	163	121.8	-149.8	-6.9	0	0	0	112.5
23	V	35.5	Very low	34.2	Very low	130 Å²	130	145.8 Å²	145.8	79%	0.788	80%	0.802	S	S	*	*			trans	-95.4	135.2	-154.6	172.7	0	0	0	0	113.5
24	S	36.7	Very low	34.6	Very low	104 Å²	104	144 Å²	144	73%	0.727	80%	0.798	S	S	*	*				-175.1	111.4	128.7	-166.4	0	0	0	0	116
25	S	36.4	Very low	35.2	Very low	91 Å²	91	141 Å²	141	64%	0.636	80%	0.797	S	S	*	*			trans	25.1	116.3	142.2	70.2	0	0	0	0	122.9
26	K	38.5	Very low	35.7	Very low	200 Å²	200	137 Å²	137	87%	0.87	79%	0.789	S	S	*	*				178.9	127.4	100.7	-96.2	167.8	-177.4	169.7	0	115.1
27	S	34.9	Very low	36.2	Very low	97 Å²	97	135.9 Å²	135.9	68%	0.678	79%	0.787	S	S	*	*			trans	-35.8	149.3	169.7	60.9	0	0	0	0	117.5
28	R	36.7	Very low	36.8	Very low	226 Å²	226	135.1 Å²	135.1	85%	0.853	79%	0.787	S	S	*	*				-171.5	134.2	71.6	-86.5	172.7	-179.6	-173.2	-2.7	114.9
29	K	38.2	Very low	37.2	Very low	198 Å²	198	132.9 Å²	132.9	86%	0.861	78%	0.783	S	S	*	*			trans	43	126.3	141.1	-64.1	-172.1	174.3	-172.3	0	122.5
30	P	32.3	Very low	37.6	Very low	130 Å²	130	131.8 Å²	131.8	84%	0.844	78%	0.782	S	S	*	*			trans	-106.8	159.4	147.8	37.7	-29.3	0	0	0	113
31	S	39.5	Very low	37.7	Very low	105 Å²	105	127.9 Å²	127.9	73%	0.734	78%	0.775	S	S	*	*			trans	-158.8	123.7	168	55.9	0	0	0	0	113.2
32	S	37.2	Very low	37.7	Very low	106 Å²	106	126.4 Å²	126.4	74%	0.741	77%	0.771	S	S	*	*			trans	10.7	145	137.3	57.1	0	0	0	0	118.6
33	S	38.6	Very low	37.7	Very low	115 Å²	115	124.1 Å²	124.1	80%	0.804	77%	0.768	S	S	*	*			cis	173.4	169.2	25.6	27.7	0	0	0	0	107.7
34	A	39.5	Very low	37.6	Very low	84 Å²	84	121.8 Å²	121.8	69%	0.694	77%	0.77	S	S	*	*			cis	-174.4	-176.6	-16.7	0	0	0	0	0	108.3
35	S	41	Very low	37.9	Very low	119 Å²	119	121.8 Å²	121.8	83%	0.832	77%	0.771	S	S	*	*			trans	69.6	150.1	173.6	7.3	0	0	0	0	116.3
36	S	39.9	Very low	38.2	Very low	103 Å²	103	122.6 Å²	122.6	72%	0.72	77%	0.771	S	S	*	*			cis	-162.6	140.9	3.5	44	0	0	0	0	113.7
37	S	40.2	Very low	38.7	Very low	107 Å²	107	118.2 Å²	118.2	75%	0.748	77%	0.766	S	S	*	*			trans	44.3	114	144.5	63.3	0	0	0	0	123.6
38	S	40.1	Very low	39	Very low	113 Å²	113	116.7 Å²	116.7	79%	0.79	76%	0.759	S	S	*	*				168.3	101.3	123.9	47.1	0	0	0	0	109.1
39	S	39.8	Very low	39.5	Very low	106 Å²	106	109.6 Å²	109.6	74%	0.741	74%	0.744	S	S	*	*				95.2	125.6	77.8	68.8	0	0	0	0	115
40	V	38.8	Very low	40.1	Very low	136 Å²	136	104.1 Å²	104.1	82%	0.824	73%	0.727	S	S	*	*			trans	79.4	133.5	159.1	-137.1	0	0	0	0	120.6
41	S	39.2	Very low	41.5	Very low	97 Å²	97	101.4 Å²	101.4	68%	0.678	71%	0.711	S	S	*	*			trans	105.6	83.4	146	-58.6	0	0	0	0	122.1
42	T	33.4	Very low	42.6	Very low	126 Å²	126	102 Å²	102	77%	0.773	71%	0.706	S	S	*	*				69.6	135.1	117.7	-35.2	0	0	0	0	123.1
43	S	36.1	Very low	44.3	Very low	113 Å²	113	99.2 Å²	99.2	79%	0.79	69%	0.686	S	S	*	*			trans	70.7	129.3	152.3	48.6	0	0	0	0	120.4
44	G	33.3	Very low	46.2	Very low	81 Å²	81	96.3 Å²	96.3	84%	0.835	67%	0.669	S	S	*	*			trans	-94.6	144.7	-177.8	0	0	0	0	0	114.8
45	S	42.1	Very low	48.3	Very low	105 Å²	105	94.1 Å²	94.1	73%	0.734	65%	0.649	S	S	*	*			trans	-140	16.1	178.4	61.7	0	0	0	0	113.9
46	V	42.2	Very low	50.7	Low	107 Å²	107	91.6 Å²	91.6	65%	0.648	62%	0.623	S	S	*	*			trans	-84.9	-20	-162.5	-172	0	0	0	0	114.4	S49 T50	V46-S49 PolarHBondContact O-OG 3.38Å; V46-T50 PolarHBondContact O-OG1 3.24Å
47	S	49	Very low	53.1	Low	109 Å²	109	92.6 Å²	92.6	76%	0.762	62%	0.615	S	S	*	*	H	α-helix	trans	-77.9	-28	-170.6	-48.5	0	0	0	0	115
48	A	42.2	Very low	55.6	Low	65 Å²	65	91.7 Å²	91.7	54%	0.537	60%	0.599	S	S	.	*	H	α-helix	trans	-85.9	-30.9	-172.6	0	0	0	0	0	114.2	S51	A48-S51 PolarHBondContact O-OG 3.01Å; A48-S51 VanDerWaalsContact O-OG 3.13Å
49	S	47.1	Very low	58.3	Low	76 Å²	76	86.5 Å²	86.5	53%	0.531	56%	0.562	S	S	.	*	H	α-helix	trans	-69.8	-36.2	176.2	52.4	0	0	0	0	111.8	V46 S53	V46-S49 PolarHBondContact O-OG 3.38Å; S49-S53 WeakPolarHBondContact O-CB 3.49Å; S49-S53 PolarHBondContact O-N 3.07Å
50	T	49.7	Very low	61	Low	83 Å²	83	82.7 Å²	82.7	51%	0.509	53%	0.532	S	S	.	.	H	α-helix	trans	-63.3	-45.8	179.8	-53.1	0	0	0	0	111.9	V46 S53 A54	V46-T50 PolarHBondContact O-OG1 3.24Å; T50-S53 PolarHBondContact O-N 3.22Å; T50-S53 PolarHBondContact O-OG 3.09Å; T50-A54 PolarHBondContact O-N 3.02Å
51	S	62.5	Low	63.7	Low	73 Å²	73	81.2 Å²	81.2	51%	0.51	52%	0.516	S	S	.	.	H	α-helix	trans	-67.1	-41.9	-178.9	59.3	0	0	0	0	113	A48 S53 A54 S55	A48-S51 PolarHBondContact O-OG 3.01Å; A48-S51 VanDerWaalsContact O-OG 3.13Å; S51-S53 VanDerWaalsContact C-N 3.31Å; S51-S53 PolarHBondContact O-N 3.21Å; S51-A54 PolarHBondContact O-N 3.43Å; S51-A54 VanDerWaalsContact O-N 3.15Å; S51-S55 PolarHBondContact O-N 3.19Å; S51-S55 PolarHBondContact O-OG 3.33Å
52	L	63.8	Low	66.4	Low	117 Å²	117	76.7 Å²	76.7	61%	0.613	48%	0.484	S	S	*	.	H	α-helix	trans	-61.9	-37.8	172.8	-70.7	170.4	0	0	0	112	A54 S55 F56	L52-A54 VanDerWaalsContact C-N 3.31Å; L52-A54 PolarHBondContact O-N 3.38Å; L52-S55 PolarHBondContact O-OG 3.44Å; L52-F56 WeakPolarHBondContact O-CB 3.47Å; L52-F56 PolarHBondContact O-N 2.86Å
53	S	72.2	Confident	69.4	Low	48 Å²	48	70.8 Å²	70.8	34%	0.336	45%	0.448	S	S	.	.	H	α-helix	trans	-67.3	-32.1	174.9	85.8	0	0	0	0	112.7	S49 T50 S51 K57	S49-S53 WeakPolarHBondContact O-CB 3.49Å; S49-S53 PolarHBondContact O-N 3.07Å; T50-S53 PolarHBondContact O-N 3.22Å; T50-S53 PolarHBondContact O-OG 3.09Å; S51-S53 VanDerWaalsContact C-N 3.31Å; S51-S53 PolarHBondContact O-N 3.21Å; S53-K57 WeakPolarHBondContact O-CB 3.49Å; S53-K57 WeakPolarHBondContact O-CD 3.33Å; S53-K57 WeakPolarHBondContact O-CG 3.48Å; S53-K57 PolarHBondContact O-N 2.92Å; S53-K57 VanDerWaalsContact O-N 3.09Å
54	A	78.4	Confident	72.3	Confident	54 Å²	54	69.3 Å²	69.3	45%	0.446	43%	0.427	S	S	.	.	H	α-helix	trans	-74.5	-46.9	180	0	0	0	0	0	111.8	T50 S51 L52 F56 K57 Q58	T50-A54 PolarHBondContact O-N 3.02Å; S51-A54 PolarHBondContact O-N 3.43Å; S51-A54 VanDerWaalsContact O-N 3.15Å; L52-A54 VanDerWaalsContact C-N 3.31Å; L52-A54 PolarHBondContact O-N 3.38Å; A54-F56 VanDerWaalsContact C-N 3.34Å; A54-F56 PolarHBondContact O-N 3.15Å; A54-K57 PolarHBondContact O-N 3.07Å; A54-Q58 PolarHBondContact O-N 2.87Å
55	S	83.2	Confident	75.3	Confident	39 Å²	39	69 Å²	69	27%	0.273	40%	0.404	S	S	.	.	H	α-helix	trans	-62.1	-41.5	176.3	60.6	0	0	0	0	111.7	S51 L52 Q58 R59	S51-S55 PolarHBondContact O-N 3.19Å; S51-S55 PolarHBondContact O-OG 3.33Å; L52-S55 PolarHBondContact O-OG 3.44Å; S55-Q58 PolarHBondContact O-N 2.87Å; S55-R59 PolarHBondContact O-N 3.23Å
56	F	91.2	Very high	78	Confident	65 Å²	65	64 Å²	64	29%	0.285	37%	0.369	S	S	.	.	H	α-helix	trans	-62.1	-45	174.8	-179.2	-95.3	0	0	0	112.9	L52 A54 Q58 R59 K60 D127 N131	L52-F56 WeakPolarHBondContact O-CB 3.47Å; L52-F56 PolarHBondContact O-N 2.86Å; A54-F56 VanDerWaalsContact C-N 3.34Å; A54-F56 PolarHBondContact O-N 3.15Å; F56-Q58 VanDerWaalsContact C-N 3.31Å; F56-Q58 PolarHBondContact O-N 3.36Å; F56-R59 PolarHBondContact O-N 3.32Å; F56-K60 WeakPolarHBondContact O-CB 3.06Å; F56-K60 PolarHBondContact O-N 3Å; F56-D127 VanDerWaalsContact CE1-O 3.22Å; F56-D127 WeakPolarHBondContact CE1-O 3.44Å; F56-D127 WeakPolarHBondContact CZ-O 3.5Å; F56-N131 WeakPolarHBondContact CE2-OD1 3.46Å
57	K	91.4	Very high	80.6	Confident	125 Å²	125	59.4 Å²	59.4	54%	0.543	34%	0.341	S	S	.	.	H	α-helix	trans	-59.1	-43.5	173.8	-78.4	169.7	-176.8	175.5	0	111.2	S53 A54 K60 H61	S53-K57 WeakPolarHBondContact O-CB 3.49Å; S53-K57 WeakPolarHBondContact O-CD 3.33Å; S53-K57 WeakPolarHBondContact O-CG 3.48Å; S53-K57 PolarHBondContact O-N 2.92Å; S53-K57 VanDerWaalsContact O-N 3.09Å; A54-K57 PolarHBondContact O-N 3.07Å; K57-K60 WeakPolarHBondContact O-CB 3.23Å; K57-K60 PolarHBondContact O-N 3.43Å; K57-H61 PolarHBondContact O-N 3.08Å; K57-H61 VanDerWaalsContact O-N 3.11Å; K57-H61 PolarHBondContact O-ND1 3.49Å
58	Q	93	Very high	82.9	Confident	88 Å²	88	60.7 Å²	60.7	41%	0.411	33%	0.333	S	S	.	.	H	α-helix	trans	-64.2	-47.9	178.1	-166.5	65.9	-0	0	0	111.4	A54 S55 F56 K60 H61 V62 V212	A54-Q58 PolarHBondContact O-N 2.87Å; S55-Q58 PolarHBondContact O-N 2.87Å; F56-Q58 VanDerWaalsContact C-N 3.31Å; F56-Q58 PolarHBondContact O-N 3.36Å; Q58-K60 VanDerWaalsContact C-N 3.31Å; Q58-K60 PolarHBondContact O-N 3.23Å; Q58-H61 WeakPolarHBondContact O-CB 3.43Å; Q58-H61 PolarHBondContact O-N 2.92Å; Q58-V62 WeakPolarHBondContact O-CG2 3.44Å; Q58-V62 PolarHBondContact O-N 2.97Å; Q58-V212 HydrophobicContact CB-CB 4.45Å; Q58-V212 HydrophobicContact CB-CG1 4.16Å; Q58-V212 HydrophobicContact CG-CB 4.37Å; Q58-V212 HydrophobicContact CG-CG1 3.63Å
59	R	96.2	Very high	85.5	Confident	3 Å²	3	59.1 Å²	59.1	1%	0.011	32%	0.316	C	S	.	.	H	α-helix	trans	-55.3	-44.1	174.2	-175.3	166.9	161.3	82.8	9.3	112	S55 F56 H61 V62 V63 G130 A132 L209 V212 T213 H217 D219	S55-R59 PolarHBondContact O-N 3.23Å; F56-R59 PolarHBondContact O-N 3.32Å; R59-H61 VanDerWaalsContact C-N 3.3Å; R59-H61 PolarHBondContact O-N 2.93Å; R59-V62 PolarHBondContact O-N 3.5Å; R59-V63 HydrophobicContact CG-CG2 4.21Å; R59-V63 WeakPolarHBondContact O-CB 3.47Å; R59-V63 WeakPolarHBondContact O-CG2 3.5Å; R59-V63 PolarHBondContact O-N 2.87Å; R59-G130 VanDerWaalsContact CD-O 3.27Å; R59-G130 WeakPolarHBondContact CD-O 3.44Å; R59-G130 PolarHBondContact NE-O 2.98Å; R59-A132 PolarHBondContact NH2-O 2.96Å; R59-L209 HydrophobicContact CG-CD1 4.11Å; R59-V212 HydrophobicContact CB-CB 4.46Å; R59-V212 HydrophobicContact CB-CG2 3.79Å; R59-V212 HydrophobicContact CG-CG2 4.29Å; R59-T213 PolarHBondContact NH1-OG1 3.3Å; R59-H217 PolarHBondContact NE-NE2 2.75Å; R59-H217 VanDerWaalsContact NE-NE2 3.13Å; R59-H217 PolarHBondContact NH2-CE1 3.49Å; R59-H217 VanDerWaalsContact NH2-CE1 3.31Å; R59-D219 IonicContact CZ-OD2 3.64Å; R59-D219 IonicContact NH1-OD2 3.59Å; R59-D219 IonicContact NH2-OD2 2.63Å; R59-D219 PolarHBondContact NH2-OD2 3.28Å
60	K	95.7	Very high	87.9	Confident	27 Å²	27	55.7 Å²	55.7	12%	0.117	29%	0.292	C	S	.	.	H	α-helix	trans	-56.4	-39.3	173.8	166.4	172.7	164.1	170.6	0	112.7	F56 K57 Q58 K64 N126 D127 L129	F56-K60 WeakPolarHBondContact O-CB 3.06Å; F56-K60 PolarHBondContact O-N 3Å; K57-K60 WeakPolarHBondContact O-CB 3.23Å; K57-K60 PolarHBondContact O-N 3.43Å; Q58-K60 VanDerWaalsContact C-N 3.31Å; Q58-K60 PolarHBondContact O-N 3.23Å; K60-K64 WeakPolarHBondContact O-CG 3.49Å; K60-K64 PolarHBondContact O-N 3.15Å; K60-K64 VanDerWaalsContact O-N 3.17Å; K60-N126 WeakPolarHBondContact CD-O 3.19Å; K60-N126 WeakPolarHBondContact CE-O 3.39Å; K60-N126 PolarHBondContact NZ-O 3.4Å; K60-D127 IonicContact NZ-OD1 2.82Å; K60-D127 PolarHBondContact NZ-OD1 3.42Å; K60-L129 HydrophobicContact CG-CB 4.27Å
61	H	95.6	Very high	90.2	Very high	105 Å²	105	53.1 Å²	53.1	49%	0.486	28%	0.28	S	S	.	.	H	α-helix	trans	-69.1	-45	175.6	-65	124.4	0	0	0	112.5	K57 Q58 R59 V63 K64 E65	K57-H61 PolarHBondContact O-N 3.08Å; K57-H61 VanDerWaalsContact O-N 3.11Å; K57-H61 PolarHBondContact O-ND1 3.49Å; Q58-H61 WeakPolarHBondContact O-CB 3.43Å; Q58-H61 PolarHBondContact O-N 2.92Å; R59-H61 VanDerWaalsContact C-N 3.3Å; R59-H61 PolarHBondContact O-N 2.93Å; H61-V63 VanDerWaalsContact C-N 3.35Å; H61-V63 PolarHBondContact O-N 3.14Å; H61-K64 PolarHBondContact O-N 3.38Å; H61-E65 PolarHBondContact O-N 3.36Å
62	V	96.3	Very high	91.8	Very high	2 Å²	2	53 Å²	53	1%	0.012	27%	0.273	C	S	.	.	H	α-helix	trans	-62.9	-41.8	178.7	-173.1	0	0	0	0	111.3	Q58 R59 K64 E65 L66 L205 L208 L209 V212	Q58-V62 WeakPolarHBondContact O-CG2 3.44Å; Q58-V62 PolarHBondContact O-N 2.97Å; R59-V62 PolarHBondContact O-N 3.5Å; V62-K64 PolarHBondContact O-N 3.03Å; V62-E65 PolarHBondContact O-N 3.38Å; V62-L66 WeakPolarHBondContact O-CB 3.48Å; V62-L66 PolarHBondContact O-N 3.21Å; V62-L205 HydrophobicContact CG1-CD2 4.48Å; V62-L208 HydrophobicContact CG2-CD2 3.64Å; V62-L208 HydrophobicContact CG2-CG 3.69Å; V62-L209 HydrophobicContact CB-CD1 4Å; V62-L209 HydrophobicContact CG1-CB 3.86Å; V62-L209 HydrophobicContact CG1-CD1 3.8Å; V62-L209 HydrophobicContact CG1-CG 4.39Å; V62-V212 HydrophobicContact CG2-CG2 4.22Å
63	V	97	Very high	93.5	Very high	1 Å²	1	48 Å²	48	1%	0.006	25%	0.247	C	C	.	.	H	α-helix	trans	-57	-49.1	173.8	168.7	0	0	0	0	110.9	R59 H61 L66 V67 A132 I134 L209	R59-V63 HydrophobicContact CG-CG2 4.21Å; R59-V63 WeakPolarHBondContact O-CB 3.47Å; R59-V63 WeakPolarHBondContact O-CG2 3.5Å; R59-V63 PolarHBondContact O-N 2.87Å; H61-V63 VanDerWaalsContact C-N 3.35Å; H61-V63 PolarHBondContact O-N 3.14Å; V63-L66 PolarHBondContact O-N 3.13Å; V63-V67 WeakPolarHBondContact O-CG2 3.27Å; V63-V67 PolarHBondContact O-N 3.21Å; V63-V67 VanDerWaalsContact O-N 3.1Å; V63-A132 HydrophobicContact CG1-CB 4.34Å; V63-I134 HydrophobicContact CB-CD1 4.08Å; V63-I134 HydrophobicContact CG1-CD1 4.21Å; V63-I134 HydrophobicContact CG1-CG2 4.1Å; V63-I134 HydrophobicContact CG2-CD1 3.68Å; V63-I134 HydrophobicContact CG2-CG1 4.09Å; V63-L209 HydrophobicContact CG2-CD1 4.2Å
64	K	96.3	Very high	94.7	Very high	82 Å²	82	46 Å²	46	36%	0.357	23%	0.232	S	C	.	.	H	α-helix	trans	-61.5	-45.2	177.6	-77.9	-178.4	172.6	-161.7	0	112.7	K60 H61 V62 K68 N126 L129	K60-K64 WeakPolarHBondContact O-CG 3.49Å; K60-K64 PolarHBondContact O-N 3.15Å; K60-K64 VanDerWaalsContact O-N 3.17Å; H61-K64 PolarHBondContact O-N 3.38Å; V62-K64 PolarHBondContact O-N 3.03Å; K64-K68 VanDerWaalsContact O-CB 3.23Å; K64-K68 WeakPolarHBondContact O-CB 3.34Å; K64-K68 PolarHBondContact O-N 3.45Å; K64-N126 VanDerWaalsContact CE-OD1 3.23Å; K64-N126 WeakPolarHBondContact CE-OD1 3.39Å; K64-N126 PolarHBondContact NZ-OD1 3.44Å; K64-L129 HydrophobicContact CD-CD1 4.42Å; K64-L129 VanDerWaalsContact CE-CD1 3.46Å; K64-L129 HydrophobicContact CG-CD1 4.08Å
65	E	97.3	Very high	95.6	Very high	75 Å²	75	46.2 Å²	46.2	35%	0.35	23%	0.23	S	C	.	.	H	α-helix	trans	-63.8	-42.6	179.6	-169.6	-175.2	161.8	0	0	111.2	H61 V62 T69 K201 L205	H61-E65 PolarHBondContact O-N 3.36Å; V62-E65 PolarHBondContact O-N 3.38Å; E65-T69 HydrophobicContact CG-CG2 4.08Å; E65-T69 VanDerWaalsContact O-CB 3.3Å; E65-T69 WeakPolarHBondContact O-CB 3.36Å; E65-T69 VanDerWaalsContact O-CG2 3.23Å; E65-T69 WeakPolarHBondContact O-CG2 3.48Å; E65-T69 PolarHBondContact O-N 2.96Å; E65-T69 PolarHBondContact O-OG1 3.45Å; E65-K201 WeakPolarHBondContact OE1-CE 3.4Å; E65-K201 IonicContact OE1-NZ 2.72Å; E65-K201 PolarHBondContact OE1-NZ 2.66Å; E65-L205 HydrophobicContact CB-CD2 4.31Å; E65-L205 HydrophobicContact CG-CD2 4.05Å
66	L	97.2	Very high	96.1	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.5	-48.3	179.6	-168.7	153.1	0	0	0	111.5	V62 V63 T69 Q70 L117 I134 I138 L205 F206	V62-L66 WeakPolarHBondContact O-CB 3.48Å; V62-L66 PolarHBondContact O-N 3.21Å; V63-L66 PolarHBondContact O-N 3.13Å; L66-T69 PolarHBondContact O-OG1 3.49Å; L66-Q70 WeakPolarHBondContact O-CB 3.3Å; L66-Q70 PolarHBondContact O-N 3.23Å; L66-L117 HydrophobicContact CD2-CD1 3.99Å; L66-I134 HydrophobicContact CB-CD1 4.37Å; L66-I134 HydrophobicContact CD1-CD1 4.16Å; L66-I134 HydrophobicContact CD2-CD1 4.35Å; L66-I138 HydrophobicContact CD1-CD1 4.49Å; L66-I138 HydrophobicContact CD2-CD1 3.54Å; L66-L205 HydrophobicContact CB-CD1 4.29Å; L66-L205 HydrophobicContact CD1-CB 4.21Å; L66-L205 HydrophobicContact CG-CD1 4.3Å; L66-F206 HydrophobicContact CD1-CD2 4.15Å; L66-F206 HydrophobicContact CD1-CE2 3.71Å; L66-F206 HydrophobicContact CD1-CZ 3.95Å
67	V	97	Very high	96.4	Very high	11 Å²	11	42.6 Å²	42.6	7%	0.067	21%	0.211	C	C	.	.	H	α-helix	trans	-67.5	-45.9	-180	177.9	0	0	0	0	111.4	V63 Q70 A71 L117 I121 I134	V63-V67 WeakPolarHBondContact O-CG2 3.27Å; V63-V67 PolarHBondContact O-N 3.21Å; V63-V67 VanDerWaalsContact O-N 3.1Å; V67-Q70 PolarHBondContact O-N 3.14Å; V67-A71 PolarHBondContact O-N 3.41Å; V67-A71 VanDerWaalsContact O-N 3.09Å; V67-L117 HydrophobicContact CG1-CB 4.39Å; V67-L117 HydrophobicContact CG2-CB 4.19Å; V67-L117 HydrophobicContact CG2-CD1 4.38Å; V67-L117 HydrophobicContact CG2-CD2 4.24Å; V67-I121 HydrophobicContact CG1-CD1 3.98Å; V67-I121 HydrophobicContact CG2-CG2 3.99Å; V67-I134 HydrophobicContact CG2-CG2 4.47Å
68	K	97.3	Very high	96.7	Very high	136 Å²	136	40.1 Å²	40.1	59%	0.591	20%	0.2	S	C	*	.	H	α-helix	trans	-59.2	-53.4	177.1	-173.3	-165.7	168.8	-172.5	0	111	K64 Q70 A71 D72	K64-K68 VanDerWaalsContact O-CB 3.23Å; K64-K68 WeakPolarHBondContact O-CB 3.34Å; K64-K68 PolarHBondContact O-N 3.45Å; K68-Q70 PolarHBondContact O-N 2.69Å; K68-A71 PolarHBondContact O-N 2.77Å; K68-D72 WeakPolarHBondContact CE-OD2 3.36Å; K68-D72 VanDerWaalsContact O-CG 3.24Å; K68-D72 PolarHBondContact O-N 2.92Å
69	T	97.4	Very high	96.8	Very high	31 Å²	31	37.6 Å²	37.6	19%	0.19	19%	0.19	C	C	.	.	H	α-helix	trans	-68.6	-18.7	-177.4	61.7	0	0	0	0	113.4	E65 L66 F73 R198	E65-T69 HydrophobicContact CG-CG2 4.08Å; E65-T69 VanDerWaalsContact O-CB 3.3Å; E65-T69 WeakPolarHBondContact O-CB 3.36Å; E65-T69 VanDerWaalsContact O-CG2 3.23Å; E65-T69 WeakPolarHBondContact O-CG2 3.48Å; E65-T69 PolarHBondContact O-N 2.96Å; E65-T69 PolarHBondContact O-OG1 3.45Å; L66-T69 PolarHBondContact O-OG1 3.49Å; T69-F73 VanDerWaalsContact O-CB 3.25Å; T69-F73 WeakPolarHBondContact O-CB 3.3Å; T69-F73 PolarHBondContact O-N 2.89Å; T69-F73 VanDerWaalsContact O-N 3.15Å; T69-R198 PolarHBondContact O-NH1 3.24Å; T69-R198 PolarHBondContact OG1-NH1 2.89Å
70	Q	97.6	Very high	96.8	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.019	19%	0.189	C	C	.	.	H	α-helix	trans	-72.4	-46.6	168.2	-175.4	65.2	14.4	0	0	111.1	L66 V67 K68 F73 V74 S110 I113 L117 R198	L66-Q70 WeakPolarHBondContact O-CB 3.3Å; L66-Q70 PolarHBondContact O-N 3.23Å; V67-Q70 PolarHBondContact O-N 3.14Å; K68-Q70 PolarHBondContact O-N 2.69Å; Q70-F73 PolarHBondContact O-N 2.89Å; Q70-V74 WeakPolarHBondContact O-CG2 3.49Å; Q70-V74 PolarHBondContact O-N 2.9Å; Q70-S110 PolarHBondContact NE2-O 2.83Å; Q70-I113 HydrophobicContact CG-CG2 4.3Å; Q70-L117 HydrophobicContact CB-CD1 4.24Å; Q70-L117 HydrophobicContact CG-CD1 4.1Å; Q70-R198 VanDerWaalsContact CA-NH2 3.3Å
71	A	97.5	Very high	96.8	Very high	30 Å²	30	37 Å²	37	25%	0.248	19%	0.187	C	C	.	.	H	α-helix	trans	-63.2	-43.3	176.5	0	0	0	0	0	111.8	V67 K68 F73 V74 S75	V67-A71 PolarHBondContact O-N 3.41Å; V67-A71 VanDerWaalsContact O-N 3.09Å; K68-A71 PolarHBondContact O-N 2.77Å; A71-F73 PolarHBondContact O-N 3.08Å; A71-V74 PolarHBondContact O-N 3.26Å; A71-S75 WeakPolarHBondContact O-CB 3.46Å; A71-S75 PolarHBondContact O-N 2.82Å
72	D	97.1	Very high	96.8	Very high	71 Å²	71	36.3 Å²	36.3	38%	0.38	19%	0.187	S	C	.	.	H	α-helix	trans	-58.5	-47.4	175	-62.9	-22.7	0	0	0	110.7	K68 V74 S75 D76	K68-D72 WeakPolarHBondContact CE-OD2 3.36Å; K68-D72 VanDerWaalsContact O-CG 3.24Å; K68-D72 PolarHBondContact O-N 2.92Å; D72-V74 PolarHBondContact O-N 3.3Å; D72-S75 PolarHBondContact O-N 3.38Å; D72-D76 WeakPolarHBondContact O-CB 3.39Å; D72-D76 VanDerWaalsContact O-CG 3.32Å; D72-D76 PolarHBondContact O-N 3.23Å
73	F	97.9	Very high	96.7	Very high	12 Å²	12	36.3 Å²	36.3	5%	0.053	19%	0.187	C	C	.	.	H	α-helix	trans	-61.8	-43	177.3	173.7	-103.7	0	0	0	113	T69 Q70 A71 D76 M77 L106 K194 P195 R198	T69-F73 VanDerWaalsContact O-CB 3.25Å; T69-F73 WeakPolarHBondContact O-CB 3.3Å; T69-F73 PolarHBondContact O-N 2.89Å; T69-F73 VanDerWaalsContact O-N 3.15Å; Q70-F73 PolarHBondContact O-N 2.89Å; A71-F73 PolarHBondContact O-N 3.08Å; F73-D76 PolarHBondContact O-N 2.95Å; F73-M77 HydrophobicContact CD2-CG 4.09Å; F73-M77 HydrophobicContact CE1-CG 4.33Å; F73-M77 HydrophobicContact CE2-CG 3.65Å; F73-M77 HydrophobicContact CE2-SD 4.16Å; F73-M77 HydrophobicContact CZ-CG 3.79Å; F73-M77 VanDerWaalsContact O-CG 3.3Å; F73-M77 WeakPolarHBondContact O-CG 3.44Å; F73-M77 PolarHBondContact O-N 2.87Å; F73-L106 HydrophobicContact CZ-CD2 4.24Å; F73-K194 HydrophobicContact CD2-CB 4.46Å; F73-K194 HydrophobicContact CE2-CB 4.3Å; F73-P195 HydrophobicContact CE2-CB 4.48Å; F73-P195 HydrophobicContact CE2-CG 4.09Å; F73-P195 HydrophobicContact CZ-CB 4.38Å; F73-P195 HydrophobicContact CZ-CG 4.13Å; F73-R198 HydrophobicContact CD1-CG 4.18Å; F73-R198 HydrophobicContact CD2-CB 4.16Å; F73-R198 HydrophobicContact CD2-CG 4.13Å; F73-R198 HydrophobicContact CE1-CG 4.23Å; F73-R198 HydrophobicContact CE2-CB 3.94Å; F73-R198 HydrophobicContact CE2-CG 4.18Å; F73-R198 HydrophobicContact CG-CG 4.13Å; F73-R198 HydrophobicContact CZ-CB 4.25Å; F73-R198 HydrophobicContact CZ-CG 4.23Å
74	V	97.9	Very high	96.5	Very high	5 Å²	5	36.4 Å²	36.4	3%	0.03	19%	0.187	C	C	.	.	H	α-helix	trans	-65.2	-43.3	177.4	169.4	0	0	0	0	111.2	Q70 A71 D72 M77 K78 S110 D111	Q70-V74 WeakPolarHBondContact O-CG2 3.49Å; Q70-V74 PolarHBondContact O-N 2.9Å; A71-V74 PolarHBondContact O-N 3.26Å; D72-V74 PolarHBondContact O-N 3.3Å; V74-M77 PolarHBondContact O-N 3.39Å; V74-K78 HydrophobicContact CG1-CD 3.97Å; V74-K78 HydrophobicContact CG1-CG 4.37Å; V74-K78 WeakPolarHBondContact O-CB 3.42Å; V74-K78 WeakPolarHBondContact O-CG 3.43Å; V74-K78 PolarHBondContact O-N 3.32Å; V74-S110 VanDerWaalsContact CG2-C 3.44Å; V74-S110 VanDerWaalsContact CG2-O 3.3Å; V74-S110 WeakPolarHBondContact CG2-O 3.46Å; V74-D111 HydrophobicContact CG1-CB 3.99Å; V74-D111 WeakPolarHBondContact CG1-OD1 3.2Å
75	S	96.6	Very high	96.4	Very high	58 Å²	58	37 Å²	37	41%	0.406	20%	0.195	S	C	.	.	H	α-helix	trans	-60.5	-49.1	175.7	-175.7	0	0	0	0	111.2	A71 D72 M77 K78 N79	A71-S75 WeakPolarHBondContact O-CB 3.46Å; A71-S75 PolarHBondContact O-N 2.82Å; D72-S75 PolarHBondContact O-N 3.38Å; S75-M77 PolarHBondContact O-N 3Å; S75-K78 PolarHBondContact O-N 2.75Å; S75-N79 PolarHBondContact O-N 2.68Å; S75-N79 PolarHBondContact O-ND2 3.38Å; S75-N79 VanDerWaalsContact O-ND2 3.09Å
76	D	95.6	Very high	96.1	Very high	28 Å²	28	36.8 Å²	36.8	15%	0.15	20%	0.201	C	C	.	.	H	α-helix	trans	-53.6	-51	176.9	-77.9	-9.4	0	0	0	112.2	D72 F73 N79 V80 R182 K194	D72-D76 WeakPolarHBondContact O-CB 3.39Å; D72-D76 VanDerWaalsContact O-CG 3.32Å; D72-D76 PolarHBondContact O-N 3.23Å; F73-D76 PolarHBondContact O-N 2.95Å; D76-N79 PolarHBondContact O-N 3.15Å; D76-V80 WeakPolarHBondContact O-CG2 3.47Å; D76-V80 PolarHBondContact O-N 3.3Å; D76-V80 VanDerWaalsContact O-N 3.16Å; D76-R182 IonicContact OD1-CZ 2.79Å; D76-R182 IonicContact OD1-NH1 2.79Å; D76-R182 PolarHBondContact OD1-NH1 2.89Å; D76-R182 IonicContact OD1-NH2 3.39Å; D76-R182 PolarHBondContact OD1-NH2 3.23Å; D76-K194 HydrophobicContact CB-CD 4.32Å; D76-K194 VanDerWaalsContact CG-NZ 3.34Å; D76-K194 IonicContact OD1-NZ 2.65Å; D76-K194 IonicContact OD2-NZ 2.8Å; D76-K194 PolarHBondContact OD2-NZ 3.28Å
77	M	96.9	Very high	95.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-75.7	-29	-176.4	-60.4	-63.6	90.2	0	0	113.4	F73 V74 S75 V80 L81 L103 V107 K194 P195	F73-M77 HydrophobicContact CD2-CG 4.09Å; F73-M77 HydrophobicContact CE1-CG 4.33Å; F73-M77 HydrophobicContact CE2-CG 3.65Å; F73-M77 HydrophobicContact CE2-SD 4.16Å; F73-M77 HydrophobicContact CZ-CG 3.79Å; F73-M77 VanDerWaalsContact O-CG 3.3Å; F73-M77 WeakPolarHBondContact O-CG 3.44Å; F73-M77 PolarHBondContact O-N 2.87Å; V74-M77 PolarHBondContact O-N 3.39Å; S75-M77 PolarHBondContact O-N 3Å; M77-V80 HydrophobicContact CE-CG2 4.07Å; M77-V80 PolarHBondContact O-N 2.94Å; M77-L81 PolarHBondContact O-N 3.06Å; M77-L81 VanDerWaalsContact O-N 3.09Å; M77-L103 HydrophobicContact CB-CD1 4.25Å; M77-L103 HydrophobicContact CG-CD1 4.28Å; M77-L103 HydrophobicContact SD-CD1 3.9Å; M77-V107 HydrophobicContact CB-CG2 3.41Å; M77-V107 VanDerWaalsContact CB-CG2 3.41Å; M77-V107 HydrophobicContact CG-CG2 4.5Å; M77-K194 HydrophobicContact CE-CB 4.02Å; M77-K194 HydrophobicContact CE-CD 3.84Å; M77-K194 HydrophobicContact CE-CG 4.45Å; M77-K194 HydrophobicContact SD-CB 4.48Å; M77-P195 HydrophobicContact SD-CG 3.76Å
78	K	96.9	Very high	94.8	Very high	74 Å²	74	43.1 Å²	43.1	32%	0.322	25%	0.245	S	C	.	.	H	α-helix	trans	-63.6	-44	169.6	-82	-180	170.6	176.6	0	111.5	V74 S75 V80 L81 I82 V107 D111	V74-K78 HydrophobicContact CG1-CD 3.97Å; V74-K78 HydrophobicContact CG1-CG 4.37Å; V74-K78 WeakPolarHBondContact O-CB 3.42Å; V74-K78 WeakPolarHBondContact O-CG 3.43Å; V74-K78 PolarHBondContact O-N 3.32Å; S75-K78 PolarHBondContact O-N 2.75Å; K78-V80 VanDerWaalsContact C-N 3.31Å; K78-V80 PolarHBondContact O-N 3.32Å; K78-L81 PolarHBondContact O-N 3.42Å; K78-L81 VanDerWaalsContact O-N 3.14Å; K78-I82 WeakPolarHBondContact O-CG1 3.33Å; K78-I82 PolarHBondContact O-N 3.05Å; K78-V107 HydrophobicContact CG-CG1 3.6Å; K78-D111 WeakPolarHBondContact CE-OD2 3.41Å; K78-D111 IonicContact NZ-OD1 2.67Å; K78-D111 PolarHBondContact NZ-OD1 3.23Å; K78-D111 IonicContact NZ-OD2 2.78Å; K78-D111 PolarHBondContact NZ-OD2 3.18Å
79	N	95.3	Very high	93.5	Very high	35 Å²	35	39.4 Å²	39.4	19%	0.187	24%	0.236	C	C	.	.	H	α-helix	trans	-63.4	-37.9	177.8	-62.6	-23.6	0	0	0	111.3	S75 D76 A83 L178	S75-N79 PolarHBondContact O-N 2.68Å; S75-N79 PolarHBondContact O-ND2 3.38Å; S75-N79 VanDerWaalsContact O-ND2 3.09Å; D76-N79 PolarHBondContact O-N 3.15Å; N79-A83 VanDerWaalsContact O-CB 3.25Å; N79-A83 WeakPolarHBondContact O-CB 3.28Å; N79-A83 PolarHBondContact O-N 3.34Å; N79-L178 HydrophobicContact CB-CD1 4.2Å
80	V	95.8	Very high	92.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.5	-48.1	170.9	173.8	0	0	0	0	111.3	D76 M77 K78 A83 F84 L100 L103 L178 E191 L192	D76-V80 WeakPolarHBondContact O-CG2 3.47Å; D76-V80 PolarHBondContact O-N 3.3Å; D76-V80 VanDerWaalsContact O-N 3.16Å; M77-V80 HydrophobicContact CE-CG2 4.07Å; M77-V80 PolarHBondContact O-N 2.94Å; K78-V80 VanDerWaalsContact C-N 3.31Å; K78-V80 PolarHBondContact O-N 3.32Å; V80-A83 PolarHBondContact O-N 2.7Å; V80-F84 HydrophobicContact CG1-CD2 4.22Å; V80-F84 HydrophobicContact CG1-CE2 4.49Å; V80-F84 VanDerWaalsContact O-CD2 3.26Å; V80-F84 WeakPolarHBondContact O-CD2 3.33Å; V80-F84 PolarHBondContact O-N 3.05Å; V80-F84 VanDerWaalsContact O-N 3.17Å; V80-L100 HydrophobicContact CG1-CD2 4.46Å; V80-L103 HydrophobicContact CB-CD2 4.46Å; V80-L103 HydrophobicContact CG1-CD2 3.88Å; V80-L178 HydrophobicContact CG2-CD2 3.94Å; V80-E191 HydrophobicContact CG2-CB 3.98Å; V80-E191 HydrophobicContact CG2-CG 4.5Å; V80-L192 HydrophobicContact CG1-CD2 4.13Å
81	L	96	Very high	91.7	Very high	16 Å²	16	45.8 Å²	45.8	8%	0.084	28%	0.275	C	S	.	.	H	α-helix	trans	-62.5	-48.7	179	-69.3	176	0	0	0	112.1	M77 K78 A83 F84 D85 L103 D104 V107	M77-L81 PolarHBondContact O-N 3.06Å; M77-L81 VanDerWaalsContact O-N 3.09Å; K78-L81 PolarHBondContact O-N 3.42Å; K78-L81 VanDerWaalsContact O-N 3.14Å; L81-A83 VanDerWaalsContact C-N 3.31Å; L81-A83 PolarHBondContact O-N 2.82Å; L81-F84 PolarHBondContact O-N 2.99Å; L81-F84 VanDerWaalsContact O-N 3.07Å; L81-D85 WeakPolarHBondContact O-CB 3.32Å; L81-D85 VanDerWaalsContact O-CG 3.3Å; L81-D85 PolarHBondContact O-N 3.37Å; L81-L103 HydrophobicContact CD2-CB 4.14Å; L81-L103 HydrophobicContact CD2-CD2 3.86Å; L81-L103 HydrophobicContact CD2-CG 3.96Å; L81-L103 HydrophobicContact CG-CD2 4.18Å; L81-L103 HydrophobicContact CG-CG 4.24Å; L81-D104 WeakPolarHBondContact CD2-OD1 3.24Å; L81-V107 HydrophobicContact CD1-CB 3.87Å; L81-V107 HydrophobicContact CD1-CG1 4.11Å; L81-V107 HydrophobicContact CD1-CG2 3.72Å
82	I	95.1	Very high	91.2	Very high	92 Å²	92	47.8 Å²	47.8	47%	0.472	29%	0.285	S	S	.	.	H	α-helix	trans	-57.6	-43.3	178.9	-67	163.7	0	0	0	111.5	K78 F84 S86	K78-I82 WeakPolarHBondContact O-CG1 3.33Å; K78-I82 PolarHBondContact O-N 3.05Å; I82-F84 VanDerWaalsContact C-N 3.3Å; I82-F84 PolarHBondContact O-N 3.35Å; I82-S86 VanDerWaalsContact O-CB 3.31Å; I82-S86 WeakPolarHBondContact O-CB 3.31Å; I82-S86 PolarHBondContact O-N 2.84Å; I82-S86 VanDerWaalsContact O-N 3.14Å; I82-S86 PolarHBondContact O-OG 2.9Å
83	A	94.5	Very high	90.7	Very high	2 Å²	2	50.6 Å²	50.6	2%	0.017	30%	0.295	C	S	.	.	H	α-helix	trans	-65.6	-30.6	178.3	0	0	0	0	0	113.6	N79 V80 L81 S86 N177 L178	N79-A83 VanDerWaalsContact O-CB 3.25Å; N79-A83 WeakPolarHBondContact O-CB 3.28Å; N79-A83 PolarHBondContact O-N 3.34Å; V80-A83 PolarHBondContact O-N 2.7Å; L81-A83 VanDerWaalsContact C-N 3.31Å; L81-A83 PolarHBondContact O-N 2.82Å; A83-S86 PolarHBondContact O-OG 3.49Å; A83-N177 HydrophobicContact CB-CB 3.99Å; A83-N177 VanDerWaalsContact O-CB 3.29Å; A83-N177 WeakPolarHBondContact O-CB 3.25Å; A83-N177 PolarHBondContact O-ND2 3.39Å; A83-L178 HydrophobicContact CB-CB 3.64Å; A83-L178 HydrophobicContact CB-CD1 4.11Å; A83-L178 HydrophobicContact CB-CG 4.44Å
84	F	94.4	Very high	90.2	Very high	2 Å²	2	54 Å²	54	1%	0.009	32%	0.321	C	S	.	.	H	α-helix	trans	-89	-36.2	179.7	-86.4	-98.9	0	0	0	113.3	V80 L81 I82 S86 V87 L99 L100 F170 G174 L188	V80-F84 HydrophobicContact CG1-CD2 4.22Å; V80-F84 HydrophobicContact CG1-CE2 4.49Å; V80-F84 VanDerWaalsContact O-CD2 3.26Å; V80-F84 WeakPolarHBondContact O-CD2 3.33Å; V80-F84 PolarHBondContact O-N 3.05Å; V80-F84 VanDerWaalsContact O-N 3.17Å; L81-F84 PolarHBondContact O-N 2.99Å; L81-F84 VanDerWaalsContact O-N 3.07Å; I82-F84 VanDerWaalsContact C-N 3.3Å; I82-F84 PolarHBondContact O-N 3.35Å; F84-S86 PolarHBondContact O-N 3.45Å; F84-V87 WeakPolarHBondContact O-CB 3.4Å; F84-V87 WeakPolarHBondContact O-CG2 3.31Å; F84-V87 PolarHBondContact O-N 3.11Å; F84-L99 HydrophobicContact CD1-CD2 4.32Å; F84-L99 HydrophobicContact CE1-CD2 3.61Å; F84-L99 HydrophobicContact CZ-CD2 4.33Å; F84-L100 HydrophobicContact CB-CD1 4.11Å; F84-L100 HydrophobicContact CD1-CD1 4.32Å; F84-L100 HydrophobicContact CD1-CD2 4.45Å; F84-L100 HydrophobicContact CG-CD1 4.29Å; F84-F170 HydrophobicContact CB-CZ 4.21Å; F84-F170 HydrophobicContact CD1-CD1 4.03Å; F84-F170 HydrophobicContact CD1-CD2 4.48Å; F84-F170 AromaticContact CD1-CE1 3.61Å; F84-F170 HydrophobicContact CD1-CE1 3.61Å; F84-F170 HydrophobicContact CD1-CE2 4.11Å; F84-F170 HydrophobicContact CD1-CG 4.46Å; F84-F170 AromaticContact CD1-CZ 3.66Å; F84-F170 HydrophobicContact CD1-CZ 3.66Å; F84-F170 HydrophobicContact CE1-CD1 4.21Å; F84-F170 HydrophobicContact CE1-CE1 4.21Å; F84-F170 HydrophobicContact CG-CZ 4.44Å; F84-G174 VanDerWaalsContact CE2-C 3.44Å; F84-L188 HydrophobicContact CE2-CD1 3.58Å; F84-L188 HydrophobicContact CZ-CD1 3.59Å; F84-L188 HydrophobicContact CZ-CD2 3.7Å; F84-L188 HydrophobicContact CZ-CG 4.3Å
85	D	92.3	Very high	89.7	Confident	96 Å²	96	54.7 Å²	54.7	51%	0.513	32%	0.324	S	S	.	.	H	α-helix	trans	-73.3	-18.1	176.5	-63.9	-23.5	0	0	0	111.9	L81 V87 R96	L81-D85 WeakPolarHBondContact O-CB 3.32Å; L81-D85 VanDerWaalsContact O-CG 3.3Å; L81-D85 PolarHBondContact O-N 3.37Å; D85-V87 VanDerWaalsContact C-N 3.31Å; D85-R96 IonicContact OD1-CZ 3.52Å; D85-R96 IonicContact OD1-NE 3.45Å; D85-R96 PolarHBondContact OD1-NE 2.91Å; D85-R96 IonicContact OD1-NH2 2.81Å; D85-R96 PolarHBondContact OD1-NH2 2.92Å; D85-R96 IonicContact OD2-NH2 3.93Å
86	S	91.2	Very high	89.5	Confident	70 Å²	70	53.2 Å²	53.2	49%	0.49	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	2.5	170.6	53.5	0	0	0	0	114.5	I82 A83 F84 S88 N177	I82-S86 VanDerWaalsContact O-CB 3.31Å; I82-S86 WeakPolarHBondContact O-CB 3.31Å; I82-S86 PolarHBondContact O-N 2.84Å; I82-S86 VanDerWaalsContact O-N 3.14Å; I82-S86 PolarHBondContact O-OG 2.9Å; A83-S86 PolarHBondContact O-OG 3.49Å; F84-S86 PolarHBondContact O-N 3.45Å; S86-S88 PolarHBondContact O-N 2.95Å; S86-N177 PolarHBondContact OG-ND2 3.36Å; S86-N177 VanDerWaalsContact OG-ND2 3.1Å
87	V	90.8	Very high	89.3	Confident	19 Å²	19	56.8 Å²	56.8	12%	0.115	32%	0.322	C	S	.	.			trans	-76	116.7	175.8	176.4	0	0	0	0	110	F84 D85 S89 F170 L173	F84-V87 WeakPolarHBondContact O-CB 3.4Å; F84-V87 WeakPolarHBondContact O-CG2 3.31Å; F84-V87 PolarHBondContact O-N 3.11Å; D85-V87 VanDerWaalsContact C-N 3.31Å; V87-S89 PolarHBondContact O-N 3.37Å; V87-S89 VanDerWaalsContact O-N 3.09Å; V87-F170 HydrophobicContact CB-CD2 4.21Å; V87-F170 HydrophobicContact CB-CE2 4.07Å; V87-F170 HydrophobicContact CG1-CD2 3.99Å; V87-F170 HydrophobicContact CG1-CE2 4.32Å; V87-F170 HydrophobicContact CG2-CD2 4.42Å; V87-F170 HydrophobicContact CG2-CE2 4.32Å; V87-L173 HydrophobicContact CG1-CB 3.73Å; V87-L173 HydrophobicContact CG1-CD1 3.79Å; V87-L173 HydrophobicContact CG1-CG 4.42Å; V87-L173 HydrophobicContact CG2-CB 3.95Å
88	S	75.9	Confident	88.9	Confident	125 Å²	125	58.6 Å²	58.6	87%	0.874	34%	0.335	S	S	*	.			trans	-71	-0.4	-177.8	56.9	0	0	0	0	115.6	S86	S86-S88 PolarHBondContact O-N 2.95Å
89	S	71.1	Confident	88.6	Confident	58 Å²	58	55.5 Å²	55.5	41%	0.406	32%	0.322	S	S	.	.	S	Bend	trans	-89.7	127.1	179.5	-168.5	0	0	0	0	110.6	V87 V91	V87-S89 PolarHBondContact O-N 3.37Å; V87-S89 VanDerWaalsContact O-N 3.09Å; S89-V91 PolarHBondContact O-N 3.36Å
90	T	73.2	Confident	88.6	Confident	141 Å²	141	53.9 Å²	53.9	87%	0.865	31%	0.313	S	S	*	.			trans	-70.2	102	177.2	52.4	0	0	0	0	110.8
91	V	83.1	Confident	88.5	Confident	27 Å²	27	54.2 Å²	54.2	16%	0.164	32%	0.317	C	S	.	.			trans	-105.2	138.1	175.4	174.8	0	0	0	0	108.5	S89 N95 F170	S89-V91 PolarHBondContact O-N 3.36Å; V91-N95 HydrophobicContact CG1-CB 3.6Å; V91-F170 HydrophobicContact CB-CD2 4.19Å; V91-F170 HydrophobicContact CB-CG 4.35Å; V91-F170 HydrophobicContact CG1-CB 4.47Å; V91-F170 HydrophobicContact CG1-CD1 4.28Å; V91-F170 HydrophobicContact CG1-CG 4.19Å; V91-F170 HydrophobicContact CG2-CB 3.81Å; V91-F170 HydrophobicContact CG2-CD2 3.63Å; V91-F170 HydrophobicContact CG2-CE2 4.35Å; V91-F170 HydrophobicContact CG2-CG 3.82Å
92	T	87.7	Confident	88.5	Confident	73 Å²	73	54 Å²	54	45%	0.448	32%	0.315	S	S	.	.			trans	-65	144.8	178.3	67	0	0	0	0	111	S94 N95 R96	T92-S94 PolarHBondContact O-N 3.27Å; T92-S94 VanDerWaalsContact O-N 3.09Å; T92-N95 CarbonylContact O-C 3.57Å; T92-N95 WeakPolarHBondContact O-CA 3.49Å; T92-N95 PolarHBondContact O-N 2.8Å; T92-N95 WeakPolarHBondContact OG1-CB 3.31Å; T92-N95 PolarHBondContact OG1-N 2.75Å; T92-N95 PolarHBondContact OG1-ND2 3.1Å; T92-R96 PolarHBondContact O-N 2.82Å
93	E	86.8	Confident	88.5	Confident	129 Å²	129	49.6 Å²	49.6	60%	0.603	29%	0.293	S	S	*	.	H	α-helix	trans	-54.8	-31.9	176.4	-78	-56.7	127	0	0	112.8	R96 Y97	E93-R96 PolarHBondContact O-N 2.92Å; E93-Y97 WeakPolarHBondContact O-CB 3.47Å; E93-Y97 PolarHBondContact O-N 2.84Å
94	S	86.2	Confident	88.6	Confident	83 Å²	83	51.3 Å²	51.3	58%	0.58	30%	0.302	S	S	*	.	H	α-helix	trans	-64.2	-40.4	173	-172.3	0	0	0	0	112.8	T92 S98	T92-S94 PolarHBondContact O-N 3.27Å; T92-S94 VanDerWaalsContact O-N 3.09Å; S94-S98 VanDerWaalsContact O-CB 3.24Å; S94-S98 WeakPolarHBondContact O-CB 3.34Å; S94-S98 PolarHBondContact O-N 3.34Å; S94-S98 PolarHBondContact O-OG 2.83Å
95	N	88.2	Confident	88.8	Confident	20 Å²	20	54.9 Å²	54.9	11%	0.107	32%	0.318	C	S	.	.	H	α-helix	trans	-73.2	-39.7	175.5	-77.9	-23.8	0	0	0	111.5	V91 T92 S98 L99 N164 E166 I167	V91-N95 HydrophobicContact CG1-CB 3.6Å; T92-N95 CarbonylContact O-C 3.57Å; T92-N95 WeakPolarHBondContact O-CA 3.49Å; T92-N95 PolarHBondContact O-N 2.8Å; T92-N95 WeakPolarHBondContact OG1-CB 3.31Å; T92-N95 PolarHBondContact OG1-N 2.75Å; T92-N95 PolarHBondContact OG1-ND2 3.1Å; N95-S98 WeakPolarHBondContact O-CB 3.4Å; N95-S98 PolarHBondContact O-N 2.75Å; N95-L99 PolarHBondContact O-N 3.38Å; N95-N164 PolarHBondContact OD1-ND2 2.93Å; N95-E166 PolarHBondContact ND2-OE2 3.16Å; N95-I167 HydrophobicContact CB-CD1 4.24Å; N95-I167 HydrophobicContact CB-CG1 3.67Å
96	R	91.5	Very high	89	Confident	27 Å²	27	50.3 Å²	50.3	10%	0.102	29%	0.294	C	S	.	.	H	α-helix	trans	-57.3	-52.4	171.3	-175	-179.9	-178.1	-80.9	0	110.8	D85 T92 E93 S98 L99 L100 D104 F170	D85-R96 IonicContact OD1-CZ 3.52Å; D85-R96 IonicContact OD1-NE 3.45Å; D85-R96 PolarHBondContact OD1-NE 2.91Å; D85-R96 IonicContact OD1-NH2 2.81Å; D85-R96 PolarHBondContact OD1-NH2 2.92Å; D85-R96 IonicContact OD2-NH2 3.93Å; T92-R96 PolarHBondContact O-N 2.82Å; E93-R96 PolarHBondContact O-N 2.92Å; R96-S98 VanDerWaalsContact C-N 3.29Å; R96-S98 PolarHBondContact O-N 2.97Å; R96-L99 PolarHBondContact O-N 2.95Å; R96-L100 HydrophobicContact CG-CD1 4.17Å; R96-L100 PolarHBondContact O-N 3.4Å; R96-D104 IonicContact CZ-OD1 2.73Å; R96-D104 IonicContact CZ-OD2 2.85Å; R96-D104 IonicContact NH1-OD1 3.66Å; R96-D104 PolarHBondContact NH1-OD1 2.81Å; R96-D104 IonicContact NH1-OD2 2.65Å; R96-D104 PolarHBondContact NH1-OD2 2.97Å; R96-D104 IonicContact NH2-OD1 3.3Å; R96-D104 PolarHBondContact NH2-OD1 3.13Å; R96-D104 IonicContact NH2-OD2 3.96Å; R96-F170 HydrophobicContact CB-CE1 4.3Å; R96-F170 HydrophobicContact CG-CE1 4.07Å; R96-F170 HydrophobicContact CG-CZ 4.11Å
97	Y	91.7	Very high	89.3	Confident	103 Å²	103	47.4 Å²	47.4	40%	0.404	27%	0.273	S	S	.	.	H	α-helix	trans	-63.2	-31.6	176.7	-169	-86.9	0	0	0	112.8	E93 L99 G101 N102 N155	E93-Y97 WeakPolarHBondContact O-CB 3.47Å; E93-Y97 PolarHBondContact O-N 2.84Å; Y97-L99 PolarHBondContact O-N 2.89Å; Y97-G101 WeakPolarHBondContact CD2-O 3.3Å; Y97-G101 VanDerWaalsContact CE2-C 3.47Å; Y97-G101 WeakPolarHBondContact CE2-O 3.36Å; Y97-G101 WeakPolarHBondContact O-CA 3.19Å; Y97-G101 PolarHBondContact O-N 2.81Å; Y97-N102 HydrophobicContact CE2-CB 4.26Å; Y97-N155 PolarHBondContact OH-ND2 3.41Å; Y97-N155 VanDerWaalsContact OH-ND2 3.09Å
98	S	88.3	Confident	89.7	Confident	38 Å²	38	53.5 Å²	53.5	27%	0.266	29%	0.294	S	S	.	.	H	α-helix	trans	-67.4	-17.6	177.1	-72.3	0	0	0	0	114.6	S94 N95 R96 K163	S94-S98 VanDerWaalsContact O-CB 3.24Å; S94-S98 WeakPolarHBondContact O-CB 3.34Å; S94-S98 PolarHBondContact O-N 3.34Å; S94-S98 PolarHBondContact O-OG 2.83Å; N95-S98 WeakPolarHBondContact O-CB 3.4Å; N95-S98 PolarHBondContact O-N 2.75Å; R96-S98 VanDerWaalsContact C-N 3.29Å; R96-S98 PolarHBondContact O-N 2.97Å; S98-K163 PolarHBondContact O-NZ 3.38Å
99	L	92.5	Very high	90.7	Very high	10 Å²	10	48.2 Å²	48.2	5%	0.052	26%	0.257	C	S	.	.	H	α-helix	trans	-103.8	-53.5	174.9	-179.6	66	0	0	0	112.2	F84 N95 R96 Y97 A160 I167 F170 S171 L188 L192	F84-L99 HydrophobicContact CD1-CD2 4.32Å; F84-L99 HydrophobicContact CE1-CD2 3.61Å; F84-L99 HydrophobicContact CZ-CD2 4.33Å; N95-L99 PolarHBondContact O-N 3.38Å; R96-L99 PolarHBondContact O-N 2.95Å; Y97-L99 PolarHBondContact O-N 2.89Å; L99-A160 HydrophobicContact CD1-CB 4.11Å; L99-I167 HydrophobicContact CB-CG2 4.07Å; L99-I167 HydrophobicContact CD1-CG2 4.35Å; L99-F170 HydrophobicContact CD2-CD1 3.78Å; L99-F170 HydrophobicContact CD2-CE1 4.19Å; L99-S171 VanDerWaalsContact CD2-OG 3.32Å; L99-S171 WeakPolarHBondContact CD2-OG 3.45Å; L99-L188 HydrophobicContact CD1-CD2 4.5Å; L99-L192 HydrophobicContact CD1-CD1 4.03Å; L99-L192 HydrophobicContact CG-CD1 4.4Å
100	L	94.3	Very high	92	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-92.9	-12.7	-172.4	-58.3	179.3	0	0	0	113.5	V80 F84 R96 N102 L103 Y152 F170 L192	V80-L100 HydrophobicContact CG1-CD2 4.46Å; F84-L100 HydrophobicContact CB-CD1 4.11Å; F84-L100 HydrophobicContact CD1-CD1 4.32Å; F84-L100 HydrophobicContact CD1-CD2 4.45Å; F84-L100 HydrophobicContact CG-CD1 4.29Å; R96-L100 HydrophobicContact CG-CD1 4.17Å; R96-L100 PolarHBondContact O-N 3.4Å; L100-N102 PolarHBondContact O-N 3.37Å; L100-L103 HydrophobicContact CB-CB 4.39Å; L100-L103 HydrophobicContact CD2-CD2 4.44Å; L100-L103 VanDerWaalsContact O-CB 3.28Å; L100-L103 WeakPolarHBondContact O-CB 3.44Å; L100-L103 PolarHBondContact O-N 3.38Å; L100-L103 VanDerWaalsContact O-N 3.17Å; L100-Y152 VanDerWaalsContact O-CE2 3.24Å; L100-Y152 WeakPolarHBondContact O-CE2 3.49Å; L100-F170 HydrophobicContact CD1-CE1 4.36Å; L100-L192 HydrophobicContact CD2-CD2 3.85Å
101	G	93.1	Very high	93.1	Very high	7 Å²	7	40.8 Å²	40.8	7%	0.072	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	-136.5	-175.2	0	0	0	0	0	111.9	Y97 L103	Y97-G101 WeakPolarHBondContact CD2-O 3.3Å; Y97-G101 VanDerWaalsContact CE2-C 3.47Å; Y97-G101 WeakPolarHBondContact CE2-O 3.36Å; Y97-G101 WeakPolarHBondContact O-CA 3.19Å; Y97-G101 PolarHBondContact O-N 2.81Å; G101-L103 VanDerWaalsContact C-N 3.33Å; G101-L103 PolarHBondContact O-N 3.37Å
102	N	95.8	Very high	93.8	Very high	10 Å²	10	43 Å²	43	5%	0.053	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	33	174.5	70.1	-45.6	0	0	0	113	Y97 L100 D104 Q105 L106 A148 T151 Y152	Y97-N102 HydrophobicContact CE2-CB 4.26Å; L100-N102 PolarHBondContact O-N 3.37Å; N102-D104 PolarHBondContact O-N 3.17Å; N102-D104 VanDerWaalsContact O-N 3.16Å; N102-Q105 HydrophobicContact CB-CB 4.33Å; N102-Q105 PolarHBondContact ND2-OE1 2.74Å; N102-Q105 WeakPolarHBondContact O-CB 3.35Å; N102-Q105 PolarHBondContact O-N 3.06Å; N102-L106 PolarHBondContact O-N 3.44Å; N102-L106 VanDerWaalsContact O-N 3.11Å; N102-A148 PolarHBondContact ND2-O 2.88Å; N102-T151 HydrophobicContact CB-CG2 4.09Å; N102-Y152 WeakPolarHBondContact OD1-CA 3.42Å; N102-Y152 VanDerWaalsContact OD1-CB 3.29Å; N102-Y152 WeakPolarHBondContact OD1-CB 3.3Å; N102-Y152 PolarHBondContact OD1-N 2.94Å
103	L	96.9	Very high	94.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-52.6	-40	-176.1	-171.6	57.2	0	0	0	112.5	M77 V80 L81 L100 G101 Q105 L106 V107 Y152 P195	M77-L103 HydrophobicContact CB-CD1 4.25Å; M77-L103 HydrophobicContact CG-CD1 4.28Å; M77-L103 HydrophobicContact SD-CD1 3.9Å; V80-L103 HydrophobicContact CB-CD2 4.46Å; V80-L103 HydrophobicContact CG1-CD2 3.88Å; L81-L103 HydrophobicContact CD2-CB 4.14Å; L81-L103 HydrophobicContact CD2-CD2 3.86Å; L81-L103 HydrophobicContact CD2-CG 3.96Å; L81-L103 HydrophobicContact CG-CD2 4.18Å; L81-L103 HydrophobicContact CG-CG 4.24Å; L100-L103 HydrophobicContact CB-CB 4.39Å; L100-L103 HydrophobicContact CD2-CD2 4.44Å; L100-L103 VanDerWaalsContact O-CB 3.28Å; L100-L103 WeakPolarHBondContact O-CB 3.44Å; L100-L103 PolarHBondContact O-N 3.38Å; L100-L103 VanDerWaalsContact O-N 3.17Å; G101-L103 VanDerWaalsContact C-N 3.33Å; G101-L103 PolarHBondContact O-N 3.37Å; L103-Q105 VanDerWaalsContact C-N 3.3Å; L103-Q105 PolarHBondContact O-N 2.82Å; L103-L106 PolarHBondContact O-N 2.68Å; L103-L106 VanDerWaalsContact O-N 3.15Å; L103-V107 HydrophobicContact CD1-CG2 4.08Å; L103-V107 HydrophobicContact CG-CG2 4.14Å; L103-V107 WeakPolarHBondContact O-CB 3.4Å; L103-V107 WeakPolarHBondContact O-CG2 3.36Å; L103-V107 PolarHBondContact O-N 3.39Å; L103-Y152 HydrophobicContact CB-CD2 4.42Å; L103-Y152 HydrophobicContact CB-CE2 3.98Å; L103-Y152 HydrophobicContact CD1-CD2 4.38Å; L103-Y152 HydrophobicContact CD1-CE2 3.88Å; L103-Y152 HydrophobicContact CG-CE2 4.44Å; L103-P195 HydrophobicContact CD1-CG 4.3Å
104	D	96.2	Very high	94.8	Very high	39 Å²	39	34 Å²	34	21%	0.209	17%	0.172	C	C	.	.	H	α-helix	trans	-56.2	-42.8	177.6	-46.7	-88	0	0	0	112.6	L81 R96 N102 R108	L81-D104 WeakPolarHBondContact CD2-OD1 3.24Å; R96-D104 IonicContact CZ-OD1 2.73Å; R96-D104 IonicContact CZ-OD2 2.85Å; R96-D104 IonicContact NH1-OD1 3.66Å; R96-D104 PolarHBondContact NH1-OD1 2.81Å; R96-D104 IonicContact NH1-OD2 2.65Å; R96-D104 PolarHBondContact NH1-OD2 2.97Å; R96-D104 IonicContact NH2-OD1 3.3Å; R96-D104 PolarHBondContact NH2-OD1 3.13Å; R96-D104 IonicContact NH2-OD2 3.96Å; N102-D104 PolarHBondContact O-N 3.17Å; N102-D104 VanDerWaalsContact O-N 3.16Å; D104-R108 WeakPolarHBondContact O-CG 3.11Å; D104-R108 PolarHBondContact O-N 2.81Å; D104-R108 VanDerWaalsContact O-N 3.08Å; D104-R108 PolarHBondContact O-NH1 3.02Å
105	Q	97	Very high	95.3	Very high	76 Å²	76	35 Å²	35	36%	0.355	17%	0.169	S	C	.	.	H	α-helix	trans	-69.5	-43.1	178.2	-174.4	-167.7	17.5	0	0	110.9	N102 L103 V107 R108 V109	N102-Q105 HydrophobicContact CB-CB 4.33Å; N102-Q105 PolarHBondContact ND2-OE1 2.74Å; N102-Q105 WeakPolarHBondContact O-CB 3.35Å; N102-Q105 PolarHBondContact O-N 3.06Å; L103-Q105 VanDerWaalsContact C-N 3.3Å; L103-Q105 PolarHBondContact O-N 2.82Å; Q105-V107 VanDerWaalsContact C-N 3.34Å; Q105-R108 PolarHBondContact O-N 3.36Å; Q105-V109 WeakPolarHBondContact O-CG2 3.49Å; Q105-V109 PolarHBondContact O-N 3.25Å; Q105-V109 VanDerWaalsContact O-N 3.07Å
106	L	97.9	Very high	95.8	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-64	-40.2	178.5	178.6	60.9	0	0	0	111.7	F73 N102 L103 S110 A148 L149 Y152 P195	F73-L106 HydrophobicContact CZ-CD2 4.24Å; N102-L106 PolarHBondContact O-N 3.44Å; N102-L106 VanDerWaalsContact O-N 3.11Å; L103-L106 PolarHBondContact O-N 2.68Å; L103-L106 VanDerWaalsContact O-N 3.15Å; L106-S110 WeakPolarHBondContact O-CB 3.49Å; L106-S110 PolarHBondContact O-N 2.66Å; L106-S110 PolarHBondContact O-OG 3.45Å; L106-A148 HydrophobicContact CB-CB 4.26Å; L106-A148 HydrophobicContact CD1-CB 3.88Å; L106-L149 HydrophobicContact CD1-CD2 3.69Å; L106-L149 HydrophobicContact CD1-CG 3.88Å; L106-L149 HydrophobicContact CD2-CD2 4.11Å; L106-Y152 HydrophobicContact CD2-CD2 4.37Å; L106-Y152 HydrophobicContact CD2-CG 4.21Å; L106-P195 HydrophobicContact CD2-CB 3.66Å; L106-P195 HydrophobicContact CD2-CG 3.98Å
107	V	97.9	Very high	96	Very high	9 Å²	9	34 Å²	34	6%	0.055	17%	0.169	C	C	.	.	H	α-helix	trans	-64.1	-48.2	175.6	171.6	0	0	0	0	110.8	M77 K78 L81 L103 Q105 V109 S110 D111	M77-V107 HydrophobicContact CB-CG2 3.41Å; M77-V107 VanDerWaalsContact CB-CG2 3.41Å; M77-V107 HydrophobicContact CG-CG2 4.5Å; K78-V107 HydrophobicContact CG-CG1 3.6Å; L81-V107 HydrophobicContact CD1-CB 3.87Å; L81-V107 HydrophobicContact CD1-CG1 4.11Å; L81-V107 HydrophobicContact CD1-CG2 3.72Å; L103-V107 HydrophobicContact CD1-CG2 4.08Å; L103-V107 HydrophobicContact CG-CG2 4.14Å; L103-V107 WeakPolarHBondContact O-CB 3.4Å; L103-V107 WeakPolarHBondContact O-CG2 3.36Å; L103-V107 PolarHBondContact O-N 3.39Å; Q105-V107 VanDerWaalsContact C-N 3.34Å; V107-V109 PolarHBondContact O-N 3.47Å; V107-S110 PolarHBondContact O-N 3.47Å; V107-D111 VanDerWaalsContact O-CB 3.29Å; V107-D111 WeakPolarHBondContact O-CB 3.41Å; V107-D111 PolarHBondContact O-N 3Å
108	R	97.9	Very high	96.2	Very high	146 Å²	146	33.7 Å²	33.7	55%	0.551	17%	0.171	S	C	*	.	H	α-helix	trans	-54.9	-53.9	176.7	-73.8	-171.3	-54.8	-89.9	8.7	112.1	D104 Q105 S110 D111 D112	D104-R108 WeakPolarHBondContact O-CG 3.11Å; D104-R108 PolarHBondContact O-N 2.81Å; D104-R108 VanDerWaalsContact O-N 3.08Å; D104-R108 PolarHBondContact O-NH1 3.02Å; Q105-R108 PolarHBondContact O-N 3.36Å; R108-S110 VanDerWaalsContact C-N 3.28Å; R108-S110 PolarHBondContact O-N 3.07Å; R108-D111 WeakPolarHBondContact O-CB 3.35Å; R108-D111 PolarHBondContact O-N 3.28Å; R108-D111 VanDerWaalsContact O-N 3.17Å; R108-D112 PolarHBondContact O-N 2.98Å
109	V	97.7	Very high	96.6	Very high	15 Å²	15	39.1 Å²	39.1	9%	0.091	19%	0.19	C	C	.	.	H	α-helix	trans	-61.8	-37.7	179.4	175.9	0	0	0	0	111.8	Q105 V107 I113 M145	Q105-V109 WeakPolarHBondContact O-CG2 3.49Å; Q105-V109 PolarHBondContact O-N 3.25Å; Q105-V109 VanDerWaalsContact O-N 3.07Å; V107-V109 PolarHBondContact O-N 3.47Å; V109-I113 HydrophobicContact CG1-CD1 4.05Å; V109-I113 WeakPolarHBondContact O-CD1 3.21Å; V109-I113 VanDerWaalsContact O-CG1 3.26Å; V109-I113 WeakPolarHBondContact O-CG1 3.36Å; V109-I113 PolarHBondContact O-N 3.42Å; V109-I113 VanDerWaalsContact O-N 3.11Å; V109-M145 HydrophobicContact CG1-CB 3.97Å
110	S	97.5	Very high	96.8	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.014	19%	0.192	C	C	.	.	H	α-helix	trans	-70.2	-32.8	178.8	-61	0	0	0	0	112.8	Q70 V74 L106 V107 R108 S114	Q70-S110 PolarHBondContact NE2-O 2.83Å; V74-S110 VanDerWaalsContact CG2-C 3.44Å; V74-S110 VanDerWaalsContact CG2-O 3.3Å; V74-S110 WeakPolarHBondContact CG2-O 3.46Å; L106-S110 WeakPolarHBondContact O-CB 3.49Å; L106-S110 PolarHBondContact O-N 2.66Å; L106-S110 PolarHBondContact O-OG 3.45Å; V107-S110 PolarHBondContact O-N 3.47Å; R108-S110 VanDerWaalsContact C-N 3.28Å; R108-S110 PolarHBondContact O-N 3.07Å; S110-S114 WeakPolarHBondContact O-CB 3.42Å; S110-S114 PolarHBondContact O-N 2.97Å
111	D	97.8	Very high	96.8	Very high	40 Å²	40	41.3 Å²	41.3	21%	0.214	20%	0.201	C	C	.	.	H	α-helix	trans	-72.3	-43	176	-163.8	46.8	0	0	0	111.3	V74 K78 V107 R108 I113 S114 M115	V74-D111 HydrophobicContact CG1-CB 3.99Å; V74-D111 WeakPolarHBondContact CG1-OD1 3.2Å; K78-D111 WeakPolarHBondContact CE-OD2 3.41Å; K78-D111 IonicContact NZ-OD1 2.67Å; K78-D111 PolarHBondContact NZ-OD1 3.23Å; K78-D111 IonicContact NZ-OD2 2.78Å; K78-D111 PolarHBondContact NZ-OD2 3.18Å; V107-D111 VanDerWaalsContact O-CB 3.29Å; V107-D111 WeakPolarHBondContact O-CB 3.41Å; V107-D111 PolarHBondContact O-N 3Å; R108-D111 WeakPolarHBondContact O-CB 3.35Å; R108-D111 PolarHBondContact O-N 3.28Å; R108-D111 VanDerWaalsContact O-N 3.17Å; D111-I113 VanDerWaalsContact C-N 3.31Å; D111-I113 PolarHBondContact O-N 3.07Å; D111-S114 CarbonylContact O-C 3.59Å; D111-S114 WeakPolarHBondContact O-CA 3.08Å; D111-S114 WeakPolarHBondContact O-CB 3.39Å; D111-S114 PolarHBondContact O-N 3.43Å; D111-M115 WeakPolarHBondContact O-CG 3.27Å; D111-M115 PolarHBondContact O-N 2.67Å
112	D	98	Very high	96.9	Very high	74 Å²	74	45.4 Å²	45.4	40%	0.396	23%	0.229	S	C	.	.	H	α-helix	trans	-56.6	-45.3	171.7	-66.5	-32.5	0	0	0	111.3	R108 M115 A116 F141	R108-D112 PolarHBondContact O-N 2.98Å; D112-M115 PolarHBondContact O-N 3.47Å; D112-A116 WeakPolarHBondContact O-CB 3.46Å; D112-A116 PolarHBondContact O-N 2.72Å; D112-F141 HydrophobicContact CB-CD1 4.4Å; D112-F141 HydrophobicContact CB-CE1 3.72Å; D112-F141 HydrophobicContact CB-CZ 4.3Å
113	I	97.6	Very high	96.9	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-62.7	-42	173.6	-69.9	166.4	0	0	0	111.2	Q70 V109 D111 A116 L117 I138 F141 M145	Q70-I113 HydrophobicContact CG-CG2 4.3Å; V109-I113 HydrophobicContact CG1-CD1 4.05Å; V109-I113 WeakPolarHBondContact O-CD1 3.21Å; V109-I113 VanDerWaalsContact O-CG1 3.26Å; V109-I113 WeakPolarHBondContact O-CG1 3.36Å; V109-I113 PolarHBondContact O-N 3.42Å; V109-I113 VanDerWaalsContact O-N 3.11Å; D111-I113 VanDerWaalsContact C-N 3.31Å; D111-I113 PolarHBondContact O-N 3.07Å; I113-A116 PolarHBondContact O-N 2.84Å; I113-L117 HydrophobicContact CG2-CD1 3.85Å; I113-L117 HydrophobicContact CG2-CG 4.29Å; I113-L117 WeakPolarHBondContact O-CB 3.49Å; I113-L117 VanDerWaalsContact O-CG 3.26Å; I113-L117 WeakPolarHBondContact O-CG 3.5Å; I113-L117 PolarHBondContact O-N 3.48Å; I113-I138 HydrophobicContact CG2-CG1 4.02Å; I113-F141 HydrophobicContact CD1-CB 3.7Å; I113-F141 HydrophobicContact CD1-CG 4.15Å; I113-F141 HydrophobicContact CG1-CB 3.59Å; I113-F141 HydrophobicContact CG1-CD1 3.96Å; I113-F141 HydrophobicContact CG1-CD2 3.67Å; I113-F141 HydrophobicContact CG1-CE2 4.32Å; I113-F141 HydrophobicContact CG1-CG 3.46Å; I113-F141 VanDerWaalsContact CG1-CG 3.46Å; I113-M145 HydrophobicContact CD1-CB 4Å; I113-M145 HydrophobicContact CD1-CE 3.98Å; I113-M145 HydrophobicContact CD1-CG 4.19Å; I113-M145 HydrophobicContact CD1-SD 3.46Å; I113-M145 WeakPolarHBondContact CD1-SD 3.24Å
114	S	97.2	Very high	96.8	Very high	12 Å²	12	54.3 Å²	54.3	8%	0.084	27%	0.266	C	S	.	.	H	α-helix	trans	-62	-45.9	178.1	-167.9	0	0	0	0	111.4	S110 D111 L117 Q118	S110-S114 WeakPolarHBondContact O-CB 3.42Å; S110-S114 PolarHBondContact O-N 2.97Å; D111-S114 CarbonylContact O-C 3.59Å; D111-S114 WeakPolarHBondContact O-CA 3.08Å; D111-S114 WeakPolarHBondContact O-CB 3.39Å; D111-S114 PolarHBondContact O-N 3.43Å; S114-L117 PolarHBondContact O-N 3.01Å; S114-Q118 WeakPolarHBondContact O-CB 3.37Å; S114-Q118 WeakPolarHBondContact O-CG 3.26Å; S114-Q118 PolarHBondContact O-N 2.88Å
115	M	97.1	Very high	96.6	Very high	105 Å²	105	56.2 Å²	56.2	52%	0.517	28%	0.279	S	S	.	.	H	α-helix	trans	-62.9	-42.7	175	-70.2	-172.2	-72.9	0	0	112.2	D111 D112 Q118 K119	D111-M115 WeakPolarHBondContact O-CG 3.27Å; D111-M115 PolarHBondContact O-N 2.67Å; D112-M115 PolarHBondContact O-N 3.47Å; M115-Q118 PolarHBondContact O-N 3.07Å; M115-K119 WeakPolarHBondContact O-CB 3.46Å; M115-K119 PolarHBondContact O-N 3.18Å
116	A	97.1	Very high	96.2	Very high	24 Å²	24	56.6 Å²	56.6	20%	0.198	28%	0.283	C	S	.	.	H	α-helix	trans	-64.6	-40.3	177.2	0	0	0	0	0	112	D112 I113 K119 E120 C137 F141	D112-A116 WeakPolarHBondContact O-CB 3.46Å; D112-A116 PolarHBondContact O-N 2.72Å; I113-A116 PolarHBondContact O-N 2.84Å; A116-K119 PolarHBondContact O-N 3.49Å; A116-E120 PolarHBondContact O-N 3Å; A116-C137 VanDerWaalsContact C-SG 3.54Å; A116-C137 VanDerWaalsContact CB-SG 3.6Å; A116-F141 HydrophobicContact CB-CE2 3.69Å; A116-F141 HydrophobicContact CB-CZ 3.99Å
117	L	97.1	Very high	95.8	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-66.1	-44.6	174.2	-75.5	172.2	0	0	0	112.4	L66 V67 Q70 I113 S114 K119 E120 I121 I134 C137 I138	L66-L117 HydrophobicContact CD2-CD1 3.99Å; V67-L117 HydrophobicContact CG1-CB 4.39Å; V67-L117 HydrophobicContact CG2-CB 4.19Å; V67-L117 HydrophobicContact CG2-CD1 4.38Å; V67-L117 HydrophobicContact CG2-CD2 4.24Å; Q70-L117 HydrophobicContact CB-CD1 4.24Å; Q70-L117 HydrophobicContact CG-CD1 4.1Å; I113-L117 HydrophobicContact CG2-CD1 3.85Å; I113-L117 HydrophobicContact CG2-CG 4.29Å; I113-L117 WeakPolarHBondContact O-CB 3.49Å; I113-L117 VanDerWaalsContact O-CG 3.26Å; I113-L117 WeakPolarHBondContact O-CG 3.5Å; I113-L117 PolarHBondContact O-N 3.48Å; S114-L117 PolarHBondContact O-N 3.01Å; L117-K119 VanDerWaalsContact C-N 3.29Å; L117-K119 PolarHBondContact O-N 2.58Å; L117-E120 PolarHBondContact O-N 3.3Å; L117-E120 VanDerWaalsContact O-N 3.08Å; L117-I121 WeakPolarHBondContact O-CG1 3.43Å; L117-I121 PolarHBondContact O-N 2.87Å; L117-I134 HydrophobicContact CD2-CB 3.86Å; L117-I134 HydrophobicContact CD2-CG2 3.88Å; L117-C137 HydrophobicContact CD2-CB 4.44Å; L117-I138 HydrophobicContact CD1-CD1 4.07Å; L117-I138 HydrophobicContact CD1-CG1 4.3Å; L117-I138 HydrophobicContact CD2-CD1 3.91Å; L117-I138 HydrophobicContact CD2-CG1 3.97Å; L117-I138 HydrophobicContact CG-CD1 4.41Å; L117-I138 HydrophobicContact CG-CG1 4.29Å
118	Q	96.5	Very high	95.5	Very high	96 Å²	96	65.8 Å²	65.8	45%	0.449	33%	0.329	S	S	.	.	H	α-helix	trans	-57.3	-42.7	174.1	-72.9	-79.1	12	0	0	111.3	S114 M115 E120 I121 S122	S114-Q118 WeakPolarHBondContact O-CB 3.37Å; S114-Q118 WeakPolarHBondContact O-CG 3.26Å; S114-Q118 PolarHBondContact O-N 2.88Å; M115-Q118 PolarHBondContact O-N 3.07Å; Q118-E120 VanDerWaalsContact C-N 3.32Å; Q118-E120 PolarHBondContact O-N 3.27Å; Q118-I121 WeakPolarHBondContact O-CG1 3.33Å; Q118-S122 WeakPolarHBondContact O-CB 3.39Å; Q118-S122 PolarHBondContact O-N 3Å; Q118-S122 VanDerWaalsContact O-N 3.1Å; Q118-S122 PolarHBondContact O-OG 2.91Å
119	K	95.9	Very high	95.3	Very high	153 Å²	153	59.6 Å²	59.6	67%	0.665	31%	0.307	S	S	*	.	H	α-helix	trans	-68.5	-26.3	175.3	-176.1	178.6	178.5	-178.7	0	113.7	M115 A116 L117 S122	M115-K119 WeakPolarHBondContact O-CB 3.46Å; M115-K119 PolarHBondContact O-N 3.18Å; A116-K119 PolarHBondContact O-N 3.49Å; L117-K119 VanDerWaalsContact C-N 3.29Å; L117-K119 PolarHBondContact O-N 2.58Å; K119-S122 PolarHBondContact O-OG 3.32Å
120	E	95.8	Very high	95	Very high	18 Å²	18	58.9 Å²	58.9	8%	0.084	30%	0.302	C	S	.	.	H	α-helix	trans	-77.1	-49.6	173.9	-178.7	60.4	-163.8	0	0	110.8	A116 L117 Q118 S122 K123 Y124 A132 C133 I134	A116-E120 PolarHBondContact O-N 3Å; L117-E120 PolarHBondContact O-N 3.3Å; L117-E120 VanDerWaalsContact O-N 3.08Å; Q118-E120 VanDerWaalsContact C-N 3.32Å; Q118-E120 PolarHBondContact O-N 3.27Å; E120-S122 VanDerWaalsContact C-N 3.29Å; E120-S122 PolarHBondContact O-N 2.93Å; E120-K123 WeakPolarHBondContact O-CB 3.34Å; E120-K123 WeakPolarHBondContact O-CG 3.48Å; E120-K123 PolarHBondContact O-N 3.23Å; E120-K123 WeakPolarHBondContact OE2-CE 3.33Å; E120-K123 IonicContact OE2-NZ 3.32Å; E120-K123 PolarHBondContact OE2-NZ 2.8Å; E120-Y124 VanDerWaalsContact O-CD2 3.27Å; E120-Y124 WeakPolarHBondContact O-CD2 3.41Å; E120-Y124 WeakPolarHBondContact O-CE2 3.41Å; E120-Y124 WeakPolarHBondContact OE1-CE2 3.4Å; E120-Y124 PolarHBondContact OE1-OH 2.93Å; E120-A132 HydrophobicContact CG-CB 4.46Å; E120-C133 PolarHBondContact OE1-N 3.36Å; E120-I134 HydrophobicContact CG-CG2 4.41Å
121	I	95.9	Very high	94.8	Very high	38 Å²	38	62.1 Å²	62.1	20%	0.195	32%	0.32	C	S	.	.	H	α-helix	trans	-66.2	-29.1	-178.7	61.8	161	0	0	0	113.2	V67 L117 Q118 K123 Y124 L129	V67-I121 HydrophobicContact CG1-CD1 3.98Å; V67-I121 HydrophobicContact CG2-CG2 3.99Å; L117-I121 WeakPolarHBondContact O-CG1 3.43Å; L117-I121 PolarHBondContact O-N 2.87Å; Q118-I121 WeakPolarHBondContact O-CG1 3.33Å; I121-K123 PolarHBondContact O-N 3.22Å; I121-K123 VanDerWaalsContact O-N 3.13Å; I121-Y124 PolarHBondContact O-N 3.27Å; I121-L129 HydrophobicContact CB-CD2 3.8Å; I121-L129 HydrophobicContact CG2-CD2 3.98Å
122	S	94.8	Very high	94.7	Very high	94 Å²	94	60.2 Å²	60.2	66%	0.657	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-11.9	179	65.6	0	0	0	0	114.2	Q118 K119 E120 Y124	Q118-S122 WeakPolarHBondContact O-CB 3.39Å; Q118-S122 PolarHBondContact O-N 3Å; Q118-S122 VanDerWaalsContact O-N 3.1Å; Q118-S122 PolarHBondContact O-OG 2.91Å; K119-S122 PolarHBondContact O-OG 3.32Å; E120-S122 VanDerWaalsContact C-N 3.29Å; E120-S122 PolarHBondContact O-N 2.93Å; S122-Y124 VanDerWaalsContact C-N 3.31Å
123	K	94.9	Very high	94.6	Very high	135 Å²	135	57.9 Å²	57.9	59%	0.587	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-15.4	172.9	-57.5	171.6	-176	173.2	0	113.4	E120 I121	E120-K123 WeakPolarHBondContact O-CB 3.34Å; E120-K123 WeakPolarHBondContact O-CG 3.48Å; E120-K123 PolarHBondContact O-N 3.23Å; E120-K123 WeakPolarHBondContact OE2-CE 3.33Å; E120-K123 IonicContact OE2-NZ 3.32Å; E120-K123 PolarHBondContact OE2-NZ 2.8Å; I121-K123 PolarHBondContact O-N 3.22Å; I121-K123 VanDerWaalsContact O-N 3.13Å
124	Y	95.2	Very high	94.6	Very high	62 Å²	62	57.8 Å²	57.8	24%	0.243	30%	0.298	C	S	.	.	S	Bend	trans	-119.3	141.5	-170.6	-56.6	-89.5	0	0	0	111	E120 I121 S122 Q128 N131 A132	E120-Y124 VanDerWaalsContact O-CD2 3.27Å; E120-Y124 WeakPolarHBondContact O-CD2 3.41Å; E120-Y124 WeakPolarHBondContact O-CE2 3.41Å; E120-Y124 WeakPolarHBondContact OE1-CE2 3.4Å; E120-Y124 PolarHBondContact OE1-OH 2.93Å; I121-Y124 PolarHBondContact O-N 3.27Å; S122-Y124 VanDerWaalsContact C-N 3.31Å; Y124-Q128 HydrophobicContact CD1-CB 4.3Å; Y124-N131 HydrophobicContact CD1-CB 4.17Å; Y124-N131 HydrophobicContact CE1-CB 3.88Å; Y124-N131 PolarHBondContact OH-O 3.47Å; Y124-A132 HydrophobicContact CD2-CB 3.83Å; Y124-A132 HydrophobicContact CE2-CB 3.71Å; Y124-A132 HydrophobicContact CG-CB 4.49Å
125	T	92.6	Very high	94.6	Very high	79 Å²	79	57.2 Å²	57.2	49%	0.485	29%	0.294	S	S	.	.			trans	-65.1	157.7	164.5	62.1	0	0	0	0	110.2	D127 Q128 L129	T125-D127 PolarHBondContact O-N 2.85Å; T125-Q128 CarbonylContact O-C 3.59Å; T125-Q128 WeakPolarHBondContact O-CA 3.36Å; T125-Q128 PolarHBondContact O-N 3.15Å; T125-Q128 VanDerWaalsContact OG1-CD 3.26Å; T125-Q128 WeakPolarHBondContact OG1-CG 3.48Å; T125-Q128 PolarHBondContact OG1-N 3Å; T125-Q128 PolarHBondContact OG1-OE1 3.5Å; T125-L129 PolarHBondContact O-N 2.95Å; T125-L129 VanDerWaalsContact O-N 3.12Å
126	N	89.2	Confident	94.5	Very high	83 Å²	83	55.4 Å²	55.4	44%	0.444	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-30.7	177.7	173.5	60.5	0	0	0	113.3	K60 K64	K60-N126 WeakPolarHBondContact CD-O 3.19Å; K60-N126 WeakPolarHBondContact CE-O 3.39Å; K60-N126 PolarHBondContact NZ-O 3.4Å; K64-N126 VanDerWaalsContact CE-OD1 3.23Å; K64-N126 WeakPolarHBondContact CE-OD1 3.39Å; K64-N126 PolarHBondContact NZ-OD1 3.44Å
127	D	88.4	Confident	94.4	Very high	107 Å²	107	55.3 Å²	55.3	57%	0.572	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-15.4	179.4	-60.2	-41.2	0	0	0	114	F56 K60 T125	F56-D127 VanDerWaalsContact CE1-O 3.22Å; F56-D127 WeakPolarHBondContact CE1-O 3.44Å; F56-D127 WeakPolarHBondContact CZ-O 3.5Å; K60-D127 IonicContact NZ-OD1 2.82Å; K60-D127 PolarHBondContact NZ-OD1 3.42Å; T125-D127 PolarHBondContact O-N 2.85Å
128	Q	92.1	Very high	94.4	Very high	96 Å²	96	55.4 Å²	55.4	45%	0.449	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-3.4	173.7	-69.1	166.5	-37.7	0	0	113.8	Y124 T125 G130 N131	Y124-Q128 HydrophobicContact CD1-CB 4.3Å; T125-Q128 CarbonylContact O-C 3.59Å; T125-Q128 WeakPolarHBondContact O-CA 3.36Å; T125-Q128 PolarHBondContact O-N 3.15Å; T125-Q128 VanDerWaalsContact OG1-CD 3.26Å; T125-Q128 WeakPolarHBondContact OG1-CG 3.48Å; T125-Q128 PolarHBondContact OG1-N 3Å; T125-Q128 PolarHBondContact OG1-OE1 3.5Å; Q128-G130 PolarHBondContact O-N 3.42Å; Q128-N131 WeakPolarHBondContact O-CB 3.42Å; Q128-N131 PolarHBondContact O-N 2.87Å; Q128-N131 PolarHBondContact O-ND2 3.06Å
129	L	92.8	Very high	94.3	Very high	17 Å²	17	52.6 Å²	52.6	9%	0.089	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-53.2	-25.4	-178.2	-78.7	172.6	0	0	0	115.1	K60 K64 I121 T125 N131 A132	K60-L129 HydrophobicContact CG-CB 4.27Å; K64-L129 HydrophobicContact CD-CD1 4.42Å; K64-L129 VanDerWaalsContact CE-CD1 3.46Å; K64-L129 HydrophobicContact CG-CD1 4.08Å; I121-L129 HydrophobicContact CB-CD2 3.8Å; I121-L129 HydrophobicContact CG2-CD2 3.98Å; T125-L129 PolarHBondContact O-N 2.95Å; T125-L129 VanDerWaalsContact O-N 3.12Å; L129-N131 PolarHBondContact O-N 3.33Å; L129-A132 WeakPolarHBondContact O-CB 3.3Å; L129-A132 PolarHBondContact O-N 3.49Å
130	G	92	Very high	94.2	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-62.9	-18.5	173.3	0	0	0	0	0	114	R59 Q128 H217	R59-G130 VanDerWaalsContact CD-O 3.27Å; R59-G130 WeakPolarHBondContact CD-O 3.44Å; R59-G130 PolarHBondContact NE-O 2.98Å; Q128-G130 PolarHBondContact O-N 3.42Å; G130-H217 PolarHBondContact O-NE2 3.26Å; G130-H217 VanDerWaalsContact O-NE2 3.17Å
131	N	93.7	Very high	94.2	Very high	70 Å²	70	51 Å²	51	37%	0.374	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-88	-5.7	177.5	-61.1	-47.7	0	0	0	114	F56 Y124 Q128 L129 H217	F56-N131 WeakPolarHBondContact CE2-OD1 3.46Å; Y124-N131 HydrophobicContact CD1-CB 4.17Å; Y124-N131 HydrophobicContact CE1-CB 3.88Å; Y124-N131 PolarHBondContact OH-O 3.47Å; Q128-N131 WeakPolarHBondContact O-CB 3.42Å; Q128-N131 PolarHBondContact O-N 2.87Å; Q128-N131 PolarHBondContact O-ND2 3.06Å; L129-N131 PolarHBondContact O-N 3.33Å; N131-H217 WeakPolarHBondContact CA-NE2 3.34Å; N131-H217 PolarHBondContact O-CE1 2.91Å
132	A	95.9	Very high	94.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.288	C	S	.	.			trans	-65.7	138.5	-174.4	0	0	0	0	0	112.1	R59 V63 E120 Y124 L129 I134	R59-A132 PolarHBondContact NH2-O 2.96Å; V63-A132 HydrophobicContact CG1-CB 4.34Å; E120-A132 HydrophobicContact CG-CB 4.46Å; Y124-A132 HydrophobicContact CD2-CB 3.83Å; Y124-A132 HydrophobicContact CE2-CB 3.71Å; Y124-A132 HydrophobicContact CG-CB 4.49Å; L129-A132 WeakPolarHBondContact O-CB 3.3Å; L129-A132 PolarHBondContact O-N 3.49Å; A132-I134 VanDerWaalsContact C-N 3.27Å; A132-I134 HydrophobicContact CB-CG2 4.05Å; A132-I134 PolarHBondContact O-N 3.39Å; A132-I134 VanDerWaalsContact O-N 3.11Å
133	C	96.1	Very high	94	Very high	24 Å²	24	55.3 Å²	55.3	16%	0.162	29%	0.287	C	S	.	.			trans	-91.1	55.3	-176.7	-64.7	0	0	0	0	111.8	E120 A135 T136 C137 D219	E120-C133 PolarHBondContact OE1-N 3.36Å; C133-A135 PolarHBondContact O-N 3.4Å; C133-T136 PolarHBondContact O-N 3.4Å; C133-C137 PolarHBondContact O-N 3.03Å; C133-D219 VanDerWaalsContact C-OD1 3.27Å; C133-D219 WeakPolarHBondContact CA-OD1 3.49Å; C133-D219 HydrophobicContact CB-CB 4.44Å
134	I	96.4	Very high	94.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-68.4	-30.8	-171.8	57.3	159.5	0	0	0	113.8	V63 L66 V67 L117 E120 A132 C137 I138 L209 D219	V63-I134 HydrophobicContact CB-CD1 4.08Å; V63-I134 HydrophobicContact CG1-CD1 4.21Å; V63-I134 HydrophobicContact CG1-CG2 4.1Å; V63-I134 HydrophobicContact CG2-CD1 3.68Å; V63-I134 HydrophobicContact CG2-CG1 4.09Å; L66-I134 HydrophobicContact CB-CD1 4.37Å; L66-I134 HydrophobicContact CD1-CD1 4.16Å; L66-I134 HydrophobicContact CD2-CD1 4.35Å; V67-I134 HydrophobicContact CG2-CG2 4.47Å; L117-I134 HydrophobicContact CD2-CB 3.86Å; L117-I134 HydrophobicContact CD2-CG2 3.88Å; E120-I134 HydrophobicContact CG-CG2 4.41Å; A132-I134 VanDerWaalsContact C-N 3.27Å; A132-I134 HydrophobicContact CB-CG2 4.05Å; A132-I134 PolarHBondContact O-N 3.39Å; A132-I134 VanDerWaalsContact O-N 3.11Å; I134-C137 WeakPolarHBondContact O-CB 3.26Å; I134-C137 PolarHBondContact O-N 3.36Å; I134-I138 WeakPolarHBondContact O-CG1 3.34Å; I134-I138 PolarHBondContact O-N 3.02Å; I134-I138 VanDerWaalsContact O-N 3.09Å; I134-L209 HydrophobicContact CD1-CD1 4.39Å; I134-L209 HydrophobicContact CD1-CD2 3.67Å; I134-L209 HydrophobicContact CG1-CD2 3.98Å; I134-D219 PolarHBondContact N-OD2 3.41Å
135	A	96.6	Very high	94.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-72.3	-40.8	178.1	0	0	0	0	0	110.6	C133 C137 I138 N139 F206 D219 A222 T223	C133-A135 PolarHBondContact O-N 3.4Å; A135-C137 VanDerWaalsContact C-N 3.31Å; A135-C137 PolarHBondContact O-N 3.05Å; A135-I138 PolarHBondContact O-N 3.17Å; A135-N139 WeakPolarHBondContact O-CB 3.43Å; A135-N139 PolarHBondContact O-N 3.15Å; A135-F206 HydrophobicContact CB-CD1 4.49Å; A135-F206 HydrophobicContact CB-CE1 3.68Å; A135-D219 WeakPolarHBondContact CB-OD1 3.48Å; A135-D219 WeakPolarHBondContact CB-OD2 3.24Å; A135-D219 PolarHBondContact N-OD1 3.26Å; A135-D219 PolarHBondContact N-OD2 2.76Å; A135-D219 VanDerWaalsContact N-OD2 3.14Å; A135-A222 VanDerWaalsContact CB-C 3.47Å; A135-A222 HydrophobicContact CB-CB 3.73Å; A135-T223 HydrophobicContact CB-CG2 3.55Å; A135-T223 VanDerWaalsContact CB-N 3.35Å
136	T	96.3	Very high	94.3	Very high	67 Å²	67	45.8 Å²	45.8	41%	0.411	25%	0.248	S	C	.	.	H	α-helix	trans	-59.2	-43.3	173.5	-54.2	0	0	0	0	110.9	C133 N139 D219 A222	C133-T136 PolarHBondContact O-N 3.4Å; T136-N139 PolarHBondContact O-N 3.11Å; T136-D219 WeakPolarHBondContact CB-OD1 3.38Å; T136-D219 PolarHBondContact N-OD1 2.93Å; T136-D219 PolarHBondContact OG1-OD1 3.04Å; T136-A222 VanDerWaalsContact N-CB 3.33Å; T136-A222 WeakPolarHBondContact OG1-CB 3.35Å
137	C	95.1	Very high	94.6	Very high	22 Å²	22	46.3 Å²	46.3	15%	0.149	25%	0.248	C	C	.	.	H	α-helix	trans	-56.6	-52.7	173.9	-176	0	0	0	0	111.8	A116 L117 C133 I134 A135 N139 S140	A116-C137 VanDerWaalsContact C-SG 3.54Å; A116-C137 VanDerWaalsContact CB-SG 3.6Å; L117-C137 HydrophobicContact CD2-CB 4.44Å; C133-C137 PolarHBondContact O-N 3.03Å; I134-C137 WeakPolarHBondContact O-CB 3.26Å; I134-C137 PolarHBondContact O-N 3.36Å; A135-C137 VanDerWaalsContact C-N 3.31Å; A135-C137 PolarHBondContact O-N 3.05Å; C137-N139 PolarHBondContact O-N 3.1Å; C137-S140 PolarHBondContact O-N 3.43Å; C137-S140 PolarHBondContact O-OG 3.34Å
138	I	96	Very high	95	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.015	22%	0.221	C	C	.	.	H	α-helix	trans	-69.5	-32.7	-177.6	-66.4	162.7	0	0	0	112.3	L66 I113 L117 I134 A135 S140 F141 R142 M145 F206 M226	L66-I138 HydrophobicContact CD1-CD1 4.49Å; L66-I138 HydrophobicContact CD2-CD1 3.54Å; I113-I138 HydrophobicContact CG2-CG1 4.02Å; L117-I138 HydrophobicContact CD1-CD1 4.07Å; L117-I138 HydrophobicContact CD1-CG1 4.3Å; L117-I138 HydrophobicContact CD2-CD1 3.91Å; L117-I138 HydrophobicContact CD2-CG1 3.97Å; L117-I138 HydrophobicContact CG-CD1 4.41Å; L117-I138 HydrophobicContact CG-CG1 4.29Å; I134-I138 WeakPolarHBondContact O-CG1 3.34Å; I134-I138 PolarHBondContact O-N 3.02Å; I134-I138 VanDerWaalsContact O-N 3.09Å; A135-I138 PolarHBondContact O-N 3.17Å; I138-S140 PolarHBondContact O-N 2.85Å; I138-F141 WeakPolarHBondContact O-CA 3.37Å; I138-F141 PolarHBondContact O-N 3.34Å; I138-R142 PolarHBondContact O-N 3.24Å; I138-M145 HydrophobicContact CG2-CE 3.83Å; I138-F206 HydrophobicContact CB-CZ 4.31Å; I138-F206 HydrophobicContact CD1-CE2 4.13Å; I138-F206 HydrophobicContact CD1-CZ 3.65Å; I138-F206 HydrophobicContact CG2-CZ 4.28Å; I138-M226 HydrophobicContact CG2-CE 3.76Å; I138-M226 HydrophobicContact CG2-SD 4.46Å
139	N	93.9	Very high	95.2	Very high	36 Å²	36	36.7 Å²	36.7	19%	0.193	20%	0.2	C	C	.	.	H	α-helix	trans	-60.7	-27.4	179.7	-166.1	24.3	0	0	0	112.7	A135 T136 C137 F141 R142 Q225 M226	A135-N139 WeakPolarHBondContact O-CB 3.43Å; A135-N139 PolarHBondContact O-N 3.15Å; T136-N139 PolarHBondContact O-N 3.11Å; C137-N139 PolarHBondContact O-N 3.1Å; N139-F141 PolarHBondContact O-N 3.21Å; N139-R142 VanDerWaalsContact O-CB 3.28Å; N139-R142 WeakPolarHBondContact O-CB 3.43Å; N139-R142 PolarHBondContact O-N 3.33Å; N139-Q225 PolarHBondContact ND2-OE1 3.49Å; N139-M226 VanDerWaalsContact CA-SD 3.53Å; N139-M226 HydrophobicContact CB-CG 4.25Å; N139-M226 HydrophobicContact CB-SD 3.76Å
140	S	93.7	Very high	95.2	Very high	92 Å²	92	38.9 Å²	38.9	64%	0.643	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-24	172.7	71	0	0	0	0	113.5	C137 I138	C137-S140 PolarHBondContact O-N 3.43Å; C137-S140 PolarHBondContact O-OG 3.34Å; I138-S140 PolarHBondContact O-N 2.85Å
141	F	96.2	Very high	95.3	Very high	47 Å²	47	40.9 Å²	40.9	21%	0.206	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	9.4	176.7	-59.3	-89.7	0	0	0	113.6	D112 I113 A116 I138 N139 L143 S144 M145	D112-F141 HydrophobicContact CB-CD1 4.4Å; D112-F141 HydrophobicContact CB-CE1 3.72Å; D112-F141 HydrophobicContact CB-CZ 4.3Å; I113-F141 HydrophobicContact CD1-CB 3.7Å; I113-F141 HydrophobicContact CD1-CG 4.15Å; I113-F141 HydrophobicContact CG1-CB 3.59Å; I113-F141 HydrophobicContact CG1-CD1 3.96Å; I113-F141 HydrophobicContact CG1-CD2 3.67Å; I113-F141 HydrophobicContact CG1-CE2 4.32Å; I113-F141 HydrophobicContact CG1-CG 3.46Å; I113-F141 VanDerWaalsContact CG1-CG 3.46Å; A116-F141 HydrophobicContact CB-CE2 3.69Å; A116-F141 HydrophobicContact CB-CZ 3.99Å; I138-F141 WeakPolarHBondContact O-CA 3.37Å; I138-F141 PolarHBondContact O-N 3.34Å; N139-F141 PolarHBondContact O-N 3.21Å; F141-L143 PolarHBondContact O-N 3.13Å; F141-S144 PolarHBondContact O-N 3.2Å; F141-S144 PolarHBondContact O-OG 2.53Å; F141-S144 VanDerWaalsContact O-OG 3.07Å; F141-M145 WeakPolarHBondContact O-CB 3.37Å; F141-M145 PolarHBondContact O-N 2.95Å
142	R	93.8	Very high	95.5	Very high	97 Å²	97	37.7 Å²	37.7	37%	0.366	20%	0.203	S	C	.	.	H	α-helix	trans	-52.9	-48.4	-171.8	-168.7	-173.8	86.4	-130.3	4.8	113.2	I138 N139 N146 M226 N229	I138-R142 PolarHBondContact O-N 3.24Å; N139-R142 VanDerWaalsContact O-CB 3.28Å; N139-R142 WeakPolarHBondContact O-CB 3.43Å; N139-R142 PolarHBondContact O-N 3.33Å; R142-N146 VanDerWaalsContact O-CB 3.25Å; R142-N146 WeakPolarHBondContact O-CB 3.37Å; R142-N146 PolarHBondContact O-N 3.43Å; R142-N146 PolarHBondContact O-OD1 3.19Å; R142-M226 HydrophobicContact CG-CE 4.48Å; R142-M226 HydrophobicContact CG-SD 4.32Å; R142-N229 WeakPolarHBondContact CD-OD1 3.36Å; R142-N229 HydrophobicContact CG-CB 4.44Å; R142-N229 WeakPolarHBondContact CG-OD1 3.11Å
143	L	93.4	Very high	95.4	Very high	124 Å²	124	37.9 Å²	37.9	65%	0.649	21%	0.205	S	C	*	.	H	α-helix	trans	-67.8	-47.9	-176.3	-62.5	178.3	0	0	0	112.2	F141 N146 E147	F141-L143 PolarHBondContact O-N 3.13Å; L143-N146 PolarHBondContact O-N 2.97Å; L143-E147 PolarHBondContact O-N 3.21Å; L143-E147 VanDerWaalsContact O-N 3.12Å
144	S	96.5	Very high	95	Very high	50 Å²	50	38.2 Å²	38.2	35%	0.35	21%	0.205	S	C	.	.	H	α-helix	trans	-66.6	-39.6	-178.7	51.1	0	0	0	0	112	F141 A148	F141-S144 PolarHBondContact O-N 3.2Å; F141-S144 PolarHBondContact O-OG 2.53Å; F141-S144 VanDerWaalsContact O-OG 3.07Å; S144-A148 VanDerWaalsContact O-CB 3.25Å; S144-A148 WeakPolarHBondContact O-CB 3.4Å; S144-A148 PolarHBondContact O-N 2.9Å
145	M	96.4	Very high	94.6	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.025	22%	0.222	C	C	.	.	H	α-helix	trans	-71.7	-39.2	177.4	-173	166	58	0	0	112.4	V109 I113 I138 F141 A148 L149 L202 F230	V109-M145 HydrophobicContact CG1-CB 3.97Å; I113-M145 HydrophobicContact CD1-CB 4Å; I113-M145 HydrophobicContact CD1-CE 3.98Å; I113-M145 HydrophobicContact CD1-CG 4.19Å; I113-M145 HydrophobicContact CD1-SD 3.46Å; I113-M145 WeakPolarHBondContact CD1-SD 3.24Å; I138-M145 HydrophobicContact CG2-CE 3.83Å; F141-M145 WeakPolarHBondContact O-CB 3.37Å; F141-M145 PolarHBondContact O-N 2.95Å; M145-A148 PolarHBondContact O-N 3.13Å; M145-L149 HydrophobicContact CG-CD1 3.75Å; M145-L149 HydrophobicContact CG-CG 4.16Å; M145-L149 WeakPolarHBondContact O-CB 3.2Å; M145-L149 WeakPolarHBondContact O-CG 3.47Å; M145-L149 PolarHBondContact O-N 3.33Å; M145-L149 HydrophobicContact SD-CD1 4.34Å; M145-L202 HydrophobicContact CE-CD1 4.27Å; M145-L202 HydrophobicContact SD-CD1 4.16Å; M145-F230 HydrophobicContact CE-CE1 3.73Å; M145-F230 HydrophobicContact CE-CZ 3.44Å; M145-F230 VanDerWaalsContact CE-CZ 3.44Å
146	N	96	Very high	94.3	Very high	22 Å²	22	43 Å²	43	12%	0.118	23%	0.228	C	C	.	.	H	α-helix	trans	-58.2	-51.4	175.5	-77.3	6.7	0	0	0	111.2	R142 L143 L149 K150 N229 L233	R142-N146 VanDerWaalsContact O-CB 3.25Å; R142-N146 WeakPolarHBondContact O-CB 3.37Å; R142-N146 PolarHBondContact O-N 3.43Å; R142-N146 PolarHBondContact O-OD1 3.19Å; L143-N146 PolarHBondContact O-N 2.97Å; N146-L149 PolarHBondContact O-N 2.92Å; N146-K150 WeakPolarHBondContact O-CB 3.38Å; N146-K150 PolarHBondContact O-N 2.88Å; N146-N229 PolarHBondContact ND2-OD1 3.18Å; N146-N229 PolarHBondContact OD1-ND2 3.21Å; N146-L233 HydrophobicContact CB-CD1 4.46Å; N146-L233 HydrophobicContact CB-CD2 4.17Å
147	E	94.9	Very high	93.9	Very high	93 Å²	93	41.8 Å²	41.8	44%	0.435	22%	0.223	S	C	.	.	H	α-helix	trans	-68	-37.2	-178.3	-71.6	-56.8	127.8	0	0	112.4	L143 K150 T151	L143-E147 PolarHBondContact O-N 3.21Å; L143-E147 VanDerWaalsContact O-N 3.12Å; E147-K150 IonicContact OE1-NZ 3.57Å; E147-K150 PolarHBondContact OE1-NZ 3.27Å; E147-T151 VanDerWaalsContact O-CB 3.22Å; E147-T151 WeakPolarHBondContact O-CB 3.48Å; E147-T151 PolarHBondContact O-N 2.89Å; E147-T151 PolarHBondContact O-OG1 3.37Å
148	A	97.2	Very high	93.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.9	-47.9	175.4	0	0	0	0	0	112.4	N102 L106 S144 M145 Y152	N102-A148 PolarHBondContact ND2-O 2.88Å; L106-A148 HydrophobicContact CB-CB 4.26Å; L106-A148 HydrophobicContact CD1-CB 3.88Å; S144-A148 VanDerWaalsContact O-CB 3.25Å; S144-A148 WeakPolarHBondContact O-CB 3.4Å; S144-A148 PolarHBondContact O-N 2.9Å; M145-A148 PolarHBondContact O-N 3.13Å; A148-Y152 PolarHBondContact O-N 3.41Å; A148-Y152 VanDerWaalsContact O-N 3.13Å
149	L	96.8	Very high	92.8	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-64.9	-47.5	176.8	-75.7	171.9	0	0	0	111.7	L106 M145 N146 T151 Y152 I153 L199 L202 L233	L106-L149 HydrophobicContact CD1-CD2 3.69Å; L106-L149 HydrophobicContact CD1-CG 3.88Å; L106-L149 HydrophobicContact CD2-CD2 4.11Å; M145-L149 HydrophobicContact CG-CD1 3.75Å; M145-L149 HydrophobicContact CG-CG 4.16Å; M145-L149 WeakPolarHBondContact O-CB 3.2Å; M145-L149 WeakPolarHBondContact O-CG 3.47Å; M145-L149 PolarHBondContact O-N 3.33Å; M145-L149 HydrophobicContact SD-CD1 4.34Å; N146-L149 PolarHBondContact O-N 2.92Å; L149-T151 PolarHBondContact O-N 3.32Å; L149-Y152 PolarHBondContact O-N 3.21Å; L149-I153 HydrophobicContact CB-CD1 4.31Å; L149-I153 WeakPolarHBondContact O-CB 3.24Å; L149-I153 WeakPolarHBondContact O-CD1 3.36Å; L149-I153 WeakPolarHBondContact O-CG1 3.36Å; L149-I153 PolarHBondContact O-N 3.02Å; L149-L199 HydrophobicContact CD1-CD1 4.44Å; L149-L202 HydrophobicContact CD1-CD1 4.23Å; L149-L233 HydrophobicContact CB-CD2 4.46Å; L149-L233 HydrophobicContact CD1-CD2 4.43Å
150	K	93.2	Very high	92.2	Very high	64 Å²	64	46 Å²	46	28%	0.278	25%	0.247	S	C	.	.	H	α-helix	trans	-57.2	-49.7	179.4	-175.8	174.1	172.2	-171.9	0	111.3	N146 E147 Y152 I153 L154 L233 V237	N146-K150 WeakPolarHBondContact O-CB 3.38Å; N146-K150 PolarHBondContact O-N 2.88Å; E147-K150 IonicContact OE1-NZ 3.57Å; E147-K150 PolarHBondContact OE1-NZ 3.27Å; K150-Y152 PolarHBondContact O-N 3.07Å; K150-I153 PolarHBondContact O-N 3.42Å; K150-L154 HydrophobicContact CG-CD1 3.89Å; K150-L154 VanDerWaalsContact O-CB 3.28Å; K150-L154 WeakPolarHBondContact O-CB 3.32Å; K150-L154 WeakPolarHBondContact O-CG 3.11Å; K150-L154 PolarHBondContact O-N 3.18Å; K150-L233 HydrophobicContact CB-CD1 4.08Å; K150-L233 HydrophobicContact CD-CD1 4.33Å; K150-L233 HydrophobicContact CG-CD1 4.48Å; K150-V237 HydrophobicContact CB-CG2 4.35Å; K150-V237 HydrophobicContact CG-CG2 4.1Å
151	T	93.5	Very high	91.7	Very high	42 Å²	42	42.8 Å²	42.8	26%	0.258	23%	0.225	S	C	.	.	H	α-helix	trans	-60.3	-45.6	178.8	-59.1	0	0	0	0	111.2	N102 E147 L149 N155	N102-T151 HydrophobicContact CB-CG2 4.09Å; E147-T151 VanDerWaalsContact O-CB 3.22Å; E147-T151 WeakPolarHBondContact O-CB 3.48Å; E147-T151 PolarHBondContact O-N 2.89Å; E147-T151 PolarHBondContact O-OG1 3.37Å; L149-T151 PolarHBondContact O-N 3.32Å; T151-N155 WeakPolarHBondContact O-CB 3.24Å; T151-N155 PolarHBondContact O-N 3.21Å; T151-N155 PolarHBondContact O-ND2 2.72Å
152	Y	96.7	Very high	91	Very high	2 Å²	2	45 Å²	45	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-62	-54.1	178.8	-171.3	-83.2	0	0	0	111	L100 N102 L103 L106 A148 L149 K150 L154 N155 F156 L192 P195	L100-Y152 VanDerWaalsContact O-CE2 3.24Å; L100-Y152 WeakPolarHBondContact O-CE2 3.49Å; N102-Y152 WeakPolarHBondContact OD1-CA 3.42Å; N102-Y152 VanDerWaalsContact OD1-CB 3.29Å; N102-Y152 WeakPolarHBondContact OD1-CB 3.3Å; N102-Y152 PolarHBondContact OD1-N 2.94Å; L103-Y152 HydrophobicContact CB-CD2 4.42Å; L103-Y152 HydrophobicContact CB-CE2 3.98Å; L103-Y152 HydrophobicContact CD1-CD2 4.38Å; L103-Y152 HydrophobicContact CD1-CE2 3.88Å; L103-Y152 HydrophobicContact CG-CE2 4.44Å; L106-Y152 HydrophobicContact CD2-CD2 4.37Å; L106-Y152 HydrophobicContact CD2-CG 4.21Å; A148-Y152 PolarHBondContact O-N 3.41Å; A148-Y152 VanDerWaalsContact O-N 3.13Å; L149-Y152 PolarHBondContact O-N 3.21Å; K150-Y152 PolarHBondContact O-N 3.07Å; Y152-L154 VanDerWaalsContact C-N 3.28Å; Y152-L154 PolarHBondContact O-N 3.13Å; Y152-N155 PolarHBondContact O-N 3.1Å; Y152-N155 VanDerWaalsContact O-N 3.09Å; Y152-F156 HydrophobicContact CD1-CB 4.29Å; Y152-F156 HydrophobicContact CE1-CB 4.05Å; Y152-F156 AromaticContact CE1-CD2 3.91Å; Y152-F156 HydrophobicContact CE1-CD2 3.91Å; Y152-F156 HydrophobicContact CE1-CG 4.3Å; Y152-F156 WeakPolarHBondContact O-CB 3.36Å; Y152-F156 PolarHBondContact O-N 3.32Å; Y152-L192 PolarHBondContact OH-O 2.93Å; Y152-P195 HydrophobicContact CD1-CB 3.43Å; Y152-P195 VanDerWaalsContact CD1-CB 3.43Å; Y152-P195 HydrophobicContact CD1-CG 4Å; Y152-P195 HydrophobicContact CE1-CB 3.5Å; Y152-P195 VanDerWaalsContact CE1-CB 3.5Å; Y152-P195 HydrophobicContact CE1-CG 3.61Å; Y152-P195 HydrophobicContact CE2-CG 4.29Å; Y152-P195 HydrophobicContact CG-CB 4.06Å
153	I	93.8	Very high	90.2	Very high	5 Å²	5	45.6 Å²	45.6	3%	0.026	25%	0.247	C	C	.	.	H	α-helix	trans	-66.1	-33	-172.1	-59.5	163.9	0	0	0	111.1	L149 K150 N155 V196 L199 V237 K241	L149-I153 HydrophobicContact CB-CD1 4.31Å; L149-I153 WeakPolarHBondContact O-CB 3.24Å; L149-I153 WeakPolarHBondContact O-CD1 3.36Å; L149-I153 WeakPolarHBondContact O-CG1 3.36Å; L149-I153 PolarHBondContact O-N 3.02Å; K150-I153 PolarHBondContact O-N 3.42Å; I153-N155 VanDerWaalsContact C-N 3.32Å; I153-V196 HydrophobicContact CG1-CB 4.48Å; I153-V196 HydrophobicContact CG1-CG2 4.17Å; I153-V196 HydrophobicContact CG2-CG1 4.02Å; I153-V196 HydrophobicContact CG2-CG2 4.23Å; I153-L199 HydrophobicContact CD1-CB 3.91Å; I153-L199 HydrophobicContact CD1-CD2 3.6Å; I153-L199 HydrophobicContact CD1-CG 4.41Å; I153-V237 HydrophobicContact CB-CG1 3.99Å; I153-V237 HydrophobicContact CG2-CG1 3.41Å; I153-V237 VanDerWaalsContact CG2-CG1 3.41Å; I153-K241 WeakPolarHBondContact O-CE 3.32Å; I153-K241 PolarHBondContact O-NZ 3.2Å
154	L	88.4	Confident	89.7	Confident	31 Å²	31	42.1 Å²	42.1	16%	0.162	23%	0.229	C	C	.	.	H	α-helix	trans	-74.8	-17.3	177.3	-69.7	-179.4	0	0	0	114.6	K150 Y152 V237 V240 K241 K244	K150-L154 HydrophobicContact CG-CD1 3.89Å; K150-L154 VanDerWaalsContact O-CB 3.28Å; K150-L154 WeakPolarHBondContact O-CB 3.32Å; K150-L154 WeakPolarHBondContact O-CG 3.11Å; K150-L154 PolarHBondContact O-N 3.18Å; Y152-L154 VanDerWaalsContact C-N 3.28Å; Y152-L154 PolarHBondContact O-N 3.13Å; L154-V237 HydrophobicContact CD2-CG1 4.18Å; L154-V240 HydrophobicContact CD1-CB 4.49Å; L154-V240 HydrophobicContact CD1-CG1 4.01Å; L154-V240 HydrophobicContact CD2-CB 3.81Å; L154-V240 HydrophobicContact CD2-CG1 3.62Å; L154-V240 HydrophobicContact CG-CG1 4.46Å; L154-K241 HydrophobicContact CD2-CG 4.12Å; L154-K244 PolarHBondContact O-NZ 2.96Å
155	N	88.8	Confident	89.3	Confident	69 Å²	69	44.8 Å²	44.8	37%	0.369	25%	0.246	S	C	.	.	H	α-helix	trans	-107	-21.3	178.8	-68.5	-17	0	0	0	113	Y97 T151 Y152 I153 S157	Y97-N155 PolarHBondContact OH-ND2 3.41Å; Y97-N155 VanDerWaalsContact OH-ND2 3.09Å; T151-N155 WeakPolarHBondContact O-CB 3.24Å; T151-N155 PolarHBondContact O-N 3.21Å; T151-N155 PolarHBondContact O-ND2 2.72Å; Y152-N155 PolarHBondContact O-N 3.1Å; Y152-N155 VanDerWaalsContact O-N 3.09Å; I153-N155 VanDerWaalsContact C-N 3.32Å; N155-S157 PolarHBondContact O-N 3.49Å
156	F	90.7	Very high	88.9	Confident	30 Å²	30	49.3 Å²	49.3	13%	0.132	27%	0.267	C	S	.	.			trans	-54.8	132.6	173.8	175.3	-93.1	0	0	0	112.2	Y152 V158 L192 I193 V196	Y152-F156 HydrophobicContact CD1-CB 4.29Å; Y152-F156 HydrophobicContact CE1-CB 4.05Å; Y152-F156 AromaticContact CE1-CD2 3.91Å; Y152-F156 HydrophobicContact CE1-CD2 3.91Å; Y152-F156 HydrophobicContact CE1-CG 4.3Å; Y152-F156 WeakPolarHBondContact O-CB 3.36Å; Y152-F156 PolarHBondContact O-N 3.32Å; F156-V158 HydrophobicContact CE1-CG2 3.93Å; F156-V158 HydrophobicContact CZ-CG2 4.21Å; F156-L192 WeakPolarHBondContact CD2-O 3.41Å; F156-L192 HydrophobicContact CE2-CB 3.88Å; F156-L192 WeakPolarHBondContact CE2-O 3.3Å; F156-I193 HydrophobicContact CD1-CD1 4.33Å; F156-I193 HydrophobicContact CE1-CD1 3.47Å; F156-I193 VanDerWaalsContact CE1-CD1 3.47Å; F156-I193 HydrophobicContact CZ-CB 4.23Å; F156-I193 HydrophobicContact CZ-CD1 3.58Å; F156-I193 HydrophobicContact CZ-CG1 4.5Å; F156-V196 HydrophobicContact CB-CG2 4.33Å; F156-V196 HydrophobicContact CD1-CG2 3.91Å; F156-V196 HydrophobicContact CE1-CG2 4.41Å; F156-V196 HydrophobicContact CG-CG2 3.97Å
157	S	86	Confident	88.5	Confident	42 Å²	42	48.3 Å²	48.3	29%	0.294	26%	0.261	S	S	.	.			trans	-144.6	127.5	177.3	173.7	0	0	0	0	110	N155 D159 A160	N155-S157 PolarHBondContact O-N 3.49Å; S157-D159 PolarHBondContact O-N 3.03Å; S157-D159 PolarHBondContact OG-N 3.49Å; S157-A160 WeakPolarHBondContact O-CB 3.5Å; S157-A160 PolarHBondContact O-N 3.22Å
158	V	83.7	Confident	88.3	Confident	63 Å²	63	49 Å²	49	38%	0.382	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-31.2	178.9	-177.9	0	0	0	0	112.1	F156 A160 N189	F156-V158 HydrophobicContact CE1-CG2 3.93Å; F156-V158 HydrophobicContact CZ-CG2 4.21Å; V158-A160 VanDerWaalsContact C-N 3.34Å; V158-N189 PolarHBondContact O-ND2 3.26Å
159	D	84.6	Confident	88	Confident	81 Å²	81	51.2 Å²	51.2	43%	0.433	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	4.1	-178.1	-56.9	-28.3	0	0	0	112.3	S157 S161 T162	S157-D159 PolarHBondContact O-N 3.03Å; S157-D159 PolarHBondContact OG-N 3.49Å; D159-S161 VanDerWaalsContact C-N 3.32Å; D159-S161 PolarHBondContact O-N 3.27Å; D159-T162 PolarHBondContact O-N 2.65Å; D159-T162 PolarHBondContact O-OG1 2.94Å
160	A	82.7	Confident	87.8	Confident	5 Å²	5	51.6 Å²	51.6	4%	0.041	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-55.9	-41.8	-172	0	0	0	0	0	113.8	L99 S157 V158 T162 K163 I167	L99-A160 HydrophobicContact CD1-CB 4.11Å; S157-A160 WeakPolarHBondContact O-CB 3.5Å; S157-A160 PolarHBondContact O-N 3.22Å; V158-A160 VanDerWaalsContact C-N 3.34Å; A160-T162 PolarHBondContact O-N 2.8Å; A160-T162 VanDerWaalsContact O-N 3.07Å; A160-K163 WeakPolarHBondContact O-CG 3.23Å; A160-K163 PolarHBondContact O-N 3.2Å; A160-I167 VanDerWaalsContact O-CG2 3.32Å; A160-I167 WeakPolarHBondContact O-CG2 3.47Å
161	S	82.1	Confident	87.8	Confident	26 Å²	26	48.9 Å²	48.9	18%	0.182	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-63.3	-8.7	177.2	55.1	0	0	0	0	114.8	D159 Q168 S171	D159-S161 VanDerWaalsContact C-N 3.32Å; D159-S161 PolarHBondContact O-N 3.27Å; S161-Q168 VanDerWaalsContact O-CA 3.25Å; S161-Q168 WeakPolarHBondContact O-CA 3.23Å; S161-Q168 WeakPolarHBondContact O-CB 3.28Å; S161-S171 WeakPolarHBondContact CA-OG 3.42Å; S161-S171 VanDerWaalsContact CB-OG 3.27Å; S161-S171 WeakPolarHBondContact CB-OG 2.99Å
162	T	81.9	Confident	87.7	Confident	92 Å²	92	51.4 Å²	51.4	56%	0.564	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-114.9	2	-177.6	67.4	0	0	0	0	113.9	D159 A160 N164	D159-T162 PolarHBondContact O-N 2.65Å; D159-T162 PolarHBondContact O-OG1 2.94Å; A160-T162 PolarHBondContact O-N 2.8Å; A160-T162 VanDerWaalsContact O-N 3.07Å; T162-N164 PolarHBondContact O-N 3.38Å
163	K	77.1	Confident	87.6	Confident	110 Å²	110	54.4 Å²	54.4	48%	0.478	31%	0.305	S	S	.	.	S	Bend	trans	-63.8	-39.5	-174.5	-74.5	172	178.9	166.9	0	114.1	S98 A160 I167	S98-K163 PolarHBondContact O-NZ 3.38Å; A160-K163 WeakPolarHBondContact O-CG 3.23Å; A160-K163 PolarHBondContact O-N 3.2Å; K163-I167 HydrophobicContact CB-CD1 4.22Å
164	N	82.9	Confident	87.6	Confident	51 Å²	51	54.2 Å²	54.2	27%	0.273	30%	0.303	S	S	.	.	S	Bend	trans	-152.3	164.6	176.1	71.3	32.4	0	0	0	110.7	N95 T162 E166 I167 Q168	N95-N164 PolarHBondContact OD1-ND2 2.93Å; T162-N164 PolarHBondContact O-N 3.38Å; N164-E166 PolarHBondContact O-N 3.32Å; N164-E166 PolarHBondContact OD1-N 2.98Å; N164-I167 WeakPolarHBondContact ND2-CD1 3.47Å; N164-I167 PolarHBondContact O-N 3.4Å; N164-I167 WeakPolarHBondContact OD1-CB 3.46Å; N164-I167 WeakPolarHBondContact OD1-CG1 3.38Å; N164-I167 PolarHBondContact OD1-N 3.04Å; N164-Q168 WeakPolarHBondContact O-CB 3.38Å; N164-Q168 PolarHBondContact O-N 2.97Å
165	P	87.5	Confident	87.9	Confident	107 Å²	107	54.3 Å²	54.3	70%	0.695	30%	0.303	S	S	*	.	H	α-helix	trans	-63.6	-33.7	-175.9	-25.1	36	0	0	0	114.7	Q168 A169	P165-Q168 PolarHBondContact O-N 3.27Å; P165-A169 WeakPolarHBondContact O-CB 3.35Å; P165-A169 PolarHBondContact O-N 3.35Å
166	E	87.5	Confident	88.1	Confident	100 Å²	100	58 Å²	58	47%	0.467	32%	0.316	S	S	.	.	H	α-helix	trans	-65.7	-49	177.8	-72.2	177.3	-144.7	0	0	111.5	N95 N164 Q168 A169 F170	N95-E166 PolarHBondContact ND2-OE2 3.16Å; N164-E166 PolarHBondContact O-N 3.32Å; N164-E166 PolarHBondContact OD1-N 2.98Å; E166-Q168 PolarHBondContact O-N 3.34Å; E166-A169 PolarHBondContact O-N 3.14Å; E166-F170 WeakPolarHBondContact O-CB 3.35Å; E166-F170 PolarHBondContact O-N 3.34Å
167	I	89.4	Confident	88.3	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-61.6	-36.7	175.7	-65.3	167.4	0	0	0	110.1	N95 L99 A160 K163 N164 S171	N95-I167 HydrophobicContact CB-CD1 4.24Å; N95-I167 HydrophobicContact CB-CG1 3.67Å; L99-I167 HydrophobicContact CB-CG2 4.07Å; L99-I167 HydrophobicContact CD1-CG2 4.35Å; A160-I167 VanDerWaalsContact O-CG2 3.32Å; A160-I167 WeakPolarHBondContact O-CG2 3.47Å; K163-I167 HydrophobicContact CB-CD1 4.22Å; N164-I167 WeakPolarHBondContact ND2-CD1 3.47Å; N164-I167 PolarHBondContact O-N 3.4Å; N164-I167 WeakPolarHBondContact OD1-CB 3.46Å; N164-I167 WeakPolarHBondContact OD1-CG1 3.38Å; N164-I167 PolarHBondContact OD1-N 3.04Å; I167-S171 VanDerWaalsContact O-CB 3.26Å; I167-S171 WeakPolarHBondContact O-CB 3.18Å; I167-S171 PolarHBondContact O-N 3.47Å; I167-S171 PolarHBondContact O-OG 2.98Å
168	Q	90.5	Very high	88.7	Confident	107 Å²	107	56.9 Å²	56.9	50%	0.5	31%	0.307	S	S	.	.	H	α-helix	trans	-65.6	-47	176.8	-169.5	178.7	20.7	0	0	111.8	S161 N164 P165 E166 S171 V172	S161-Q168 VanDerWaalsContact O-CA 3.25Å; S161-Q168 WeakPolarHBondContact O-CA 3.23Å; S161-Q168 WeakPolarHBondContact O-CB 3.28Å; N164-Q168 WeakPolarHBondContact O-CB 3.38Å; N164-Q168 PolarHBondContact O-N 2.97Å; P165-Q168 PolarHBondContact O-N 3.27Å; E166-Q168 PolarHBondContact O-N 3.34Å; Q168-S171 PolarHBondContact O-N 3.32Å; Q168-V172 WeakPolarHBondContact O-CG2 3.31Å; Q168-V172 PolarHBondContact O-N 3.36Å
169	A	90.9	Very high	89.2	Confident	47 Å²	47	57.3 Å²	57.3	39%	0.388	31%	0.305	S	S	.	.	H	α-helix	trans	-61.3	-45.5	175.8	0	0	0	0	0	111.6	P165 E166 S171 V172 L173	P165-A169 WeakPolarHBondContact O-CB 3.35Å; P165-A169 PolarHBondContact O-N 3.35Å; E166-A169 PolarHBondContact O-N 3.14Å; A169-S171 PolarHBondContact O-N 2.85Å; A169-V172 PolarHBondContact O-N 3.21Å; A169-L173 WeakPolarHBondContact O-CG 3.46Å; A169-L173 PolarHBondContact O-N 3.19Å
170	F	92.6	Very high	89.5	Confident	9 Å²	9	58 Å²	58	4%	0.039	32%	0.316	C	S	.	.	H	α-helix	trans	-58.1	-46.5	174.6	-172.4	-127.7	0	0	0	112.3	F84 V87 V91 R96 L99 L100 E166 V172 L173 G174	F84-F170 HydrophobicContact CB-CZ 4.21Å; F84-F170 HydrophobicContact CD1-CD1 4.03Å; F84-F170 HydrophobicContact CD1-CD2 4.48Å; F84-F170 AromaticContact CD1-CE1 3.61Å; F84-F170 HydrophobicContact CD1-CE1 3.61Å; F84-F170 HydrophobicContact CD1-CE2 4.11Å; F84-F170 HydrophobicContact CD1-CG 4.46Å; F84-F170 AromaticContact CD1-CZ 3.66Å; F84-F170 HydrophobicContact CD1-CZ 3.66Å; F84-F170 HydrophobicContact CE1-CD1 4.21Å; F84-F170 HydrophobicContact CE1-CE1 4.21Å; F84-F170 HydrophobicContact CG-CZ 4.44Å; V87-F170 HydrophobicContact CB-CD2 4.21Å; V87-F170 HydrophobicContact CB-CE2 4.07Å; V87-F170 HydrophobicContact CG1-CD2 3.99Å; V87-F170 HydrophobicContact CG1-CE2 4.32Å; V87-F170 HydrophobicContact CG2-CD2 4.42Å; V87-F170 HydrophobicContact CG2-CE2 4.32Å; V91-F170 HydrophobicContact CB-CD2 4.19Å; V91-F170 HydrophobicContact CB-CG 4.35Å; V91-F170 HydrophobicContact CG1-CB 4.47Å; V91-F170 HydrophobicContact CG1-CD1 4.28Å; V91-F170 HydrophobicContact CG1-CG 4.19Å; V91-F170 HydrophobicContact CG2-CB 3.81Å; V91-F170 HydrophobicContact CG2-CD2 3.63Å; V91-F170 HydrophobicContact CG2-CE2 4.35Å; V91-F170 HydrophobicContact CG2-CG 3.82Å; R96-F170 HydrophobicContact CB-CE1 4.3Å; R96-F170 HydrophobicContact CG-CE1 4.07Å; R96-F170 HydrophobicContact CG-CZ 4.11Å; L99-F170 HydrophobicContact CD2-CD1 3.78Å; L99-F170 HydrophobicContact CD2-CE1 4.19Å; L100-F170 HydrophobicContact CD1-CE1 4.36Å; E166-F170 WeakPolarHBondContact O-CB 3.35Å; E166-F170 PolarHBondContact O-N 3.34Å; F170-V172 VanDerWaalsContact C-N 3.34Å; F170-V172 PolarHBondContact O-N 3.02Å; F170-L173 PolarHBondContact O-N 3.03Å; F170-G174 PolarHBondContact O-N 3.4Å
171	S	92.2	Very high	89.6	Confident	7 Å²	7	63 Å²	63	5%	0.049	34%	0.339	C	S	.	.	H	α-helix	trans	-58.8	-43.8	177.5	-60.2	0	0	0	0	111.8	L99 S161 I167 Q168 A169 F175	L99-S171 VanDerWaalsContact CD2-OG 3.32Å; L99-S171 WeakPolarHBondContact CD2-OG 3.45Å; S161-S171 WeakPolarHBondContact CA-OG 3.42Å; S161-S171 VanDerWaalsContact CB-OG 3.27Å; S161-S171 WeakPolarHBondContact CB-OG 2.99Å; I167-S171 VanDerWaalsContact O-CB 3.26Å; I167-S171 WeakPolarHBondContact O-CB 3.18Å; I167-S171 PolarHBondContact O-N 3.47Å; I167-S171 PolarHBondContact O-OG 2.98Å; Q168-S171 PolarHBondContact O-N 3.32Å; A169-S171 PolarHBondContact O-N 2.85Å; S171-F175 WeakPolarHBondContact O-CB 3.05Å; S171-F175 PolarHBondContact O-N 3.11Å
172	V	92.7	Very high	90	Very high	94 Å²	94	65.1 Å²	65.1	57%	0.57	34%	0.343	S	S	*	.	H	α-helix	trans	-69.2	-42.7	179.9	171.5	0	0	0	0	111.5	Q168 A169 F170 K176	Q168-V172 WeakPolarHBondContact O-CG2 3.31Å; Q168-V172 PolarHBondContact O-N 3.36Å; A169-V172 PolarHBondContact O-N 3.21Å; F170-V172 VanDerWaalsContact C-N 3.34Å; F170-V172 PolarHBondContact O-N 3.02Å; V172-K176 WeakPolarHBondContact O-CB 3.43Å; V172-K176 PolarHBondContact O-N 3.06Å
173	L	93.3	Very high	90.4	Very high	66 Å²	66	65.4 Å²	65.4	35%	0.346	35%	0.346	S	S	.	.	H	α-helix	trans	-67.8	-49.7	179.3	-68.9	173.4	0	0	0	111.9	V87 A169 F170 F175 K176 N177	V87-L173 HydrophobicContact CG1-CB 3.73Å; V87-L173 HydrophobicContact CG1-CD1 3.79Å; V87-L173 HydrophobicContact CG1-CG 4.42Å; V87-L173 HydrophobicContact CG2-CB 3.95Å; A169-L173 WeakPolarHBondContact O-CG 3.46Å; A169-L173 PolarHBondContact O-N 3.19Å; F170-L173 PolarHBondContact O-N 3.03Å; L173-F175 VanDerWaalsContact C-N 3.32Å; L173-F175 PolarHBondContact O-N 2.73Å; L173-K176 WeakPolarHBondContact O-CB 3.45Å; L173-K176 PolarHBondContact O-N 2.75Å; L173-N177 PolarHBondContact O-N 3.22Å; L173-N177 PolarHBondContact O-OD1 3.45Å
174	G	93.8	Very high	90.9	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-64.2	-36.6	178	0	0	0	0	0	112.5	F84 F170 N177 L178	F84-G174 VanDerWaalsContact CE2-C 3.44Å; F170-G174 PolarHBondContact O-N 3.4Å; G174-N177 PolarHBondContact O-N 2.95Å; G174-L178 WeakPolarHBondContact O-CB 3.47Å; G174-L178 PolarHBondContact O-N 3.27Å
175	F	94.3	Very high	91.2	Very high	34 Å²	34	65.7 Å²	65.7	15%	0.149	35%	0.353	C	S	.	.	H	α-helix	trans	-68.2	-37.1	173.9	-174.6	-121.2	0	0	0	112.8	S171 L173 L178 Q179 I185 L188	S171-F175 WeakPolarHBondContact O-CB 3.05Å; S171-F175 PolarHBondContact O-N 3.11Å; L173-F175 VanDerWaalsContact C-N 3.32Å; L173-F175 PolarHBondContact O-N 2.73Å; F175-L178 PolarHBondContact O-N 3.42Å; F175-Q179 HydrophobicContact CD1-CG 4.49Å; F175-Q179 HydrophobicContact CD2-CG 4.43Å; F175-Q179 HydrophobicContact CE1-CG 4.07Å; F175-Q179 HydrophobicContact CE2-CG 3.98Å; F175-Q179 HydrophobicContact CZ-CG 3.78Å; F175-Q179 WeakPolarHBondContact O-CG 3.29Å; F175-Q179 PolarHBondContact O-N 3.31Å; F175-I185 HydrophobicContact CE2-CG2 3.83Å; F175-I185 HydrophobicContact CZ-CG2 4.46Å; F175-L188 HydrophobicContact CB-CB 4.29Å; F175-L188 HydrophobicContact CD2-CB 3.69Å; F175-L188 HydrophobicContact CD2-CD1 4.23Å; F175-L188 HydrophobicContact CE2-CB 4.22Å; F175-L188 HydrophobicContact CG-CB 4.01Å
176	K	93.7	Very high	91.2	Very high	147 Å²	147	67.5 Å²	67.5	64%	0.639	36%	0.356	S	S	*	.	H	α-helix	trans	-62.7	-42.9	173.4	-176.7	-174	176.2	-172	0	111.7	V172 L173 Q179 S180	V172-K176 WeakPolarHBondContact O-CB 3.43Å; V172-K176 PolarHBondContact O-N 3.06Å; L173-K176 WeakPolarHBondContact O-CB 3.45Å; L173-K176 PolarHBondContact O-N 2.75Å; K176-Q179 PolarHBondContact O-N 3.33Å; K176-S180 PolarHBondContact O-N 3.1Å; K176-S180 VanDerWaalsContact O-N 3.16Å
177	N	94.3	Very high	91.4	Very high	47 Å²	47	65.7 Å²	65.7	25%	0.251	35%	0.352	S	S	.	.	H	α-helix	trans	-60	-47.2	174.2	-70.5	0.3	0	0	0	110.4	A83 S86 L173 G174 Q179 S180	A83-N177 HydrophobicContact CB-CB 3.99Å; A83-N177 VanDerWaalsContact O-CB 3.29Å; A83-N177 WeakPolarHBondContact O-CB 3.25Å; A83-N177 PolarHBondContact O-ND2 3.39Å; S86-N177 PolarHBondContact OG-ND2 3.36Å; S86-N177 VanDerWaalsContact OG-ND2 3.1Å; L173-N177 PolarHBondContact O-N 3.22Å; L173-N177 PolarHBondContact O-OD1 3.45Å; G174-N177 PolarHBondContact O-N 2.95Å; N177-Q179 PolarHBondContact O-N 3.24Å; N177-S180 WeakPolarHBondContact O-CB 3.46Å; N177-S180 PolarHBondContact O-N 3.03Å; N177-S180 PolarHBondContact O-OG 2.85Å
178	L	94.3	Very high	91.5	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-62.4	-39.9	179.8	-174.9	60.3	0	0	0	112.6	N79 V80 A83 G174 F175 S180 E181 R182 I185 E191	N79-L178 HydrophobicContact CB-CD1 4.2Å; V80-L178 HydrophobicContact CG2-CD2 3.94Å; A83-L178 HydrophobicContact CB-CB 3.64Å; A83-L178 HydrophobicContact CB-CD1 4.11Å; A83-L178 HydrophobicContact CB-CG 4.44Å; G174-L178 WeakPolarHBondContact O-CB 3.47Å; G174-L178 PolarHBondContact O-N 3.27Å; F175-L178 PolarHBondContact O-N 3.42Å; L178-S180 VanDerWaalsContact C-N 3.27Å; L178-S180 PolarHBondContact O-N 3.09Å; L178-E181 PolarHBondContact O-N 3.28Å; L178-R182 PolarHBondContact O-N 3.15Å; L178-I185 HydrophobicContact CD1-CD1 4.28Å; L178-I185 HydrophobicContact CD2-CD1 4.11Å; L178-I185 HydrophobicContact CG-CD1 3.94Å; L178-E191 HydrophobicContact CD2-CG 4.11Å
179	Q	94.2	Very high	91.6	Very high	73 Å²	73	63.5 Å²	63.5	34%	0.341	34%	0.344	S	S	.	.	H	α-helix	trans	-67.3	-25.2	175.1	-77.8	-168.1	-33.9	0	0	113.4	F175 K176 N177 E181 R182 P183 I185	F175-Q179 HydrophobicContact CD1-CG 4.49Å; F175-Q179 HydrophobicContact CD2-CG 4.43Å; F175-Q179 HydrophobicContact CE1-CG 4.07Å; F175-Q179 HydrophobicContact CE2-CG 3.98Å; F175-Q179 HydrophobicContact CZ-CG 3.78Å; F175-Q179 WeakPolarHBondContact O-CG 3.29Å; F175-Q179 PolarHBondContact O-N 3.31Å; K176-Q179 PolarHBondContact O-N 3.33Å; N177-Q179 PolarHBondContact O-N 3.24Å; Q179-E181 VanDerWaalsContact C-N 3.34Å; Q179-R182 CarbonylContact O-C 3.59Å; Q179-R182 PolarHBondContact O-N 3.47Å; Q179-P183 WeakPolarHBondContact O-CA 3.13Å; Q179-I185 PolarHBondContact NE2-O 2.63Å
180	S	91.1	Very high	91.6	Very high	95 Å²	95	65.1 Å²	65.1	66%	0.664	35%	0.345	S	S	*	.	H	α-helix	trans	-68.6	-34.2	177	78.8	0	0	0	0	112.5	K176 N177 L178	K176-S180 PolarHBondContact O-N 3.1Å; K176-S180 VanDerWaalsContact O-N 3.16Å; N177-S180 WeakPolarHBondContact O-CB 3.46Å; N177-S180 PolarHBondContact O-N 3.03Å; N177-S180 PolarHBondContact O-OG 2.85Å; L178-S180 VanDerWaalsContact C-N 3.27Å; L178-S180 PolarHBondContact O-N 3.09Å
181	E	86.3	Confident	91.7	Very high	110 Å²	110	65.1 Å²	65.1	51%	0.514	35%	0.346	S	S	.	.	H	α-helix	trans	-85.5	-32.4	173.4	-61.9	-174.8	166.1	0	0	112.1	L178 Q179	L178-E181 PolarHBondContact O-N 3.28Å; Q179-E181 VanDerWaalsContact C-N 3.34Å
182	R	90.3	Very high	91.9	Very high	71 Å²	71	65 Å²	65	27%	0.268	34%	0.344	S	S	.	.			trans	-134.3	77.8	-173.8	-61.3	-178.2	71.6	168.4	9.1	112.2	D76 L178 Q179 N184 I185	D76-R182 IonicContact OD1-CZ 2.79Å; D76-R182 IonicContact OD1-NH1 2.79Å; D76-R182 PolarHBondContact OD1-NH1 2.89Å; D76-R182 IonicContact OD1-NH2 3.39Å; D76-R182 PolarHBondContact OD1-NH2 3.23Å; L178-R182 PolarHBondContact O-N 3.15Å; Q179-R182 CarbonylContact O-C 3.59Å; Q179-R182 PolarHBondContact O-N 3.47Å; R182-N184 PolarHBondContact O-N 3.37Å; R182-I185 HydrophobicContact CB-CD1 3.56Å; R182-I185 HydrophobicContact CB-CG1 4Å; R182-I185 HydrophobicContact CG-CD1 4.37Å; R182-I185 PolarHBondContact O-N 2.79Å
183	P	89.2	Confident	92	Very high	98 Å²	98	62.6 Å²	62.6	64%	0.636	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-20.7	-174.8	-26.7	35.7	0	0	0	115.7	Q179 I185	Q179-P183 WeakPolarHBondContact O-CA 3.13Å; P183-I185 VanDerWaalsContact C-N 3.27Å; P183-I185 PolarHBondContact O-N 2.79Å
184	N	88.7	Confident	92.1	Very high	155 Å²	155	61.2 Å²	61.2	83%	0.829	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-5.2	-177	-63.1	-18.6	0	0	0	114	R182 L186	R182-N184 PolarHBondContact O-N 3.37Å; N184-L186 PolarHBondContact O-N 3.44Å
185	I	88.1	Confident	92.3	Very high	12 Å²	12	61.2 Å²	61.2	6%	0.062	32%	0.319	C	S	.	.			trans	-82.2	115.6	-179.6	-57.9	174.4	0	0	0	109.7	F175 L178 Q179 R182 P183 E191	F175-I185 HydrophobicContact CE2-CG2 3.83Å; F175-I185 HydrophobicContact CZ-CG2 4.46Å; L178-I185 HydrophobicContact CD1-CD1 4.28Å; L178-I185 HydrophobicContact CD2-CD1 4.11Å; L178-I185 HydrophobicContact CG-CD1 3.94Å; Q179-I185 PolarHBondContact NE2-O 2.63Å; R182-I185 HydrophobicContact CB-CD1 3.56Å; R182-I185 HydrophobicContact CB-CG1 4Å; R182-I185 HydrophobicContact CG-CD1 4.37Å; R182-I185 PolarHBondContact O-N 2.79Å; P183-I185 VanDerWaalsContact C-N 3.27Å; P183-I185 PolarHBondContact O-N 2.79Å; I185-E191 HydrophobicContact CD1-CG 3.98Å; I185-E191 HydrophobicContact CG2-CG 3.65Å
186	L	87.9	Confident	92.3	Very high	145 Å²	145	60.4 Å²	60.4	76%	0.759	32%	0.317	S	S	*	.			trans	-77.9	-43.3	-174.7	-60.6	179.6	0	0	0	113.2	N184	N184-L186 PolarHBondContact O-N 3.44Å
187	T	91.2	Very high	92.4	Very high	61 Å²	61	58.6 Å²	58.6	37%	0.374	31%	0.311	S	S	.	.			trans	-139.9	152.8	177	83	0	0	0	0	112.3	N189 D190	T187-N189 PolarHBondContact O-N 3.48Å; T187-N189 PolarHBondContact OG1-N 3.01Å; T187-D190 WeakPolarHBondContact CB-OD2 3.24Å; T187-D190 PolarHBondContact N-OD2 3.39Å; T187-D190 VanDerWaalsContact N-OD2 3.11Å; T187-D190 PolarHBondContact O-N 3Å; T187-D190 PolarHBondContact OG1-N 3.45Å; T187-D190 PolarHBondContact OG1-OD2 2.89Å
188	L	92.6	Very high	92.5	Very high	15 Å²	15	57.1 Å²	57.1	8%	0.079	30%	0.302	C	S	.	.	H	α-helix	trans	-59.5	-33.6	172.7	179.4	62.3	0	0	0	112.4	F84 L99 F175 D190 E191 L192	F84-L188 HydrophobicContact CE2-CD1 3.58Å; F84-L188 HydrophobicContact CZ-CD1 3.59Å; F84-L188 HydrophobicContact CZ-CD2 3.7Å; F84-L188 HydrophobicContact CZ-CG 4.3Å; L99-L188 HydrophobicContact CD1-CD2 4.5Å; F175-L188 HydrophobicContact CB-CB 4.29Å; F175-L188 HydrophobicContact CD2-CB 3.69Å; F175-L188 HydrophobicContact CD2-CD1 4.23Å; F175-L188 HydrophobicContact CE2-CB 4.22Å; F175-L188 HydrophobicContact CG-CB 4.01Å; L188-D190 VanDerWaalsContact C-N 3.28Å; L188-D190 PolarHBondContact O-N 3.13Å; L188-E191 PolarHBondContact O-N 3.45Å; L188-L192 HydrophobicContact CD1-CD1 4.18Å; L188-L192 HydrophobicContact CD1-CG 4.11Å; L188-L192 HydrophobicContact CD2-CD1 4.07Å; L188-L192 HydrophobicContact CG-CD1 3.76Å; L188-L192 HydrophobicContact CG-CG 4.08Å; L188-L192 WeakPolarHBondContact O-CG 3.41Å; L188-L192 PolarHBondContact O-N 3.44Å
189	N	92.1	Very high	92.6	Very high	48 Å²	48	57.4 Å²	57.4	26%	0.257	30%	0.303	S	S	.	.	H	α-helix	trans	-68.6	-26.4	-179.3	-87.4	-30	0	0	0	112.6	V158 T187 E191 I193	V158-N189 PolarHBondContact O-ND2 3.26Å; T187-N189 PolarHBondContact O-N 3.48Å; T187-N189 PolarHBondContact OG1-N 3.01Å; N189-E191 PolarHBondContact O-N 3.19Å; N189-I193 VanDerWaalsContact O-CB 3.3Å; N189-I193 WeakPolarHBondContact O-CB 3.38Å; N189-I193 WeakPolarHBondContact O-CG2 3.5Å; N189-I193 PolarHBondContact O-N 2.94Å
190	D	91.5	Very high	92.6	Very high	80 Å²	80	56.8 Å²	56.8	43%	0.428	30%	0.304	S	S	.	.	H	α-helix	trans	-68	-23.5	174.3	-58.9	-51.7	0	0	0	112.4	T187 L188 I193	T187-D190 WeakPolarHBondContact CB-OD2 3.24Å; T187-D190 PolarHBondContact N-OD2 3.39Å; T187-D190 VanDerWaalsContact N-OD2 3.11Å; T187-D190 PolarHBondContact O-N 3Å; T187-D190 PolarHBondContact OG1-N 3.45Å; T187-D190 PolarHBondContact OG1-OD2 2.89Å; L188-D190 VanDerWaalsContact C-N 3.28Å; L188-D190 PolarHBondContact O-N 3.13Å; D190-I193 WeakPolarHBondContact O-CG2 3.44Å
191	E	94.3	Very high	92.9	Very high	10 Å²	10	55.5 Å²	55.5	5%	0.047	29%	0.287	C	S	.	.	H	α-helix	trans	-88.8	-49.8	173.7	-63.8	-63.6	133.8	0	0	111.2	V80 L178 I185 L188 N189 I193 K194	V80-E191 HydrophobicContact CG2-CB 3.98Å; V80-E191 HydrophobicContact CG2-CG 4.5Å; L178-E191 HydrophobicContact CD2-CG 4.11Å; I185-E191 HydrophobicContact CD1-CG 3.98Å; I185-E191 HydrophobicContact CG2-CG 3.65Å; L188-E191 PolarHBondContact O-N 3.45Å; N189-E191 PolarHBondContact O-N 3.19Å; E191-I193 PolarHBondContact O-N 3.4Å; E191-K194 VanDerWaalsContact O-CB 3.28Å; E191-K194 WeakPolarHBondContact O-CB 3.4Å; E191-K194 WeakPolarHBondContact O-CG 3.43Å; E191-K194 PolarHBondContact O-N 2.93Å; E191-K194 WeakPolarHBondContact OE1-CE 3.27Å; E191-K194 IonicContact OE1-NZ 2.58Å; E191-K194 PolarHBondContact OE1-NZ 2.87Å; E191-K194 WeakPolarHBondContact OE2-CE 3.45Å; E191-K194 IonicContact OE2-NZ 3.07Å; E191-K194 PolarHBondContact OE2-NZ 3.48Å
192	L	95.4	Very high	93.4	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-66.1	-19	-178.1	-62.1	-179.1	0	0	0	113.7	V80 L99 L100 Y152 F156 L188 K194 P195	V80-L192 HydrophobicContact CG1-CD2 4.13Å; L99-L192 HydrophobicContact CD1-CD1 4.03Å; L99-L192 HydrophobicContact CG-CD1 4.4Å; L100-L192 HydrophobicContact CD2-CD2 3.85Å; Y152-L192 PolarHBondContact OH-O 2.93Å; F156-L192 WeakPolarHBondContact CD2-O 3.41Å; F156-L192 HydrophobicContact CE2-CB 3.88Å; F156-L192 WeakPolarHBondContact CE2-O 3.3Å; L188-L192 HydrophobicContact CD1-CD1 4.18Å; L188-L192 HydrophobicContact CD1-CG 4.11Å; L188-L192 HydrophobicContact CD2-CD1 4.07Å; L188-L192 HydrophobicContact CG-CD1 3.76Å; L188-L192 HydrophobicContact CG-CG 4.08Å; L188-L192 WeakPolarHBondContact O-CG 3.41Å; L188-L192 PolarHBondContact O-N 3.44Å; L192-K194 VanDerWaalsContact C-N 3.35Å; L192-P195 WeakPolarHBondContact O-CD 3.44Å
193	I	94.7	Very high	93.6	Very high	44 Å²	44	49.7 Å²	49.7	23%	0.226	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-19	172.8	-165	64.1	0	0	0	113.1	F156 N189 D190 E191 V196 Q197	F156-I193 HydrophobicContact CD1-CD1 4.33Å; F156-I193 HydrophobicContact CE1-CD1 3.47Å; F156-I193 VanDerWaalsContact CE1-CD1 3.47Å; F156-I193 HydrophobicContact CZ-CB 4.23Å; F156-I193 HydrophobicContact CZ-CD1 3.58Å; F156-I193 HydrophobicContact CZ-CG1 4.5Å; N189-I193 VanDerWaalsContact O-CB 3.3Å; N189-I193 WeakPolarHBondContact O-CB 3.38Å; N189-I193 WeakPolarHBondContact O-CG2 3.5Å; N189-I193 PolarHBondContact O-N 2.94Å; D190-I193 WeakPolarHBondContact O-CG2 3.44Å; E191-I193 PolarHBondContact O-N 3.4Å; I193-V196 HydrophobicContact CD1-CB 3.98Å; I193-V196 HydrophobicContact CD1-CG1 4.42Å; I193-V196 HydrophobicContact CD1-CG2 4Å; I193-V196 WeakPolarHBondContact O-CA 3.49Å; I193-V196 WeakPolarHBondContact O-CB 3.42Å; I193-V196 PolarHBondContact O-N 2.88Å; I193-Q197 HydrophobicContact CG1-CG 4.27Å; I193-Q197 PolarHBondContact O-N 2.82Å; I193-Q197 VanDerWaalsContact O-N 3.13Å
194	K	96.3	Very high	93.9	Very high	38 Å²	38	48.2 Å²	48.2	17%	0.165	25%	0.247	C	C	.	.	H	α-helix	trans	-56.9	-41	-173.3	-69.5	177.5	178.8	176.7	0	113.9	F73 D76 M77 E191 L192 V196 Q197 R198	F73-K194 HydrophobicContact CD2-CB 4.46Å; F73-K194 HydrophobicContact CE2-CB 4.3Å; D76-K194 HydrophobicContact CB-CD 4.32Å; D76-K194 VanDerWaalsContact CG-NZ 3.34Å; D76-K194 IonicContact OD1-NZ 2.65Å; D76-K194 IonicContact OD2-NZ 2.8Å; D76-K194 PolarHBondContact OD2-NZ 3.28Å; M77-K194 HydrophobicContact CE-CB 4.02Å; M77-K194 HydrophobicContact CE-CD 3.84Å; M77-K194 HydrophobicContact CE-CG 4.45Å; M77-K194 HydrophobicContact SD-CB 4.48Å; E191-K194 VanDerWaalsContact O-CB 3.28Å; E191-K194 WeakPolarHBondContact O-CB 3.4Å; E191-K194 WeakPolarHBondContact O-CG 3.43Å; E191-K194 PolarHBondContact O-N 2.93Å; E191-K194 WeakPolarHBondContact OE1-CE 3.27Å; E191-K194 IonicContact OE1-NZ 2.58Å; E191-K194 PolarHBondContact OE1-NZ 2.87Å; E191-K194 WeakPolarHBondContact OE2-CE 3.45Å; E191-K194 IonicContact OE2-NZ 3.07Å; E191-K194 PolarHBondContact OE2-NZ 3.48Å; L192-K194 VanDerWaalsContact C-N 3.35Å; K194-V196 VanDerWaalsContact C-N 3.29Å; K194-V196 PolarHBondContact O-N 3.46Å; K194-Q197 CarbonylContact O-C 3.38Å; K194-Q197 PolarHBondContact O-N 2.98Å; K194-Q197 VanDerWaalsContact O-N 3.17Å; K194-R198 WeakPolarHBondContact O-CB 3.37Å; K194-R198 PolarHBondContact O-N 2.91Å
195	P	97.4	Very high	94.4	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-57.8	-36	172.6	-31.6	40.4	0	0	0	114.6	F73 M77 L103 L106 Y152 L192 R198	F73-P195 HydrophobicContact CE2-CB 4.48Å; F73-P195 HydrophobicContact CE2-CG 4.09Å; F73-P195 HydrophobicContact CZ-CB 4.38Å; F73-P195 HydrophobicContact CZ-CG 4.13Å; M77-P195 HydrophobicContact SD-CG 3.76Å; L103-P195 HydrophobicContact CD1-CG 4.3Å; L106-P195 HydrophobicContact CD2-CB 3.66Å; L106-P195 HydrophobicContact CD2-CG 3.98Å; Y152-P195 HydrophobicContact CD1-CB 3.43Å; Y152-P195 VanDerWaalsContact CD1-CB 3.43Å; Y152-P195 HydrophobicContact CD1-CG 4Å; Y152-P195 HydrophobicContact CE1-CB 3.5Å; Y152-P195 VanDerWaalsContact CE1-CB 3.5Å; Y152-P195 HydrophobicContact CE1-CG 3.61Å; Y152-P195 HydrophobicContact CE2-CG 4.29Å; Y152-P195 HydrophobicContact CG-CB 4.06Å; L192-P195 WeakPolarHBondContact O-CD 3.44Å; P195-R198 PolarHBondContact O-N 2.8Å
196	V	94.9	Very high	94.8	Very high	17 Å²	17	40.4 Å²	40.4	10%	0.103	21%	0.205	C	C	.	.	H	α-helix	trans	-68.7	-41.2	176.5	-171.7	0	0	0	0	110.4	I153 F156 I193 K194	I153-V196 HydrophobicContact CG1-CB 4.48Å; I153-V196 HydrophobicContact CG1-CG2 4.17Å; I153-V196 HydrophobicContact CG2-CG1 4.02Å; I153-V196 HydrophobicContact CG2-CG2 4.23Å; F156-V196 HydrophobicContact CB-CG2 4.33Å; F156-V196 HydrophobicContact CD1-CG2 3.91Å; F156-V196 HydrophobicContact CE1-CG2 4.41Å; F156-V196 HydrophobicContact CG-CG2 3.97Å; I193-V196 HydrophobicContact CD1-CB 3.98Å; I193-V196 HydrophobicContact CD1-CG1 4.42Å; I193-V196 HydrophobicContact CD1-CG2 4Å; I193-V196 WeakPolarHBondContact O-CA 3.49Å; I193-V196 WeakPolarHBondContact O-CB 3.42Å; I193-V196 PolarHBondContact O-N 2.88Å; K194-V196 VanDerWaalsContact C-N 3.29Å; K194-V196 PolarHBondContact O-N 3.46Å
197	Q	95.9	Very high	95.2	Very high	109 Å²	109	37.1 Å²	37.1	51%	0.509	19%	0.185	S	C	.	.	H	α-helix	trans	-68.3	-34.4	174.9	-63.7	170.4	-12.5	0	0	112.1	I193 K194 L199 V200 K201	I193-Q197 HydrophobicContact CG1-CG 4.27Å; I193-Q197 PolarHBondContact O-N 2.82Å; I193-Q197 VanDerWaalsContact O-N 3.13Å; K194-Q197 CarbonylContact O-C 3.38Å; K194-Q197 PolarHBondContact O-N 2.98Å; K194-Q197 VanDerWaalsContact O-N 3.17Å; Q197-L199 VanDerWaalsContact C-N 3.34Å; Q197-L199 PolarHBondContact O-N 3.22Å; Q197-V200 PolarHBondContact O-N 2.98Å; Q197-V200 VanDerWaalsContact O-N 3.13Å; Q197-K201 PolarHBondContact O-N 2.95Å
198	R	97.3	Very high	95.5	Very high	15 Å²	15	37.3 Å²	37.3	6%	0.057	18%	0.184	C	C	.	.	H	α-helix	trans	-61.9	-38.9	-177.4	-171.7	64.1	-176.8	160.2	4.6	112.1	T69 Q70 F73 K194 P195 V200 K201 L202	T69-R198 PolarHBondContact O-NH1 3.24Å; T69-R198 PolarHBondContact OG1-NH1 2.89Å; Q70-R198 VanDerWaalsContact CA-NH2 3.3Å; F73-R198 HydrophobicContact CD1-CG 4.18Å; F73-R198 HydrophobicContact CD2-CB 4.16Å; F73-R198 HydrophobicContact CD2-CG 4.13Å; F73-R198 HydrophobicContact CE1-CG 4.23Å; F73-R198 HydrophobicContact CE2-CB 3.94Å; F73-R198 HydrophobicContact CE2-CG 4.18Å; F73-R198 HydrophobicContact CG-CG 4.13Å; F73-R198 HydrophobicContact CZ-CB 4.25Å; F73-R198 HydrophobicContact CZ-CG 4.23Å; K194-R198 WeakPolarHBondContact O-CB 3.37Å; K194-R198 PolarHBondContact O-N 2.91Å; P195-R198 PolarHBondContact O-N 2.8Å; R198-V200 VanDerWaalsContact C-N 3.35Å; R198-V200 PolarHBondContact O-N 3.42Å; R198-K201 PolarHBondContact O-N 3.41Å; R198-L202 HydrophobicContact CG-CD1 4.11Å; R198-L202 HydrophobicContact CG-CG 4.32Å; R198-L202 WeakPolarHBondContact O-CB 3.47Å; R198-L202 VanDerWaalsContact O-CG 3.27Å; R198-L202 WeakPolarHBondContact O-CG 3.47Å; R198-L202 PolarHBondContact O-N 3.09Å
199	L	96.1	Very high	95.6	Very high	7 Å²	7	36.6 Å²	36.6	4%	0.037	18%	0.18	C	C	.	.	H	α-helix	trans	-58.5	-45.5	173.7	176.4	56.9	0	0	0	112	L149 I153 Q197 L202 K203 F230 L233 A234	L149-L199 HydrophobicContact CD1-CD1 4.44Å; I153-L199 HydrophobicContact CD1-CB 3.91Å; I153-L199 HydrophobicContact CD1-CD2 3.6Å; I153-L199 HydrophobicContact CD1-CG 4.41Å; Q197-L199 VanDerWaalsContact C-N 3.34Å; Q197-L199 PolarHBondContact O-N 3.22Å; L199-L202 PolarHBondContact O-N 3.31Å; L199-K203 PolarHBondContact O-N 3.3Å; L199-K203 VanDerWaalsContact O-N 3.08Å; L199-F230 HydrophobicContact CD1-CB 4.35Å; L199-F230 HydrophobicContact CD1-CD1 3.87Å; L199-L233 HydrophobicContact CD1-CB 4.33Å; L199-L233 HydrophobicContact CD1-CD2 3.68Å; L199-L233 HydrophobicContact CD1-CG 3.98Å; L199-L233 HydrophobicContact CD2-CD2 4.49Å; L199-L233 HydrophobicContact CD2-CG 4.17Å; L199-A234 HydrophobicContact CD2-CB 4.3Å; L199-A234 HydrophobicContact CG-CB 4.43Å
200	V	93.9	Very high	95.8	Very high	60 Å²	60	36.8 Å²	36.8	36%	0.364	18%	0.179	S	C	.	.	H	α-helix	trans	-65.1	-43.9	178.3	-176.6	0	0	0	0	110.9	L6 Q197 R198 K203 Q204	L6-V200 HydrophobicContact CD2-CG2 4.34Å; Q197-V200 PolarHBondContact O-N 2.98Å; Q197-V200 VanDerWaalsContact O-N 3.13Å; R198-V200 VanDerWaalsContact C-N 3.35Å; R198-V200 PolarHBondContact O-N 3.42Å; V200-K203 PolarHBondContact O-N 3.48Å; V200-Q204 WeakPolarHBondContact O-CG 3.48Å; V200-Q204 PolarHBondContact O-N 3.49Å; V200-Q204 VanDerWaalsContact O-N 3.08Å
201	K	96.2	Very high	95.9	Very high	67 Å²	67	38.1 Å²	38.1	29%	0.291	19%	0.186	S	C	.	.	H	α-helix	trans	-67.4	-36.6	179.1	-174.2	58.1	176.2	175.3	0	112.4	E65 Q197 R198 Q204 L205	E65-K201 WeakPolarHBondContact OE1-CE 3.4Å; E65-K201 IonicContact OE1-NZ 2.72Å; E65-K201 PolarHBondContact OE1-NZ 2.66Å; Q197-K201 PolarHBondContact O-N 2.95Å; R198-K201 PolarHBondContact O-N 3.41Å; K201-Q204 PolarHBondContact O-N 2.74Å; K201-L205 HydrophobicContact CD-CD1 4.31Å; K201-L205 HydrophobicContact CD-CG 4.23Å; K201-L205 HydrophobicContact CG-CD1 4Å; K201-L205 HydrophobicContact CG-CG 4.39Å; K201-L205 WeakPolarHBondContact O-CB 3.39Å; K201-L205 VanDerWaalsContact O-CG 3.29Å; K201-L205 WeakPolarHBondContact O-CG 3.17Å; K201-L205 PolarHBondContact O-N 3.36Å
202	L	97.2	Very high	95.9	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.016	19%	0.19	C	C	.	.	H	α-helix	trans	-61.8	-48.4	172.8	-76.5	169.8	0	0	0	110.9	M145 L149 R198 L199 Q204 L205 F206 F230	M145-L202 HydrophobicContact CE-CD1 4.27Å; M145-L202 HydrophobicContact SD-CD1 4.16Å; L149-L202 HydrophobicContact CD1-CD1 4.23Å; R198-L202 HydrophobicContact CG-CD1 4.11Å; R198-L202 HydrophobicContact CG-CG 4.32Å; R198-L202 WeakPolarHBondContact O-CB 3.47Å; R198-L202 VanDerWaalsContact O-CG 3.27Å; R198-L202 WeakPolarHBondContact O-CG 3.47Å; R198-L202 PolarHBondContact O-N 3.09Å; L199-L202 PolarHBondContact O-N 3.31Å; L202-Q204 PolarHBondContact O-N 3.17Å; L202-L205 PolarHBondContact O-N 3.28Å; L202-F206 HydrophobicContact CD2-CE2 4.31Å; L202-F206 WeakPolarHBondContact O-CD2 3.27Å; L202-F206 PolarHBondContact O-N 3.46Å; L202-F230 HydrophobicContact CB-CD1 4.33Å; L202-F230 HydrophobicContact CB-CD2 4.04Å; L202-F230 HydrophobicContact CB-CE1 4.38Å; L202-F230 HydrophobicContact CB-CE2 4.1Å; L202-F230 HydrophobicContact CB-CG 4.18Å; L202-F230 HydrophobicContact CB-CZ 4.28Å; L202-F230 HydrophobicContact CD1-CE1 4.05Å; L202-F230 HydrophobicContact CD1-CZ 4.13Å
203	K	95.5	Very high	95.8	Very high	56 Å²	56	39 Å²	39	24%	0.243	19%	0.192	C	C	.	.	H	α-helix	trans	-52.2	-53.2	173.9	178.4	-175.5	165.9	174.4	0	111.2	L199 V200 L205 F206 E207 F227 F230 D231	L199-K203 PolarHBondContact O-N 3.3Å; L199-K203 VanDerWaalsContact O-N 3.08Å; V200-K203 PolarHBondContact O-N 3.48Å; K203-L205 PolarHBondContact O-N 2.85Å; K203-F206 PolarHBondContact O-N 3.38Å; K203-E207 WeakPolarHBondContact O-CB 3.49Å; K203-E207 PolarHBondContact O-N 3.44Å; K203-F227 HydrophobicContact CG-CD2 4.39Å; K203-F227 HydrophobicContact CG-CE2 4.15Å; K203-F230 HydrophobicContact CB-CB 3.96Å; K203-D231 HydrophobicContact CD-CB 4.39Å; K203-D231 VanDerWaalsContact CE-OD1 3.23Å; K203-D231 WeakPolarHBondContact CE-OD1 3.33Å; K203-D231 IonicContact NZ-OD1 3.46Å; K203-D231 PolarHBondContact NZ-OD1 3.46Å
204	Q	95.9	Very high	95.6	Very high	68 Å²	68	39.1 Å²	39.1	32%	0.318	20%	0.196	S	C	.	.	H	α-helix	trans	-60.3	-43	-179	-71	172.7	-19.2	0	0	113.3	V200 K201 L202 E207 L208	V200-Q204 WeakPolarHBondContact O-CG 3.48Å; V200-Q204 PolarHBondContact O-N 3.49Å; V200-Q204 VanDerWaalsContact O-N 3.08Å; K201-Q204 PolarHBondContact O-N 2.74Å; L202-Q204 PolarHBondContact O-N 3.17Å; Q204-E207 PolarHBondContact O-N 3.28Å; Q204-L208 PolarHBondContact O-N 2.83Å
205	L	97.4	Very high	95.3	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-66.6	-39.3	178.9	-74.7	169.7	0	0	0	111.5	V62 E65 L66 K201 L202 K203 L209	V62-L205 HydrophobicContact CG1-CD2 4.48Å; E65-L205 HydrophobicContact CB-CD2 4.31Å; E65-L205 HydrophobicContact CG-CD2 4.05Å; L66-L205 HydrophobicContact CB-CD1 4.29Å; L66-L205 HydrophobicContact CD1-CB 4.21Å; L66-L205 HydrophobicContact CG-CD1 4.3Å; K201-L205 HydrophobicContact CD-CD1 4.31Å; K201-L205 HydrophobicContact CD-CG 4.23Å; K201-L205 HydrophobicContact CG-CD1 4Å; K201-L205 HydrophobicContact CG-CG 4.39Å; K201-L205 WeakPolarHBondContact O-CB 3.39Å; K201-L205 VanDerWaalsContact O-CG 3.29Å; K201-L205 WeakPolarHBondContact O-CG 3.17Å; K201-L205 PolarHBondContact O-N 3.36Å; L202-L205 PolarHBondContact O-N 3.28Å; K203-L205 PolarHBondContact O-N 2.85Å; L205-L209 WeakPolarHBondContact O-CB 3.34Å; L205-L209 PolarHBondContact O-N 2.88Å
206	F	97.5	Very high	94.9	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-75.2	-29.6	177	-85.6	-78.7	0	0	0	113.7	L66 A135 I138 L202 K203 L209 K210 M226 F227 F230	L66-F206 HydrophobicContact CD1-CD2 4.15Å; L66-F206 HydrophobicContact CD1-CE2 3.71Å; L66-F206 HydrophobicContact CD1-CZ 3.95Å; A135-F206 HydrophobicContact CB-CD1 4.49Å; A135-F206 HydrophobicContact CB-CE1 3.68Å; I138-F206 HydrophobicContact CB-CZ 4.31Å; I138-F206 HydrophobicContact CD1-CE2 4.13Å; I138-F206 HydrophobicContact CD1-CZ 3.65Å; I138-F206 HydrophobicContact CG2-CZ 4.28Å; L202-F206 HydrophobicContact CD2-CE2 4.31Å; L202-F206 WeakPolarHBondContact O-CD2 3.27Å; L202-F206 PolarHBondContact O-N 3.46Å; K203-F206 PolarHBondContact O-N 3.38Å; F206-L209 HydrophobicContact CD1-CD2 4.17Å; F206-L209 HydrophobicContact CE1-CD2 4.14Å; F206-L209 PolarHBondContact O-N 3.18Å; F206-K210 VanDerWaalsContact O-CB 3.26Å; F206-K210 WeakPolarHBondContact O-CB 3.49Å; F206-K210 PolarHBondContact O-N 3.44Å; F206-M226 HydrophobicContact CD1-CB 3.38Å; F206-M226 HydrophobicContact CD1-CG 4.34Å; F206-M226 HydrophobicContact CD2-CB 4.37Å; F206-M226 HydrophobicContact CE1-CB 3.32Å; F206-M226 HydrophobicContact CE1-CG 3.79Å; F206-M226 HydrophobicContact CE2-CB 4.33Å; F206-M226 HydrophobicContact CG-CB 3.91Å; F206-M226 HydrophobicContact CZ-CB 3.81Å; F206-M226 HydrophobicContact CZ-CG 4.07Å; F206-F227 HydrophobicContact CB-CB 4.1Å; F206-F230 HydrophobicContact CB-CD2 4.48Å; F206-F230 AromaticContact CD2-CD2 3.75Å; F206-F230 HydrophobicContact CD2-CD2 3.75Å; F206-F230 AromaticContact CD2-CE2 3.42Å; F206-F230 HydrophobicContact CD2-CE2 3.42Å; F206-F230 VanDerWaalsContact CD2-CE2 3.42Å; F206-F230 HydrophobicContact CE2-CD2 4.31Å; F206-F230 AromaticContact CE2-CE2 3.51Å; F206-F230 HydrophobicContact CE2-CE2 3.51Å; F206-F230 HydrophobicContact CE2-CZ 4.37Å; F206-F230 HydrophobicContact CG-CD2 4.29Å; F206-F230 HydrophobicContact CG-CE2 4.21Å; F206-F230 HydrophobicContact CZ-CE2 4.36Å
207	E	97.1	Very high	94.8	Very high	76 Å²	76	51.2 Å²	51.2	36%	0.355	26%	0.259	S	S	.	.	H	α-helix	trans	-59.9	-54.7	169.4	-169.4	162.6	-149.9	0	0	110.4	K203 Q204 L209 K210 D211 F227	K203-E207 WeakPolarHBondContact O-CB 3.49Å; K203-E207 PolarHBondContact O-N 3.44Å; Q204-E207 PolarHBondContact O-N 3.28Å; E207-L209 VanDerWaalsContact C-N 3.35Å; E207-L209 PolarHBondContact O-N 2.9Å; E207-K210 WeakPolarHBondContact O-CB 3.3Å; E207-K210 PolarHBondContact O-N 3.34Å; E207-D211 PolarHBondContact O-N 2.98Å; E207-D211 VanDerWaalsContact O-N 3.16Å; E207-F227 HydrophobicContact CB-CD2 3.57Å; E207-F227 HydrophobicContact CB-CE2 3.49Å; E207-F227 VanDerWaalsContact CB-CE2 3.49Å; E207-F227 HydrophobicContact CB-CZ 4.49Å; E207-F227 HydrophobicContact CG-CD2 4.1Å; E207-F227 HydrophobicContact CG-CE2 3.56Å; E207-F227 HydrophobicContact CG-CZ 4.14Å
208	L	96.1	Very high	94.7	Very high	65 Å²	65	51 Å²	51	34%	0.34	27%	0.268	S	S	.	.	H	α-helix	trans	-63.2	-39.7	176.6	-177.3	60.1	0	0	0	112	V62 Q204 D211 V212	V62-L208 HydrophobicContact CG2-CD2 3.64Å; V62-L208 HydrophobicContact CG2-CG 3.69Å; Q204-L208 PolarHBondContact O-N 2.83Å; L208-D211 PolarHBondContact O-N 3.41Å; L208-V212 HydrophobicContact CD1-CG1 4.23Å; L208-V212 WeakPolarHBondContact O-CG1 3.42Å; L208-V212 WeakPolarHBondContact O-CG2 3.18Å; L208-V212 PolarHBondContact O-N 2.92Å
209	L	96.2	Very high	94.6	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.2	-43.4	178.4	-168.2	65.3	0	0	0	111.3	R59 V62 V63 I134 L205 F206 E207 D211 V212 T213 T223	R59-L209 HydrophobicContact CG-CD1 4.11Å; V62-L209 HydrophobicContact CB-CD1 4Å; V62-L209 HydrophobicContact CG1-CB 3.86Å; V62-L209 HydrophobicContact CG1-CD1 3.8Å; V62-L209 HydrophobicContact CG1-CG 4.39Å; V63-L209 HydrophobicContact CG2-CD1 4.2Å; I134-L209 HydrophobicContact CD1-CD1 4.39Å; I134-L209 HydrophobicContact CD1-CD2 3.67Å; I134-L209 HydrophobicContact CG1-CD2 3.98Å; L205-L209 WeakPolarHBondContact O-CB 3.34Å; L205-L209 PolarHBondContact O-N 2.88Å; F206-L209 HydrophobicContact CD1-CD2 4.17Å; F206-L209 HydrophobicContact CE1-CD2 4.14Å; F206-L209 PolarHBondContact O-N 3.18Å; E207-L209 VanDerWaalsContact C-N 3.35Å; E207-L209 PolarHBondContact O-N 2.9Å; L209-D211 VanDerWaalsContact C-N 3.33Å; L209-D211 PolarHBondContact O-N 3.35Å; L209-V212 PolarHBondContact O-N 2.92Å; L209-T213 WeakPolarHBondContact O-CB 3.19Å; L209-T213 PolarHBondContact O-N 3.01Å; L209-T213 PolarHBondContact O-OG1 3.4Å; L209-T223 HydrophobicContact CB-CG2 4.46Å; L209-T223 HydrophobicContact CD2-CG2 3.68Å; L209-T223 HydrophobicContact CG-CG2 3.67Å
210	K	94.3	Very high	94.5	Very high	52 Å²	52	50.6 Å²	50.6	23%	0.226	27%	0.267	C	S	.	.	H	α-helix	trans	-54.2	-49.4	173	169.3	-176.4	60.1	65	0	110.7	F206 E207 V212 T213 T224 F227	F206-K210 VanDerWaalsContact O-CB 3.26Å; F206-K210 WeakPolarHBondContact O-CB 3.49Å; F206-K210 PolarHBondContact O-N 3.44Å; E207-K210 WeakPolarHBondContact O-CB 3.3Å; E207-K210 PolarHBondContact O-N 3.34Å; K210-V212 VanDerWaalsContact C-N 3.28Å; K210-V212 PolarHBondContact O-N 3.42Å; K210-T213 PolarHBondContact O-N 2.95Å; K210-T224 HydrophobicContact CD-CG2 4.44Å; K210-F227 HydrophobicContact CD-CD1 4.04Å; K210-F227 HydrophobicContact CD-CG 4.42Å
211	D	93.8	Very high	94.4	Very high	109 Å²	109	49.9 Å²	49.9	58%	0.583	26%	0.261	S	S	*	.	H	α-helix	trans	-68.8	-24.1	-174	-64.8	-17.4	0	0	0	114	E207 L208 L209	E207-D211 PolarHBondContact O-N 2.98Å; E207-D211 VanDerWaalsContact O-N 3.16Å; L208-D211 PolarHBondContact O-N 3.41Å; L209-D211 VanDerWaalsContact C-N 3.33Å; L209-D211 PolarHBondContact O-N 3.35Å
212	V	94.4	Very high	94.3	Very high	20 Å²	20	46.9 Å²	46.9	12%	0.121	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	4.7	179.7	-52.9	0	0	0	0	113.6	Q58 R59 V62 L208 L209 K210	Q58-V212 HydrophobicContact CB-CB 4.45Å; Q58-V212 HydrophobicContact CB-CG1 4.16Å; Q58-V212 HydrophobicContact CG-CB 4.37Å; Q58-V212 HydrophobicContact CG-CG1 3.63Å; R59-V212 HydrophobicContact CB-CB 4.46Å; R59-V212 HydrophobicContact CB-CG2 3.79Å; R59-V212 HydrophobicContact CG-CG2 4.29Å; V62-V212 HydrophobicContact CG2-CG2 4.22Å; L208-V212 HydrophobicContact CD1-CG1 4.23Å; L208-V212 WeakPolarHBondContact O-CG1 3.42Å; L208-V212 WeakPolarHBondContact O-CG2 3.18Å; L208-V212 PolarHBondContact O-N 2.92Å; L209-V212 PolarHBondContact O-N 2.92Å; K210-V212 VanDerWaalsContact C-N 3.28Å; K210-V212 PolarHBondContact O-N 3.42Å
213	T	93.4	Very high	94.2	Very high	12 Å²	12	46.8 Å²	46.8	7%	0.074	25%	0.248	C	C	.	.	S	Bend	trans	-97.2	118.1	-179.8	-59.5	0	0	0	0	110.5	R59 L209 K210 H217 C220 T223	R59-T213 PolarHBondContact NH1-OG1 3.3Å; L209-T213 WeakPolarHBondContact O-CB 3.19Å; L209-T213 PolarHBondContact O-N 3.01Å; L209-T213 PolarHBondContact O-OG1 3.4Å; K210-T213 PolarHBondContact O-N 2.95Å; T213-H217 HydrophobicContact CG2-CB 3.72Å; T213-C220 HydrophobicContact CG2-CB 3.91Å; T213-T223 HydrophobicContact CG2-CG2 4.5Å
214	P	91.4	Very high	94.2	Very high	46 Å²	46	46.5 Å²	46.5	30%	0.299	25%	0.252	S	S	.	.			trans	-59.6	144	175.2	-26	36.3	0	0	0	112.3	N216 H217	P214-N216 WeakPolarHBondContact CB-OD1 3.21Å; P214-N216 PolarHBondContact O-N 3.42Å; P214-N216 VanDerWaalsContact O-N 3.13Å; P214-H217 HydrophobicContact CB-CB 4.49Å; P214-H217 WeakPolarHBondContact O-CB 3.12Å; P214-H217 PolarHBondContact O-N 2.88Å
215	I	89.5	Confident	94.1	Very high	138 Å²	138	45.8 Å²	45.8	71%	0.708	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-31	179.8	-62.2	167.6	0	0	0	112	H217	I215-H217 VanDerWaalsContact C-N 3.34Å
216	N	88.3	Confident	94.1	Very high	148 Å²	148	45.7 Å²	45.7	79%	0.791	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	2.5	176.9	65.1	-18.1	0	0	0	114.6	P214	P214-N216 WeakPolarHBondContact CB-OD1 3.21Å; P214-N216 PolarHBondContact O-N 3.42Å; P214-N216 VanDerWaalsContact O-N 3.13Å
217	H	92.8	Very high	94	Very high	22 Å²	22	46.9 Å²	46.9	10%	0.102	25%	0.253	C	S	.	.	S	Bend	trans	-78.6	134.7	175.5	-167.8	-59.8	0	0	0	109.9	R59 G130 N131 T213 P214 I215 D219 C220	R59-H217 PolarHBondContact NE-NE2 2.75Å; R59-H217 VanDerWaalsContact NE-NE2 3.13Å; R59-H217 PolarHBondContact NH2-CE1 3.49Å; R59-H217 VanDerWaalsContact NH2-CE1 3.31Å; G130-H217 PolarHBondContact O-NE2 3.26Å; G130-H217 VanDerWaalsContact O-NE2 3.17Å; N131-H217 WeakPolarHBondContact CA-NE2 3.34Å; N131-H217 PolarHBondContact O-CE1 2.91Å; T213-H217 HydrophobicContact CG2-CB 3.72Å; P214-H217 HydrophobicContact CB-CB 4.49Å; P214-H217 WeakPolarHBondContact O-CB 3.12Å; P214-H217 PolarHBondContact O-N 2.88Å; I215-H217 VanDerWaalsContact C-N 3.34Å; H217-D219 VanDerWaalsContact ND1-CB 3.3Å; H217-D219 WeakPolarHBondContact ND1-CB 3.15Å; H217-D219 PolarHBondContact ND1-N 2.79Å; H217-D219 VanDerWaalsContact ND1-N 3.15Å; H217-D219 PolarHBondContact O-N 3.48Å; H217-C220 WeakPolarHBondContact O-CB 3.48Å; H217-C220 PolarHBondContact O-N 3.37Å
218	P	94	Very high	93.9	Very high	106 Å²	106	47.5 Å²	47.5	69%	0.688	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	1.6	179.8	25	-36.6	0	0	0	115.9
219	D	95.4	Very high	93.9	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-8	-177.8	-156.3	45.6	0	0	0	111.4	R59 C133 I134 A135 T136 H217 L221 A222 T223	R59-D219 IonicContact CZ-OD2 3.64Å; R59-D219 IonicContact NH1-OD2 3.59Å; R59-D219 IonicContact NH2-OD2 2.63Å; R59-D219 PolarHBondContact NH2-OD2 3.28Å; C133-D219 VanDerWaalsContact C-OD1 3.27Å; C133-D219 WeakPolarHBondContact CA-OD1 3.49Å; C133-D219 HydrophobicContact CB-CB 4.44Å; I134-D219 PolarHBondContact N-OD2 3.41Å; A135-D219 WeakPolarHBondContact CB-OD1 3.48Å; A135-D219 WeakPolarHBondContact CB-OD2 3.24Å; A135-D219 PolarHBondContact N-OD1 3.26Å; A135-D219 PolarHBondContact N-OD2 2.76Å; A135-D219 VanDerWaalsContact N-OD2 3.14Å; T136-D219 WeakPolarHBondContact CB-OD1 3.38Å; T136-D219 PolarHBondContact N-OD1 2.93Å; T136-D219 PolarHBondContact OG1-OD1 3.04Å; H217-D219 VanDerWaalsContact ND1-CB 3.3Å; H217-D219 WeakPolarHBondContact ND1-CB 3.15Å; H217-D219 PolarHBondContact ND1-N 2.79Å; H217-D219 VanDerWaalsContact ND1-N 3.15Å; H217-D219 PolarHBondContact O-N 3.48Å; D219-L221 PolarHBondContact O-N 3.5Å; D219-A222 PolarHBondContact O-N 3.49Å; D219-T223 WeakPolarHBondContact O-CG2 3.43Å; D219-T223 PolarHBondContact O-N 2.79Å; D219-T223 PolarHBondContact O-OG1 3.36Å
220	C	93.8	Very high	93.9	Very high	12 Å²	12	45.4 Å²	45.4	8%	0.081	25%	0.248	C	C	.	.	H	α-helix	trans	-58.6	-42.3	-173.5	-178.6	0	0	0	0	113.4	T213 H217 T223 T224	T213-C220 HydrophobicContact CG2-CB 3.91Å; H217-C220 WeakPolarHBondContact O-CB 3.48Å; H217-C220 PolarHBondContact O-N 3.37Å; C220-T223 WeakPolarHBondContact CA-OG1 3.47Å; C220-T223 PolarHBondContact O-OG1 3.48Å; C220-T224 PolarHBondContact O-N 3.2Å; C220-T224 PolarHBondContact O-OG1 2.9Å
221	L	92.6	Very high	93.8	Very high	45 Å²	45	46 Å²	46	24%	0.236	25%	0.254	C	S	.	.	H	α-helix	trans	-59.5	-53.5	171.8	167.9	45.2	0	0	0	110.8	D219 T223 T224 Q225 D347 P349	D219-L221 PolarHBondContact O-N 3.5Å; L221-T223 VanDerWaalsContact C-N 3.33Å; L221-T223 PolarHBondContact O-N 2.77Å; L221-T224 PolarHBondContact O-N 2.88Å; L221-Q225 HydrophobicContact CD1-CG 3.85Å; L221-Q225 PolarHBondContact O-N 3.22Å; L221-D347 HydrophobicContact CB-CB 4.32Å; L221-D347 HydrophobicContact CD1-CB 4.21Å; L221-D347 WeakPolarHBondContact CD1-O 3.36Å; L221-P349 HydrophobicContact CD2-CB 4.31Å; L221-P349 HydrophobicContact CD2-CG 4.42Å
222	A	94.7	Very high	93.5	Very high	5 Å²	5	45.7 Å²	45.7	4%	0.041	25%	0.249	C	C	.	.	H	α-helix	trans	-64.3	-35.8	-176.4	0	0	0	0	0	112.5	A135 T136 D219 T224 Q225 M226	A135-A222 VanDerWaalsContact CB-C 3.47Å; A135-A222 HydrophobicContact CB-CB 3.73Å; T136-A222 VanDerWaalsContact N-CB 3.33Å; T136-A222 WeakPolarHBondContact OG1-CB 3.35Å; D219-A222 PolarHBondContact O-N 3.49Å; A222-T224 VanDerWaalsContact C-N 3.32Å; A222-T224 PolarHBondContact O-N 3.45Å; A222-Q225 PolarHBondContact O-N 3.17Å; A222-M226 WeakPolarHBondContact O-CB 3.44Å; A222-M226 VanDerWaalsContact O-CG 3.3Å; A222-M226 WeakPolarHBondContact O-CG 3.38Å; A222-M226 PolarHBondContact O-N 3.02Å
223	T	95.3	Very high	93.3	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61	-42.7	174.9	50.2	0	0	0	0	111.5	A135 L209 T213 D219 C220 L221 M226 F227	A135-T223 HydrophobicContact CB-CG2 3.55Å; A135-T223 VanDerWaalsContact CB-N 3.35Å; L209-T223 HydrophobicContact CB-CG2 4.46Å; L209-T223 HydrophobicContact CD2-CG2 3.68Å; L209-T223 HydrophobicContact CG-CG2 3.67Å; T213-T223 HydrophobicContact CG2-CG2 4.5Å; D219-T223 WeakPolarHBondContact O-CG2 3.43Å; D219-T223 PolarHBondContact O-N 2.79Å; D219-T223 PolarHBondContact O-OG1 3.36Å; C220-T223 WeakPolarHBondContact CA-OG1 3.47Å; C220-T223 PolarHBondContact O-OG1 3.48Å; L221-T223 VanDerWaalsContact C-N 3.33Å; L221-T223 PolarHBondContact O-N 2.77Å; T223-M226 PolarHBondContact O-N 3.15Å; T223-F227 PolarHBondContact O-N 3.45Å
224	T	93.8	Very high	92.9	Very high	51 Å²	51	45.9 Å²	45.9	31%	0.313	25%	0.253	S	S	.	.	H	α-helix	trans	-68	-43.9	178.8	-56.8	0	0	0	0	111.6	K210 C220 L221 A222 M226 F227 N228	K210-T224 HydrophobicContact CD-CG2 4.44Å; C220-T224 PolarHBondContact O-N 3.2Å; C220-T224 PolarHBondContact O-OG1 2.9Å; L221-T224 PolarHBondContact O-N 2.88Å; A222-T224 VanDerWaalsContact C-N 3.32Å; A222-T224 PolarHBondContact O-N 3.45Å; T224-M226 PolarHBondContact O-N 2.85Å; T224-F227 PolarHBondContact O-N 2.69Å; T224-N228 VanDerWaalsContact O-CG 3.29Å; T224-N228 PolarHBondContact O-N 3.27Å; T224-N228 VanDerWaalsContact O-N 3.09Å; T224-N228 PolarHBondContact O-ND2 2.89Å
225	Q	94.3	Very high	92.4	Very high	53 Å²	53	49.4 Å²	49.4	25%	0.248	26%	0.261	C	S	.	.	H	α-helix	trans	-60.2	-45.1	175	-79.4	175.8	-1.7	0	0	112.5	N139 L221 A222 N228 N229	N139-Q225 PolarHBondContact ND2-OE1 3.49Å; L221-Q225 HydrophobicContact CD1-CG 3.85Å; L221-Q225 PolarHBondContact O-N 3.22Å; A222-Q225 PolarHBondContact O-N 3.17Å; Q225-N228 PolarHBondContact O-N 2.75Å; Q225-N229 VanDerWaalsContact O-CB 3.22Å; Q225-N229 WeakPolarHBondContact O-CB 3.34Å; Q225-N229 PolarHBondContact O-N 3.1Å
226	M	96.9	Very high	91.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-69.5	-37.6	-178.5	-71.1	-50.9	-50.7	0	0	112.5	I138 N139 R142 F206 A222 T223 T224 N229 F230	I138-M226 HydrophobicContact CG2-CE 3.76Å; I138-M226 HydrophobicContact CG2-SD 4.46Å; N139-M226 VanDerWaalsContact CA-SD 3.53Å; N139-M226 HydrophobicContact CB-CG 4.25Å; N139-M226 HydrophobicContact CB-SD 3.76Å; R142-M226 HydrophobicContact CG-CE 4.48Å; R142-M226 HydrophobicContact CG-SD 4.32Å; F206-M226 HydrophobicContact CD1-CB 3.38Å; F206-M226 HydrophobicContact CD1-CG 4.34Å; F206-M226 HydrophobicContact CD2-CB 4.37Å; F206-M226 HydrophobicContact CE1-CB 3.32Å; F206-M226 HydrophobicContact CE1-CG 3.79Å; F206-M226 HydrophobicContact CE2-CB 4.33Å; F206-M226 HydrophobicContact CG-CB 3.91Å; F206-M226 HydrophobicContact CZ-CB 3.81Å; F206-M226 HydrophobicContact CZ-CG 4.07Å; A222-M226 WeakPolarHBondContact O-CB 3.44Å; A222-M226 VanDerWaalsContact O-CG 3.3Å; A222-M226 WeakPolarHBondContact O-CG 3.38Å; A222-M226 PolarHBondContact O-N 3.02Å; T223-M226 PolarHBondContact O-N 3.15Å; T224-M226 PolarHBondContact O-N 2.85Å; M226-N229 PolarHBondContact O-N 3.09Å; M226-F230 HydrophobicContact CB-CE2 4.28Å; M226-F230 HydrophobicContact CE-CD2 4.33Å; M226-F230 HydrophobicContact CE-CE1 4.19Å; M226-F230 HydrophobicContact CE-CE2 3.33Å; M226-F230 HydrophobicContact CE-CZ 3.24Å; M226-F230 WeakPolarHBondContact O-CD2 3.42Å; M226-F230 PolarHBondContact O-N 3.49Å; M226-F230 VanDerWaalsContact O-N 3.09Å
227	F	96.8	Very high	91.4	Very high	25 Å²	25	39.1 Å²	39.1	11%	0.11	21%	0.207	C	C	.	.	H	α-helix	trans	-58	-55.4	170.9	169.3	-107.8	0	0	0	111.5	K203 F206 E207 K210 T223 T224 N229 F230 D231	K203-F227 HydrophobicContact CG-CD2 4.39Å; K203-F227 HydrophobicContact CG-CE2 4.15Å; F206-F227 HydrophobicContact CB-CB 4.1Å; E207-F227 HydrophobicContact CB-CD2 3.57Å; E207-F227 HydrophobicContact CB-CE2 3.49Å; E207-F227 VanDerWaalsContact CB-CE2 3.49Å; E207-F227 HydrophobicContact CB-CZ 4.49Å; E207-F227 HydrophobicContact CG-CD2 4.1Å; E207-F227 HydrophobicContact CG-CE2 3.56Å; E207-F227 HydrophobicContact CG-CZ 4.14Å; K210-F227 HydrophobicContact CD-CD1 4.04Å; K210-F227 HydrophobicContact CD-CG 4.42Å; T223-F227 PolarHBondContact O-N 3.45Å; T224-F227 PolarHBondContact O-N 2.69Å; F227-N229 PolarHBondContact O-N 2.86Å; F227-F230 PolarHBondContact O-N 2.97Å; F227-F230 VanDerWaalsContact O-N 3.15Å; F227-D231 PolarHBondContact O-N 3.43Å
228	N	94.1	Very high	90.6	Very high	88 Å²	88	41.9 Å²	41.9	47%	0.471	22%	0.223	S	C	.	.	H	α-helix	trans	-58.7	-37.3	179.9	-68.5	-15.2	0	0	0	111.8	T224 Q225 D231 Q232	T224-N228 VanDerWaalsContact O-CG 3.29Å; T224-N228 PolarHBondContact O-N 3.27Å; T224-N228 VanDerWaalsContact O-N 3.09Å; T224-N228 PolarHBondContact O-ND2 2.89Å; Q225-N228 PolarHBondContact O-N 2.75Å; N228-D231 PolarHBondContact O-N 3.06Å; N228-Q232 WeakPolarHBondContact O-CB 3.31Å; N228-Q232 PolarHBondContact O-N 2.94Å
229	N	95.8	Very high	89.5	Confident	21 Å²	21	38.1 Å²	38.1	11%	0.112	20%	0.196	C	C	.	.	H	α-helix	trans	-62.4	-46.2	176.2	176.9	84.4	0	0	0	112.9	R142 N146 Q225 M226 F227 L233	R142-N229 WeakPolarHBondContact CD-OD1 3.36Å; R142-N229 HydrophobicContact CG-CB 4.44Å; R142-N229 WeakPolarHBondContact CG-OD1 3.11Å; N146-N229 PolarHBondContact ND2-OD1 3.18Å; N146-N229 PolarHBondContact OD1-ND2 3.21Å; Q225-N229 VanDerWaalsContact O-CB 3.22Å; Q225-N229 WeakPolarHBondContact O-CB 3.34Å; Q225-N229 PolarHBondContact O-N 3.1Å; M226-N229 PolarHBondContact O-N 3.09Å; F227-N229 PolarHBondContact O-N 2.86Å; N229-L233 VanDerWaalsContact O-CB 3.25Å; N229-L233 WeakPolarHBondContact O-CB 3.33Å; N229-L233 PolarHBondContact O-N 3.43Å
230	F	96.2	Very high	88.2	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-73.5	-30.7	178.4	-64.6	-53.9	0	0	0	113.2	M145 L199 L202 K203 F206 M226 F227 L233 A234	M145-F230 HydrophobicContact CE-CE1 3.73Å; M145-F230 HydrophobicContact CE-CZ 3.44Å; M145-F230 VanDerWaalsContact CE-CZ 3.44Å; L199-F230 HydrophobicContact CD1-CB 4.35Å; L199-F230 HydrophobicContact CD1-CD1 3.87Å; L202-F230 HydrophobicContact CB-CD1 4.33Å; L202-F230 HydrophobicContact CB-CD2 4.04Å; L202-F230 HydrophobicContact CB-CE1 4.38Å; L202-F230 HydrophobicContact CB-CE2 4.1Å; L202-F230 HydrophobicContact CB-CG 4.18Å; L202-F230 HydrophobicContact CB-CZ 4.28Å; L202-F230 HydrophobicContact CD1-CE1 4.05Å; L202-F230 HydrophobicContact CD1-CZ 4.13Å; K203-F230 HydrophobicContact CB-CB 3.96Å; F206-F230 HydrophobicContact CB-CD2 4.48Å; F206-F230 AromaticContact CD2-CD2 3.75Å; F206-F230 HydrophobicContact CD2-CD2 3.75Å; F206-F230 AromaticContact CD2-CE2 3.42Å; F206-F230 HydrophobicContact CD2-CE2 3.42Å; F206-F230 VanDerWaalsContact CD2-CE2 3.42Å; F206-F230 HydrophobicContact CE2-CD2 4.31Å; F206-F230 AromaticContact CE2-CE2 3.51Å; F206-F230 HydrophobicContact CE2-CE2 3.51Å; F206-F230 HydrophobicContact CE2-CZ 4.37Å; F206-F230 HydrophobicContact CG-CD2 4.29Å; F206-F230 HydrophobicContact CG-CE2 4.21Å; F206-F230 HydrophobicContact CZ-CE2 4.36Å; M226-F230 HydrophobicContact CB-CE2 4.28Å; M226-F230 HydrophobicContact CE-CD2 4.33Å; M226-F230 HydrophobicContact CE-CE1 4.19Å; M226-F230 HydrophobicContact CE-CE2 3.33Å; M226-F230 HydrophobicContact CE-CZ 3.24Å; M226-F230 WeakPolarHBondContact O-CD2 3.42Å; M226-F230 PolarHBondContact O-N 3.49Å; M226-F230 VanDerWaalsContact O-N 3.09Å; F227-F230 PolarHBondContact O-N 2.97Å; F227-F230 VanDerWaalsContact O-N 3.15Å; F230-L233 HydrophobicContact CD1-CD2 4.44Å; F230-A234 VanDerWaalsContact O-CB 3.26Å; F230-A234 WeakPolarHBondContact O-CB 3.12Å; F230-A234 PolarHBondContact O-N 2.78Å
231	D	92.7	Very high	87.1	Confident	65 Å²	65	42.5 Å²	42.5	35%	0.348	22%	0.219	S	C	.	.	H	α-helix	trans	-64.3	-49.8	173.1	-168.6	49.6	0	0	0	111.5	K203 F227 N228 L233 A234 Y235	K203-D231 HydrophobicContact CD-CB 4.39Å; K203-D231 VanDerWaalsContact CE-OD1 3.23Å; K203-D231 WeakPolarHBondContact CE-OD1 3.33Å; K203-D231 IonicContact NZ-OD1 3.46Å; K203-D231 PolarHBondContact NZ-OD1 3.46Å; F227-D231 PolarHBondContact O-N 3.43Å; N228-D231 PolarHBondContact O-N 3.06Å; D231-L233 PolarHBondContact O-N 3.43Å; D231-A234 PolarHBondContact O-N 2.88Å; D231-Y235 PolarHBondContact O-N 3.43Å
232	Q	86.7	Confident	85.8	Confident	103 Å²	103	47.3 Å²	47.3	48%	0.481	23%	0.234	S	C	.	.	H	α-helix	trans	-61.5	-43.3	175.5	-172	61.8	53.8	0	0	111.9	N228 A234 Y235 D236	N228-Q232 WeakPolarHBondContact O-CB 3.31Å; N228-Q232 PolarHBondContact O-N 2.94Å; Q232-A234 VanDerWaalsContact C-N 3.35Å; Q232-A234 PolarHBondContact O-N 3.5Å; Q232-Y235 WeakPolarHBondContact O-CB 3.28Å; Q232-Y235 PolarHBondContact O-N 3.45Å; Q232-D236 PolarHBondContact NE2-OD1 3.49Å; Q232-D236 WeakPolarHBondContact O-CB 3.44Å; Q232-D236 VanDerWaalsContact O-CG 3.27Å; Q232-D236 PolarHBondContact O-N 2.97Å
233	L	90.7	Very high	83.9	Confident	7 Å²	7	49.5 Å²	49.5	4%	0.037	24%	0.241	C	C	.	.	H	α-helix	trans	-62.6	-40.3	177.9	-179.8	61.1	0	0	0	112.2	N146 L149 K150 L199 N229 F230 D231 V237	N146-L233 HydrophobicContact CB-CD1 4.46Å; N146-L233 HydrophobicContact CB-CD2 4.17Å; L149-L233 HydrophobicContact CB-CD2 4.46Å; L149-L233 HydrophobicContact CD1-CD2 4.43Å; K150-L233 HydrophobicContact CB-CD1 4.08Å; K150-L233 HydrophobicContact CD-CD1 4.33Å; K150-L233 HydrophobicContact CG-CD1 4.48Å; L199-L233 HydrophobicContact CD1-CB 4.33Å; L199-L233 HydrophobicContact CD1-CD2 3.68Å; L199-L233 HydrophobicContact CD1-CG 3.98Å; L199-L233 HydrophobicContact CD2-CD2 4.49Å; L199-L233 HydrophobicContact CD2-CG 4.17Å; N229-L233 VanDerWaalsContact O-CB 3.25Å; N229-L233 WeakPolarHBondContact O-CB 3.33Å; N229-L233 PolarHBondContact O-N 3.43Å; F230-L233 HydrophobicContact CD1-CD2 4.44Å; D231-L233 PolarHBondContact O-N 3.43Å; L233-V237 HydrophobicContact CD1-CG2 4.17Å; L233-V237 WeakPolarHBondContact O-CB 3.1Å; L233-V237 VanDerWaalsContact O-CG2 3.28Å; L233-V237 WeakPolarHBondContact O-CG2 3.4Å; L233-V237 PolarHBondContact O-N 2.94Å; L233-V237 VanDerWaalsContact O-N 3.08Å
234	A	86	Confident	82.5	Confident	29 Å²	29	54.3 Å²	54.3	24%	0.24	26%	0.262	C	S	.	.	H	α-helix	trans	-65.3	-41.1	175.4	0	0	0	0	0	111.8	L199 F230 D231 Q232 N238	L199-A234 HydrophobicContact CD2-CB 4.3Å; L199-A234 HydrophobicContact CG-CB 4.43Å; F230-A234 VanDerWaalsContact O-CB 3.26Å; F230-A234 WeakPolarHBondContact O-CB 3.12Å; F230-A234 PolarHBondContact O-N 2.78Å; D231-A234 PolarHBondContact O-N 2.88Å; Q232-A234 VanDerWaalsContact C-N 3.35Å; Q232-A234 PolarHBondContact O-N 3.5Å; A234-N238 VanDerWaalsContact O-CB 3.23Å; A234-N238 WeakPolarHBondContact O-CB 3.19Å; A234-N238 PolarHBondContact O-N 2.92Å; A234-N238 VanDerWaalsContact O-N 3.09Å
235	Y	79.3	Confident	81	Confident	120 Å²	120	56 Å²	56	47%	0.471	27%	0.266	S	S	.	.	H	α-helix	trans	-61.1	-50.7	173.9	176.3	-90.3	0	0	0	112	D231 Q232 V237 N238 E239	D231-Y235 PolarHBondContact O-N 3.43Å; Q232-Y235 WeakPolarHBondContact O-CB 3.28Å; Q232-Y235 PolarHBondContact O-N 3.45Å; Y235-V237 PolarHBondContact O-N 3.44Å; Y235-N238 PolarHBondContact O-N 3.15Å; Y235-E239 HydrophobicContact CE1-CG 3.96Å; Y235-E239 HydrophobicContact CE2-CG 4.23Å; Y235-E239 PolarHBondContact O-N 2.85Å
236	D	77.9	Confident	79.2	Confident	60 Å²	60	56 Å²	56	32%	0.321	27%	0.268	S	S	.	.	H	α-helix	trans	-59.9	-47.3	-177.9	-72.4	-7.6	0	0	0	111.9	Q232 N238 E239 V240	Q232-D236 PolarHBondContact NE2-OD1 3.49Å; Q232-D236 WeakPolarHBondContact O-CB 3.44Å; Q232-D236 VanDerWaalsContact O-CG 3.27Å; Q232-D236 PolarHBondContact O-N 2.97Å; D236-N238 VanDerWaalsContact C-N 3.33Å; D236-N238 PolarHBondContact O-N 2.91Å; D236-E239 PolarHBondContact O-N 3.19Å; D236-V240 WeakPolarHBondContact O-CG2 3.33Å; D236-V240 PolarHBondContact O-N 3.22Å
237	V	79.8	Confident	77.1	Confident	9 Å²	9	58.1 Å²	58.1	6%	0.055	28%	0.282	C	S	.	.	H	α-helix	trans	-63.2	-40.4	178.3	168.4	0	0	0	0	111.2	K150 I153 L154 L233 Y235 K241	K150-V237 HydrophobicContact CB-CG2 4.35Å; K150-V237 HydrophobicContact CG-CG2 4.1Å; I153-V237 HydrophobicContact CB-CG1 3.99Å; I153-V237 HydrophobicContact CG2-CG1 3.41Å; I153-V237 VanDerWaalsContact CG2-CG1 3.41Å; L154-V237 HydrophobicContact CD2-CG1 4.18Å; L233-V237 HydrophobicContact CD1-CG2 4.17Å; L233-V237 WeakPolarHBondContact O-CB 3.1Å; L233-V237 VanDerWaalsContact O-CG2 3.28Å; L233-V237 WeakPolarHBondContact O-CG2 3.4Å; L233-V237 PolarHBondContact O-N 2.94Å; L233-V237 VanDerWaalsContact O-N 3.08Å; Y235-V237 PolarHBondContact O-N 3.44Å; V237-K241 WeakPolarHBondContact O-CG 3.39Å; V237-K241 PolarHBondContact O-N 3.04Å
238	N	75.5	Confident	75.4	Confident	80 Å²	80	59.2 Å²	59.2	43%	0.428	30%	0.295	S	S	.	.	H	α-helix	trans	-67.3	-44.1	178.4	-174.8	57.5	0	0	0	112.1	A234 Y235 D236 K241 R242	A234-N238 VanDerWaalsContact O-CB 3.23Å; A234-N238 WeakPolarHBondContact O-CB 3.19Å; A234-N238 PolarHBondContact O-N 2.92Å; A234-N238 VanDerWaalsContact O-N 3.09Å; Y235-N238 PolarHBondContact O-N 3.15Å; D236-N238 VanDerWaalsContact C-N 3.33Å; D236-N238 PolarHBondContact O-N 2.91Å; N238-K241 PolarHBondContact O-N 3.33Å; N238-R242 WeakPolarHBondContact O-CB 3.33Å; N238-R242 PolarHBondContact O-N 2.97Å
239	E	71.6	Confident	73.6	Confident	27 Å²	27	57.6 Å²	57.6	13%	0.126	29%	0.291	C	S	.	.	H	α-helix	trans	-61.9	-46.9	174.5	-85.1	-69.1	108.2	0	0	111.3	Y235 D236 K241 R242 W243	Y235-E239 HydrophobicContact CE1-CG 3.96Å; Y235-E239 HydrophobicContact CE2-CG 4.23Å; Y235-E239 PolarHBondContact O-N 2.85Å; D236-E239 PolarHBondContact O-N 3.19Å; E239-K241 VanDerWaalsContact C-N 3.32Å; E239-K241 PolarHBondContact O-N 2.89Å; E239-R242 WeakPolarHBondContact O-CB 3.13Å; E239-R242 PolarHBondContact O-N 2.76Å; E239-R242 VanDerWaalsContact O-N 3.15Å; E239-R242 WeakPolarHBondContact OE1-CD 3.31Å; E239-W243 PolarHBondContact O-N 2.96Å; E239-W243 PolarHBondContact OE2-NE1 3.47Å
240	V	68	Low	71.3	Confident	60 Å²	60	58.5 Å²	58.5	36%	0.364	30%	0.297	S	S	.	.	H	α-helix	trans	-62.1	-38.6	178.4	175.4	0	0	0	0	111.6	L154 D236 W243 K244	L154-V240 HydrophobicContact CD1-CB 4.49Å; L154-V240 HydrophobicContact CD1-CG1 4.01Å; L154-V240 HydrophobicContact CD2-CB 3.81Å; L154-V240 HydrophobicContact CD2-CG1 3.62Å; L154-V240 HydrophobicContact CG-CG1 4.46Å; D236-V240 WeakPolarHBondContact O-CG2 3.33Å; D236-V240 PolarHBondContact O-N 3.22Å; V240-W243 PolarHBondContact O-N 3.43Å; V240-K244 WeakPolarHBondContact O-CG 3.33Å; V240-K244 PolarHBondContact O-N 3.2Å
241	K	70.8	Confident	69.2	Low	44 Å²	44	61.5 Å²	61.5	19%	0.191	32%	0.318	C	S	.	.	H	α-helix	trans	-61.5	-47.3	172	-80	-170.7	172.9	-174.9	0	112.1	I153 L154 V237 N238 E239 W243 K244 E245	I153-K241 WeakPolarHBondContact O-CE 3.32Å; I153-K241 PolarHBondContact O-NZ 3.2Å; L154-K241 HydrophobicContact CD2-CG 4.12Å; V237-K241 WeakPolarHBondContact O-CG 3.39Å; V237-K241 PolarHBondContact O-N 3.04Å; N238-K241 PolarHBondContact O-N 3.33Å; E239-K241 VanDerWaalsContact C-N 3.32Å; E239-K241 PolarHBondContact O-N 2.89Å; K241-W243 VanDerWaalsContact C-N 3.29Å; K241-W243 PolarHBondContact O-N 2.9Å; K241-K244 PolarHBondContact O-N 3.39Å; K241-K244 VanDerWaalsContact O-N 3.14Å; K241-E245 PolarHBondContact O-N 2.69Å
242	R	64.5	Low	67.5	Low	146 Å²	146	61.5 Å²	61.5	55%	0.551	32%	0.316	S	S	*	.	H	α-helix	trans	-56	-42.5	175.3	-172.7	-172.4	-177.5	100.8	4.6	111.7	N238 E239 E245 I246	N238-R242 WeakPolarHBondContact O-CB 3.33Å; N238-R242 PolarHBondContact O-N 2.97Å; E239-R242 WeakPolarHBondContact O-CB 3.13Å; E239-R242 PolarHBondContact O-N 2.76Å; E239-R242 VanDerWaalsContact O-N 3.15Å; E239-R242 WeakPolarHBondContact OE1-CD 3.31Å; R242-E245 PolarHBondContact O-N 3.33Å; R242-I246 HydrophobicContact CG-CD1 4.15Å; R242-I246 VanDerWaalsContact O-CG1 3.27Å; R242-I246 WeakPolarHBondContact O-CG1 3.49Å; R242-I246 PolarHBondContact O-N 2.92Å
243	W	56.2	Low	65.5	Low	52 Å²	52	60.2 Å²	60.2	20%	0.197	31%	0.31	C	S	.	.	H	α-helix	trans	-68	-40.8	175.7	-74.6	105.9	0	0	0	112.7	E239 V240 K241 E245 I246 C247 R314 F477	E239-W243 PolarHBondContact O-N 2.96Å; E239-W243 PolarHBondContact OE2-NE1 3.47Å; V240-W243 PolarHBondContact O-N 3.43Å; K241-W243 VanDerWaalsContact C-N 3.29Å; K241-W243 PolarHBondContact O-N 2.9Å; W243-E245 PolarHBondContact O-N 3.46Å; W243-I246 HydrophobicContact CE3-CD1 4.3Å; W243-I246 HydrophobicContact CZ3-CD1 4.34Å; W243-I246 PolarHBondContact O-N 3.31Å; W243-C247 WeakPolarHBondContact O-CB 3.26Å; W243-C247 PolarHBondContact O-N 2.76Å; W243-C247 PolarHBondContact O-SG 3.01Å; W243-C247 VanDerWaalsContact O-SG 3.37Å; W243-R314 VanDerWaalsContact CZ2-CD 3.44Å; W243-R314 VanDerWaalsContact NE1-NH1 3.19Å; W243-F477 HydrophobicContact CE3-CE1 4.31Å; W243-F477 AromaticContact CE3-CZ 3.89Å; W243-F477 HydrophobicContact CE3-CZ 3.89Å; W243-F477 HydrophobicContact CZ3-CZ 4.37Å
244	K	64.7	Low	63.5	Low	101 Å²	101	61.1 Å²	61.1	44%	0.439	32%	0.316	S	S	.	.	H	α-helix	trans	-59.8	-44	171.8	-74.2	-173.4	-178	-171	0	111.5	L154 V240 K241 C247 A248	L154-K244 PolarHBondContact O-NZ 2.96Å; V240-K244 WeakPolarHBondContact O-CG 3.33Å; V240-K244 PolarHBondContact O-N 3.2Å; K241-K244 PolarHBondContact O-N 3.39Å; K241-K244 VanDerWaalsContact O-N 3.14Å; K244-C247 PolarHBondContact O-N 3.02Å; K244-A248 WeakPolarHBondContact O-CB 3.5Å; K244-A248 PolarHBondContact O-N 3Å
245	E	63.4	Low	61.6	Low	87 Å²	87	66.8 Å²	66.8	41%	0.407	33%	0.331	S	S	.	.	H	α-helix	trans	-63.5	-41.3	176.3	-72.3	-174.3	166.1	0	0	112.3	S3 C4 K241 R242 W243 A248 S249	S3-E245 WeakPolarHBondContact CA-OE1 3.43Å; C4-E245 PolarHBondContact N-OE1 3.39Å; K241-E245 PolarHBondContact O-N 2.69Å; R242-E245 PolarHBondContact O-N 3.33Å; W243-E245 PolarHBondContact O-N 3.46Å; E245-A248 PolarHBondContact O-N 3.26Å; E245-S249 WeakPolarHBondContact O-CB 3.38Å; E245-S249 PolarHBondContact O-N 3.43Å; E245-S249 PolarHBondContact O-OG 3.07Å
246	I	55.1	Low	60	Low	53 Å²	53	64.5 Å²	64.5	27%	0.272	32%	0.323	S	S	.	.	H	α-helix	trans	-63.3	-51.7	175	-69.4	163.7	0	0	0	110.3	R242 W243 A248 S249 V250	R242-I246 HydrophobicContact CG-CD1 4.15Å; R242-I246 VanDerWaalsContact O-CG1 3.27Å; R242-I246 WeakPolarHBondContact O-CG1 3.49Å; R242-I246 PolarHBondContact O-N 2.92Å; W243-I246 HydrophobicContact CE3-CD1 4.3Å; W243-I246 HydrophobicContact CZ3-CD1 4.34Å; W243-I246 PolarHBondContact O-N 3.31Å; I246-A248 VanDerWaalsContact C-N 3.32Å; I246-A248 PolarHBondContact O-N 2.84Å; I246-S249 PolarHBondContact O-N 3.5Å; I246-S249 PolarHBondContact O-OG 3.46Å; I246-V250 WeakPolarHBondContact O-CG2 3.43Å; I246-V250 PolarHBondContact O-N 2.82Å
247	C	53.9	Low	58.1	Low	44 Å²	44	63.6 Å²	63.6	30%	0.297	32%	0.316	S	S	.	.	H	α-helix	trans	-62.4	-38.5	178.8	-69.1	0	0	0	0	112.4	W243 K244 S251	W243-C247 WeakPolarHBondContact O-CB 3.26Å; W243-C247 PolarHBondContact O-N 2.76Å; W243-C247 PolarHBondContact O-SG 3.01Å; W243-C247 VanDerWaalsContact O-SG 3.37Å; K244-C247 PolarHBondContact O-N 3.02Å; C247-S251 VanDerWaalsContact O-CB 3.24Å; C247-S251 WeakPolarHBondContact O-CB 3.39Å; C247-S251 PolarHBondContact O-N 3.46Å; C247-S251 PolarHBondContact O-OG 2.88Å
248	A	60.1	Low	56.4	Low	47 Å²	47	66.7 Å²	66.7	39%	0.388	34%	0.338	S	S	.	.	H	α-helix	trans	-66.4	-41.1	174.8	0	0	0	0	0	111.9	K244 E245 I246 S251 E252	K244-A248 WeakPolarHBondContact O-CB 3.5Å; K244-A248 PolarHBondContact O-N 3Å; E245-A248 PolarHBondContact O-N 3.26Å; I246-A248 VanDerWaalsContact C-N 3.32Å; I246-A248 PolarHBondContact O-N 2.84Å; A248-S251 PolarHBondContact O-N 3.37Å; A248-E252 WeakPolarHBondContact O-CB 3.36Å; A248-E252 PolarHBondContact O-N 3.14Å
249	S	57.6	Low	54.6	Low	55 Å²	55	67.8 Å²	67.8	39%	0.385	34%	0.343	S	S	.	.	H	α-helix	trans	-64.9	-46	175.9	63.4	0	0	0	0	111.6	E245 I246 S251 E252 E253	E245-S249 WeakPolarHBondContact O-CB 3.38Å; E245-S249 PolarHBondContact O-N 3.43Å; E245-S249 PolarHBondContact O-OG 3.07Å; I246-S249 PolarHBondContact O-N 3.5Å; I246-S249 PolarHBondContact O-OG 3.46Å; S249-S251 VanDerWaalsContact C-N 3.3Å; S249-S251 PolarHBondContact O-N 3.34Å; S249-E252 PolarHBondContact O-N 2.82Å; S249-E253 WeakPolarHBondContact O-CB 3.28Å; S249-E253 PolarHBondContact O-N 2.73Å
250	V	46.5	Very low	53.2	Low	39 Å²	39	70.5 Å²	70.5	24%	0.236	36%	0.355	C	S	.	.	H	α-helix	trans	-58.9	-41.5	173.4	173.9	0	0	0	0	111.5	I246 T254	I246-V250 WeakPolarHBondContact O-CG2 3.43Å; I246-V250 PolarHBondContact O-N 2.82Å; V250-T254 WeakPolarHBondContact O-CB 3.46Å; V250-T254 PolarHBondContact O-N 2.83Å; V250-T254 PolarHBondContact O-OG1 2.9Å
251	S	52.8	Low	52	Low	64 Å²	64	75.3 Å²	75.3	45%	0.448	37%	0.373	S	S	.	.	H	α-helix	trans	-72.6	-41.5	-179	-58.4	0	0	0	0	113.2	C247 A248 S249 T254 R255	C247-S251 VanDerWaalsContact O-CB 3.24Å; C247-S251 WeakPolarHBondContact O-CB 3.39Å; C247-S251 PolarHBondContact O-N 3.46Å; C247-S251 PolarHBondContact O-OG 2.88Å; A248-S251 PolarHBondContact O-N 3.37Å; S249-S251 VanDerWaalsContact C-N 3.3Å; S249-S251 PolarHBondContact O-N 3.34Å; S251-T254 PolarHBondContact O-N 3.37Å; S251-R255 WeakPolarHBondContact O-CB 3.18Å; S251-R255 PolarHBondContact O-N 3.44Å
252	E	56	Low	50.7	Low	65 Å²	65	79.4 Å²	79.4	30%	0.304	40%	0.397	S	S	.	.	H	α-helix	trans	-67.3	-42.2	174.2	-87.7	-163.1	-148.8	0	0	111.3	M1 A248 S249 T254 R255 K256	M1-E252 WeakPolarHBondContact CE-OE2 3.33Å; M1-E252 VanDerWaalsContact SD-OE2 3.33Å; A248-E252 WeakPolarHBondContact O-CB 3.36Å; A248-E252 PolarHBondContact O-N 3.14Å; S249-E252 PolarHBondContact O-N 2.82Å; E252-T254 VanDerWaalsContact C-N 3.28Å; E252-T254 PolarHBondContact O-N 3Å; E252-R255 CarbonylContact O-C 3.57Å; E252-R255 PolarHBondContact O-N 2.92Å; E252-R255 VanDerWaalsContact O-N 3.09Å; E252-K256 WeakPolarHBondContact O-CG 3.43Å; E252-K256 PolarHBondContact O-N 3.08Å
253	E	46	Very low	49.8	Very low	75 Å²	75	73.2 Å²	73.2	35%	0.35	38%	0.375	S	S	.	.	H	α-helix	trans	-64.7	-38.6	178	-147.6	75.5	178.3	0	0	109.7	S249 K256 Y257 H299	S249-E253 WeakPolarHBondContact O-CB 3.28Å; S249-E253 PolarHBondContact O-N 2.73Å; E253-K256 PolarHBondContact O-N 2.95Å; E253-K256 WeakPolarHBondContact OE2-CD 3.25Å; E253-K256 IonicContact OE2-NZ 3.66Å; E253-K256 PolarHBondContact OE2-NZ 3.42Å; E253-Y257 WeakPolarHBondContact O-CD2 3.48Å; E253-H299 VanDerWaalsContact CB-NE2 3.33Å; E253-H299 WeakPolarHBondContact CB-NE2 3.5Å; E253-H299 WeakPolarHBondContact CG-CD2 3.42Å; E253-H299 WeakPolarHBondContact CG-NE2 3.46Å
254	T	47.1	Very low	49.4	Very low	26 Å²	26	75.2 Å²	75.2	16%	0.16	39%	0.39	C	S	.	.	H	α-helix	trans	-61.3	-41.5	168	-55.4	0	0	0	0	112.9	V250 S251 E252 Y257 N466	V250-T254 WeakPolarHBondContact O-CB 3.46Å; V250-T254 PolarHBondContact O-N 2.83Å; V250-T254 PolarHBondContact O-OG1 2.9Å; S251-T254 PolarHBondContact O-N 3.37Å; E252-T254 VanDerWaalsContact C-N 3.28Å; E252-T254 PolarHBondContact O-N 3Å; T254-Y257 WeakPolarHBondContact O-CB 3.06Å; T254-Y257 PolarHBondContact O-N 3.19Å; T254-N466 HydrophobicContact CG2-CB 4.27Å
255	R	46.3	Very low	48.5	Very low	149 Å²	149	77.9 Å²	77.9	56%	0.562	40%	0.401	S	S	*	.	H	α-helix	trans	-72.7	-30.4	179.2	-167.6	-172.5	-63.8	140.7	-1.1	112.9	S251 E252 Y257 S258 L259	S251-R255 WeakPolarHBondContact O-CB 3.18Å; S251-R255 PolarHBondContact O-N 3.44Å; E252-R255 CarbonylContact O-C 3.57Å; E252-R255 PolarHBondContact O-N 2.92Å; E252-R255 VanDerWaalsContact O-N 3.09Å; R255-Y257 PolarHBondContact O-N 2.89Å; R255-S258 PolarHBondContact O-N 2.98Å; R255-S258 VanDerWaalsContact O-N 3.1Å; R255-S258 PolarHBondContact O-OG 3.32Å; R255-L259 HydrophobicContact CG-CD1 4.48Å; R255-L259 PolarHBondContact O-N 3.29Å
256	K	45.5	Very low	47.6	Very low	72 Å²	72	76.4 Å²	76.4	31%	0.313	40%	0.401	S	S	.	.	H	α-helix	trans	-56.4	-35.8	169.3	-73.5	168.7	-163.5	165.4	0	109.5	E252 E253 S258 L259 F260	E252-K256 WeakPolarHBondContact O-CG 3.43Å; E252-K256 PolarHBondContact O-N 3.08Å; E253-K256 PolarHBondContact O-N 2.95Å; E253-K256 WeakPolarHBondContact OE2-CD 3.25Å; E253-K256 IonicContact OE2-NZ 3.66Å; E253-K256 PolarHBondContact OE2-NZ 3.42Å; K256-S258 PolarHBondContact O-N 3.43Å; K256-L259 CarbonylContact O-C 3.56Å; K256-L259 WeakPolarHBondContact O-CA 3.28Å; K256-L259 PolarHBondContact O-N 2.95Å; K256-L259 VanDerWaalsContact O-N 3.09Å; K256-F260 HydrophobicContact CB-CD2 4.23Å; K256-F260 HydrophobicContact CB-CE2 4.31Å; K256-F260 VanDerWaalsContact O-CD2 3.24Å; K256-F260 WeakPolarHBondContact O-CD2 3.42Å; K256-F260 PolarHBondContact O-N 3.44Å
257	Y	39.9	Very low	47.1	Very low	40 Å²	40	76.9 Å²	76.9	16%	0.157	41%	0.406	C	S	.	.	H	α-helix	trans	-70.5	-26.7	175.3	-76.5	-70.2	0	0	0	116.2	E253 T254 R255 L259 F260 E295 A296 H299	E253-Y257 WeakPolarHBondContact O-CD2 3.48Å; T254-Y257 WeakPolarHBondContact O-CB 3.06Å; T254-Y257 PolarHBondContact O-N 3.19Å; R255-Y257 PolarHBondContact O-N 2.89Å; Y257-L259 VanDerWaalsContact C-N 3.35Å; Y257-F260 HydrophobicContact CE1-CD2 4.31Å; Y257-E295 HydrophobicContact CE1-CB 3.96Å; Y257-E295 PolarHBondContact OH-O 2.98Å; Y257-A296 HydrophobicContact CD1-CB 3.49Å; Y257-A296 VanDerWaalsContact CD1-CB 3.49Å; Y257-A296 HydrophobicContact CE1-CB 3.91Å; Y257-A296 HydrophobicContact CG-CB 4.21Å; Y257-H299 HydrophobicContact CD2-CB 3.93Å; Y257-H299 AromaticContact CD2-CE1 3.87Å; Y257-H299 AromaticContact CD2-CG 3.59Å; Y257-H299 AromaticContact CD2-ND1 3.12Å; Y257-H299 WeakPolarHBondContact CD2-ND1 3.27Å; Y257-H299 HydrophobicContact CE1-CB 4.41Å; Y257-H299 HydrophobicContact CE2-CB 3.1Å; Y257-H299 AromaticContact CE2-CD2 4Å; Y257-H299 AromaticContact CE2-CG 3.09Å; Y257-H299 AromaticContact CE2-ND1 3.21Å; Y257-H299 WeakPolarHBondContact CE2-ND1 3.47Å; Y257-H299 AromaticContact CZ-CG 3.93Å; Y257-H299 WeakPolarHBondContact OH-CB 3.25Å
258	S	42.4	Very low	46.8	Very low	75 Å²	75	79.2 Å²	79.2	52%	0.524	41%	0.411	S	S	.	.	H	α-helix	trans	-73.5	-31.1	166.7	66.6	0	0	0	0	111.8	R255 K256	R255-S258 PolarHBondContact O-N 2.98Å; R255-S258 VanDerWaalsContact O-N 3.1Å; R255-S258 PolarHBondContact O-OG 3.32Å; K256-S258 PolarHBondContact O-N 3.43Å
259	L	38.1	Very low	46.1	Very low	102 Å²	102	84.7 Å²	84.7	53%	0.534	42%	0.421	S	S	.	.	H	α-helix	trans	-81.9	-23.1	178.1	-85.4	158.1	0	0	0	114.3	R255 K256 Y257 Q261 L262	R255-L259 HydrophobicContact CG-CD1 4.48Å; R255-L259 PolarHBondContact O-N 3.29Å; K256-L259 CarbonylContact O-C 3.56Å; K256-L259 WeakPolarHBondContact O-CA 3.28Å; K256-L259 PolarHBondContact O-N 2.95Å; K256-L259 VanDerWaalsContact O-N 3.09Å; Y257-L259 VanDerWaalsContact C-N 3.35Å; L259-Q261 PolarHBondContact O-N 3.3Å; L259-L262 HydrophobicContact CD2-CD1 4.27Å; L259-L262 WeakPolarHBondContact O-CA 3.38Å; L259-L262 WeakPolarHBondContact O-CB 3.32Å; L259-L262 PolarHBondContact O-N 3.46Å
260	F	42.3	Very low	45.5	Very low	85 Å²	85	87.4 Å²	87.4	37%	0.373	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-11	177.1	-98.2	-76.2	0	0	0	113.4	K256 Y257 L262 V263	K256-F260 HydrophobicContact CB-CD2 4.23Å; K256-F260 HydrophobicContact CB-CE2 4.31Å; K256-F260 VanDerWaalsContact O-CD2 3.24Å; K256-F260 WeakPolarHBondContact O-CD2 3.42Å; K256-F260 PolarHBondContact O-N 3.44Å; Y257-F260 HydrophobicContact CE1-CD2 4.31Å; F260-L262 PolarHBondContact O-N 3.22Å; F260-V263 VanDerWaalsContact O-CG2 3.29Å; F260-V263 WeakPolarHBondContact O-CG2 3.32Å; F260-V263 PolarHBondContact O-N 2.93Å
261	Q	43.4	Very low	45.6	Very low	160 Å²	160	87.6 Å²	87.6	75%	0.748	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-19.6	163.6	-62	-170.6	0.2	0	0	112.3	L259 V263	L259-Q261 PolarHBondContact O-N 3.3Å; Q261-V263 PolarHBondContact O-N 2.93Å
262	L	43	Very low	45.2	Very low	131 Å²	131	85.7 Å²	85.7	69%	0.686	42%	0.418	S	S	*	.	S	Bend	trans	-95.8	59.9	167.9	-70.9	162.3	0	0	0	111.2	L259 F260 D264	L259-L262 HydrophobicContact CD2-CD1 4.27Å; L259-L262 WeakPolarHBondContact O-CA 3.38Å; L259-L262 WeakPolarHBondContact O-CB 3.32Å; L259-L262 PolarHBondContact O-N 3.46Å; F260-L262 PolarHBondContact O-N 3.22Å; L262-D264 PolarHBondContact O-N 3.17Å
263	V	46.3	Very low	44.8	Very low	16 Å²	16	88.5 Å²	88.5	10%	0.097	43%	0.433	C	S	.	.			trans	-49.3	127.1	169.8	-175.4	0	0	0	0	109.6	F260 Q261 T267 K268 Q288 T292	F260-V263 VanDerWaalsContact O-CG2 3.29Å; F260-V263 WeakPolarHBondContact O-CG2 3.32Å; F260-V263 PolarHBondContact O-N 2.93Å; Q261-V263 PolarHBondContact O-N 2.93Å; V263-T267 HydrophobicContact CG1-CG2 4.02Å; V263-K268 HydrophobicContact CB-CG 4.11Å; V263-K268 HydrophobicContact CG1-CG 4Å; V263-K268 VanDerWaalsContact O-CD 3.24Å; V263-K268 WeakPolarHBondContact O-CD 3.27Å; V263-K268 WeakPolarHBondContact O-CE 3.47Å; V263-K268 PolarHBondContact O-NZ 3.05Å; V263-Q288 HydrophobicContact CG2-CG 4.48Å; V263-T292 HydrophobicContact CG2-CG2 3.5Å; V263-T292 VanDerWaalsContact CG2-CG2 3.5Å
264	D	46.3	Very low	44.8	Very low	94 Å²	94	88.3 Å²	88.3	50%	0.503	44%	0.444	S	S	.	.			trans	-58.5	149.8	-171.1	177.8	35.6	0	0	0	112.6	L262 S266 T267 K268	L262-D264 PolarHBondContact O-N 3.17Å; D264-S266 PolarHBondContact O-N 3.31Å; D264-S266 VanDerWaalsContact O-N 3.13Å; D264-S266 VanDerWaalsContact OD2-CB 3.3Å; D264-S266 WeakPolarHBondContact OD2-CB 3.33Å; D264-S266 PolarHBondContact OD2-N 3.22Å; D264-S266 PolarHBondContact OD2-OG 3.48Å; D264-T267 PolarHBondContact O-N 3.45Å; D264-K268 WeakPolarHBondContact O-CB 3.48Å; D264-K268 PolarHBondContact O-N 3.12Å
265	K	47	Very low	44.7	Very low	157 Å²	157	88.6 Å²	88.6	68%	0.683	45%	0.448	S	S	*	.	H	α-helix	trans	-57.7	-23	177.2	-91.2	-179.2	176.3	174.8	0	113	R269	K265-R269 WeakPolarHBondContact O-CB 3.15Å; K265-R269 WeakPolarHBondContact O-CG 3.46Å; K265-R269 PolarHBondContact O-N 2.89Å; K265-R269 PolarHBondContact O-NE 3.2Å
266	S	44.3	Very low	44.7	Very low	56 Å²	56	89.2 Å²	89.2	39%	0.392	45%	0.451	S	S	.	.	H	α-helix	trans	-78.4	-51.7	173.7	72.1	0	0	0	0	111.5	D264 K268 R269 I270	D264-S266 PolarHBondContact O-N 3.31Å; D264-S266 VanDerWaalsContact O-N 3.13Å; D264-S266 VanDerWaalsContact OD2-CB 3.3Å; D264-S266 WeakPolarHBondContact OD2-CB 3.33Å; D264-S266 PolarHBondContact OD2-N 3.22Å; D264-S266 PolarHBondContact OD2-OG 3.48Å; S266-K268 PolarHBondContact O-N 3.31Å; S266-R269 CarbonylContact O-C 2.96Å; S266-R269 WeakPolarHBondContact O-CA 3.24Å; S266-R269 WeakPolarHBondContact O-CB 3.36Å; S266-R269 PolarHBondContact O-N 3.02Å; S266-I270 WeakPolarHBondContact O-CG1 3.47Å; S266-I270 PolarHBondContact O-N 3.21Å
267	T	44.9	Very low	45.1	Very low	62 Å²	62	90.6 Å²	90.6	38%	0.38	47%	0.469	S	S	.	.	H	α-helix	trans	-61.9	-42.2	178	-42.4	0	0	0	0	111.9	V263 D264 R269 I270 I271	V263-T267 HydrophobicContact CG1-CG2 4.02Å; D264-T267 PolarHBondContact O-N 3.45Å; T267-R269 VanDerWaalsContact C-N 3.26Å; T267-R269 PolarHBondContact O-N 2.95Å; T267-I270 PolarHBondContact O-N 3.38Å; T267-I271 HydrophobicContact CG2-CD1 3.88Å; T267-I271 HydrophobicContact CG2-CG1 4.48Å; T267-I271 WeakPolarHBondContact O-CB 3.3Å; T267-I271 WeakPolarHBondContact O-CG1 3.49Å; T267-I271 PolarHBondContact O-N 3.15Å
268	K	46.5	Very low	45.3	Very low	93 Å²	93	93.6 Å²	93.6	40%	0.404	50%	0.496	S	S	.	.	H	α-helix	trans	-57.6	-36.4	170	-78.8	176.7	172.6	142.8	0	112.5	V263 D264 S266 A272	V263-K268 HydrophobicContact CB-CG 4.11Å; V263-K268 HydrophobicContact CG1-CG 4Å; V263-K268 VanDerWaalsContact O-CD 3.24Å; V263-K268 WeakPolarHBondContact O-CD 3.27Å; V263-K268 WeakPolarHBondContact O-CE 3.47Å; V263-K268 PolarHBondContact O-NZ 3.05Å; D264-K268 WeakPolarHBondContact O-CB 3.48Å; D264-K268 PolarHBondContact O-N 3.12Å; S266-K268 PolarHBondContact O-N 3.31Å; K268-A272 WeakPolarHBondContact O-CB 3.42Å; K268-A272 PolarHBondContact O-N 3.36Å
269	R	46	Very low	45.9	Very low	162 Å²	162	92.3 Å²	92.3	61%	0.611	50%	0.495	S	S	*	.	H	α-helix	trans	-72	-40.8	176.6	-89.2	-177.2	-95.8	-174.1	-8	112.4	K265 S266 T267 A272 M273	K265-R269 WeakPolarHBondContact O-CB 3.15Å; K265-R269 WeakPolarHBondContact O-CG 3.46Å; K265-R269 PolarHBondContact O-N 2.89Å; K265-R269 PolarHBondContact O-NE 3.2Å; S266-R269 CarbonylContact O-C 2.96Å; S266-R269 WeakPolarHBondContact O-CA 3.24Å; S266-R269 WeakPolarHBondContact O-CB 3.36Å; S266-R269 PolarHBondContact O-N 3.02Å; T267-R269 VanDerWaalsContact C-N 3.26Å; T267-R269 PolarHBondContact O-N 2.95Å; R269-A272 CarbonylContact O-C 3.56Å; R269-A272 PolarHBondContact O-N 2.87Å; R269-M273 WeakPolarHBondContact O-CB 3.43Å; R269-M273 VanDerWaalsContact O-CG 3.31Å; R269-M273 WeakPolarHBondContact O-CG 3.29Å; R269-M273 PolarHBondContact O-N 3.35Å
270	I	45.8	Very low	46.9	Very low	113 Å²	113	90.8 Å²	90.8	58%	0.579	49%	0.493	S	S	*	.	H	α-helix	trans	-69	-44.6	178.7	-65.2	166.1	0	0	0	110.6	S266 T267 A272 M273 A274	S266-I270 WeakPolarHBondContact O-CG1 3.47Å; S266-I270 PolarHBondContact O-N 3.21Å; T267-I270 PolarHBondContact O-N 3.38Å; I270-A272 VanDerWaalsContact C-N 3.34Å; I270-A272 PolarHBondContact O-N 3.43Å; I270-M273 WeakPolarHBondContact O-CB 3.2Å; I270-M273 PolarHBondContact O-N 3.35Å; I270-M273 VanDerWaalsContact O-N 3.07Å; I270-A274 PolarHBondContact O-N 2.92Å
271	I	47.3	Very low	47.3	Very low	43 Å²	43	91.1 Å²	91.1	22%	0.221	50%	0.495	C	S	.	.	H	α-helix	trans	-63.9	-40.2	174.1	-66.9	170.3	0	0	0	110.4	T267 M273 A274 A275 Q288 L291	T267-I271 HydrophobicContact CG2-CD1 3.88Å; T267-I271 HydrophobicContact CG2-CG1 4.48Å; T267-I271 WeakPolarHBondContact O-CB 3.3Å; T267-I271 WeakPolarHBondContact O-CG1 3.49Å; T267-I271 PolarHBondContact O-N 3.15Å; I271-M273 VanDerWaalsContact C-N 3.3Å; I271-M273 PolarHBondContact O-N 3.37Å; I271-A274 PolarHBondContact O-N 3.37Å; I271-A275 WeakPolarHBondContact O-CB 3.47Å; I271-A275 PolarHBondContact O-N 3.01Å; I271-Q288 VanDerWaalsContact CD1-OE1 3.24Å; I271-L291 HydrophobicContact CD1-CD1 3.91Å
272	A	44.7	Very low	47.6	Very low	23 Å²	23	86.1 Å²	86.1	19%	0.19	48%	0.482	C	S	.	.	H	α-helix	trans	-69.2	-22.5	172.5	0	0	0	0	0	114.1	K268 R269 I270 R276	K268-A272 WeakPolarHBondContact O-CB 3.42Å; K268-A272 PolarHBondContact O-N 3.36Å; R269-A272 CarbonylContact O-C 3.56Å; R269-A272 PolarHBondContact O-N 2.87Å; I270-A272 VanDerWaalsContact C-N 3.34Å; I270-A272 PolarHBondContact O-N 3.43Å; A272-R276 VanDerWaalsContact O-CG 3.31Å; A272-R276 WeakPolarHBondContact O-CG 3.32Å; A272-R276 PolarHBondContact O-N 2.9Å; A272-R276 PolarHBondContact O-NE 3.14Å; A272-R276 PolarHBondContact O-NH1 2.9Å; A272-R276 VanDerWaalsContact O-NH1 3.11Å
273	M	47.5	Very low	48.4	Very low	125 Å²	125	82.7 Å²	82.7	62%	0.616	47%	0.466	S	S	*	.	H	α-helix	trans	-73.4	-49.7	171.1	-82.2	173.6	157.6	0	0	110.8	R269 I270 I271 A275 R276	R269-M273 WeakPolarHBondContact O-CB 3.43Å; R269-M273 VanDerWaalsContact O-CG 3.31Å; R269-M273 WeakPolarHBondContact O-CG 3.29Å; R269-M273 PolarHBondContact O-N 3.35Å; I270-M273 WeakPolarHBondContact O-CB 3.2Å; I270-M273 PolarHBondContact O-N 3.35Å; I270-M273 VanDerWaalsContact O-N 3.07Å; I271-M273 VanDerWaalsContact C-N 3.3Å; I271-M273 PolarHBondContact O-N 3.37Å; M273-A275 PolarHBondContact O-N 3.21Å; M273-R276 PolarHBondContact O-N 3.5Å
274	A	46.8	Very low	49	Very low	71 Å²	71	85.5 Å²	85.5	59%	0.587	48%	0.475	S	S	*	.	H	α-helix	trans	-63.2	-42	177.6	0	0	0	0	0	112.3	I270 I271 R276 S277	I270-A274 PolarHBondContact O-N 2.92Å; I271-A274 PolarHBondContact O-N 3.37Å; A274-R276 VanDerWaalsContact C-N 3.3Å; A274-R276 PolarHBondContact O-N 2.86Å; A274-S277 PolarHBondContact O-OG 3.49Å
275	A	44.5	Very low	49.9	Very low	31 Å²	31	87.6 Å²	87.6	26%	0.256	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-82.7	1.4	-178.5	0	0	0	0	0	114.8	I271 M273 S277 R284	I271-A275 WeakPolarHBondContact O-CB 3.47Å; I271-A275 PolarHBondContact O-N 3.01Å; M273-A275 PolarHBondContact O-N 3.21Å; A275-S277 PolarHBondContact O-N 3.03Å; A275-R284 HydrophobicContact CB-CG 3.67Å
276	R	47.4	Very low	50.5	Low	163 Å²	163	81.6 Å²	81.6	62%	0.615	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-71.4	-8.1	168.2	-99	-175.7	-70.7	-89.4	15	113.2	A272 M273 A274	A272-R276 VanDerWaalsContact O-CG 3.31Å; A272-R276 WeakPolarHBondContact O-CG 3.32Å; A272-R276 PolarHBondContact O-N 2.9Å; A272-R276 PolarHBondContact O-NE 3.14Å; A272-R276 PolarHBondContact O-NH1 2.9Å; A272-R276 VanDerWaalsContact O-NH1 3.11Å; M273-R276 PolarHBondContact O-N 3.5Å; A274-R276 VanDerWaalsContact C-N 3.3Å; A274-R276 PolarHBondContact O-N 2.86Å
277	S	52.5	Low	51.6	Low	100 Å²	100	81.3 Å²	81.3	70%	0.699	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-77.3	-32.1	-177.2	-43.4	0	0	0	0	113.8	A274 A275	A274-S277 PolarHBondContact O-OG 3.49Å; A275-S277 PolarHBondContact O-N 3.03Å
278	S	43.8	Very low	52.7	Low	103 Å²	103	80 Å²	80	72%	0.72	44%	0.437	S	S	*	.	S	Bend	trans	-174.1	111	179.2	51.3	0	0	0	0	111.3
279	G	56.4	Low	53.9	Low	48 Å²	48	79.1 Å²	79.1	50%	0.495	43%	0.433	S	S	.	.			trans	152.6	149.4	169.1	0	0	0	0	0	116.7
280	S	58.4	Low	55.2	Low	70 Å²	70	71.7 Å²	71.7	49%	0.49	41%	0.405	S	S	.	.			trans	-65.3	156.2	173.1	172.6	0	0	0	0	111.8	A282 T283 R284	S280-A282 PolarHBondContact O-N 3.05Å; S280-A282 PolarHBondContact OG-N 3.39Å; S280-T283 PolarHBondContact N-OG1 3.28Å; S280-T283 WeakPolarHBondContact O-CB 3.25Å; S280-T283 PolarHBondContact O-N 2.98Å; S280-T283 VanDerWaalsContact O-N 3.07Å; S280-R284 PolarHBondContact O-N 2.62Å
281	E	49.6	Very low	56.4	Low	92 Å²	92	69.5 Å²	69.5	43%	0.43	39%	0.394	S	S	.	.	H	α-helix	trans	-53.1	-34.2	167.2	179.4	65	-142.7	0	0	111.7	R284 K285	E281-R284 PolarHBondContact O-N 3.11Å; E281-R284 IonicContact OE1-NH1 3.98Å; E281-R284 IonicContact OE2-CZ 2.68Å; E281-R284 IonicContact OE2-NH1 3.42Å; E281-R284 PolarHBondContact OE2-NH1 3.25Å; E281-R284 IonicContact OE2-NH2 3.38Å; E281-R284 PolarHBondContact OE2-NH2 3.23Å; E281-K285 WeakPolarHBondContact O-CG 3.4Å; E281-K285 PolarHBondContact O-N 3.4Å; E281-K285 VanDerWaalsContact O-N 3.1Å; E281-K285 WeakPolarHBondContact OE1-CE 3.35Å
282	A	51.4	Low	57.7	Low	56 Å²	56	68.6 Å²	68.6	46%	0.463	39%	0.39	S	S	.	.	H	α-helix	trans	-62.8	-50.3	173.9	0	0	0	0	0	111.4	S280 R284 K285 I286	S280-A282 PolarHBondContact O-N 3.05Å; S280-A282 PolarHBondContact OG-N 3.39Å; A282-R284 VanDerWaalsContact C-N 3.29Å; A282-R284 PolarHBondContact O-N 2.98Å; A282-K285 PolarHBondContact O-N 2.78Å; A282-I286 WeakPolarHBondContact O-CD1 3.25Å; A282-I286 VanDerWaalsContact O-CG1 3.24Å; A282-I286 WeakPolarHBondContact O-CG1 3.28Å; A282-I286 PolarHBondContact O-N 3.38Å
283	T	60.1	Low	59.1	Low	58 Å²	58	68.1 Å²	68.1	36%	0.356	39%	0.385	S	S	.	.	H	α-helix	trans	-56.4	-43.1	176.5	-42.7	0	0	0	0	111.4	S280 K285 I286 Q287	S280-T283 PolarHBondContact N-OG1 3.28Å; S280-T283 WeakPolarHBondContact O-CB 3.25Å; S280-T283 PolarHBondContact O-N 2.98Å; S280-T283 VanDerWaalsContact O-N 3.07Å; T283-K285 PolarHBondContact O-N 3.07Å; T283-I286 PolarHBondContact O-N 3.25Å; T283-Q287 PolarHBondContact O-N 3.47Å
284	R	58.9	Low	60.6	Low	75 Å²	75	64.6 Å²	64.6	28%	0.283	36%	0.364	S	S	.	.	H	α-helix	trans	-61.6	-42.4	177.1	-74.8	-170.1	-82.4	109.4	4.3	113.1	A275 S280 E281 A282 Q288	A275-R284 HydrophobicContact CB-CG 3.67Å; S280-R284 PolarHBondContact O-N 2.62Å; E281-R284 PolarHBondContact O-N 3.11Å; E281-R284 IonicContact OE1-NH1 3.98Å; E281-R284 IonicContact OE2-CZ 2.68Å; E281-R284 IonicContact OE2-NH1 3.42Å; E281-R284 PolarHBondContact OE2-NH1 3.25Å; E281-R284 IonicContact OE2-NH2 3.38Å; E281-R284 PolarHBondContact OE2-NH2 3.23Å; A282-R284 VanDerWaalsContact C-N 3.29Å; A282-R284 PolarHBondContact O-N 2.98Å; R284-Q288 WeakPolarHBondContact O-CB 3.48Å; R284-Q288 PolarHBondContact O-N 3.46Å; R284-Q288 VanDerWaalsContact O-N 3.15Å
285	K	63.7	Low	62.1	Low	138 Å²	138	65.2 Å²	65.2	60%	0.6	36%	0.355	S	S	*	.	H	α-helix	trans	-66.2	-37.2	175.7	-72.9	177	-179.6	175.2	0	112.5	E281 A282 T283 K289	E281-K285 WeakPolarHBondContact O-CG 3.4Å; E281-K285 PolarHBondContact O-N 3.4Å; E281-K285 VanDerWaalsContact O-N 3.1Å; E281-K285 WeakPolarHBondContact OE1-CE 3.35Å; A282-K285 PolarHBondContact O-N 2.78Å; T283-K285 PolarHBondContact O-N 3.07Å; K285-K289 PolarHBondContact O-N 2.91Å; K285-K289 VanDerWaalsContact O-N 3.11Å
286	I	61	Low	63.9	Low	32 Å²	32	63.9 Å²	63.9	16%	0.164	34%	0.344	C	S	.	.	H	α-helix	trans	-66.5	-51.1	179.2	-67.6	165.9	0	0	0	110.8	A282 T283 Q288 K289 F290 Q451 Q455	A282-I286 WeakPolarHBondContact O-CD1 3.25Å; A282-I286 VanDerWaalsContact O-CG1 3.24Å; A282-I286 WeakPolarHBondContact O-CG1 3.28Å; A282-I286 PolarHBondContact O-N 3.38Å; T283-I286 PolarHBondContact O-N 3.25Å; I286-Q288 VanDerWaalsContact C-N 3.28Å; I286-Q288 PolarHBondContact O-N 3.31Å; I286-K289 WeakPolarHBondContact O-CB 3.39Å; I286-K289 PolarHBondContact O-N 3.38Å; I286-F290 HydrophobicContact CG2-CD2 3.94Å; I286-F290 HydrophobicContact CG2-CE2 3.52Å; I286-F290 HydrophobicContact CG2-CZ 4.08Å; I286-F290 PolarHBondContact O-N 3.45Å; I286-Q451 HydrophobicContact CG2-CG 3.96Å; I286-Q455 VanDerWaalsContact CG1-NE2 3.35Å; I286-Q455 VanDerWaalsContact CG2-NE2 3.28Å
287	Q	66.1	Low	65.5	Low	50 Å²	50	56.2 Å²	56.2	23%	0.234	32%	0.315	C	S	.	.	H	α-helix	trans	-61.7	-39	179.3	-158.5	71.8	-16	0	0	111.8	T283 K289 F290 L291 Y410 E414	T283-Q287 PolarHBondContact O-N 3.47Å; Q287-K289 VanDerWaalsContact C-N 3.3Å; Q287-K289 PolarHBondContact O-N 2.81Å; Q287-F290 PolarHBondContact O-N 3.26Å; Q287-L291 WeakPolarHBondContact O-CG 3.38Å; Q287-L291 PolarHBondContact O-N 3.07Å; Q287-Y410 PolarHBondContact OE1-OH 2.89Å; Q287-E414 PolarHBondContact NE2-OE2 3.49Å
288	Q	68.8	Low	67.1	Low	34 Å²	34	54 Å²	54	16%	0.159	30%	0.296	C	S	.	.	H	α-helix	trans	-61.6	-37.9	174.8	-174.6	62.7	90.5	0	0	112.6	V263 I271 R284 I286 T292	V263-Q288 HydrophobicContact CG2-CG 4.48Å; I271-Q288 VanDerWaalsContact CD1-OE1 3.24Å; R284-Q288 WeakPolarHBondContact O-CB 3.48Å; R284-Q288 PolarHBondContact O-N 3.46Å; R284-Q288 VanDerWaalsContact O-N 3.15Å; I286-Q288 VanDerWaalsContact C-N 3.28Å; I286-Q288 PolarHBondContact O-N 3.31Å; Q288-T292 PolarHBondContact O-N 3.4Å
289	K	70.5	Confident	68.9	Low	75 Å²	75	49.5 Å²	49.5	33%	0.326	26%	0.263	S	S	.	.	H	α-helix	trans	-66.3	-48.7	177.3	-164.1	-166.8	-176.8	-143.9	0	111	K285 I286 Q287 L291 T292 E293 Q455	K285-K289 PolarHBondContact O-N 2.91Å; K285-K289 VanDerWaalsContact O-N 3.11Å; I286-K289 WeakPolarHBondContact O-CB 3.39Å; I286-K289 PolarHBondContact O-N 3.38Å; Q287-K289 VanDerWaalsContact C-N 3.3Å; Q287-K289 PolarHBondContact O-N 2.81Å; K289-L291 VanDerWaalsContact C-N 3.31Å; K289-L291 PolarHBondContact O-N 2.85Å; K289-T292 PolarHBondContact O-N 3.32Å; K289-T292 VanDerWaalsContact O-N 3.11Å; K289-T292 PolarHBondContact O-OG1 3.16Å; K289-E293 WeakPolarHBondContact CE-OE1 3.47Å; K289-E293 IonicContact NZ-OE1 3.31Å; K289-E293 PolarHBondContact NZ-OE1 3.26Å; K289-E293 WeakPolarHBondContact O-CG 3.23Å; K289-E293 PolarHBondContact O-N 2.84Å; K289-Q455 PolarHBondContact NZ-O 3.33Å
290	F	73.1	Confident	70.3	Confident	6 Å²	6	47.3 Å²	47.3	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-62	-35.4	178.1	-67.4	-32.6	0	0	0	113.3	I286 Q287 E293 R294 L407 Y410 Q451 L454 Q455 L458	I286-F290 HydrophobicContact CG2-CD2 3.94Å; I286-F290 HydrophobicContact CG2-CE2 3.52Å; I286-F290 HydrophobicContact CG2-CZ 4.08Å; I286-F290 PolarHBondContact O-N 3.45Å; Q287-F290 PolarHBondContact O-N 3.26Å; F290-E293 WeakPolarHBondContact CD1-OE2 3.36Å; F290-E293 PolarHBondContact O-N 2.89Å; F290-R294 WeakPolarHBondContact O-CB 3.47Å; F290-R294 PolarHBondContact O-N 3.48Å; F290-L407 HydrophobicContact CB-CD2 4.25Å; F290-Y410 HydrophobicContact CD2-CD1 4.25Å; F290-Y410 AromaticContact CD2-CE1 3.75Å; F290-Y410 HydrophobicContact CD2-CE1 3.75Å; F290-Y410 HydrophobicContact CD2-CE2 4.34Å; F290-Y410 AromaticContact CD2-CZ 3.79Å; F290-Y410 HydrophobicContact CE2-CD1 4.42Å; F290-Y410 HydrophobicContact CE2-CD2 4.2Å; F290-Y410 AromaticContact CE2-CE1 3.94Å; F290-Y410 HydrophobicContact CE2-CE1 3.94Å; F290-Y410 AromaticContact CE2-CE2 3.68Å; F290-Y410 HydrophobicContact CE2-CE2 3.68Å; F290-Y410 AromaticContact CE2-CZ 3.53Å; F290-Q451 HydrophobicContact CE2-CG 3.97Å; F290-Q451 HydrophobicContact CZ-CB 4.49Å; F290-Q451 HydrophobicContact CZ-CG 3.9Å; F290-L454 HydrophobicContact CD1-CB 4.41Å; F290-L454 HydrophobicContact CE1-CB 3.55Å; F290-L454 HydrophobicContact CZ-CB 3.82Å; F290-L454 HydrophobicContact CZ-CD1 4.43Å; F290-Q455 HydrophobicContact CE1-CG 3.72Å; F290-Q455 HydrophobicContact CZ-CG 3.71Å; F290-L458 HydrophobicContact CD1-CD1 3.84Å; F290-L458 HydrophobicContact CE1-CD1 4.13Å
291	L	72.4	Confident	71.8	Confident	67 Å²	67	46.4 Å²	46.4	35%	0.351	23%	0.228	S	C	.	.	H	α-helix	trans	-59.6	-48.8	171.5	-72.8	170	0	0	0	111.6	I271 Q287 K289 E293 R294 E295	I271-L291 HydrophobicContact CD1-CD1 3.91Å; Q287-L291 WeakPolarHBondContact O-CG 3.38Å; Q287-L291 PolarHBondContact O-N 3.07Å; K289-L291 VanDerWaalsContact C-N 3.31Å; K289-L291 PolarHBondContact O-N 2.85Å; L291-E293 VanDerWaalsContact C-N 3.32Å; L291-E293 PolarHBondContact O-N 3.46Å; L291-R294 PolarHBondContact O-N 3.09Å; L291-E295 WeakPolarHBondContact O-CG 3.47Å; L291-E295 PolarHBondContact O-N 3.38Å
292	T	74.7	Confident	73.7	Confident	23 Å²	23	49.4 Å²	49.4	14%	0.141	24%	0.24	C	C	.	.	H	α-helix	trans	-64.8	-34.1	177.8	57.8	0	0	0	0	113.2	V263 Q288 K289 A296	V263-T292 HydrophobicContact CG2-CG2 3.5Å; V263-T292 VanDerWaalsContact CG2-CG2 3.5Å; Q288-T292 PolarHBondContact O-N 3.4Å; K289-T292 PolarHBondContact O-N 3.32Å; K289-T292 VanDerWaalsContact O-N 3.11Å; K289-T292 PolarHBondContact O-OG1 3.16Å; T292-A296 WeakPolarHBondContact O-CB 3.4Å; T292-A296 PolarHBondContact O-N 2.8Å
293	E	74.2	Confident	75.4	Confident	14 Å²	14	47.3 Å²	47.3	7%	0.065	22%	0.222	C	C	.	.	H	α-helix	trans	-74.1	-34.9	177.5	-71	168.1	164.5	0	0	112	K289 F290 L291 A296 I297 L458 P459	K289-E293 WeakPolarHBondContact CE-OE1 3.47Å; K289-E293 IonicContact NZ-OE1 3.31Å; K289-E293 PolarHBondContact NZ-OE1 3.26Å; K289-E293 WeakPolarHBondContact O-CG 3.23Å; K289-E293 PolarHBondContact O-N 2.84Å; F290-E293 WeakPolarHBondContact CD1-OE2 3.36Å; F290-E293 PolarHBondContact O-N 2.89Å; L291-E293 VanDerWaalsContact C-N 3.32Å; L291-E293 PolarHBondContact O-N 3.46Å; E293-A296 WeakPolarHBondContact O-CB 3.44Å; E293-A296 PolarHBondContact O-N 2.93Å; E293-I297 WeakPolarHBondContact O-CG1 3.21Å; E293-I297 PolarHBondContact O-N 3.03Å; E293-L458 HydrophobicContact CB-CB 4.11Å; E293-L458 HydrophobicContact CB-CD1 3.98Å; E293-L458 HydrophobicContact CG-CB 4.09Å; E293-L458 WeakPolarHBondContact OE2-CB 3.35Å; E293-L458 WeakPolarHBondContact OE2-CD1 3.23Å; E293-P459 WeakPolarHBondContact OE1-CD 3.13Å; E293-P459 VanDerWaalsContact OE1-CG 3.31Å; E293-P459 WeakPolarHBondContact OE1-CG 3.47Å
294	R	78	Confident	76.9	Confident	51 Å²	51	44.6 Å²	44.6	19%	0.192	21%	0.205	C	C	.	.	H	α-helix	trans	-66.6	-43.4	172.8	-176.3	-179.2	-111.1	140.3	-12.6	111.7	F290 L291 A296 I297 N298 L407 D408 D411	F290-R294 WeakPolarHBondContact O-CB 3.47Å; F290-R294 PolarHBondContact O-N 3.48Å; L291-R294 PolarHBondContact O-N 3.09Å; R294-A296 VanDerWaalsContact C-N 3.3Å; R294-A296 PolarHBondContact O-N 3.37Å; R294-I297 PolarHBondContact O-N 2.79Å; R294-N298 WeakPolarHBondContact O-CB 3.3Å; R294-N298 PolarHBondContact O-N 2.89Å; R294-N298 PolarHBondContact O-ND2 2.83Å; R294-L407 HydrophobicContact CB-CD1 3.93Å; R294-L407 HydrophobicContact CG-CD1 4.2Å; R294-D408 IonicContact CZ-OD1 2.74Å; R294-D408 IonicContact NH2-OD1 2.69Å; R294-D408 PolarHBondContact NH2-OD1 3.16Å; R294-D411 IonicContact CZ-OD2 2.61Å; R294-D411 IonicContact NH1-OD1 3.02Å; R294-D411 PolarHBondContact NH1-OD1 2.92Å; R294-D411 IonicContact NH1-OD2 3Å; R294-D411 PolarHBondContact NH1-OD2 3.4Å; R294-D411 IonicContact NH2-OD2 2.72Å; R294-D411 PolarHBondContact NH2-OD2 3.42Å
295	E	78.8	Confident	78.3	Confident	83 Å²	83	43.3 Å²	43.3	39%	0.388	21%	0.211	S	C	.	.	H	α-helix	trans	-58	-45.4	172.8	-71.8	178.4	159	0	0	110.5	Y257 L291 I297 N298 H299	Y257-E295 HydrophobicContact CE1-CB 3.96Å; Y257-E295 PolarHBondContact OH-O 2.98Å; L291-E295 WeakPolarHBondContact O-CG 3.47Å; L291-E295 PolarHBondContact O-N 3.38Å; E295-I297 PolarHBondContact O-N 3.06Å; E295-N298 PolarHBondContact O-N 3.23Å; E295-H299 PolarHBondContact O-N 3.1Å
296	A	81.1	Confident	79.5	Confident	4 Å²	4	39.9 Å²	39.9	3%	0.033	20%	0.204	C	C	.	.	H	α-helix	trans	-57.4	-47.4	176.5	0	0	0	0	0	112.6	Y257 T292 E293 R294 H299 I300 V462	Y257-A296 HydrophobicContact CD1-CB 3.49Å; Y257-A296 VanDerWaalsContact CD1-CB 3.49Å; Y257-A296 HydrophobicContact CE1-CB 3.91Å; Y257-A296 HydrophobicContact CG-CB 4.21Å; T292-A296 WeakPolarHBondContact O-CB 3.4Å; T292-A296 PolarHBondContact O-N 2.8Å; E293-A296 WeakPolarHBondContact O-CB 3.44Å; E293-A296 PolarHBondContact O-N 2.93Å; R294-A296 VanDerWaalsContact C-N 3.3Å; R294-A296 PolarHBondContact O-N 3.37Å; A296-H299 PolarHBondContact O-N 3.48Å; A296-I300 WeakPolarHBondContact O-CB 3.37Å; A296-I300 WeakPolarHBondContact O-CD1 3.43Å; A296-I300 WeakPolarHBondContact O-CG1 3.44Å; A296-I300 PolarHBondContact O-N 3.09Å; A296-V462 HydrophobicContact CB-CG1 3.91Å; A296-V462 HydrophobicContact CB-CG2 3.76Å
297	I	82.5	Confident	80.9	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-62.9	-45.7	177.9	-71.7	169	0	0	0	111.6	E293 R294 E295 H299 I300 E301 I400 K404 L407 L458 V462	E293-I297 WeakPolarHBondContact O-CG1 3.21Å; E293-I297 PolarHBondContact O-N 3.03Å; R294-I297 PolarHBondContact O-N 2.79Å; E295-I297 PolarHBondContact O-N 3.06Å; I297-H299 VanDerWaalsContact C-N 3.25Å; I297-H299 PolarHBondContact O-N 2.91Å; I297-I300 PolarHBondContact O-N 3.2Å; I297-E301 WeakPolarHBondContact O-CB 3.45Å; I297-E301 PolarHBondContact O-N 3.23Å; I297-I400 HydrophobicContact CG2-CG2 3.85Å; I297-K404 HydrophobicContact CG2-CD 4.05Å; I297-K404 HydrophobicContact CG2-CG 3.58Å; I297-L407 HydrophobicContact CD1-CD1 3.98Å; I297-L458 HydrophobicContact CD1-CD2 3.42Å; I297-L458 VanDerWaalsContact CD1-CD2 3.42Å; I297-V462 HydrophobicContact CG1-CG2 4.33Å
298	N	84.9	Confident	82.1	Confident	55 Å²	55	39.3 Å²	39.3	29%	0.294	20%	0.201	S	C	.	.	H	α-helix	trans	-62.7	-30.1	178.3	-75.7	-25.8	0	0	0	112.9	R294 E295 K302 K404	R294-N298 WeakPolarHBondContact O-CB 3.3Å; R294-N298 PolarHBondContact O-N 2.89Å; R294-N298 PolarHBondContact O-ND2 2.83Å; E295-N298 PolarHBondContact O-N 3.23Å; N298-K302 WeakPolarHBondContact O-CG 3.33Å; N298-K302 PolarHBondContact O-N 3.06Å; N298-K404 WeakPolarHBondContact OD1-CE 3.43Å
299	H	81.8	Confident	83.1	Confident	8 Å²	8	41.4 Å²	41.4	4%	0.037	22%	0.22	C	C	.	.	H	α-helix	trans	-76.8	-46.7	171.3	159.8	-107	0	0	0	112.9	E253 Y257 E295 A296 I297 E301 K302 S303	E253-H299 VanDerWaalsContact CB-NE2 3.33Å; E253-H299 WeakPolarHBondContact CB-NE2 3.5Å; E253-H299 WeakPolarHBondContact CG-CD2 3.42Å; E253-H299 WeakPolarHBondContact CG-NE2 3.46Å; Y257-H299 HydrophobicContact CD2-CB 3.93Å; Y257-H299 AromaticContact CD2-CE1 3.87Å; Y257-H299 AromaticContact CD2-CG 3.59Å; Y257-H299 AromaticContact CD2-ND1 3.12Å; Y257-H299 WeakPolarHBondContact CD2-ND1 3.27Å; Y257-H299 HydrophobicContact CE1-CB 4.41Å; Y257-H299 HydrophobicContact CE2-CB 3.1Å; Y257-H299 AromaticContact CE2-CD2 4Å; Y257-H299 AromaticContact CE2-CG 3.09Å; Y257-H299 AromaticContact CE2-ND1 3.21Å; Y257-H299 WeakPolarHBondContact CE2-ND1 3.47Å; Y257-H299 AromaticContact CZ-CG 3.93Å; Y257-H299 WeakPolarHBondContact OH-CB 3.25Å; E295-H299 PolarHBondContact O-N 3.1Å; A296-H299 PolarHBondContact O-N 3.48Å; I297-H299 VanDerWaalsContact C-N 3.25Å; I297-H299 PolarHBondContact O-N 2.91Å; H299-E301 PolarHBondContact O-N 3.17Å; H299-K302 CarbonylContact O-C 3.53Å; H299-K302 WeakPolarHBondContact O-CA 3.25Å; H299-K302 WeakPolarHBondContact O-CB 3.43Å; H299-K302 PolarHBondContact O-N 3.29Å; H299-S303 PolarHBondContact NE2-OG 3.26Å; H299-S303 PolarHBondContact O-N 2.89Å
300	I	87.2	Confident	83.9	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-57.1	-37.3	178.8	-67.4	161.9	0	0	0	109.2	A296 I297 S303 C304 L396 I400 V462 A465 L469	A296-I300 WeakPolarHBondContact O-CB 3.37Å; A296-I300 WeakPolarHBondContact O-CD1 3.43Å; A296-I300 WeakPolarHBondContact O-CG1 3.44Å; A296-I300 PolarHBondContact O-N 3.09Å; I297-I300 PolarHBondContact O-N 3.2Å; I300-S303 PolarHBondContact O-N 3.47Å; I300-C304 WeakPolarHBondContact O-CB 3.45Å; I300-C304 PolarHBondContact O-N 3.14Å; I300-L396 HydrophobicContact CG2-CD2 4.41Å; I300-I400 HydrophobicContact CB-CD1 4.29Å; I300-I400 HydrophobicContact CG2-CD1 3.51Å; I300-I400 HydrophobicContact CG2-CG1 4.24Å; I300-V462 HydrophobicContact CD1-CB 4.29Å; I300-V462 HydrophobicContact CD1-CG1 4.13Å; I300-V462 HydrophobicContact CD1-CG2 4.15Å; I300-A465 HydrophobicContact CD1-CB 3.93Å; I300-A465 HydrophobicContact CG2-CB 3.66Å; I300-L469 HydrophobicContact CG2-CD1 3.93Å
301	E	89	Confident	84.6	Confident	51 Å²	51	39.5 Å²	39.5	24%	0.238	22%	0.218	C	C	.	.	H	α-helix	trans	-57	-51.8	170.6	-172.2	-179.3	-147.5	0	0	112.7	I297 H299 C304 A305 I400 K404	I297-E301 WeakPolarHBondContact O-CB 3.45Å; I297-E301 PolarHBondContact O-N 3.23Å; H299-E301 PolarHBondContact O-N 3.17Å; E301-C304 PolarHBondContact O-N 3.36Å; E301-A305 WeakPolarHBondContact O-CB 3.49Å; E301-A305 PolarHBondContact O-N 3.45Å; E301-I400 HydrophobicContact CB-CG2 3.89Å; E301-I400 HydrophobicContact CG-CG2 4.15Å; E301-K404 IonicContact OE1-NZ 3.11Å; E301-K404 PolarHBondContact OE1-NZ 3.18Å; E301-K404 IonicContact OE2-NZ 2.68Å; E301-K404 PolarHBondContact OE2-NZ 3.41Å
302	K	89	Confident	85.5	Confident	154 Å²	154	39.1 Å²	39.1	67%	0.67	21%	0.214	S	C	*	.	H	α-helix	trans	-61.7	-43.6	177.4	-71.9	173.2	-176.9	179	0	112.3	N298 H299 A305 S306	N298-K302 WeakPolarHBondContact O-CG 3.33Å; N298-K302 PolarHBondContact O-N 3.06Å; H299-K302 CarbonylContact O-C 3.53Å; H299-K302 WeakPolarHBondContact O-CA 3.25Å; H299-K302 WeakPolarHBondContact O-CB 3.43Å; H299-K302 PolarHBondContact O-N 3.29Å; K302-A305 PolarHBondContact O-N 2.97Å; K302-S306 VanDerWaalsContact O-CB 3.27Å; K302-S306 WeakPolarHBondContact O-CB 3.45Å; K302-S306 PolarHBondContact O-N 3Å
303	S	88.1	Confident	86.2	Confident	12 Å²	12	41 Å²	41	8%	0.084	23%	0.229	C	C	.	.	H	α-helix	trans	-69.4	-37.4	178.7	-83.4	0	0	0	0	112.3	H299 I300 S306 L307	H299-S303 PolarHBondContact NE2-OG 3.26Å; H299-S303 PolarHBondContact O-N 2.89Å; I300-S303 PolarHBondContact O-N 3.47Å; S303-S306 PolarHBondContact O-N 3.28Å; S303-L307 VanDerWaalsContact O-CB 3.25Å; S303-L307 WeakPolarHBondContact O-CB 3.22Å; S303-L307 PolarHBondContact O-N 2.88Å
304	C	90.8	Very high	86.7	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.014	24%	0.238	C	C	.	.	H	α-helix	trans	-61.6	-48.8	171.4	-174.7	0	0	0	0	111.4	I300 E301 S306 L307 Q308 L393 L469	I300-C304 WeakPolarHBondContact O-CB 3.45Å; I300-C304 PolarHBondContact O-N 3.14Å; E301-C304 PolarHBondContact O-N 3.36Å; C304-S306 PolarHBondContact O-N 3.07Å; C304-L307 PolarHBondContact O-N 2.63Å; C304-Q308 WeakPolarHBondContact O-CB 3.42Å; C304-Q308 PolarHBondContact O-N 3.22Å; C304-L393 PolarHBondContact SG-O 2.98Å; C304-L393 VanDerWaalsContact SG-O 3.4Å; C304-L469 HydrophobicContact CB-CD2 3.97Å
305	A	89.5	Confident	87.2	Confident	48 Å²	48	41.5 Å²	41.5	40%	0.397	23%	0.231	S	C	.	.	H	α-helix	trans	-63.7	-41	177.7	0	0	0	0	0	112.8	E301 K302 S309	E301-A305 WeakPolarHBondContact O-CB 3.49Å; E301-A305 PolarHBondContact O-N 3.45Å; K302-A305 PolarHBondContact O-N 2.97Å; A305-S309 WeakPolarHBondContact O-CB 3.32Å; A305-S309 PolarHBondContact O-N 2.98Å
306	S	88.5	Confident	87.8	Confident	65 Å²	65	43.4 Å²	43.4	46%	0.455	24%	0.238	S	C	.	.	H	α-helix	trans	-62.8	-48.8	175.7	-174.1	0	0	0	0	111.6	K302 S303 C304 S309 A310	K302-S306 VanDerWaalsContact O-CB 3.27Å; K302-S306 WeakPolarHBondContact O-CB 3.45Å; K302-S306 PolarHBondContact O-N 3Å; S303-S306 PolarHBondContact O-N 3.28Å; C304-S306 PolarHBondContact O-N 3.07Å; S306-S309 PolarHBondContact O-N 3.47Å; S306-A310 VanDerWaalsContact O-CB 3.31Å; S306-A310 WeakPolarHBondContact O-CB 3.21Å; S306-A310 PolarHBondContact O-N 2.94Å
307	L	89.1	Confident	88	Confident	24 Å²	24	49.9 Å²	49.9	13%	0.126	26%	0.261	C	S	.	.	H	α-helix	trans	-63.4	-44.2	178.1	-179.1	59.7	0	0	0	111.7	S303 C304 A310 V311 L393 L469 A472	S303-L307 VanDerWaalsContact O-CB 3.25Å; S303-L307 WeakPolarHBondContact O-CB 3.22Å; S303-L307 PolarHBondContact O-N 2.88Å; C304-L307 PolarHBondContact O-N 2.63Å; L307-A310 PolarHBondContact O-N 3.08Å; L307-V311 HydrophobicContact CD1-CG2 4.02Å; L307-V311 HydrophobicContact CG-CG2 4.43Å; L307-V311 WeakPolarHBondContact O-CB 3.3Å; L307-V311 VanDerWaalsContact O-CG2 3.28Å; L307-V311 WeakPolarHBondContact O-CG2 3.46Å; L307-V311 PolarHBondContact O-N 3.06Å; L307-L393 HydrophobicContact CD2-CD1 4.18Å; L307-L393 HydrophobicContact CD2-CD2 4.01Å; L307-L393 HydrophobicContact CG-CD1 4.05Å; L307-L469 HydrophobicContact CD2-CD2 4.12Å; L307-A472 HydrophobicContact CD2-CB 4.3Å
308	Q	91.8	Very high	88.3	Confident	46 Å²	46	50.5 Å²	50.5	22%	0.215	27%	0.265	C	S	.	.	H	α-helix	trans	-57.9	-52	176.2	-176.9	-178.1	-9.9	0	0	111	C304 A310 V311 E312 L390 L393	C304-Q308 WeakPolarHBondContact O-CB 3.42Å; C304-Q308 PolarHBondContact O-N 3.22Å; Q308-A310 VanDerWaalsContact C-N 3.34Å; Q308-A310 PolarHBondContact O-N 2.79Å; Q308-V311 PolarHBondContact O-N 3.45Å; Q308-E312 WeakPolarHBondContact CG-OE1 3.5Å; Q308-E312 PolarHBondContact NE2-OE1 3.13Å; Q308-E312 WeakPolarHBondContact O-CB 3.39Å; Q308-E312 WeakPolarHBondContact O-CG 3.37Å; Q308-E312 PolarHBondContact O-N 3.42Å; Q308-L390 HydrophobicContact CG-CD2 4.14Å; Q308-L393 HydrophobicContact CB-CD1 4.23Å
309	S	90.5	Very high	88.5	Confident	78 Å²	78	52.4 Å²	52.4	55%	0.545	27%	0.268	S	S	.	.	H	α-helix	trans	-60.5	-41.6	179	-176.8	0	0	0	0	112.4	A305 S306 S313	A305-S309 WeakPolarHBondContact O-CB 3.32Å; A305-S309 PolarHBondContact O-N 2.98Å; S306-S309 PolarHBondContact O-N 3.47Å; S309-S313 WeakPolarHBondContact O-CB 3.31Å; S309-S313 PolarHBondContact O-N 3.09Å
310	A	86.3	Confident	88.9	Confident	31 Å²	31	61.1 Å²	61.1	26%	0.256	30%	0.301	S	S	.	.	H	α-helix	trans	-63.6	-45.3	176.8	0	0	0	0	0	112.4	S306 L307 Q308 R314	S306-A310 VanDerWaalsContact O-CB 3.31Å; S306-A310 WeakPolarHBondContact O-CB 3.21Å; S306-A310 PolarHBondContact O-N 2.94Å; L307-A310 PolarHBondContact O-N 3.08Å; Q308-A310 VanDerWaalsContact C-N 3.34Å; Q308-A310 PolarHBondContact O-N 2.79Å; A310-R314 WeakPolarHBondContact O-CB 3.26Å; A310-R314 PolarHBondContact O-N 3.46Å
311	V	89.4	Confident	88.9	Confident	11 Å²	11	66.7 Å²	66.7	7%	0.067	33%	0.325	C	S	.	.	H	α-helix	trans	-64.4	-47.7	178.2	169.2	0	0	0	0	111.2	L307 Q308 R314 S315 M385 V389 L390 A476	L307-V311 HydrophobicContact CD1-CG2 4.02Å; L307-V311 HydrophobicContact CG-CG2 4.43Å; L307-V311 WeakPolarHBondContact O-CB 3.3Å; L307-V311 VanDerWaalsContact O-CG2 3.28Å; L307-V311 WeakPolarHBondContact O-CG2 3.46Å; L307-V311 PolarHBondContact O-N 3.06Å; Q308-V311 PolarHBondContact O-N 3.45Å; V311-R314 PolarHBondContact O-N 3.46Å; V311-S315 WeakPolarHBondContact O-CB 3.46Å; V311-S315 PolarHBondContact O-N 3.08Å; V311-S315 PolarHBondContact O-OG 3.39Å; V311-M385 HydrophobicContact CG1-CE 4.41Å; V311-M385 HydrophobicContact CG1-CG 3.74Å; V311-M385 HydrophobicContact CG1-SD 3.43Å; V311-M385 WeakPolarHBondContact CG1-SD 3.47Å; V311-V389 HydrophobicContact CG1-CG1 4.31Å; V311-V389 HydrophobicContact CG2-CG1 4.33Å; V311-L390 HydrophobicContact CB-CD2 4.35Å; V311-L390 HydrophobicContact CG1-CD2 3.88Å; V311-A476 HydrophobicContact CG2-CB 4.01Å
312	E	91	Very high	88.9	Confident	58 Å²	58	64.4 Å²	64.4	27%	0.271	32%	0.315	S	S	.	.	H	α-helix	trans	-63.1	-46	178.5	-73.5	-177.6	-154.3	0	0	112.1	Q308 R314 S315 K316 L390	Q308-E312 WeakPolarHBondContact CG-OE1 3.5Å; Q308-E312 PolarHBondContact NE2-OE1 3.13Å; Q308-E312 WeakPolarHBondContact O-CB 3.39Å; Q308-E312 WeakPolarHBondContact O-CG 3.37Å; Q308-E312 PolarHBondContact O-N 3.42Å; E312-R314 PolarHBondContact O-N 3.35Å; E312-S315 PolarHBondContact O-N 3.46Å; E312-K316 WeakPolarHBondContact O-CB 3.23Å; E312-K316 WeakPolarHBondContact O-CD 3.36Å; E312-K316 VanDerWaalsContact O-CG 3.26Å; E312-K316 WeakPolarHBondContact O-CG 3.49Å; E312-K316 PolarHBondContact O-N 2.83Å; E312-K316 IonicContact OE2-NZ 3.9Å; E312-L390 HydrophobicContact CG-CD1 4.18Å; E312-L390 HydrophobicContact CG-CD2 3.94Å
313	S	88	Confident	89	Confident	63 Å²	63	59.5 Å²	59.5	44%	0.441	30%	0.296	S	S	.	.	H	α-helix	trans	-61.9	-42.8	178.5	-176.8	0	0	0	0	111.6	S309 K316 R317	S309-S313 WeakPolarHBondContact O-CB 3.31Å; S309-S313 PolarHBondContact O-N 3.09Å; S313-K316 PolarHBondContact O-N 3.09Å; S313-R317 WeakPolarHBondContact O-CB 3.38Å; S313-R317 PolarHBondContact O-N 3.29Å
314	R	86.4	Confident	89	Confident	71 Å²	71	61.7 Å²	61.7	27%	0.268	31%	0.314	S	S	.	.	H	α-helix	trans	-67.8	-43	178.1	-172	152.2	177	94.1	3.2	112.2	W243 A310 V311 E312 K316 R317 T318 Q480	W243-R314 VanDerWaalsContact CZ2-CD 3.44Å; W243-R314 VanDerWaalsContact NE1-NH1 3.19Å; A310-R314 WeakPolarHBondContact O-CB 3.26Å; A310-R314 PolarHBondContact O-N 3.46Å; V311-R314 PolarHBondContact O-N 3.46Å; E312-R314 PolarHBondContact O-N 3.35Å; R314-K316 PolarHBondContact O-N 3.32Å; R314-R317 PolarHBondContact O-N 3Å; R314-T318 PolarHBondContact O-N 3.33Å; R314-T318 PolarHBondContact O-OG1 3.08Å; R314-Q480 VanDerWaalsContact NE-CD 3.34Å; R314-Q480 VanDerWaalsContact NE-NE2 3.17Å
315	S	88.7	Confident	88.9	Confident	5 Å²	5	65 Å²	65	4%	0.035	33%	0.329	C	S	.	.	H	α-helix	trans	-60.9	-45.2	174.8	-55.2	0	0	0	0	111.4	V311 E312 R317 T318 R319 Y381	V311-S315 WeakPolarHBondContact O-CB 3.46Å; V311-S315 PolarHBondContact O-N 3.08Å; V311-S315 PolarHBondContact O-OG 3.39Å; E312-S315 PolarHBondContact O-N 3.46Å; S315-R317 PolarHBondContact O-N 2.65Å; S315-T318 PolarHBondContact O-N 3.4Å; S315-R319 WeakPolarHBondContact O-CB 3.36Å; S315-R319 PolarHBondContact O-N 3.39Å; S315-Y381 PolarHBondContact OG-OH 3.18Å
316	K	89.6	Confident	88.9	Confident	122 Å²	122	63.6 Å²	63.6	53%	0.53	31%	0.314	S	S	.	.	H	α-helix	trans	-59.9	-42.2	174.1	-73.8	164.7	-178.3	162.5	0	112.1	E312 S313 R314 R320	E312-K316 WeakPolarHBondContact O-CB 3.23Å; E312-K316 WeakPolarHBondContact O-CD 3.36Å; E312-K316 VanDerWaalsContact O-CG 3.26Å; E312-K316 WeakPolarHBondContact O-CG 3.49Å; E312-K316 PolarHBondContact O-N 2.83Å; E312-K316 IonicContact OE2-NZ 3.9Å; S313-K316 PolarHBondContact O-N 3.09Å; R314-K316 PolarHBondContact O-N 3.32Å; K316-R320 WeakPolarHBondContact O-CG 3.17Å; K316-R320 PolarHBondContact O-N 3.47Å; K316-R320 VanDerWaalsContact O-N 3.08Å
317	R	86.6	Confident	88.9	Confident	140 Å²	140	65.6 Å²	65.6	53%	0.528	32%	0.32	S	S	.	.	H	α-helix	trans	-66.6	-47.2	177.8	-170.8	-176.6	-67.7	-173	-2.8	112	S313 R314 S315 R319 R320 F321	S313-R317 WeakPolarHBondContact O-CB 3.38Å; S313-R317 PolarHBondContact O-N 3.29Å; R314-R317 PolarHBondContact O-N 3Å; S315-R317 PolarHBondContact O-N 2.65Å; R317-R319 VanDerWaalsContact C-N 3.32Å; R317-R319 PolarHBondContact O-N 2.94Å; R317-R320 PolarHBondContact O-N 2.92Å; R317-F321 PolarHBondContact O-N 3Å
318	T	87.4	Confident	88.9	Confident	15 Å²	15	70.2 Å²	70.2	9%	0.092	34%	0.339	C	S	.	.	H	α-helix	trans	-61.1	-40.1	176.6	-65.6	0	0	0	0	111.5	R314 S315 F321 I322 Q480 L483 M484	R314-T318 PolarHBondContact O-N 3.33Å; R314-T318 PolarHBondContact O-OG1 3.08Å; S315-T318 PolarHBondContact O-N 3.4Å; T318-F321 PolarHBondContact O-N 3.17Å; T318-I322 HydrophobicContact CG2-CD1 3.91Å; T318-I322 WeakPolarHBondContact O-CG1 3.41Å; T318-I322 PolarHBondContact O-N 3.01Å; T318-Q480 PolarHBondContact OG1-NE2 2.78Å; T318-Q480 VanDerWaalsContact OG1-NE2 3.14Å; T318-L483 HydrophobicContact CG2-CD2 3.6Å; T318-M484 HydrophobicContact CG2-CE 3.93Å
319	R	90.6	Very high	88.6	Confident	94 Å²	94	68.4 Å²	68.4	36%	0.355	33%	0.331	S	S	.	.	H	α-helix	trans	-61.7	-46.3	174.6	-176	159.9	-158.1	-75.8	-3.8	113.1	S315 R317 F321 I322 L323 M377 D378	S315-R319 WeakPolarHBondContact O-CB 3.36Å; S315-R319 PolarHBondContact O-N 3.39Å; R317-R319 VanDerWaalsContact C-N 3.32Å; R317-R319 PolarHBondContact O-N 2.94Å; R319-F321 VanDerWaalsContact C-N 3.33Å; R319-F321 PolarHBondContact O-N 3.17Å; R319-I322 PolarHBondContact O-N 3.13Å; R319-L323 HydrophobicContact CG-CD1 3.95Å; R319-L323 WeakPolarHBondContact O-CB 3.26Å; R319-L323 VanDerWaalsContact O-CG 3.3Å; R319-L323 WeakPolarHBondContact O-CG 3.28Å; R319-L323 PolarHBondContact O-N 3.32Å; R319-M377 VanDerWaalsContact CA-SD 3.55Å; R319-M377 HydrophobicContact CB-CE 4.29Å; R319-M377 HydrophobicContact CB-SD 3.8Å; R319-M377 HydrophobicContact CG-CE 3.62Å; R319-M377 HydrophobicContact CG-SD 3.83Å; R319-D378 IonicContact CZ-OD1 3.55Å; R319-D378 IonicContact CZ-OD2 2.67Å; R319-D378 IonicContact NE-OD1 3.58Å; R319-D378 PolarHBondContact NE-OD1 3.43Å; R319-D378 IonicContact NE-OD2 3.56Å; R319-D378 PolarHBondContact NE-OD2 3.5Å; R319-D378 IonicContact NH2-OD1 2.71Å; R319-D378 IonicContact NH2-OD2 3.05Å; R319-D378 PolarHBondContact NH2-OD2 2.96Å
320	R	89.4	Confident	88.5	Confident	192 Å²	192	66.2 Å²	66.2	73%	0.725	32%	0.315	S	S	*	.	H	α-helix	trans	-60.8	-41.3	175	-71.9	177.8	-174.1	-179.8	1	112.3	K316 R317 L323 A324	K316-R320 WeakPolarHBondContact O-CG 3.17Å; K316-R320 PolarHBondContact O-N 3.47Å; K316-R320 VanDerWaalsContact O-N 3.08Å; R317-R320 PolarHBondContact O-N 2.92Å; R320-L323 PolarHBondContact O-N 2.97Å; R320-A324 WeakPolarHBondContact O-CB 3.4Å; R320-A324 PolarHBondContact O-N 2.71Å
321	F	88.3	Confident	88.5	Confident	119 Å²	119	70.3 Å²	70.3	52%	0.522	33%	0.327	S	S	.	.	H	α-helix	trans	-61.5	-47.7	178.6	177.6	-90.2	0	0	0	112.3	R317 T318 R319 A324 H325	R317-F321 PolarHBondContact O-N 3Å; T318-F321 PolarHBondContact O-N 3.17Å; R319-F321 VanDerWaalsContact C-N 3.33Å; R319-F321 PolarHBondContact O-N 3.17Å; F321-A324 PolarHBondContact O-N 3.17Å; F321-H325 AromaticContact CD2-CE1 3.87Å; F321-H325 AromaticContact CE1-CE1 3.69Å; F321-H325 AromaticContact CE1-ND1 3.91Å; F321-H325 AromaticContact CE2-CE1 3.37Å; F321-H325 WeakPolarHBondContact CE2-CE1 3.28Å; F321-H325 AromaticContact CZ-CE1 3.26Å; F321-H325 WeakPolarHBondContact CZ-CE1 3.49Å; F321-H325 AromaticContact CZ-ND1 3.94Å; F321-H325 AromaticContact CZ-NE2 3.83Å; F321-H325 PolarHBondContact O-N 2.65Å; F321-H325 PolarHBondContact O-ND1 3.03Å
322	I	88.1	Confident	88.3	Confident	3 Å²	3	71.3 Å²	71.3	2%	0.015	33%	0.332	C	S	.	.	H	α-helix	trans	-65	-42.7	179.1	-68.7	168.3	0	0	0	111	T318 R319 H325 K326 F370 L373 I374 M377 L483	T318-I322 HydrophobicContact CG2-CD1 3.91Å; T318-I322 WeakPolarHBondContact O-CG1 3.41Å; T318-I322 PolarHBondContact O-N 3.01Å; R319-I322 PolarHBondContact O-N 3.13Å; I322-H325 PolarHBondContact O-N 3.28Å; I322-K326 PolarHBondContact O-N 2.84Å; I322-K326 VanDerWaalsContact O-N 3.09Å; I322-F370 HydrophobicContact CG2-CD1 4.21Å; I322-L373 HydrophobicContact CD1-CD2 4.16Å; I322-L373 HydrophobicContact CD1-CG 4.21Å; I322-L373 HydrophobicContact CG1-CD2 4.14Å; I322-L373 HydrophobicContact CG2-CD2 4.04Å; I322-L373 HydrophobicContact CG2-CG 4.17Å; I322-I374 HydrophobicContact CG2-CG1 3.7Å; I322-M377 HydrophobicContact CB-SD 4.27Å; I322-M377 HydrophobicContact CD1-CG 4.49Å; I322-M377 HydrophobicContact CD1-SD 3.73Å; I322-M377 HydrophobicContact CG2-SD 4.47Å; I322-L483 HydrophobicContact CD1-CD1 4.38Å; I322-L483 HydrophobicContact CD1-CD2 4.2Å; I322-L483 HydrophobicContact CD1-CG 4.47Å
323	L	90.8	Very high	87.9	Confident	51 Å²	51	70.7 Å²	70.7	27%	0.267	33%	0.328	S	S	.	.	H	α-helix	trans	-64.1	-44.5	177.1	-70	170.6	0	0	0	112.3	R319 R320 H325 K326 D327 I374	R319-L323 HydrophobicContact CG-CD1 3.95Å; R319-L323 WeakPolarHBondContact O-CB 3.26Å; R319-L323 VanDerWaalsContact O-CG 3.3Å; R319-L323 WeakPolarHBondContact O-CG 3.28Å; R319-L323 PolarHBondContact O-N 3.32Å; R320-L323 PolarHBondContact O-N 2.97Å; L323-H325 VanDerWaalsContact C-N 3.25Å; L323-H325 PolarHBondContact O-N 2.72Å; L323-K326 WeakPolarHBondContact O-CA 2.84Å; L323-K326 WeakPolarHBondContact O-CB 3.15Å; L323-K326 PolarHBondContact O-N 2.69Å; L323-D327 PolarHBondContact O-N 3.33Å; L323-I374 HydrophobicContact CD2-CD1 3.86Å; L323-I374 HydrophobicContact CD2-CG1 4.24Å
324	A	87.7	Confident	87.8	Confident	57 Å²	57	74.4 Å²	74.4	47%	0.471	34%	0.336	S	S	.	.	H	α-helix	trans	-59.6	-35.3	177.6	0	0	0	0	0	112.8	R320 F321 F328	R320-A324 WeakPolarHBondContact O-CB 3.4Å; R320-A324 PolarHBondContact O-N 2.71Å; F321-A324 PolarHBondContact O-N 3.17Å; A324-F328 WeakPolarHBondContact O-CB 3.43Å; A324-F328 PolarHBondContact O-N 2.84Å
325	H	88.7	Confident	87.6	Confident	72 Å²	72	72.1 Å²	72.1	33%	0.333	33%	0.33	S	S	.	.	H	α-helix	trans	-69.1	-41.2	173	-76.1	71.9	0	0	0	112.1	F321 I322 L323 D327 F328 I329 F370	F321-H325 AromaticContact CD2-CE1 3.87Å; F321-H325 AromaticContact CE1-CE1 3.69Å; F321-H325 AromaticContact CE1-ND1 3.91Å; F321-H325 AromaticContact CE2-CE1 3.37Å; F321-H325 WeakPolarHBondContact CE2-CE1 3.28Å; F321-H325 AromaticContact CZ-CE1 3.26Å; F321-H325 WeakPolarHBondContact CZ-CE1 3.49Å; F321-H325 AromaticContact CZ-ND1 3.94Å; F321-H325 AromaticContact CZ-NE2 3.83Å; F321-H325 PolarHBondContact O-N 2.65Å; F321-H325 PolarHBondContact O-ND1 3.03Å; I322-H325 PolarHBondContact O-N 3.28Å; L323-H325 VanDerWaalsContact C-N 3.25Å; L323-H325 PolarHBondContact O-N 2.72Å; H325-D327 VanDerWaalsContact C-N 3.35Å; H325-F328 PolarHBondContact O-N 3.36Å; H325-I329 WeakPolarHBondContact O-CD1 3.34Å; H325-I329 VanDerWaalsContact O-CG1 3.29Å; H325-I329 WeakPolarHBondContact O-CG1 3.16Å; H325-I329 PolarHBondContact O-N 3.04Å; H325-F370 HydrophobicContact CB-CD1 3.87Å; H325-F370 HydrophobicContact CB-CE1 3.27Å; H325-F370 HydrophobicContact CB-CZ 3.67Å
326	K	89.1	Confident	87.2	Confident	19 Å²	19	73.4 Å²	73.4	8%	0.083	34%	0.335	C	S	.	.	H	α-helix	trans	-61	-44	173.3	-177.7	57.1	162.4	87.1	0	111.4	I322 L323 F328 I329 C330 E367 F370 D371 I374	I322-K326 PolarHBondContact O-N 2.84Å; I322-K326 VanDerWaalsContact O-N 3.09Å; L323-K326 WeakPolarHBondContact O-CA 2.84Å; L323-K326 WeakPolarHBondContact O-CB 3.15Å; L323-K326 PolarHBondContact O-N 2.69Å; K326-F328 VanDerWaalsContact C-N 3.33Å; K326-F328 PolarHBondContact O-N 3.36Å; K326-I329 PolarHBondContact O-N 3.45Å; K326-C330 PolarHBondContact NZ-SG 3.42Å; K326-C330 WeakPolarHBondContact O-CB 3.21Å; K326-C330 PolarHBondContact O-N 2.89Å; K326-C330 PolarHBondContact O-SG 3.4Å; K326-E367 WeakPolarHBondContact CE-O 3.42Å; K326-E367 IonicContact NZ-OE1 3.72Å; K326-E367 PolarHBondContact NZ-OE1 2.86Å; K326-F370 HydrophobicContact CB-CB 4.16Å; K326-F370 HydrophobicContact CD-CB 3.81Å; K326-F370 HydrophobicContact CG-CB 4.49Å; K326-D371 WeakPolarHBondContact CE-OD1 3.4Å; K326-D371 WeakPolarHBondContact CE-OD2 3.38Å; K326-D371 IonicContact NZ-OD1 2.79Å; K326-D371 IonicContact NZ-OD2 3.21Å; K326-D371 PolarHBondContact NZ-OD2 3.48Å; K326-I374 HydrophobicContact CB-CD1 3.87Å; K326-I374 HydrophobicContact CG-CD1 3.88Å
327	D	89.7	Confident	86.8	Confident	106 Å²	106	72.6 Å²	72.6	57%	0.567	34%	0.336	S	S	*	.	H	α-helix	trans	-62.7	-39.8	178.2	-68.7	-29.3	0	0	0	111.7	L323 H325 C330 F331	L323-D327 PolarHBondContact O-N 3.33Å; H325-D327 VanDerWaalsContact C-N 3.35Å; D327-C330 WeakPolarHBondContact O-CB 3.48Å; D327-C330 PolarHBondContact O-N 3.28Å; D327-F331 WeakPolarHBondContact O-CB 3.48Å; D327-F331 PolarHBondContact O-N 3Å
328	F	88.3	Confident	86.5	Confident	121 Å²	121	73.4 Å²	73.4	53%	0.531	35%	0.346	S	S	.	.	H	α-helix	trans	-62.6	-42.7	172.5	178	-106.2	0	0	0	112.6	A324 H325 K326 F331 M332	A324-F328 WeakPolarHBondContact O-CB 3.43Å; A324-F328 PolarHBondContact O-N 2.84Å; H325-F328 PolarHBondContact O-N 3.36Å; K326-F328 VanDerWaalsContact C-N 3.33Å; K326-F328 PolarHBondContact O-N 3.36Å; F328-F331 WeakPolarHBondContact O-CB 3.32Å; F328-F331 PolarHBondContact O-N 3.36Å; F328-M332 HydrophobicContact CD1-CE 3.98Å; F328-M332 HydrophobicContact CD1-SD 4.4Å; F328-M332 HydrophobicContact CE1-CE 3.66Å; F328-M332 HydrophobicContact CE1-CG 4.17Å; F328-M332 HydrophobicContact CE1-SD 3.63Å; F328-M332 HydrophobicContact CZ-CE 4.46Å; F328-M332 HydrophobicContact CZ-CG 4.11Å; F328-M332 HydrophobicContact CZ-SD 3.85Å; F328-M332 WeakPolarHBondContact O-CG 3.28Å; F328-M332 PolarHBondContact O-N 2.96Å
329	I	86.8	Confident	86.2	Confident	9 Å²	9	78.8 Å²	78.8	5%	0.046	37%	0.37	C	S	.	.	H	α-helix	trans	-67.9	-40.4	176.4	-62.5	155.7	0	0	0	111.2	H325 K326 F331 M332 K333 I363 E367 F370	H325-I329 WeakPolarHBondContact O-CD1 3.34Å; H325-I329 VanDerWaalsContact O-CG1 3.29Å; H325-I329 WeakPolarHBondContact O-CG1 3.16Å; H325-I329 PolarHBondContact O-N 3.04Å; K326-I329 PolarHBondContact O-N 3.45Å; I329-F331 VanDerWaalsContact C-N 3.27Å; I329-F331 PolarHBondContact O-N 2.98Å; I329-M332 HydrophobicContact CB-CE 4.39Å; I329-M332 HydrophobicContact CG1-CE 4Å; I329-M332 PolarHBondContact O-N 3.42Å; I329-K333 PolarHBondContact O-N 3.29Å; I329-I363 HydrophobicContact CG2-CG2 4.12Å; I329-E367 HydrophobicContact CG2-CB 3.85Å; I329-F370 HydrophobicContact CD1-CB 4.31Å; I329-F370 HydrophobicContact CD1-CD2 3.25Å; I329-F370 HydrophobicContact CD1-CE2 3.62Å; I329-F370 HydrophobicContact CD1-CG 3.81Å; I329-F370 HydrophobicContact CD1-CZ 4.46Å
330	C	87.6	Confident	85.5	Confident	31 Å²	31	78.8 Å²	78.8	21%	0.209	38%	0.384	C	S	.	.	H	α-helix	trans	-57.3	-40.8	171.2	-72.8	0	0	0	0	111.8	K326 D327 K334	K326-C330 PolarHBondContact NZ-SG 3.42Å; K326-C330 WeakPolarHBondContact O-CB 3.21Å; K326-C330 PolarHBondContact O-N 2.89Å; K326-C330 PolarHBondContact O-SG 3.4Å; D327-C330 WeakPolarHBondContact O-CB 3.48Å; D327-C330 PolarHBondContact O-N 3.28Å; C330-K334 WeakPolarHBondContact O-CG 3.37Å; C330-K334 PolarHBondContact O-N 2.91Å
331	F	86.8	Confident	84.9	Confident	118 Å²	118	72 Å²	72	52%	0.518	36%	0.364	S	S	.	.	H	α-helix	trans	-64	-50.4	174.8	173.4	-99	0	0	0	111.2	D327 F328 I329 K333 K334 T335	D327-F331 WeakPolarHBondContact O-CB 3.48Å; D327-F331 PolarHBondContact O-N 3Å; F328-F331 WeakPolarHBondContact O-CB 3.32Å; F328-F331 PolarHBondContact O-N 3.36Å; I329-F331 VanDerWaalsContact C-N 3.27Å; I329-F331 PolarHBondContact O-N 2.98Å; F331-K333 VanDerWaalsContact C-N 3.3Å; F331-K333 PolarHBondContact O-N 3.02Å; F331-K334 PolarHBondContact O-N 3.02Å; F331-K334 VanDerWaalsContact O-N 3.09Å; F331-T335 PolarHBondContact O-N 3.4Å; F331-T335 PolarHBondContact O-OG1 3.19Å
332	M	84.9	Confident	84.2	Confident	32 Å²	32	67.5 Å²	67.5	16%	0.158	35%	0.345	C	S	.	.	H	α-helix	trans	-54.4	-45.2	174.6	-68.9	-165.5	-65.5	0	0	111.8	F328 I329 K334 T335 F336 I342 I363	F328-M332 HydrophobicContact CD1-CE 3.98Å; F328-M332 HydrophobicContact CD1-SD 4.4Å; F328-M332 HydrophobicContact CE1-CE 3.66Å; F328-M332 HydrophobicContact CE1-CG 4.17Å; F328-M332 HydrophobicContact CE1-SD 3.63Å; F328-M332 HydrophobicContact CZ-CE 4.46Å; F328-M332 HydrophobicContact CZ-CG 4.11Å; F328-M332 HydrophobicContact CZ-SD 3.85Å; F328-M332 WeakPolarHBondContact O-CG 3.28Å; F328-M332 PolarHBondContact O-N 2.96Å; I329-M332 HydrophobicContact CB-CE 4.39Å; I329-M332 HydrophobicContact CG1-CE 4Å; I329-M332 PolarHBondContact O-N 3.42Å; M332-K334 PolarHBondContact O-N 3.49Å; M332-T335 PolarHBondContact O-N 3.43Å; M332-F336 PolarHBondContact O-N 3.3Å; M332-I342 HydrophobicContact CB-CD1 4.11Å; M332-I342 WeakPolarHBondContact O-CD1 3.33Å; M332-I363 HydrophobicContact CB-CD1 4.43Å; M332-I363 HydrophobicContact CB-CG2 4.22Å
333	K	83.4	Confident	83.4	Confident	44 Å²	44	73.9 Å²	73.9	19%	0.191	37%	0.373	C	S	.	.	H	α-helix	trans	-59.7	-44	176.8	-175.8	176.9	179.3	-176.6	0	112.5	I329 F331 F336 L337 I363 E367	I329-K333 PolarHBondContact O-N 3.29Å; F331-K333 VanDerWaalsContact C-N 3.3Å; F331-K333 PolarHBondContact O-N 3.02Å; K333-F336 PolarHBondContact O-N 2.92Å; K333-L337 HydrophobicContact CG-CD1 4.21Å; K333-L337 VanDerWaalsContact O-CG 3.31Å; K333-L337 WeakPolarHBondContact O-CG 3.37Å; K333-L337 PolarHBondContact O-N 3.12Å; K333-I363 HydrophobicContact CB-CG2 3.89Å; K333-E367 WeakPolarHBondContact CD-OE2 3.49Å; K333-E367 WeakPolarHBondContact CE-OE2 3.22Å; K333-E367 IonicContact NZ-OE2 2.66Å; K333-E367 PolarHBondContact NZ-OE2 3.23Å
334	K	85.7	Confident	82.2	Confident	142 Å²	142	73.6 Å²	73.6	62%	0.617	37%	0.372	S	S	*	.	H	α-helix	trans	-63.2	-44.5	176.7	-74.3	174.3	179.4	179.3	0	111.8	C330 F331 M332 L337 Q338	C330-K334 WeakPolarHBondContact O-CG 3.37Å; C330-K334 PolarHBondContact O-N 2.91Å; F331-K334 PolarHBondContact O-N 3.02Å; F331-K334 VanDerWaalsContact O-N 3.09Å; M332-K334 PolarHBondContact O-N 3.49Å; K334-L337 PolarHBondContact O-N 3.14Å; K334-Q338 WeakPolarHBondContact O-CG 3.32Å; K334-Q338 PolarHBondContact O-N 3.23Å; K334-Q338 VanDerWaalsContact O-N 3.12Å
335	T	80.5	Confident	81	Confident	22 Å²	22	76.2 Å²	76.2	14%	0.135	37%	0.374	C	S	.	.	H	α-helix	trans	-62.4	-43.1	177.3	-57.9	0	0	0	0	111.5	F331 M332 L337 Q338 Q339 I342	F331-T335 PolarHBondContact O-N 3.4Å; F331-T335 PolarHBondContact O-OG1 3.19Å; M332-T335 PolarHBondContact O-N 3.43Å; T335-L337 PolarHBondContact O-N 2.89Å; T335-Q338 PolarHBondContact O-N 3.2Å; T335-Q338 VanDerWaalsContact O-N 3.15Å; T335-Q339 HydrophobicContact CG2-CG 4.37Å; T335-Q339 WeakPolarHBondContact O-CB 3.35Å; T335-Q339 PolarHBondContact O-N 2.77Å; T335-I342 HydrophobicContact CG2-CD1 4.22Å; T335-I342 HydrophobicContact CG2-CG1 4.3Å
336	F	81.8	Confident	79.5	Confident	32 Å²	32	77.4 Å²	77.4	14%	0.14	39%	0.388	C	S	.	.	H	α-helix	trans	-60.7	-45.3	175.7	-167.2	-74	0	0	0	111.5	M332 K333 Q338 Q339 S340 I342 L358 I360 I363	M332-F336 PolarHBondContact O-N 3.3Å; K333-F336 PolarHBondContact O-N 2.92Å; F336-Q338 PolarHBondContact O-N 3.06Å; F336-Q339 PolarHBondContact O-N 3.44Å; F336-S340 WeakPolarHBondContact CE1-O 3.34Å; F336-S340 VanDerWaalsContact CZ-O 3.25Å; F336-S340 WeakPolarHBondContact CZ-O 3.47Å; F336-S340 VanDerWaalsContact O-CA 3.24Å; F336-S340 WeakPolarHBondContact O-CA 3.26Å; F336-S340 PolarHBondContact O-N 3Å; F336-I342 HydrophobicContact CB-CD1 3.86Å; F336-I342 HydrophobicContact CB-CG1 4.01Å; F336-I342 HydrophobicContact CD2-CB 4.18Å; F336-I342 HydrophobicContact CD2-CD1 4.46Å; F336-I342 HydrophobicContact CD2-CG1 4.02Å; F336-I342 HydrophobicContact CG-CG1 4.48Å; F336-L358 WeakPolarHBondContact CE2-O 3.37Å; F336-I360 HydrophobicContact CD1-CB 4.01Å; F336-I360 HydrophobicContact CD1-CD1 3.58Å; F336-I360 HydrophobicContact CD1-CG1 3.81Å; F336-I360 HydrophobicContact CD2-CB 4.49Å; F336-I360 HydrophobicContact CE1-CB 3.72Å; F336-I360 HydrophobicContact CE1-CD1 3.77Å; F336-I360 HydrophobicContact CE1-CG1 4.01Å; F336-I360 HydrophobicContact CE1-CG2 4.46Å; F336-I360 HydrophobicContact CE2-CB 4.22Å; F336-I360 HydrophobicContact CG-CB 4.41Å; F336-I360 HydrophobicContact CG-CD1 4.42Å; F336-I360 HydrophobicContact CG-CG1 4.24Å; F336-I360 HydrophobicContact CZ-CB 3.84Å; F336-I363 HydrophobicContact CB-CD1 4.19Å; F336-I363 HydrophobicContact CD2-CD1 4.04Å; F336-I363 HydrophobicContact CG-CD1 4.38Å
337	L	80.6	Confident	77.7	Confident	105 Å²	105	78.8 Å²	78.8	55%	0.55	40%	0.396	S	S	.	.	H	α-helix	trans	-64.8	-21.8	178	-70.4	170.3	0	0	0	113.6	K333 K334 T335 I360	K333-L337 HydrophobicContact CG-CD1 4.21Å; K333-L337 VanDerWaalsContact O-CG 3.31Å; K333-L337 WeakPolarHBondContact O-CG 3.37Å; K333-L337 PolarHBondContact O-N 3.12Å; K334-L337 PolarHBondContact O-N 3.14Å; T335-L337 PolarHBondContact O-N 2.89Å; L337-I360 HydrophobicContact CD2-CD1 4.37Å
338	Q	81	Confident	75.9	Confident	158 Å²	158	77.4 Å²	77.4	74%	0.738	39%	0.388	S	S	*	.	H	α-helix	trans	-90.5	-35.3	176.8	-72.7	175.4	-17.6	0	0	113.4	K334 T335 F336	K334-Q338 WeakPolarHBondContact O-CG 3.32Å; K334-Q338 PolarHBondContact O-N 3.23Å; K334-Q338 VanDerWaalsContact O-N 3.12Å; T335-Q338 PolarHBondContact O-N 3.2Å; T335-Q338 VanDerWaalsContact O-N 3.15Å; F336-Q338 PolarHBondContact O-N 3.06Å
339	Q	79.8	Confident	74	Confident	127 Å²	127	74.7 Å²	74.7	59%	0.593	38%	0.383	S	S	*	.	H	α-helix	trans	-106.8	-3.7	-172.2	-62.7	-176.9	-9.5	0	0	113.5	T335 F336 T341	T335-Q339 HydrophobicContact CG2-CG 4.37Å; T335-Q339 WeakPolarHBondContact O-CB 3.35Å; T335-Q339 PolarHBondContact O-N 2.77Å; F336-Q339 PolarHBondContact O-N 3.44Å; Q339-T341 PolarHBondContact O-N 2.86Å
340	S	77.2	Confident	72.5	Confident	94 Å²	94	76.3 Å²	76.3	66%	0.657	39%	0.393	S	S	*	.	S	Bend	trans	57.2	-5.8	-173	-56.9	0	0	0	0	116.2	F336	F336-S340 WeakPolarHBondContact CE1-O 3.34Å; F336-S340 VanDerWaalsContact CZ-O 3.25Å; F336-S340 WeakPolarHBondContact CZ-O 3.47Å; F336-S340 VanDerWaalsContact O-CA 3.24Å; F336-S340 WeakPolarHBondContact O-CA 3.26Å; F336-S340 PolarHBondContact O-N 3Å
341	T	76.8	Confident	70.6	Confident	49 Å²	49	81.7 Å²	81.7	30%	0.301	42%	0.419	S	S	.	.			trans	-146.2	151	177.6	59.5	0	0	0	0	109.1	Q339	Q339-T341 PolarHBondContact O-N 2.86Å
342	I	73	Confident	68.7	Low	26 Å²	26	83.5 Å²	83.5	13%	0.133	44%	0.435	C	S	.	.			trans	-124.9	118.7	160.2	-74	-176.7	0	0	0	106.8	M332 T335 F336 E357 L358 I363	M332-I342 HydrophobicContact CB-CD1 4.11Å; M332-I342 WeakPolarHBondContact O-CD1 3.33Å; T335-I342 HydrophobicContact CG2-CD1 4.22Å; T335-I342 HydrophobicContact CG2-CG1 4.3Å; F336-I342 HydrophobicContact CB-CD1 3.86Å; F336-I342 HydrophobicContact CB-CG1 4.01Å; F336-I342 HydrophobicContact CD2-CB 4.18Å; F336-I342 HydrophobicContact CD2-CD1 4.46Å; F336-I342 HydrophobicContact CD2-CG1 4.02Å; F336-I342 HydrophobicContact CG-CG1 4.48Å; I342-E357 CarbonylContact O-C 3.58Å; I342-E357 VanDerWaalsContact O-CA 3.31Å; I342-E357 WeakPolarHBondContact O-CA 3.05Å; I342-L358 HydrophobicContact CB-CB 4.4Å; I342-L358 HydrophobicContact CG2-CB 4.34Å; I342-L358 PolarHBondContact O-N 2.97Å; I342-I363 HydrophobicContact CD1-CD1 4.12Å
343	K	71	Confident	66.8	Low	136 Å²	136	85.6 Å²	85.6	59%	0.591	45%	0.452	S	S	*	.	B	Isolated β-bridge	trans	-94.7	123.5	174.3	-69.2	179.1	-175.9	-164.4	0	108.8	N356 E357	K343-N356 CarbonylContact C-O 3.55Å; K343-N356 WeakPolarHBondContact CA-O 3.37Å; K343-E357 HydrophobicContact CD-CG 4.35Å; K343-E357 WeakPolarHBondContact CE-OE1 3.48Å; K343-E357 HydrophobicContact CG-CG 3.77Å; K343-E357 IonicContact NZ-OE1 2.9Å; K343-E357 PolarHBondContact NZ-OE1 3.41Å
344	L	66.1	Low	65.4	Low	46 Å²	46	90 Å²	90	24%	0.241	49%	0.488	C	S	.	.	P	Polyproline II helix	trans	-55.5	141.9	161.1	-71.1	174.6	0	0	0	108.7	I348 T350 N356 L358	L344-I348 HydrophobicContact CB-CB 4.2Å; L344-I348 HydrophobicContact CB-CD1 4.28Å; L344-I348 HydrophobicContact CD1-CG2 4.12Å; L344-I348 HydrophobicContact CD2-CD1 3.8Å; L344-I348 HydrophobicContact CD2-CG2 4.17Å; L344-T350 HydrophobicContact CD1-CG2 3.56Å; L344-N356 HydrophobicContact CB-CB 4.48Å; L344-N356 PolarHBondContact N-O 2.96Å; L344-L358 HydrophobicContact CD1-CD1 3.67Å; L344-L358 HydrophobicContact CD2-CD1 3.59Å; L344-L358 HydrophobicContact CG-CD1 3.55Å
345	H	62.3	Low	64.2	Low	111 Å²	111	85.8 Å²	85.8	51%	0.514	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-54.1	142.7	171.4	-160.5	-102.9	0	0	0	108.9	D347 I348	H345-D347 IonicContact CE1-OD2 2.73Å; H345-D347 PolarHBondContact CE1-OD2 3.34Å; H345-D347 IonicContact ND1-OD2 2.77Å; H345-D347 PolarHBondContact ND1-OD2 3.45Å; H345-D347 PolarHBondContact O-N 3.32Å; H345-I348 HydrophobicContact CB-CD1 4.07Å; H345-I348 HydrophobicContact CB-CG1 4.16Å; H345-I348 PolarHBondContact O-N 3.5Å
346	P	56.7	Low	63.2	Low	97 Å²	97	87.5 Å²	87.5	63%	0.63	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-28.8	178.2	-28	36.1	0	0	0	113.4	I348	P346-I348 PolarHBondContact O-N 3.32Å
347	D	51.1	Low	62.6	Low	49 Å²	49	89.7 Å²	89.7	26%	0.262	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	23.2	173.8	-51.2	-40.8	0	0	0	114.1	L221 H345	L221-D347 HydrophobicContact CB-CB 4.32Å; L221-D347 HydrophobicContact CD1-CB 4.21Å; L221-D347 WeakPolarHBondContact CD1-O 3.36Å; H345-D347 IonicContact CE1-OD2 2.73Å; H345-D347 PolarHBondContact CE1-OD2 3.34Å; H345-D347 IonicContact ND1-OD2 2.77Å; H345-D347 PolarHBondContact ND1-OD2 3.45Å; H345-D347 PolarHBondContact O-N 3.32Å
348	I	52.1	Low	62.1	Low	77 Å²	77	86.1 Å²	86.1	40%	0.395	48%	0.477	S	S	.	.	S	Bend	trans	-116.3	110.6	170.2	-60.2	173.4	0	0	0	107	L344 H345 P346 T350	L344-I348 HydrophobicContact CB-CB 4.2Å; L344-I348 HydrophobicContact CB-CD1 4.28Å; L344-I348 HydrophobicContact CD1-CG2 4.12Å; L344-I348 HydrophobicContact CD2-CD1 3.8Å; L344-I348 HydrophobicContact CD2-CG2 4.17Å; H345-I348 HydrophobicContact CB-CD1 4.07Å; H345-I348 HydrophobicContact CB-CG1 4.16Å; H345-I348 PolarHBondContact O-N 3.5Å; P346-I348 PolarHBondContact O-N 3.32Å; I348-T350 PolarHBondContact O-N 3.18Å
349	P	48.6	Very low	61.8	Low	64 Å²	64	81.7 Å²	81.7	42%	0.416	46%	0.462	S	S	.	.			trans	-71.2	106.8	-170.3	28.6	-34.8	0	0	0	111.2	L221 N351	L221-P349 HydrophobicContact CD2-CB 4.31Å; L221-P349 HydrophobicContact CD2-CG 4.42Å; P349-N351 VanDerWaalsContact C-N 3.34Å; P349-N351 PolarHBondContact O-N 3.25Å; P349-N351 VanDerWaalsContact O-N 3.15Å
350	T	56	Low	61.8	Low	43 Å²	43	76.9 Å²	76.9	26%	0.264	44%	0.44	S	S	.	.			trans	-83.9	74.1	172.7	46.2	0	0	0	0	110.4	L344 I348 N352 C353	L344-T350 HydrophobicContact CD1-CG2 3.56Å; I348-T350 PolarHBondContact O-N 3.18Å; T350-N352 PolarHBondContact O-N 3.27Å; T350-C353 PolarHBondContact O-N 2.93Å
351	N	48.2	Very low	61.7	Low	143 Å²	143	73.7 Å²	73.7	77%	0.765	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-21.5	-172	-77.2	1.3	0	0	0	116	P349	P349-N351 VanDerWaalsContact C-N 3.34Å; P349-N351 PolarHBondContact O-N 3.25Å; P349-N351 VanDerWaalsContact O-N 3.15Å
352	N	46.6	Very low	61.8	Low	157 Å²	157	72.9 Å²	72.9	84%	0.84	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.7	14.7	-177.5	-76.5	-30.4	0	0	0	115	T350	T350-N352 PolarHBondContact O-N 3.27Å
353	C	45	Very low	62.3	Low	76 Å²	76	71.7 Å²	71.7	51%	0.514	40%	0.403	S	S	.	.			trans	-122.7	125.6	179.4	-71.8	0	0	0	0	112.2	T350 S355	T350-C353 PolarHBondContact O-N 2.93Å; C353-S355 WeakPolarHBondContact CB-O 3.49Å; C353-S355 PolarHBondContact O-N 2.89Å
354	S	52.5	Low	62.9	Low	135 Å²	135	65.4 Å²	65.4	94%	0.944	38%	0.376	S	S	*	.	S	Bend	trans	-72.1	-13.9	174.1	49.8	0	0	0	0	113.6
355	S	60.5	Low	63.7	Low	55 Å²	55	64 Å²	64	39%	0.385	37%	0.368	S	S	.	.	S	Bend	trans	-110.4	136.9	167.9	61.1	0	0	0	0	110.6	C353 E357	C353-S355 WeakPolarHBondContact CB-O 3.49Å; C353-S355 PolarHBondContact O-N 2.89Å; S355-E357 PolarHBondContact O-N 3.4Å
356	N	61.3	Low	64.8	Low	57 Å²	57	61.5 Å²	61.5	31%	0.305	36%	0.355	S	S	.	.			trans	-73.8	8	165.6	-69.9	17	0	0	0	112	K343 L344	K343-N356 CarbonylContact C-O 3.55Å; K343-N356 WeakPolarHBondContact CA-O 3.37Å; L344-N356 HydrophobicContact CB-CB 4.48Å; L344-N356 PolarHBondContact N-O 2.96Å
357	E	68.2	Low	66.2	Low	78 Å²	78	58.2 Å²	58.2	36%	0.364	33%	0.331	S	S	.	.	B	Isolated β-bridge	trans	-85.9	124.6	-175.7	-70.6	175.2	-172.1	0	0	110.2	I342 K343 S355 P359	I342-E357 CarbonylContact O-C 3.58Å; I342-E357 VanDerWaalsContact O-CA 3.31Å; I342-E357 WeakPolarHBondContact O-CA 3.05Å; K343-E357 HydrophobicContact CD-CG 4.35Å; K343-E357 WeakPolarHBondContact CE-OE1 3.48Å; K343-E357 HydrophobicContact CG-CG 3.77Å; K343-E357 IonicContact NZ-OE1 2.9Å; K343-E357 PolarHBondContact NZ-OE1 3.41Å; S355-E357 PolarHBondContact O-N 3.4Å; E357-P359 WeakPolarHBondContact O-CD 3.38Å
358	L	69.2	Low	67.8	Low	30 Å²	30	57.1 Å²	57.1	16%	0.157	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-73.2	122.1	176.2	-133.4	82	0	0	0	109.5	F336 I342 L344 I360 L362 I363	F336-L358 WeakPolarHBondContact CE2-O 3.37Å; I342-L358 HydrophobicContact CB-CB 4.4Å; I342-L358 HydrophobicContact CG2-CB 4.34Å; I342-L358 PolarHBondContact O-N 2.97Å; L344-L358 HydrophobicContact CD1-CD1 3.67Å; L344-L358 HydrophobicContact CD2-CD1 3.59Å; L344-L358 HydrophobicContact CG-CD1 3.55Å; L358-I360 PolarHBondContact O-N 2.83Å; L358-L362 HydrophobicContact CG-CD2 4.38Å; L358-I363 HydrophobicContact CD2-CD1 4.21Å; L358-I363 HydrophobicContact CD2-CG1 3.82Å
359	P	75.4	Confident	69.4	Low	65 Å²	65	53.6 Å²	53.6	42%	0.422	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-62.1	134.8	175.6	-22.5	34	0	0	0	111	E357 D361 L362 I363	E357-P359 WeakPolarHBondContact O-CD 3.38Å; P359-D361 PolarHBondContact O-N 3.35Å; P359-L362 HydrophobicContact CB-CB 4.36Å; P359-L362 WeakPolarHBondContact O-CB 3.5Å; P359-L362 PolarHBondContact O-N 3.2Å; P359-I363 PolarHBondContact O-N 3.3Å
360	I	79.1	Confident	71.4	Confident	27 Å²	27	51.7 Å²	51.7	14%	0.138	29%	0.293	C	S	.	.	H	α-helix	trans	-58.6	-37.1	176.9	-164.3	177.8	0	0	0	111.5	F336 L337 L358 L362 I363 I364 F516	F336-I360 HydrophobicContact CD1-CB 4.01Å; F336-I360 HydrophobicContact CD1-CD1 3.58Å; F336-I360 HydrophobicContact CD1-CG1 3.81Å; F336-I360 HydrophobicContact CD2-CB 4.49Å; F336-I360 HydrophobicContact CE1-CB 3.72Å; F336-I360 HydrophobicContact CE1-CD1 3.77Å; F336-I360 HydrophobicContact CE1-CG1 4.01Å; F336-I360 HydrophobicContact CE1-CG2 4.46Å; F336-I360 HydrophobicContact CE2-CB 4.22Å; F336-I360 HydrophobicContact CG-CB 4.41Å; F336-I360 HydrophobicContact CG-CD1 4.42Å; F336-I360 HydrophobicContact CG-CG1 4.24Å; F336-I360 HydrophobicContact CZ-CB 3.84Å; L337-I360 HydrophobicContact CD2-CD1 4.37Å; L358-I360 PolarHBondContact O-N 2.83Å; I360-L362 PolarHBondContact O-N 3Å; I360-I363 WeakPolarHBondContact O-CB 3.43Å; I360-I363 PolarHBondContact O-N 3.02Å; I360-I364 HydrophobicContact CG1-CD1 4.26Å; I360-I364 HydrophobicContact CG1-CG1 4.41Å; I360-I364 VanDerWaalsContact O-CG1 3.28Å; I360-I364 WeakPolarHBondContact O-CG1 3.41Å; I360-I364 PolarHBondContact O-N 3.46Å; I360-F516 HydrophobicContact CD1-CD2 4.09Å; I360-F516 HydrophobicContact CD1-CE2 3.54Å; I360-F516 HydrophobicContact CD1-CZ 4.43Å; I360-F516 HydrophobicContact CG1-CE2 4.26Å
361	D	76.7	Confident	73	Confident	26 Å²	26	52.8 Å²	52.8	14%	0.139	30%	0.297	C	S	.	.	H	α-helix	trans	-58.6	-34	176.9	-71.2	-14.9	0	0	0	111.9	P359 N365 R519	P359-D361 PolarHBondContact O-N 3.35Å; D361-N365 WeakPolarHBondContact O-CB 3.44Å; D361-N365 PolarHBondContact O-N 3.07Å; D361-N365 PolarHBondContact O-ND2 2.83Å; D361-R519 IonicContact OD2-NH1 3.91Å; D361-R519 PolarHBondContact OD2-NH1 3.19Å
362	L	79	Confident	74.9	Confident	32 Å²	32	47.5 Å²	47.5	17%	0.168	27%	0.27	C	S	.	.	H	α-helix	trans	-68.2	-43.1	174.1	-175.3	63.3	0	0	0	111.5	L358 P359 I360 I364 N365 Y366 T498	L358-L362 HydrophobicContact CG-CD2 4.38Å; P359-L362 HydrophobicContact CB-CB 4.36Å; P359-L362 WeakPolarHBondContact O-CB 3.5Å; P359-L362 PolarHBondContact O-N 3.2Å; I360-L362 PolarHBondContact O-N 3Å; L362-I364 VanDerWaalsContact C-N 3.34Å; L362-I364 PolarHBondContact O-N 3.17Å; L362-N365 PolarHBondContact O-N 3.35Å; L362-Y366 HydrophobicContact CD1-CD2 3.99Å; L362-Y366 HydrophobicContact CD1-CE2 3.64Å; L362-Y366 HydrophobicContact CD2-CE2 4.36Å; L362-Y366 HydrophobicContact CG-CD2 3.94Å; L362-Y366 HydrophobicContact CG-CE2 3.82Å; L362-Y366 VanDerWaalsContact O-CD2 3.26Å; L362-Y366 WeakPolarHBondContact O-CD2 3.5Å; L362-Y366 PolarHBondContact O-N 3.17Å; L362-T498 HydrophobicContact CD1-CG2 4.37Å; L362-T498 WeakPolarHBondContact CD1-OG1 3.19Å
363	I	82.5	Confident	77	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-62.5	-42.8	176.7	-57.1	173.2	0	0	0	110.5	I329 M332 K333 F336 I342 L358 P359 I360 Y366 E367	I329-I363 HydrophobicContact CG2-CG2 4.12Å; M332-I363 HydrophobicContact CB-CD1 4.43Å; M332-I363 HydrophobicContact CB-CG2 4.22Å; K333-I363 HydrophobicContact CB-CG2 3.89Å; F336-I363 HydrophobicContact CB-CD1 4.19Å; F336-I363 HydrophobicContact CD2-CD1 4.04Å; F336-I363 HydrophobicContact CG-CD1 4.38Å; I342-I363 HydrophobicContact CD1-CD1 4.12Å; L358-I363 HydrophobicContact CD2-CD1 4.21Å; L358-I363 HydrophobicContact CD2-CG1 3.82Å; P359-I363 PolarHBondContact O-N 3.3Å; I360-I363 WeakPolarHBondContact O-CB 3.43Å; I360-I363 PolarHBondContact O-N 3.02Å; I363-Y366 PolarHBondContact O-N 2.82Å; I363-E367 PolarHBondContact O-N 3.49Å
364	I	83.3	Confident	79.2	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-46.6	175.4	-62.3	163.9	0	0	0	110.6	I360 L362 Y366 E367 I368 F516 V520 L523	I360-I364 HydrophobicContact CG1-CD1 4.26Å; I360-I364 HydrophobicContact CG1-CG1 4.41Å; I360-I364 VanDerWaalsContact O-CG1 3.28Å; I360-I364 WeakPolarHBondContact O-CG1 3.41Å; I360-I364 PolarHBondContact O-N 3.46Å; L362-I364 VanDerWaalsContact C-N 3.34Å; L362-I364 PolarHBondContact O-N 3.17Å; I364-Y366 VanDerWaalsContact C-N 3.33Å; I364-Y366 PolarHBondContact O-N 3.01Å; I364-E367 WeakPolarHBondContact O-CB 3.37Å; I364-E367 PolarHBondContact O-N 3.4Å; I364-I368 HydrophobicContact CG2-CD1 3.81Å; I364-I368 WeakPolarHBondContact O-CB 3.29Å; I364-I368 WeakPolarHBondContact O-CG1 2.93Å; I364-I368 PolarHBondContact O-N 3.32Å; I364-F516 HydrophobicContact CD1-CD2 3.99Å; I364-F516 HydrophobicContact CD1-CE2 3.38Å; I364-F516 HydrophobicContact CD1-CZ 4.16Å; I364-F516 HydrophobicContact CG1-CE2 4.17Å; I364-V520 HydrophobicContact CD1-CG2 4.15Å; I364-V520 HydrophobicContact CG2-CG2 4.23Å; I364-L523 HydrophobicContact CG2-CD1 4.33Å
365	N	82.7	Confident	80.9	Confident	16 Å²	16	35.5 Å²	35.5	9%	0.086	19%	0.187	C	C	.	.	H	α-helix	trans	-60	-42.4	178.5	-75.5	-21.1	0	0	0	111.6	D361 L362 I368 A369 C494 T498	D361-N365 WeakPolarHBondContact O-CB 3.44Å; D361-N365 PolarHBondContact O-N 3.07Å; D361-N365 PolarHBondContact O-ND2 2.83Å; L362-N365 PolarHBondContact O-N 3.35Å; N365-I368 WeakPolarHBondContact O-CB 3.31Å; N365-I368 PolarHBondContact O-N 3.44Å; N365-A369 PolarHBondContact O-N 2.84Å; N365-C494 VanDerWaalsContact C-SG 3.6Å; N365-C494 HydrophobicContact CB-CB 4.07Å; N365-C494 PolarHBondContact O-SG 3.43Å; N365-T498 PolarHBondContact ND2-OG1 3.17Å
366	Y	85.1	Confident	82.3	Confident	59 Å²	59	35.3 Å²	35.3	23%	0.231	18%	0.178	C	C	.	.	H	α-helix	trans	-64.5	-43.2	173.4	-87	-67.7	0	0	0	112.6	L362 I363 I364 I368 A369 F370 V491	L362-Y366 HydrophobicContact CD1-CD2 3.99Å; L362-Y366 HydrophobicContact CD1-CE2 3.64Å; L362-Y366 HydrophobicContact CD2-CE2 4.36Å; L362-Y366 HydrophobicContact CG-CD2 3.94Å; L362-Y366 HydrophobicContact CG-CE2 3.82Å; L362-Y366 VanDerWaalsContact O-CD2 3.26Å; L362-Y366 WeakPolarHBondContact O-CD2 3.5Å; L362-Y366 PolarHBondContact O-N 3.17Å; I363-Y366 PolarHBondContact O-N 2.82Å; I364-Y366 VanDerWaalsContact C-N 3.33Å; I364-Y366 PolarHBondContact O-N 3.01Å; Y366-I368 VanDerWaalsContact C-N 3.32Å; Y366-I368 PolarHBondContact O-N 2.96Å; Y366-A369 PolarHBondContact O-N 3.43Å; Y366-F370 HydrophobicContact CD1-CE2 4.39Å; Y366-F370 WeakPolarHBondContact O-CD2 3.44Å; Y366-F370 PolarHBondContact O-N 2.96Å; Y366-V491 HydrophobicContact CE1-CG1 4.03Å; Y366-V491 HydrophobicContact CE1-CG2 4.21Å
367	E	86.4	Confident	83.7	Confident	28 Å²	28	32.6 Å²	32.6	13%	0.131	16%	0.164	C	C	.	.	H	α-helix	trans	-56.4	-49.2	175.8	156.5	158	-102	0	0	111	K326 I329 K333 I363 I364 A369 F370 D371	K326-E367 WeakPolarHBondContact CE-O 3.42Å; K326-E367 IonicContact NZ-OE1 3.72Å; K326-E367 PolarHBondContact NZ-OE1 2.86Å; I329-E367 HydrophobicContact CG2-CB 3.85Å; K333-E367 WeakPolarHBondContact CD-OE2 3.49Å; K333-E367 WeakPolarHBondContact CE-OE2 3.22Å; K333-E367 IonicContact NZ-OE2 2.66Å; K333-E367 PolarHBondContact NZ-OE2 3.23Å; I363-E367 PolarHBondContact O-N 3.49Å; I364-E367 WeakPolarHBondContact O-CB 3.37Å; I364-E367 PolarHBondContact O-N 3.4Å; E367-A369 VanDerWaalsContact C-N 3.35Å; E367-A369 PolarHBondContact O-N 3.47Å; E367-F370 PolarHBondContact O-N 3.29Å; E367-D371 PolarHBondContact O-N 2.91Å
368	I	84.8	Confident	84.8	Confident	26 Å²	26	31.3 Å²	31.3	13%	0.133	16%	0.159	C	C	.	.	H	α-helix	trans	-55.5	-44.9	175.3	-86.6	166.7	0	0	0	112.6	I364 N365 Y366 T372 L523 L527	I364-I368 HydrophobicContact CG2-CD1 3.81Å; I364-I368 WeakPolarHBondContact O-CB 3.29Å; I364-I368 WeakPolarHBondContact O-CG1 2.93Å; I364-I368 PolarHBondContact O-N 3.32Å; N365-I368 WeakPolarHBondContact O-CB 3.31Å; N365-I368 PolarHBondContact O-N 3.44Å; Y366-I368 VanDerWaalsContact C-N 3.32Å; Y366-I368 PolarHBondContact O-N 2.96Å; I368-T372 WeakPolarHBondContact O-CB 3.37Å; I368-T372 PolarHBondContact O-N 3.49Å; I368-T372 PolarHBondContact O-OG1 2.8Å; I368-L523 HydrophobicContact CD1-CB 3.74Å; I368-L523 HydrophobicContact CD1-CD1 3.96Å; I368-L523 HydrophobicContact CD1-CG 4.32Å; I368-L527 HydrophobicContact CB-CD1 4.03Å; I368-L527 HydrophobicContact CD1-CD1 3.96Å; I368-L527 HydrophobicContact CG1-CD1 3.7Å; I368-L527 HydrophobicContact CG2-CD1 3.34Å; I368-L527 HydrophobicContact CG2-CD2 3.63Å; I368-L527 HydrophobicContact CG2-CG 4.06Å
369	A	86.7	Confident	85.7	Confident	4 Å²	4	33.1 Å²	33.1	3%	0.033	17%	0.169	C	C	.	.	H	α-helix	trans	-66	-42.7	179.1	0	0	0	0	0	111.3	N365 Y366 E367 T372 L373 L490 C494	N365-A369 PolarHBondContact O-N 2.84Å; Y366-A369 PolarHBondContact O-N 3.43Å; E367-A369 VanDerWaalsContact C-N 3.35Å; E367-A369 PolarHBondContact O-N 3.47Å; A369-T372 PolarHBondContact O-N 2.97Å; A369-L373 VanDerWaalsContact O-CB 3.31Å; A369-L373 WeakPolarHBondContact O-CB 3.45Å; A369-L373 PolarHBondContact O-N 3.3Å; A369-L490 HydrophobicContact CB-CB 3.99Å; A369-C494 WeakPolarHBondContact CB-SG 3.49Å
370	F	90.1	Very high	86.3	Confident	23 Å²	23	32.8 Å²	32.8	10%	0.101	16%	0.163	C	C	.	.	H	α-helix	trans	-71.3	-35.5	177.9	-85.1	-92.4	0	0	0	112.8	I322 H325 K326 I329 Y366 E367 T372 L373 I374	I322-F370 HydrophobicContact CG2-CD1 4.21Å; H325-F370 HydrophobicContact CB-CD1 3.87Å; H325-F370 HydrophobicContact CB-CE1 3.27Å; H325-F370 HydrophobicContact CB-CZ 3.67Å; K326-F370 HydrophobicContact CB-CB 4.16Å; K326-F370 HydrophobicContact CD-CB 3.81Å; K326-F370 HydrophobicContact CG-CB 4.49Å; I329-F370 HydrophobicContact CD1-CB 4.31Å; I329-F370 HydrophobicContact CD1-CD2 3.25Å; I329-F370 HydrophobicContact CD1-CE2 3.62Å; I329-F370 HydrophobicContact CD1-CG 3.81Å; I329-F370 HydrophobicContact CD1-CZ 4.46Å; Y366-F370 HydrophobicContact CD1-CE2 4.39Å; Y366-F370 WeakPolarHBondContact O-CD2 3.44Å; Y366-F370 PolarHBondContact O-N 2.96Å; E367-F370 PolarHBondContact O-N 3.29Å; F370-T372 VanDerWaalsContact C-N 3.34Å; F370-T372 PolarHBondContact O-N 3.24Å; F370-L373 HydrophobicContact CD1-CD2 4.31Å; F370-L373 HydrophobicContact CE1-CD2 4.25Å; F370-L373 PolarHBondContact O-N 3.09Å; F370-I374 WeakPolarHBondContact O-CB 3.26Å; F370-I374 WeakPolarHBondContact O-CD1 3.44Å; F370-I374 WeakPolarHBondContact O-CG1 3.48Å; F370-I374 PolarHBondContact O-N 3Å
371	D	89.2	Confident	86.9	Confident	66 Å²	66	31.8 Å²	31.8	35%	0.353	16%	0.158	S	C	.	.	H	α-helix	trans	-60.2	-44.6	168.9	-78.9	-40.2	0	0	0	111.2	K326 E367 L373 I374 H375	K326-D371 WeakPolarHBondContact CE-OD1 3.4Å; K326-D371 WeakPolarHBondContact CE-OD2 3.38Å; K326-D371 IonicContact NZ-OD1 2.79Å; K326-D371 IonicContact NZ-OD2 3.21Å; K326-D371 PolarHBondContact NZ-OD2 3.48Å; E367-D371 PolarHBondContact O-N 2.91Å; D371-L373 VanDerWaalsContact C-N 3.33Å; D371-L373 PolarHBondContact O-N 3.41Å; D371-I374 PolarHBondContact O-N 3.26Å; D371-H375 PolarHBondContact O-CD2 3.16Å; D371-H375 PolarHBondContact O-N 3.46Å
372	T	88.6	Confident	87.5	Confident	32 Å²	32	33.6 Å²	33.6	20%	0.196	17%	0.166	C	C	.	.	H	α-helix	trans	-63.8	-38.4	176.6	-56.6	0	0	0	0	112	I368 A369 F370 Y376 L490	I368-T372 WeakPolarHBondContact O-CB 3.37Å; I368-T372 PolarHBondContact O-N 3.49Å; I368-T372 PolarHBondContact O-OG1 2.8Å; A369-T372 PolarHBondContact O-N 2.97Å; F370-T372 VanDerWaalsContact C-N 3.34Å; F370-T372 PolarHBondContact O-N 3.24Å; T372-Y376 PolarHBondContact O-N 3.44Å; T372-L490 HydrophobicContact CG2-CD1 4.13Å; T372-L490 HydrophobicContact CG2-CD2 3.97Å
373	L	90	Very high	88.1	Confident	5 Å²	5	39.2 Å²	39.2	3%	0.026	19%	0.185	C	C	.	.	H	α-helix	trans	-69.6	-38.1	176.4	-177.1	61.6	0	0	0	112	I322 A369 F370 D371 Y376 M377 L483 A487 L490	I322-L373 HydrophobicContact CD1-CD2 4.16Å; I322-L373 HydrophobicContact CD1-CG 4.21Å; I322-L373 HydrophobicContact CG1-CD2 4.14Å; I322-L373 HydrophobicContact CG2-CD2 4.04Å; I322-L373 HydrophobicContact CG2-CG 4.17Å; A369-L373 VanDerWaalsContact O-CB 3.31Å; A369-L373 WeakPolarHBondContact O-CB 3.45Å; A369-L373 PolarHBondContact O-N 3.3Å; F370-L373 HydrophobicContact CD1-CD2 4.31Å; F370-L373 HydrophobicContact CE1-CD2 4.25Å; F370-L373 PolarHBondContact O-N 3.09Å; D371-L373 VanDerWaalsContact C-N 3.33Å; D371-L373 PolarHBondContact O-N 3.41Å; L373-Y376 PolarHBondContact O-N 3.29Å; L373-M377 VanDerWaalsContact O-CB 3.22Å; L373-M377 WeakPolarHBondContact O-CB 3.44Å; L373-M377 PolarHBondContact O-N 3.33Å; L373-L483 HydrophobicContact CD1-CD1 3.75Å; L373-A487 HydrophobicContact CD1-CB 3.85Å; L373-A487 HydrophobicContact CD2-CB 3.55Å; L373-A487 HydrophobicContact CG-CB 4.37Å; L373-L490 HydrophobicContact CB-CD1 4.02Å; L373-L490 HydrophobicContact CD1-CD1 4.48Å
374	I	91.2	Very high	88.5	Confident	27 Å²	27	43.5 Å²	43.5	14%	0.138	20%	0.203	C	C	.	.	H	α-helix	trans	-63.5	-44.4	174.3	-72	161.5	0	0	0	110.3	I322 L323 K326 F370 D371 M377 D378	I322-I374 HydrophobicContact CG2-CG1 3.7Å; L323-I374 HydrophobicContact CD2-CD1 3.86Å; L323-I374 HydrophobicContact CD2-CG1 4.24Å; K326-I374 HydrophobicContact CB-CD1 3.87Å; K326-I374 HydrophobicContact CG-CD1 3.88Å; F370-I374 WeakPolarHBondContact O-CB 3.26Å; F370-I374 WeakPolarHBondContact O-CD1 3.44Å; F370-I374 WeakPolarHBondContact O-CG1 3.48Å; F370-I374 PolarHBondContact O-N 3Å; D371-I374 PolarHBondContact O-N 3.26Å; I374-M377 HydrophobicContact CB-CE 4.47Å; I374-M377 HydrophobicContact CG1-CE 4.35Å; I374-M377 HydrophobicContact CG2-CE 4.25Å; I374-M377 WeakPolarHBondContact O-CB 3.41Å; I374-M377 PolarHBondContact O-N 3.38Å; I374-D378 PolarHBondContact O-N 3.21Å
375	H	89.5	Confident	88.9	Confident	84 Å²	84	43.4 Å²	43.4	39%	0.389	20%	0.203	S	C	.	.	H	α-helix	trans	-58.9	-49.4	171.8	-79.4	-67.5	0	0	0	112.2	D371 M377 D378 D379 K531	D371-H375 PolarHBondContact O-CD2 3.16Å; D371-H375 PolarHBondContact O-N 3.46Å; H375-M377 VanDerWaalsContact C-N 3.25Å; H375-M377 PolarHBondContact O-N 3.31Å; H375-D378 PolarHBondContact O-N 2.89Å; H375-D379 IonicContact ND1-OD2 3.64Å; H375-D379 VanDerWaalsContact O-CB 3.25Å; H375-D379 WeakPolarHBondContact O-CB 3.26Å; H375-D379 PolarHBondContact O-N 2.98Å; H375-K531 PolarHBondContact CD2-NZ 3.31Å; H375-K531 PolarHBondContact NE2-NZ 3.12Å
376	Y	89.4	Confident	89.3	Confident	52 Å²	52	45.2 Å²	45.2	20%	0.204	22%	0.217	C	C	.	.	I	π-helix	trans	-59.2	-39.7	176.9	-175.8	-83.2	0	0	0	111.8	T372 L373 I380 Y381 L483 Q486	T372-Y376 PolarHBondContact O-N 3.44Å; L373-Y376 PolarHBondContact O-N 3.29Å; Y376-I380 HydrophobicContact CD2-CB 4.35Å; Y376-I380 HydrophobicContact CD2-CD1 3.58Å; Y376-I380 HydrophobicContact CE2-CB 4.31Å; Y376-I380 HydrophobicContact CE2-CD1 3.8Å; Y376-I380 HydrophobicContact CE2-CG2 4.08Å; Y376-I380 HydrophobicContact CG-CD1 4.36Å; Y376-I380 WeakPolarHBondContact O-CA 3.25Å; Y376-I380 VanDerWaalsContact O-CB 3.32Å; Y376-I380 WeakPolarHBondContact O-CB 3.49Å; Y376-I380 PolarHBondContact O-N 3.04Å; Y376-I380 VanDerWaalsContact O-N 3.07Å; Y376-Y381 PolarHBondContact O-N 3.09Å; Y376-L483 HydrophobicContact CD1-CD1 3.64Å; Y376-L483 HydrophobicContact CE1-CB 4.39Å; Y376-L483 HydrophobicContact CE1-CD1 4.09Å; Y376-Q486 HydrophobicContact CD1-CB 4.45Å; Y376-Q486 HydrophobicContact CD1-CG 4.35Å; Y376-Q486 HydrophobicContact CD2-CG 4.13Å; Y376-Q486 HydrophobicContact CE1-CB 4.45Å; Y376-Q486 HydrophobicContact CE1-CG 4.01Å; Y376-Q486 HydrophobicContact CE2-CG 3.76Å; Y376-Q486 HydrophobicContact CG-CG 4.42Å
377	M	91.3	Very high	89.5	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.223	C	C	.	.	I	π-helix	trans	-62.9	-54.6	177.8	176	-173.7	67.4	0	0	111.7	R319 I322 L373 I374 H375 Y381 M382 L483	R319-M377 VanDerWaalsContact CA-SD 3.55Å; R319-M377 HydrophobicContact CB-CE 4.29Å; R319-M377 HydrophobicContact CB-SD 3.8Å; R319-M377 HydrophobicContact CG-CE 3.62Å; R319-M377 HydrophobicContact CG-SD 3.83Å; I322-M377 HydrophobicContact CB-SD 4.27Å; I322-M377 HydrophobicContact CD1-CG 4.49Å; I322-M377 HydrophobicContact CD1-SD 3.73Å; I322-M377 HydrophobicContact CG2-SD 4.47Å; L373-M377 VanDerWaalsContact O-CB 3.22Å; L373-M377 WeakPolarHBondContact O-CB 3.44Å; L373-M377 PolarHBondContact O-N 3.33Å; I374-M377 HydrophobicContact CB-CE 4.47Å; I374-M377 HydrophobicContact CG1-CE 4.35Å; I374-M377 HydrophobicContact CG2-CE 4.25Å; I374-M377 WeakPolarHBondContact O-CB 3.41Å; I374-M377 PolarHBondContact O-N 3.38Å; H375-M377 VanDerWaalsContact C-N 3.25Å; H375-M377 PolarHBondContact O-N 3.31Å; M377-Y381 HydrophobicContact CG-CD1 4.33Å; M377-Y381 WeakPolarHBondContact O-CB 3.35Å; M377-Y381 PolarHBondContact O-N 3.38Å; M377-M382 HydrophobicContact CG-CG 4.49Å; M377-M382 WeakPolarHBondContact O-CB 3.35Å; M377-M382 WeakPolarHBondContact O-CG 3.37Å; M377-M382 PolarHBondContact O-N 3.13Å; M377-L483 HydrophobicContact CB-CD1 4.05Å; M377-L483 HydrophobicContact CG-CD2 4.48Å
378	D	89.7	Confident	89.6	Confident	51 Å²	51	46.1 Å²	46.1	27%	0.273	23%	0.231	S	C	.	.	I	π-helix	trans	-77.7	-40.5	-174.3	-73.4	-24	0	0	0	112.2	R319 I374 H375	R319-D378 IonicContact CZ-OD1 3.55Å; R319-D378 IonicContact CZ-OD2 2.67Å; R319-D378 IonicContact NE-OD1 3.58Å; R319-D378 PolarHBondContact NE-OD1 3.43Å; R319-D378 IonicContact NE-OD2 3.56Å; R319-D378 PolarHBondContact NE-OD2 3.5Å; R319-D378 IonicContact NH2-OD1 2.71Å; R319-D378 IonicContact NH2-OD2 3.05Å; R319-D378 PolarHBondContact NH2-OD2 2.96Å; I374-D378 PolarHBondContact O-N 3.21Å; H375-D378 PolarHBondContact O-N 2.89Å
379	D	88.5	Confident	89.8	Confident	68 Å²	68	44.9 Å²	44.9	36%	0.364	22%	0.224	S	C	.	.	I	π-helix	trans	-82.7	-30	-176.9	-73.9	-58.5	0	0	0	114.7	H375 R383	H375-D379 IonicContact ND1-OD2 3.64Å; H375-D379 VanDerWaalsContact O-CB 3.25Å; H375-D379 WeakPolarHBondContact O-CB 3.26Å; H375-D379 PolarHBondContact O-N 2.98Å; D379-R383 WeakPolarHBondContact O-CB 3.42Å; D379-R383 WeakPolarHBondContact O-CD 3.41Å; D379-R383 PolarHBondContact O-NE 3.45Å; D379-R383 VanDerWaalsContact O-NE 3.16Å; D379-R383 PolarHBondContact O-NH1 3.18Å; D379-R383 IonicContact OD1-CZ 2.8Å; D379-R383 IonicContact OD1-NH2 3.52Å; D379-R383 PolarHBondContact OD1-NH2 3.15Å
380	I	88.7	Confident	90	Very high	58 Å²	58	46.3 Å²	46.3	30%	0.297	23%	0.231	S	C	.	.	I	π-helix	trans	-114.7	-56.6	-173.4	-60.6	168.6	0	0	0	111.2	Y376 K384	Y376-I380 HydrophobicContact CD2-CB 4.35Å; Y376-I380 HydrophobicContact CD2-CD1 3.58Å; Y376-I380 HydrophobicContact CE2-CB 4.31Å; Y376-I380 HydrophobicContact CE2-CD1 3.8Å; Y376-I380 HydrophobicContact CE2-CG2 4.08Å; Y376-I380 HydrophobicContact CG-CD1 4.36Å; Y376-I380 WeakPolarHBondContact O-CA 3.25Å; Y376-I380 VanDerWaalsContact O-CB 3.32Å; Y376-I380 WeakPolarHBondContact O-CB 3.49Å; Y376-I380 PolarHBondContact O-N 3.04Å; Y376-I380 VanDerWaalsContact O-N 3.07Å; I380-K384 HydrophobicContact CG2-CD 4.24Å; I380-K384 VanDerWaalsContact O-CB 3.31Å; I380-K384 WeakPolarHBondContact O-CB 3.35Å; I380-K384 VanDerWaalsContact O-CG 3.3Å; I380-K384 WeakPolarHBondContact O-CG 3.08Å; I380-K384 PolarHBondContact O-N 3.02Å
381	Y	91.2	Very high	90	Very high	6 Å²	6	49.2 Å²	49.2	2%	0.024	25%	0.248	C	C	.	.	I	π-helix	trans	-67	-55.3	-176.8	166.1	-94.5	0	0	0	111.9	S315 Y376 M377 R383 K384 M385 L479 Q480 L483	S315-Y381 PolarHBondContact OG-OH 3.18Å; Y376-Y381 PolarHBondContact O-N 3.09Å; M377-Y381 HydrophobicContact CG-CD1 4.33Å; M377-Y381 WeakPolarHBondContact O-CB 3.35Å; M377-Y381 PolarHBondContact O-N 3.38Å; Y381-R383 VanDerWaalsContact C-N 3.34Å; Y381-R383 PolarHBondContact O-N 3.26Å; Y381-K384 PolarHBondContact O-N 3.15Å; Y381-M385 HydrophobicContact CD2-CE 4.41Å; Y381-M385 HydrophobicContact CE2-CE 3.52Å; Y381-M385 VanDerWaalsContact O-CB 3.26Å; Y381-M385 WeakPolarHBondContact O-CB 3.46Å; Y381-M385 PolarHBondContact O-N 3.45Å; Y381-L479 HydrophobicContact CD2-CB 3.97Å; Y381-L479 WeakPolarHBondContact CD2-O 3.16Å; Y381-L479 HydrophobicContact CE2-CB 4.05Å; Y381-Q480 HydrophobicContact CE2-CB 4.11Å; Y381-Q480 HydrophobicContact CE2-CG 4.5Å; Y381-L483 HydrophobicContact CD1-CD2 3.89Å; Y381-L483 HydrophobicContact CD2-CB 4.07Å; Y381-L483 HydrophobicContact CD2-CD2 3.97Å; Y381-L483 HydrophobicContact CE1-CD2 4.12Å; Y381-L483 HydrophobicContact CE2-CD2 4.19Å; Y381-L483 HydrophobicContact CG-CB 4.43Å; Y381-L483 HydrophobicContact CG-CD2 3.82Å
382	M	90.1	Very high	89.9	Confident	63 Å²	63	53.1 Å²	53.1	31%	0.31	26%	0.258	S	S	.	.	I	π-helix	trans	-64	-39.8	-179.7	-71.8	-58.9	-62	0	0	111.4	M377 M385 S386	M377-M382 HydrophobicContact CG-CG 4.49Å; M377-M382 WeakPolarHBondContact O-CB 3.35Å; M377-M382 WeakPolarHBondContact O-CG 3.37Å; M377-M382 PolarHBondContact O-N 3.13Å; M382-M385 PolarHBondContact O-N 2.87Å; M382-S386 VanDerWaalsContact O-CB 3.31Å; M382-S386 WeakPolarHBondContact O-CB 3.43Å; M382-S386 PolarHBondContact O-N 2.85Å
383	R	90.9	Very high	90	Very high	151 Å²	151	51.6 Å²	51.6	57%	0.57	25%	0.248	S	C	*	.	H	α-helix	trans	-59.5	-52.1	175.3	-169.2	177.1	-63.7	154.5	11.4	111.7	D379 Y381 S386 S387	D379-R383 WeakPolarHBondContact O-CB 3.42Å; D379-R383 WeakPolarHBondContact O-CD 3.41Å; D379-R383 PolarHBondContact O-NE 3.45Å; D379-R383 VanDerWaalsContact O-NE 3.16Å; D379-R383 PolarHBondContact O-NH1 3.18Å; D379-R383 IonicContact OD1-CZ 2.8Å; D379-R383 IonicContact OD1-NH2 3.52Å; D379-R383 PolarHBondContact OD1-NH2 3.15Å; Y381-R383 VanDerWaalsContact C-N 3.34Å; Y381-R383 PolarHBondContact O-N 3.26Å; R383-S386 PolarHBondContact O-N 2.86Å; R383-S387 WeakPolarHBondContact O-CB 3.42Å; R383-S387 PolarHBondContact O-N 2.75Å; R383-S387 PolarHBondContact O-OG 3.03Å
384	K	91.5	Very high	90	Very high	90 Å²	90	53.8 Å²	53.8	39%	0.391	26%	0.264	S	S	.	.	H	α-helix	trans	-67.2	-35.7	178.1	-72	-178.9	178.3	-176.5	0	112.8	I380 Y381 N388 L479	I380-K384 HydrophobicContact CG2-CD 4.24Å; I380-K384 VanDerWaalsContact O-CB 3.31Å; I380-K384 WeakPolarHBondContact O-CB 3.35Å; I380-K384 VanDerWaalsContact O-CG 3.3Å; I380-K384 WeakPolarHBondContact O-CG 3.08Å; I380-K384 PolarHBondContact O-N 3.02Å; Y381-K384 PolarHBondContact O-N 3.15Å; K384-N388 VanDerWaalsContact O-CB 3.25Å; K384-N388 WeakPolarHBondContact O-CB 3.47Å; K384-N388 PolarHBondContact O-N 2.96Å; K384-L479 HydrophobicContact CB-CD1 3.9Å; K384-L479 HydrophobicContact CB-CD2 3.73Å; K384-L479 HydrophobicContact CB-CG 4.5Å; K384-L479 HydrophobicContact CD-CD2 3.81Å; K384-L479 HydrophobicContact CG-CD2 4.43Å
385	M	91.6	Very high	89.8	Confident	3 Å²	3	56.9 Å²	56.9	2%	0.015	28%	0.278	C	S	.	.	H	α-helix	trans	-64	-44.5	175.6	-167.8	65.8	75.4	0	0	110.6	V311 Y381 M382 V389 L390 A476 L479	V311-M385 HydrophobicContact CG1-CE 4.41Å; V311-M385 HydrophobicContact CG1-CG 3.74Å; V311-M385 HydrophobicContact CG1-SD 3.43Å; V311-M385 WeakPolarHBondContact CG1-SD 3.47Å; Y381-M385 HydrophobicContact CD2-CE 4.41Å; Y381-M385 HydrophobicContact CE2-CE 3.52Å; Y381-M385 VanDerWaalsContact O-CB 3.26Å; Y381-M385 WeakPolarHBondContact O-CB 3.46Å; Y381-M385 PolarHBondContact O-N 3.45Å; M382-M385 PolarHBondContact O-N 2.87Å; M385-V389 WeakPolarHBondContact O-CA 3.09Å; M385-V389 VanDerWaalsContact O-CB 3.29Å; M385-V389 WeakPolarHBondContact O-CB 3.48Å; M385-V389 PolarHBondContact O-N 3.25Å; M385-V389 VanDerWaalsContact O-N 3.14Å; M385-V389 HydrophobicContact SD-CB 3.91Å; M385-V389 HydrophobicContact SD-CG1 4.26Å; M385-V389 HydrophobicContact SD-CG2 3.71Å; M385-L390 PolarHBondContact O-N 2.56Å; M385-A476 HydrophobicContact CE-CB 4.08Å; M385-A476 HydrophobicContact SD-CB 3.86Å; M385-L479 HydrophobicContact CB-CD1 4.15Å; M385-L479 HydrophobicContact CE-CB 4.03Å; M385-L479 HydrophobicContact CE-CD1 3.9Å; M385-L479 HydrophobicContact SD-CD1 4.06Å
386	S	91.2	Very high	89.8	Confident	53 Å²	53	53 Å²	53	37%	0.371	26%	0.26	S	S	.	.	I	π-helix	trans	-63.6	-54.2	175.4	-167.4	0	0	0	0	111.7	M382 R383 L390 N391	M382-S386 VanDerWaalsContact O-CB 3.31Å; M382-S386 WeakPolarHBondContact O-CB 3.43Å; M382-S386 PolarHBondContact O-N 2.85Å; R383-S386 PolarHBondContact O-N 2.86Å; S386-L390 PolarHBondContact O-N 3.29Å; S386-N391 WeakPolarHBondContact O-CB 3.21Å; S386-N391 VanDerWaalsContact O-CG 3.26Å; S386-N391 PolarHBondContact O-N 3.3Å; S386-N391 PolarHBondContact O-OD1 3.47Å
387	S	88.3	Confident	89.9	Confident	51 Å²	51	55 Å²	55	36%	0.357	27%	0.27	S	S	.	.	I	π-helix	trans	-70.5	-38.3	-173.2	68.9	0	0	0	0	114.3	R383	R383-S387 WeakPolarHBondContact O-CB 3.42Å; R383-S387 PolarHBondContact O-N 2.75Å; R383-S387 PolarHBondContact O-OG 3.03Å
388	N	88.2	Confident	89.8	Confident	56 Å²	56	60 Å²	60	30%	0.299	29%	0.291	S	S	.	.	I	π-helix	trans	-106.2	-18.1	-167.9	-57.3	-6.6	0	0	0	113	K384 R392 Y475	K384-N388 VanDerWaalsContact O-CB 3.25Å; K384-N388 WeakPolarHBondContact O-CB 3.47Å; K384-N388 PolarHBondContact O-N 2.96Å; N388-R392 VanDerWaalsContact O-CD 3.28Å; N388-R392 WeakPolarHBondContact O-CD 3.49Å; N388-R392 WeakPolarHBondContact O-CG 3.41Å; N388-Y475 HydrophobicContact CB-CD1 4.01Å; N388-Y475 HydrophobicContact CB-CE1 3.55Å; N388-Y475 PolarHBondContact ND2-OH 3.45Å
389	V	89.8	Confident	89.6	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.299	C	S	.	.	I	π-helix	trans	-112.8	-66.5	177.6	-173.4	0	0	0	0	110.1	V311 M385 N391 R392 L393 A472 Y475 A476	V311-V389 HydrophobicContact CG1-CG1 4.31Å; V311-V389 HydrophobicContact CG2-CG1 4.33Å; M385-V389 WeakPolarHBondContact O-CA 3.09Å; M385-V389 VanDerWaalsContact O-CB 3.29Å; M385-V389 WeakPolarHBondContact O-CB 3.48Å; M385-V389 PolarHBondContact O-N 3.25Å; M385-V389 VanDerWaalsContact O-N 3.14Å; M385-V389 HydrophobicContact SD-CB 3.91Å; M385-V389 HydrophobicContact SD-CG1 4.26Å; M385-V389 HydrophobicContact SD-CG2 3.71Å; V389-N391 PolarHBondContact O-N 2.93Å; V389-R392 PolarHBondContact O-N 3.28Å; V389-L393 HydrophobicContact CG1-CD1 4.06Å; V389-L393 WeakPolarHBondContact O-CG 3.29Å; V389-L393 PolarHBondContact O-N 2.98Å; V389-A472 HydrophobicContact CG1-CB 4.21Å; V389-Y475 HydrophobicContact CG2-CD1 3.82Å; V389-A476 HydrophobicContact CG1-CB 4.34Å; V389-A476 HydrophobicContact CG2-CB 4.28Å
390	L	91.5	Very high	89.5	Confident	33 Å²	33	58.5 Å²	58.5	17%	0.173	28%	0.283	C	S	.	.	I	π-helix	trans	-64.5	-42.9	-171.6	-60.2	177.6	0	0	0	112.7	Q308 V311 E312 M385 S386 R392 L393 S394	Q308-L390 HydrophobicContact CG-CD2 4.14Å; V311-L390 HydrophobicContact CB-CD2 4.35Å; V311-L390 HydrophobicContact CG1-CD2 3.88Å; E312-L390 HydrophobicContact CG-CD1 4.18Å; E312-L390 HydrophobicContact CG-CD2 3.94Å; M385-L390 PolarHBondContact O-N 2.56Å; S386-L390 PolarHBondContact O-N 3.29Å; L390-R392 PolarHBondContact O-N 3.13Å; L390-L393 PolarHBondContact O-N 3.46Å; L390-S394 WeakPolarHBondContact O-CB 3.41Å; L390-S394 PolarHBondContact O-N 3.42Å
391	N	89.3	Confident	89.4	Confident	85 Å²	85	58.8 Å²	58.8	46%	0.455	29%	0.285	S	S	.	.	H	α-helix	trans	-62.3	-42.7	174.5	-74	-2.7	0	0	0	111.8	S386 V389 L393 S394 E395	S386-N391 WeakPolarHBondContact O-CB 3.21Å; S386-N391 VanDerWaalsContact O-CG 3.26Å; S386-N391 PolarHBondContact O-N 3.3Å; S386-N391 PolarHBondContact O-OD1 3.47Å; V389-N391 PolarHBondContact O-N 2.93Å; N391-L393 VanDerWaalsContact C-N 3.34Å; N391-L393 PolarHBondContact O-N 2.83Å; N391-S394 WeakPolarHBondContact O-CB 3.27Å; N391-S394 PolarHBondContact O-N 3.45Å; N391-E395 WeakPolarHBondContact O-CG 3.47Å; N391-E395 PolarHBondContact O-N 2.89Å
392	R	87.4	Confident	88.9	Confident	148 Å²	148	62.9 Å²	62.9	56%	0.558	31%	0.306	S	S	*	.	H	α-helix	trans	-63.8	-38.7	177.4	-70.6	-164.8	176.1	-164	-4.3	112.3	N388 V389 L390 L396	N388-R392 VanDerWaalsContact O-CD 3.28Å; N388-R392 WeakPolarHBondContact O-CD 3.49Å; N388-R392 WeakPolarHBondContact O-CG 3.41Å; V389-R392 PolarHBondContact O-N 3.28Å; L390-R392 PolarHBondContact O-N 3.13Å; R392-L396 WeakPolarHBondContact O-CB 3.29Å; R392-L396 PolarHBondContact O-N 3.09Å
393	L	91.1	Very high	88.5	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-67.4	-37.8	173.6	-65.5	176	0	0	0	111.8	C304 L307 Q308 V389 L390 N391 L396 K397 L469 A472	C304-L393 PolarHBondContact SG-O 2.98Å; C304-L393 VanDerWaalsContact SG-O 3.4Å; L307-L393 HydrophobicContact CD2-CD1 4.18Å; L307-L393 HydrophobicContact CD2-CD2 4.01Å; L307-L393 HydrophobicContact CG-CD1 4.05Å; Q308-L393 HydrophobicContact CB-CD1 4.23Å; V389-L393 HydrophobicContact CG1-CD1 4.06Å; V389-L393 WeakPolarHBondContact O-CG 3.29Å; V389-L393 PolarHBondContact O-N 2.98Å; L390-L393 PolarHBondContact O-N 3.46Å; N391-L393 VanDerWaalsContact C-N 3.34Å; N391-L393 PolarHBondContact O-N 2.83Å; L393-L396 PolarHBondContact O-N 2.82Å; L393-K397 WeakPolarHBondContact O-CB 3.23Å; L393-K397 PolarHBondContact O-N 3.38Å; L393-L469 HydrophobicContact CD2-CD2 3.78Å; L393-A472 HydrophobicContact CD2-CB 4.14Å; L393-A472 HydrophobicContact CG-CB 4.48Å
394	S	89.9	Confident	88.2	Confident	50 Å²	50	55.4 Å²	55.4	35%	0.35	28%	0.277	S	S	.	.	H	α-helix	trans	-62.5	-48.4	174	-173.4	0	0	0	0	112.2	L390 N391 L396 K397 K398	L390-S394 WeakPolarHBondContact O-CB 3.41Å; L390-S394 PolarHBondContact O-N 3.42Å; N391-S394 WeakPolarHBondContact O-CB 3.27Å; N391-S394 PolarHBondContact O-N 3.45Å; S394-L396 PolarHBondContact O-N 3.09Å; S394-K397 WeakPolarHBondContact O-CB 3.3Å; S394-K397 PolarHBondContact O-N 3.28Å; S394-K398 WeakPolarHBondContact O-CG 3.3Å; S394-K398 PolarHBondContact O-N 2.92Å
395	E	87.7	Confident	87.7	Confident	93 Å²	93	60.1 Å²	60.1	44%	0.435	29%	0.293	S	S	.	.	H	α-helix	trans	-63.7	-40.8	175.7	-62	-42.3	124.8	0	0	111.8	N391 K397 K398 L399	N391-E395 WeakPolarHBondContact O-CG 3.47Å; N391-E395 PolarHBondContact O-N 2.89Å; E395-K397 VanDerWaalsContact C-N 3.31Å; E395-K397 PolarHBondContact O-N 3.45Å; E395-K398 WeakPolarHBondContact O-CB 3.25Å; E395-K398 PolarHBondContact O-N 3.35Å; E395-K398 VanDerWaalsContact O-N 3.13Å; E395-K398 WeakPolarHBondContact OE1-CE 3.42Å; E395-K398 IonicContact OE1-NZ 3.39Å; E395-K398 PolarHBondContact OE1-NZ 3.03Å; E395-K398 WeakPolarHBondContact OE2-CD 3.28Å; E395-K398 WeakPolarHBondContact OE2-CE 3.43Å; E395-K398 IonicContact OE2-NZ 2.66Å; E395-K398 PolarHBondContact OE2-NZ 3.23Å; E395-L399 WeakPolarHBondContact O-CG 3.24Å; E395-L399 PolarHBondContact O-N 2.99Å
396	L	89.3	Confident	87.1	Confident	3 Å²	3	62.9 Å²	62.9	2%	0.016	31%	0.307	C	S	.	.	H	α-helix	trans	-59.2	-42	173.3	175.4	58.3	0	0	0	111.7	I300 R392 L393 S394 K398 L399 I400 A465 I468 L469	I300-L396 HydrophobicContact CG2-CD2 4.41Å; R392-L396 WeakPolarHBondContact O-CB 3.29Å; R392-L396 PolarHBondContact O-N 3.09Å; L393-L396 PolarHBondContact O-N 2.82Å; S394-L396 PolarHBondContact O-N 3.09Å; L396-K398 VanDerWaalsContact C-N 3.33Å; L396-K398 PolarHBondContact O-N 3Å; L396-L399 PolarHBondContact O-N 3.32Å; L396-I400 HydrophobicContact CD1-CD1 4.02Å; L396-I400 HydrophobicContact CD1-CG1 4.24Å; L396-I400 HydrophobicContact CG-CD1 3.85Å; L396-I400 WeakPolarHBondContact O-CB 3.17Å; L396-I400 WeakPolarHBondContact O-CD1 3.47Å; L396-I400 VanDerWaalsContact O-CG1 3.27Å; L396-I400 WeakPolarHBondContact O-CG1 3.24Å; L396-I400 PolarHBondContact O-N 2.92Å; L396-A465 HydrophobicContact CD1-CB 3.52Å; L396-A465 HydrophobicContact CD2-CB 4.36Å; L396-I468 HydrophobicContact CD2-CB 4.28Å; L396-I468 HydrophobicContact CD2-CG2 3.93Å; L396-L469 HydrophobicContact CD2-CD2 4.03Å; L396-L469 HydrophobicContact CD2-CG 4.01Å
397	K	90.5	Very high	86.4	Confident	93 Å²	93	60.3 Å²	60.3	40%	0.404	29%	0.289	S	S	.	.	H	α-helix	trans	-62.4	-36.8	175.2	-172.4	178.9	-178	178.5	0	112.3	L393 S394 E395 N401	L393-K397 WeakPolarHBondContact O-CB 3.23Å; L393-K397 PolarHBondContact O-N 3.38Å; S394-K397 WeakPolarHBondContact O-CB 3.3Å; S394-K397 PolarHBondContact O-N 3.28Å; E395-K397 VanDerWaalsContact C-N 3.31Å; E395-K397 PolarHBondContact O-N 3.45Å; K397-N401 VanDerWaalsContact O-CG 3.32Å; K397-N401 PolarHBondContact O-N 3.35Å; K397-N401 VanDerWaalsContact O-N 3.1Å; K397-N401 PolarHBondContact O-ND2 2.73Å
398	K	88.8	Confident	85.8	Confident	106 Å²	106	61.1 Å²	61.1	46%	0.461	29%	0.289	S	S	.	.	H	α-helix	trans	-64.6	-46.5	172.6	-64.3	179	-158.5	162.9	0	111.7	S394 E395 L396 I400 N401 I402	S394-K398 WeakPolarHBondContact O-CG 3.3Å; S394-K398 PolarHBondContact O-N 2.92Å; E395-K398 WeakPolarHBondContact O-CB 3.25Å; E395-K398 PolarHBondContact O-N 3.35Å; E395-K398 VanDerWaalsContact O-N 3.13Å; E395-K398 WeakPolarHBondContact OE1-CE 3.42Å; E395-K398 IonicContact OE1-NZ 3.39Å; E395-K398 PolarHBondContact OE1-NZ 3.03Å; E395-K398 WeakPolarHBondContact OE2-CD 3.28Å; E395-K398 WeakPolarHBondContact OE2-CE 3.43Å; E395-K398 IonicContact OE2-NZ 2.66Å; E395-K398 PolarHBondContact OE2-NZ 3.23Å; L396-K398 VanDerWaalsContact C-N 3.33Å; L396-K398 PolarHBondContact O-N 3Å; K398-I400 PolarHBondContact O-N 3.11Å; K398-N401 PolarHBondContact O-N 3.23Å; K398-I402 WeakPolarHBondContact O-CG1 3.47Å; K398-I402 PolarHBondContact O-N 3.21Å
399	L	86.3	Confident	85.3	Confident	84 Å²	84	64 Å²	64	44%	0.44	30%	0.299	S	S	.	.	H	α-helix	trans	-60.1	-45.4	178	-68.7	172.2	0	0	0	112	E395 L396 N401 I402 S403 L461	E395-L399 WeakPolarHBondContact O-CG 3.24Å; E395-L399 PolarHBondContact O-N 2.99Å; L396-L399 PolarHBondContact O-N 3.32Å; L399-N401 VanDerWaalsContact C-N 3.34Å; L399-N401 PolarHBondContact O-N 2.92Å; L399-I402 WeakPolarHBondContact O-CB 3.38Å; L399-I402 PolarHBondContact O-N 2.9Å; L399-S403 PolarHBondContact O-N 3.15Å; L399-S403 PolarHBondContact O-OG 3.34Å; L399-L461 HydrophobicContact CB-CD1 4.15Å; L399-L461 HydrophobicContact CD1-CD1 4.47Å
400	I	85.8	Confident	84.6	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.01	30%	0.3	C	S	.	.	H	α-helix	trans	-54.1	-48.6	173.1	-75.8	164	0	0	0	111.3	I297 I300 E301 L396 K398 I402 S403 K404	I297-I400 HydrophobicContact CG2-CG2 3.85Å; I300-I400 HydrophobicContact CB-CD1 4.29Å; I300-I400 HydrophobicContact CG2-CD1 3.51Å; I300-I400 HydrophobicContact CG2-CG1 4.24Å; E301-I400 HydrophobicContact CB-CG2 3.89Å; E301-I400 HydrophobicContact CG-CG2 4.15Å; L396-I400 HydrophobicContact CD1-CD1 4.02Å; L396-I400 HydrophobicContact CD1-CG1 4.24Å; L396-I400 HydrophobicContact CG-CD1 3.85Å; L396-I400 WeakPolarHBondContact O-CB 3.17Å; L396-I400 WeakPolarHBondContact O-CD1 3.47Å; L396-I400 VanDerWaalsContact O-CG1 3.27Å; L396-I400 WeakPolarHBondContact O-CG1 3.24Å; L396-I400 PolarHBondContact O-N 2.92Å; K398-I400 PolarHBondContact O-N 3.11Å; I400-I402 VanDerWaalsContact C-N 3.33Å; I400-I402 PolarHBondContact O-N 2.88Å; I400-S403 PolarHBondContact O-N 2.88Å; I400-K404 HydrophobicContact CG2-CD 4.14Å; I400-K404 WeakPolarHBondContact O-CG 3.26Å; I400-K404 PolarHBondContact O-N 2.84Å
401	N	86.4	Confident	83.7	Confident	65 Å²	65	64.9 Å²	64.9	35%	0.348	30%	0.304	S	S	.	.	H	α-helix	trans	-63.8	-35.8	179.2	-76.2	-24.2	0	0	0	113	K397 K398 L399 R405	K397-N401 VanDerWaalsContact O-CG 3.32Å; K397-N401 PolarHBondContact O-N 3.35Å; K397-N401 VanDerWaalsContact O-N 3.1Å; K397-N401 PolarHBondContact O-ND2 2.73Å; K398-N401 PolarHBondContact O-N 3.23Å; L399-N401 VanDerWaalsContact C-N 3.34Å; L399-N401 PolarHBondContact O-N 2.92Å; N401-R405 WeakPolarHBondContact O-CG 3.25Å; N401-R405 PolarHBondContact O-N 3.25Å; N401-R405 VanDerWaalsContact O-N 3.13Å
402	I	80.8	Confident	82.8	Confident	92 Å²	92	65.2 Å²	65.2	47%	0.472	31%	0.306	S	S	.	.	H	α-helix	trans	-63.6	-46.8	173.9	-67.7	164.4	0	0	0	109.9	K398 L399 I400 K404 R405 L406	K398-I402 WeakPolarHBondContact O-CG1 3.47Å; K398-I402 PolarHBondContact O-N 3.21Å; L399-I402 WeakPolarHBondContact O-CB 3.38Å; L399-I402 PolarHBondContact O-N 2.9Å; I400-I402 VanDerWaalsContact C-N 3.33Å; I400-I402 PolarHBondContact O-N 2.88Å; I402-K404 PolarHBondContact O-N 2.73Å; I402-R405 PolarHBondContact O-N 3.38Å; I402-L406 HydrophobicContact CG2-CD1 4.13Å; I402-L406 WeakPolarHBondContact O-CG 3.35Å; I402-L406 PolarHBondContact O-N 3.46Å
403	S	83.1	Confident	82.2	Confident	8 Å²	8	58.8 Å²	58.8	6%	0.056	28%	0.283	C	S	.	.	H	α-helix	trans	-67.6	-35.3	180	-63.1	0	0	0	0	113.7	L399 I400 L406 L407 L461	L399-S403 PolarHBondContact O-N 3.15Å; L399-S403 PolarHBondContact O-OG 3.34Å; I400-S403 PolarHBondContact O-N 2.88Å; S403-L406 PolarHBondContact O-N 2.88Å; S403-L407 PolarHBondContact O-N 3.26Å; S403-L461 WeakPolarHBondContact OG-CD2 3.43Å
404	K	83.4	Confident	81.4	Confident	49 Å²	49	61.3 Å²	61.3	21%	0.213	30%	0.295	C	S	.	.	H	α-helix	trans	-59	-50.3	170.4	-69.4	175.5	68.6	173.9	0	110.7	I297 N298 E301 I400 I402 L406 L407 D408	I297-K404 HydrophobicContact CG2-CD 4.05Å; I297-K404 HydrophobicContact CG2-CG 3.58Å; N298-K404 WeakPolarHBondContact OD1-CE 3.43Å; E301-K404 IonicContact OE1-NZ 3.11Å; E301-K404 PolarHBondContact OE1-NZ 3.18Å; E301-K404 IonicContact OE2-NZ 2.68Å; E301-K404 PolarHBondContact OE2-NZ 3.41Å; I400-K404 HydrophobicContact CG2-CD 4.14Å; I400-K404 WeakPolarHBondContact O-CG 3.26Å; I400-K404 PolarHBondContact O-N 2.84Å; I402-K404 PolarHBondContact O-N 2.73Å; K404-L406 VanDerWaalsContact C-N 3.29Å; K404-L406 PolarHBondContact O-N 2.86Å; K404-L407 WeakPolarHBondContact O-CB 3.4Å; K404-L407 PolarHBondContact O-N 3.32Å; K404-L407 VanDerWaalsContact O-N 3.15Å; K404-D408 PolarHBondContact O-N 2.69Å
405	R	81.3	Confident	80.2	Confident	189 Å²	189	63.3 Å²	63.3	71%	0.713	30%	0.301	S	S	*	.	H	α-helix	trans	-58.9	-35.3	176.5	-72.1	173.8	176.9	-174.4	-1.5	113.7	N401 I402 K409	N401-R405 WeakPolarHBondContact O-CG 3.25Å; N401-R405 PolarHBondContact O-N 3.25Å; N401-R405 VanDerWaalsContact O-N 3.13Å; I402-R405 PolarHBondContact O-N 3.38Å; R405-K409 WeakPolarHBondContact O-CB 3.41Å; R405-K409 PolarHBondContact O-N 2.83Å
406	L	78.4	Confident	79.3	Confident	60 Å²	60	62.5 Å²	62.5	31%	0.314	30%	0.299	S	S	.	.	H	α-helix	trans	-72.3	-38.7	176.7	-69.1	171.8	0	0	0	112.3	I402 S403 K404 K409 Y410 L450 L454	I402-L406 HydrophobicContact CG2-CD1 4.13Å; I402-L406 WeakPolarHBondContact O-CG 3.35Å; I402-L406 PolarHBondContact O-N 3.46Å; S403-L406 PolarHBondContact O-N 2.88Å; K404-L406 VanDerWaalsContact C-N 3.29Å; K404-L406 PolarHBondContact O-N 2.86Å; L406-K409 PolarHBondContact O-N 3.4Å; L406-Y410 PolarHBondContact O-N 3.42Å; L406-L450 HydrophobicContact CD2-CD2 4.43Å; L406-L454 HydrophobicContact CB-CD2 3.72Å
407	L	77.3	Confident	78.4	Confident	0 Å²	0	63 Å²	63	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-63	-45.3	170.8	-78.1	161.6	0	0	0	111.2	F290 R294 I297 S403 K404 K409 Y410 D411 L454 L458	F290-L407 HydrophobicContact CB-CD2 4.25Å; R294-L407 HydrophobicContact CB-CD1 3.93Å; R294-L407 HydrophobicContact CG-CD1 4.2Å; I297-L407 HydrophobicContact CD1-CD1 3.98Å; S403-L407 PolarHBondContact O-N 3.26Å; K404-L407 WeakPolarHBondContact O-CB 3.4Å; K404-L407 PolarHBondContact O-N 3.32Å; K404-L407 VanDerWaalsContact O-N 3.15Å; L407-K409 VanDerWaalsContact C-N 3.29Å; L407-K409 PolarHBondContact O-N 2.97Å; L407-Y410 WeakPolarHBondContact O-CB 3.47Å; L407-Y410 PolarHBondContact O-N 2.72Å; L407-Y410 VanDerWaalsContact O-N 3.13Å; L407-D411 PolarHBondContact O-N 2.74Å; L407-L454 HydrophobicContact CD2-CD1 4.27Å; L407-L458 HydrophobicContact CD1-CD2 4.36Å; L407-L458 HydrophobicContact CD2-CD1 3.99Å; L407-L458 HydrophobicContact CG-CD1 4.4Å
408	D	76.3	Confident	77.3	Confident	67 Å²	67	62.5 Å²	62.5	36%	0.358	31%	0.307	S	S	.	.	H	α-helix	trans	-62.3	-38.2	176.2	-55.6	-26.2	0	0	0	110.8	R294 K404 N412	R294-D408 IonicContact CZ-OD1 2.74Å; R294-D408 IonicContact NH2-OD1 2.69Å; R294-D408 PolarHBondContact NH2-OD1 3.16Å; K404-D408 PolarHBondContact O-N 2.69Å; D408-N412 WeakPolarHBondContact O-CB 3.31Å; D408-N412 PolarHBondContact O-N 3.06Å; D408-N412 PolarHBondContact O-ND2 2.67Å
409	K	76.9	Confident	76.2	Confident	118 Å²	118	61.8 Å²	61.8	51%	0.513	31%	0.308	S	S	.	.	H	α-helix	trans	-65.6	-37.1	174.4	-171.4	-179.5	176.8	-175.8	0	112.3	R405 L406 L407 T413 L450	R405-K409 WeakPolarHBondContact O-CB 3.41Å; R405-K409 PolarHBondContact O-N 2.83Å; L406-K409 PolarHBondContact O-N 3.4Å; L407-K409 VanDerWaalsContact C-N 3.29Å; L407-K409 PolarHBondContact O-N 2.97Å; K409-T413 WeakPolarHBondContact O-CB 3.41Å; K409-T413 PolarHBondContact O-N 3.48Å; K409-T413 PolarHBondContact O-OG1 2.61Å; K409-L450 HydrophobicContact CD-CD1 4.12Å; K409-L450 HydrophobicContact CD-CD2 4.12Å; K409-L450 HydrophobicContact CG-CD1 3.92Å
410	Y	75.9	Confident	75.6	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.008	29%	0.292	C	S	.	.	H	α-helix	trans	-62.5	-53.9	175.4	173.6	-89.4	0	0	0	110.9	Q287 F290 L406 L407 N412 T413 E414 L447 L450 Q451 L454	Q287-Y410 PolarHBondContact OE1-OH 2.89Å; F290-Y410 HydrophobicContact CD2-CD1 4.25Å; F290-Y410 AromaticContact CD2-CE1 3.75Å; F290-Y410 HydrophobicContact CD2-CE1 3.75Å; F290-Y410 HydrophobicContact CD2-CE2 4.34Å; F290-Y410 AromaticContact CD2-CZ 3.79Å; F290-Y410 HydrophobicContact CE2-CD1 4.42Å; F290-Y410 HydrophobicContact CE2-CD2 4.2Å; F290-Y410 AromaticContact CE2-CE1 3.94Å; F290-Y410 HydrophobicContact CE2-CE1 3.94Å; F290-Y410 AromaticContact CE2-CE2 3.68Å; F290-Y410 HydrophobicContact CE2-CE2 3.68Å; F290-Y410 AromaticContact CE2-CZ 3.53Å; L406-Y410 PolarHBondContact O-N 3.42Å; L407-Y410 WeakPolarHBondContact O-CB 3.47Å; L407-Y410 PolarHBondContact O-N 2.72Å; L407-Y410 VanDerWaalsContact O-N 3.13Å; Y410-N412 VanDerWaalsContact C-N 3.33Å; Y410-N412 PolarHBondContact O-N 3.16Å; Y410-T413 PolarHBondContact O-N 3Å; Y410-E414 PolarHBondContact O-N 3.29Å; Y410-L447 HydrophobicContact CD2-CD1 3.56Å; Y410-L447 HydrophobicContact CD2-CG 4.38Å; Y410-L447 HydrophobicContact CE2-CD1 3.51Å; Y410-L447 HydrophobicContact CE2-CG 3.99Å; Y410-L447 HydrophobicContact CG-CD1 4.21Å; Y410-L450 HydrophobicContact CD2-CB 4.34Å; Y410-Q451 HydrophobicContact CE2-CB 3.95Å; Y410-Q451 HydrophobicContact CE2-CG 4.25Å; Y410-L454 HydrophobicContact CD2-CD1 4.32Å; Y410-L454 HydrophobicContact CG-CD1 4.12Å
411	D	71.9	Confident	75	Confident	49 Å²	49	61.8 Å²	61.8	26%	0.262	31%	0.306	S	S	.	.	H	α-helix	trans	-58.4	-43.3	179.1	-60.6	-14.6	0	0	0	112.2	R294 L407 T413 E414 L415	R294-D411 IonicContact CZ-OD2 2.61Å; R294-D411 IonicContact NH1-OD1 3.02Å; R294-D411 PolarHBondContact NH1-OD1 2.92Å; R294-D411 IonicContact NH1-OD2 3Å; R294-D411 PolarHBondContact NH1-OD2 3.4Å; R294-D411 IonicContact NH2-OD2 2.72Å; R294-D411 PolarHBondContact NH2-OD2 3.42Å; L407-D411 PolarHBondContact O-N 2.74Å; D411-T413 VanDerWaalsContact C-N 3.29Å; D411-T413 PolarHBondContact O-N 2.72Å; D411-E414 PolarHBondContact O-N 2.99Å; D411-L415 WeakPolarHBondContact O-CB 3.47Å; D411-L415 PolarHBondContact O-N 3.34Å
412	N	70.8	Confident	74.3	Confident	91 Å²	91	61 Å²	61	49%	0.487	31%	0.308	S	S	.	.	H	α-helix	trans	-65	-33.5	178.1	-78.7	-61.7	0	0	0	111.9	D408 Y410 N416	D408-N412 WeakPolarHBondContact O-CB 3.31Å; D408-N412 PolarHBondContact O-N 3.06Å; D408-N412 PolarHBondContact O-ND2 2.67Å; Y410-N412 VanDerWaalsContact C-N 3.33Å; Y410-N412 PolarHBondContact O-N 3.16Å; N412-N416 VanDerWaalsContact O-CB 3.3Å; N412-N416 WeakPolarHBondContact O-CB 3.47Å; N412-N416 PolarHBondContact O-N 2.9Å; N412-N416 PolarHBondContact O-ND2 3.24Å; N412-N416 VanDerWaalsContact O-ND2 3.15Å
413	T	74.7	Confident	74	Confident	13 Å²	13	59.4 Å²	59.4	8%	0.08	31%	0.305	C	S	.	.	H	α-helix	trans	-71.9	-40.9	175.9	-52.2	0	0	0	0	110.9	K409 Y410 D411 N416 I417 N443 N446 L447	K409-T413 WeakPolarHBondContact O-CB 3.41Å; K409-T413 PolarHBondContact O-N 3.48Å; K409-T413 PolarHBondContact O-OG1 2.61Å; Y410-T413 PolarHBondContact O-N 3Å; D411-T413 VanDerWaalsContact C-N 3.29Å; D411-T413 PolarHBondContact O-N 2.72Å; T413-N416 PolarHBondContact O-N 2.91Å; T413-I417 HydrophobicContact CG2-CD1 4.47Å; T413-I417 WeakPolarHBondContact O-CD1 3.38Å; T413-I417 WeakPolarHBondContact O-CG1 3.46Å; T413-I417 PolarHBondContact O-N 3.12Å; T413-I417 VanDerWaalsContact O-N 3.13Å; T413-N443 HydrophobicContact CG2-CB 4.32Å; T413-N443 WeakPolarHBondContact CG2-O 3.35Å; T413-N446 HydrophobicContact CG2-CB 4.43Å; T413-L447 HydrophobicContact CG2-CB 3.98Å; T413-L447 HydrophobicContact CG2-CD1 4.12Å
414	E	73.4	Confident	73.7	Confident	54 Å²	54	60.9 Å²	60.9	25%	0.252	31%	0.312	S	S	.	.	H	α-helix	trans	-61.5	-48.2	173.7	-174.3	173.1	-146.2	0	0	111.2	Q287 Y410 D411 N416 I417 V418 L447	Q287-E414 PolarHBondContact NE2-OE2 3.49Å; Y410-E414 PolarHBondContact O-N 3.29Å; D411-E414 PolarHBondContact O-N 2.99Å; E414-N416 PolarHBondContact O-N 3.39Å; E414-I417 PolarHBondContact O-N 3.46Å; E414-V418 PolarHBondContact O-N 3.05Å; E414-V418 VanDerWaalsContact O-N 3.14Å; E414-L447 HydrophobicContact CB-CD1 4.13Å
415	L	65.4	Low	73.3	Confident	91 Å²	91	66.7 Å²	66.7	48%	0.476	34%	0.337	S	S	.	.	H	α-helix	trans	-60.5	-43.1	176.3	-179.6	61.4	0	0	0	112.2	D411 I417 V418 L419	D411-L415 WeakPolarHBondContact O-CB 3.47Å; D411-L415 PolarHBondContact O-N 3.34Å; L415-I417 VanDerWaalsContact C-N 3.32Å; L415-I417 PolarHBondContact O-N 3.32Å; L415-V418 PolarHBondContact O-N 3.32Å; L415-L419 HydrophobicContact CD1-CD1 4.24Å; L415-L419 HydrophobicContact CD1-CG 4.18Å; L415-L419 HydrophobicContact CG-CD1 3.97Å; L415-L419 HydrophobicContact CG-CG 4.34Å; L415-L419 WeakPolarHBondContact O-CB 3.16Å; L415-L419 WeakPolarHBondContact O-CG 3.47Å; L415-L419 PolarHBondContact O-N 3.29Å
416	N	68.2	Low	73	Confident	76 Å²	76	64.2 Å²	64.2	41%	0.406	34%	0.338	S	S	.	.	H	α-helix	trans	-59.9	-40.5	176.3	-77.7	-22.9	0	0	0	112	N412 T413 E414 L419 M420	N412-N416 VanDerWaalsContact O-CB 3.3Å; N412-N416 WeakPolarHBondContact O-CB 3.47Å; N412-N416 PolarHBondContact O-N 2.9Å; N412-N416 PolarHBondContact O-ND2 3.24Å; N412-N416 VanDerWaalsContact O-ND2 3.15Å; T413-N416 PolarHBondContact O-N 2.91Å; E414-N416 PolarHBondContact O-N 3.39Å; N416-L419 PolarHBondContact O-N 3.15Å; N416-M420 WeakPolarHBondContact O-CB 3.36Å; N416-M420 WeakPolarHBondContact O-CG 3.43Å; N416-M420 PolarHBondContact O-N 3.09Å
417	I	71	Confident	72.9	Confident	14 Å²	14	65.6 Å²	65.6	7%	0.072	34%	0.342	C	S	.	.	H	α-helix	trans	-62.2	-46.5	175.9	-67.5	159	0	0	0	110.5	T413 E414 L415 L419 M420 E421 R440 N443 I444 L447	T413-I417 HydrophobicContact CG2-CD1 4.47Å; T413-I417 WeakPolarHBondContact O-CD1 3.38Å; T413-I417 WeakPolarHBondContact O-CG1 3.46Å; T413-I417 PolarHBondContact O-N 3.12Å; T413-I417 VanDerWaalsContact O-N 3.13Å; E414-I417 PolarHBondContact O-N 3.46Å; L415-I417 VanDerWaalsContact C-N 3.32Å; L415-I417 PolarHBondContact O-N 3.32Å; I417-L419 PolarHBondContact O-N 2.91Å; I417-M420 PolarHBondContact O-N 3.3Å; I417-E421 WeakPolarHBondContact O-CG 3.4Å; I417-E421 PolarHBondContact O-N 2.9Å; I417-R440 HydrophobicContact CG2-CG 4.4Å; I417-N443 HydrophobicContact CD1-CB 4.1Å; I417-N443 HydrophobicContact CG1-CB 3.66Å; I417-I444 HydrophobicContact CD1-CG1 3.9Å; I417-I444 HydrophobicContact CG1-CG1 4.36Å; I417-L447 HydrophobicContact CD1-CB 4.19Å; I417-L447 HydrophobicContact CD1-CD2 3.87Å
418	V	67.8	Low	73	Confident	82 Å²	82	75.4 Å²	75.4	50%	0.497	39%	0.385	S	S	.	.	H	α-helix	trans	-62.3	-43.4	178.5	174.9	0	0	0	0	111.8	E414 L415 E421 A422	E414-V418 PolarHBondContact O-N 3.05Å; E414-V418 VanDerWaalsContact O-N 3.14Å; L415-V418 PolarHBondContact O-N 3.32Å; V418-E421 PolarHBondContact O-N 3.45Å; V418-A422 WeakPolarHBondContact O-CB 3.44Å; V418-A422 PolarHBondContact O-N 2.89Å
419	L	65.3	Low	73.4	Confident	92 Å²	92	76.6 Å²	76.6	48%	0.482	39%	0.391	S	S	.	.	H	α-helix	trans	-64.5	-42.2	177.1	-70.7	174.1	0	0	0	111.6	L415 N416 I417 A422 S423	L415-L419 HydrophobicContact CD1-CD1 4.24Å; L415-L419 HydrophobicContact CD1-CG 4.18Å; L415-L419 HydrophobicContact CG-CD1 3.97Å; L415-L419 HydrophobicContact CG-CG 4.34Å; L415-L419 WeakPolarHBondContact O-CB 3.16Å; L415-L419 WeakPolarHBondContact O-CG 3.47Å; L415-L419 PolarHBondContact O-N 3.29Å; N416-L419 PolarHBondContact O-N 3.15Å; I417-L419 PolarHBondContact O-N 2.91Å; L419-A422 PolarHBondContact O-N 3.41Å; L419-S423 WeakPolarHBondContact O-CB 3.44Å; L419-S423 PolarHBondContact O-N 2.98Å; L419-S423 PolarHBondContact O-OG 2.77Å; L419-S423 VanDerWaalsContact O-OG 3.07Å
420	M	72.9	Confident	73.7	Confident	21 Å²	21	76.4 Å²	76.4	10%	0.103	40%	0.4	C	S	.	.	H	α-helix	trans	-64.1	-42.3	175.6	-71.3	179	80.7	0	0	112.1	N416 I417 A422 S423 M424 M436 Q439 R440 N443	N416-M420 WeakPolarHBondContact O-CB 3.36Å; N416-M420 WeakPolarHBondContact O-CG 3.43Å; N416-M420 PolarHBondContact O-N 3.09Å; I417-M420 PolarHBondContact O-N 3.3Å; M420-A422 VanDerWaalsContact C-N 3.31Å; M420-A422 PolarHBondContact O-N 3.43Å; M420-S423 PolarHBondContact O-N 3.21Å; M420-M424 WeakPolarHBondContact O-CB 3.21Å; M420-M424 VanDerWaalsContact O-CG 3.23Å; M420-M424 WeakPolarHBondContact O-CG 3.38Å; M420-M424 PolarHBondContact O-N 3.49Å; M420-M436 HydrophobicContact CE-CB 4.16Å; M420-M436 HydrophobicContact CE-CG 4.47Å; M420-M436 WeakPolarHBondContact CE-O 3.37Å; M420-Q439 HydrophobicContact CE-CB 3.63Å; M420-Q439 HydrophobicContact CE-CG 3.58Å; M420-Q439 HydrophobicContact SD-CG 4.14Å; M420-R440 HydrophobicContact CE-CB 4.28Å; M420-N443 PolarHBondContact SD-ND2 3.13Å; M420-N443 VanDerWaalsContact SD-ND2 3.36Å
421	E	74	Confident	74	Confident	65 Å²	65	82 Å²	82	30%	0.304	43%	0.426	S	S	.	.	H	α-helix	trans	-62	-36.9	174.5	-74.7	-179.4	-175.3	0	0	112.8	I417 V418 K425 R440	I417-E421 WeakPolarHBondContact O-CG 3.4Å; I417-E421 PolarHBondContact O-N 2.9Å; V418-E421 PolarHBondContact O-N 3.45Å; E421-K425 WeakPolarHBondContact O-CG 3.09Å; E421-K425 PolarHBondContact O-N 2.94Å; E421-R440 VanDerWaalsContact CG-NE 3.34Å; E421-R440 IonicContact OE1-CZ 3.83Å; E421-R440 IonicContact OE1-NE 2.69Å; E421-R440 PolarHBondContact OE1-NE 2.84Å; E421-R440 IonicContact OE1-NH2 3.19Å; E421-R440 PolarHBondContact OE1-NH2 3.15Å
422	A	71.3	Confident	74.6	Confident	48 Å²	48	80.8 Å²	80.8	40%	0.397	42%	0.423	S	S	.	.	H	α-helix	trans	-69.2	-41.1	173.5	0	0	0	0	0	112.1	V418 L419 M420 N426	V418-A422 WeakPolarHBondContact O-CB 3.44Å; V418-A422 PolarHBondContact O-N 2.89Å; L419-A422 PolarHBondContact O-N 3.41Å; M420-A422 VanDerWaalsContact C-N 3.31Å; M420-A422 PolarHBondContact O-N 3.43Å; A422-N426 PolarHBondContact O-ND2 2.97Å
423	S	73.9	Confident	75.2	Confident	59 Å²	59	78.2 Å²	78.2	41%	0.413	41%	0.411	S	S	.	.	H	α-helix	trans	-64	-45.9	176.2	-65.3	0	0	0	0	112	L419 M420 K425 N426 H427	L419-S423 WeakPolarHBondContact O-CB 3.44Å; L419-S423 PolarHBondContact O-N 2.98Å; L419-S423 PolarHBondContact O-OG 2.77Å; L419-S423 VanDerWaalsContact O-OG 3.07Å; M420-S423 PolarHBondContact O-N 3.21Å; S423-K425 VanDerWaalsContact C-N 3.31Å; S423-K425 PolarHBondContact O-N 3.42Å; S423-N426 PolarHBondContact O-N 3.24Å; S423-N426 VanDerWaalsContact O-N 3.09Å; S423-H427 PolarHBondContact O-N 3.41Å
424	M	76.9	Confident	75.8	Confident	39 Å²	39	81 Å²	81	19%	0.192	43%	0.427	C	S	.	.	H	α-helix	trans	-58.3	-39.2	179.9	-74.3	170.3	68.1	0	0	112.8	M420 N426 H427 V433 M436 Q437	M420-M424 WeakPolarHBondContact O-CB 3.21Å; M420-M424 VanDerWaalsContact O-CG 3.23Å; M420-M424 WeakPolarHBondContact O-CG 3.38Å; M420-M424 PolarHBondContact O-N 3.49Å; M424-N426 PolarHBondContact O-N 2.95Å; M424-H427 PolarHBondContact O-N 2.94Å; M424-V433 HydrophobicContact CE-CG1 4.14Å; M424-M436 HydrophobicContact CG-CB 3.83Å; M424-M436 HydrophobicContact CG-CE 4.04Å; M424-M436 HydrophobicContact CG-SD 4.23Å; M424-M436 HydrophobicContact SD-CB 4.24Å; M424-Q437 HydrophobicContact CE-CB 4.04Å
425	K	76.2	Confident	76.4	Confident	170 Å²	170	82.5 Å²	82.5	74%	0.739	44%	0.437	S	S	*	.	H	α-helix	trans	-62.1	-24.2	177.9	-73.4	168.9	-175.3	171.9	0	113.8	E421 S423	E421-K425 WeakPolarHBondContact O-CG 3.09Å; E421-K425 PolarHBondContact O-N 2.94Å; S423-K425 VanDerWaalsContact C-N 3.31Å; S423-K425 PolarHBondContact O-N 3.42Å
426	N	74.7	Confident	77.3	Confident	137 Å²	137	79.6 Å²	79.6	73%	0.733	42%	0.421	S	S	*	.	H	α-helix	trans	-106.8	-3.6	-175.1	-65.8	-41.1	0	0	0	113.5	A422 S423 M424	A422-N426 PolarHBondContact O-ND2 2.97Å; S423-N426 PolarHBondContact O-N 3.24Å; S423-N426 VanDerWaalsContact O-N 3.09Å; M424-N426 PolarHBondContact O-N 2.95Å
427	H	77	Confident	78.1	Confident	89 Å²	89	78.8 Å²	78.8	41%	0.412	42%	0.415	S	S	.	.			trans	-93.9	120.7	-168.1	-146.3	-90.6	0	0	0	112.9	S423 M424 A432 V433 M436	S423-H427 PolarHBondContact O-N 3.41Å; M424-H427 PolarHBondContact O-N 2.94Å; H427-A432 WeakPolarHBondContact CE1-CB 3.28Å; H427-V433 HydrophobicContact CB-CG2 3.85Å; H427-M436 HydrophobicContact CB-CE 3.77Å
428	K	78.1	Confident	78.9	Confident	207 Å²	207	82.7 Å²	82.7	90%	0.9	44%	0.436	S	S	*	.			trans	-80.5	-21.9	-177.2	-63.4	-177	-179.9	-179.8	0	114.6
429	N	85.2	Confident	79.7	Confident	91 Å²	91	84 Å²	84	49%	0.487	44%	0.436	S	S	.	.			trans	-86.3	112.8	-178.4	179.5	-25.4	0	0	0	110.6	Q431 A432 V433	N429-Q431 PolarHBondContact O-N 2.99Å; N429-Q431 PolarHBondContact OD1-N 3.1Å; N429-A432 HydrophobicContact CB-CB 4.05Å; N429-A432 PolarHBondContact O-N 2.99Å; N429-A432 PolarHBondContact OD1-N 3.4Å; N429-V433 WeakPolarHBondContact O-CG2 3.39Å; N429-V433 PolarHBondContact O-N 2.73Å; N429-V433 VanDerWaalsContact O-N 3.07Å
430	V	82.5	Confident	80.7	Confident	114 Å²	114	82.2 Å²	82.2	69%	0.691	42%	0.423	S	S	*	.	H	α-helix	trans	-58.8	-44.2	-178.5	-179.3	0	0	0	0	112.5	A432 V433 V434	V430-A432 VanDerWaalsContact C-N 3.31Å; V430-A432 PolarHBondContact O-N 3.12Å; V430-V433 WeakPolarHBondContact O-CB 3.37Å; V430-V433 PolarHBondContact O-N 3.27Å; V430-V433 VanDerWaalsContact O-N 3.11Å; V430-V434 WeakPolarHBondContact O-CG2 3.38Å; V430-V434 PolarHBondContact O-N 3.49Å
431	Q	83.4	Confident	81.4	Confident	119 Å²	119	84.7 Å²	84.7	56%	0.556	44%	0.435	S	S	*	.	H	α-helix	trans	-64.1	-38.3	-179.9	-173.6	61.5	53.5	0	0	111.6	N429 V433 V434 N435	N429-Q431 PolarHBondContact O-N 2.99Å; N429-Q431 PolarHBondContact OD1-N 3.1Å; Q431-V433 VanDerWaalsContact C-N 3.35Å; Q431-V434 PolarHBondContact O-N 3Å; Q431-N435 PolarHBondContact NE2-OD1 3.17Å; Q431-N435 VanDerWaalsContact O-CG 3.25Å; Q431-N435 PolarHBondContact O-N 3.27Å; Q431-N435 PolarHBondContact O-OD1 3.01Å
432	A	83.1	Confident	82	Confident	25 Å²	25	85.2 Å²	85.2	21%	0.207	44%	0.439	C	S	.	.	H	α-helix	trans	-66.7	-36.3	174.5	0	0	0	0	0	112	H427 N429 V430 N435 M436	H427-A432 WeakPolarHBondContact CE1-CB 3.28Å; N429-A432 HydrophobicContact CB-CB 4.05Å; N429-A432 PolarHBondContact O-N 2.99Å; N429-A432 PolarHBondContact OD1-N 3.4Å; V430-A432 VanDerWaalsContact C-N 3.31Å; V430-A432 PolarHBondContact O-N 3.12Å; A432-N435 PolarHBondContact O-N 2.81Å; A432-M436 WeakPolarHBondContact O-CB 3.22Å; A432-M436 WeakPolarHBondContact O-CE 3.19Å; A432-M436 WeakPolarHBondContact O-CG 3.44Å; A432-M436 PolarHBondContact O-N 2.96Å
433	V	84.2	Confident	82.4	Confident	37 Å²	37	84 Å²	84	22%	0.224	43%	0.426	C	S	.	.	H	α-helix	trans	-64.6	-41.7	173.5	174.7	0	0	0	0	111.6	M424 H427 N429 V430 Q431 M436 Q437	M424-V433 HydrophobicContact CE-CG1 4.14Å; H427-V433 HydrophobicContact CB-CG2 3.85Å; N429-V433 WeakPolarHBondContact O-CG2 3.39Å; N429-V433 PolarHBondContact O-N 2.73Å; N429-V433 VanDerWaalsContact O-N 3.07Å; V430-V433 WeakPolarHBondContact O-CB 3.37Å; V430-V433 PolarHBondContact O-N 3.27Å; V430-V433 VanDerWaalsContact O-N 3.11Å; Q431-V433 VanDerWaalsContact C-N 3.35Å; V433-M436 HydrophobicContact CG2-CE 4.14Å; V433-M436 PolarHBondContact O-N 3.37Å; V433-Q437 WeakPolarHBondContact O-CB 3.14Å; V433-Q437 PolarHBondContact O-N 3.26Å
434	V	86.7	Confident	82.9	Confident	70 Å²	70	84.4 Å²	84.4	42%	0.424	42%	0.423	S	S	.	.	H	α-helix	trans	-61.9	-45.1	174.8	173.2	0	0	0	0	111.3	V430 Q431 M436 Q437 L438	V430-V434 WeakPolarHBondContact O-CG2 3.38Å; V430-V434 PolarHBondContact O-N 3.49Å; Q431-V434 PolarHBondContact O-N 3Å; V434-M436 PolarHBondContact O-N 2.95Å; V434-Q437 PolarHBondContact O-N 3.02Å; V434-L438 PolarHBondContact O-N 3.48Å; V434-L438 VanDerWaalsContact O-N 3.08Å
435	N	85.7	Confident	83.4	Confident	86 Å²	86	88.7 Å²	88.7	46%	0.46	44%	0.437	S	S	.	.	H	α-helix	trans	-63.6	-41.9	177.2	-66.4	4.4	0	0	0	111.8	Q431 A432 Q437 L438 Q439	Q431-N435 PolarHBondContact NE2-OD1 3.17Å; Q431-N435 VanDerWaalsContact O-CG 3.25Å; Q431-N435 PolarHBondContact O-N 3.27Å; Q431-N435 PolarHBondContact O-OD1 3.01Å; A432-N435 PolarHBondContact O-N 2.81Å; N435-Q437 VanDerWaalsContact C-N 3.34Å; N435-L438 PolarHBondContact O-N 3.31Å; N435-Q439 PolarHBondContact O-N 3.21Å; N435-Q439 VanDerWaalsContact O-N 3.15Å
436	M	84.3	Confident	83.8	Confident	30 Å²	30	84.5 Å²	84.5	15%	0.148	42%	0.423	C	S	.	.	H	α-helix	trans	-64.1	-36.6	174.2	-74.7	-173.8	-69.6	0	0	112.3	M420 M424 H427 A432 V433 V434 R440	M420-M436 HydrophobicContact CE-CB 4.16Å; M420-M436 HydrophobicContact CE-CG 4.47Å; M420-M436 WeakPolarHBondContact CE-O 3.37Å; M424-M436 HydrophobicContact CG-CB 3.83Å; M424-M436 HydrophobicContact CG-CE 4.04Å; M424-M436 HydrophobicContact CG-SD 4.23Å; M424-M436 HydrophobicContact SD-CB 4.24Å; H427-M436 HydrophobicContact CB-CE 3.77Å; A432-M436 WeakPolarHBondContact O-CB 3.22Å; A432-M436 WeakPolarHBondContact O-CE 3.19Å; A432-M436 WeakPolarHBondContact O-CG 3.44Å; A432-M436 PolarHBondContact O-N 2.96Å; V433-M436 HydrophobicContact CG2-CE 4.14Å; V433-M436 PolarHBondContact O-N 3.37Å; V434-M436 PolarHBondContact O-N 2.95Å; M436-R440 VanDerWaalsContact O-CB 3.27Å; M436-R440 WeakPolarHBondContact O-CB 3.43Å; M436-R440 PolarHBondContact O-N 3.49Å
437	Q	86.5	Confident	84.1	Confident	60 Å²	60	79.2 Å²	79.2	28%	0.28	39%	0.394	S	S	.	.	H	α-helix	trans	-63.9	-45.5	176.2	176.1	61.8	21.3	0	0	111.7	M424 V433 V434 N435 R440 E441	M424-Q437 HydrophobicContact CE-CB 4.04Å; V433-Q437 WeakPolarHBondContact O-CB 3.14Å; V433-Q437 PolarHBondContact O-N 3.26Å; V434-Q437 PolarHBondContact O-N 3.02Å; N435-Q437 VanDerWaalsContact C-N 3.34Å; Q437-R440 WeakPolarHBondContact O-CB 3.3Å; Q437-R440 PolarHBondContact O-N 2.84Å; Q437-E441 PolarHBondContact NE2-OE1 3.49Å; Q437-E441 WeakPolarHBondContact O-CG 3.4Å; Q437-E441 PolarHBondContact O-N 3.41Å
438	L	87.6	Confident	84.4	Confident	96 Å²	96	78 Å²	78	50%	0.503	40%	0.396	S	S	.	.	H	α-helix	trans	-59.8	-48.2	176.7	-70.9	170.7	0	0	0	111.6	V434 N435 R440 E441 D442	V434-L438 PolarHBondContact O-N 3.48Å; V434-L438 VanDerWaalsContact O-N 3.08Å; N435-L438 PolarHBondContact O-N 3.31Å; L438-R440 VanDerWaalsContact C-N 3.29Å; L438-R440 PolarHBondContact O-N 2.92Å; L438-E441 WeakPolarHBondContact O-CB 3Å; L438-E441 PolarHBondContact O-N 2.87Å; L438-E441 VanDerWaalsContact O-N 3.14Å; L438-D442 PolarHBondContact O-N 3.12Å
439	Q	84.8	Confident	84.7	Confident	108 Å²	108	72.8 Å²	72.8	51%	0.505	38%	0.382	S	S	.	.	H	α-helix	trans	-66.1	-30.5	177.6	178	-174.5	7.4	0	0	112.4	M420 N435 D442 N443	M420-Q439 HydrophobicContact CE-CB 3.63Å; M420-Q439 HydrophobicContact CE-CG 3.58Å; M420-Q439 HydrophobicContact SD-CG 4.14Å; N435-Q439 PolarHBondContact O-N 3.21Å; N435-Q439 VanDerWaalsContact O-N 3.15Å; Q439-D442 PolarHBondContact O-N 3.44Å; Q439-N443 WeakPolarHBondContact O-CB 3.21Å; Q439-N443 PolarHBondContact O-N 3.36Å; Q439-N443 PolarHBondContact O-ND2 2.84Å
440	R	85.1	Confident	84.4	Confident	56 Å²	56	69.6 Å²	69.6	21%	0.211	36%	0.364	C	S	.	.	H	α-helix	trans	-65.4	-41.3	171.8	177.5	-178.5	169	-82	-2.3	111.1	I417 M420 E421 M436 Q437 L438 N443 I444	I417-R440 HydrophobicContact CG2-CG 4.4Å; M420-R440 HydrophobicContact CE-CB 4.28Å; E421-R440 VanDerWaalsContact CG-NE 3.34Å; E421-R440 IonicContact OE1-CZ 3.83Å; E421-R440 IonicContact OE1-NE 2.69Å; E421-R440 PolarHBondContact OE1-NE 2.84Å; E421-R440 IonicContact OE1-NH2 3.19Å; E421-R440 PolarHBondContact OE1-NH2 3.15Å; M436-R440 VanDerWaalsContact O-CB 3.27Å; M436-R440 WeakPolarHBondContact O-CB 3.43Å; M436-R440 PolarHBondContact O-N 3.49Å; Q437-R440 WeakPolarHBondContact O-CB 3.3Å; Q437-R440 PolarHBondContact O-N 2.84Å; L438-R440 VanDerWaalsContact C-N 3.29Å; L438-R440 PolarHBondContact O-N 2.92Å; R440-N443 PolarHBondContact O-N 3.48Å; R440-I444 HydrophobicContact CG-CD1 4.02Å; R440-I444 VanDerWaalsContact O-CG1 3.3Å; R440-I444 WeakPolarHBondContact O-CG1 3.19Å; R440-I444 PolarHBondContact O-N 2.78Å
441	E	87.2	Confident	84.3	Confident	73 Å²	73	66.5 Å²	66.5	34%	0.341	34%	0.342	S	S	.	.	H	α-helix	trans	-65.8	-39.3	176.2	-71.2	173	-163	0	0	112.4	Q437 L438 I444 R445	Q437-E441 PolarHBondContact NE2-OE1 3.49Å; Q437-E441 WeakPolarHBondContact O-CG 3.4Å; Q437-E441 PolarHBondContact O-N 3.41Å; L438-E441 WeakPolarHBondContact O-CB 3Å; L438-E441 PolarHBondContact O-N 2.87Å; L438-E441 VanDerWaalsContact O-N 3.14Å; E441-I444 PolarHBondContact O-N 3.46Å; E441-R445 WeakPolarHBondContact O-CG 3.25Å; E441-R445 PolarHBondContact O-N 3.01Å
442	D	88	Confident	84	Confident	75 Å²	75	67.7 Å²	67.7	40%	0.401	35%	0.346	S	S	.	.	H	α-helix	trans	-60.6	-45.4	169.7	-82.2	-43.5	0	0	0	112.3	L438 Q439 I444 R445 N446	L438-D442 PolarHBondContact O-N 3.12Å; Q439-D442 PolarHBondContact O-N 3.44Å; D442-I444 VanDerWaalsContact C-N 3.3Å; D442-I444 PolarHBondContact O-N 3.49Å; D442-R445 VanDerWaalsContact CG-NH2 3.32Å; D442-R445 PolarHBondContact O-N 2.86Å; D442-R445 IonicContact OD1-CZ 3.44Å; D442-R445 IonicContact OD1-NE 3.18Å; D442-R445 PolarHBondContact OD1-NE 3.18Å; D442-R445 IonicContact OD1-NH2 3.61Å; D442-R445 PolarHBondContact OD1-NH2 3.45Å; D442-R445 IonicContact OD2-NH2 2.77Å; D442-N446 WeakPolarHBondContact O-CB 3.46Å; D442-N446 PolarHBondContact O-N 3.04Å; D442-N446 PolarHBondContact O-ND2 2.9Å; D442-N446 VanDerWaalsContact O-ND2 3.15Å
443	N	80.2	Confident	83.7	Confident	24 Å²	24	67.7 Å²	67.7	13%	0.128	35%	0.348	C	S	.	.	H	α-helix	trans	-62.1	-36.9	176.4	-75.3	-25.3	0	0	0	112.1	T413 I417 M420 Q439 R440 N446 L447	T413-N443 HydrophobicContact CG2-CB 4.32Å; T413-N443 WeakPolarHBondContact CG2-O 3.35Å; I417-N443 HydrophobicContact CD1-CB 4.1Å; I417-N443 HydrophobicContact CG1-CB 3.66Å; M420-N443 PolarHBondContact SD-ND2 3.13Å; M420-N443 VanDerWaalsContact SD-ND2 3.36Å; Q439-N443 WeakPolarHBondContact O-CB 3.21Å; Q439-N443 PolarHBondContact O-N 3.36Å; Q439-N443 PolarHBondContact O-ND2 2.84Å; R440-N443 PolarHBondContact O-N 3.48Å; N443-N446 PolarHBondContact O-N 2.76Å; N443-L447 WeakPolarHBondContact O-CB 3.27Å; N443-L447 PolarHBondContact O-N 2.72Å
444	I	84.6	Confident	83.4	Confident	67 Å²	67	66.1 Å²	66.1	34%	0.344	34%	0.339	S	S	.	.	H	α-helix	trans	-66.2	-41.9	174.8	-71.2	164.9	0	0	0	111.5	I417 R440 E441 D442 N446 L447 S448	I417-I444 HydrophobicContact CD1-CG1 3.9Å; I417-I444 HydrophobicContact CG1-CG1 4.36Å; R440-I444 HydrophobicContact CG-CD1 4.02Å; R440-I444 VanDerWaalsContact O-CG1 3.3Å; R440-I444 WeakPolarHBondContact O-CG1 3.19Å; R440-I444 PolarHBondContact O-N 2.78Å; E441-I444 PolarHBondContact O-N 3.46Å; D442-I444 VanDerWaalsContact C-N 3.3Å; D442-I444 PolarHBondContact O-N 3.49Å; I444-N446 VanDerWaalsContact C-N 3.35Å; I444-L447 PolarHBondContact O-N 2.94Å; I444-S448 PolarHBondContact O-N 3.46Å
445	R	85.9	Confident	82.9	Confident	129 Å²	129	65.1 Å²	65.1	49%	0.487	33%	0.329	S	S	.	.	H	α-helix	trans	-61.7	-41.7	173.1	-72.3	-173.9	-75.8	-96.2	9.2	112	E441 D442 S448 T449	E441-R445 WeakPolarHBondContact O-CG 3.25Å; E441-R445 PolarHBondContact O-N 3.01Å; D442-R445 VanDerWaalsContact CG-NH2 3.32Å; D442-R445 PolarHBondContact O-N 2.86Å; D442-R445 IonicContact OD1-CZ 3.44Å; D442-R445 IonicContact OD1-NE 3.18Å; D442-R445 PolarHBondContact OD1-NE 3.18Å; D442-R445 IonicContact OD1-NH2 3.61Å; D442-R445 PolarHBondContact OD1-NH2 3.45Å; D442-R445 IonicContact OD2-NH2 2.77Å; R445-S448 PolarHBondContact O-OG 3.03Å; R445-S448 VanDerWaalsContact O-OG 3.06Å; R445-T449 WeakPolarHBondContact O-CB 3.46Å; R445-T449 PolarHBondContact O-N 3.04Å; R445-T449 PolarHBondContact O-OG1 2.94Å
446	N	84.7	Confident	82.4	Confident	81 Å²	81	65.5 Å²	65.5	43%	0.433	33%	0.331	S	S	.	.	H	α-helix	trans	-66.1	-42.8	176.1	-74.4	-39	0	0	0	111.9	T413 D442 N443 I444 T449 L450	T413-N446 HydrophobicContact CG2-CB 4.43Å; D442-N446 WeakPolarHBondContact O-CB 3.46Å; D442-N446 PolarHBondContact O-N 3.04Å; D442-N446 PolarHBondContact O-ND2 2.9Å; D442-N446 VanDerWaalsContact O-ND2 3.15Å; N443-N446 PolarHBondContact O-N 2.76Å; I444-N446 VanDerWaalsContact C-N 3.35Å; N446-T449 PolarHBondContact O-N 3.03Å; N446-L450 WeakPolarHBondContact O-CB 3.48Å; N446-L450 WeakPolarHBondContact O-CG 3.47Å; N446-L450 PolarHBondContact O-N 2.93Å
447	L	82.2	Confident	82.1	Confident	27 Å²	27	68.4 Å²	68.4	14%	0.141	35%	0.346	C	S	.	.	H	α-helix	trans	-63	-45	178.1	-170.2	73.9	0	0	0	111.3	Y410 T413 E414 I417 N443 I444 T449 L450 Q451	Y410-L447 HydrophobicContact CD2-CD1 3.56Å; Y410-L447 HydrophobicContact CD2-CG 4.38Å; Y410-L447 HydrophobicContact CE2-CD1 3.51Å; Y410-L447 HydrophobicContact CE2-CG 3.99Å; Y410-L447 HydrophobicContact CG-CD1 4.21Å; T413-L447 HydrophobicContact CG2-CB 3.98Å; T413-L447 HydrophobicContact CG2-CD1 4.12Å; E414-L447 HydrophobicContact CB-CD1 4.13Å; I417-L447 HydrophobicContact CD1-CB 4.19Å; I417-L447 HydrophobicContact CD1-CD2 3.87Å; N443-L447 WeakPolarHBondContact O-CB 3.27Å; N443-L447 PolarHBondContact O-N 2.72Å; I444-L447 PolarHBondContact O-N 2.94Å; L447-T449 VanDerWaalsContact C-N 3.33Å; L447-T449 PolarHBondContact O-N 3.45Å; L447-L450 PolarHBondContact O-N 3.34Å; L447-Q451 WeakPolarHBondContact O-CB 3.25Å; L447-Q451 PolarHBondContact O-N 2.91Å
448	S	82.5	Confident	81.7	Confident	63 Å²	63	65.5 Å²	65.5	44%	0.441	33%	0.333	S	S	.	.	H	α-helix	trans	-64.5	-38.3	178.9	72.3	0	0	0	0	112.2	I444 R445 Q451 F452	I444-S448 PolarHBondContact O-N 3.46Å; R445-S448 PolarHBondContact O-OG 3.03Å; R445-S448 VanDerWaalsContact O-OG 3.06Å; S448-Q451 PolarHBondContact O-N 3.11Å; S448-F452 WeakPolarHBondContact O-CB 3.35Å; S448-F452 PolarHBondContact O-N 3Å
449	T	84.1	Confident	81.4	Confident	98 Å²	98	63.5 Å²	63.5	60%	0.601	33%	0.326	S	S	*	.	H	α-helix	trans	-64.6	-46.7	175.6	-55.8	0	0	0	0	111.6	R445 N446 L447 F452 G453	R445-T449 WeakPolarHBondContact O-CB 3.46Å; R445-T449 PolarHBondContact O-N 3.04Å; R445-T449 PolarHBondContact O-OG1 2.94Å; N446-T449 PolarHBondContact O-N 3.03Å; L447-T449 VanDerWaalsContact C-N 3.33Å; L447-T449 PolarHBondContact O-N 3.45Å; T449-F452 PolarHBondContact O-N 3.34Å; T449-G453 PolarHBondContact O-N 3.48Å
450	L	79.6	Confident	81.2	Confident	24 Å²	24	61.9 Å²	61.9	13%	0.126	33%	0.326	C	S	.	.	H	α-helix	trans	-62.1	-44.5	174.7	-73.2	170.3	0	0	0	111.6	L406 K409 Y410 N446 L447 F452 G453 L454	L406-L450 HydrophobicContact CD2-CD2 4.43Å; K409-L450 HydrophobicContact CD-CD1 4.12Å; K409-L450 HydrophobicContact CD-CD2 4.12Å; K409-L450 HydrophobicContact CG-CD1 3.92Å; Y410-L450 HydrophobicContact CD2-CB 4.34Å; N446-L450 WeakPolarHBondContact O-CB 3.48Å; N446-L450 WeakPolarHBondContact O-CG 3.47Å; N446-L450 PolarHBondContact O-N 2.93Å; L447-L450 PolarHBondContact O-N 3.34Å; L450-F452 PolarHBondContact O-N 2.68Å; L450-G453 PolarHBondContact O-N 2.94Å; L450-L454 WeakPolarHBondContact O-CB 3.22Å; L450-L454 VanDerWaalsContact O-CG 3.3Å; L450-L454 WeakPolarHBondContact O-CG 3.18Å; L450-L454 PolarHBondContact O-N 3.15Å
451	Q	79.8	Confident	81.1	Confident	48 Å²	48	60.3 Å²	60.3	22%	0.224	32%	0.322	C	S	.	.	H	α-helix	trans	-58.2	-48.3	178.9	-172.3	-173.5	-84.8	0	0	111.4	I286 F290 Y410 L447 S448 L454 Q455	I286-Q451 HydrophobicContact CG2-CG 3.96Å; F290-Q451 HydrophobicContact CE2-CG 3.97Å; F290-Q451 HydrophobicContact CZ-CB 4.49Å; F290-Q451 HydrophobicContact CZ-CG 3.9Å; Y410-Q451 HydrophobicContact CE2-CB 3.95Å; Y410-Q451 HydrophobicContact CE2-CG 4.25Å; L447-Q451 WeakPolarHBondContact O-CB 3.25Å; L447-Q451 PolarHBondContact O-N 2.91Å; S448-Q451 PolarHBondContact O-N 3.11Å; Q451-L454 PolarHBondContact O-N 3.48Å; Q451-Q455 VanDerWaalsContact CG-NE2 3.34Å; Q451-Q455 WeakPolarHBondContact O-CB 3.22Å; Q451-Q455 VanDerWaalsContact O-CG 3.26Å; Q451-Q455 WeakPolarHBondContact O-CG 3.45Å; Q451-Q455 PolarHBondContact O-N 3.17Å
452	F	76.6	Confident	80.9	Confident	144 Å²	144	57.9 Å²	57.9	63%	0.632	31%	0.312	S	S	*	.	H	α-helix	trans	-63.1	-45.6	178.5	-178.4	-99.6	0	0	0	111.8	S448 T449 L450 N456	S448-F452 WeakPolarHBondContact O-CB 3.35Å; S448-F452 PolarHBondContact O-N 3Å; T449-F452 PolarHBondContact O-N 3.34Å; L450-F452 PolarHBondContact O-N 2.68Å; F452-N456 WeakPolarHBondContact CE1-ND2 3.01Å; F452-N456 VanDerWaalsContact CZ-ND2 3.35Å; F452-N456 WeakPolarHBondContact CZ-ND2 3.44Å; F452-N456 PolarHBondContact O-N 3.17Å; F452-N456 PolarHBondContact O-ND2 3.16Å
453	G	77.1	Confident	80.7	Confident	25 Å²	25	62.3 Å²	62.3	26%	0.258	33%	0.328	S	S	.	.	H	α-helix	trans	-59.8	-50.2	176	0	0	0	0	0	112.6	T449 L450 N456 I457	T449-G453 PolarHBondContact O-N 3.48Å; L450-G453 PolarHBondContact O-N 2.94Å; G453-N456 PolarHBondContact O-N 3.1Å; G453-I457 WeakPolarHBondContact O-CB 3.18Å; G453-I457 WeakPolarHBondContact O-CD1 3.23Å; G453-I457 VanDerWaalsContact O-CG1 3.23Å; G453-I457 WeakPolarHBondContact O-CG1 3.44Å; G453-I457 PolarHBondContact O-N 3.47Å
454	L	78.3	Confident	80.9	Confident	5 Å²	5	63.9 Å²	63.9	3%	0.026	34%	0.341	C	S	.	.	H	α-helix	trans	-62.1	-45.1	179.8	-73.1	176.6	0	0	0	112.3	F290 L406 L407 Y410 L450 Q451 N456 I457 L458	F290-L454 HydrophobicContact CD1-CB 4.41Å; F290-L454 HydrophobicContact CE1-CB 3.55Å; F290-L454 HydrophobicContact CZ-CB 3.82Å; F290-L454 HydrophobicContact CZ-CD1 4.43Å; L406-L454 HydrophobicContact CB-CD2 3.72Å; L407-L454 HydrophobicContact CD2-CD1 4.27Å; Y410-L454 HydrophobicContact CD2-CD1 4.32Å; Y410-L454 HydrophobicContact CG-CD1 4.12Å; L450-L454 WeakPolarHBondContact O-CB 3.22Å; L450-L454 VanDerWaalsContact O-CG 3.3Å; L450-L454 WeakPolarHBondContact O-CG 3.18Å; L450-L454 PolarHBondContact O-N 3.15Å; Q451-L454 PolarHBondContact O-N 3.48Å; L454-N456 PolarHBondContact O-N 3.42Å; L454-I457 PolarHBondContact O-N 2.82Å; L454-L458 HydrophobicContact CB-CD1 3.85Å; L454-L458 HydrophobicContact CB-CG 4.29Å; L454-L458 HydrophobicContact CD2-CD1 3.96Å; L454-L458 HydrophobicContact CD2-CD2 4.22Å; L454-L458 HydrophobicContact CD2-CG 4.04Å; L454-L458 HydrophobicContact CG-CD1 4.41Å; L454-L458 VanDerWaalsContact O-CB 3.28Å; L454-L458 WeakPolarHBondContact O-CB 3.44Å; L454-L458 VanDerWaalsContact O-CG 3.23Å; L454-L458 WeakPolarHBondContact O-CG 3.12Å; L454-L458 PolarHBondContact O-N 2.71Å
455	Q	75.8	Confident	81.1	Confident	49 Å²	49	60.8 Å²	60.8	23%	0.229	33%	0.325	C	S	.	.	H	α-helix	trans	-59.9	-31.5	-179	-78.7	177.6	15.8	0	0	113.8	I286 K289 F290 Q451 P459	I286-Q455 VanDerWaalsContact CG1-NE2 3.35Å; I286-Q455 VanDerWaalsContact CG2-NE2 3.28Å; K289-Q455 PolarHBondContact NZ-O 3.33Å; F290-Q455 HydrophobicContact CE1-CG 3.72Å; F290-Q455 HydrophobicContact CZ-CG 3.71Å; Q451-Q455 VanDerWaalsContact CG-NE2 3.34Å; Q451-Q455 WeakPolarHBondContact O-CB 3.22Å; Q451-Q455 VanDerWaalsContact O-CG 3.26Å; Q451-Q455 WeakPolarHBondContact O-CG 3.45Å; Q451-Q455 PolarHBondContact O-N 3.17Å; Q455-P459 VanDerWaalsContact O-CD 3.3Å; Q455-P459 WeakPolarHBondContact O-CD 3.38Å; Q455-P459 WeakPolarHBondContact O-CG 3.37Å
456	N	76.2	Confident	81	Confident	93 Å²	93	55.7 Å²	55.7	50%	0.497	31%	0.307	S	S	.	.	H	α-helix	trans	-86.8	-39.5	179.5	-67.6	-33.6	0	0	0	112.2	F452 G453 L454	F452-N456 WeakPolarHBondContact CE1-ND2 3.01Å; F452-N456 VanDerWaalsContact CZ-ND2 3.35Å; F452-N456 WeakPolarHBondContact CZ-ND2 3.44Å; F452-N456 PolarHBondContact O-N 3.17Å; F452-N456 PolarHBondContact O-ND2 3.16Å; G453-N456 PolarHBondContact O-N 3.1Å; L454-N456 PolarHBondContact O-N 3.42Å
457	I	77.6	Confident	81.1	Confident	91 Å²	91	54.8 Å²	54.8	47%	0.467	31%	0.307	S	S	.	.	H	α-helix	trans	-81	-44.3	-174.4	-65.5	167.5	0	0	0	112.2	G453 L454 S460 L461	G453-I457 WeakPolarHBondContact O-CB 3.18Å; G453-I457 WeakPolarHBondContact O-CD1 3.23Å; G453-I457 VanDerWaalsContact O-CG1 3.23Å; G453-I457 WeakPolarHBondContact O-CG1 3.44Å; G453-I457 PolarHBondContact O-N 3.47Å; L454-I457 PolarHBondContact O-N 2.82Å; I457-S460 PolarHBondContact O-N 2.92Å; I457-L461 WeakPolarHBondContact O-CB 3.34Å; I457-L461 PolarHBondContact O-N 3.3Å
458	L	78.8	Confident	81.2	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-60.5	-46.2	-170.3	-67.9	173.4	0	0	0	114.2	F290 E293 I297 L407 L454 S460 L461 V462	F290-L458 HydrophobicContact CD1-CD1 3.84Å; F290-L458 HydrophobicContact CE1-CD1 4.13Å; E293-L458 HydrophobicContact CB-CB 4.11Å; E293-L458 HydrophobicContact CB-CD1 3.98Å; E293-L458 HydrophobicContact CG-CB 4.09Å; E293-L458 WeakPolarHBondContact OE2-CB 3.35Å; E293-L458 WeakPolarHBondContact OE2-CD1 3.23Å; I297-L458 HydrophobicContact CD1-CD2 3.42Å; I297-L458 VanDerWaalsContact CD1-CD2 3.42Å; L407-L458 HydrophobicContact CD1-CD2 4.36Å; L407-L458 HydrophobicContact CD2-CD1 3.99Å; L407-L458 HydrophobicContact CG-CD1 4.4Å; L454-L458 HydrophobicContact CB-CD1 3.85Å; L454-L458 HydrophobicContact CB-CG 4.29Å; L454-L458 HydrophobicContact CD2-CD1 3.96Å; L454-L458 HydrophobicContact CD2-CD2 4.22Å; L454-L458 HydrophobicContact CD2-CG 4.04Å; L454-L458 HydrophobicContact CG-CD1 4.41Å; L454-L458 VanDerWaalsContact O-CB 3.28Å; L454-L458 WeakPolarHBondContact O-CB 3.44Å; L454-L458 VanDerWaalsContact O-CG 3.23Å; L454-L458 WeakPolarHBondContact O-CG 3.12Å; L454-L458 PolarHBondContact O-N 2.71Å; L458-S460 VanDerWaalsContact C-N 3.34Å; L458-S460 PolarHBondContact O-N 3.03Å; L458-L461 PolarHBondContact O-N 3.09Å; L458-V462 WeakPolarHBondContact O-CB 3.3Å; L458-V462 WeakPolarHBondContact O-CG2 3.35Å; L458-V462 PolarHBondContact O-N 3.49Å
459	P	79.7	Confident	81.4	Confident	54 Å²	54	53 Å²	53	35%	0.351	29%	0.293	S	S	.	.	H	α-helix	trans	-61.3	-41.9	177.6	-19	28.1	0	0	0	112.8	E293 Q455 V462 K463	E293-P459 WeakPolarHBondContact OE1-CD 3.13Å; E293-P459 VanDerWaalsContact OE1-CG 3.31Å; E293-P459 WeakPolarHBondContact OE1-CG 3.47Å; Q455-P459 VanDerWaalsContact O-CD 3.3Å; Q455-P459 WeakPolarHBondContact O-CD 3.38Å; Q455-P459 WeakPolarHBondContact O-CG 3.37Å; P459-V462 PolarHBondContact O-N 3.33Å; P459-K463 WeakPolarHBondContact O-CB 3.49Å; P459-K463 PolarHBondContact O-N 3.36Å
460	S	80.8	Confident	81.3	Confident	73 Å²	73	52.4 Å²	52.4	51%	0.51	29%	0.285	S	S	.	.	H	α-helix	trans	-66.6	-42.6	-179.4	-172.6	0	0	0	0	111.2	I457 L458 K463 S464	I457-S460 PolarHBondContact O-N 2.92Å; L458-S460 VanDerWaalsContact C-N 3.34Å; L458-S460 PolarHBondContact O-N 3.03Å; S460-K463 PolarHBondContact O-N 3.22Å; S460-S464 VanDerWaalsContact O-CB 3.28Å; S460-S464 WeakPolarHBondContact O-CB 3.41Å; S460-S464 PolarHBondContact O-N 3.49Å; S460-S464 PolarHBondContact O-OG 3.48Å
461	L	83.2	Confident	81.5	Confident	23 Å²	23	53.4 Å²	53.4	12%	0.12	29%	0.293	C	S	.	.	H	α-helix	trans	-62.7	-48.7	174.9	179.1	65	0	0	0	111.7	L399 S403 I457 L458 K463 S464 A465	L399-L461 HydrophobicContact CB-CD1 4.15Å; L399-L461 HydrophobicContact CD1-CD1 4.47Å; S403-L461 WeakPolarHBondContact OG-CD2 3.43Å; I457-L461 WeakPolarHBondContact O-CB 3.34Å; I457-L461 PolarHBondContact O-N 3.3Å; L458-L461 PolarHBondContact O-N 3.09Å; L461-K463 VanDerWaalsContact C-N 3.33Å; L461-K463 PolarHBondContact O-N 2.97Å; L461-S464 PolarHBondContact O-N 3.06Å; L461-A465 WeakPolarHBondContact O-CB 3.35Å; L461-A465 PolarHBondContact O-N 2.81Å
462	V	83.4	Confident	81.9	Confident	22 Å²	22	51.3 Å²	51.3	13%	0.133	28%	0.284	C	S	.	.	H	α-helix	trans	-59.8	-43.1	179.5	167.2	0	0	0	0	111.1	A296 I297 I300 L458 P459 N466	A296-V462 HydrophobicContact CB-CG1 3.91Å; A296-V462 HydrophobicContact CB-CG2 3.76Å; I297-V462 HydrophobicContact CG1-CG2 4.33Å; I300-V462 HydrophobicContact CD1-CB 4.29Å; I300-V462 HydrophobicContact CD1-CG1 4.13Å; I300-V462 HydrophobicContact CD1-CG2 4.15Å; L458-V462 WeakPolarHBondContact O-CB 3.3Å; L458-V462 WeakPolarHBondContact O-CG2 3.35Å; L458-V462 PolarHBondContact O-N 3.49Å; P459-V462 PolarHBondContact O-N 3.33Å; V462-N466 PolarHBondContact O-N 2.72Å; V462-N466 PolarHBondContact O-ND2 2.9Å
463	K	84.2	Confident	82.4	Confident	169 Å²	169	45.7 Å²	45.7	74%	0.735	26%	0.263	S	S	*	.	H	α-helix	trans	-62.8	-48.8	175.5	-173.3	-177.2	179.2	-173.4	0	111.7	P459 S460 L461 N466 S467	P459-K463 WeakPolarHBondContact O-CB 3.49Å; P459-K463 PolarHBondContact O-N 3.36Å; S460-K463 PolarHBondContact O-N 3.22Å; L461-K463 VanDerWaalsContact C-N 3.33Å; L461-K463 PolarHBondContact O-N 2.97Å; K463-N466 PolarHBondContact O-N 2.87Å; K463-S467 PolarHBondContact O-N 3.36Å
464	S	83.3	Confident	82.7	Confident	57 Å²	57	49.2 Å²	49.2	40%	0.399	27%	0.273	S	S	.	.	H	α-helix	trans	-65.5	-42.1	-177.9	-58.1	0	0	0	0	112.1	S460 L461 S467 I468	S460-S464 VanDerWaalsContact O-CB 3.28Å; S460-S464 WeakPolarHBondContact O-CB 3.41Å; S460-S464 PolarHBondContact O-N 3.49Å; S460-S464 PolarHBondContact O-OG 3.48Å; L461-S464 PolarHBondContact O-N 3.06Å; S464-S467 WeakPolarHBondContact O-CB 3.34Å; S464-S467 PolarHBondContact O-N 3.05Å; S464-I468 WeakPolarHBondContact O-CG1 3.31Å; S464-I468 PolarHBondContact O-N 3.37Å
465	A	88.3	Confident	83.1	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.008	29%	0.286	C	S	.	.	H	α-helix	trans	-61.6	-44.1	178.1	0	0	0	0	0	112.8	I300 L396 L461 S467 I468 L469	I300-A465 HydrophobicContact CD1-CB 3.93Å; I300-A465 HydrophobicContact CG2-CB 3.66Å; L396-A465 HydrophobicContact CD1-CB 3.52Å; L396-A465 HydrophobicContact CD2-CB 4.36Å; L461-A465 WeakPolarHBondContact O-CB 3.35Å; L461-A465 PolarHBondContact O-N 2.81Å; A465-S467 VanDerWaalsContact C-N 3.33Å; A465-S467 PolarHBondContact O-N 2.8Å; A465-I468 PolarHBondContact O-N 3.46Å; A465-L469 WeakPolarHBondContact O-CG 3.33Å; A465-L469 PolarHBondContact O-N 3.09Å
466	N	85.5	Confident	83.6	Confident	22 Å²	22	50.9 Å²	50.9	12%	0.118	28%	0.28	C	S	.	.	H	α-helix	trans	-63.1	-40	174.9	-74.5	-49.1	0	0	0	111.6	T254 V462 K463 L469 I470	T254-N466 HydrophobicContact CG2-CB 4.27Å; V462-N466 PolarHBondContact O-N 2.72Å; V462-N466 PolarHBondContact O-ND2 2.9Å; K463-N466 PolarHBondContact O-N 2.87Å; N466-L469 PolarHBondContact O-N 3Å; N466-I470 WeakPolarHBondContact O-CG1 3.25Å; N466-I470 PolarHBondContact O-N 3.14Å
467	S	85.9	Confident	84	Confident	62 Å²	62	50.2 Å²	50.2	43%	0.434	27%	0.272	S	S	.	.	H	α-helix	trans	-62.2	-41.6	173.6	-171.8	0	0	0	0	112.4	K463 S464 A465 I470 S471	K463-S467 PolarHBondContact O-N 3.36Å; S464-S467 WeakPolarHBondContact O-CB 3.34Å; S464-S467 PolarHBondContact O-N 3.05Å; A465-S467 VanDerWaalsContact C-N 3.33Å; A465-S467 PolarHBondContact O-N 2.8Å; S467-I470 PolarHBondContact O-N 2.92Å; S467-S471 WeakPolarHBondContact O-CB 3.42Å; S467-S471 PolarHBondContact O-N 3.32Å; S467-S471 PolarHBondContact O-OG 2.9Å
468	I	85.3	Confident	84.2	Confident	48 Å²	48	50.1 Å²	50.1	25%	0.246	27%	0.272	C	S	.	.	H	α-helix	trans	-62.9	-44.3	174.8	-68.5	163.7	0	0	0	111	L396 S464 A465 S471 A472	L396-I468 HydrophobicContact CD2-CB 4.28Å; L396-I468 HydrophobicContact CD2-CG2 3.93Å; S464-I468 WeakPolarHBondContact O-CG1 3.31Å; S464-I468 PolarHBondContact O-N 3.37Å; A465-I468 PolarHBondContact O-N 3.46Å; I468-S471 WeakPolarHBondContact CA-OG 3.29Å; I468-S471 PolarHBondContact O-OG 3.46Å; I468-A472 WeakPolarHBondContact O-CB 3.35Å; I468-A472 PolarHBondContact O-N 3.09Å
469	L	86.4	Confident	84.7	Confident	6 Å²	6	50.6 Å²	50.6	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-62.7	-43.9	178.4	-71.6	174.2	0	0	0	112.4	I300 C304 L307 L393 L396 A465 N466 S473	I300-L469 HydrophobicContact CG2-CD1 3.93Å; C304-L469 HydrophobicContact CB-CD2 3.97Å; L307-L469 HydrophobicContact CD2-CD2 4.12Å; L393-L469 HydrophobicContact CD2-CD2 3.78Å; L396-L469 HydrophobicContact CD2-CD2 4.03Å; L396-L469 HydrophobicContact CD2-CG 4.01Å; A465-L469 WeakPolarHBondContact O-CG 3.33Å; A465-L469 PolarHBondContact O-N 3.09Å; N466-L469 PolarHBondContact O-N 3Å; L469-S473 VanDerWaalsContact O-CB 3.32Å; L469-S473 WeakPolarHBondContact O-CB 3.34Å; L469-S473 PolarHBondContact O-N 3.43Å
470	I	82.3	Confident	85	Confident	85 Å²	85	48.8 Å²	48.8	44%	0.436	26%	0.261	S	S	.	.	H	α-helix	trans	-64.6	-50.7	178.3	-67.5	166.2	0	0	0	110.5	N466 S467 S473 Q474	N466-I470 WeakPolarHBondContact O-CG1 3.25Å; N466-I470 PolarHBondContact O-N 3.14Å; S467-I470 PolarHBondContact O-N 2.92Å; I470-S473 WeakPolarHBondContact O-CB 3.43Å; I470-S473 PolarHBondContact O-N 3.45Å; I470-Q474 WeakPolarHBondContact O-CG 3.43Å; I470-Q474 PolarHBondContact O-N 2.81Å
471	S	83.6	Confident	85.1	Confident	44 Å²	44	49 Å²	49	31%	0.308	26%	0.262	S	S	.	.	H	α-helix	trans	-66.5	-38.5	-179	56.3	0	0	0	0	112.9	S467 I468 Q474 Y475	S467-S471 WeakPolarHBondContact O-CB 3.42Å; S467-S471 PolarHBondContact O-N 3.32Å; S467-S471 PolarHBondContact O-OG 2.9Å; I468-S471 WeakPolarHBondContact CA-OG 3.29Å; I468-S471 PolarHBondContact O-OG 3.46Å; S471-Q474 PolarHBondContact O-N 3.07Å; S471-Y475 VanDerWaalsContact O-CB 3.28Å; S471-Y475 WeakPolarHBondContact O-CB 3.23Å; S471-Y475 PolarHBondContact O-N 3.09Å
472	A	87.8	Confident	85.3	Confident	4 Å²	4	50.2 Å²	50.2	3%	0.033	27%	0.269	C	S	.	.	H	α-helix	trans	-62.6	-42.3	174	0	0	0	0	0	112	L307 V389 L393 I468 A476	L307-A472 HydrophobicContact CD2-CB 4.3Å; V389-A472 HydrophobicContact CG1-CB 4.21Å; L393-A472 HydrophobicContact CD2-CB 4.14Å; L393-A472 HydrophobicContact CG-CB 4.48Å; I468-A472 WeakPolarHBondContact O-CB 3.35Å; I468-A472 PolarHBondContact O-N 3.09Å; A472-A476 WeakPolarHBondContact O-CB 3.46Å; A472-A476 PolarHBondContact O-N 3.32Å
473	S	85.8	Confident	85.6	Confident	26 Å²	26	49.2 Å²	49.2	18%	0.182	26%	0.263	C	S	.	.	H	α-helix	trans	-61.8	-52.7	174.5	-177.9	0	0	0	0	111.5	L469 I470 Y475 A476 F477	L469-S473 VanDerWaalsContact O-CB 3.32Å; L469-S473 WeakPolarHBondContact O-CB 3.34Å; L469-S473 PolarHBondContact O-N 3.43Å; I470-S473 WeakPolarHBondContact O-CB 3.43Å; I470-S473 PolarHBondContact O-N 3.45Å; S473-Y475 VanDerWaalsContact C-N 3.35Å; S473-Y475 PolarHBondContact O-N 2.92Å; S473-A476 PolarHBondContact O-N 3.17Å; S473-F477 VanDerWaalsContact O-CD2 3.25Å; S473-F477 WeakPolarHBondContact O-CD2 3.33Å; S473-F477 PolarHBondContact O-N 2.79Å; S473-F477 VanDerWaalsContact O-N 3.12Å
474	Q	83.9	Confident	85.6	Confident	100 Å²	100	44.8 Å²	44.8	47%	0.467	25%	0.246	S	C	.	.	H	α-helix	trans	-57.1	-45.4	177.7	-72.6	171.7	-20.9	0	0	112.2	I470 S471 A476 F477 I478	I470-Q474 WeakPolarHBondContact O-CG 3.43Å; I470-Q474 PolarHBondContact O-N 2.81Å; S471-Q474 PolarHBondContact O-N 3.07Å; Q474-A476 PolarHBondContact O-N 3.46Å; Q474-F477 PolarHBondContact O-N 3.39Å; Q474-I478 WeakPolarHBondContact O-CG1 3.25Å; Q474-I478 PolarHBondContact O-N 3.4Å
475	Y	88	Confident	85.6	Confident	78 Å²	78	46 Å²	46	31%	0.306	25%	0.245	S	C	.	.	H	α-helix	trans	-65.8	-37.9	179.7	-164.8	-101.4	0	0	0	112.3	N388 V389 S471 S473 F477 I478 L479	N388-Y475 HydrophobicContact CB-CD1 4.01Å; N388-Y475 HydrophobicContact CB-CE1 3.55Å; N388-Y475 PolarHBondContact ND2-OH 3.45Å; V389-Y475 HydrophobicContact CG2-CD1 3.82Å; S471-Y475 VanDerWaalsContact O-CB 3.28Å; S471-Y475 WeakPolarHBondContact O-CB 3.23Å; S471-Y475 PolarHBondContact O-N 3.09Å; S473-Y475 VanDerWaalsContact C-N 3.35Å; S473-Y475 PolarHBondContact O-N 2.92Å; Y475-F477 VanDerWaalsContact C-N 3.34Å; Y475-F477 PolarHBondContact O-N 3.06Å; Y475-I478 PolarHBondContact O-N 3.03Å; Y475-L479 HydrophobicContact CD1-CD1 3.79Å; Y475-L479 HydrophobicContact CD1-CG 3.94Å; Y475-L479 HydrophobicContact CE1-CD1 3.61Å; Y475-L479 HydrophobicContact CE1-CD2 3.93Å; Y475-L479 HydrophobicContact CE1-CG 3.72Å; Y475-L479 WeakPolarHBondContact O-CG 3.46Å; Y475-L479 PolarHBondContact O-N 3.03Å
476	A	86.6	Confident	85.5	Confident	11 Å²	11	47.3 Å²	47.3	9%	0.091	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-40.3	174.3	0	0	0	0	0	112.3	V311 M385 V389 A472 S473 Q474 Q480	V311-A476 HydrophobicContact CG2-CB 4.01Å; M385-A476 HydrophobicContact CE-CB 4.08Å; M385-A476 HydrophobicContact SD-CB 3.86Å; V389-A476 HydrophobicContact CG1-CB 4.34Å; V389-A476 HydrophobicContact CG2-CB 4.28Å; A472-A476 WeakPolarHBondContact O-CB 3.46Å; A472-A476 PolarHBondContact O-N 3.32Å; S473-A476 PolarHBondContact O-N 3.17Å; Q474-A476 PolarHBondContact O-N 3.46Å; A476-Q480 PolarHBondContact O-N 3.21Å
477	F	83.1	Confident	85.5	Confident	79 Å²	79	47.2 Å²	47.2	35%	0.346	25%	0.254	S	S	.	.	H	α-helix	trans	-63.5	-46	172.6	-81.3	-71.8	0	0	0	112.2	W243 S473 Q474 Y475 L479 Q480 S481	W243-F477 HydrophobicContact CE3-CE1 4.31Å; W243-F477 AromaticContact CE3-CZ 3.89Å; W243-F477 HydrophobicContact CE3-CZ 3.89Å; W243-F477 HydrophobicContact CZ3-CZ 4.37Å; S473-F477 VanDerWaalsContact O-CD2 3.25Å; S473-F477 WeakPolarHBondContact O-CD2 3.33Å; S473-F477 PolarHBondContact O-N 2.79Å; S473-F477 VanDerWaalsContact O-N 3.12Å; Q474-F477 PolarHBondContact O-N 3.39Å; Y475-F477 VanDerWaalsContact C-N 3.34Å; Y475-F477 PolarHBondContact O-N 3.06Å; F477-L479 PolarHBondContact O-N 2.71Å; F477-Q480 PolarHBondContact O-N 3.41Å; F477-S481 WeakPolarHBondContact O-CB 3.49Å; F477-S481 PolarHBondContact O-N 3Å
478	I	82.5	Confident	85.1	Confident	88 Å²	88	48.9 Å²	48.9	45%	0.451	26%	0.255	S	S	.	.	H	α-helix	trans	-60.4	-46.3	178.3	-68.3	164.7	0	0	0	111	Q474 Y475 Q480 S481 N482	Q474-I478 WeakPolarHBondContact O-CG1 3.25Å; Q474-I478 PolarHBondContact O-N 3.4Å; Y475-I478 PolarHBondContact O-N 3.03Å; I478-Q480 VanDerWaalsContact C-N 3.29Å; I478-Q480 PolarHBondContact O-N 3.09Å; I478-S481 PolarHBondContact O-N 3.37Å; I478-N482 WeakPolarHBondContact O-CB 3.28Å; I478-N482 VanDerWaalsContact O-CG 3.23Å; I478-N482 PolarHBondContact O-N 3.23Å; I478-N482 PolarHBondContact O-ND2 3Å
479	L	88.3	Confident	85	Confident	11 Å²	11	50.3 Å²	50.3	6%	0.058	26%	0.263	C	S	.	.	H	α-helix	trans	-57.6	-42	176.7	-75.6	-178.8	0	0	0	112.2	Y381 K384 M385 Y475 F477 L483	Y381-L479 HydrophobicContact CD2-CB 3.97Å; Y381-L479 WeakPolarHBondContact CD2-O 3.16Å; Y381-L479 HydrophobicContact CE2-CB 4.05Å; K384-L479 HydrophobicContact CB-CD1 3.9Å; K384-L479 HydrophobicContact CB-CD2 3.73Å; K384-L479 HydrophobicContact CB-CG 4.5Å; K384-L479 HydrophobicContact CD-CD2 3.81Å; K384-L479 HydrophobicContact CG-CD2 4.43Å; M385-L479 HydrophobicContact CB-CD1 4.15Å; M385-L479 HydrophobicContact CE-CB 4.03Å; M385-L479 HydrophobicContact CE-CD1 3.9Å; M385-L479 HydrophobicContact SD-CD1 4.06Å; Y475-L479 HydrophobicContact CD1-CD1 3.79Å; Y475-L479 HydrophobicContact CD1-CG 3.94Å; Y475-L479 HydrophobicContact CE1-CD1 3.61Å; Y475-L479 HydrophobicContact CE1-CD2 3.93Å; Y475-L479 HydrophobicContact CE1-CG 3.72Å; Y475-L479 WeakPolarHBondContact O-CG 3.46Å; Y475-L479 PolarHBondContact O-N 3.03Å; F477-L479 PolarHBondContact O-N 2.71Å; L479-L483 PolarHBondContact O-N 3.14Å; L479-L483 VanDerWaalsContact O-N 3.1Å
480	Q	87.1	Confident	84.8	Confident	16 Å²	16	51.1 Å²	51.1	8%	0.075	27%	0.267	C	S	.	.	H	α-helix	trans	-73.3	-39.6	-180	-165.4	-177	33.7	0	0	112.4	R314 T318 Y381 A476 F477 I478 N482 L483 M484	R314-Q480 VanDerWaalsContact NE-CD 3.34Å; R314-Q480 VanDerWaalsContact NE-NE2 3.17Å; T318-Q480 PolarHBondContact OG1-NE2 2.78Å; T318-Q480 VanDerWaalsContact OG1-NE2 3.14Å; Y381-Q480 HydrophobicContact CE2-CB 4.11Å; Y381-Q480 HydrophobicContact CE2-CG 4.5Å; A476-Q480 PolarHBondContact O-N 3.21Å; F477-Q480 PolarHBondContact O-N 3.41Å; I478-Q480 VanDerWaalsContact C-N 3.29Å; I478-Q480 PolarHBondContact O-N 3.09Å; Q480-N482 VanDerWaalsContact C-N 3.3Å; Q480-N482 PolarHBondContact O-N 3.1Å; Q480-L483 WeakPolarHBondContact O-CB 3.46Å; Q480-L483 PolarHBondContact O-N 2.92Å; Q480-M484 WeakPolarHBondContact O-CG 3.49Å; Q480-M484 PolarHBondContact O-N 2.97Å
481	S	82.4	Confident	84.5	Confident	76 Å²	76	49 Å²	49	53%	0.531	26%	0.258	S	S	.	.	H	α-helix	trans	-56	-47.8	173	-170.1	0	0	0	0	110.6	F477 I478 L483 M484 Q485	F477-S481 WeakPolarHBondContact O-CB 3.49Å; F477-S481 PolarHBondContact O-N 3Å; I478-S481 PolarHBondContact O-N 3.37Å; S481-L483 VanDerWaalsContact C-N 3.34Å; S481-L483 PolarHBondContact O-N 3.49Å; S481-M484 PolarHBondContact O-N 3.38Å; S481-M484 VanDerWaalsContact O-N 3.17Å; S481-Q485 WeakPolarHBondContact O-CB 3.24Å; S481-Q485 PolarHBondContact O-N 3.08Å
482	N	86.9	Confident	84.1	Confident	50 Å²	50	51.5 Å²	51.5	27%	0.267	27%	0.265	S	S	.	.	H	α-helix	trans	-60	-39.2	176.3	-70.2	-22.5	0	0	0	113.1	I478 Q480 Q485 Q486	I478-N482 WeakPolarHBondContact O-CB 3.28Å; I478-N482 VanDerWaalsContact O-CG 3.23Å; I478-N482 PolarHBondContact O-N 3.23Å; I478-N482 PolarHBondContact O-ND2 3Å; Q480-N482 VanDerWaalsContact C-N 3.3Å; Q480-N482 PolarHBondContact O-N 3.1Å; N482-Q485 PolarHBondContact O-N 3.33Å; N482-Q486 WeakPolarHBondContact O-CG 3.34Å; N482-Q486 PolarHBondContact O-N 3.48Å
483	L	89.6	Confident	83.6	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64	-43.3	175.2	176.1	64.7	0	0	0	111.9	T318 I322 L373 Y376 M377 Y381 L479 Q480 S481 Q486 A487	T318-L483 HydrophobicContact CG2-CD2 3.6Å; I322-L483 HydrophobicContact CD1-CD1 4.38Å; I322-L483 HydrophobicContact CD1-CD2 4.2Å; I322-L483 HydrophobicContact CD1-CG 4.47Å; L373-L483 HydrophobicContact CD1-CD1 3.75Å; Y376-L483 HydrophobicContact CD1-CD1 3.64Å; Y376-L483 HydrophobicContact CE1-CB 4.39Å; Y376-L483 HydrophobicContact CE1-CD1 4.09Å; M377-L483 HydrophobicContact CB-CD1 4.05Å; M377-L483 HydrophobicContact CG-CD2 4.48Å; Y381-L483 HydrophobicContact CD1-CD2 3.89Å; Y381-L483 HydrophobicContact CD2-CB 4.07Å; Y381-L483 HydrophobicContact CD2-CD2 3.97Å; Y381-L483 HydrophobicContact CE1-CD2 4.12Å; Y381-L483 HydrophobicContact CE2-CD2 4.19Å; Y381-L483 HydrophobicContact CG-CB 4.43Å; Y381-L483 HydrophobicContact CG-CD2 3.82Å; L479-L483 PolarHBondContact O-N 3.14Å; L479-L483 VanDerWaalsContact O-N 3.1Å; Q480-L483 WeakPolarHBondContact O-CB 3.46Å; Q480-L483 PolarHBondContact O-N 2.92Å; S481-L483 VanDerWaalsContact C-N 3.34Å; S481-L483 PolarHBondContact O-N 3.49Å; L483-Q486 PolarHBondContact O-N 3.39Å; L483-A487 PolarHBondContact O-N 3.26Å
484	M	86.1	Confident	83	Confident	76 Å²	76	55.3 Å²	55.3	37%	0.374	28%	0.278	S	S	.	.	H	α-helix	trans	-67.5	-40.9	177	-60.1	-64.5	88.5	0	0	111.5	T318 Q480 S481 Q486 A487 E488	T318-M484 HydrophobicContact CG2-CE 3.93Å; Q480-M484 WeakPolarHBondContact O-CG 3.49Å; Q480-M484 PolarHBondContact O-N 2.97Å; S481-M484 PolarHBondContact O-N 3.38Å; S481-M484 VanDerWaalsContact O-N 3.17Å; M484-Q486 VanDerWaalsContact C-N 3.32Å; M484-Q486 PolarHBondContact O-N 3.35Å; M484-A487 WeakPolarHBondContact O-CB 3.36Å; M484-A487 PolarHBondContact O-N 3.28Å; M484-A487 VanDerWaalsContact O-N 3.1Å; M484-E488 PolarHBondContact O-N 3.06Å
485	Q	82.3	Confident	82.2	Confident	82 Å²	82	53.5 Å²	53.5	38%	0.383	27%	0.271	S	S	.	.	H	α-helix	trans	-62.6	-37.1	174.9	-167.8	65.9	71.2	0	0	112.3	S481 N482 E488 N489	S481-Q485 WeakPolarHBondContact O-CB 3.24Å; S481-Q485 PolarHBondContact O-N 3.08Å; N482-Q485 PolarHBondContact O-N 3.33Å; Q485-E488 PolarHBondContact NE2-OE2 3.01Å; Q485-N489 PolarHBondContact NE2-OD1 3.23Å; Q485-N489 VanDerWaalsContact O-CB 3.28Å; Q485-N489 WeakPolarHBondContact O-CB 3.32Å; Q485-N489 PolarHBondContact O-N 3.33Å; Q485-N489 PolarHBondContact O-ND2 3.5Å; Q485-N489 VanDerWaalsContact O-ND2 3.12Å
486	Q	86.3	Confident	81.2	Confident	29 Å²	29	53.2 Å²	53.2	14%	0.136	28%	0.275	C	S	.	.	H	α-helix	trans	-67.5	-37.6	172.6	-71	-55.7	-55.5	0	0	112.1	Y376 N482 L483 M484 L490	Y376-Q486 HydrophobicContact CD1-CB 4.45Å; Y376-Q486 HydrophobicContact CD1-CG 4.35Å; Y376-Q486 HydrophobicContact CD2-CG 4.13Å; Y376-Q486 HydrophobicContact CE1-CB 4.45Å; Y376-Q486 HydrophobicContact CE1-CG 4.01Å; Y376-Q486 HydrophobicContact CE2-CG 3.76Å; Y376-Q486 HydrophobicContact CG-CG 4.42Å; N482-Q486 WeakPolarHBondContact O-CG 3.34Å; N482-Q486 PolarHBondContact O-N 3.48Å; L483-Q486 PolarHBondContact O-N 3.39Å; M484-Q486 VanDerWaalsContact C-N 3.32Å; M484-Q486 PolarHBondContact O-N 3.35Å; Q486-L490 WeakPolarHBondContact O-CB 3.26Å; Q486-L490 WeakPolarHBondContact O-CD1 3.47Å; Q486-L490 WeakPolarHBondContact O-CG 3.43Å; Q486-L490 PolarHBondContact O-N 3.02Å
487	A	84.5	Confident	80.1	Confident	21 Å²	21	55.5 Å²	55.5	17%	0.174	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-49.9	174.7	0	0	0	0	0	111.4	L373 L483 M484 N489 L490 V491	L373-A487 HydrophobicContact CD1-CB 3.85Å; L373-A487 HydrophobicContact CD2-CB 3.55Å; L373-A487 HydrophobicContact CG-CB 4.37Å; L483-A487 PolarHBondContact O-N 3.26Å; M484-A487 WeakPolarHBondContact O-CB 3.36Å; M484-A487 PolarHBondContact O-N 3.28Å; M484-A487 VanDerWaalsContact O-N 3.1Å; A487-N489 PolarHBondContact O-N 3.02Å; A487-L490 PolarHBondContact O-N 3.39Å; A487-V491 WeakPolarHBondContact O-CG2 3.38Å; A487-V491 PolarHBondContact O-N 2.92Å
488	E	77.9	Confident	79	Confident	97 Å²	97	52.9 Å²	52.9	45%	0.453	28%	0.276	S	S	.	.	H	α-helix	trans	-57.3	-49.1	175.7	176.9	174.7	-137.6	0	0	112	M484 Q485 L490 V491 H492	M484-E488 PolarHBondContact O-N 3.06Å; Q485-E488 PolarHBondContact NE2-OE2 3.01Å; E488-L490 VanDerWaalsContact C-N 3.31Å; E488-L490 PolarHBondContact O-N 3.39Å; E488-V491 PolarHBondContact O-N 3.06Å; E488-H492 PolarHBondContact O-CD2 3.29Å; E488-H492 PolarHBondContact O-N 2.86Å
489	N	83.1	Confident	77.6	Confident	77 Å²	77	54.3 Å²	54.3	41%	0.412	28%	0.281	S	S	.	.	H	α-helix	trans	-61.5	-36.8	178.7	-72	-20.7	0	0	0	113	Q485 A487 K493	Q485-N489 PolarHBondContact NE2-OD1 3.23Å; Q485-N489 VanDerWaalsContact O-CB 3.28Å; Q485-N489 WeakPolarHBondContact O-CB 3.32Å; Q485-N489 PolarHBondContact O-N 3.33Å; Q485-N489 PolarHBondContact O-ND2 3.5Å; Q485-N489 VanDerWaalsContact O-ND2 3.12Å; A487-N489 PolarHBondContact O-N 3.02Å; N489-K493 WeakPolarHBondContact O-CB 3.31Å; N489-K493 PolarHBondContact O-N 3.26Å; N489-K493 VanDerWaalsContact O-N 3.09Å
490	L	83.5	Confident	75.9	Confident	23 Å²	23	61.7 Å²	61.7	12%	0.12	31%	0.312	C	S	.	.	H	α-helix	trans	-69.8	-44.3	176.7	-73.9	166.4	0	0	0	111	A369 T372 L373 Q486 A487 E488 K493 C494	A369-L490 HydrophobicContact CB-CB 3.99Å; T372-L490 HydrophobicContact CG2-CD1 4.13Å; T372-L490 HydrophobicContact CG2-CD2 3.97Å; L373-L490 HydrophobicContact CB-CD1 4.02Å; L373-L490 HydrophobicContact CD1-CD1 4.48Å; Q486-L490 WeakPolarHBondContact O-CB 3.26Å; Q486-L490 WeakPolarHBondContact O-CD1 3.47Å; Q486-L490 WeakPolarHBondContact O-CG 3.43Å; Q486-L490 PolarHBondContact O-N 3.02Å; A487-L490 PolarHBondContact O-N 3.39Å; E488-L490 VanDerWaalsContact C-N 3.31Å; E488-L490 PolarHBondContact O-N 3.39Å; L490-K493 WeakPolarHBondContact O-CB 3.48Å; L490-K493 PolarHBondContact O-N 2.76Å; L490-C494 PolarHBondContact O-N 2.91Å; L490-C494 PolarHBondContact O-SG 3.19Å
491	V	75.5	Confident	74.1	Confident	41 Å²	41	63.3 Å²	63.3	25%	0.248	33%	0.325	C	S	.	.	H	α-helix	trans	-61.5	-47.1	176.1	168.9	0	0	0	0	111.6	Y366 A487 E488 K493 C494 I495	Y366-V491 HydrophobicContact CE1-CG1 4.03Å; Y366-V491 HydrophobicContact CE1-CG2 4.21Å; A487-V491 WeakPolarHBondContact O-CG2 3.38Å; A487-V491 PolarHBondContact O-N 2.92Å; E488-V491 PolarHBondContact O-N 3.06Å; V491-K493 VanDerWaalsContact C-N 3.28Å; V491-K493 PolarHBondContact O-N 3.17Å; V491-C494 WeakPolarHBondContact O-CB 3.49Å; V491-C494 PolarHBondContact O-N 3.3Å; V491-C494 VanDerWaalsContact O-N 3.16Å; V491-I495 HydrophobicContact CG1-CD1 4.19Å; V491-I495 WeakPolarHBondContact O-CG1 3.41Å; V491-I495 PolarHBondContact O-N 3.33Å; V491-I495 VanDerWaalsContact O-N 3.17Å
492	H	75.9	Confident	72.3	Confident	97 Å²	97	65.3 Å²	65.3	45%	0.449	33%	0.33	S	S	.	.	H	α-helix	trans	-60.7	-36.6	175	-86.6	-66.8	0	0	0	112.7	E488 I495 N496	E488-H492 PolarHBondContact O-CD2 3.29Å; E488-H492 PolarHBondContact O-N 2.86Å; H492-I495 PolarHBondContact O-N 3.5Å; H492-N496 WeakPolarHBondContact O-CB 2.92Å; H492-N496 PolarHBondContact O-N 3.24Å; H492-N496 PolarHBondContact O-ND2 2.83Å
493	K	77.4	Confident	69.8	Low	100 Å²	100	70 Å²	70	44%	0.435	35%	0.354	S	S	.	.	H	α-helix	trans	-63.3	-44.2	174.6	-169.8	-176.1	176.3	-162.2	0	111.4	N489 L490 V491 I495 N496 D497	N489-K493 WeakPolarHBondContact O-CB 3.31Å; N489-K493 PolarHBondContact O-N 3.26Å; N489-K493 VanDerWaalsContact O-N 3.09Å; L490-K493 WeakPolarHBondContact O-CB 3.48Å; L490-K493 PolarHBondContact O-N 2.76Å; V491-K493 VanDerWaalsContact C-N 3.28Å; V491-K493 PolarHBondContact O-N 3.17Å; K493-I495 VanDerWaalsContact C-N 3.3Å; K493-I495 PolarHBondContact O-N 3.03Å; K493-N496 PolarHBondContact O-N 2.92Å; K493-D497 WeakPolarHBondContact CE-OD2 3.36Å; K493-D497 WeakPolarHBondContact CG-OD2 3.3Å; K493-D497 IonicContact NZ-OD2 2.65Å; K493-D497 WeakPolarHBondContact O-CB 3.36Å; K493-D497 PolarHBondContact O-N 3.43Å
494	C	71.5	Confident	67	Low	9 Å²	9	74.7 Å²	74.7	6%	0.061	39%	0.387	C	S	.	.	H	α-helix	trans	-57.7	-41.5	176.7	-62.4	0	0	0	0	112.8	N365 A369 L490 V491 T498	N365-C494 VanDerWaalsContact C-SG 3.6Å; N365-C494 HydrophobicContact CB-CB 4.07Å; N365-C494 PolarHBondContact O-SG 3.43Å; A369-C494 WeakPolarHBondContact CB-SG 3.49Å; L490-C494 PolarHBondContact O-N 2.91Å; L490-C494 PolarHBondContact O-SG 3.19Å; V491-C494 WeakPolarHBondContact O-CB 3.49Å; V491-C494 PolarHBondContact O-N 3.3Å; V491-C494 VanDerWaalsContact O-N 3.16Å; C494-T498 WeakPolarHBondContact O-CB 3.28Å; C494-T498 PolarHBondContact O-N 3.03Å; C494-T498 PolarHBondContact O-OG1 3.04Å
495	I	66.9	Low	64.7	Low	62 Å²	62	75.8 Å²	75.8	32%	0.318	39%	0.393	S	S	.	.	H	α-helix	trans	-64.7	-54.4	177.7	-63.7	165.9	0	0	0	109.7	V491 H492 K493 D497 T498 E499	V491-I495 HydrophobicContact CG1-CD1 4.19Å; V491-I495 WeakPolarHBondContact O-CG1 3.41Å; V491-I495 PolarHBondContact O-N 3.33Å; V491-I495 VanDerWaalsContact O-N 3.17Å; H492-I495 PolarHBondContact O-N 3.5Å; K493-I495 VanDerWaalsContact C-N 3.3Å; K493-I495 PolarHBondContact O-N 3.03Å; I495-D497 PolarHBondContact O-N 3.39Å; I495-T498 WeakPolarHBondContact O-CB 3.45Å; I495-T498 PolarHBondContact O-N 2.96Å; I495-T498 VanDerWaalsContact O-N 3.13Å; I495-E499 PolarHBondContact O-N 3.16Å
496	N	68.5	Low	62.5	Low	72 Å²	72	78.9 Å²	78.9	39%	0.385	41%	0.407	S	S	.	.	H	α-helix	trans	-64.8	-36.5	-176.3	-66	-10.2	0	0	0	113.5	H492 K493 T498 E499 K500	H492-N496 WeakPolarHBondContact O-CB 2.92Å; H492-N496 PolarHBondContact O-N 3.24Å; H492-N496 PolarHBondContact O-ND2 2.83Å; K493-N496 PolarHBondContact O-N 2.92Å; N496-T498 VanDerWaalsContact C-N 3.31Å; N496-E499 PolarHBondContact O-N 3.22Å; N496-K500 WeakPolarHBondContact O-CG 3.45Å; N496-K500 PolarHBondContact O-N 2.8Å; N496-K500 VanDerWaalsContact O-N 3.08Å
497	D	63.5	Low	60.1	Low	60 Å²	60	83.8 Å²	83.8	32%	0.321	44%	0.442	S	S	.	.	H	α-helix	trans	-69	-34.1	176.6	-73.9	-7.6	0	0	0	110.6	K493 I495 K500 S501	K493-D497 WeakPolarHBondContact CE-OD2 3.36Å; K493-D497 WeakPolarHBondContact CG-OD2 3.3Å; K493-D497 IonicContact NZ-OD2 2.65Å; K493-D497 WeakPolarHBondContact O-CB 3.36Å; K493-D497 PolarHBondContact O-N 3.43Å; I495-D497 PolarHBondContact O-N 3.39Å; D497-K500 PolarHBondContact O-N 2.84Å; D497-S501 VanDerWaalsContact O-CB 3.29Å; D497-S501 WeakPolarHBondContact O-CB 3.44Å; D497-S501 PolarHBondContact O-N 2.89Å; D497-S501 PolarHBondContact O-OG 3.25Å
498	T	58.3	Low	58.2	Low	24 Å²	24	86.3 Å²	86.3	15%	0.147	47%	0.47	C	S	.	.	H	α-helix	trans	-65.6	-47.1	173.7	-53.5	0	0	0	0	110.9	L362 N365 C494 I495 N496 K500 S501	L362-T498 HydrophobicContact CD1-CG2 4.37Å; L362-T498 WeakPolarHBondContact CD1-OG1 3.19Å; N365-T498 PolarHBondContact ND2-OG1 3.17Å; C494-T498 WeakPolarHBondContact O-CB 3.28Å; C494-T498 PolarHBondContact O-N 3.03Å; C494-T498 PolarHBondContact O-OG1 3.04Å; I495-T498 WeakPolarHBondContact O-CB 3.45Å; I495-T498 PolarHBondContact O-N 2.96Å; I495-T498 VanDerWaalsContact O-N 3.13Å; N496-T498 VanDerWaalsContact C-N 3.31Å; T498-K500 VanDerWaalsContact C-N 3.33Å; T498-K500 PolarHBondContact O-N 3.23Å; T498-S501 WeakPolarHBondContact CA-OG 3.32Å; T498-S501 PolarHBondContact O-N 3.17Å; T498-S501 VanDerWaalsContact O-N 3.08Å; T498-S501 PolarHBondContact O-OG 3.09Å
499	E	54.1	Low	56.5	Low	117 Å²	117	86.5 Å²	86.5	55%	0.547	48%	0.481	S	S	.	.	H	α-helix	trans	-58.9	-41.2	176.6	-70.1	-177.8	166.5	0	0	112.7	I495 N496 S501 N502	I495-E499 PolarHBondContact O-N 3.16Å; N496-E499 PolarHBondContact O-N 3.22Å; E499-S501 VanDerWaalsContact C-N 3.32Å; E499-N502 WeakPolarHBondContact O-CB 3.45Å; E499-N502 PolarHBondContact O-N 3.35Å
500	K	52.9	Low	54.9	Low	166 Å²	166	90.4 Å²	90.4	72%	0.722	50%	0.502	S	S	*	.	H	α-helix	trans	-72.4	-24.2	176.3	-71.1	174.1	-177.7	177.7	0	113.5	N496 D497 T498 N502	N496-K500 WeakPolarHBondContact O-CG 3.45Å; N496-K500 PolarHBondContact O-N 2.8Å; N496-K500 VanDerWaalsContact O-N 3.08Å; D497-K500 PolarHBondContact O-N 2.84Å; T498-K500 VanDerWaalsContact C-N 3.33Å; T498-K500 PolarHBondContact O-N 3.23Å; K500-N502 PolarHBondContact O-N 3.42Å
501	S	49.2	Very low	53.6	Low	50 Å²	50	92.2 Å²	92.2	35%	0.35	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	3.1	177.7	74.2	0	0	0	0	114.3	D497 T498 E499 I503	D497-S501 VanDerWaalsContact O-CB 3.29Å; D497-S501 WeakPolarHBondContact O-CB 3.44Å; D497-S501 PolarHBondContact O-N 2.89Å; D497-S501 PolarHBondContact O-OG 3.25Å; T498-S501 WeakPolarHBondContact CA-OG 3.32Å; T498-S501 PolarHBondContact O-N 3.17Å; T498-S501 VanDerWaalsContact O-N 3.08Å; T498-S501 PolarHBondContact O-OG 3.09Å; E499-S501 VanDerWaalsContact C-N 3.32Å; S501-I503 PolarHBondContact O-N 3.35Å
502	N	44	Very low	52.7	Low	118 Å²	118	93 Å²	93	63%	0.631	52%	0.519	S	S	*	.			trans	-67.6	40.6	170.8	-80.7	-33.8	0	0	0	113.9	E499 K500 S504	E499-N502 WeakPolarHBondContact O-CB 3.45Å; E499-N502 PolarHBondContact O-N 3.35Å; K500-N502 PolarHBondContact O-N 3.42Å; N502-S504 PolarHBondContact O-N 3.49Å
503	I	34.2	Very low	51.3	Low	148 Å²	148	93.4 Å²	93.4	76%	0.759	53%	0.529	S	S	*	.	S	Bend	trans	-70.3	83.5	161.6	-56	175.2	0	0	0	107.2	S501 I505	S501-I503 PolarHBondContact O-N 3.35Å; I503-I505 PolarHBondContact O-N 3.02Å
504	S	32	Very low	50.6	Low	99 Å²	99	91.5 Å²	91.5	69%	0.692	53%	0.532	S	S	*	.			trans	51.2	51.6	162.2	-173.9	0	0	0	0	116.3	N502 Q506	N502-S504 PolarHBondContact O-N 3.49Å; S504-Q506 PolarHBondContact O-N 2.87Å; S504-Q506 VanDerWaalsContact O-N 3.09Å
505	I	37.8	Very low	50.2	Low	99 Å²	99	94.4 Å²	94.4	51%	0.508	55%	0.545	S	S	.	.			trans	-78.7	91.7	161.7	-55.1	-177.9	0	0	0	107.9	I503	I503-I505 PolarHBondContact O-N 3.02Å
506	Q	35.3	Very low	49.4	Very low	147 Å²	147	93.4 Å²	93.4	69%	0.687	54%	0.539	S	S	*	.			trans	-60.6	140.5	163.2	-74.6	-168.4	-11.1	0	0	109.3	S504 G508 C509	S504-Q506 PolarHBondContact O-N 2.87Å; S504-Q506 VanDerWaalsContact O-N 3.09Å; Q506-G508 PolarHBondContact O-N 3.23Å; Q506-G508 VanDerWaalsContact O-N 3.12Å; Q506-C509 PolarHBondContact O-N 3.03Å
507	P	36.1	Very low	49.1	Very low	133 Å²	133	94.6 Å²	94.6	86%	0.864	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	117.2	176.9	25.5	-33.1	0	0	0	109.9
508	G	45.5	Very low	49.3	Very low	74 Å²	74	96.7 Å²	96.7	76%	0.763	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	120	-0.2	179.2	0	0	0	0	0	116.5	Q506 N510	Q506-G508 PolarHBondContact O-N 3.23Å; Q506-G508 VanDerWaalsContact O-N 3.12Å; G508-N510 PolarHBondContact O-N 3.13Å
509	C	42	Very low	49.2	Very low	100 Å²	100	99.7 Å²	99.7	68%	0.676	56%	0.563	S	S	*	*			trans	-81.8	101	-179.1	-152.6	0	0	0	0	112.7	Q506 I511	Q506-C509 PolarHBondContact O-N 3.03Å; C509-I511 PolarHBondContact O-N 3.36Å
510	N	49.8	Very low	49.2	Very low	160 Å²	160	95 Å²	95	86%	0.856	54%	0.542	S	S	*	.			trans	-68.2	108.7	172.9	-75.7	-37.1	0	0	0	111.1	G508 S512	G508-N510 PolarHBondContact O-N 3.13Å; N510-S512 PolarHBondContact O-N 2.9Å
511	I	56.1	Low	49.8	Very low	60 Å²	60	90.8 Å²	90.8	31%	0.308	53%	0.527	S	S	.	.			trans	-63.6	128.7	166.7	-75.3	171.2	0	0	0	109.1	C509 E515 F516 R519	C509-I511 PolarHBondContact O-N 3.36Å; I511-E515 HydrophobicContact CG2-CB 4.04Å; I511-E515 HydrophobicContact CG2-CG 3.93Å; I511-F516 HydrophobicContact CG2-CB 3.92Å; I511-R519 VanDerWaalsContact CD1-NH1 3.34Å
512	S	56.1	Low	50.7	Low	59 Å²	59	95.5 Å²	95.5	41%	0.413	54%	0.541	S	S	.	.			trans	-70	151.6	175.4	79.5	0	0	0	0	110.9	N510 A514 E515 F516	N510-S512 PolarHBondContact O-N 2.9Å; S512-A514 PolarHBondContact O-N 3.06Å; S512-A514 VanDerWaalsContact O-N 3.11Å; S512-E515 PolarHBondContact O-N 3.03Å; S512-E515 VanDerWaalsContact O-N 3.09Å; S512-E515 PolarHBondContact OG-N 3.15Å; S512-F516 PolarHBondContact O-N 2.8Å
513	P	46.4	Very low	50.9	Low	104 Å²	104	92.3 Å²	92.3	68%	0.675	52%	0.524	S	S	*	.	H	α-helix	trans	-55.1	-30	175.4	-28.3	36.1	0	0	0	113.9	I517	P513-I517 WeakPolarHBondContact O-CD1 3.48Å; P513-I517 VanDerWaalsContact O-CG1 3.25Å; P513-I517 WeakPolarHBondContact O-CG1 3.44Å; P513-I517 PolarHBondContact O-N 3.45Å; P513-I517 VanDerWaalsContact O-N 3.08Å
514	A	63	Low	52.1	Low	60 Å²	60	90.8 Å²	90.8	50%	0.496	51%	0.512	S	S	.	.	H	α-helix	trans	-69.9	-46.5	175.7	0	0	0	0	0	112.3	S512 F516 I517 I518	S512-A514 PolarHBondContact O-N 3.06Å; S512-A514 VanDerWaalsContact O-N 3.11Å; A514-F516 VanDerWaalsContact C-N 3.31Å; A514-F516 PolarHBondContact O-N 3.35Å; A514-I517 PolarHBondContact O-N 2.72Å; A514-I518 WeakPolarHBondContact O-CG1 3.33Å; A514-I518 PolarHBondContact O-N 3.18Å
515	E	63.1	Low	53.6	Low	70 Å²	70	89.2 Å²	89.2	33%	0.327	50%	0.501	S	S	.	.	H	α-helix	trans	-63	-38.2	175.6	173.6	63.4	-168.7	0	0	111.3	I511 S512 I518 R519	I511-E515 HydrophobicContact CG2-CB 4.04Å; I511-E515 HydrophobicContact CG2-CG 3.93Å; S512-E515 PolarHBondContact O-N 3.03Å; S512-E515 VanDerWaalsContact O-N 3.09Å; S512-E515 PolarHBondContact OG-N 3.15Å; E515-I518 PolarHBondContact O-N 3.44Å; E515-R519 WeakPolarHBondContact O-CG 3.44Å; E515-R519 PolarHBondContact O-N 3.28Å; E515-R519 IonicContact OE1-CZ 2.72Å; E515-R519 VanDerWaalsContact OE1-CZ 3.3Å; E515-R519 IonicContact OE1-NE 2.71Å; E515-R519 PolarHBondContact OE1-NE 2.83Å; E515-R519 IonicContact OE1-NH2 2.69Å; E515-R519 PolarHBondContact OE1-NH2 3.4Å
516	F	50.1	Low	54.2	Low	42 Å²	42	88.7 Å²	88.7	18%	0.184	50%	0.499	C	S	.	.	H	α-helix	trans	-58.9	-47.7	171.9	171.7	-90.6	0	0	0	112.3	I360 I364 I511 S512 A514 I518 R519 V520	I360-F516 HydrophobicContact CD1-CD2 4.09Å; I360-F516 HydrophobicContact CD1-CE2 3.54Å; I360-F516 HydrophobicContact CD1-CZ 4.43Å; I360-F516 HydrophobicContact CG1-CE2 4.26Å; I364-F516 HydrophobicContact CD1-CD2 3.99Å; I364-F516 HydrophobicContact CD1-CE2 3.38Å; I364-F516 HydrophobicContact CD1-CZ 4.16Å; I364-F516 HydrophobicContact CG1-CE2 4.17Å; I511-F516 HydrophobicContact CG2-CB 3.92Å; S512-F516 PolarHBondContact O-N 2.8Å; A514-F516 VanDerWaalsContact C-N 3.31Å; A514-F516 PolarHBondContact O-N 3.35Å; F516-I518 PolarHBondContact O-N 3.26Å; F516-R519 PolarHBondContact O-N 3.17Å; F516-V520 HydrophobicContact CD1-CG2 4.37Å; F516-V520 HydrophobicContact CE1-CG2 4.03Å; F516-V520 HydrophobicContact CE2-CG2 4.25Å; F516-V520 HydrophobicContact CZ-CG2 3.97Å; F516-V520 WeakPolarHBondContact O-CG2 3.4Å; F516-V520 PolarHBondContact O-N 3.31Å
517	I	60.8	Low	54.7	Low	96 Å²	96	83.4 Å²	83.4	49%	0.492	48%	0.475	S	S	.	.	H	α-helix	trans	-60.6	-45.9	177.9	-70.9	163.2	0	0	0	110.6	P513 A514 R519 V520 D521	P513-I517 WeakPolarHBondContact O-CD1 3.48Å; P513-I517 VanDerWaalsContact O-CG1 3.25Å; P513-I517 WeakPolarHBondContact O-CG1 3.44Å; P513-I517 PolarHBondContact O-N 3.45Å; P513-I517 VanDerWaalsContact O-N 3.08Å; A514-I517 PolarHBondContact O-N 2.72Å; I517-R519 VanDerWaalsContact C-N 3.35Å; I517-R519 PolarHBondContact O-N 3.11Å; I517-V520 PolarHBondContact O-N 2.79Å; I517-D521 PolarHBondContact O-N 3.46Å
518	I	67.9	Low	55.6	Low	105 Å²	105	85 Å²	85	54%	0.538	47%	0.465	S	S	.	.	H	α-helix	trans	-58.3	-44.7	178.5	-68.2	165.1	0	0	0	111.3	A514 E515 F516 K522	A514-I518 WeakPolarHBondContact O-CG1 3.33Å; A514-I518 PolarHBondContact O-N 3.18Å; E515-I518 PolarHBondContact O-N 3.44Å; F516-I518 PolarHBondContact O-N 3.26Å; I518-K522 VanDerWaalsContact O-CB 3.3Å; I518-K522 WeakPolarHBondContact O-CB 3.22Å; I518-K522 PolarHBondContact O-N 3.14Å
519	R	56.9	Low	55.8	Low	87 Å²	87	87.2 Å²	87.2	33%	0.328	46%	0.455	S	S	.	.	H	α-helix	trans	-64.4	-45.6	177.2	-71.4	179.5	-172.4	-156.8	2.1	112.4	D361 I511 E515 F516 I517 D521 K522 L523	D361-R519 IonicContact OD2-NH1 3.91Å; D361-R519 PolarHBondContact OD2-NH1 3.19Å; I511-R519 VanDerWaalsContact CD1-NH1 3.34Å; E515-R519 WeakPolarHBondContact O-CG 3.44Å; E515-R519 PolarHBondContact O-N 3.28Å; E515-R519 IonicContact OE1-CZ 2.72Å; E515-R519 VanDerWaalsContact OE1-CZ 3.3Å; E515-R519 IonicContact OE1-NE 2.71Å; E515-R519 PolarHBondContact OE1-NE 2.83Å; E515-R519 IonicContact OE1-NH2 2.69Å; E515-R519 PolarHBondContact OE1-NH2 3.4Å; F516-R519 PolarHBondContact O-N 3.17Å; I517-R519 VanDerWaalsContact C-N 3.35Å; I517-R519 PolarHBondContact O-N 3.11Å; R519-D521 PolarHBondContact O-N 3.27Å; R519-K522 PolarHBondContact O-N 3.48Å; R519-L523 WeakPolarHBondContact O-CB 3.26Å; R519-L523 WeakPolarHBondContact O-CG 3.35Å; R519-L523 PolarHBondContact O-N 3.41Å
520	V	55.2	Low	55.7	Low	19 Å²	19	85 Å²	85	12%	0.115	44%	0.439	C	S	.	.	H	α-helix	trans	-60.8	-44.5	178.3	167.5	0	0	0	0	111.2	I364 F516 I517 L523 K524	I364-V520 HydrophobicContact CD1-CG2 4.15Å; I364-V520 HydrophobicContact CG2-CG2 4.23Å; F516-V520 HydrophobicContact CD1-CG2 4.37Å; F516-V520 HydrophobicContact CE1-CG2 4.03Å; F516-V520 HydrophobicContact CE2-CG2 4.25Å; F516-V520 HydrophobicContact CZ-CG2 3.97Å; F516-V520 WeakPolarHBondContact O-CG2 3.4Å; F516-V520 PolarHBondContact O-N 3.31Å; I517-V520 PolarHBondContact O-N 2.79Å; V520-L523 PolarHBondContact O-N 3.44Å; V520-K524 HydrophobicContact CG1-CD 4.47Å; V520-K524 WeakPolarHBondContact O-CG 3.44Å; V520-K524 PolarHBondContact O-N 2.88Å
521	D	65.3	Low	55.5	Low	76 Å²	76	82.1 Å²	82.1	41%	0.406	42%	0.419	S	S	.	.	H	α-helix	trans	-73.9	-34	-179.1	-72.3	-18.9	0	0	0	112.6	I517 R519 L523 K524 S525	I517-D521 PolarHBondContact O-N 3.46Å; R519-D521 PolarHBondContact O-N 3.27Å; D521-L523 PolarHBondContact O-N 3.09Å; D521-K524 PolarHBondContact O-N 3.46Å; D521-K524 WeakPolarHBondContact OD1-CD 3.26Å; D521-K524 IonicContact OD1-NZ 2.63Å; D521-K524 PolarHBondContact OD1-NZ 3.07Å; D521-S525 PolarHBondContact O-N 3.37Å
522	K	67.5	Low	54.9	Low	149 Å²	149	89.2 Å²	89.2	65%	0.648	44%	0.442	S	S	*	.	H	α-helix	trans	-61.4	-42.9	170.1	-171.1	173.1	-176.1	176.9	0	111.7	I518 R519 S525 L526	I518-K522 VanDerWaalsContact O-CB 3.3Å; I518-K522 WeakPolarHBondContact O-CB 3.22Å; I518-K522 PolarHBondContact O-N 3.14Å; R519-K522 PolarHBondContact O-N 3.48Å; K522-S525 PolarHBondContact O-N 2.86Å; K522-L526 WeakPolarHBondContact O-CG 3.39Å; K522-L526 PolarHBondContact O-N 3.36Å
523	L	48.8	Very low	54	Low	51 Å²	51	91.5 Å²	91.5	27%	0.267	46%	0.456	S	S	.	.	H	α-helix	trans	-64.1	-45.7	174.3	-79.5	166	0	0	0	112.1	I364 I368 R519 V520 D521 S525 L526 L527	I364-L523 HydrophobicContact CG2-CD1 4.33Å; I368-L523 HydrophobicContact CD1-CB 3.74Å; I368-L523 HydrophobicContact CD1-CD1 3.96Å; I368-L523 HydrophobicContact CD1-CG 4.32Å; R519-L523 WeakPolarHBondContact O-CB 3.26Å; R519-L523 WeakPolarHBondContact O-CG 3.35Å; R519-L523 PolarHBondContact O-N 3.41Å; V520-L523 PolarHBondContact O-N 3.44Å; D521-L523 PolarHBondContact O-N 3.09Å; L523-S525 VanDerWaalsContact C-N 3.28Å; L523-S525 PolarHBondContact O-N 3.22Å; L523-L526 PolarHBondContact O-N 2.91Å; L523-L527 WeakPolarHBondContact O-CD1 3.42Å; L523-L527 VanDerWaalsContact O-CG 3.23Å; L523-L527 WeakPolarHBondContact O-CG 3.36Å; L523-L527 PolarHBondContact O-N 2.98Å
524	K	57.9	Low	53.5	Low	116 Å²	116	93.6 Å²	93.6	50%	0.504	45%	0.451	S	S	.	.	H	α-helix	trans	-54.4	-43.4	173.6	-74.2	175.4	-166.3	155.6	0	112.2	V520 D521 L527 Y528	V520-K524 HydrophobicContact CG1-CD 4.47Å; V520-K524 WeakPolarHBondContact O-CG 3.44Å; V520-K524 PolarHBondContact O-N 2.88Å; D521-K524 PolarHBondContact O-N 3.46Å; D521-K524 WeakPolarHBondContact OD1-CD 3.26Å; D521-K524 IonicContact OD1-NZ 2.63Å; D521-K524 PolarHBondContact OD1-NZ 3.07Å; K524-L527 PolarHBondContact O-N 3.32Å; K524-Y528 PolarHBondContact O-N 3.47Å
525	S	64.3	Low	52.1	Low	67 Å²	67	96.4 Å²	96.4	47%	0.469	46%	0.462	S	S	.	.	H	α-helix	trans	-60.7	-50.7	178.6	-167.5	0	0	0	0	112.1	D521 K522 L523 L527 Y528 E529	D521-S525 PolarHBondContact O-N 3.37Å; K522-S525 PolarHBondContact O-N 2.86Å; L523-S525 VanDerWaalsContact C-N 3.28Å; L523-S525 PolarHBondContact O-N 3.22Å; S525-L527 VanDerWaalsContact C-N 3.28Å; S525-L527 PolarHBondContact O-N 3Å; S525-Y528 WeakPolarHBondContact O-CB 3.49Å; S525-Y528 PolarHBondContact O-N 3.21Å; S525-E529 PolarHBondContact O-N 2.87Å
526	L	50	Low	50.4	Low	88 Å²	88	101.3 Å²	101.3	46%	0.461	49%	0.485	S	S	.	.	H	α-helix	trans	-60.5	-35.5	178.7	-68.2	168.4	0	0	0	112.9	K522 L523 T530	K522-L526 WeakPolarHBondContact O-CG 3.39Å; K522-L526 PolarHBondContact O-N 3.36Å; L523-L526 PolarHBondContact O-N 2.91Å; L526-T530 PolarHBondContact O-N 3.4Å; L526-T530 PolarHBondContact O-OG1 3.11Å
527	L	45.8	Very low	49.5	Very low	36 Å²	36	110 Å²	110	19%	0.188	52%	0.516	C	S	.	.	H	α-helix	trans	-69.5	-37.8	174.6	-64.9	159.2	0	0	0	111.8	I368 L523 K524 S525 T530 K531	I368-L527 HydrophobicContact CB-CD1 4.03Å; I368-L527 HydrophobicContact CD1-CD1 3.96Å; I368-L527 HydrophobicContact CG1-CD1 3.7Å; I368-L527 HydrophobicContact CG2-CD1 3.34Å; I368-L527 HydrophobicContact CG2-CD2 3.63Å; I368-L527 HydrophobicContact CG2-CG 4.06Å; L523-L527 WeakPolarHBondContact O-CD1 3.42Å; L523-L527 VanDerWaalsContact O-CG 3.23Å; L523-L527 WeakPolarHBondContact O-CG 3.36Å; L523-L527 PolarHBondContact O-N 2.98Å; K524-L527 PolarHBondContact O-N 3.32Å; S525-L527 VanDerWaalsContact C-N 3.28Å; S525-L527 PolarHBondContact O-N 3Å; L527-T530 WeakPolarHBondContact O-CB 3.49Å; L527-T530 PolarHBondContact O-N 3.2Å; L527-K531 WeakPolarHBondContact O-CG 3.45Å; L527-K531 PolarHBondContact O-N 2.95Å
528	Y	55.1	Low	47.9	Very low	167 Å²	167	111.9 Å²	111.9	66%	0.655	53%	0.532	S	S	*	.	H	α-helix	trans	-66.3	-39.7	177.7	-159.6	-92.5	0	0	0	111.8	K524 S525 K531 R532	K524-Y528 PolarHBondContact O-N 3.47Å; S525-Y528 WeakPolarHBondContact O-CB 3.49Å; S525-Y528 PolarHBondContact O-N 3.21Å; Y528-K531 WeakPolarHBondContact O-CB 3.34Å; Y528-K531 PolarHBondContact O-N 3.17Å; Y528-R532 PolarHBondContact O-N 2.87Å
529	E	49.6	Very low	46.1	Very low	119 Å²	119	114.9 Å²	114.9	56%	0.556	54%	0.538	S	S	*	.	H	α-helix	trans	-62	-43.6	169.4	-67.9	-175.1	151.9	0	0	111.7	S525 K531 R532 C533	S525-E529 PolarHBondContact O-N 2.87Å; E529-K531 VanDerWaalsContact C-N 3.28Å; E529-K531 PolarHBondContact O-N 3.41Å; E529-R532 WeakPolarHBondContact O-CB 3.2Å; E529-R532 PolarHBondContact O-N 3.45Å; E529-C533 PolarHBondContact O-N 3.07Å
530	T	39.6	Very low	44.7	Very low	55 Å²	55	119.8 Å²	119.8	34%	0.337	57%	0.565	S	S	.	*	H	α-helix	trans	-62.1	-34.2	177.4	-52.4	0	0	0	0	112.3	L526 L527 R532	L526-T530 PolarHBondContact O-N 3.4Å; L526-T530 PolarHBondContact O-OG1 3.11Å; L527-T530 WeakPolarHBondContact O-CB 3.49Å; L527-T530 PolarHBondContact O-N 3.2Å; T530-R532 VanDerWaalsContact C-N 3.31Å; T530-R532 PolarHBondContact O-N 3Å
531	K	46.1	Very low	43.4	Very low	98 Å²	98	124 Å²	124	43%	0.426	59%	0.59	S	S	.	*	H	α-helix	trans	-63.2	-34.9	172.2	-75.7	179.2	175.6	-176.1	0	112.2	H375 L527 Y528 E529	H375-K531 PolarHBondContact CD2-NZ 3.31Å; H375-K531 PolarHBondContact NE2-NZ 3.12Å; L527-K531 WeakPolarHBondContact O-CG 3.45Å; L527-K531 PolarHBondContact O-N 2.95Å; Y528-K531 WeakPolarHBondContact O-CB 3.34Å; Y528-K531 PolarHBondContact O-N 3.17Å; E529-K531 VanDerWaalsContact C-N 3.28Å; E529-K531 PolarHBondContact O-N 3.41Å
532	R	43.9	Very low	41.7	Very low	210 Å²	210	126 Å²	126	79%	0.792	61%	0.607	S	S	*	*	H	α-helix	trans	-74.1	-27.4	-177.4	-152.3	174.1	-170.6	166.6	2.3	113.3	Y528 E529 T530	Y528-R532 PolarHBondContact O-N 2.87Å; E529-R532 WeakPolarHBondContact O-CB 3.2Å; E529-R532 PolarHBondContact O-N 3.45Å; T530-R532 VanDerWaalsContact C-N 3.31Å; T530-R532 PolarHBondContact O-N 3Å
533	C	36.4	Very low	39.9	Very low	106 Å²	106	126.8 Å²	126.8	72%	0.716	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	4.3	-173.1	-63.4	0	0	0	0	115.7	E529	E529-C533 PolarHBondContact O-N 3.07Å
534	R	36.7	Very low	39	Very low	148 Å²	148	127.5 Å²	127.5	56%	0.558	64%	0.639	S	S	*	*			trans	-111.3	52.3	-174.4	-73.5	-174.3	172.7	-161	-1.7	114.6
535	T	33.1	Very low	37.5	Very low	119 Å²	119	128 Å²	128	73%	0.73	65%	0.646	S	S	*	*	S	Bend	trans	-109.8	-14.5	170.6	46.6	0	0	0	0	114.7
536	H	28.5	Very low	35.6	Very low	174 Å²	174	131.1 Å²	131.1	81%	0.806	66%	0.657	S	S	*	*			trans	-121.9	92.4	177	-75.6	-74.4	0	0	0	112.6
537	R	29.8	Very low	34.6	Very low	223 Å²	223	137.5 Å²	137.5	84%	0.842	68%	0.676	S	S	*	*			trans	-148.3	101.3	148.9	-100.3	-174.2	-167.2	-168.6	2	109.4
538	T	28.2	Very low	33.7	Very low	136 Å²	136	143.7 Å²	143.7	83%	0.834	70%	0.703	S	S	*	*			trans	-60.6	137.1	164.1	-10.3	0	0	0	0	108.6
539	Y	30.5	Very low	32.4	Very low	169 Å²	169	144.4 Å²	144.4	66%	0.663	71%	0.713	S	S	*	*			trans	-109.4	121.5	163.5	-84.3	-92.7	0	0	0	106.8
540	E	27.1	Very low	31.3	Very low	189 Å²	189	147.9 Å²	147.9	88%	0.883	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-67.4	132.9	177.4	-66.5	176.2	162.7	0	0	109.7
541	V	27.4	Very low	30.7	Very low	107 Å²	107	150.5 Å²	150.5	65%	0.648	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-79.7	135.4	168.9	178.2	0	0	0	0	107	N543	V541-N543 PolarHBondContact O-N 2.89Å
542	P	29.9	Very low	30	Very low	118 Å²	118	152.6 Å²	152.6	77%	0.766	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-53.4	128.4	176.4	-27.6	35.4	0	0	0	112	G544	P542-G544 PolarHBondContact O-N 2.94Å
543	N	28.4	Very low	29.1	Very low	167 Å²	167	154.2 Å²	154.2	89%	0.893	78%	0.777	S	S	*	*	S	Bend	trans	-63.1	91.7	-177	-71.4	-22.4	0	0	0	111.6	V541	V541-N543 PolarHBondContact O-N 2.89Å
544	G	30.1	Very low	28.7	Very low	66 Å²	66	154.1 Å²	154.1	68%	0.68	78%	0.777	S	S	*	*	S	Bend	trans	-157.8	4.8	176	0	0	0	0	0	114.4	P542	P542-G544 PolarHBondContact O-N 2.94Å
545	L	26.9	Very low	28.5	Very low	126 Å²	126	152.3 Å²	152.3	66%	0.66	78%	0.779	S	S	*	*	S	Bend	trans	-138.7	77.5	176.9	-86.5	160.9	0	0	0	107.9	W547	L545-W547 PolarHBondContact O-N 3.05Å; L545-W547 VanDerWaalsContact O-N 3.07Å
546	N	25.7	Very low	28.3	Very low	133 Å²	133	154.6 Å²	154.6	71%	0.711	78%	0.779	S	S	*	*			trans	-63.1	110	175.3	-72.6	4.7	0	0	0	109.4
547	W	27.5	Very low	28.5	Very low	222 Å²	222	153 Å²	153	84%	0.841	78%	0.776	S	S	*	*			trans	-86.3	97.7	154.3	-69.1	90.1	0	0	0	106.4	L545 E549	L545-W547 PolarHBondContact O-N 3.05Å; L545-W547 VanDerWaalsContact O-N 3.07Å; W547-E549 PolarHBondContact O-N 2.73Å; W547-E549 VanDerWaalsContact O-N 3.09Å
548	E	27.8	Very low	28.5	Very low	165 Å²	165	149 Å²	149	77%	0.771	77%	0.771	S	S	*	*			trans	-71.9	99.6	167.7	-73	-179.5	161.6	0	0	108.1	E550	E548-E550 PolarHBondContact O-N 2.84Å
549	E	27.1	Very low	28.6	Very low	182 Å²	182	149.8 Å²	149.8	85%	0.85	77%	0.77	S	S	*	*			trans	-70.8	98.5	158	-72.9	-174.8	142.9	0	0	107.6	W547 S551	W547-E549 PolarHBondContact O-N 2.73Å; W547-E549 VanDerWaalsContact O-N 3.09Å; E549-S551 VanDerWaalsContact C-N 3.34Å; E549-S551 PolarHBondContact O-N 3.08Å
550	E	27.4	Very low	28.6	Very low	192 Å²	192	146.6 Å²	146.6	90%	0.897	77%	0.769	S	S	*	*			trans	-63.1	97.6	166.6	-84.4	-171.5	132.5	0	0	109.5	E548	E548-E550 PolarHBondContact O-N 2.84Å
551	S	26.2	Very low	28.6	Very low	110 Å²	110	144.9 Å²	144.9	77%	0.769	77%	0.765	S	S	*	*			trans	-114.3	109.8	159.5	81.2	0	0	0	0	109.1	E549	E549-S551 VanDerWaalsContact C-N 3.34Å; E549-S551 PolarHBondContact O-N 3.08Å
552	T	30.9	Very low	28.7	Very low	142 Å²	142	146.6 Å²	146.6	87%	0.871	77%	0.766	S	S	*	*			trans	-116.5	123	164.2	44.5	0	0	0	0	108.5
553	R	25.8	Very low	28.6	Very low	245 Å²	245	148.4 Å²	148.4	93%	0.925	77%	0.765	S	S	*	*			trans	-98.6	164.1	175	-105.3	179.7	170.6	176.5	-2.3	109.2
554	S	28.6	Very low	28.6	Very low	103 Å²	103	145.7 Å²	145.7	72%	0.72	76%	0.759	S	S	*	*			trans	77.1	137.1	177	141.5	0	0	0	0	113.7
555	D	30.8	Very low	28.6	Very low	111 Å²	111	148.2 Å²	148.2	59%	0.594	76%	0.763	S	S	*	*			cis	-147.4	151.4	1.6	-110	-59.1	0	0	0	112.8
556	K	29.6	Very low	28.7	Very low	167 Å²	167	147.9 Å²	147.9	73%	0.726	77%	0.766	S	S	*	*			trans	18.1	117.7	149.9	-59.1	157.4	-169.6	157.9	0	119.5
557	N	32.7	Very low	28.8	Very low	141 Å²	141	149.7 Å²	149.7	75%	0.754	77%	0.772	S	S	*	*				171.5	131.6	107.9	-84.6	-33	0	0	0	113.1
558	N	30.3	Very low	28.7	Very low	138 Å²	138	143.8 Å²	143.8	74%	0.738	77%	0.765	S	S	*	*			trans	27.7	136.5	136.8	-55.1	-19	0	0	0	120.2
559	L	29.3	Very low	28.6	Very low	153 Å²	153	142.7 Å²	142.7	80%	0.801	77%	0.769	S	S	*	*			cis	-157.9	171.1	5.7	-134.1	92.5	0	0	0	108.5
560	P	30.3	Very low	28.5	Very low	101 Å²	101	138.7 Å²	138.7	66%	0.656	76%	0.762	S	S	*	*			trans	-111.2	-159.6	-161.6	44.7	-39.5	0	0	0	116.1
561	L	27.4	Very low	28.6	Very low	153 Å²	153	134.4 Å²	134.4	80%	0.801	75%	0.753	S	S	*	*			trans	89.4	145.3	177.8	-59.5	132.6	0	0	0	113.7
562	Q	29.3	Very low	28.6	Very low	143 Å²	143	137.2 Å²	137.2	67%	0.668	75%	0.753	S	S	*	*			cis	-156.3	150.2	20	-154.8	170.2	-14.3	0	0	112.6
563	E	28.8	Very low	28.4	Very low	156 Å²	156	139.1 Å²	139.1	73%	0.729	76%	0.757	S	S	*	*			trans	36	146.5	149.2	-70	155.2	-137.9	0	0	122.3
564	S	27.4	Very low	28.3	Very low	111 Å²	111	132 Å²	132	78%	0.776	75%	0.745	S	S	*	*			cis	-160.9	169.6	23.7	41.6	0	0	0	0	112.5
565	P	31.9	Very low	28	Very low	119 Å²	119	133.2 Å²	133.2	77%	0.773	75%	0.748	S	S	*	*			trans	-122.2	-159.2	-171.4	37.3	-18.5	0	0	0	114.7
566	V	27.6	Very low	28	Very low	119 Å²	119	133.8 Å²	133.8	72%	0.721	76%	0.761	S	S	*	*			trans	98.4	107.4	161.6	-168.1	0	0	0	0	117.4
567	M	28.3	Very low	27.7	Very low	170 Å²	170	133 Å²	133	84%	0.837	77%	0.765	S	S	*	*				-167.6	128.4	107.7	-96.6	-59.2	-80.7	0	0	110.3
568	S	24.8	Very low	27.6	Very low	98 Å²	98	134 Å²	134	69%	0.685	77%	0.768	S	S	*	*			trans	-123.2	150.6	-176.6	44.5	0	0	0	0	110.9
569	V	27.2	Very low	27.4	Very low	143 Å²	143	137.7 Å²	137.7	87%	0.867	77%	0.773	S	S	*	*			trans	-138.6	123.4	160.5	-176.5	0	0	0	0	108.6
570	S	23.6	Very low	27.2	Very low	98 Å²	98	135.8 Å²	135.8	69%	0.685	77%	0.768	S	S	*	*			trans	-123.3	144	175.3	-64.6	0	0	0	0	109.4
571	S	30.4	Very low	27	Very low	101 Å²	101	139.6 Å²	139.6	71%	0.706	78%	0.777	S	S	*	*			trans	-172	110.9	148.1	46.5	0	0	0	0	109.4
572	H	26.6	Very low	27.2	Very low	170 Å²	170	137.8 Å²	137.8	79%	0.787	78%	0.775	S	S	*	*				75.3	111.3	81.5	-61.9	-48.5	0	0	0	113.6
573	L	26.6	Very low	26.9	Very low	182 Å²	182	136.8 Å²	136.8	95%	0.953	78%	0.782	S	S	*	*				-174.6	143.4	126.1	-98.8	154.5	0	0	0	110.2
574	S	23.1	Very low	26.9	Very low	96 Å²	96	136.6 Å²	136.6	67%	0.671	79%	0.785	S	S	*	*			trans	-143.8	160.9	-169	54.1	0	0	0	0	111.9
575	T	23.2	Very low	26.7	Very low	128 Å²	128	137.1 Å²	137.1	79%	0.785	78%	0.784	S	S	*	*			trans	59.1	120	155.6	42.5	0	0	0	0	120.3
576	S	29.9	Very low	26.4	Very low	123 Å²	123	138.6 Å²	138.6	86%	0.86	78%	0.784	S	S	*	*				-173.8	147.7	119.7	27.6	0	0	0	0	112.6
577	D	23.5	Very low	26.5	Very low	150 Å²	150	138.5 Å²	138.5	80%	0.802	79%	0.786	S	S	*	*			trans	-85.5	170	178.9	-54	-87.1	0	0	0	113.4
578	I	29.6	Very low	26.2	Very low	162 Å²	162	137.2 Å²	137.2	83%	0.831	79%	0.788	S	S	*	*			trans	170.1	106.4	147.8	-90.1	151	0	0	0	107
579	Y	26.2	Very low	26.3	Very low	215 Å²	215	135.9 Å²	135.9	84%	0.843	79%	0.79	S	S	*	*				87.4	142.1	83.6	-108.8	-100.6	0	0	0	116.3
580	T	25.3	Very low	26.3	Very low	114 Å²	114	135.1 Å²	135.1	70%	0.699	79%	0.791	S	S	*	*			trans	-52.2	173.9	-177.2	36.9	0	0	0	0	117.1
581	Q	26.9	Very low	26.3	Very low	180 Å²	180	137.2 Å²	137.2	84%	0.841	80%	0.799	S	S	*	*			cis	-165.7	175.8	33.2	-135.8	176.9	-7.4	0	0	110.8
582	P	31.3	Very low	26.2	Very low	116 Å²	116	139.5 Å²	139.5	75%	0.753	80%	0.802	S	S	*	*			trans	-113.3	162.9	-171.4	40.3	-29.1	0	0	0	117.1
583	C	23.4	Very low	26.1	Very low	122 Å²	122	136.4 Å²	136.4	82%	0.824	80%	0.799	S	S	*	*			trans	-159.6	165.7	164.5	-92.1	0	0	0	0	108.1
584	L	27.7	Very low	26	Very low	151 Å²	151	135 Å²	135	79%	0.791	79%	0.793	S	S	*	*			cis	-144.9	-150.7	0.7	-132.3	167.7	0	0	0	109.7
585	T	24.5	Very low	26.2	Very low	122 Å²	122	136 Å²	136	75%	0.748	80%	0.8	S	S	*	*			trans	-136.4	-177.1	-171.9	-20.4	0	0	0	0	112.8
586	I	25.6	Very low	26.3	Very low	150 Å²	150	137.7 Å²	137.7	77%	0.769	80%	0.803	S	S	*	*			trans	101.8	135.6	154	-50.7	-178.2	0	0	0	115.7
587	P	28.1	Very low	26.1	Very low	117 Å²	117	135.4 Å²	135.4	76%	0.76	79%	0.787	S	S	*	*			cis	-134.6	-170.8	-28.9	41	-22.2	0	0	0	114.9
588	T	23.8	Very low	26.3	Very low	143 Å²	143	133.6 Å²	133.6	88%	0.877	78%	0.783	S	S	*	*			trans	-66.1	148.8	176.5	49.3	0	0	0	0	117.3
589	G	25.9	Very low	26.3	Very low	71 Å²	71	135.3 Å²	135.3	73%	0.732	78%	0.781	S	S	*	*			trans	-170.5	128.6	163.1	0	0	0	0	0	115.1
590	S	27.5	Very low	26.4	Very low	127 Å²	127	130.4 Å²	130.4	89%	0.888	78%	0.776	S	S	*	*			trans	58.4	126.3	173.1	77.9	0	0	0	0	121.1
591	V	23.1	Very low	26.4	Very low	142 Å²	142	133.1 Å²	133.1	86%	0.861	78%	0.78	S	S	*	*			trans	-90.1	125.2	175.9	171.2	0	0	0	0	110.1
592	I	27.4	Very low	26.3	Very low	148 Å²	148	133.3 Å²	133.3	76%	0.759	78%	0.783	S	S	*	*			trans	-138	138.9	151.5	-59.1	-175.5	0	0	0	108.5
593	S	24.5	Very low	26	Very low	105 Å²	105	135.3 Å²	135.3	73%	0.734	78%	0.78	S	S	*	*			trans	-58.9	126.7	-174.9	51.3	0	0	0	0	114.4
594	N	25.7	Very low	26	Very low	154 Å²	154	136.2 Å²	136.2	82%	0.824	78%	0.775	S	S	*	*			trans	-131	118.4	163.1	-85.8	-36.4	0	0	0	110.1
595	S	27.1	Very low	26	Very low	116 Å²	116	135.4 Å²	135.4	81%	0.811	77%	0.77	S	S	*	*			trans	-71.2	129.6	171.2	44.4	0	0	0	0	110.2	S597	S595-S597 PolarHBondContact O-N 3.22Å
596	L	25	Very low	25.9	Very low	164 Å²	164	139.2 Å²	139.2	86%	0.859	77%	0.773	S	S	*	*			trans	-74	88.4	176.1	-78.3	88	0	0	0	110.9
597	S	25.6	Very low	26	Very low	75 Å²	75	140.1 Å²	140.1	52%	0.524	77%	0.773	S	S	.	*			trans	-87.8	129.7	151	172.9	0	0	0	0	108.8	S595 Y599	S595-S597 PolarHBondContact O-N 3.22Å; S597-Y599 PolarHBondContact O-N 2.77Å; S597-Y599 PolarHBondContact OG-N 3.11Å
598	P	28.4	Very low	25.8	Very low	111 Å²	111	143.1 Å²	143.1	72%	0.721	78%	0.777	S	S	*	*	S	Bend	trans	-74.9	6.3	173.7	31.4	-34.1	0	0	0	113.5
599	Y	28.3	Very low	26.1	Very low	198 Å²	198	141.2 Å²	141.2	78%	0.776	77%	0.769	S	S	*	*			trans	-125.2	84.6	179.5	-61.5	-70.8	0	0	0	112.1	S597	S597-Y599 PolarHBondContact O-N 2.77Å; S597-Y599 PolarHBondContact OG-N 3.11Å
600	P	28.4	Very low	26.3	Very low	113 Å²	113	144.9 Å²	144.9	73%	0.734	77%	0.772	S	S	*	*			trans	-76	141.8	161.3	31.7	-31.7	0	0	0	110.5	M602	P600-M602 PolarHBondContact O-N 3.2Å; P600-M602 VanDerWaalsContact O-N 3.15Å
601	E	25.3	Very low	26.4	Very low	170 Å²	170	145.6 Å²	145.6	79%	0.794	77%	0.766	S	S	*	*			trans	-33.4	106.5	177.7	-57.3	178.1	161.3	0	0	115.5	K603	E601-K603 PolarHBondContact O-N 2.95Å
602	M	25.3	Very low	26.8	Very low	185 Å²	185	145.6 Å²	145.6	91%	0.911	76%	0.757	S	S	*	*			trans	-88.4	83.1	165	-159.4	165.6	-69.2	0	0	109.8	P600 I604	P600-M602 PolarHBondContact O-N 3.2Å; P600-M602 VanDerWaalsContact O-N 3.15Å; M602-I604 PolarHBondContact O-N 3.09Å
603	K	25.7	Very low	26.9	Very low	158 Å²	158	146.7 Å²	146.7	69%	0.687	76%	0.759	S	S	*	*			trans	-48.2	138.1	164.8	-77.3	175.8	177.3	170.1	0	109.5	E601 I605	E601-K603 PolarHBondContact O-N 2.95Å; K603-I605 VanDerWaalsContact C-N 3.3Å; K603-I605 PolarHBondContact O-N 3.44Å
604	I	24	Very low	27.2	Very low	141 Å²	141	150.7 Å²	150.7	72%	0.723	77%	0.766	S	S	*	*			trans	-69.7	91.9	171.5	-58.9	175.3	0	0	0	107.6	M602 Y606	M602-I604 PolarHBondContact O-N 3.09Å; I604-Y606 HydrophobicContact CG2-CD2 4.21Å; I604-Y606 HydrophobicContact CG2-CE2 3.96Å; I604-Y606 PolarHBondContact O-N 3.45Å
605	I	26	Very low	27.3	Very low	133 Å²	133	151.7 Å²	151.7	68%	0.682	77%	0.765	S	S	*	*			trans	-78.4	108.6	167.4	-60.9	177	0	0	0	106.6	K603 H607	K603-I605 VanDerWaalsContact C-N 3.3Å; K603-I605 PolarHBondContact O-N 3.44Å; I605-H607 PolarHBondContact O-N 3.02Å; I605-H607 VanDerWaalsContact O-N 3.14Å
606	Y	23.8	Very low	27.5	Very low	203 Å²	203	154.7 Å²	154.7	80%	0.796	76%	0.764	S	S	*	*			trans	-66.6	106.7	166.1	-69.6	-97.1	0	0	0	107.9	I604 E608	I604-Y606 HydrophobicContact CG2-CD2 4.21Å; I604-Y606 HydrophobicContact CG2-CE2 3.96Å; I604-Y606 PolarHBondContact O-N 3.45Å; Y606-E608 PolarHBondContact O-N 3.39Å
607	H	26.5	Very low	27.5	Very low	169 Å²	169	154.2 Å²	154.2	78%	0.782	76%	0.761	S	S	*	*			trans	-86.6	93.3	165.1	-106.4	-67.6	0	0	0	108.9	I605	I605-H607 PolarHBondContact O-N 3.02Å; I605-H607 VanDerWaalsContact O-N 3.14Å
608	E	24.1	Very low	27.6	Very low	180 Å²	180	156.5 Å²	156.5	84%	0.841	78%	0.776	S	S	*	*			trans	-66.7	143.6	148.4	-69.1	-179.2	139	0	0	108.4	Y606	Y606-E608 PolarHBondContact O-N 3.39Å
609	S	31.4	Very low	27.3	Very low	102 Å²	102	162.6 Å²	162.6	71%	0.713	79%	0.785	S	S	*	*			trans	-151.7	88.2	172.9	61.2	0	0	0	0	109.7
610	D	29.1	Very low	27.4	Very low	149 Å²	149	161 Å²	161	80%	0.797	79%	0.788	S	S	*	*			trans	24.2	122.5	148.1	-59.4	-41.2	0	0	0	120.6
611	N	30.7	Very low	27.3	Very low	141 Å²	141	160.3 Å²	160.3	75%	0.754	79%	0.786	S	S	*	*				-178.4	138.2	120.4	-86.7	-38.4	0	0	0	107.9
612	Q	30.4	Very low	27.5	Very low	142 Å²	142	157.6 Å²	157.6	66%	0.664	79%	0.786	S	S	*	*			cis	-170.1	142	-12.6	-127.9	178.9	55.4	0	0	106.1
613	Q	30.6	Very low	27.5	Very low	172 Å²	172	152.2 Å²	152.2	80%	0.804	78%	0.777	S	S	*	*			trans	66.6	146.4	167.5	-53.5	166.8	-6.1	0	0	114.7
614	E	30.3	Very low	27.8	Very low	189 Å²	189	152.4 Å²	152.4	88%	0.883	79%	0.786	S	S	*	*			cis	-133.3	-177.5	13.5	-72	-172.4	120.3	0	0	113.4
615	Q	26.9	Very low	28.2	Very low	174 Å²	174	154 Å²	154	81%	0.813	79%	0.79	S	S	*	*			trans	-85.9	143.9	-166.3	-53.9	157.2	-1.3	0	0	114.4
616	K	30.8	Very low	28.4	Very low	179 Å²	179	154.2 Å²	154.2	78%	0.778	79%	0.791	S	S	*	*				171.4	136	108.1	-92.7	169.4	-178.8	173.2	0	114.1
617	L	26.4	Very low	28.8	Very low	154 Å²	154	153.2 Å²	153.2	81%	0.806	79%	0.791	S	S	*	*			trans	16.6	128.4	149.8	-67.9	87.7	0	0	0	118.1
618	C	26.6	Very low	29	Very low	124 Å²	124	154.7 Å²	154.7	84%	0.838	79%	0.791	S	S	*	*				-166.9	169.2	54.9	-123.8	0	0	0	0	113.4
619	R	23.2	Very low	29.3	Very low	239 Å²	239	151 Å²	151	90%	0.902	78%	0.776	S	S	*	*			trans	-87.4	152.5	179.6	-61	170.2	176.3	153.6	-3.3	112.6
620	I	29.6	Very low	29.2	Very low	163 Å²	163	152.6 Å²	152.6	84%	0.836	78%	0.777	S	S	*	*			trans	172.8	102	144.7	-87	146.9	0	0	0	104.7
621	S	27.5	Very low	29.4	Very low	100 Å²	100	150.2 Å²	150.2	70%	0.699	77%	0.767	S	S	*	*				73.8	116.3	84.6	-160.3	0	0	0	0	115.8
622	S	27.7	Very low	29.7	Very low	113 Å²	113	152.8 Å²	152.8	79%	0.79	77%	0.772	S	S	*	*			trans	56	112.7	143.5	58.4	0	0	0	0	121.3
623	G	27.2	Very low	30.1	Very low	71 Å²	71	154.4 Å²	154.4	73%	0.732	78%	0.779	S	S	*	*			trans	93	107.1	140.8	0	0	0	0	0	117.3
624	D	32	Very low	30.7	Very low	162 Å²	162	149.3 Å²	149.3	87%	0.866	76%	0.755	S	S	*	*				-173.7	160.9	115.7	-101.2	-24.4	0	0	0	113.1
625	H	32.1	Very low	31.1	Very low	175 Å²	175	142.1 Å²	142.1	81%	0.81	73%	0.725	S	S	*	*			trans	-76.7	125.8	-167.1	-67.3	-97.3	0	0	0	114.4	K627	H625-K627 PolarHBondContact O-N 2.97Å; H625-K627 VanDerWaalsContact O-N 3.13Å
626	I	30	Very low	31.7	Very low	137 Å²	137	137.3 Å²	137.3	70%	0.703	71%	0.711	S	S	*	*			trans	-70.7	105.2	167.8	-59.7	176	0	0	0	109.7	Y628	I626-Y628 HydrophobicContact CG2-CD2 4.04Å; I626-Y628 HydrophobicContact CG2-CE2 3.83Å; I626-Y628 PolarHBondContact O-N 3.03Å
627	K	32	Very low	32.3	Very low	183 Å²	183	131.8 Å²	131.8	80%	0.796	69%	0.692	S	S	*	*			trans	-75.8	106	168.5	-78.1	-177.3	175.9	176.2	0	110.6	H625 I629	H625-K627 PolarHBondContact O-N 2.97Å; H625-K627 VanDerWaalsContact O-N 3.13Å; K627-I629 PolarHBondContact O-N 3.42Å
628	Y	30.2	Very low	32.9	Very low	199 Å²	199	128 Å²	128	78%	0.78	68%	0.679	S	S	*	*			trans	-75.8	109	167.9	-80.9	-85.1	0	0	0	110.8	I626	I626-Y628 HydrophobicContact CG2-CD2 4.04Å; I626-Y628 HydrophobicContact CG2-CE2 3.83Å; I626-Y628 PolarHBondContact O-N 3.03Å
629	I	31.7	Very low	33.2	Very low	103 Å²	103	132.4 Å²	132.4	53%	0.528	68%	0.683	S	S	.	*			trans	-83.5	126.3	170	-60.5	178.1	0	0	0	109.3	K627 T631	K627-I629 PolarHBondContact O-N 3.42Å; I629-T631 HydrophobicContact CG2-CG2 3.68Å; I629-T631 PolarHBondContact O-N 2.96Å
630	N	28.8	Very low	33.8	Very low	136 Å²	136	126.8 Å²	126.8	73%	0.727	67%	0.671	S	S	*	*			trans	-94.8	88.4	-179.4	-160.9	15.6	0	0	0	109.9
631	T	33.2	Very low	33.8	Very low	98 Å²	98	124.7 Å²	124.7	60%	0.601	67%	0.671	S	S	*	*			trans	-126.5	138	-173.9	35.2	0	0	0	0	114.6	I629	I629-T631 HydrophobicContact CG2-CG2 3.68Å; I629-T631 PolarHBondContact O-N 2.96Å
632	K	36.1	Very low	34.2	Very low	196 Å²	196	125.3 Å²	125.3	85%	0.852	67%	0.67	S	S	*	*	S	Bend	trans	-62.7	143.5	176.9	-62.6	174.8	177.8	178.5	0	111.7
633	E	39.2	Very low	34.5	Very low	176 Å²	176	127.3 Å²	127.3	82%	0.822	67%	0.672	S	S	*	*			trans	41.4	89.6	166.8	-59.7	-160.6	126.3	0	0	118.2
634	Q	42.6	Very low	34.8	Very low	64 Å²	64	130.5 Å²	130.5	30%	0.299	67%	0.672	S	S	.	*	P	Polyproline II helix	trans	-70.3	133.2	162.6	-75.7	-170.1	-76.3	0	0	111.6	S636 S660 W688	Q634-S636 PolarHBondContact O-N 2.85Å; Q634-S660 PolarHBondContact OE1-OG 3.27Å; Q634-W688 HydrophobicContact CG-CH2 4.04Å; Q634-W688 HydrophobicContact CG-CZ2 4.13Å
635	P	39.5	Very low	34.9	Very low	39 Å²	39	130.4 Å²	130.4	25%	0.253	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-72.9	125.2	176.9	28.9	-34.3	0	0	0	112.2	F701	P635-F701 HydrophobicContact CB-CD2 3.84Å; P635-F701 HydrophobicContact CB-CE2 3.66Å; P635-F701 HydrophobicContact CB-CZ 4.3Å; P635-F701 HydrophobicContact CG-CB 4.16Å; P635-F701 HydrophobicContact CG-CD1 4.39Å; P635-F701 HydrophobicContact CG-CD2 3.48Å; P635-F701 VanDerWaalsContact CG-CD2 3.48Å; P635-F701 HydrophobicContact CG-CE2 3.74Å; P635-F701 HydrophobicContact CG-CG 3.79Å; P635-F701 HydrophobicContact CG-CZ 4.27Å
636	S	40.6	Very low	35.4	Very low	73 Å²	73	129 Å²	129	51%	0.51	67%	0.669	S	S	.	*	P	Polyproline II helix	trans	-75.5	131.7	177.3	48.6	0	0	0	0	112.9	Q634 S638	Q634-S636 PolarHBondContact O-N 2.85Å; S636-S638 PolarHBondContact O-N 3.41Å; S636-S638 VanDerWaalsContact O-N 3.1Å
637	T	42.8	Very low	36.4	Very low	63 Å²	63	130.2 Å²	130.2	39%	0.387	67%	0.67	S	S	.	*			trans	-79.3	86.4	178.3	50.6	0	0	0	0	111.8
638	S	38.4	Very low	37.9	Very low	74 Å²	74	127.7 Å²	127.7	52%	0.517	67%	0.665	S	S	.	*			trans	-78.3	129.2	163.5	54.2	0	0	0	0	110.2	S636 L640	S636-S638 PolarHBondContact O-N 3.41Å; S636-S638 VanDerWaalsContact O-N 3.1Å; S638-L640 PolarHBondContact O-N 2.68Å
639	K	33.7	Very low	40.2	Very low	216 Å²	216	126.5 Å²	126.5	94%	0.939	66%	0.664	S	S	*	*			trans	-44.2	118.3	-178	-67.3	179.9	177.1	-177.9	0	112.3
640	L	35	Very low	42.6	Very low	121 Å²	121	123.8 Å²	123.8	63%	0.634	65%	0.653	S	S	*	*			trans	-118.3	110.3	168.7	-105.7	143.2	0	0	0	107.1	S638 V642	S638-L640 PolarHBondContact O-N 2.68Å; L640-V642 HydrophobicContact CD2-CG2 4.45Å
641	S	29.8	Very low	45.4	Very low	120 Å²	120	120.1 Å²	120.1	84%	0.839	64%	0.636	S	S	*	*			trans	-76.8	121.2	165.9	50.9	0	0	0	0	108.5
642	V	35	Very low	48.2	Very low	112 Å²	112	117.6 Å²	117.6	68%	0.679	62%	0.617	S	S	*	*			trans	-129.3	139.9	170.2	-177.8	0	0	0	0	106.8	L640	L640-V642 HydrophobicContact CD2-CG2 4.45Å
643	N	36	Very low	50.8	Low	156 Å²	156	113.1 Å²	113.1	83%	0.834	59%	0.594	S	S	*	*			trans	-58.9	141	-166.9	-53.5	-44.3	0	0	0	112.5	D645	N643-D645 PolarHBondContact O-N 3.21Å
644	D	31.8	Very low	53.1	Low	137 Å²	137	104.8 Å²	104.8	73%	0.733	56%	0.556	S	S	*	*			trans	-69.5	112	163.9	-68.4	-59.6	0	0	0	109
645	D	35.1	Very low	55.3	Low	160 Å²	160	103 Å²	103	86%	0.856	55%	0.549	S	S	*	.			trans	-174.9	147.5	141.5	-96.3	-31.7	0	0	0	109.3	N643	N643-D645 PolarHBondContact O-N 3.21Å
646	L	42.6	Very low	57.3	Low	146 Å²	146	106 Å²	106	76%	0.764	56%	0.56	S	S	*	*	S	Bend	trans	76.6	132.1	-178.8	-122	65	0	0	0	117.6
647	F	50.1	Low	59.1	Low	163 Å²	163	107.3 Å²	107.3	72%	0.715	56%	0.561	S	S	*	*			trans	73.5	61.4	173.3	-49.1	-70.2	0	0	0	119	K649	F647-K649 VanDerWaalsContact C-N 3.25Å; F647-K649 PolarHBondContact O-N 3.13Å
648	D	64	Low	60.4	Low	130 Å²	130	105.7 Å²	105.7	70%	0.695	55%	0.549	S	S	*	.			trans	-85.7	24.9	172.8	-151.6	36.5	0	0	0	114.9	H694	D648-H694 IonicContact OD1-CE1 2.83Å
649	K	77.5	Confident	61.6	Low	174 Å²	174	106.2 Å²	106.2	76%	0.757	55%	0.552	S	S	*	*	S	Bend	trans	-109.1	137.4	170.1	-74.3	-174.7	178	-179.3	0	110.2	F647 T675	F647-K649 VanDerWaalsContact C-N 3.25Å; F647-K649 PolarHBondContact O-N 3.13Å; K649-T675 PolarHBondContact O-OG1 3.26Å
650	P	83.6	Confident	62.7	Low	46 Å²	46	97.5 Å²	97.5	30%	0.299	52%	0.518	S	S	.	.			trans	-64.4	142.1	170.9	29.1	-34.4	0	0	0	109.7	L673 T675 I710	P650-L673 HydrophobicContact CB-CB 3.81Å; P650-L673 HydrophobicContact CG-CB 4.37Å; P650-L673 HydrophobicContact CG-CD1 4.19Å; P650-T675 WeakPolarHBondContact CA-OG1 3.46Å; P650-I710 HydrophobicContact CB-CD1 3.79Å; P650-I710 HydrophobicContact CG-CD1 4.23Å
651	T	86.5	Confident	63.6	Low	59 Å²	59	100.9 Å²	100.9	36%	0.362	53%	0.528	S	S	.	.			trans	-115.8	-21.8	-179.5	59	0	0	0	0	113.4	V674 T675 I710	T651-V674 PolarHBondContact N-O 2.86Å; T651-T675 HydrophobicContact CG2-CG2 4.24Å; T651-I710 PolarHBondContact O-N 3.42Å; T651-I710 VanDerWaalsContact O-N 3.08Å
652	H	91.5	Very high	64.5	Low	45 Å²	45	99.5 Å²	99.5	21%	0.208	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	157	-177.8	-65	70.2	0	0	0	112	V674 I676 L707 E708 I710	H652-V674 HydrophobicContact CB-CG2 3.94Å; H652-V674 PolarHBondContact N-O 3.39Å; H652-V674 PolarHBondContact O-N 3.29Å; H652-I676 VanDerWaalsContact CE1-CD1 3.4Å; H652-I676 WeakPolarHBondContact CE1-CD1 3.44Å; H652-L707 HydrophobicContact CB-CB 4.33Å; H652-L707 HydrophobicContact CB-CD2 4.46Å; H652-E708 CarbonylContact C-O 3.5Å; H652-E708 WeakPolarHBondContact CA-O 3.38Å; H652-E708 WeakPolarHBondContact CB-O 3.29Å; H652-I710 WeakPolarHBondContact O-CD1 3.46Å
653	R	91.2	Very high	64.8	Low	101 Å²	101	105 Å²	105	38%	0.381	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	143.3	174.5	-172	-178.6	-63.2	-85.3	9.5	109.9	G671 Q672 E708 I710	R653-G671 PolarHBondContact NH1-O 2.69Å; R653-Q672 WeakPolarHBondContact CA-O 3.38Å; R653-E708 PolarHBondContact N-O 3.48Å; R653-E708 PolarHBondContact O-N 2.91Å; R653-I710 HydrophobicContact CB-CG1 4.21Å
654	I	87.9	Confident	65	Low	1 Å²	1	101 Å²	101	1%	0.005	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	123.1	173.4	-62	-179.3	0	0	0	109.6	H656 F658 G671 Q672 V674 F693 V702 Y706 L707	I654-H656 VanDerWaalsContact CG2-O 3.26Å; I654-H656 WeakPolarHBondContact CG2-O 3.35Å; I654-F658 HydrophobicContact CD1-CE1 4.49Å; I654-G671 PolarHBondContact O-N 3.48Å; I654-Q672 HydrophobicContact CD1-CB 4.4Å; I654-Q672 PolarHBondContact N-O 3.34Å; I654-V674 HydrophobicContact CD1-CG1 3.96Å; I654-V674 HydrophobicContact CG1-CG1 4.1Å; I654-F693 HydrophobicContact CD1-CE1 3.61Å; I654-F693 HydrophobicContact CD1-CZ 3.55Å; I654-V702 HydrophobicContact CD1-CG1 4.49Å; I654-V702 HydrophobicContact CD1-CG2 4.26Å; I654-Y706 CarbonylContact C-O 3.58Å; I654-Y706 WeakPolarHBondContact CA-O 3.41Å; I654-L707 HydrophobicContact CG1-CD2 4.25Å
655	T	88	Confident	65.4	Low	26 Å²	26	96.9 Å²	96.9	16%	0.16	49%	0.49	C	S	.	.			trans	-90.8	-19.9	-173.4	53.8	0	0	0	0	115	K670 Y706 E708	T655-K670 VanDerWaalsContact O-CD 3.25Å; T655-K670 WeakPolarHBondContact O-CD 3.41Å; T655-K670 VanDerWaalsContact O-CE 3.28Å; T655-K670 WeakPolarHBondContact O-CE 2.82Å; T655-K670 WeakPolarHBondContact O-CG 3.46Å; T655-Y706 PolarHBondContact N-O 3.36Å; T655-Y706 PolarHBondContact OG1-O 3.18Å; T655-E708 HydrophobicContact CG2-CB 3.37Å; T655-E708 HydrophobicContact CG2-CG 4.32Å; T655-E708 WeakPolarHBondContact CG2-OE2 3.37Å
656	H	82.5	Confident	66	Low	104 Å²	104	94.4 Å²	94.4	48%	0.481	48%	0.48	S	S	.	.	S	Bend	trans	-139.9	143.5	-174.2	-64.5	75.6	0	0	0	110.8	I654 Y706	I654-H656 VanDerWaalsContact CG2-O 3.26Å; I654-H656 WeakPolarHBondContact CG2-O 3.35Å; H656-Y706 HydrophobicContact CB-CD2 3.61Å; H656-Y706 HydrophobicContact CB-CE2 3.5Å; H656-Y706 VanDerWaalsContact CB-CE2 3.5Å; H656-Y706 HydrophobicContact CB-CG 4.21Å
657	D	77.9	Confident	66.4	Low	99 Å²	99	92.8 Å²	92.8	53%	0.529	47%	0.471	S	S	.	.			trans	-67	140.8	173.3	-59	-54.6	0	0	0	111.2	S668 A669 K670	D657-S668 WeakPolarHBondContact CA-O 3.33Å; D657-A669 VanDerWaalsContact OD1-CA 3.31Å; D657-A669 WeakPolarHBondContact OD1-CA 3.39Å; D657-K670 PolarHBondContact OD1-N 2.97Å
658	F	71.2	Confident	66.7	Low	30 Å²	30	85.1 Å²	85.1	13%	0.132	44%	0.438	C	S	.	.	B	Isolated β-bridge	trans	-149.6	150.3	170.3	79.9	-83	0	0	0	112.6	I654 I667 S668 V702 Y706	I654-F658 HydrophobicContact CD1-CE1 4.49Å; F658-I667 WeakPolarHBondContact O-CA 3.47Å; F658-S668 VanDerWaalsContact CE1-OG 3.27Å; F658-S668 WeakPolarHBondContact CE1-OG 3.29Å; F658-S668 WeakPolarHBondContact CZ-OG 3.34Å; F658-S668 PolarHBondContact N-O 3.19Å; F658-S668 PolarHBondContact O-N 3.45Å; F658-V702 HydrophobicContact CE1-CB 4.36Å; F658-V702 HydrophobicContact CE1-CG1 3.81Å; F658-V702 HydrophobicContact CE1-CG2 4.07Å; F658-V702 HydrophobicContact CZ-CB 4.29Å; F658-V702 HydrophobicContact CZ-CG1 4.22Å; F658-V702 HydrophobicContact CZ-CG2 3.89Å; F658-Y706 HydrophobicContact CB-CD2 4.32Å; F658-Y706 HydrophobicContact CB-CE2 3.91Å; F658-Y706 HydrophobicContact CD1-CD2 4.11Å
659	S	63.2	Low	66.7	Low	84 Å²	84	81.2 Å²	81.2	59%	0.587	42%	0.423	S	S	*	.			trans	-133.3	144.3	176.2	65.5	0	0	0	0	111.6
660	S	57.3	Low	66.8	Low	33 Å²	33	80 Å²	80	23%	0.231	42%	0.418	C	S	.	.			trans	-88.4	140.9	176.4	176.3	0	0	0	0	110.7	Q634 N662	Q634-S660 PolarHBondContact OE1-OG 3.27Å; S660-N662 PolarHBondContact O-N 3.03Å; S660-N662 PolarHBondContact OG-N 3.41Å
661	K	53	Low	66.8	Low	192 Å²	192	79.1 Å²	79.1	84%	0.835	42%	0.417	S	S	*	.	S	Bend	trans	-73.1	-15.7	173.8	-76.7	-175.9	177.1	177.3	0	113.3
662	N	49.1	Very low	66.7	Low	92 Å²	92	79.3 Å²	79.3	49%	0.492	41%	0.414	S	S	.	.	S	Bend	trans	-83.8	134.3	175.2	-75.8	-39.6	0	0	0	110.1	S660 S664	S660-N662 PolarHBondContact O-N 3.03Å; S660-N662 PolarHBondContact OG-N 3.41Å; N662-S664 PolarHBondContact O-N 3.44Å
663	K	41.5	Very low	66.6	Low	228 Å²	228	80 Å²	80	99%	0.991	42%	0.419	S	S	*	.	S	Bend	trans	-69	34	-173	-71.9	-171.7	171.9	-174.4	0	116
664	S	39	Very low	66.5	Low	72 Å²	72	75.1 Å²	75.1	50%	0.503	40%	0.401	S	S	.	.	S	Bend	trans	-140.5	124.7	167.8	56.3	0	0	0	0	107	N662	N662-S664 PolarHBondContact O-N 3.44Å
665	V	40.5	Very low	66.6	Low	49 Å²	49	75.9 Å²	75.9	30%	0.297	41%	0.405	S	S	.	.	S	Bend	trans	97.3	114.9	-179.3	-176.9	0	0	0	0	115.5	K700	V665-K700 HydrophobicContact CG1-CD 3.56Å; V665-K700 VanDerWaalsContact CG1-CE 3.48Å; V665-K700 HydrophobicContact CG1-CG 4.09Å; V665-K700 HydrophobicContact CG2-CD 4.24Å; V665-K700 HydrophobicContact CG2-CG 4.11Å
666	V	47.3	Very low	66.7	Low	108 Å²	108	76.6 Å²	76.6	66%	0.655	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-69.5	159.8	-177.6	177.5	0	0	0	0	112.6	S668	V666-S668 PolarHBondContact O-N 3.15Å
667	I	50.8	Low	66.9	Low	112 Å²	112	75.9 Å²	75.9	57%	0.574	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-46.1	116	165.8	-58.1	158.8	0	0	0	109.4	F658 A669	F658-I667 WeakPolarHBondContact O-CA 3.47Å; I667-A669 PolarHBondContact O-N 2.73Å
668	S	58.3	Low	67.2	Low	3 Å²	3	74.6 Å²	74.6	2%	0.021	39%	0.394	C	S	.	.	B	Isolated β-bridge	trans	-78.1	121.8	168.9	-62.2	0	0	0	0	108.1	D657 F658 V666 F693	D657-S668 WeakPolarHBondContact CA-O 3.33Å; F658-S668 VanDerWaalsContact CE1-OG 3.27Å; F658-S668 WeakPolarHBondContact CE1-OG 3.29Å; F658-S668 WeakPolarHBondContact CZ-OG 3.34Å; F658-S668 PolarHBondContact N-O 3.19Å; F658-S668 PolarHBondContact O-N 3.45Å; V666-S668 PolarHBondContact O-N 3.15Å; S668-F693 WeakPolarHBondContact OG-CE1 3.45Å; S668-F693 WeakPolarHBondContact OG-CZ 3.34Å
669	A	63.4	Low	67.8	Low	47 Å²	47	76.7 Å²	76.7	39%	0.388	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-77.1	135	177.9	0	0	0	0	0	110.9	D657 I667 G671 Q672	D657-A669 VanDerWaalsContact OD1-CA 3.31Å; D657-A669 WeakPolarHBondContact OD1-CA 3.39Å; I667-A669 PolarHBondContact O-N 2.73Å; A669-G671 PolarHBondContact O-N 3.03Å; A669-Q672 WeakPolarHBondContact O-CB 3.3Å; A669-Q672 PolarHBondContact O-N 3.41Å; A669-Q672 VanDerWaalsContact O-N 3.1Å
670	K	79.3	Confident	68.6	Low	150 Å²	150	79 Å²	79	65%	0.652	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	126.3	165.7	175.7	172.7	-176.5	178.1	0	109.5	T655 D657	T655-K670 VanDerWaalsContact O-CD 3.25Å; T655-K670 WeakPolarHBondContact O-CD 3.41Å; T655-K670 VanDerWaalsContact O-CE 3.28Å; T655-K670 WeakPolarHBondContact O-CE 2.82Å; T655-K670 WeakPolarHBondContact O-CG 3.46Å; D657-K670 PolarHBondContact OD1-N 2.97Å
671	G	83.4	Confident	69.3	Low	27 Å²	27	77.6 Å²	77.6	28%	0.278	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.2	-10.8	-176.8	0	0	0	0	0	115.4	R653 I654 A669	R653-G671 PolarHBondContact NH1-O 2.69Å; I654-G671 PolarHBondContact O-N 3.48Å; A669-G671 PolarHBondContact O-N 3.03Å
672	Q	84.8	Confident	69.6	Low	63 Å²	63	76 Å²	76	29%	0.294	39%	0.389	S	S	.	.			trans	-66.4	137.2	-179.1	-167.8	129.7	25.5	0	0	112.6	R653 I654 A669 F693 H694	R653-Q672 WeakPolarHBondContact CA-O 3.38Å; I654-Q672 HydrophobicContact CD1-CB 4.4Å; I654-Q672 PolarHBondContact N-O 3.34Å; A669-Q672 WeakPolarHBondContact O-CB 3.3Å; A669-Q672 PolarHBondContact O-N 3.41Å; A669-Q672 VanDerWaalsContact O-N 3.1Å; Q672-F693 HydrophobicContact CG-CD1 3.91Å; Q672-F693 HydrophobicContact CG-CE1 4.31Å; Q672-H694 PolarHBondContact NE2-O 2.78Å
673	L	89.3	Confident	70.2	Confident	58 Å²	58	79.4 Å²	79.4	30%	0.304	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	136.8	-178.6	-57.7	177	0	0	0	111.2	P650 H694 I710	P650-L673 HydrophobicContact CB-CB 3.81Å; P650-L673 HydrophobicContact CG-CB 4.37Å; P650-L673 HydrophobicContact CG-CD1 4.19Å; L673-H694 HydrophobicContact CB-CB 4.22Å; L673-H694 PolarHBondContact O-N 3.32Å; L673-I710 HydrophobicContact CD2-CD1 3.63Å; L673-I710 HydrophobicContact CD2-CG1 4.32Å
674	V	89.3	Confident	71.6	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	158.8	-178.8	-52.3	0	0	0	0	112.3	T651 H652 I654 V691 K692 F693 L707	T651-V674 PolarHBondContact N-O 2.86Å; H652-V674 HydrophobicContact CB-CG2 3.94Å; H652-V674 PolarHBondContact N-O 3.39Å; H652-V674 PolarHBondContact O-N 3.29Å; I654-V674 HydrophobicContact CD1-CG1 3.96Å; I654-V674 HydrophobicContact CG1-CG1 4.1Å; V674-V691 HydrophobicContact CB-CB 3.9Å; V674-V691 HydrophobicContact CB-CG2 3.75Å; V674-V691 HydrophobicContact CG1-CG2 3.82Å; V674-V691 HydrophobicContact CG2-CB 3.93Å; V674-V691 HydrophobicContact CG2-CG1 4.16Å; V674-V691 HydrophobicContact CG2-CG2 3.96Å; V674-K692 CarbonylContact C-O 3.59Å; V674-K692 WeakPolarHBondContact CA-O 3.46Å; V674-K692 WeakPolarHBondContact CB-O 3.44Å; V674-F693 HydrophobicContact CG1-CD1 4.23Å; V674-F693 HydrophobicContact CG1-CD2 4.07Å; V674-F693 HydrophobicContact CG1-CE1 4.37Å; V674-F693 HydrophobicContact CG1-CE2 4.19Å; V674-F693 HydrophobicContact CG1-CG 4.07Å; V674-F693 HydrophobicContact CG1-CZ 4.35Å; V674-L707 HydrophobicContact CG2-CD2 3.76Å
675	T	90.7	Very high	73.3	Confident	16 Å²	16	70.6 Å²	70.6	10%	0.098	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.4	167.8	-55.6	0	0	0	0	108.9	K649 P650 T651 I677 V691 K692 H694	K649-T675 PolarHBondContact O-OG1 3.26Å; P650-T675 WeakPolarHBondContact CA-OG1 3.46Å; T651-T675 HydrophobicContact CG2-CG2 4.24Å; T675-I677 PolarHBondContact O-N 2.65Å; T675-V691 CarbonylContact O-C 3.4Å; T675-V691 VanDerWaalsContact O-CA 3.24Å; T675-V691 WeakPolarHBondContact O-CA 3.4Å; T675-K692 PolarHBondContact N-O 3.21Å; T675-K692 PolarHBondContact O-N 3.33Å; T675-H694 PolarHBondContact OG1-NE2 3.46Å
676	I	88.5	Confident	75.4	Confident	42 Å²	42	72.9 Å²	72.9	22%	0.215	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	125.1	175.6	-60.3	-178	0	0	0	109.8	H652 V691 L707	H652-I676 VanDerWaalsContact CE1-CD1 3.4Å; H652-I676 WeakPolarHBondContact CE1-CD1 3.44Å; I676-V691 HydrophobicContact CG1-CG1 4.04Å; I676-L707 HydrophobicContact CD1-CD1 3.84Å; I676-L707 HydrophobicContact CG1-CD1 4.03Å
677	I	87.5	Confident	77.1	Confident	89 Å²	89	72.8 Å²	72.8	46%	0.456	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-38.3	172.9	-60.5	162.1	0	0	0	110.3	T675 L690 K692 I699	T675-I677 PolarHBondContact O-N 2.65Å; I677-L690 HydrophobicContact CB-CD2 4.28Å; I677-L690 HydrophobicContact CD1-CD2 4.19Å; I677-L690 HydrophobicContact CD1-CG 4.4Å; I677-L690 HydrophobicContact CG2-CD2 4.19Å; I677-L690 PolarHBondContact N-O 2.83Å; I677-K692 HydrophobicContact CD1-CB 4.04Å; I677-K692 HydrophobicContact CG1-CB 4.34Å; I677-I699 HydrophobicContact CD1-CB 4.25Å; I677-I699 HydrophobicContact CD1-CD1 3.82Å; I677-I699 HydrophobicContact CD1-CG1 3.78Å; I677-I699 HydrophobicContact CD1-CG2 3.56Å
678	R	84.9	Confident	78.7	Confident	71 Å²	71	69 Å²	69	27%	0.268	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	143.3	169.3	59.2	171.5	-177.1	-127.3	-15.9	111.3	Y680 S689 L690	R678-Y680 HydrophobicContact CB-CD1 4.31Å; R678-Y680 HydrophobicContact CB-CE1 4.08Å; R678-Y680 VanDerWaalsContact CD-O 3.24Å; R678-Y680 WeakPolarHBondContact CD-O 3.43Å; R678-Y680 PolarHBondContact NE-O 3.08Å; R678-Y680 VanDerWaalsContact NE-O 3.07Å; R678-Y680 PolarHBondContact O-N 3.48Å; R678-S689 CarbonylContact O-C 3.43Å; R678-S689 WeakPolarHBondContact O-CA 3.33Å; R678-L690 HydrophobicContact CG-CB 3.59Å; R678-L690 HydrophobicContact CG-CD2 4.49Å; R678-L690 PolarHBondContact N-O 2.67Å; R678-L690 PolarHBondContact O-N 3.42Å
679	S	83.3	Confident	80	Confident	74 Å²	74	68.9 Å²	68.9	52%	0.517	36%	0.364	S	S	.	.	S	Bend	trans	-84.6	20.9	-178.7	-37.2	0	0	0	0	114
680	Y	79.6	Confident	81.1	Confident	132 Å²	132	67.7 Å²	67.7	52%	0.518	35%	0.351	S	S	.	.			trans	-149	149.6	-177.2	55.5	-89.7	0	0	0	113.7	R678 W688	R678-Y680 HydrophobicContact CB-CD1 4.31Å; R678-Y680 HydrophobicContact CB-CE1 4.08Å; R678-Y680 VanDerWaalsContact CD-O 3.24Å; R678-Y680 WeakPolarHBondContact CD-O 3.43Å; R678-Y680 PolarHBondContact NE-O 3.08Å; R678-Y680 VanDerWaalsContact NE-O 3.07Å; R678-Y680 PolarHBondContact O-N 3.48Å; Y680-W688 CarbonylContact C-O 3.51Å; Y680-W688 WeakPolarHBondContact CA-O 3.48Å; Y680-W688 PolarHBondContact N-O 2.92Å
681	G	72.6	Confident	81.5	Confident	4 Å²	4	60.5 Å²	60.5	4%	0.041	32%	0.32	C	S	.	.			trans	-68.7	-179.1	175.5	0	0	0	0	0	113.2	G684 N685 W688	G681-G684 PolarHBondContact O-N 2.97Å; G681-N685 PolarHBondContact N-O 2.92Å; G681-W688 PolarHBondContact N-O 3.34Å
682	R	59	Low	81.8	Confident	158 Å²	158	62.1 Å²	62.1	60%	0.596	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-60.9	143.8	159.2	-133.8	172.7	-171.2	151.5	2	107.9	G684	R682-G684 VanDerWaalsContact C-N 3.3Å; R682-G684 PolarHBondContact O-N 3.37Å
683	N	61.2	Low	81.9	Confident	165 Å²	165	59.4 Å²	59.4	88%	0.882	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	65.8	21.3	-178.3	-45.2	-5.2	0	0	0	115.1	N685	N683-N685 VanDerWaalsContact C-N 3.32Å; N683-N685 PolarHBondContact O-N 3.41Å
684	G	70.8	Confident	81.6	Confident	47 Å²	47	58 Å²	58	49%	0.485	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	78.5	6.9	172.8	0	0	0	0	0	115.9	G681 R682 T686	G681-G684 PolarHBondContact O-N 2.97Å; R682-G684 VanDerWaalsContact C-N 3.3Å; R682-G684 PolarHBondContact O-N 3.37Å; G684-T686 PolarHBondContact O-N 3.44Å; G684-T686 VanDerWaalsContact O-N 3.15Å
685	N	75.1	Confident	80.9	Confident	67 Å²	67	62.8 Å²	62.8	36%	0.358	33%	0.329	S	S	.	.			trans	-64	111.4	177.6	180	0	0	0	0	111.4	G681 N683 N687	G681-N685 PolarHBondContact N-O 2.92Å; N683-N685 VanDerWaalsContact C-N 3.32Å; N683-N685 PolarHBondContact O-N 3.41Å; N685-N687 PolarHBondContact O-N 2.76Å; N685-N687 VanDerWaalsContact OD1-CB 3.3Å; N685-N687 WeakPolarHBondContact OD1-CB 3.11Å; N685-N687 PolarHBondContact OD1-N 3.07Å; N685-N687 VanDerWaalsContact OD1-N 3.09Å; N685-N687 PolarHBondContact OD1-ND2 3.13Å
686	T	84.1	Confident	79.8	Confident	98 Å²	98	70.1 Å²	70.1	60%	0.601	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-13.2	-177.2	50.2	0	0	0	0	114.4	G684 W688 T704	G684-T686 PolarHBondContact O-N 3.44Å; G684-T686 VanDerWaalsContact O-N 3.15Å; T686-W688 PolarHBondContact O-N 3.1Å; T686-T704 WeakPolarHBondContact O-CB 3.42Å; T686-T704 PolarHBondContact O-OG1 3.42Å
687	N	83.8	Confident	79.3	Confident	105 Å²	105	69.4 Å²	69.4	56%	0.561	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-11.2	178.7	-64.4	-52.9	0	0	0	113.9	N685 P703 T704	N685-N687 PolarHBondContact O-N 2.76Å; N685-N687 VanDerWaalsContact OD1-CB 3.3Å; N685-N687 WeakPolarHBondContact OD1-CB 3.11Å; N685-N687 PolarHBondContact OD1-N 3.07Å; N685-N687 VanDerWaalsContact OD1-N 3.09Å; N685-N687 PolarHBondContact OD1-ND2 3.13Å; N687-P703 CarbonylContact O-C 3.6Å; N687-P703 WeakPolarHBondContact O-CA 3.34Å; N687-T704 PolarHBondContact O-N 3.5Å
688	W	83.2	Confident	78.9	Confident	33 Å²	33	70.1 Å²	70.1	13%	0.125	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	135.2	178.5	-66.8	90.3	0	0	0	110.9	Q634 Y680 G681 T686 F701 P703 T704	Q634-W688 HydrophobicContact CG-CH2 4.04Å; Q634-W688 HydrophobicContact CG-CZ2 4.13Å; Y680-W688 CarbonylContact C-O 3.51Å; Y680-W688 WeakPolarHBondContact CA-O 3.48Å; Y680-W688 PolarHBondContact N-O 2.92Å; G681-W688 PolarHBondContact N-O 3.34Å; T686-W688 PolarHBondContact O-N 3.1Å; W688-F701 HydrophobicContact CB-CD1 4.21Å; W688-F701 HydrophobicContact CE3-CB 3.95Å; W688-P703 HydrophobicContact CE3-CG 4.34Å; W688-P703 HydrophobicContact CH2-CG 4.11Å; W688-P703 HydrophobicContact CZ3-CG 3.87Å; W688-T704 PolarHBondContact N-OG1 3.28Å
689	S	85.6	Confident	78.9	Confident	1 Å²	1	70.3 Å²	70.3	1%	0.007	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	142.3	171.6	-69.6	0	0	0	0	109.9	R678 F701 V702 T704	R678-S689 CarbonylContact O-C 3.43Å; R678-S689 WeakPolarHBondContact O-CA 3.33Å; S689-F701 WeakPolarHBondContact O-CA 3.34Å; S689-V702 PolarHBondContact N-O 3.37Å; S689-V702 PolarHBondContact O-N 3.48Å; S689-T704 PolarHBondContact N-OG1 3.41Å; S689-T704 PolarHBondContact OG-OG1 2.96Å
690	L	87.6	Confident	78.8	Confident	21 Å²	21	67.4 Å²	67.4	11%	0.11	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	128.1	170.6	-166.9	79.7	0	0	0	108.3	I677 R678 I699 K700 F701	I677-L690 HydrophobicContact CB-CD2 4.28Å; I677-L690 HydrophobicContact CD1-CD2 4.19Å; I677-L690 HydrophobicContact CD1-CG 4.4Å; I677-L690 HydrophobicContact CG2-CD2 4.19Å; I677-L690 PolarHBondContact N-O 2.83Å; R678-L690 HydrophobicContact CG-CB 3.59Å; R678-L690 HydrophobicContact CG-CD2 4.49Å; R678-L690 PolarHBondContact N-O 2.67Å; R678-L690 PolarHBondContact O-N 3.42Å; L690-I699 HydrophobicContact CD1-CG2 3.92Å; L690-I699 HydrophobicContact CD2-CG2 3.67Å; L690-I699 HydrophobicContact CG-CG2 3.71Å; L690-K700 WeakPolarHBondContact CA-O 3.41Å; L690-F701 HydrophobicContact CB-CD1 4.13Å; L690-F701 HydrophobicContact CB-CE1 4.09Å; L690-F701 HydrophobicContact CD1-CD1 3.87Å; L690-F701 HydrophobicContact CD1-CD2 3.93Å; L690-F701 HydrophobicContact CD1-CE1 3.98Å; L690-F701 HydrophobicContact CD1-CE2 4.05Å; L690-F701 HydrophobicContact CD1-CG 3.88Å; L690-F701 HydrophobicContact CD1-CZ 4.13Å
691	V	88.3	Confident	79	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	147.2	-175.8	-46.3	0	0	0	0	111.6	V674 T675 I676 F693 I699 K700 V702 L707	V674-V691 HydrophobicContact CB-CB 3.9Å; V674-V691 HydrophobicContact CB-CG2 3.75Å; V674-V691 HydrophobicContact CG1-CG2 3.82Å; V674-V691 HydrophobicContact CG2-CB 3.93Å; V674-V691 HydrophobicContact CG2-CG1 4.16Å; V674-V691 HydrophobicContact CG2-CG2 3.96Å; T675-V691 CarbonylContact O-C 3.4Å; T675-V691 VanDerWaalsContact O-CA 3.24Å; T675-V691 WeakPolarHBondContact O-CA 3.4Å; I676-V691 HydrophobicContact CG1-CG1 4.04Å; V691-F693 HydrophobicContact CG2-CD2 3.83Å; V691-F693 HydrophobicContact CG2-CE2 3.47Å; V691-F693 VanDerWaalsContact CG2-CE2 3.47Å; V691-F693 HydrophobicContact CG2-CZ 4.42Å; V691-I699 WeakPolarHBondContact O-CA 3.46Å; V691-K700 PolarHBondContact N-O 3.08Å; V691-K700 PolarHBondContact O-N 3.24Å; V691-V702 HydrophobicContact CG2-CB 4.42Å; V691-V702 HydrophobicContact CG2-CG2 3.55Å; V691-L707 HydrophobicContact CG1-CD1 3.8Å; V691-L707 HydrophobicContact CG1-CD2 4.32Å
692	K	88.7	Confident	79.6	Confident	60 Å²	60	62 Å²	62	26%	0.261	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	123.2	168.6	-168.5	179.2	-179.5	-176.5	0	108.2	V674 T675 I677 I699	V674-K692 CarbonylContact C-O 3.59Å; V674-K692 WeakPolarHBondContact CA-O 3.46Å; V674-K692 WeakPolarHBondContact CB-O 3.44Å; T675-K692 PolarHBondContact N-O 3.21Å; T675-K692 PolarHBondContact O-N 3.33Å; I677-K692 HydrophobicContact CD1-CB 4.04Å; I677-K692 HydrophobicContact CG1-CB 4.34Å; K692-I699 HydrophobicContact CB-CG1 4.44Å; K692-I699 HydrophobicContact CG-CG1 4.33Å
693	F	87.6	Confident	80.9	Confident	6 Å²	6	55.4 Å²	55.4	3%	0.026	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	136.9	177.8	-80	-119.9	0	0	0	110.7	I654 S668 Q672 V674 V691 G697 E698 K700 V702	I654-F693 HydrophobicContact CD1-CE1 3.61Å; I654-F693 HydrophobicContact CD1-CZ 3.55Å; S668-F693 WeakPolarHBondContact OG-CE1 3.45Å; S668-F693 WeakPolarHBondContact OG-CZ 3.34Å; Q672-F693 HydrophobicContact CG-CD1 3.91Å; Q672-F693 HydrophobicContact CG-CE1 4.31Å; V674-F693 HydrophobicContact CG1-CD1 4.23Å; V674-F693 HydrophobicContact CG1-CD2 4.07Å; V674-F693 HydrophobicContact CG1-CE1 4.37Å; V674-F693 HydrophobicContact CG1-CE2 4.19Å; V674-F693 HydrophobicContact CG1-CG 4.07Å; V674-F693 HydrophobicContact CG1-CZ 4.35Å; V691-F693 HydrophobicContact CG2-CD2 3.83Å; V691-F693 HydrophobicContact CG2-CE2 3.47Å; V691-F693 VanDerWaalsContact CG2-CE2 3.47Å; V691-F693 HydrophobicContact CG2-CZ 4.42Å; F693-G697 VanDerWaalsContact O-CA 3.3Å; F693-G697 WeakPolarHBondContact O-CA 3.27Å; F693-G697 PolarHBondContact O-N 2.74Å; F693-E698 HydrophobicContact CB-CB 4.38Å; F693-E698 WeakPolarHBondContact CB-O 3.49Å; F693-E698 WeakPolarHBondContact CD2-O 3.34Å; F693-E698 PolarHBondContact N-O 2.9Å; F693-K700 HydrophobicContact CD2-CB 4.27Å; F693-K700 HydrophobicContact CD2-CD 4.1Å; F693-K700 HydrophobicContact CE2-CB 3.75Å; F693-K700 HydrophobicContact CE2-CD 3.89Å; F693-K700 HydrophobicContact CE2-CG 4.38Å; F693-K700 HydrophobicContact CZ-CD 4.19Å; F693-V702 HydrophobicContact CE2-CG2 3.88Å; F693-V702 HydrophobicContact CZ-CG2 3.88Å
694	H	83.3	Confident	82.1	Confident	28 Å²	28	49.8 Å²	49.8	13%	0.13	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	147.8	174.2	-76.5	-81.6	0	0	0	111.6	D648 Q672 L673 T675	D648-H694 IonicContact OD1-CE1 2.83Å; Q672-H694 PolarHBondContact NE2-O 2.78Å; L673-H694 HydrophobicContact CB-CB 4.22Å; L673-H694 PolarHBondContact O-N 3.32Å; T675-H694 PolarHBondContact OG1-NE2 3.46Å
695	P	74	Confident	83	Confident	102 Å²	102	53.2 Å²	53.2	66%	0.662	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	cis	-83.1	-10.5	-7.6	34.3	-36.1	0	0	0	113.8	G697	P695-G697 VanDerWaalsContact C-N 3.31Å; P695-G697 PolarHBondContact O-N 3.12Å
696	F	67.1	Low	83.6	Confident	170 Å²	170	51.4 Å²	51.4	75%	0.746	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	3.3	-164.1	-57.8	-71.6	0	0	0	116.2	E698	F696-E698 VanDerWaalsContact C-N 3.26Å; F696-E698 PolarHBondContact O-N 3.34Å; F696-E698 VanDerWaalsContact O-N 3.16Å
697	G	77.9	Confident	83.8	Confident	27 Å²	27	48 Å²	48	28%	0.278	25%	0.249	S	C	.	.			trans	73.2	2.1	169.7	0	0	0	0	0	116.7	F693 P695 I699	F693-G697 VanDerWaalsContact O-CA 3.3Å; F693-G697 WeakPolarHBondContact O-CA 3.27Å; F693-G697 PolarHBondContact O-N 2.74Å; P695-G697 VanDerWaalsContact C-N 3.31Å; P695-G697 PolarHBondContact O-N 3.12Å; G697-I699 PolarHBondContact O-N 2.75Å
698	E	79.7	Confident	84.1	Confident	103 Å²	103	48.5 Å²	48.5	48%	0.481	25%	0.248	S	C	.	.			trans	-62.5	127.9	-177.8	-68.8	-172.1	100.5	0	0	112.2	F693 F696 K700	F693-E698 HydrophobicContact CB-CB 4.38Å; F693-E698 WeakPolarHBondContact CB-O 3.49Å; F693-E698 WeakPolarHBondContact CD2-O 3.34Å; F693-E698 PolarHBondContact N-O 2.9Å; F696-E698 VanDerWaalsContact C-N 3.26Å; F696-E698 PolarHBondContact O-N 3.34Å; F696-E698 VanDerWaalsContact O-N 3.16Å; E698-K700 HydrophobicContact CB-CD 4.31Å; E698-K700 WeakPolarHBondContact OE1-CE 3.49Å; E698-K700 IonicContact OE1-NZ 2.74Å; E698-K700 PolarHBondContact OE1-NZ 2.98Å; E698-K700 VanDerWaalsContact OE1-NZ 3.07Å; E698-K700 WeakPolarHBondContact OE2-CE 3.41Å; E698-K700 IonicContact OE2-NZ 3.8Å; E698-K700 PolarHBondContact OE2-NZ 3.04Å
699	I	84.8	Confident	84.4	Confident	76 Å²	76	50.3 Å²	50.3	39%	0.39	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	116.3	-179.3	-62.2	176.7	0	0	0	110.1	I677 L690 V691 K692 G697	I677-I699 HydrophobicContact CD1-CB 4.25Å; I677-I699 HydrophobicContact CD1-CD1 3.82Å; I677-I699 HydrophobicContact CD1-CG1 3.78Å; I677-I699 HydrophobicContact CD1-CG2 3.56Å; L690-I699 HydrophobicContact CD1-CG2 3.92Å; L690-I699 HydrophobicContact CD2-CG2 3.67Å; L690-I699 HydrophobicContact CG-CG2 3.71Å; V691-I699 WeakPolarHBondContact O-CA 3.46Å; K692-I699 HydrophobicContact CB-CG1 4.44Å; K692-I699 HydrophobicContact CG-CG1 4.33Å; G697-I699 PolarHBondContact O-N 2.75Å
700	K	80.9	Confident	84.4	Confident	13 Å²	13	56.4 Å²	56.4	6%	0.057	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	160	-172.8	-68.5	160.3	176.3	174.8	0	111.5	V665 L690 V691 F693 E698	V665-K700 HydrophobicContact CG1-CD 3.56Å; V665-K700 VanDerWaalsContact CG1-CE 3.48Å; V665-K700 HydrophobicContact CG1-CG 4.09Å; V665-K700 HydrophobicContact CG2-CD 4.24Å; V665-K700 HydrophobicContact CG2-CG 4.11Å; L690-K700 WeakPolarHBondContact CA-O 3.41Å; V691-K700 PolarHBondContact N-O 3.08Å; V691-K700 PolarHBondContact O-N 3.24Å; F693-K700 HydrophobicContact CD2-CB 4.27Å; F693-K700 HydrophobicContact CD2-CD 4.1Å; F693-K700 HydrophobicContact CE2-CB 3.75Å; F693-K700 HydrophobicContact CE2-CD 3.89Å; F693-K700 HydrophobicContact CE2-CG 4.38Å; F693-K700 HydrophobicContact CZ-CD 4.19Å; E698-K700 HydrophobicContact CB-CD 4.31Å; E698-K700 WeakPolarHBondContact OE1-CE 3.49Å; E698-K700 IonicContact OE1-NZ 2.74Å; E698-K700 PolarHBondContact OE1-NZ 2.98Å; E698-K700 VanDerWaalsContact OE1-NZ 3.07Å; E698-K700 WeakPolarHBondContact OE2-CE 3.41Å; E698-K700 IonicContact OE2-NZ 3.8Å; E698-K700 PolarHBondContact OE2-NZ 3.04Å
701	F	84.6	Confident	84.2	Confident	23 Å²	23	58.2 Å²	58.2	10%	0.101	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	134.7	168.1	-78	-72.7	0	0	0	110.5	P635 W688 S689 L690	P635-F701 HydrophobicContact CB-CD2 3.84Å; P635-F701 HydrophobicContact CB-CE2 3.66Å; P635-F701 HydrophobicContact CB-CZ 4.3Å; P635-F701 HydrophobicContact CG-CB 4.16Å; P635-F701 HydrophobicContact CG-CD1 4.39Å; P635-F701 HydrophobicContact CG-CD2 3.48Å; P635-F701 VanDerWaalsContact CG-CD2 3.48Å; P635-F701 HydrophobicContact CG-CE2 3.74Å; P635-F701 HydrophobicContact CG-CG 3.79Å; P635-F701 HydrophobicContact CG-CZ 4.27Å; W688-F701 HydrophobicContact CB-CD1 4.21Å; W688-F701 HydrophobicContact CE3-CB 3.95Å; S689-F701 WeakPolarHBondContact O-CA 3.34Å; L690-F701 HydrophobicContact CB-CD1 4.13Å; L690-F701 HydrophobicContact CB-CE1 4.09Å; L690-F701 HydrophobicContact CD1-CD1 3.87Å; L690-F701 HydrophobicContact CD1-CD2 3.93Å; L690-F701 HydrophobicContact CD1-CE1 3.98Å; L690-F701 HydrophobicContact CD1-CE2 4.05Å; L690-F701 HydrophobicContact CD1-CG 3.88Å; L690-F701 HydrophobicContact CD1-CZ 4.13Å
702	V	83.5	Confident	84	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	144	175.2	-178.7	0	0	0	0	107.5	I654 F658 S689 V691 F693 T704 L707	I654-V702 HydrophobicContact CD1-CG1 4.49Å; I654-V702 HydrophobicContact CD1-CG2 4.26Å; F658-V702 HydrophobicContact CE1-CB 4.36Å; F658-V702 HydrophobicContact CE1-CG1 3.81Å; F658-V702 HydrophobicContact CE1-CG2 4.07Å; F658-V702 HydrophobicContact CZ-CB 4.29Å; F658-V702 HydrophobicContact CZ-CG1 4.22Å; F658-V702 HydrophobicContact CZ-CG2 3.89Å; S689-V702 PolarHBondContact N-O 3.37Å; S689-V702 PolarHBondContact O-N 3.48Å; V691-V702 HydrophobicContact CG2-CB 4.42Å; V691-V702 HydrophobicContact CG2-CG2 3.55Å; F693-V702 HydrophobicContact CE2-CG2 3.88Å; F693-V702 HydrophobicContact CZ-CG2 3.88Å; V702-T704 PolarHBondContact O-N 3.08Å; V702-L707 HydrophobicContact CB-CD2 4.31Å; V702-L707 HydrophobicContact CG1-CD2 3.85Å; V702-L707 HydrophobicContact CG1-CG 4.21Å
703	P	86.6	Confident	83.8	Confident	18 Å²	18	61.3 Å²	61.3	12%	0.117	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	131.6	170.8	-23	34.4	0	0	0	110.4	N687 W688 N705 Y706	N687-P703 CarbonylContact O-C 3.6Å; N687-P703 WeakPolarHBondContact O-CA 3.34Å; W688-P703 HydrophobicContact CE3-CG 4.34Å; W688-P703 HydrophobicContact CH2-CG 4.11Å; W688-P703 HydrophobicContact CZ3-CG 3.87Å; P703-N705 VanDerWaalsContact CB-OD1 3.24Å; P703-N705 WeakPolarHBondContact CB-OD1 3.36Å; P703-N705 PolarHBondContact O-N 2.84Å; P703-Y706 HydrophobicContact CB-CD1 3.8Å; P703-Y706 HydrophobicContact CB-CE1 4.31Å; P703-Y706 HydrophobicContact CB-CG 4.02Å; P703-Y706 HydrophobicContact CG-CD1 4.25Å; P703-Y706 HydrophobicContact CG-CD2 4.36Å; P703-Y706 HydrophobicContact CG-CG 4.18Å; P703-Y706 WeakPolarHBondContact O-CB 3.45Å; P703-Y706 PolarHBondContact O-N 3.19Å
704	T	87.5	Confident	83.5	Confident	48 Å²	48	64.5 Å²	64.5	29%	0.294	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-61.7	-32.6	-173.6	-56.8	0	0	0	0	111.9	T686 N687 W688 S689 V702 Y706 L707	T686-T704 WeakPolarHBondContact O-CB 3.42Å; T686-T704 PolarHBondContact O-OG1 3.42Å; N687-T704 PolarHBondContact O-N 3.5Å; W688-T704 PolarHBondContact N-OG1 3.28Å; S689-T704 PolarHBondContact N-OG1 3.41Å; S689-T704 PolarHBondContact OG-OG1 2.96Å; V702-T704 PolarHBondContact O-N 3.08Å; T704-Y706 PolarHBondContact O-N 3.09Å; T704-L707 PolarHBondContact O-N 3.29Å
705	N	88.4	Confident	83.5	Confident	118 Å²	118	66.8 Å²	66.8	63%	0.631	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-73.5	-2.8	175.3	65.5	-38.1	0	0	0	114.7	P703	P703-N705 VanDerWaalsContact CB-OD1 3.24Å; P703-N705 WeakPolarHBondContact CB-OD1 3.36Å; P703-N705 PolarHBondContact O-N 2.84Å
706	Y	89.2	Confident	84.2	Confident	30 Å²	30	64.5 Å²	64.5	12%	0.118	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-97.6	1.7	174.9	-76.6	36.6	0	0	0	111.4	I654 T655 H656 F658 P703 T704	I654-Y706 CarbonylContact C-O 3.58Å; I654-Y706 WeakPolarHBondContact CA-O 3.41Å; T655-Y706 PolarHBondContact N-O 3.36Å; T655-Y706 PolarHBondContact OG1-O 3.18Å; H656-Y706 HydrophobicContact CB-CD2 3.61Å; H656-Y706 HydrophobicContact CB-CE2 3.5Å; H656-Y706 VanDerWaalsContact CB-CE2 3.5Å; H656-Y706 HydrophobicContact CB-CG 4.21Å; F658-Y706 HydrophobicContact CB-CD2 4.32Å; F658-Y706 HydrophobicContact CB-CE2 3.91Å; F658-Y706 HydrophobicContact CD1-CD2 4.11Å; P703-Y706 HydrophobicContact CB-CD1 3.8Å; P703-Y706 HydrophobicContact CB-CE1 4.31Å; P703-Y706 HydrophobicContact CB-CG 4.02Å; P703-Y706 HydrophobicContact CG-CD1 4.25Å; P703-Y706 HydrophobicContact CG-CD2 4.36Å; P703-Y706 HydrophobicContact CG-CG 4.18Å; P703-Y706 WeakPolarHBondContact O-CB 3.45Å; P703-Y706 PolarHBondContact O-N 3.19Å; T704-Y706 PolarHBondContact O-N 3.09Å
707	L	88.6	Confident	85.4	Confident	25 Å²	25	56.9 Å²	56.9	13%	0.131	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	123.8	-179.6	-59.5	176.2	0	0	0	110.3	H652 I654 V674 I676 V691 V702 T704	H652-L707 HydrophobicContact CB-CB 4.33Å; H652-L707 HydrophobicContact CB-CD2 4.46Å; I654-L707 HydrophobicContact CG1-CD2 4.25Å; V674-L707 HydrophobicContact CG2-CD2 3.76Å; I676-L707 HydrophobicContact CD1-CD1 3.84Å; I676-L707 HydrophobicContact CG1-CD1 4.03Å; V691-L707 HydrophobicContact CG1-CD1 3.8Å; V691-L707 HydrophobicContact CG1-CD2 4.32Å; V702-L707 HydrophobicContact CB-CD2 4.31Å; V702-L707 HydrophobicContact CG1-CD2 3.85Å; V702-L707 HydrophobicContact CG1-CG 4.21Å; T704-L707 PolarHBondContact O-N 3.29Å
708	E	89.8	Confident	86	Confident	116 Å²	116	59.2 Å²	59.2	54%	0.542	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	136.9	171.7	175.9	174.2	-137.1	0	0	108.3	H652 R653 T655	H652-E708 CarbonylContact C-O 3.5Å; H652-E708 WeakPolarHBondContact CA-O 3.38Å; H652-E708 WeakPolarHBondContact CB-O 3.29Å; R653-E708 PolarHBondContact N-O 3.48Å; R653-E708 PolarHBondContact O-N 2.91Å; T655-E708 HydrophobicContact CG2-CB 3.37Å; T655-E708 HydrophobicContact CG2-CG 4.32Å; T655-E708 WeakPolarHBondContact CG2-OE2 3.37Å
709	A	89.1	Confident	86.5	Confident	71 Å²	71	55.6 Å²	55.6	59%	0.587	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.1	145.7	177.2	0	0	0	0	0	110.7
710	I	85.1	Confident	86.7	Confident	129 Å²	129	53.7 Å²	53.7	66%	0.662	29%	0.294	S	S	*	.			trans	-87.1	0	177.2	-60.1	160.8	0	0	0	110.7	P650 T651 H652 R653 L673	P650-I710 HydrophobicContact CB-CD1 3.79Å; P650-I710 HydrophobicContact CG-CD1 4.23Å; T651-I710 PolarHBondContact O-N 3.42Å; T651-I710 VanDerWaalsContact O-N 3.08Å; H652-I710 WeakPolarHBondContact O-CD1 3.46Å; R653-I710 HydrophobicContact CB-CG1 4.21Å; L673-I710 HydrophobicContact CD2-CD1 3.63Å; L673-I710 HydrophobicContact CD2-CG1 4.32Å

Retrieved 710 of 710 residues in 171.8 ms (Link to these results)

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