A0A077YX19_TRITR Loading...

BTB domain containing protein

AlphaFold DB , UniProt , Accession A0A077YX19, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 773 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.4	Very low	31.8	Very low	237 Å²	237	170 Å²	170	100%	1.167	81%	0.812	S	S	*	*				0	87.8	0	-134	159.4	175.7	0	0	106.2
2	M	29.5	Very low	31.9	Very low	176 Å²	176	172.2 Å²	172.2	87%	0.867	82%	0.816	S	S	*	*				60.9	130.2	99.8	-79.9	-161.3	172.2	0	0	113.7
3	L	31.2	Very low	31.9	Very low	131 Å²	131	168.2 Å²	168.2	69%	0.686	80%	0.802	S	S	*	*			cis	-163.8	146	-7.1	-167.9	69.1	0	0	0	110
4	K	31.2	Very low	31.7	Very low	179 Å²	179	167.2 Å²	167.2	78%	0.778	80%	0.803	S	S	*	*			trans	8.6	143.8	156.9	-55.8	168.8	-179.2	177.1	0	120.9
5	I	40	Very low	31.9	Very low	178 Å²	178	164.3 Å²	164.3	91%	0.913	81%	0.806	S	S	*	*				-158.1	144.1	118.2	-97	147.6	0	0	0	110.4
6	R	27.7	Very low	31.9	Very low	228 Å²	228	158.4 Å²	158.4	86%	0.86	80%	0.801	S	S	*	*			trans	-136	138.7	179.1	-94.4	-176	169.5	-178	-3.8	109.2
7	L	32.6	Very low	31.9	Very low	155 Å²	155	158.2 Å²	158.2	81%	0.812	80%	0.803	S	S	*	*			trans	-174.4	138.5	146.5	-132.3	67.3	0	0	0	108.5
8	T	29.1	Very low	31.8	Very low	101 Å²	101	157.1 Å²	157.1	62%	0.62	81%	0.805	S	S	*	*			cis	103.7	85.8	-4.6	-41.8	0	0	0	0	117.9
9	F	33.1	Very low	31.7	Very low	191 Å²	191	153.5 Å²	153.5	84%	0.838	80%	0.801	S	S	*	*			trans	-145.7	109.2	157.1	-102.1	-88.4	0	0	0	107.2
10	F	32.2	Very low	31.6	Very low	169 Å²	169	154.6 Å²	154.6	74%	0.741	81%	0.806	S	S	*	*				57.7	108.3	79.5	-98.9	-94.4	0	0	0	113.7
11	L	27.9	Very low	31.5	Very low	125 Å²	125	151.4 Å²	151.4	65%	0.654	80%	0.802	S	S	*	*			cis	97.7	111.4	39.8	-167.5	158.6	0	0	0	112.8
12	F	32.7	Very low	31.2	Very low	196 Å²	196	150 Å²	150	86%	0.86	78%	0.784	S	S	*	*			trans	-173.2	101	158.9	-109.9	-85.8	0	0	0	108.4
13	L	31.5	Very low	31.3	Very low	121 Å²	121	153.5 Å²	153.5	63%	0.634	79%	0.789	S	S	*	*				82.5	114.7	88.4	-70.6	-173.5	0	0	0	118
14	L	29	Very low	31.2	Very low	154 Å²	154	154.9 Å²	154.9	81%	0.806	79%	0.792	S	S	*	*			trans	47.2	115.4	136.2	-59.4	166.2	0	0	0	121.6
15	S	35.8	Very low	31.2	Very low	123 Å²	123	149.6 Å²	149.6	86%	0.86	79%	0.789	S	S	*	*				163.9	149.3	100.7	58.7	0	0	0	0	114.5
16	G	31.2	Very low	30.8	Very low	70 Å²	70	152 Å²	152	72%	0.722	79%	0.788	S	S	*	*			trans	81.5	90.9	139.9	0	0	0	0	0	121.7
17	N	32.1	Very low	31	Very low	155 Å²	155	151.6 Å²	151.6	83%	0.829	79%	0.786	S	S	*	*			trans	45.1	120.5	133.7	-66	-11.3	0	0	0	123.4
18	V	29.5	Very low	30.9	Very low	139 Å²	139	152.4 Å²	152.4	84%	0.842	79%	0.791	S	S	*	*			trans	57.6	100.1	132.1	-170.7	0	0	0	0	118.8
19	A	30.5	Very low	31	Very low	89 Å²	89	156 Å²	156	74%	0.736	81%	0.805	S	S	*	*				173.6	133.6	116.9	0	0	0	0	0	113
20	I	29.1	Very low	30.9	Very low	174 Å²	174	153.4 Å²	153.4	89%	0.892	80%	0.799	S	S	*	*			trans	9.9	106.7	146.5	-48.4	169.3	0	0	0	117
21	A	29.3	Very low	30.8	Very low	88 Å²	88	156.8 Å²	156.8	73%	0.727	81%	0.807	S	S	*	*			trans	171.1	155.4	134.7	0	0	0	0	0	114.1
22	R	30.8	Very low	30.9	Very low	209 Å²	209	158.1 Å²	158.1	79%	0.789	82%	0.815	S	S	*	*			trans	60.5	97.9	156.8	-72.5	176.3	179	158.9	-0.6	119.5	E24	R22-E24 PolarHBondContact O-N 3Å; R22-E24 VanDerWaalsContact O-N 3.12Å
23	Y	30.1	Very low	30.7	Very low	248 Å²	248	154.1 Å²	154.1	97%	0.973	81%	0.808	S	S	*	*			trans	-73.5	77.1	145.5	-108.5	-98.2	0	0	0	109.9
24	E	30.3	Very low	30.8	Very low	161 Å²	161	156.2 Å²	156.2	75%	0.752	82%	0.815	S	S	*	*			trans	-120.3	104.3	162.6	-79.2	-172.4	147	0	0	107.7	R22	R22-E24 PolarHBondContact O-N 3Å; R22-E24 VanDerWaalsContact O-N 3.12Å
25	G	30.5	Very low	30.9	Very low	68 Å²	68	160.4 Å²	160.4	70%	0.701	82%	0.82	S	S	*	*			trans	-172.7	12.3	-168.3	0	0	0	0	0	119.1
26	Y	30.8	Very low	30.6	Very low	228 Å²	228	158.9 Å²	158.9	89%	0.894	82%	0.815	S	S	*	*			trans	-144.7	70.7	171.4	-91.2	-78.7	0	0	0	111.8
27	W	32.5	Very low	30.6	Very low	220 Å²	220	163.2 Å²	163.2	83%	0.833	82%	0.821	S	S	*	*			trans	-134.7	13.4	171.2	-97.9	104.8	0	0	0	113.8	L30	W27-L30 HydrophobicContact CE3-CD1 4.15Å; W27-L30 HydrophobicContact CZ3-CD1 3.7Å
28	L	31	Very low	30.7	Very low	172 Å²	172	165.5 Å²	165.5	90%	0.901	82%	0.824	S	S	*	*			trans	-115.3	57.7	-173.9	-83.3	165.5	0	0	0	113.7
29	L	31.5	Very low	30.8	Very low	177 Å²	177	165.6 Å²	165.6	93%	0.927	82%	0.82	S	S	*	*			trans	-127.8	7.9	156.6	-82.4	176.8	0	0	0	113.7	R31	L29-R31 PolarHBondContact O-N 2.92Å
30	L	30.3	Very low	31.1	Very low	135 Å²	135	171 Å²	171	71%	0.707	83%	0.826	S	S	*	*			trans	-92.8	77.8	169.3	-74.5	170	0	0	0	111.3	W27	W27-L30 HydrophobicContact CE3-CD1 4.15Å; W27-L30 HydrophobicContact CZ3-CD1 3.7Å
31	R	31.1	Very low	31.4	Very low	241 Å²	241	170.1 Å²	170.1	91%	0.909	82%	0.824	S	S	*	*			trans	177.4	89.1	151.7	-102.4	167.9	-172.6	-164.5	3.5	111.5	L29	L29-R31 PolarHBondContact O-N 2.92Å
32	N	29.7	Very low	31.8	Very low	153 Å²	153	172.7 Å²	172.7	82%	0.818	82%	0.824	S	S	*	*			trans	-149.5	79.9	146.6	-160.7	6	0	0	0	110.9	Q34	N32-Q34 PolarHBondContact O-N 3.04Å
33	P	28.8	Very low	32.3	Very low	111 Å²	111	168.1 Å²	168.1	72%	0.721	82%	0.819	S	S	*	*			trans	-86.1	88	-178.9	34	-30.9	0	0	0	110.3
34	Q	32.8	Very low	32.8	Very low	165 Å²	165	162.8 Å²	162.8	77%	0.771	81%	0.813	S	S	*	*			trans	-167.2	127.7	148.9	-83.3	-131.4	-6	0	0	111.4	N32	N32-Q34 PolarHBondContact O-N 3.04Å
35	R	31.3	Very low	33.4	Very low	242 Å²	242	157.7 Å²	157.7	91%	0.913	79%	0.794	S	S	*	*			trans	70.7	135.2	178.4	-52	173.7	176.2	-177.8	-2.9	116
36	A	30.6	Very low	34.1	Very low	91 Å²	91	161.7 Å²	161.7	75%	0.752	80%	0.799	S	S	*	*			cis	-161.2	124.3	-19.9	0	0	0	0	0	110.3
37	N	29.7	Very low	35.1	Very low	161 Å²	161	156.2 Å²	156.2	86%	0.861	78%	0.782	S	S	*	*			trans	56.4	80.1	146.8	-158.1	13.2	0	0	0	118.6
38	K	34.1	Very low	36.2	Very low	204 Å²	204	151.5 Å²	151.5	89%	0.887	77%	0.772	S	S	*	*			trans	-159	33.3	153.3	-122.4	178.5	-171.3	-173.9	0	116.4
39	D	33.2	Very low	37	Very low	140 Å²	140	146.5 Å²	146.5	75%	0.749	75%	0.752	S	S	*	*			trans	-98.1	109.8	174	-62.7	-49.2	0	0	0	111.1	I42	D39-I42 HydrophobicContact CB-CD1 4.48Å
40	K	35.6	Very low	38.2	Very low	202 Å²	202	144.6 Å²	144.6	88%	0.878	73%	0.732	S	S	*	*			trans	-120.7	137.8	157.6	-77	-171.7	175.5	-174.9	0	106.8
41	N	35.2	Very low	39.8	Very low	157 Å²	157	141.8 Å²	141.8	84%	0.84	72%	0.724	S	S	*	*			trans	74.5	66	-172.4	-56.7	4.1	0	0	0	115.3
42	I	38.5	Very low	41.2	Very low	142 Å²	142	133.8 Å²	133.8	73%	0.728	70%	0.702	S	S	*	*			trans	-97.6	100.2	147.6	-61.5	175.4	0	0	0	106.4	D39	D39-I42 HydrophobicContact CB-CD1 4.48Å
43	T	40.2	Very low	43	Very low	113 Å²	113	130.3 Å²	130.3	69%	0.693	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-83.2	120.7	168.9	32.6	0	0	0	0	109.1	C45	T43-C45 PolarHBondContact O-N 2.97Å
44	T	41.2	Very low	45.4	Very low	135 Å²	135	131.1 Å²	131.1	83%	0.828	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-72.9	117.4	170	44.3	0	0	0	0	109.2
45	C	42.3	Very low	47.7	Very low	54 Å²	54	126.1 Å²	126.1	37%	0.365	66%	0.662	S	S	.	*	P	Polyproline II helix	trans	-96.8	122.5	175.9	-174.9	0	0	0	0	110	T43 Q47 C200	T43-C45 PolarHBondContact O-N 2.97Å; C45-Q47 VanDerWaalsContact C-N 3.34Å; C45-Q47 PolarHBondContact SG-O 3.35Å; C45-C200 HydrophobicContact CB-CB 4.27Å; C45-C200 WeakPolarHBondContact CB-SG 3.36Å; C45-C200 WeakPolarHBondContact SG-CB 3.48Å; C45-C200 CovalentContact SG-SG 2.03Å; C45-C200 PolarHBondContact SG-SG 3.35Å
46	D	44.9	Very low	50.1	Low	152 Å²	152	116.3 Å²	116.3	81%	0.813	63%	0.628	S	S	*	*	S	Bend	trans	-94.7	10.9	179.2	51.5	-18.8	0	0	0	112.8
47	Q	53.4	Low	52.7	Low	113 Å²	113	116.9 Å²	116.9	53%	0.528	62%	0.615	S	S	.	*	S	Bend	trans	-131.7	-174.6	178.1	-61.9	-168.2	0.3	0	0	111.9	C45 S49	C45-Q47 VanDerWaalsContact C-N 3.34Å; C45-Q47 PolarHBondContact SG-O 3.35Å; Q47-S49 PolarHBondContact O-N 3.07Å
48	I	54	Low	55.4	Low	121 Å²	121	109.7 Å²	109.7	62%	0.621	58%	0.577	S	S	*	*			trans	-70.9	114.6	177.4	-59.6	175.1	0	0	0	109.3
49	S	48.9	Very low	57.9	Low	68 Å²	68	103 Å²	103	48%	0.476	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	129.3	166.5	61.1	0	0	0	0	110.5	Q47 A199	Q47-S49 PolarHBondContact O-N 3.07Å; S49-A199 CarbonylContact C-O 3.56Å; S49-A199 WeakPolarHBondContact CA-O 3.19Å
50	R	56.9	Low	60.4	Low	136 Å²	136	96.3 Å²	96.3	51%	0.513	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	119.9	173.2	-172.6	-179.4	-67.5	93.9	1.6	110	A199 D201	R50-A199 PolarHBondContact N-O 3.23Å; R50-A199 PolarHBondContact O-N 2.74Å; R50-D201 IonicContact NH1-OD1 2.99Å; R50-D201 PolarHBondContact NH1-OD1 3.23Å; R50-D201 VanDerWaalsContact NH1-OD1 3.11Å; R50-D201 IonicContact NH1-OD2 3.04Å
51	S	64.1	Low	62.9	Low	76 Å²	76	89.5 Å²	89.5	53%	0.531	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	130.2	170.6	-53.5	0	0	0	0	110.6	S197 T198	S51-S197 CarbonylContact C-O 3.52Å; S51-S197 VanDerWaalsContact CA-O 3.29Å; S51-S197 WeakPolarHBondContact CA-O 3.34Å; S51-T198 WeakPolarHBondContact CB-OG1 3.28Å; S51-T198 WeakPolarHBondContact OG-CG2 3.36Å; S51-T198 PolarHBondContact OG-OG1 3.48Å
52	T	59.7	Low	65.6	Low	74 Å²	74	82 Å²	82	45%	0.454	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	141.4	175	45.7	0	0	0	0	110	I196 S197	T52-I196 WeakPolarHBondContact O-CA 3.32Å; T52-S197 PolarHBondContact N-O 3.34Å; T52-S197 PolarHBondContact O-N 2.98Å; T52-S197 PolarHBondContact O-OG 3.38Å; T52-S197 PolarHBondContact OG1-OG 2.89Å
53	V	68.6	Low	67.9	Low	79 Å²	79	76.6 Å²	76.6	48%	0.479	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	127.3	170.4	65.1	0	0	0	0	109.3	Y193 E195 I196	V53-Y193 HydrophobicContact CG2-CD1 3.81Å; V53-Y193 HydrophobicContact CG2-CG 4.48Å; V53-E195 WeakPolarHBondContact CA-O 3.35Å; V53-I196 HydrophobicContact CB-CG1 4.45Å; V53-I196 HydrophobicContact CG2-CG1 4.2Å
54	K	77.4	Confident	70.2	Confident	128 Å²	128	71.2 Å²	71.2	56%	0.557	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	127.3	169.8	-173.7	177.4	179.4	-178	0	108.4	D194 E195	K54-D194 HydrophobicContact CB-CB 4.37Å; K54-D194 HydrophobicContact CD-CB 4.4Å; K54-D194 HydrophobicContact CG-CB 4.36Å; K54-D194 PolarHBondContact O-N 3.21Å; K54-E195 PolarHBondContact N-O 3.32Å
55	S	81.3	Confident	72.2	Confident	61 Å²	61	67.4 Å²	67.4	43%	0.427	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	143.7	179.1	63.9	0	0	0	0	112.9	I192	S55-I192 CarbonylContact C-O 3.55Å; S55-I192 WeakPolarHBondContact CA-O 3.43Å; S55-I192 VanDerWaalsContact CB-O 3.23Å; S55-I192 WeakPolarHBondContact CB-O 3.44Å
56	T	83.3	Confident	74.1	Confident	35 Å²	35	68 Å²	68	22%	0.215	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	117.8	-179.4	-60.2	0	0	0	0	109.2	P89 I192 D194	T56-P89 HydrophobicContact CG2-CG 4.1Å; T56-I192 PolarHBondContact N-O 3.03Å; T56-I192 PolarHBondContact O-N 3.31Å; T56-D194 PolarHBondContact OG1-OD2 2.8Å
57	E	84.6	Confident	76	Confident	103 Å²	103	60.8 Å²	60.8	48%	0.481	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	129	177.6	-174.5	171.1	93.2	0	0	111.1	K59 T189 V191	E57-K59 HydrophobicContact CG-CG 4.43Å; E57-K59 WeakPolarHBondContact OE1-CE 3.43Å; E57-K59 IonicContact OE1-NZ 3.06Å; E57-K59 PolarHBondContact OE1-NZ 3.41Å; E57-T189 HydrophobicContact CG-CG2 3.81Å; E57-V191 HydrophobicContact CB-CG2 4.35Å; E57-V191 HydrophobicContact CG-CG2 4.05Å
58	V	85.2	Confident	77.3	Confident	10 Å²	10	58.8 Å²	58.8	6%	0.061	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	130.8	174.3	-172.5	0	0	0	0	108.1	F86 A87 T189 V190 I192	V58-F86 HydrophobicContact CG1-CD2 3.81Å; V58-F86 HydrophobicContact CG1-CE2 4.32Å; V58-A87 WeakPolarHBondContact CG1-O 3.44Å; V58-T189 CarbonylContact O-C 3.19Å; V58-T189 WeakPolarHBondContact O-CA 3.44Å; V58-V190 PolarHBondContact N-O 3.46Å; V58-V190 PolarHBondContact O-N 3.03Å; V58-I192 HydrophobicContact CG2-CD1 4.22Å
59	K	86.6	Confident	78.4	Confident	63 Å²	63	54.6 Å²	54.6	27%	0.274	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	141.1	175.7	-74.7	175.5	178	127.4	0	110.6	E57 C188 T189 D433 E434	E57-K59 HydrophobicContact CG-CG 4.43Å; E57-K59 WeakPolarHBondContact OE1-CE 3.43Å; E57-K59 IonicContact OE1-NZ 3.06Å; E57-K59 PolarHBondContact OE1-NZ 3.41Å; K59-C188 WeakPolarHBondContact CA-O 3.09Å; K59-T189 HydrophobicContact CG-CG2 3.82Å; K59-D433 HydrophobicContact CB-CB 3.82Å; K59-D433 WeakPolarHBondContact CB-OD1 3.39Å; K59-D433 WeakPolarHBondContact CD-OD1 3.45Å; K59-E434 PolarHBondContact O-N 2.76Å
60	H	87.2	Confident	80	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	133.5	177.3	-169.3	73.5	0	0	0	110.5	F86 C188 E434 S436	H60-F86 HydrophobicContact CB-CB 4.2Å; H60-F86 HydrophobicContact CB-CD1 3.82Å; H60-F86 HydrophobicContact CB-CD2 3.63Å; H60-F86 HydrophobicContact CB-CE1 3.99Å; H60-F86 HydrophobicContact CB-CE2 3.78Å; H60-F86 HydrophobicContact CB-CG 3.64Å; H60-F86 HydrophobicContact CB-CZ 3.93Å; H60-F86 AromaticContact CD2-CD1 3.74Å; H60-F86 WeakPolarHBondContact CE1-CB 3.38Å; H60-F86 AromaticContact CE1-CG 3.8Å; H60-F86 AromaticContact CG-CD1 3.57Å; H60-F86 AromaticContact CG-CG 3.65Å; H60-F86 AromaticContact ND1-CD1 3.96Å; H60-F86 AromaticContact ND1-CG 3.82Å; H60-C188 PolarHBondContact N-O 3.42Å; H60-C188 PolarHBondContact O-N 3.31Å; H60-E434 WeakPolarHBondContact CA-O 3.36Å; H60-E434 VanDerWaalsContact CE1-C 3.44Å; H60-E434 WeakPolarHBondContact CE1-CB 3.34Å; H60-E434 PolarHBondContact CE1-O 2.84Å; H60-E434 IonicContact CE1-OE2 3.87Å; H60-E434 PolarHBondContact CE1-OE2 2.62Å; H60-E434 PolarHBondContact ND1-O 3.47Å; H60-E434 IonicContact ND1-OE2 2.81Å; H60-S436 VanDerWaalsContact NE2-CB 3.33Å; H60-S436 WeakPolarHBondContact NE2-CB 3.44Å
61	R	88.5	Confident	81	Confident	60 Å²	60	46.8 Å²	46.8	23%	0.226	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	114.3	177.1	-176.4	179.9	-56.5	-171.9	7.2	109.2	I63 T185 I187 E434 I435 S436	R61-I63 HydrophobicContact CG-CG1 4.3Å; R61-T185 HydrophobicContact CG-CG2 3.95Å; R61-I187 HydrophobicContact CG-CG1 4.22Å; R61-E434 PolarHBondContact N-O 2.9Å; R61-I435 HydrophobicContact CB-CG1 4.39Å; R61-I435 CarbonylContact O-C 3.31Å; R61-I435 WeakPolarHBondContact O-CA 3.47Å; R61-S436 PolarHBondContact O-N 3.03Å
62	W	90.4	Very high	81.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	119.4	176.9	-178.8	30.9	0	0	0	110	I64 M81 I97 L99 T185 I186 S436 S438	W62-I64 HydrophobicContact CD2-CD1 4.22Å; W62-I64 HydrophobicContact CD2-CG1 3.99Å; W62-I64 VanDerWaalsContact CE2-CG1 3.5Å; W62-I64 HydrophobicContact CE3-CD1 4.27Å; W62-I64 HydrophobicContact CG-CG1 4.48Å; W62-I64 HydrophobicContact CH2-CD1 3.65Å; W62-I64 HydrophobicContact CH2-CG1 4.22Å; W62-I64 HydrophobicContact CZ2-CD1 3.58Å; W62-I64 HydrophobicContact CZ2-CG1 3.63Å; W62-I64 HydrophobicContact CZ3-CD1 4.01Å; W62-M81 HydrophobicContact CH2-CB 3.85Å; W62-M81 WeakPolarHBondContact CH2-O 3.44Å; W62-M81 HydrophobicContact CZ2-CB 4.01Å; W62-I97 HydrophobicContact CB-CD1 4.24Å; W62-I97 HydrophobicContact CE3-CB 3.83Å; W62-I97 HydrophobicContact CE3-CD1 4.47Å; W62-I97 HydrophobicContact CE3-CG2 3.72Å; W62-I97 HydrophobicContact CZ3-CB 4.14Å; W62-I97 HydrophobicContact CZ3-CG2 3.81Å; W62-L99 HydrophobicContact CH2-CB 3.92Å; W62-L99 HydrophobicContact CZ3-CB 4.04Å; W62-T185 WeakPolarHBondContact O-CA 3.4Å; W62-I186 HydrophobicContact CE3-CD1 3.69Å; W62-I186 HydrophobicContact CZ3-CD1 3.87Å; W62-I186 PolarHBondContact N-O 3.33Å; W62-I186 PolarHBondContact O-N 2.86Å; W62-S436 WeakPolarHBondContact CA-O 3.3Å; W62-S436 VanDerWaalsContact CD1-OG 3.3Å; W62-S438 PolarHBondContact NE1-OG 2.87Å
63	I	87.2	Confident	82.1	Confident	27 Å²	27	42 Å²	42	14%	0.138	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	120.2	177.3	-54.9	170.4	0	0	0	107.5	R61 E65 A183 T185 I435 S436 R437 S438	R61-I63 HydrophobicContact CG-CG1 4.3Å; I63-E65 HydrophobicContact CG2-CG 4.26Å; I63-A183 HydrophobicContact CG2-CB 4.33Å; I63-T185 HydrophobicContact CG1-CG2 4.13Å; I63-I435 HydrophobicContact CD1-CG2 4.1Å; I63-S436 PolarHBondContact N-O 3.18Å; I63-R437 HydrophobicContact CB-CG 4.19Å; I63-R437 HydrophobicContact CD1-CG 4.45Å; I63-R437 CarbonylContact O-C 3.55Å; I63-R437 VanDerWaalsContact O-CA 3.31Å; I63-R437 WeakPolarHBondContact O-CA 3.35Å; I63-S438 PolarHBondContact O-N 2.83Å
64	I	87.8	Confident	82.2	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	103.2	175.9	-52.3	170.4	0	0	0	107.3	W62 F67 M81 L99 A183 L184 I186	W62-I64 HydrophobicContact CD2-CD1 4.22Å; W62-I64 HydrophobicContact CD2-CG1 3.99Å; W62-I64 VanDerWaalsContact CE2-CG1 3.5Å; W62-I64 HydrophobicContact CE3-CD1 4.27Å; W62-I64 HydrophobicContact CG-CG1 4.48Å; W62-I64 HydrophobicContact CH2-CD1 3.65Å; W62-I64 HydrophobicContact CH2-CG1 4.22Å; W62-I64 HydrophobicContact CZ2-CD1 3.58Å; W62-I64 HydrophobicContact CZ2-CG1 3.63Å; W62-I64 HydrophobicContact CZ3-CD1 4.01Å; I64-F67 HydrophobicContact CB-CD2 4.12Å; I64-F67 HydrophobicContact CD1-CD2 4.27Å; I64-F67 HydrophobicContact CD1-CE2 4.28Å; I64-F67 HydrophobicContact CG2-CD2 3.89Å; I64-M81 HydrophobicContact CD1-SD 4.27Å; I64-M81 HydrophobicContact CG2-SD 3.77Å; I64-L99 HydrophobicContact CD1-CD2 3.97Å; I64-A183 CarbonylContact O-C 3.54Å; I64-A183 WeakPolarHBondContact O-CA 3.31Å; I64-L184 PolarHBondContact N-O 2.68Å; I64-L184 PolarHBondContact O-N 2.81Å; I64-I186 HydrophobicContact CD1-CD1 4.22Å
65	E	84.7	Confident	81.7	Confident	56 Å²	56	37 Å²	37	26%	0.262	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	149.3	177.5	-60.3	174.1	164.6	0	0	110.6	I63 F67 Q70 R437 S438 T439	I63-E65 HydrophobicContact CG2-CG 4.26Å; E65-F67 VanDerWaalsContact C-N 3.28Å; E65-F67 PolarHBondContact O-N 3.23Å; E65-Q70 PolarHBondContact O-NE2 2.92Å; E65-R437 WeakPolarHBondContact OE1-CD 3.24Å; E65-S438 PolarHBondContact N-O 3.18Å; E65-T439 WeakPolarHBondContact OE2-CB 3.28Å; E65-T439 PolarHBondContact OE2-OG1 3.06Å
66	H	81.3	Confident	80.8	Confident	67 Å²	67	35.8 Å²	35.8	31%	0.31	18%	0.184	S	C	.	.	S	Bend	trans	55.1	45.8	-174.2	-58.5	-55.7	0	0	0	112.6	N68 E69 Q70 D182 I440	H66-N68 VanDerWaalsContact C-N 3.3Å; H66-N68 PolarHBondContact O-N 3.03Å; H66-E69 HydrophobicContact CB-CB 4.34Å; H66-E69 PolarHBondContact O-N 2.84Å; H66-Q70 WeakPolarHBondContact O-CG 3.4Å; H66-Q70 PolarHBondContact O-N 3.08Å; H66-D182 CarbonylContact C-O 3.56Å; H66-D182 WeakPolarHBondContact CA-O 3.28Å; H66-D182 VanDerWaalsContact CA-OD2 3.32Å; H66-D182 WeakPolarHBondContact CA-OD2 3.48Å; H66-D182 PolarHBondContact N-O 3.48Å; H66-D182 IonicContact ND1-OD2 2.7Å; H66-I440 HydrophobicContact CB-CG2 3.64Å
67	F	85	Confident	79.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-57.6	-42.3	-171.3	179.2	-95.5	0	0	0	111.9	I64 E65 Q70 E71 M81 L99 L175 I179 D182 L184	I64-F67 HydrophobicContact CB-CD2 4.12Å; I64-F67 HydrophobicContact CD1-CD2 4.27Å; I64-F67 HydrophobicContact CD1-CE2 4.28Å; I64-F67 HydrophobicContact CG2-CD2 3.89Å; E65-F67 VanDerWaalsContact C-N 3.28Å; E65-F67 PolarHBondContact O-N 3.23Å; F67-Q70 PolarHBondContact O-N 2.8Å; F67-E71 HydrophobicContact CE1-CB 4.46Å; F67-E71 WeakPolarHBondContact CE1-OE2 3.27Å; F67-E71 VanDerWaalsContact O-CB 3.27Å; F67-E71 WeakPolarHBondContact O-CB 3.37Å; F67-E71 PolarHBondContact O-N 2.89Å; F67-M81 HydrophobicContact CE2-CE 4.17Å; F67-L99 HydrophobicContact CE2-CD2 3.58Å; F67-L99 HydrophobicContact CZ-CD2 4.09Å; F67-L175 HydrophobicContact CE1-CD2 3.59Å; F67-L175 HydrophobicContact CZ-CD2 3.63Å; F67-I179 HydrophobicContact CD1-CD1 3.58Å; F67-I179 HydrophobicContact CD1-CG1 4Å; F67-I179 HydrophobicContact CE1-CD1 3.84Å; F67-I179 HydrophobicContact CE1-CG1 4.43Å; F67-D182 PolarHBondContact N-O 3.07Å; F67-D182 PolarHBondContact N-OD1 2.73Å; F67-L184 HydrophobicContact CB-CB 4.4Å; F67-L184 HydrophobicContact CD2-CB 3.52Å; F67-L184 HydrophobicContact CD2-CD2 3.97Å; F67-L184 HydrophobicContact CD2-CG 4.39Å; F67-L184 HydrophobicContact CE2-CB 3.94Å; F67-L184 HydrophobicContact CE2-CD2 3.44Å; F67-L184 VanDerWaalsContact CE2-CD2 3.44Å; F67-L184 HydrophobicContact CE2-CG 4.32Å; F67-L184 HydrophobicContact CG-CB 3.92Å; F67-L184 HydrophobicContact CZ-CD2 3.88Å
68	N	81.7	Confident	78.7	Confident	71 Å²	71	38.8 Å²	38.8	38%	0.38	19%	0.193	S	C	.	.	H	α-helix	trans	-66.3	-40	-179.2	-69.8	-66.9	0	0	0	112.2	H66 S72 D182	H66-N68 VanDerWaalsContact C-N 3.3Å; H66-N68 PolarHBondContact O-N 3.03Å; N68-S72 WeakPolarHBondContact O-CB 3.23Å; N68-S72 PolarHBondContact O-N 2.92Å; N68-S72 PolarHBondContact O-OG 2.92Å; N68-D182 WeakPolarHBondContact CB-OD1 3.47Å; N68-D182 PolarHBondContact N-OD1 2.73Å; N68-D182 PolarHBondContact ND2-OD1 2.63Å
69	E	76.8	Confident	77.6	Confident	32 Å²	32	43.7 Å²	43.7	15%	0.15	22%	0.217	C	C	.	.	H	α-helix	trans	-65	-47.3	171.3	-82	76.3	-173.3	0	0	112.5	H66 E71 S72 L73 K521 Y582	H66-E69 HydrophobicContact CB-CB 4.34Å; H66-E69 PolarHBondContact O-N 2.84Å; E69-E71 PolarHBondContact O-N 2.95Å; E69-S72 PolarHBondContact O-N 3.49Å; E69-L73 WeakPolarHBondContact O-CB 3.32Å; E69-L73 WeakPolarHBondContact O-CD1 3.5Å; E69-L73 VanDerWaalsContact O-CG 3.3Å; E69-L73 WeakPolarHBondContact O-CG 3.29Å; E69-L73 PolarHBondContact O-N 2.84Å; E69-K521 WeakPolarHBondContact OE1-CE 3.13Å; E69-K521 IonicContact OE1-NZ 3.48Å; E69-K521 PolarHBondContact OE1-NZ 3.23Å; E69-Y582 HydrophobicContact CB-CE1 4.2Å; E69-Y582 HydrophobicContact CG-CE1 3.87Å; E69-Y582 WeakPolarHBondContact CG-OH 3.15Å
70	Q	81.9	Confident	76.7	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64	-39.1	-179.9	-69.1	-163.2	43.1	0	0	111.8	E65 H66 F67 L73 Q74 M81 S438 I440 I585	E65-Q70 PolarHBondContact O-NE2 2.92Å; H66-Q70 WeakPolarHBondContact O-CG 3.4Å; H66-Q70 PolarHBondContact O-N 3.08Å; F67-Q70 PolarHBondContact O-N 2.8Å; Q70-L73 PolarHBondContact O-N 3.38Å; Q70-Q74 WeakPolarHBondContact O-CB 3.31Å; Q70-Q74 PolarHBondContact O-N 2.75Å; Q70-M81 HydrophobicContact CB-SD 3.67Å; Q70-S438 PolarHBondContact NE2-O 3.27Å; Q70-I440 HydrophobicContact CG-CB 4.2Å; Q70-I440 HydrophobicContact CG-CG2 4.47Å; Q70-I585 HydrophobicContact CB-CD1 4.22Å; Q70-I585 HydrophobicContact CG-CD1 4.01Å; Q70-I585 HydrophobicContact CG-CG1 4.28Å
71	E	78.9	Confident	76.6	Confident	41 Å²	41	44.1 Å²	44.1	19%	0.192	23%	0.225	C	C	.	.	H	α-helix	trans	-63.5	-46.7	172.9	179.3	-178.5	158.8	0	0	112.2	F67 E69 L73 Q74 T75 M81 K118	F67-E71 HydrophobicContact CE1-CB 4.46Å; F67-E71 WeakPolarHBondContact CE1-OE2 3.27Å; F67-E71 VanDerWaalsContact O-CB 3.27Å; F67-E71 WeakPolarHBondContact O-CB 3.37Å; F67-E71 PolarHBondContact O-N 2.89Å; E69-E71 PolarHBondContact O-N 2.95Å; E71-L73 PolarHBondContact O-N 2.94Å; E71-Q74 PolarHBondContact O-N 2.69Å; E71-T75 PolarHBondContact O-N 2.93Å; E71-T75 PolarHBondContact O-OG1 3.28Å; E71-M81 HydrophobicContact CB-CE 4.36Å; E71-K118 VanDerWaalsContact CD-CE 3.44Å; E71-K118 WeakPolarHBondContact OE1-CE 3.36Å; E71-K118 IonicContact OE1-NZ 2.65Å; E71-K118 PolarHBondContact OE1-NZ 3.1Å; E71-K118 WeakPolarHBondContact OE2-CE 3.48Å; E71-K118 IonicContact OE2-NZ 2.73Å; E71-K118 PolarHBondContact OE2-NZ 2.87Å
72	S	73.8	Confident	76.6	Confident	44 Å²	44	45 Å²	45	31%	0.308	23%	0.232	S	C	.	.	H	α-helix	trans	-57.6	-36.2	176.9	-62.9	0	0	0	0	111.1	N68 E69 C76	N68-S72 WeakPolarHBondContact O-CB 3.23Å; N68-S72 PolarHBondContact O-N 2.92Å; N68-S72 PolarHBondContact O-OG 2.92Å; E69-S72 PolarHBondContact O-N 3.49Å; S72-C76 PolarHBondContact O-N 2.9Å; S72-C76 PolarHBondContact O-SG 3.16Å
73	L	71.4	Confident	76.6	Confident	5 Å²	5	45.1 Å²	45.1	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-80.2	-34.9	177.5	-71.5	164.6	0	0	0	114	E69 Q70 E71 T75 C76 K77 I440 Y582	E69-L73 WeakPolarHBondContact O-CB 3.32Å; E69-L73 WeakPolarHBondContact O-CD1 3.5Å; E69-L73 VanDerWaalsContact O-CG 3.3Å; E69-L73 WeakPolarHBondContact O-CG 3.29Å; E69-L73 PolarHBondContact O-N 2.84Å; Q70-L73 PolarHBondContact O-N 3.38Å; E71-L73 PolarHBondContact O-N 2.94Å; L73-T75 VanDerWaalsContact C-N 3.29Å; L73-T75 PolarHBondContact O-N 3.12Å; L73-C76 PolarHBondContact O-N 3.14Å; L73-C76 VanDerWaalsContact O-N 3.11Å; L73-K77 WeakPolarHBondContact O-CB 3.48Å; L73-K77 PolarHBondContact O-N 3.41Å; L73-I440 HydrophobicContact CD1-CD1 3.09Å; L73-Y582 HydrophobicContact CD1-CD1 3.84Å; L73-Y582 HydrophobicContact CD1-CD2 3.86Å; L73-Y582 HydrophobicContact CD1-CE1 4.33Å; L73-Y582 HydrophobicContact CD1-CE2 4.35Å; L73-Y582 HydrophobicContact CD1-CG 3.57Å; L73-Y582 HydrophobicContact CD2-CD2 3.76Å; L73-Y582 HydrophobicContact CD2-CE2 4.44Å; L73-Y582 HydrophobicContact CD2-CG 4.13Å; L73-Y582 HydrophobicContact CG-CD2 4.22Å; L73-Y582 HydrophobicContact CG-CG 4.39Å
74	Q	71.3	Confident	76.6	Confident	16 Å²	16	44.7 Å²	44.7	8%	0.075	23%	0.233	C	C	.	.	H	α-helix	trans	-56.1	-48.3	171.3	169	166	46.3	0	0	109.9	Q70 E71 C76 F78 M79 M81 L99	Q70-Q74 WeakPolarHBondContact O-CB 3.31Å; Q70-Q74 PolarHBondContact O-N 2.75Å; E71-Q74 PolarHBondContact O-N 2.69Å; Q74-C76 PolarHBondContact O-N 2.86Å; Q74-F78 WeakPolarHBondContact O-CA 3.19Å; Q74-F78 PolarHBondContact O-N 2.93Å; Q74-M79 WeakPolarHBondContact CG-O 3.29Å; Q74-M81 HydrophobicContact CB-CE 4.42Å; Q74-L99 PolarHBondContact NE2-O 3.43Å
75	T	66.7	Low	76.6	Confident	87 Å²	87	49 Å²	49	53%	0.534	25%	0.253	S	S	.	.	H	α-helix	trans	-60.3	-30.6	177	-51.7	0	0	0	0	112.4	E71 L73	E71-T75 PolarHBondContact O-N 2.93Å; E71-T75 PolarHBondContact O-OG1 3.28Å; L73-T75 VanDerWaalsContact C-N 3.29Å; L73-T75 PolarHBondContact O-N 3.12Å
76	C	63.3	Low	76.7	Confident	35 Å²	35	46.5 Å²	46.5	24%	0.236	24%	0.241	C	C	.	.	H	α-helix	trans	-86.2	-43.9	179.6	-72.8	0	0	0	0	114.8	S72 L73 Q74 H545	S72-C76 PolarHBondContact O-N 2.9Å; S72-C76 PolarHBondContact O-SG 3.16Å; L73-C76 PolarHBondContact O-N 3.14Å; L73-C76 VanDerWaalsContact O-N 3.11Å; Q74-C76 PolarHBondContact O-N 2.86Å; C76-H545 HydrophobicContact CB-CB 3.51Å; C76-H545 PolarHBondContact O-CD2 3.39Å; C76-H545 VanDerWaalsContact O-CD2 3.23Å
77	K	61.5	Low	77	Confident	66 Å²	66	44.4 Å²	44.4	29%	0.287	24%	0.236	S	C	.	.	H	α-helix	trans	-93.7	-15.6	-172.2	-74.6	-171	176.8	178.9	0	113.6	L73 M79 S519 E583	L73-K77 WeakPolarHBondContact O-CB 3.48Å; L73-K77 PolarHBondContact O-N 3.41Å; K77-M79 HydrophobicContact CB-CB 4.38Å; K77-M79 HydrophobicContact CB-CG 3.97Å; K77-M79 HydrophobicContact CB-SD 4.36Å; K77-M79 HydrophobicContact CD-SD 3.87Å; K77-M79 PolarHBondContact O-N 2.87Å; K77-S519 VanDerWaalsContact CE-OG 3.27Å; K77-S519 WeakPolarHBondContact CE-OG 3.39Å; K77-E583 PolarHBondContact NZ-O 3.37Å; K77-E583 VanDerWaalsContact NZ-O 3.13Å
78	F	61.3	Low	76.9	Confident	134 Å²	134	44.6 Å²	44.6	59%	0.588	24%	0.237	S	C	*	.			trans	56.9	24.9	-165.8	-63.7	-91.2	0	0	0	113.8	Q74	Q74-F78 WeakPolarHBondContact O-CA 3.19Å; Q74-F78 PolarHBondContact O-N 2.93Å
79	M	62.5	Low	76.7	Confident	114 Å²	114	44.2 Å²	44.2	56%	0.562	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-84.1	122.9	172.3	-69.6	-176.5	79.8	0	0	108.9	Q74 K77	Q74-M79 WeakPolarHBondContact CG-O 3.29Å; K77-M79 HydrophobicContact CB-CB 4.38Å; K77-M79 HydrophobicContact CB-CG 3.97Å; K77-M79 HydrophobicContact CB-SD 4.36Å; K77-M79 HydrophobicContact CD-SD 3.87Å; K77-M79 PolarHBondContact O-N 2.87Å
80	P	68.1	Low	76.8	Confident	65 Å²	65	46 Å²	46	42%	0.422	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-69.5	135.3	174.5	29.9	-33.4	0	0	0	109.8	F98	P80-F98 HydrophobicContact CB-CD1 4.2Å; P80-F98 HydrophobicContact CG-CD1 4.47Å
81	M	85	Confident	76.7	Confident	6 Å²	6	53.2 Å²	53.2	3%	0.03	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	132.6	163.4	-73.7	-173.7	-87.6	0	0	108.1	W62 I64 F67 Q70 E71 Q74 F98 L99	W62-M81 HydrophobicContact CH2-CB 3.85Å; W62-M81 WeakPolarHBondContact CH2-O 3.44Å; W62-M81 HydrophobicContact CZ2-CB 4.01Å; I64-M81 HydrophobicContact CD1-SD 4.27Å; I64-M81 HydrophobicContact CG2-SD 3.77Å; F67-M81 HydrophobicContact CE2-CE 4.17Å; Q70-M81 HydrophobicContact CB-SD 3.67Å; E71-M81 HydrophobicContact CB-CE 4.36Å; Q74-M81 HydrophobicContact CB-CE 4.42Å; M81-F98 WeakPolarHBondContact O-CA 3.35Å; M81-L99 HydrophobicContact CB-CB 4.24Å; M81-L99 HydrophobicContact CE-CD2 3.74Å; M81-L99 HydrophobicContact CE-CG 4.32Å; M81-L99 PolarHBondContact O-N 2.87Å
82	Q	89.1	Confident	76.8	Confident	80 Å²	80	56.2 Å²	56.2	37%	0.374	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	142.3	-178.9	68.9	-173.4	20.7	0	0	111.2	I97 F98 T587	Q82-I97 CarbonylContact C-O 3.57Å; Q82-I97 VanDerWaalsContact CA-O 3.27Å; Q82-I97 WeakPolarHBondContact CA-O 3.38Å; Q82-F98 HydrophobicContact CB-CD1 3.71Å; Q82-F98 HydrophobicContact CB-CE1 3.79Å; Q82-F98 HydrophobicContact CB-CG 4.32Å; Q82-F98 HydrophobicContact CB-CZ 4.44Å; Q82-T587 PolarHBondContact O-OG1 2.81Å
83	S	90	Very high	77.2	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.007	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-66.6	172.5	168	73.5	0	0	0	0	110.4	Q96 I97	S83-Q96 WeakPolarHBondContact O-CG 3.34Å; S83-Q96 PolarHBondContact O-NE2 2.95Å; S83-I97 PolarHBondContact N-O 2.71Å; S83-I97 PolarHBondContact OG-N 3.47Å
84	A	86.7	Confident	78	Confident	18 Å²	18	58.1 Å²	58.1	15%	0.149	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-67.1	163.9	159.6	0	0	0	0	0	111	T587 C589	A84-T587 HydrophobicContact CB-CG2 4.41Å; A84-C589 WeakPolarHBondContact CB-SG 3.48Å
85	E	87.8	Confident	78.9	Confident	92 Å²	92	57.3 Å²	57.3	43%	0.43	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-67.8	137.5	167.4	-72.4	-175.8	-161.9	0	0	110	K94 F95	E85-K94 IonicContact OE2-NZ 3.16Å; E85-K94 PolarHBondContact OE2-NZ 2.86Å; E85-F95 WeakPolarHBondContact CA-O 3.36Å
86	F	88	Confident	80	Confident	3 Å²	3	54 Å²	54	1%	0.013	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	156.1	170.9	62.2	-79.3	0	0	0	109.7	V58 H60 F95 I97 L122 C188 V190 E434	V58-F86 HydrophobicContact CG1-CD2 3.81Å; V58-F86 HydrophobicContact CG1-CE2 4.32Å; H60-F86 HydrophobicContact CB-CB 4.2Å; H60-F86 HydrophobicContact CB-CD1 3.82Å; H60-F86 HydrophobicContact CB-CD2 3.63Å; H60-F86 HydrophobicContact CB-CE1 3.99Å; H60-F86 HydrophobicContact CB-CE2 3.78Å; H60-F86 HydrophobicContact CB-CG 3.64Å; H60-F86 HydrophobicContact CB-CZ 3.93Å; H60-F86 AromaticContact CD2-CD1 3.74Å; H60-F86 WeakPolarHBondContact CE1-CB 3.38Å; H60-F86 AromaticContact CE1-CG 3.8Å; H60-F86 AromaticContact CG-CD1 3.57Å; H60-F86 AromaticContact CG-CG 3.65Å; H60-F86 AromaticContact ND1-CD1 3.96Å; H60-F86 AromaticContact ND1-CG 3.82Å; F86-F95 HydrophobicContact CD1-CB 4.05Å; F86-F95 WeakPolarHBondContact CD1-O 3.28Å; F86-F95 HydrophobicContact CD2-CB 3.96Å; F86-F95 HydrophobicContact CD2-CD2 4.13Å; F86-F95 HydrophobicContact CD2-CG 4.48Å; F86-F95 HydrophobicContact CE1-CB 3.65Å; F86-F95 HydrophobicContact CE2-CB 3.59Å; F86-F95 AromaticContact CE2-CD2 3.98Å; F86-F95 HydrophobicContact CE2-CD2 3.98Å; F86-F95 HydrophobicContact CE2-CG 4.06Å; F86-F95 HydrophobicContact CG-CB 4.19Å; F86-F95 HydrophobicContact CZ-CB 3.44Å; F86-F95 VanDerWaalsContact CZ-CB 3.44Å; F86-F95 HydrophobicContact CZ-CG 4.28Å; F86-F95 PolarHBondContact N-O 2.88Å; F86-F95 PolarHBondContact O-N 3.31Å; F86-I97 HydrophobicContact CE1-CD1 4.45Å; F86-I97 HydrophobicContact CE1-CG1 3.82Å; F86-I97 HydrophobicContact CZ-CG1 4.3Å; F86-L122 HydrophobicContact CE1-CD1 4.13Å; F86-L122 HydrophobicContact CZ-CD1 3.73Å; F86-C188 HydrophobicContact CZ-CB 4.28Å; F86-V190 HydrophobicContact CE2-CG2 4.31Å; F86-E434 WeakPolarHBondContact CA-OE2 3.47Å; F86-E434 WeakPolarHBondContact CB-OE2 3.29Å
87	A	86.5	Confident	81.4	Confident	23 Å²	23	52.4 Å²	52.4	19%	0.19	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	163.5	-170.9	0	0	0	0	0	114.4	V58 H93 K94	V58-A87 WeakPolarHBondContact CG1-O 3.44Å; A87-H93 CarbonylContact C-O 3.59Å; A87-H93 WeakPolarHBondContact CA-O 3.42Å; A87-K94 HydrophobicContact CB-CG 4.17Å
88	S	82.5	Confident	82.8	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.021	25%	0.247	C	C	.	.			trans	-60.7	152	161.9	54.3	0	0	0	0	111.1	D90 K91 R92 H93	S88-D90 VanDerWaalsContact CB-OD1 3.29Å; S88-D90 WeakPolarHBondContact CB-OD1 3.3Å; S88-D90 PolarHBondContact O-N 3.35Å; S88-D90 PolarHBondContact OG-OD1 2.98Å; S88-K91 WeakPolarHBondContact O-CA 3.43Å; S88-K91 PolarHBondContact O-N 3.46Å; S88-R92 PolarHBondContact OG-N 2.89Å; S88-H93 PolarHBondContact N-O 2.65Å; S88-H93 PolarHBondContact OG-N 3Å; S88-H93 PolarHBondContact OG-O 3.17Å
89	P	78.6	Confident	84	Confident	64 Å²	64	43.9 Å²	43.9	42%	0.416	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-18.4	-179.6	-27.4	36.1	0	0	0	115.7	T56 N597	T56-P89 HydrophobicContact CG2-CG 4.1Å; P89-N597 VanDerWaalsContact CB-ND2 3.34Å; P89-N597 WeakPolarHBondContact CB-ND2 3.28Å; P89-N597 PolarHBondContact O-ND2 3.38Å
90	D	77.4	Confident	84.9	Confident	68 Å²	68	42.4 Å²	42.4	36%	0.364	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-3	174	60.6	16	0	0	0	113.6	S88 R92	S88-D90 VanDerWaalsContact CB-OD1 3.29Å; S88-D90 WeakPolarHBondContact CB-OD1 3.3Å; S88-D90 PolarHBondContact O-N 3.35Å; S88-D90 PolarHBondContact OG-OD1 2.98Å; D90-R92 HydrophobicContact CB-CG 4.42Å; D90-R92 PolarHBondContact O-N 2.86Å; D90-R92 WeakPolarHBondContact OD1-CB 3.47Å; D90-R92 PolarHBondContact OD1-N 2.88Å; D90-R92 IonicContact OD1-NE 3.53Å; D90-R92 IonicContact OD2-CZ 2.61Å; D90-R92 VanDerWaalsContact OD2-CZ 3.23Å; D90-R92 IonicContact OD2-NE 3.53Å; D90-R92 PolarHBondContact OD2-NE 2.73Å; D90-R92 IonicContact OD2-NH2 2.71Å; D90-R92 PolarHBondContact OD2-NH2 2.97Å
91	K	81.4	Confident	85.1	Confident	153 Å²	153	41.3 Å²	41.3	67%	0.665	20%	0.201	S	C	*	.	S	Bend	trans	60.1	13.7	-176.5	-52.9	-175.4	-178.2	-176.8	0	115.1	S88	S88-K91 WeakPolarHBondContact O-CA 3.43Å; S88-K91 PolarHBondContact O-N 3.46Å
92	R	80.6	Confident	84	Confident	104 Å²	104	48.1 Å²	48.1	39%	0.392	23%	0.226	S	C	.	.	S	Bend	trans	-70.4	-39.8	174.4	-68.5	-170.6	-66.8	149.3	2.6	112.5	S88 D90 S126 D129 D194	S88-R92 PolarHBondContact OG-N 2.89Å; D90-R92 HydrophobicContact CB-CG 4.42Å; D90-R92 PolarHBondContact O-N 2.86Å; D90-R92 WeakPolarHBondContact OD1-CB 3.47Å; D90-R92 PolarHBondContact OD1-N 2.88Å; D90-R92 IonicContact OD1-NE 3.53Å; D90-R92 IonicContact OD2-CZ 2.61Å; D90-R92 VanDerWaalsContact OD2-CZ 3.23Å; D90-R92 IonicContact OD2-NE 3.53Å; D90-R92 PolarHBondContact OD2-NE 2.73Å; D90-R92 IonicContact OD2-NH2 2.71Å; D90-R92 PolarHBondContact OD2-NH2 2.97Å; R92-S126 PolarHBondContact O-OG 2.86Å; R92-D129 WeakPolarHBondContact CD-OD2 3.4Å; R92-D129 IonicContact NH1-OD2 3.25Å; R92-D194 IonicContact CZ-OD1 3.51Å; R92-D194 IonicContact NH2-OD1 2.69Å; R92-D194 PolarHBondContact NH2-OD1 3.24Å
93	H	82.4	Confident	82.3	Confident	5 Å²	5	50.1 Å²	50.1	2%	0.023	24%	0.235	C	C	.	.	S	Bend	trans	-109.6	110.5	-177.5	-61.2	-65	0	0	0	111.4	A87 S88 F95 S126 I192	A87-H93 CarbonylContact C-O 3.59Å; A87-H93 WeakPolarHBondContact CA-O 3.42Å; S88-H93 PolarHBondContact N-O 2.65Å; S88-H93 PolarHBondContact OG-N 3Å; S88-H93 PolarHBondContact OG-O 3.17Å; H93-F95 HydrophobicContact CB-CE2 3.84Å; H93-F95 HydrophobicContact CB-CZ 3.69Å; H93-S126 VanDerWaalsContact CA-OG 3.29Å; H93-S126 WeakPolarHBondContact CA-OG 3.4Å; H93-I192 HydrophobicContact CB-CD1 3.76Å
94	K	87.8	Confident	80	Confident	83 Å²	83	54.1 Å²	54.1	36%	0.361	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	144.5	177.5	-76.2	-175.4	161.5	-146.3	0	111.1	E85 A87 S124 F125 S126	E85-K94 IonicContact OE2-NZ 3.16Å; E85-K94 PolarHBondContact OE2-NZ 2.86Å; A87-K94 HydrophobicContact CB-CG 4.17Å; K94-S124 VanDerWaalsContact O-CA 3.25Å; K94-S124 WeakPolarHBondContact O-CA 3.1Å; K94-S124 PolarHBondContact O-OG 2.92Å; K94-S124 VanDerWaalsContact O-OG 3.1Å; K94-F125 HydrophobicContact CB-CB 4.02Å; K94-F125 PolarHBondContact O-N 3.39Å; K94-S126 PolarHBondContact N-OG 2.87Å
95	F	89.7	Confident	77.7	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	153.6	-175.1	-53.2	-74.7	0	0	0	112.5	E85 F86 H93 L122 H123 L131 I166 V190 I192	E85-F95 WeakPolarHBondContact CA-O 3.36Å; F86-F95 HydrophobicContact CD1-CB 4.05Å; F86-F95 WeakPolarHBondContact CD1-O 3.28Å; F86-F95 HydrophobicContact CD2-CB 3.96Å; F86-F95 HydrophobicContact CD2-CD2 4.13Å; F86-F95 HydrophobicContact CD2-CG 4.48Å; F86-F95 HydrophobicContact CE1-CB 3.65Å; F86-F95 HydrophobicContact CE2-CB 3.59Å; F86-F95 AromaticContact CE2-CD2 3.98Å; F86-F95 HydrophobicContact CE2-CD2 3.98Å; F86-F95 HydrophobicContact CE2-CG 4.06Å; F86-F95 HydrophobicContact CG-CB 4.19Å; F86-F95 HydrophobicContact CZ-CB 3.44Å; F86-F95 VanDerWaalsContact CZ-CB 3.44Å; F86-F95 HydrophobicContact CZ-CG 4.28Å; F86-F95 PolarHBondContact N-O 2.88Å; F86-F95 PolarHBondContact O-N 3.31Å; H93-F95 HydrophobicContact CB-CE2 3.84Å; H93-F95 HydrophobicContact CB-CZ 3.69Å; F95-L122 HydrophobicContact CB-CD1 4.18Å; F95-H123 CarbonylContact C-O 3.59Å; F95-H123 VanDerWaalsContact CA-O 3.23Å; F95-H123 WeakPolarHBondContact CA-O 3.3Å; F95-L131 HydrophobicContact CE1-CD2 3.98Å; F95-L131 HydrophobicContact CZ-CD1 4.45Å; F95-L131 HydrophobicContact CZ-CD2 4.49Å; F95-I166 HydrophobicContact CD1-CD1 3.88Å; F95-I166 HydrophobicContact CE1-CD1 3.82Å; F95-V190 HydrophobicContact CE1-CG1 4.15Å; F95-V190 HydrophobicContact CE2-CG1 4.23Å; F95-V190 HydrophobicContact CZ-CG1 3.79Å; F95-I192 HydrophobicContact CE2-CD1 4.1Å; F95-I192 HydrophobicContact CZ-CD1 4.07Å; F95-I192 HydrophobicContact CZ-CG1 4.42Å
96	Q	90.9	Very high	75.2	Confident	17 Å²	17	59.6 Å²	59.6	8%	0.079	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	137.3	171.1	-164.8	177.3	23.6	0	0	110.2	S83 F98 H123 F125	S83-Q96 WeakPolarHBondContact O-CG 3.34Å; S83-Q96 PolarHBondContact O-NE2 2.95Å; Q96-F98 HydrophobicContact CB-CE2 3.93Å; Q96-F98 HydrophobicContact CG-CE2 3.98Å; Q96-F98 HydrophobicContact CG-CZ 4.3Å; Q96-H123 PolarHBondContact N-O 3.34Å; Q96-H123 PolarHBondContact O-N 3.11Å; Q96-F125 HydrophobicContact CB-CE2 3.46Å; Q96-F125 VanDerWaalsContact CB-CE2 3.46Å; Q96-F125 HydrophobicContact CB-CZ 3.83Å
97	I	91.4	Very high	72.7	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.005	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	135.7	175.7	-44.6	179	0	0	0	108.5	W62 Q82 S83 F86 I120 L122 I186 C188	W62-I97 HydrophobicContact CB-CD1 4.24Å; W62-I97 HydrophobicContact CE3-CB 3.83Å; W62-I97 HydrophobicContact CE3-CD1 4.47Å; W62-I97 HydrophobicContact CE3-CG2 3.72Å; W62-I97 HydrophobicContact CZ3-CB 4.14Å; W62-I97 HydrophobicContact CZ3-CG2 3.81Å; Q82-I97 CarbonylContact C-O 3.57Å; Q82-I97 VanDerWaalsContact CA-O 3.27Å; Q82-I97 WeakPolarHBondContact CA-O 3.38Å; S83-I97 PolarHBondContact N-O 2.71Å; S83-I97 PolarHBondContact OG-N 3.47Å; F86-I97 HydrophobicContact CE1-CD1 4.45Å; F86-I97 HydrophobicContact CE1-CG1 3.82Å; F86-I97 HydrophobicContact CZ-CG1 4.3Å; I97-I120 HydrophobicContact CG2-CG2 3.4Å; I97-I120 VanDerWaalsContact CG2-CG2 3.4Å; I97-L122 HydrophobicContact CG1-CD1 4.15Å; I97-I186 HydrophobicContact CD1-CG2 4.21Å; I97-C188 HydrophobicContact CD1-CB 3.61Å; I97-C188 HydrophobicContact CG1-CB 4.29Å
98	F	90.3	Very high	70.1	Confident	20 Å²	20	71.5 Å²	71.5	9%	0.088	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	139.3	170.7	-66.2	-101.2	0	0	0	109.9	P80 M81 Q82 Q96 I120 T121 H123 F125	P80-F98 HydrophobicContact CB-CD1 4.2Å; P80-F98 HydrophobicContact CG-CD1 4.47Å; M81-F98 WeakPolarHBondContact O-CA 3.35Å; Q82-F98 HydrophobicContact CB-CD1 3.71Å; Q82-F98 HydrophobicContact CB-CE1 3.79Å; Q82-F98 HydrophobicContact CB-CG 4.32Å; Q82-F98 HydrophobicContact CB-CZ 4.44Å; Q96-F98 HydrophobicContact CB-CE2 3.93Å; Q96-F98 HydrophobicContact CG-CE2 3.98Å; Q96-F98 HydrophobicContact CG-CZ 4.3Å; F98-I120 CarbonylContact O-C 3.27Å; F98-I120 WeakPolarHBondContact O-CA 3.5Å; F98-T121 PolarHBondContact N-O 2.8Å; F98-T121 PolarHBondContact O-N 2.93Å; F98-T121 PolarHBondContact O-OG1 2.94Å; F98-H123 HydrophobicContact CD2-CB 4.26Å; F98-H123 AromaticContact CD2-CD2 3.55Å; F98-H123 AromaticContact CD2-CG 3.97Å; F98-H123 HydrophobicContact CE2-CB 3.92Å; F98-H123 AromaticContact CE2-CD2 3.96Å; F98-H123 AromaticContact CE2-CG 3.9Å; F98-F125 HydrophobicContact CE2-CZ 4.16Å; F98-F125 HydrophobicContact CZ-CZ 4.39Å
99	L	88.1	Confident	67.7	Low	2 Å²	2	75 Å²	75	1%	0.01	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.2	167.5	175.9	60.1	0	0	0	108.9	W62 I64 F67 Q74 M81 K118 I120 L171 L184	W62-L99 HydrophobicContact CH2-CB 3.92Å; W62-L99 HydrophobicContact CZ3-CB 4.04Å; I64-L99 HydrophobicContact CD1-CD2 3.97Å; F67-L99 HydrophobicContact CE2-CD2 3.58Å; F67-L99 HydrophobicContact CZ-CD2 4.09Å; Q74-L99 PolarHBondContact NE2-O 3.43Å; M81-L99 HydrophobicContact CB-CB 4.24Å; M81-L99 HydrophobicContact CE-CD2 3.74Å; M81-L99 HydrophobicContact CE-CG 4.32Å; M81-L99 PolarHBondContact O-N 2.87Å; L99-K118 HydrophobicContact CD1-CB 4.36Å; L99-I120 HydrophobicContact CD1-CG1 4.09Å; L99-L171 HydrophobicContact CD1-CD1 3.7Å; L99-L171 HydrophobicContact CD1-CG 4.32Å; L99-L184 HydrophobicContact CD2-CD2 4.35Å
100	R	81.4	Confident	65.6	Low	83 Å²	83	80.4 Å²	80.4	31%	0.313	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	138.8	-175.2	-61.8	-179.2	-176.2	144	7.4	111.4	K118 A119 T121 H123 E165	R100-K118 CarbonylContact O-C 3.54Å; R100-K118 WeakPolarHBondContact O-CA 3.27Å; R100-A119 PolarHBondContact N-O 3.17Å; R100-A119 PolarHBondContact O-N 3.07Å; R100-T121 PolarHBondContact NH1-OG1 2.94Å; R100-H123 VanDerWaalsContact CZ-NE2 3.27Å; R100-H123 PolarHBondContact NH1-NE2 2.83Å; R100-H123 PolarHBondContact NH2-NE2 2.85Å; R100-E165 IonicContact CZ-OE2 2.63Å; R100-E165 IonicContact NH1-OE2 3.68Å; R100-E165 PolarHBondContact NH1-OE2 2.9Å
101	S	72.2	Confident	63.4	Low	41 Å²	41	86.8 Å²	86.8	29%	0.287	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	123.9	164.1	-61.5	0	0	0	0	109.6
102	R	62.1	Low	61	Low	150 Å²	150	85.9 Å²	85.9	57%	0.566	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	104.6	177.7	-174.9	173.1	177.2	159.2	-4.9	109.7	Q117 E168	R102-Q117 VanDerWaalsContact CB-O 3.31Å; R102-Q117 WeakPolarHBondContact CB-O 3.48Å; R102-Q117 PolarHBondContact N-O 2.84Å; R102-E168 IonicContact NH1-OE1 3.49Å
103	E	53.4	Low	58.9	Low	121 Å²	121	90.5 Å²	90.5	57%	0.565	50%	0.504	S	S	*	.			trans	-65.4	138.8	163.2	-68.8	-175.5	177.5	0	0	109.7	N105	E103-N105 VanDerWaalsContact C-N 3.33Å; E103-N105 PolarHBondContact O-N 3.45Å
104	A	40.4	Very low	56.8	Low	86 Å²	86	97.4 Å²	97.4	71%	0.711	54%	0.54	S	S	*	.			trans	-75.3	83.3	-178.7	0	0	0	0	0	111	G106	A104-G106 VanDerWaalsContact C-N 3.33Å; A104-G106 PolarHBondContact O-N 2.89Å
105	N	38.3	Very low	55.1	Low	163 Å²	163	100.8 Å²	100.8	87%	0.872	56%	0.557	S	S	*	*			trans	-63.3	89	169.4	-80.3	-27.6	0	0	0	110.6	E103	E103-N105 VanDerWaalsContact C-N 3.33Å; E103-N105 PolarHBondContact O-N 3.45Å
106	G	35.3	Very low	53.6	Low	61 Å²	61	103.6 Å²	103.6	63%	0.629	58%	0.58	S	S	*	*	S	Bend	trans	-175.7	75.7	-176.9	0	0	0	0	0	114.9	A104	A104-G106 VanDerWaalsContact C-N 3.33Å; A104-G106 PolarHBondContact O-N 2.89Å
107	N	35.1	Very low	52.6	Low	164 Å²	164	108 Å²	108	88%	0.877	60%	0.601	S	S	*	*			trans	61.4	117.4	167.6	-63.7	-13.5	0	0	0	117.9	G109	N107-G109 PolarHBondContact O-N 2.82Å
108	A	32.9	Very low	52	Low	113 Å²	113	110 Å²	110	93%	0.934	61%	0.609	S	S	*	*	S	Bend	trans	-58.5	129.1	164.5	0	0	0	0	0	110.7
109	G	32.4	Very low	51.8	Low	76 Å²	76	109.3 Å²	109.3	78%	0.784	61%	0.608	S	S	*	*			trans	170.4	-28.3	175.9	0	0	0	0	0	116.9	N107	N107-G109 PolarHBondContact O-N 2.82Å
110	M	34.6	Very low	51.8	Low	178 Å²	178	109.2 Å²	109.2	88%	0.877	61%	0.607	S	S	*	*			trans	-135	115.8	178.7	-79.3	-167.9	155.6	0	0	113.1	N112	M110-N112 PolarHBondContact O-N 2.88Å; M110-N112 VanDerWaalsContact O-N 3.14Å
111	Q	29.9	Very low	52.2	Low	201 Å²	201	105.4 Å²	105.4	94%	0.939	59%	0.593	S	S	*	*			trans	-71.9	96.7	161.6	-73.3	176.1	-46.6	0	0	109
112	N	31.3	Very low	53.1	Low	135 Å²	135	103.5 Å²	103.5	72%	0.722	58%	0.579	S	S	*	*			trans	-136.5	144.4	153.7	-94	-32.7	0	0	0	107.8	M110 L114	M110-N112 PolarHBondContact O-N 2.88Å; M110-N112 VanDerWaalsContact O-N 3.14Å; N112-L114 VanDerWaalsContact C-N 3.3Å; N112-L114 PolarHBondContact O-N 2.82Å
113	Q	37.4	Very low	54.4	Low	200 Å²	200	97.8 Å²	97.8	94%	0.935	56%	0.559	S	S	*	*			trans	-69.2	79.3	-171.2	-68.4	169.7	-29.1	0	0	112	Q115	Q113-Q115 PolarHBondContact O-N 2.84Å
114	L	38.5	Very low	56.1	Low	151 Å²	151	92 Å²	92	79%	0.791	53%	0.532	S	S	*	.			trans	-80.5	101.5	167.9	-81.5	155	0	0	0	108.7	N112 A116	N112-L114 VanDerWaalsContact C-N 3.3Å; N112-L114 PolarHBondContact O-N 2.82Å; L114-A116 PolarHBondContact O-N 3.24Å
115	Q	51.8	Low	57.9	Low	154 Å²	154	89.5 Å²	89.5	72%	0.72	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-55.2	132	171.7	-70.3	176.3	-23.8	0	0	109.9	Q113 Q117	Q113-Q115 PolarHBondContact O-N 2.84Å; Q115-Q117 PolarHBondContact O-N 3.04Å
116	A	57.8	Low	59.3	Low	58 Å²	58	82 Å²	82	48%	0.479	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-62	121.5	178.1	0	0	0	0	0	110	L114 K118	L114-A116 PolarHBondContact O-N 3.24Å; A116-K118 PolarHBondContact O-N 2.84Å
117	Q	68.8	Low	60.5	Low	110 Å²	110	86.4 Å²	86.4	51%	0.514	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	129.2	177.5	-76.3	-176.6	-20.8	0	0	109.8	R102 Q115 T170	R102-Q117 VanDerWaalsContact CB-O 3.31Å; R102-Q117 WeakPolarHBondContact CB-O 3.48Å; R102-Q117 PolarHBondContact N-O 2.84Å; Q115-Q117 PolarHBondContact O-N 3.04Å; Q117-T170 HydrophobicContact CB-CG2 4.12Å; Q117-T170 HydrophobicContact CG-CG2 4.41Å
118	K	79.7	Confident	61.7	Low	43 Å²	43	83.5 Å²	83.5	19%	0.187	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	141.2	175	-56.6	169.7	-167.7	176.3	0	109.2	E71 L99 R100 A116 T170 L171 L175	E71-K118 VanDerWaalsContact CD-CE 3.44Å; E71-K118 WeakPolarHBondContact OE1-CE 3.36Å; E71-K118 IonicContact OE1-NZ 2.65Å; E71-K118 PolarHBondContact OE1-NZ 3.1Å; E71-K118 WeakPolarHBondContact OE2-CE 3.48Å; E71-K118 IonicContact OE2-NZ 2.73Å; E71-K118 PolarHBondContact OE2-NZ 2.87Å; L99-K118 HydrophobicContact CD1-CB 4.36Å; R100-K118 CarbonylContact O-C 3.54Å; R100-K118 WeakPolarHBondContact O-CA 3.27Å; A116-K118 PolarHBondContact O-N 2.84Å; K118-T170 CarbonylContact O-C 3.6Å; K118-T170 WeakPolarHBondContact O-CA 3.3Å; K118-T170 WeakPolarHBondContact O-CG2 3.46Å; K118-L171 HydrophobicContact CB-CB 4.1Å; K118-L171 HydrophobicContact CB-CD1 3.75Å; K118-L171 HydrophobicContact CB-CG 4.08Å; K118-L171 HydrophobicContact CD-CD1 4.07Å; K118-L171 PolarHBondContact O-N 2.8Å; K118-L175 HydrophobicContact CD-CD2 4.37Å
119	A	86.2	Confident	63.5	Low	6 Å²	6	80.4 Å²	80.4	5%	0.05	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	137	176	0	0	0	0	0	111.6	R100 E168 V169	R100-A119 PolarHBondContact N-O 3.17Å; R100-A119 PolarHBondContact O-N 3.07Å; A119-E168 HydrophobicContact CB-CG 4.13Å; A119-V169 CarbonylContact C-O 3.57Å; A119-V169 VanDerWaalsContact CA-O 3.27Å; A119-V169 WeakPolarHBondContact CA-O 3.46Å
120	I	88.3	Confident	65.6	Low	0 Å²	0	80.7 Å²	80.7	0%	0	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	128.6	165.6	-60.8	169.4	0	0	0	107.4	I97 F98 L99 I137 I139 E168 V169 L171 I186	I97-I120 HydrophobicContact CG2-CG2 3.4Å; I97-I120 VanDerWaalsContact CG2-CG2 3.4Å; F98-I120 CarbonylContact O-C 3.27Å; F98-I120 WeakPolarHBondContact O-CA 3.5Å; L99-I120 HydrophobicContact CD1-CG1 4.09Å; I120-I137 HydrophobicContact CD1-CG2 4.11Å; I120-I137 HydrophobicContact CG2-CD1 4.08Å; I120-I137 HydrophobicContact CG2-CG2 4.32Å; I120-I139 HydrophobicContact CD1-CD1 3.9Å; I120-I139 HydrophobicContact CD1-CG1 4.4Å; I120-E168 CarbonylContact O-C 3.47Å; I120-E168 WeakPolarHBondContact O-CA 3.42Å; I120-V169 HydrophobicContact CB-CG1 3.88Å; I120-V169 PolarHBondContact N-O 2.68Å; I120-V169 PolarHBondContact O-N 3.12Å; I120-L171 HydrophobicContact CD1-CD2 3.58Å; I120-L171 HydrophobicContact CG1-CD2 3.87Å; I120-L171 HydrophobicContact CG1-CG 4.42Å; I120-I186 HydrophobicContact CD1-CD1 3.62Å; I120-I186 HydrophobicContact CD1-CG1 3.81Å; I120-I186 HydrophobicContact CD1-CG2 3.96Å; I120-I186 HydrophobicContact CG1-CD1 4.03Å
121	T	89.8	Confident	67.8	Low	3 Å²	3	72.2 Å²	72.2	2%	0.018	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.5	175.7	51.9	0	0	0	0	110.2	F98 R100 H123 E165 A167 E168	F98-T121 PolarHBondContact N-O 2.8Å; F98-T121 PolarHBondContact O-N 2.93Å; F98-T121 PolarHBondContact O-OG1 2.94Å; R100-T121 PolarHBondContact NH1-OG1 2.94Å; T121-H123 WeakPolarHBondContact CB-NE2 3.26Å; T121-H123 PolarHBondContact OG1-NE2 2.92Å; T121-E165 WeakPolarHBondContact CB-OE2 3.28Å; T121-E165 HydrophobicContact CG2-CG 4.33Å; T121-E165 WeakPolarHBondContact CG2-OE2 3.14Å; T121-A167 CarbonylContact C-O 3.43Å; T121-A167 VanDerWaalsContact CA-O 3.25Å; T121-A167 WeakPolarHBondContact CA-O 3.42Å; T121-E168 HydrophobicContact CG2-CB 4.04Å; T121-E168 HydrophobicContact CG2-CG 3.88Å
122	L	91.2	Very high	70.5	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	125.3	173.8	-176.1	67.5	0	0	0	109	F86 F95 I97 V135 I166 A167 V190	F86-L122 HydrophobicContact CE1-CD1 4.13Å; F86-L122 HydrophobicContact CZ-CD1 3.73Å; F95-L122 HydrophobicContact CB-CD1 4.18Å; I97-L122 HydrophobicContact CG1-CD1 4.15Å; L122-V135 HydrophobicContact CD2-CB 4.38Å; L122-V135 HydrophobicContact CD2-CG1 3.54Å; L122-V135 HydrophobicContact CD2-CG2 3.86Å; L122-I166 HydrophobicContact CB-CG1 4.14Å; L122-I166 HydrophobicContact CD2-CD1 3.6Å; L122-I166 HydrophobicContact CD2-CG1 3.92Å; L122-I166 HydrophobicContact CG-CD1 3.93Å; L122-I166 HydrophobicContact CG-CG1 3.87Å; L122-I166 VanDerWaalsContact O-CG1 3.31Å; L122-I166 WeakPolarHBondContact O-CG1 3.31Å; L122-I166 PolarHBondContact O-N 2.84Å; L122-A167 HydrophobicContact CB-CB 4.08Å; L122-A167 PolarHBondContact N-O 3.35Å; L122-A167 PolarHBondContact O-N 2.87Å; L122-V190 HydrophobicContact CD2-CG2 3.91Å
123	H	90.1	Very high	73.2	Confident	30 Å²	30	61 Å²	61	14%	0.139	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	144.5	177.7	-74.4	-105.3	0	0	0	110.3	F95 Q96 F98 R100 T121 F125 V163 S164 E165	F95-H123 CarbonylContact C-O 3.59Å; F95-H123 VanDerWaalsContact CA-O 3.23Å; F95-H123 WeakPolarHBondContact CA-O 3.3Å; Q96-H123 PolarHBondContact N-O 3.34Å; Q96-H123 PolarHBondContact O-N 3.11Å; F98-H123 HydrophobicContact CD2-CB 4.26Å; F98-H123 AromaticContact CD2-CD2 3.55Å; F98-H123 AromaticContact CD2-CG 3.97Å; F98-H123 HydrophobicContact CE2-CB 3.92Å; F98-H123 AromaticContact CE2-CD2 3.96Å; F98-H123 AromaticContact CE2-CG 3.9Å; R100-H123 VanDerWaalsContact CZ-NE2 3.27Å; R100-H123 PolarHBondContact NH1-NE2 2.83Å; R100-H123 PolarHBondContact NH2-NE2 2.85Å; T121-H123 WeakPolarHBondContact CB-NE2 3.26Å; T121-H123 PolarHBondContact OG1-NE2 2.92Å; H123-F125 HydrophobicContact CB-CE2 3.73Å; H123-F125 HydrophobicContact CB-CZ 4.01Å; H123-V163 HydrophobicContact CB-CG1 3.96Å; H123-S164 CarbonylContact C-O 3.55Å; H123-S164 VanDerWaalsContact CA-O 3.31Å; H123-S164 WeakPolarHBondContact CA-O 3.03Å; H123-E165 WeakPolarHBondContact CE1-CB 3.49Å; H123-E165 IonicContact CE1-OE2 3.79Å; H123-E165 PolarHBondContact CE1-OE2 3.36Å; H123-E165 WeakPolarHBondContact NE2-CG 3.36Å; H123-E165 IonicContact NE2-OE2 3.91Å; H123-E165 PolarHBondContact NE2-OE2 2.86Å
124	S	87.8	Confident	75.6	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	144.5	170.2	-172.7	0	0	0	0	111.2	K94 V163 S164	K94-S124 VanDerWaalsContact O-CA 3.25Å; K94-S124 WeakPolarHBondContact O-CA 3.1Å; K94-S124 PolarHBondContact O-OG 2.92Å; K94-S124 VanDerWaalsContact O-OG 3.1Å; S124-V163 WeakPolarHBondContact O-CA 3.41Å; S124-S164 PolarHBondContact N-O 2.82Å; S124-S164 PolarHBondContact O-N 2.84Å
125	F	79.2	Confident	78	Confident	34 Å²	34	47.2 Å²	47.2	15%	0.149	25%	0.249	C	C	.	.			trans	-120.7	18.5	-168	-61.2	-104.5	0	0	0	113.3	K94 Q96 F98 H123 H127 A162 V163	K94-F125 HydrophobicContact CB-CB 4.02Å; K94-F125 PolarHBondContact O-N 3.39Å; Q96-F125 HydrophobicContact CB-CE2 3.46Å; Q96-F125 VanDerWaalsContact CB-CE2 3.46Å; Q96-F125 HydrophobicContact CB-CZ 3.83Å; F98-F125 HydrophobicContact CE2-CZ 4.16Å; F98-F125 HydrophobicContact CZ-CZ 4.39Å; H123-F125 HydrophobicContact CB-CE2 3.73Å; H123-F125 HydrophobicContact CB-CZ 4.01Å; F125-H127 PolarHBondContact O-CD2 2.87Å; F125-H127 VanDerWaalsContact O-CD2 3.28Å; F125-A162 WeakPolarHBondContact CA-O 2.91Å; F125-V163 HydrophobicContact CD1-CB 4.33Å; F125-V163 HydrophobicContact CD1-CG1 4Å; F125-V163 HydrophobicContact CD1-CG2 3.63Å; F125-V163 HydrophobicContact CE1-CB 4.28Å; F125-V163 HydrophobicContact CE1-CG1 3.61Å; F125-V163 HydrophobicContact CE1-CG2 3.66Å; F125-V163 HydrophobicContact CE2-CG1 4.38Å; F125-V163 HydrophobicContact CZ-CG1 3.82Å
126	S	66.8	Low	79.7	Confident	6 Å²	6	43.8 Å²	43.8	4%	0.042	23%	0.229	C	C	.	.			trans	-81.7	141.7	-175.1	-66.3	0	0	0	0	112.9	R92 H93 K94 L160	R92-S126 PolarHBondContact O-OG 2.86Å; H93-S126 VanDerWaalsContact CA-OG 3.29Å; H93-S126 WeakPolarHBondContact CA-OG 3.4Å; K94-S126 PolarHBondContact N-OG 2.87Å; S126-L160 WeakPolarHBondContact O-CB 3.21Å
127	H	60.4	Low	81.1	Confident	152 Å²	152	41.1 Å²	41.1	70%	0.704	21%	0.207	S	C	*	.	S	Bend	trans	-108.6	-0.7	-165.1	-82.4	-81.7	0	0	0	116.2	F125 A162	F125-H127 PolarHBondContact O-CD2 2.87Å; F125-H127 VanDerWaalsContact O-CD2 3.28Å; H127-A162 VanDerWaalsContact CE1-CB 3.45Å; H127-A162 WeakPolarHBondContact CE1-CB 3.06Å
128	S	60	Low	81.9	Confident	103 Å²	103	36.4 Å²	36.4	72%	0.72	19%	0.185	S	C	*	.	S	Bend	trans	-148	-39.8	-176.1	52.1	0	0	0	0	114.9
129	D	70.9	Confident	82.1	Confident	49 Å²	49	34.4 Å²	34.4	26%	0.262	18%	0.176	S	C	.	.	S	Bend	trans	-96.9	132.8	-162.6	-63.9	16.9	0	0	0	111.4	R92 L160	R92-D129 WeakPolarHBondContact CD-OD2 3.4Å; R92-D129 IonicContact NH1-OD2 3.25Å; D129-L160 WeakPolarHBondContact O-CD1 3.11Å
130	P	77.3	Confident	81.4	Confident	82 Å²	82	34.7 Å²	34.7	53%	0.532	18%	0.179	S	C	.	.			trans	-62.9	140.3	177.6	28	-34.8	0	0	0	110.7	Q157	P130-Q157 WeakPolarHBondContact CA-O 3.44Å
131	L	81.5	Confident	80.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	114.3	-178.4	177.9	63.5	0	0	0	110.7	F95 C133 H156 Q157 L160 I166 I192	F95-L131 HydrophobicContact CE1-CD2 3.98Å; F95-L131 HydrophobicContact CZ-CD1 4.45Å; F95-L131 HydrophobicContact CZ-CD2 4.49Å; L131-C133 HydrophobicContact CD1-CB 3.98Å; L131-C133 HydrophobicContact CG-CB 4.37Å; L131-H156 CarbonylContact O-C 3.51Å; L131-H156 WeakPolarHBondContact O-CA 3.05Å; L131-Q157 PolarHBondContact N-O 2.84Å; L131-Q157 PolarHBondContact O-N 2.83Å; L131-L160 HydrophobicContact CB-CD1 4.36Å; L131-I166 HydrophobicContact CD2-CD1 4.19Å; L131-I166 HydrophobicContact CD2-CG2 4.43Å; L131-I192 HydrophobicContact CD1-CG1 4.36Å; L131-I192 HydrophobicContact CD1-CG2 4.19Å
132	F	85.8	Confident	78.6	Confident	99 Å²	99	39.6 Å²	39.6	43%	0.434	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	120.4	159.1	-85.8	-88.1	0	0	0	108.6	H156 Y193	F132-H156 HydrophobicContact CD1-CB 3.87Å; F132-H156 AromaticContact CD1-CD2 3.75Å; F132-H156 AromaticContact CD1-CG 3.91Å; F132-H156 AromaticContact CD2-CD2 3.54Å; F132-H156 AromaticContact CD2-NE2 3.98Å; F132-H156 HydrophobicContact CE1-CB 3.69Å; F132-H156 AromaticContact CE1-CD2 3.4Å; F132-H156 WeakPolarHBondContact CE1-CD2 3.44Å; F132-H156 AromaticContact CE1-CG 3.39Å; F132-H156 AromaticContact CE1-ND1 3.94Å; F132-H156 AromaticContact CE1-NE2 3.98Å; F132-H156 AromaticContact CE2-CD2 3.16Å; F132-H156 WeakPolarHBondContact CE2-CD2 3.49Å; F132-H156 AromaticContact CE2-NE2 3.2Å; F132-H156 WeakPolarHBondContact CE2-NE2 3.39Å; F132-H156 AromaticContact CG-CD2 3.83Å; F132-H156 HydrophobicContact CZ-CB 4.27Å; F132-H156 AromaticContact CZ-CD2 3.1Å; F132-H156 WeakPolarHBondContact CZ-CD2 3.18Å; F132-H156 AromaticContact CZ-CE1 3.57Å; F132-H156 AromaticContact CZ-CG 3.46Å; F132-H156 VanDerWaalsContact CZ-CG 3.46Å; F132-H156 AromaticContact CZ-ND1 3.74Å; F132-H156 AromaticContact CZ-NE2 3.21Å; F132-H156 WeakPolarHBondContact CZ-NE2 3.43Å; F132-Y193 PolarHBondContact O-N 2.81Å
133	C	87	Confident	76.7	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	162.6	175.9	68.3	0	0	0	0	113.5	L131 V154 V155 V190 V191 I192	L131-C133 HydrophobicContact CD1-CB 3.98Å; L131-C133 HydrophobicContact CG-CB 4.37Å; C133-V154 CarbonylContact O-C 3.57Å; C133-V154 WeakPolarHBondContact O-CA 3.23Å; C133-V155 PolarHBondContact N-O 2.85Å; C133-V155 PolarHBondContact O-N 2.86Å; C133-V190 HydrophobicContact CB-CG1 3.79Å; C133-V191 CarbonylContact C-O 3.13Å; C133-V191 WeakPolarHBondContact CA-O 3.16Å; C133-V191 VanDerWaalsContact CB-O 3.29Å; C133-V191 WeakPolarHBondContact CB-O 3.4Å; C133-I192 HydrophobicContact CB-CG1 4.33Å
134	K	88.3	Confident	74.7	Confident	62 Å²	62	42.7 Å²	42.7	27%	0.27	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	118.7	164.8	-171.7	-176.2	69.4	154.9	0	108.9	E152 K153 V154 V190 V191 Y193	K134-E152 HydrophobicContact CD-CG 4.06Å; K134-E152 VanDerWaalsContact CD-OE1 3.31Å; K134-E152 WeakPolarHBondContact CD-OE1 3.49Å; K134-E152 VanDerWaalsContact CE-OE1 3.22Å; K134-E152 WeakPolarHBondContact CE-OE1 3.34Å; K134-E152 HydrophobicContact CG-CG 4.1Å; K134-E152 IonicContact NZ-OE1 2.62Å; K134-E152 PolarHBondContact NZ-OE1 2.85Å; K134-K153 WeakPolarHBondContact CA-O 3.37Å; K134-V154 HydrophobicContact CB-CG2 4.36Å; K134-V154 HydrophobicContact CG-CG2 4.13Å; K134-V190 WeakPolarHBondContact O-CA 3.5Å; K134-V191 HydrophobicContact CB-CB 4.34Å; K134-V191 PolarHBondContact N-O 2.89Å; K134-V191 PolarHBondContact O-N 3.01Å; K134-Y193 HydrophobicContact CB-CE2 3.98Å
135	V	89.4	Confident	72.8	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	130.2	177.5	179.5	0	0	0	0	109	L122 I137 F151 E152 K153 V155 I166 A167 T189 V190	L122-V135 HydrophobicContact CD2-CB 4.38Å; L122-V135 HydrophobicContact CD2-CG1 3.54Å; L122-V135 HydrophobicContact CD2-CG2 3.86Å; V135-I137 HydrophobicContact CG1-CD1 4.44Å; V135-I137 HydrophobicContact CG1-CG1 4.13Å; V135-F151 HydrophobicContact CB-CE1 4.43Å; V135-F151 HydrophobicContact CG1-CD1 4.49Å; V135-F151 HydrophobicContact CG1-CE1 4.33Å; V135-E152 CarbonylContact O-C 3.59Å; V135-E152 VanDerWaalsContact O-CA 3.27Å; V135-E152 WeakPolarHBondContact O-CA 3.49Å; V135-K153 PolarHBondContact N-O 2.85Å; V135-K153 PolarHBondContact O-N 2.83Å; V135-V155 HydrophobicContact CG2-CG2 4.15Å; V135-I166 HydrophobicContact CG2-CD1 4.18Å; V135-A167 HydrophobicContact CB-CB 4.47Å; V135-A167 HydrophobicContact CG1-CB 3.99Å; V135-T189 CarbonylContact C-O 3.59Å; V135-T189 WeakPolarHBondContact CA-O 3.47Å; V135-V190 HydrophobicContact CG2-CG1 4.41Å; V135-V190 HydrophobicContact CG2-CG2 4.46Å
136	R	88.3	Confident	71.7	Confident	83 Å²	83	49.2 Å²	49.2	31%	0.313	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	136.4	166.3	-172.2	-175.7	66.9	-160.2	-11.8	109.2	D138 K149 F151 E152 C188 T189	R136-D138 WeakPolarHBondContact CD-OD1 3.44Å; R136-D138 WeakPolarHBondContact CD-OD2 3.38Å; R136-D138 WeakPolarHBondContact CG-OD1 3.32Å; R136-D138 IonicContact CZ-OD2 3.35Å; R136-D138 IonicContact NE-OD1 3.61Å; R136-D138 IonicContact NE-OD2 3.13Å; R136-D138 PolarHBondContact NE-OD2 2.85Å; R136-D138 IonicContact NH2-OD2 3.66Å; R136-K149 HydrophobicContact CG-CG 4.36Å; R136-F151 CarbonylContact C-O 3.58Å; R136-F151 VanDerWaalsContact CA-O 3.25Å; R136-F151 WeakPolarHBondContact CA-O 3.28Å; R136-F151 VanDerWaalsContact CG-O 3.29Å; R136-F151 WeakPolarHBondContact CG-O 3.48Å; R136-E152 HydrophobicContact CG-CB 4.44Å; R136-C188 WeakPolarHBondContact O-CA 3.27Å; R136-T189 PolarHBondContact N-O 3.19Å; R136-T189 PolarHBondContact NH2-OG1 2.95Å; R136-T189 PolarHBondContact O-N 2.95Å
137	I	87.4	Confident	71.4	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	124.2	173.4	-57.2	174.6	0	0	0	108.1	I120 V135 L150 F151 A167 V169 I186 I187	I120-I137 HydrophobicContact CD1-CG2 4.11Å; I120-I137 HydrophobicContact CG2-CD1 4.08Å; I120-I137 HydrophobicContact CG2-CG2 4.32Å; V135-I137 HydrophobicContact CG1-CD1 4.44Å; V135-I137 HydrophobicContact CG1-CG1 4.13Å; I137-L150 PolarHBondContact O-N 3.38Å; I137-L150 VanDerWaalsContact O-N 3.13Å; I137-F151 HydrophobicContact CB-CB 4.18Å; I137-F151 HydrophobicContact CG1-CD1 4.47Å; I137-F151 PolarHBondContact N-O 2.98Å; I137-F151 PolarHBondContact O-N 2.85Å; I137-F151 VanDerWaalsContact O-N 3.11Å; I137-A167 HydrophobicContact CD1-CB 4.46Å; I137-V169 HydrophobicContact CB-CG1 4.29Å; I137-V169 HydrophobicContact CD1-CG1 4.04Å; I137-V169 HydrophobicContact CG2-CG1 4.19Å; I137-I186 HydrophobicContact CG2-CG2 3.98Å; I137-I187 WeakPolarHBondContact CA-O 2.98Å
138	D	85.5	Confident	71.7	Confident	11 Å²	11	47.1 Å²	47.1	6%	0.059	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	153.3	-177.7	-47.6	-67.1	0	0	0	109.8	R136 M147 N148 K149 I187	R136-D138 WeakPolarHBondContact CD-OD1 3.44Å; R136-D138 WeakPolarHBondContact CD-OD2 3.38Å; R136-D138 WeakPolarHBondContact CG-OD1 3.32Å; R136-D138 IonicContact CZ-OD2 3.35Å; R136-D138 IonicContact NE-OD1 3.61Å; R136-D138 IonicContact NE-OD2 3.13Å; R136-D138 PolarHBondContact NE-OD2 2.85Å; R136-D138 IonicContact NH2-OD2 3.66Å; D138-M147 HydrophobicContact CB-CB 4.42Å; D138-M147 HydrophobicContact CB-SD 4.38Å; D138-N148 VanDerWaalsContact CA-O 3.3Å; D138-N148 WeakPolarHBondContact CA-O 3.46Å; D138-K149 VanDerWaalsContact OD1-CA 3.32Å; D138-K149 WeakPolarHBondContact OD1-CA 3.21Å; D138-I187 HydrophobicContact CB-CB 4.46Å; D138-I187 PolarHBondContact N-O 2.9Å; D138-I187 PolarHBondContact O-N 3.42Å
139	I	82.4	Confident	72.1	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	137.8	169.9	-66.1	-171.7	0	0	0	109.8	I120 N148 L150 L171 Y178 L184 T185 I186	I120-I139 HydrophobicContact CD1-CD1 3.9Å; I120-I139 HydrophobicContact CD1-CG1 4.4Å; I139-N148 PolarHBondContact N-O 2.85Å; I139-N148 PolarHBondContact O-N 2.8Å; I139-L150 HydrophobicContact CB-CD1 4.27Å; I139-L150 HydrophobicContact CD1-CD1 3.46Å; I139-L150 VanDerWaalsContact CD1-CD1 3.46Å; I139-L150 HydrophobicContact CG1-CD1 3.59Å; I139-L150 HydrophobicContact CG1-CG 4.34Å; I139-L171 HydrophobicContact CD1-CD2 3.4Å; I139-Y178 HydrophobicContact CB-CD1 4.33Å; I139-Y178 HydrophobicContact CG2-CD1 3.7Å; I139-Y178 HydrophobicContact CG2-CG 4.01Å; I139-L184 HydrophobicContact CD1-CD1 4.33Å; I139-L184 HydrophobicContact CG2-CD1 3.86Å; I139-T185 WeakPolarHBondContact CA-O 3.37Å; I139-I186 HydrophobicContact CD1-CG1 4.25Å; I139-I186 HydrophobicContact CG1-CG1 4.21Å
140	A	72.8	Confident	72	Confident	12 Å²	12	46.8 Å²	46.8	10%	0.099	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	137.9	176	0	0	0	0	0	111.4	M147 T185	A140-M147 HydrophobicContact CB-CE 3.69Å; A140-M147 HydrophobicContact CB-SD 4.08Å; A140-T185 HydrophobicContact CB-CG2 4.33Å; A140-T185 PolarHBondContact N-O 2.73Å
141	Y	65.7	Low	71.9	Confident	67 Å²	67	44.6 Å²	44.6	26%	0.263	23%	0.229	S	C	.	.			trans	-80.6	160.7	170.2	-78.1	-81.2	0	0	0	112.2	N143 G144 H146 N148 Y178	Y141-N143 WeakPolarHBondContact CB-OD1 3.18Å; Y141-N143 PolarHBondContact O-N 2.52Å; Y141-G144 PolarHBondContact O-N 2.9Å; Y141-H146 HydrophobicContact CD2-CB 3.64Å; Y141-H146 WeakPolarHBondContact CD2-O 3.27Å; Y141-H146 HydrophobicContact CE2-CB 4.14Å; Y141-H146 PolarHBondContact N-O 3.01Å; Y141-N148 HydrophobicContact CD2-CB 4.4Å; Y141-N148 HydrophobicContact CE2-CB 3.57Å; Y141-N148 PolarHBondContact OH-ND2 2.89Å; Y141-Y178 AromaticContact CD1-CD1 3.78Å; Y141-Y178 HydrophobicContact CD1-CD1 3.78Å; Y141-Y178 AromaticContact CD1-CE1 3.54Å; Y141-Y178 HydrophobicContact CD1-CE1 3.54Å; Y141-Y178 HydrophobicContact CD2-CE1 4.33Å; Y141-Y178 AromaticContact CE1-CD1 3.93Å; Y141-Y178 HydrophobicContact CE1-CD1 3.93Å; Y141-Y178 AromaticContact CE1-CE1 3.19Å; Y141-Y178 HydrophobicContact CE1-CE1 3.19Å; Y141-Y178 HydrophobicContact CE1-CE2 4.37Å; Y141-Y178 AromaticContact CE1-CZ 3.46Å; Y141-Y178 VanDerWaalsContact CE1-CZ 3.46Å; Y141-Y178 HydrophobicContact CE2-CE1 4.08Å; Y141-Y178 HydrophobicContact CG-CD1 4.2Å; Y141-Y178 HydrophobicContact CG-CE1 4.11Å; Y141-Y178 AromaticContact CZ-CE1 3.49Å; Y141-Y178 VanDerWaalsContact CZ-CE1 3.49Å; Y141-Y178 AromaticContact CZ-CZ 3.87Å; Y141-Y178 PolarHBondContact OH-OH 3.11Å
142	A	53.9	Low	71.7	Confident	39 Å²	39	48.6 Å²	48.6	32%	0.322	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-18.8	172.8	0	0	0	0	0	115.5	S177 V180	A142-S177 PolarHBondContact N-O 3.26Å; A142-S177 VanDerWaalsContact N-O 3.14Å; A142-V180 HydrophobicContact CB-CG1 4.26Å; A142-V180 HydrophobicContact CB-CG2 4.21Å
143	N	49.6	Very low	71.3	Confident	64 Å²	64	48.7 Å²	48.7	34%	0.342	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	5.8	176.3	66.1	-0.1	0	0	0	114.4	Y141 A145 D426	Y141-N143 WeakPolarHBondContact CB-OD1 3.18Å; Y141-N143 PolarHBondContact O-N 2.52Å; N143-A145 PolarHBondContact O-N 3.17Å; N143-D426 WeakPolarHBondContact O-CB 3.38Å
144	G	49.1	Very low	70.4	Confident	31 Å²	31	53.2 Å²	53.2	32%	0.32	28%	0.276	S	S	.	.	S	Bend	trans	67.7	-29.4	171.2	0	0	0	0	0	117.9	Y141	Y141-G144 PolarHBondContact O-N 2.9Å
145	A	47.9	Very low	69.8	Low	52 Å²	52	50.9 Å²	50.9	43%	0.43	27%	0.267	S	S	.	.	S	Bend	trans	-87.2	-19.2	-172.8	0	0	0	0	0	114.2	N143 D426	N143-A145 PolarHBondContact O-N 3.17Å; A145-D426 HydrophobicContact CB-CB 3.93Å
146	H	55	Low	69.2	Low	119 Å²	119	55.2 Å²	55.2	55%	0.551	29%	0.287	S	S	*	.			trans	-113.8	140.6	176.5	-69.2	-74.7	0	0	0	111.5	Y141	Y141-H146 HydrophobicContact CD2-CB 3.64Å; Y141-H146 WeakPolarHBondContact CD2-O 3.27Å; Y141-H146 HydrophobicContact CE2-CB 4.14Å; Y141-H146 PolarHBondContact N-O 3.01Å
147	M	60.9	Low	68.2	Low	72 Å²	72	52.9 Å²	52.9	36%	0.355	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.8	165.3	-73.7	-74.5	158.1	0	0	107.6	D138 A140 I187 I429	D138-M147 HydrophobicContact CB-CB 4.42Å; D138-M147 HydrophobicContact CB-SD 4.38Å; A140-M147 HydrophobicContact CB-CE 3.69Å; A140-M147 HydrophobicContact CB-SD 4.08Å; M147-I187 HydrophobicContact CE-CD1 3.51Å; M147-I187 HydrophobicContact SD-CD1 3.83Å; M147-I187 HydrophobicContact SD-CG1 4.47Å; M147-I429 HydrophobicContact CE-CD1 4.32Å
148	N	66.1	Low	66.9	Low	43 Å²	43	59.5 Å²	59.5	23%	0.23	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	115.9	166.2	-165.5	0.6	0	0	0	109.2	D138 I139 Y141 L150 Y178	D138-N148 VanDerWaalsContact CA-O 3.3Å; D138-N148 WeakPolarHBondContact CA-O 3.46Å; I139-N148 PolarHBondContact N-O 2.85Å; I139-N148 PolarHBondContact O-N 2.8Å; Y141-N148 HydrophobicContact CD2-CB 4.4Å; Y141-N148 HydrophobicContact CE2-CB 3.57Å; Y141-N148 PolarHBondContact OH-ND2 2.89Å; N148-L150 HydrophobicContact CB-CD2 4.25Å; N148-L150 PolarHBondContact O-N 2.79Å; N148-Y178 HydrophobicContact CB-CE1 3.73Å; N148-Y178 PolarHBondContact ND2-OH 3.13Å
149	K	69.4	Low	65.6	Low	109 Å²	109	67.4 Å²	67.4	47%	0.474	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	93.3	172.5	-177.5	-173	177.8	-174.3	0	109	R136 D138 E152	R136-K149 HydrophobicContact CG-CG 4.36Å; D138-K149 VanDerWaalsContact OD1-CA 3.32Å; D138-K149 WeakPolarHBondContact OD1-CA 3.21Å; K149-E152 VanDerWaalsContact CE-CB 3.47Å; K149-E152 WeakPolarHBondContact CE-OE2 3.33Å; K149-E152 IonicContact NZ-OE2 2.66Å; K149-E152 PolarHBondContact NZ-OE2 2.97Å
150	L	69.3	Low	64.4	Low	36 Å²	36	69 Å²	69	19%	0.188	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	-32.3	179.6	-60	-172.7	0	0	0	112.2	I137 I139 N148 V169 L171 P172	I137-L150 PolarHBondContact O-N 3.38Å; I137-L150 VanDerWaalsContact O-N 3.13Å; I139-L150 HydrophobicContact CB-CD1 4.27Å; I139-L150 HydrophobicContact CD1-CD1 3.46Å; I139-L150 VanDerWaalsContact CD1-CD1 3.46Å; I139-L150 HydrophobicContact CG1-CD1 3.59Å; I139-L150 HydrophobicContact CG1-CG 4.34Å; N148-L150 HydrophobicContact CB-CD2 4.25Å; N148-L150 PolarHBondContact O-N 2.79Å; L150-V169 HydrophobicContact CB-CG2 3.87Å; L150-L171 HydrophobicContact CD1-CD2 4.05Å; L150-P172 HydrophobicContact CD2-CG 3.85Å
151	F	75.7	Confident	63.8	Low	35 Å²	35	78.4 Å²	78.4	15%	0.154	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	139.2	-169.8	-173.3	-99.6	0	0	0	112.6	V135 R136 I137 K153 A167 E168 V169	V135-F151 HydrophobicContact CB-CE1 4.43Å; V135-F151 HydrophobicContact CG1-CD1 4.49Å; V135-F151 HydrophobicContact CG1-CE1 4.33Å; R136-F151 CarbonylContact C-O 3.58Å; R136-F151 VanDerWaalsContact CA-O 3.25Å; R136-F151 WeakPolarHBondContact CA-O 3.28Å; R136-F151 VanDerWaalsContact CG-O 3.29Å; R136-F151 WeakPolarHBondContact CG-O 3.48Å; I137-F151 HydrophobicContact CB-CB 4.18Å; I137-F151 HydrophobicContact CG1-CD1 4.47Å; I137-F151 PolarHBondContact N-O 2.98Å; I137-F151 PolarHBondContact O-N 2.85Å; I137-F151 VanDerWaalsContact O-N 3.11Å; F151-K153 HydrophobicContact CD1-CB 4.28Å; F151-K153 HydrophobicContact CE1-CB 3.39Å; F151-K153 HydrophobicContact CE1-CD 4.3Å; F151-K153 HydrophobicContact CE1-CG 4.48Å; F151-K153 HydrophobicContact CE2-CB 4.15Å; F151-K153 HydrophobicContact CE2-CD 4.32Å; F151-K153 HydrophobicContact CZ-CB 3.33Å; F151-K153 HydrophobicContact CZ-CD 3.54Å; F151-K153 HydrophobicContact CZ-CG 4.07Å; F151-A167 HydrophobicContact CD1-CB 4.33Å; F151-A167 HydrophobicContact CE1-CB 3.43Å; F151-A167 VanDerWaalsContact CE1-CB 3.43Å; F151-A167 HydrophobicContact CZ-CB 3.7Å; F151-E168 VanDerWaalsContact CE2-O 3.26Å; F151-E168 WeakPolarHBondContact CE2-O 3.44Å; F151-V169 HydrophobicContact CB-CB 3.86Å; F151-V169 HydrophobicContact CB-CG1 4.17Å; F151-V169 HydrophobicContact CB-CG2 3.91Å; F151-V169 HydrophobicContact CD2-CB 3.89Å; F151-V169 HydrophobicContact CD2-CG2 4.27Å; F151-V169 HydrophobicContact CG-CB 4.08Å; F151-V169 HydrophobicContact CG-CG2 4.49Å
152	E	75.3	Confident	63.6	Low	84 Å²	84	77.7 Å²	77.7	39%	0.393	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	129	159.1	-177.4	175.8	-140.2	0	0	109.1	K134 V135 R136 K149	K134-E152 HydrophobicContact CD-CG 4.06Å; K134-E152 VanDerWaalsContact CD-OE1 3.31Å; K134-E152 WeakPolarHBondContact CD-OE1 3.49Å; K134-E152 VanDerWaalsContact CE-OE1 3.22Å; K134-E152 WeakPolarHBondContact CE-OE1 3.34Å; K134-E152 HydrophobicContact CG-CG 4.1Å; K134-E152 IonicContact NZ-OE1 2.62Å; K134-E152 PolarHBondContact NZ-OE1 2.85Å; V135-E152 CarbonylContact O-C 3.59Å; V135-E152 VanDerWaalsContact O-CA 3.27Å; V135-E152 WeakPolarHBondContact O-CA 3.49Å; R136-E152 HydrophobicContact CG-CB 4.44Å; K149-E152 VanDerWaalsContact CE-CB 3.47Å; K149-E152 WeakPolarHBondContact CE-OE2 3.33Å; K149-E152 IonicContact NZ-OE2 2.66Å; K149-E152 PolarHBondContact NZ-OE2 2.97Å
153	K	77.7	Confident	64.5	Low	101 Å²	101	79.4 Å²	79.4	44%	0.439	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	137.7	-178.7	-176.8	-174.6	174.1	-166.2	0	110.8	K134 V135 F151 V155	K134-K153 WeakPolarHBondContact CA-O 3.37Å; V135-K153 PolarHBondContact N-O 2.85Å; V135-K153 PolarHBondContact O-N 2.83Å; F151-K153 HydrophobicContact CD1-CB 4.28Å; F151-K153 HydrophobicContact CE1-CB 3.39Å; F151-K153 HydrophobicContact CE1-CD 4.3Å; F151-K153 HydrophobicContact CE1-CG 4.48Å; F151-K153 HydrophobicContact CE2-CB 4.15Å; F151-K153 HydrophobicContact CE2-CD 4.32Å; F151-K153 HydrophobicContact CZ-CB 3.33Å; F151-K153 HydrophobicContact CZ-CD 3.54Å; F151-K153 HydrophobicContact CZ-CG 4.07Å; K153-V155 HydrophobicContact CD-CG2 4.37Å; K153-V155 HydrophobicContact CG-CG2 4.42Å
154	V	68	Low	65.9	Low	96 Å²	96	76.9 Å²	76.9	58%	0.582	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	128.2	165.2	-176.7	0	0	0	0	108.9	C133 K134	C133-V154 CarbonylContact O-C 3.57Å; C133-V154 WeakPolarHBondContact O-CA 3.23Å; K134-V154 HydrophobicContact CB-CG2 4.36Å; K134-V154 HydrophobicContact CG-CG2 4.13Å
155	V	77.1	Confident	67.7	Low	13 Å²	13	79.1 Å²	79.1	8%	0.079	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	133.9	179.2	-175	0	0	0	0	108.6	C133 V135 K153 I166	C133-V155 PolarHBondContact N-O 2.85Å; C133-V155 PolarHBondContact O-N 2.86Å; V135-V155 HydrophobicContact CG2-CG2 4.15Å; K153-V155 HydrophobicContact CD-CG2 4.37Å; K153-V155 HydrophobicContact CG-CG2 4.42Å; V155-I166 HydrophobicContact CG1-CB 4.07Å; V155-I166 HydrophobicContact CG1-CG2 4.24Å; V155-I166 WeakPolarHBondContact CG2-O 3.33Å
156	H	76.1	Confident	69.5	Low	90 Å²	90	77 Å²	77	42%	0.417	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	127.5	168.4	171.9	-141.6	0	0	0	108.4	L131 F132 E158	L131-H156 CarbonylContact O-C 3.51Å; L131-H156 WeakPolarHBondContact O-CA 3.05Å; F132-H156 HydrophobicContact CD1-CB 3.87Å; F132-H156 AromaticContact CD1-CD2 3.75Å; F132-H156 AromaticContact CD1-CG 3.91Å; F132-H156 AromaticContact CD2-CD2 3.54Å; F132-H156 AromaticContact CD2-NE2 3.98Å; F132-H156 HydrophobicContact CE1-CB 3.69Å; F132-H156 AromaticContact CE1-CD2 3.4Å; F132-H156 WeakPolarHBondContact CE1-CD2 3.44Å; F132-H156 AromaticContact CE1-CG 3.39Å; F132-H156 AromaticContact CE1-ND1 3.94Å; F132-H156 AromaticContact CE1-NE2 3.98Å; F132-H156 AromaticContact CE2-CD2 3.16Å; F132-H156 WeakPolarHBondContact CE2-CD2 3.49Å; F132-H156 AromaticContact CE2-NE2 3.2Å; F132-H156 WeakPolarHBondContact CE2-NE2 3.39Å; F132-H156 AromaticContact CG-CD2 3.83Å; F132-H156 HydrophobicContact CZ-CB 4.27Å; F132-H156 AromaticContact CZ-CD2 3.1Å; F132-H156 WeakPolarHBondContact CZ-CD2 3.18Å; F132-H156 AromaticContact CZ-CE1 3.57Å; F132-H156 AromaticContact CZ-CG 3.46Å; F132-H156 VanDerWaalsContact CZ-CG 3.46Å; F132-H156 AromaticContact CZ-ND1 3.74Å; F132-H156 AromaticContact CZ-NE2 3.21Å; F132-H156 WeakPolarHBondContact CZ-NE2 3.43Å; H156-E158 WeakPolarHBondContact CE1-CG 3.26Å; H156-E158 IonicContact CE1-OE1 2.8Å; H156-E158 PolarHBondContact CE1-OE1 2.85Å; H156-E158 WeakPolarHBondContact NE2-CG 3.27Å
157	Q	67.4	Low	71	Confident	34 Å²	34	71.4 Å²	71.4	16%	0.159	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	97.7	179.1	-170.8	170.2	7.4	0	0	111.9	P130 L131 K159 L160 S164	P130-Q157 WeakPolarHBondContact CA-O 3.44Å; L131-Q157 PolarHBondContact N-O 2.84Å; L131-Q157 PolarHBondContact O-N 2.83Å; Q157-K159 VanDerWaalsContact C-N 3.28Å; Q157-K159 WeakPolarHBondContact CG-O 3.47Å; Q157-K159 PolarHBondContact NE2-O 2.7Å; Q157-K159 PolarHBondContact O-N 3.11Å; Q157-L160 HydrophobicContact CG-CG 4.23Å; Q157-S164 PolarHBondContact NE2-OG 2.74Å
158	E	60.8	Low	72.3	Confident	141 Å²	141	71.8 Å²	71.8	66%	0.659	35%	0.346	S	S	*	.	S	Bend	trans	-68.2	-23.4	176.3	-59.5	-180	169.3	0	0	113.9	H156	H156-E158 WeakPolarHBondContact CE1-CG 3.26Å; H156-E158 IonicContact CE1-OE1 2.8Å; H156-E158 PolarHBondContact CE1-OE1 2.85Å; H156-E158 WeakPolarHBondContact NE2-CG 3.27Å
159	K	58.1	Low	73.3	Confident	177 Å²	177	70.4 Å²	70.4	77%	0.77	34%	0.339	S	S	*	.	S	Bend	trans	-138.3	103.3	-176.4	-68.7	-177.8	-178.2	173.7	0	110.2	Q157	Q157-K159 VanDerWaalsContact C-N 3.28Å; Q157-K159 WeakPolarHBondContact CG-O 3.47Å; Q157-K159 PolarHBondContact NE2-O 2.7Å; Q157-K159 PolarHBondContact O-N 3.11Å
160	L	56.5	Low	74	Confident	35 Å²	35	68.5 Å²	68.5	18%	0.183	34%	0.337	C	S	.	.			trans	-78.2	126.4	168.1	-74.8	132.4	0	0	0	110	S126 D129 L131 Q157	S126-L160 WeakPolarHBondContact O-CB 3.21Å; D129-L160 WeakPolarHBondContact O-CD1 3.11Å; L131-L160 HydrophobicContact CB-CD1 4.36Å; Q157-L160 HydrophobicContact CG-CG 4.23Å
161	R	59.9	Low	74.6	Confident	208 Å²	208	67.3 Å²	67.3	79%	0.785	33%	0.331	S	S	*	.			trans	-75.6	152	151.9	-64.5	179.3	-179.9	177.1	0.4	106.8	V163 S164	R161-V163 CarbonylContact O-C 3.58Å; R161-V163 VanDerWaalsContact O-C 3.28Å; R161-V163 WeakPolarHBondContact O-CA 3.45Å; R161-V163 PolarHBondContact O-N 2.88Å; R161-S164 PolarHBondContact N-OG 2.73Å; R161-S164 VanDerWaalsContact N-OG 3.11Å; R161-S164 PolarHBondContact O-OG 3.41Å
162	A	62.6	Low	74.6	Confident	53 Å²	53	67.5 Å²	67.5	44%	0.438	34%	0.335	S	S	.	.	S	Bend	trans	-40.6	-36.7	-176.6	0	0	0	0	0	115	F125 H127	F125-A162 WeakPolarHBondContact CA-O 2.91Å; H127-A162 VanDerWaalsContact CE1-CB 3.45Å; H127-A162 WeakPolarHBondContact CE1-CB 3.06Å
163	V	71.1	Confident	74.4	Confident	74 Å²	74	71.7 Å²	71.7	45%	0.448	36%	0.355	S	S	.	.	S	Bend	trans	-129.3	131.2	160.9	-168.4	0	0	0	0	108	H123 S124 F125 R161	H123-V163 HydrophobicContact CB-CG1 3.96Å; S124-V163 WeakPolarHBondContact O-CA 3.41Å; F125-V163 HydrophobicContact CD1-CB 4.33Å; F125-V163 HydrophobicContact CD1-CG1 4Å; F125-V163 HydrophobicContact CD1-CG2 3.63Å; F125-V163 HydrophobicContact CE1-CB 4.28Å; F125-V163 HydrophobicContact CE1-CG1 3.61Å; F125-V163 HydrophobicContact CE1-CG2 3.66Å; F125-V163 HydrophobicContact CE2-CG1 4.38Å; F125-V163 HydrophobicContact CZ-CG1 3.82Å; R161-V163 CarbonylContact O-C 3.58Å; R161-V163 VanDerWaalsContact O-C 3.28Å; R161-V163 WeakPolarHBondContact O-CA 3.45Å; R161-V163 PolarHBondContact O-N 2.88Å
164	S	80.3	Confident	74.2	Confident	11 Å²	11	71.5 Å²	71.5	8%	0.077	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	129.9	179.5	-60.9	0	0	0	0	111.2	H123 S124 Q157 R161 I166	H123-S164 CarbonylContact C-O 3.55Å; H123-S164 VanDerWaalsContact CA-O 3.31Å; H123-S164 WeakPolarHBondContact CA-O 3.03Å; S124-S164 PolarHBondContact N-O 2.82Å; S124-S164 PolarHBondContact O-N 2.84Å; Q157-S164 PolarHBondContact NE2-OG 2.74Å; R161-S164 PolarHBondContact N-OG 2.73Å; R161-S164 VanDerWaalsContact N-OG 3.11Å; R161-S164 PolarHBondContact O-OG 3.41Å; S164-I166 PolarHBondContact O-N 2.68Å
165	E	85.9	Confident	74.7	Confident	79 Å²	79	67.2 Å²	67.2	37%	0.369	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	121.8	170.9	-165.4	166.6	98.8	0	0	110	R100 T121 H123	R100-E165 IonicContact CZ-OE2 2.63Å; R100-E165 IonicContact NH1-OE2 3.68Å; R100-E165 PolarHBondContact NH1-OE2 2.9Å; T121-E165 WeakPolarHBondContact CB-OE2 3.28Å; T121-E165 HydrophobicContact CG2-CG 4.33Å; T121-E165 WeakPolarHBondContact CG2-OE2 3.14Å; H123-E165 WeakPolarHBondContact CE1-CB 3.49Å; H123-E165 IonicContact CE1-OE2 3.79Å; H123-E165 PolarHBondContact CE1-OE2 3.36Å; H123-E165 WeakPolarHBondContact NE2-CG 3.36Å; H123-E165 IonicContact NE2-OE2 3.91Å; H123-E165 PolarHBondContact NE2-OE2 2.86Å
166	I	86.6	Confident	74.7	Confident	7 Å²	7	72.5 Å²	72.5	4%	0.036	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	-26.9	-176.4	54.8	166.5	0	0	0	112.9	F95 L122 L131 V135 V155 S164	F95-I166 HydrophobicContact CD1-CD1 3.88Å; F95-I166 HydrophobicContact CE1-CD1 3.82Å; L122-I166 HydrophobicContact CB-CG1 4.14Å; L122-I166 HydrophobicContact CD2-CD1 3.6Å; L122-I166 HydrophobicContact CD2-CG1 3.92Å; L122-I166 HydrophobicContact CG-CD1 3.93Å; L122-I166 HydrophobicContact CG-CG1 3.87Å; L122-I166 VanDerWaalsContact O-CG1 3.31Å; L122-I166 WeakPolarHBondContact O-CG1 3.31Å; L122-I166 PolarHBondContact O-N 2.84Å; L131-I166 HydrophobicContact CD2-CD1 4.19Å; L131-I166 HydrophobicContact CD2-CG2 4.43Å; V135-I166 HydrophobicContact CG2-CD1 4.18Å; V155-I166 HydrophobicContact CG1-CB 4.07Å; V155-I166 HydrophobicContact CG1-CG2 4.24Å; V155-I166 WeakPolarHBondContact CG2-O 3.33Å; S164-I166 PolarHBondContact O-N 2.68Å
167	A	86.9	Confident	74.5	Confident	2 Å²	2	70.6 Å²	70.6	2%	0.017	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	145.7	173.8	0	0	0	0	0	111.8	T121 L122 V135 I137 F151	T121-A167 CarbonylContact C-O 3.43Å; T121-A167 VanDerWaalsContact CA-O 3.25Å; T121-A167 WeakPolarHBondContact CA-O 3.42Å; L122-A167 HydrophobicContact CB-CB 4.08Å; L122-A167 PolarHBondContact N-O 3.35Å; L122-A167 PolarHBondContact O-N 2.87Å; V135-A167 HydrophobicContact CB-CB 4.47Å; V135-A167 HydrophobicContact CG1-CB 3.99Å; I137-A167 HydrophobicContact CD1-CB 4.46Å; F151-A167 HydrophobicContact CD1-CB 4.33Å; F151-A167 HydrophobicContact CE1-CB 3.43Å; F151-A167 VanDerWaalsContact CE1-CB 3.43Å; F151-A167 HydrophobicContact CZ-CB 3.7Å
168	E	88.2	Confident	74.9	Confident	80 Å²	80	69.9 Å²	69.9	37%	0.374	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	134.2	168.7	-179.8	-175.1	-167.9	0	0	107.1	R102 A119 I120 T121 F151	R102-E168 IonicContact NH1-OE1 3.49Å; A119-E168 HydrophobicContact CB-CG 4.13Å; I120-E168 CarbonylContact O-C 3.47Å; I120-E168 WeakPolarHBondContact O-CA 3.42Å; T121-E168 HydrophobicContact CG2-CB 4.04Å; T121-E168 HydrophobicContact CG2-CG 3.88Å; F151-E168 VanDerWaalsContact CE2-O 3.26Å; F151-E168 WeakPolarHBondContact CE2-O 3.44Å
169	V	85.7	Confident	75.8	Confident	14 Å²	14	64.3 Å²	64.3	9%	0.085	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	128.9	169.3	60.3	0	0	0	0	110.6	A119 I120 I137 L150 F151	A119-V169 CarbonylContact C-O 3.57Å; A119-V169 VanDerWaalsContact CA-O 3.27Å; A119-V169 WeakPolarHBondContact CA-O 3.46Å; I120-V169 HydrophobicContact CB-CG1 3.88Å; I120-V169 PolarHBondContact N-O 2.68Å; I120-V169 PolarHBondContact O-N 3.12Å; I137-V169 HydrophobicContact CB-CG1 4.29Å; I137-V169 HydrophobicContact CD1-CG1 4.04Å; I137-V169 HydrophobicContact CG2-CG1 4.19Å; L150-V169 HydrophobicContact CB-CG2 3.87Å; F151-V169 HydrophobicContact CB-CB 3.86Å; F151-V169 HydrophobicContact CB-CG1 4.17Å; F151-V169 HydrophobicContact CB-CG2 3.91Å; F151-V169 HydrophobicContact CD2-CB 3.89Å; F151-V169 HydrophobicContact CD2-CG2 4.27Å; F151-V169 HydrophobicContact CG-CB 4.08Å; F151-V169 HydrophobicContact CG-CG2 4.49Å
170	T	85.2	Confident	76.3	Confident	68 Å²	68	57.4 Å²	57.4	42%	0.417	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	135	174.3	-44	0	0	0	0	110.2	Q117 K118	Q117-T170 HydrophobicContact CB-CG2 4.12Å; Q117-T170 HydrophobicContact CG-CG2 4.41Å; K118-T170 CarbonylContact O-C 3.6Å; K118-T170 WeakPolarHBondContact O-CA 3.3Å; K118-T170 WeakPolarHBondContact O-CG2 3.46Å
171	L	80.8	Confident	77.1	Confident	12 Å²	12	59.3 Å²	59.3	6%	0.063	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-68.9	151.2	174.3	-70.4	-173.2	0	0	0	111.7	L99 K118 I120 I139 L150 L175	L99-L171 HydrophobicContact CD1-CD1 3.7Å; L99-L171 HydrophobicContact CD1-CG 4.32Å; K118-L171 HydrophobicContact CB-CB 4.1Å; K118-L171 HydrophobicContact CB-CD1 3.75Å; K118-L171 HydrophobicContact CB-CG 4.08Å; K118-L171 HydrophobicContact CD-CD1 4.07Å; K118-L171 PolarHBondContact O-N 2.8Å; I120-L171 HydrophobicContact CD1-CD2 3.58Å; I120-L171 HydrophobicContact CG1-CD2 3.87Å; I120-L171 HydrophobicContact CG1-CG 4.42Å; I139-L171 HydrophobicContact CD1-CD2 3.4Å; L150-L171 HydrophobicContact CD1-CD2 4.05Å; L171-L175 HydrophobicContact CB-CD1 4.36Å; L171-L175 HydrophobicContact CD1-CD1 4.01Å; L171-L175 HydrophobicContact CD1-CD2 3.86Å; L171-L175 HydrophobicContact CD2-CD1 4.43Å
172	P	76.2	Confident	78.1	Confident	39 Å²	39	51.3 Å²	51.3	25%	0.253	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-55.4	144.5	167.5	-23.1	34	0	0	0	111.9	L150 N174 Y178	L150-P172 HydrophobicContact CD2-CG 3.85Å; P172-N174 PolarHBondContact O-N 3.4Å; P172-Y178 HydrophobicContact CB-CE2 4.1Å; P172-Y178 HydrophobicContact CG-CE2 4.01Å
173	Q	71.4	Confident	79	Confident	171 Å²	171	49.6 Å²	49.6	80%	0.799	27%	0.269	S	S	*	.	S	Bend	trans	-63.7	-39	178.1	-72.9	-179.4	-18	0	0	112.8	L175	Q173-L175 PolarHBondContact O-N 2.8Å
174	N	74	Confident	79.8	Confident	98 Å²	98	46.1 Å²	46.1	52%	0.524	25%	0.248	S	C	.	.			trans	-90.2	96.4	170.7	-176.7	-10.2	0	0	0	108.3	P172 D176 Y178	P172-N174 PolarHBondContact O-N 3.4Å; N174-D176 PolarHBondContact OD1-N 3.14Å; N174-Y178 WeakPolarHBondContact O-CE2 3.43Å
175	L	78.6	Confident	80.1	Confident	6 Å²	6	46.8 Å²	46.8	3%	0.031	25%	0.252	C	S	.	.			trans	-90.7	-17.5	178.2	-159	65.1	0	0	0	112.3	F67 K118 L171 Q173 S177 Y178 I179 L184	F67-L175 HydrophobicContact CE1-CD2 3.59Å; F67-L175 HydrophobicContact CZ-CD2 3.63Å; K118-L175 HydrophobicContact CD-CD2 4.37Å; L171-L175 HydrophobicContact CB-CD1 4.36Å; L171-L175 HydrophobicContact CD1-CD1 4.01Å; L171-L175 HydrophobicContact CD1-CD2 3.86Å; L171-L175 HydrophobicContact CD2-CD1 4.43Å; Q173-L175 PolarHBondContact O-N 2.8Å; L175-S177 PolarHBondContact O-N 3.36Å; L175-S177 VanDerWaalsContact O-N 3.17Å; L175-Y178 HydrophobicContact CD1-CD2 4.25Å; L175-Y178 WeakPolarHBondContact O-CA 3.33Å; L175-Y178 WeakPolarHBondContact O-CB 3.47Å; L175-Y178 PolarHBondContact O-N 3.34Å; L175-I179 HydrophobicContact CB-CD1 4.34Å; L175-I179 HydrophobicContact CD2-CD1 4.25Å; L175-I179 HydrophobicContact CG-CD1 4.13Å; L175-I179 HydrophobicContact CG-CG1 4.28Å; L175-I179 PolarHBondContact O-N 2.79Å; L175-L184 HydrophobicContact CD1-CD1 4.21Å; L175-L184 HydrophobicContact CD2-CD2 4.38Å; L175-L184 HydrophobicContact CG-CD1 4.37Å
176	D	75.4	Confident	80.2	Confident	124 Å²	124	43 Å²	43	66%	0.663	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-59	-32.6	-173.7	-55.2	-17.9	0	0	0	112.5	N174 Y178 I179	N174-D176 PolarHBondContact OD1-N 3.14Å; D176-Y178 PolarHBondContact O-N 3.23Å; D176-I179 PolarHBondContact O-N 3.18Å
177	S	72.7	Confident	80.2	Confident	50 Å²	50	43.4 Å²	43.4	35%	0.35	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-70.7	-9.4	175.2	58.5	0	0	0	0	115.1	A142 L175	A142-S177 PolarHBondContact N-O 3.26Å; A142-S177 VanDerWaalsContact N-O 3.14Å; L175-S177 PolarHBondContact O-N 3.36Å; L175-S177 VanDerWaalsContact O-N 3.17Å
178	Y	76.7	Confident	80.3	Confident	18 Å²	18	43.3 Å²	43.3	7%	0.071	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-111.6	-11.6	180	-55.3	-88.1	0	0	0	112.9	I139 Y141 N148 P172 N174 L175 D176	I139-Y178 HydrophobicContact CB-CD1 4.33Å; I139-Y178 HydrophobicContact CG2-CD1 3.7Å; I139-Y178 HydrophobicContact CG2-CG 4.01Å; Y141-Y178 AromaticContact CD1-CD1 3.78Å; Y141-Y178 HydrophobicContact CD1-CD1 3.78Å; Y141-Y178 AromaticContact CD1-CE1 3.54Å; Y141-Y178 HydrophobicContact CD1-CE1 3.54Å; Y141-Y178 HydrophobicContact CD2-CE1 4.33Å; Y141-Y178 AromaticContact CE1-CD1 3.93Å; Y141-Y178 HydrophobicContact CE1-CD1 3.93Å; Y141-Y178 AromaticContact CE1-CE1 3.19Å; Y141-Y178 HydrophobicContact CE1-CE1 3.19Å; Y141-Y178 HydrophobicContact CE1-CE2 4.37Å; Y141-Y178 AromaticContact CE1-CZ 3.46Å; Y141-Y178 VanDerWaalsContact CE1-CZ 3.46Å; Y141-Y178 HydrophobicContact CE2-CE1 4.08Å; Y141-Y178 HydrophobicContact CG-CD1 4.2Å; Y141-Y178 HydrophobicContact CG-CE1 4.11Å; Y141-Y178 AromaticContact CZ-CE1 3.49Å; Y141-Y178 VanDerWaalsContact CZ-CE1 3.49Å; Y141-Y178 AromaticContact CZ-CZ 3.87Å; Y141-Y178 PolarHBondContact OH-OH 3.11Å; N148-Y178 HydrophobicContact CB-CE1 3.73Å; N148-Y178 PolarHBondContact ND2-OH 3.13Å; P172-Y178 HydrophobicContact CB-CE2 4.1Å; P172-Y178 HydrophobicContact CG-CE2 4.01Å; N174-Y178 WeakPolarHBondContact O-CE2 3.43Å; L175-Y178 HydrophobicContact CD1-CD2 4.25Å; L175-Y178 WeakPolarHBondContact O-CA 3.33Å; L175-Y178 WeakPolarHBondContact O-CB 3.47Å; L175-Y178 PolarHBondContact O-N 3.34Å; D176-Y178 PolarHBondContact O-N 3.23Å
179	I	78.1	Confident	80.3	Confident	24 Å²	24	39.7 Å²	39.7	12%	0.123	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	112.3	178.2	-63.5	164.2	0	0	0	107.7	F67 L175 D176 A183 L184	F67-I179 HydrophobicContact CD1-CD1 3.58Å; F67-I179 HydrophobicContact CD1-CG1 4Å; F67-I179 HydrophobicContact CE1-CD1 3.84Å; F67-I179 HydrophobicContact CE1-CG1 4.43Å; L175-I179 HydrophobicContact CB-CD1 4.34Å; L175-I179 HydrophobicContact CD2-CD1 4.25Å; L175-I179 HydrophobicContact CG-CD1 4.13Å; L175-I179 HydrophobicContact CG-CG1 4.28Å; L175-I179 PolarHBondContact O-N 2.79Å; D176-I179 PolarHBondContact O-N 3.18Å; I179-A183 WeakPolarHBondContact CA-O 3.45Å; I179-L184 HydrophobicContact CG1-CD1 4.44Å
180	V	70.4	Confident	80.4	Confident	32 Å²	32	39 Å²	39	19%	0.194	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	119.4	-174.2	-151.2	0	0	0	0	108.3	A142 D182 A183	A142-V180 HydrophobicContact CB-CG1 4.26Å; A142-V180 HydrophobicContact CB-CG2 4.21Å; V180-D182 PolarHBondContact O-N 2.72Å; V180-A183 PolarHBondContact N-O 2.83Å; V180-A183 WeakPolarHBondContact O-CB 3.38Å; V180-A183 PolarHBondContact O-N 2.99Å
181	N	71.5	Confident	80.5	Confident	75 Å²	75	36.5 Å²	36.5	40%	0.401	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	42.2	-174.2	-64.4	-13.6	0	0	0	112.9	A183 T388	N181-A183 PolarHBondContact O-N 2.91Å; N181-T388 HydrophobicContact CB-CG2 3.62Å; N181-T388 WeakPolarHBondContact ND2-CG2 3.2Å
182	D	81.1	Confident	80.8	Confident	41 Å²	41	36.1 Å²	36.1	22%	0.219	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	29	-175.8	-169.9	30.7	0	0	0	113.7	H66 F67 N68 V180	H66-D182 CarbonylContact C-O 3.56Å; H66-D182 WeakPolarHBondContact CA-O 3.28Å; H66-D182 VanDerWaalsContact CA-OD2 3.32Å; H66-D182 WeakPolarHBondContact CA-OD2 3.48Å; H66-D182 PolarHBondContact N-O 3.48Å; H66-D182 IonicContact ND1-OD2 2.7Å; F67-D182 PolarHBondContact N-O 3.07Å; F67-D182 PolarHBondContact N-OD1 2.73Å; N68-D182 WeakPolarHBondContact CB-OD1 3.47Å; N68-D182 PolarHBondContact N-OD1 2.73Å; N68-D182 PolarHBondContact ND2-OD1 2.63Å; V180-D182 PolarHBondContact O-N 2.72Å
183	A	82.5	Confident	81.1	Confident	17 Å²	17	37.8 Å²	37.8	14%	0.14	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	135.9	172.7	0	0	0	0	0	112.7	I63 I64 I179 V180 N181	I63-A183 HydrophobicContact CG2-CB 4.33Å; I64-A183 CarbonylContact O-C 3.54Å; I64-A183 WeakPolarHBondContact O-CA 3.31Å; I179-A183 WeakPolarHBondContact CA-O 3.45Å; V180-A183 PolarHBondContact N-O 2.83Å; V180-A183 WeakPolarHBondContact O-CB 3.38Å; V180-A183 PolarHBondContact O-N 2.99Å; N181-A183 PolarHBondContact O-N 2.91Å
184	L	87.3	Confident	81.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	126.3	172.1	-175.4	69.9	0	0	0	109.6	I64 F67 L99 I139 L175 I179 I186	I64-L184 PolarHBondContact N-O 2.68Å; I64-L184 PolarHBondContact O-N 2.81Å; F67-L184 HydrophobicContact CB-CB 4.4Å; F67-L184 HydrophobicContact CD2-CB 3.52Å; F67-L184 HydrophobicContact CD2-CD2 3.97Å; F67-L184 HydrophobicContact CD2-CG 4.39Å; F67-L184 HydrophobicContact CE2-CB 3.94Å; F67-L184 HydrophobicContact CE2-CD2 3.44Å; F67-L184 VanDerWaalsContact CE2-CD2 3.44Å; F67-L184 HydrophobicContact CE2-CG 4.32Å; F67-L184 HydrophobicContact CG-CB 3.92Å; F67-L184 HydrophobicContact CZ-CD2 3.88Å; L99-L184 HydrophobicContact CD2-CD2 4.35Å; I139-L184 HydrophobicContact CD1-CD1 4.33Å; I139-L184 HydrophobicContact CG2-CD1 3.86Å; L175-L184 HydrophobicContact CD1-CD1 4.21Å; L175-L184 HydrophobicContact CD2-CD2 4.38Å; L175-L184 HydrophobicContact CG-CD1 4.37Å; I179-L184 HydrophobicContact CG1-CD1 4.44Å; L184-I186 HydrophobicContact CD2-CD1 4.24Å; L184-I186 HydrophobicContact CD2-CG1 4.34Å; L184-I186 HydrophobicContact CG-CG1 4.42Å
185	T	86.6	Confident	81	Confident	25 Å²	25	33.8 Å²	33.8	15%	0.153	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	117.2	176.8	-59.6	0	0	0	0	111.2	R61 W62 I63 I139 A140 I187	R61-T185 HydrophobicContact CG-CG2 3.95Å; W62-T185 WeakPolarHBondContact O-CA 3.4Å; I63-T185 HydrophobicContact CG1-CG2 4.13Å; I139-T185 WeakPolarHBondContact CA-O 3.37Å; A140-T185 HydrophobicContact CB-CG2 4.33Å; A140-T185 PolarHBondContact N-O 2.73Å; T185-I187 HydrophobicContact CG2-CG1 4.49Å
186	I	87.9	Confident	80.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	132	176.3	-61	164.2	0	0	0	108.3	W62 I64 I97 I120 I137 I139 L184	W62-I186 HydrophobicContact CE3-CD1 3.69Å; W62-I186 HydrophobicContact CZ3-CD1 3.87Å; W62-I186 PolarHBondContact N-O 3.33Å; W62-I186 PolarHBondContact O-N 2.86Å; I64-I186 HydrophobicContact CD1-CD1 4.22Å; I97-I186 HydrophobicContact CD1-CG2 4.21Å; I120-I186 HydrophobicContact CD1-CD1 3.62Å; I120-I186 HydrophobicContact CD1-CG1 3.81Å; I120-I186 HydrophobicContact CD1-CG2 3.96Å; I120-I186 HydrophobicContact CG1-CD1 4.03Å; I137-I186 HydrophobicContact CG2-CG2 3.98Å; I139-I186 HydrophobicContact CD1-CG1 4.25Å; I139-I186 HydrophobicContact CG1-CG1 4.21Å; L184-I186 HydrophobicContact CD2-CD1 4.24Å; L184-I186 HydrophobicContact CD2-CG1 4.34Å; L184-I186 HydrophobicContact CG-CG1 4.42Å
187	I	86.7	Confident	79.7	Confident	16 Å²	16	36.7 Å²	36.7	8%	0.082	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	127.9	171.7	-59.5	-173.1	0	0	0	108.6	R61 I137 D138 M147 T185	R61-I187 HydrophobicContact CG-CG1 4.22Å; I137-I187 WeakPolarHBondContact CA-O 2.98Å; D138-I187 HydrophobicContact CB-CB 4.46Å; D138-I187 PolarHBondContact N-O 2.9Å; D138-I187 PolarHBondContact O-N 3.42Å; M147-I187 HydrophobicContact CE-CD1 3.51Å; M147-I187 HydrophobicContact SD-CD1 3.83Å; M147-I187 HydrophobicContact SD-CG1 4.47Å; T185-I187 HydrophobicContact CG2-CG1 4.49Å
188	C	88.6	Confident	78.8	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	130.4	172.9	-175.9	0	0	0	0	109.4	K59 H60 F86 I97 R136	K59-C188 WeakPolarHBondContact CA-O 3.09Å; H60-C188 PolarHBondContact N-O 3.42Å; H60-C188 PolarHBondContact O-N 3.31Å; F86-C188 HydrophobicContact CZ-CB 4.28Å; I97-C188 HydrophobicContact CD1-CB 3.61Å; I97-C188 HydrophobicContact CG1-CB 4.29Å; R136-C188 WeakPolarHBondContact O-CA 3.27Å
189	T	88.3	Confident	77.6	Confident	4 Å²	4	40.1 Å²	40.1	3%	0.025	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	127.6	170.5	-50.1	0	0	0	0	108.6	E57 V58 K59 V135 R136 V191	E57-T189 HydrophobicContact CG-CG2 3.81Å; V58-T189 CarbonylContact O-C 3.19Å; V58-T189 WeakPolarHBondContact O-CA 3.44Å; K59-T189 HydrophobicContact CG-CG2 3.82Å; V135-T189 CarbonylContact C-O 3.59Å; V135-T189 WeakPolarHBondContact CA-O 3.47Å; R136-T189 PolarHBondContact N-O 3.19Å; R136-T189 PolarHBondContact NH2-OG1 2.95Å; R136-T189 PolarHBondContact O-N 2.95Å; T189-V191 HydrophobicContact CG2-CG2 4.4Å
190	V	88.4	Confident	76.1	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	110.7	176.2	-172.5	0	0	0	0	108.5	V58 F86 F95 L122 C133 K134 V135 I192	V58-V190 PolarHBondContact N-O 3.46Å; V58-V190 PolarHBondContact O-N 3.03Å; F86-V190 HydrophobicContact CE2-CG2 4.31Å; F95-V190 HydrophobicContact CE1-CG1 4.15Å; F95-V190 HydrophobicContact CE2-CG1 4.23Å; F95-V190 HydrophobicContact CZ-CG1 3.79Å; L122-V190 HydrophobicContact CD2-CG2 3.91Å; C133-V190 HydrophobicContact CB-CG1 3.79Å; K134-V190 WeakPolarHBondContact O-CA 3.5Å; V135-V190 HydrophobicContact CG2-CG1 4.41Å; V135-V190 HydrophobicContact CG2-CG2 4.46Å; V190-I192 HydrophobicContact CG1-CG1 4.08Å
191	V	87.5	Confident	75.1	Confident	14 Å²	14	43.2 Å²	43.2	9%	0.085	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	103.4	173.3	-177.3	0	0	0	0	107.9	E57 C133 K134 T189 Y193	E57-V191 HydrophobicContact CB-CG2 4.35Å; E57-V191 HydrophobicContact CG-CG2 4.05Å; C133-V191 CarbonylContact C-O 3.13Å; C133-V191 WeakPolarHBondContact CA-O 3.16Å; C133-V191 VanDerWaalsContact CB-O 3.29Å; C133-V191 WeakPolarHBondContact CB-O 3.4Å; K134-V191 HydrophobicContact CB-CB 4.34Å; K134-V191 PolarHBondContact N-O 2.89Å; K134-V191 PolarHBondContact O-N 3.01Å; T189-V191 HydrophobicContact CG2-CG2 4.4Å; V191-Y193 HydrophobicContact CG1-CE1 4.01Å
192	I	86.1	Confident	73.8	Confident	4 Å²	4	43.3 Å²	43.3	2%	0.021	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	135.9	177.7	-54.6	170.7	0	0	0	108.1	S55 T56 V58 H93 F95 L131 C133 V190	S55-I192 CarbonylContact C-O 3.55Å; S55-I192 WeakPolarHBondContact CA-O 3.43Å; S55-I192 VanDerWaalsContact CB-O 3.23Å; S55-I192 WeakPolarHBondContact CB-O 3.44Å; T56-I192 PolarHBondContact N-O 3.03Å; T56-I192 PolarHBondContact O-N 3.31Å; V58-I192 HydrophobicContact CG2-CD1 4.22Å; H93-I192 HydrophobicContact CB-CD1 3.76Å; F95-I192 HydrophobicContact CE2-CD1 4.1Å; F95-I192 HydrophobicContact CZ-CD1 4.07Å; F95-I192 HydrophobicContact CZ-CG1 4.42Å; L131-I192 HydrophobicContact CD1-CG1 4.36Å; L131-I192 HydrophobicContact CD1-CG2 4.19Å; C133-I192 HydrophobicContact CB-CG1 4.33Å; V190-I192 HydrophobicContact CG1-CG1 4.08Å
193	Y	82.6	Confident	71.7	Confident	74 Å²	74	48.7 Å²	48.7	29%	0.29	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	118.7	174.4	-58.1	-74.9	0	0	0	108.8	V53 F132 K134 V191	V53-Y193 HydrophobicContact CG2-CD1 3.81Å; V53-Y193 HydrophobicContact CG2-CG 4.48Å; F132-Y193 PolarHBondContact O-N 2.81Å; K134-Y193 HydrophobicContact CB-CE2 3.98Å; V191-Y193 HydrophobicContact CG1-CE1 4.01Å
194	D	74	Confident	69.6	Low	48 Å²	48	52.9 Å²	52.9	26%	0.257	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-67.3	-177.4	-73	-70.1	0	0	0	110.8	K54 T56 R92	K54-D194 HydrophobicContact CB-CB 4.37Å; K54-D194 HydrophobicContact CD-CB 4.4Å; K54-D194 HydrophobicContact CG-CB 4.36Å; K54-D194 PolarHBondContact O-N 3.21Å; T56-D194 PolarHBondContact OG1-OD2 2.8Å; R92-D194 IonicContact CZ-OD1 3.51Å; R92-D194 IonicContact NH2-OD1 2.69Å; R92-D194 PolarHBondContact NH2-OD1 3.24Å
195	E	69.3	Low	67.2	Low	138 Å²	138	58.6 Å²	58.6	65%	0.645	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.9	150	-170.9	-68	-178.4	169.7	0	0	111.4	V53 K54	V53-E195 WeakPolarHBondContact CA-O 3.35Å; K54-E195 PolarHBondContact N-O 3.32Å
196	I	65.9	Low	64.9	Low	131 Å²	131	61.5 Å²	61.5	67%	0.672	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	110.8	166.2	-57.5	174.6	0	0	0	107.2	T52 V53	T52-I196 WeakPolarHBondContact O-CA 3.32Å; V53-I196 HydrophobicContact CB-CG1 4.45Å; V53-I196 HydrophobicContact CG2-CG1 4.2Å
197	S	60.5	Low	62.4	Low	60 Å²	60	67.2 Å²	67.2	42%	0.42	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	131.3	172.4	52.4	0	0	0	0	109.6	S51 T52	S51-S197 CarbonylContact C-O 3.52Å; S51-S197 VanDerWaalsContact CA-O 3.29Å; S51-S197 WeakPolarHBondContact CA-O 3.34Å; T52-S197 PolarHBondContact N-O 3.34Å; T52-S197 PolarHBondContact O-N 2.98Å; T52-S197 PolarHBondContact O-OG 3.38Å; T52-S197 PolarHBondContact OG1-OG 2.89Å
198	T	55.8	Low	60.1	Low	85 Å²	85	73.5 Å²	73.5	52%	0.521	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	112	170	-58.4	0	0	0	0	108.1	S51	S51-T198 WeakPolarHBondContact CB-OG1 3.28Å; S51-T198 WeakPolarHBondContact OG-CG2 3.36Å; S51-T198 PolarHBondContact OG-OG1 3.48Å
199	A	51	Low	58.1	Low	55 Å²	55	78.3 Å²	78.3	46%	0.455	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	141.8	174.6	0	0	0	0	0	109.5	S49 R50	S49-A199 CarbonylContact C-O 3.56Å; S49-A199 WeakPolarHBondContact CA-O 3.19Å; R50-A199 PolarHBondContact N-O 3.23Å; R50-A199 PolarHBondContact O-N 2.74Å
200	C	46	Very low	56.5	Low	27 Å²	27	82.5 Å²	82.5	18%	0.182	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	144.8	156.2	-78.8	0	0	0	0	108.7	C45 S202 E203	C45-C200 HydrophobicContact CB-CB 4.27Å; C45-C200 WeakPolarHBondContact CB-SG 3.36Å; C45-C200 WeakPolarHBondContact SG-CB 3.48Å; C45-C200 CovalentContact SG-SG 2.03Å; C45-C200 PolarHBondContact SG-SG 3.35Å; C200-S202 PolarHBondContact O-N 2.91Å; C200-E203 PolarHBondContact O-N 3Å
201	D	49	Very low	55	Low	94 Å²	94	85.5 Å²	85.5	50%	0.503	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	11.1	-173.5	-66.2	-29.9	0	0	0	113.7	R50	R50-D201 IonicContact NH1-OD1 2.99Å; R50-D201 PolarHBondContact NH1-OD1 3.23Å; R50-D201 VanDerWaalsContact NH1-OD1 3.11Å; R50-D201 IonicContact NH1-OD2 3.04Å
202	S	44	Very low	53.9	Low	77 Å²	77	89.7 Å²	89.7	54%	0.538	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-2.7	-176.8	51.8	0	0	0	0	115.8	C200	C200-S202 PolarHBondContact O-N 2.91Å
203	E	36.7	Very low	53.1	Low	154 Å²	154	91 Å²	91	72%	0.72	52%	0.518	S	S	*	.	S	Bend	trans	-103	136	175.6	-70.5	-170.8	172.1	0	0	112.8	C200	C200-E203 PolarHBondContact O-N 3Å
204	S	40	Very low	52.8	Low	104 Å²	104	87.5 Å²	87.5	73%	0.727	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-59.6	149.1	176.2	52.3	0	0	0	0	111.9	A206	S204-A206 PolarHBondContact O-N 3.49Å; S204-A206 VanDerWaalsContact O-N 3.11Å
205	P	36.5	Very low	53.1	Low	121 Å²	121	85.4 Å²	85.4	79%	0.786	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-56.8	119.9	-172.9	-21.9	32.3	0	0	0	111.9	D207	P205-D207 PolarHBondContact O-N 3.48Å
206	A	37.5	Very low	53.6	Low	85 Å²	85	80.5 Å²	80.5	70%	0.702	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-67.9	128	170.2	0	0	0	0	0	109.4	S204 N208	S204-A206 PolarHBondContact O-N 3.49Å; S204-A206 VanDerWaalsContact O-N 3.11Å; A206-N208 VanDerWaalsContact C-N 3.27Å; A206-N208 PolarHBondContact O-N 2.99Å
207	D	36.3	Very low	54.3	Low	121 Å²	121	74.9 Å²	74.9	65%	0.647	45%	0.447	S	S	*	.			trans	-65.5	74.9	-173.7	-62.4	-40.2	0	0	0	113.7	P205 E209	P205-D207 PolarHBondContact O-N 3.48Å; D207-E209 HydrophobicContact CB-CG 4.18Å; D207-E209 PolarHBondContact O-N 2.82Å
208	N	37.6	Very low	55.5	Low	147 Å²	147	72 Å²	72	79%	0.786	43%	0.427	S	S	*	.			trans	-78.3	56.7	157.4	-75.7	-34.8	0	0	0	109.3	A206 N210	A206-N208 VanDerWaalsContact C-N 3.27Å; A206-N208 PolarHBondContact O-N 2.99Å; N208-N210 VanDerWaalsContact C-N 3.29Å; N208-N210 PolarHBondContact O-N 3.22Å
209	E	46.5	Very low	57	Low	101 Å²	101	71.3 Å²	71.3	47%	0.472	42%	0.418	S	S	.	.			trans	-71.7	84	179.8	-74.3	-164.4	136.4	0	0	111.1	D207 A213	D207-E209 HydrophobicContact CB-CG 4.18Å; D207-E209 PolarHBondContact O-N 2.82Å; E209-A213 HydrophobicContact CB-CB 4.32Å; E209-A213 HydrophobicContact CG-CB 4.31Å
210	N	56.1	Low	58.6	Low	92 Å²	92	75.6 Å²	75.6	49%	0.492	43%	0.426	S	S	.	.			trans	-66.9	166	167.2	-160.7	21.4	0	0	0	110.8	N208 E212 A213	N208-N210 VanDerWaalsContact C-N 3.29Å; N208-N210 PolarHBondContact O-N 3.22Å; N210-E212 HydrophobicContact CB-CB 4.41Å; N210-E212 HydrophobicContact CB-CG 4.48Å; N210-E212 PolarHBondContact ND2-OE2 2.84Å; N210-E212 PolarHBondContact O-N 2.79Å; N210-A213 WeakPolarHBondContact O-CB 3.45Å; N210-A213 PolarHBondContact O-N 3.49Å
211	D	55.4	Low	60.5	Low	63 Å²	63	74.9 Å²	74.9	34%	0.337	42%	0.42	S	S	.	.	H	α-helix	trans	-56.8	-21.2	177.6	-68.8	-32.7	0	0	0	112.6	A213 F214 V215 D600	D211-A213 VanDerWaalsContact C-N 3.25Å; D211-A213 PolarHBondContact O-N 3.05Å; D211-F214 WeakPolarHBondContact O-CB 3.24Å; D211-F214 PolarHBondContact O-N 2.61Å; D211-F214 VanDerWaalsContact O-N 3.1Å; D211-V215 PolarHBondContact O-N 2.71Å; D211-V215 VanDerWaalsContact O-N 3.13Å; D211-D600 HydrophobicContact CB-CB 3.71Å
212	E	64.7	Low	62.4	Low	103 Å²	103	71.8 Å²	71.8	48%	0.481	40%	0.403	S	S	.	.	H	α-helix	trans	-54.6	-31.1	169.8	-61.8	178.6	122.9	0	0	114.5	N210 F214 S216	N210-E212 HydrophobicContact CB-CB 4.41Å; N210-E212 HydrophobicContact CB-CG 4.48Å; N210-E212 PolarHBondContact ND2-OE2 2.84Å; N210-E212 PolarHBondContact O-N 2.79Å; E212-F214 VanDerWaalsContact C-N 3.35Å; E212-S216 WeakPolarHBondContact O-CB 3.23Å; E212-S216 PolarHBondContact O-N 2.83Å; E212-S216 PolarHBondContact O-OG 3.33Å
213	A	70.4	Confident	64.4	Low	30 Å²	30	75.1 Å²	75.1	25%	0.248	41%	0.408	C	S	.	.	H	α-helix	trans	-68.1	-35.4	176.7	0	0	0	0	0	111.9	E209 N210 D211 S216 S217	E209-A213 HydrophobicContact CB-CB 4.32Å; E209-A213 HydrophobicContact CG-CB 4.31Å; N210-A213 WeakPolarHBondContact O-CB 3.45Å; N210-A213 PolarHBondContact O-N 3.49Å; D211-A213 VanDerWaalsContact C-N 3.25Å; D211-A213 PolarHBondContact O-N 3.05Å; A213-S216 PolarHBondContact O-OG 2.91Å; A213-S217 PolarHBondContact O-N 2.84Å
214	F	75.2	Confident	66.8	Low	2 Å²	2	70.6 Å²	70.6	1%	0.009	40%	0.397	C	S	.	.	H	α-helix	trans	-70.6	-50.4	173.5	179.5	-103.2	0	0	0	110.8	D211 E212 S216 S217 F218 F603 V604 F607 R638 Y673 D675	D211-F214 WeakPolarHBondContact O-CB 3.24Å; D211-F214 PolarHBondContact O-N 2.61Å; D211-F214 VanDerWaalsContact O-N 3.1Å; E212-F214 VanDerWaalsContact C-N 3.35Å; F214-S216 PolarHBondContact O-N 3.43Å; F214-S217 PolarHBondContact O-N 3.31Å; F214-S217 VanDerWaalsContact O-N 3.17Å; F214-S217 PolarHBondContact O-OG 3.02Å; F214-F218 HydrophobicContact CD1-CE2 4.42Å; F214-F218 HydrophobicContact CD2-CE2 4.46Å; F214-F218 HydrophobicContact CE1-CD2 4.34Å; F214-F218 AromaticContact CE1-CE2 3.85Å; F214-F218 HydrophobicContact CE1-CE2 3.85Å; F214-F218 AromaticContact CE2-CE2 3.92Å; F214-F218 HydrophobicContact CE2-CE2 3.92Å; F214-F218 HydrophobicContact CZ-CD2 4.48Å; F214-F218 AromaticContact CZ-CE2 3.59Å; F214-F218 HydrophobicContact CZ-CE2 3.59Å; F214-F218 HydrophobicContact CZ-CZ 4.4Å; F214-F603 HydrophobicContact CD1-CD1 4.22Å; F214-F603 AromaticContact CD1-CE1 3.98Å; F214-F603 HydrophobicContact CD1-CE1 3.98Å; F214-F603 HydrophobicContact CE1-CD1 4.01Å; F214-F603 AromaticContact CE1-CE1 3.73Å; F214-F603 HydrophobicContact CE1-CE1 3.73Å; F214-V604 HydrophobicContact CD1-CG2 3.87Å; F214-V604 HydrophobicContact CE1-CG2 3.72Å; F214-F607 HydrophobicContact CE1-CD2 4.42Å; F214-F607 HydrophobicContact CZ-CD2 4.41Å; F214-R638 HydrophobicContact CE2-CG 4.3Å; F214-Y673 WeakPolarHBondContact CZ-O 3.31Å; F214-D675 HydrophobicContact CB-CB 4.22Å; F214-D675 HydrophobicContact CD2-CB 3.56Å; F214-D675 HydrophobicContact CE2-CB 4.11Å; F214-D675 HydrophobicContact CG-CB 4.07Å
215	V	80.9	Confident	68.9	Low	4 Å²	4	71 Å²	71	2%	0.024	39%	0.385	C	S	.	.	H	α-helix	trans	-59.5	-47.2	-179.8	175.5	0	0	0	0	111.8	D211 S217 F218 E219 T285 F603	D211-V215 PolarHBondContact O-N 2.71Å; D211-V215 VanDerWaalsContact O-N 3.13Å; V215-S217 PolarHBondContact O-N 2.73Å; V215-F218 PolarHBondContact O-N 2.96Å; V215-F218 VanDerWaalsContact O-N 3.08Å; V215-E219 PolarHBondContact O-N 2.89Å; V215-T285 HydrophobicContact CG1-CG2 4.19Å; V215-T285 WeakPolarHBondContact CG1-O 3.47Å; V215-F603 HydrophobicContact CG2-CD1 3.98Å; V215-F603 HydrophobicContact CG2-CE1 4.06Å
216	S	79.8	Confident	70.9	Confident	34 Å²	34	68 Å²	68	24%	0.238	37%	0.365	C	S	.	.	H	α-helix	trans	-65.4	-20.5	179.7	62.3	0	0	0	0	113.8	E212 A213 F214 E219 K220	E212-S216 WeakPolarHBondContact O-CB 3.23Å; E212-S216 PolarHBondContact O-N 2.83Å; E212-S216 PolarHBondContact O-OG 3.33Å; A213-S216 PolarHBondContact O-OG 2.91Å; F214-S216 PolarHBondContact O-N 3.43Å; S216-E219 PolarHBondContact O-N 2.69Å; S216-K220 VanDerWaalsContact O-CG 3.28Å; S216-K220 WeakPolarHBondContact O-CG 3.47Å; S216-K220 PolarHBondContact O-N 3Å
217	S	81.1	Confident	72.9	Confident	14 Å²	14	65.3 Å²	65.3	10%	0.098	34%	0.343	C	S	.	.	H	α-helix	trans	-70.8	-34.7	172.5	73.2	0	0	0	0	112.6	A213 F214 V215 F221 R638	A213-S217 PolarHBondContact O-N 2.84Å; F214-S217 PolarHBondContact O-N 3.31Å; F214-S217 VanDerWaalsContact O-N 3.17Å; F214-S217 PolarHBondContact O-OG 3.02Å; V215-S217 PolarHBondContact O-N 2.73Å; S217-F221 VanDerWaalsContact O-CB 3.3Å; S217-F221 WeakPolarHBondContact O-CB 3.02Å; S217-F221 PolarHBondContact O-N 2.96Å; S217-R638 WeakPolarHBondContact OG-CD 3.48Å; S217-R638 PolarHBondContact OG-NH1 3.41Å
218	F	85.4	Confident	75.4	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-69.8	-36.1	171.4	-77.2	-72.9	0	0	0	112.3	F214 V215 F221 L222 I245 Y284 F603 F607 K634 A637 R638	F214-F218 HydrophobicContact CD1-CE2 4.42Å; F214-F218 HydrophobicContact CD2-CE2 4.46Å; F214-F218 HydrophobicContact CE1-CD2 4.34Å; F214-F218 AromaticContact CE1-CE2 3.85Å; F214-F218 HydrophobicContact CE1-CE2 3.85Å; F214-F218 AromaticContact CE2-CE2 3.92Å; F214-F218 HydrophobicContact CE2-CE2 3.92Å; F214-F218 HydrophobicContact CZ-CD2 4.48Å; F214-F218 AromaticContact CZ-CE2 3.59Å; F214-F218 HydrophobicContact CZ-CE2 3.59Å; F214-F218 HydrophobicContact CZ-CZ 4.4Å; V215-F218 PolarHBondContact O-N 2.96Å; V215-F218 VanDerWaalsContact O-N 3.08Å; F218-F221 PolarHBondContact O-N 2.92Å; F218-L222 WeakPolarHBondContact O-CB 3.41Å; F218-L222 PolarHBondContact O-N 3.38Å; F218-I245 HydrophobicContact CD1-CD1 4Å; F218-I245 HydrophobicContact CE1-CD1 4.07Å; F218-Y284 HydrophobicContact CB-CD1 4.33Å; F218-Y284 VanDerWaalsContact CB-O 3.29Å; F218-Y284 WeakPolarHBondContact CB-O 3.42Å; F218-F603 HydrophobicContact CD2-CE1 4.18Å; F218-F603 HydrophobicContact CD2-CZ 4.21Å; F218-F607 HydrophobicContact CE2-CE2 4.35Å; F218-K634 HydrophobicContact CE1-CD 3.69Å; F218-K634 HydrophobicContact CZ-CD 3.71Å; F218-A637 HydrophobicContact CD1-CB 3.96Å; F218-A637 HydrophobicContact CE1-CB 3.54Å; F218-A637 HydrophobicContact CZ-CB 4.04Å; F218-R638 HydrophobicContact CE2-CG 4.39Å; F218-R638 HydrophobicContact CZ-CG 4.22Å
219	E	86.9	Confident	77.7	Confident	70 Å²	70	55.3 Å²	55.3	33%	0.327	29%	0.29	S	S	.	.	H	α-helix	trans	-62.2	-47.2	173.7	-162.8	-164.3	153.7	0	0	111.9	V215 S216 F221 L222 K223 T285	V215-E219 PolarHBondContact O-N 2.89Å; S216-E219 PolarHBondContact O-N 2.69Å; E219-F221 VanDerWaalsContact C-N 3.31Å; E219-F221 PolarHBondContact O-N 3.3Å; E219-L222 PolarHBondContact O-N 2.87Å; E219-K223 HydrophobicContact CG-CD 4.38Å; E219-K223 WeakPolarHBondContact O-CB 3.4Å; E219-K223 WeakPolarHBondContact O-CG 3.33Å; E219-K223 PolarHBondContact O-N 2.78Å; E219-K223 WeakPolarHBondContact OE1-CE 3.37Å; E219-K223 IonicContact OE1-NZ 3.68Å; E219-K223 PolarHBondContact OE1-NZ 3.08Å; E219-T285 HydrophobicContact CB-CG2 3.74Å; E219-T285 HydrophobicContact CG-CG2 4.07Å
220	K	85.2	Confident	79.8	Confident	145 Å²	145	50.5 Å²	50.5	63%	0.63	27%	0.268	S	S	*	.	H	α-helix	trans	-59.6	-42.5	174	-72.3	167	-175.4	170.7	0	111.3	S216 K223 A224	S216-K220 VanDerWaalsContact O-CG 3.28Å; S216-K220 WeakPolarHBondContact O-CG 3.47Å; S216-K220 PolarHBondContact O-N 3Å; K220-K223 PolarHBondContact O-N 3.27Å; K220-A224 VanDerWaalsContact O-CB 3.3Å; K220-A224 WeakPolarHBondContact O-CB 3.42Å; K220-A224 PolarHBondContact O-N 3.06Å
221	F	86.1	Confident	81.5	Confident	11 Å²	11	47.7 Å²	47.7	5%	0.048	25%	0.253	C	S	.	.	H	α-helix	trans	-65.8	-41.3	179.8	-178	-122.5	0	0	0	112.9	S217 F218 E219 A224 K225 T226 H242 I245 S633 F636 A637	S217-F221 VanDerWaalsContact O-CB 3.3Å; S217-F221 WeakPolarHBondContact O-CB 3.02Å; S217-F221 PolarHBondContact O-N 2.96Å; F218-F221 PolarHBondContact O-N 2.92Å; E219-F221 VanDerWaalsContact C-N 3.31Å; E219-F221 PolarHBondContact O-N 3.3Å; F221-A224 PolarHBondContact O-N 3.08Å; F221-K225 PolarHBondContact O-N 3.09Å; F221-T226 HydrophobicContact CE2-CG2 4.49Å; F221-T226 WeakPolarHBondContact CE2-O 3.48Å; F221-T226 VanDerWaalsContact CZ-O 3.31Å; F221-T226 WeakPolarHBondContact CZ-O 3.35Å; F221-H242 AromaticContact CD1-CE1 3.85Å; F221-H242 AromaticContact CE1-CD2 3.84Å; F221-H242 AromaticContact CE1-CE1 3.22Å; F221-H242 WeakPolarHBondContact CE1-CE1 3.27Å; F221-H242 AromaticContact CE1-CG 3.79Å; F221-H242 AromaticContact CE1-ND1 3.42Å; F221-H242 WeakPolarHBondContact CE1-ND1 3.03Å; F221-H242 AromaticContact CE1-NE2 3.51Å; F221-H242 AromaticContact CZ-CD2 3.76Å; F221-H242 AromaticContact CZ-CE1 3.36Å; F221-H242 WeakPolarHBondContact CZ-CE1 3.38Å; F221-H242 AromaticContact CZ-ND1 3.98Å; F221-H242 AromaticContact CZ-NE2 3.21Å; F221-H242 WeakPolarHBondContact CZ-NE2 3.49Å; F221-I245 HydrophobicContact CD1-CD1 3.98Å; F221-I245 HydrophobicContact CE1-CD1 3.83Å; F221-S633 WeakPolarHBondContact CE1-O 3.49Å; F221-F636 HydrophobicContact CD2-CB 4.17Å; F221-F636 HydrophobicContact CE2-CB 3.36Å; F221-F636 HydrophobicContact CE2-CG 4.24Å; F221-F636 HydrophobicContact CZ-CB 3.68Å; F221-A637 HydrophobicContact CB-CB 4.05Å; F221-A637 HydrophobicContact CD1-CB 3.74Å; F221-A637 HydrophobicContact CD2-CB 4.45Å; F221-A637 HydrophobicContact CE1-CB 4.31Å; F221-A637 HydrophobicContact CG-CB 3.81Å
222	L	87.5	Confident	83.3	Confident	29 Å²	29	44.7 Å²	44.7	15%	0.152	24%	0.237	C	C	.	.	H	α-helix	trans	-59.5	-51.6	171.4	177.7	60.3	0	0	0	111.1	F218 E219 A224 K225 I280 Y284	F218-L222 WeakPolarHBondContact O-CB 3.41Å; F218-L222 PolarHBondContact O-N 3.38Å; E219-L222 PolarHBondContact O-N 2.87Å; L222-A224 VanDerWaalsContact C-N 3.28Å; L222-A224 PolarHBondContact O-N 3.33Å; L222-K225 PolarHBondContact O-N 2Å; L222-I280 HydrophobicContact CD1-CG2 3.7Å; L222-I280 HydrophobicContact CD2-CG2 3.98Å; L222-Y284 HydrophobicContact CB-CD1 3.69Å; L222-Y284 HydrophobicContact CB-CE1 3.88Å; L222-Y284 HydrophobicContact CB-CG 4.21Å; L222-Y284 HydrophobicContact CD1-CD1 4.41Å; L222-Y284 HydrophobicContact CD1-CD2 4.45Å; L222-Y284 HydrophobicContact CD1-CE1 4.06Å; L222-Y284 HydrophobicContact CD1-CE2 4.12Å; L222-Y284 HydrophobicContact CD2-CD1 4.37Å; L222-Y284 HydrophobicContact CD2-CD2 4.26Å; L222-Y284 HydrophobicContact CD2-CG 4.05Å; L222-Y284 HydrophobicContact CG-CD1 4.37Å; L222-Y284 HydrophobicContact CG-CE1 4.46Å
223	K	87.5	Confident	84.6	Confident	147 Å²	147	42.2 Å²	42.2	64%	0.639	23%	0.226	S	C	*	.	H	α-helix	trans	-60.9	-34.5	-179.7	-74.8	173.6	172	175.8	0	112.9	E219 K220 K225	E219-K223 HydrophobicContact CG-CD 4.38Å; E219-K223 WeakPolarHBondContact O-CB 3.4Å; E219-K223 WeakPolarHBondContact O-CG 3.33Å; E219-K223 PolarHBondContact O-N 2.78Å; E219-K223 WeakPolarHBondContact OE1-CE 3.37Å; E219-K223 IonicContact OE1-NZ 3.68Å; E219-K223 PolarHBondContact OE1-NZ 3.08Å; K220-K223 PolarHBondContact O-N 3.27Å; K223-K225 VanDerWaalsContact C-N 3.27Å; K223-K225 PolarHBondContact O-N 3.48Å
224	A	85.7	Confident	85.7	Confident	59 Å²	59	41 Å²	41	49%	0.488	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-10.2	177.5	0	0	0	0	0	114.3	K220 F221 L222 T226	K220-A224 VanDerWaalsContact O-CB 3.3Å; K220-A224 WeakPolarHBondContact O-CB 3.42Å; K220-A224 PolarHBondContact O-N 3.06Å; F221-A224 PolarHBondContact O-N 3.08Å; L222-A224 VanDerWaalsContact C-N 3.28Å; L222-A224 PolarHBondContact O-N 3.33Å; A224-T226 PolarHBondContact O-N 2.79Å; A224-T226 PolarHBondContact O-OG1 2.85Å; A224-T226 VanDerWaalsContact O-OG1 3.06Å
225	K	84.8	Confident	86.5	Confident	112 Å²	112	44.4 Å²	44.4	49%	0.487	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	23.7	-179	-62	-173.3	174.2	-170.9	0	114.7	F221 L222 K223 T228	F221-K225 PolarHBondContact O-N 3.09Å; L222-K225 PolarHBondContact O-N 2Å; K223-K225 VanDerWaalsContact C-N 3.27Å; K223-K225 PolarHBondContact O-N 3.48Å; K225-T228 HydrophobicContact CB-CG2 4.47Å; K225-T228 PolarHBondContact O-OG1 2.91Å
226	T	79.4	Confident	87	Confident	59 Å²	59	49.3 Å²	49.3	36%	0.362	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	125.4	-169.4	-64.5	0	0	0	0	110.5	F221 A224 T228 H242 F636	F221-T226 HydrophobicContact CE2-CG2 4.49Å; F221-T226 WeakPolarHBondContact CE2-O 3.48Å; F221-T226 VanDerWaalsContact CZ-O 3.31Å; F221-T226 WeakPolarHBondContact CZ-O 3.35Å; A224-T226 PolarHBondContact O-N 2.79Å; A224-T226 PolarHBondContact O-OG1 2.85Å; A224-T226 VanDerWaalsContact O-OG1 3.06Å; T226-T228 VanDerWaalsContact C-N 3.29Å; T226-T228 PolarHBondContact O-N 3Å; T226-H242 PolarHBondContact O-NE2 3.06Å; T226-F636 HydrophobicContact CG2-CD1 3.84Å; T226-F636 HydrophobicContact CG2-CE1 4Å
227	A	79	Confident	87.5	Confident	28 Å²	28	49.2 Å²	49.2	23%	0.231	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	25.1	178.8	0	0	0	0	0	116.1	D229 R632 F636	A227-D229 PolarHBondContact O-N 3.38Å; A227-R632 PolarHBondContact O-NH2 3.48Å; A227-F636 HydrophobicContact CB-CD1 4.44Å; A227-F636 HydrophobicContact CB-CD2 3.62Å; A227-F636 HydrophobicContact CB-CE1 4.23Å; A227-F636 HydrophobicContact CB-CE2 3.38Å; A227-F636 HydrophobicContact CB-CG 4.17Å; A227-F636 HydrophobicContact CB-CZ 3.73Å
228	T	87.7	Confident	88	Confident	24 Å²	24	52.9 Å²	52.9	15%	0.147	29%	0.287	C	S	.	.			trans	-59.1	127.5	172.3	52.9	0	0	0	0	112.3	K225 T226 A241 H242 R263	K225-T228 HydrophobicContact CB-CG2 4.47Å; K225-T228 PolarHBondContact O-OG1 2.91Å; T226-T228 VanDerWaalsContact C-N 3.29Å; T226-T228 PolarHBondContact O-N 3Å; T228-A241 WeakPolarHBondContact CA-O 3.41Å; T228-A241 WeakPolarHBondContact CB-O 3.14Å; T228-H242 PolarHBondContact N-NE2 2.97Å; T228-R263 PolarHBondContact O-NH1 3.49Å; T228-R263 VanDerWaalsContact O-NH1 3.16Å
229	D	87.1	Confident	88.1	Confident	35 Å²	35	53.4 Å²	53.4	19%	0.187	29%	0.29	C	S	.	.			trans	-110.2	-0.8	-175.4	63.6	-10.1	0	0	0	113.2	A227 A241 H242 R243 Y264	A227-D229 PolarHBondContact O-N 3.38Å; D229-A241 PolarHBondContact N-O 3.04Å; D229-H242 VanDerWaalsContact OD1-CA 3.23Å; D229-H242 WeakPolarHBondContact OD1-CA 3.48Å; D229-R243 PolarHBondContact OD1-N 2.89Å; D229-Y264 PolarHBondContact O-N 2.84Å
230	M	89.9	Confident	88.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	144.1	-173.6	-170.8	172.2	74.6	0	0	112.3	V232 T240 A241 R243 L246 I257 R263 Y264	M230-V232 HydrophobicContact CE-CG2 4.14Å; M230-T240 WeakPolarHBondContact O-CA 3.31Å; M230-A241 HydrophobicContact CE-CB 4.12Å; M230-A241 PolarHBondContact N-O 2.82Å; M230-A241 PolarHBondContact O-N 2.86Å; M230-R243 HydrophobicContact CB-CB 4.19Å; M230-R243 HydrophobicContact SD-CB 3.86Å; M230-R243 HydrophobicContact SD-CG 4.28Å; M230-L246 HydrophobicContact CE-CB 4.1Å; M230-L246 HydrophobicContact CE-CD1 3.89Å; M230-L246 HydrophobicContact CE-CD2 3.35Å; M230-L246 HydrophobicContact CE-CG 3.94Å; M230-I257 HydrophobicContact CE-CD1 4.47Å; M230-I257 HydrophobicContact SD-CD1 3.59Å; M230-I257 VanDerWaalsContact SD-CD1 3.59Å; M230-I257 HydrophobicContact SD-CG1 3.86Å; M230-I257 HydrophobicContact SD-CG2 4.26Å; M230-R263 PolarHBondContact O-NH2 3.48Å; M230-Y264 CarbonylContact C-O 3.6Å; M230-Y264 VanDerWaalsContact CA-O 3.25Å; M230-Y264 WeakPolarHBondContact CA-O 3.42Å; M230-Y264 WeakPolarHBondContact CG-O 3.27Å
231	D	92.5	Very high	88.6	Confident	32 Å²	32	44.7 Å²	44.7	17%	0.171	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	137.9	170.2	-62.1	-32.7	0	0	0	109.7	V238 R263 Y264 V265 L266	D231-V238 HydrophobicContact CB-CG1 3.86Å; D231-R263 IonicContact OD1-CZ 2.66Å; D231-R263 IonicContact OD1-NE 2.91Å; D231-R263 PolarHBondContact OD1-NE 3.08Å; D231-R263 IonicContact OD1-NH2 3.37Å; D231-R263 PolarHBondContact OD1-NH2 3.11Å; D231-R263 WeakPolarHBondContact OD2-CD 3.37Å; D231-R263 IonicContact OD2-CZ 2.84Å; D231-R263 IonicContact OD2-NE 3.13Å; D231-R263 PolarHBondContact OD2-NE 2.92Å; D231-R263 IonicContact OD2-NH2 3.13Å; D231-Y264 PolarHBondContact N-O 3.45Å; D231-V265 CarbonylContact O-C 3.28Å; D231-V265 WeakPolarHBondContact O-CA 3.49Å; D231-L266 PolarHBondContact O-N 3.32Å
232	V	91.7	Very high	88.7	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	113.2	173	-177.3	0	0	0	0	106.7	M230 V238 T239 A241 L246 L266 A268 M276 I280	M230-V232 HydrophobicContact CE-CG2 4.14Å; V232-V238 WeakPolarHBondContact O-CA 3.27Å; V232-T239 HydrophobicContact CB-CG2 3.9Å; V232-T239 HydrophobicContact CG1-CG2 4.46Å; V232-T239 PolarHBondContact N-O 2.82Å; V232-T239 PolarHBondContact O-N 3.29Å; V232-A241 HydrophobicContact CG2-CB 4.29Å; V232-L246 HydrophobicContact CG2-CD2 4.49Å; V232-L266 WeakPolarHBondContact CA-O 3.37Å; V232-L266 HydrophobicContact CG1-CD2 4.19Å; V232-L266 HydrophobicContact CG1-CG 4.41Å; V232-L266 HydrophobicContact CG2-CB 4.3Å; V232-L266 HydrophobicContact CG2-CD2 4.29Å; V232-A268 HydrophobicContact CG1-CB 4.36Å; V232-M276 HydrophobicContact CG1-CE 3.71Å; V232-I280 HydrophobicContact CB-CD1 4.3Å; V232-I280 HydrophobicContact CG1-CD1 4.35Å; V232-I280 HydrophobicContact CG2-CD1 4.07Å
233	I	92.8	Very high	88.7	Confident	52 Å²	52	45.5 Å²	45.5	27%	0.267	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	105.5	-177.4	-56	-179.8	0	0	0	107.7	V238 V265 L266 A268 T269	I233-V238 HydrophobicContact CG1-CG1 4.45Å; I233-V238 HydrophobicContact CG1-CG2 4.23Å; I233-V238 HydrophobicContact CG2-CG2 4.47Å; I233-V265 HydrophobicContact CD1-CG1 3.5Å; I233-V265 HydrophobicContact CG1-CG1 3.99Å; I233-L266 PolarHBondContact N-O 2.91Å; I233-A268 CarbonylContact O-C 3.5Å; I233-A268 VanDerWaalsContact O-CA 3.31Å; I233-A268 WeakPolarHBondContact O-CA 3.42Å; I233-A268 PolarHBondContact O-N 2.89Å; I233-T269 HydrophobicContact CG2-CG2 3.88Å; I233-T269 PolarHBondContact O-N 3.17Å
234	A	92.6	Very high	88.6	Confident	4 Å²	4	38.6 Å²	38.6	3%	0.033	23%	0.225	C	C	.	.			trans	-84.1	178.4	169.8	0	0	0	0	0	110.2	D236 C237 F271 M276	A234-D236 VanDerWaalsContact C-N 3.27Å; A234-D236 PolarHBondContact O-N 3.26Å; A234-C237 PolarHBondContact N-O 3.44Å; A234-F271 WeakPolarHBondContact CB-O 3.25Å; A234-M276 HydrophobicContact CB-CG 4.42Å
235	S	92	Very high	88.7	Confident	74 Å²	74	35.8 Å²	35.8	52%	0.517	20%	0.202	S	C	.	.	S	Bend	trans	-63.2	-30.8	179.1	65.5	0	0	0	0	113.8	T269 F271	S235-T269 VanDerWaalsContact CB-O 3.25Å; S235-T269 WeakPolarHBondContact CB-O 3.47Å; S235-F271 PolarHBondContact N-O 3.45Å; S235-F271 PolarHBondContact OG-O 2.86Å
236	D	91.7	Very high	89	Confident	106 Å²	106	30.4 Å²	30.4	57%	0.567	18%	0.178	S	C	*	.	S	Bend	trans	-127.8	-7.5	-169.7	64.7	-32.4	0	0	0	114	A234 C273	A234-D236 VanDerWaalsContact C-N 3.27Å; A234-D236 PolarHBondContact O-N 3.26Å; D236-C273 VanDerWaalsContact OD1-CB 3.29Å; D236-C273 WeakPolarHBondContact OD1-CB 3.31Å; D236-C273 PolarHBondContact OD1-N 2.83Å
237	C	90.7	Very high	89.3	Confident	32 Å²	32	27.9 Å²	27.9	22%	0.216	16%	0.162	C	C	.	.			trans	-149.1	167.3	-179.3	93.1	0	0	0	0	113.5	A234 C273	A234-C237 PolarHBondContact N-O 3.44Å; C237-C273 HydrophobicContact CB-CB 3.58Å; C237-C273 WeakPolarHBondContact CB-SG 3.37Å; C237-C273 WeakPolarHBondContact SG-CB 3.35Å; C237-C273 CovalentContact SG-SG 2.03Å; C237-C273 PolarHBondContact SG-SG 2.88Å
238	V	91.3	Very high	89.5	Confident	91 Å²	91	27 Å²	27	55%	0.552	16%	0.155	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	123.6	163.1	-176.4	0	0	0	0	108.4	D231 V232 I233	D231-V238 HydrophobicContact CB-CG1 3.86Å; V232-V238 WeakPolarHBondContact O-CA 3.27Å; I233-V238 HydrophobicContact CG1-CG1 4.45Å; I233-V238 HydrophobicContact CG1-CG2 4.23Å; I233-V238 HydrophobicContact CG2-CG2 4.47Å
239	T	88.2	Confident	89.5	Confident	12 Å²	12	27.9 Å²	27.9	7%	0.074	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	152.7	175.1	-165.8	0	0	0	0	110.7	V232 I280	V232-T239 HydrophobicContact CB-CG2 3.9Å; V232-T239 HydrophobicContact CG1-CG2 4.46Å; V232-T239 PolarHBondContact N-O 2.82Å; V232-T239 PolarHBondContact O-N 3.29Å; T239-I280 HydrophobicContact CG2-CD1 3.57Å
240	T	90.3	Very high	89.5	Confident	32 Å²	32	26.5 Å²	26.5	20%	0.196	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	141.4	-172.5	62.7	0	0	0	0	111.6	M230	M230-T240 WeakPolarHBondContact O-CA 3.31Å
241	A	91.3	Very high	89.1	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	-179.5	-174.8	0	0	0	0	0	112.6	T228 D229 M230 V232 L246	T228-A241 WeakPolarHBondContact CA-O 3.41Å; T228-A241 WeakPolarHBondContact CB-O 3.14Å; D229-A241 PolarHBondContact N-O 3.04Å; M230-A241 HydrophobicContact CE-CB 4.12Å; M230-A241 PolarHBondContact N-O 2.82Å; M230-A241 PolarHBondContact O-N 2.86Å; V232-A241 HydrophobicContact CG2-CB 4.29Å; A241-L246 HydrophobicContact CB-CD1 3.72Å
242	H	88.9	Confident	88.8	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	18%	0.184	C	C	.	.			trans	-107.9	111.2	176.1	-54	93.8	0	0	0	109.9	F221 T226 T228 D229 S244 I245 L246 Y284	F221-H242 AromaticContact CD1-CE1 3.85Å; F221-H242 AromaticContact CE1-CD2 3.84Å; F221-H242 AromaticContact CE1-CE1 3.22Å; F221-H242 WeakPolarHBondContact CE1-CE1 3.27Å; F221-H242 AromaticContact CE1-CG 3.79Å; F221-H242 AromaticContact CE1-ND1 3.42Å; F221-H242 WeakPolarHBondContact CE1-ND1 3.03Å; F221-H242 AromaticContact CE1-NE2 3.51Å; F221-H242 AromaticContact CZ-CD2 3.76Å; F221-H242 AromaticContact CZ-CE1 3.36Å; F221-H242 WeakPolarHBondContact CZ-CE1 3.38Å; F221-H242 AromaticContact CZ-ND1 3.98Å; F221-H242 AromaticContact CZ-NE2 3.21Å; F221-H242 WeakPolarHBondContact CZ-NE2 3.49Å; T226-H242 PolarHBondContact O-NE2 3.06Å; T228-H242 PolarHBondContact N-NE2 2.97Å; D229-H242 VanDerWaalsContact OD1-CA 3.23Å; D229-H242 WeakPolarHBondContact OD1-CA 3.48Å; H242-S244 PolarHBondContact O-N 2.87Å; H242-I245 HydrophobicContact CB-CB 4.11Å; H242-I245 HydrophobicContact CB-CD1 3.93Å; H242-I245 HydrophobicContact CB-CG1 3.9Å; H242-I245 PolarHBondContact O-N 3.3Å; H242-L246 WeakPolarHBondContact O-CD1 3.5Å; H242-L246 PolarHBondContact O-N 3.23Å; H242-L246 VanDerWaalsContact O-N 3.09Å; H242-Y284 WeakPolarHBondContact CB-OH 3.41Å; H242-Y284 PolarHBondContact N-OH 3.07Å; H242-Y284 AromaticContact ND1-CE1 3.79Å; H242-Y284 AromaticContact ND1-CZ 3.75Å; H242-Y284 PolarHBondContact ND1-OH 3Å
243	R	88.4	Confident	88.6	Confident	55 Å²	55	32.3 Å²	32.3	21%	0.208	18%	0.184	C	C	.	.	H	α-helix	trans	-50.3	-45.1	177.3	174.6	172.1	176.4	-121.8	1.4	111.7	D229 M230 I245 L246 L247 I257 Y264	D229-R243 PolarHBondContact OD1-N 2.89Å; M230-R243 HydrophobicContact CB-CB 4.19Å; M230-R243 HydrophobicContact SD-CB 3.86Å; M230-R243 HydrophobicContact SD-CG 4.28Å; R243-I245 VanDerWaalsContact C-N 3.27Å; R243-I245 PolarHBondContact O-N 2.89Å; R243-L246 PolarHBondContact O-N 2.92Å; R243-L247 HydrophobicContact CG-CD1 3.61Å; R243-L247 HydrophobicContact CG-CG 4.15Å; R243-L247 WeakPolarHBondContact O-CB 3.24Å; R243-L247 VanDerWaalsContact O-CG 3.26Å; R243-L247 WeakPolarHBondContact O-CG 3.38Å; R243-L247 PolarHBondContact O-N 3.3Å; R243-I257 HydrophobicContact CG-CD1 4.48Å; R243-Y264 VanDerWaalsContact CD-CD2 3.45Å; R243-Y264 VanDerWaalsContact CD-CG 3.42Å; R243-Y264 PolarHBondContact NH1-OH 2.72Å
244	S	85.5	Confident	88	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.014	19%	0.193	C	C	.	.	H	α-helix	trans	-62.5	-26.8	177.6	45.5	0	0	0	0	114.3	H242 A248 F610 S633	H242-S244 PolarHBondContact O-N 2.87Å; S244-A248 WeakPolarHBondContact O-CB 3.29Å; S244-F610 WeakPolarHBondContact O-CE1 3.27Å; S244-F610 VanDerWaalsContact O-CZ 3.25Å; S244-F610 WeakPolarHBondContact O-CZ 3.42Å; S244-S633 PolarHBondContact OG-OG 2.9Å
245	I	87.9	Confident	87.5	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-83.8	-41.8	175.7	-61.7	179.1	0	0	0	110.7	F218 F221 H242 R243 A248 R249 I283 Y284	F218-I245 HydrophobicContact CD1-CD1 4Å; F218-I245 HydrophobicContact CE1-CD1 4.07Å; F221-I245 HydrophobicContact CD1-CD1 3.98Å; F221-I245 HydrophobicContact CE1-CD1 3.83Å; H242-I245 HydrophobicContact CB-CB 4.11Å; H242-I245 HydrophobicContact CB-CD1 3.93Å; H242-I245 HydrophobicContact CB-CG1 3.9Å; H242-I245 PolarHBondContact O-N 3.3Å; R243-I245 VanDerWaalsContact C-N 3.27Å; R243-I245 PolarHBondContact O-N 2.89Å; I245-A248 PolarHBondContact O-N 3.11Å; I245-R249 VanDerWaalsContact O-CG 3.3Å; I245-R249 WeakPolarHBondContact O-CG 3.46Å; I245-R249 PolarHBondContact O-N 3.44Å; I245-I283 HydrophobicContact CG2-CG2 4.27Å; I245-Y284 HydrophobicContact CB-CE1 4.3Å; I245-Y284 HydrophobicContact CB-CE2 4.24Å; I245-Y284 HydrophobicContact CD1-CD1 4.16Å; I245-Y284 HydrophobicContact CD1-CE1 3.49Å; I245-Y284 VanDerWaalsContact CD1-CE1 3.49Å; I245-Y284 HydrophobicContact CG1-CE1 4.47Å; I245-Y284 HydrophobicContact CG2-CD1 4.08Å; I245-Y284 HydrophobicContact CG2-CD2 3.87Å; I245-Y284 HydrophobicContact CG2-CE1 3.94Å; I245-Y284 HydrophobicContact CG2-CE2 3.72Å; I245-Y284 HydrophobicContact CG2-CG 4.08Å
246	L	89.4	Confident	87.3	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63	-49.4	177	-84.2	75.4	0	0	0	110.9	M230 V232 A241 H242 R243 A248 R249 C250 M253 L266 I283 Y284	M230-L246 HydrophobicContact CE-CB 4.1Å; M230-L246 HydrophobicContact CE-CD1 3.89Å; M230-L246 HydrophobicContact CE-CD2 3.35Å; M230-L246 HydrophobicContact CE-CG 3.94Å; V232-L246 HydrophobicContact CG2-CD2 4.49Å; A241-L246 HydrophobicContact CB-CD1 3.72Å; H242-L246 WeakPolarHBondContact O-CD1 3.5Å; H242-L246 PolarHBondContact O-N 3.23Å; H242-L246 VanDerWaalsContact O-N 3.09Å; R243-L246 PolarHBondContact O-N 2.92Å; L246-A248 VanDerWaalsContact C-N 3.27Å; L246-A248 PolarHBondContact O-N 3.02Å; L246-R249 PolarHBondContact O-N 2.98Å; L246-C250 PolarHBondContact O-N 2.78Å; L246-M253 HydrophobicContact CB-SD 4.06Å; L246-M253 HydrophobicContact CD2-CE 4.44Å; L246-M253 HydrophobicContact CD2-SD 3.6Å; L246-M253 HydrophobicContact CG-SD 4.14Å; L246-L266 HydrophobicContact CD2-CD2 4.22Å; L246-I283 HydrophobicContact CD1-CG2 4.43Å; L246-I283 HydrophobicContact CD2-CD1 4.38Å; L246-I283 HydrophobicContact CG-CD1 4.05Å; L246-I283 HydrophobicContact CG-CG2 4.23Å; L246-Y284 HydrophobicContact CD1-CE2 3.83Å
247	L	86.4	Confident	87.1	Confident	5 Å²	5	35.5 Å²	35.5	3%	0.026	20%	0.202	C	C	.	.	H	α-helix	trans	-63.2	-29.3	-179.8	-67.9	179.4	0	0	0	114	R243 R249 M254 I257 F610 A616	R243-L247 HydrophobicContact CG-CD1 3.61Å; R243-L247 HydrophobicContact CG-CG 4.15Å; R243-L247 WeakPolarHBondContact O-CB 3.24Å; R243-L247 VanDerWaalsContact O-CG 3.26Å; R243-L247 WeakPolarHBondContact O-CG 3.38Å; R243-L247 PolarHBondContact O-N 3.3Å; L247-R249 VanDerWaalsContact C-N 3.26Å; L247-R249 PolarHBondContact O-N 3.39Å; L247-M254 HydrophobicContact CD1-CE 4.22Å; L247-M254 HydrophobicContact CD2-CB 3.68Å; L247-M254 HydrophobicContact CD2-CE 4.22Å; L247-M254 HydrophobicContact CD2-CG 4.21Å; L247-I257 HydrophobicContact CD2-CD1 3.88Å; L247-I257 HydrophobicContact CG-CD1 4.28Å; L247-F610 HydrophobicContact CB-CE2 3.88Å; L247-F610 HydrophobicContact CB-CZ 4.15Å; L247-A616 HydrophobicContact CD1-CB 3.82Å
248	A	83.5	Confident	86.9	Confident	10 Å²	10	40.7 Å²	40.7	8%	0.083	22%	0.222	C	C	.	.	H	α-helix	trans	-70	-23.6	176	0	0	0	0	0	113.8	S244 I245 L246 F607 F610	S244-A248 WeakPolarHBondContact O-CB 3.29Å; I245-A248 PolarHBondContact O-N 3.11Å; L246-A248 VanDerWaalsContact C-N 3.27Å; L246-A248 PolarHBondContact O-N 3.02Å; A248-F607 HydrophobicContact CB-CD1 3.73Å; A248-F607 HydrophobicContact CB-CE1 3.77Å; A248-F610 HydrophobicContact CB-CB 3.7Å; A248-F610 HydrophobicContact CB-CD1 3.56Å; A248-F610 HydrophobicContact CB-CD2 3.62Å; A248-F610 HydrophobicContact CB-CE1 3.96Å; A248-F610 HydrophobicContact CB-CE2 4.01Å; A248-F610 HydrophobicContact CB-CG 3.35Å; A248-F610 HydrophobicContact CB-CZ 4.17Å
249	R	86.6	Confident	86.6	Confident	43 Å²	43	42.9 Å²	42.9	16%	0.162	23%	0.225	C	C	.	.	H	α-helix	trans	-114.2	-30.6	-168.7	-65.6	-72.2	-66.3	151	9.2	112.4	I245 L246 L247 I283 D286 F603 S606 F607	I245-R249 VanDerWaalsContact O-CG 3.3Å; I245-R249 WeakPolarHBondContact O-CG 3.46Å; I245-R249 PolarHBondContact O-N 3.44Å; L246-R249 PolarHBondContact O-N 2.98Å; L247-R249 VanDerWaalsContact C-N 3.26Å; L247-R249 PolarHBondContact O-N 3.39Å; R249-I283 HydrophobicContact CB-CG2 3.85Å; R249-I283 HydrophobicContact CG-CG2 4.12Å; R249-I283 WeakPolarHBondContact CG-O 3.37Å; R249-I283 PolarHBondContact NE-O 2.79Å; R249-D286 IonicContact CZ-OD2 3.65Å; R249-D286 IonicContact NH1-OD2 2.71Å; R249-D286 PolarHBondContact NH1-OD2 3.33Å; R249-D286 IonicContact NH2-OD1 3.28Å; R249-D286 PolarHBondContact NH2-OD1 2.84Å; R249-D286 IonicContact NH2-OD2 3.14Å; R249-D286 PolarHBondContact NH2-OD2 3.31Å; R249-F603 VanDerWaalsContact CZ-CD2 3.49Å; R249-S606 WeakPolarHBondContact CD-OG 3.37Å; R249-S606 PolarHBondContact NH1-OG 3.11Å; R249-S606 VanDerWaalsContact NH1-OG 3.07Å; R249-F607 HydrophobicContact CG-CE1 3.75Å; R249-F607 HydrophobicContact CG-CZ 3.97Å
250	C	88.2	Confident	86.3	Confident	5 Å²	5	47.3 Å²	47.3	3%	0.034	24%	0.244	C	C	.	.			trans	-135.9	85.9	172.7	-176.2	0	0	0	0	109.5	L246 L252 M253 Y305	L246-C250 PolarHBondContact O-N 2.78Å; C250-L252 PolarHBondContact O-N 3.29Å; C250-M253 HydrophobicContact CB-CE 4.41Å; C250-M253 HydrophobicContact CB-CG 4.27Å; C250-M253 HydrophobicContact CB-SD 4Å; C250-M253 PolarHBondContact O-N 3.06Å; C250-Y305 PolarHBondContact SG-O 3Å; C250-Y305 VanDerWaalsContact SG-O 3.39Å
251	P	82	Confident	85.8	Confident	86 Å²	86	54.5 Å²	54.5	56%	0.558	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-60.4	-23.6	178.5	-26	36.1	0	0	0	114.2	M253 M254	P251-M253 PolarHBondContact O-N 3.4Å; P251-M254 WeakPolarHBondContact O-CB 3.5Å; P251-M254 PolarHBondContact O-N 2.91Å
252	L	85.2	Confident	85.1	Confident	69 Å²	69	61.9 Å²	61.9	36%	0.361	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-63.3	-27.2	178.7	-65.5	168.5	0	0	0	113.2	C250 M254 S255 E306	C250-L252 PolarHBondContact O-N 3.29Å; L252-M254 PolarHBondContact O-N 3Å; L252-M254 VanDerWaalsContact O-N 3.09Å; L252-S255 PolarHBondContact O-N 3.49Å; L252-S255 PolarHBondContact O-OG 3.35Å; L252-E306 HydrophobicContact CD1-CB 3.5Å; L252-E306 VanDerWaalsContact CD1-CD 3.41Å; L252-E306 HydrophobicContact CD1-CG 3.42Å; L252-E306 VanDerWaalsContact CD1-CG 3.42Å
253	M	87.4	Confident	84.8	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-62.9	-14.4	173	-70.5	173.5	174	0	0	112.6	L246 C250 P251 S255 L256 I257 L266 V279 I283 Y305	L246-M253 HydrophobicContact CB-SD 4.06Å; L246-M253 HydrophobicContact CD2-CE 4.44Å; L246-M253 HydrophobicContact CD2-SD 3.6Å; L246-M253 HydrophobicContact CG-SD 4.14Å; C250-M253 HydrophobicContact CB-CE 4.41Å; C250-M253 HydrophobicContact CB-CG 4.27Å; C250-M253 HydrophobicContact CB-SD 4Å; C250-M253 PolarHBondContact O-N 3.06Å; P251-M253 PolarHBondContact O-N 3.4Å; M253-S255 VanDerWaalsContact C-N 3.29Å; M253-S255 PolarHBondContact O-N 2.87Å; M253-L256 PolarHBondContact O-N 3.43Å; M253-I257 HydrophobicContact CB-CD1 4.05Å; M253-I257 WeakPolarHBondContact O-CD1 3.43Å; M253-I257 VanDerWaalsContact O-CG1 3.27Å; M253-I257 WeakPolarHBondContact O-CG1 3.47Å; M253-I257 PolarHBondContact O-N 3.48Å; M253-I257 VanDerWaalsContact O-N 3.11Å; M253-L266 HydrophobicContact CE-CD2 4.22Å; M253-L266 HydrophobicContact CG-CD2 4.29Å; M253-L266 HydrophobicContact SD-CD2 3.99Å; M253-V279 HydrophobicContact CE-CG1 4.44Å; M253-I283 HydrophobicContact CE-CD1 3.87Å; M253-I283 HydrophobicContact SD-CD1 4.15Å; M253-Y305 HydrophobicContact CE-CD1 3.69Å; M253-Y305 HydrophobicContact CE-CD2 3.76Å; M253-Y305 HydrophobicContact CE-CE1 3.88Å; M253-Y305 HydrophobicContact CE-CE2 3.95Å; M253-Y305 HydrophobicContact CE-CG 3.64Å; M253-Y305 HydrophobicContact CG-CD1 4.13Å; M253-Y305 HydrophobicContact CG-CE1 4.31Å
254	M	81	Confident	84.9	Confident	92 Å²	92	66.1 Å²	66.1	45%	0.453	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-60.6	-34.2	179.8	-165.9	173.5	-69.6	0	0	113.8	L247 P251 L252 L256 T615	L247-M254 HydrophobicContact CD1-CE 4.22Å; L247-M254 HydrophobicContact CD2-CB 3.68Å; L247-M254 HydrophobicContact CD2-CE 4.22Å; L247-M254 HydrophobicContact CD2-CG 4.21Å; P251-M254 WeakPolarHBondContact O-CB 3.5Å; P251-M254 PolarHBondContact O-N 2.91Å; L252-M254 PolarHBondContact O-N 3Å; L252-M254 VanDerWaalsContact O-N 3.09Å; M254-L256 VanDerWaalsContact C-N 3.33Å; M254-T615 HydrophobicContact CE-CG2 4.43Å
255	S	82.3	Confident	85.2	Confident	107 Å²	107	66.5 Å²	66.5	75%	0.748	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-85.4	-5.8	176.1	53.4	0	0	0	0	113.9	L252 M253	L252-S255 PolarHBondContact O-N 3.49Å; L252-S255 PolarHBondContact O-OG 3.35Å; M253-S255 VanDerWaalsContact C-N 3.29Å; M253-S255 PolarHBondContact O-N 2.87Å
256	L	86.8	Confident	85.4	Confident	82 Å²	82	66.5 Å²	66.5	43%	0.429	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-5.4	-178.8	-55.7	177.7	0	0	0	112.7	M253 M254 L266 Y305	M253-L256 PolarHBondContact O-N 3.43Å; M254-L256 VanDerWaalsContact C-N 3.33Å; L256-L266 HydrophobicContact CB-CD1 3.54Å; L256-Y305 HydrophobicContact CD1-CD1 4.39Å; L256-Y305 HydrophobicContact CD1-CE1 3.86Å
257	I	87.8	Confident	85.5	Confident	22 Å²	22	72.4 Å²	72.4	11%	0.113	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	110.2	179.8	-71.2	161.3	0	0	0	109.3	M230 R243 L247 M253 Y264 V265 L266	M230-I257 HydrophobicContact CE-CD1 4.47Å; M230-I257 HydrophobicContact SD-CD1 3.59Å; M230-I257 VanDerWaalsContact SD-CD1 3.59Å; M230-I257 HydrophobicContact SD-CG1 3.86Å; M230-I257 HydrophobicContact SD-CG2 4.26Å; R243-I257 HydrophobicContact CG-CD1 4.48Å; L247-I257 HydrophobicContact CD2-CD1 3.88Å; L247-I257 HydrophobicContact CG-CD1 4.28Å; M253-I257 HydrophobicContact CB-CD1 4.05Å; M253-I257 WeakPolarHBondContact O-CD1 3.43Å; M253-I257 VanDerWaalsContact O-CG1 3.27Å; M253-I257 WeakPolarHBondContact O-CG1 3.47Å; M253-I257 PolarHBondContact O-N 3.48Å; M253-I257 VanDerWaalsContact O-N 3.11Å; I257-Y264 HydrophobicContact CG2-CD1 3.85Å; I257-Y264 HydrophobicContact CG2-CG 4.19Å; I257-V265 CarbonylContact C-O 3.54Å; I257-V265 WeakPolarHBondContact CA-O 3.35Å; I257-L266 HydrophobicContact CG1-CB 4.13Å; I257-L266 HydrophobicContact CG1-CD1 4.28Å
258	E	86.5	Confident	85.7	Confident	140 Å²	140	72.2 Å²	72.2	65%	0.654	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	166.3	171.3	-58.9	-155.7	166.9	0	0	111.1	Y264 V265	E258-Y264 CarbonylContact O-C 3.58Å; E258-Y264 WeakPolarHBondContact O-CA 3.26Å; E258-V265 PolarHBondContact N-O 2.99Å; E258-V265 PolarHBondContact O-N 3.01Å
259	K	85	Confident	86.1	Confident	138 Å²	138	74.6 Å²	74.6	60%	0.6	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.3	107.3	174	-172.1	-172.8	175.1	-172.7	0	109.5	K261 Y264	K259-K261 VanDerWaalsContact CE-O 3.28Å; K259-K261 WeakPolarHBondContact CE-O 3.29Å; K259-Y264 HydrophobicContact CB-CD1 4.03Å; K259-Y264 HydrophobicContact CB-CE1 3.89Å; K259-Y264 HydrophobicContact CD-CE1 4.21Å; K259-Y264 HydrophobicContact CG-CD1 4.21Å; K259-Y264 HydrophobicContact CG-CE1 3.93Å
260	E	82	Confident	86.5	Confident	104 Å²	104	77.5 Å²	77.5	49%	0.486	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	114.3	174.5	-68.1	-165.6	-165.3	0	0	110.8	D262 R263 V265	E260-D262 PolarHBondContact O-N 3.37Å; E260-R263 PolarHBondContact N-O 3.41Å; E260-R263 PolarHBondContact O-N 3.05Å; E260-R263 VanDerWaalsContact O-O 3.05Å; E260-V265 HydrophobicContact CB-CG2 3.85Å; E260-V265 HydrophobicContact CG-CB 4.35Å; E260-V265 HydrophobicContact CG-CG2 3.84Å
261	K	78.9	Confident	86.8	Confident	183 Å²	183	77.5 Å²	77.5	80%	0.796	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	-108.7	-178.9	-54.7	165.3	-174.4	161.4	0	110.6	K259	K259-K261 VanDerWaalsContact CE-O 3.28Å; K259-K261 WeakPolarHBondContact CE-O 3.29Å
262	D	78.1	Confident	87.4	Confident	156 Å²	156	74.1 Å²	74.1	83%	0.834	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	0.6	-175.2	-57.2	-46.7	0	0	0	113.7	E260	E260-D262 PolarHBondContact O-N 3.37Å
263	R	82.7	Confident	87.8	Confident	80 Å²	80	71.7 Å²	71.7	30%	0.302	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	159.9	-180	-68.2	-178.2	72.1	87.6	-1.2	111.7	T228 M230 D231 E260	T228-R263 PolarHBondContact O-NH1 3.49Å; T228-R263 VanDerWaalsContact O-NH1 3.16Å; M230-R263 PolarHBondContact O-NH2 3.48Å; D231-R263 IonicContact OD1-CZ 2.66Å; D231-R263 IonicContact OD1-NE 2.91Å; D231-R263 PolarHBondContact OD1-NE 3.08Å; D231-R263 IonicContact OD1-NH2 3.37Å; D231-R263 PolarHBondContact OD1-NH2 3.11Å; D231-R263 WeakPolarHBondContact OD2-CD 3.37Å; D231-R263 IonicContact OD2-CZ 2.84Å; D231-R263 IonicContact OD2-NE 3.13Å; D231-R263 PolarHBondContact OD2-NE 2.92Å; D231-R263 IonicContact OD2-NH2 3.13Å; E260-R263 PolarHBondContact N-O 3.41Å; E260-R263 PolarHBondContact O-N 3.05Å; E260-R263 VanDerWaalsContact O-O 3.05Å
264	Y	89.8	Confident	88.2	Confident	64 Å²	64	77 Å²	77	25%	0.251	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	144.5	167.7	-69.2	-76.2	0	0	0	109.8	D229 M230 D231 R243 I257 E258 K259	D229-Y264 PolarHBondContact O-N 2.84Å; M230-Y264 CarbonylContact C-O 3.6Å; M230-Y264 VanDerWaalsContact CA-O 3.25Å; M230-Y264 WeakPolarHBondContact CA-O 3.42Å; M230-Y264 WeakPolarHBondContact CG-O 3.27Å; D231-Y264 PolarHBondContact N-O 3.45Å; R243-Y264 VanDerWaalsContact CD-CD2 3.45Å; R243-Y264 VanDerWaalsContact CD-CG 3.42Å; R243-Y264 PolarHBondContact NH1-OH 2.72Å; I257-Y264 HydrophobicContact CG2-CD1 3.85Å; I257-Y264 HydrophobicContact CG2-CG 4.19Å; E258-Y264 CarbonylContact O-C 3.58Å; E258-Y264 WeakPolarHBondContact O-CA 3.26Å; K259-Y264 HydrophobicContact CB-CD1 4.03Å; K259-Y264 HydrophobicContact CB-CE1 3.89Å; K259-Y264 HydrophobicContact CD-CE1 4.21Å; K259-Y264 HydrophobicContact CG-CD1 4.21Å; K259-Y264 HydrophobicContact CG-CE1 3.93Å
265	V	92.2	Very high	88.9	Confident	10 Å²	10	72.7 Å²	72.7	6%	0.061	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	128.5	-177.7	178	0	0	0	0	109.1	D231 I233 I257 E258 E260	D231-V265 CarbonylContact O-C 3.28Å; D231-V265 WeakPolarHBondContact O-CA 3.49Å; I233-V265 HydrophobicContact CD1-CG1 3.5Å; I233-V265 HydrophobicContact CG1-CG1 3.99Å; I257-V265 CarbonylContact C-O 3.54Å; I257-V265 WeakPolarHBondContact CA-O 3.35Å; E258-V265 PolarHBondContact N-O 2.99Å; E258-V265 PolarHBondContact O-N 3.01Å; E260-V265 HydrophobicContact CB-CG2 3.85Å; E260-V265 HydrophobicContact CG-CB 4.35Å; E260-V265 HydrophobicContact CG-CG2 3.84Å
266	L	92.3	Very high	89.5	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	109.5	166.9	174	61.1	0	0	0	108	D231 V232 I233 L246 M253 L256 I257 A268	D231-L266 PolarHBondContact O-N 3.32Å; V232-L266 WeakPolarHBondContact CA-O 3.37Å; V232-L266 HydrophobicContact CG1-CD2 4.19Å; V232-L266 HydrophobicContact CG1-CG 4.41Å; V232-L266 HydrophobicContact CG2-CB 4.3Å; V232-L266 HydrophobicContact CG2-CD2 4.29Å; I233-L266 PolarHBondContact N-O 2.91Å; L246-L266 HydrophobicContact CD2-CD2 4.22Å; M253-L266 HydrophobicContact CE-CD2 4.22Å; M253-L266 HydrophobicContact CG-CD2 4.29Å; M253-L266 HydrophobicContact SD-CD2 3.99Å; L256-L266 HydrophobicContact CB-CD1 3.54Å; I257-L266 HydrophobicContact CG1-CB 4.13Å; I257-L266 HydrophobicContact CG1-CD1 4.28Å; L266-A268 PolarHBondContact O-N 2.87Å
267	E	90.8	Very high	89.8	Confident	125 Å²	125	68.3 Å²	68.3	58%	0.584	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	118.6	173.3	-160	-178.3	166	0	0	109.9	T269	E267-T269 HydrophobicContact CG-CG2 3.66Å; E267-T269 WeakPolarHBondContact OE1-CG2 3.31Å; E267-T269 PolarHBondContact OE1-OG1 3.47Å
268	A	91.6	Very high	90.2	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	32%	0.319	C	S	.	.			trans	-132.8	35.3	-179.6	0	0	0	0	0	110.4	V232 I233 L266 Q270 F271 M276	V232-A268 HydrophobicContact CG1-CB 4.36Å; I233-A268 CarbonylContact O-C 3.5Å; I233-A268 VanDerWaalsContact O-CA 3.31Å; I233-A268 WeakPolarHBondContact O-CA 3.42Å; I233-A268 PolarHBondContact O-N 2.89Å; L266-A268 PolarHBondContact O-N 2.87Å; A268-Q270 PolarHBondContact O-N 2.82Å; A268-F271 HydrophobicContact CB-CD2 4.46Å; A268-F271 PolarHBondContact O-N 2.87Å; A268-M276 HydrophobicContact CB-CE 3.8Å; A268-M276 HydrophobicContact CB-CG 4.26Å; A268-M276 HydrophobicContact CB-SD 3.98Å
269	T	92.1	Very high	90.6	Very high	61 Å²	61	61 Å²	61	37%	0.374	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-9.9	-172.7	45.2	0	0	0	0	114.4	I233 S235 E267 F271	I233-T269 HydrophobicContact CG2-CG2 3.88Å; I233-T269 PolarHBondContact O-N 3.17Å; S235-T269 VanDerWaalsContact CB-O 3.25Å; S235-T269 WeakPolarHBondContact CB-O 3.47Å; E267-T269 HydrophobicContact CG-CG2 3.66Å; E267-T269 WeakPolarHBondContact OE1-CG2 3.31Å; E267-T269 PolarHBondContact OE1-OG1 3.47Å; T269-F271 VanDerWaalsContact C-N 3.32Å
270	Q	93.2	Very high	91	Very high	103 Å²	103	54.7 Å²	54.7	48%	0.481	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-5.1	169	73	-77.1	-5.9	0	0	115.2	A268	A268-Q270 PolarHBondContact O-N 2.82Å
271	F	95.3	Very high	91.5	Very high	6 Å²	6	51.4 Å²	51.4	3%	0.026	25%	0.25	C	C	.	.	S	Bend	trans	-128	146.3	-177.5	-57.7	-50	0	0	0	111.6	A234 S235 A268 T269 M276 R300 A301 N304 Y305	A234-F271 WeakPolarHBondContact CB-O 3.25Å; S235-F271 PolarHBondContact N-O 3.45Å; S235-F271 PolarHBondContact OG-O 2.86Å; A268-F271 HydrophobicContact CB-CD2 4.46Å; A268-F271 PolarHBondContact O-N 2.87Å; T269-F271 VanDerWaalsContact C-N 3.32Å; F271-M276 HydrophobicContact CB-CG 3.82Å; F271-M276 HydrophobicContact CB-SD 3.97Å; F271-M276 HydrophobicContact CD2-SD 3.62Å; F271-M276 HydrophobicContact CG-SD 4.18Å; F271-R300 HydrophobicContact CE1-CB 3.91Å; F271-A301 HydrophobicContact CD1-CB 4.18Å; F271-A301 HydrophobicContact CD2-CB 3.92Å; F271-A301 HydrophobicContact CE1-CB 3.92Å; F271-A301 HydrophobicContact CE2-CB 3.6Å; F271-A301 HydrophobicContact CG-CB 4.2Å; F271-A301 HydrophobicContact CZ-CB 3.64Å; F271-N304 HydrophobicContact CZ-CB 4.29Å; F271-Y305 HydrophobicContact CD2-CE2 4.3Å; F271-Y305 AromaticContact CE2-CE2 3.88Å; F271-Y305 HydrophobicContact CE2-CE2 3.88Å
272	S	94.6	Very high	92.3	Very high	14 Å²	14	43 Å²	43	10%	0.098	21%	0.213	C	C	.	.			trans	-68	160.3	172.4	63.4	0	0	0	0	113.1	Q274 A275 M276 E297	S272-Q274 VanDerWaalsContact C-N 3.27Å; S272-Q274 PolarHBondContact O-N 2.9Å; S272-A275 PolarHBondContact O-N 3.2Å; S272-A275 WeakPolarHBondContact OG-CB 3.45Å; S272-A275 PolarHBondContact OG-N 3Å; S272-M276 PolarHBondContact O-N 2.94Å; S272-E297 WeakPolarHBondContact CB-OE2 3.24Å; S272-E297 PolarHBondContact N-OE2 2.86Å; S272-E297 PolarHBondContact OG-OE2 2.8Å
273	C	94.2	Very high	92.9	Very high	19 Å²	19	35.6 Å²	35.6	13%	0.128	17%	0.173	C	C	.	.	H	α-helix	trans	-52.5	-46.5	173.2	-158.8	0	0	0	0	111.3	D236 C237 M276 E277	D236-C273 VanDerWaalsContact OD1-CB 3.29Å; D236-C273 WeakPolarHBondContact OD1-CB 3.31Å; D236-C273 PolarHBondContact OD1-N 2.83Å; C237-C273 HydrophobicContact CB-CB 3.58Å; C237-C273 WeakPolarHBondContact CB-SG 3.37Å; C237-C273 WeakPolarHBondContact SG-CB 3.35Å; C237-C273 CovalentContact SG-SG 2.03Å; C237-C273 PolarHBondContact SG-SG 2.88Å; C273-M276 PolarHBondContact O-N 2.84Å; C273-E277 WeakPolarHBondContact O-CB 3.39Å; C273-E277 WeakPolarHBondContact O-CG 3.23Å; C273-E277 PolarHBondContact O-N 3.14Å
274	Q	95	Very high	93.3	Very high	112 Å²	112	31.8 Å²	31.8	52%	0.523	16%	0.159	S	C	.	.	H	α-helix	trans	-65.7	-42	-177.2	-62.2	178.7	-58.4	0	0	112.3	S272 E277 C278 I294	S272-Q274 VanDerWaalsContact C-N 3.27Å; S272-Q274 PolarHBondContact O-N 2.9Å; Q274-E277 PolarHBondContact O-N 2.93Å; Q274-C278 PolarHBondContact O-N 2.84Å; Q274-I294 HydrophobicContact CB-CG2 3.83Å
275	A	95.6	Very high	93.3	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.9	-45	175.3	0	0	0	0	0	111.2	S272 C278 V279 E297 V298	S272-A275 PolarHBondContact O-N 3.2Å; S272-A275 WeakPolarHBondContact OG-CB 3.45Å; S272-A275 PolarHBondContact OG-N 3Å; A275-C278 WeakPolarHBondContact O-CB 3.46Å; A275-C278 PolarHBondContact O-N 2.84Å; A275-V279 WeakPolarHBondContact O-CG2 3.45Å; A275-V279 PolarHBondContact O-N 2.86Å; A275-E297 HydrophobicContact CB-CB 3.64Å; A275-V298 HydrophobicContact CB-CG2 4.09Å
276	M	94.8	Very high	93.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-68.4	-34.1	177.5	-70.6	-54.3	-64.5	0	0	113.1	V232 A234 A268 F271 S272 C273 V279 I280 Y305	V232-M276 HydrophobicContact CG1-CE 3.71Å; A234-M276 HydrophobicContact CB-CG 4.42Å; A268-M276 HydrophobicContact CB-CE 3.8Å; A268-M276 HydrophobicContact CB-CG 4.26Å; A268-M276 HydrophobicContact CB-SD 3.98Å; F271-M276 HydrophobicContact CB-CG 3.82Å; F271-M276 HydrophobicContact CB-SD 3.97Å; F271-M276 HydrophobicContact CD2-SD 3.62Å; F271-M276 HydrophobicContact CG-SD 4.18Å; S272-M276 PolarHBondContact O-N 2.94Å; C273-M276 PolarHBondContact O-N 2.84Å; M276-V279 PolarHBondContact O-N 2.76Å; M276-I280 WeakPolarHBondContact O-CB 3.46Å; M276-I280 WeakPolarHBondContact O-CD1 3.33Å; M276-I280 WeakPolarHBondContact O-CG1 3.17Å; M276-I280 PolarHBondContact O-N 2.88Å; M276-Y305 HydrophobicContact CE-CE2 4.04Å; M276-Y305 HydrophobicContact SD-CE2 4.07Å
277	E	94.1	Very high	92.9	Very high	98 Å²	98	34.1 Å²	34.1	46%	0.458	17%	0.171	S	C	.	.	H	α-helix	trans	-64.5	-38.2	171.4	-76.9	-172.3	156.6	0	0	111.8	C273 Q274 S281	C273-E277 WeakPolarHBondContact O-CB 3.39Å; C273-E277 WeakPolarHBondContact O-CG 3.23Å; C273-E277 PolarHBondContact O-N 3.14Å; Q274-E277 PolarHBondContact O-N 2.93Å; E277-S281 WeakPolarHBondContact O-CB 3.23Å; E277-S281 PolarHBondContact O-N 2.86Å
278	C	95	Very high	93	Very high	7 Å²	7	29.6 Å²	29.6	5%	0.047	15%	0.152	C	C	.	.	H	α-helix	trans	-63.1	-48.2	172	-148	0	0	0	0	111	Q274 A275 I280 S281 Y282 C288 T289 I294 V298	Q274-C278 PolarHBondContact O-N 2.84Å; A275-C278 WeakPolarHBondContact O-CB 3.46Å; A275-C278 PolarHBondContact O-N 2.84Å; C278-I280 PolarHBondContact O-N 2.87Å; C278-S281 PolarHBondContact O-N 3.3Å; C278-Y282 VanDerWaalsContact O-CB 3.3Å; C278-Y282 WeakPolarHBondContact O-CB 3.45Å; C278-Y282 PolarHBondContact O-N 2.99Å; C278-C288 VanDerWaalsContact C-SG 3.54Å; C278-C288 VanDerWaalsContact CA-SG 3.59Å; C278-C288 HydrophobicContact CB-CB 3.96Å; C278-C288 WeakPolarHBondContact CB-SG 3.39Å; C278-C288 WeakPolarHBondContact O-CB 3.41Å; C278-C288 PolarHBondContact O-SG 3.28Å; C278-C288 WeakPolarHBondContact SG-CB 3.33Å; C278-C288 CovalentContact SG-SG 2.05Å; C278-C288 PolarHBondContact SG-SG 3.31Å; C278-T289 PolarHBondContact SG-O 3.19Å; C278-I294 HydrophobicContact CB-CD1 4.34Å; C278-V298 HydrophobicContact CB-CG2 3.98Å
279	V	95	Very high	92.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.8	-45.7	177.7	171.9	0	0	0	0	111.3	M253 A275 M276 Y282 I283 A301 Y305 M307 L310	M253-V279 HydrophobicContact CE-CG1 4.44Å; A275-V279 WeakPolarHBondContact O-CG2 3.45Å; A275-V279 PolarHBondContact O-N 2.86Å; M276-V279 PolarHBondContact O-N 2.76Å; V279-Y282 PolarHBondContact O-N 2.81Å; V279-I283 HydrophobicContact CG1-CD1 4.1Å; V279-I283 WeakPolarHBondContact O-CG1 3.3Å; V279-I283 PolarHBondContact O-N 2.69Å; V279-A301 HydrophobicContact CG2-CB 3.76Å; V279-Y305 HydrophobicContact CG1-CD2 4.11Å; V279-Y305 HydrophobicContact CG1-CE2 4.45Å; V279-M307 HydrophobicContact CG1-SD 4.23Å; V279-L310 HydrophobicContact CG2-CD2 3.97Å
280	I	94	Very high	93	Very high	6 Å²	6	33.2 Å²	33.2	3%	0.031	17%	0.174	C	C	.	.	H	α-helix	trans	-67.4	-44.3	178.3	-66.4	165	0	0	0	110.5	L222 V232 T239 M276 C278 Y282 I283 Y284	L222-I280 HydrophobicContact CD1-CG2 3.7Å; L222-I280 HydrophobicContact CD2-CG2 3.98Å; V232-I280 HydrophobicContact CB-CD1 4.3Å; V232-I280 HydrophobicContact CG1-CD1 4.35Å; V232-I280 HydrophobicContact CG2-CD1 4.07Å; T239-I280 HydrophobicContact CG2-CD1 3.57Å; M276-I280 WeakPolarHBondContact O-CB 3.46Å; M276-I280 WeakPolarHBondContact O-CD1 3.33Å; M276-I280 WeakPolarHBondContact O-CG1 3.17Å; M276-I280 PolarHBondContact O-N 2.88Å; C278-I280 PolarHBondContact O-N 2.87Å; I280-Y282 VanDerWaalsContact C-N 3.28Å; I280-Y282 PolarHBondContact O-N 2.85Å; I280-I283 WeakPolarHBondContact O-CB 3.25Å; I280-I283 PolarHBondContact O-N 3.41Å; I280-I283 VanDerWaalsContact O-N 3.17Å; I280-Y284 HydrophobicContact CG2-CD2 4.02Å; I280-Y284 HydrophobicContact CG2-CE2 3.82Å; I280-Y284 WeakPolarHBondContact O-CD2 3.25Å; I280-Y284 PolarHBondContact O-N 3.49Å
281	S	93.3	Very high	93	Very high	35 Å²	35	30.7 Å²	30.7	25%	0.245	17%	0.166	C	C	.	.	H	α-helix	trans	-56.9	-44.1	174.4	-174.1	0	0	0	0	111.4	E277 C278 Y284 T285 K287	E277-S281 WeakPolarHBondContact O-CB 3.23Å; E277-S281 PolarHBondContact O-N 2.86Å; C278-S281 PolarHBondContact O-N 3.3Å; S281-Y284 PolarHBondContact O-N 3.21Å; S281-T285 PolarHBondContact O-N 3.11Å; S281-T285 PolarHBondContact O-OG1 2.9Å; S281-K287 CarbonylContact C-O 3.57Å; S281-K287 VanDerWaalsContact C-O 3.31Å; S281-K287 PolarHBondContact OG-O 2.9Å
282	Y	94.1	Very high	92.7	Very high	8 Å²	8	32.2 Å²	32.2	3%	0.031	18%	0.176	C	C	.	.	H	α-helix	trans	-64.4	-41.1	176.5	-174.5	-84.1	0	0	0	112.2	C278 V279 I280 Y284 T285 D286 K287 M307 K309 L310	C278-Y282 VanDerWaalsContact O-CB 3.3Å; C278-Y282 WeakPolarHBondContact O-CB 3.45Å; C278-Y282 PolarHBondContact O-N 2.99Å; V279-Y282 PolarHBondContact O-N 2.81Å; I280-Y282 VanDerWaalsContact C-N 3.28Å; I280-Y282 PolarHBondContact O-N 2.85Å; Y282-Y284 VanDerWaalsContact C-N 3.26Å; Y282-Y284 PolarHBondContact O-N 3.49Å; Y282-T285 PolarHBondContact O-N 2.98Å; Y282-D286 VanDerWaalsContact CE1-OD1 3.25Å; Y282-D286 WeakPolarHBondContact CE1-OD1 3.25Å; Y282-D286 WeakPolarHBondContact CE2-O 3.4Å; Y282-D286 VanDerWaalsContact O-CA 3.27Å; Y282-D286 WeakPolarHBondContact O-CA 3.3Å; Y282-D286 PolarHBondContact O-N 3.4Å; Y282-D286 PolarHBondContact OH-OD1 3.15Å; Y282-K287 WeakPolarHBondContact CA-O 3.35Å; Y282-K287 PolarHBondContact N-O 3.3Å; Y282-M307 HydrophobicContact CD1-CE 3.66Å; Y282-M307 HydrophobicContact CE1-CE 3.91Å; Y282-K309 VanDerWaalsContact OH-CB 3.29Å; Y282-K309 WeakPolarHBondContact OH-CB 3.41Å; Y282-L310 HydrophobicContact CD1-CB 4.03Å; Y282-L310 HydrophobicContact CD1-CD2 4.13Å; Y282-L310 HydrophobicContact CD1-CG 4.48Å; Y282-L310 HydrophobicContact CD2-CB 4.2Å; Y282-L310 HydrophobicContact CD2-CD1 3.76Å; Y282-L310 HydrophobicContact CD2-CG 4.42Å; Y282-L310 HydrophobicContact CE1-CB 4.06Å; Y282-L310 HydrophobicContact CE2-CB 4.17Å; Y282-L310 HydrophobicContact CE2-CD1 4.38Å; Y282-L310 HydrophobicContact CG-CB 4.15Å; Y282-L310 HydrophobicContact CG-CD1 3.9Å; Y282-L310 HydrophobicContact CG-CD2 4.04Å; Y282-L310 HydrophobicContact CG-CG 4.25Å
283	I	91.9	Very high	92.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-56.4	-41.8	173.2	-79.1	172	0	0	0	111.4	I245 L246 R249 M253 V279 I280 M307	I245-I283 HydrophobicContact CG2-CG2 4.27Å; L246-I283 HydrophobicContact CD1-CG2 4.43Å; L246-I283 HydrophobicContact CD2-CD1 4.38Å; L246-I283 HydrophobicContact CG-CD1 4.05Å; L246-I283 HydrophobicContact CG-CG2 4.23Å; R249-I283 HydrophobicContact CB-CG2 3.85Å; R249-I283 HydrophobicContact CG-CG2 4.12Å; R249-I283 WeakPolarHBondContact CG-O 3.37Å; R249-I283 PolarHBondContact NE-O 2.79Å; M253-I283 HydrophobicContact CE-CD1 3.87Å; M253-I283 HydrophobicContact SD-CD1 4.15Å; V279-I283 HydrophobicContact CG1-CD1 4.1Å; V279-I283 WeakPolarHBondContact O-CG1 3.3Å; V279-I283 PolarHBondContact O-N 2.69Å; I280-I283 WeakPolarHBondContact O-CB 3.25Å; I280-I283 PolarHBondContact O-N 3.41Å; I280-I283 VanDerWaalsContact O-N 3.17Å; I283-M307 HydrophobicContact CD1-CE 4.49Å; I283-M307 HydrophobicContact CG1-CE 3.69Å; I283-M307 HydrophobicContact CG1-SD 4.34Å
284	Y	90.9	Very high	92.7	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-83.5	-16.6	-176.4	-80.9	-117.4	0	0	0	114.3	F218 L222 H242 I245 L246 I280 S281 Y282 F603	F218-Y284 HydrophobicContact CB-CD1 4.33Å; F218-Y284 VanDerWaalsContact CB-O 3.29Å; F218-Y284 WeakPolarHBondContact CB-O 3.42Å; L222-Y284 HydrophobicContact CB-CD1 3.69Å; L222-Y284 HydrophobicContact CB-CE1 3.88Å; L222-Y284 HydrophobicContact CB-CG 4.21Å; L222-Y284 HydrophobicContact CD1-CD1 4.41Å; L222-Y284 HydrophobicContact CD1-CD2 4.45Å; L222-Y284 HydrophobicContact CD1-CE1 4.06Å; L222-Y284 HydrophobicContact CD1-CE2 4.12Å; L222-Y284 HydrophobicContact CD2-CD1 4.37Å; L222-Y284 HydrophobicContact CD2-CD2 4.26Å; L222-Y284 HydrophobicContact CD2-CG 4.05Å; L222-Y284 HydrophobicContact CG-CD1 4.37Å; L222-Y284 HydrophobicContact CG-CE1 4.46Å; H242-Y284 WeakPolarHBondContact CB-OH 3.41Å; H242-Y284 PolarHBondContact N-OH 3.07Å; H242-Y284 AromaticContact ND1-CE1 3.79Å; H242-Y284 AromaticContact ND1-CZ 3.75Å; H242-Y284 PolarHBondContact ND1-OH 3Å; I245-Y284 HydrophobicContact CB-CE1 4.3Å; I245-Y284 HydrophobicContact CB-CE2 4.24Å; I245-Y284 HydrophobicContact CD1-CD1 4.16Å; I245-Y284 HydrophobicContact CD1-CE1 3.49Å; I245-Y284 VanDerWaalsContact CD1-CE1 3.49Å; I245-Y284 HydrophobicContact CG1-CE1 4.47Å; I245-Y284 HydrophobicContact CG2-CD1 4.08Å; I245-Y284 HydrophobicContact CG2-CD2 3.87Å; I245-Y284 HydrophobicContact CG2-CE1 3.94Å; I245-Y284 HydrophobicContact CG2-CE2 3.72Å; I245-Y284 HydrophobicContact CG2-CG 4.08Å; L246-Y284 HydrophobicContact CD1-CE2 3.83Å; I280-Y284 HydrophobicContact CG2-CD2 4.02Å; I280-Y284 HydrophobicContact CG2-CE2 3.82Å; I280-Y284 WeakPolarHBondContact O-CD2 3.25Å; I280-Y284 PolarHBondContact O-N 3.49Å; S281-Y284 PolarHBondContact O-N 3.21Å; Y282-Y284 VanDerWaalsContact C-N 3.26Å; Y282-Y284 PolarHBondContact O-N 3.49Å; Y284-F603 WeakPolarHBondContact O-CE2 3.27Å; Y284-F603 WeakPolarHBondContact O-CZ 3.06Å
285	T	89	Confident	92.7	Very high	4 Å²	4	31 Å²	31	3%	0.025	17%	0.171	C	C	.	.	H	α-helix	trans	-142.6	-3.9	-169.7	67	0	0	0	0	116.6	V215 E219 S281 Y282 K287	V215-T285 HydrophobicContact CG1-CG2 4.19Å; V215-T285 WeakPolarHBondContact CG1-O 3.47Å; E219-T285 HydrophobicContact CB-CG2 3.74Å; E219-T285 HydrophobicContact CG-CG2 4.07Å; S281-T285 PolarHBondContact O-N 3.11Å; S281-T285 PolarHBondContact O-OG1 2.9Å; Y282-T285 PolarHBondContact O-N 2.98Å; T285-K287 PolarHBondContact O-N 2.67Å; T285-K287 VanDerWaalsContact O-N 3.12Å; T285-K287 PolarHBondContact OG1-N 3.34Å; T285-K287 VanDerWaalsContact OG1-N 3.13Å; T285-K287 PolarHBondContact OG1-O 2.88Å
286	D	88.2	Confident	92.7	Very high	16 Å²	16	33.2 Å²	33.2	9%	0.086	18%	0.181	C	C	.	.	S	Bend	trans	53.3	18.2	-163.4	-91.4	-48.1	0	0	0	113.5	R249 Y282 F603	R249-D286 IonicContact CZ-OD2 3.65Å; R249-D286 IonicContact NH1-OD2 2.71Å; R249-D286 PolarHBondContact NH1-OD2 3.33Å; R249-D286 IonicContact NH2-OD1 3.28Å; R249-D286 PolarHBondContact NH2-OD1 2.84Å; R249-D286 IonicContact NH2-OD2 3.14Å; R249-D286 PolarHBondContact NH2-OD2 3.31Å; Y282-D286 VanDerWaalsContact CE1-OD1 3.25Å; Y282-D286 WeakPolarHBondContact CE1-OD1 3.25Å; Y282-D286 WeakPolarHBondContact CE2-O 3.4Å; Y282-D286 VanDerWaalsContact O-CA 3.27Å; Y282-D286 WeakPolarHBondContact O-CA 3.3Å; Y282-D286 PolarHBondContact O-N 3.4Å; Y282-D286 PolarHBondContact OH-OD1 3.15Å; D286-F603 HydrophobicContact CB-CD2 4.43Å; D286-F603 WeakPolarHBondContact OD2-CB 3.22Å; D286-F603 WeakPolarHBondContact OD2-CD2 3.5Å
287	K	89	Confident	92.8	Very high	102 Å²	102	36.6 Å²	36.6	44%	0.443	20%	0.197	S	C	.	.			trans	-134.7	133.6	-178.6	-60.3	169.3	-171.7	177.8	0	110.5	S281 Y282 T285	S281-K287 CarbonylContact C-O 3.57Å; S281-K287 VanDerWaalsContact C-O 3.31Å; S281-K287 PolarHBondContact OG-O 2.9Å; Y282-K287 WeakPolarHBondContact CA-O 3.35Å; Y282-K287 PolarHBondContact N-O 3.3Å; T285-K287 PolarHBondContact O-N 2.67Å; T285-K287 VanDerWaalsContact O-N 3.12Å; T285-K287 PolarHBondContact OG1-N 3.34Å; T285-K287 VanDerWaalsContact OG1-N 3.13Å; T285-K287 PolarHBondContact OG1-O 2.88Å
288	C	91.3	Very high	92.9	Very high	30 Å²	30	31.9 Å²	31.9	20%	0.203	18%	0.175	C	C	.	.			trans	-150.4	153.1	160.7	82.5	0	0	0	0	110.2	C278 I290	C278-C288 VanDerWaalsContact C-SG 3.54Å; C278-C288 VanDerWaalsContact CA-SG 3.59Å; C278-C288 HydrophobicContact CB-CB 3.96Å; C278-C288 WeakPolarHBondContact CB-SG 3.39Å; C278-C288 WeakPolarHBondContact O-CB 3.41Å; C278-C288 PolarHBondContact O-SG 3.28Å; C278-C288 WeakPolarHBondContact SG-CB 3.33Å; C278-C288 CovalentContact SG-SG 2.05Å; C278-C288 PolarHBondContact SG-SG 3.31Å; C288-I290 PolarHBondContact O-N 2.91Å
289	T	91.4	Very high	93	Very high	121 Å²	121	31.6 Å²	31.6	74%	0.742	17%	0.173	S	C	*	.			trans	-84.2	109	175.6	-54.7	0	0	0	0	108.2	C278 T291	C278-T289 PolarHBondContact SG-O 3.19Å; T289-T291 HydrophobicContact CG2-CG2 4.39Å
290	I	93.9	Very high	93	Very high	17 Å²	17	36 Å²	36	9%	0.087	19%	0.189	C	C	.	.			trans	-91.2	128.4	173.6	-50.7	177.6	0	0	0	107	C288 I294 A295 V298 L310 N313 A314 E317	C288-I290 PolarHBondContact O-N 2.91Å; I290-I294 HydrophobicContact CG2-CG1 4.38Å; I290-A295 HydrophobicContact CG2-CB 3.63Å; I290-V298 HydrophobicContact CD1-CG1 4.05Å; I290-V298 HydrophobicContact CG1-CG1 4.28Å; I290-L310 HydrophobicContact CD1-CD1 4.05Å; I290-N313 HydrophobicContact CD1-CB 3.68Å; I290-A314 HydrophobicContact CD1-CB 4.01Å; I290-E317 HydrophobicContact CB-CB 4.5Å; I290-E317 HydrophobicContact CB-CG 4.32Å; I290-E317 HydrophobicContact CG2-CB 4.13Å; I290-E317 HydrophobicContact CG2-CG 4.06Å
291	T	92.5	Very high	93	Very high	50 Å²	50	35.7 Å²	35.7	31%	0.307	19%	0.188	S	C	.	.			trans	-109.3	157.1	172.6	56.5	0	0	0	0	110.2	T289 D293 I294 A295	T289-T291 HydrophobicContact CG2-CG2 4.39Å; T291-D293 WeakPolarHBondContact CB-OD1 3.48Å; T291-D293 PolarHBondContact O-N 2.83Å; T291-D293 VanDerWaalsContact O-N 3.14Å; T291-D293 PolarHBondContact OG1-OD1 3.18Å; T291-I294 WeakPolarHBondContact O-CG1 3.5Å; T291-I294 PolarHBondContact O-N 3.01Å; T291-I294 VanDerWaalsContact O-N 3.13Å; T291-A295 WeakPolarHBondContact O-CB 3.43Å; T291-A295 PolarHBondContact O-N 2.85Å
292	P	89.8	Confident	93.1	Very high	38 Å²	38	34 Å²	34	25%	0.247	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-25.8	-169.2	-25.9	36.8	0	0	0	115.1	Y321 R330	P292-Y321 HydrophobicContact CB-CD1 4.27Å; P292-Y321 HydrophobicContact CB-CD2 4.12Å; P292-Y321 HydrophobicContact CB-CG 3.92Å; P292-Y321 HydrophobicContact CG-CD1 3.75Å; P292-Y321 HydrophobicContact CG-CD2 3.48Å; P292-Y321 VanDerWaalsContact CG-CD2 3.48Å; P292-Y321 HydrophobicContact CG-CE1 3.79Å; P292-Y321 HydrophobicContact CG-CE2 3.54Å; P292-Y321 HydrophobicContact CG-CG 3.59Å; P292-R330 PolarHBondContact O-NH2 3.5Å
293	D	92.9	Very high	92.9	Very high	108 Å²	108	37.1 Å²	37.1	58%	0.578	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-44.1	175.6	53.6	-49.7	0	0	0	112.4	T291	T291-D293 WeakPolarHBondContact CB-OD1 3.48Å; T291-D293 PolarHBondContact O-N 2.83Å; T291-D293 VanDerWaalsContact O-N 3.14Å; T291-D293 PolarHBondContact OG1-OD1 3.18Å
294	I	95.2	Very high	92.9	Very high	11 Å²	11	41.8 Å²	41.8	6%	0.056	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-14	179.1	71.5	176.5	0	0	0	113.5	Q274 C278 I290 T291 E296 E297 V298	Q274-I294 HydrophobicContact CB-CG2 3.83Å; C278-I294 HydrophobicContact CB-CD1 4.34Å; I290-I294 HydrophobicContact CG2-CG1 4.38Å; T291-I294 WeakPolarHBondContact O-CG1 3.5Å; T291-I294 PolarHBondContact O-N 3.01Å; T291-I294 VanDerWaalsContact O-N 3.13Å; I294-E296 VanDerWaalsContact C-N 3.25Å; I294-E296 PolarHBondContact O-N 3.19Å; I294-E296 VanDerWaalsContact O-N 3.13Å; I294-E297 PolarHBondContact O-N 3.49Å; I294-V298 HydrophobicContact CB-CG2 4.27Å; I294-V298 HydrophobicContact CD1-CG2 4.03Å; I294-V298 HydrophobicContact CG1-CG2 3.96Å; I294-V298 WeakPolarHBondContact O-CG2 3.49Å; I294-V298 PolarHBondContact O-N 3.41Å
295	A	95.8	Very high	92.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.2	-32.1	-168.9	0	0	0	0	0	114.2	I290 T291 L299 E317 L318	I290-A295 HydrophobicContact CG2-CB 3.63Å; T291-A295 WeakPolarHBondContact O-CB 3.43Å; T291-A295 PolarHBondContact O-N 2.85Å; A295-L299 WeakPolarHBondContact O-CB 3.32Å; A295-L299 PolarHBondContact O-N 3.39Å; A295-E317 HydrophobicContact CB-CB 4.22Å; A295-E317 HydrophobicContact CB-CG 4.3Å; A295-L318 HydrophobicContact CB-CD2 3.72Å; A295-L318 HydrophobicContact CB-CG 3.79Å
296	E	95.4	Very high	93	Very high	47 Å²	47	48.9 Å²	48.9	22%	0.22	25%	0.249	C	C	.	.	H	α-helix	trans	-71.3	-42.9	175.2	175.5	163.6	166.6	0	0	112.4	I294 L299 R300 L318 R330 L333	I294-E296 VanDerWaalsContact C-N 3.25Å; I294-E296 PolarHBondContact O-N 3.19Å; I294-E296 VanDerWaalsContact O-N 3.13Å; E296-L299 PolarHBondContact O-N 2.77Å; E296-R300 WeakPolarHBondContact O-CG 3.09Å; E296-R300 PolarHBondContact O-N 3.16Å; E296-R300 IonicContact OE1-CZ 2.66Å; E296-R300 IonicContact OE1-NE 2.81Å; E296-R300 PolarHBondContact OE1-NE 3.02Å; E296-R300 VanDerWaalsContact OE1-NE 3.13Å; E296-R300 IonicContact OE1-NH2 2.76Å; E296-R300 PolarHBondContact OE1-NH2 3.13Å; E296-L318 HydrophobicContact CB-CD2 4.35Å; E296-R330 IonicContact OE2-NH1 3.94Å; E296-R330 PolarHBondContact OE2-NH1 3.06Å; E296-R330 VanDerWaalsContact OE2-NH1 3.11Å; E296-L333 HydrophobicContact CB-CD2 4.12Å; E296-L333 HydrophobicContact CG-CD1 3.77Å; E296-L333 HydrophobicContact CG-CD2 3.74Å; E296-L333 HydrophobicContact CG-CG 4.38Å
297	E	95.6	Very high	93.1	Very high	70 Å²	70	48.9 Å²	48.9	33%	0.327	25%	0.248	S	C	.	.	H	α-helix	trans	-66.2	-42.2	175.5	-70.7	-171	-160.6	0	0	111.3	S272 A275 I294 L299 R300 A301	S272-E297 WeakPolarHBondContact CB-OE2 3.24Å; S272-E297 PolarHBondContact N-OE2 2.86Å; S272-E297 PolarHBondContact OG-OE2 2.8Å; A275-E297 HydrophobicContact CB-CB 3.64Å; I294-E297 PolarHBondContact O-N 3.49Å; E297-L299 VanDerWaalsContact C-N 3.31Å; E297-L299 PolarHBondContact O-N 3.42Å; E297-R300 PolarHBondContact O-N 3.43Å; E297-A301 WeakPolarHBondContact O-CB 3.14Å; E297-A301 PolarHBondContact O-N 3.2Å
298	V	97.1	Very high	93.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.2	-38.3	175.5	176.4	0	0	0	0	111.1	A275 C278 I290 I294 A302 L310 A314	A275-V298 HydrophobicContact CB-CG2 4.09Å; C278-V298 HydrophobicContact CB-CG2 3.98Å; I290-V298 HydrophobicContact CD1-CG1 4.05Å; I290-V298 HydrophobicContact CG1-CG1 4.28Å; I294-V298 HydrophobicContact CB-CG2 4.27Å; I294-V298 HydrophobicContact CD1-CG2 4.03Å; I294-V298 HydrophobicContact CG1-CG2 3.96Å; I294-V298 WeakPolarHBondContact O-CG2 3.49Å; I294-V298 PolarHBondContact O-N 3.41Å; V298-A302 WeakPolarHBondContact O-CB 3.25Å; V298-A302 PolarHBondContact O-N 2.94Å; V298-L310 HydrophobicContact CG1-CD1 3.83Å; V298-L310 HydrophobicContact CG1-CD2 4.27Å; V298-L310 HydrophobicContact CG1-CG 3.99Å; V298-A314 HydrophobicContact CB-CB 4.47Å; V298-A314 HydrophobicContact CG1-CB 4.2Å
299	L	96.5	Very high	93.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.9	-49.2	172.7	177.1	55.5	0	0	0	111.5	A295 E296 E297 A301 A302 Q303 A311 A314 E315 L318 L333 V337 L342	A295-L299 WeakPolarHBondContact O-CB 3.32Å; A295-L299 PolarHBondContact O-N 3.39Å; E296-L299 PolarHBondContact O-N 2.77Å; E297-L299 VanDerWaalsContact C-N 3.31Å; E297-L299 PolarHBondContact O-N 3.42Å; L299-A301 PolarHBondContact O-N 3.25Å; L299-A302 PolarHBondContact O-N 3.44Å; L299-Q303 HydrophobicContact CD1-CG 4.4Å; L299-Q303 WeakPolarHBondContact O-CG 3.46Å; L299-Q303 PolarHBondContact O-N 3.19Å; L299-A311 HydrophobicContact CD1-CB 3.85Å; L299-A314 HydrophobicContact CB-CB 3.82Å; L299-E315 HydrophobicContact CD1-CG 3.87Å; L299-E315 HydrophobicContact CD2-CG 4.22Å; L299-L318 HydrophobicContact CB-CD1 4.28Å; L299-L318 HydrophobicContact CD2-CD1 3.61Å; L299-L333 HydrophobicContact CD2-CD2 4.27Å; L299-L333 HydrophobicContact CD2-CG 4.44Å; L299-V337 HydrophobicContact CD2-CG1 4.39Å; L299-V337 HydrophobicContact CD2-CG2 4.05Å; L299-V337 HydrophobicContact CG-CG1 4.5Å; L299-L342 HydrophobicContact CD2-CD2 4.46Å
300	R	95.1	Very high	93.3	Very high	92 Å²	92	45.7 Å²	45.7	35%	0.347	23%	0.231	S	C	.	.	H	α-helix	trans	-62.8	-41.5	179.1	-68.5	171.3	-175.9	-79.6	5.3	111.9	F271 E296 E297 Q303 N304	F271-R300 HydrophobicContact CE1-CB 3.91Å; E296-R300 WeakPolarHBondContact O-CG 3.09Å; E296-R300 PolarHBondContact O-N 3.16Å; E296-R300 IonicContact OE1-CZ 2.66Å; E296-R300 IonicContact OE1-NE 2.81Å; E296-R300 PolarHBondContact OE1-NE 3.02Å; E296-R300 VanDerWaalsContact OE1-NE 3.13Å; E296-R300 IonicContact OE1-NH2 2.76Å; E296-R300 PolarHBondContact OE1-NH2 3.13Å; E297-R300 PolarHBondContact O-N 3.43Å; R300-Q303 PolarHBondContact O-N 3.21Å; R300-N304 PolarHBondContact O-N 3.48Å; R300-N304 PolarHBondContact O-OD1 3.29Å
301	A	94.5	Very high	93.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.8	-45	174.8	0	0	0	0	0	111.9	F271 V279 E297 L299 Q303 N304 Y305	F271-A301 HydrophobicContact CD1-CB 4.18Å; F271-A301 HydrophobicContact CD2-CB 3.92Å; F271-A301 HydrophobicContact CE1-CB 3.92Å; F271-A301 HydrophobicContact CE2-CB 3.6Å; F271-A301 HydrophobicContact CG-CB 4.2Å; F271-A301 HydrophobicContact CZ-CB 3.64Å; V279-A301 HydrophobicContact CG2-CB 3.76Å; E297-A301 WeakPolarHBondContact O-CB 3.14Å; E297-A301 PolarHBondContact O-N 3.2Å; L299-A301 PolarHBondContact O-N 3.25Å; A301-Q303 PolarHBondContact O-N 3.22Å; A301-N304 PolarHBondContact O-N 2.93Å; A301-Y305 HydrophobicContact CB-CD2 4.28Å; A301-Y305 HydrophobicContact CB-CE2 4.2Å; A301-Y305 WeakPolarHBondContact O-CB 3.4Å; A301-Y305 WeakPolarHBondContact O-CD2 3.29Å; A301-Y305 PolarHBondContact O-N 3.25Å
302	A	94.4	Very high	93.4	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-61.8	-29.9	175.7	0	0	0	0	0	112.7	V298 L299 E306 M307 L310 A311	V298-A302 WeakPolarHBondContact O-CB 3.25Å; V298-A302 PolarHBondContact O-N 2.94Å; L299-A302 PolarHBondContact O-N 3.44Å; A302-E306 PolarHBondContact O-N 3.11Å; A302-M307 HydrophobicContact CB-CB 4.23Å; A302-M307 PolarHBondContact O-N 2.98Å; A302-L310 HydrophobicContact CB-CB 3.98Å; A302-L310 HydrophobicContact CB-CD2 4.03Å; A302-L310 HydrophobicContact CB-CG 3.85Å; A302-A311 HydrophobicContact CB-CB 3.81Å
303	Q	91.5	Very high	93.5	Very high	73 Å²	73	50.4 Å²	50.4	34%	0.341	24%	0.244	S	C	.	.	H	α-helix	trans	-74.9	-48.4	171.8	-70.8	-167	-37.9	0	0	112.7	L299 R300 A301 Y305 E306 V337	L299-Q303 HydrophobicContact CD1-CG 4.4Å; L299-Q303 WeakPolarHBondContact O-CG 3.46Å; L299-Q303 PolarHBondContact O-N 3.19Å; R300-Q303 PolarHBondContact O-N 3.21Å; A301-Q303 PolarHBondContact O-N 3.22Å; Q303-Y305 PolarHBondContact O-N 3.35Å; Q303-Y305 VanDerWaalsContact O-N 3.16Å; Q303-E306 PolarHBondContact O-N 3.13Å; Q303-V337 PolarHBondContact NE2-O 2.76Å; Q303-V337 VanDerWaalsContact OE1-CG1 3.23Å
304	N	91.3	Very high	93.6	Very high	98 Å²	98	45.3 Å²	45.3	52%	0.524	22%	0.217	S	C	.	.	H	α-helix	trans	-59.2	-27.4	178.4	-76.4	12	0	0	0	113.2	F271 R300 A301	F271-N304 HydrophobicContact CZ-CB 4.29Å; R300-N304 PolarHBondContact O-N 3.48Å; R300-N304 PolarHBondContact O-OD1 3.29Å; A301-N304 PolarHBondContact O-N 2.93Å
305	Y	91.6	Very high	93.6	Very high	6 Å²	6	45.7 Å²	45.7	2%	0.024	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106	13.7	178.9	-56.7	-48.2	0	0	0	113.7	C250 M253 L256 F271 M276 V279 A301 Q303 M307	C250-Y305 PolarHBondContact SG-O 3Å; C250-Y305 VanDerWaalsContact SG-O 3.39Å; M253-Y305 HydrophobicContact CE-CD1 3.69Å; M253-Y305 HydrophobicContact CE-CD2 3.76Å; M253-Y305 HydrophobicContact CE-CE1 3.88Å; M253-Y305 HydrophobicContact CE-CE2 3.95Å; M253-Y305 HydrophobicContact CE-CG 3.64Å; M253-Y305 HydrophobicContact CG-CD1 4.13Å; M253-Y305 HydrophobicContact CG-CE1 4.31Å; L256-Y305 HydrophobicContact CD1-CD1 4.39Å; L256-Y305 HydrophobicContact CD1-CE1 3.86Å; F271-Y305 HydrophobicContact CD2-CE2 4.3Å; F271-Y305 AromaticContact CE2-CE2 3.88Å; F271-Y305 HydrophobicContact CE2-CE2 3.88Å; M276-Y305 HydrophobicContact CE-CE2 4.04Å; M276-Y305 HydrophobicContact SD-CE2 4.07Å; V279-Y305 HydrophobicContact CG1-CD2 4.11Å; V279-Y305 HydrophobicContact CG1-CE2 4.45Å; A301-Y305 HydrophobicContact CB-CD2 4.28Å; A301-Y305 HydrophobicContact CB-CE2 4.2Å; A301-Y305 WeakPolarHBondContact O-CB 3.4Å; A301-Y305 WeakPolarHBondContact O-CD2 3.29Å; A301-Y305 PolarHBondContact O-N 3.25Å; Q303-Y305 PolarHBondContact O-N 3.35Å; Q303-Y305 VanDerWaalsContact O-N 3.16Å; Y305-M307 VanDerWaalsContact O-CG 3.25Å; Y305-M307 WeakPolarHBondContact O-CG 3.3Å; Y305-M307 PolarHBondContact O-N 3.05Å
306	E	90.2	Very high	93.4	Very high	146 Å²	146	49.3 Å²	49.3	68%	0.682	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	44.4	52.5	-178.8	-60.6	-178	-161.6	0	0	114.8	L252 A302 Q303 P308	L252-E306 HydrophobicContact CD1-CB 3.5Å; L252-E306 VanDerWaalsContact CD1-CD 3.41Å; L252-E306 HydrophobicContact CD1-CG 3.42Å; L252-E306 VanDerWaalsContact CD1-CG 3.42Å; A302-E306 PolarHBondContact O-N 3.11Å; Q303-E306 PolarHBondContact O-N 3.13Å; E306-P308 VanDerWaalsContact C-CD 3.4Å; E306-P308 WeakPolarHBondContact O-CD 3.47Å
307	M	91.2	Very high	93.3	Very high	16 Å²	16	49 Å²	49	8%	0.079	24%	0.236	C	C	.	.			trans	-106.8	71.9	-179.9	-50	-164.6	84.7	0	0	111.1	V279 Y282 I283 A302 Y305 K309 L310 A311	V279-M307 HydrophobicContact CG1-SD 4.23Å; Y282-M307 HydrophobicContact CD1-CE 3.66Å; Y282-M307 HydrophobicContact CE1-CE 3.91Å; I283-M307 HydrophobicContact CD1-CE 4.49Å; I283-M307 HydrophobicContact CG1-CE 3.69Å; I283-M307 HydrophobicContact CG1-SD 4.34Å; A302-M307 HydrophobicContact CB-CB 4.23Å; A302-M307 PolarHBondContact O-N 2.98Å; Y305-M307 VanDerWaalsContact O-CG 3.25Å; Y305-M307 WeakPolarHBondContact O-CG 3.3Å; Y305-M307 PolarHBondContact O-N 3.05Å; M307-K309 VanDerWaalsContact C-N 3.26Å; M307-K309 PolarHBondContact O-N 3.42Å; M307-K309 VanDerWaalsContact O-N 3.11Å; M307-L310 HydrophobicContact CB-CB 4Å; M307-L310 PolarHBondContact O-N 3.46Å; M307-L310 HydrophobicContact SD-CD2 4.19Å; M307-A311 PolarHBondContact O-N 3.28Å
308	P	90.5	Very high	93.3	Very high	98 Å²	98	45.7 Å²	45.7	64%	0.636	22%	0.221	S	C	*	.	H	α-helix	trans	-62.7	-25.9	-168.2	24.7	-36.2	0	0	0	114.6	E306 R312	E306-P308 VanDerWaalsContact C-CD 3.4Å; E306-P308 WeakPolarHBondContact O-CD 3.47Å; P308-R312 WeakPolarHBondContact O-CB 3.37Å; P308-R312 PolarHBondContact O-N 3.05Å
309	K	90.7	Very high	93.1	Very high	89 Å²	89	47.9 Å²	47.9	39%	0.387	23%	0.234	S	C	.	.	H	α-helix	trans	-71.1	-44.7	173.7	-71.8	-174.8	178.9	-177.3	0	111.8	Y282 M307 R312 N313 N599	Y282-K309 VanDerWaalsContact OH-CB 3.29Å; Y282-K309 WeakPolarHBondContact OH-CB 3.41Å; M307-K309 VanDerWaalsContact C-N 3.26Å; M307-K309 PolarHBondContact O-N 3.42Å; M307-K309 VanDerWaalsContact O-N 3.11Å; K309-R312 PolarHBondContact O-N 2.68Å; K309-N313 VanDerWaalsContact O-CG 3.31Å; K309-N313 PolarHBondContact O-N 2.87Å; K309-N313 PolarHBondContact O-OD1 2.95Å; K309-N599 PolarHBondContact NZ-OD1 3.13Å
310	L	94.3	Very high	92.8	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-65.5	-41.4	175.1	-179.5	60.5	0	0	0	111.1	V279 Y282 I290 V298 A302 M307 R312 N313 A314	V279-L310 HydrophobicContact CG2-CD2 3.97Å; Y282-L310 HydrophobicContact CD1-CB 4.03Å; Y282-L310 HydrophobicContact CD1-CD2 4.13Å; Y282-L310 HydrophobicContact CD1-CG 4.48Å; Y282-L310 HydrophobicContact CD2-CB 4.2Å; Y282-L310 HydrophobicContact CD2-CD1 3.76Å; Y282-L310 HydrophobicContact CD2-CG 4.42Å; Y282-L310 HydrophobicContact CE1-CB 4.06Å; Y282-L310 HydrophobicContact CE2-CB 4.17Å; Y282-L310 HydrophobicContact CE2-CD1 4.38Å; Y282-L310 HydrophobicContact CG-CB 4.15Å; Y282-L310 HydrophobicContact CG-CD1 3.9Å; Y282-L310 HydrophobicContact CG-CD2 4.04Å; Y282-L310 HydrophobicContact CG-CG 4.25Å; I290-L310 HydrophobicContact CD1-CD1 4.05Å; V298-L310 HydrophobicContact CG1-CD1 3.83Å; V298-L310 HydrophobicContact CG1-CD2 4.27Å; V298-L310 HydrophobicContact CG1-CG 3.99Å; A302-L310 HydrophobicContact CB-CB 3.98Å; A302-L310 HydrophobicContact CB-CD2 4.03Å; A302-L310 HydrophobicContact CB-CG 3.85Å; M307-L310 HydrophobicContact CB-CB 4Å; M307-L310 PolarHBondContact O-N 3.46Å; M307-L310 HydrophobicContact SD-CD2 4.19Å; L310-R312 VanDerWaalsContact C-N 3.35Å; L310-R312 PolarHBondContact O-N 3.1Å; L310-N313 PolarHBondContact O-N 3.03Å; L310-A314 PolarHBondContact O-N 2.8Å
311	A	94.5	Very high	92.6	Very high	9 Å²	9	54.5 Å²	54.5	7%	0.074	27%	0.268	C	S	.	.	H	α-helix	trans	-56.9	-47.6	173.7	0	0	0	0	0	111.1	L299 A302 M307 N313 A314 E315	L299-A311 HydrophobicContact CD1-CB 3.85Å; A302-A311 HydrophobicContact CB-CB 3.81Å; M307-A311 PolarHBondContact O-N 3.28Å; A311-N313 VanDerWaalsContact C-N 3.33Å; A311-N313 PolarHBondContact O-N 2.89Å; A311-A314 PolarHBondContact O-N 2.88Å; A311-E315 VanDerWaalsContact O-CG 3.25Å; A311-E315 WeakPolarHBondContact O-CG 3.34Å; A311-E315 PolarHBondContact O-N 3.01Å
312	R	92.8	Very high	92.4	Very high	124 Å²	124	55.5 Å²	55.5	47%	0.468	27%	0.273	S	S	.	.	H	α-helix	trans	-62.2	-36.8	176.6	-171.3	-179.5	-65.7	174.1	-1.2	113.4	P308 K309 L310 E315 N316	P308-R312 WeakPolarHBondContact O-CB 3.37Å; P308-R312 PolarHBondContact O-N 3.05Å; K309-R312 PolarHBondContact O-N 2.68Å; L310-R312 VanDerWaalsContact C-N 3.35Å; L310-R312 PolarHBondContact O-N 3.1Å; R312-E315 WeakPolarHBondContact CA-OE2 3.17Å; R312-E315 PolarHBondContact O-N 2.88Å; R312-N316 VanDerWaalsContact O-CG 3.23Å; R312-N316 PolarHBondContact O-N 2.72Å; R312-N316 PolarHBondContact O-ND2 3.24Å; R312-N316 VanDerWaalsContact O-ND2 3.16Å
313	N	92.6	Very high	92.2	Very high	71 Å²	71	58.5 Å²	58.5	38%	0.38	29%	0.289	S	S	.	.	H	α-helix	trans	-65	-43.8	175	-67.6	-9.9	0	0	0	110.8	I290 K309 L310 A311 N316 E317	I290-N313 HydrophobicContact CD1-CB 3.68Å; K309-N313 VanDerWaalsContact O-CG 3.31Å; K309-N313 PolarHBondContact O-N 2.87Å; K309-N313 PolarHBondContact O-OD1 2.95Å; L310-N313 PolarHBondContact O-N 3.03Å; A311-N313 VanDerWaalsContact C-N 3.33Å; A311-N313 PolarHBondContact O-N 2.89Å; N313-N316 PolarHBondContact O-N 3.12Å; N313-E317 PolarHBondContact O-N 3.23Å
314	A	95.3	Very high	91.9	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.5	-42.2	175.6	0	0	0	0	0	112.3	I290 V298 L299 L310 A311 N316 E317 L318	I290-A314 HydrophobicContact CD1-CB 4.01Å; V298-A314 HydrophobicContact CB-CB 4.47Å; V298-A314 HydrophobicContact CG1-CB 4.2Å; L299-A314 HydrophobicContact CB-CB 3.82Å; L310-A314 PolarHBondContact O-N 2.8Å; A311-A314 PolarHBondContact O-N 2.88Å; A314-N316 VanDerWaalsContact C-N 3.33Å; A314-N316 PolarHBondContact O-N 3.11Å; A314-E317 PolarHBondContact O-N 2.81Å; A314-L318 WeakPolarHBondContact O-CB 3Å; A314-L318 WeakPolarHBondContact O-CD1 3.42Å; A314-L318 WeakPolarHBondContact O-CG 3.35Å; A314-L318 PolarHBondContact O-N 3.29Å
315	E	94.4	Very high	91.7	Very high	19 Å²	19	63.1 Å²	63.1	9%	0.089	31%	0.307	C	S	.	.	H	α-helix	trans	-56.9	-44.1	173	-70.8	167.6	158.1	0	0	112	L299 A311 R312 L318 V319 S339 V341	L299-E315 HydrophobicContact CD1-CG 3.87Å; L299-E315 HydrophobicContact CD2-CG 4.22Å; A311-E315 VanDerWaalsContact O-CG 3.25Å; A311-E315 WeakPolarHBondContact O-CG 3.34Å; A311-E315 PolarHBondContact O-N 3.01Å; R312-E315 WeakPolarHBondContact CA-OE2 3.17Å; R312-E315 PolarHBondContact O-N 2.88Å; E315-L318 PolarHBondContact O-N 3.07Å; E315-V319 WeakPolarHBondContact O-CB 3.33Å; E315-V319 VanDerWaalsContact O-CG2 3.24Å; E315-V319 WeakPolarHBondContact O-CG2 2.61Å; E315-V319 PolarHBondContact O-N 3.27Å; E315-S339 WeakPolarHBondContact CG-OG 3.17Å; E315-S339 WeakPolarHBondContact OE1-CB 3.49Å; E315-S339 PolarHBondContact OE1-OG 2.81Å; E315-V341 HydrophobicContact CB-CB 4.17Å; E315-V341 HydrophobicContact CB-CG1 3.97Å; E315-V341 HydrophobicContact CG-CB 4.45Å; E315-V341 VanDerWaalsContact OE2-CB 3.3Å; E315-V341 WeakPolarHBondContact OE2-CB 3.32Å; E315-V341 WeakPolarHBondContact OE2-CG2 3.43Å
316	N	92.4	Very high	91.6	Very high	76 Å²	76	64 Å²	64	41%	0.406	31%	0.312	S	S	.	.	H	α-helix	trans	-64.5	-43.1	177.7	-72	-32	0	0	0	111.7	R312 N313 A314 V319 L320	R312-N316 VanDerWaalsContact O-CG 3.23Å; R312-N316 PolarHBondContact O-N 2.72Å; R312-N316 PolarHBondContact O-ND2 3.24Å; R312-N316 VanDerWaalsContact O-ND2 3.16Å; N313-N316 PolarHBondContact O-N 3.12Å; A314-N316 VanDerWaalsContact C-N 3.33Å; A314-N316 PolarHBondContact O-N 3.11Å; N316-V319 PolarHBondContact O-N 2.86Å; N316-L320 WeakPolarHBondContact O-CG 3.23Å; N316-L320 PolarHBondContact O-N 3.13Å
317	E	93.8	Very high	91.5	Very high	41 Å²	41	57 Å²	57	19%	0.192	28%	0.28	C	S	.	.	H	α-helix	trans	-62.1	-45.5	177.3	-159.7	63.1	-157.8	0	0	111.2	I290 A295 N313 A314 V319 L320 Y321	I290-E317 HydrophobicContact CB-CB 4.5Å; I290-E317 HydrophobicContact CB-CG 4.32Å; I290-E317 HydrophobicContact CG2-CB 4.13Å; I290-E317 HydrophobicContact CG2-CG 4.06Å; A295-E317 HydrophobicContact CB-CB 4.22Å; A295-E317 HydrophobicContact CB-CG 4.3Å; N313-E317 PolarHBondContact O-N 3.23Å; A314-E317 PolarHBondContact O-N 2.81Å; E317-V319 VanDerWaalsContact C-N 3.25Å; E317-V319 PolarHBondContact O-N 2.65Å; E317-L320 PolarHBondContact O-N 3.37Å; E317-Y321 WeakPolarHBondContact O-CD2 3.34Å; E317-Y321 PolarHBondContact O-N 3.06Å; E317-Y321 VanDerWaalsContact OE1-CE2 3.28Å; E317-Y321 WeakPolarHBondContact OE1-CE2 3.45Å
318	L	94.1	Very high	91.4	Very high	1 Å²	1	57 Å²	57	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-59.3	-34.4	174.4	-69.2	166	0	0	0	112.8	A295 E296 L299 A314 E315 L333 L342	A295-L318 HydrophobicContact CB-CD2 3.72Å; A295-L318 HydrophobicContact CB-CG 3.79Å; E296-L318 HydrophobicContact CB-CD2 4.35Å; L299-L318 HydrophobicContact CB-CD1 4.28Å; L299-L318 HydrophobicContact CD2-CD1 3.61Å; A314-L318 WeakPolarHBondContact O-CB 3Å; A314-L318 WeakPolarHBondContact O-CD1 3.42Å; A314-L318 WeakPolarHBondContact O-CG 3.35Å; A314-L318 PolarHBondContact O-N 3.29Å; E315-L318 PolarHBondContact O-N 3.07Å; L318-L333 HydrophobicContact CD1-CD2 3.81Å; L318-L333 HydrophobicContact CD2-CD2 4.43Å; L318-L342 HydrophobicContact CB-CD1 3.85Å; L318-L342 HydrophobicContact CD1-CD2 4.27Å
319	V	93.4	Very high	91.4	Very high	45 Å²	45	54.9 Å²	54.9	27%	0.273	27%	0.27	S	S	.	.	H	α-helix	trans	-77.5	-31.8	177.9	169.4	0	0	0	0	112.7	E315 N316 E317 Y321 L322 L342	E315-V319 WeakPolarHBondContact O-CB 3.33Å; E315-V319 VanDerWaalsContact O-CG2 3.24Å; E315-V319 WeakPolarHBondContact O-CG2 2.61Å; E315-V319 PolarHBondContact O-N 3.27Å; N316-V319 PolarHBondContact O-N 2.86Å; E317-V319 VanDerWaalsContact C-N 3.25Å; E317-V319 PolarHBondContact O-N 2.65Å; V319-Y321 VanDerWaalsContact C-N 3.28Å; V319-Y321 PolarHBondContact O-N 2.66Å; V319-L322 HydrophobicContact CB-CD1 4.44Å; V319-L322 HydrophobicContact CG1-CD1 4.32Å; V319-L322 HydrophobicContact CG2-CD1 4.43Å; V319-L342 HydrophobicContact CG2-CD1 3.68Å
320	L	90.9	Very high	91.4	Very high	107 Å²	107	52 Å²	52	56%	0.56	26%	0.256	S	S	*	.	H	α-helix	trans	-64.9	-33.9	176.4	-75.7	171.3	0	0	0	112.1	N316 E317	N316-L320 WeakPolarHBondContact O-CG 3.23Å; N316-L320 PolarHBondContact O-N 3.13Å; E317-L320 PolarHBondContact O-N 3.37Å
321	Y	90.5	Very high	91.3	Very high	125 Å²	125	52 Å²	52	49%	0.49	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	39.6	-177.6	-67.6	-94.9	0	0	0	112.7	P292 E317 V319 N326	P292-Y321 HydrophobicContact CB-CD1 4.27Å; P292-Y321 HydrophobicContact CB-CD2 4.12Å; P292-Y321 HydrophobicContact CB-CG 3.92Å; P292-Y321 HydrophobicContact CG-CD1 3.75Å; P292-Y321 HydrophobicContact CG-CD2 3.48Å; P292-Y321 VanDerWaalsContact CG-CD2 3.48Å; P292-Y321 HydrophobicContact CG-CE1 3.79Å; P292-Y321 HydrophobicContact CG-CE2 3.54Å; P292-Y321 HydrophobicContact CG-CG 3.59Å; E317-Y321 WeakPolarHBondContact O-CD2 3.34Å; E317-Y321 PolarHBondContact O-N 3.06Å; E317-Y321 VanDerWaalsContact OE1-CE2 3.28Å; E317-Y321 WeakPolarHBondContact OE1-CE2 3.45Å; V319-Y321 VanDerWaalsContact C-N 3.28Å; V319-Y321 PolarHBondContact O-N 2.66Å; Y321-N326 PolarHBondContact O-ND2 3.06Å
322	L	90.6	Very high	91	Very high	20 Å²	20	55.4 Å²	55.4	11%	0.105	27%	0.269	C	S	.	.			trans	-77.3	129.3	169	-73.6	168.2	0	0	0	111	V319 I327 R330 I346 Y349	V319-L322 HydrophobicContact CB-CD1 4.44Å; V319-L322 HydrophobicContact CG1-CD1 4.32Å; V319-L322 HydrophobicContact CG2-CD1 4.43Å; L322-I327 HydrophobicContact CD2-CD1 4.04Å; L322-R330 HydrophobicContact CD2-CB 3.96Å; L322-R330 HydrophobicContact CD2-CG 3.82Å; L322-I346 HydrophobicContact CD1-CG1 4.2Å; L322-I346 HydrophobicContact CD2-CG1 3.98Å; L322-Y349 HydrophobicContact CB-CD2 3.59Å; L322-Y349 HydrophobicContact CB-CE2 4.06Å; L322-Y349 HydrophobicContact CB-CG 3.95Å; L322-Y349 HydrophobicContact CD1-CG 4.41Å; L322-Y349 WeakPolarHBondContact O-CE2 3.32Å
323	D	89.5	Confident	91	Very high	65 Å²	65	49.6 Å²	49.6	35%	0.348	25%	0.248	S	C	.	.			trans	-139.6	-177.6	174.5	61.6	48.4	0	0	0	110.9	E325 N326 I327 Y349	D323-E325 WeakPolarHBondContact OD1-CA 3.33Å; D323-E325 PolarHBondContact OD1-N 3.17Å; D323-N326 PolarHBondContact N-ND2 2.96Å; D323-N326 PolarHBondContact N-OD1 3.46Å; D323-N326 WeakPolarHBondContact OD1-CB 3.32Å; D323-N326 VanDerWaalsContact OD1-CG 3.24Å; D323-N326 PolarHBondContact OD1-N 3.4Å; D323-N326 PolarHBondContact OD1-ND2 3.18Å; D323-N326 VanDerWaalsContact OD1-ND2 3.09Å; D323-N326 PolarHBondContact OD2-ND2 2.9Å; D323-I327 WeakPolarHBondContact O-CB 3.22Å; D323-I327 PolarHBondContact O-N 2.97Å; D323-Y349 VanDerWaalsContact C-OH 3.28Å; D323-Y349 WeakPolarHBondContact CA-OH 3.47Å
324	E	85.2	Confident	90.9	Very high	91 Å²	91	46.2 Å²	46.2	43%	0.425	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-32.5	-178.5	-61.4	-178.5	-144.7	0	0	112.7	I327 Y349 H355 V356	E324-I327 WeakPolarHBondContact O-CG2 3.16Å; E324-Y349 PolarHBondContact N-OH 3.29Å; E324-H355 IonicContact OE1-CD2 2.98Å; E324-H355 IonicContact OE1-CE1 3.09Å; E324-H355 IonicContact OE1-NE2 3.92Å; E324-H355 PolarHBondContact OE1-NE2 2.82Å; E324-H355 IonicContact OE2-CD2 3.86Å; E324-H355 IonicContact OE2-NE2 2Å; E324-H355 PolarHBondContact OE2-NE2 3.08Å; E324-V356 HydrophobicContact CG-CG2 3.98Å
325	E	86.6	Confident	90.6	Very high	177 Å²	177	49.9 Å²	49.9	83%	0.827	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-35.3	-177.4	-57.8	-178.1	-177.1	0	0	111.3	D323	D323-E325 WeakPolarHBondContact OD1-CA 3.33Å; D323-E325 PolarHBondContact OD1-N 3.17Å
326	N	89.9	Confident	90.3	Very high	23 Å²	23	52.6 Å²	52.6	12%	0.123	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-14.7	-175.7	79.8	50.8	0	0	0	114.6	Y321 D323 A328 S329 R330	Y321-N326 PolarHBondContact O-ND2 3.06Å; D323-N326 PolarHBondContact N-ND2 2.96Å; D323-N326 PolarHBondContact N-OD1 3.46Å; D323-N326 WeakPolarHBondContact OD1-CB 3.32Å; D323-N326 VanDerWaalsContact OD1-CG 3.24Å; D323-N326 PolarHBondContact OD1-N 3.4Å; D323-N326 PolarHBondContact OD1-ND2 3.18Å; D323-N326 VanDerWaalsContact OD1-ND2 3.09Å; D323-N326 PolarHBondContact OD2-ND2 2.9Å; N326-A328 PolarHBondContact O-N 2.74Å; N326-S329 PolarHBondContact O-N 3.44Å; N326-S329 PolarHBondContact O-OG 3.19Å; N326-R330 HydrophobicContact CB-CG 4.49Å; N326-R330 WeakPolarHBondContact O-CG 3.39Å; N326-R330 PolarHBondContact O-N 3.25Å; N326-R330 WeakPolarHBondContact OD1-CG 3.44Å
327	I	89.2	Confident	90.1	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-52.4	-37.8	-176	-160.5	63.7	0	0	0	112.6	L322 D323 E324 R330 I331 I346 Y349 V356	L322-I327 HydrophobicContact CD2-CD1 4.04Å; D323-I327 WeakPolarHBondContact O-CB 3.22Å; D323-I327 PolarHBondContact O-N 2.97Å; E324-I327 WeakPolarHBondContact O-CG2 3.16Å; I327-R330 PolarHBondContact O-N 3.09Å; I327-I331 HydrophobicContact CG1-CD1 3.96Å; I327-I331 WeakPolarHBondContact O-CB 3.26Å; I327-I331 WeakPolarHBondContact O-CD1 3.41Å; I327-I331 WeakPolarHBondContact O-CG1 3.48Å; I327-I331 PolarHBondContact O-N 2.91Å; I327-I346 HydrophobicContact CD1-CB 4.49Å; I327-I346 HydrophobicContact CD1-CG1 4.37Å; I327-I346 HydrophobicContact CD1-CG2 3.92Å; I327-Y349 HydrophobicContact CD1-CD1 3.67Å; I327-Y349 HydrophobicContact CD1-CE1 4.22Å; I327-Y349 HydrophobicContact CD1-CG 4.36Å; I327-Y349 HydrophobicContact CG1-CD1 4.37Å; I327-V356 HydrophobicContact CG1-CG1 4.28Å; I327-V356 HydrophobicContact CG2-CG1 3.8Å
328	A	88.2	Confident	89.7	Confident	16 Å²	16	50.1 Å²	50.1	13%	0.132	27%	0.272	C	S	.	.	H	α-helix	trans	-66.1	-42.8	-179.7	0	0	0	0	0	113.5	N326 K332 I365	N326-A328 PolarHBondContact O-N 2.74Å; A328-K332 WeakPolarHBondContact O-CG 3.42Å; A328-K332 PolarHBondContact O-N 3.5Å; A328-I365 HydrophobicContact CB-CD1 3.61Å; A328-I365 HydrophobicContact CB-CG1 3.78Å
329	S	89.8	Confident	89.4	Confident	53 Å²	53	50.3 Å²	50.3	37%	0.371	27%	0.273	S	S	.	.	H	α-helix	trans	-71.2	-39.9	176	64	0	0	0	0	110.7	N326 I331 K332 L333	N326-S329 PolarHBondContact O-N 3.44Å; N326-S329 PolarHBondContact O-OG 3.19Å; S329-I331 PolarHBondContact O-N 3.44Å; S329-K332 PolarHBondContact O-N 2.86Å; S329-L333 WeakPolarHBondContact O-CB 3.47Å; S329-L333 PolarHBondContact O-N 2.78Å
330	R	91.9	Very high	89	Confident	27 Å²	27	52 Å²	52	10%	0.102	28%	0.283	C	S	.	.	H	α-helix	trans	-65.2	-34.6	177.2	-57.1	-44.6	-173.1	-164	5.3	113	P292 E296 L322 N326 I327 L333 A334 I346	P292-R330 PolarHBondContact O-NH2 3.5Å; E296-R330 IonicContact OE2-NH1 3.94Å; E296-R330 PolarHBondContact OE2-NH1 3.06Å; E296-R330 VanDerWaalsContact OE2-NH1 3.11Å; L322-R330 HydrophobicContact CD2-CB 3.96Å; L322-R330 HydrophobicContact CD2-CG 3.82Å; N326-R330 HydrophobicContact CB-CG 4.49Å; N326-R330 WeakPolarHBondContact O-CG 3.39Å; N326-R330 PolarHBondContact O-N 3.25Å; N326-R330 WeakPolarHBondContact OD1-CG 3.44Å; I327-R330 PolarHBondContact O-N 3.09Å; R330-L333 PolarHBondContact O-N 3.4Å; R330-A334 VanDerWaalsContact O-CB 3.3Å; R330-A334 WeakPolarHBondContact O-CB 3.3Å; R330-A334 PolarHBondContact O-N 2.94Å; R330-I346 VanDerWaalsContact C-CD1 3.5Å; R330-I346 HydrophobicContact CB-CD1 3.91Å; R330-I346 HydrophobicContact CB-CG1 4.34Å; R330-I346 VanDerWaalsContact O-CD1 3.29Å; R330-I346 WeakPolarHBondContact O-CD1 3.29Å
331	I	90.7	Very high	88.9	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.6	-48.6	172.6	-74.4	163.8	0	0	0	111.1	I327 S329 L333 A334 K335 I346 I350 W362 I365 A372 I376	I327-I331 HydrophobicContact CG1-CD1 3.96Å; I327-I331 WeakPolarHBondContact O-CB 3.26Å; I327-I331 WeakPolarHBondContact O-CD1 3.41Å; I327-I331 WeakPolarHBondContact O-CG1 3.48Å; I327-I331 PolarHBondContact O-N 2.91Å; S329-I331 PolarHBondContact O-N 3.44Å; I331-L333 VanDerWaalsContact C-N 3.34Å; I331-L333 PolarHBondContact O-N 2.99Å; I331-A334 PolarHBondContact O-N 3.31Å; I331-K335 PolarHBondContact O-N 2.75Å; I331-I346 HydrophobicContact CD1-CG2 4.37Å; I331-I346 HydrophobicContact CG1-CD1 4.38Å; I331-I346 HydrophobicContact CG1-CG2 3.72Å; I331-I350 HydrophobicContact CD1-CD1 4.49Å; I331-W362 HydrophobicContact CD1-CE3 4.18Å; I331-W362 HydrophobicContact CD1-CH2 4.46Å; I331-W362 HydrophobicContact CD1-CZ3 3.6Å; I331-I365 HydrophobicContact CD1-CD1 3.76Å; I331-I365 HydrophobicContact CG2-CG2 4.18Å; I331-A372 HydrophobicContact CG2-CB 3.93Å; I331-I376 HydrophobicContact CB-CG1 4.4Å; I331-I376 HydrophobicContact CG1-CG1 4.09Å; I331-I376 HydrophobicContact CG1-CG2 4.37Å; I331-I376 HydrophobicContact CG2-CG1 3.95Å
332	K	90.1	Very high	88.9	Confident	82 Å²	82	42.7 Å²	42.7	36%	0.357	24%	0.244	S	C	.	.	H	α-helix	trans	-61.9	-42.7	176.9	-70	175.5	179	-179.9	0	111.2	A328 S329 A336 E368	A328-K332 WeakPolarHBondContact O-CG 3.42Å; A328-K332 PolarHBondContact O-N 3.5Å; S329-K332 PolarHBondContact O-N 2.86Å; K332-A336 WeakPolarHBondContact O-CB 3.28Å; K332-A336 PolarHBondContact O-N 3Å; K332-E368 IonicContact NZ-OE2 3.4Å; K332-E368 PolarHBondContact NZ-OE2 2.6Å
333	L	91.3	Very high	88.9	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-58.5	-55.6	173.9	177.7	63.4	0	0	0	111.4	E296 L299 L318 S329 R330 I331 K335 A336 V337 L342	E296-L333 HydrophobicContact CB-CD2 4.12Å; E296-L333 HydrophobicContact CG-CD1 3.77Å; E296-L333 HydrophobicContact CG-CD2 3.74Å; E296-L333 HydrophobicContact CG-CG 4.38Å; L299-L333 HydrophobicContact CD2-CD2 4.27Å; L299-L333 HydrophobicContact CD2-CG 4.44Å; L318-L333 HydrophobicContact CD1-CD2 3.81Å; L318-L333 HydrophobicContact CD2-CD2 4.43Å; S329-L333 WeakPolarHBondContact O-CB 3.47Å; S329-L333 PolarHBondContact O-N 2.78Å; R330-L333 PolarHBondContact O-N 3.4Å; I331-L333 VanDerWaalsContact C-N 3.34Å; I331-L333 PolarHBondContact O-N 2.99Å; L333-K335 VanDerWaalsContact C-N 3.26Å; L333-K335 PolarHBondContact O-N 2.59Å; L333-A336 PolarHBondContact O-N 3.41Å; L333-V337 HydrophobicContact CD1-CG1 3.6Å; L333-V337 HydrophobicContact CD1-CG2 4.49Å; L333-V337 HydrophobicContact CG-CG1 4.38Å; L333-V337 HydrophobicContact CG-CG2 4.41Å; L333-V337 WeakPolarHBondContact O-CG2 3.24Å; L333-V337 PolarHBondContact O-N 2.83Å; L333-L342 HydrophobicContact CB-CD2 4.49Å; L333-L342 HydrophobicContact CD2-CD2 3.85Å; L333-L342 HydrophobicContact CG-CD2 3.99Å
334	A	91.2	Very high	88.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-55.8	-38.9	-175.8	0	0	0	0	0	113.3	R330 I331 G338 S339 L342 I346 I376	R330-A334 VanDerWaalsContact O-CB 3.3Å; R330-A334 WeakPolarHBondContact O-CB 3.3Å; R330-A334 PolarHBondContact O-N 2.94Å; I331-A334 PolarHBondContact O-N 3.31Å; A334-G338 WeakPolarHBondContact O-CA 3.31Å; A334-G338 PolarHBondContact O-N 3.02Å; A334-S339 PolarHBondContact O-N 2.86Å; A334-L342 HydrophobicContact CB-CB 4.28Å; A334-L342 HydrophobicContact CB-CD2 3.88Å; A334-L342 HydrophobicContact CB-CG 3.91Å; A334-I346 HydrophobicContact CB-CD1 3.75Å; A334-I376 HydrophobicContact CB-CD1 4.37Å
335	K	88.6	Confident	89	Confident	77 Å²	77	40.2 Å²	40.2	34%	0.335	23%	0.228	S	C	.	.	H	α-helix	trans	-68.2	-49	172	176.8	-174.2	162.9	-165.6	0	111.8	I331 L333 V337 G338 D369 S371 A372 F375	I331-K335 PolarHBondContact O-N 2.75Å; L333-K335 VanDerWaalsContact C-N 3.26Å; L333-K335 PolarHBondContact O-N 2.59Å; K335-V337 VanDerWaalsContact C-N 3.29Å; K335-V337 PolarHBondContact O-N 2.94Å; K335-G338 PolarHBondContact O-N 2.85Å; K335-D369 IonicContact NZ-OD1 2.68Å; K335-D369 PolarHBondContact NZ-OD1 2.78Å; K335-D369 IonicContact NZ-OD2 2.99Å; K335-D369 PolarHBondContact NZ-OD2 3.27Å; K335-S371 PolarHBondContact NZ-OG 3.38Å; K335-A372 HydrophobicContact CD-CB 3.65Å; K335-F375 HydrophobicContact CB-CD1 4.08Å; K335-F375 HydrophobicContact CB-CE1 4.35Å
336	A	88.4	Confident	89.2	Confident	75 Å²	75	31.8 Å²	31.8	62%	0.62	19%	0.188	S	C	*	.	H	α-helix	trans	-61.8	-36.5	-178.2	0	0	0	0	0	112.9	K332 L333	K332-A336 WeakPolarHBondContact O-CB 3.28Å; K332-A336 PolarHBondContact O-N 3Å; L333-A336 PolarHBondContact O-N 3.41Å
337	V	87.8	Confident	89.1	Confident	15 Å²	15	30.7 Å²	30.7	9%	0.091	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-8	179.1	-61	0	0	0	0	113.6	L299 Q303 L333 K335 S339	L299-V337 HydrophobicContact CD2-CG1 4.39Å; L299-V337 HydrophobicContact CD2-CG2 4.05Å; L299-V337 HydrophobicContact CG-CG1 4.5Å; Q303-V337 PolarHBondContact NE2-O 2.76Å; Q303-V337 VanDerWaalsContact OE1-CG1 3.23Å; L333-V337 HydrophobicContact CD1-CG1 3.6Å; L333-V337 HydrophobicContact CD1-CG2 4.49Å; L333-V337 HydrophobicContact CG-CG1 4.38Å; L333-V337 HydrophobicContact CG-CG2 4.41Å; L333-V337 WeakPolarHBondContact O-CG2 3.24Å; L333-V337 PolarHBondContact O-N 2.83Å; K335-V337 VanDerWaalsContact C-N 3.29Å; K335-V337 PolarHBondContact O-N 2.94Å; V337-S339 PolarHBondContact O-N 2.88Å
338	G	86.3	Confident	88.9	Confident	51 Å²	51	32.3 Å²	32.3	53%	0.526	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.4	21.7	-175.9	0	0	0	0	0	114.9	A334 K335 T340	A334-G338 WeakPolarHBondContact O-CA 3.31Å; A334-G338 PolarHBondContact O-N 3.02Å; K335-G338 PolarHBondContact O-N 2.85Å; G338-T340 PolarHBondContact O-N 2.78Å
339	S	86.7	Confident	88.9	Confident	4 Å²	4	33.2 Å²	33.2	3%	0.028	19%	0.191	C	C	.	.			trans	-76.8	111.4	-171.7	175.2	0	0	0	0	112.4	E315 A334 V337 V341 L342 S343	E315-S339 WeakPolarHBondContact CG-OG 3.17Å; E315-S339 WeakPolarHBondContact OE1-CB 3.49Å; E315-S339 PolarHBondContact OE1-OG 2.81Å; A334-S339 PolarHBondContact O-N 2.86Å; V337-S339 PolarHBondContact O-N 2.88Å; S339-V341 VanDerWaalsContact C-N 3.32Å; S339-V341 PolarHBondContact OG-N 2.98Å; S339-L342 WeakPolarHBondContact OG-CB 3.28Å; S339-L342 PolarHBondContact OG-N 2.86Å; S339-S343 VanDerWaalsContact O-CB 3.25Å; S339-S343 WeakPolarHBondContact O-CB 3.46Å; S339-S343 PolarHBondContact O-N 2.93Å; S339-S343 PolarHBondContact O-OG 2.95Å
340	T	86.2	Confident	88.8	Confident	81 Å²	81	30.8 Å²	30.8	50%	0.497	17%	0.174	S	C	.	.	H	α-helix	trans	-71.6	-25.6	173.4	64.9	0	0	0	0	112.9	G338 R344	G338-T340 PolarHBondContact O-N 2.78Å; T340-R344 WeakPolarHBondContact O-CB 3.46Å; T340-R344 PolarHBondContact O-N 3.2Å; T340-R344 VanDerWaalsContact O-N 3.08Å
341	V	87.9	Confident	88.3	Confident	36 Å²	36	31.4 Å²	31.4	22%	0.218	18%	0.179	C	C	.	.	H	α-helix	trans	-72.3	-51.9	177.4	179.8	0	0	0	0	109.7	E315 S339 R344 G345	E315-V341 HydrophobicContact CB-CB 4.17Å; E315-V341 HydrophobicContact CB-CG1 3.97Å; E315-V341 HydrophobicContact CG-CB 4.45Å; E315-V341 VanDerWaalsContact OE2-CB 3.3Å; E315-V341 WeakPolarHBondContact OE2-CB 3.32Å; E315-V341 WeakPolarHBondContact OE2-CG2 3.43Å; S339-V341 VanDerWaalsContact C-N 3.32Å; S339-V341 PolarHBondContact OG-N 2.98Å; V341-R344 PolarHBondContact O-N 3.42Å; V341-G345 PolarHBondContact O-N 2.83Å
342	L	90.6	Very high	87.9	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.7	-43.2	177.7	-176.1	59	0	0	0	111	L299 L318 V319 L333 A334 S339 R344 G345 I346	L299-L342 HydrophobicContact CD2-CD2 4.46Å; L318-L342 HydrophobicContact CB-CD1 3.85Å; L318-L342 HydrophobicContact CD1-CD2 4.27Å; V319-L342 HydrophobicContact CG2-CD1 3.68Å; L333-L342 HydrophobicContact CB-CD2 4.49Å; L333-L342 HydrophobicContact CD2-CD2 3.85Å; L333-L342 HydrophobicContact CG-CD2 3.99Å; A334-L342 HydrophobicContact CB-CB 4.28Å; A334-L342 HydrophobicContact CB-CD2 3.88Å; A334-L342 HydrophobicContact CB-CG 3.91Å; S339-L342 WeakPolarHBondContact OG-CB 3.28Å; S339-L342 PolarHBondContact OG-N 2.86Å; L342-R344 VanDerWaalsContact C-N 3.3Å; L342-R344 PolarHBondContact O-N 3.4Å; L342-G345 PolarHBondContact O-N 2.53Å; L342-G345 VanDerWaalsContact O-N 3.14Å; L342-I346 HydrophobicContact CD1-CD1 4.16Å; L342-I346 HydrophobicContact CD1-CG1 4.3Å; L342-I346 HydrophobicContact CG-CD1 3.85Å; L342-I346 HydrophobicContact CG-CG1 4.44Å; L342-I346 WeakPolarHBondContact O-CB 3.21Å; L342-I346 VanDerWaalsContact O-CG1 3.28Å; L342-I346 WeakPolarHBondContact O-CG1 3.28Å; L342-I346 PolarHBondContact O-N 2.72Å
343	S	90.7	Very high	87.7	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-58.2	-40.6	175.1	-59.4	0	0	0	0	112.6	S339 S347 F375	S339-S343 VanDerWaalsContact O-CB 3.25Å; S339-S343 WeakPolarHBondContact O-CB 3.46Å; S339-S343 PolarHBondContact O-N 2.93Å; S339-S343 PolarHBondContact O-OG 2.95Å; S343-S347 VanDerWaalsContact O-CB 3.26Å; S343-S347 WeakPolarHBondContact O-CB 3.48Å; S343-S347 PolarHBondContact O-N 2.91Å; S343-S347 PolarHBondContact O-OG 3.48Å; S343-F375 VanDerWaalsContact OG-CE1 3.3Å; S343-F375 WeakPolarHBondContact OG-CE1 3.44Å
344	R	87.7	Confident	87.1	Confident	115 Å²	115	37.7 Å²	37.7	43%	0.434	21%	0.205	S	C	.	.	H	α-helix	trans	-70.1	-36.4	176.3	-170.4	178.9	-55.5	122.2	12	112.2	T340 V341 L342 N348	T340-R344 WeakPolarHBondContact O-CB 3.46Å; T340-R344 PolarHBondContact O-N 3.2Å; T340-R344 VanDerWaalsContact O-N 3.08Å; V341-R344 PolarHBondContact O-N 3.42Å; L342-R344 VanDerWaalsContact C-N 3.3Å; L342-R344 PolarHBondContact O-N 3.4Å; R344-N348 WeakPolarHBondContact O-CB 3.27Å; R344-N348 PolarHBondContact O-N 2.97Å; R344-N348 PolarHBondContact O-ND2 3.08Å
345	G	89.2	Confident	86.8	Confident	10 Å²	10	41.9 Å²	41.9	10%	0.103	23%	0.225	C	C	.	.	H	α-helix	trans	-62.9	-51.3	173.2	0	0	0	0	0	112.1	V341 L342 S347 N348 Y349	V341-G345 PolarHBondContact O-N 2.83Å; L342-G345 PolarHBondContact O-N 2.53Å; L342-G345 VanDerWaalsContact O-N 3.14Å; G345-S347 PolarHBondContact O-N 2.81Å; G345-N348 CarbonylContact O-C 3.56Å; G345-N348 WeakPolarHBondContact O-CB 3.25Å; G345-N348 PolarHBondContact O-N 2.74Å; G345-N348 VanDerWaalsContact O-N 3.15Å; G345-Y349 PolarHBondContact O-N 3.47Å
346	I	90.5	Very high	86.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-55.7	-48.4	173.8	-69.8	167.7	0	0	0	110.9	L322 I327 R330 I331 A334 L342 N348 Y349 I350 I376	L322-I346 HydrophobicContact CD1-CG1 4.2Å; L322-I346 HydrophobicContact CD2-CG1 3.98Å; I327-I346 HydrophobicContact CD1-CB 4.49Å; I327-I346 HydrophobicContact CD1-CG1 4.37Å; I327-I346 HydrophobicContact CD1-CG2 3.92Å; R330-I346 VanDerWaalsContact C-CD1 3.5Å; R330-I346 HydrophobicContact CB-CD1 3.91Å; R330-I346 HydrophobicContact CB-CG1 4.34Å; R330-I346 VanDerWaalsContact O-CD1 3.29Å; R330-I346 WeakPolarHBondContact O-CD1 3.29Å; I331-I346 HydrophobicContact CD1-CG2 4.37Å; I331-I346 HydrophobicContact CG1-CD1 4.38Å; I331-I346 HydrophobicContact CG1-CG2 3.72Å; A334-I346 HydrophobicContact CB-CD1 3.75Å; L342-I346 HydrophobicContact CD1-CD1 4.16Å; L342-I346 HydrophobicContact CD1-CG1 4.3Å; L342-I346 HydrophobicContact CG-CD1 3.85Å; L342-I346 HydrophobicContact CG-CG1 4.44Å; L342-I346 WeakPolarHBondContact O-CB 3.21Å; L342-I346 VanDerWaalsContact O-CG1 3.28Å; L342-I346 WeakPolarHBondContact O-CG1 3.28Å; L342-I346 PolarHBondContact O-N 2.72Å; I346-N348 VanDerWaalsContact C-N 3.33Å; I346-N348 PolarHBondContact O-N 2.87Å; I346-Y349 WeakPolarHBondContact O-CB 3.4Å; I346-Y349 PolarHBondContact O-N 3.15Å; I346-Y349 VanDerWaalsContact O-N 3.08Å; I346-I350 HydrophobicContact CG2-CD1 3.76Å; I346-I350 HydrophobicContact CG2-CG1 4.48Å; I346-I350 WeakPolarHBondContact O-CG1 3.32Å; I346-I350 PolarHBondContact O-N 3.32Å; I346-I376 HydrophobicContact CB-CD1 4.45Å; I346-I376 HydrophobicContact CD1-CD1 4.41Å; I346-I376 HydrophobicContact CG2-CD1 4.11Å; I346-I376 HydrophobicContact CG2-CG1 4.4Å; I346-I376 HydrophobicContact CG2-CG2 3.57Å
347	S	87.1	Confident	86.4	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-58.3	-44.1	176.8	-64.6	0	0	0	0	112	S343 G345 Y349 I350 I351 E379 A380	S343-S347 VanDerWaalsContact O-CB 3.26Å; S343-S347 WeakPolarHBondContact O-CB 3.48Å; S343-S347 PolarHBondContact O-N 2.91Å; S343-S347 PolarHBondContact O-OG 3.48Å; G345-S347 PolarHBondContact O-N 2.81Å; S347-Y349 VanDerWaalsContact C-N 3.32Å; S347-Y349 PolarHBondContact O-N 2.96Å; S347-I350 PolarHBondContact O-N 3.04Å; S347-I351 WeakPolarHBondContact O-CB 3.43Å; S347-I351 WeakPolarHBondContact O-CD1 3.39Å; S347-I351 WeakPolarHBondContact O-CG1 3.44Å; S347-I351 PolarHBondContact O-N 3.25Å; S347-E379 WeakPolarHBondContact OG-CB 3.47Å; S347-A380 PolarHBondContact OG-N 2.7Å
348	N	86.3	Confident	86.2	Confident	34 Å²	34	37.9 Å²	37.9	18%	0.182	20%	0.203	C	C	.	.	H	α-helix	trans	-66.2	-32.2	175.3	-87.2	-76	0	0	0	113.1	R344 G345 I346 K352 H383	R344-N348 WeakPolarHBondContact O-CB 3.27Å; R344-N348 PolarHBondContact O-N 2.97Å; R344-N348 PolarHBondContact O-ND2 3.08Å; G345-N348 CarbonylContact O-C 3.56Å; G345-N348 WeakPolarHBondContact O-CB 3.25Å; G345-N348 PolarHBondContact O-N 2.74Å; G345-N348 VanDerWaalsContact O-N 3.15Å; I346-N348 VanDerWaalsContact C-N 3.33Å; I346-N348 PolarHBondContact O-N 2.87Å; N348-K352 VanDerWaalsContact O-CD 3.31Å; N348-K352 WeakPolarHBondContact O-CD 3.19Å; N348-K352 VanDerWaalsContact O-CG 3.24Å; N348-K352 WeakPolarHBondContact O-CG 3.44Å; N348-K352 PolarHBondContact O-N 3.15Å; N348-H383 VanDerWaalsContact CG-CE1 3.44Å; N348-H383 PolarHBondContact ND2-CE1 2.7Å; N348-H383 PolarHBondContact ND2-NE2 3.16Å; N348-H383 PolarHBondContact OD1-CE1 3.18Å
349	Y	88.4	Confident	86.1	Confident	36 Å²	36	36.9 Å²	36.9	14%	0.141	19%	0.187	C	C	.	.	H	α-helix	trans	-68.2	-49.5	174.1	-178.6	-87.5	0	0	0	110.8	L322 D323 E324 I327 G345 I346 S347 I351 K352 N353 V356	L322-Y349 HydrophobicContact CB-CD2 3.59Å; L322-Y349 HydrophobicContact CB-CE2 4.06Å; L322-Y349 HydrophobicContact CB-CG 3.95Å; L322-Y349 HydrophobicContact CD1-CG 4.41Å; L322-Y349 WeakPolarHBondContact O-CE2 3.32Å; D323-Y349 VanDerWaalsContact C-OH 3.28Å; D323-Y349 WeakPolarHBondContact CA-OH 3.47Å; E324-Y349 PolarHBondContact N-OH 3.29Å; I327-Y349 HydrophobicContact CD1-CD1 3.67Å; I327-Y349 HydrophobicContact CD1-CE1 4.22Å; I327-Y349 HydrophobicContact CD1-CG 4.36Å; I327-Y349 HydrophobicContact CG1-CD1 4.37Å; G345-Y349 PolarHBondContact O-N 3.47Å; I346-Y349 WeakPolarHBondContact O-CB 3.4Å; I346-Y349 PolarHBondContact O-N 3.15Å; I346-Y349 VanDerWaalsContact O-N 3.08Å; S347-Y349 VanDerWaalsContact C-N 3.32Å; S347-Y349 PolarHBondContact O-N 2.96Å; Y349-I351 VanDerWaalsContact C-N 3.34Å; Y349-I351 PolarHBondContact O-N 2.84Å; Y349-K352 CarbonylContact O-C 3.48Å; Y349-K352 PolarHBondContact O-N 3.07Å; Y349-N353 HydrophobicContact CD1-CB 4.4Å; Y349-N353 VanDerWaalsContact CD2-ND2 3.32Å; Y349-N353 WeakPolarHBondContact CD2-ND2 3.35Å; Y349-N353 HydrophobicContact CE1-CB 4.01Å; Y349-N353 WeakPolarHBondContact CE2-ND2 3.16Å; Y349-N353 VanDerWaalsContact CZ-ND2 3.26Å; Y349-N353 WeakPolarHBondContact O-CB 3.29Å; Y349-N353 PolarHBondContact O-N 3.39Å; Y349-N353 PolarHBondContact O-ND2 3.05Å; Y349-V356 HydrophobicContact CE1-CG2 4.05Å
350	I	87.2	Confident	86	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-59.4	-43	177.3	-67.4	166.1	0	0	0	111.4	I331 I346 S347 K352 N353 R354 L357 W362 I376	I331-I350 HydrophobicContact CD1-CD1 4.49Å; I346-I350 HydrophobicContact CG2-CD1 3.76Å; I346-I350 HydrophobicContact CG2-CG1 4.48Å; I346-I350 WeakPolarHBondContact O-CG1 3.32Å; I346-I350 PolarHBondContact O-N 3.32Å; S347-I350 PolarHBondContact O-N 3.04Å; I350-K352 PolarHBondContact O-N 3.03Å; I350-N353 CarbonylContact O-C 3.55Å; I350-N353 VanDerWaalsContact O-C 3.27Å; I350-N353 PolarHBondContact O-N 3.28Å; I350-R354 VanDerWaalsContact O-CA 3.3Å; I350-R354 WeakPolarHBondContact O-CA 3.38Å; I350-R354 PolarHBondContact O-N 3.34Å; I350-R354 VanDerWaalsContact O-N 3.15Å; I350-L357 HydrophobicContact CG2-CD1 3.97Å; I350-L357 HydrophobicContact CG2-CD2 3.79Å; I350-L357 HydrophobicContact CG2-CG 3.85Å; I350-W362 HydrophobicContact CD1-CH2 4.31Å; I350-W362 HydrophobicContact CD1-CZ3 3.77Å; I350-I376 HydrophobicContact CD1-CG2 3.5Å
351	I	82.3	Confident	85.7	Confident	41 Å²	41	42.7 Å²	42.7	21%	0.21	22%	0.215	C	C	.	.	H	α-helix	trans	-61.5	-33	176.6	-68.9	162	0	0	0	111.7	S347 Y349 A380 H383 L384 L417	S347-I351 WeakPolarHBondContact O-CB 3.43Å; S347-I351 WeakPolarHBondContact O-CD1 3.39Å; S347-I351 WeakPolarHBondContact O-CG1 3.44Å; S347-I351 PolarHBondContact O-N 3.25Å; Y349-I351 VanDerWaalsContact C-N 3.34Å; Y349-I351 PolarHBondContact O-N 2.84Å; I351-A380 HydrophobicContact CD1-CB 4.44Å; I351-H383 HydrophobicContact CD1-CB 4.41Å; I351-L384 HydrophobicContact CD1-CD1 4.46Å; I351-L384 HydrophobicContact CD1-CD2 4.07Å; I351-L384 HydrophobicContact CD1-CG 3.92Å; I351-L384 HydrophobicContact CG1-CD1 4.42Å; I351-L384 HydrophobicContact CG1-CD2 4.3Å; I351-L384 HydrophobicContact CG1-CG 4.32Å; I351-L384 HydrophobicContact CG2-CD2 4.21Å; I351-L417 HydrophobicContact CB-CD2 4.32Å; I351-L417 HydrophobicContact CG1-CD2 4.14Å; I351-L417 HydrophobicContact CG2-CD2 4.11Å
352	K	82.5	Confident	85.6	Confident	89 Å²	89	41 Å²	41	39%	0.387	21%	0.205	S	C	.	.	H	α-helix	trans	-85.4	-25.4	178.6	-70.6	166.7	-170.2	160.4	0	113.5	N348 Y349 I350 N428	N348-K352 VanDerWaalsContact O-CD 3.31Å; N348-K352 WeakPolarHBondContact O-CD 3.19Å; N348-K352 VanDerWaalsContact O-CG 3.24Å; N348-K352 WeakPolarHBondContact O-CG 3.44Å; N348-K352 PolarHBondContact O-N 3.15Å; Y349-K352 CarbonylContact O-C 3.48Å; Y349-K352 PolarHBondContact O-N 3.07Å; I350-K352 PolarHBondContact O-N 3.03Å; K352-N428 HydrophobicContact CD-CB 4.32Å; K352-N428 WeakPolarHBondContact CE-OD1 3.37Å; K352-N428 PolarHBondContact NZ-OD1 3.13Å
353	N	84.6	Confident	85.2	Confident	36 Å²	36	46.2 Å²	46.2	19%	0.193	23%	0.229	C	C	.	.			trans	-127.4	57.4	-173.8	-59.3	-56.9	0	0	0	109.4	Y349 I350 H355 V356	Y349-N353 HydrophobicContact CD1-CB 4.4Å; Y349-N353 VanDerWaalsContact CD2-ND2 3.32Å; Y349-N353 WeakPolarHBondContact CD2-ND2 3.35Å; Y349-N353 HydrophobicContact CE1-CB 4.01Å; Y349-N353 WeakPolarHBondContact CE2-ND2 3.16Å; Y349-N353 VanDerWaalsContact CZ-ND2 3.26Å; Y349-N353 WeakPolarHBondContact O-CB 3.29Å; Y349-N353 PolarHBondContact O-N 3.39Å; Y349-N353 PolarHBondContact O-ND2 3.05Å; I350-N353 CarbonylContact O-C 3.55Å; I350-N353 VanDerWaalsContact O-C 3.27Å; I350-N353 PolarHBondContact O-N 3.28Å; N353-H355 PolarHBondContact O-N 3.14Å; N353-V356 HydrophobicContact CB-CG2 4.29Å; N353-V356 WeakPolarHBondContact O-CB 3.29Å; N353-V356 WeakPolarHBondContact O-CG2 3.37Å; N353-V356 PolarHBondContact O-N 2.92Å; N353-V356 VanDerWaalsContact O-N 3.07Å
354	R	79.3	Confident	84.9	Confident	91 Å²	91	51.4 Å²	51.4	34%	0.343	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-59	-22.6	-170	73.3	-176	-171.4	-67.6	0.4	114.5	I350 V356 L357 L417 D418 E421	I350-R354 VanDerWaalsContact O-CA 3.3Å; I350-R354 WeakPolarHBondContact O-CA 3.38Å; I350-R354 PolarHBondContact O-N 3.34Å; I350-R354 VanDerWaalsContact O-N 3.15Å; R354-V356 PolarHBondContact O-N 2.86Å; R354-L357 WeakPolarHBondContact O-CB 3.31Å; R354-L357 PolarHBondContact O-N 2.87Å; R354-L417 HydrophobicContact CB-CD1 4.07Å; R354-D418 IonicContact NE-OD1 2.63Å; R354-E421 WeakPolarHBondContact CD-OE1 3.43Å; R354-E421 IonicContact CZ-OE1 2.76Å; R354-E421 IonicContact CZ-OE2 3.47Å; R354-E421 IonicContact NE-OE1 3.79Å; R354-E421 PolarHBondContact NE-OE1 3.34Å; R354-E421 IonicContact NE-OE2 2.72Å; R354-E421 PolarHBondContact NE-OE2 3.37Å; R354-E421 IonicContact NH1-OE1 2.76Å; R354-E421 PolarHBondContact NH1-OE1 3.39Å; R354-E421 IonicContact NH1-OE2 3.11Å; R354-E421 PolarHBondContact NH1-OE2 2.96Å; R354-E421 VanDerWaalsContact NH1-OE2 3.13Å; R354-E421 IonicContact NH2-OE1 3.47Å; R354-E421 IonicContact NH2-OE2 2.9Å; R354-E421 PolarHBondContact NH2-OE2 3.5Å
355	H	84.5	Confident	84.7	Confident	88 Å²	88	46 Å²	46	41%	0.407	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-61.8	-21.7	177.6	61.1	-77.9	0	0	0	112.9	E324 N353 L357 S358 S359	E324-H355 IonicContact OE1-CD2 2.98Å; E324-H355 IonicContact OE1-CE1 3.09Å; E324-H355 IonicContact OE1-NE2 3.92Å; E324-H355 PolarHBondContact OE1-NE2 2.82Å; E324-H355 IonicContact OE2-CD2 3.86Å; E324-H355 IonicContact OE2-NE2 2Å; E324-H355 PolarHBondContact OE2-NE2 3.08Å; N353-H355 PolarHBondContact O-N 3.14Å; H355-L357 PolarHBondContact O-N 3.02Å; H355-S358 CarbonylContact O-C 3.53Å; H355-S358 WeakPolarHBondContact O-CA 3.24Å; H355-S358 WeakPolarHBondContact O-CB 3.48Å; H355-S358 PolarHBondContact O-N 3.25Å; H355-S359 PolarHBondContact O-N 3.24Å
356	V	85.6	Confident	84.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-56	-32.5	169.6	173.1	0	0	0	0	112.4	E324 I327 Y349 N353 R354 S358 S359 W362	E324-V356 HydrophobicContact CG-CG2 3.98Å; I327-V356 HydrophobicContact CG1-CG1 4.28Å; I327-V356 HydrophobicContact CG2-CG1 3.8Å; Y349-V356 HydrophobicContact CE1-CG2 4.05Å; N353-V356 HydrophobicContact CB-CG2 4.29Å; N353-V356 WeakPolarHBondContact O-CB 3.29Å; N353-V356 WeakPolarHBondContact O-CG2 3.37Å; N353-V356 PolarHBondContact O-N 2.92Å; N353-V356 VanDerWaalsContact O-N 3.07Å; R354-V356 PolarHBondContact O-N 2.86Å; V356-S358 PolarHBondContact O-N 3.03Å; V356-S358 VanDerWaalsContact O-N 3.09Å; V356-S359 PolarHBondContact O-N 3.44Å; V356-S359 PolarHBondContact O-OG 2.88Å; V356-S359 VanDerWaalsContact O-OG 3.11Å; V356-W362 HydrophobicContact CG1-CE3 4.43Å; V356-W362 WeakPolarHBondContact O-CB 3.49Å
357	L	83.6	Confident	84.1	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-68.7	-7.3	176.4	-61.5	176.7	0	0	0	113.6	I350 R354 H355 W362 L377 R410 V413 L414 L417	I350-L357 HydrophobicContact CG2-CD1 3.97Å; I350-L357 HydrophobicContact CG2-CD2 3.79Å; I350-L357 HydrophobicContact CG2-CG 3.85Å; R354-L357 WeakPolarHBondContact O-CB 3.31Å; R354-L357 PolarHBondContact O-N 2.87Å; H355-L357 PolarHBondContact O-N 3.02Å; L357-W362 HydrophobicContact CD2-CD2 3.7Å; L357-W362 HydrophobicContact CD2-CE3 3.75Å; L357-W362 HydrophobicContact CD2-CG 4.46Å; L357-W362 HydrophobicContact CD2-CH2 3.74Å; L357-W362 HydrophobicContact CD2-CZ2 3.69Å; L357-W362 HydrophobicContact CD2-CZ3 3.76Å; L357-L377 HydrophobicContact CD2-CD2 3.93Å; L357-R410 VanDerWaalsContact O-CD 3.3Å; L357-R410 WeakPolarHBondContact O-CD 3.24Å; L357-R410 PolarHBondContact O-NH1 3.33Å; L357-V413 HydrophobicContact CD1-CG1 4.04Å; L357-L414 HydrophobicContact CB-CD1 3.66Å; L357-L414 HydrophobicContact CD1-CD1 3.79Å; L357-L414 HydrophobicContact CG-CD1 4.37Å; L357-L417 HydrophobicContact CD1-CD1 3.86Å
358	S	82.8	Confident	84	Confident	83 Å²	83	56.8 Å²	56.8	58%	0.58	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-116.3	8.3	178.1	-55.5	0	0	0	0	112.9	H355 V356	H355-S358 CarbonylContact O-C 3.53Å; H355-S358 WeakPolarHBondContact O-CA 3.24Å; H355-S358 WeakPolarHBondContact O-CB 3.48Å; H355-S358 PolarHBondContact O-N 3.25Å; V356-S358 PolarHBondContact O-N 3.03Å; V356-S358 VanDerWaalsContact O-N 3.09Å
359	S	85.1	Confident	83.8	Confident	29 Å²	29	57.1 Å²	57.1	20%	0.203	29%	0.288	C	S	.	.	S	Bend	trans	-84	153.7	175.3	73.4	0	0	0	0	112.2	H355 V356 D361 W362 E363	H355-S359 PolarHBondContact O-N 3.24Å; V356-S359 PolarHBondContact O-N 3.44Å; V356-S359 PolarHBondContact O-OG 2.88Å; V356-S359 VanDerWaalsContact O-OG 3.11Å; S359-D361 PolarHBondContact O-N 3.18Å; S359-W362 PolarHBondContact O-N 3.22Å; S359-W362 PolarHBondContact OG-N 2.94Å; S359-E363 PolarHBondContact O-N 3.11Å
360	D	83.9	Confident	83.6	Confident	137 Å²	137	57.3 Å²	57.3	73%	0.733	30%	0.295	S	S	*	.	H	α-helix	trans	-56.4	-35.3	174.2	-61.1	-3.1	0	0	0	111.4	W362 E363 K364	D360-W362 VanDerWaalsContact C-N 3.35Å; D360-W362 PolarHBondContact O-N 3.44Å; D360-E363 PolarHBondContact O-N 2.52Å; D360-K364 WeakPolarHBondContact O-CB 3.3Å; D360-K364 PolarHBondContact O-N 2.82Å
361	D	81.1	Confident	83.4	Confident	71 Å²	71	60.5 Å²	60.5	38%	0.38	32%	0.318	S	S	.	.	H	α-helix	trans	-64.3	-36	175.3	-69.1	-58.2	0	0	0	112.7	S359 K364 I365	S359-D361 PolarHBondContact O-N 3.18Å; D361-K364 WeakPolarHBondContact O-CB 3.4Å; D361-K364 PolarHBondContact O-N 3.09Å; D361-I365 VanDerWaalsContact O-CG1 3.29Å; D361-I365 WeakPolarHBondContact O-CG1 3.41Å; D361-I365 PolarHBondContact O-N 3.27Å
362	W	84.4	Confident	83.5	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-69.6	-41.9	174.1	-176.1	-81.2	0	0	0	112	I331 I350 V356 L357 S359 D360 K364 I365 E366 A373 L377	I331-W362 HydrophobicContact CD1-CE3 4.18Å; I331-W362 HydrophobicContact CD1-CH2 4.46Å; I331-W362 HydrophobicContact CD1-CZ3 3.6Å; I350-W362 HydrophobicContact CD1-CH2 4.31Å; I350-W362 HydrophobicContact CD1-CZ3 3.77Å; V356-W362 HydrophobicContact CG1-CE3 4.43Å; V356-W362 WeakPolarHBondContact O-CB 3.49Å; L357-W362 HydrophobicContact CD2-CD2 3.7Å; L357-W362 HydrophobicContact CD2-CE3 3.75Å; L357-W362 HydrophobicContact CD2-CG 4.46Å; L357-W362 HydrophobicContact CD2-CH2 3.74Å; L357-W362 HydrophobicContact CD2-CZ2 3.69Å; L357-W362 HydrophobicContact CD2-CZ3 3.76Å; S359-W362 PolarHBondContact O-N 3.22Å; S359-W362 PolarHBondContact OG-N 2.94Å; D360-W362 VanDerWaalsContact C-N 3.35Å; D360-W362 PolarHBondContact O-N 3.44Å; W362-K364 PolarHBondContact O-N 3.45Å; W362-I365 HydrophobicContact CE3-CD1 4.34Å; W362-I365 PolarHBondContact O-N 3.27Å; W362-I365 VanDerWaalsContact O-N 3.16Å; W362-E366 WeakPolarHBondContact O-CB 3.34Å; W362-E366 PolarHBondContact O-N 3.07Å; W362-A373 HydrophobicContact CH2-CB 4.48Å; W362-A373 HydrophobicContact CZ2-CB 3.92Å; W362-L377 HydrophobicContact CH2-CD2 3.98Å; W362-L377 HydrophobicContact CH2-CG 3.96Å; W362-L377 HydrophobicContact CZ2-CD1 3.84Å; W362-L377 HydrophobicContact CZ2-CD2 3.89Å; W362-L377 HydrophobicContact CZ2-CG 3.74Å
363	E	82.9	Confident	83.5	Confident	109 Å²	109	54.3 Å²	54.3	51%	0.509	29%	0.289	S	S	.	.	H	α-helix	trans	-61.1	-35.8	174.4	-175.9	163.8	-172.6	0	0	111.6	S359 D360 E366 T367	S359-E363 PolarHBondContact O-N 3.11Å; D360-E363 PolarHBondContact O-N 2.52Å; E363-E366 PolarHBondContact O-N 3.06Å; E363-T367 WeakPolarHBondContact O-CG2 3.4Å; E363-T367 PolarHBondContact O-N 2.68Å; E363-T367 PolarHBondContact O-OG1 3.01Å
364	K	83.5	Confident	83.4	Confident	109 Å²	109	53.4 Å²	53.4	47%	0.474	29%	0.286	S	S	.	.	H	α-helix	trans	-64.8	-42	172	-172.8	176	178.1	-178.1	0	113	D360 D361 W362 T367 E368	D360-K364 WeakPolarHBondContact O-CB 3.3Å; D360-K364 PolarHBondContact O-N 2.82Å; D361-K364 WeakPolarHBondContact O-CB 3.4Å; D361-K364 PolarHBondContact O-N 3.09Å; W362-K364 PolarHBondContact O-N 3.45Å; K364-T367 WeakPolarHBondContact CA-OG1 3.41Å; K364-T367 PolarHBondContact O-N 3.25Å; K364-T367 PolarHBondContact O-OG1 3.21Å; K364-T367 VanDerWaalsContact O-OG1 3.11Å; K364-E368 WeakPolarHBondContact CE-OE1 3.44Å; K364-E368 HydrophobicContact CG-CG 4.22Å; K364-E368 WeakPolarHBondContact CG-OE1 3.36Å; K364-E368 VanDerWaalsContact O-CB 3.26Å; K364-E368 WeakPolarHBondContact O-CB 3.3Å; K364-E368 VanDerWaalsContact O-CG 3.28Å; K364-E368 WeakPolarHBondContact O-CG 3.28Å; K364-E368 PolarHBondContact O-N 3.4Å
365	I	83.5	Confident	83.6	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.015	28%	0.283	C	S	.	.	H	α-helix	trans	-65.2	-43	173	-56.7	156.5	0	0	0	110.6	A328 I331 D361 W362 T367 E368 D369 S370 A373	A328-I365 HydrophobicContact CB-CD1 3.61Å; A328-I365 HydrophobicContact CB-CG1 3.78Å; I331-I365 HydrophobicContact CD1-CD1 3.76Å; I331-I365 HydrophobicContact CG2-CG2 4.18Å; D361-I365 VanDerWaalsContact O-CG1 3.29Å; D361-I365 WeakPolarHBondContact O-CG1 3.41Å; D361-I365 PolarHBondContact O-N 3.27Å; W362-I365 HydrophobicContact CE3-CD1 4.34Å; W362-I365 PolarHBondContact O-N 3.27Å; W362-I365 VanDerWaalsContact O-N 3.16Å; I365-T367 VanDerWaalsContact C-N 3.25Å; I365-T367 PolarHBondContact O-N 3.22Å; I365-E368 PolarHBondContact O-N 3.49Å; I365-D369 CarbonylContact O-C 3.33Å; I365-D369 WeakPolarHBondContact O-CA 3.39Å; I365-D369 PolarHBondContact O-N 3.21Å; I365-S370 PolarHBondContact O-N 3.43Å; I365-A373 HydrophobicContact CG2-CB 4.21Å
366	E	83.3	Confident	83.7	Confident	21 Å²	21	47.9 Å²	47.9	10%	0.098	26%	0.264	C	S	.	.	H	α-helix	trans	-60.1	-35.2	179.5	171	141.1	-99.3	0	0	112.1	W362 E363 S370 S406 A407 R410	W362-E366 WeakPolarHBondContact O-CB 3.34Å; W362-E366 PolarHBondContact O-N 3.07Å; E363-E366 PolarHBondContact O-N 3.06Å; E366-S370 WeakPolarHBondContact O-CA 3.14Å; E366-S370 WeakPolarHBondContact O-CB 3.46Å; E366-S370 PolarHBondContact O-N 2.88Å; E366-S406 WeakPolarHBondContact CG-OG 3.34Å; E366-S406 WeakPolarHBondContact OE1-CB 3.1Å; E366-S406 PolarHBondContact OE1-OG 2.63Å; E366-A407 VanDerWaalsContact OE1-CA 3.24Å; E366-A407 WeakPolarHBondContact OE1-CA 3.09Å; E366-A407 PolarHBondContact OE1-N 3.02Å; E366-R410 IonicContact OE2-CZ 2.73Å; E366-R410 IonicContact OE2-NE 2.72Å; E366-R410 PolarHBondContact OE2-NE 3.41Å; E366-R410 IonicContact OE2-NH2 2.63Å; E366-R410 PolarHBondContact OE2-NH2 3.19Å
367	T	83.7	Confident	83.5	Confident	105 Å²	105	47.9 Å²	47.9	64%	0.644	26%	0.264	S	S	*	.	H	α-helix	trans	-85.3	-39.3	177.1	49.3	0	0	0	0	114.1	E363 K364 I365	E363-T367 WeakPolarHBondContact O-CG2 3.4Å; E363-T367 PolarHBondContact O-N 2.68Å; E363-T367 PolarHBondContact O-OG1 3.01Å; K364-T367 WeakPolarHBondContact CA-OG1 3.41Å; K364-T367 PolarHBondContact O-N 3.25Å; K364-T367 PolarHBondContact O-OG1 3.21Å; K364-T367 VanDerWaalsContact O-OG1 3.11Å; I365-T367 VanDerWaalsContact C-N 3.25Å; I365-T367 PolarHBondContact O-N 3.22Å
368	E	84.8	Confident	83.3	Confident	109 Å²	109	52.4 Å²	52.4	51%	0.509	28%	0.283	S	S	.	.	H	α-helix	trans	-79.3	-40	-179.9	-69.6	178.2	175.4	0	0	113.6	K332 K364 I365	K332-E368 IonicContact NZ-OE2 3.4Å; K332-E368 PolarHBondContact NZ-OE2 2.6Å; K364-E368 WeakPolarHBondContact CE-OE1 3.44Å; K364-E368 HydrophobicContact CG-CG 4.22Å; K364-E368 WeakPolarHBondContact CG-OE1 3.36Å; K364-E368 VanDerWaalsContact O-CB 3.26Å; K364-E368 WeakPolarHBondContact O-CB 3.3Å; K364-E368 VanDerWaalsContact O-CG 3.28Å; K364-E368 WeakPolarHBondContact O-CG 3.28Å; K364-E368 PolarHBondContact O-N 3.4Å; I365-E368 PolarHBondContact O-N 3.49Å
369	D	82.8	Confident	82.9	Confident	41 Å²	41	50.4 Å²	50.4	22%	0.219	27%	0.265	C	S	.	.			trans	-148.5	70	-179.7	-169.3	-9.1	0	0	0	111.1	K335 I365 S371 A372 A373	K335-D369 IonicContact NZ-OD1 2.68Å; K335-D369 PolarHBondContact NZ-OD1 2.78Å; K335-D369 IonicContact NZ-OD2 2.99Å; K335-D369 PolarHBondContact NZ-OD2 3.27Å; I365-D369 CarbonylContact O-C 3.33Å; I365-D369 WeakPolarHBondContact O-CA 3.39Å; I365-D369 PolarHBondContact O-N 3.21Å; D369-S371 PolarHBondContact O-N 3.37Å; D369-S371 PolarHBondContact OD1-N 3.16Å; D369-S371 PolarHBondContact OD1-OG 2.82Å; D369-A372 HydrophobicContact CB-CB 4.05Å; D369-A372 WeakPolarHBondContact O-CB 3.45Å; D369-A372 PolarHBondContact O-N 2.97Å; D369-A372 PolarHBondContact OD1-N 3.32Å; D369-A372 WeakPolarHBondContact OD2-CB 3.46Å; D369-A373 PolarHBondContact O-N 2.66Å
370	S	83.3	Confident	82.5	Confident	41 Å²	41	49 Å²	49	29%	0.287	26%	0.255	S	S	.	.	H	α-helix	trans	-48.3	-30.9	173.5	-177.8	0	0	0	0	112.8	I365 E366 A373 A374 S406	I365-S370 PolarHBondContact O-N 3.43Å; E366-S370 WeakPolarHBondContact O-CA 3.14Å; E366-S370 WeakPolarHBondContact O-CB 3.46Å; E366-S370 PolarHBondContact O-N 2.88Å; S370-A373 PolarHBondContact O-N 2.87Å; S370-A374 VanDerWaalsContact O-CB 3.31Å; S370-A374 WeakPolarHBondContact O-CB 3.34Å; S370-A374 PolarHBondContact O-N 2.99Å; S370-S406 VanDerWaalsContact OG-CB 3.28Å; S370-S406 WeakPolarHBondContact OG-CB 3.32Å; S370-S406 PolarHBondContact OG-OG 3.12Å
371	S	83.7	Confident	81.8	Confident	68 Å²	68	43.1 Å²	43.1	48%	0.476	22%	0.224	S	C	.	.	H	α-helix	trans	-73.7	-28.7	178.5	72.8	0	0	0	0	113.6	K335 D369 F375	K335-S371 PolarHBondContact NZ-OG 3.38Å; D369-S371 PolarHBondContact O-N 3.37Å; D369-S371 PolarHBondContact OD1-N 3.16Å; D369-S371 PolarHBondContact OD1-OG 2.82Å; S371-F375 VanDerWaalsContact O-CB 3.24Å; S371-F375 WeakPolarHBondContact O-CB 3.3Å; S371-F375 PolarHBondContact O-N 3.46Å
372	A	84	Confident	81.2	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-71.9	-42.7	169.2	0	0	0	0	0	112	I331 K335 D369 A374 F375 I376	I331-A372 HydrophobicContact CG2-CB 3.93Å; K335-A372 HydrophobicContact CD-CB 3.65Å; D369-A372 HydrophobicContact CB-CB 4.05Å; D369-A372 WeakPolarHBondContact O-CB 3.45Å; D369-A372 PolarHBondContact O-N 2.97Å; D369-A372 PolarHBondContact OD1-N 3.32Å; D369-A372 WeakPolarHBondContact OD2-CB 3.46Å; A372-A374 PolarHBondContact O-N 2.89Å; A372-F375 PolarHBondContact O-N 3.45Å; A372-I376 PolarHBondContact O-N 3.48Å; A372-I376 VanDerWaalsContact O-N 3.09Å
373	A	83.9	Confident	80.3	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-57.8	-48.9	172.3	0	0	0	0	0	111	W362 I365 D369 S370 F375 I376 L377	W362-A373 HydrophobicContact CH2-CB 4.48Å; W362-A373 HydrophobicContact CZ2-CB 3.92Å; I365-A373 HydrophobicContact CG2-CB 4.21Å; D369-A373 PolarHBondContact O-N 2.66Å; S370-A373 PolarHBondContact O-N 2.87Å; A373-F375 PolarHBondContact O-N 2.82Å; A373-I376 PolarHBondContact O-N 2.88Å; A373-L377 WeakPolarHBondContact O-CB 3.25Å; A373-L377 VanDerWaalsContact O-CG 3.28Å; A373-L377 WeakPolarHBondContact O-CG 3.18Å; A373-L377 PolarHBondContact O-N 3.34Å
374	A	82.4	Confident	79.3	Confident	16 Å²	16	41.9 Å²	41.9	13%	0.132	22%	0.219	C	C	.	.	H	α-helix	trans	-63.2	-37.8	177.7	0	0	0	0	0	113.2	S370 A372 K378	S370-A374 VanDerWaalsContact O-CB 3.31Å; S370-A374 WeakPolarHBondContact O-CB 3.34Å; S370-A374 PolarHBondContact O-N 2.99Å; A372-A374 PolarHBondContact O-N 2.89Å; A374-K378 WeakPolarHBondContact O-CB 3.3Å; A374-K378 PolarHBondContact O-N 3.46Å
375	F	83.4	Confident	78.1	Confident	64 Å²	64	38.4 Å²	38.4	28%	0.281	21%	0.207	S	C	.	.	H	α-helix	trans	-61.9	-46.7	176.4	173.8	-108.8	0	0	0	112.1	K335 S343 S371 A372 A373 K378 E379	K335-F375 HydrophobicContact CB-CD1 4.08Å; K335-F375 HydrophobicContact CB-CE1 4.35Å; S343-F375 VanDerWaalsContact OG-CE1 3.3Å; S343-F375 WeakPolarHBondContact OG-CE1 3.44Å; S371-F375 VanDerWaalsContact O-CB 3.24Å; S371-F375 WeakPolarHBondContact O-CB 3.3Å; S371-F375 PolarHBondContact O-N 3.46Å; A372-F375 PolarHBondContact O-N 3.45Å; A373-F375 PolarHBondContact O-N 2.82Å; F375-K378 WeakPolarHBondContact O-CB 3.38Å; F375-K378 PolarHBondContact O-N 3.11Å; F375-E379 PolarHBondContact O-N 2.88Å
376	I	85.7	Confident	76.6	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-74.7	-36.6	179.9	-70	-65.3	0	0	0	112.2	I331 A334 I346 I350 A372 A373 K378 E379 A380	I331-I376 HydrophobicContact CB-CG1 4.4Å; I331-I376 HydrophobicContact CG1-CG1 4.09Å; I331-I376 HydrophobicContact CG1-CG2 4.37Å; I331-I376 HydrophobicContact CG2-CG1 3.95Å; A334-I376 HydrophobicContact CB-CD1 4.37Å; I346-I376 HydrophobicContact CB-CD1 4.45Å; I346-I376 HydrophobicContact CD1-CD1 4.41Å; I346-I376 HydrophobicContact CG2-CD1 4.11Å; I346-I376 HydrophobicContact CG2-CG1 4.4Å; I346-I376 HydrophobicContact CG2-CG2 3.57Å; I350-I376 HydrophobicContact CD1-CG2 3.5Å; A372-I376 PolarHBondContact O-N 3.48Å; A372-I376 VanDerWaalsContact O-N 3.09Å; A373-I376 PolarHBondContact O-N 2.88Å; I376-K378 VanDerWaalsContact C-N 3.28Å; I376-K378 PolarHBondContact O-N 3.38Å; I376-E379 PolarHBondContact O-N 2.78Å; I376-A380 WeakPolarHBondContact O-CB 3.15Å; I376-A380 PolarHBondContact O-N 2.65Å
377	L	82.5	Confident	75	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63.6	-34.2	172	-70	176	0	0	0	112.1	L357 W362 A373 A380 V381 V409 R410 V413	L357-L377 HydrophobicContact CD2-CD2 3.93Å; W362-L377 HydrophobicContact CH2-CD2 3.98Å; W362-L377 HydrophobicContact CH2-CG 3.96Å; W362-L377 HydrophobicContact CZ2-CD1 3.84Å; W362-L377 HydrophobicContact CZ2-CD2 3.89Å; W362-L377 HydrophobicContact CZ2-CG 3.74Å; A373-L377 WeakPolarHBondContact O-CB 3.25Å; A373-L377 VanDerWaalsContact O-CG 3.28Å; A373-L377 WeakPolarHBondContact O-CG 3.18Å; A373-L377 PolarHBondContact O-N 3.34Å; L377-A380 PolarHBondContact O-N 2.83Å; L377-V381 WeakPolarHBondContact O-CB 3.46Å; L377-V381 VanDerWaalsContact O-CG2 3.25Å; L377-V381 WeakPolarHBondContact O-CG2 3.46Å; L377-V381 PolarHBondContact O-N 2.82Å; L377-V409 HydrophobicContact CB-CG1 3.63Å; L377-V409 HydrophobicContact CD1-CB 3.96Å; L377-V409 HydrophobicContact CD1-CG1 3.78Å; L377-V409 HydrophobicContact CG-CG1 4.32Å; L377-R410 HydrophobicContact CD1-CB 4.21Å; L377-V413 HydrophobicContact CD2-CB 4.26Å; L377-V413 HydrophobicContact CD2-CG1 4.05Å; L377-V413 HydrophobicContact CD2-CG2 4.21Å
378	K	78.5	Confident	73.2	Confident	95 Å²	95	44.9 Å²	44.9	41%	0.413	25%	0.25	S	C	.	.	H	α-helix	trans	-61.2	-48.5	171.5	172.3	177.4	174.6	-166.7	0	111.7	A374 F375 I376 A380 V381 L382 L401	A374-K378 WeakPolarHBondContact O-CB 3.3Å; A374-K378 PolarHBondContact O-N 3.46Å; F375-K378 WeakPolarHBondContact O-CB 3.38Å; F375-K378 PolarHBondContact O-N 3.11Å; I376-K378 VanDerWaalsContact C-N 3.28Å; I376-K378 PolarHBondContact O-N 3.38Å; K378-A380 VanDerWaalsContact C-N 3.34Å; K378-V381 PolarHBondContact O-N 2.83Å; K378-L382 HydrophobicContact CG-CD1 4.09Å; K378-L382 WeakPolarHBondContact O-CG 3.45Å; K378-L382 PolarHBondContact O-N 2.85Å; K378-L401 HydrophobicContact CB-CD1 3.87Å; K378-L401 HydrophobicContact CB-CD2 3.78Å; K378-L401 HydrophobicContact CB-CG 4.47Å; K378-L401 HydrophobicContact CD-CD1 4.19Å; K378-L401 HydrophobicContact CG-CD1 3.73Å
379	E	75.3	Confident	71.2	Confident	40 Å²	40	42.3 Å²	42.3	19%	0.187	24%	0.238	C	C	.	.	H	α-helix	trans	-64.4	-38.5	177.9	-71.1	-60	125.8	0	0	111.8	S347 F375 I376 L382 H383	S347-E379 WeakPolarHBondContact OG-CB 3.47Å; F375-E379 PolarHBondContact O-N 2.88Å; I376-E379 PolarHBondContact O-N 2.78Å; E379-L382 PolarHBondContact O-N 2.72Å; E379-H383 VanDerWaalsContact O-CB 3.3Å; E379-H383 WeakPolarHBondContact O-CB 3.39Å; E379-H383 PolarHBondContact O-N 2.63Å
380	A	75	Confident	69.4	Low	1 Å²	1	47.1 Å²	47.1	1%	0.008	26%	0.261	C	S	.	.	H	α-helix	trans	-62	-43.6	173	0	0	0	0	0	112.2	S347 I351 I376 L377 K378 H383 L384	S347-A380 PolarHBondContact OG-N 2.7Å; I351-A380 HydrophobicContact CD1-CB 4.44Å; I376-A380 WeakPolarHBondContact O-CB 3.15Å; I376-A380 PolarHBondContact O-N 2.65Å; L377-A380 PolarHBondContact O-N 2.83Å; K378-A380 VanDerWaalsContact C-N 3.34Å; A380-H383 PolarHBondContact O-N 3.2Å; A380-L384 VanDerWaalsContact O-CG 3.3Å; A380-L384 WeakPolarHBondContact O-CG 3.43Å; A380-L384 PolarHBondContact O-N 3.47Å
381	V	69.4	Low	67.9	Low	12 Å²	12	50.2 Å²	50.2	7%	0.073	28%	0.28	C	S	.	.	H	α-helix	trans	-61.5	-47.9	173.1	167.9	0	0	0	0	111.1	L377 K378 H383 L384 V385 I397 V413	L377-V381 WeakPolarHBondContact O-CB 3.46Å; L377-V381 VanDerWaalsContact O-CG2 3.25Å; L377-V381 WeakPolarHBondContact O-CG2 3.46Å; L377-V381 PolarHBondContact O-N 2.82Å; K378-V381 PolarHBondContact O-N 2.83Å; V381-H383 PolarHBondContact O-N 3.18Å; V381-L384 PolarHBondContact O-N 3.33Å; V381-L384 VanDerWaalsContact O-N 3.11Å; V381-V385 HydrophobicContact CG1-CG2 3.93Å; V381-V385 WeakPolarHBondContact O-CB 3.42Å; V381-V385 VanDerWaalsContact O-CG2 3.24Å; V381-V385 WeakPolarHBondContact O-CG2 3.21Å; V381-V385 PolarHBondContact O-N 2.75Å; V381-I397 HydrophobicContact CB-CG2 4.31Å; V381-I397 HydrophobicContact CG1-CB 4.2Å; V381-I397 HydrophobicContact CG1-CD1 3.7Å; V381-I397 HydrophobicContact CG1-CG2 3.74Å; V381-I397 HydrophobicContact CG2-CD1 4.32Å; V381-I397 HydrophobicContact CG2-CG2 3.94Å; V381-V413 HydrophobicContact CG2-CG2 3.63Å
382	L	68.8	Low	66.3	Low	86 Å²	86	55.1 Å²	55.1	45%	0.45	29%	0.293	S	S	.	.	H	α-helix	trans	-58.9	-39.1	178.6	-72	171	0	0	0	111.4	K378 E379 V385 G386	K378-L382 HydrophobicContact CG-CD1 4.09Å; K378-L382 WeakPolarHBondContact O-CG 3.45Å; K378-L382 PolarHBondContact O-N 2.85Å; E379-L382 PolarHBondContact O-N 2.72Å; L382-V385 PolarHBondContact O-N 3.38Å; L382-G386 PolarHBondContact O-N 2.82Å
383	H	65	Low	65.1	Low	46 Å²	46	58 Å²	58	21%	0.213	31%	0.308	C	S	.	.	H	α-helix	trans	-71.3	-26.2	177.5	-161.4	-88.5	0	0	0	113.9	N348 I351 E379 A380 V381	N348-H383 VanDerWaalsContact CG-CE1 3.44Å; N348-H383 PolarHBondContact ND2-CE1 2.7Å; N348-H383 PolarHBondContact ND2-NE2 3.16Å; N348-H383 PolarHBondContact OD1-CE1 3.18Å; I351-H383 HydrophobicContact CD1-CB 4.41Å; E379-H383 VanDerWaalsContact O-CB 3.3Å; E379-H383 WeakPolarHBondContact O-CB 3.39Å; E379-H383 PolarHBondContact O-N 2.63Å; A380-H383 PolarHBondContact O-N 3.2Å; V381-H383 PolarHBondContact O-N 3.18Å
384	L	62.2	Low	63.7	Low	22 Å²	22	59.7 Å²	59.7	12%	0.115	32%	0.318	C	S	.	.	H	α-helix	trans	-80	-39.4	170	-69.8	165.9	0	0	0	111.8	I351 A380 V381 G386 K387 T388 L417	I351-L384 HydrophobicContact CD1-CD1 4.46Å; I351-L384 HydrophobicContact CD1-CD2 4.07Å; I351-L384 HydrophobicContact CD1-CG 3.92Å; I351-L384 HydrophobicContact CG1-CD1 4.42Å; I351-L384 HydrophobicContact CG1-CD2 4.3Å; I351-L384 HydrophobicContact CG1-CG 4.32Å; I351-L384 HydrophobicContact CG2-CD2 4.21Å; A380-L384 VanDerWaalsContact O-CG 3.3Å; A380-L384 WeakPolarHBondContact O-CG 3.43Å; A380-L384 PolarHBondContact O-N 3.47Å; V381-L384 PolarHBondContact O-N 3.33Å; V381-L384 VanDerWaalsContact O-N 3.11Å; L384-G386 VanDerWaalsContact C-N 3.31Å; L384-G386 PolarHBondContact O-N 3.4Å; L384-K387 PolarHBondContact O-N 3.01Å; L384-T388 PolarHBondContact O-N 3.42Å; L384-L417 HydrophobicContact CD1-CD2 4.08Å; L384-L417 HydrophobicContact CD2-CD2 4.43Å
385	V	58.4	Low	62.5	Low	36 Å²	36	62.7 Å²	62.7	22%	0.218	34%	0.338	C	S	.	.	H	α-helix	trans	-63.7	-37.3	178.1	166.3	0	0	0	0	111.4	V381 L382 K387 M389 V394	V381-V385 HydrophobicContact CG1-CG2 3.93Å; V381-V385 WeakPolarHBondContact O-CB 3.42Å; V381-V385 VanDerWaalsContact O-CG2 3.24Å; V381-V385 WeakPolarHBondContact O-CG2 3.21Å; V381-V385 PolarHBondContact O-N 2.75Å; L382-V385 PolarHBondContact O-N 3.38Å; V385-K387 PolarHBondContact O-N 3.32Å; V385-K387 VanDerWaalsContact O-N 3.11Å; V385-M389 HydrophobicContact CG2-CB 4.33Å; V385-M389 HydrophobicContact CG2-SD 3.97Å; V385-V394 HydrophobicContact CB-CG2 4.46Å; V385-V394 HydrophobicContact CG1-CG1 4.42Å; V385-V394 HydrophobicContact CG1-CG2 3.6Å; V385-V394 HydrophobicContact CG2-CG2 3.94Å
386	G	52.2	Low	61.3	Low	64 Å²	64	62.8 Å²	62.8	66%	0.66	34%	0.344	S	S	*	.	H	α-helix	trans	-67.3	1.1	172	0	0	0	0	0	115.2	L382 L384	L382-G386 PolarHBondContact O-N 2.82Å; L384-G386 VanDerWaalsContact C-N 3.31Å; L384-G386 PolarHBondContact O-N 3.4Å
387	K	50.5	Low	59.9	Low	132 Å²	132	63.4 Å²	63.4	57%	0.574	35%	0.347	S	S	*	.	H	α-helix	trans	-112.2	-50.3	175.5	-68.1	-173.6	176.2	-173.3	0	113.3	L384 V385	L384-K387 PolarHBondContact O-N 3.01Å; V385-K387 PolarHBondContact O-N 3.32Å; V385-K387 VanDerWaalsContact O-N 3.11Å
388	T	44.5	Very low	58.7	Low	70 Å²	70	68.4 Å²	68.4	43%	0.429	37%	0.373	S	S	.	.	H	α-helix	trans	-162.1	71.5	-169.7	46	0	0	0	0	114.4	N181 L384	N181-T388 HydrophobicContact CB-CG2 3.62Å; N181-T388 WeakPolarHBondContact ND2-CG2 3.2Å; L384-T388 PolarHBondContact O-N 3.42Å
389	M	43	Very low	57.7	Low	54 Å²	54	69.6 Å²	69.6	27%	0.266	38%	0.383	S	S	.	.			trans	-143.5	144.6	175.4	-96.9	-159	176.3	0	0	118.5	V385 I393 V394 Q416	V385-M389 HydrophobicContact CG2-CB 4.33Å; V385-M389 HydrophobicContact CG2-SD 3.97Å; M389-I393 HydrophobicContact CE-CB 4.27Å; M389-I393 HydrophobicContact CE-CD1 4.12Å; M389-I393 HydrophobicContact CE-CG2 3.58Å; M389-I393 HydrophobicContact CG-CD1 4.49Å; M389-I393 HydrophobicContact SD-CB 3.76Å; M389-I393 HydrophobicContact SD-CD1 4.33Å; M389-I393 HydrophobicContact SD-CG2 3.53Å; M389-I393 VanDerWaalsContact SD-CG2 3.53Å; M389-V394 HydrophobicContact CB-CG2 4.49Å; M389-Q416 HydrophobicContact CE-CB 4.37Å; M389-Q416 HydrophobicContact CE-CG 3.88Å
390	M	46.5	Very low	56.8	Low	142 Å²	142	68.2 Å²	68.2	70%	0.7	38%	0.377	S	S	*	.			trans	-73.7	143.1	172.6	-62	-167.3	-163.9	0	0	112.3	K392 I393	M390-K392 PolarHBondContact O-N 3.47Å; M390-I393 PolarHBondContact O-N 2.58Å
391	P	51	Low	55.8	Low	107 Å²	107	70 Å²	70	70%	0.695	39%	0.386	S	S	*	.	H	α-helix	trans	-54.2	-27.8	-177.8	-29.2	34.9	0	0	0	116.1	I393 V394 S395	P391-I393 VanDerWaalsContact C-N 3.35Å; P391-I393 PolarHBondContact O-N 3.49Å; P391-V394 PolarHBondContact O-N 3.02Å; P391-S395 PolarHBondContact O-N 3.29Å
392	K	51.1	Low	55.1	Low	171 Å²	171	73.5 Å²	73.5	74%	0.743	42%	0.416	S	S	*	.	H	α-helix	trans	-65.2	-35.8	178.4	-68.6	-174.8	175.9	-176.1	0	113	M390 T396	M390-K392 PolarHBondContact O-N 3.47Å; K392-T396 WeakPolarHBondContact O-CB 3.22Å; K392-T396 PolarHBondContact O-N 2.85Å; K392-T396 PolarHBondContact O-OG1 3.03Å
393	I	56.9	Low	54.6	Low	59 Å²	59	74.7 Å²	74.7	30%	0.303	42%	0.422	S	S	.	.	H	α-helix	trans	-76.3	-40.9	-179.1	-50.4	174.9	0	0	0	109.1	M389 M390 P391 S395 T396 I397	M389-I393 HydrophobicContact CE-CB 4.27Å; M389-I393 HydrophobicContact CE-CD1 4.12Å; M389-I393 HydrophobicContact CE-CG2 3.58Å; M389-I393 HydrophobicContact CG-CD1 4.49Å; M389-I393 HydrophobicContact SD-CB 3.76Å; M389-I393 HydrophobicContact SD-CD1 4.33Å; M389-I393 HydrophobicContact SD-CG2 3.53Å; M389-I393 VanDerWaalsContact SD-CG2 3.53Å; M390-I393 PolarHBondContact O-N 2.58Å; P391-I393 VanDerWaalsContact C-N 3.35Å; P391-I393 PolarHBondContact O-N 3.49Å; I393-S395 VanDerWaalsContact C-N 3.35Å; I393-S395 PolarHBondContact O-N 3.43Å; I393-T396 WeakPolarHBondContact O-CB 3.31Å; I393-T396 PolarHBondContact O-N 3.46Å; I393-T396 VanDerWaalsContact O-N 3.08Å; I393-I397 HydrophobicContact CG2-CD1 3.88Å; I393-I397 HydrophobicContact CG2-CG1 4.32Å; I393-I397 WeakPolarHBondContact O-CG1 3.1Å; I393-I397 PolarHBondContact O-N 3.3Å
394	V	54.7	Low	54.2	Low	37 Å²	37	74.6 Å²	74.6	22%	0.224	43%	0.433	C	S	.	.	H	α-helix	trans	-53.6	-50.4	171	-173.8	0	0	0	0	111.1	V385 M389 P391 T396 I397 I398	V385-V394 HydrophobicContact CB-CG2 4.46Å; V385-V394 HydrophobicContact CG1-CG1 4.42Å; V385-V394 HydrophobicContact CG1-CG2 3.6Å; V385-V394 HydrophobicContact CG2-CG2 3.94Å; M389-V394 HydrophobicContact CB-CG2 4.49Å; P391-V394 PolarHBondContact O-N 3.02Å; V394-T396 VanDerWaalsContact C-N 3.31Å; V394-T396 PolarHBondContact O-N 3.11Å; V394-I397 PolarHBondContact O-N 3.05Å; V394-I398 HydrophobicContact CG1-CD1 3.82Å; V394-I398 HydrophobicContact CG1-CG1 4.47Å; V394-I398 WeakPolarHBondContact O-CB 3.16Å; V394-I398 VanDerWaalsContact O-CG1 3.28Å; V394-I398 WeakPolarHBondContact O-CG1 3.4Å; V394-I398 PolarHBondContact O-N 3.44Å
395	S	57	Low	54.5	Low	79 Å²	79	77.3 Å²	77.3	55%	0.552	45%	0.448	S	S	*	.	H	α-helix	trans	-61.2	-37.7	176.5	178.3	0	0	0	0	112.9	P391 I393 L399	P391-S395 PolarHBondContact O-N 3.29Å; I393-S395 VanDerWaalsContact C-N 3.35Å; I393-S395 PolarHBondContact O-N 3.43Å; S395-L399 WeakPolarHBondContact O-CB 3.08Å; S395-L399 PolarHBondContact O-N 2.9Å; S395-L399 VanDerWaalsContact O-N 3.08Å
396	T	58.5	Low	54.9	Low	65 Å²	65	75.8 Å²	75.8	40%	0.399	44%	0.439	S	S	.	.	H	α-helix	trans	-68.2	-40.7	178	-57.5	0	0	0	0	111.7	K392 I393 V394 L399 I400	K392-T396 WeakPolarHBondContact O-CB 3.22Å; K392-T396 PolarHBondContact O-N 2.85Å; K392-T396 PolarHBondContact O-OG1 3.03Å; I393-T396 WeakPolarHBondContact O-CB 3.31Å; I393-T396 PolarHBondContact O-N 3.46Å; I393-T396 VanDerWaalsContact O-N 3.08Å; V394-T396 VanDerWaalsContact C-N 3.31Å; V394-T396 PolarHBondContact O-N 3.11Å; T396-L399 PolarHBondContact O-N 2.98Å; T396-I400 HydrophobicContact CG2-CD1 4.04Å; T396-I400 VanDerWaalsContact O-CD1 3.24Å; T396-I400 WeakPolarHBondContact O-CD1 3.07Å; T396-I400 VanDerWaalsContact O-CG1 3.23Å; T396-I400 WeakPolarHBondContact O-CG1 3.4Å; T396-I400 PolarHBondContact O-N 3.43Å
397	I	56.2	Low	55.7	Low	14 Å²	14	74.8 Å²	74.8	7%	0.072	42%	0.424	C	S	.	.	H	α-helix	trans	-75.1	-39	179.5	-57.3	165.7	0	0	0	110.9	V381 I393 V394 L399 I400 L401	V381-I397 HydrophobicContact CB-CG2 4.31Å; V381-I397 HydrophobicContact CG1-CB 4.2Å; V381-I397 HydrophobicContact CG1-CD1 3.7Å; V381-I397 HydrophobicContact CG1-CG2 3.74Å; V381-I397 HydrophobicContact CG2-CD1 4.32Å; V381-I397 HydrophobicContact CG2-CG2 3.94Å; I393-I397 HydrophobicContact CG2-CD1 3.88Å; I393-I397 HydrophobicContact CG2-CG1 4.32Å; I393-I397 WeakPolarHBondContact O-CG1 3.1Å; I393-I397 PolarHBondContact O-N 3.3Å; V394-I397 PolarHBondContact O-N 3.05Å; I397-L399 VanDerWaalsContact C-N 3.26Å; I397-L399 PolarHBondContact O-N 3.01Å; I397-I400 PolarHBondContact O-N 3.47Å; I397-L401 HydrophobicContact CG2-CD1 4Å; I397-L401 HydrophobicContact CG2-CG 4.11Å; I397-L401 WeakPolarHBondContact O-CB 3.41Å; I397-L401 VanDerWaalsContact O-CG 3.29Å; I397-L401 WeakPolarHBondContact O-CG 3.23Å; I397-L401 PolarHBondContact O-N 3.38Å
398	I	57.6	Low	56.5	Low	105 Å²	105	72.1 Å²	72.1	54%	0.538	42%	0.416	S	S	.	.	H	α-helix	trans	-55.6	-43	171.4	-71.1	170.4	0	0	0	110.9	V394 I400 L401 A402	V394-I398 HydrophobicContact CG1-CD1 3.82Å; V394-I398 HydrophobicContact CG1-CG1 4.47Å; V394-I398 WeakPolarHBondContact O-CB 3.16Å; V394-I398 VanDerWaalsContact O-CG1 3.28Å; V394-I398 WeakPolarHBondContact O-CG1 3.4Å; V394-I398 PolarHBondContact O-N 3.44Å; I398-I400 VanDerWaalsContact C-N 3.28Å; I398-I400 PolarHBondContact O-N 3.26Å; I398-L401 PolarHBondContact O-N 2.98Å; I398-A402 PolarHBondContact O-N 3.02Å
399	L	57.2	Low	57.6	Low	119 Å²	119	69 Å²	69	62%	0.623	40%	0.396	S	S	*	.	H	α-helix	trans	-63.1	-33	177.5	-167.1	70.6	0	0	0	112.7	S395 T396 I397 I403	S395-L399 WeakPolarHBondContact O-CB 3.08Å; S395-L399 PolarHBondContact O-N 2.9Å; S395-L399 VanDerWaalsContact O-N 3.08Å; T396-L399 PolarHBondContact O-N 2.98Å; I397-L399 VanDerWaalsContact C-N 3.26Å; I397-L399 PolarHBondContact O-N 3.01Å; L399-I403 WeakPolarHBondContact O-CD1 3.1Å; L399-I403 WeakPolarHBondContact O-CG1 3.09Å
400	I	57.8	Low	58.9	Low	11 Å²	11	69.4 Å²	69.4	6%	0.056	40%	0.395	C	S	.	.	H	α-helix	trans	-81.5	-37.5	-179.5	-64.1	160.8	0	0	0	111.3	T396 I397 I398 A402 I403 G404 L408 V409 K412	T396-I400 HydrophobicContact CG2-CD1 4.04Å; T396-I400 VanDerWaalsContact O-CD1 3.24Å; T396-I400 WeakPolarHBondContact O-CD1 3.07Å; T396-I400 VanDerWaalsContact O-CG1 3.23Å; T396-I400 WeakPolarHBondContact O-CG1 3.4Å; T396-I400 PolarHBondContact O-N 3.43Å; I397-I400 PolarHBondContact O-N 3.47Å; I398-I400 VanDerWaalsContact C-N 3.28Å; I398-I400 PolarHBondContact O-N 3.26Å; I400-A402 PolarHBondContact O-N 2.86Å; I400-I403 WeakPolarHBondContact O-CB 3.34Å; I400-I403 PolarHBondContact O-N 3.18Å; I400-G404 PolarHBondContact O-N 2.85Å; I400-L408 HydrophobicContact CG2-CB 4.31Å; I400-L408 HydrophobicContact CG2-CD2 4.01Å; I400-L408 HydrophobicContact CG2-CG 3.99Å; I400-V409 HydrophobicContact CG2-CG2 3.78Å; I400-K412 HydrophobicContact CD1-CD 3.44Å; I400-K412 VanDerWaalsContact CD1-CD 3.44Å
401	L	54.4	Low	60	Low	40 Å²	40	66.3 Å²	66.3	21%	0.209	39%	0.388	C	S	.	.	H	α-helix	trans	-60.3	-33.1	171.1	-69.7	171.3	0	0	0	111.7	K378 I397 I398 I403 G404 V409	K378-L401 HydrophobicContact CB-CD1 3.87Å; K378-L401 HydrophobicContact CB-CD2 3.78Å; K378-L401 HydrophobicContact CB-CG 4.47Å; K378-L401 HydrophobicContact CD-CD1 4.19Å; K378-L401 HydrophobicContact CG-CD1 3.73Å; I397-L401 HydrophobicContact CG2-CD1 4Å; I397-L401 HydrophobicContact CG2-CG 4.11Å; I397-L401 WeakPolarHBondContact O-CB 3.41Å; I397-L401 VanDerWaalsContact O-CG 3.29Å; I397-L401 WeakPolarHBondContact O-CG 3.23Å; I397-L401 PolarHBondContact O-N 3.38Å; I398-L401 PolarHBondContact O-N 2.98Å; L401-I403 VanDerWaalsContact C-N 3.26Å; L401-I403 PolarHBondContact O-N 3.27Å; L401-G404 PolarHBondContact O-N 3.03Å; L401-V409 HydrophobicContact CD2-CG1 4.12Å; L401-V409 HydrophobicContact CD2-CG2 4Å
402	A	54.5	Low	60.8	Low	85 Å²	85	65.5 Å²	65.5	70%	0.702	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-17.8	173.2	0	0	0	0	0	114.2	I398 I400	I398-A402 PolarHBondContact O-N 3.02Å; I400-A402 PolarHBondContact O-N 2.86Å
403	I	57.3	Low	61.5	Low	111 Å²	111	57.6 Å²	57.6	57%	0.569	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-12.1	177.8	-62.7	164	0	0	0	111.1	L399 I400 L401 N405	L399-I403 WeakPolarHBondContact O-CD1 3.1Å; L399-I403 WeakPolarHBondContact O-CG1 3.09Å; I400-I403 WeakPolarHBondContact O-CB 3.34Å; I400-I403 PolarHBondContact O-N 3.18Å; L401-I403 VanDerWaalsContact C-N 3.26Å; L401-I403 PolarHBondContact O-N 3.27Å; I403-N405 HydrophobicContact CG2-CB 4.31Å; I403-N405 PolarHBondContact O-N 3.31Å; I403-N405 VanDerWaalsContact O-N 3.08Å
404	G	57.1	Low	62	Low	43 Å²	43	57.4 Å²	57.4	44%	0.443	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	2.3	174.8	0	0	0	0	0	115.7	I400 L401 S406	I400-G404 PolarHBondContact O-N 2.85Å; L401-G404 PolarHBondContact O-N 3.03Å; G404-S406 PolarHBondContact O-N 2.89Å
405	N	67.6	Low	62.6	Low	80 Å²	80	61.1 Å²	61.1	43%	0.428	35%	0.353	S	S	.	.			trans	-83.8	93.9	-177.8	-173.1	-34	0	0	0	110.7	I403 A407 L408 V409	I403-N405 HydrophobicContact CG2-CB 4.31Å; I403-N405 PolarHBondContact O-N 3.31Å; I403-N405 VanDerWaalsContact O-N 3.08Å; N405-A407 PolarHBondContact O-N 3.43Å; N405-A407 PolarHBondContact OD1-N 2.91Å; N405-L408 HydrophobicContact CB-CB 4.24Å; N405-L408 PolarHBondContact O-N 3.43Å; N405-L408 PolarHBondContact OD1-N 2.93Å; N405-V409 WeakPolarHBondContact O-CG2 3.41Å; N405-V409 PolarHBondContact O-N 2.81Å
406	S	68.2	Low	62.9	Low	4 Å²	4	59.5 Å²	59.5	3%	0.028	34%	0.337	C	S	.	.	H	α-helix	trans	-56.6	-34.8	-177.8	61.3	0	0	0	0	113.3	E366 S370 G404 L408 V409 R410	E366-S406 WeakPolarHBondContact CG-OG 3.34Å; E366-S406 WeakPolarHBondContact OE1-CB 3.1Å; E366-S406 PolarHBondContact OE1-OG 2.63Å; S370-S406 VanDerWaalsContact OG-CB 3.28Å; S370-S406 WeakPolarHBondContact OG-CB 3.32Å; S370-S406 PolarHBondContact OG-OG 3.12Å; G404-S406 PolarHBondContact O-N 2.89Å; S406-L408 PolarHBondContact O-N 3.16Å; S406-V409 CarbonylContact O-C 3.42Å; S406-V409 WeakPolarHBondContact O-CA 3.34Å; S406-V409 WeakPolarHBondContact O-CB 3.29Å; S406-V409 PolarHBondContact O-N 3.27Å; S406-V409 VanDerWaalsContact O-N 3.13Å; S406-R410 WeakPolarHBondContact O-CB 3.37Å; S406-R410 PolarHBondContact O-N 3.2Å
407	A	68.5	Low	63	Low	43 Å²	43	56.8 Å²	56.8	36%	0.355	32%	0.32	S	S	.	.	H	α-helix	trans	-68.5	-36.7	-177.7	0	0	0	0	0	111.8	E366 N405 R410 S411	E366-A407 VanDerWaalsContact OE1-CA 3.24Å; E366-A407 WeakPolarHBondContact OE1-CA 3.09Å; E366-A407 PolarHBondContact OE1-N 3.02Å; N405-A407 PolarHBondContact O-N 3.43Å; N405-A407 PolarHBondContact OD1-N 2.91Å; A407-R410 PolarHBondContact O-N 2.77Å; A407-S411 PolarHBondContact O-N 3.23Å
408	L	67.1	Low	63.1	Low	75 Å²	75	59.6 Å²	59.6	39%	0.393	34%	0.335	S	S	.	.	H	α-helix	trans	-70.4	-32.4	173.7	-170.6	63.6	0	0	0	112	I400 N405 S406 K412	I400-L408 HydrophobicContact CG2-CB 4.31Å; I400-L408 HydrophobicContact CG2-CD2 4.01Å; I400-L408 HydrophobicContact CG2-CG 3.99Å; N405-L408 HydrophobicContact CB-CB 4.24Å; N405-L408 PolarHBondContact O-N 3.43Å; N405-L408 PolarHBondContact OD1-N 2.93Å; S406-L408 PolarHBondContact O-N 3.16Å; L408-K412 PolarHBondContact O-N 3.26Å
409	V	67.2	Low	63	Low	4 Å²	4	58 Å²	58	2%	0.024	33%	0.328	C	S	.	.	H	α-helix	trans	-67.5	-48.5	170.6	-173.8	0	0	0	0	109.9	L377 I400 L401 N405 S406 S411 K412 V413	L377-V409 HydrophobicContact CB-CG1 3.63Å; L377-V409 HydrophobicContact CD1-CB 3.96Å; L377-V409 HydrophobicContact CD1-CG1 3.78Å; L377-V409 HydrophobicContact CG-CG1 4.32Å; I400-V409 HydrophobicContact CG2-CG2 3.78Å; L401-V409 HydrophobicContact CD2-CG1 4.12Å; L401-V409 HydrophobicContact CD2-CG2 4Å; N405-V409 WeakPolarHBondContact O-CG2 3.41Å; N405-V409 PolarHBondContact O-N 2.81Å; S406-V409 CarbonylContact O-C 3.42Å; S406-V409 WeakPolarHBondContact O-CA 3.34Å; S406-V409 WeakPolarHBondContact O-CB 3.29Å; S406-V409 PolarHBondContact O-N 3.27Å; S406-V409 VanDerWaalsContact O-N 3.13Å; V409-S411 PolarHBondContact O-N 2.92Å; V409-K412 PolarHBondContact O-N 3.41Å; V409-K412 VanDerWaalsContact O-N 3.16Å; V409-V413 HydrophobicContact CG1-CG2 4.03Å; V409-V413 WeakPolarHBondContact O-CG2 3.48Å; V409-V413 PolarHBondContact O-N 3.31Å
410	R	70.6	Confident	62.6	Low	63 Å²	63	54.3 Å²	54.3	24%	0.238	31%	0.31	C	S	.	.	H	α-helix	trans	-54.1	-51.9	179.1	174.1	165.7	64.2	135.9	-4.6	111.6	L357 E366 L377 S406 A407 K412 V413 L414	L357-R410 VanDerWaalsContact O-CD 3.3Å; L357-R410 WeakPolarHBondContact O-CD 3.24Å; L357-R410 PolarHBondContact O-NH1 3.33Å; E366-R410 IonicContact OE2-CZ 2.73Å; E366-R410 IonicContact OE2-NE 2.72Å; E366-R410 PolarHBondContact OE2-NE 3.41Å; E366-R410 IonicContact OE2-NH2 2.63Å; E366-R410 PolarHBondContact OE2-NH2 3.19Å; L377-R410 HydrophobicContact CD1-CB 4.21Å; S406-R410 WeakPolarHBondContact O-CB 3.37Å; S406-R410 PolarHBondContact O-N 3.2Å; A407-R410 PolarHBondContact O-N 2.77Å; R410-K412 VanDerWaalsContact C-N 3.29Å; R410-K412 PolarHBondContact O-N 3.43Å; R410-V413 PolarHBondContact O-N 3.29Å; R410-L414 PolarHBondContact O-N 3.03Å
411	S	69.5	Low	61.8	Low	78 Å²	78	56.9 Å²	56.9	55%	0.545	32%	0.322	S	S	.	.	H	α-helix	trans	-55.6	-41.6	178.8	173.5	0	0	0	0	112.8	A407 V409 H415	A407-S411 PolarHBondContact O-N 3.23Å; V409-S411 PolarHBondContact O-N 2.92Å; S411-H415 PolarHBondContact O-N 2.82Å
412	K	67.3	Low	61.2	Low	89 Å²	89	65.8 Å²	65.8	39%	0.387	35%	0.353	S	S	.	.	H	α-helix	trans	-76.1	-35.3	177.6	-90.4	168.8	174.1	172.5	0	113.6	I400 L408 V409 R410 H415 Q416	I400-K412 HydrophobicContact CD1-CD 3.44Å; I400-K412 VanDerWaalsContact CD1-CD 3.44Å; L408-K412 PolarHBondContact O-N 3.26Å; V409-K412 PolarHBondContact O-N 3.41Å; V409-K412 VanDerWaalsContact O-N 3.16Å; R410-K412 VanDerWaalsContact C-N 3.29Å; R410-K412 PolarHBondContact O-N 3.43Å; K412-H415 PolarHBondContact O-N 2.77Å; K412-Q416 WeakPolarHBondContact O-CB 3.4Å; K412-Q416 VanDerWaalsContact O-CG 3.29Å; K412-Q416 WeakPolarHBondContact O-CG 3.38Å; K412-Q416 PolarHBondContact O-N 3.34Å
413	V	65.3	Low	60.6	Low	6 Å²	6	64.6 Å²	64.6	4%	0.036	34%	0.343	C	S	.	.	H	α-helix	trans	-64.6	-42.6	173.3	170.4	0	0	0	0	110.3	L357 L377 V381 V409 R410 H415 Q416 L417	L357-V413 HydrophobicContact CD1-CG1 4.04Å; L377-V413 HydrophobicContact CD2-CB 4.26Å; L377-V413 HydrophobicContact CD2-CG1 4.05Å; L377-V413 HydrophobicContact CD2-CG2 4.21Å; V381-V413 HydrophobicContact CG2-CG2 3.63Å; V409-V413 HydrophobicContact CG1-CG2 4.03Å; V409-V413 WeakPolarHBondContact O-CG2 3.48Å; V409-V413 PolarHBondContact O-N 3.31Å; R410-V413 PolarHBondContact O-N 3.29Å; V413-H415 PolarHBondContact O-N 3.42Å; V413-Q416 PolarHBondContact O-N 3.34Å; V413-L417 HydrophobicContact CG1-CD1 3.75Å; V413-L417 HydrophobicContact CG1-CG 4.21Å; V413-L417 WeakPolarHBondContact O-CB 3.01Å; V413-L417 VanDerWaalsContact O-CG 3.25Å; V413-L417 WeakPolarHBondContact O-CG 3.25Å; V413-L417 PolarHBondContact O-N 3.35Å
414	L	67.8	Low	59.6	Low	54 Å²	54	62.7 Å²	62.7	28%	0.283	33%	0.334	S	S	.	.	H	α-helix	trans	-56.6	-52.4	174.4	-131.7	81	0	0	0	111.4	L357 R410 Q416 L417 D418	L357-L414 HydrophobicContact CB-CD1 3.66Å; L357-L414 HydrophobicContact CD1-CD1 3.79Å; L357-L414 HydrophobicContact CG-CD1 4.37Å; R410-L414 PolarHBondContact O-N 3.03Å; L414-Q416 VanDerWaalsContact C-N 3.32Å; L414-Q416 PolarHBondContact O-N 2.76Å; L414-L417 PolarHBondContact O-N 3.14Å; L414-L417 VanDerWaalsContact O-N 3.15Å; L414-D418 PolarHBondContact O-N 3.37Å
415	H	68.5	Low	58.4	Low	115 Å²	115	68.1 Å²	68.1	53%	0.532	35%	0.345	S	S	.	.	H	α-helix	trans	-60.5	-39.5	179.9	-164.8	-52.8	0	0	0	112.6	S411 K412 V413 D418 D419	S411-H415 PolarHBondContact O-N 2.82Å; K412-H415 PolarHBondContact O-N 2.77Å; V413-H415 PolarHBondContact O-N 3.42Å; H415-D418 PolarHBondContact O-N 2.76Å; H415-D419 IonicContact CE1-OD1 3.38Å; H415-D419 IonicContact CE1-OD2 2.75Å; H415-D419 PolarHBondContact CE1-OD2 3.41Å; H415-D419 IonicContact ND1-OD1 3.6Å; H415-D419 IonicContact ND1-OD2 3.73Å; H415-D419 PolarHBondContact ND1-OD2 2.94Å; H415-D419 VanDerWaalsContact O-CG 3.24Å; H415-D419 PolarHBondContact O-N 2.92Å; H415-D419 VanDerWaalsContact O-OD2 3.07Å
416	Q	62.6	Low	57	Low	46 Å²	46	68.8 Å²	68.8	22%	0.215	35%	0.349	C	S	.	.	H	α-helix	trans	-73.8	-30.9	177.4	-68.5	-56.2	-57.9	0	0	113	M389 K412 V413 L414 D419 T420	M389-Q416 HydrophobicContact CE-CB 4.37Å; M389-Q416 HydrophobicContact CE-CG 3.88Å; K412-Q416 WeakPolarHBondContact O-CB 3.4Å; K412-Q416 VanDerWaalsContact O-CG 3.29Å; K412-Q416 WeakPolarHBondContact O-CG 3.38Å; K412-Q416 PolarHBondContact O-N 3.34Å; V413-Q416 PolarHBondContact O-N 3.34Å; L414-Q416 VanDerWaalsContact C-N 3.32Å; L414-Q416 PolarHBondContact O-N 2.76Å; Q416-D419 PolarHBondContact NE2-OD2 2.79Å; Q416-T420 WeakPolarHBondContact O-CB 3.29Å; Q416-T420 PolarHBondContact O-N 3.13Å; Q416-T420 PolarHBondContact O-OG1 2.94Å
417	L	59.9	Low	55.6	Low	8 Å²	8	75.8 Å²	75.8	4%	0.042	38%	0.379	C	S	.	.	H	α-helix	trans	-65.7	-46.5	170.4	-73.2	169.3	0	0	0	110.4	I351 R354 L357 L384 V413 L414 D419 T420 E421	I351-L417 HydrophobicContact CB-CD2 4.32Å; I351-L417 HydrophobicContact CG1-CD2 4.14Å; I351-L417 HydrophobicContact CG2-CD2 4.11Å; R354-L417 HydrophobicContact CB-CD1 4.07Å; L357-L417 HydrophobicContact CD1-CD1 3.86Å; L384-L417 HydrophobicContact CD1-CD2 4.08Å; L384-L417 HydrophobicContact CD2-CD2 4.43Å; V413-L417 HydrophobicContact CG1-CD1 3.75Å; V413-L417 HydrophobicContact CG1-CG 4.21Å; V413-L417 WeakPolarHBondContact O-CB 3.01Å; V413-L417 VanDerWaalsContact O-CG 3.25Å; V413-L417 WeakPolarHBondContact O-CG 3.25Å; V413-L417 PolarHBondContact O-N 3.35Å; L414-L417 PolarHBondContact O-N 3.14Å; L414-L417 VanDerWaalsContact O-N 3.15Å; L417-D419 VanDerWaalsContact C-N 3.33Å; L417-D419 PolarHBondContact O-N 3.3Å; L417-T420 CarbonylContact O-C 3.38Å; L417-T420 PolarHBondContact O-N 2.77Å; L417-E421 VanDerWaalsContact O-CB 3.25Å; L417-E421 WeakPolarHBondContact O-CB 3.42Å; L417-E421 PolarHBondContact O-N 3.2Å
418	D	59.2	Low	53.7	Low	72 Å²	72	79.3 Å²	79.3	39%	0.385	39%	0.392	S	S	.	.	H	α-helix	trans	-61.7	-37	176.6	-69.7	-26.9	0	0	0	112.7	R354 L414 H415 E421	R354-D418 IonicContact NE-OD1 2.63Å; L414-D418 PolarHBondContact O-N 3.37Å; H415-D418 PolarHBondContact O-N 2.76Å; D418-E421 PolarHBondContact O-N 3.18Å
419	D	54.1	Low	52.1	Low	73 Å²	73	80.3 Å²	80.3	39%	0.39	40%	0.396	S	S	.	.	H	α-helix	trans	-65.7	-39.1	172.2	-72	-38.7	0	0	0	111.8	H415 Q416 L417	H415-D419 IonicContact CE1-OD1 3.38Å; H415-D419 IonicContact CE1-OD2 2.75Å; H415-D419 PolarHBondContact CE1-OD2 3.41Å; H415-D419 IonicContact ND1-OD1 3.6Å; H415-D419 IonicContact ND1-OD2 3.73Å; H415-D419 PolarHBondContact ND1-OD2 2.94Å; H415-D419 VanDerWaalsContact O-CG 3.24Å; H415-D419 PolarHBondContact O-N 2.92Å; H415-D419 VanDerWaalsContact O-OD2 3.07Å; Q416-D419 PolarHBondContact NE2-OD2 2.79Å; L417-D419 VanDerWaalsContact C-N 3.33Å; L417-D419 PolarHBondContact O-N 3.3Å
420	T	49.4	Very low	50.3	Low	40 Å²	40	83.6 Å²	83.6	25%	0.245	42%	0.42	C	S	.	.	H	α-helix	trans	-74.2	-28.3	178.1	-52.3	0	0	0	0	112.3	Q416 L417 R422 A423 N424	Q416-T420 WeakPolarHBondContact O-CB 3.29Å; Q416-T420 PolarHBondContact O-N 3.13Å; Q416-T420 PolarHBondContact O-OG1 2.94Å; L417-T420 CarbonylContact O-C 3.38Å; L417-T420 PolarHBondContact O-N 2.77Å; T420-R422 VanDerWaalsContact C-N 3.33Å; T420-R422 PolarHBondContact O-N 3.16Å; T420-A423 WeakPolarHBondContact O-CB 3.07Å; T420-A423 PolarHBondContact O-N 3.17Å; T420-N424 PolarHBondContact O-N 3.17Å
421	E	41.3	Very low	48.4	Very low	66 Å²	66	86.2 Å²	86.2	31%	0.308	44%	0.443	S	S	.	.	H	α-helix	trans	-75	-20.3	-172.8	-171.3	166.7	-88.1	0	0	113.7	R354 L417 D418 A423	R354-E421 WeakPolarHBondContact CD-OE1 3.43Å; R354-E421 IonicContact CZ-OE1 2.76Å; R354-E421 IonicContact CZ-OE2 3.47Å; R354-E421 IonicContact NE-OE1 3.79Å; R354-E421 PolarHBondContact NE-OE1 3.34Å; R354-E421 IonicContact NE-OE2 2.72Å; R354-E421 PolarHBondContact NE-OE2 3.37Å; R354-E421 IonicContact NH1-OE1 2.76Å; R354-E421 PolarHBondContact NH1-OE1 3.39Å; R354-E421 IonicContact NH1-OE2 3.11Å; R354-E421 PolarHBondContact NH1-OE2 2.96Å; R354-E421 VanDerWaalsContact NH1-OE2 3.13Å; R354-E421 IonicContact NH2-OE1 3.47Å; R354-E421 IonicContact NH2-OE2 2.9Å; R354-E421 PolarHBondContact NH2-OE2 3.5Å; L417-E421 VanDerWaalsContact O-CB 3.25Å; L417-E421 WeakPolarHBondContact O-CB 3.42Å; L417-E421 PolarHBondContact O-N 3.2Å; D418-E421 PolarHBondContact O-N 3.18Å; E421-A423 PolarHBondContact O-N 2.61Å
422	R	41.8	Very low	46.6	Very low	226 Å²	226	87.1 Å²	87.1	85%	0.853	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-14.8	166.1	-61.8	-172.6	-164.5	179.9	8.1	112.9	T420	T420-R422 VanDerWaalsContact C-N 3.33Å; T420-R422 PolarHBondContact O-N 3.16Å
423	A	42	Very low	45.8	Very low	61 Å²	61	84.2 Å²	84.2	50%	0.504	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-16.4	-176.2	0	0	0	0	0	114.9	T420 E421	T420-A423 WeakPolarHBondContact O-CB 3.07Å; T420-A423 PolarHBondContact O-N 3.17Å; E421-A423 PolarHBondContact O-N 2.61Å
424	N	36.6	Very low	45.8	Very low	70 Å²	70	87.4 Å²	87.4	37%	0.374	45%	0.451	S	S	.	.			trans	-139	95.9	-174.8	-82.8	-83.2	0	0	0	113	T420	T420-N424 PolarHBondContact O-N 3.17Å
425	K	31.5	Very low	46.3	Very low	158 Å²	158	86.5 Å²	86.5	69%	0.687	45%	0.446	S	S	*	.			trans	-100.6	147.4	157.1	-79.7	-174.7	174.9	-179.4	0	110.2
426	D	38.5	Very low	47	Very low	93 Å²	93	81 Å²	81	50%	0.497	42%	0.421	S	S	.	.			trans	86.5	84	164.9	-51.3	-34.1	0	0	0	119.3	N143 A145	N143-D426 WeakPolarHBondContact O-CB 3.38Å; A145-D426 HydrophobicContact CB-CB 3.93Å
427	K	39.1	Very low	47.9	Very low	151 Å²	151	82.5 Å²	82.5	66%	0.657	43%	0.425	S	S	*	.			trans	34.9	113.5	131	-65.2	-177.8	179.9	-176.6	0	118.8
428	N	28.9	Very low	49	Very low	117 Å²	117	82.1 Å²	82.1	63%	0.626	42%	0.423	S	S	*	.				85	88.8	86	-151.4	32	0	0	0	113.7	K352	K352-N428 HydrophobicContact CD-CB 4.32Å; K352-N428 WeakPolarHBondContact CE-OD1 3.37Å; K352-N428 PolarHBondContact NZ-OD1 3.13Å
429	I	33.9	Very low	50	Low	96 Å²	96	81 Å²	81	49%	0.492	42%	0.418	S	S	.	.			trans	-126.8	126.8	174.4	-63	175.3	0	0	0	109	M147	M147-I429 HydrophobicContact CE-CD1 4.32Å
430	S	28	Very low	51.1	Low	74 Å²	74	78 Å²	78	52%	0.517	40%	0.402	S	S	.	.			trans	-102.2	-179.2	172.3	60.1	0	0	0	0	111.5
431	T	31.7	Very low	52.4	Low	117 Å²	117	81.9 Å²	81.9	72%	0.718	42%	0.416	S	S	*	.			trans	81.3	147.3	-176.8	72.4	0	0	0	0	116.1
432	C	31.7	Very low	54.2	Low	98 Å²	98	83.9 Å²	83.9	66%	0.662	42%	0.421	S	S	*	.			trans	-112.6	122	-148.4	-175.6	0	0	0	0	111.4
433	D	50.3	Low	56.2	Low	28 Å²	28	74.7 Å²	74.7	15%	0.15	39%	0.39	C	S	.	.			trans	-133.3	159.1	179.3	-56.8	-34.4	0	0	0	108.2	K59 I435	K59-D433 HydrophobicContact CB-CB 3.82Å; K59-D433 WeakPolarHBondContact CB-OD1 3.39Å; K59-D433 WeakPolarHBondContact CD-OD1 3.45Å; D433-I435 WeakPolarHBondContact O-CG1 3.41Å; D433-I435 PolarHBondContact O-N 3.42Å
434	E	65.9	Low	58.2	Low	72 Å²	72	75.1 Å²	75.1	34%	0.336	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	127.4	171.5	-72.1	-177.8	-176.7	0	0	109.8	K59 H60 R61 F86	K59-E434 PolarHBondContact O-N 2.76Å; H60-E434 WeakPolarHBondContact CA-O 3.36Å; H60-E434 VanDerWaalsContact CE1-C 3.44Å; H60-E434 WeakPolarHBondContact CE1-CB 3.34Å; H60-E434 PolarHBondContact CE1-O 2.84Å; H60-E434 IonicContact CE1-OE2 3.87Å; H60-E434 PolarHBondContact CE1-OE2 2.62Å; H60-E434 PolarHBondContact ND1-O 3.47Å; H60-E434 IonicContact ND1-OE2 2.81Å; R61-E434 PolarHBondContact N-O 2.9Å; F86-E434 WeakPolarHBondContact CA-OE2 3.47Å; F86-E434 WeakPolarHBondContact CB-OE2 3.29Å
435	I	78.3	Confident	60.5	Low	35 Å²	35	72.2 Å²	72.2	18%	0.179	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	127.3	179.7	-51.4	-176.6	0	0	0	109	R61 I63 D433 C589 D590	R61-I435 HydrophobicContact CB-CG1 4.39Å; R61-I435 CarbonylContact O-C 3.31Å; R61-I435 WeakPolarHBondContact O-CA 3.47Å; I63-I435 HydrophobicContact CD1-CG2 4.1Å; D433-I435 WeakPolarHBondContact O-CG1 3.41Å; D433-I435 PolarHBondContact O-N 3.42Å; I435-C589 CarbonylContact O-C 3.05Å; I435-C589 WeakPolarHBondContact O-CA 3.43Å; I435-D590 HydrophobicContact CB-CB 4.28Å; I435-D590 PolarHBondContact O-N 3.13Å
436	S	82.4	Confident	63.3	Low	0 Å²	0	71.1 Å²	71.1	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	140.7	165.4	65	0	0	0	0	111.7	H60 R61 W62 I63 V588	H60-S436 VanDerWaalsContact NE2-CB 3.33Å; H60-S436 WeakPolarHBondContact NE2-CB 3.44Å; R61-S436 PolarHBondContact O-N 3.03Å; W62-S436 WeakPolarHBondContact CA-O 3.3Å; W62-S436 VanDerWaalsContact CD1-OG 3.3Å; I63-S436 PolarHBondContact N-O 3.18Å; S436-V588 CarbonylContact C-O 3.58Å; S436-V588 VanDerWaalsContact CA-O 3.23Å; S436-V588 WeakPolarHBondContact CA-O 3.38Å
437	R	81.3	Confident	65.8	Low	77 Å²	77	68.1 Å²	68.1	29%	0.291	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	122.9	173.7	-72.8	-176.4	-174.3	74.4	-0.6	110.4	I63 E65 T587 V588 D590	I63-R437 HydrophobicContact CB-CG 4.19Å; I63-R437 HydrophobicContact CD1-CG 4.45Å; I63-R437 CarbonylContact O-C 3.55Å; I63-R437 VanDerWaalsContact O-CA 3.31Å; I63-R437 WeakPolarHBondContact O-CA 3.35Å; E65-R437 WeakPolarHBondContact OE1-CD 3.24Å; R437-T587 CarbonylContact O-C 3.55Å; R437-T587 VanDerWaalsContact O-CA 3.27Å; R437-T587 WeakPolarHBondContact O-CA 3.43Å; R437-V588 PolarHBondContact N-O 3.39Å; R437-V588 PolarHBondContact O-N 3.14Å; R437-D590 IonicContact CZ-OD2 2.68Å; R437-D590 IonicContact NH1-OD1 2.58Å; R437-D590 PolarHBondContact NH1-OD1 2.97Å; R437-D590 IonicContact NH1-OD2 2.74Å; R437-D590 PolarHBondContact NH1-OD2 3.34Å; R437-D590 IonicContact NH2-OD2 3.19Å
438	S	84	Confident	68.3	Low	1 Å²	1	65.1 Å²	65.1	1%	0.007	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	119	167.3	-63.3	0	0	0	0	109.3	W62 I63 E65 Q70 S586 T587	W62-S438 PolarHBondContact NE1-OG 2.87Å; I63-S438 PolarHBondContact O-N 2.83Å; E65-S438 PolarHBondContact N-O 3.18Å; Q70-S438 PolarHBondContact NE2-O 3.27Å; S438-S586 CarbonylContact C-O 3.6Å; S438-S586 WeakPolarHBondContact CA-O 2.9Å; S438-T587 WeakPolarHBondContact OG-CG2 3.3Å; S438-T587 PolarHBondContact OG-OG1 3.27Å
439	T	79.7	Confident	71.3	Confident	47 Å²	47	60.9 Å²	60.9	29%	0.288	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	166.6	178.7	-157.1	0	0	0	0	110.4	E65 I585 S586	E65-T439 WeakPolarHBondContact OE2-CB 3.28Å; E65-T439 PolarHBondContact OE2-OG1 3.06Å; T439-I585 WeakPolarHBondContact O-CA 3.32Å; T439-S586 PolarHBondContact N-O 2.96Å; T439-S586 PolarHBondContact O-N 3.45Å
440	I	76.3	Confident	73.9	Confident	10 Å²	10	60 Å²	60	5%	0.051	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	126.5	-176	-174.9	166.3	0	0	0	112.4	H66 Q70 L73 Y442 Y582 I585	H66-I440 HydrophobicContact CB-CG2 3.64Å; Q70-I440 HydrophobicContact CG-CB 4.2Å; Q70-I440 HydrophobicContact CG-CG2 4.47Å; L73-I440 HydrophobicContact CD1-CD1 3.09Å; I440-Y442 HydrophobicContact CG2-CD1 4.36Å; I440-Y442 WeakPolarHBondContact O-CD1 3.26Å; I440-Y582 HydrophobicContact CD1-CD1 3.39Å; I440-Y582 HydrophobicContact CD1-CE1 3.99Å; I440-Y582 HydrophobicContact CD1-CG 4.06Å; I440-Y582 HydrophobicContact CG1-CD1 4.1Å; I440-I585 HydrophobicContact CB-CG1 4.42Å; I440-I585 HydrophobicContact CD1-CG1 4.17Å; I440-I585 HydrophobicContact CG1-CG1 4.19Å
441	K	77.6	Confident	76.9	Confident	123 Å²	123	56.6 Å²	56.6	54%	0.535	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	127.5	173.6	-168	-179.8	178.9	-133.8	0	110.4	E583 E584	K441-E583 HydrophobicContact CB-CB 4.46Å; K441-E583 WeakPolarHBondContact CE-OE2 3.3Å; K441-E583 IonicContact NZ-OE2 2.72Å; K441-E583 PolarHBondContact NZ-OE2 2.05Å; K441-E583 PolarHBondContact O-N 3.35Å; K441-E584 PolarHBondContact N-O 3.25Å
442	Y	79.3	Confident	79.5	Confident	107 Å²	107	57.3 Å²	57.3	42%	0.42	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	156.3	178.7	63.2	-94.8	0	0	0	112.7	I440 V444 T580 I581	I440-Y442 HydrophobicContact CG2-CD1 4.36Å; I440-Y442 WeakPolarHBondContact O-CD1 3.26Å; Y442-V444 HydrophobicContact CD2-CG2 3.71Å; Y442-V444 HydrophobicContact CE2-CG2 3.67Å; Y442-T580 HydrophobicContact CD2-CG2 3.6Å; Y442-T580 HydrophobicContact CE2-CG2 4.34Å; Y442-T580 HydrophobicContact CG-CG2 3.85Å; Y442-I581 CarbonylContact C-O 3.56Å; Y442-I581 WeakPolarHBondContact CA-O 3.12Å; Y442-I581 VanDerWaalsContact CB-O 3.28Å; Y442-I581 WeakPolarHBondContact CB-O 3.31Å
443	T	83.1	Confident	82.2	Confident	33 Å²	33	56.9 Å²	56.9	20%	0.202	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	125	175.9	-74.4	0	0	0	0	109.2	P476 I581 E583	T443-P476 HydrophobicContact CG2-CG 3.95Å; T443-I581 PolarHBondContact N-O 3.33Å; T443-I581 PolarHBondContact O-N 3.13Å; T443-E583 PolarHBondContact OG1-OE1 2.84Å
444	V	83.6	Confident	84	Confident	71 Å²	71	55.7 Å²	55.7	43%	0.43	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	126.2	-178.5	-174.9	0	0	0	0	111	Y442 V578 T580	Y442-V444 HydrophobicContact CD2-CG2 3.71Å; Y442-V444 HydrophobicContact CE2-CG2 3.67Å; V444-V578 HydrophobicContact CG1-CG1 3.56Å; V444-T580 HydrophobicContact CG2-CG2 4.32Å
445	V	86.7	Confident	84.9	Confident	9 Å²	9	57.1 Å²	57.1	6%	0.055	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	116.7	172.8	-166.6	0	0	0	0	108.5	F473 V578 V579 I581	V445-F473 HydrophobicContact CG1-CD2 3.84Å; V445-F473 HydrophobicContact CG1-CE2 4.4Å; V445-V578 CarbonylContact O-C 3.49Å; V445-V578 WeakPolarHBondContact O-CA 3.36Å; V445-V579 HydrophobicContact CB-CB 4.37Å; V445-V579 PolarHBondContact N-O 3.19Å; V445-V579 PolarHBondContact O-N 2.84Å; V445-I581 HydrophobicContact CG2-CD1 3.71Å; V445-I581 HydrophobicContact CG2-CG1 4.36Å
446	K	89.2	Confident	85.2	Confident	134 Å²	134	61 Å²	61	58%	0.583	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.2	175.6	-177.4	171.3	-174.3	179.1	0	110	I576 C577 V578	K446-I576 HydrophobicContact CD-CG2 4.45Å; K446-I576 VanDerWaalsContact CE-CG2 3.43Å; K446-I576 HydrophobicContact CG-CG2 4.29Å; K446-C577 WeakPolarHBondContact CA-O 3.47Å; K446-V578 HydrophobicContact CD-CG2 4.37Å; K446-V578 HydrophobicContact CG-CG2 4.12Å
447	H	90.8	Very high	85.4	Confident	31 Å²	31	64.8 Å²	64.8	14%	0.144	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	138.2	173	-173.5	69.6	0	0	0	109.9	F473 I576 C577	H447-F473 HydrophobicContact CB-CB 4.27Å; H447-F473 HydrophobicContact CB-CD1 3.68Å; H447-F473 HydrophobicContact CB-CD2 3.7Å; H447-F473 HydrophobicContact CB-CE1 3.78Å; H447-F473 HydrophobicContact CB-CE2 3.79Å; H447-F473 HydrophobicContact CB-CG 3.63Å; H447-F473 HydrophobicContact CB-CZ 3.82Å; H447-F473 AromaticContact CD2-CD1 3.49Å; H447-F473 VanDerWaalsContact CD2-CD1 3.49Å; H447-F473 WeakPolarHBondContact CD2-CD1 3.49Å; H447-F473 AromaticContact CD2-CE1 3.56Å; H447-F473 AromaticContact CE1-CD1 3.95Å; H447-F473 AromaticContact CG-CD1 3.32Å; H447-F473 AromaticContact CG-CE1 3.67Å; H447-F473 AromaticContact CG-CG 3.63Å; H447-F473 AromaticContact ND1-CD1 3.64Å; H447-F473 AromaticContact ND1-CG 3.78Å; H447-F473 AromaticContact NE2-CD1 3.89Å; H447-I576 WeakPolarHBondContact O-CA 3.26Å; H447-C577 PolarHBondContact N-O 3.34Å; H447-C577 PolarHBondContact O-N 2.99Å
448	Q	90.9	Very high	85.5	Confident	88 Å²	88	61.9 Å²	61.9	41%	0.411	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	117.8	173.2	-179	178.1	-39.7	0	0	107.7	I450 T574 L575 I576	Q448-I450 HydrophobicContact CG-CG1 4.31Å; Q448-T574 HydrophobicContact CG-CG2 3.64Å; Q448-L575 CarbonylContact C-O 3.59Å; Q448-L575 WeakPolarHBondContact CA-O 3.4Å; Q448-I576 HydrophobicContact CB-CG1 4.49Å; Q448-I576 HydrophobicContact CG-CG1 4.22Å
449	W	92.1	Very high	85.5	Confident	28 Å²	28	64.9 Å²	64.9	11%	0.106	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	108.1	176.3	-179.4	23.5	0	0	0	108	I451 M468 I484 L486 L507 L575	W449-I451 HydrophobicContact CD2-CD1 4.1Å; W449-I451 HydrophobicContact CD2-CG1 3.95Å; W449-I451 HydrophobicContact CE3-CD1 4.22Å; W449-I451 HydrophobicContact CG-CG1 4.29Å; W449-I451 HydrophobicContact CH2-CD1 3.83Å; W449-I451 HydrophobicContact CH2-CG1 4.41Å; W449-I451 HydrophobicContact CZ2-CD1 3.7Å; W449-I451 HydrophobicContact CZ2-CG1 3.78Å; W449-I451 HydrophobicContact CZ3-CD1 4.09Å; W449-M468 HydrophobicContact CH2-CB 4.15Å; W449-M468 HydrophobicContact CZ2-CB 4.37Å; W449-I484 HydrophobicContact CE3-CB 4.12Å; W449-I484 HydrophobicContact CE3-CG2 3.89Å; W449-I484 HydrophobicContact CZ3-CB 4.31Å; W449-I484 HydrophobicContact CZ3-CG2 3.84Å; W449-L486 HydrophobicContact CH2-CB 3.91Å; W449-L486 HydrophobicContact CZ3-CB 4.05Å; W449-L507 HydrophobicContact CZ3-CD1 4.06Å; W449-L575 HydrophobicContact CE3-CD1 3.87Å; W449-L575 HydrophobicContact CZ3-CD1 4.12Å; W449-L575 PolarHBondContact N-O 3.12Å; W449-L575 PolarHBondContact O-N 2.93Å
450	I	89.7	Confident	85.6	Confident	77 Å²	77	66.5 Å²	66.5	40%	0.395	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	128.3	170.8	-51	175.9	0	0	0	106.9	Q448 E452 A572 T574	Q448-I450 HydrophobicContact CG-CG1 4.31Å; I450-E452 HydrophobicContact CG2-CG 4.08Å; I450-A572 HydrophobicContact CG2-CB 4.04Å; I450-T574 HydrophobicContact CG1-CG2 4.17Å
451	I	89.7	Confident	85.8	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.01	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	94.7	174.2	-52	167.5	0	0	0	106.9	W449 F454 M468 L486 A572 L573 L575	W449-I451 HydrophobicContact CD2-CD1 4.1Å; W449-I451 HydrophobicContact CD2-CG1 3.95Å; W449-I451 HydrophobicContact CE3-CD1 4.22Å; W449-I451 HydrophobicContact CG-CG1 4.29Å; W449-I451 HydrophobicContact CH2-CD1 3.83Å; W449-I451 HydrophobicContact CH2-CG1 4.41Å; W449-I451 HydrophobicContact CZ2-CD1 3.7Å; W449-I451 HydrophobicContact CZ2-CG1 3.78Å; W449-I451 HydrophobicContact CZ3-CD1 4.09Å; I451-F454 HydrophobicContact CB-CD2 4.22Å; I451-F454 HydrophobicContact CD1-CD2 4.32Å; I451-F454 HydrophobicContact CD1-CE2 4.48Å; I451-F454 HydrophobicContact CG2-CB 4.45Å; I451-F454 HydrophobicContact CG2-CD2 3.91Å; I451-M468 HydrophobicContact CD1-CE 4.16Å; I451-M468 HydrophobicContact CG2-CE 3.61Å; I451-L486 HydrophobicContact CD1-CD2 4.1Å; I451-A572 VanDerWaalsContact O-CA 3.31Å; I451-A572 WeakPolarHBondContact O-CA 3.38Å; I451-L573 HydrophobicContact CB-CB 4.42Å; I451-L573 HydrophobicContact CD1-CD2 4.45Å; I451-L573 PolarHBondContact N-O 3.32Å; I451-L573 PolarHBondContact O-N 3.04Å; I451-L575 HydrophobicContact CD1-CD1 4.05Å
452	E	88.2	Confident	85.7	Confident	133 Å²	133	66.2 Å²	66.2	62%	0.621	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	149.8	174.7	-61	175.1	162.7	0	0	110.6	I450 F454 Q457	I450-E452 HydrophobicContact CG2-CG 4.08Å; E452-F454 VanDerWaalsContact C-N 3.27Å; E452-F454 PolarHBondContact O-N 3.48Å; E452-Q457 PolarHBondContact O-NE2 2.79Å
453	N	88.2	Confident	85.6	Confident	89 Å²	89	68 Å²	68	48%	0.476	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	45.4	-172.5	-54.4	-5.9	0	0	0	112	I455 E456 Q457 D571	N453-I455 VanDerWaalsContact C-N 3.29Å; N453-I455 PolarHBondContact O-N 3.26Å; N453-E456 HydrophobicContact CB-CB 4.26Å; N453-E456 HydrophobicContact CB-CG 4.42Å; N453-E456 PolarHBondContact O-N 2.76Å; N453-E456 VanDerWaalsContact O-N 3.12Å; N453-Q457 PolarHBondContact O-N 3.47Å; N453-D571 WeakPolarHBondContact CA-O 3.48Å; N453-D571 VanDerWaalsContact CA-OD2 3.28Å; N453-D571 WeakPolarHBondContact CA-OD2 3.2Å; N453-D571 PolarHBondContact N-O 3.12Å
454	F	87.5	Confident	85.3	Confident	3 Å²	3	72.7 Å²	72.7	1%	0.013	36%	0.358	C	S	.	.	H	α-helix	trans	-56	-41.1	-171.7	175.3	-101.9	0	0	0	112.5	I451 E452 Q457 E458 M468 L486 I568 D571 L573	I451-F454 HydrophobicContact CB-CD2 4.22Å; I451-F454 HydrophobicContact CD1-CD2 4.32Å; I451-F454 HydrophobicContact CD1-CE2 4.48Å; I451-F454 HydrophobicContact CG2-CB 4.45Å; I451-F454 HydrophobicContact CG2-CD2 3.91Å; E452-F454 VanDerWaalsContact C-N 3.27Å; E452-F454 PolarHBondContact O-N 3.48Å; F454-Q457 PolarHBondContact O-N 3.09Å; F454-E458 HydrophobicContact CZ-CB 4.34Å; F454-E458 WeakPolarHBondContact O-CB 3.07Å; F454-E458 PolarHBondContact O-N 2.96Å; F454-M468 HydrophobicContact CD2-CE 4.01Å; F454-M468 HydrophobicContact CE2-CE 3.95Å; F454-L486 HydrophobicContact CE2-CD2 3.68Å; F454-L486 HydrophobicContact CZ-CD2 4.29Å; F454-I568 HydrophobicContact CD1-CD1 3.64Å; F454-I568 HydrophobicContact CD1-CG1 4.24Å; F454-I568 HydrophobicContact CE1-CD1 3.93Å; F454-D571 PolarHBondContact N-O 2.79Å; F454-D571 PolarHBondContact N-OD1 3.24Å; F454-D571 VanDerWaalsContact N-OD1 3.14Å; F454-L573 HydrophobicContact CB-CB 4.15Å; F454-L573 HydrophobicContact CD1-CB 4.47Å; F454-L573 HydrophobicContact CD2-CB 3.76Å; F454-L573 HydrophobicContact CD2-CD2 3.8Å; F454-L573 HydrophobicContact CD2-CG 4.43Å; F454-L573 HydrophobicContact CE1-CD2 4.38Å; F454-L573 HydrophobicContact CE2-CB 4.36Å; F454-L573 HydrophobicContact CE2-CD2 3.5Å; F454-L573 HydrophobicContact CG-CB 3.84Å; F454-L573 HydrophobicContact CG-CD2 4.38Å; F454-L573 HydrophobicContact CZ-CD2 3.83Å
455	I	83.5	Confident	84.9	Confident	102 Å²	102	75.6 Å²	75.6	52%	0.523	38%	0.376	S	S	.	.	H	α-helix	trans	-63.7	-41.5	178.9	-67.6	163.6	0	0	0	111.2	N453 S459 D571	N453-I455 VanDerWaalsContact C-N 3.29Å; N453-I455 PolarHBondContact O-N 3.26Å; I455-S459 WeakPolarHBondContact O-CB 3.36Å; I455-S459 PolarHBondContact O-N 3.41Å; I455-S459 VanDerWaalsContact O-N 3.07Å; I455-S459 PolarHBondContact O-OG 3.47Å; I455-D571 WeakPolarHBondContact CD1-OD1 3.27Å; I455-D571 VanDerWaalsContact CG1-OD1 3.24Å; I455-D571 WeakPolarHBondContact CG1-OD1 3.49Å; I455-D571 PolarHBondContact N-OD1 3.27Å
456	E	85.2	Confident	84.4	Confident	117 Å²	117	80.2 Å²	80.2	55%	0.547	40%	0.398	S	S	.	.	H	α-helix	trans	-67.9	-44.8	175.8	-61.7	-169.2	152.2	0	0	111.5	N453 S459 L460	N453-E456 HydrophobicContact CB-CB 4.26Å; N453-E456 HydrophobicContact CB-CG 4.42Å; N453-E456 PolarHBondContact O-N 2.76Å; N453-E456 VanDerWaalsContact O-N 3.12Å; E456-S459 WeakPolarHBondContact O-CB 3.49Å; E456-S459 PolarHBondContact O-N 3.44Å; E456-L460 WeakPolarHBondContact O-CG 3.49Å; E456-L460 PolarHBondContact O-N 3.38Å
457	Q	87.3	Confident	83.9	Confident	79 Å²	79	78.1 Å²	78.1	37%	0.369	40%	0.398	S	S	.	.	H	α-helix	trans	-65	-40.9	178.7	-67.7	-161.2	45.7	0	0	112.5	E452 N453 F454 S459 L460 Q461 M468	E452-Q457 PolarHBondContact O-NE2 2.79Å; N453-Q457 PolarHBondContact O-N 3.47Å; F454-Q457 PolarHBondContact O-N 3.09Å; Q457-S459 VanDerWaalsContact C-N 3.31Å; Q457-S459 PolarHBondContact O-N 3.3Å; Q457-L460 PolarHBondContact O-N 3.07Å; Q457-Q461 WeakPolarHBondContact O-CB 3.29Å; Q457-Q461 PolarHBondContact O-N 3.21Å; Q457-M468 HydrophobicContact CB-CE 3.7Å; Q457-M468 HydrophobicContact CB-SD 4.27Å
458	E	83.6	Confident	83.7	Confident	16 Å²	16	77.1 Å²	77.1	8%	0.075	39%	0.394	C	S	.	.	H	α-helix	trans	-63.2	-39.3	174	179	173.3	-84.1	0	0	110.8	F454 Q461 K462 R505	F454-E458 HydrophobicContact CZ-CB 4.34Å; F454-E458 WeakPolarHBondContact O-CB 3.07Å; F454-E458 PolarHBondContact O-N 2.96Å; E458-Q461 PolarHBondContact O-N 2.93Å; E458-K462 HydrophobicContact CG-CD 4.34Å; E458-K462 WeakPolarHBondContact O-CG 3.32Å; E458-K462 PolarHBondContact O-N 3.04Å; E458-K462 VanDerWaalsContact O-N 3.07Å; E458-K462 IonicContact OE2-NZ 2.69Å; E458-K462 PolarHBondContact OE2-NZ 3.37Å; E458-R505 IonicContact OE1-CZ 3.56Å; E458-R505 IonicContact OE1-NE 3.8Å; E458-R505 PolarHBondContact OE1-NE 3.05Å; E458-R505 IonicContact OE1-NH2 2.66Å; E458-R505 PolarHBondContact OE1-NH2 3.21Å; E458-R505 IonicContact OE2-CZ 2.75Å; E458-R505 IonicContact OE2-NE 3.45Å; E458-R505 IonicContact OE2-NH2 2.72Å; E458-R505 PolarHBondContact OE2-NH2 3.06Å
459	S	82.4	Confident	83.7	Confident	63 Å²	63	77.1 Å²	77.1	44%	0.441	39%	0.394	S	S	.	.	H	α-helix	trans	-64.3	-43.8	175.7	-59.6	0	0	0	0	111.6	I455 E456 Q457 K462 L463	I455-S459 WeakPolarHBondContact O-CB 3.36Å; I455-S459 PolarHBondContact O-N 3.41Å; I455-S459 VanDerWaalsContact O-N 3.07Å; I455-S459 PolarHBondContact O-OG 3.47Å; E456-S459 WeakPolarHBondContact O-CB 3.49Å; E456-S459 PolarHBondContact O-N 3.44Å; Q457-S459 VanDerWaalsContact C-N 3.31Å; Q457-S459 PolarHBondContact O-N 3.3Å; S459-K462 PolarHBondContact O-N 3.42Å; S459-L463 WeakPolarHBondContact O-CB 3.08Å; S459-L463 PolarHBondContact O-N 2.98Å
460	L	81.9	Confident	83.7	Confident	81 Å²	81	76 Å²	76	42%	0.424	39%	0.39	S	S	.	.	H	α-helix	trans	-66.3	-37.5	175.2	-72.6	170.6	0	0	0	112.9	E456 Q457 K462 L463 K464	E456-L460 WeakPolarHBondContact O-CG 3.49Å; E456-L460 PolarHBondContact O-N 3.38Å; Q457-L460 PolarHBondContact O-N 3.07Å; L460-K462 VanDerWaalsContact C-N 3.35Å; L460-L463 PolarHBondContact O-N 2.85Å; L460-K464 PolarHBondContact O-N 3.11Å
461	Q	81.8	Confident	83.7	Confident	19 Å²	19	75.8 Å²	75.8	9%	0.089	40%	0.399	C	S	.	.	H	α-helix	trans	-58.5	-47.4	172.9	168.3	164.5	104.4	0	0	110.8	Q457 E458 T465 M466 M468 L486	Q457-Q461 WeakPolarHBondContact O-CB 3.29Å; Q457-Q461 PolarHBondContact O-N 3.21Å; E458-Q461 PolarHBondContact O-N 2.93Å; Q461-T465 WeakPolarHBondContact O-CA 3.43Å; Q461-T465 PolarHBondContact O-N 3.04Å; Q461-M466 WeakPolarHBondContact CB-O 3.42Å; Q461-M466 WeakPolarHBondContact CG-O 3.44Å; Q461-M466 PolarHBondContact NE2-O 3.22Å; Q461-M468 HydrophobicContact CB-CG 4.26Å; Q461-M468 HydrophobicContact CB-SD 4.01Å; Q461-M468 VanDerWaalsContact NE2-N 3.18Å; Q461-L486 PolarHBondContact NE2-O 3.07Å
462	K	75.8	Confident	83.8	Confident	108 Å²	108	80.4 Å²	80.4	47%	0.47	42%	0.421	S	S	.	.	H	α-helix	trans	-64.4	-41.5	177.6	-68.9	166.9	-172.5	165.2	0	112	E458 S459 L460	E458-K462 HydrophobicContact CG-CD 4.34Å; E458-K462 WeakPolarHBondContact O-CG 3.32Å; E458-K462 PolarHBondContact O-N 3.04Å; E458-K462 VanDerWaalsContact O-N 3.07Å; E458-K462 IonicContact OE2-NZ 2.69Å; E458-K462 PolarHBondContact OE2-NZ 3.37Å; S459-K462 PolarHBondContact O-N 3.42Å; L460-K462 VanDerWaalsContact C-N 3.35Å
463	L	77	Confident	83.9	Confident	146 Å²	146	74.8 Å²	74.8	76%	0.764	40%	0.395	S	S	*	.	H	α-helix	trans	-81.2	-28.9	-171.9	-145.1	120.3	0	0	0	114.4	S459 L460	S459-L463 WeakPolarHBondContact O-CB 3.08Å; S459-L463 PolarHBondContact O-N 2.98Å; L460-L463 PolarHBondContact O-N 2.85Å
464	K	76.3	Confident	84	Confident	131 Å²	131	73.5 Å²	73.5	57%	0.57	39%	0.39	S	S	*	.	H	α-helix	trans	-127.2	10.5	-173.6	-68.3	-174.2	177.5	178.5	0	114.5	L460 M466	L460-K464 PolarHBondContact O-N 3.11Å; K464-M466 HydrophobicContact CB-CG 3.84Å; K464-M466 HydrophobicContact CB-SD 4.3Å; K464-M466 HydrophobicContact CD-SD 4.31Å; K464-M466 PolarHBondContact O-N 2.92Å
465	T	74.4	Confident	83.8	Confident	131 Å²	131	73.5 Å²	73.5	80%	0.804	39%	0.39	S	S	*	.			trans	49.4	30	-173.6	52.2	0	0	0	0	114.1	Q461 P467	Q461-T465 WeakPolarHBondContact O-CA 3.43Å; Q461-T465 PolarHBondContact O-N 3.04Å; T465-P467 WeakPolarHBondContact O-CD 3.35Å
466	M	75.9	Confident	83.8	Confident	107 Å²	107	73.4 Å²	73.4	53%	0.527	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-73.1	122.4	-179.8	-69.9	-171.5	72.8	0	0	110.6	Q461 K464 M468	Q461-M466 WeakPolarHBondContact CB-O 3.42Å; Q461-M466 WeakPolarHBondContact CG-O 3.44Å; Q461-M466 PolarHBondContact NE2-O 3.22Å; K464-M466 HydrophobicContact CB-CG 3.84Å; K464-M466 HydrophobicContact CB-SD 4.3Å; K464-M466 HydrophobicContact CD-SD 4.31Å; K464-M466 PolarHBondContact O-N 2.92Å; M466-M468 PolarHBondContact O-N 2.95Å
467	P	79.3	Confident	83.5	Confident	89 Å²	89	70.9 Å²	70.9	58%	0.578	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-76.1	121.9	-176.7	30.2	-34.1	0	0	0	110.6	T465 Q469	T465-P467 WeakPolarHBondContact O-CD 3.35Å; P467-Q469 HydrophobicContact CB-CG 4.16Å; P467-Q469 PolarHBondContact O-N 3.45Å
468	M	88	Confident	83.3	Confident	11 Å²	11	75.5 Å²	75.5	5%	0.054	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	119.5	172	-66.4	170.6	74.3	0	0	108.1	W449 I451 F454 Q457 Q461 M466 S485 L486	W449-M468 HydrophobicContact CH2-CB 4.15Å; W449-M468 HydrophobicContact CZ2-CB 4.37Å; I451-M468 HydrophobicContact CD1-CE 4.16Å; I451-M468 HydrophobicContact CG2-CE 3.61Å; F454-M468 HydrophobicContact CD2-CE 4.01Å; F454-M468 HydrophobicContact CE2-CE 3.95Å; Q457-M468 HydrophobicContact CB-CE 3.7Å; Q457-M468 HydrophobicContact CB-SD 4.27Å; Q461-M468 HydrophobicContact CB-CG 4.26Å; Q461-M468 HydrophobicContact CB-SD 4.01Å; Q461-M468 VanDerWaalsContact NE2-N 3.18Å; M466-M468 PolarHBondContact O-N 2.95Å; M468-S485 WeakPolarHBondContact O-CA 3.21Å; M468-L486 HydrophobicContact CB-CB 4.22Å; M468-L486 HydrophobicContact CE-CD2 4.25Å; M468-L486 PolarHBondContact O-N 3.13Å
469	Q	90.8	Very high	83.2	Confident	88 Å²	88	80.6 Å²	80.6	41%	0.411	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	145.2	-175.3	-57.3	-178.8	-16	0	0	111.4	P467 K483 I484	P467-Q469 HydrophobicContact CB-CG 4.16Å; P467-Q469 PolarHBondContact O-N 3.45Å; Q469-K483 VanDerWaalsContact CB-CE 3.44Å; Q469-I484 CarbonylContact C-O 3.29Å; Q469-I484 VanDerWaalsContact CA-O 3.27Å; Q469-I484 WeakPolarHBondContact CA-O 3.25Å
470	S	91.4	Very high	83.3	Confident	5 Å²	5	78.2 Å²	78.2	4%	0.035	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-71.5	166	174.2	76.3	0	0	0	0	111.8	K483 I484	S470-K483 VanDerWaalsContact O-CE 3.29Å; S470-K483 WeakPolarHBondContact O-CE 3.46Å; S470-I484 PolarHBondContact N-O 3.02Å; S470-I484 PolarHBondContact OG-N 3.21Å
471	A	90	Very high	83.6	Confident	71 Å²	71	77.5 Å²	77.5	59%	0.587	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-57.9	154.9	156.5	0	0	0	0	0	110.3
472	E	91.5	Very high	84	Confident	99 Å²	99	76.6 Å²	76.6	46%	0.463	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-73.7	138.3	172.4	-58.1	173.4	122	0	0	109.7	K481 F482 K483 L512	E472-K481 VanDerWaalsContact OE1-CE 3.32Å; E472-K481 WeakPolarHBondContact OE1-CE 3.39Å; E472-K481 IonicContact OE1-NZ 2.87Å; E472-K481 PolarHBondContact OE1-NZ 3.37Å; E472-K481 WeakPolarHBondContact OE2-CE 3.34Å; E472-K481 IonicContact OE2-NZ 2.92Å; E472-K481 PolarHBondContact OE2-NZ 2.81Å; E472-F482 CarbonylContact C-O 3.55Å; E472-F482 VanDerWaalsContact CA-O 3.3Å; E472-F482 WeakPolarHBondContact CA-O 3.5Å; E472-K483 HydrophobicContact CG-CB 4.44Å; E472-K483 HydrophobicContact CG-CD 3.98Å; E472-L512 HydrophobicContact CG-CD1 3.91Å; E472-L512 VanDerWaalsContact OE1-CD1 3.23Å; E472-L512 WeakPolarHBondContact OE1-CD1 3.49Å
473	F	91.2	Very high	84.8	Confident	16 Å²	16	74 Å²	74	7%	0.07	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	153	175.1	56.5	-83	0	0	0	110.4	V445 H447 F482 I484 L509 C577 V579	V445-F473 HydrophobicContact CG1-CD2 3.84Å; V445-F473 HydrophobicContact CG1-CE2 4.4Å; H447-F473 HydrophobicContact CB-CB 4.27Å; H447-F473 HydrophobicContact CB-CD1 3.68Å; H447-F473 HydrophobicContact CB-CD2 3.7Å; H447-F473 HydrophobicContact CB-CE1 3.78Å; H447-F473 HydrophobicContact CB-CE2 3.79Å; H447-F473 HydrophobicContact CB-CG 3.63Å; H447-F473 HydrophobicContact CB-CZ 3.82Å; H447-F473 AromaticContact CD2-CD1 3.49Å; H447-F473 VanDerWaalsContact CD2-CD1 3.49Å; H447-F473 WeakPolarHBondContact CD2-CD1 3.49Å; H447-F473 AromaticContact CD2-CE1 3.56Å; H447-F473 AromaticContact CE1-CD1 3.95Å; H447-F473 AromaticContact CG-CD1 3.32Å; H447-F473 AromaticContact CG-CE1 3.67Å; H447-F473 AromaticContact CG-CG 3.63Å; H447-F473 AromaticContact ND1-CD1 3.64Å; H447-F473 AromaticContact ND1-CG 3.78Å; H447-F473 AromaticContact NE2-CD1 3.89Å; F473-F482 HydrophobicContact CD1-CB 4.31Å; F473-F482 HydrophobicContact CD2-CB 3.82Å; F473-F482 HydrophobicContact CD2-CD2 4.11Å; F473-F482 HydrophobicContact CD2-CG 4.38Å; F473-F482 HydrophobicContact CE1-CB 3.99Å; F473-F482 HydrophobicContact CE2-CB 3.47Å; F473-F482 VanDerWaalsContact CE2-CB 3.47Å; F473-F482 HydrophobicContact CE2-CD2 4.01Å; F473-F482 AromaticContact CE2-CG 3.98Å; F473-F482 HydrophobicContact CE2-CG 3.98Å; F473-F482 HydrophobicContact CG-CB 4.25Å; F473-F482 HydrophobicContact CZ-CB 3.57Å; F473-F482 HydrophobicContact CZ-CG 4.43Å; F473-F482 PolarHBondContact N-O 2.95Å; F473-F482 PolarHBondContact O-N 3.44Å; F473-I484 HydrophobicContact CE1-CD1 3.88Å; F473-I484 HydrophobicContact CE1-CG1 3.89Å; F473-I484 HydrophobicContact CZ-CD1 4.12Å; F473-I484 HydrophobicContact CZ-CG1 4.14Å; F473-L509 HydrophobicContact CE1-CD1 4.35Å; F473-L509 HydrophobicContact CZ-CD1 3.68Å; F473-C577 HydrophobicContact CZ-CB 4.42Å; F473-V579 HydrophobicContact CE2-CG2 4.36Å
474	V	89.2	Confident	85.5	Confident	61 Å²	61	67 Å²	67	37%	0.37	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	149.8	-168.6	-148.9	0	0	0	0	109.8	K478 H480 K481	V474-K478 HydrophobicContact CG1-CB 4.36Å; V474-H480 CarbonylContact C-O 3.54Å; V474-H480 WeakPolarHBondContact CA-O 3.38Å; V474-H480 VanDerWaalsContact CG1-O 3.28Å; V474-H480 WeakPolarHBondContact CG1-O 2.96Å; V474-K481 HydrophobicContact CG1-CB 4.23Å; V474-K481 HydrophobicContact CG2-CG 4.3Å
475	S	84	Confident	86.2	Confident	3 Å²	3	61 Å²	61	2%	0.021	32%	0.321	C	S	.	.			trans	-58.8	152.6	165.9	54	0	0	0	0	111.6	D477 K478 R479 H480	S475-D477 VanDerWaalsContact CB-OD1 3.26Å; S475-D477 WeakPolarHBondContact CB-OD1 3.5Å; S475-D477 PolarHBondContact O-N 3.32Å; S475-D477 PolarHBondContact OG-OD1 2.75Å; S475-K478 WeakPolarHBondContact O-CA 3.35Å; S475-K478 PolarHBondContact O-N 3.06Å; S475-R479 PolarHBondContact OG-N 3.39Å; S475-H480 PolarHBondContact N-O 3.25Å; S475-H480 PolarHBondContact OG-N 2.97Å; S475-H480 PolarHBondContact OG-O 3.48Å
476	P	81.9	Confident	86.9	Confident	100 Å²	100	54.9 Å²	54.9	65%	0.649	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-35.3	178.7	-29.5	35.1	0	0	0	114.7	T443 K478	T443-P476 HydrophobicContact CG2-CG 3.95Å; P476-K478 PolarHBondContact O-N 3.26Å
477	D	80.9	Confident	87.4	Confident	64 Å²	64	53.3 Å²	53.3	34%	0.342	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-1	176.3	65.7	6.1	0	0	0	114.4	S475 R479	S475-D477 VanDerWaalsContact CB-OD1 3.26Å; S475-D477 WeakPolarHBondContact CB-OD1 3.5Å; S475-D477 PolarHBondContact O-N 3.32Å; S475-D477 PolarHBondContact OG-OD1 2.75Å; D477-R479 PolarHBondContact O-N 3.28Å; D477-R479 PolarHBondContact OD1-N 3.3Å; D477-R479 IonicContact OD2-CZ 3.76Å; D477-R479 IonicContact OD2-NE 2.71Å; D477-R479 PolarHBondContact OD2-NE 2.97Å; D477-R479 IonicContact OD2-NH2 3.79Å; D477-R479 PolarHBondContact OD2-NH2 3.31Å
478	K	82.1	Confident	87.2	Confident	176 Å²	176	50.4 Å²	50.4	77%	0.765	26%	0.257	S	S	*	.	S	Bend	trans	62.2	8.9	-177.1	-54.9	179.6	-176.6	175.9	0	116.3	V474 S475 P476	V474-K478 HydrophobicContact CG1-CB 4.36Å; S475-K478 WeakPolarHBondContact O-CA 3.35Å; S475-K478 PolarHBondContact O-N 3.06Å; P476-K478 PolarHBondContact O-N 3.26Å
479	R	82	Confident	86.1	Confident	124 Å²	124	55.1 Å²	55.1	47%	0.468	28%	0.277	S	S	.	.			trans	-74.9	-39.5	179.9	-70.8	-171.8	-69.6	-170.9	-2.6	113.7	S475 D477 S513	S475-R479 PolarHBondContact OG-N 3.39Å; D477-R479 PolarHBondContact O-N 3.28Å; D477-R479 PolarHBondContact OD1-N 3.3Å; D477-R479 IonicContact OD2-CZ 3.76Å; D477-R479 IonicContact OD2-NE 2.71Å; D477-R479 PolarHBondContact OD2-NE 2.97Å; D477-R479 IonicContact OD2-NH2 3.79Å; D477-R479 PolarHBondContact OD2-NH2 3.31Å; R479-S513 PolarHBondContact O-OG 2.99Å
480	H	84.1	Confident	84.6	Confident	12 Å²	12	58.3 Å²	58.3	6%	0.056	29%	0.292	C	S	.	.			trans	-110.8	113.5	-173.8	-59.5	-68.9	0	0	0	111.5	V474 S475 F482 S513 I581	V474-H480 CarbonylContact C-O 3.54Å; V474-H480 WeakPolarHBondContact CA-O 3.38Å; V474-H480 VanDerWaalsContact CG1-O 3.28Å; V474-H480 WeakPolarHBondContact CG1-O 2.96Å; S475-H480 PolarHBondContact N-O 3.25Å; S475-H480 PolarHBondContact OG-N 2.97Å; S475-H480 PolarHBondContact OG-O 3.48Å; H480-F482 HydrophobicContact CB-CE2 3.67Å; H480-F482 HydrophobicContact CB-CZ 3.68Å; H480-F482 WeakPolarHBondContact O-CE2 3.46Å; H480-S513 VanDerWaalsContact CA-OG 3.31Å; H480-S513 WeakPolarHBondContact CA-OG 3.16Å; H480-I581 HydrophobicContact CB-CD1 3.81Å
481	K	88.5	Confident	82.5	Confident	66 Å²	66	61.4 Å²	61.4	29%	0.287	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	137.8	-179.1	-165.6	-176.1	-166.1	-160.3	0	110.5	E472 V474 L512 S513	E472-K481 VanDerWaalsContact OE1-CE 3.32Å; E472-K481 WeakPolarHBondContact OE1-CE 3.39Å; E472-K481 IonicContact OE1-NZ 2.87Å; E472-K481 PolarHBondContact OE1-NZ 3.37Å; E472-K481 WeakPolarHBondContact OE2-CE 3.34Å; E472-K481 IonicContact OE2-NZ 2.92Å; E472-K481 PolarHBondContact OE2-NZ 2.81Å; V474-K481 HydrophobicContact CG1-CB 4.23Å; V474-K481 HydrophobicContact CG2-CG 4.3Å; K481-L512 HydrophobicContact CB-CB 4.09Å; K481-L512 HydrophobicContact CD-CB 4.13Å; K481-L512 HydrophobicContact CD-CD1 4.21Å; K481-L512 HydrophobicContact CG-CB 4.13Å; K481-L512 HydrophobicContact CG-CD1 4.2Å; K481-L512 PolarHBondContact O-N 3.37Å; K481-S513 PolarHBondContact N-OG 2.93Å
482	F	90.5	Very high	80.2	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	157.9	-172.5	-57	-77	0	0	0	112.2	E472 F473 H480 L509 H510 L518 I555 V579 I581	E472-F482 CarbonylContact C-O 3.55Å; E472-F482 VanDerWaalsContact CA-O 3.3Å; E472-F482 WeakPolarHBondContact CA-O 3.5Å; F473-F482 HydrophobicContact CD1-CB 4.31Å; F473-F482 HydrophobicContact CD2-CB 3.82Å; F473-F482 HydrophobicContact CD2-CD2 4.11Å; F473-F482 HydrophobicContact CD2-CG 4.38Å; F473-F482 HydrophobicContact CE1-CB 3.99Å; F473-F482 HydrophobicContact CE2-CB 3.47Å; F473-F482 VanDerWaalsContact CE2-CB 3.47Å; F473-F482 HydrophobicContact CE2-CD2 4.01Å; F473-F482 AromaticContact CE2-CG 3.98Å; F473-F482 HydrophobicContact CE2-CG 3.98Å; F473-F482 HydrophobicContact CG-CB 4.25Å; F473-F482 HydrophobicContact CZ-CB 3.57Å; F473-F482 HydrophobicContact CZ-CG 4.43Å; F473-F482 PolarHBondContact N-O 2.95Å; F473-F482 PolarHBondContact O-N 3.44Å; H480-F482 HydrophobicContact CB-CE2 3.67Å; H480-F482 HydrophobicContact CB-CZ 3.68Å; H480-F482 WeakPolarHBondContact O-CE2 3.46Å; F482-L509 HydrophobicContact CB-CD1 4.07Å; F482-L509 HydrophobicContact CD1-CD1 4.48Å; F482-H510 VanDerWaalsContact CA-O 3.27Å; F482-H510 WeakPolarHBondContact CA-O 3.38Å; F482-L518 HydrophobicContact CE1-CD2 3.71Å; F482-L518 HydrophobicContact CZ-CD1 4.45Å; F482-L518 HydrophobicContact CZ-CD2 4Å; F482-I555 HydrophobicContact CD1-CD1 3.96Å; F482-I555 HydrophobicContact CE1-CD1 3.75Å; F482-V579 HydrophobicContact CE1-CG1 4.18Å; F482-V579 HydrophobicContact CE2-CG1 4.32Å; F482-V579 HydrophobicContact CZ-CG1 3.83Å; F482-I581 HydrophobicContact CE2-CD1 4Å; F482-I581 HydrophobicContact CZ-CD1 4.07Å
483	K	91.7	Very high	77.6	Confident	53 Å²	53	62.4 Å²	62.4	23%	0.23	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	144.1	172.5	-178.7	167.1	173.9	174.9	0	110.1	Q469 S470 E472 H510 L512	Q469-K483 VanDerWaalsContact CB-CE 3.44Å; S470-K483 VanDerWaalsContact O-CE 3.29Å; S470-K483 WeakPolarHBondContact O-CE 3.46Å; E472-K483 HydrophobicContact CG-CB 4.44Å; E472-K483 HydrophobicContact CG-CD 3.98Å; K483-H510 PolarHBondContact N-O 3.34Å; K483-H510 WeakPolarHBondContact O-CB 3.43Å; K483-H510 PolarHBondContact O-N 3.42Å; K483-L512 HydrophobicContact CB-CD1 3.84Å; K483-L512 HydrophobicContact CB-CG 4.45Å
484	I	91.7	Very high	75.1	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.005	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	144.3	177.9	-57.8	157.6	0	0	0	109	W449 Q469 S470 F473 L507 T508 L509 C577	W449-I484 HydrophobicContact CE3-CB 4.12Å; W449-I484 HydrophobicContact CE3-CG2 3.89Å; W449-I484 HydrophobicContact CZ3-CB 4.31Å; W449-I484 HydrophobicContact CZ3-CG2 3.84Å; Q469-I484 CarbonylContact C-O 3.29Å; Q469-I484 VanDerWaalsContact CA-O 3.27Å; Q469-I484 WeakPolarHBondContact CA-O 3.25Å; S470-I484 PolarHBondContact N-O 3.02Å; S470-I484 PolarHBondContact OG-N 3.21Å; F473-I484 HydrophobicContact CE1-CD1 3.88Å; F473-I484 HydrophobicContact CE1-CG1 3.89Å; F473-I484 HydrophobicContact CZ-CD1 4.12Å; F473-I484 HydrophobicContact CZ-CG1 4.14Å; I484-L507 HydrophobicContact CG2-CD1 3.34Å; I484-L507 HydrophobicContact CG2-CD2 4.34Å; I484-L507 HydrophobicContact CG2-CG 3.74Å; I484-T508 CarbonylContact C-O 3.55Å; I484-T508 WeakPolarHBondContact CA-O 3.37Å; I484-L509 HydrophobicContact CG1-CD1 3.78Å; I484-C577 HydrophobicContact CD1-CB 3.55Å; I484-C577 HydrophobicContact CG1-CB 4.42Å
485	S	91.2	Very high	72.9	Confident	4 Å²	4	74.1 Å²	74.1	3%	0.028	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	141.2	168.2	65.8	0	0	0	0	111	M468 T508 H510	M468-S485 WeakPolarHBondContact O-CA 3.21Å; S485-T508 PolarHBondContact N-O 2.72Å; S485-T508 PolarHBondContact O-N 3.45Å; S485-H510 PolarHBondContact OG-NE2 3.49Å
486	L	89.9	Confident	70.7	Confident	3 Å²	3	78.3 Å²	78.3	2%	0.016	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	129	169.8	-179.5	60.6	0	0	0	109.2	W449 I451 F454 Q461 M468 R505 T506 L507 L560	W449-L486 HydrophobicContact CH2-CB 3.91Å; W449-L486 HydrophobicContact CZ3-CB 4.05Å; I451-L486 HydrophobicContact CD1-CD2 4.1Å; F454-L486 HydrophobicContact CE2-CD2 3.68Å; F454-L486 HydrophobicContact CZ-CD2 4.29Å; Q461-L486 PolarHBondContact NE2-O 3.07Å; M468-L486 HydrophobicContact CB-CB 4.22Å; M468-L486 HydrophobicContact CE-CD2 4.25Å; M468-L486 PolarHBondContact O-N 3.13Å; L486-R505 HydrophobicContact CD1-CB 4.43Å; L486-T506 WeakPolarHBondContact CA-O 3.21Å; L486-L507 HydrophobicContact CB-CD1 4.09Å; L486-L507 HydrophobicContact CD1-CB 4.47Å; L486-L507 HydrophobicContact CD1-CD1 4.19Å; L486-L560 HydrophobicContact CD1-CD1 3.64Å; L486-L560 HydrophobicContact CD1-CG 4.32Å; L486-L560 HydrophobicContact CD2-CD1 4.44Å
487	Q	85	Confident	68.6	Low	73 Å²	73	77.4 Å²	77.4	34%	0.341	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	136	176.4	-63.7	-177.9	13.8	0	0	110.5	T506	Q487-T506 PolarHBondContact N-O 3.09Å; Q487-T506 PolarHBondContact O-N 3.38Å
488	S	75.5	Confident	66.4	Low	29 Å²	29	83.9 Å²	83.9	20%	0.203	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	116.6	163.6	-162.3	0	0	0	0	109.3	A503 Q504	S488-A503 VanDerWaalsContact OG-CB 3.3Å; S488-A503 WeakPolarHBondContact OG-CB 3.47Å; S488-Q504 WeakPolarHBondContact CA-O 3.49Å
489	K	65.2	Low	64.2	Low	110 Å²	110	80 Å²	80	48%	0.478	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	124.7	174.1	-76.9	177.2	-178.4	164.4	0	109.7	Q504	K489-Q504 PolarHBondContact N-O 3.18Å; K489-Q504 PolarHBondContact O-N 3.31Å
490	E	58.8	Low	62.2	Low	154 Å²	154	80.5 Å²	80.5	72%	0.72	46%	0.462	S	S	*	.			trans	-77.7	120.3	163.6	-70	-175.7	171.3	0	0	109.1	T492 A503	E490-T492 PolarHBondContact O-N 3.01Å; E490-T492 VanDerWaalsContact O-N 3.08Å; E490-A503 HydrophobicContact CG-CB 3.99Å
491	T	47.3	Very low	60.3	Low	71 Å²	71	85.1 Å²	85.1	44%	0.436	48%	0.484	S	S	.	.			trans	-71.6	100.7	172.4	39.8	0	0	0	0	109.4	G493 Q501	T491-G493 PolarHBondContact O-N 3.49Å; T491-Q501 PolarHBondContact OG1-OE1 2.87Å
492	T	42.3	Very low	58.7	Low	133 Å²	133	88.3 Å²	88.3	82%	0.816	50%	0.5	S	S	*	.			trans	-71.2	76.6	171.3	39.8	0	0	0	0	110.5	E490 K494	E490-T492 PolarHBondContact O-N 3.01Å; E490-T492 VanDerWaalsContact O-N 3.08Å; T492-K494 PolarHBondContact O-N 3.09Å
493	G	37.2	Very low	57.3	Low	57 Å²	57	89.5 Å²	89.5	59%	0.588	51%	0.51	S	S	*	.			trans	-62.3	103.1	175.7	0	0	0	0	0	111.4	T491 T495	T491-G493 PolarHBondContact O-N 3.49Å; G493-T495 PolarHBondContact O-N 3.23Å
494	K	37.6	Very low	56.4	Low	206 Å²	206	90.7 Å²	90.7	90%	0.896	52%	0.516	S	S	*	.			trans	-70.7	55.2	170.5	-74.5	-172.3	174.7	-179.1	0	112.6	T492	T492-K494 PolarHBondContact O-N 3.09Å
495	T	42.8	Very low	56	Low	118 Å²	118	92.9 Å²	92.9	72%	0.724	52%	0.524	S	S	*	.	S	Bend	trans	-164.9	96.1	165.3	40.4	0	0	0	0	111.8	G493 S497	G493-T495 PolarHBondContact O-N 3.23Å; T495-S497 VanDerWaalsContact C-N 3.29Å; T495-S497 PolarHBondContact O-N 3.21Å
496	G	38.3	Very low	55.8	Low	91 Å²	91	92.9 Å²	92.9	94%	0.938	52%	0.524	S	S	*	.			trans	55	-14.8	134.6	0	0	0	0	0	124
497	S	38.9	Very low	55.7	Low	80 Å²	80	92.8 Å²	92.8	56%	0.559	52%	0.524	S	S	*	.			trans	-93.6	116.7	-174.3	63	0	0	0	0	112.4	T495 T499	T495-S497 VanDerWaalsContact C-N 3.29Å; T495-S497 PolarHBondContact O-N 3.21Å; S497-T499 VanDerWaalsContact C-N 3.33Å; S497-T499 PolarHBondContact O-N 3.37Å
498	Q	34.5	Very low	55.9	Low	201 Å²	201	89.4 Å²	89.4	94%	0.939	51%	0.508	S	S	*	.			trans	-73.5	81.1	173	-68.7	-179.7	-11.7	0	0	111.6
499	T	34.8	Very low	56.6	Low	95 Å²	95	88 Å²	88	58%	0.583	50%	0.498	S	S	*	.			trans	-135.2	134.3	157.2	40.3	0	0	0	0	108.7	S497 Q501	S497-T499 VanDerWaalsContact C-N 3.33Å; S497-T499 PolarHBondContact O-N 3.37Å; T499-Q501 PolarHBondContact O-N 2.94Å
500	P	40.7	Very low	57.7	Low	133 Å²	133	84 Å²	84	86%	0.864	48%	0.481	S	S	*	.			trans	-70.1	96.9	177.9	28.2	-32.8	0	0	0	109.3	Q502	P500-Q502 PolarHBondContact O-N 2.92Å
501	Q	43.9	Very low	59.1	Low	110 Å²	110	76.7 Å²	76.7	51%	0.514	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-68.7	117	176.1	-70	-174.4	-12.3	0	0	109.4	T491 T499	T491-Q501 PolarHBondContact OG1-OE1 2.87Å; T499-Q501 PolarHBondContact O-N 2.94Å
502	Q	54.8	Low	60.8	Low	132 Å²	132	74.7 Å²	74.7	62%	0.617	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-62.8	136	176.3	-74.7	-178.7	-26.7	0	0	110.7	P500 Q504	P500-Q502 PolarHBondContact O-N 2.92Å; Q502-Q504 PolarHBondContact O-N 3.46Å
503	A	60.6	Low	62.3	Low	25 Å²	25	69 Å²	69	21%	0.207	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-59.2	131.4	-179.3	0	0	0	0	0	111.9	S488 E490	S488-A503 VanDerWaalsContact OG-CB 3.3Å; S488-A503 WeakPolarHBondContact OG-CB 3.47Å; E490-A503 HydrophobicContact CG-CB 3.99Å
504	Q	73.1	Confident	63.6	Low	79 Å²	79	76 Å²	76	37%	0.369	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	127.5	-177.7	-171.1	170.5	-15.4	0	0	109.8	S488 K489 Q502 T559	S488-Q504 WeakPolarHBondContact CA-O 3.49Å; K489-Q504 PolarHBondContact N-O 3.18Å; K489-Q504 PolarHBondContact O-N 3.31Å; Q502-Q504 PolarHBondContact O-N 3.46Å; Q504-T559 HydrophobicContact CG-CG2 3.58Å; Q504-T559 PolarHBondContact NE2-OG1 3.11Å
505	R	84.2	Confident	64.7	Low	46 Å²	46	70.1 Å²	70.1	17%	0.174	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	121.1	178.8	-66.6	175	-176.1	103.3	6.2	109.6	E458 L486 T559 L560 Q562	E458-R505 IonicContact OE1-CZ 3.56Å; E458-R505 IonicContact OE1-NE 3.8Å; E458-R505 PolarHBondContact OE1-NE 3.05Å; E458-R505 IonicContact OE1-NH2 2.66Å; E458-R505 PolarHBondContact OE1-NH2 3.21Å; E458-R505 IonicContact OE2-CZ 2.75Å; E458-R505 IonicContact OE2-NE 3.45Å; E458-R505 IonicContact OE2-NH2 2.72Å; E458-R505 PolarHBondContact OE2-NH2 3.06Å; L486-R505 HydrophobicContact CD1-CB 4.43Å; R505-T559 CarbonylContact O-C 3.55Å; R505-T559 WeakPolarHBondContact O-CA 3.5Å; R505-L560 HydrophobicContact CB-CB 3.92Å; R505-L560 HydrophobicContact CB-CD1 4.16Å; R505-L560 HydrophobicContact CB-CG 4.15Å; R505-L560 PolarHBondContact O-N 2.76Å; R505-Q562 PolarHBondContact NH1-O 3.33Å
506	T	86.4	Confident	66.1	Low	5 Å²	5	66.9 Å²	66.9	3%	0.031	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	121.8	-175.8	-62.4	0	0	0	0	110.1	L486 Q487 E557	L486-T506 WeakPolarHBondContact CA-O 3.21Å; Q487-T506 PolarHBondContact N-O 3.09Å; Q487-T506 PolarHBondContact O-N 3.38Å; T506-E557 HydrophobicContact CG2-CG 3.28Å; T506-E557 WeakPolarHBondContact CG2-OE1 3.25Å
507	L	88.8	Confident	67.9	Low	1 Å²	1	66.6 Å²	66.6	1%	0.005	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	119.4	175.9	-169.3	72.7	0	0	0	109.6	W449 I484 L486 F524 E557 V558 L560 L575	W449-L507 HydrophobicContact CZ3-CD1 4.06Å; I484-L507 HydrophobicContact CG2-CD1 3.34Å; I484-L507 HydrophobicContact CG2-CD2 4.34Å; I484-L507 HydrophobicContact CG2-CG 3.74Å; L486-L507 HydrophobicContact CB-CD1 4.09Å; L486-L507 HydrophobicContact CD1-CB 4.47Å; L486-L507 HydrophobicContact CD1-CD1 4.19Å; L507-F524 HydrophobicContact CD2-CD1 3.6Å; L507-F524 HydrophobicContact CD2-CE1 3.72Å; L507-F524 HydrophobicContact CD2-CG 4.23Å; L507-F524 HydrophobicContact CD2-CZ 4.43Å; L507-F524 HydrophobicContact CG-CD1 4.49Å; L507-F524 HydrophobicContact CG-CE1 4.14Å; L507-E557 WeakPolarHBondContact O-CA 3.46Å; L507-V558 HydrophobicContact CB-CG1 3.88Å; L507-V558 HydrophobicContact CD2-CG1 4.29Å; L507-V558 PolarHBondContact N-O 3.25Å; L507-V558 PolarHBondContact O-N 2.69Å; L507-L560 HydrophobicContact CB-CD2 4.01Å; L507-L560 HydrophobicContact CB-CG 4.46Å; L507-L560 HydrophobicContact CD2-CD2 4.31Å; L507-L575 HydrophobicContact CD1-CD1 3.56Å; L507-L575 HydrophobicContact CD2-CD1 4.05Å; L507-L575 HydrophobicContact CD2-CD2 4.38Å; L507-L575 HydrophobicContact CG-CD1 4.47Å
508	T	89	Confident	69.8	Low	1 Å²	1	62.8 Å²	62.8	1%	0.006	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	128.5	-174.2	-45.6	0	0	0	0	110.3	I484 S485 H510 E554 A556 E557	I484-T508 CarbonylContact C-O 3.55Å; I484-T508 WeakPolarHBondContact CA-O 3.37Å; S485-T508 PolarHBondContact N-O 2.72Å; S485-T508 PolarHBondContact O-N 3.45Å; T508-H510 PolarHBondContact O-CD2 3.09Å; T508-E554 HydrophobicContact CG2-CB 3.86Å; T508-E554 HydrophobicContact CG2-CG 3.65Å; T508-A556 CarbonylContact C-O 3.56Å; T508-A556 WeakPolarHBondContact CA-O 3.19Å; T508-A556 WeakPolarHBondContact CG2-O 3.49Å; T508-E557 HydrophobicContact CG2-CB 4.49Å
509	L	89.9	Confident	72	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	128.5	170.4	-178.4	66.8	0	0	0	109.2	F473 F482 I484 V522 F524 I555 A556 V579	F473-L509 HydrophobicContact CE1-CD1 4.35Å; F473-L509 HydrophobicContact CZ-CD1 3.68Å; F482-L509 HydrophobicContact CB-CD1 4.07Å; F482-L509 HydrophobicContact CD1-CD1 4.48Å; I484-L509 HydrophobicContact CG1-CD1 3.78Å; L509-V522 HydrophobicContact CD2-CB 4.3Å; L509-V522 HydrophobicContact CD2-CG1 3.54Å; L509-V522 HydrophobicContact CD2-CG2 3.69Å; L509-F524 HydrophobicContact CB-CE1 4.3Å; L509-F524 HydrophobicContact CB-CZ 3.69Å; L509-I555 HydrophobicContact CB-CG1 4.1Å; L509-I555 HydrophobicContact CD2-CD1 3.63Å; L509-I555 HydrophobicContact CD2-CG1 3.8Å; L509-I555 HydrophobicContact CG-CD1 3.92Å; L509-I555 HydrophobicContact CG-CG1 3.77Å; L509-I555 WeakPolarHBondContact O-CG1 3.5Å; L509-I555 PolarHBondContact O-N 3.13Å; L509-A556 HydrophobicContact CB-CB 4.16Å; L509-A556 PolarHBondContact N-O 3.1Å; L509-A556 PolarHBondContact O-N 3.08Å; L509-V579 HydrophobicContact CD2-CG2 3.77Å
510	H	88.6	Confident	74.3	Confident	26 Å²	26	48.9 Å²	48.9	12%	0.12	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	135.4	177.2	-58.6	-94	0	0	0	109.7	F482 K483 S485 T508 L512 V552 G553 E554	F482-H510 VanDerWaalsContact CA-O 3.27Å; F482-H510 WeakPolarHBondContact CA-O 3.38Å; K483-H510 PolarHBondContact N-O 3.34Å; K483-H510 WeakPolarHBondContact O-CB 3.43Å; K483-H510 PolarHBondContact O-N 3.42Å; S485-H510 PolarHBondContact OG-NE2 3.49Å; T508-H510 PolarHBondContact O-CD2 3.09Å; H510-L512 HydrophobicContact CB-CD2 4.38Å; H510-V552 HydrophobicContact CB-CG1 4.39Å; H510-G553 CarbonylContact C-O 3.55Å; H510-G553 VanDerWaalsContact CA-O 3.3Å; H510-G553 WeakPolarHBondContact CA-O 3.44Å; H510-E554 IonicContact CE1-OE1 3.68Å
511	S	86.9	Confident	76.4	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.007	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	138	161.5	-169.9	0	0	0	0	109.6	V552 G553	S511-V552 WeakPolarHBondContact O-CA 3.26Å; S511-G553 PolarHBondContact N-O 3.02Å; S511-G553 PolarHBondContact O-N 3.45Å
512	L	84.1	Confident	78.5	Confident	29 Å²	29	39.2 Å²	39.2	15%	0.152	20%	0.198	C	C	.	.			trans	-114.8	0.9	-177.4	-53.1	179.3	0	0	0	112.4	E472 K481 K483 H510 V552	E472-L512 HydrophobicContact CG-CD1 3.91Å; E472-L512 VanDerWaalsContact OE1-CD1 3.23Å; E472-L512 WeakPolarHBondContact OE1-CD1 3.49Å; K481-L512 HydrophobicContact CB-CB 4.09Å; K481-L512 HydrophobicContact CD-CB 4.13Å; K481-L512 HydrophobicContact CD-CD1 4.21Å; K481-L512 HydrophobicContact CG-CB 4.13Å; K481-L512 HydrophobicContact CG-CD1 4.2Å; K481-L512 PolarHBondContact O-N 3.37Å; K483-L512 HydrophobicContact CB-CD1 3.84Å; K483-L512 HydrophobicContact CB-CG 4.45Å; H510-L512 HydrophobicContact CB-CD2 4.38Å; L512-V552 HydrophobicContact CD2-CB 4.29Å; L512-V552 HydrophobicContact CD2-CG1 3.85Å; L512-V552 HydrophobicContact CD2-CG2 3.79Å
513	S	73	Confident	80	Confident	13 Å²	13	36.3 Å²	36.3	9%	0.091	18%	0.181	C	C	.	.			trans	-81.9	138.1	177.6	-69.2	0	0	0	0	111.1	R479 H480 K481 P549	R479-S513 PolarHBondContact O-OG 2.99Å; H480-S513 VanDerWaalsContact CA-OG 3.31Å; H480-S513 WeakPolarHBondContact CA-OG 3.16Å; K481-S513 PolarHBondContact N-OG 2.93Å; S513-P549 WeakPolarHBondContact O-CG 3.16Å
514	R	64.4	Low	81.4	Confident	203 Å²	203	35.3 Å²	35.3	77%	0.766	17%	0.172	S	C	*	.	S	Bend	trans	-100.8	-7.7	-164.9	-61.1	-168.4	171.3	-169.7	-2.6	116	A551	R514-A551 HydrophobicContact CG-CB 3.89Å
515	S	61.8	Low	82	Confident	84 Å²	84	31.8 Å²	31.8	59%	0.587	16%	0.156	S	C	*	.	S	Bend	trans	-135.3	-46.1	-168	48.5	0	0	0	0	114.1
516	D	70.6	Confident	82.1	Confident	50 Å²	50	29.6 Å²	29.6	27%	0.267	15%	0.148	S	C	.	.	S	Bend	trans	-84.2	130.9	-160	-62.6	11.9	0	0	0	111.2	L518 P549	D516-L518 PolarHBondContact O-N 3.11Å; D516-P549 WeakPolarHBondContact O-CD 3.27Å; D516-P549 WeakPolarHBondContact O-CG 3.45Å
517	P	76.7	Confident	81.9	Confident	84 Å²	84	30.2 Å²	30.2	55%	0.545	15%	0.153	S	C	.	.			trans	-63.5	130.1	176.9	26.4	-33.4	0	0	0	110	L546	P517-L546 CarbonylContact C-O 3.54Å; P517-L546 WeakPolarHBondContact CA-O 3.32Å
518	L	78.9	Confident	81.5	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	116	-175.8	175.8	61.7	0	0	0	109.8	F482 D516 C520 H545 L546 I555 I581	F482-L518 HydrophobicContact CE1-CD2 3.71Å; F482-L518 HydrophobicContact CZ-CD1 4.45Å; F482-L518 HydrophobicContact CZ-CD2 4Å; D516-L518 PolarHBondContact O-N 3.11Å; L518-C520 HydrophobicContact CD1-CB 3.94Å; L518-C520 HydrophobicContact CG-CB 4.25Å; L518-H545 CarbonylContact O-C 3.54Å; L518-H545 WeakPolarHBondContact O-CA 3.35Å; L518-L546 HydrophobicContact CB-CB 4.4Å; L518-L546 HydrophobicContact CB-CD1 4.43Å; L518-L546 HydrophobicContact CD2-CD1 4.26Å; L518-L546 PolarHBondContact N-O 3.34Å; L518-L546 PolarHBondContact O-N 2.91Å; L518-I555 HydrophobicContact CD2-CD1 4.18Å; L518-I581 HydrophobicContact CD1-CG1 4.16Å; L518-I581 HydrophobicContact CD1-CG2 3.89Å
519	S	80	Confident	80.4	Confident	4 Å²	4	35.1 Å²	35.1	3%	0.028	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	120.8	159.4	-83.7	0	0	0	0	108	K77 I544 H545 Y582	K77-S519 VanDerWaalsContact CE-OG 3.27Å; K77-S519 WeakPolarHBondContact CE-OG 3.39Å; S519-I544 WeakPolarHBondContact CA-O 3.45Å; S519-H545 PolarHBondContact OG-ND1 2.96Å; S519-Y582 PolarHBondContact O-N 2.88Å
520	C	83.7	Confident	79	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	154.9	176	63.4	0	0	0	0	114	L518 V543 I544 V579 T580 I581	L518-C520 HydrophobicContact CD1-CB 3.94Å; L518-C520 HydrophobicContact CG-CB 4.25Å; C520-V543 WeakPolarHBondContact O-CA 3.44Å; C520-I544 PolarHBondContact N-O 2.92Å; C520-I544 PolarHBondContact O-N 2.62Å; C520-V579 HydrophobicContact CB-CG1 3.7Å; C520-T580 CarbonylContact C-O 3.53Å; C520-T580 WeakPolarHBondContact CA-O 3.4Å; C520-T580 VanDerWaalsContact CB-O 3.23Å; C520-T580 WeakPolarHBondContact CB-O 3.25Å; C520-I581 HydrophobicContact CB-CG1 4.4Å
521	K	85.2	Confident	77.5	Confident	39 Å²	39	46.4 Å²	46.4	17%	0.17	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	118.1	165.1	-171.3	166.5	73.6	152.8	0	108.2	E69 E541 K542 V543 V579 T580 Y582	E69-K521 WeakPolarHBondContact OE1-CE 3.13Å; E69-K521 IonicContact OE1-NZ 3.48Å; E69-K521 PolarHBondContact OE1-NZ 3.23Å; K521-E541 HydrophobicContact CD-CG 4.09Å; K521-E541 WeakPolarHBondContact CD-OE1 3.34Å; K521-E541 WeakPolarHBondContact CE-OE1 3.44Å; K521-E541 HydrophobicContact CG-CG 3.89Å; K521-E541 IonicContact NZ-OE1 2.85Å; K521-E541 PolarHBondContact NZ-OE1 3.07Å; K521-K542 WeakPolarHBondContact CA-O 3.23Å; K521-V543 HydrophobicContact CB-CG2 4.17Å; K521-V543 HydrophobicContact CD-CG2 3.96Å; K521-V543 HydrophobicContact CG-CG2 3.92Å; K521-V579 WeakPolarHBondContact O-CA 3.08Å; K521-T580 PolarHBondContact N-O 2.74Å; K521-T580 PolarHBondContact O-N 3.43Å; K521-Y582 HydrophobicContact CB-CE2 3.75Å; K521-Y582 WeakPolarHBondContact CB-OH 3.37Å; K521-Y582 WeakPolarHBondContact CE-OH 3.48Å
522	V	87.5	Confident	75.9	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.012	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	128.2	179.4	177.1	0	0	0	0	108.4	L509 F524 E541 K542 I544 I555 A556 V578 V579	L509-V522 HydrophobicContact CD2-CB 4.3Å; L509-V522 HydrophobicContact CD2-CG1 3.54Å; L509-V522 HydrophobicContact CD2-CG2 3.69Å; V522-F524 HydrophobicContact CG1-CD2 4.34Å; V522-F524 HydrophobicContact CG1-CE2 4.06Å; V522-F524 HydrophobicContact CG1-CZ 4.34Å; V522-E541 CarbonylContact O-C 3.6Å; V522-E541 WeakPolarHBondContact O-CA 3.25Å; V522-K542 PolarHBondContact N-O 3.34Å; V522-K542 PolarHBondContact O-N 3.09Å; V522-I544 HydrophobicContact CB-CD1 3.92Å; V522-I544 HydrophobicContact CG2-CD1 3.55Å; V522-I555 HydrophobicContact CG2-CD1 4.36Å; V522-A556 HydrophobicContact CB-CB 4.11Å; V522-A556 HydrophobicContact CG1-CB 3.74Å; V522-A556 HydrophobicContact CG2-CB 4.42Å; V522-V578 CarbonylContact C-O 3.55Å; V522-V578 WeakPolarHBondContact CA-O 3.28Å; V522-V579 HydrophobicContact CG2-CG1 4.21Å; V522-V579 HydrophobicContact CG2-CG2 4.33Å
523	R	87.7	Confident	74.5	Confident	70 Å²	70	58.4 Å²	58.4	26%	0.264	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	128.3	179.3	-163.3	175.2	70.5	72.7	24.9	109.3	D525 N538 A540 E541 V578	R523-D525 IonicContact CZ-OD1 2.7Å; R523-D525 IonicContact CZ-OD2 3.23Å; R523-D525 IonicContact NH1-OD1 3.38Å; R523-D525 PolarHBondContact NH1-OD1 3.11Å; R523-D525 IonicContact NH1-OD2 3.35Å; R523-D525 PolarHBondContact NH1-OD2 3.47Å; R523-D525 IonicContact NH2-OD1 2.65Å; R523-D525 IonicContact NH2-OD2 3.74Å; R523-D525 PolarHBondContact NH2-OD2 3.06Å; R523-N538 WeakPolarHBondContact CG-ND2 3.46Å; R523-A540 WeakPolarHBondContact CA-O 3.45Å; R523-E541 HydrophobicContact CB-CG 4.16Å; R523-E541 WeakPolarHBondContact CD-OE2 3.29Å; R523-E541 HydrophobicContact CG-CB 4.1Å; R523-E541 HydrophobicContact CG-CG 4.02Å; R523-V578 HydrophobicContact CB-CB 4.39Å; R523-V578 PolarHBondContact N-O 3.35Å; R523-V578 PolarHBondContact O-N 3.16Å
524	F	88.7	Confident	74	Confident	4 Å²	4	68.6 Å²	68.6	2%	0.018	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	134.6	176.6	-68.6	-74.8	0	0	0	110.3	L507 L509 V522 N538 L539 A540 A556 V558 I576 C577	L507-F524 HydrophobicContact CD2-CD1 3.6Å; L507-F524 HydrophobicContact CD2-CE1 3.72Å; L507-F524 HydrophobicContact CD2-CG 4.23Å; L507-F524 HydrophobicContact CD2-CZ 4.43Å; L507-F524 HydrophobicContact CG-CD1 4.49Å; L507-F524 HydrophobicContact CG-CE1 4.14Å; L509-F524 HydrophobicContact CB-CE1 4.3Å; L509-F524 HydrophobicContact CB-CZ 3.69Å; V522-F524 HydrophobicContact CG1-CD2 4.34Å; V522-F524 HydrophobicContact CG1-CE2 4.06Å; V522-F524 HydrophobicContact CG1-CZ 4.34Å; F524-N538 PolarHBondContact O-ND2 3.14Å; F524-N538 VanDerWaalsContact O-ND2 3.11Å; F524-L539 HydrophobicContact CB-CB 4.17Å; F524-L539 HydrophobicContact CB-CD1 4.29Å; F524-L539 PolarHBondContact O-N 3.17Å; F524-A540 PolarHBondContact N-O 2.97Å; F524-A556 HydrophobicContact CE2-CB 3.83Å; F524-A556 HydrophobicContact CZ-CB 4.31Å; F524-V558 HydrophobicContact CB-CG1 4.17Å; F524-V558 HydrophobicContact CD2-CB 4.11Å; F524-V558 HydrophobicContact CD2-CG1 3.49Å; F524-V558 VanDerWaalsContact CD2-CG1 3.49Å; F524-V558 HydrophobicContact CE2-CB 4.4Å; F524-V558 HydrophobicContact CE2-CG1 3.83Å; F524-V558 HydrophobicContact CG-CG1 3.92Å; F524-I576 CarbonylContact C-O 3.56Å; F524-I576 WeakPolarHBondContact CA-O 3.43Å; F524-C577 HydrophobicContact CD1-CB 4.1Å; F524-C577 HydrophobicContact CE1-CB 4.23Å
525	D	86.9	Confident	74.2	Confident	6 Å²	6	60.9 Å²	60.9	3%	0.032	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	155.9	171.3	-44.1	-50.9	0	0	0	111.1	R523 Q537 N538 I576	R523-D525 IonicContact CZ-OD1 2.7Å; R523-D525 IonicContact CZ-OD2 3.23Å; R523-D525 IonicContact NH1-OD1 3.38Å; R523-D525 PolarHBondContact NH1-OD1 3.11Å; R523-D525 IonicContact NH1-OD2 3.35Å; R523-D525 PolarHBondContact NH1-OD2 3.47Å; R523-D525 IonicContact NH2-OD1 2.65Å; R523-D525 IonicContact NH2-OD2 3.74Å; R523-D525 PolarHBondContact NH2-OD2 3.06Å; D525-Q537 CarbonylContact C-O 3.57Å; D525-Q537 WeakPolarHBondContact CA-O 3.47Å; D525-Q537 WeakPolarHBondContact CB-O 3.45Å; D525-N538 WeakPolarHBondContact OD1-CA 3.35Å; D525-N538 PolarHBondContact OD1-ND2 3.2Å; D525-I576 HydrophobicContact CB-CB 4.24Å; D525-I576 PolarHBondContact N-O 3.46Å; D525-I576 PolarHBondContact O-N 2.91Å
526	I	85.6	Confident	74.6	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	128.6	161.5	-53.5	169.4	0	0	0	107.7	S536 Q537 L539 M564 L567 L573 T574 L575	I526-S536 CarbonylContact O-C 3.51Å; I526-S536 WeakPolarHBondContact O-CA 3.43Å; I526-Q537 PolarHBondContact N-O 3.33Å; I526-Q537 PolarHBondContact O-N 2.91Å; I526-L539 HydrophobicContact CD1-CD1 4.01Å; I526-L539 HydrophobicContact CD1-CD2 3.75Å; I526-L539 HydrophobicContact CD1-CG 4.18Å; I526-L539 HydrophobicContact CG1-CD1 3.68Å; I526-L539 HydrophobicContact CG1-CD2 4.1Å; I526-L539 HydrophobicContact CG1-CG 3.98Å; I526-M564 HydrophobicContact CD1-CE 3.72Å; I526-M564 HydrophobicContact CD1-SD 3.8Å; I526-L567 HydrophobicContact CD1-CD1 3.87Å; I526-L567 HydrophobicContact CG2-CB 4.1Å; I526-L573 HydrophobicContact CG2-CD1 3.74Å; I526-T574 WeakPolarHBondContact CA-O 3.47Å; I526-L575 HydrophobicContact CG1-CD2 3.93Å
527	A	82.3	Confident	74.9	Confident	18 Å²	18	61.8 Å²	61.8	15%	0.149	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	137.3	173.3	0	0	0	0	0	110.9	S535 T574 I576	A527-S535 WeakPolarHBondContact CA-O 3.39Å; A527-T574 HydrophobicContact CB-CG2 3.93Å; A527-T574 PolarHBondContact N-O 2.8Å; A527-I576 HydrophobicContact CB-CD1 3.83Å; A527-I576 HydrophobicContact CB-CG1 4.36Å
528	Y	79.2	Confident	75	Confident	57 Å²	57	61.1 Å²	61.1	22%	0.224	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	153.2	-177.5	58.6	-82.1	0	0	0	110	H530 S535 Q537 L567	Y528-H530 HydrophobicContact CD2-CB 4.43Å; Y528-H530 HydrophobicContact CE2-CB 4.27Å; Y528-S535 PolarHBondContact N-O 3.29Å; Y528-S535 PolarHBondContact O-N 3.3Å; Y528-Q537 HydrophobicContact CE1-CB 4.08Å; Y528-L567 HydrophobicContact CD1-CD2 3.43Å; Y528-L567 VanDerWaalsContact CD1-CD2 3.43Å; Y528-L567 HydrophobicContact CD2-CD2 4.45Å; Y528-L567 HydrophobicContact CE1-CD2 3.64Å; Y528-L567 HydrophobicContact CG-CD2 3.88Å
529	A	66.3	Low	74.9	Confident	48 Å²	48	62.8 Å²	62.8	40%	0.397	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	133.6	171.1	0	0	0	0	0	110.3	D569	A529-D569 VanDerWaalsContact CB-OD2 3.26Å; A529-D569 WeakPolarHBondContact CB-OD2 3.41Å
530	H	60.9	Low	74.7	Confident	99 Å²	99	64 Å²	64	46%	0.458	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	122.8	166.8	-164.2	-85.5	0	0	0	108.1	Y528 S532 Q533	Y528-H530 HydrophobicContact CD2-CB 4.43Å; Y528-H530 HydrophobicContact CE2-CB 4.27Å; H530-S532 VanDerWaalsContact C-N 3.28Å; H530-S532 PolarHBondContact O-N 3.44Å; H530-S532 VanDerWaalsContact O-N 3.12Å; H530-Q533 PolarHBondContact N-O 2.85Å; H530-Q533 PolarHBondContact O-N 3.41Å; H530-Q533 VanDerWaalsContact O-O 3.1Å
531	E	56.6	Low	74.2	Confident	164 Å²	164	68.4 Å²	68.4	77%	0.766	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	43.7	172.6	-65.1	166.8	160.2	0	0	114.4	Q533	E531-Q533 VanDerWaalsContact C-N 3.26Å; E531-Q533 PolarHBondContact O-N 2.88Å
532	S	54	Low	73.7	Confident	132 Å²	132	72.2 Å²	72.2	92%	0.923	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	-1.7	-177.1	-26.2	0	0	0	0	116.3	H530	H530-S532 VanDerWaalsContact C-N 3.28Å; H530-S532 PolarHBondContact O-N 3.44Å; H530-S532 VanDerWaalsContact O-N 3.12Å
533	Q	55.3	Low	72.8	Confident	149 Å²	149	74.2 Å²	74.2	70%	0.696	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.7	141.3	171.8	-63.3	-167.4	0.5	0	0	111.4	H530 E531 S535	H530-Q533 PolarHBondContact N-O 2.85Å; H530-Q533 PolarHBondContact O-N 3.41Å; H530-Q533 VanDerWaalsContact O-O 3.1Å; E531-Q533 VanDerWaalsContact C-N 3.26Å; E531-Q533 PolarHBondContact O-N 2.88Å; Q533-S535 PolarHBondContact O-N 2.8Å
534	R	61.1	Low	72.1	Confident	227 Å²	227	71.6 Å²	71.6	86%	0.857	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	108.6	169.9	-79	-176.1	174.3	171.4	-0.9	109.2
535	S	69.1	Low	71.2	Confident	42 Å²	42	73.5 Å²	73.5	29%	0.294	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	162	173.3	-69.6	0	0	0	0	110.6	A527 Y528 Q533	A527-S535 WeakPolarHBondContact CA-O 3.39Å; Y528-S535 PolarHBondContact N-O 3.29Å; Y528-S535 PolarHBondContact O-N 3.3Å; Q533-S535 PolarHBondContact O-N 2.8Å
536	S	69.9	Low	70.3	Confident	70 Å²	70	75.2 Å²	75.2	49%	0.49	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	129	172	61.8	0	0	0	0	112.1	I526	I526-S536 CarbonylContact O-C 3.51Å; I526-S536 WeakPolarHBondContact O-CA 3.43Å
537	Q	78.2	Confident	69.3	Low	82 Å²	82	81.3 Å²	81.3	38%	0.383	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	126	174.9	178.1	179	2.7	0	0	109.6	D525 I526 Y528	D525-Q537 CarbonylContact C-O 3.57Å; D525-Q537 WeakPolarHBondContact CA-O 3.47Å; D525-Q537 WeakPolarHBondContact CB-O 3.45Å; I526-Q537 PolarHBondContact N-O 3.33Å; I526-Q537 PolarHBondContact O-N 2.91Å; Y528-Q537 HydrophobicContact CE1-CB 4.08Å
538	N	78	Confident	68.3	Low	71 Å²	71	89.3 Å²	89.3	38%	0.38	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	133.1	169.9	-174.3	-106.6	0	0	0	110.9	R523 F524 D525	R523-N538 WeakPolarHBondContact CG-ND2 3.46Å; F524-N538 PolarHBondContact O-ND2 3.14Å; F524-N538 VanDerWaalsContact O-ND2 3.11Å; D525-N538 WeakPolarHBondContact OD1-CA 3.35Å; D525-N538 PolarHBondContact OD1-ND2 3.2Å
539	L	76.2	Confident	67.4	Low	34 Å²	34	87.2 Å²	87.2	18%	0.178	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-43.5	179.4	-68.9	176.9	0	0	0	112.7	F524 I526 V558 L560 P561	F524-L539 HydrophobicContact CB-CB 4.17Å; F524-L539 HydrophobicContact CB-CD1 4.29Å; F524-L539 PolarHBondContact O-N 3.17Å; I526-L539 HydrophobicContact CD1-CD1 4.01Å; I526-L539 HydrophobicContact CD1-CD2 3.75Å; I526-L539 HydrophobicContact CD1-CG 4.18Å; I526-L539 HydrophobicContact CG1-CD1 3.68Å; I526-L539 HydrophobicContact CG1-CD2 4.1Å; I526-L539 HydrophobicContact CG1-CG 3.98Å; L539-V558 HydrophobicContact CB-CG2 3.92Å; L539-V558 HydrophobicContact CD1-CG1 4.38Å; L539-L560 HydrophobicContact CD1-CD2 3.45Å; L539-L560 VanDerWaalsContact CD1-CD2 3.45Å; L539-P561 HydrophobicContact CD2-CG 4.11Å
540	A	77.1	Confident	66.9	Low	30 Å²	30	94.8 Å²	94.8	25%	0.248	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	154.6	178.4	0	0	0	0	0	110.5	R523 F524 V558	R523-A540 WeakPolarHBondContact CA-O 3.45Å; F524-A540 PolarHBondContact N-O 2.97Å; A540-V558 HydrophobicContact CB-CB 4.01Å; A540-V558 HydrophobicContact CB-CG2 3.56Å
541	E	73.4	Confident	66.7	Low	93 Å²	93	92.2 Å²	92.2	44%	0.435	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	132.3	167.2	-167.7	161.9	166.5	0	0	108.7	K521 V522 R523	K521-E541 HydrophobicContact CD-CG 4.09Å; K521-E541 WeakPolarHBondContact CD-OE1 3.34Å; K521-E541 WeakPolarHBondContact CE-OE1 3.44Å; K521-E541 HydrophobicContact CG-CG 3.89Å; K521-E541 IonicContact NZ-OE1 2.85Å; K521-E541 PolarHBondContact NZ-OE1 3.07Å; V522-E541 CarbonylContact O-C 3.6Å; V522-E541 WeakPolarHBondContact O-CA 3.25Å; R523-E541 HydrophobicContact CB-CG 4.16Å; R523-E541 WeakPolarHBondContact CD-OE2 3.29Å; R523-E541 HydrophobicContact CG-CB 4.1Å; R523-E541 HydrophobicContact CG-CG 4.02Å
542	K	74.6	Confident	67	Low	118 Å²	118	88.8 Å²	88.8	51%	0.513	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	126.8	-175.1	-166.8	178.4	-176.3	178.5	0	111.4	K521 V522 I544	K521-K542 WeakPolarHBondContact CA-O 3.23Å; V522-K542 PolarHBondContact N-O 3.34Å; V522-K542 PolarHBondContact O-N 3.09Å; K542-I544 HydrophobicContact CB-CD1 4.42Å; K542-I544 HydrophobicContact CD-CD1 4.46Å; K542-I544 HydrophobicContact CD-CG1 4.28Å; K542-I544 HydrophobicContact CG-CD1 4.41Å; K542-I544 HydrophobicContact CG-CG1 4.14Å
543	V	67.5	Low	67.9	Low	44 Å²	44	83.4 Å²	83.4	27%	0.267	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	132.9	169	-174.7	0	0	0	0	109.4	C520 K521	C520-V543 WeakPolarHBondContact O-CA 3.44Å; K521-V543 HydrophobicContact CB-CG2 4.17Å; K521-V543 HydrophobicContact CD-CG2 3.96Å; K521-V543 HydrophobicContact CG-CG2 3.92Å
544	I	74.1	Confident	69	Low	16 Å²	16	82.1 Å²	82.1	8%	0.082	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	136.4	-172.8	-65.3	142.5	0	0	0	108.6	S519 C520 V522 K542 L546 I555 A556	S519-I544 WeakPolarHBondContact CA-O 3.45Å; C520-I544 PolarHBondContact N-O 2.92Å; C520-I544 PolarHBondContact O-N 2.62Å; V522-I544 HydrophobicContact CB-CD1 3.92Å; V522-I544 HydrophobicContact CG2-CD1 3.55Å; K542-I544 HydrophobicContact CB-CD1 4.42Å; K542-I544 HydrophobicContact CD-CD1 4.46Å; K542-I544 HydrophobicContact CD-CG1 4.28Å; K542-I544 HydrophobicContact CG-CD1 4.41Å; K542-I544 HydrophobicContact CG-CG1 4.14Å; I544-L546 HydrophobicContact CG2-CD1 4.38Å; I544-L546 HydrophobicContact CG2-CD2 4.18Å; I544-L546 HydrophobicContact CG2-CG 3.99Å; I544-I555 WeakPolarHBondContact CD1-O 3.49Å; I544-I555 WeakPolarHBondContact CG1-O 3.28Å; I544-I555 HydrophobicContact CG2-CB 4.37Å; I544-A556 HydrophobicContact CD1-CB 3.86Å
545	H	68.9	Low	69.9	Low	44 Å²	44	71.9 Å²	71.9	20%	0.204	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	124.8	171.2	179.3	59.9	0	0	0	111.4	C76 L518 S519 K547	C76-H545 HydrophobicContact CB-CB 3.51Å; C76-H545 PolarHBondContact O-CD2 3.39Å; C76-H545 VanDerWaalsContact O-CD2 3.23Å; L518-H545 CarbonylContact O-C 3.54Å; L518-H545 WeakPolarHBondContact O-CA 3.35Å; S519-H545 PolarHBondContact OG-ND1 2.96Å; H545-K547 VanDerWaalsContact NE2-CG 3.27Å; H545-K547 WeakPolarHBondContact NE2-CG 3.44Å
546	L	69.2	Low	70.6	Confident	42 Å²	42	70.2 Å²	70.2	22%	0.22	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	102.8	-178.8	-57	170.8	0	0	0	108.3	P517 L518 I544 K548 P549 I555	P517-L546 CarbonylContact C-O 3.54Å; P517-L546 WeakPolarHBondContact CA-O 3.32Å; L518-L546 HydrophobicContact CB-CB 4.4Å; L518-L546 HydrophobicContact CB-CD1 4.43Å; L518-L546 HydrophobicContact CD2-CD1 4.26Å; L518-L546 PolarHBondContact N-O 3.34Å; L518-L546 PolarHBondContact O-N 2.91Å; I544-L546 HydrophobicContact CG2-CD1 4.38Å; I544-L546 HydrophobicContact CG2-CD2 4.18Å; I544-L546 HydrophobicContact CG2-CG 3.99Å; L546-K548 PolarHBondContact O-N 2.97Å; L546-P549 HydrophobicContact CD1-CB 4.33Å; L546-I555 HydrophobicContact CD1-CB 4.21Å; L546-I555 HydrophobicContact CD1-CG2 3.42Å; L546-I555 VanDerWaalsContact CD1-CG2 3.42Å
547	K	63.4	Low	71.4	Confident	128 Å²	128	71.5 Å²	71.5	56%	0.557	35%	0.352	S	S	*	.	S	Bend	trans	-63.5	-30	176.7	-69.6	-176.6	178.6	-179	0	112.8	H545	H545-K547 VanDerWaalsContact NE2-CG 3.27Å; H545-K547 WeakPolarHBondContact NE2-CG 3.44Å
548	K	61.7	Low	71.7	Confident	185 Å²	185	68.3 Å²	68.3	80%	0.804	34%	0.339	S	S	*	.	S	Bend	trans	-150.4	99.5	172.8	-64.3	-172.3	-179.4	-177.4	0	108.6	L546 R550	L546-K548 PolarHBondContact O-N 2.97Å; K548-R550 PolarHBondContact O-N 3.12Å
549	P	59.1	Low	72.1	Confident	13 Å²	13	67.9 Å²	67.9	8%	0.084	34%	0.339	C	S	.	.			trans	-61.6	136	174.5	25.3	-32.9	0	0	0	110.3	S513 D516 L546	S513-P549 WeakPolarHBondContact O-CG 3.16Å; D516-P549 WeakPolarHBondContact O-CD 3.27Å; D516-P549 WeakPolarHBondContact O-CG 3.45Å; L546-P549 HydrophobicContact CD1-CB 4.33Å
550	R	57.7	Low	72.4	Confident	208 Å²	208	66.5 Å²	66.5	79%	0.785	33%	0.331	S	S	*	.			trans	-68.7	148.8	165.9	-68.8	-177.4	179.2	178.8	0.2	108.1	K548 V552	K548-R550 PolarHBondContact O-N 3.12Å; R550-V552 CarbonylContact O-C 3.52Å; R550-V552 VanDerWaalsContact O-C 3.29Å; R550-V552 WeakPolarHBondContact O-CA 3.31Å; R550-V552 PolarHBondContact O-N 3.17Å
551	A	56.5	Low	72.6	Confident	44 Å²	44	66.9 Å²	66.9	36%	0.364	33%	0.331	S	S	.	.	S	Bend	trans	-54.8	-26.1	-168.7	0	0	0	0	0	115.4	R514	R514-A551 HydrophobicContact CG-CB 3.89Å
552	V	62.8	Low	72.7	Confident	93 Å²	93	68.8 Å²	68.8	56%	0.564	34%	0.34	S	S	*	.	S	Bend	trans	-132.8	131	151.5	179.5	0	0	0	0	105.7	H510 S511 L512 R550	H510-V552 HydrophobicContact CB-CG1 4.39Å; S511-V552 WeakPolarHBondContact O-CA 3.26Å; L512-V552 HydrophobicContact CD2-CB 4.29Å; L512-V552 HydrophobicContact CD2-CG1 3.85Å; L512-V552 HydrophobicContact CD2-CG2 3.79Å; R550-V552 CarbonylContact O-C 3.52Å; R550-V552 VanDerWaalsContact O-C 3.29Å; R550-V552 WeakPolarHBondContact O-CA 3.31Å; R550-V552 PolarHBondContact O-N 3.17Å
553	G	71.7	Confident	72.8	Confident	19 Å²	19	68.5 Å²	68.5	20%	0.196	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	136.7	178.3	0	0	0	0	0	112	H510 S511 I555	H510-G553 CarbonylContact C-O 3.55Å; H510-G553 VanDerWaalsContact CA-O 3.3Å; H510-G553 WeakPolarHBondContact CA-O 3.44Å; S511-G553 PolarHBondContact N-O 3.02Å; S511-G553 PolarHBondContact O-N 3.45Å; G553-I555 WeakPolarHBondContact O-CG2 3.46Å; G553-I555 PolarHBondContact O-N 2.77Å
554	E	79.7	Confident	73.3	Confident	121 Å²	121	66.5 Å²	66.5	57%	0.565	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.1	121.6	171	-62.4	177.5	158.7	0	0	108.7	T508 H510	T508-E554 HydrophobicContact CG2-CB 3.86Å; T508-E554 HydrophobicContact CG2-CG 3.65Å; H510-E554 IonicContact CE1-OE1 3.68Å
555	I	80.1	Confident	73.4	Confident	13 Å²	13	72.3 Å²	72.3	7%	0.067	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	-33.8	-175.9	71.1	170.5	0	0	0	112.1	F482 L509 L518 V522 I544 L546 G553	F482-I555 HydrophobicContact CD1-CD1 3.96Å; F482-I555 HydrophobicContact CE1-CD1 3.75Å; L509-I555 HydrophobicContact CB-CG1 4.1Å; L509-I555 HydrophobicContact CD2-CD1 3.63Å; L509-I555 HydrophobicContact CD2-CG1 3.8Å; L509-I555 HydrophobicContact CG-CD1 3.92Å; L509-I555 HydrophobicContact CG-CG1 3.77Å; L509-I555 WeakPolarHBondContact O-CG1 3.5Å; L509-I555 PolarHBondContact O-N 3.13Å; L518-I555 HydrophobicContact CD2-CD1 4.18Å; V522-I555 HydrophobicContact CG2-CD1 4.36Å; I544-I555 WeakPolarHBondContact CD1-O 3.49Å; I544-I555 WeakPolarHBondContact CG1-O 3.28Å; I544-I555 HydrophobicContact CG2-CB 4.37Å; L546-I555 HydrophobicContact CD1-CB 4.21Å; L546-I555 HydrophobicContact CD1-CG2 3.42Å; L546-I555 VanDerWaalsContact CD1-CG2 3.42Å; G553-I555 WeakPolarHBondContact O-CG2 3.46Å; G553-I555 PolarHBondContact O-N 2.77Å
556	A	83.5	Confident	73.8	Confident	6 Å²	6	74.6 Å²	74.6	5%	0.05	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	144.4	173.8	0	0	0	0	0	109.9	T508 L509 V522 F524 I544	T508-A556 CarbonylContact C-O 3.56Å; T508-A556 WeakPolarHBondContact CA-O 3.19Å; T508-A556 WeakPolarHBondContact CG2-O 3.49Å; L509-A556 HydrophobicContact CB-CB 4.16Å; L509-A556 PolarHBondContact N-O 3.1Å; L509-A556 PolarHBondContact O-N 3.08Å; V522-A556 HydrophobicContact CB-CB 4.11Å; V522-A556 HydrophobicContact CG1-CB 3.74Å; V522-A556 HydrophobicContact CG2-CB 4.42Å; F524-A556 HydrophobicContact CE2-CB 3.83Å; F524-A556 HydrophobicContact CZ-CB 4.31Å; I544-A556 HydrophobicContact CD1-CB 3.86Å
557	E	85.3	Confident	74.3	Confident	98 Å²	98	73 Å²	73	46%	0.458	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	137.7	173.2	-175.6	174.5	117.7	0	0	108.3	T506 L507 T508	T506-E557 HydrophobicContact CG2-CG 3.28Å; T506-E557 WeakPolarHBondContact CG2-OE1 3.25Å; L507-E557 WeakPolarHBondContact O-CA 3.46Å; T508-E557 HydrophobicContact CG2-CB 4.49Å
558	V	85.8	Confident	75.1	Confident	15 Å²	15	68.4 Å²	68.4	9%	0.091	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	142.5	173.2	66.1	0	0	0	0	110.4	L507 F524 L539 A540	L507-V558 HydrophobicContact CB-CG1 3.88Å; L507-V558 HydrophobicContact CD2-CG1 4.29Å; L507-V558 PolarHBondContact N-O 3.25Å; L507-V558 PolarHBondContact O-N 2.69Å; F524-V558 HydrophobicContact CB-CG1 4.17Å; F524-V558 HydrophobicContact CD2-CB 4.11Å; F524-V558 HydrophobicContact CD2-CG1 3.49Å; F524-V558 VanDerWaalsContact CD2-CG1 3.49Å; F524-V558 HydrophobicContact CE2-CB 4.4Å; F524-V558 HydrophobicContact CE2-CG1 3.83Å; F524-V558 HydrophobicContact CG-CG1 3.92Å; L539-V558 HydrophobicContact CB-CG2 3.92Å; L539-V558 HydrophobicContact CD1-CG1 4.38Å; A540-V558 HydrophobicContact CB-CB 4.01Å; A540-V558 HydrophobicContact CB-CG2 3.56Å
559	T	84.9	Confident	76	Confident	62 Å²	62	62.9 Å²	62.9	38%	0.38	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	130.1	171.6	-65.8	0	0	0	0	109.5	Q504 R505	Q504-T559 HydrophobicContact CG-CG2 3.58Å; Q504-T559 PolarHBondContact NE2-OG1 3.11Å; R505-T559 CarbonylContact O-C 3.55Å; R505-T559 WeakPolarHBondContact O-CA 3.5Å
560	L	83.6	Confident	77	Confident	4 Å²	4	69.4 Å²	69.4	2%	0.021	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-76.1	152.7	173.8	-53.6	-174.3	0	0	0	110.9	L486 R505 L507 L539 M564 L573	L486-L560 HydrophobicContact CD1-CD1 3.64Å; L486-L560 HydrophobicContact CD1-CG 4.32Å; L486-L560 HydrophobicContact CD2-CD1 4.44Å; R505-L560 HydrophobicContact CB-CB 3.92Å; R505-L560 HydrophobicContact CB-CD1 4.16Å; R505-L560 HydrophobicContact CB-CG 4.15Å; R505-L560 PolarHBondContact O-N 2.76Å; L507-L560 HydrophobicContact CB-CD2 4.01Å; L507-L560 HydrophobicContact CB-CG 4.46Å; L507-L560 HydrophobicContact CD2-CD2 4.31Å; L539-L560 HydrophobicContact CD1-CD2 3.45Å; L539-L560 VanDerWaalsContact CD1-CD2 3.45Å; L560-M564 HydrophobicContact CB-CE 4.49Å; L560-M564 HydrophobicContact CB-SD 4.25Å; L560-M564 HydrophobicContact CD1-CE 4.05Å; L560-L573 HydrophobicContact CD1-CD2 4.37Å
561	P	81	Confident	78.3	Confident	38 Å²	38	61.6 Å²	61.6	25%	0.247	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-50.7	145.6	171.2	-27.5	34.8	0	0	0	113	L539 M564 L567	L539-P561 HydrophobicContact CD2-CG 4.11Å; P561-M564 HydrophobicContact CB-SD 4.04Å; P561-M564 HydrophobicContact CG-SD 4.19Å; P561-M564 VanDerWaalsContact O-CG 3.28Å; P561-M564 WeakPolarHBondContact O-CG 3.41Å; P561-L567 HydrophobicContact CG-CD1 4.29Å
562	Q	75.9	Confident	79.7	Confident	133 Å²	133	60.4 Å²	60.4	62%	0.621	34%	0.335	S	S	*	.	S	Bend	trans	-69.6	-43.5	178	-71.8	179	-16.2	0	0	111.6	R505	R505-Q562 PolarHBondContact NH1-O 3.33Å
563	N	76.9	Confident	81	Confident	112 Å²	112	56 Å²	56	60%	0.599	31%	0.308	S	S	*	.			trans	-93.5	111.9	172.8	-173.9	0.6	0	0	0	109.8	N565	N563-N565 PolarHBondContact OD1-N 2.9Å
564	M	77.8	Confident	81.7	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.015	31%	0.305	C	S	.	.			trans	-113.9	4.6	-177.7	-65.4	-82.7	-72.3	0	0	112.1	I526 L560 P561 S566 L567 I568 L573	I526-M564 HydrophobicContact CD1-CE 3.72Å; I526-M564 HydrophobicContact CD1-SD 3.8Å; L560-M564 HydrophobicContact CB-CE 4.49Å; L560-M564 HydrophobicContact CB-SD 4.25Å; L560-M564 HydrophobicContact CD1-CE 4.05Å; P561-M564 HydrophobicContact CB-SD 4.04Å; P561-M564 HydrophobicContact CG-SD 4.19Å; P561-M564 VanDerWaalsContact O-CG 3.28Å; P561-M564 WeakPolarHBondContact O-CG 3.41Å; M564-S566 PolarHBondContact O-N 3.48Å; M564-S566 VanDerWaalsContact O-N 3.17Å; M564-L567 WeakPolarHBondContact O-CA 3.43Å; M564-L567 WeakPolarHBondContact O-CB 3.44Å; M564-L567 PolarHBondContact O-N 2.92Å; M564-L567 HydrophobicContact SD-CD1 3.91Å; M564-I568 HydrophobicContact CB-CD1 3.8Å; M564-I568 HydrophobicContact CB-CG1 4.23Å; M564-I568 WeakPolarHBondContact O-CG1 3.1Å; M564-I568 PolarHBondContact O-N 3.31Å; M564-I568 VanDerWaalsContact O-N 3.1Å; M564-L573 HydrophobicContact CE-CD1 3.46Å; M564-L573 VanDerWaalsContact CE-CD1 3.46Å; M564-L573 HydrophobicContact CE-CD2 3.75Å; M564-L573 HydrophobicContact CE-CG 4.28Å
565	N	76	Confident	82.2	Confident	137 Å²	137	50.4 Å²	50.4	73%	0.733	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-27.6	-168.2	-65.7	4.3	0	0	0	113.4	N563	N563-N565 PolarHBondContact OD1-N 2.9Å
566	S	77.6	Confident	82.6	Confident	93 Å²	93	50.4 Å²	50.4	65%	0.65	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-2.4	174.3	59.1	0	0	0	0	114	M564	M564-S566 PolarHBondContact O-N 3.48Å; M564-S566 VanDerWaalsContact O-N 3.17Å
567	L	79.4	Confident	82.8	Confident	7 Å²	7	50.1 Å²	50.1	4%	0.037	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-10.1	-176	-60.8	175.3	0	0	0	112.6	I526 Y528 P561 M564	I526-L567 HydrophobicContact CD1-CD1 3.87Å; I526-L567 HydrophobicContact CG2-CB 4.1Å; Y528-L567 HydrophobicContact CD1-CD2 3.43Å; Y528-L567 VanDerWaalsContact CD1-CD2 3.43Å; Y528-L567 HydrophobicContact CD2-CD2 4.45Å; Y528-L567 HydrophobicContact CE1-CD2 3.64Å; Y528-L567 HydrophobicContact CG-CD2 3.88Å; P561-L567 HydrophobicContact CG-CD1 4.29Å; M564-L567 WeakPolarHBondContact O-CA 3.43Å; M564-L567 WeakPolarHBondContact O-CB 3.44Å; M564-L567 PolarHBondContact O-N 2.92Å; M564-L567 HydrophobicContact SD-CD1 3.91Å
568	I	80.7	Confident	83	Confident	32 Å²	32	46.3 Å²	46.3	16%	0.164	26%	0.259	C	S	.	.			trans	-100.6	117.6	173.4	-62.7	161.2	0	0	0	106.9	F454 M564 L573	F454-I568 HydrophobicContact CD1-CD1 3.64Å; F454-I568 HydrophobicContact CD1-CG1 4.24Å; F454-I568 HydrophobicContact CE1-CD1 3.93Å; M564-I568 HydrophobicContact CB-CD1 3.8Å; M564-I568 HydrophobicContact CB-CG1 4.23Å; M564-I568 WeakPolarHBondContact O-CG1 3.1Å; M564-I568 PolarHBondContact O-N 3.31Å; M564-I568 VanDerWaalsContact O-N 3.1Å; I568-L573 HydrophobicContact CG1-CB 4.46Å; I568-L573 HydrophobicContact CG1-CD1 4.4Å
569	D	79.6	Confident	83	Confident	69 Å²	69	45.6 Å²	45.6	37%	0.369	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	-107.3	118.9	-178	-179.9	8.9	0	0	0	108.6	A529 D571 A572	A529-D569 VanDerWaalsContact CB-OD2 3.26Å; A529-D569 WeakPolarHBondContact CB-OD2 3.41Å; D569-D571 VanDerWaalsContact C-N 3.33Å; D569-D571 PolarHBondContact O-N 3.03Å; D569-A572 PolarHBondContact N-O 3.25Å; D569-A572 VanDerWaalsContact N-O 3.11Å; D569-A572 WeakPolarHBondContact O-CA 3.05Å; D569-A572 VanDerWaalsContact O-CB 3.29Å; D569-A572 WeakPolarHBondContact O-CB 3.15Å; D569-A572 PolarHBondContact O-N 3.04Å
570	N	80.7	Confident	83.1	Confident	151 Å²	151	43.7 Å²	43.7	81%	0.807	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	45.8	-177.1	-66.4	-73.2	0	0	0	114.3	A572	N570-A572 PolarHBondContact O-N 3.37Å; N570-A572 VanDerWaalsContact O-N 3.17Å
571	D	85.5	Confident	83.1	Confident	43 Å²	43	43.9 Å²	43.9	23%	0.23	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	22.8	-171.8	-158.6	19.4	0	0	0	114.7	N453 F454 I455 D569	N453-D571 WeakPolarHBondContact CA-O 3.48Å; N453-D571 VanDerWaalsContact CA-OD2 3.28Å; N453-D571 WeakPolarHBondContact CA-OD2 3.2Å; N453-D571 PolarHBondContact N-O 3.12Å; F454-D571 PolarHBondContact N-O 2.79Å; F454-D571 PolarHBondContact N-OD1 3.24Å; F454-D571 VanDerWaalsContact N-OD1 3.14Å; I455-D571 WeakPolarHBondContact CD1-OD1 3.27Å; I455-D571 VanDerWaalsContact CG1-OD1 3.24Å; I455-D571 WeakPolarHBondContact CG1-OD1 3.49Å; I455-D571 PolarHBondContact N-OD1 3.27Å; D569-D571 VanDerWaalsContact C-N 3.33Å; D569-D571 PolarHBondContact O-N 3.03Å
572	A	86.1	Confident	83.1	Confident	20 Å²	20	42.6 Å²	42.6	17%	0.165	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-108.8	120.1	171.3	0	0	0	0	0	111.2	I450 I451 D569 N570	I450-A572 HydrophobicContact CG2-CB 4.04Å; I451-A572 VanDerWaalsContact O-CA 3.31Å; I451-A572 WeakPolarHBondContact O-CA 3.38Å; D569-A572 PolarHBondContact N-O 3.25Å; D569-A572 VanDerWaalsContact N-O 3.11Å; D569-A572 WeakPolarHBondContact O-CA 3.05Å; D569-A572 VanDerWaalsContact O-CB 3.29Å; D569-A572 WeakPolarHBondContact O-CB 3.15Å; D569-A572 PolarHBondContact O-N 3.04Å; N570-A572 PolarHBondContact O-N 3.37Å; N570-A572 VanDerWaalsContact O-N 3.17Å
573	L	89.3	Confident	83.1	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	114.3	169.9	177.5	57.9	0	0	0	109.7	I451 F454 I526 L560 M564 I568 L575	I451-L573 HydrophobicContact CB-CB 4.42Å; I451-L573 HydrophobicContact CD1-CD2 4.45Å; I451-L573 PolarHBondContact N-O 3.32Å; I451-L573 PolarHBondContact O-N 3.04Å; F454-L573 HydrophobicContact CB-CB 4.15Å; F454-L573 HydrophobicContact CD1-CB 4.47Å; F454-L573 HydrophobicContact CD2-CB 3.76Å; F454-L573 HydrophobicContact CD2-CD2 3.8Å; F454-L573 HydrophobicContact CD2-CG 4.43Å; F454-L573 HydrophobicContact CE1-CD2 4.38Å; F454-L573 HydrophobicContact CE2-CB 4.36Å; F454-L573 HydrophobicContact CE2-CD2 3.5Å; F454-L573 HydrophobicContact CG-CB 3.84Å; F454-L573 HydrophobicContact CG-CD2 4.38Å; F454-L573 HydrophobicContact CZ-CD2 3.83Å; I526-L573 HydrophobicContact CG2-CD1 3.74Å; L560-L573 HydrophobicContact CD1-CD2 4.37Å; M564-L573 HydrophobicContact CE-CD1 3.46Å; M564-L573 VanDerWaalsContact CE-CD1 3.46Å; M564-L573 HydrophobicContact CE-CD2 3.75Å; M564-L573 HydrophobicContact CE-CG 4.28Å; I568-L573 HydrophobicContact CG1-CB 4.46Å; I568-L573 HydrophobicContact CG1-CD1 4.4Å; L573-L575 HydrophobicContact CD1-CD2 4.17Å; L573-L575 HydrophobicContact CD2-CD1 4.45Å; L573-L575 HydrophobicContact CD2-CD2 4.19Å; L573-L575 HydrophobicContact CD2-CG 4.35Å; L573-L575 HydrophobicContact CG-CD2 4.06Å; L573-L575 HydrophobicContact CG-CG 4.11Å
574	T	87.4	Confident	83	Confident	22 Å²	22	39.9 Å²	39.9	14%	0.135	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	107.8	177.9	-60.9	0	0	0	0	111.6	Q448 I450 I526 A527	Q448-T574 HydrophobicContact CG-CG2 3.64Å; I450-T574 HydrophobicContact CG1-CG2 4.17Å; I526-T574 WeakPolarHBondContact CA-O 3.47Å; A527-T574 HydrophobicContact CB-CG2 3.93Å; A527-T574 PolarHBondContact N-O 2.8Å
575	L	88.6	Confident	82.9	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	133.9	176.3	-59.5	175.3	0	0	0	110.4	Q448 W449 I451 L507 I526 L573	Q448-L575 CarbonylContact C-O 3.59Å; Q448-L575 WeakPolarHBondContact CA-O 3.4Å; W449-L575 HydrophobicContact CE3-CD1 3.87Å; W449-L575 HydrophobicContact CZ3-CD1 4.12Å; W449-L575 PolarHBondContact N-O 3.12Å; W449-L575 PolarHBondContact O-N 2.93Å; I451-L575 HydrophobicContact CD1-CD1 4.05Å; L507-L575 HydrophobicContact CD1-CD1 3.56Å; L507-L575 HydrophobicContact CD2-CD1 4.05Å; L507-L575 HydrophobicContact CD2-CD2 4.38Å; L507-L575 HydrophobicContact CG-CD1 4.47Å; I526-L575 HydrophobicContact CG1-CD2 3.93Å; L573-L575 HydrophobicContact CD1-CD2 4.17Å; L573-L575 HydrophobicContact CD2-CD1 4.45Å; L573-L575 HydrophobicContact CD2-CD2 4.19Å; L573-L575 HydrophobicContact CD2-CG 4.35Å; L573-L575 HydrophobicContact CG-CD2 4.06Å; L573-L575 HydrophobicContact CG-CG 4.11Å
576	I	88.1	Confident	83	Confident	13 Å²	13	38.3 Å²	38.3	7%	0.067	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.8	174.1	-62.3	179.3	0	0	0	108.5	K446 H447 Q448 F524 D525 A527 V578	K446-I576 HydrophobicContact CD-CG2 4.45Å; K446-I576 VanDerWaalsContact CE-CG2 3.43Å; K446-I576 HydrophobicContact CG-CG2 4.29Å; H447-I576 WeakPolarHBondContact O-CA 3.26Å; Q448-I576 HydrophobicContact CB-CG1 4.49Å; Q448-I576 HydrophobicContact CG-CG1 4.22Å; F524-I576 CarbonylContact C-O 3.56Å; F524-I576 WeakPolarHBondContact CA-O 3.43Å; D525-I576 HydrophobicContact CB-CB 4.24Å; D525-I576 PolarHBondContact N-O 3.46Å; D525-I576 PolarHBondContact O-N 2.91Å; A527-I576 HydrophobicContact CB-CD1 3.83Å; A527-I576 HydrophobicContact CB-CG1 4.36Å; I576-V578 HydrophobicContact CG2-CG2 4.07Å
577	C	89.2	Confident	83.1	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	129.9	168.8	-173	0	0	0	0	109.1	K446 H447 F473 I484 F524	K446-C577 WeakPolarHBondContact CA-O 3.47Å; H447-C577 PolarHBondContact N-O 3.34Å; H447-C577 PolarHBondContact O-N 2.99Å; F473-C577 HydrophobicContact CZ-CB 4.42Å; I484-C577 HydrophobicContact CD1-CB 3.55Å; I484-C577 HydrophobicContact CG1-CB 4.42Å; F524-C577 HydrophobicContact CD1-CB 4.1Å; F524-C577 HydrophobicContact CE1-CB 4.23Å
578	V	88	Confident	82.9	Confident	17 Å²	17	39.9 Å²	39.9	10%	0.103	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.2	172	-175.3	0	0	0	0	108.1	V444 V445 K446 V522 R523 I576	V444-V578 HydrophobicContact CG1-CG1 3.56Å; V445-V578 CarbonylContact O-C 3.49Å; V445-V578 WeakPolarHBondContact O-CA 3.36Å; K446-V578 HydrophobicContact CD-CG2 4.37Å; K446-V578 HydrophobicContact CG-CG2 4.12Å; V522-V578 CarbonylContact C-O 3.55Å; V522-V578 WeakPolarHBondContact CA-O 3.28Å; R523-V578 HydrophobicContact CB-CB 4.39Å; R523-V578 PolarHBondContact N-O 3.35Å; R523-V578 PolarHBondContact O-N 3.16Å; I576-V578 HydrophobicContact CG2-CG2 4.07Å
579	V	87.7	Confident	82.3	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	105	176.3	-172.1	0	0	0	0	108	V445 F473 F482 L509 C520 K521 V522 I581	V445-V579 HydrophobicContact CB-CB 4.37Å; V445-V579 PolarHBondContact N-O 3.19Å; V445-V579 PolarHBondContact O-N 2.84Å; F473-V579 HydrophobicContact CE2-CG2 4.36Å; F482-V579 HydrophobicContact CE1-CG1 4.18Å; F482-V579 HydrophobicContact CE2-CG1 4.32Å; F482-V579 HydrophobicContact CZ-CG1 3.83Å; L509-V579 HydrophobicContact CD2-CG2 3.77Å; C520-V579 HydrophobicContact CB-CG1 3.7Å; K521-V579 WeakPolarHBondContact O-CA 3.08Å; V522-V579 HydrophobicContact CG2-CG1 4.21Å; V522-V579 HydrophobicContact CG2-CG2 4.33Å; V579-I581 HydrophobicContact CG1-CG1 4.02Å
580	T	85.1	Confident	81.3	Confident	22 Å²	22	40.8 Å²	40.8	14%	0.135	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	106.5	172.5	-60.8	0	0	0	0	108.2	Y442 V444 C520 K521 Y582	Y442-T580 HydrophobicContact CD2-CG2 3.6Å; Y442-T580 HydrophobicContact CE2-CG2 4.34Å; Y442-T580 HydrophobicContact CG-CG2 3.85Å; V444-T580 HydrophobicContact CG2-CG2 4.32Å; C520-T580 CarbonylContact C-O 3.53Å; C520-T580 WeakPolarHBondContact CA-O 3.4Å; C520-T580 VanDerWaalsContact CB-O 3.23Å; C520-T580 WeakPolarHBondContact CB-O 3.25Å; K521-T580 PolarHBondContact N-O 2.74Å; K521-T580 PolarHBondContact O-N 3.43Å; T580-Y582 HydrophobicContact CG2-CD1 4.38Å; T580-Y582 HydrophobicContact CG2-CE1 3.83Å
581	I	85.2	Confident	79.4	Confident	8 Å²	8	42.8 Å²	42.8	4%	0.041	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	123.8	-178.7	-56.8	175	0	0	0	108.7	Y442 T443 V445 H480 F482 L518 C520 V579	Y442-I581 CarbonylContact C-O 3.56Å; Y442-I581 WeakPolarHBondContact CA-O 3.12Å; Y442-I581 VanDerWaalsContact CB-O 3.28Å; Y442-I581 WeakPolarHBondContact CB-O 3.31Å; T443-I581 PolarHBondContact N-O 3.33Å; T443-I581 PolarHBondContact O-N 3.13Å; V445-I581 HydrophobicContact CG2-CD1 3.71Å; V445-I581 HydrophobicContact CG2-CG1 4.36Å; H480-I581 HydrophobicContact CB-CD1 3.81Å; F482-I581 HydrophobicContact CE2-CD1 4Å; F482-I581 HydrophobicContact CZ-CD1 4.07Å; L518-I581 HydrophobicContact CD1-CG1 4.16Å; L518-I581 HydrophobicContact CD1-CG2 3.89Å; C520-I581 HydrophobicContact CB-CG1 4.4Å; V579-I581 HydrophobicContact CG1-CG1 4.02Å
582	Y	80.8	Confident	77.1	Confident	12 Å²	12	42.3 Å²	42.3	5%	0.047	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	126.5	-178.2	-58.3	-73	0	0	0	111.2	E69 L73 I440 S519 K521 T580	E69-Y582 HydrophobicContact CB-CE1 4.2Å; E69-Y582 HydrophobicContact CG-CE1 3.87Å; E69-Y582 WeakPolarHBondContact CG-OH 3.15Å; L73-Y582 HydrophobicContact CD1-CD1 3.84Å; L73-Y582 HydrophobicContact CD1-CD2 3.86Å; L73-Y582 HydrophobicContact CD1-CE1 4.33Å; L73-Y582 HydrophobicContact CD1-CE2 4.35Å; L73-Y582 HydrophobicContact CD1-CG 3.57Å; L73-Y582 HydrophobicContact CD2-CD2 3.76Å; L73-Y582 HydrophobicContact CD2-CE2 4.44Å; L73-Y582 HydrophobicContact CD2-CG 4.13Å; L73-Y582 HydrophobicContact CG-CD2 4.22Å; L73-Y582 HydrophobicContact CG-CG 4.39Å; I440-Y582 HydrophobicContact CD1-CD1 3.39Å; I440-Y582 HydrophobicContact CD1-CE1 3.99Å; I440-Y582 HydrophobicContact CD1-CG 4.06Å; I440-Y582 HydrophobicContact CG1-CD1 4.1Å; S519-Y582 PolarHBondContact O-N 2.88Å; K521-Y582 HydrophobicContact CB-CE2 3.75Å; K521-Y582 WeakPolarHBondContact CB-OH 3.37Å; K521-Y582 WeakPolarHBondContact CE-OH 3.48Å; T580-Y582 HydrophobicContact CG2-CD1 4.38Å; T580-Y582 HydrophobicContact CG2-CE1 3.83Å
583	E	75.8	Confident	74.5	Confident	52 Å²	52	44.4 Å²	44.4	24%	0.243	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-79.3	-177.1	-63.3	173.4	-145.8	0	0	109.7	K77 K441 T443	K77-E583 PolarHBondContact NZ-O 3.37Å; K77-E583 VanDerWaalsContact NZ-O 3.13Å; K441-E583 HydrophobicContact CB-CB 4.46Å; K441-E583 WeakPolarHBondContact CE-OE2 3.3Å; K441-E583 IonicContact NZ-OE2 2.72Å; K441-E583 PolarHBondContact NZ-OE2 2.05Å; K441-E583 PolarHBondContact O-N 3.35Å; T443-E583 PolarHBondContact OG1-OE1 2.84Å
584	E	75.3	Confident	71.9	Confident	136 Å²	136	47.6 Å²	47.6	64%	0.636	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138	149.6	-169.9	-176.8	167	-151.9	0	0	110.7	K441	K441-E584 PolarHBondContact N-O 3.25Å
585	I	74.6	Confident	69.6	Low	58 Å²	58	51.7 Å²	51.7	30%	0.297	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	123	168.3	-64.8	171.4	0	0	0	106.2	Q70 T439 I440	Q70-I585 HydrophobicContact CB-CD1 4.22Å; Q70-I585 HydrophobicContact CG-CD1 4.01Å; Q70-I585 HydrophobicContact CG-CG1 4.28Å; T439-I585 WeakPolarHBondContact O-CA 3.32Å; I440-I585 HydrophobicContact CB-CG1 4.42Å; I440-I585 HydrophobicContact CD1-CG1 4.17Å; I440-I585 HydrophobicContact CG1-CG1 4.19Å
586	S	79.2	Confident	67.1	Low	48 Å²	48	53.4 Å²	53.4	34%	0.336	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	136.3	-179.9	54.6	0	0	0	0	110.5	S438 T439	S438-S586 CarbonylContact C-O 3.6Å; S438-S586 WeakPolarHBondContact CA-O 2.9Å; T439-S586 PolarHBondContact N-O 2.96Å; T439-S586 PolarHBondContact O-N 3.45Å
587	T	78.8	Confident	64.8	Low	47 Å²	47	57 Å²	57	29%	0.288	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	123.7	174.7	-52.3	0	0	0	0	109.4	Q82 A84 R437 S438	Q82-T587 PolarHBondContact O-OG1 2.81Å; A84-T587 HydrophobicContact CB-CG2 4.41Å; R437-T587 CarbonylContact O-C 3.55Å; R437-T587 VanDerWaalsContact O-CA 3.27Å; R437-T587 WeakPolarHBondContact O-CA 3.43Å; S438-T587 WeakPolarHBondContact OG-CG2 3.3Å; S438-T587 PolarHBondContact OG-OG1 3.27Å
588	V	75.5	Confident	62.4	Low	86 Å²	86	62.6 Å²	62.6	52%	0.521	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	139.8	-177	-176.2	0	0	0	0	109.5	S436 R437	S436-V588 CarbonylContact C-O 3.58Å; S436-V588 VanDerWaalsContact CA-O 3.23Å; S436-V588 WeakPolarHBondContact CA-O 3.38Å; R437-V588 PolarHBondContact N-O 3.39Å; R437-V588 PolarHBondContact O-N 3.14Å
589	C	68.4	Low	60.7	Low	50 Å²	50	63 Å²	63	34%	0.338	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	134.7	165.2	-80	0	0	0	0	110.9	A84 I435 E591	A84-C589 WeakPolarHBondContact CB-SG 3.48Å; I435-C589 CarbonylContact O-C 3.05Å; I435-C589 WeakPolarHBondContact O-CA 3.43Å; C589-E591 PolarHBondContact O-N 3.49Å
590	D	57.3	Low	59.2	Low	71 Å²	71	63.8 Å²	63.8	38%	0.38	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	117	150.9	-66.7	8	0	0	0	106.7	I435 R437 A592	I435-D590 HydrophobicContact CB-CB 4.28Å; I435-D590 PolarHBondContact O-N 3.13Å; R437-D590 IonicContact CZ-OD2 2.68Å; R437-D590 IonicContact NH1-OD1 2.58Å; R437-D590 PolarHBondContact NH1-OD1 2.97Å; R437-D590 IonicContact NH1-OD2 2.74Å; R437-D590 PolarHBondContact NH1-OD2 3.34Å; R437-D590 IonicContact NH2-OD2 3.19Å; D590-A592 VanDerWaalsContact C-N 3.26Å; D590-A592 PolarHBondContact O-N 2.92Å
591	E	41.4	Very low	58.2	Low	192 Å²	192	69.8 Å²	69.8	90%	0.897	39%	0.39	S	S	*	.			trans	-69.7	84.5	173.1	-71	-171.2	167.1	0	0	110.7	C589 S593	C589-E591 PolarHBondContact O-N 3.49Å; E591-S593 PolarHBondContact O-N 3.42Å
592	A	37.2	Very low	57.3	Low	33 Å²	33	71.3 Å²	71.3	27%	0.273	40%	0.404	S	S	.	.			trans	-72.7	90.8	167.2	0	0	0	0	0	109.1	D590 S594	D590-A592 VanDerWaalsContact C-N 3.26Å; D590-A592 PolarHBondContact O-N 2.92Å; A592-S594 PolarHBondContact O-N 3.15Å
593	S	31.3	Very low	56.9	Low	65 Å²	65	70.7 Å²	70.7	46%	0.455	40%	0.401	S	S	.	.			trans	-52.3	107.1	178.7	57.2	0	0	0	0	111.7	E591	E591-S593 PolarHBondContact O-N 3.42Å
594	S	34.6	Very low	56.7	Low	67 Å²	67	69.5 Å²	69.5	47%	0.469	40%	0.398	S	S	.	.			trans	-64	126.9	-179.2	63.6	0	0	0	0	110.9	A592 G596	A592-S594 PolarHBondContact O-N 3.15Å; S594-G596 VanDerWaalsContact C-N 3.27Å; S594-G596 PolarHBondContact O-N 3.16Å
595	P	38.9	Very low	56.6	Low	107 Å²	107	65 Å²	65	70%	0.695	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-4.8	-170.7	-16.9	30.7	0	0	0	116.3	N599	P595-N599 PolarHBondContact O-ND2 2.89Å
596	G	37.3	Very low	56.6	Low	38 Å²	38	63.1 Å²	63.1	39%	0.392	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-86.1	-175.7	0	0	0	0	0	113.3	S594 E598 N599	S594-G596 VanDerWaalsContact C-N 3.27Å; S594-G596 PolarHBondContact O-N 3.16Å; G596-E598 PolarHBondContact O-N 3.17Å; G596-N599 PolarHBondContact O-N 2.88Å
597	N	38.8	Very low	56.5	Low	87 Å²	87	60.9 Å²	60.9	47%	0.465	36%	0.357	S	S	.	.	H	α-helix	trans	-77.6	-16.2	-157	-65.7	0.9	0	0	0	116.5	P89	P89-N597 VanDerWaalsContact CB-ND2 3.34Å; P89-N597 WeakPolarHBondContact CB-ND2 3.28Å; P89-N597 PolarHBondContact O-ND2 3.38Å
598	E	39.9	Very low	56.5	Low	118 Å²	118	61.8 Å²	61.8	55%	0.551	36%	0.358	S	S	*	.	H	α-helix	trans	-85.8	-24.3	175	-71	-163.2	154.6	0	0	113	G596 A602	G596-E598 PolarHBondContact O-N 3.17Å; E598-A602 WeakPolarHBondContact O-CB 3.33Å; E598-A602 PolarHBondContact O-N 2.97Å
599	N	51.2	Low	56.6	Low	27 Å²	27	64.9 Å²	64.9	14%	0.144	37%	0.365	C	S	.	.	H	α-helix	trans	-68.1	-46.7	-177.4	-78.4	-20.5	0	0	0	111.3	K309 P595 G596 K601 A602 F603	K309-N599 PolarHBondContact NZ-OD1 3.13Å; P595-N599 PolarHBondContact O-ND2 2.89Å; G596-N599 PolarHBondContact O-N 2.88Å; N599-K601 PolarHBondContact O-N 2.03Å; N599-A602 WeakPolarHBondContact O-CB 2.95Å; N599-A602 PolarHBondContact O-N 2.87Å; N599-A602 VanDerWaalsContact O-N 3.13Å; N599-F603 WeakPolarHBondContact O-CB 3.05Å; N599-F603 PolarHBondContact O-N 3.17Å
600	D	56.9	Low	57	Low	15 Å²	15	63 Å²	63	8%	0.08	35%	0.351	C	S	.	.	H	α-helix	trans	-65.1	-37.5	-175.6	-63.4	-18.1	0	0	0	112.6	D211 F603 V604	D211-D600 HydrophobicContact CB-CB 3.71Å; D600-F603 WeakPolarHBondContact O-CB 3.37Å; D600-F603 PolarHBondContact O-N 3.04Å; D600-V604 WeakPolarHBondContact O-CB 3.05Å; D600-V604 WeakPolarHBondContact O-CG2 3.25Å; D600-V604 PolarHBondContact O-N 3.37Å
601	K	62.9	Low	57.9	Low	149 Å²	149	61 Å²	61	65%	0.648	34%	0.34	S	S	*	.	H	α-helix	trans	-67.5	-40.7	172.7	-72.6	179.6	177.5	171.4	0	112.6	N599 F603 S605	N599-K601 PolarHBondContact O-N 2.03Å; K601-F603 VanDerWaalsContact C-N 3.34Å; K601-S605 WeakPolarHBondContact O-CB 3.47Å; K601-S605 PolarHBondContact O-N 3.43Å; K601-S605 PolarHBondContact O-OG 3.39Å
602	A	66.7	Low	59.7	Low	39 Å²	39	58.9 Å²	58.9	32%	0.322	33%	0.328	S	S	.	.	H	α-helix	trans	-64	-42.1	174.9	0	0	0	0	0	111.1	E598 N599 S605 S606	E598-A602 WeakPolarHBondContact O-CB 3.33Å; E598-A602 PolarHBondContact O-N 2.97Å; N599-A602 WeakPolarHBondContact O-CB 2.95Å; N599-A602 PolarHBondContact O-N 2.87Å; N599-A602 VanDerWaalsContact O-N 3.13Å; A602-S605 PolarHBondContact O-N 2.76Å; A602-S605 PolarHBondContact O-OG 3.49Å; A602-S606 PolarHBondContact O-N 3.44Å; A602-S606 VanDerWaalsContact O-N 3.13Å
603	F	71.9	Confident	61.6	Low	0 Å²	0	60.1 Å²	60.1	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-55.9	-56.7	174.1	-178.4	-99.4	0	0	0	111.5	F214 V215 F218 R249 Y284 D286 N599 D600 K601 S605 S606 F607	F214-F603 HydrophobicContact CD1-CD1 4.22Å; F214-F603 AromaticContact CD1-CE1 3.98Å; F214-F603 HydrophobicContact CD1-CE1 3.98Å; F214-F603 HydrophobicContact CE1-CD1 4.01Å; F214-F603 AromaticContact CE1-CE1 3.73Å; F214-F603 HydrophobicContact CE1-CE1 3.73Å; V215-F603 HydrophobicContact CG2-CD1 3.98Å; V215-F603 HydrophobicContact CG2-CE1 4.06Å; F218-F603 HydrophobicContact CD2-CE1 4.18Å; F218-F603 HydrophobicContact CD2-CZ 4.21Å; R249-F603 VanDerWaalsContact CZ-CD2 3.49Å; Y284-F603 WeakPolarHBondContact O-CE2 3.27Å; Y284-F603 WeakPolarHBondContact O-CZ 3.06Å; D286-F603 HydrophobicContact CB-CD2 4.43Å; D286-F603 WeakPolarHBondContact OD2-CB 3.22Å; D286-F603 WeakPolarHBondContact OD2-CD2 3.5Å; N599-F603 WeakPolarHBondContact O-CB 3.05Å; N599-F603 PolarHBondContact O-N 3.17Å; D600-F603 WeakPolarHBondContact O-CB 3.37Å; D600-F603 PolarHBondContact O-N 3.04Å; K601-F603 VanDerWaalsContact C-N 3.34Å; F603-S605 PolarHBondContact O-N 2.91Å; F603-S606 WeakPolarHBondContact O-CB 3.12Å; F603-S606 PolarHBondContact O-N 3.19Å; F603-S606 VanDerWaalsContact O-N 3.17Å; F603-S606 PolarHBondContact O-OG 3.44Å; F603-F607 HydrophobicContact CD1-CE2 4.18Å; F603-F607 AromaticContact CE1-CE2 3.63Å; F603-F607 HydrophobicContact CE1-CE2 3.63Å; F603-F607 HydrophobicContact CE1-CZ 4.46Å; F603-F607 HydrophobicContact CE2-CE2 4.07Å; F603-F607 HydrophobicContact CE2-CZ 4.16Å; F603-F607 AromaticContact CZ-CE2 3.55Å; F603-F607 HydrophobicContact CZ-CE2 3.55Å; F603-F607 AromaticContact CZ-CZ 3.93Å; F603-F607 HydrophobicContact CZ-CZ 3.93Å
604	V	73.1	Confident	63.9	Low	27 Å²	27	63 Å²	63	16%	0.164	34%	0.342	C	S	.	.	H	α-helix	trans	-55.3	-47.9	176.1	164.6	0	0	0	0	111.8	F214 D600 S606 F607 E608 M674	F214-V604 HydrophobicContact CD1-CG2 3.87Å; F214-V604 HydrophobicContact CE1-CG2 3.72Å; D600-V604 WeakPolarHBondContact O-CB 3.05Å; D600-V604 WeakPolarHBondContact O-CG2 3.25Å; D600-V604 PolarHBondContact O-N 3.37Å; V604-S606 PolarHBondContact O-N 3.06Å; V604-S606 VanDerWaalsContact O-N 3.17Å; V604-F607 PolarHBondContact O-N 3.47Å; V604-F607 VanDerWaalsContact O-N 3.16Å; V604-E608 PolarHBondContact O-N 3.26Å; V604-M674 HydrophobicContact CG1-CB 3.73Å; V604-M674 HydrophobicContact CG1-CG 4.05Å
605	S	73.6	Confident	65.7	Low	42 Å²	42	62 Å²	62	29%	0.294	33%	0.334	S	S	.	.	H	α-helix	trans	-63.3	-23.7	-178.4	77.6	0	0	0	0	114.3	K601 A602 F603 F607 E608 K609	K601-S605 WeakPolarHBondContact O-CB 3.47Å; K601-S605 PolarHBondContact O-N 3.43Å; K601-S605 PolarHBondContact O-OG 3.39Å; A602-S605 PolarHBondContact O-N 2.76Å; A602-S605 PolarHBondContact O-OG 3.49Å; F603-S605 PolarHBondContact O-N 2.91Å; S605-F607 VanDerWaalsContact C-N 3.35Å; S605-E608 WeakPolarHBondContact O-CB 3.35Å; S605-E608 PolarHBondContact O-N 2.74Å; S605-K609 PolarHBondContact O-N 3.22Å
606	S	73.5	Confident	67.5	Low	18 Å²	18	58.4 Å²	58.4	13%	0.126	31%	0.313	C	S	.	.	H	α-helix	trans	-67.4	-36.1	177.2	68.9	0	0	0	0	112.1	R249 A602 F603 V604 K609 F610	R249-S606 WeakPolarHBondContact CD-OG 3.37Å; R249-S606 PolarHBondContact NH1-OG 3.11Å; R249-S606 VanDerWaalsContact NH1-OG 3.07Å; A602-S606 PolarHBondContact O-N 3.44Å; A602-S606 VanDerWaalsContact O-N 3.13Å; F603-S606 WeakPolarHBondContact O-CB 3.12Å; F603-S606 PolarHBondContact O-N 3.19Å; F603-S606 VanDerWaalsContact O-N 3.17Å; F603-S606 PolarHBondContact O-OG 3.44Å; V604-S606 PolarHBondContact O-N 3.06Å; V604-S606 VanDerWaalsContact O-N 3.17Å; S606-K609 PolarHBondContact O-N 2.81Å; S606-F610 PolarHBondContact O-N 3.25Å
607	F	77.4	Confident	69.8	Low	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-74.7	-27.7	175.7	-60.8	-49	0	0	0	113.1	F214 F218 A248 R249 F603 V604 S605 F610 L611 Y673	F214-F607 HydrophobicContact CE1-CD2 4.42Å; F214-F607 HydrophobicContact CZ-CD2 4.41Å; F218-F607 HydrophobicContact CE2-CE2 4.35Å; A248-F607 HydrophobicContact CB-CD1 3.73Å; A248-F607 HydrophobicContact CB-CE1 3.77Å; R249-F607 HydrophobicContact CG-CE1 3.75Å; R249-F607 HydrophobicContact CG-CZ 3.97Å; F603-F607 HydrophobicContact CD1-CE2 4.18Å; F603-F607 AromaticContact CE1-CE2 3.63Å; F603-F607 HydrophobicContact CE1-CE2 3.63Å; F603-F607 HydrophobicContact CE1-CZ 4.46Å; F603-F607 HydrophobicContact CE2-CE2 4.07Å; F603-F607 HydrophobicContact CE2-CZ 4.16Å; F603-F607 AromaticContact CZ-CE2 3.55Å; F603-F607 HydrophobicContact CZ-CE2 3.55Å; F603-F607 AromaticContact CZ-CZ 3.93Å; F603-F607 HydrophobicContact CZ-CZ 3.93Å; V604-F607 PolarHBondContact O-N 3.47Å; V604-F607 VanDerWaalsContact O-N 3.16Å; S605-F607 VanDerWaalsContact C-N 3.35Å; F607-F610 PolarHBondContact O-N 3.3Å; F607-L611 WeakPolarHBondContact O-CB 3.4Å; F607-L611 PolarHBondContact O-N 3.03Å; F607-Y673 HydrophobicContact CB-CD1 4.2Å
608	E	78.8	Confident	72	Confident	66 Å²	66	55.6 Å²	55.6	31%	0.308	29%	0.29	S	S	.	.	H	α-helix	trans	-61.5	-47	171.1	-168.3	-167.3	175.7	0	0	111.5	V604 S605 F610 L611 K612 M674	V604-E608 PolarHBondContact O-N 3.26Å; S605-E608 WeakPolarHBondContact O-CB 3.35Å; S605-E608 PolarHBondContact O-N 2.74Å; E608-F610 VanDerWaalsContact C-N 3.31Å; E608-F610 PolarHBondContact O-N 2.75Å; E608-L611 PolarHBondContact O-N 3.08Å; E608-K612 HydrophobicContact CG-CD 4.33Å; E608-K612 WeakPolarHBondContact O-CG 3.49Å; E608-K612 PolarHBondContact O-N 3.07Å; E608-K612 WeakPolarHBondContact OE1-CE 3.47Å; E608-K612 IonicContact OE1-NZ 2.79Å; E608-K612 PolarHBondContact OE1-NZ 2.85Å; E608-M674 HydrophobicContact CB-CG 4.37Å; E608-M674 HydrophobicContact CB-SD 3.63Å; E608-M674 HydrophobicContact CG-CE 4.46Å; E608-M674 HydrophobicContact CG-SD 3.58Å; E608-M674 VanDerWaalsContact CG-SD 3.58Å
609	K	76.4	Confident	74.4	Confident	151 Å²	151	50 Å²	50	66%	0.657	26%	0.264	S	S	*	.	H	α-helix	trans	-60.2	-42.7	176.6	-67.7	176.8	-176.6	176.1	0	111.3	S605 S606 K612 A613	S605-K609 PolarHBondContact O-N 3.22Å; S606-K609 PolarHBondContact O-N 2.81Å; K609-K612 PolarHBondContact O-N 3.33Å; K609-A613 WeakPolarHBondContact O-CB 3.26Å; K609-A613 PolarHBondContact O-N 3.49Å
610	F	76.9	Confident	76.3	Confident	11 Å²	11	50.1 Å²	50.1	5%	0.048	26%	0.264	C	S	.	.	H	α-helix	trans	-68.3	-40.5	179.8	-168.8	-109.8	0	0	0	113.1	S244 L247 A248 S606 F607 E608 K612 A613 K614 T615 H631	S244-F610 WeakPolarHBondContact O-CE1 3.27Å; S244-F610 VanDerWaalsContact O-CZ 3.25Å; S244-F610 WeakPolarHBondContact O-CZ 3.42Å; L247-F610 HydrophobicContact CB-CE2 3.88Å; L247-F610 HydrophobicContact CB-CZ 4.15Å; A248-F610 HydrophobicContact CB-CB 3.7Å; A248-F610 HydrophobicContact CB-CD1 3.56Å; A248-F610 HydrophobicContact CB-CD2 3.62Å; A248-F610 HydrophobicContact CB-CE1 3.96Å; A248-F610 HydrophobicContact CB-CE2 4.01Å; A248-F610 HydrophobicContact CB-CG 3.35Å; A248-F610 HydrophobicContact CB-CZ 4.17Å; S606-F610 PolarHBondContact O-N 3.25Å; F607-F610 PolarHBondContact O-N 3.3Å; E608-F610 VanDerWaalsContact C-N 3.31Å; E608-F610 PolarHBondContact O-N 2.75Å; F610-K612 VanDerWaalsContact C-N 3.32Å; F610-K612 PolarHBondContact O-N 2.91Å; F610-A613 PolarHBondContact O-N 3.06Å; F610-K614 PolarHBondContact O-N 2.66Å; F610-T615 VanDerWaalsContact CD2-OG1 3.27Å; F610-T615 WeakPolarHBondContact CD2-OG1 3.36Å; F610-T615 WeakPolarHBondContact CE2-O 3.43Å; F610-T615 WeakPolarHBondContact CE2-OG1 3.35Å; F610-T615 WeakPolarHBondContact CZ-O 3.29Å; F610-H631 AromaticContact CD1-CE1 3.59Å; F610-H631 AromaticContact CD1-ND1 3.98Å; F610-H631 AromaticContact CD1-NE2 3.93Å; F610-H631 AromaticContact CE1-CD2 3.56Å; F610-H631 AromaticContact CE1-CE1 3.37Å; F610-H631 WeakPolarHBondContact CE1-CE1 3.45Å; F610-H631 AromaticContact CE1-CG 3.89Å; F610-H631 AromaticContact CE1-ND1 3.78Å; F610-H631 AromaticContact CE1-NE2 3.22Å; F610-H631 WeakPolarHBondContact CE1-NE2 3.49Å; F610-H631 AromaticContact CZ-NE2 3.75Å
611	L	77.1	Confident	77.9	Confident	30 Å²	30	49.4 Å²	49.4	16%	0.157	26%	0.261	C	S	.	.	H	α-helix	trans	-58.5	-44.6	172.3	179	60.7	0	0	0	111.2	F607 E608 K614 I669 Y673	F607-L611 WeakPolarHBondContact O-CB 3.4Å; F607-L611 PolarHBondContact O-N 3.03Å; E608-L611 PolarHBondContact O-N 3.08Å; L611-K614 PolarHBondContact O-N 3.32Å; L611-I669 HydrophobicContact CD1-CG2 3.67Å; L611-I669 HydrophobicContact CD2-CG2 3.95Å; L611-I669 HydrophobicContact CG-CG2 4.48Å; L611-Y673 HydrophobicContact CB-CD1 3.72Å; L611-Y673 HydrophobicContact CB-CE1 3.96Å; L611-Y673 HydrophobicContact CB-CG 4.37Å; L611-Y673 HydrophobicContact CD1-CD1 4.24Å; L611-Y673 HydrophobicContact CD1-CE1 3.96Å; L611-Y673 HydrophobicContact CD1-CE2 4.28Å; L611-Y673 HydrophobicContact CD2-CD1 4.27Å; L611-Y673 HydrophobicContact CD2-CD2 4.45Å; L611-Y673 HydrophobicContact CD2-CG 4.08Å; L611-Y673 HydrophobicContact CG-CD1 4.29Å; L611-Y673 HydrophobicContact CG-CE1 4.44Å
612	K	79.3	Confident	79.4	Confident	147 Å²	147	45 Å²	45	64%	0.639	24%	0.243	S	C	*	.	H	α-helix	trans	-65.8	-34.7	176.7	-72.5	171	175.4	174.7	0	112.8	E608 K609 F610	E608-K612 HydrophobicContact CG-CD 4.33Å; E608-K612 WeakPolarHBondContact O-CG 3.49Å; E608-K612 PolarHBondContact O-N 3.07Å; E608-K612 WeakPolarHBondContact OE1-CE 3.47Å; E608-K612 IonicContact OE1-NZ 2.79Å; E608-K612 PolarHBondContact OE1-NZ 2.85Å; K609-K612 PolarHBondContact O-N 3.33Å; F610-K612 VanDerWaalsContact C-N 3.32Å; F610-K612 PolarHBondContact O-N 2.91Å
613	A	76.7	Confident	80.7	Confident	59 Å²	59	43.3 Å²	43.3	49%	0.488	23%	0.23	S	C	.	.	H	α-helix	trans	-73.1	-22.1	179.5	0	0	0	0	0	114.2	K609 F610 T615	K609-A613 WeakPolarHBondContact O-CB 3.26Å; K609-A613 PolarHBondContact O-N 3.49Å; F610-A613 PolarHBondContact O-N 3.06Å; A613-T615 HydrophobicContact CB-CG2 4.06Å; A613-T615 PolarHBondContact O-N 2.87Å
614	K	79.6	Confident	81.7	Confident	125 Å²	125	46.8 Å²	46.8	54%	0.543	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	19.2	-177.6	-58.4	-176.6	173.2	-168.6	0	115.1	F610 L611 T617 T629	F610-K614 PolarHBondContact O-N 2.66Å; L611-K614 PolarHBondContact O-N 3.32Å; K614-T617 HydrophobicContact CB-CG2 4.42Å; K614-T617 WeakPolarHBondContact O-CG2 3.46Å; K614-T617 PolarHBondContact O-OG1 3.29Å; K614-T629 WeakPolarHBondContact CD-OG1 3.3Å
615	T	73.4	Confident	82.6	Confident	47 Å²	47	50.5 Å²	50.5	29%	0.288	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	127.1	-177.2	42.1	0	0	0	0	112.2	M254 F610 A613 T617 H631	M254-T615 HydrophobicContact CE-CG2 4.43Å; F610-T615 VanDerWaalsContact CD2-OG1 3.27Å; F610-T615 WeakPolarHBondContact CD2-OG1 3.36Å; F610-T615 WeakPolarHBondContact CE2-O 3.43Å; F610-T615 WeakPolarHBondContact CE2-OG1 3.35Å; F610-T615 WeakPolarHBondContact CZ-O 3.29Å; A613-T615 HydrophobicContact CB-CG2 4.06Å; A613-T615 PolarHBondContact O-N 2.87Å; T615-T617 VanDerWaalsContact C-N 3.34Å; T615-T617 PolarHBondContact O-N 3.03Å; T615-H631 PolarHBondContact O-NE2 3.06Å
616	A	75.4	Confident	83.5	Confident	31 Å²	31	50.2 Å²	50.2	26%	0.256	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.9	30.9	179.4	0	0	0	0	0	115.4	L247 D618 H631	L247-A616 HydrophobicContact CD1-CB 3.82Å; A616-D618 PolarHBondContact O-N 3.09Å; A616-H631 PolarHBondContact O-CD2 2.77Å; A616-H631 VanDerWaalsContact O-CD2 3.28Å
617	T	86.3	Confident	84.4	Confident	32 Å²	32	53.6 Å²	53.6	20%	0.196	29%	0.29	C	S	.	.			trans	-64.2	122.7	170.1	49.9	0	0	0	0	111.5	K614 T615 A630 H631 R652	K614-T617 HydrophobicContact CB-CG2 4.42Å; K614-T617 WeakPolarHBondContact O-CG2 3.46Å; K614-T617 PolarHBondContact O-OG1 3.29Å; T615-T617 VanDerWaalsContact C-N 3.34Å; T615-T617 PolarHBondContact O-N 3.03Å; T617-A630 CarbonylContact C-O 3.54Å; T617-A630 VanDerWaalsContact CA-O 3.31Å; T617-A630 WeakPolarHBondContact CA-O 3.33Å; T617-A630 VanDerWaalsContact CB-O 3.24Å; T617-A630 WeakPolarHBondContact CB-O 3.28Å; T617-H631 WeakPolarHBondContact CG2-NE2 3.29Å; T617-H631 PolarHBondContact N-NE2 3.38Å; T617-R652 PolarHBondContact O-NH2 3.28Å
618	D	85.2	Confident	85	Confident	33 Å²	33	54.5 Å²	54.5	18%	0.176	30%	0.295	C	S	.	.			trans	-104.1	-6.4	179.3	67.3	-32.9	0	0	0	113	A616 A630 H631 R632 Y653	A616-D618 PolarHBondContact O-N 3.09Å; D618-A630 PolarHBondContact N-O 3.33Å; D618-H631 WeakPolarHBondContact OD1-CA 3.36Å; D618-R632 WeakPolarHBondContact OD1-CB 3.22Å; D618-R632 PolarHBondContact OD1-N 2.93Å; D618-R632 WeakPolarHBondContact OD2-CB 3.35Å; D618-R632 IonicContact OD2-NE 2.65Å; D618-R632 PolarHBondContact OD2-NE 3.47Å; D618-Y653 PolarHBondContact O-N 3.39Å
619	M	89.4	Confident	85.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	147.2	-171.1	-176.4	-178.4	175.6	0	0	112.2	I621 T629 A630 R632 F635 I646 R652 Y653 L655	M619-I621 HydrophobicContact CE-CG1 4Å; M619-T629 CarbonylContact O-C 3.59Å; M619-T629 WeakPolarHBondContact O-CA 3.19Å; M619-A630 PolarHBondContact N-O 3.38Å; M619-A630 VanDerWaalsContact N-O 3.12Å; M619-A630 PolarHBondContact O-N 3.44Å; M619-R632 HydrophobicContact CB-CB 4.22Å; M619-R632 HydrophobicContact SD-CB 4.2Å; M619-R632 HydrophobicContact SD-CG 4.43Å; M619-F635 HydrophobicContact CE-CD1 4.49Å; M619-F635 HydrophobicContact CE-CD2 4.48Å; M619-F635 HydrophobicContact CE-CG 4.44Å; M619-F635 HydrophobicContact SD-CD2 3.9Å; M619-F635 HydrophobicContact SD-CE2 4.21Å; M619-F635 HydrophobicContact SD-CG 4.28Å; M619-I646 HydrophobicContact CE-CD1 3.58Å; M619-I646 HydrophobicContact CE-CG1 3.67Å; M619-I646 HydrophobicContact CE-CG2 4.31Å; M619-I646 HydrophobicContact SD-CD1 3.86Å; M619-R652 PolarHBondContact O-NH2 3.17Å; M619-Y653 CarbonylContact C-O 3.59Å; M619-Y653 VanDerWaalsContact CA-O 3.24Å; M619-Y653 WeakPolarHBondContact CA-O 3.47Å; M619-L655 HydrophobicContact CE-CB 3.38Å; M619-L655 HydrophobicContact CE-CD2 4.19Å; M619-L655 HydrophobicContact CE-CG 4.39Å
620	D	91.7	Very high	86.1	Confident	30 Å²	30	45.7 Å²	45.7	16%	0.16	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	139.5	169.8	-71.5	-33.5	0	0	0	110.2	V627 T629 R652 Y653 V654 L655	D620-V627 HydrophobicContact CB-CG1 3.8Å; D620-T629 WeakPolarHBondContact OD1-CG2 3.11Å; D620-R652 VanDerWaalsContact CG-CZ 3.42Å; D620-R652 IonicContact OD1-CZ 3.97Å; D620-R652 IonicContact OD1-NH1 3.2Å; D620-R652 PolarHBondContact OD1-NH1 2.96Å; D620-R652 IonicContact OD1-NH2 3.75Å; D620-R652 PolarHBondContact OD1-NH2 3.42Å; D620-R652 WeakPolarHBondContact OD2-CD 3.36Å; D620-R652 IonicContact OD2-CZ 3.93Å; D620-R652 IonicContact OD2-NE 2.67Å; D620-R652 PolarHBondContact OD2-NE 2.89Å; D620-R652 IonicContact OD2-NH1 2.78Å; D620-R652 PolarHBondContact OD2-NH1 3.16Å; D620-Y653 PolarHBondContact N-O 3.11Å; D620-V654 WeakPolarHBondContact O-CA 3.4Å; D620-L655 PolarHBondContact O-N 2.91Å
621	I	91.7	Very high	86.5	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	115.4	177.8	-59.5	160.4	0	0	0	107	M619 A623 V627 I628 A630 F635 L655 A657 M665 I669	M619-I621 HydrophobicContact CE-CG1 4Å; I621-A623 PolarHBondContact O-N 2.99Å; I621-V627 CarbonylContact O-C 3.55Å; I621-V627 WeakPolarHBondContact O-CA 3.31Å; I621-I628 HydrophobicContact CB-CB 4.3Å; I621-I628 PolarHBondContact N-O 2.75Å; I621-I628 PolarHBondContact O-N 3.09Å; I621-A630 HydrophobicContact CD1-CB 3.7Å; I621-A630 HydrophobicContact CG1-CB 4.46Å; I621-F635 HydrophobicContact CD1-CE1 4.28Å; I621-F635 HydrophobicContact CD1-CE2 4.06Å; I621-F635 HydrophobicContact CD1-CZ 3.48Å; I621-F635 VanDerWaalsContact CD1-CZ 3.48Å; I621-F635 HydrophobicContact CG1-CZ 4.5Å; I621-L655 CarbonylContact C-O 3.55Å; I621-L655 WeakPolarHBondContact CA-O 3.2Å; I621-L655 HydrophobicContact CG1-CB 4.29Å; I621-L655 HydrophobicContact CG1-CD2 4.31Å; I621-L655 HydrophobicContact CG2-CD2 4.13Å; I621-A657 HydrophobicContact CG2-CB 4.28Å; I621-M665 HydrophobicContact CG2-CE 3.84Å; I621-I669 HydrophobicContact CD1-CD1 3.51Å; I621-I669 HydrophobicContact CD1-CG1 3.83Å
622	I	93.5	Very high	87	Confident	56 Å²	56	45.2 Å²	45.2	29%	0.287	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	101.6	-179.1	-53.2	177.4	0	0	0	107.5	V627 V654 L655 A657 T658	I622-V627 HydrophobicContact CG1-CG2 4.47Å; I622-V654 HydrophobicContact CD1-CG1 3.59Å; I622-V654 HydrophobicContact CG1-CG1 4Å; I622-L655 PolarHBondContact N-O 3.27Å; I622-A657 CarbonylContact O-C 3.59Å; I622-A657 WeakPolarHBondContact O-CA 3.04Å; I622-A657 PolarHBondContact O-N 3.2Å; I622-T658 HydrophobicContact CG2-CG2 3.76Å; I622-T658 PolarHBondContact O-N 3.08Å
623	A	93.6	Very high	87.1	Confident	5 Å²	5	38.5 Å²	38.5	4%	0.041	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	174.1	170.4	0	0	0	0	0	110.3	I621 D625 C626 C662 M665	I621-A623 PolarHBondContact O-N 2.99Å; A623-D625 PolarHBondContact O-N 3.37Å; A623-D625 VanDerWaalsContact O-N 3.15Å; A623-C626 WeakPolarHBondContact CB-O 3.25Å; A623-C626 PolarHBondContact N-O 2.96Å; A623-C662 HydrophobicContact CB-CB 4.5Å; A623-M665 HydrophobicContact CB-CG 4.38Å
624	S	93.2	Very high	87.4	Confident	73 Å²	73	35.7 Å²	35.7	51%	0.51	20%	0.202	S	C	.	.	S	Bend	trans	-56.9	-30.3	-178.6	73.9	0	0	0	0	114.6	T658 F660	S624-T658 VanDerWaalsContact CB-O 3.24Å; S624-T658 WeakPolarHBondContact CB-O 3.3Å; S624-F660 WeakPolarHBondContact CB-O 3.4Å; S624-F660 PolarHBondContact N-O 2.84Å; S624-F660 PolarHBondContact OG-O 2.9Å
625	D	92.8	Very high	87.8	Confident	105 Å²	105	29.7 Å²	29.7	56%	0.561	18%	0.177	S	C	*	.	S	Bend	trans	-132.7	-5.2	-166	61.1	-47.7	0	0	0	113.5	A623 S661 C662	A623-D625 PolarHBondContact O-N 3.37Å; A623-D625 VanDerWaalsContact O-N 3.15Å; D625-S661 WeakPolarHBondContact OD1-CA 3.38Å; D625-C662 WeakPolarHBondContact OD1-CB 3.48Å; D625-C662 PolarHBondContact OD1-N 3.26Å; D625-C662 VanDerWaalsContact OD2-CB 3.28Å; D625-C662 WeakPolarHBondContact OD2-CB 3.37Å
626	C	92.1	Very high	88.1	Confident	35 Å²	35	30 Å²	30	24%	0.236	17%	0.174	C	C	.	.			trans	-156.3	167	-178.5	91.5	0	0	0	0	113	A623 I628 C662	A623-C626 WeakPolarHBondContact CB-O 3.25Å; A623-C626 PolarHBondContact N-O 2.96Å; C626-I628 WeakPolarHBondContact SG-CG1 3.3Å; C626-C662 HydrophobicContact CB-CB 3.67Å; C626-C662 WeakPolarHBondContact CB-SG 3.5Å; C626-C662 WeakPolarHBondContact SG-CB 3.4Å; C626-C662 CovalentContact SG-SG 2.03Å; C626-C662 PolarHBondContact SG-SG 3.2Å
627	V	91.5	Very high	88.2	Confident	89 Å²	89	29.1 Å²	29.1	54%	0.539	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	127.3	166.1	-178.2	0	0	0	0	109.6	D620 I621 I622	D620-V627 HydrophobicContact CB-CG1 3.8Å; I621-V627 CarbonylContact O-C 3.55Å; I621-V627 WeakPolarHBondContact O-CA 3.31Å; I622-V627 HydrophobicContact CG1-CG2 4.47Å
628	I	90.1	Very high	88	Confident	19 Å²	19	30.5 Å²	30.5	10%	0.097	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	116.6	-179.4	-45.5	170.2	0	0	0	110	I621 C626 M665 Q666 I669	I621-I628 HydrophobicContact CB-CB 4.3Å; I621-I628 PolarHBondContact N-O 2.75Å; I621-I628 PolarHBondContact O-N 3.09Å; C626-I628 WeakPolarHBondContact SG-CG1 3.3Å; I628-M665 HydrophobicContact CD1-CB 3.73Å; I628-Q666 HydrophobicContact CD1-CG 4.05Å; I628-I669 HydrophobicContact CB-CD1 4.06Å; I628-I669 HydrophobicContact CD1-CD1 3.71Å; I628-I669 HydrophobicContact CG1-CD1 4.49Å; I628-I669 HydrophobicContact CG2-CD1 3.63Å
629	T	89.5	Confident	87.5	Confident	33 Å²	33	29 Å²	29	20%	0.202	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	129.7	174	55.8	0	0	0	0	111.1	K614 M619 D620	K614-T629 WeakPolarHBondContact CD-OG1 3.3Å; M619-T629 CarbonylContact O-C 3.59Å; M619-T629 WeakPolarHBondContact O-CA 3.19Å; D620-T629 WeakPolarHBondContact OD1-CG2 3.11Å
630	A	88.9	Confident	86.4	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	-177.5	-178.6	0	0	0	0	0	113.2	T617 D618 M619 I621 F635	T617-A630 CarbonylContact C-O 3.54Å; T617-A630 VanDerWaalsContact CA-O 3.31Å; T617-A630 WeakPolarHBondContact CA-O 3.33Å; T617-A630 VanDerWaalsContact CB-O 3.24Å; T617-A630 WeakPolarHBondContact CB-O 3.28Å; D618-A630 PolarHBondContact N-O 3.33Å; M619-A630 PolarHBondContact N-O 3.38Å; M619-A630 VanDerWaalsContact N-O 3.12Å; M619-A630 PolarHBondContact O-N 3.44Å; I621-A630 HydrophobicContact CD1-CB 3.7Å; I621-A630 HydrophobicContact CG1-CB 4.46Å; A630-F635 HydrophobicContact CB-CE2 3.92Å
631	H	86.4	Confident	85.7	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	21%	0.205	C	C	.	.			trans	-113.8	114.3	178.7	-48	88.9	0	0	0	110.5	F610 T615 A616 T617 D618 S633 K634 F635 Y673	F610-H631 AromaticContact CD1-CE1 3.59Å; F610-H631 AromaticContact CD1-ND1 3.98Å; F610-H631 AromaticContact CD1-NE2 3.93Å; F610-H631 AromaticContact CE1-CD2 3.56Å; F610-H631 AromaticContact CE1-CE1 3.37Å; F610-H631 WeakPolarHBondContact CE1-CE1 3.45Å; F610-H631 AromaticContact CE1-CG 3.89Å; F610-H631 AromaticContact CE1-ND1 3.78Å; F610-H631 AromaticContact CE1-NE2 3.22Å; F610-H631 WeakPolarHBondContact CE1-NE2 3.49Å; F610-H631 AromaticContact CZ-NE2 3.75Å; T615-H631 PolarHBondContact O-NE2 3.06Å; A616-H631 PolarHBondContact O-CD2 2.77Å; A616-H631 VanDerWaalsContact O-CD2 3.28Å; T617-H631 WeakPolarHBondContact CG2-NE2 3.29Å; T617-H631 PolarHBondContact N-NE2 3.38Å; D618-H631 WeakPolarHBondContact OD1-CA 3.36Å; H631-S633 VanDerWaalsContact C-N 3.25Å; H631-S633 PolarHBondContact O-N 3.07Å; H631-K634 HydrophobicContact CB-CG 4.22Å; H631-K634 WeakPolarHBondContact O-CB 3.49Å; H631-K634 PolarHBondContact O-N 3.06Å; H631-F635 WeakPolarHBondContact O-CD2 3.21Å; H631-Y673 VanDerWaalsContact CB-OH 3.26Å; H631-Y673 WeakPolarHBondContact CB-OH 3.46Å; H631-Y673 PolarHBondContact N-OH 3.12Å; H631-Y673 AromaticContact ND1-CE1 3.72Å; H631-Y673 AromaticContact ND1-CZ 3.7Å; H631-Y673 PolarHBondContact ND1-OH 3.22Å
632	R	86.5	Confident	85.1	Confident	30 Å²	30	36.3 Å²	36.3	11%	0.113	21%	0.205	C	C	.	.	H	α-helix	trans	-56.7	-37.1	-177.6	-168.8	-178.3	55.5	132	6	112.9	A227 D618 M619 K634 F635 F636 I646 Y653	A227-R632 PolarHBondContact O-NH2 3.48Å; D618-R632 WeakPolarHBondContact OD1-CB 3.22Å; D618-R632 PolarHBondContact OD1-N 2.93Å; D618-R632 WeakPolarHBondContact OD2-CB 3.35Å; D618-R632 IonicContact OD2-NE 2.65Å; D618-R632 PolarHBondContact OD2-NE 3.47Å; M619-R632 HydrophobicContact CB-CB 4.22Å; M619-R632 HydrophobicContact SD-CB 4.2Å; M619-R632 HydrophobicContact SD-CG 4.43Å; R632-K634 PolarHBondContact O-N 2.91Å; R632-K634 VanDerWaalsContact O-N 3.17Å; R632-F635 WeakPolarHBondContact O-CB 3.41Å; R632-F635 PolarHBondContact O-N 2.84Å; R632-F636 HydrophobicContact CG-CD2 3.83Å; R632-F636 HydrophobicContact CG-CE2 3.59Å; R632-F636 WeakPolarHBondContact O-CD2 3.35Å; R632-F636 PolarHBondContact O-N 3.36Å; R632-I646 HydrophobicContact CG-CD1 4.09Å; R632-I646 HydrophobicContact CG-CG2 4.43Å; R632-Y653 VanDerWaalsContact CD-CG 3.41Å; R632-Y653 PolarHBondContact NH1-OH 2.87Å
633	S	82.4	Confident	84.3	Confident	5 Å²	5	35.3 Å²	35.3	4%	0.035	20%	0.201	C	C	.	.	H	α-helix	trans	-54.6	-32.2	176.4	62.8	0	0	0	0	113.3	F221 S244 H631 A637	F221-S633 WeakPolarHBondContact CE1-O 3.49Å; S244-S633 PolarHBondContact OG-OG 2.9Å; H631-S633 VanDerWaalsContact C-N 3.25Å; H631-S633 PolarHBondContact O-N 3.07Å; S633-A637 WeakPolarHBondContact O-CB 3.47Å; S633-A637 PolarHBondContact O-N 3.35Å; S633-A637 VanDerWaalsContact O-N 3.08Å
634	K	83.1	Confident	83.7	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-75.1	-34.2	177.7	-62.5	-61.1	-172.5	175.2	0	112.4	F218 H631 R632 A637 R638 I672 Y673	F218-K634 HydrophobicContact CE1-CD 3.69Å; F218-K634 HydrophobicContact CZ-CD 3.71Å; H631-K634 HydrophobicContact CB-CG 4.22Å; H631-K634 WeakPolarHBondContact O-CB 3.49Å; H631-K634 PolarHBondContact O-N 3.06Å; R632-K634 PolarHBondContact O-N 2.91Å; R632-K634 VanDerWaalsContact O-N 3.17Å; K634-A637 PolarHBondContact O-N 2.94Å; K634-R638 WeakPolarHBondContact O-CB 3.41Å; K634-R638 PolarHBondContact O-N 2.86Å; K634-R638 VanDerWaalsContact O-N 3.1Å; K634-I672 HydrophobicContact CB-CG2 4.04Å; K634-Y673 HydrophobicContact CB-CD2 4.31Å; K634-Y673 HydrophobicContact CB-CE1 4.45Å; K634-Y673 HydrophobicContact CB-CE2 3.73Å; K634-Y673 HydrophobicContact CG-CD1 4.38Å; K634-Y673 HydrophobicContact CG-CE1 3.83Å; K634-Y673 HydrophobicContact CG-CE2 4.03Å
635	F	86.8	Confident	83.3	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-69.4	-42.2	172.6	-71.6	-101.8	0	0	0	111.1	M619 I621 A630 H631 R632 A637 R638 G639 M642 I646 L655 I669 I672	M619-F635 HydrophobicContact CE-CD1 4.49Å; M619-F635 HydrophobicContact CE-CD2 4.48Å; M619-F635 HydrophobicContact CE-CG 4.44Å; M619-F635 HydrophobicContact SD-CD2 3.9Å; M619-F635 HydrophobicContact SD-CE2 4.21Å; M619-F635 HydrophobicContact SD-CG 4.28Å; I621-F635 HydrophobicContact CD1-CE1 4.28Å; I621-F635 HydrophobicContact CD1-CE2 4.06Å; I621-F635 HydrophobicContact CD1-CZ 3.48Å; I621-F635 VanDerWaalsContact CD1-CZ 3.48Å; I621-F635 HydrophobicContact CG1-CZ 4.5Å; A630-F635 HydrophobicContact CB-CE2 3.92Å; H631-F635 WeakPolarHBondContact O-CD2 3.21Å; R632-F635 WeakPolarHBondContact O-CB 3.41Å; R632-F635 PolarHBondContact O-N 2.84Å; F635-A637 VanDerWaalsContact C-N 3.32Å; F635-A637 PolarHBondContact O-N 3.48Å; F635-R638 PolarHBondContact O-N 3.11Å; F635-G639 CarbonylContact O-C 3.57Å; F635-G639 WeakPolarHBondContact O-CA 3.14Å; F635-G639 PolarHBondContact O-N 3.19Å; F635-M642 HydrophobicContact CD1-CB 4.03Å; F635-M642 HydrophobicContact CD1-CE 4.09Å; F635-M642 HydrophobicContact CD1-SD 3.75Å; F635-M642 HydrophobicContact CE1-CE 3.68Å; F635-M642 HydrophobicContact CE1-SD 3.75Å; F635-I646 HydrophobicContact CB-CD1 3.95Å; F635-I646 HydrophobicContact CG-CD1 4.47Å; F635-L655 HydrophobicContact CE1-CD2 4.41Å; F635-I669 HydrophobicContact CZ-CG1 4.12Å; F635-I672 HydrophobicContact CD1-CD1 3.65Å; F635-I672 HydrophobicContact CE1-CD1 3.28Å; F635-I672 HydrophobicContact CE2-CD1 4.39Å; F635-I672 HydrophobicContact CG-CD1 4.34Å; F635-I672 HydrophobicContact CZ-CD1 3.69Å
636	F	79.6	Confident	83	Confident	52 Å²	52	36.6 Å²	36.6	23%	0.228	21%	0.209	C	C	.	.	H	α-helix	trans	-59.6	-39.3	171.9	-82	-76.9	0	0	0	113.3	F221 T226 A227 R632 V643	F221-F636 HydrophobicContact CD2-CB 4.17Å; F221-F636 HydrophobicContact CE2-CB 3.36Å; F221-F636 HydrophobicContact CE2-CG 4.24Å; F221-F636 HydrophobicContact CZ-CB 3.68Å; T226-F636 HydrophobicContact CG2-CD1 3.84Å; T226-F636 HydrophobicContact CG2-CE1 4Å; A227-F636 HydrophobicContact CB-CD1 4.44Å; A227-F636 HydrophobicContact CB-CD2 3.62Å; A227-F636 HydrophobicContact CB-CE1 4.23Å; A227-F636 HydrophobicContact CB-CE2 3.38Å; A227-F636 HydrophobicContact CB-CG 4.17Å; A227-F636 HydrophobicContact CB-CZ 3.73Å; R632-F636 HydrophobicContact CG-CD2 3.83Å; R632-F636 HydrophobicContact CG-CE2 3.59Å; R632-F636 WeakPolarHBondContact O-CD2 3.35Å; R632-F636 PolarHBondContact O-N 3.36Å; F636-V643 HydrophobicContact CB-CG2 4.35Å; F636-V643 HydrophobicContact CD1-CB 4.31Å; F636-V643 HydrophobicContact CD1-CG1 3.63Å; F636-V643 HydrophobicContact CD1-CG2 3.61Å; F636-V643 HydrophobicContact CE1-CB 4.3Å; F636-V643 HydrophobicContact CE1-CG1 3.22Å; F636-V643 HydrophobicContact CE1-CG2 4.09Å; F636-V643 HydrophobicContact CG-CG2 3.96Å; F636-V643 HydrophobicContact CZ-CG1 3.87Å
637	A	78.4	Confident	82.7	Confident	14 Å²	14	41.5 Å²	41.5	12%	0.116	23%	0.228	C	C	.	.	H	α-helix	trans	-73.9	-29.8	-179.4	0	0	0	0	0	114.4	F218 F221 S633 K634 F635	F218-A637 HydrophobicContact CD1-CB 3.96Å; F218-A637 HydrophobicContact CE1-CB 3.54Å; F218-A637 HydrophobicContact CZ-CB 4.04Å; F221-A637 HydrophobicContact CB-CB 4.05Å; F221-A637 HydrophobicContact CD1-CB 3.74Å; F221-A637 HydrophobicContact CD2-CB 4.45Å; F221-A637 HydrophobicContact CE1-CB 4.31Å; F221-A637 HydrophobicContact CG-CB 3.81Å; S633-A637 WeakPolarHBondContact O-CB 3.47Å; S633-A637 PolarHBondContact O-N 3.35Å; S633-A637 VanDerWaalsContact O-N 3.08Å; K634-A637 PolarHBondContact O-N 2.94Å; F635-A637 VanDerWaalsContact C-N 3.32Å; F635-A637 PolarHBondContact O-N 3.48Å
638	R	81.2	Confident	82.4	Confident	61 Å²	61	43.9 Å²	43.9	23%	0.23	23%	0.231	C	C	.	.	H	α-helix	trans	-130.1	-16.9	-166.4	-63.6	-59.6	-54.5	144.2	2.3	116.3	F214 S217 F218 K634 F635 I672 D675	F214-R638 HydrophobicContact CE2-CG 4.3Å; S217-R638 WeakPolarHBondContact OG-CD 3.48Å; S217-R638 PolarHBondContact OG-NH1 3.41Å; F218-R638 HydrophobicContact CE2-CG 4.39Å; F218-R638 HydrophobicContact CZ-CG 4.22Å; K634-R638 WeakPolarHBondContact O-CB 3.41Å; K634-R638 PolarHBondContact O-N 2.86Å; K634-R638 VanDerWaalsContact O-N 3.1Å; F635-R638 PolarHBondContact O-N 3.11Å; R638-I672 HydrophobicContact CB-CG2 4.17Å; R638-I672 WeakPolarHBondContact CG-O 3.47Å; R638-D675 IonicContact CZ-OD1 3.22Å; R638-D675 IonicContact NE-OD1 2.73Å; R638-D675 IonicContact NH2-OD1 3.47Å; R638-D675 PolarHBondContact NH2-OD1 2.95Å
639	G	75	Confident	82.1	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.01	25%	0.249	C	C	.	.			trans	-130.1	65.2	-174.2	0	0	0	0	0	112.6	F635 L641 M642 V643	F635-G639 CarbonylContact O-C 3.57Å; F635-G639 WeakPolarHBondContact O-CA 3.14Å; F635-G639 PolarHBondContact O-N 3.19Å; G639-L641 VanDerWaalsContact C-N 3.29Å; G639-L641 PolarHBondContact O-N 2.79Å; G639-M642 WeakPolarHBondContact O-CB 3.08Å; G639-M642 PolarHBondContact O-N 2.87Å; G639-V643 PolarHBondContact O-N 3.25Å
640	P	67.3	Low	81.6	Confident	102 Å²	102	55.3 Å²	55.3	66%	0.662	28%	0.279	S	S	*	.	H	α-helix	trans	-61.5	-26.4	-169.2	23	-34	0	0	0	115.2
641	L	75.4	Confident	81	Confident	81 Å²	81	62.9 Å²	62.9	42%	0.424	32%	0.319	S	S	.	.	H	α-helix	trans	-76.5	-33.9	171.3	-70.2	-166.9	0	0	0	113.1	G639 V643 S644 N695	G639-L641 VanDerWaalsContact C-N 3.29Å; G639-L641 PolarHBondContact O-N 2.79Å; L641-V643 PolarHBondContact O-N 2.88Å; L641-S644 PolarHBondContact O-N 2.98Å; L641-S644 PolarHBondContact O-OG 3.18Å; L641-N695 HydrophobicContact CD1-CB 3.38Å; L641-N695 HydrophobicContact CG-CB 4.25Å
642	M	80.5	Confident	80.9	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-64.3	-32.2	178.8	-55.6	-173.5	80.8	0	0	110.6	F635 G639 S644 L645 I646 L655 M665 V668 I672 Y694 M696	F635-M642 HydrophobicContact CD1-CB 4.03Å; F635-M642 HydrophobicContact CD1-CE 4.09Å; F635-M642 HydrophobicContact CD1-SD 3.75Å; F635-M642 HydrophobicContact CE1-CE 3.68Å; F635-M642 HydrophobicContact CE1-SD 3.75Å; G639-M642 WeakPolarHBondContact O-CB 3.08Å; G639-M642 PolarHBondContact O-N 2.87Å; M642-S644 VanDerWaalsContact C-N 3.29Å; M642-S644 PolarHBondContact O-N 3.38Å; M642-L645 CarbonylContact O-C 3.53Å; M642-L645 WeakPolarHBondContact O-CA 3.09Å; M642-L645 WeakPolarHBondContact O-CB 3.42Å; M642-L645 PolarHBondContact O-N 3.08Å; M642-I646 WeakPolarHBondContact O-CG1 3.48Å; M642-I646 PolarHBondContact O-N 3.04Å; M642-L655 HydrophobicContact CE-CD2 3.49Å; M642-L655 VanDerWaalsContact CE-CD2 3.49Å; M642-M665 HydrophobicContact CE-CE 4.16Å; M642-V668 HydrophobicContact CE-CG1 4.34Å; M642-V668 HydrophobicContact SD-CG1 4.37Å; M642-I672 HydrophobicContact SD-CD1 3.78Å; M642-Y694 HydrophobicContact CE-CD1 4.25Å; M642-Y694 HydrophobicContact CE-CD2 3.54Å; M642-Y694 HydrophobicContact CE-CE1 4.34Å; M642-Y694 HydrophobicContact CE-CE2 3.62Å; M642-Y694 HydrophobicContact CE-CG 3.88Å; M642-Y694 HydrophobicContact CG-CD1 4.1Å; M642-Y694 HydrophobicContact CG-CD2 4.43Å; M642-Y694 HydrophobicContact CG-CG 3.86Å; M642-Y694 HydrophobicContact SD-CD2 4.05Å; M642-Y694 HydrophobicContact SD-CG 4.06Å; M642-M696 HydrophobicContact CG-CE 4.25Å; M642-M696 HydrophobicContact SD-CE 3.28Å; M642-M696 WeakPolarHBondContact SD-CE 3.43Å
643	V	76.5	Confident	81	Confident	36 Å²	36	67.6 Å²	67.6	22%	0.218	34%	0.338	C	S	.	.	H	α-helix	trans	-50.8	-43.8	175.5	171.9	0	0	0	0	113	F636 G639 L641 L645 I646	F636-V643 HydrophobicContact CB-CG2 4.35Å; F636-V643 HydrophobicContact CD1-CB 4.31Å; F636-V643 HydrophobicContact CD1-CG1 3.63Å; F636-V643 HydrophobicContact CD1-CG2 3.61Å; F636-V643 HydrophobicContact CE1-CB 4.3Å; F636-V643 HydrophobicContact CE1-CG1 3.22Å; F636-V643 HydrophobicContact CE1-CG2 4.09Å; F636-V643 HydrophobicContact CG-CG2 3.96Å; F636-V643 HydrophobicContact CZ-CG1 3.87Å; G639-V643 PolarHBondContact O-N 3.25Å; L641-V643 PolarHBondContact O-N 2.88Å; V643-L645 PolarHBondContact O-N 3.35Å; V643-I646 PolarHBondContact O-N 2.93Å
644	S	80.4	Confident	81.4	Confident	96 Å²	96	67.9 Å²	67.9	67%	0.671	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-12.2	178.2	35.3	0	0	0	0	114.3	L641 M642	L641-S644 PolarHBondContact O-N 2.98Å; L641-S644 PolarHBondContact O-OG 3.18Å; M642-S644 VanDerWaalsContact C-N 3.29Å; M642-S644 PolarHBondContact O-N 3.38Å
645	L	86	Confident	81.9	Confident	88 Å²	88	67.9 Å²	67.9	46%	0.461	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	0.5	176.3	-51.8	176.2	0	0	0	112.4	M642 V643 L655 Y694	M642-L645 CarbonylContact O-C 3.53Å; M642-L645 WeakPolarHBondContact O-CA 3.09Å; M642-L645 WeakPolarHBondContact O-CB 3.42Å; M642-L645 PolarHBondContact O-N 3.08Å; V643-L645 PolarHBondContact O-N 3.35Å; L645-L655 HydrophobicContact CB-CD1 3.48Å; L645-L655 VanDerWaalsContact CB-CD1 3.48Å; L645-L655 HydrophobicContact CD1-CD1 4.38Å; L645-Y694 HydrophobicContact CD1-CD1 4.16Å; L645-Y694 HydrophobicContact CD1-CE1 3.97Å
646	I	86.2	Confident	82.1	Confident	26 Å²	26	72.5 Å²	72.5	13%	0.133	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	106.9	177.8	-56.2	-179.8	0	0	0	109.3	M619 R632 F635 M642 V643 Y653 V654	M619-I646 HydrophobicContact CE-CD1 3.58Å; M619-I646 HydrophobicContact CE-CG1 3.67Å; M619-I646 HydrophobicContact CE-CG2 4.31Å; M619-I646 HydrophobicContact SD-CD1 3.86Å; R632-I646 HydrophobicContact CG-CD1 4.09Å; R632-I646 HydrophobicContact CG-CG2 4.43Å; F635-I646 HydrophobicContact CB-CD1 3.95Å; F635-I646 HydrophobicContact CG-CD1 4.47Å; M642-I646 WeakPolarHBondContact O-CG1 3.48Å; M642-I646 PolarHBondContact O-N 3.04Å; V643-I646 PolarHBondContact O-N 2.93Å; I646-Y653 HydrophobicContact CG2-CD1 4.17Å; I646-Y653 HydrophobicContact CG2-CG 4.32Å; I646-V654 WeakPolarHBondContact CA-O 3.29Å
647	E	86.1	Confident	82.7	Confident	138 Å²	138	70 Å²	70	65%	0.645	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	162.8	174.1	-61.1	-168.1	169.6	0	0	111.1	Y653 V654	E647-Y653 CarbonylContact O-C 3.56Å; E647-Y653 VanDerWaalsContact O-CA 3.3Å; E647-Y653 WeakPolarHBondContact O-CA 3.48Å; E647-V654 PolarHBondContact N-O 3.45Å; E647-V654 PolarHBondContact O-N 3.45Å
648	K	84.1	Confident	83.4	Confident	139 Å²	139	72.7 Å²	72.7	60%	0.604	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.7	108.7	174.2	-172.6	-175.7	176.1	-173.9	0	109.7	K650 Y653	K648-K650 VanDerWaalsContact CE-O 3.27Å; K648-K650 WeakPolarHBondContact CE-O 3.39Å; K648-Y653 HydrophobicContact CB-CD1 4Å; K648-Y653 HydrophobicContact CB-CE1 3.92Å; K648-Y653 HydrophobicContact CD-CE1 4.11Å; K648-Y653 HydrophobicContact CG-CD1 4.18Å; K648-Y653 HydrophobicContact CG-CE1 3.91Å
649	E	83.5	Confident	84	Confident	102 Å²	102	74.9 Å²	74.9	48%	0.477	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	110.7	174.6	-68.1	-168.7	-157.2	0	0	110.5	D651 R652 V654	E649-D651 PolarHBondContact O-N 2.64Å; E649-R652 CarbonylContact C-O 3.52Å; E649-R652 PolarHBondContact N-O 2.69Å; E649-R652 PolarHBondContact O-N 2.97Å; E649-R652 VanDerWaalsContact O-O 3.05Å; E649-V654 HydrophobicContact CB-CG2 3.83Å; E649-V654 HydrophobicContact CG-CB 4.22Å; E649-V654 HydrophobicContact CG-CG2 3.87Å
650	K	79.5	Confident	85	Confident	190 Å²	190	75.1 Å²	75.1	83%	0.826	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	-110.8	-178.1	-54.1	169.2	-174.6	167.4	0	110.7	K648	K648-K650 VanDerWaalsContact CE-O 3.27Å; K648-K650 WeakPolarHBondContact CE-O 3.39Å
651	D	77.1	Confident	86.3	Confident	158 Å²	158	71 Å²	71	85%	0.845	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	1.1	-175.7	-56.6	-48.2	0	0	0	113.5	E649	E649-D651 PolarHBondContact O-N 2.64Å
652	R	82.7	Confident	87.1	Confident	75 Å²	75	67.9 Å²	67.9	28%	0.283	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	162.1	-179	-58.1	-158.7	76.2	-176.5	-0.3	112.3	T617 M619 D620 E649	T617-R652 PolarHBondContact O-NH2 3.28Å; M619-R652 PolarHBondContact O-NH2 3.17Å; D620-R652 VanDerWaalsContact CG-CZ 3.42Å; D620-R652 IonicContact OD1-CZ 3.97Å; D620-R652 IonicContact OD1-NH1 3.2Å; D620-R652 PolarHBondContact OD1-NH1 2.96Å; D620-R652 IonicContact OD1-NH2 3.75Å; D620-R652 PolarHBondContact OD1-NH2 3.42Å; D620-R652 WeakPolarHBondContact OD2-CD 3.36Å; D620-R652 IonicContact OD2-CZ 3.93Å; D620-R652 IonicContact OD2-NE 2.67Å; D620-R652 PolarHBondContact OD2-NE 2.89Å; D620-R652 IonicContact OD2-NH1 2.78Å; D620-R652 PolarHBondContact OD2-NH1 3.16Å; E649-R652 CarbonylContact C-O 3.52Å; E649-R652 PolarHBondContact N-O 2.69Å; E649-R652 PolarHBondContact O-N 2.97Å; E649-R652 VanDerWaalsContact O-O 3.05Å
653	Y	88.9	Confident	87.8	Confident	56 Å²	56	72.2 Å²	72.2	22%	0.22	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	139.2	170.9	-64.3	-82.4	0	0	0	110	D618 M619 D620 R632 I646 E647 K648	D618-Y653 PolarHBondContact O-N 3.39Å; M619-Y653 CarbonylContact C-O 3.59Å; M619-Y653 VanDerWaalsContact CA-O 3.24Å; M619-Y653 WeakPolarHBondContact CA-O 3.47Å; D620-Y653 PolarHBondContact N-O 3.11Å; R632-Y653 VanDerWaalsContact CD-CG 3.41Å; R632-Y653 PolarHBondContact NH1-OH 2.87Å; I646-Y653 HydrophobicContact CG2-CD1 4.17Å; I646-Y653 HydrophobicContact CG2-CG 4.32Å; E647-Y653 CarbonylContact O-C 3.56Å; E647-Y653 VanDerWaalsContact O-CA 3.3Å; E647-Y653 WeakPolarHBondContact O-CA 3.48Å; K648-Y653 HydrophobicContact CB-CD1 4Å; K648-Y653 HydrophobicContact CB-CE1 3.92Å; K648-Y653 HydrophobicContact CD-CE1 4.11Å; K648-Y653 HydrophobicContact CG-CD1 4.18Å; K648-Y653 HydrophobicContact CG-CE1 3.91Å
654	V	91.9	Very high	88.6	Confident	11 Å²	11	70.5 Å²	70.5	7%	0.067	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.1	-174.2	178.4	0	0	0	0	109.6	D620 I622 I646 E647 E649	D620-V654 WeakPolarHBondContact O-CA 3.4Å; I622-V654 HydrophobicContact CD1-CG1 3.59Å; I622-V654 HydrophobicContact CG1-CG1 4Å; I646-V654 WeakPolarHBondContact CA-O 3.29Å; E647-V654 PolarHBondContact N-O 3.45Å; E647-V654 PolarHBondContact O-N 3.45Å; E649-V654 HydrophobicContact CB-CG2 3.83Å; E649-V654 HydrophobicContact CG-CB 4.22Å; E649-V654 HydrophobicContact CG-CG2 3.87Å
655	L	92.2	Very high	89.3	Confident	0 Å²	0	66 Å²	66	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	119.4	163.1	171.5	69.8	0	0	0	108.1	M619 D620 I621 I622 F635 M642 L645 A657 M665	M619-L655 HydrophobicContact CE-CB 3.38Å; M619-L655 HydrophobicContact CE-CD2 4.19Å; M619-L655 HydrophobicContact CE-CG 4.39Å; D620-L655 PolarHBondContact O-N 2.91Å; I621-L655 CarbonylContact C-O 3.55Å; I621-L655 WeakPolarHBondContact CA-O 3.2Å; I621-L655 HydrophobicContact CG1-CB 4.29Å; I621-L655 HydrophobicContact CG1-CD2 4.31Å; I621-L655 HydrophobicContact CG2-CD2 4.13Å; I622-L655 PolarHBondContact N-O 3.27Å; F635-L655 HydrophobicContact CE1-CD2 4.41Å; M642-L655 HydrophobicContact CE-CD2 3.49Å; M642-L655 VanDerWaalsContact CE-CD2 3.49Å; L645-L655 HydrophobicContact CB-CD1 3.48Å; L645-L655 VanDerWaalsContact CB-CD1 3.48Å; L645-L655 HydrophobicContact CD1-CD1 4.38Å; L655-A657 HydrophobicContact CG-CB 4.47Å; L655-M665 HydrophobicContact CD2-CE 4.34Å
656	N	91.6	Very high	89.5	Confident	97 Å²	97	66.4 Å²	66.4	52%	0.519	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	114.1	171.7	-168.9	-15.3	0	0	0	108.9	T658	N656-T658 WeakPolarHBondContact OD1-CB 3.45Å; N656-T658 VanDerWaalsContact OD1-CG2 3.22Å; N656-T658 WeakPolarHBondContact OD1-CG2 3.12Å; N656-T658 PolarHBondContact OD1-N 2.59Å; N656-T658 PolarHBondContact OD1-OG1 2.9Å
657	A	92.4	Very high	89.8	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	40.8	-179.5	0	0	0	0	0	109.5	I621 I622 L655 E659 F660 M665 Y694	I621-A657 HydrophobicContact CG2-CB 4.28Å; I622-A657 CarbonylContact O-C 3.59Å; I622-A657 WeakPolarHBondContact O-CA 3.04Å; I622-A657 PolarHBondContact O-N 3.2Å; L655-A657 HydrophobicContact CG-CB 4.47Å; A657-E659 VanDerWaalsContact CA-OE2 3.28Å; A657-E659 WeakPolarHBondContact CA-OE2 3.47Å; A657-E659 PolarHBondContact O-N 3.48Å; A657-E659 VanDerWaalsContact O-N 3.16Å; A657-F660 PolarHBondContact O-N 3.04Å; A657-F660 VanDerWaalsContact O-N 3.09Å; A657-M665 HydrophobicContact CB-CE 3.72Å; A657-M665 HydrophobicContact CB-CG 4.35Å; A657-M665 HydrophobicContact CB-SD 4.08Å; A657-Y694 VanDerWaalsContact CB-OH 3.3Å; A657-Y694 WeakPolarHBondContact CB-OH 3.46Å
658	T	92.7	Very high	90.1	Very high	70 Å²	70	59.1 Å²	59.1	43%	0.429	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-10	-173.4	40.4	0	0	0	0	113.9	I622 S624 N656 F660	I622-T658 HydrophobicContact CG2-CG2 3.76Å; I622-T658 PolarHBondContact O-N 3.08Å; S624-T658 VanDerWaalsContact CB-O 3.24Å; S624-T658 WeakPolarHBondContact CB-O 3.3Å; N656-T658 WeakPolarHBondContact OD1-CB 3.45Å; N656-T658 VanDerWaalsContact OD1-CG2 3.22Å; N656-T658 WeakPolarHBondContact OD1-CG2 3.12Å; N656-T658 PolarHBondContact OD1-N 2.59Å; N656-T658 PolarHBondContact OD1-OG1 2.9Å; T658-F660 VanDerWaalsContact C-N 3.31Å
659	E	93.6	Very high	90.4	Very high	106 Å²	106	52.6 Å²	52.6	50%	0.495	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-14	170.5	70.5	-75.5	176.8	0	0	114.4	A657 Y694	A657-E659 VanDerWaalsContact CA-OE2 3.28Å; A657-E659 WeakPolarHBondContact CA-OE2 3.47Å; A657-E659 PolarHBondContact O-N 3.48Å; A657-E659 VanDerWaalsContact O-N 3.16Å; E659-Y694 PolarHBondContact OE1-OH 3.48Å
660	F	95.6	Very high	90.7	Very high	6 Å²	6	49.4 Å²	49.4	3%	0.026	24%	0.244	C	C	.	.	S	Bend	trans	-120.8	148	-177.9	-60.3	-55.8	0	0	0	113.3	S624 A657 T658 A664 M665 E686 R689 A690 D693 Y694	S624-F660 WeakPolarHBondContact CB-O 3.4Å; S624-F660 PolarHBondContact N-O 2.84Å; S624-F660 PolarHBondContact OG-O 2.9Å; A657-F660 PolarHBondContact O-N 3.04Å; A657-F660 VanDerWaalsContact O-N 3.09Å; T658-F660 VanDerWaalsContact C-N 3.31Å; F660-A664 HydrophobicContact CB-CB 4.43Å; F660-M665 HydrophobicContact CB-CG 3.77Å; F660-M665 HydrophobicContact CB-SD 3.91Å; F660-M665 HydrophobicContact CD2-SD 3.81Å; F660-M665 HydrophobicContact CG-SD 4.19Å; F660-E686 HydrophobicContact CD1-CB 4.48Å; F660-R689 HydrophobicContact CE1-CB 3.8Å; F660-R689 HydrophobicContact CZ-CB 4.32Å; F660-A690 HydrophobicContact CD1-CB 4.06Å; F660-A690 HydrophobicContact CD2-CB 3.9Å; F660-A690 HydrophobicContact CE1-CB 3.83Å; F660-A690 HydrophobicContact CE2-CB 3.64Å; F660-A690 HydrophobicContact CG-CB 4.12Å; F660-A690 HydrophobicContact CZ-CB 3.62Å; F660-D693 WeakPolarHBondContact CZ-OD2 3.48Å; F660-Y694 HydrophobicContact CD2-CE2 4.09Å; F660-Y694 WeakPolarHBondContact CD2-OH 3.45Å; F660-Y694 AromaticContact CE2-CE2 3.86Å; F660-Y694 HydrophobicContact CE2-CE2 3.86Å; F660-Y694 AromaticContact CE2-CZ 3.67Å; F660-Y694 WeakPolarHBondContact CE2-OH 3.18Å
661	S	94.9	Very high	91.2	Very high	17 Å²	17	40.9 Å²	40.9	12%	0.119	21%	0.208	C	C	.	.			trans	-68.7	156.7	172.8	67.4	0	0	0	0	112.9	D625 Q663 A664 M665 E686	D625-S661 WeakPolarHBondContact OD1-CA 3.38Å; S661-Q663 PolarHBondContact O-N 2.72Å; S661-Q663 VanDerWaalsContact O-N 3.17Å; S661-A664 PolarHBondContact O-N 3.22Å; S661-A664 VanDerWaalsContact O-N 3.15Å; S661-A664 WeakPolarHBondContact OG-CB 3.37Å; S661-A664 PolarHBondContact OG-N 2.6Å; S661-A664 VanDerWaalsContact OG-N 3.16Å; S661-M665 PolarHBondContact O-N 2.88Å; S661-E686 WeakPolarHBondContact CB-OE2 3.44Å; S661-E686 PolarHBondContact N-OE2 2.75Å; S661-E686 PolarHBondContact OG-OE2 2.93Å
662	C	93.6	Very high	91.7	Very high	15 Å²	15	33.5 Å²	33.5	10%	0.101	17%	0.168	C	C	.	.	H	α-helix	trans	-53.1	-35.6	172.7	-163.9	0	0	0	0	111.7	A623 D625 C626 Q666	A623-C662 HydrophobicContact CB-CB 4.5Å; D625-C662 WeakPolarHBondContact OD1-CB 3.48Å; D625-C662 PolarHBondContact OD1-N 3.26Å; D625-C662 VanDerWaalsContact OD2-CB 3.28Å; D625-C662 WeakPolarHBondContact OD2-CB 3.37Å; C626-C662 HydrophobicContact CB-CB 3.67Å; C626-C662 WeakPolarHBondContact CB-SG 3.5Å; C626-C662 WeakPolarHBondContact SG-CB 3.4Å; C626-C662 CovalentContact SG-SG 2.03Å; C626-C662 PolarHBondContact SG-SG 3.2Å; C662-Q666 VanDerWaalsContact O-CB 3.31Å; C662-Q666 WeakPolarHBondContact O-CB 3.26Å; C662-Q666 WeakPolarHBondContact O-CG 3.24Å; C662-Q666 PolarHBondContact O-N 2.94Å; C662-Q666 PolarHBondContact SG-NE2 3.3Å; C662-Q666 VanDerWaalsContact SG-NE2 3.37Å
663	Q	93.4	Very high	91.9	Very high	91 Å²	91	29.9 Å²	29.9	43%	0.425	15%	0.154	S	C	.	.	H	α-helix	trans	-74.4	-42.3	179.4	-62.3	-170.1	4.9	0	0	112.4	S661 Q666 C667 I683	S661-Q663 PolarHBondContact O-N 2.72Å; S661-Q663 VanDerWaalsContact O-N 3.17Å; Q663-Q666 PolarHBondContact O-N 3.06Å; Q663-C667 PolarHBondContact O-N 2.83Å; Q663-C667 VanDerWaalsContact O-N 3.12Å; Q663-I683 HydrophobicContact CB-CD1 4.5Å; Q663-I683 HydrophobicContact CB-CG2 3.78Å
664	A	94.6	Very high	91.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-62.1	-46.2	174	0	0	0	0	0	111	F660 S661 Q666 C667 V668 E686 V687	F660-A664 HydrophobicContact CB-CB 4.43Å; S661-A664 PolarHBondContact O-N 3.22Å; S661-A664 VanDerWaalsContact O-N 3.15Å; S661-A664 WeakPolarHBondContact OG-CB 3.37Å; S661-A664 PolarHBondContact OG-N 2.6Å; S661-A664 VanDerWaalsContact OG-N 3.16Å; A664-Q666 PolarHBondContact O-N 2.71Å; A664-C667 WeakPolarHBondContact O-CA 3.31Å; A664-C667 WeakPolarHBondContact O-CB 3.35Å; A664-C667 PolarHBondContact O-N 2.83Å; A664-V668 PolarHBondContact O-N 3.41Å; A664-E686 HydrophobicContact CB-CB 3.63Å; A664-E686 WeakPolarHBondContact CB-OE2 3.44Å; A664-V687 HydrophobicContact CB-CG2 4.07Å
665	M	94.2	Very high	91.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66.9	-35.9	177.3	-68.9	-54.1	-69.8	0	0	112.9	I621 A623 I628 M642 L655 A657 F660 S661 C667 V668 I669 Y694	I621-M665 HydrophobicContact CG2-CE 3.84Å; A623-M665 HydrophobicContact CB-CG 4.38Å; I628-M665 HydrophobicContact CD1-CB 3.73Å; M642-M665 HydrophobicContact CE-CE 4.16Å; L655-M665 HydrophobicContact CD2-CE 4.34Å; A657-M665 HydrophobicContact CB-CE 3.72Å; A657-M665 HydrophobicContact CB-CG 4.35Å; A657-M665 HydrophobicContact CB-SD 4.08Å; F660-M665 HydrophobicContact CB-CG 3.77Å; F660-M665 HydrophobicContact CB-SD 3.91Å; F660-M665 HydrophobicContact CD2-SD 3.81Å; F660-M665 HydrophobicContact CG-SD 4.19Å; S661-M665 PolarHBondContact O-N 2.88Å; M665-C667 PolarHBondContact O-N 3.43Å; M665-V668 PolarHBondContact O-N 3.26Å; M665-V668 HydrophobicContact SD-CG2 4.38Å; M665-I669 WeakPolarHBondContact O-CB 3.19Å; M665-I669 VanDerWaalsContact O-CD1 3.3Å; M665-I669 WeakPolarHBondContact O-CD1 3.47Å; M665-I669 WeakPolarHBondContact O-CG1 3.15Å; M665-I669 PolarHBondContact O-N 2.78Å; M665-Y694 HydrophobicContact CE-CE2 3.94Å; M665-Y694 HydrophobicContact SD-CE2 3.95Å
666	Q	91.5	Very high	90.6	Very high	98 Å²	98	33.7 Å²	33.7	46%	0.458	18%	0.178	S	C	.	.	H	α-helix	trans	-59	-33.7	169.3	-80	168.9	27.5	0	0	112.4	I628 C662 Q663 A664 S670	I628-Q666 HydrophobicContact CD1-CG 4.05Å; C662-Q666 VanDerWaalsContact O-CB 3.31Å; C662-Q666 WeakPolarHBondContact O-CB 3.26Å; C662-Q666 WeakPolarHBondContact O-CG 3.24Å; C662-Q666 PolarHBondContact O-N 2.94Å; C662-Q666 PolarHBondContact SG-NE2 3.3Å; C662-Q666 VanDerWaalsContact SG-NE2 3.37Å; Q663-Q666 PolarHBondContact O-N 3.06Å; A664-Q666 PolarHBondContact O-N 2.71Å; Q666-S670 VanDerWaalsContact O-CB 3.25Å; Q666-S670 WeakPolarHBondContact O-CB 3.47Å; Q666-S670 PolarHBondContact O-N 3.41Å; Q666-S670 PolarHBondContact O-OG 3.15Å
667	C	92	Very high	90	Very high	10 Å²	10	29.7 Å²	29.7	7%	0.068	16%	0.157	C	C	.	.	H	α-helix	trans	-69	-47.1	175.3	-154.1	0	0	0	0	111.8	Q663 A664 M665 I669 S670 F671 I683 V687	Q663-C667 PolarHBondContact O-N 2.83Å; Q663-C667 VanDerWaalsContact O-N 3.12Å; A664-C667 WeakPolarHBondContact O-CA 3.31Å; A664-C667 WeakPolarHBondContact O-CB 3.35Å; A664-C667 PolarHBondContact O-N 2.83Å; M665-C667 PolarHBondContact O-N 3.43Å; C667-I669 PolarHBondContact O-N 3Å; C667-S670 WeakPolarHBondContact O-CB 3.4Å; C667-S670 PolarHBondContact O-N 3.28Å; C667-F671 WeakPolarHBondContact O-CB 3.33Å; C667-F671 PolarHBondContact O-N 3.34Å; C667-I683 HydrophobicContact CB-CD1 4.25Å; C667-V687 HydrophobicContact CB-CG2 3.79Å
668	V	92.5	Very high	89.6	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58.3	-47.1	174.3	176.7	0	0	0	0	111.2	M642 A664 M665 F671 I672 A690 Y694 M696 L699	M642-V668 HydrophobicContact CE-CG1 4.34Å; M642-V668 HydrophobicContact SD-CG1 4.37Å; A664-V668 PolarHBondContact O-N 3.41Å; M665-V668 PolarHBondContact O-N 3.26Å; M665-V668 HydrophobicContact SD-CG2 4.38Å; V668-F671 WeakPolarHBondContact O-CB 3.33Å; V668-F671 PolarHBondContact O-N 2.83Å; V668-I672 HydrophobicContact CG1-CD1 4.14Å; V668-I672 WeakPolarHBondContact O-CG1 3.48Å; V668-I672 PolarHBondContact O-N 3.01Å; V668-A690 HydrophobicContact CG2-CB 3.84Å; V668-Y694 HydrophobicContact CG1-CD2 4.33Å; V668-M696 HydrophobicContact CG1-CE 3.79Å; V668-M696 HydrophobicContact CG1-SD 4.01Å; V668-L699 HydrophobicContact CB-CD2 4.43Å; V668-L699 HydrophobicContact CG2-CD2 3.99Å
669	I	90.4	Very high	89.5	Confident	3 Å²	3	33.1 Å²	33.1	2%	0.015	18%	0.177	C	C	.	.	H	α-helix	trans	-62.9	-44.3	177.1	-64	160	0	0	0	110.6	L611 I621 I628 F635 M665 C667 F671 I672 Y673	L611-I669 HydrophobicContact CD1-CG2 3.67Å; L611-I669 HydrophobicContact CD2-CG2 3.95Å; L611-I669 HydrophobicContact CG-CG2 4.48Å; I621-I669 HydrophobicContact CD1-CD1 3.51Å; I621-I669 HydrophobicContact CD1-CG1 3.83Å; I628-I669 HydrophobicContact CB-CD1 4.06Å; I628-I669 HydrophobicContact CD1-CD1 3.71Å; I628-I669 HydrophobicContact CG1-CD1 4.49Å; I628-I669 HydrophobicContact CG2-CD1 3.63Å; F635-I669 HydrophobicContact CZ-CG1 4.12Å; M665-I669 WeakPolarHBondContact O-CB 3.19Å; M665-I669 VanDerWaalsContact O-CD1 3.3Å; M665-I669 WeakPolarHBondContact O-CD1 3.47Å; M665-I669 WeakPolarHBondContact O-CG1 3.15Å; M665-I669 PolarHBondContact O-N 2.78Å; C667-I669 PolarHBondContact O-N 3Å; I669-F671 VanDerWaalsContact C-N 3.28Å; I669-F671 PolarHBondContact O-N 2.9Å; I669-I672 PolarHBondContact O-N 3.42Å; I669-Y673 HydrophobicContact CG2-CD2 3.98Å; I669-Y673 HydrophobicContact CG2-CE2 3.88Å; I669-Y673 WeakPolarHBondContact O-CD2 3.45Å; I669-Y673 PolarHBondContact O-N 2.83Å
670	S	88.9	Confident	89.3	Confident	34 Å²	34	34 Å²	34	24%	0.238	18%	0.18	C	C	.	.	H	α-helix	trans	-57.9	-43.4	176	-64.4	0	0	0	0	111.4	Q666 C667 Y673 M674	Q666-S670 VanDerWaalsContact O-CB 3.25Å; Q666-S670 WeakPolarHBondContact O-CB 3.47Å; Q666-S670 PolarHBondContact O-N 3.41Å; Q666-S670 PolarHBondContact O-OG 3.15Å; C667-S670 WeakPolarHBondContact O-CB 3.4Å; C667-S670 PolarHBondContact O-N 3.28Å; S670-Y673 PolarHBondContact O-N 3.01Å; S670-M674 WeakPolarHBondContact O-CB 3.25Å; S670-M674 WeakPolarHBondContact O-CE 3.32Å; S670-M674 PolarHBondContact O-N 3.3Å
671	F	90	Very high	89	Confident	12 Å²	12	37.9 Å²	37.9	5%	0.053	20%	0.2	C	C	.	.	H	α-helix	trans	-63.9	-43.2	175.7	-176.9	-92.6	0	0	0	112.4	C667 V668 I669 Y673 M674 D675 C677 M696 K698 L699 I702	C667-F671 WeakPolarHBondContact O-CB 3.33Å; C667-F671 PolarHBondContact O-N 3.34Å; V668-F671 WeakPolarHBondContact O-CB 3.33Å; V668-F671 PolarHBondContact O-N 2.83Å; I669-F671 VanDerWaalsContact C-N 3.28Å; I669-F671 PolarHBondContact O-N 2.9Å; F671-Y673 PolarHBondContact O-N 2.85Å; F671-M674 PolarHBondContact O-N 2.82Å; F671-D675 VanDerWaalsContact CE2-C 3.41Å; F671-D675 VanDerWaalsContact CE2-O 3.31Å; F671-D675 WeakPolarHBondContact CE2-O 3.33Å; F671-D675 VanDerWaalsContact O-CA 3.26Å; F671-D675 WeakPolarHBondContact O-CA 3.39Å; F671-D675 PolarHBondContact O-N 3.43Å; F671-C677 HydrophobicContact CB-CB 4.33Å; F671-M696 HydrophobicContact CD1-SD 4.17Å; F671-K698 HydrophobicContact CE2-CB 4.34Å; F671-K698 HydrophobicContact CE2-CD 4.06Å; F671-K698 HydrophobicContact CE2-CG 4.07Å; F671-K698 HydrophobicContact CZ-CB 3.81Å; F671-K698 HydrophobicContact CZ-CD 3.89Å; F671-K698 HydrophobicContact CZ-CG 3.97Å; F671-L699 HydrophobicContact CB-CD1 4.02Å; F671-L699 HydrophobicContact CB-CD2 4.21Å; F671-L699 HydrophobicContact CD1-CB 3.89Å; F671-L699 HydrophobicContact CD1-CD2 4.23Å; F671-L699 HydrophobicContact CD1-CG 4.47Å; F671-L699 HydrophobicContact CD2-CB 4.14Å; F671-L699 HydrophobicContact CD2-CD1 3.98Å; F671-L699 HydrophobicContact CE1-CB 4.01Å; F671-L699 HydrophobicContact CE2-CB 4.25Å; F671-L699 HydrophobicContact CG-CB 3.98Å; F671-L699 HydrophobicContact CG-CD1 3.92Å; F671-L699 HydrophobicContact CG-CD2 4.21Å; F671-L699 HydrophobicContact CG-CG 4.26Å; F671-L699 HydrophobicContact CZ-CB 4.22Å; F671-I702 HydrophobicContact CD2-CD1 4.33Å; F671-I702 HydrophobicContact CE2-CD1 4.09Å
672	I	88.9	Confident	88.8	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-57.2	-37	173.6	-73.6	170	0	0	0	112	K634 F635 R638 M642 V668 I669 M696	K634-I672 HydrophobicContact CB-CG2 4.04Å; F635-I672 HydrophobicContact CD1-CD1 3.65Å; F635-I672 HydrophobicContact CE1-CD1 3.28Å; F635-I672 HydrophobicContact CE2-CD1 4.39Å; F635-I672 HydrophobicContact CG-CD1 4.34Å; F635-I672 HydrophobicContact CZ-CD1 3.69Å; R638-I672 HydrophobicContact CB-CG2 4.17Å; R638-I672 WeakPolarHBondContact CG-O 3.47Å; M642-I672 HydrophobicContact SD-CD1 3.78Å; V668-I672 HydrophobicContact CG1-CD1 4.14Å; V668-I672 WeakPolarHBondContact O-CG1 3.48Å; V668-I672 PolarHBondContact O-N 3.01Å; I669-I672 PolarHBondContact O-N 3.42Å; I672-M696 HydrophobicContact CD1-CE 3.94Å; I672-M696 HydrophobicContact CG1-CE 4Å
673	Y	86	Confident	88.8	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-86.6	-19	-175.5	-80.3	-118.7	0	0	0	113.6	F214 F607 L611 H631 K634 I669 S670 F671	F214-Y673 WeakPolarHBondContact CZ-O 3.31Å; F607-Y673 HydrophobicContact CB-CD1 4.2Å; L611-Y673 HydrophobicContact CB-CD1 3.72Å; L611-Y673 HydrophobicContact CB-CE1 3.96Å; L611-Y673 HydrophobicContact CB-CG 4.37Å; L611-Y673 HydrophobicContact CD1-CD1 4.24Å; L611-Y673 HydrophobicContact CD1-CE1 3.96Å; L611-Y673 HydrophobicContact CD1-CE2 4.28Å; L611-Y673 HydrophobicContact CD2-CD1 4.27Å; L611-Y673 HydrophobicContact CD2-CD2 4.45Å; L611-Y673 HydrophobicContact CD2-CG 4.08Å; L611-Y673 HydrophobicContact CG-CD1 4.29Å; L611-Y673 HydrophobicContact CG-CE1 4.44Å; H631-Y673 VanDerWaalsContact CB-OH 3.26Å; H631-Y673 WeakPolarHBondContact CB-OH 3.46Å; H631-Y673 PolarHBondContact N-OH 3.12Å; H631-Y673 AromaticContact ND1-CE1 3.72Å; H631-Y673 AromaticContact ND1-CZ 3.7Å; H631-Y673 PolarHBondContact ND1-OH 3.22Å; K634-Y673 HydrophobicContact CB-CD2 4.31Å; K634-Y673 HydrophobicContact CB-CE1 4.45Å; K634-Y673 HydrophobicContact CB-CE2 3.73Å; K634-Y673 HydrophobicContact CG-CD1 4.38Å; K634-Y673 HydrophobicContact CG-CE1 3.83Å; K634-Y673 HydrophobicContact CG-CE2 4.03Å; I669-Y673 HydrophobicContact CG2-CD2 3.98Å; I669-Y673 HydrophobicContact CG2-CE2 3.88Å; I669-Y673 WeakPolarHBondContact O-CD2 3.45Å; I669-Y673 PolarHBondContact O-N 2.83Å; S670-Y673 PolarHBondContact O-N 3.01Å; F671-Y673 PolarHBondContact O-N 2.85Å
674	M	83	Confident	88.9	Confident	33 Å²	33	38 Å²	38	16%	0.163	20%	0.201	C	C	.	.	H	α-helix	trans	-137.8	-3.3	-168.3	-58.5	-179	-73.6	0	0	115.8	V604 E608 S670 F671 N676	V604-M674 HydrophobicContact CG1-CB 3.73Å; V604-M674 HydrophobicContact CG1-CG 4.05Å; E608-M674 HydrophobicContact CB-CG 4.37Å; E608-M674 HydrophobicContact CB-SD 3.63Å; E608-M674 HydrophobicContact CG-CE 4.46Å; E608-M674 HydrophobicContact CG-SD 3.58Å; E608-M674 VanDerWaalsContact CG-SD 3.58Å; S670-M674 WeakPolarHBondContact O-CB 3.25Å; S670-M674 WeakPolarHBondContact O-CE 3.32Å; S670-M674 PolarHBondContact O-N 3.3Å; F671-M674 PolarHBondContact O-N 2.82Å; M674-N676 PolarHBondContact O-N 3.28Å
675	D	82.1	Confident	88.9	Confident	11 Å²	11	40 Å²	40	6%	0.059	21%	0.21	C	C	.	.	S	Bend	trans	53.9	19.2	-173	-134.7	55.9	0	0	0	115.1	F214 R638 F671 K698	F214-D675 HydrophobicContact CB-CB 4.22Å; F214-D675 HydrophobicContact CD2-CB 3.56Å; F214-D675 HydrophobicContact CE2-CB 4.11Å; F214-D675 HydrophobicContact CG-CB 4.07Å; R638-D675 IonicContact CZ-OD1 3.22Å; R638-D675 IonicContact NE-OD1 2.73Å; R638-D675 IonicContact NH2-OD1 3.47Å; R638-D675 PolarHBondContact NH2-OD1 2.95Å; F671-D675 VanDerWaalsContact CE2-C 3.41Å; F671-D675 VanDerWaalsContact CE2-O 3.31Å; F671-D675 WeakPolarHBondContact CE2-O 3.33Å; F671-D675 VanDerWaalsContact O-CA 3.26Å; F671-D675 WeakPolarHBondContact O-CA 3.39Å; F671-D675 PolarHBondContact O-N 3.43Å; D675-K698 PolarHBondContact O-NZ 2.96Å; D675-K698 WeakPolarHBondContact OD2-CD 3.34Å; D675-K698 IonicContact OD2-NZ 3.57Å; D675-K698 PolarHBondContact OD2-NZ 2.83Å
676	N	80.1	Confident	89	Confident	103 Å²	103	42.7 Å²	42.7	55%	0.551	22%	0.223	S	C	*	.			trans	-153.7	146.9	-174.6	-173.3	14.1	0	0	0	109.5	M674	M674-N676 PolarHBondContact O-N 3.28Å
677	C	80.3	Confident	89.2	Confident	13 Å²	13	38 Å²	38	9%	0.088	20%	0.201	C	C	.	.			trans	-155.2	149.5	172.8	63.1	0	0	0	0	109.9	F671 L699	F671-C677 HydrophobicContact CB-CB 4.33Å; C677-L699 WeakPolarHBondContact SG-CD1 3.43Å
678	T	84	Confident	89.4	Confident	131 Å²	131	37.6 Å²	37.6	80%	0.804	20%	0.198	S	C	*	.			trans	-95.7	111.8	166	-57.8	0	0	0	0	107.9
679	I	89.5	Confident	89.6	Confident	10 Å²	10	41.5 Å²	41.5	5%	0.051	21%	0.213	C	C	.	.			trans	-84.8	128.2	177.7	-58.1	178.9	0	0	0	107.8	I683 A684 V687 L699 I702 A703	I679-I683 HydrophobicContact CG2-CG1 4.38Å; I679-A684 HydrophobicContact CG2-CB 3.71Å; I679-V687 HydrophobicContact CD1-CB 4.4Å; I679-V687 HydrophobicContact CD1-CG1 3.67Å; I679-V687 HydrophobicContact CG1-CG1 4.21Å; I679-V687 HydrophobicContact CG2-CB 4.45Å; I679-V687 HydrophobicContact CG2-CG2 4.48Å; I679-L699 HydrophobicContact CD1-CD1 4.23Å; I679-I702 HydrophobicContact CD1-CB 4.14Å; I679-I702 HydrophobicContact CD1-CG2 3.69Å; I679-I702 HydrophobicContact CG1-CG2 4.12Å; I679-A703 VanDerWaalsContact CD1-CA 3.48Å; I679-A703 HydrophobicContact CD1-CB 3.67Å
680	K	89.4	Confident	89.7	Confident	125 Å²	125	41.4 Å²	41.4	54%	0.543	21%	0.212	S	C	.	.			trans	-84.5	150.4	169.1	-61.5	177.7	-178.2	174.7	0	109.7	D682 I683 A684	K680-D682 VanDerWaalsContact C-N 3.32Å; K680-D682 WeakPolarHBondContact CB-OD1 3.2Å; K680-D682 PolarHBondContact O-N 3.24Å; K680-I683 HydrophobicContact CB-CG1 4.22Å; K680-I683 WeakPolarHBondContact O-CG1 3.38Å; K680-I683 PolarHBondContact O-N 3.31Å; K680-A684 PolarHBondContact O-N 2.92Å; K680-A684 VanDerWaalsContact O-N 3.14Å
681	L	89.1	Confident	90	Very high	87 Å²	87	39.8 Å²	39.8	46%	0.455	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-36.6	-174.6	177.7	55.2	0	0	0	113.8	I683 A684 S710	L681-I683 VanDerWaalsContact C-N 3.34Å; L681-I683 PolarHBondContact O-N 2.73Å; L681-A684 PolarHBondContact O-N 3.03Å; L681-S710 WeakPolarHBondContact CD1-OG 3.48Å
682	D	91.3	Very high	90.1	Very high	113 Å²	113	42.7 Å²	42.7	60%	0.604	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-39.5	178.5	51	-7.9	0	0	0	112.9	K680	K680-D682 VanDerWaalsContact C-N 3.32Å; K680-D682 WeakPolarHBondContact CB-OD1 3.2Å; K680-D682 PolarHBondContact O-N 3.24Å
683	I	93.9	Very high	90.2	Very high	13 Å²	13	47 Å²	47	7%	0.067	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-4.4	179.4	66	173	0	0	0	114.2	Q663 C667 I679 K680 L681 E685 E686 V687	Q663-I683 HydrophobicContact CB-CD1 4.5Å; Q663-I683 HydrophobicContact CB-CG2 3.78Å; C667-I683 HydrophobicContact CB-CD1 4.25Å; I679-I683 HydrophobicContact CG2-CG1 4.38Å; K680-I683 HydrophobicContact CB-CG1 4.22Å; K680-I683 WeakPolarHBondContact O-CG1 3.38Å; K680-I683 PolarHBondContact O-N 3.31Å; L681-I683 VanDerWaalsContact C-N 3.34Å; L681-I683 PolarHBondContact O-N 2.73Å; I683-E685 VanDerWaalsContact C-N 3.25Å; I683-E685 PolarHBondContact O-N 3.09Å; I683-E685 VanDerWaalsContact O-N 3.17Å; I683-E686 PolarHBondContact O-N 3.34Å; I683-E686 VanDerWaalsContact O-N 3.12Å; I683-V687 HydrophobicContact CB-CG2 4.42Å; I683-V687 HydrophobicContact CD1-CG2 4.08Å; I683-V687 HydrophobicContact CG1-CG2 4.13Å; I683-V687 WeakPolarHBondContact O-CG2 3.26Å; I683-V687 PolarHBondContact O-N 3.31Å
684	A	94.4	Very high	90.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.6	-31.1	-167.3	0	0	0	0	0	113.7	I679 K680 L681 L688 L707	I679-A684 HydrophobicContact CG2-CB 3.71Å; K680-A684 PolarHBondContact O-N 2.92Å; K680-A684 VanDerWaalsContact O-N 3.14Å; L681-A684 PolarHBondContact O-N 3.03Å; A684-L688 WeakPolarHBondContact O-CB 3.32Å; A684-L688 PolarHBondContact O-N 2.6Å; A684-L707 HydrophobicContact CB-CD2 3.56Å; A684-L707 HydrophobicContact CB-CG 3.96Å
685	E	95.4	Very high	90.7	Very high	41 Å²	41	50.8 Å²	50.8	19%	0.192	26%	0.258	C	S	.	.	H	α-helix	trans	-72.9	-40.5	176.3	-57.8	-163.3	-178.6	0	0	112.8	I683 L688 R689 L707 R719 L722	I683-E685 VanDerWaalsContact C-N 3.25Å; I683-E685 PolarHBondContact O-N 3.09Å; I683-E685 VanDerWaalsContact O-N 3.17Å; E685-L688 PolarHBondContact O-N 2.82Å; E685-R689 WeakPolarHBondContact O-CG 3.42Å; E685-R689 PolarHBondContact O-N 2.71Å; E685-R689 VanDerWaalsContact O-N 3.08Å; E685-R689 IonicContact OE2-CZ 3.11Å; E685-R689 IonicContact OE2-NH2 2.61Å; E685-R689 PolarHBondContact OE2-NH2 3.28Å; E685-L707 HydrophobicContact CG-CD2 3.76Å; E685-R719 IonicContact OE1-CZ 3.6Å; E685-R719 IonicContact OE1-NE 2.69Å; E685-R719 PolarHBondContact OE1-NE 3.45Å; E685-R719 IonicContact OE1-NH2 3.59Å; E685-L722 HydrophobicContact CB-CD2 3.77Å; E685-L722 HydrophobicContact CG-CD2 3.59Å
686	E	95.6	Very high	91	Very high	58 Å²	58	50.9 Å²	50.9	27%	0.271	26%	0.259	S	S	.	.	H	α-helix	trans	-64.8	-43.7	174.4	-71.8	-179.9	-136.1	0	0	111.1	F660 S661 A664 I683 L688 R689 A690	F660-E686 HydrophobicContact CD1-CB 4.48Å; S661-E686 WeakPolarHBondContact CB-OE2 3.44Å; S661-E686 PolarHBondContact N-OE2 2.75Å; S661-E686 PolarHBondContact OG-OE2 2.93Å; A664-E686 HydrophobicContact CB-CB 3.63Å; A664-E686 WeakPolarHBondContact CB-OE2 3.44Å; I683-E686 PolarHBondContact O-N 3.34Å; I683-E686 VanDerWaalsContact O-N 3.12Å; E686-L688 VanDerWaalsContact C-N 3.28Å; E686-L688 PolarHBondContact O-N 3.32Å; E686-R689 PolarHBondContact O-N 3.18Å; E686-A690 WeakPolarHBondContact O-CB 3.48Å; E686-A690 PolarHBondContact O-N 3.42Å
687	V	96.1	Very high	91.4	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63.9	-34.3	176.5	-179.8	0	0	0	0	111.3	A664 C667 I679 I683 A691 L699 A703	A664-V687 HydrophobicContact CB-CG2 4.07Å; C667-V687 HydrophobicContact CB-CG2 3.79Å; I679-V687 HydrophobicContact CD1-CB 4.4Å; I679-V687 HydrophobicContact CD1-CG1 3.67Å; I679-V687 HydrophobicContact CG1-CG1 4.21Å; I679-V687 HydrophobicContact CG2-CB 4.45Å; I679-V687 HydrophobicContact CG2-CG2 4.48Å; I683-V687 HydrophobicContact CB-CG2 4.42Å; I683-V687 HydrophobicContact CD1-CG2 4.08Å; I683-V687 HydrophobicContact CG1-CG2 4.13Å; I683-V687 WeakPolarHBondContact O-CG2 3.26Å; I683-V687 PolarHBondContact O-N 3.31Å; V687-A691 WeakPolarHBondContact O-CB 3.49Å; V687-A691 PolarHBondContact O-N 3.47Å; V687-L699 HydrophobicContact CG1-CD1 3.91Å; V687-L699 HydrophobicContact CG1-CD2 4.27Å; V687-L699 HydrophobicContact CG1-CG 4.09Å; V687-A703 HydrophobicContact CG1-CB 4.39Å
688	L	96.3	Very high	91.7	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65.7	-42.7	173.5	-177.3	63.6	0	0	0	112.3	A684 E685 E686 H692 K700 A703 E704 L707 L722 T726 L731	A684-L688 WeakPolarHBondContact O-CB 3.32Å; A684-L688 PolarHBondContact O-N 2.6Å; E685-L688 PolarHBondContact O-N 2.82Å; E686-L688 VanDerWaalsContact C-N 3.28Å; E686-L688 PolarHBondContact O-N 3.32Å; L688-H692 PolarHBondContact O-N 3.26Å; L688-K700 HydrophobicContact CD1-CB 4.45Å; L688-K700 HydrophobicContact CD1-CG 3.51Å; L688-A703 HydrophobicContact CB-CB 3.86Å; L688-A703 HydrophobicContact CD1-CB 4.03Å; L688-E704 HydrophobicContact CD1-CG 3.64Å; L688-L707 HydrophobicContact CB-CD1 3.77Å; L688-L707 HydrophobicContact CD2-CD1 3.45Å; L688-L707 VanDerWaalsContact CD2-CD1 3.45Å; L688-L707 HydrophobicContact CG-CD1 4.13Å; L688-L722 HydrophobicContact CD2-CD1 4.2Å; L688-L722 HydrophobicContact CD2-CD2 3.95Å; L688-L722 HydrophobicContact CD2-CG 3.86Å; L688-T726 HydrophobicContact CD2-CG2 4.32Å; L688-T726 HydrophobicContact CG-CG2 4.17Å; L688-L731 HydrophobicContact CD2-CD2 4.08Å
689	R	96	Very high	92.1	Very high	83 Å²	83	46.6 Å²	46.6	31%	0.313	23%	0.231	S	C	.	.	H	α-helix	trans	-63.3	-52.6	176.1	-67.7	176.3	-163.8	104.2	6.9	110.6	F660 E685 E686 A691 H692 D693 L722 T726	F660-R689 HydrophobicContact CE1-CB 3.8Å; F660-R689 HydrophobicContact CZ-CB 4.32Å; E685-R689 WeakPolarHBondContact O-CG 3.42Å; E685-R689 PolarHBondContact O-N 2.71Å; E685-R689 VanDerWaalsContact O-N 3.08Å; E685-R689 IonicContact OE2-CZ 3.11Å; E685-R689 IonicContact OE2-NH2 2.61Å; E685-R689 PolarHBondContact OE2-NH2 3.28Å; E686-R689 PolarHBondContact O-N 3.18Å; R689-A691 VanDerWaalsContact C-N 3.3Å; R689-A691 PolarHBondContact O-N 3.01Å; R689-H692 WeakPolarHBondContact O-CA 3.31Å; R689-H692 WeakPolarHBondContact O-CB 3.28Å; R689-H692 PolarHBondContact O-N 2.89Å; R689-D693 VanDerWaalsContact O-CG 3.26Å; R689-D693 PolarHBondContact O-N 2.86Å; R689-L722 HydrophobicContact CG-CD1 3.87Å; R689-T726 HydrophobicContact CG-CG2 4.18Å
690	A	94.4	Very high	92.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-57.5	-39.9	177	0	0	0	0	0	113.1	F660 V668 E686 H692 D693 Y694	F660-A690 HydrophobicContact CD1-CB 4.06Å; F660-A690 HydrophobicContact CD2-CB 3.9Å; F660-A690 HydrophobicContact CE1-CB 3.83Å; F660-A690 HydrophobicContact CE2-CB 3.64Å; F660-A690 HydrophobicContact CG-CB 4.12Å; F660-A690 HydrophobicContact CZ-CB 3.62Å; V668-A690 HydrophobicContact CG2-CB 3.84Å; E686-A690 WeakPolarHBondContact O-CB 3.48Å; E686-A690 PolarHBondContact O-N 3.42Å; A690-H692 VanDerWaalsContact C-N 3.3Å; A690-H692 PolarHBondContact O-N 2.96Å; A690-D693 PolarHBondContact O-N 3.3Å; A690-Y694 HydrophobicContact CB-CD2 4.22Å; A690-Y694 HydrophobicContact CB-CE2 4.09Å; A690-Y694 WeakPolarHBondContact O-CB 3.46Å; A690-Y694 WeakPolarHBondContact O-CD2 3.47Å; A690-Y694 PolarHBondContact O-N 2.95Å
691	A	93.4	Very high	92.4	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-71.3	-23.3	176.2	0	0	0	0	0	113.7	V687 R689 M696 L699 K700	V687-A691 WeakPolarHBondContact O-CB 3.49Å; V687-A691 PolarHBondContact O-N 3.47Å; R689-A691 VanDerWaalsContact C-N 3.3Å; R689-A691 PolarHBondContact O-N 3.01Å; A691-M696 HydrophobicContact CB-CB 4.38Å; A691-M696 PolarHBondContact O-N 3.44Å; A691-L699 HydrophobicContact CB-CB 3.97Å; A691-L699 HydrophobicContact CB-CD2 3.93Å; A691-L699 HydrophobicContact CB-CG 3.74Å; A691-K700 HydrophobicContact CB-CB 3.94Å
692	H	92.9	Very high	92.5	Very high	73 Å²	73	46.5 Å²	46.5	34%	0.338	23%	0.225	S	C	.	.	H	α-helix	trans	-75.8	-52	170	-179	31.8	0	0	0	110.9	L688 R689 A690 Y694 N695 T726	L688-H692 PolarHBondContact O-N 3.26Å; R689-H692 WeakPolarHBondContact O-CA 3.31Å; R689-H692 WeakPolarHBondContact O-CB 3.28Å; R689-H692 PolarHBondContact O-N 2.89Å; A690-H692 VanDerWaalsContact C-N 3.3Å; A690-H692 PolarHBondContact O-N 2.96Å; H692-Y694 PolarHBondContact O-N 3.38Å; H692-N695 WeakPolarHBondContact O-CA 3.45Å; H692-N695 PolarHBondContact O-N 2.88Å; H692-T726 HydrophobicContact CB-CG2 4.39Å
693	D	91.9	Very high	92.6	Very high	91 Å²	91	41.1 Å²	41.1	49%	0.487	20%	0.196	S	C	.	.	H	α-helix	trans	-67.1	-39.1	-172	-60.8	-14	0	0	0	111.7	F660 R689 A690 N695	F660-D693 WeakPolarHBondContact CZ-OD2 3.48Å; R689-D693 VanDerWaalsContact O-CG 3.26Å; R689-D693 PolarHBondContact O-N 2.86Å; A690-D693 PolarHBondContact O-N 3.3Å; D693-N695 VanDerWaalsContact C-N 3.29Å; D693-N695 PolarHBondContact O-N 3.43Å
694	Y	90	Very high	92.6	Very high	8 Å²	8	41.1 Å²	41.1	3%	0.031	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	7.9	174.4	-51.9	-38.3	0	0	0	113.8	M642 L645 A657 E659 F660 M665 V668 A690 H692	M642-Y694 HydrophobicContact CE-CD1 4.25Å; M642-Y694 HydrophobicContact CE-CD2 3.54Å; M642-Y694 HydrophobicContact CE-CE1 4.34Å; M642-Y694 HydrophobicContact CE-CE2 3.62Å; M642-Y694 HydrophobicContact CE-CG 3.88Å; M642-Y694 HydrophobicContact CG-CD1 4.1Å; M642-Y694 HydrophobicContact CG-CD2 4.43Å; M642-Y694 HydrophobicContact CG-CG 3.86Å; M642-Y694 HydrophobicContact SD-CD2 4.05Å; M642-Y694 HydrophobicContact SD-CG 4.06Å; L645-Y694 HydrophobicContact CD1-CD1 4.16Å; L645-Y694 HydrophobicContact CD1-CE1 3.97Å; A657-Y694 VanDerWaalsContact CB-OH 3.3Å; A657-Y694 WeakPolarHBondContact CB-OH 3.46Å; E659-Y694 PolarHBondContact OE1-OH 3.48Å; F660-Y694 HydrophobicContact CD2-CE2 4.09Å; F660-Y694 WeakPolarHBondContact CD2-OH 3.45Å; F660-Y694 AromaticContact CE2-CE2 3.86Å; F660-Y694 HydrophobicContact CE2-CE2 3.86Å; F660-Y694 AromaticContact CE2-CZ 3.67Å; F660-Y694 WeakPolarHBondContact CE2-OH 3.18Å; M665-Y694 HydrophobicContact CE-CE2 3.94Å; M665-Y694 HydrophobicContact SD-CE2 3.95Å; V668-Y694 HydrophobicContact CG1-CD2 4.33Å; A690-Y694 HydrophobicContact CB-CD2 4.22Å; A690-Y694 HydrophobicContact CB-CE2 4.09Å; A690-Y694 WeakPolarHBondContact O-CB 3.46Å; A690-Y694 WeakPolarHBondContact O-CD2 3.47Å; A690-Y694 PolarHBondContact O-N 2.95Å; H692-Y694 PolarHBondContact O-N 3.38Å
695	N	88	Confident	92.5	Very high	105 Å²	105	46.2 Å²	46.2	56%	0.561	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.9	68.3	-178.6	-170.7	26	0	0	0	113.7	L641 H692 D693 P697	L641-N695 HydrophobicContact CD1-CB 3.38Å; L641-N695 HydrophobicContact CG-CB 4.25Å; H692-N695 WeakPolarHBondContact O-CA 3.45Å; H692-N695 PolarHBondContact O-N 2.88Å; D693-N695 VanDerWaalsContact C-N 3.29Å; D693-N695 PolarHBondContact O-N 3.43Å; N695-P697 WeakPolarHBondContact O-CD 3.36Å
696	M	88.7	Confident	92.4	Very high	13 Å²	13	46.8 Å²	46.8	6%	0.064	22%	0.221	C	C	.	.			trans	-116.1	80.5	176.8	-62.3	-172.5	-177.8	0	0	110.8	M642 V668 F671 I672 A691 K698 L699 K700	M642-M696 HydrophobicContact CG-CE 4.25Å; M642-M696 HydrophobicContact SD-CE 3.28Å; M642-M696 WeakPolarHBondContact SD-CE 3.43Å; V668-M696 HydrophobicContact CG1-CE 3.79Å; V668-M696 HydrophobicContact CG1-SD 4.01Å; F671-M696 HydrophobicContact CD1-SD 4.17Å; I672-M696 HydrophobicContact CD1-CE 3.94Å; I672-M696 HydrophobicContact CG1-CE 4Å; A691-M696 HydrophobicContact CB-CB 4.38Å; A691-M696 PolarHBondContact O-N 3.44Å; M696-K698 VanDerWaalsContact C-N 3.32Å; M696-K698 PolarHBondContact O-N 3.42Å; M696-L699 HydrophobicContact CB-CB 3.86Å; M696-L699 PolarHBondContact O-N 2.96Å; M696-L699 VanDerWaalsContact O-N 3.11Å; M696-L699 HydrophobicContact SD-CD2 3.82Å; M696-K700 WeakPolarHBondContact O-CB 3.43Å; M696-K700 PolarHBondContact O-N 3.41Å
697	P	88	Confident	92.4	Very high	89 Å²	89	44 Å²	44	58%	0.578	21%	0.208	S	C	*	.	H	α-helix	trans	-55.9	-39.9	-170.8	-27.8	35.3	0	0	0	114.5	N695 K700 R701	N695-P697 WeakPolarHBondContact O-CD 3.36Å; P697-K700 WeakPolarHBondContact O-CB 3.43Å; P697-K700 PolarHBondContact O-N 3.08Å; P697-R701 WeakPolarHBondContact O-CB 3.22Å; P697-R701 PolarHBondContact O-N 2.98Å
698	K	88.2	Confident	92.2	Very high	68 Å²	68	46.2 Å²	46.2	30%	0.296	22%	0.221	S	C	.	.	H	α-helix	trans	-67.1	-44.3	178.3	-172.7	-177.4	-170	-157.8	0	111.9	F671 D675 M696 R701 I702	F671-K698 HydrophobicContact CE2-CB 4.34Å; F671-K698 HydrophobicContact CE2-CD 4.06Å; F671-K698 HydrophobicContact CE2-CG 4.07Å; F671-K698 HydrophobicContact CZ-CB 3.81Å; F671-K698 HydrophobicContact CZ-CD 3.89Å; F671-K698 HydrophobicContact CZ-CG 3.97Å; D675-K698 PolarHBondContact O-NZ 2.96Å; D675-K698 WeakPolarHBondContact OD2-CD 3.34Å; D675-K698 IonicContact OD2-NZ 3.57Å; D675-K698 PolarHBondContact OD2-NZ 2.83Å; M696-K698 VanDerWaalsContact C-N 3.32Å; M696-K698 PolarHBondContact O-N 3.42Å; K698-R701 PolarHBondContact O-N 2.97Å; K698-I702 WeakPolarHBondContact O-CG1 3.36Å; K698-I702 PolarHBondContact O-N 3.4Å; K698-I702 VanDerWaalsContact O-N 3.09Å
699	L	91.9	Very high	92	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.4	-43.8	174.6	-178	59.6	0	0	0	111.4	V668 F671 C677 I679 V687 A691 M696 R701 I702 A703	V668-L699 HydrophobicContact CB-CD2 4.43Å; V668-L699 HydrophobicContact CG2-CD2 3.99Å; F671-L699 HydrophobicContact CB-CD1 4.02Å; F671-L699 HydrophobicContact CB-CD2 4.21Å; F671-L699 HydrophobicContact CD1-CB 3.89Å; F671-L699 HydrophobicContact CD1-CD2 4.23Å; F671-L699 HydrophobicContact CD1-CG 4.47Å; F671-L699 HydrophobicContact CD2-CB 4.14Å; F671-L699 HydrophobicContact CD2-CD1 3.98Å; F671-L699 HydrophobicContact CE1-CB 4.01Å; F671-L699 HydrophobicContact CE2-CB 4.25Å; F671-L699 HydrophobicContact CG-CB 3.98Å; F671-L699 HydrophobicContact CG-CD1 3.92Å; F671-L699 HydrophobicContact CG-CD2 4.21Å; F671-L699 HydrophobicContact CG-CG 4.26Å; F671-L699 HydrophobicContact CZ-CB 4.22Å; C677-L699 WeakPolarHBondContact SG-CD1 3.43Å; I679-L699 HydrophobicContact CD1-CD1 4.23Å; V687-L699 HydrophobicContact CG1-CD1 3.91Å; V687-L699 HydrophobicContact CG1-CD2 4.27Å; V687-L699 HydrophobicContact CG1-CG 4.09Å; A691-L699 HydrophobicContact CB-CB 3.97Å; A691-L699 HydrophobicContact CB-CD2 3.93Å; A691-L699 HydrophobicContact CB-CG 3.74Å; M696-L699 HydrophobicContact CB-CB 3.86Å; M696-L699 PolarHBondContact O-N 2.96Å; M696-L699 VanDerWaalsContact O-N 3.11Å; M696-L699 HydrophobicContact SD-CD2 3.82Å; L699-R701 VanDerWaalsContact C-N 3.29Å; L699-R701 PolarHBondContact O-N 2.85Å; L699-I702 PolarHBondContact O-N 2.86Å; L699-A703 PolarHBondContact O-N 3.11Å
700	K	93	Very high	91.8	Very high	35 Å²	35	52 Å²	52	15%	0.152	25%	0.246	C	C	.	.	H	α-helix	trans	-53	-49.9	174.7	-168	-174.5	-180	170.4	0	109.8	L688 A691 M696 P697 I702 A703 E704 T726	L688-K700 HydrophobicContact CD1-CB 4.45Å; L688-K700 HydrophobicContact CD1-CG 3.51Å; A691-K700 HydrophobicContact CB-CB 3.94Å; M696-K700 WeakPolarHBondContact O-CB 3.43Å; M696-K700 PolarHBondContact O-N 3.41Å; P697-K700 WeakPolarHBondContact O-CB 3.43Å; P697-K700 PolarHBondContact O-N 3.08Å; K700-I702 VanDerWaalsContact C-N 3.33Å; K700-I702 PolarHBondContact O-N 2.66Å; K700-A703 PolarHBondContact O-N 3.42Å; K700-E704 WeakPolarHBondContact CE-OE1 3.34Å; K700-E704 HydrophobicContact CG-CG 4.49Å; K700-E704 VanDerWaalsContact O-CG 3.22Å; K700-E704 WeakPolarHBondContact O-CG 3.28Å; K700-E704 PolarHBondContact O-N 3.01Å; K700-T726 PolarHBondContact NZ-O 3.43Å
701	R	91.1	Very high	91.6	Very high	139 Å²	139	52.7 Å²	52.7	53%	0.525	25%	0.249	S	C	.	.	H	α-helix	trans	-65.1	-28.3	178.7	-165.5	176.1	-174.9	-173.7	2.1	114.4	P697 K698 L699 E704 K705	P697-R701 WeakPolarHBondContact O-CB 3.22Å; P697-R701 PolarHBondContact O-N 2.98Å; K698-R701 PolarHBondContact O-N 2.97Å; L699-R701 VanDerWaalsContact C-N 3.29Å; L699-R701 PolarHBondContact O-N 2.85Å; R701-E704 WeakPolarHBondContact CA-OE2 3.35Å; R701-K705 VanDerWaalsContact O-CG 3.29Å; R701-K705 WeakPolarHBondContact O-CG 3.28Å; R701-K705 PolarHBondContact O-N 2.71Å
702	I	91.6	Very high	91.4	Very high	47 Å²	47	55.7 Å²	55.7	24%	0.241	27%	0.265	C	S	.	.	H	α-helix	trans	-71.7	-46.7	172.4	-62.9	163.5	0	0	0	109.4	F671 I679 K698 L699 K700 K705 E706	F671-I702 HydrophobicContact CD2-CD1 4.33Å; F671-I702 HydrophobicContact CE2-CD1 4.09Å; I679-I702 HydrophobicContact CD1-CB 4.14Å; I679-I702 HydrophobicContact CD1-CG2 3.69Å; I679-I702 HydrophobicContact CG1-CG2 4.12Å; K698-I702 WeakPolarHBondContact O-CG1 3.36Å; K698-I702 PolarHBondContact O-N 3.4Å; K698-I702 VanDerWaalsContact O-N 3.09Å; L699-I702 PolarHBondContact O-N 2.86Å; K700-I702 VanDerWaalsContact C-N 3.33Å; K700-I702 PolarHBondContact O-N 2.66Å; I702-K705 PolarHBondContact O-N 3.11Å; I702-E706 PolarHBondContact O-N 3.13Å
703	A	94	Very high	91	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.1	-46.6	177	0	0	0	0	0	111.8	I679 V687 L688 L699 K700 K705 E706 L707	I679-A703 VanDerWaalsContact CD1-CA 3.48Å; I679-A703 HydrophobicContact CD1-CB 3.67Å; V687-A703 HydrophobicContact CG1-CB 4.39Å; L688-A703 HydrophobicContact CB-CB 3.86Å; L688-A703 HydrophobicContact CD1-CB 4.03Å; L699-A703 PolarHBondContact O-N 3.11Å; K700-A703 PolarHBondContact O-N 3.42Å; A703-K705 VanDerWaalsContact C-N 3.32Å; A703-K705 PolarHBondContact O-N 3.06Å; A703-E706 PolarHBondContact O-N 3.12Å; A703-E706 VanDerWaalsContact O-N 3.14Å; A703-L707 WeakPolarHBondContact O-CB 3.33Å; A703-L707 VanDerWaalsContact O-CG 3.23Å; A703-L707 WeakPolarHBondContact O-CG 3.47Å; A703-L707 PolarHBondContact O-N 3.48Å
704	E	94	Very high	90.8	Very high	13 Å²	13	59.8 Å²	59.8	6%	0.061	29%	0.286	C	S	.	.	H	α-helix	trans	-53.6	-46	174.9	-71.3	171.7	157	0	0	112.3	L688 K700 R701 E706 L707 V708 S728 V730	L688-E704 HydrophobicContact CD1-CG 3.64Å; K700-E704 WeakPolarHBondContact CE-OE1 3.34Å; K700-E704 HydrophobicContact CG-CG 4.49Å; K700-E704 VanDerWaalsContact O-CG 3.22Å; K700-E704 WeakPolarHBondContact O-CG 3.28Å; K700-E704 PolarHBondContact O-N 3.01Å; R701-E704 WeakPolarHBondContact CA-OE2 3.35Å; E704-E706 VanDerWaalsContact C-N 3.34Å; E704-E706 PolarHBondContact O-N 3.36Å; E704-L707 PolarHBondContact O-N 3.21Å; E704-V708 WeakPolarHBondContact O-CB 3.43Å; E704-V708 VanDerWaalsContact O-CG2 3.25Å; E704-V708 WeakPolarHBondContact O-CG2 3.3Å; E704-V708 PolarHBondContact O-N 3.43Å; E704-S728 VanDerWaalsContact CG-OG 3.29Å; E704-S728 WeakPolarHBondContact CG-OG 3.44Å; E704-S728 VanDerWaalsContact OE1-CB 3.28Å; E704-S728 WeakPolarHBondContact OE1-CB 3.22Å; E704-S728 PolarHBondContact OE1-OG 3.25Å; E704-V730 HydrophobicContact CB-CB 4.06Å; E704-V730 HydrophobicContact CB-CG1 3.96Å; E704-V730 HydrophobicContact CG-CB 4.3Å; E704-V730 WeakPolarHBondContact OE2-CB 3.45Å; E704-V730 VanDerWaalsContact OE2-CG2 3.3Å; E704-V730 WeakPolarHBondContact OE2-CG2 3.42Å
705	K	92.4	Very high	90.8	Very high	106 Å²	106	60.3 Å²	60.3	46%	0.461	29%	0.289	S	S	.	.	H	α-helix	trans	-63	-39.5	178.9	-77	172.3	-179.7	178.5	0	112.5	R701 I702 A703 V708 R709	R701-K705 VanDerWaalsContact O-CG 3.29Å; R701-K705 WeakPolarHBondContact O-CG 3.28Å; R701-K705 PolarHBondContact O-N 2.71Å; I702-K705 PolarHBondContact O-N 3.11Å; A703-K705 VanDerWaalsContact C-N 3.32Å; A703-K705 PolarHBondContact O-N 3.06Å; K705-V708 PolarHBondContact O-N 2.85Å; K705-R709 WeakPolarHBondContact O-CG 3.38Å; K705-R709 PolarHBondContact O-N 3.27Å
706	E	93.5	Very high	90.9	Very high	54 Å²	54	55.3 Å²	55.3	25%	0.252	26%	0.263	S	S	.	.	H	α-helix	trans	-74.1	-35.9	-179.7	-155.6	56.2	-150.3	0	0	112	I702 A703 E704 R709 S710	I702-E706 PolarHBondContact O-N 3.13Å; A703-E706 PolarHBondContact O-N 3.12Å; A703-E706 VanDerWaalsContact O-N 3.14Å; E704-E706 VanDerWaalsContact C-N 3.34Å; E704-E706 PolarHBondContact O-N 3.36Å; E706-R709 PolarHBondContact O-N 3.11Å; E706-R709 WeakPolarHBondContact OE2-CD 3.47Å; E706-R709 IonicContact OE2-CZ 2.91Å; E706-R709 IonicContact OE2-NH1 3.93Å; E706-R709 PolarHBondContact OE2-NH1 3.36Å; E706-S710 PolarHBondContact O-N 2.56Å; E706-S710 PolarHBondContact O-OG 3Å
707	L	94.6	Very high	90.8	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-66.6	-34.3	171.9	-66.5	167.8	0	0	0	112.5	A684 E685 L688 A703 E704 S710 R719 L722 L731	A684-L707 HydrophobicContact CB-CD2 3.56Å; A684-L707 HydrophobicContact CB-CG 3.96Å; E685-L707 HydrophobicContact CG-CD2 3.76Å; L688-L707 HydrophobicContact CB-CD1 3.77Å; L688-L707 HydrophobicContact CD2-CD1 3.45Å; L688-L707 VanDerWaalsContact CD2-CD1 3.45Å; L688-L707 HydrophobicContact CG-CD1 4.13Å; A703-L707 WeakPolarHBondContact O-CB 3.33Å; A703-L707 VanDerWaalsContact O-CG 3.23Å; A703-L707 WeakPolarHBondContact O-CG 3.47Å; A703-L707 PolarHBondContact O-N 3.48Å; E704-L707 PolarHBondContact O-N 3.21Å; L707-S710 WeakPolarHBondContact CA-OG 3.24Å; L707-S710 PolarHBondContact O-OG 3.32Å; L707-S710 VanDerWaalsContact O-OG 3.11Å; L707-R719 PolarHBondContact O-NH1 3.34Å; L707-L722 HydrophobicContact CD1-CD2 3.87Å; L707-L722 HydrophobicContact CD2-CD2 4.47Å; L707-L731 HydrophobicContact CB-CD1 3.84Å; L707-L731 HydrophobicContact CB-CD2 4.42Å; L707-L731 HydrophobicContact CD1-CD2 4.28Å
708	V	92.8	Very high	90.9	Very high	46 Å²	46	56.4 Å²	56.4	28%	0.279	27%	0.268	S	S	.	.	H	α-helix	trans	-72.5	-38.4	174.5	169	0	0	0	0	112.2	E704 K705 S710 L711 L731	E704-V708 WeakPolarHBondContact O-CB 3.43Å; E704-V708 VanDerWaalsContact O-CG2 3.25Å; E704-V708 WeakPolarHBondContact O-CG2 3.3Å; E704-V708 PolarHBondContact O-N 3.43Å; K705-V708 PolarHBondContact O-N 2.85Å; V708-S710 PolarHBondContact O-N 2.87Å; V708-L711 HydrophobicContact CG1-CD1 4.35Å; V708-L711 WeakPolarHBondContact O-CG 3.3Å; V708-L711 PolarHBondContact O-N 2.69Å; V708-L731 HydrophobicContact CG2-CD1 3.71Å
709	R	91.7	Very high	91.1	Very high	187 Å²	187	53.9 Å²	53.9	71%	0.706	26%	0.256	S	S	*	.	H	α-helix	trans	-63.7	-26	176.2	-79.3	169.9	177.1	155.7	-3.2	113.9	K705 E706	K705-R709 WeakPolarHBondContact O-CG 3.38Å; K705-R709 PolarHBondContact O-N 3.27Å; E706-R709 PolarHBondContact O-N 3.11Å; E706-R709 WeakPolarHBondContact OE2-CD 3.47Å; E706-R709 IonicContact OE2-CZ 2.91Å; E706-R709 IonicContact OE2-NH1 3.93Å; E706-R709 PolarHBondContact OE2-NH1 3.36Å
710	S	91.7	Very high	91	Very high	18 Å²	18	54.7 Å²	54.7	13%	0.126	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	10.5	-175.2	51.8	0	0	0	0	113.7	L681 E706 L707 V708 D712 N715 R719	L681-S710 WeakPolarHBondContact CD1-OG 3.48Å; E706-S710 PolarHBondContact O-N 2.56Å; E706-S710 PolarHBondContact O-OG 3Å; L707-S710 WeakPolarHBondContact CA-OG 3.24Å; L707-S710 PolarHBondContact O-OG 3.32Å; L707-S710 VanDerWaalsContact O-OG 3.11Å; V708-S710 PolarHBondContact O-N 2.87Å; S710-D712 PolarHBondContact O-N 3.46Å; S710-N715 PolarHBondContact O-ND2 2.69Å; S710-R719 PolarHBondContact OG-NH1 3.47Å
711	L	91.2	Very high	90.9	Very high	14 Å²	14	59.5 Å²	59.5	7%	0.073	28%	0.281	C	S	.	.			trans	-62.1	126.7	177.8	-70.5	170	0	0	0	111.3	V708 N715 R719 G734 I735 Y738	V708-L711 HydrophobicContact CG1-CD1 4.35Å; V708-L711 WeakPolarHBondContact O-CG 3.3Å; V708-L711 PolarHBondContact O-N 2.69Å; L711-N715 WeakPolarHBondContact CA-OD1 3.36Å; L711-R719 HydrophobicContact CD2-CB 4.04Å; L711-R719 HydrophobicContact CD2-CG 4.1Å; L711-G734 VanDerWaalsContact CD1-C 3.48Å; L711-I735 HydrophobicContact CD1-CG1 4.09Å; L711-I735 HydrophobicContact CD2-CG1 3.75Å; L711-Y738 HydrophobicContact CB-CD2 3.76Å; L711-Y738 HydrophobicContact CB-CE2 4.21Å; L711-Y738 HydrophobicContact CB-CG 3.99Å; L711-Y738 WeakPolarHBondContact O-CE2 3.01Å
712	D	89	Confident	91	Very high	63 Å²	63	52.9 Å²	52.9	34%	0.337	26%	0.257	S	S	.	.			trans	-141	169.6	174.7	72.9	54.7	0	0	0	110.7	S710 N714 N715 I716 Y738	S710-D712 PolarHBondContact O-N 3.46Å; D712-N714 PolarHBondContact O-N 3Å; D712-N714 VanDerWaalsContact O-N 3.16Å; D712-N714 WeakPolarHBondContact OD1-CA 3.37Å; D712-N714 VanDerWaalsContact OD1-CB 3.29Å; D712-N714 WeakPolarHBondContact OD1-CB 3.28Å; D712-N714 PolarHBondContact OD1-N 3.49Å; D712-N714 PolarHBondContact OD1-ND2 3.46Å; D712-N715 PolarHBondContact N-ND2 2.93Å; D712-N715 PolarHBondContact N-OD1 3.03Å; D712-N715 PolarHBondContact O-N 2.61Å; D712-N715 PolarHBondContact O-OD1 3.25Å; D712-N715 PolarHBondContact OD1-N 2.97Å; D712-N715 PolarHBondContact OD1-ND2 2.89Å; D712-N715 PolarHBondContact OD2-ND2 2.84Å; D712-I716 WeakPolarHBondContact O-CG1 3.31Å; D712-I716 PolarHBondContact O-N 3.39Å; D712-Y738 WeakPolarHBondContact CA-OH 3.29Å
713	E	85.1	Confident	91.1	Very high	116 Å²	116	50.7 Å²	50.7	54%	0.542	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.5	-176.7	65.8	-168.7	174.6	0	0	115.1	V745	E713-V745 HydrophobicContact CB-CG2 4.41Å
714	N	86.9	Confident	90.9	Very high	135 Å²	135	57.2 Å²	57.2	72%	0.722	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-18.5	-178.2	-52.9	-79	0	0	0	112.7	D712	D712-N714 PolarHBondContact O-N 3Å; D712-N714 VanDerWaalsContact O-N 3.16Å; D712-N714 WeakPolarHBondContact OD1-CA 3.37Å; D712-N714 VanDerWaalsContact OD1-CB 3.29Å; D712-N714 WeakPolarHBondContact OD1-CB 3.28Å; D712-N714 PolarHBondContact OD1-N 3.49Å; D712-N714 PolarHBondContact OD1-ND2 3.46Å
715	N	90.5	Very high	90.8	Very high	19 Å²	19	61 Å²	61	10%	0.102	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-3.9	-175.1	73.3	48.3	0	0	0	115.2	S710 L711 D712 D717 S718 R719	S710-N715 PolarHBondContact O-ND2 2.69Å; L711-N715 WeakPolarHBondContact CA-OD1 3.36Å; D712-N715 PolarHBondContact N-ND2 2.93Å; D712-N715 PolarHBondContact N-OD1 3.03Å; D712-N715 PolarHBondContact O-N 2.61Å; D712-N715 PolarHBondContact O-OD1 3.25Å; D712-N715 PolarHBondContact OD1-N 2.97Å; D712-N715 PolarHBondContact OD1-ND2 2.89Å; D712-N715 PolarHBondContact OD2-ND2 2.84Å; N715-D717 PolarHBondContact O-N 2.97Å; N715-S718 PolarHBondContact O-N 2.79Å; N715-S718 PolarHBondContact O-OG 3.4Å; N715-S718 VanDerWaalsContact O-OG 3.06Å; N715-R719 HydrophobicContact CB-CG 4.28Å; N715-R719 VanDerWaalsContact O-CB 3.3Å; N715-R719 WeakPolarHBondContact O-CB 3.49Å; N715-R719 WeakPolarHBondContact O-CG 3.48Å; N715-R719 PolarHBondContact O-N 3.1Å
716	I	88.8	Confident	90.8	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-56.8	-45.4	-179.7	-72.7	162.4	0	0	0	112.7	D712 R719 M720 I735 Y738 I739 V745 V750	D712-I716 WeakPolarHBondContact O-CG1 3.31Å; D712-I716 PolarHBondContact O-N 3.39Å; I716-R719 PolarHBondContact O-N 3.43Å; I716-M720 WeakPolarHBondContact O-CB 3.42Å; I716-M720 PolarHBondContact O-N 3.08Å; I716-I735 HydrophobicContact CG2-CG2 4.16Å; I716-Y738 HydrophobicContact CD1-CD1 3.78Å; I716-Y738 HydrophobicContact CD1-CE1 3.84Å; I716-Y738 HydrophobicContact CG1-CD1 4.39Å; I716-I739 HydrophobicContact CD1-CG1 4.24Å; I716-I739 HydrophobicContact CG2-CD1 4.12Å; I716-V745 HydrophobicContact CD1-CB 4.44Å; I716-V745 HydrophobicContact CD1-CG1 3.55Å; I716-V745 HydrophobicContact CD1-CG2 4.05Å; I716-V750 HydrophobicContact CB-CG1 4.29Å; I716-V750 HydrophobicContact CG2-CG1 3.6Å
717	D	86.4	Confident	90.6	Very high	70 Å²	70	56 Å²	56	37%	0.374	29%	0.287	S	S	.	.	H	α-helix	trans	-65.5	-43.6	-176.8	-72.2	-26.3	0	0	0	112	N715 M720 K721	N715-D717 PolarHBondContact O-N 2.97Å; D717-M720 PolarHBondContact O-N 3.32Å; D717-K721 PolarHBondContact O-N 3.01Å
718	S	90.5	Very high	90.5	Very high	54 Å²	54	56 Å²	56	38%	0.378	29%	0.287	S	S	.	.	H	α-helix	trans	-67.4	-40.2	176.9	65.9	0	0	0	0	111.7	N715 K721 L722	N715-S718 PolarHBondContact O-N 2.79Å; N715-S718 PolarHBondContact O-OG 3.4Å; N715-S718 VanDerWaalsContact O-OG 3.06Å; S718-K721 PolarHBondContact O-N 3.09Å; S718-L722 WeakPolarHBondContact O-CB 3.21Å; S718-L722 PolarHBondContact O-N 3.38Å
719	R	92.2	Very high	90.3	Very high	15 Å²	15	57.2 Å²	57.2	6%	0.057	30%	0.295	C	S	.	.	H	α-helix	trans	-70.5	-33	177.9	-63.5	-68.9	167.1	88.6	-4.4	112.5	E685 L707 S710 L711 N715 I716 L722 A723 I735	E685-R719 IonicContact OE1-CZ 3.6Å; E685-R719 IonicContact OE1-NE 2.69Å; E685-R719 PolarHBondContact OE1-NE 3.45Å; E685-R719 IonicContact OE1-NH2 3.59Å; L707-R719 PolarHBondContact O-NH1 3.34Å; S710-R719 PolarHBondContact OG-NH1 3.47Å; L711-R719 HydrophobicContact CD2-CB 4.04Å; L711-R719 HydrophobicContact CD2-CG 4.1Å; N715-R719 HydrophobicContact CB-CG 4.28Å; N715-R719 VanDerWaalsContact O-CB 3.3Å; N715-R719 WeakPolarHBondContact O-CB 3.49Å; N715-R719 WeakPolarHBondContact O-CG 3.48Å; N715-R719 PolarHBondContact O-N 3.1Å; I716-R719 PolarHBondContact O-N 3.43Å; R719-L722 PolarHBondContact O-N 3.41Å; R719-A723 WeakPolarHBondContact O-CB 3.36Å; R719-A723 PolarHBondContact O-N 2.9Å; R719-I735 HydrophobicContact CB-CD1 3.97Å; R719-I735 HydrophobicContact CB-CG1 4.5Å
720	M	89.4	Confident	90.2	Very high	17 Å²	17	50.4 Å²	50.4	8%	0.084	27%	0.274	C	S	.	.	H	α-helix	trans	-65.4	-46.9	172.8	173.8	164.6	67.1	0	0	110.9	I716 D717 A723 K724 I735 M754 I765	I716-M720 WeakPolarHBondContact O-CB 3.42Å; I716-M720 PolarHBondContact O-N 3.08Å; D717-M720 PolarHBondContact O-N 3.32Å; M720-A723 PolarHBondContact O-N 2.81Å; M720-K724 PolarHBondContact O-N 3.17Å; M720-K724 VanDerWaalsContact O-N 3.13Å; M720-I735 HydrophobicContact CB-CD1 4.39Å; M720-M754 HydrophobicContact CE-CE 4.46Å; M720-M754 HydrophobicContact CE-CG 4.08Å; M720-M754 HydrophobicContact SD-CE 3.4Å; M720-M754 WeakPolarHBondContact SD-CE 3.49Å; M720-M754 HydrophobicContact SD-CG 3.87Å; M720-I765 HydrophobicContact CG-CD1 3.56Å; M720-I765 HydrophobicContact SD-CD1 3.88Å
721	K	91.6	Very high	90.2	Very high	136 Å²	136	49.6 Å²	49.6	59%	0.591	27%	0.268	S	S	*	.	H	α-helix	trans	-59.1	-48.9	173.6	-175.2	-178.3	174.4	-175.4	0	111	D717 S718 A723 K724 D725	D717-K721 PolarHBondContact O-N 3.01Å; S718-K721 PolarHBondContact O-N 3.09Å; K721-A723 VanDerWaalsContact C-N 3.32Å; K721-A723 PolarHBondContact O-N 2.99Å; K721-K724 WeakPolarHBondContact O-CB 3.44Å; K721-K724 PolarHBondContact O-N 3.05Å; K721-K724 VanDerWaalsContact O-N 3.12Å; K721-D725 WeakPolarHBondContact CE-OD2 3.22Å; K721-D725 VanDerWaalsContact O-CG 3.24Å; K721-D725 PolarHBondContact O-N 3.16Å
722	L	93.5	Very high	90.2	Very high	1 Å²	1	49 Å²	49	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-58.4	-40.1	177.2	177	63.8	0	0	0	113.1	E685 L688 R689 L707 S718 R719 K724 D725 T726 L731	E685-L722 HydrophobicContact CB-CD2 3.77Å; E685-L722 HydrophobicContact CG-CD2 3.59Å; L688-L722 HydrophobicContact CD2-CD1 4.2Å; L688-L722 HydrophobicContact CD2-CD2 3.95Å; L688-L722 HydrophobicContact CD2-CG 3.86Å; R689-L722 HydrophobicContact CG-CD1 3.87Å; L707-L722 HydrophobicContact CD1-CD2 3.87Å; L707-L722 HydrophobicContact CD2-CD2 4.47Å; S718-L722 WeakPolarHBondContact O-CB 3.21Å; S718-L722 PolarHBondContact O-N 3.38Å; R719-L722 PolarHBondContact O-N 3.41Å; L722-K724 VanDerWaalsContact C-N 3.32Å; L722-K724 PolarHBondContact O-N 2.87Å; L722-D725 PolarHBondContact O-N 3.37Å; L722-T726 HydrophobicContact CD1-CG2 3.78Å; L722-T726 WeakPolarHBondContact O-CB 3.34Å; L722-T726 WeakPolarHBondContact O-CG2 3.4Å; L722-T726 PolarHBondContact O-N 3.27Å; L722-T726 PolarHBondContact O-OG1 3.34Å; L722-L731 HydrophobicContact CD2-CD2 4.18Å; L722-L731 HydrophobicContact CG-CD2 4.27Å
723	A	93.4	Very high	90.1	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.008	27%	0.266	C	S	.	.	H	α-helix	trans	-64.7	-36.8	177.4	0	0	0	0	0	112.2	R719 M720 K721 G727 S728 L731 I735	R719-A723 WeakPolarHBondContact O-CB 3.36Å; R719-A723 PolarHBondContact O-N 2.9Å; M720-A723 PolarHBondContact O-N 2.81Å; K721-A723 VanDerWaalsContact C-N 3.32Å; K721-A723 PolarHBondContact O-N 2.99Å; A723-G727 CarbonylContact O-C 3.59Å; A723-G727 WeakPolarHBondContact O-CA 3.42Å; A723-G727 PolarHBondContact O-N 3.03Å; A723-G727 VanDerWaalsContact O-N 3.11Å; A723-S728 PolarHBondContact O-N 2.86Å; A723-L731 HydrophobicContact CB-CB 4.07Å; A723-L731 HydrophobicContact CB-CD2 3.99Å; A723-L731 HydrophobicContact CB-CG 3.97Å; A723-I735 HydrophobicContact CB-CD1 4.3Å
724	K	91	Very high	90.3	Very high	137 Å²	137	45.6 Å²	45.6	60%	0.596	25%	0.246	S	C	*	.	H	α-helix	trans	-68.6	-52	173.2	-176.2	179.6	-178.9	175.6	0	111.4	M720 K721 L722 T726 G727	M720-K724 PolarHBondContact O-N 3.17Å; M720-K724 VanDerWaalsContact O-N 3.13Å; K721-K724 WeakPolarHBondContact O-CB 3.44Å; K721-K724 PolarHBondContact O-N 3.05Å; K721-K724 VanDerWaalsContact O-N 3.12Å; L722-K724 VanDerWaalsContact C-N 3.32Å; L722-K724 PolarHBondContact O-N 2.87Å; K724-T726 PolarHBondContact O-N 3.01Å; K724-G727 PolarHBondContact O-N 2.85Å
725	D	91.8	Very high	90.4	Very high	91 Å²	91	39.1 Å²	39.1	49%	0.487	21%	0.212	S	C	.	.	H	α-helix	trans	-60.1	-32.7	-177.5	-66.3	-10.4	0	0	0	112.1	K721 L722	K721-D725 WeakPolarHBondContact CE-OD2 3.22Å; K721-D725 VanDerWaalsContact O-CG 3.24Å; K721-D725 PolarHBondContact O-N 3.16Å; L722-D725 PolarHBondContact O-N 3.37Å
726	T	91.1	Very high	90.1	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.018	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	0.7	-179.8	61.9	0	0	0	0	114.5	L688 R689 H692 K700 L722 K724 S728	L688-T726 HydrophobicContact CD2-CG2 4.32Å; L688-T726 HydrophobicContact CG-CG2 4.17Å; R689-T726 HydrophobicContact CG-CG2 4.18Å; H692-T726 HydrophobicContact CB-CG2 4.39Å; K700-T726 PolarHBondContact NZ-O 3.43Å; L722-T726 HydrophobicContact CD1-CG2 3.78Å; L722-T726 WeakPolarHBondContact O-CB 3.34Å; L722-T726 WeakPolarHBondContact O-CG2 3.4Å; L722-T726 PolarHBondContact O-N 3.27Å; L722-T726 PolarHBondContact O-OG1 3.34Å; K724-T726 PolarHBondContact O-N 3.01Å; T726-S728 PolarHBondContact O-N 2.96Å
727	G	90.8	Very high	90.1	Very high	53 Å²	53	40.6 Å²	40.6	55%	0.546	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	33.8	-173.5	0	0	0	0	0	114.1	A723 K724 T729	A723-G727 CarbonylContact O-C 3.59Å; A723-G727 WeakPolarHBondContact O-CA 3.42Å; A723-G727 PolarHBondContact O-N 3.03Å; A723-G727 VanDerWaalsContact O-N 3.11Å; K724-G727 PolarHBondContact O-N 2.85Å; G727-T729 PolarHBondContact O-N 2.77Å
728	S	90.6	Very high	90.1	Very high	1 Å²	1	40 Å²	40	1%	0.007	21%	0.214	C	C	.	.			trans	-82.7	104.9	-177	-178.6	0	0	0	0	112.2	E704 A723 T726 L731 S732	E704-S728 VanDerWaalsContact CG-OG 3.29Å; E704-S728 WeakPolarHBondContact CG-OG 3.44Å; E704-S728 VanDerWaalsContact OE1-CB 3.28Å; E704-S728 WeakPolarHBondContact OE1-CB 3.22Å; E704-S728 PolarHBondContact OE1-OG 3.25Å; A723-S728 PolarHBondContact O-N 2.86Å; T726-S728 PolarHBondContact O-N 2.96Å; S728-L731 VanDerWaalsContact OG-CB 3.28Å; S728-L731 WeakPolarHBondContact OG-CB 3.33Å; S728-L731 PolarHBondContact OG-N 3.35Å; S728-L731 VanDerWaalsContact OG-N 3.07Å; S728-S732 VanDerWaalsContact O-CB 3.31Å; S728-S732 WeakPolarHBondContact O-CB 3.14Å; S728-S732 PolarHBondContact O-N 3.18Å; S728-S732 VanDerWaalsContact O-N 3.09Å; S728-S732 PolarHBondContact O-OG 3.2Å
729	T	89.8	Confident	89.8	Confident	70 Å²	70	38.1 Å²	38.1	43%	0.429	20%	0.2	S	C	.	.	H	α-helix	trans	-73	-28.9	172.3	64.8	0	0	0	0	112.2	G727 R733	G727-T729 PolarHBondContact O-N 2.77Å; T729-R733 VanDerWaalsContact O-CB 3.25Å; T729-R733 WeakPolarHBondContact O-CB 3.41Å; T729-R733 PolarHBondContact O-N 2.9Å
730	V	90.3	Very high	89.3	Confident	45 Å²	45	39.1 Å²	39.1	27%	0.273	21%	0.208	S	C	.	.	H	α-helix	trans	-68.7	-46	177.9	-179.3	0	0	0	0	110.7	E704 G734	E704-V730 HydrophobicContact CB-CB 4.06Å; E704-V730 HydrophobicContact CB-CG1 3.96Å; E704-V730 HydrophobicContact CG-CB 4.3Å; E704-V730 WeakPolarHBondContact OE2-CB 3.45Å; E704-V730 VanDerWaalsContact OE2-CG2 3.3Å; E704-V730 WeakPolarHBondContact OE2-CG2 3.42Å; V730-G734 PolarHBondContact O-N 3.47Å
731	L	91.2	Very high	89	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.8	-43	176.1	-174	57.2	0	0	0	111	L688 L707 V708 L722 A723 S728 R733 G734 I735	L688-L731 HydrophobicContact CD2-CD2 4.08Å; L707-L731 HydrophobicContact CB-CD1 3.84Å; L707-L731 HydrophobicContact CB-CD2 4.42Å; L707-L731 HydrophobicContact CD1-CD2 4.28Å; V708-L731 HydrophobicContact CG2-CD1 3.71Å; L722-L731 HydrophobicContact CD2-CD2 4.18Å; L722-L731 HydrophobicContact CG-CD2 4.27Å; A723-L731 HydrophobicContact CB-CB 4.07Å; A723-L731 HydrophobicContact CB-CD2 3.99Å; A723-L731 HydrophobicContact CB-CG 3.97Å; S728-L731 VanDerWaalsContact OG-CB 3.28Å; S728-L731 WeakPolarHBondContact OG-CB 3.33Å; S728-L731 PolarHBondContact OG-N 3.35Å; S728-L731 VanDerWaalsContact OG-N 3.07Å; L731-R733 VanDerWaalsContact C-N 3.34Å; L731-R733 PolarHBondContact O-N 2.8Å; L731-G734 PolarHBondContact O-N 2.73Å; L731-G734 VanDerWaalsContact O-N 3.16Å; L731-I735 HydrophobicContact CD1-CD1 4.3Å; L731-I735 HydrophobicContact CD1-CG1 4.4Å; L731-I735 HydrophobicContact CG-CD1 3.96Å; L731-I735 VanDerWaalsContact O-CG1 3.31Å; L731-I735 WeakPolarHBondContact O-CG1 3.23Å; L731-I735 PolarHBondContact O-N 2.82Å
732	S	89.9	Confident	88.3	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.014	22%	0.222	C	C	.	.	H	α-helix	trans	-54.5	-46.7	174.6	-62.7	0	0	0	0	112.4	S728 I735 S736	S728-S732 VanDerWaalsContact O-CB 3.31Å; S728-S732 WeakPolarHBondContact O-CB 3.14Å; S728-S732 PolarHBondContact O-N 3.18Å; S728-S732 VanDerWaalsContact O-N 3.09Å; S728-S732 PolarHBondContact O-OG 3.2Å; S732-I735 PolarHBondContact O-N 3.19Å; S732-S736 WeakPolarHBondContact O-CB 3.33Å; S732-S736 PolarHBondContact O-N 2.84Å
733	R	87.8	Confident	86.8	Confident	96 Å²	96	50.7 Å²	50.7	36%	0.362	26%	0.26	S	S	.	.	H	α-helix	trans	-68.3	-37.2	177.6	-164.5	177.9	-49.3	113.6	13.7	112.8	T729 L731 S736 T737 E768	T729-R733 VanDerWaalsContact O-CB 3.25Å; T729-R733 WeakPolarHBondContact O-CB 3.41Å; T729-R733 PolarHBondContact O-N 2.9Å; L731-R733 VanDerWaalsContact C-N 3.34Å; L731-R733 PolarHBondContact O-N 2.8Å; R733-S736 PolarHBondContact O-N 2.03Å; R733-T737 WeakPolarHBondContact O-CB 3.44Å; R733-T737 PolarHBondContact O-N 3.22Å; R733-T737 PolarHBondContact O-OG1 2.81Å; R733-E768 IonicContact CZ-OE1 3.98Å; R733-E768 VanDerWaalsContact CZ-OE1 3.25Å; R733-E768 IonicContact NE-OE1 3.27Å; R733-E768 PolarHBondContact NE-OE1 2.73Å; R733-E768 IonicContact NH2-OE1 3.21Å; R733-E768 PolarHBondContact NH2-OE1 2.67Å
734	G	88.9	Confident	85.4	Confident	11 Å²	11	58.2 Å²	58.2	11%	0.113	30%	0.295	C	S	.	.	H	α-helix	trans	-61.5	-45.7	173.1	0	0	0	0	0	112.4	L711 V730 L731 T737 Y738	L711-G734 VanDerWaalsContact CD1-C 3.48Å; V730-G734 PolarHBondContact O-N 3.47Å; L731-G734 PolarHBondContact O-N 2.73Å; L731-G734 VanDerWaalsContact O-N 3.16Å; G734-T737 PolarHBondContact O-N 2.87Å; G734-Y738 WeakPolarHBondContact O-CB 2.96Å; G734-Y738 PolarHBondContact O-N 3.34Å
735	I	88.7	Confident	84	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60.9	-50.6	175.1	-67.4	162.8	0	0	0	110.6	L711 I716 R719 M720 A723 L731 S732 T737 Y738 I739 M754	L711-I735 HydrophobicContact CD1-CG1 4.09Å; L711-I735 HydrophobicContact CD2-CG1 3.75Å; I716-I735 HydrophobicContact CG2-CG2 4.16Å; R719-I735 HydrophobicContact CB-CD1 3.97Å; R719-I735 HydrophobicContact CB-CG1 4.5Å; M720-I735 HydrophobicContact CB-CD1 4.39Å; A723-I735 HydrophobicContact CB-CD1 4.3Å; L731-I735 HydrophobicContact CD1-CD1 4.3Å; L731-I735 HydrophobicContact CD1-CG1 4.4Å; L731-I735 HydrophobicContact CG-CD1 3.96Å; L731-I735 VanDerWaalsContact O-CG1 3.31Å; L731-I735 WeakPolarHBondContact O-CG1 3.23Å; L731-I735 PolarHBondContact O-N 2.82Å; S732-I735 PolarHBondContact O-N 3.19Å; I735-T737 VanDerWaalsContact C-N 3.28Å; I735-T737 PolarHBondContact O-N 2.88Å; I735-Y738 PolarHBondContact O-N 3.36Å; I735-Y738 VanDerWaalsContact O-N 3.11Å; I735-I739 HydrophobicContact CG2-CD1 3.66Å; I735-I739 HydrophobicContact CG2-CG1 4.41Å; I735-I739 WeakPolarHBondContact O-CG1 3.4Å; I735-I739 PolarHBondContact O-N 2.89Å; I735-M754 HydrophobicContact CG2-CE 4.12Å
736	S	85.5	Confident	82.3	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.007	27%	0.265	C	S	.	.	H	α-helix	trans	-57	-41.3	177	-177.6	0	0	0	0	112.2	S732 R733 T740 T769	S732-S736 WeakPolarHBondContact O-CB 3.33Å; S732-S736 PolarHBondContact O-N 2.84Å; R733-S736 PolarHBondContact O-N 2.03Å; S736-T740 VanDerWaalsContact O-CB 3.28Å; S736-T740 WeakPolarHBondContact O-CB 3.24Å; S736-T740 PolarHBondContact O-N 2.03Å; S736-T740 PolarHBondContact O-OG1 3.37Å; S736-T769 WeakPolarHBondContact OG-CA 3.12Å; S736-T769 PolarHBondContact OG-OG1 3.37Å
737	T	87.6	Confident	80.4	Confident	49 Å²	49	57.2 Å²	57.2	30%	0.301	30%	0.296	S	S	.	.	H	α-helix	trans	-65.1	-44.1	175.2	-57.1	0	0	0	0	111.7	R733 G734 I735 T740 N741	R733-T737 WeakPolarHBondContact O-CB 3.44Å; R733-T737 PolarHBondContact O-N 3.22Å; R733-T737 PolarHBondContact O-OG1 2.81Å; G734-T737 PolarHBondContact O-N 2.87Å; I735-T737 VanDerWaalsContact C-N 3.28Å; I735-T737 PolarHBondContact O-N 2.88Å; T737-T740 PolarHBondContact O-N 3.49Å; T737-N741 WeakPolarHBondContact O-CB 3.39Å; T737-N741 PolarHBondContact O-N 3Å; T737-N741 VanDerWaalsContact O-N 3.09Å; T737-N741 PolarHBondContact O-ND2 3.49Å
738	Y	87	Confident	78.9	Confident	57 Å²	57	56.8 Å²	56.8	22%	0.224	28%	0.284	C	S	.	.	H	α-helix	trans	-62.5	-46.8	179	-174.4	-87	0	0	0	111.8	L711 D712 I716 G734 I735 T740 N741 N742 V745	L711-Y738 HydrophobicContact CB-CD2 3.76Å; L711-Y738 HydrophobicContact CB-CE2 4.21Å; L711-Y738 HydrophobicContact CB-CG 3.99Å; L711-Y738 WeakPolarHBondContact O-CE2 3.01Å; D712-Y738 WeakPolarHBondContact CA-OH 3.29Å; I716-Y738 HydrophobicContact CD1-CD1 3.78Å; I716-Y738 HydrophobicContact CD1-CE1 3.84Å; I716-Y738 HydrophobicContact CG1-CD1 4.39Å; G734-Y738 WeakPolarHBondContact O-CB 2.96Å; G734-Y738 PolarHBondContact O-N 3.34Å; I735-Y738 PolarHBondContact O-N 3.36Å; I735-Y738 VanDerWaalsContact O-N 3.11Å; Y738-T740 VanDerWaalsContact C-N 3.34Å; Y738-T740 PolarHBondContact O-N 3.26Å; Y738-N741 PolarHBondContact O-N 2.97Å; Y738-N742 HydrophobicContact CD1-CB 4.48Å; Y738-N742 WeakPolarHBondContact CD2-ND2 3.4Å; Y738-N742 HydrophobicContact CE1-CB 4.15Å; Y738-N742 WeakPolarHBondContact CE1-ND2 3.48Å; Y738-N742 VanDerWaalsContact CE2-ND2 3.26Å; Y738-N742 WeakPolarHBondContact CE2-ND2 3.37Å; Y738-N742 VanDerWaalsContact CZ-ND2 3.31Å; Y738-N742 WeakPolarHBondContact O-CB 3.25Å; Y738-N742 PolarHBondContact O-N 3.31Å; Y738-N742 PolarHBondContact O-ND2 3.38Å; Y738-V745 HydrophobicContact CE1-CG2 4.05Å
739	I	84.9	Confident	77.4	Confident	14 Å²	14	61.5 Å²	61.5	7%	0.072	31%	0.309	C	S	.	.	H	α-helix	trans	-64.6	-39.3	177.6	-64.6	168.3	0	0	0	111.1	I716 I735 N741 V745 R746 M754	I716-I739 HydrophobicContact CD1-CG1 4.24Å; I716-I739 HydrophobicContact CG2-CD1 4.12Å; I735-I739 HydrophobicContact CG2-CD1 3.66Å; I735-I739 HydrophobicContact CG2-CG1 4.41Å; I735-I739 WeakPolarHBondContact O-CG1 3.4Å; I735-I739 PolarHBondContact O-N 2.89Å; I739-N741 VanDerWaalsContact C-N 3.31Å; I739-N741 PolarHBondContact O-N 2.97Å; I739-V745 HydrophobicContact CG1-CG1 4.1Å; I739-R746 HydrophobicContact CG2-CG 4.28Å; I739-M754 HydrophobicContact CD1-CE 3.31Å; I739-M754 HydrophobicContact CD1-SD 3.67Å
740	T	80.9	Confident	75.9	Confident	37 Å²	37	58.9 Å²	58.9	23%	0.227	29%	0.293	C	S	.	.	H	α-helix	trans	-63.7	-37.9	179	-63.2	0	0	0	0	111.9	S736 T737 Y738 R746	S736-T740 VanDerWaalsContact O-CB 3.28Å; S736-T740 WeakPolarHBondContact O-CB 3.24Å; S736-T740 PolarHBondContact O-N 2.03Å; S736-T740 PolarHBondContact O-OG1 3.37Å; T737-T740 PolarHBondContact O-N 3.49Å; Y738-T740 VanDerWaalsContact C-N 3.34Å; Y738-T740 PolarHBondContact O-N 3.26Å; T740-R746 PolarHBondContact O-NH1 3.25Å
741	N	82.7	Confident	74	Confident	118 Å²	118	58 Å²	58	63%	0.631	29%	0.289	S	S	*	.	H	α-helix	trans	-83.5	-34.3	-179.2	-68.8	-25.6	0	0	0	113.5	T737 Y738 I739 R743	T737-N741 WeakPolarHBondContact O-CB 3.39Å; T737-N741 PolarHBondContact O-N 3Å; T737-N741 VanDerWaalsContact O-N 3.09Å; T737-N741 PolarHBondContact O-ND2 3.49Å; Y738-N741 PolarHBondContact O-N 2.97Å; I739-N741 VanDerWaalsContact C-N 3.31Å; I739-N741 PolarHBondContact O-N 2.97Å; N741-R743 PolarHBondContact O-N 2.9Å
742	N	78.1	Confident	72.3	Confident	62 Å²	62	63.4 Å²	63.4	33%	0.332	31%	0.313	S	S	.	.			trans	-96.9	89.9	-175.6	-68.1	-69.2	0	0	0	112.2	Y738 Q744 V745	Y738-N742 HydrophobicContact CD1-CB 4.48Å; Y738-N742 WeakPolarHBondContact CD2-ND2 3.4Å; Y738-N742 HydrophobicContact CE1-CB 4.15Å; Y738-N742 WeakPolarHBondContact CE1-ND2 3.48Å; Y738-N742 VanDerWaalsContact CE2-ND2 3.26Å; Y738-N742 WeakPolarHBondContact CE2-ND2 3.37Å; Y738-N742 VanDerWaalsContact CZ-ND2 3.31Å; Y738-N742 WeakPolarHBondContact O-CB 3.25Å; Y738-N742 PolarHBondContact O-N 3.31Å; Y738-N742 PolarHBondContact O-ND2 3.38Å; N742-Q744 PolarHBondContact O-N 3.07Å; N742-V745 HydrophobicContact CB-CG2 4.08Å; N742-V745 PolarHBondContact O-N 3.14Å; N742-V745 VanDerWaalsContact O-N 3.08Å
743	R	61.7	Low	70.8	Confident	217 Å²	217	66.7 Å²	66.7	82%	0.819	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-30.5	-179.7	-85	-172.2	174.9	-176.3	-1.3	115.4	N741 V745 R746	N741-R743 PolarHBondContact O-N 2.9Å; R743-V745 VanDerWaalsContact C-N 3.3Å; R743-V745 PolarHBondContact O-N 3.37Å; R743-R746 PolarHBondContact O-N 3.18Å
744	Q	62.9	Low	69	Low	158 Å²	158	63.5 Å²	63.5	74%	0.738	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-30.3	-177	-56.2	-167.8	21.3	0	0	112.3	N742 S747	N742-Q744 PolarHBondContact O-N 3.07Å; Q744-S747 PolarHBondContact O-N 3.05Å; Q744-S747 PolarHBondContact O-OG 3.48Å
745	V	62.1	Low	67.2	Low	5 Å²	5	70.1 Å²	70.1	3%	0.03	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-72.1	-34.9	177.1	-178	0	0	0	0	111.9	E713 I716 Y738 I739 N742 R743 S747 S748 V750	E713-V745 HydrophobicContact CB-CG2 4.41Å; I716-V745 HydrophobicContact CD1-CB 4.44Å; I716-V745 HydrophobicContact CD1-CG1 3.55Å; I716-V745 HydrophobicContact CD1-CG2 4.05Å; Y738-V745 HydrophobicContact CE1-CG2 4.05Å; I739-V745 HydrophobicContact CG1-CG1 4.1Å; N742-V745 HydrophobicContact CB-CG2 4.08Å; N742-V745 PolarHBondContact O-N 3.14Å; N742-V745 VanDerWaalsContact O-N 3.08Å; R743-V745 VanDerWaalsContact C-N 3.3Å; R743-V745 PolarHBondContact O-N 3.37Å; V745-S747 PolarHBondContact O-N 3.48Å; V745-S748 PolarHBondContact O-N 2.95Å; V745-S748 VanDerWaalsContact O-N 3.11Å; V745-S748 PolarHBondContact O-OG 2.8Å; V745-S748 VanDerWaalsContact O-OG 3.09Å; V745-V750 HydrophobicContact CG1-CG1 4.35Å
746	R	55.5	Low	65.4	Low	110 Å²	110	75 Å²	75	42%	0.415	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-59.3	-17.8	173.9	-87.7	-172.7	167.4	117.4	-6.9	113.8	I739 T740 R743	I739-R746 HydrophobicContact CG2-CG 4.28Å; T740-R746 PolarHBondContact O-NH1 3.25Å; R743-R746 PolarHBondContact O-N 3.18Å
747	S	51.6	Low	63.7	Low	96 Å²	96	81.8 Å²	81.8	67%	0.671	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-100.9	-7.2	178.1	39.2	0	0	0	0	115	Q744 V745	Q744-S747 PolarHBondContact O-N 3.05Å; Q744-S747 PolarHBondContact O-OG 3.48Å; V745-S747 PolarHBondContact O-N 3.48Å
748	S	59.4	Low	61.9	Low	44 Å²	44	81 Å²	81	31%	0.308	40%	0.403	S	S	.	.	S	Bend	trans	-86.1	164.9	176.6	70	0	0	0	0	111.8	V745 V750 S751	V745-S748 PolarHBondContact O-N 2.95Å; V745-S748 VanDerWaalsContact O-N 3.11Å; V745-S748 PolarHBondContact O-OG 2.8Å; V745-S748 VanDerWaalsContact O-OG 3.09Å; S748-V750 PolarHBondContact O-N 3.3Å; S748-V750 VanDerWaalsContact O-N 3.11Å; S748-V750 WeakPolarHBondContact OG-CB 3.4Å; S748-V750 WeakPolarHBondContact OG-CG2 3.28Å; S748-S751 PolarHBondContact O-N 3.31Å
749	D	59	Low	59.8	Low	99 Å²	99	82.9 Å²	82.9	53%	0.529	43%	0.43	S	S	.	.	H	α-helix	trans	-61.9	-18.8	179.8	-65.9	-49	0	0	0	113.1	S751 K752 N753	D749-S751 PolarHBondContact O-N 2.92Å; D749-K752 WeakPolarHBondContact O-CA 3.04Å; D749-K752 WeakPolarHBondContact O-CB 2.97Å; D749-K752 PolarHBondContact O-N 3.32Å; D749-K752 WeakPolarHBondContact OD1-CD 3.44Å; D749-K752 WeakPolarHBondContact OD1-CE 3.48Å; D749-K752 IonicContact OD1-NZ 3.12Å; D749-K752 PolarHBondContact OD1-NZ 3.19Å; D749-N753 PolarHBondContact O-N 2.78Å
750	V	57.3	Low	57.9	Low	15 Å²	15	85.4 Å²	85.4	9%	0.091	45%	0.449	C	S	.	.	H	α-helix	trans	-49.2	-44.9	167.6	177.9	0	0	0	0	111.5	I716 V745 S748 K752 N753 M754	I716-V750 HydrophobicContact CB-CG1 4.29Å; I716-V750 HydrophobicContact CG2-CG1 3.6Å; V745-V750 HydrophobicContact CG1-CG1 4.35Å; S748-V750 PolarHBondContact O-N 3.3Å; S748-V750 VanDerWaalsContact O-N 3.11Å; S748-V750 WeakPolarHBondContact OG-CB 3.4Å; S748-V750 WeakPolarHBondContact OG-CG2 3.28Å; V750-K752 VanDerWaalsContact C-N 3.31Å; V750-K752 PolarHBondContact O-N 3.46Å; V750-N753 PolarHBondContact O-N 3.32Å; V750-M754 PolarHBondContact O-N 3.17Å; V750-M754 VanDerWaalsContact O-N 3.09Å
751	S	52.2	Low	56.2	Low	26 Å²	26	87.9 Å²	87.9	18%	0.182	47%	0.473	C	S	.	.	H	α-helix	trans	-70.6	-27.2	179.8	-161.7	0	0	0	0	112.6	S748 D749	S748-S751 PolarHBondContact O-N 3.31Å; D749-S751 PolarHBondContact O-N 2.92Å
752	K	55	Low	54.5	Low	115 Å²	115	89.3 Å²	89.3	50%	0.5	48%	0.481	S	S	.	.	H	α-helix	trans	-76.6	-39.7	175	-58.8	176.6	-167.1	155.6	0	111	D749 V750 M754 E755 T756	D749-K752 WeakPolarHBondContact O-CA 3.04Å; D749-K752 WeakPolarHBondContact O-CB 2.97Å; D749-K752 PolarHBondContact O-N 3.32Å; D749-K752 WeakPolarHBondContact OD1-CD 3.44Å; D749-K752 WeakPolarHBondContact OD1-CE 3.48Å; D749-K752 IonicContact OD1-NZ 3.12Å; D749-K752 PolarHBondContact OD1-NZ 3.19Å; V750-K752 VanDerWaalsContact C-N 3.31Å; V750-K752 PolarHBondContact O-N 3.46Å; K752-M754 VanDerWaalsContact C-N 3.28Å; K752-M754 PolarHBondContact O-N 2.89Å; K752-E755 PolarHBondContact O-N 3.38Å; K752-E755 VanDerWaalsContact O-N 3.08Å; K752-T756 PolarHBondContact O-N 2.87Å; K752-T756 PolarHBondContact O-OG1 3.41Å
753	N	57.1	Low	53.3	Low	70 Å²	70	86.9 Å²	86.9	37%	0.374	47%	0.469	S	S	.	.	H	α-helix	trans	-62.3	-37	175.9	-66.7	-14.6	0	0	0	111.5	D749 V750 E755 T756 E757	D749-N753 PolarHBondContact O-N 2.78Å; V750-N753 PolarHBondContact O-N 3.32Å; N753-E755 VanDerWaalsContact C-N 3.3Å; N753-E755 PolarHBondContact O-N 2.93Å; N753-T756 WeakPolarHBondContact CA-OG1 3.41Å; N753-T756 PolarHBondContact O-N 3.06Å; N753-T756 PolarHBondContact O-OG1 3.34Å; N753-E757 PolarHBondContact O-N 3.27Å
754	M	51.9	Low	52.8	Low	30 Å²	30	79.5 Å²	79.5	15%	0.148	45%	0.45	C	S	.	.	H	α-helix	trans	-59.3	-38.4	171.3	-81.1	-165.6	155.1	0	0	113.2	M720 I735 I739 V750 K752 N758 I765	M720-M754 HydrophobicContact CE-CE 4.46Å; M720-M754 HydrophobicContact CE-CG 4.08Å; M720-M754 HydrophobicContact SD-CE 3.4Å; M720-M754 WeakPolarHBondContact SD-CE 3.49Å; M720-M754 HydrophobicContact SD-CG 3.87Å; I735-M754 HydrophobicContact CG2-CE 4.12Å; I739-M754 HydrophobicContact CD1-CE 3.31Å; I739-M754 HydrophobicContact CD1-SD 3.67Å; V750-M754 PolarHBondContact O-N 3.17Å; V750-M754 VanDerWaalsContact O-N 3.09Å; K752-M754 VanDerWaalsContact C-N 3.28Å; K752-M754 PolarHBondContact O-N 2.89Å; M754-N758 WeakPolarHBondContact O-CB 3.45Å; M754-N758 PolarHBondContact O-N 3.06Å; M754-I765 HydrophobicContact CE-CG2 3.97Å
755	E	49.9	Very low	52.2	Low	149 Å²	149	72.5 Å²	72.5	70%	0.696	42%	0.417	S	S	*	.	H	α-helix	trans	-76.6	-32	178.9	-69.4	177.2	177.2	0	0	112.7	K752 N753	K752-E755 PolarHBondContact O-N 3.38Å; K752-E755 VanDerWaalsContact O-N 3.08Å; N753-E755 VanDerWaalsContact C-N 3.3Å; N753-E755 PolarHBondContact O-N 2.93Å
756	T	52.1	Low	51.7	Low	102 Å²	102	73.7 Å²	73.7	63%	0.626	43%	0.426	S	S	*	.	H	α-helix	trans	-86.9	-32	-177.1	54.9	0	0	0	0	114.5	K752 N753	K752-T756 PolarHBondContact O-N 2.87Å; K752-T756 PolarHBondContact O-OG1 3.41Å; N753-T756 WeakPolarHBondContact CA-OG1 3.41Å; N753-T756 PolarHBondContact O-N 3.06Å; N753-T756 PolarHBondContact O-OG1 3.34Å
757	E	49.5	Very low	51.5	Low	145 Å²	145	75 Å²	75	68%	0.678	44%	0.435	S	S	*	.	H	α-helix	trans	-94	-22.2	-179.4	-67.9	-160.6	150.4	0	0	114.8	N753	N753-E757 PolarHBondContact O-N 3.27Å
758	N	48.6	Very low	51.6	Low	33 Å²	33	71.7 Å²	71.7	18%	0.176	41%	0.408	C	S	.	.			trans	-105.6	31.6	-177.4	-64.5	-61.9	0	0	0	114.1	M754 S760 A763	M754-N758 WeakPolarHBondContact O-CB 3.45Å; M754-N758 PolarHBondContact O-N 3.06Å; N758-S760 PolarHBondContact O-N 3.41Å; N758-A763 HydrophobicContact CB-CB 3.94Å
759	A	42.8	Very low	51.1	Low	96 Å²	96	71.3 Å²	71.3	79%	0.793	41%	0.405	S	S	*	.			trans	-65.1	1.7	175.3	0	0	0	0	0	114.8
760	S	46.5	Very low	50.7	Low	67 Å²	67	72.4 Å²	72.4	47%	0.469	41%	0.409	S	S	.	.	S	Bend	trans	-86.5	128.5	168.1	177.8	0	0	0	0	111.1	N758 D762 A763	N758-S760 PolarHBondContact O-N 3.41Å; S760-D762 PolarHBondContact O-N 2.76Å; S760-D762 VanDerWaalsContact O-N 3.1Å; S760-D762 PolarHBondContact OG-N 2.89Å; S760-A763 WeakPolarHBondContact O-CB 3.5Å; S760-A763 PolarHBondContact O-N 3.44Å; S760-A763 VanDerWaalsContact O-N 3.13Å
761	A	43.6	Very low	50.2	Low	89 Å²	89	77.8 Å²	77.8	74%	0.736	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-14.6	175.6	0	0	0	0	0	114
762	D	47.9	Very low	49.9	Very low	147 Å²	147	81 Å²	81	79%	0.786	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-1.2	177.9	-64.6	-46.5	0	0	0	113.7	S760 P764	S760-D762 PolarHBondContact O-N 2.76Å; S760-D762 VanDerWaalsContact O-N 3.1Å; S760-D762 PolarHBondContact OG-N 2.89Å; D762-P764 WeakPolarHBondContact O-CD 3.41Å
763	A	52.2	Low	49	Very low	11 Å²	11	83.1 Å²	83.1	9%	0.091	46%	0.464	C	S	.	.			trans	-65.6	120.6	176.1	0	0	0	0	0	110.4	N758 S760 I765 S766 K767	N758-A763 HydrophobicContact CB-CB 3.94Å; S760-A763 WeakPolarHBondContact O-CB 3.5Å; S760-A763 PolarHBondContact O-N 3.44Å; S760-A763 VanDerWaalsContact O-N 3.13Å; A763-I765 PolarHBondContact O-N 3.34Å; A763-I765 VanDerWaalsContact O-N 3.14Å; A763-S766 PolarHBondContact O-N 3.43Å; A763-S766 PolarHBondContact O-OG 2.97Å; A763-K767 PolarHBondContact O-N 2.84Å
764	P	51.1	Low	48.6	Very low	63 Å²	63	83.8 Å²	83.8	41%	0.409	47%	0.469	S	S	.	.	H	α-helix	trans	-59.6	-34.7	-173.2	20.9	-32.1	0	0	0	112.6	D762 K767 E768	D762-P764 WeakPolarHBondContact O-CD 3.41Å; P764-K767 PolarHBondContact O-N 2.9Å; P764-E768 WeakPolarHBondContact O-CB 3.41Å; P764-E768 PolarHBondContact O-N 3.16Å
765	I	52	Low	48.4	Very low	10 Å²	10	86.6 Å²	86.6	5%	0.051	49%	0.486	C	S	.	.	H	α-helix	trans	-64.9	-41.2	178.6	-58.9	172.5	0	0	0	111.4	M720 M754 A763 E768 T769	M720-I765 HydrophobicContact CG-CD1 3.56Å; M720-I765 HydrophobicContact SD-CD1 3.88Å; M754-I765 HydrophobicContact CE-CG2 3.97Å; A763-I765 PolarHBondContact O-N 3.34Å; A763-I765 VanDerWaalsContact O-N 3.14Å; I765-E768 PolarHBondContact O-N 3.2Å; I765-T769 WeakPolarHBondContact O-CB 3.44Å; I765-T769 PolarHBondContact O-N 2.78Å; I765-T769 PolarHBondContact O-OG1 3.04Å
766	S	50.8	Low	48.3	Very low	31 Å²	31	83.1 Å²	83.1	22%	0.217	47%	0.474	C	S	.	.	H	α-helix	trans	-65	-44.2	178.2	70.9	0	0	0	0	110.4	A763 T769 I770	A763-S766 PolarHBondContact O-N 3.43Å; A763-S766 PolarHBondContact O-OG 2.97Å; S766-T769 PolarHBondContact O-N 3.44Å; S766-I770 WeakPolarHBondContact O-CB 3.47Å; S766-I770 WeakPolarHBondContact O-CD1 3.36Å; S766-I770 WeakPolarHBondContact O-CG1 3.3Å; S766-I770 PolarHBondContact O-N 3.04Å
767	K	50.7	Low	48.1	Very low	138 Å²	138	82 Å²	82	60%	0.6	47%	0.465	S	S	*	.	H	α-helix	trans	-61.3	-44.4	175.9	-171.6	175.7	-177.7	176	0	112.5	A763 P764 I770 L771	A763-K767 PolarHBondContact O-N 2.84Å; P764-K767 PolarHBondContact O-N 2.9Å; K767-I770 PolarHBondContact O-N 3.02Å; K767-L771 HydrophobicContact CG-CD1 4.17Å; K767-L771 WeakPolarHBondContact O-CB 3.3Å; K767-L771 WeakPolarHBondContact O-CD1 3.37Å; K767-L771 VanDerWaalsContact O-CG 3.26Å; K767-L771 WeakPolarHBondContact O-CG 3.35Å; K767-L771 PolarHBondContact O-N 2.98Å
768	E	53.5	Low	48	Very low	25 Å²	25	78.1 Å²	78.1	12%	0.117	45%	0.452	C	S	.	.	H	α-helix	trans	-75.1	-31.1	179.6	-81.7	173.5	124	0	0	113.3	R733 P764 I765 L771 H772	R733-E768 IonicContact CZ-OE1 3.98Å; R733-E768 VanDerWaalsContact CZ-OE1 3.25Å; R733-E768 IonicContact NE-OE1 3.27Å; R733-E768 PolarHBondContact NE-OE1 2.73Å; R733-E768 IonicContact NH2-OE1 3.21Å; R733-E768 PolarHBondContact NH2-OE1 2.67Å; P764-E768 WeakPolarHBondContact O-CB 3.41Å; P764-E768 PolarHBondContact O-N 3.16Å; I765-E768 PolarHBondContact O-N 3.2Å; E768-L771 PolarHBondContact O-N 3.13Å; E768-H772 WeakPolarHBondContact O-CB 3.27Å; E768-H772 PolarHBondContact O-N 3.32Å; E768-H772 VanDerWaalsContact O-N 3.07Å
769	T	49.8	Very low	48	Very low	37 Å²	37	81.1 Å²	81.1	23%	0.227	47%	0.47	C	S	.	.	H	α-helix	trans	-69.4	-39.5	169.7	-58.7	0	0	0	0	111.6	S736 I765 S766 L771 H772 L773	S736-T769 WeakPolarHBondContact OG-CA 3.12Å; S736-T769 PolarHBondContact OG-OG1 3.37Å; I765-T769 WeakPolarHBondContact O-CB 3.44Å; I765-T769 PolarHBondContact O-N 2.78Å; I765-T769 PolarHBondContact O-OG1 3.04Å; S766-T769 PolarHBondContact O-N 3.44Å; T769-L771 VanDerWaalsContact C-N 3.29Å; T769-L771 PolarHBondContact O-N 3.04Å; T769-H772 PolarHBondContact O-N 3.1Å; T769-L773 HydrophobicContact CG2-CD1 4.03Å; T769-L773 HydrophobicContact CG2-CG 4.48Å; T769-L773 WeakPolarHBondContact O-CG 3.43Å; T769-L773 PolarHBondContact O-N 3.27Å; T769-L773 VanDerWaalsContact O-N 3.08Å
770	I	49.9	Very low	48.3	Very low	121 Å²	121	80 Å²	80	62%	0.621	45%	0.447	S	S	*	.	H	α-helix	trans	-65.2	-30.8	172.6	-71.1	162.8	0	0	0	112	S766 K767	S766-I770 WeakPolarHBondContact O-CB 3.47Å; S766-I770 WeakPolarHBondContact O-CD1 3.36Å; S766-I770 WeakPolarHBondContact O-CG1 3.3Å; S766-I770 PolarHBondContact O-N 3.04Å; K767-I770 PolarHBondContact O-N 3.02Å
771	L	46.7	Very low	48.5	Very low	128 Å²	128	81 Å²	81	67%	0.67	45%	0.446	S	S	*	.	H	α-helix	trans	-79.6	-18.6	174.8	-76.6	165.5	0	0	0	114	K767 E768 T769	K767-L771 HydrophobicContact CG-CD1 4.17Å; K767-L771 WeakPolarHBondContact O-CB 3.3Å; K767-L771 WeakPolarHBondContact O-CD1 3.37Å; K767-L771 VanDerWaalsContact O-CG 3.26Å; K767-L771 WeakPolarHBondContact O-CG 3.35Å; K767-L771 PolarHBondContact O-N 2.98Å; E768-L771 PolarHBondContact O-N 3.13Å; T769-L771 VanDerWaalsContact C-N 3.29Å; T769-L771 PolarHBondContact O-N 3.04Å
772	H	45.9	Very low	48.9	Very low	94 Å²	94	80.3 Å²	80.3	44%	0.435	42%	0.421	S	S	.	.	H	α-helix	trans	-95.1	-21.3	179.3	-114.1	-70.1	0	0	0	114.1	E768 T769	E768-H772 WeakPolarHBondContact O-CB 3.27Å; E768-H772 PolarHBondContact O-N 3.32Å; E768-H772 VanDerWaalsContact O-N 3.07Å; T769-H772 PolarHBondContact O-N 3.1Å
773	L	36.4	Very low	49	Very low	159 Å²	159	74.3 Å²	74.3	83%	0.832	39%	0.388	S	S	*	.			trans	-79.6	0	170.6	-71	169.5	0	0	0	111.7	T769	T769-L773 HydrophobicContact CG2-CD1 4.03Å; T769-L773 HydrophobicContact CG2-CG 4.48Å; T769-L773 WeakPolarHBondContact O-CG 3.43Å; T769-L773 PolarHBondContact O-N 3.27Å; T769-L773 VanDerWaalsContact O-N 3.08Å

Retrieved 773 of 773 residues in 170.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).