A0A087Y8Q3_POEFO Loading...

RAS guanyl releasing protein 4

AlphaFold DB , UniProt , Accession A0A087Y8Q3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 712 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.8	Very low	29.4	Very low	233 Å²	233	174.5 Å²	174.5	100%	1.148	87%	0.866	S	S	*	*				0	167.8	0	-67.3	87.4	92	0	0	110.6
2	N	30.2	Very low	29.1	Very low	161 Å²	161	171.3 Å²	171.3	86%	0.861	86%	0.864	S	S	*	*			trans	26.4	116.1	168	-64.3	5.2	0	0	0	121
3	K	31.5	Very low	29.7	Very low	200 Å²	200	167.6 Å²	167.6	87%	0.87	86%	0.859	S	S	*	*			trans	-83.3	151.6	159.9	-56.1	159.8	179.2	166.4	0	109.7
4	T	29.2	Very low	29.2	Very low	146 Å²	146	161.6 Å²	161.6	90%	0.896	86%	0.86	S	S	*	*			trans	-144.6	140.5	145.8	-9.4	0	0	0	0	111.2
5	K	34	Very low	28.9	Very low	198 Å²	198	155.7 Å²	155.7	86%	0.861	85%	0.853	S	S	*	*			trans	-100.9	157.8	-179.4	-63.5	172.9	174.9	176.6	0	110.7
6	R	25.7	Very low	28.7	Very low	247 Å²	247	157.2 Å²	157.2	93%	0.932	86%	0.858	S	S	*	*			trans	-160.6	120.1	134	-110.9	165	-174.4	-177.5	0.6	114.2
7	K	28	Very low	28.7	Very low	199 Å²	199	159.9 Å²	159.9	87%	0.865	86%	0.86	S	S	*	*			trans	-109.5	170.5	143.2	-89.7	-171	174.5	-172.1	0	105.5
8	P	35.7	Very low	28.5	Very low	113 Å²	113	157.5 Å²	157.5	73%	0.734	86%	0.857	S	S	*	*			cis	-108.6	-168.1	16.9	39	-25.6	0	0	0	113
9	N	26.1	Very low	28.4	Very low	146 Å²	146	159.5 Å²	159.5	78%	0.781	86%	0.856	S	S	*	*			cis	-129.7	179.2	-6.8	-122.2	8.2	0	0	0	107.5
10	A	25.3	Very low	28.3	Very low	82 Å²	82	161.4 Å²	161.4	68%	0.678	86%	0.857	S	S	*	*			cis	87.1	92.9	11	0	0	0	0	0	118.4
11	E	25.3	Very low	28.2	Very low	194 Å²	194	161.5 Å²	161.5	91%	0.907	86%	0.857	S	S	*	*			trans	-144.9	162.1	157	-133.3	171.6	-134.3	0	0	108
12	T	26.8	Very low	27.9	Very low	136 Å²	136	157.2 Å²	157.2	83%	0.834	84%	0.843	S	S	*	*			trans	-159.4	170.1	-164.4	24	0	0	0	0	110.8
13	P	36	Very low	27.7	Very low	124 Å²	124	158 Å²	158	81%	0.805	84%	0.842	S	S	*	*			cis	-136.5	-175.1	8.9	42.1	-24.7	0	0	0	116.3
14	G	23.7	Very low	27.6	Very low	84 Å²	84	159.9 Å²	159.9	87%	0.866	84%	0.843	S	S	*	*			trans	108.1	119.8	137.9	0	0	0	0	0	118.8
15	G	24.9	Very low	27.8	Very low	73 Å²	73	164.1 Å²	164.1	75%	0.753	84%	0.843	S	S	*	*			trans	152.8	81.4	168.2	0	0	0	0	0	115.1
16	L	25.7	Very low	27.7	Very low	179 Å²	179	165.6 Å²	165.6	94%	0.937	84%	0.843	S	S	*	*			trans	-70.9	130.2	179.4	-72.2	85.1	0	0	0	112
17	K	27.7	Very low	28.7	Very low	204 Å²	204	161.5 Å²	161.5	89%	0.887	84%	0.84	S	S	*	*			trans	-113.2	116.6	158.6	-76.1	-175.1	177	176.8	0	109.8
18	S	24.9	Very low	29.2	Very low	116 Å²	116	158 Å²	158	81%	0.811	84%	0.835	S	S	*	*			trans	-67	129.9	-179.6	-177.3	0	0	0	0	111.6	K20	S18-K20 PolarHBondContact O-N 3.03Å
19	K	26.8	Very low	29.5	Very low	195 Å²	195	155.5 Å²	155.5	85%	0.848	82%	0.82	S	S	*	*			trans	-72.6	103.8	170.4	-71.9	-177.4	178	178.8	0	109	L21	K19-L21 PolarHBondContact O-N 3.19Å
20	K	26.5	Very low	30.5	Very low	198 Å²	198	152 Å²	152	86%	0.861	81%	0.805	S	S	*	*			trans	-58	131.3	165.1	-76.3	-173.4	175.2	-178.4	0	109	S18 V22	S18-K20 PolarHBondContact O-N 3.03Å; K20-V22 PolarHBondContact O-N 3.31Å
21	L	25.6	Very low	31.3	Very low	164 Å²	164	150.1 Å²	150.1	86%	0.859	79%	0.787	S	S	*	*			trans	-62	133.1	171.9	-81.4	76.7	0	0	0	109.4	K19 Q23	K19-L21 PolarHBondContact O-N 3.19Å; L21-Q23 PolarHBondContact O-N 3.18Å; L21-Q23 VanDerWaalsContact O-N 3.11Å
22	V	27	Very low	32.3	Very low	142 Å²	142	144.1 Å²	144.1	86%	0.861	77%	0.765	S	S	*	*			trans	-73.5	102.3	167.5	178.8	0	0	0	0	107.7	K20 R24	K20-V22 PolarHBondContact O-N 3.31Å; V22-R24 PolarHBondContact O-N 3.45Å; V22-R24 VanDerWaalsContact O-N 3.16Å
23	Q	26	Very low	33.1	Very low	179 Å²	179	144 Å²	144	84%	0.836	75%	0.754	S	S	*	*			trans	-67.2	111.5	178.1	-167.2	170.3	3.7	0	0	109	L21 R25	L21-Q23 PolarHBondContact O-N 3.18Å; L21-Q23 VanDerWaalsContact O-N 3.11Å; Q23-R25 PolarHBondContact O-N 3.02Å
24	R	29.4	Very low	33.5	Very low	239 Å²	239	141.9 Å²	141.9	90%	0.902	74%	0.737	S	S	*	*			trans	-53.5	112.9	176.1	-79.9	-179.3	169.1	174.6	-4.5	109.2	V22 R26	V22-R24 PolarHBondContact O-N 3.45Å; V22-R24 VanDerWaalsContact O-N 3.16Å; R24-R26 PolarHBondContact O-N 2.95Å
25	R	31.9	Very low	35	Very low	234 Å²	234	139.5 Å²	139.5	88%	0.883	70%	0.704	S	S	*	*			trans	-59.3	133.3	168.2	-72	-173.7	174.6	-164.8	-2	108.1	Q23	Q23-R25 PolarHBondContact O-N 3.02Å
26	R	32.6	Very low	36.4	Very low	229 Å²	229	137.6 Å²	137.6	86%	0.864	68%	0.679	S	S	*	*			trans	-74.2	141.9	168.1	-78.7	-179.3	168.4	174.4	-4.9	108.5	R24 T28	R24-R26 PolarHBondContact O-N 2.95Å; R26-T28 PolarHBondContact O-N 3.33Å
27	N	46.5	Very low	37.6	Very low	162 Å²	162	135 Å²	135	87%	0.866	66%	0.66	S	S	*	*			trans	-77.9	99.6	175.9	-66.9	-7	0	0	0	109.3
28	T	38.9	Very low	38.8	Very low	125 Å²	125	128.9 Å²	128.9	77%	0.767	65%	0.648	S	S	*	*			trans	-115.1	173.3	165.7	53.8	0	0	0	0	109.4	R26	R26-T28 PolarHBondContact O-N 3.33Å
29	C	42.5	Very low	40.3	Very low	61 Å²	61	126.3 Å²	126.3	41%	0.412	63%	0.625	S	S	.	*	P	Polyproline II helix	trans	-52.7	154.2	165.8	-62.3	0	0	0	0	111	S31 K349	C29-S31 PolarHBondContact O-N 3.23Å; C29-K349 VanDerWaalsContact SG-CE 3.54Å; C29-K349 PolarHBondContact SG-NZ 3.14Å
30	P	46.3	Very low	41.2	Very low	71 Å²	71	123.5 Å²	123.5	46%	0.461	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-54.1	138.3	164.3	26.5	-34.7	0	0	0	108.9	D34 I35	P30-D34 HydrophobicContact CB-CB 3.95Å; P30-I35 HydrophobicContact CB-CG1 4.08Å; P30-I35 HydrophobicContact CG-CD1 4.29Å; P30-I35 HydrophobicContact CG-CG1 3.91Å
31	S	41.7	Very low	41.5	Very low	44 Å²	44	118.1 Å²	118.1	31%	0.308	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-68.5	161.1	178.9	70.5	0	0	0	0	110.6	C29 Q33 D34 I35	C29-S31 PolarHBondContact O-N 3.23Å; S31-Q33 PolarHBondContact O-N 3.05Å; S31-Q33 PolarHBondContact OG-N 2.67Å; S31-D34 VanDerWaalsContact CB-OD2 3.31Å; S31-D34 WeakPolarHBondContact CB-OD2 3.22Å; S31-D34 PolarHBondContact N-OD2 3.18Å; S31-D34 WeakPolarHBondContact O-CA 3.47Å; S31-D34 PolarHBondContact O-N 3.38Å; S31-D34 PolarHBondContact OG-N 3.19Å; S31-D34 PolarHBondContact OG-OD2 2.97Å; S31-I35 WeakPolarHBondContact O-CG1 3.32Å; S31-I35 PolarHBondContact O-N 3.49Å
32	P	46.3	Very low	42.3	Very low	67 Å²	67	117 Å²	117	44%	0.435	60%	0.604	S	S	.	*	H	α-helix	trans	-44.6	-36.3	167	-35.5	40.1	0	0	0	113.9	S36 A357	P32-S36 VanDerWaalsContact O-CB 3.22Å; P32-S36 WeakPolarHBondContact O-CB 3.43Å; P32-S36 PolarHBondContact O-N 3.32Å; P32-A357 HydrophobicContact CB-CB 4.16Å
33	Q	43.5	Very low	42.8	Very low	133 Å²	133	115.2 Å²	115.2	62%	0.621	60%	0.598	S	S	*	*	H	α-helix	trans	-74.1	-31	177.4	-59.1	-176.1	1.3	0	0	113.5	S31 K37	S31-Q33 PolarHBondContact O-N 3.05Å; S31-Q33 PolarHBondContact OG-N 2.67Å; Q33-K37 WeakPolarHBondContact O-CB 3.44Å; Q33-K37 VanDerWaalsContact O-CD 3.25Å; Q33-K37 WeakPolarHBondContact O-CD 3.39Å; Q33-K37 WeakPolarHBondContact O-CG 3.42Å; Q33-K37 PolarHBondContact O-N 3.38Å; Q33-K37 VanDerWaalsContact O-N 3.11Å
34	D	45.2	Very low	43.1	Very low	81 Å²	81	111.6 Å²	111.6	43%	0.433	59%	0.593	S	S	.	*	H	α-helix	trans	-77.4	-37.5	175.9	-56.5	-55.3	0	0	0	110.9	P30 S31 K37 A38	P30-D34 HydrophobicContact CB-CB 3.95Å; S31-D34 VanDerWaalsContact CB-OD2 3.31Å; S31-D34 WeakPolarHBondContact CB-OD2 3.22Å; S31-D34 PolarHBondContact N-OD2 3.18Å; S31-D34 WeakPolarHBondContact O-CA 3.47Å; S31-D34 PolarHBondContact O-N 3.38Å; S31-D34 PolarHBondContact OG-N 3.19Å; S31-D34 PolarHBondContact OG-OD2 2.97Å; D34-K37 PolarHBondContact O-N 2.89Å; D34-A38 WeakPolarHBondContact O-CB 3.34Å; D34-A38 PolarHBondContact O-N 2.91Å
35	I	56	Low	43.3	Very low	33 Å²	33	103.2 Å²	103.2	17%	0.169	58%	0.575	C	S	.	*	H	α-helix	trans	-62	-51.4	171.1	-62.9	170.9	0	0	0	109.5	P30 S31 K37 A38 L39 A357	P30-I35 HydrophobicContact CB-CG1 4.08Å; P30-I35 HydrophobicContact CG-CD1 4.29Å; P30-I35 HydrophobicContact CG-CG1 3.91Å; S31-I35 WeakPolarHBondContact O-CG1 3.32Å; S31-I35 PolarHBondContact O-N 3.49Å; I35-K37 VanDerWaalsContact C-N 3.3Å; I35-K37 PolarHBondContact O-N 2.97Å; I35-A38 PolarHBondContact O-N 2.87Å; I35-L39 HydrophobicContact CG2-CD1 4.04Å; I35-L39 HydrophobicContact CG2-CG 4.46Å; I35-L39 WeakPolarHBondContact O-CG 3.37Å; I35-L39 PolarHBondContact O-N 3.31Å; I35-A357 HydrophobicContact CB-CB 4.09Å; I35-A357 HydrophobicContact CD1-CB 4.19Å; I35-A357 HydrophobicContact CG2-CB 3.89Å
36	S	53.9	Low	43.5	Very low	34 Å²	34	97.7 Å²	97.7	24%	0.238	57%	0.569	C	S	.	*	H	α-helix	trans	-56.8	-41.8	178	-172.7	0	0	0	0	112.2	P32 L39 Q40	P32-S36 VanDerWaalsContact O-CB 3.22Å; P32-S36 WeakPolarHBondContact O-CB 3.43Å; P32-S36 PolarHBondContact O-N 3.32Å; S36-L39 PolarHBondContact O-N 3.25Å; S36-Q40 WeakPolarHBondContact O-CG 3.42Å; S36-Q40 PolarHBondContact O-N 2.98Å; S36-Q40 PolarHBondContact O-NE2 2.96Å; S36-Q40 PolarHBondContact OG-NE2 3.11Å; S36-Q40 VanDerWaalsContact OG-NE2 3.09Å
37	K	51.1	Low	43.9	Very low	123 Å²	123	92 Å²	92	54%	0.535	57%	0.565	S	S	.	*	H	α-helix	trans	-66.9	-36.4	174.7	-73.5	163.7	-165.7	159.8	0	113.4	Q33 D34 I35 L39 Q40	Q33-K37 WeakPolarHBondContact O-CB 3.44Å; Q33-K37 VanDerWaalsContact O-CD 3.25Å; Q33-K37 WeakPolarHBondContact O-CD 3.39Å; Q33-K37 WeakPolarHBondContact O-CG 3.42Å; Q33-K37 PolarHBondContact O-N 3.38Å; Q33-K37 VanDerWaalsContact O-N 3.11Å; D34-K37 PolarHBondContact O-N 2.89Å; I35-K37 VanDerWaalsContact C-N 3.3Å; I35-K37 PolarHBondContact O-N 2.97Å; K37-L39 VanDerWaalsContact C-N 3.33Å; K37-Q40 PolarHBondContact O-N 3.16Å
38	A	53.1	Low	44.5	Very low	77 Å²	77	86.9 Å²	86.9	64%	0.636	55%	0.545	S	S	*	.	H	α-helix	trans	-67.7	-33.9	176.2	0	0	0	0	0	112.3	D34 I35 Q40	D34-A38 WeakPolarHBondContact O-CB 3.34Å; D34-A38 PolarHBondContact O-N 2.91Å; I35-A38 PolarHBondContact O-N 2.87Å; A38-Q40 VanDerWaalsContact C-N 3.32Å
39	L	54.4	Low	46	Very low	62 Å²	62	82.7 Å²	82.7	33%	0.325	52%	0.52	S	S	.	.	H	α-helix	trans	-77	-13.8	175.7	-62.8	176.5	0	0	0	113.6	I35 S36 K37 S41 L358	I35-L39 HydrophobicContact CG2-CD1 4.04Å; I35-L39 HydrophobicContact CG2-CG 4.46Å; I35-L39 WeakPolarHBondContact O-CG 3.37Å; I35-L39 PolarHBondContact O-N 3.31Å; S36-L39 PolarHBondContact O-N 3.25Å; K37-L39 VanDerWaalsContact C-N 3.33Å; L39-S41 PolarHBondContact O-N 3.02Å; L39-L358 HydrophobicContact CD1-CD1 4.09Å; L39-L358 HydrophobicContact CD1-CD2 4.49Å
40	Q	45.8	Very low	47.9	Very low	136 Å²	136	80.6 Å²	80.6	64%	0.636	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	23.8	178.8	-75.7	165.9	35.5	0	0	114.1	S36 K37 A38	S36-Q40 WeakPolarHBondContact O-CG 3.42Å; S36-Q40 PolarHBondContact O-N 2.98Å; S36-Q40 PolarHBondContact O-NE2 2.96Å; S36-Q40 PolarHBondContact OG-NE2 3.11Å; S36-Q40 VanDerWaalsContact OG-NE2 3.09Å; K37-Q40 PolarHBondContact O-N 3.16Å; A38-Q40 VanDerWaalsContact C-N 3.32Å
41	S	33.5	Very low	49.9	Very low	85 Å²	85	77.2 Å²	77.2	59%	0.594	49%	0.485	S	S	*	.	S	Bend	trans	-68.5	141.5	168.9	64	0	0	0	0	111	L39 S43	L39-S41 PolarHBondContact O-N 3.02Å; S41-S43 PolarHBondContact O-N 3.35Å
42	P	42.4	Very low	52.2	Low	140 Å²	140	76.3 Å²	76.3	91%	0.909	48%	0.479	S	S	*	.	S	Bend	trans	-76.9	98.1	-161.7	29.6	-36.3	0	0	0	113.6
43	S	37.8	Very low	54.3	Low	104 Å²	104	74.4 Å²	74.4	73%	0.727	47%	0.465	S	S	*	.			trans	-149.1	130.3	167.8	-175.1	0	0	0	0	111.7	S41	S41-S43 PolarHBondContact O-N 3.35Å
44	S	33.1	Very low	56.5	Low	104 Å²	104	70.6 Å²	70.6	73%	0.727	45%	0.449	S	S	*	.	S	Bend	trans	71.9	151.9	-175.9	80.9	0	0	0	0	116.6
45	A	31.9	Very low	58.7	Low	63 Å²	63	70.9 Å²	70.9	52%	0.521	45%	0.448	S	S	.	.			trans	-88.5	147.8	-171.5	0	0	0	0	0	112.4	S47 A48	A45-S47 PolarHBondContact O-N 2.82Å; A45-A48 WeakPolarHBondContact O-CB 3.27Å; A45-A48 PolarHBondContact O-N 2.81Å
46	P	37.6	Very low	60.3	Low	117 Å²	117	69.4 Å²	69.4	76%	0.76	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-14.1	-170.3	24.8	-35.1	0	0	0	115.3	A48 S49	P46-A48 VanDerWaalsContact C-N 3.32Å; P46-S49 PolarHBondContact O-OG 3.04Å; P46-S49 VanDerWaalsContact O-OG 3.05Å
47	S	41.3	Very low	62.1	Low	111 Å²	111	67.8 Å²	67.8	78%	0.776	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-6.9	173.5	-164.4	0	0	0	0	113.9	A45	A45-S47 PolarHBondContact O-N 2.82Å
48	A	57.7	Low	63.9	Low	54 Å²	54	64.2 Å²	64.2	45%	0.446	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-21.1	179.1	0	0	0	0	0	113.3	A45 P46 A50	A45-A48 WeakPolarHBondContact O-CB 3.27Å; A45-A48 PolarHBondContact O-N 2.81Å; P46-A48 VanDerWaalsContact C-N 3.32Å; A48-A50 PolarHBondContact O-N 3.35Å
49	S	71	Confident	65.7	Low	37 Å²	37	64 Å²	64	26%	0.259	40%	0.397	S	S	.	.	S	Bend	trans	-76	-4.3	-177.2	43.8	0	0	0	0	115	P46 L369	P46-S49 PolarHBondContact O-OG 3.04Å; P46-S49 VanDerWaalsContact O-OG 3.05Å; S49-L369 WeakPolarHBondContact O-CB 3.07Å; S49-L369 PolarHBondContact O-N 2.72Å
50	A	82.3	Confident	67.4	Low	16 Å²	16	61 Å²	61	13%	0.132	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	154.5	179.8	0	0	0	0	0	111.2	A48 R59 I362 K366 I367	A48-A50 PolarHBondContact O-N 3.35Å; A50-R59 PolarHBondContact O-NH1 2.97Å; A50-R59 PolarHBondContact O-NH2 3.13Å; A50-I362 HydrophobicContact CB-CD1 4.15Å; A50-K366 HydrophobicContact CB-CB 4.34Å; A50-K366 HydrophobicContact CB-CD 4.41Å; A50-I367 WeakPolarHBondContact CA-O 3.18Å
51	A	87.4	Confident	69.4	Low	0 Å²	0	54.5 Å²	54.5	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	150.5	170.1	0	0	0	0	0	110.1	E55 L56 K366 I367 L369	A51-E55 HydrophobicContact CB-CB 4.03Å; A51-L56 HydrophobicContact CB-CB 4.29Å; A51-K366 CarbonylContact O-C 3.55Å; A51-K366 WeakPolarHBondContact O-CA 3.4Å; A51-I367 PolarHBondContact N-O 3.12Å; A51-I367 WeakPolarHBondContact O-CB 3.44Å; A51-I367 PolarHBondContact O-N 3.02Å; A51-L369 HydrophobicContact CB-CD1 3.79Å; A51-L369 HydrophobicContact CB-CD2 4.36Å; A51-L369 HydrophobicContact CB-CG 4.23Å
52	S	91.1	Very high	72	Confident	26 Å²	26	55.2 Å²	55.2	18%	0.182	35%	0.348	C	S	.	.			trans	-68.4	163.1	157.1	66.3	0	0	0	0	110.5	D54 E55 L56	S52-D54 PolarHBondContact O-N 3.03Å; S52-E55 PolarHBondContact O-N 3.31Å; S52-E55 WeakPolarHBondContact OG-CB 3.2Å; S52-E55 WeakPolarHBondContact OG-CG 3.44Å; S52-E55 PolarHBondContact OG-N 2.82Å; S52-E55 VanDerWaalsContact OG-N 3.09Å; S52-L56 WeakPolarHBondContact O-CB 3.33Å; S52-L56 PolarHBondContact O-N 3.42Å
53	L	89.5	Confident	74.1	Confident	26 Å²	26	49.9 Å²	49.9	14%	0.136	31%	0.313	C	S	.	.	H	α-helix	trans	-54.8	-41.5	172.2	175.6	60.6	0	0	0	111.7	L56 I57 V90 F95 K98 I367	L53-L56 PolarHBondContact O-N 3.48Å; L53-I57 HydrophobicContact CD1-CD1 3.96Å; L53-I57 HydrophobicContact CD1-CG1 4.34Å; L53-I57 HydrophobicContact CG-CD1 4.04Å; L53-I57 WeakPolarHBondContact O-CG1 3.49Å; L53-I57 PolarHBondContact O-N 3.36Å; L53-V90 HydrophobicContact CD1-CG1 4.34Å; L53-V90 HydrophobicContact CD1-CG2 4.31Å; L53-V90 HydrophobicContact CD2-CG1 3.81Å; L53-V90 HydrophobicContact CD2-CG2 4.3Å; L53-F95 HydrophobicContact CD1-CD2 3.9Å; L53-F95 HydrophobicContact CD1-CE2 4.37Å; L53-K98 HydrophobicContact CD2-CG 3.85Å; L53-K98 HydrophobicContact CG-CG 4.45Å; L53-I367 HydrophobicContact CB-CD1 4.22Å
54	D	90.5	Very high	76.4	Confident	54 Å²	54	45.2 Å²	45.2	29%	0.289	28%	0.28	S	S	.	.	H	α-helix	trans	-66.9	-44.9	-178.9	-69.5	-5.7	0	0	0	111.3	S52 L56 I57 Q58 K98 F102	S52-D54 PolarHBondContact O-N 3.03Å; D54-L56 VanDerWaalsContact C-N 3.33Å; D54-L56 PolarHBondContact O-N 3.29Å; D54-I57 PolarHBondContact O-N 3.46Å; D54-Q58 WeakPolarHBondContact O-CB 3.41Å; D54-Q58 WeakPolarHBondContact O-CG 3.46Å; D54-Q58 PolarHBondContact O-N 3.18Å; D54-K98 WeakPolarHBondContact OD1-CD 3.42Å; D54-K98 WeakPolarHBondContact OD1-CE 3.45Å; D54-K98 IonicContact OD1-NZ 2.61Å; D54-K98 PolarHBondContact OD1-NZ 3.15Å; D54-K98 IonicContact OD2-NZ 2.69Å; D54-K98 PolarHBondContact OD2-NZ 3.32Å; D54-F102 HydrophobicContact CB-CZ 3.88Å
55	E	90.7	Very high	78.6	Confident	86 Å²	86	42.9 Å²	42.9	40%	0.402	26%	0.259	S	S	.	.	H	α-helix	trans	-59.3	-42.9	171	-80.1	179.8	-126.9	0	0	112.2	A51 S52 Q58 R59	A51-E55 HydrophobicContact CB-CB 4.03Å; S52-E55 PolarHBondContact O-N 3.31Å; S52-E55 WeakPolarHBondContact OG-CB 3.2Å; S52-E55 WeakPolarHBondContact OG-CG 3.44Å; S52-E55 PolarHBondContact OG-N 2.82Å; S52-E55 VanDerWaalsContact OG-N 3.09Å; E55-Q58 PolarHBondContact O-N 3.42Å; E55-R59 WeakPolarHBondContact O-CB 3.43Å; E55-R59 WeakPolarHBondContact O-CG 3.4Å; E55-R59 PolarHBondContact O-N 2.99Å; E55-R59 IonicContact OE2-CZ 3.64Å; E55-R59 IonicContact OE2-NE 3.85Å; E55-R59 IonicContact OE2-NH2 2.69Å; E55-R59 PolarHBondContact OE2-NH2 2.69Å
56	L	90.4	Very high	80.4	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-64.9	-42.7	-177.9	-175.7	59.5	0	0	0	111.6	A51 S52 L53 D54 R59 C60 L78 T82 L369	A51-L56 HydrophobicContact CB-CB 4.29Å; S52-L56 WeakPolarHBondContact O-CB 3.33Å; S52-L56 PolarHBondContact O-N 3.42Å; L53-L56 PolarHBondContact O-N 3.48Å; D54-L56 VanDerWaalsContact C-N 3.33Å; D54-L56 PolarHBondContact O-N 3.29Å; L56-R59 PolarHBondContact O-N 3.46Å; L56-C60 PolarHBondContact O-N 3.09Å; L56-C60 PolarHBondContact O-SG 2.96Å; L56-L78 HydrophobicContact CD1-CD1 4.2Å; L56-T82 HydrophobicContact CD1-CG2 4.47Å; L56-T82 HydrophobicContact CD2-CG2 3.9Å; L56-T82 HydrophobicContact CG-CG2 3.89Å; L56-L369 HydrophobicContact CD1-CD2 3.9Å; L56-L369 HydrophobicContact CD2-CD2 4.02Å
57	I	90.9	Very high	81.9	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.1	-46.8	172.9	-70	168	0	0	0	110.4	L53 D54 R59 C60 L61 F95 K98 L99 F102	L53-I57 HydrophobicContact CD1-CD1 3.96Å; L53-I57 HydrophobicContact CD1-CG1 4.34Å; L53-I57 HydrophobicContact CG-CD1 4.04Å; L53-I57 WeakPolarHBondContact O-CG1 3.49Å; L53-I57 PolarHBondContact O-N 3.36Å; D54-I57 PolarHBondContact O-N 3.46Å; I57-R59 PolarHBondContact O-N 3.32Å; I57-C60 WeakPolarHBondContact O-CB 3.44Å; I57-C60 PolarHBondContact O-N 3.32Å; I57-C60 VanDerWaalsContact O-N 3.1Å; I57-L61 HydrophobicContact CG2-CD1 3.95Å; I57-L61 HydrophobicContact CG2-CG 4.3Å; I57-L61 WeakPolarHBondContact O-CG 3.25Å; I57-L61 PolarHBondContact O-N 3.06Å; I57-F95 HydrophobicContact CD1-CD2 4.21Å; I57-F95 HydrophobicContact CD1-CE2 4.17Å; I57-F95 HydrophobicContact CG1-CD2 4.26Å; I57-F95 HydrophobicContact CG1-CE2 3.71Å; I57-F95 HydrophobicContact CG1-CZ 3.99Å; I57-K98 HydrophobicContact CD1-CB 3.65Å; I57-K98 HydrophobicContact CD1-CG 4.49Å; I57-L99 HydrophobicContact CG2-CD2 3.64Å; I57-F102 HydrophobicContact CB-CE2 4.03Å; I57-F102 HydrophobicContact CD1-CE2 4.3Å; I57-F102 HydrophobicContact CG2-CD2 3.73Å; I57-F102 HydrophobicContact CG2-CE2 3.69Å
58	Q	90.4	Very high	83.2	Confident	48 Å²	48	40 Å²	40	22%	0.224	23%	0.226	C	C	.	.	H	α-helix	trans	-63	-38.9	178.3	-68.3	-67.7	-43.4	0	0	112.4	D54 E55 C60 L61 N62 F102	D54-Q58 WeakPolarHBondContact O-CB 3.41Å; D54-Q58 WeakPolarHBondContact O-CG 3.46Å; D54-Q58 PolarHBondContact O-N 3.18Å; E55-Q58 PolarHBondContact O-N 3.42Å; Q58-C60 VanDerWaalsContact C-N 3.32Å; Q58-C60 PolarHBondContact O-N 3.24Å; Q58-L61 PolarHBondContact O-N 3.38Å; Q58-N62 WeakPolarHBondContact O-CB 3.43Å; Q58-N62 PolarHBondContact O-N 2.99Å; Q58-N62 PolarHBondContact O-ND2 3.31Å; Q58-N62 PolarHBondContact O-OD1 3.33Å; Q58-F102 HydrophobicContact CG-CE1 4.33Å; Q58-F102 HydrophobicContact CG-CZ 4.11Å
59	R	90.1	Very high	84.1	Confident	72 Å²	72	43.8 Å²	43.8	27%	0.272	23%	0.232	S	C	.	.	H	α-helix	trans	-61.4	-39.2	172.4	-69.6	169.2	-163.5	-164.7	10.8	111.2	A50 E55 L56 I57 C63 L78	A50-R59 PolarHBondContact O-NH1 2.97Å; A50-R59 PolarHBondContact O-NH2 3.13Å; E55-R59 WeakPolarHBondContact O-CB 3.43Å; E55-R59 WeakPolarHBondContact O-CG 3.4Å; E55-R59 PolarHBondContact O-N 2.99Å; E55-R59 IonicContact OE2-CZ 3.64Å; E55-R59 IonicContact OE2-NE 3.85Å; E55-R59 IonicContact OE2-NH2 2.69Å; E55-R59 PolarHBondContact OE2-NH2 2.69Å; L56-R59 PolarHBondContact O-N 3.46Å; I57-R59 PolarHBondContact O-N 3.32Å; R59-C63 PolarHBondContact O-SG 3.11Å; R59-L78 HydrophobicContact CB-CD2 4.15Å
60	C	89.9	Confident	84.5	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-67.8	-48.3	175.9	-69.7	0	0	0	0	112.9	L56 I57 Q58 N62 C63 F64 V79 T82 L121	L56-C60 PolarHBondContact O-N 3.09Å; L56-C60 PolarHBondContact O-SG 2.96Å; I57-C60 WeakPolarHBondContact O-CB 3.44Å; I57-C60 PolarHBondContact O-N 3.32Å; I57-C60 VanDerWaalsContact O-N 3.1Å; Q58-C60 VanDerWaalsContact C-N 3.32Å; Q58-C60 PolarHBondContact O-N 3.24Å; C60-N62 VanDerWaalsContact C-N 3.27Å; C60-N62 PolarHBondContact O-N 3.23Å; C60-C63 WeakPolarHBondContact O-CB 3.48Å; C60-C63 PolarHBondContact O-N 3.22Å; C60-F64 WeakPolarHBondContact O-CD2 3.16Å; C60-V79 HydrophobicContact CB-CG2 3.87Å; C60-T82 PolarHBondContact SG-OG1 3.03Å; C60-T82 VanDerWaalsContact SG-OG1 3.33Å; C60-L121 HydrophobicContact CB-CD1 4.46Å; C60-L121 HydrophobicContact CB-CD2 4.44Å
61	L	88	Confident	84	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.9	-38.6	178.1	-67.1	173	0	0	0	111.8	I57 Q58 C63 F64 Q117 I118 L121	I57-L61 HydrophobicContact CG2-CD1 3.95Å; I57-L61 HydrophobicContact CG2-CG 4.3Å; I57-L61 WeakPolarHBondContact O-CG 3.25Å; I57-L61 PolarHBondContact O-N 3.06Å; Q58-L61 PolarHBondContact O-N 3.38Å; L61-C63 PolarHBondContact O-N 3.09Å; L61-C63 VanDerWaalsContact O-N 3.11Å; L61-F64 PolarHBondContact O-N 2.9Å; L61-Q117 HydrophobicContact CB-CB 4.39Å; L61-Q117 HydrophobicContact CD2-CB 4.07Å; L61-Q117 VanDerWaalsContact O-CD 3.24Å; L61-Q117 PolarHBondContact O-NE2 2.98Å; L61-I118 HydrophobicContact CD1-CG1 3.93Å; L61-I118 HydrophobicContact CD2-CB 4.3Å; L61-I118 HydrophobicContact CD2-CG1 3.62Å; L61-I118 HydrophobicContact CG-CG1 4.46Å; L61-L121 HydrophobicContact CD2-CB 4.17Å; L61-L121 HydrophobicContact CD2-CD2 3.73Å; L61-L121 HydrophobicContact CG-CD2 4.3Å
62	N	88.3	Confident	83.7	Confident	100 Å²	100	51.5 Å²	51.5	54%	0.535	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-7.1	175.7	-68.5	-9.8	0	0	0	114.5	Q58 C60 R114	Q58-N62 WeakPolarHBondContact O-CB 3.43Å; Q58-N62 PolarHBondContact O-N 2.99Å; Q58-N62 PolarHBondContact O-ND2 3.31Å; Q58-N62 PolarHBondContact O-OD1 3.33Å; C60-N62 VanDerWaalsContact C-N 3.27Å; C60-N62 PolarHBondContact O-N 3.23Å; N62-R114 VanDerWaalsContact OD1-CZ 3.29Å; N62-R114 PolarHBondContact OD1-NH1 3.47Å; N62-R114 PolarHBondContact OD1-NH2 2.85Å
63	C	86.9	Confident	83.1	Confident	27 Å²	27	55.2 Å²	55.2	18%	0.182	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-4.3	177.9	-65.2	0	0	0	0	114.2	R59 C60 L61 M70 G75 V79	R59-C63 PolarHBondContact O-SG 3.11Å; C60-C63 WeakPolarHBondContact O-CB 3.48Å; C60-C63 PolarHBondContact O-N 3.22Å; L61-C63 PolarHBondContact O-N 3.09Å; L61-C63 VanDerWaalsContact O-N 3.11Å; C63-M70 HydrophobicContact CB-CE 3.45Å; C63-M70 VanDerWaalsContact CB-CE 3.45Å; C63-G75 VanDerWaalsContact SG-CA 3.53Å; C63-V79 HydrophobicContact CB-CG2 4.16Å
64	F	84.9	Confident	82.7	Confident	7 Å²	7	64 Å²	64	3%	0.031	34%	0.336	C	S	.	.			trans	-103.9	135.7	176.7	-65.3	-94.8	0	0	0	110.9	C60 L61 K69 M70 V79 Q117 H120 L121 Q124	C60-F64 WeakPolarHBondContact O-CD2 3.16Å; L61-F64 PolarHBondContact O-N 2.9Å; F64-K69 WeakPolarHBondContact CA-O 3.44Å; F64-M70 HydrophobicContact CD1-CG 3.92Å; F64-M70 HydrophobicContact CD1-SD 4.5Å; F64-M70 HydrophobicContact CD2-CE 4.44Å; F64-M70 HydrophobicContact CE1-CG 3.88Å; F64-M70 HydrophobicContact CE1-SD 3.95Å; F64-M70 HydrophobicContact CE2-CE 4.14Å; F64-M70 HydrophobicContact CZ-CE 4.18Å; F64-M70 HydrophobicContact CZ-CG 4.42Å; F64-M70 HydrophobicContact CZ-SD 3.96Å; F64-V79 HydrophobicContact CE2-CG1 4.28Å; F64-V79 HydrophobicContact CE2-CG2 4.03Å; F64-V79 HydrophobicContact CZ-CG1 4.13Å; F64-Q117 HydrophobicContact CB-CG 4.07Å; F64-Q117 PolarHBondContact O-NE2 3.16Å; F64-H120 HydrophobicContact CD1-CB 3.86Å; F64-H120 HydrophobicContact CE1-CB 4.05Å; F64-H120 HydrophobicContact CG-CB 4.48Å; F64-L121 HydrophobicContact CE2-CB 4Å; F64-L121 HydrophobicContact CE2-CD1 3.91Å; F64-L121 HydrophobicContact CZ-CB 4.23Å; F64-L121 HydrophobicContact CZ-CD1 4.18Å; F64-Q124 HydrophobicContact CZ-CB 4.46Å
65	D	79.9	Confident	82.3	Confident	54 Å²	54	61.7 Å²	61.7	29%	0.289	33%	0.325	S	S	.	.			trans	-80.8	-176.4	169	64.4	32.1	0	0	0	112.5	E67 G68 K69	D65-E67 PolarHBondContact O-N 3.38Å; D65-E67 WeakPolarHBondContact OD1-CA 3.22Å; D65-E67 WeakPolarHBondContact OD1-CB 3.3Å; D65-E67 PolarHBondContact OD1-N 3.44Å; D65-G68 PolarHBondContact O-N 3.17Å; D65-G68 VanDerWaalsContact O-N 3.17Å; D65-G68 PolarHBondContact OD1-N 3.11Å; D65-K69 PolarHBondContact N-O 3.25Å; D65-K69 PolarHBondContact OD1-N 2.97Å; D65-K69 WeakPolarHBondContact OD2-CB 3.37Å
66	S	69.4	Low	82	Confident	80 Å²	80	59.9 Å²	59.9	56%	0.559	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-18.1	-179.6	56.4	0	0	0	0	114.2
67	E	68.7	Low	81.9	Confident	134 Å²	134	63.9 Å²	63.9	63%	0.626	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	5	178.3	-55	-65.3	115.4	0	0	111.6	D65 K69	D65-E67 PolarHBondContact O-N 3.38Å; D65-E67 WeakPolarHBondContact OD1-CA 3.22Å; D65-E67 WeakPolarHBondContact OD1-CB 3.3Å; D65-E67 PolarHBondContact OD1-N 3.44Å; E67-K69 VanDerWaalsContact C-N 3.27Å; E67-K69 HydrophobicContact CB-CD 4.4Å; E67-K69 PolarHBondContact O-N 3.29Å
68	G	69.6	Low	81.8	Confident	16 Å²	16	66 Å²	66	17%	0.165	35%	0.352	C	S	.	.	S	Bend	trans	72.6	13.2	-176.5	0	0	0	0	0	114.9	D65 H120	D65-G68 PolarHBondContact O-N 3.17Å; D65-G68 VanDerWaalsContact O-N 3.17Å; D65-G68 PolarHBondContact OD1-N 3.11Å; G68-H120 WeakPolarHBondContact CA-CD2 3.47Å; G68-H120 VanDerWaalsContact CA-CG 3.47Å; G68-H120 WeakPolarHBondContact CA-NE2 3.44Å
69	K	76.1	Confident	81.8	Confident	135 Å²	135	63.9 Å²	63.9	59%	0.587	34%	0.341	S	S	*	.			trans	-87.2	157.5	176.6	-65.1	167.5	-173	159.6	0	110.2	F64 D65 E67 P71	F64-K69 WeakPolarHBondContact CA-O 3.44Å; D65-K69 PolarHBondContact N-O 3.25Å; D65-K69 PolarHBondContact OD1-N 2.97Å; D65-K69 WeakPolarHBondContact OD2-CB 3.37Å; E67-K69 VanDerWaalsContact C-N 3.27Å; E67-K69 HydrophobicContact CB-CD 4.4Å; E67-K69 PolarHBondContact O-N 3.29Å; K69-P71 WeakPolarHBondContact O-CD 3.38Å
70	M	79.9	Confident	81.9	Confident	42 Å²	42	62.6 Å²	62.6	21%	0.207	34%	0.339	C	S	.	.			trans	-112.6	89.6	-179.8	-60.3	-161	81.5	0	0	109.9	C63 F64 S72 G75 V79	C63-M70 HydrophobicContact CB-CE 3.45Å; C63-M70 VanDerWaalsContact CB-CE 3.45Å; F64-M70 HydrophobicContact CD1-CG 3.92Å; F64-M70 HydrophobicContact CD1-SD 4.5Å; F64-M70 HydrophobicContact CD2-CE 4.44Å; F64-M70 HydrophobicContact CE1-CG 3.88Å; F64-M70 HydrophobicContact CE1-SD 3.95Å; F64-M70 HydrophobicContact CE2-CE 4.14Å; F64-M70 HydrophobicContact CZ-CE 4.18Å; F64-M70 HydrophobicContact CZ-CG 4.42Å; F64-M70 HydrophobicContact CZ-SD 3.96Å; M70-S72 PolarHBondContact O-N 3.13Å; M70-G75 WeakPolarHBondContact CE-O 3.35Å; M70-V79 HydrophobicContact CE-CB 3.81Å; M70-V79 HydrophobicContact CE-CG1 4.41Å; M70-V79 HydrophobicContact CE-CG2 3.46Å; M70-V79 VanDerWaalsContact CE-CG2 3.46Å; M70-V79 HydrophobicContact SD-CB 4.4Å
71	P	70.9	Confident	82	Confident	111 Å²	111	63 Å²	63	72%	0.721	34%	0.34	S	S	*	.			trans	-70.5	-12.3	-173.8	27.4	-35.7	0	0	0	114.1	K69	K69-P71 WeakPolarHBondContact O-CD 3.38Å
72	S	81.1	Confident	82.2	Confident	61 Å²	61	63 Å²	63	43%	0.427	34%	0.341	S	S	.	.			trans	-111.4	121.1	-179.2	178	0	0	0	0	111.8	M70 R74 G75 S76	M70-S72 PolarHBondContact O-N 3.13Å; S72-R74 VanDerWaalsContact C-N 3.26Å; S72-R74 PolarHBondContact O-N 3.42Å; S72-R74 PolarHBondContact OG-N 3.38Å; S72-G75 WeakPolarHBondContact O-CA 3.36Å; S72-G75 PolarHBondContact O-N 2.94Å; S72-G75 PolarHBondContact OG-N 2.96Å; S72-S76 PolarHBondContact O-N 2.9Å
73	S	80	Confident	82.4	Confident	105 Å²	105	58.3 Å²	58.3	73%	0.734	32%	0.316	S	S	*	.	H	α-helix	trans	-55	-40	171.6	168.4	0	0	0	0	112.3	G75 S76 Q77	S73-G75 VanDerWaalsContact C-N 3.35Å; S73-G75 PolarHBondContact O-N 3.18Å; S73-S76 PolarHBondContact O-N 2.96Å; S73-Q77 PolarHBondContact O-N 3.47Å
74	R	80.1	Confident	82.6	Confident	210 Å²	210	57.1 Å²	57.1	79%	0.792	31%	0.307	S	S	*	.	H	α-helix	trans	-64.9	-36.2	173.3	-82.1	-176.4	166.3	-175.3	-4.1	112.8	S72 L78	S72-R74 VanDerWaalsContact C-N 3.26Å; S72-R74 PolarHBondContact O-N 3.42Å; S72-R74 PolarHBondContact OG-N 3.38Å; R74-L78 WeakPolarHBondContact O-CB 3.23Å; R74-L78 PolarHBondContact O-N 3.47Å
75	G	81.8	Confident	82.9	Confident	5 Å²	5	56.8 Å²	56.8	5%	0.052	31%	0.306	C	S	.	.	H	α-helix	trans	-66.9	-43.9	175.2	0	0	0	0	0	111.9	C63 M70 S72 S73 L78 V79	C63-G75 VanDerWaalsContact SG-CA 3.53Å; M70-G75 WeakPolarHBondContact CE-O 3.35Å; S72-G75 WeakPolarHBondContact O-CA 3.36Å; S72-G75 PolarHBondContact O-N 2.94Å; S72-G75 PolarHBondContact OG-N 2.96Å; S73-G75 VanDerWaalsContact C-N 3.35Å; S73-G75 PolarHBondContact O-N 3.18Å; G75-L78 PolarHBondContact O-N 3.47Å; G75-V79 PolarHBondContact O-N 3.48Å
76	S	85.9	Confident	83.4	Confident	49 Å²	49	54.6 Å²	54.6	34%	0.343	29%	0.294	S	S	.	.	H	α-helix	trans	-60.4	-44.4	174.4	-173.7	0	0	0	0	112.1	S72 S73 V79 H80	S72-S76 PolarHBondContact O-N 2.9Å; S73-S76 PolarHBondContact O-N 2.96Å; S76-V79 PolarHBondContact O-N 3.45Å; S76-H80 WeakPolarHBondContact O-CB 3.46Å; S76-H80 PolarHBondContact O-N 3.32Å
77	Q	87.2	Confident	84.4	Confident	86 Å²	86	51 Å²	51	40%	0.402	27%	0.269	S	S	.	.	H	α-helix	trans	-62.7	-42.2	174.7	-169.3	-178.8	19.5	0	0	112.3	S73 M81 Y376	S73-Q77 PolarHBondContact O-N 3.47Å; Q77-M81 WeakPolarHBondContact O-CB 3.45Å; Q77-M81 PolarHBondContact O-N 3.39Å; Q77-Y376 HydrophobicContact CG-CE1 4.08Å
78	L	89.2	Confident	85.3	Confident	45 Å²	45	45.7 Å²	45.7	24%	0.236	24%	0.243	C	C	.	.	H	α-helix	trans	-62.7	-42.8	176.8	174.8	61.3	0	0	0	112.2	L56 R59 R74 G75 M81 T82	L56-L78 HydrophobicContact CD1-CD1 4.2Å; R59-L78 HydrophobicContact CB-CD2 4.15Å; R74-L78 WeakPolarHBondContact O-CB 3.23Å; R74-L78 PolarHBondContact O-N 3.47Å; G75-L78 PolarHBondContact O-N 3.47Å; L78-M81 HydrophobicContact CD1-CE 3.92Å; L78-T82 WeakPolarHBondContact O-CB 3.48Å; L78-T82 PolarHBondContact O-N 3.38Å; L78-T82 PolarHBondContact O-OG1 2.79Å
79	V	90.1	Very high	86.2	Confident	2 Å²	2	46 Å²	46	1%	0.012	24%	0.242	C	C	.	.	H	α-helix	trans	-68	-48.5	177.5	168.6	0	0	0	0	110.7	C60 C63 F64 M70 G75 S76 M81 T82 L83 L121	C60-V79 HydrophobicContact CB-CG2 3.87Å; C63-V79 HydrophobicContact CB-CG2 4.16Å; F64-V79 HydrophobicContact CE2-CG1 4.28Å; F64-V79 HydrophobicContact CE2-CG2 4.03Å; F64-V79 HydrophobicContact CZ-CG1 4.13Å; M70-V79 HydrophobicContact CE-CB 3.81Å; M70-V79 HydrophobicContact CE-CG1 4.41Å; M70-V79 HydrophobicContact CE-CG2 3.46Å; M70-V79 VanDerWaalsContact CE-CG2 3.46Å; M70-V79 HydrophobicContact SD-CB 4.4Å; G75-V79 PolarHBondContact O-N 3.48Å; S76-V79 PolarHBondContact O-N 3.45Å; V79-M81 VanDerWaalsContact C-N 3.31Å; V79-M81 PolarHBondContact O-N 3.27Å; V79-T82 PolarHBondContact O-N 2.96Å; V79-T82 VanDerWaalsContact O-N 3.14Å; V79-L83 HydrophobicContact CG1-CD1 3.63Å; V79-L83 HydrophobicContact CG1-CG 4.11Å; V79-L83 WeakPolarHBondContact O-CB 3.42Å; V79-L83 VanDerWaalsContact O-CG 3.29Å; V79-L83 WeakPolarHBondContact O-CG 3.43Å; V79-L83 PolarHBondContact O-N 2.92Å; V79-L121 HydrophobicContact CG1-CD1 3.72Å
80	H	91.3	Very high	86.8	Confident	46 Å²	46	40.1 Å²	40.1	21%	0.213	22%	0.217	C	C	.	.	H	α-helix	trans	-61.2	-38.7	176.9	-173.7	-53.5	0	0	0	112.1	S76 M84 F129 Y376	S76-H80 WeakPolarHBondContact O-CB 3.46Å; S76-H80 PolarHBondContact O-N 3.32Å; H80-M84 WeakPolarHBondContact O-CB 3.22Å; H80-M84 PolarHBondContact O-N 2.77Å; H80-M84 VanDerWaalsContact O-N 3.09Å; H80-F129 AromaticContact CE1-CZ 3.62Å; H80-F129 AromaticContact ND1-CZ 3.83Å; H80-F129 AromaticContact NE2-CZ 3.93Å; H80-Y376 AromaticContact ND1-CE2 3.57Å
81	M	92.9	Very high	87.3	Confident	7 Å²	7	41.9 Å²	41.9	3%	0.034	23%	0.232	C	C	.	.	H	α-helix	trans	-61.5	-50.2	172.2	179.2	-178.7	77.2	0	0	110.9	Q77 L78 V79 M84 M85 L372 Q373 Y376	Q77-M81 WeakPolarHBondContact O-CB 3.45Å; Q77-M81 PolarHBondContact O-N 3.39Å; L78-M81 HydrophobicContact CD1-CE 3.92Å; V79-M81 VanDerWaalsContact C-N 3.31Å; V79-M81 PolarHBondContact O-N 3.27Å; M81-M84 PolarHBondContact O-N 2.83Å; M81-M85 HydrophobicContact CG-CG 4.19Å; M81-M85 WeakPolarHBondContact O-CB 3.42Å; M81-M85 VanDerWaalsContact O-CG 3.24Å; M81-M85 WeakPolarHBondContact O-CG 3.22Å; M81-M85 PolarHBondContact O-N 3.2Å; M81-L372 HydrophobicContact SD-CB 4.49Å; M81-Q373 VanDerWaalsContact SD-CA 3.59Å; M81-Q373 HydrophobicContact SD-CB 3.98Å; M81-Y376 HydrophobicContact CB-CD1 4.34Å; M81-Y376 HydrophobicContact CB-CD2 3.78Å; M81-Y376 HydrophobicContact CB-CE2 4.07Å; M81-Y376 HydrophobicContact CB-CG 3.95Å; M81-Y376 HydrophobicContact CG-CD1 4.34Å; M81-Y376 HydrophobicContact CG-CD2 3.85Å; M81-Y376 HydrophobicContact CG-CG 3.71Å; M81-Y376 HydrophobicContact SD-CG 4.35Å
82	T	91.7	Very high	88.2	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.012	20%	0.201	C	C	.	.	H	α-helix	trans	-62.8	-46.4	-178.2	-56.4	0	0	0	0	111.5	L56 C60 L78 V79 M84 M85 H86 F95	L56-T82 HydrophobicContact CD1-CG2 4.47Å; L56-T82 HydrophobicContact CD2-CG2 3.9Å; L56-T82 HydrophobicContact CG-CG2 3.89Å; C60-T82 PolarHBondContact SG-OG1 3.03Å; C60-T82 VanDerWaalsContact SG-OG1 3.33Å; L78-T82 WeakPolarHBondContact O-CB 3.48Å; L78-T82 PolarHBondContact O-N 3.38Å; L78-T82 PolarHBondContact O-OG1 2.79Å; V79-T82 PolarHBondContact O-N 2.96Å; V79-T82 VanDerWaalsContact O-N 3.14Å; T82-M84 VanDerWaalsContact C-N 3.35Å; T82-M84 PolarHBondContact O-N 2.89Å; T82-M85 PolarHBondContact O-N 3.01Å; T82-H86 VanDerWaalsContact O-CB 3.25Å; T82-H86 WeakPolarHBondContact O-CB 3.19Å; T82-H86 PolarHBondContact O-N 3.48Å; T82-H86 PolarHBondContact O-ND1 3.04Å; T82-F95 HydrophobicContact CG2-CE2 3.8Å; T82-F95 HydrophobicContact CG2-CZ 3.98Å
83	L	92.1	Very high	88.6	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-65.1	-35.4	-179.6	-66.8	178.5	0	0	0	112.7	V79 H86 F95 L121 Q124 W125 F129	V79-L83 HydrophobicContact CG1-CD1 3.63Å; V79-L83 HydrophobicContact CG1-CG 4.11Å; V79-L83 WeakPolarHBondContact O-CB 3.42Å; V79-L83 VanDerWaalsContact O-CG 3.29Å; V79-L83 WeakPolarHBondContact O-CG 3.43Å; V79-L83 PolarHBondContact O-N 2.92Å; L83-H86 PolarHBondContact O-CE1 3.33Å; L83-H86 PolarHBondContact O-ND1 3.1Å; L83-F95 HydrophobicContact CD2-CE1 4.22Å; L83-F95 HydrophobicContact CD2-CZ 4.4Å; L83-L121 HydrophobicContact CD1-CD1 4.09Å; L83-L121 HydrophobicContact CD2-CD1 3.95Å; L83-L121 HydrophobicContact CG-CD1 4.24Å; L83-Q124 HydrophobicContact CD1-CG 4.44Å; L83-W125 HydrophobicContact CD1-CB 3.96Å; L83-W125 HydrophobicContact CD2-CB 3.78Å; L83-W125 HydrophobicContact CD2-CD2 3.94Å; L83-W125 HydrophobicContact CD2-CE3 4.27Å; L83-W125 HydrophobicContact CD2-CG 3.72Å; L83-W125 HydrophobicContact CG-CB 4.39Å; L83-W125 HydrophobicContact CG-CG 4.48Å; L83-F129 HydrophobicContact CB-CD2 4.06Å; L83-F129 HydrophobicContact CB-CE2 3.75Å
84	M	91.1	Very high	89	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-78	-39	174.8	-161.7	171.6	76.4	0	0	112.7	H80 M81 T82 F129 F215 Y376 I379 L383	H80-M84 WeakPolarHBondContact O-CB 3.22Å; H80-M84 PolarHBondContact O-N 2.77Å; H80-M84 VanDerWaalsContact O-N 3.09Å; M81-M84 PolarHBondContact O-N 2.83Å; T82-M84 VanDerWaalsContact C-N 3.35Å; T82-M84 PolarHBondContact O-N 2.89Å; M84-F129 HydrophobicContact CB-CE1 4.12Å; M84-F129 HydrophobicContact CB-CE2 4.37Å; M84-F129 HydrophobicContact CB-CZ 3.81Å; M84-F129 HydrophobicContact CG-CE1 3.99Å; M84-F129 HydrophobicContact CG-CZ 4.2Å; M84-F129 HydrophobicContact SD-CE1 4.14Å; M84-F129 HydrophobicContact SD-CZ 4.47Å; M84-F215 HydrophobicContact CB-CD2 4.42Å; M84-F215 HydrophobicContact CB-CE2 4.49Å; M84-F215 HydrophobicContact CG-CB 3.83Å; M84-F215 HydrophobicContact CG-CD1 4.03Å; M84-F215 HydrophobicContact CG-CD2 3.29Å; M84-F215 HydrophobicContact CG-CE1 4.43Å; M84-F215 HydrophobicContact CG-CE2 3.74Å; M84-F215 HydrophobicContact CG-CG 3.44Å; M84-F215 VanDerWaalsContact CG-CG 3.44Å; M84-F215 HydrophobicContact CG-CZ 4.27Å; M84-F215 WeakPolarHBondContact O-CD2 3.42Å; M84-F215 WeakPolarHBondContact O-CE2 3.42Å; M84-F215 HydrophobicContact SD-CB 3.79Å; M84-F215 HydrophobicContact SD-CD1 4.42Å; M84-F215 HydrophobicContact SD-CD2 4.38Å; M84-F215 HydrophobicContact SD-CG 3.96Å; M84-Y376 HydrophobicContact CE-CD2 3.61Å; M84-Y376 HydrophobicContact CE-CE2 3.88Å; M84-I379 HydrophobicContact CE-CB 4.17Å; M84-I379 HydrophobicContact CE-CG2 3.67Å; M84-I379 HydrophobicContact SD-CG2 4.35Å; M84-L383 HydrophobicContact CE-CD1 4.5Å; M84-L383 HydrophobicContact SD-CD1 3.83Å
85	M	91.8	Very high	89.5	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-105.2	-13.2	-164.7	-55.9	-57.4	-59.4	0	0	115.9	M81 T82 S87 W88 L372 L375 Y376 I379	M81-M85 HydrophobicContact CG-CG 4.19Å; M81-M85 WeakPolarHBondContact O-CB 3.42Å; M81-M85 VanDerWaalsContact O-CG 3.24Å; M81-M85 WeakPolarHBondContact O-CG 3.22Å; M81-M85 PolarHBondContact O-N 3.2Å; T82-M85 PolarHBondContact O-N 3.01Å; M85-S87 PolarHBondContact O-N 3.1Å; M85-W88 HydrophobicContact CE-CD2 4Å; M85-W88 HydrophobicContact CE-CE3 3.41Å; M85-W88 VanDerWaalsContact CE-CE3 3.41Å; M85-W88 HydrophobicContact CE-CZ3 3.77Å; M85-W88 WeakPolarHBondContact O-CB 3.38Å; M85-W88 PolarHBondContact O-N 2.96Å; M85-L372 HydrophobicContact CB-CD2 4.27Å; M85-L375 HydrophobicContact CE-CB 3.55Å; M85-L375 HydrophobicContact CE-CD1 4.21Å; M85-Y376 HydrophobicContact CG-CD2 4.15Å; M85-I379 HydrophobicContact CE-CD1 4.15Å; M85-I379 HydrophobicContact SD-CD1 4.29Å
86	H	90.6	Very high	89.9	Confident	7 Å²	7	24.4 Å²	24.4	3%	0.032	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-53.8	-40.5	179.6	67.3	-81.4	0	0	0	111.8	T82 L83 W88 V89 V90 F95 W125	T82-H86 VanDerWaalsContact O-CB 3.25Å; T82-H86 WeakPolarHBondContact O-CB 3.19Å; T82-H86 PolarHBondContact O-N 3.48Å; T82-H86 PolarHBondContact O-ND1 3.04Å; L83-H86 PolarHBondContact O-CE1 3.33Å; L83-H86 PolarHBondContact O-ND1 3.1Å; H86-W88 PolarHBondContact O-N 3.47Å; H86-V89 PolarHBondContact O-N 3.47Å; H86-V90 CarbonylContact C-O 3.58Å; H86-V90 PolarHBondContact O-N 2.96Å; H86-V90 VanDerWaalsContact O-O 3.06Å; H86-F95 HydrophobicContact CB-CD2 3.87Å; H86-F95 HydrophobicContact CB-CE2 4.07Å; H86-F95 AromaticContact CD2-CG 3.96Å; H86-F95 AromaticContact CG-CD2 3.88Å; H86-W125 AromaticContact CE1-CE2 3.82Å; H86-W125 AromaticContact CE1-CZ2 3.38Å; H86-W125 WeakPolarHBondContact CE1-CZ2 3.1Å; H86-W125 AromaticContact NE2-CH2 3.86Å; H86-W125 AromaticContact NE2-CZ2 3.44Å; H86-W125 WeakPolarHBondContact NE2-CZ2 3.33Å
87	S	90	Very high	90	Very high	6 Å²	6	26.5 Å²	26.5	4%	0.042	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-55.1	-21.5	179.4	67.3	0	0	0	0	114	M85 V89 V90 R219	M85-S87 PolarHBondContact O-N 3.1Å; S87-V89 VanDerWaalsContact C-N 3.28Å; S87-V89 PolarHBondContact O-N 3.24Å; S87-V90 VanDerWaalsContact CA-O 3.26Å; S87-V90 WeakPolarHBondContact CA-O 3.4Å; S87-R219 PolarHBondContact O-NE 3.08Å; S87-R219 PolarHBondContact O-NH2 2.89Å; S87-R219 WeakPolarHBondContact OG-CD 3.4Å; S87-R219 PolarHBondContact OG-NE 2.75Å
88	W	89.1	Confident	90.2	Very high	21 Å²	21	25.8 Å²	25.8	8%	0.08	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-68.2	-26.4	177	-145.6	-76.6	0	0	0	113.2	M85 H86 R219 V222 N355 L372 L375 I379	M85-W88 HydrophobicContact CE-CD2 4Å; M85-W88 HydrophobicContact CE-CE3 3.41Å; M85-W88 VanDerWaalsContact CE-CE3 3.41Å; M85-W88 HydrophobicContact CE-CZ3 3.77Å; M85-W88 WeakPolarHBondContact O-CB 3.38Å; M85-W88 PolarHBondContact O-N 2.96Å; H86-W88 PolarHBondContact O-N 3.47Å; W88-R219 HydrophobicContact CD2-CG 4.18Å; W88-R219 HydrophobicContact CE3-CB 3.71Å; W88-R219 HydrophobicContact CE3-CG 3.75Å; W88-R219 HydrophobicContact CH2-CB 4.21Å; W88-R219 VanDerWaalsContact CZ3-CA 3.46Å; W88-R219 HydrophobicContact CZ3-CB 3.51Å; W88-R219 HydrophobicContact CZ3-CG 4.04Å; W88-V222 HydrophobicContact CH2-CB 4.07Å; W88-V222 HydrophobicContact CH2-CG1 4.36Å; W88-V222 HydrophobicContact CH2-CG2 4.32Å; W88-V222 HydrophobicContact CZ2-CB 3.79Å; W88-V222 HydrophobicContact CZ2-CG1 3.65Å; W88-V222 HydrophobicContact CZ2-CG2 4.41Å; W88-N355 PolarHBondContact NE1-OD1 3.21Å; W88-L372 HydrophobicContact CB-CD2 4.26Å; W88-L375 HydrophobicContact CD2-CD1 3.97Å; W88-L375 HydrophobicContact CG-CD1 4.24Å; W88-L375 HydrophobicContact CH2-CD2 4.25Å; W88-L375 HydrophobicContact CZ2-CD1 3.86Å; W88-L375 HydrophobicContact CZ2-CD2 3.85Å; W88-L375 HydrophobicContact CZ2-CG 4.46Å; W88-I379 HydrophobicContact CH2-CD1 3.83Å; W88-I379 HydrophobicContact CZ3-CD1 3.56Å
89	V	88.3	Confident	90.2	Very high	22 Å²	22	23.6 Å²	23.6	13%	0.133	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.3	-30.3	-171.9	-177.6	0	0	0	0	112.3	H86 S87 D360 Y361 I367 L372	H86-V89 PolarHBondContact O-N 3.47Å; S87-V89 VanDerWaalsContact C-N 3.28Å; S87-V89 PolarHBondContact O-N 3.24Å; V89-D360 HydrophobicContact CG1-CB 4.35Å; V89-D360 HydrophobicContact CG2-CB 4.04Å; V89-Y361 HydrophobicContact CG1-CD2 4.38Å; V89-Y361 HydrophobicContact CG1-CE1 3.99Å; V89-Y361 HydrophobicContact CG1-CE2 3.58Å; V89-Y361 VanDerWaalsContact CG1-OH 3.28Å; V89-Y361 WeakPolarHBondContact CG1-OH 3.33Å; V89-Y361 PolarHBondContact O-OH 2.97Å; V89-I367 HydrophobicContact CB-CG2 4.49Å; V89-I367 HydrophobicContact CG1-CD1 4.37Å; V89-I367 HydrophobicContact CG1-CG1 4.04Å; V89-I367 HydrophobicContact CG1-CG2 4.17Å; V89-I367 HydrophobicContact CG2-CG2 4.37Å; V89-L372 HydrophobicContact CG2-CD2 3.9Å
90	V	88.3	Confident	90.1	Very high	13 Å²	13	24.2 Å²	24.2	8%	0.079	12%	0.123	C	C	.	.	S	Bend	trans	-135.9	129.2	-176.1	176.5	0	0	0	0	109.5	L53 H86 S87 M94 I367	L53-V90 HydrophobicContact CD1-CG1 4.34Å; L53-V90 HydrophobicContact CD1-CG2 4.31Å; L53-V90 HydrophobicContact CD2-CG1 3.81Å; L53-V90 HydrophobicContact CD2-CG2 4.3Å; H86-V90 CarbonylContact C-O 3.58Å; H86-V90 PolarHBondContact O-N 2.96Å; H86-V90 VanDerWaalsContact O-O 3.06Å; S87-V90 VanDerWaalsContact CA-O 3.26Å; S87-V90 WeakPolarHBondContact CA-O 3.4Å; V90-M94 HydrophobicContact CG1-CB 3.71Å; V90-I367 HydrophobicContact CG2-CD1 4.09Å
91	P	89.5	Confident	90	Very high	78 Å²	78	24.8 Å²	24.8	51%	0.506	13%	0.13	S	C	.	.			trans	-57.1	142.6	175.6	-24.9	34.3	0	0	0	113.1	Q93 M94 F95	P91-Q93 PolarHBondContact O-N 3.35Å; P91-Q93 VanDerWaalsContact O-N 3.16Å; P91-M94 HydrophobicContact CB-CG 4.28Å; P91-M94 HydrophobicContact CG-CG 4.32Å; P91-M94 WeakPolarHBondContact O-CB 3.45Å; P91-M94 PolarHBondContact O-N 3.13Å; P91-F95 PolarHBondContact O-N 3.44Å
92	S	90.2	Very high	89.8	Confident	12 Å²	12	26.7 Å²	26.7	8%	0.084	14%	0.139	C	C	.	.	H	α-helix	trans	-53.6	-38.4	-179.8	-46.5	0	0	0	0	112.6	M94 F95 V96	S92-M94 PolarHBondContact O-N 2.89Å; S92-F95 WeakPolarHBondContact O-CB 3.43Å; S92-F95 PolarHBondContact O-N 3.2Å; S92-V96 PolarHBondContact O-N 3.11Å
93	Q	89	Confident	89.4	Confident	45 Å²	45	26.6 Å²	26.6	21%	0.21	14%	0.138	C	C	.	.	H	α-helix	trans	-55	-48.8	173.5	-170.2	-147.8	3	0	0	112.7	P91 F95 V96 Q97 L138 T142	P91-Q93 PolarHBondContact O-N 3.35Å; P91-Q93 VanDerWaalsContact O-N 3.16Å; Q93-F95 VanDerWaalsContact C-N 3.27Å; Q93-F95 PolarHBondContact O-N 3.02Å; Q93-V96 PolarHBondContact O-N 3.09Å; Q93-Q97 WeakPolarHBondContact O-CB 3.2Å; Q93-Q97 PolarHBondContact O-N 3.4Å; Q93-L138 HydrophobicContact CG-CD2 4.37Å; Q93-L138 HydrophobicContact CG-CG 3.97Å; Q93-T142 HydrophobicContact CG-CG2 4.37Å; Q93-T142 VanDerWaalsContact CG-OG1 3.25Å; Q93-T142 WeakPolarHBondContact CG-OG1 3.3Å
94	M	88	Confident	89.1	Confident	68 Å²	68	31.9 Å²	31.9	34%	0.335	16%	0.161	S	C	.	.	H	α-helix	trans	-65	-33.8	179.7	-64.5	-70	100	0	0	111.5	V90 P91 S92 Q97 K98	V90-M94 HydrophobicContact CG1-CB 3.71Å; P91-M94 HydrophobicContact CB-CG 4.28Å; P91-M94 HydrophobicContact CG-CG 4.32Å; P91-M94 WeakPolarHBondContact O-CB 3.45Å; P91-M94 PolarHBondContact O-N 3.13Å; S92-M94 PolarHBondContact O-N 2.89Å; M94-Q97 PolarHBondContact O-N 3.47Å; M94-K98 WeakPolarHBondContact O-CG 3.25Å; M94-K98 PolarHBondContact O-N 2.94Å
95	F	91.4	Very high	88.8	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.3	-45.1	174.1	-167.5	-87.7	0	0	0	111.4	L53 I57 T82 L83 H86 P91 S92 Q93 K98 L99 W125	L53-F95 HydrophobicContact CD1-CD2 3.9Å; L53-F95 HydrophobicContact CD1-CE2 4.37Å; I57-F95 HydrophobicContact CD1-CD2 4.21Å; I57-F95 HydrophobicContact CD1-CE2 4.17Å; I57-F95 HydrophobicContact CG1-CD2 4.26Å; I57-F95 HydrophobicContact CG1-CE2 3.71Å; I57-F95 HydrophobicContact CG1-CZ 3.99Å; T82-F95 HydrophobicContact CG2-CE2 3.8Å; T82-F95 HydrophobicContact CG2-CZ 3.98Å; L83-F95 HydrophobicContact CD2-CE1 4.22Å; L83-F95 HydrophobicContact CD2-CZ 4.4Å; H86-F95 HydrophobicContact CB-CD2 3.87Å; H86-F95 HydrophobicContact CB-CE2 4.07Å; H86-F95 AromaticContact CD2-CG 3.96Å; H86-F95 AromaticContact CG-CD2 3.88Å; P91-F95 PolarHBondContact O-N 3.44Å; S92-F95 WeakPolarHBondContact O-CB 3.43Å; S92-F95 PolarHBondContact O-N 3.2Å; Q93-F95 VanDerWaalsContact C-N 3.27Å; Q93-F95 PolarHBondContact O-N 3.02Å; F95-K98 PolarHBondContact O-N 3.01Å; F95-L99 HydrophobicContact CD1-CD1 3.95Å; F95-L99 HydrophobicContact CE1-CD1 3.85Å; F95-L99 HydrophobicContact CE1-CG 4.47Å; F95-L99 WeakPolarHBondContact O-CG 3.46Å; F95-L99 PolarHBondContact O-N 3.25Å; F95-L99 VanDerWaalsContact O-N 3.12Å; F95-W125 HydrophobicContact CB-CH2 4.46Å; F95-W125 HydrophobicContact CD1-CE3 4.27Å; F95-W125 AromaticContact CD1-CH2 3.85Å; F95-W125 HydrophobicContact CD1-CH2 3.85Å; F95-W125 AromaticContact CD1-CZ3 3.54Å; F95-W125 HydrophobicContact CD1-CZ3 3.54Å; F95-W125 HydrophobicContact CE1-CE3 4.32Å; F95-W125 HydrophobicContact CE1-CZ3 4.04Å
96	V	89.4	Confident	88.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.5	-40.9	173.6	179.5	0	0	0	0	111.9	S92 Q93 K98 L99 L100 W125 L139 T142 M143 L146	S92-V96 PolarHBondContact O-N 3.11Å; Q93-V96 PolarHBondContact O-N 3.09Å; V96-K98 VanDerWaalsContact C-N 3.29Å; V96-K98 PolarHBondContact O-N 3.01Å; V96-L99 CarbonylContact O-C 3.3Å; V96-L99 WeakPolarHBondContact O-CB 3.13Å; V96-L99 PolarHBondContact O-N 3.33Å; V96-L99 VanDerWaalsContact O-N 3.08Å; V96-L100 PolarHBondContact O-N 2.84Å; V96-W125 HydrophobicContact CG2-CH2 3.84Å; V96-W125 HydrophobicContact CG2-CZ3 3.54Å; V96-L139 HydrophobicContact CB-CD1 4.3Å; V96-L139 HydrophobicContact CG2-CD1 3.39Å; V96-T142 HydrophobicContact CB-CG2 4.19Å; V96-T142 HydrophobicContact CG1-CG2 3.95Å; V96-M143 HydrophobicContact CG1-CE 4.21Å; V96-M143 HydrophobicContact CG1-SD 4.23Å; V96-M143 HydrophobicContact CG2-CE 3.64Å; V96-L146 HydrophobicContact CG1-CD2 4.36Å
97	Q	89.7	Confident	87.7	Confident	93 Å²	93	41.4 Å²	41.4	44%	0.435	22%	0.217	S	C	.	.	H	α-helix	trans	-60.9	-38.5	178	-167.5	179.2	9.5	0	0	111.7	Q93 M94 L100 T101 T142	Q93-Q97 WeakPolarHBondContact O-CB 3.2Å; Q93-Q97 PolarHBondContact O-N 3.4Å; M94-Q97 PolarHBondContact O-N 3.47Å; Q97-L100 WeakPolarHBondContact O-CB 3.2Å; Q97-L100 PolarHBondContact O-N 2.8Å; Q97-T101 PolarHBondContact O-N 2.92Å; Q97-T101 PolarHBondContact O-OG1 2.97Å; Q97-T142 HydrophobicContact CB-CG2 4.21Å
98	K	90.4	Very high	87	Confident	71 Å²	71	46.2 Å²	46.2	31%	0.309	25%	0.246	S	C	.	.	H	α-helix	trans	-66.4	-39.3	172.1	-75.9	-66.7	-162.9	155.4	0	113	L53 D54 I57 M94 F95 V96 L100 T101 F102	L53-K98 HydrophobicContact CD2-CG 3.85Å; L53-K98 HydrophobicContact CG-CG 4.45Å; D54-K98 WeakPolarHBondContact OD1-CD 3.42Å; D54-K98 WeakPolarHBondContact OD1-CE 3.45Å; D54-K98 IonicContact OD1-NZ 2.61Å; D54-K98 PolarHBondContact OD1-NZ 3.15Å; D54-K98 IonicContact OD2-NZ 2.69Å; D54-K98 PolarHBondContact OD2-NZ 3.32Å; I57-K98 HydrophobicContact CD1-CB 3.65Å; I57-K98 HydrophobicContact CD1-CG 4.49Å; M94-K98 WeakPolarHBondContact O-CG 3.25Å; M94-K98 PolarHBondContact O-N 2.94Å; F95-K98 PolarHBondContact O-N 3.01Å; V96-K98 VanDerWaalsContact C-N 3.29Å; V96-K98 PolarHBondContact O-N 3.01Å; K98-L100 VanDerWaalsContact C-N 3.31Å; K98-L100 PolarHBondContact O-N 2.72Å; K98-T101 PolarHBondContact O-N 3.46Å; K98-F102 WeakPolarHBondContact O-CD2 3.2Å; K98-F102 PolarHBondContact O-N 2.6Å
99	L	89.9	Confident	86.2	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61.9	-39.3	172	-69.1	171.7	0	0	0	111.9	I57 F95 V96 F102 Y103 I118 L121 V122	I57-L99 HydrophobicContact CG2-CD2 3.64Å; F95-L99 HydrophobicContact CD1-CD1 3.95Å; F95-L99 HydrophobicContact CE1-CD1 3.85Å; F95-L99 HydrophobicContact CE1-CG 4.47Å; F95-L99 WeakPolarHBondContact O-CG 3.46Å; F95-L99 PolarHBondContact O-N 3.25Å; F95-L99 VanDerWaalsContact O-N 3.12Å; V96-L99 CarbonylContact O-C 3.3Å; V96-L99 WeakPolarHBondContact O-CB 3.13Å; V96-L99 PolarHBondContact O-N 3.33Å; V96-L99 VanDerWaalsContact O-N 3.08Å; L99-F102 PolarHBondContact O-N 2.81Å; L99-Y103 WeakPolarHBondContact O-CB 3.48Å; L99-Y103 PolarHBondContact O-N 2.8Å; L99-I118 HydrophobicContact CB-CG2 4.43Å; L99-I118 HydrophobicContact CD2-CG2 4.46Å; L99-L121 HydrophobicContact CD2-CD2 3.93Å; L99-V122 HydrophobicContact CD1-CG2 3.91Å
100	L	87.4	Confident	85.6	Confident	14 Å²	14	58.3 Å²	58.3	7%	0.073	31%	0.305	C	S	.	.	H	α-helix	trans	-63.2	-42.1	174.6	-179.8	62	0	0	0	112.2	V96 Q97 K98 Y103 K104 D145 L146 L149	V96-L100 PolarHBondContact O-N 2.84Å; Q97-L100 WeakPolarHBondContact O-CB 3.2Å; Q97-L100 PolarHBondContact O-N 2.8Å; K98-L100 VanDerWaalsContact C-N 3.31Å; K98-L100 PolarHBondContact O-N 2.72Å; L100-Y103 PolarHBondContact O-N 3.03Å; L100-K104 HydrophobicContact CG-CD 4.43Å; L100-K104 WeakPolarHBondContact O-CG 3.08Å; L100-K104 PolarHBondContact O-N 3.46Å; L100-K104 VanDerWaalsContact O-N 3.08Å; L100-D145 HydrophobicContact CD2-CB 4.22Å; L100-L146 HydrophobicContact CB-CD1 4.41Å; L100-L146 HydrophobicContact CD1-CB 4.21Å; L100-L146 HydrophobicContact CD1-CD1 3.81Å; L100-L149 HydrophobicContact CD1-CD2 3.66Å
101	T	89.5	Confident	85.2	Confident	58 Å²	58	62.3 Å²	62.3	36%	0.356	32%	0.318	S	S	.	.	H	α-helix	trans	-60.2	-50	171.1	-60.3	0	0	0	0	111.1	Q97 K98 Y103 K104 D105	Q97-T101 PolarHBondContact O-N 2.92Å; Q97-T101 PolarHBondContact O-OG1 2.97Å; K98-T101 PolarHBondContact O-N 3.46Å; T101-Y103 PolarHBondContact O-N 3.45Å; T101-K104 PolarHBondContact O-N 2.9Å; T101-K104 VanDerWaalsContact O-N 3.17Å; T101-D105 WeakPolarHBondContact CG2-OD2 3.48Å; T101-D105 PolarHBondContact O-N 2.88Å
102	F	87.6	Confident	84.5	Confident	48 Å²	48	60.1 Å²	60.1	21%	0.211	31%	0.31	C	S	.	.	H	α-helix	trans	-63.2	-27.3	177.9	-72.5	-53.2	0	0	0	114.2	D54 I57 Q58 K98 L99 I118	D54-F102 HydrophobicContact CB-CZ 3.88Å; I57-F102 HydrophobicContact CB-CE2 4.03Å; I57-F102 HydrophobicContact CD1-CE2 4.3Å; I57-F102 HydrophobicContact CG2-CD2 3.73Å; I57-F102 HydrophobicContact CG2-CE2 3.69Å; Q58-F102 HydrophobicContact CG-CE1 4.33Å; Q58-F102 HydrophobicContact CG-CZ 4.11Å; K98-F102 WeakPolarHBondContact O-CD2 3.2Å; K98-F102 PolarHBondContact O-N 2.6Å; L99-F102 PolarHBondContact O-N 2.81Å; F102-I118 HydrophobicContact CB-CD1 4.07Å
103	Y	85.1	Confident	84.1	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-75.6	-36.2	175.7	-170.6	-79.5	0	0	0	112.3	L99 L100 T101 R115 I118 L146 L149 V150 D153	L99-Y103 WeakPolarHBondContact O-CB 3.48Å; L99-Y103 PolarHBondContact O-N 2.8Å; L100-Y103 PolarHBondContact O-N 3.03Å; T101-Y103 PolarHBondContact O-N 3.45Å; Y103-R115 HydrophobicContact CD2-CB 4.13Å; Y103-R115 HydrophobicContact CD2-CG 3.75Å; Y103-R115 HydrophobicContact CE1-CG 4.41Å; Y103-R115 HydrophobicContact CE2-CB 3.56Å; Y103-R115 HydrophobicContact CE2-CG 3.43Å; Y103-R115 VanDerWaalsContact CE2-CG 3.43Å; Y103-R115 HydrophobicContact CG-CG 4.34Å; Y103-R115 PolarHBondContact O-NE 3.42Å; Y103-I118 HydrophobicContact CD2-CB 4.47Å; Y103-I118 HydrophobicContact CD2-CD1 4.3Å; Y103-I118 HydrophobicContact CD2-CG2 4.27Å; Y103-L146 HydrophobicContact CD2-CD1 4.47Å; Y103-L146 HydrophobicContact CG-CD1 4.19Å; Y103-L149 HydrophobicContact CD1-CD2 3.56Å; Y103-L149 HydrophobicContact CD1-CG 4.01Å; Y103-L149 HydrophobicContact CE1-CD2 4.06Å; Y103-L149 HydrophobicContact CE1-CG 3.98Å; Y103-V150 HydrophobicContact CD2-CG2 4.26Å; Y103-V150 HydrophobicContact CE1-CG2 4.15Å; Y103-V150 HydrophobicContact CE2-CG2 3.64Å; Y103-D153 WeakPolarHBondContact CE1-OD2 3.5Å; Y103-D153 PolarHBondContact OH-OD2 3.38Å
104	K	85.1	Confident	83.8	Confident	112 Å²	112	63.8 Å²	63.8	49%	0.487	33%	0.326	S	S	.	.	H	α-helix	trans	-71.5	-54.4	175.1	-72.9	173.3	-179.3	177.4	0	111.7	L100 T101 C106 L149	L100-K104 HydrophobicContact CG-CD 4.43Å; L100-K104 WeakPolarHBondContact O-CG 3.08Å; L100-K104 PolarHBondContact O-N 3.46Å; L100-K104 VanDerWaalsContact O-N 3.08Å; T101-K104 PolarHBondContact O-N 2.9Å; T101-K104 VanDerWaalsContact O-N 3.17Å; K104-C106 PolarHBondContact O-N 2.91Å; K104-C106 VanDerWaalsContact O-N 3.08Å; K104-L149 HydrophobicContact CD-CD2 4.23Å; K104-L149 HydrophobicContact CG-CD2 3.49Å; K104-L149 VanDerWaalsContact CG-CD2 3.49Å
105	D	84.9	Confident	83.7	Confident	121 Å²	121	61.4 Å²	61.4	65%	0.647	31%	0.313	S	S	*	.	S	Bend	trans	-85.5	20.6	-167.4	-57.7	-23.1	0	0	0	113.1	T101 P107	T101-D105 WeakPolarHBondContact CG2-OD2 3.48Å; T101-D105 PolarHBondContact O-N 2.88Å; D105-P107 WeakPolarHBondContact O-CD 3.22Å
106	C	80.7	Confident	83.2	Confident	7 Å²	7	62 Å²	62	5%	0.047	32%	0.318	C	S	.	.			trans	-74.1	125.7	-174.2	-171.3	0	0	0	0	112.3	K104 R111 R114	K104-C106 PolarHBondContact O-N 2.91Å; K104-C106 VanDerWaalsContact O-N 3.08Å; C106-R111 PolarHBondContact O-NH2 3.03Å; C106-R114 WeakPolarHBondContact SG-CB 3.44Å
107	P	79.1	Confident	83.1	Confident	81 Å²	81	62.5 Å²	62.5	53%	0.526	32%	0.321	S	S	.	.			trans	-53.3	140.1	173.3	-27.1	35.3	0	0	0	112.4	D105 D109 K110 R111	D105-P107 WeakPolarHBondContact O-CD 3.22Å; P107-D109 VanDerWaalsContact C-N 3.33Å; P107-D109 PolarHBondContact O-N 3.15Å; P107-K110 PolarHBondContact O-N 3.39Å; P107-K110 VanDerWaalsContact O-N 3.15Å; P107-R111 PolarHBondContact O-N 3.15Å; P107-R111 VanDerWaalsContact O-N 3.12Å
108	V	74.3	Confident	83	Confident	107 Å²	107	58.1 Å²	58.1	65%	0.648	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-53.6	-49.7	-173.9	-173.4	0	0	0	0	111.2	K110 R111	V108-K110 PolarHBondContact O-N 2.89Å; V108-R111 VanDerWaalsContact O-CB 3.27Å; V108-R111 WeakPolarHBondContact O-CB 3.4Å; V108-R111 PolarHBondContact O-N 3.4Å; V108-R111 VanDerWaalsContact O-N 3.13Å
109	D	72.3	Confident	82.7	Confident	155 Å²	155	54.8 Å²	54.8	83%	0.829	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-63.2	-15.5	-174.9	-36.1	-41.8	0	0	0	114.6	P107	P107-D109 VanDerWaalsContact C-N 3.33Å; P107-D109 PolarHBondContact O-N 3.15Å
110	K	76.3	Confident	82.5	Confident	141 Å²	141	56.1 Å²	56.1	61%	0.613	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-122.4	5.7	-178.3	-63.2	-176.2	-178.8	177.1	0	112.9	P107 V108 G112 L113 R114	P107-K110 PolarHBondContact O-N 3.39Å; P107-K110 VanDerWaalsContact O-N 3.15Å; V108-K110 PolarHBondContact O-N 2.89Å; K110-G112 PolarHBondContact O-N 2.96Å; K110-L113 PolarHBondContact O-N 3.25Å; K110-R114 HydrophobicContact CB-CG 4.49Å; K110-R114 WeakPolarHBondContact O-CB 3.5Å; K110-R114 PolarHBondContact O-N 3.05Å
111	R	78.6	Confident	82.5	Confident	97 Å²	97	55.5 Å²	55.5	37%	0.366	29%	0.289	S	S	.	.	H	α-helix	trans	-56.7	-53.4	-168.2	-174.8	167.7	-72.3	-172.5	-3.7	113.6	C106 P107 V108 R115	C106-R111 PolarHBondContact O-NH2 3.03Å; P107-R111 PolarHBondContact O-N 3.15Å; P107-R111 VanDerWaalsContact O-N 3.12Å; V108-R111 VanDerWaalsContact O-CB 3.27Å; V108-R111 WeakPolarHBondContact O-CB 3.4Å; V108-R111 PolarHBondContact O-N 3.4Å; V108-R111 VanDerWaalsContact O-N 3.13Å; R111-R115 VanDerWaalsContact O-CB 3.3Å; R111-R115 WeakPolarHBondContact O-CB 3.48Å; R111-R115 WeakPolarHBondContact O-CG 3.31Å; R111-R115 PolarHBondContact O-N 3.44Å
112	G	75.9	Confident	82.4	Confident	33 Å²	33	52.8 Å²	52.8	34%	0.34	27%	0.272	S	S	.	.	H	α-helix	trans	-58.5	-55.4	179.5	0	0	0	0	0	112.4	K110 R114 R115 A116	K110-G112 PolarHBondContact O-N 2.96Å; G112-R114 PolarHBondContact O-N 3.12Å; G112-R115 PolarHBondContact O-N 2.88Å; G112-A116 WeakPolarHBondContact O-CB 3.41Å; G112-A116 PolarHBondContact O-N 3.38Å
113	L	81.3	Confident	82.2	Confident	86 Å²	86	54 Å²	54	45%	0.45	28%	0.275	S	S	.	.	H	α-helix	trans	-58.9	-45.9	-179.1	-179.8	63.2	0	0	0	112.6	K110 A116 Q117	K110-L113 PolarHBondContact O-N 3.25Å; L113-A116 PolarHBondContact O-N 2.97Å; L113-Q117 HydrophobicContact CD1-CG 4.35Å; L113-Q117 WeakPolarHBondContact O-CB 3.43Å; L113-Q117 VanDerWaalsContact O-CG 3.23Å; L113-Q117 WeakPolarHBondContact O-CG 3.31Å; L113-Q117 PolarHBondContact O-N 2.95Å
114	R	83.1	Confident	82.3	Confident	48 Å²	48	57.1 Å²	57.1	18%	0.181	29%	0.29	C	S	.	.	H	α-helix	trans	-66.9	-39.4	-179.1	-90.5	-70.3	-170.3	-117	8	112.6	N62 C106 K110 G112 Q117 I118	N62-R114 VanDerWaalsContact OD1-CZ 3.29Å; N62-R114 PolarHBondContact OD1-NH1 3.47Å; N62-R114 PolarHBondContact OD1-NH2 2.85Å; C106-R114 WeakPolarHBondContact SG-CB 3.44Å; K110-R114 HydrophobicContact CB-CG 4.49Å; K110-R114 WeakPolarHBondContact O-CB 3.5Å; K110-R114 PolarHBondContact O-N 3.05Å; G112-R114 PolarHBondContact O-N 3.12Å; R114-Q117 PolarHBondContact O-N 3.28Å; R114-I118 WeakPolarHBondContact O-CG1 3.38Å; R114-I118 PolarHBondContact O-N 2.89Å
115	R	85.2	Confident	82.4	Confident	17 Å²	17	51.8 Å²	51.8	6%	0.064	27%	0.267	C	S	.	.	H	α-helix	trans	-67.3	-42.7	177.1	-71.9	177.4	165.5	-170.5	-18.8	111.3	Y103 R111 G112 Q117 I118 C119 D153	Y103-R115 HydrophobicContact CD2-CB 4.13Å; Y103-R115 HydrophobicContact CD2-CG 3.75Å; Y103-R115 HydrophobicContact CE1-CG 4.41Å; Y103-R115 HydrophobicContact CE2-CB 3.56Å; Y103-R115 HydrophobicContact CE2-CG 3.43Å; Y103-R115 VanDerWaalsContact CE2-CG 3.43Å; Y103-R115 HydrophobicContact CG-CG 4.34Å; Y103-R115 PolarHBondContact O-NE 3.42Å; R111-R115 VanDerWaalsContact O-CB 3.3Å; R111-R115 WeakPolarHBondContact O-CB 3.48Å; R111-R115 WeakPolarHBondContact O-CG 3.31Å; R111-R115 PolarHBondContact O-N 3.44Å; G112-R115 PolarHBondContact O-N 2.88Å; R115-Q117 PolarHBondContact O-N 3.19Å; R115-I118 PolarHBondContact O-N 2.84Å; R115-C119 PolarHBondContact O-N 2.93Å; R115-C119 PolarHBondContact O-SG 3.22Å; R115-C119 VanDerWaalsContact O-SG 3.38Å; R115-D153 IonicContact CZ-OD1 3.98Å; R115-D153 IonicContact CZ-OD2 3.69Å; R115-D153 IonicContact NE-OD2 2.74Å; R115-D153 IonicContact NH1-OD1 3.64Å; R115-D153 PolarHBondContact NH1-OD1 3.48Å; R115-D153 IonicContact NH1-OD2 2.66Å; R115-D153 PolarHBondContact NH1-OD2 3.19Å; R115-D153 IonicContact NH2-OD1 3.71Å; R115-D153 PolarHBondContact NH2-OD1 3.16Å; R115-D153 IonicContact NH2-OD2 3.9Å; R115-D153 PolarHBondContact NH2-OD2 2.73Å
116	A	82.1	Confident	82.3	Confident	12 Å²	12	47 Å²	47	10%	0.099	24%	0.241	C	C	.	.	H	α-helix	trans	-56.3	-50.9	171.5	0	0	0	0	0	111.3	G112 L113 I118 C119 H120 H158	G112-A116 WeakPolarHBondContact O-CB 3.41Å; G112-A116 PolarHBondContact O-N 3.38Å; L113-A116 PolarHBondContact O-N 2.97Å; A116-I118 VanDerWaalsContact C-N 3.28Å; A116-I118 PolarHBondContact O-N 3.13Å; A116-C119 PolarHBondContact O-N 3.14Å; A116-C119 VanDerWaalsContact O-N 3.13Å; A116-H120 VanDerWaalsContact C-CD2 3.49Å; A116-H120 PolarHBondContact O-CD2 2.78Å; A116-H120 PolarHBondContact O-N 3.17Å; A116-H158 WeakPolarHBondContact CA-NE2 3.28Å; A116-H158 WeakPolarHBondContact CB-NE2 3.46Å; A116-H158 PolarHBondContact N-NE2 2.92Å; A116-H158 VanDerWaalsContact N-NE2 3.18Å
117	Q	86.4	Confident	82.5	Confident	11 Å²	11	50.1 Å²	50.1	5%	0.051	26%	0.263	C	S	.	.	H	α-helix	trans	-57.2	-38	177.6	-72	174.6	-28.3	0	0	112.9	L61 F64 L113 R114 R115 L121	L61-Q117 HydrophobicContact CB-CB 4.39Å; L61-Q117 HydrophobicContact CD2-CB 4.07Å; L61-Q117 VanDerWaalsContact O-CD 3.24Å; L61-Q117 PolarHBondContact O-NE2 2.98Å; F64-Q117 HydrophobicContact CB-CG 4.07Å; F64-Q117 PolarHBondContact O-NE2 3.16Å; L113-Q117 HydrophobicContact CD1-CG 4.35Å; L113-Q117 WeakPolarHBondContact O-CB 3.43Å; L113-Q117 VanDerWaalsContact O-CG 3.23Å; L113-Q117 WeakPolarHBondContact O-CG 3.31Å; L113-Q117 PolarHBondContact O-N 2.95Å; R114-Q117 PolarHBondContact O-N 3.28Å; R115-Q117 PolarHBondContact O-N 3.19Å; Q117-L121 WeakPolarHBondContact O-CB 3.31Å; Q117-L121 PolarHBondContact O-N 3.4Å
118	I	87.1	Confident	82.7	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-67	-47.9	174.9	-68.1	165.4	0	0	0	110.5	L61 L99 F102 Y103 R114 R115 A116 H120 L121 V122	L61-I118 HydrophobicContact CD1-CG1 3.93Å; L61-I118 HydrophobicContact CD2-CB 4.3Å; L61-I118 HydrophobicContact CD2-CG1 3.62Å; L61-I118 HydrophobicContact CG-CG1 4.46Å; L99-I118 HydrophobicContact CB-CG2 4.43Å; L99-I118 HydrophobicContact CD2-CG2 4.46Å; F102-I118 HydrophobicContact CB-CD1 4.07Å; Y103-I118 HydrophobicContact CD2-CB 4.47Å; Y103-I118 HydrophobicContact CD2-CD1 4.3Å; Y103-I118 HydrophobicContact CD2-CG2 4.27Å; R114-I118 WeakPolarHBondContact O-CG1 3.38Å; R114-I118 PolarHBondContact O-N 2.89Å; R115-I118 PolarHBondContact O-N 2.84Å; A116-I118 VanDerWaalsContact C-N 3.28Å; A116-I118 PolarHBondContact O-N 3.13Å; I118-H120 VanDerWaalsContact C-N 3.34Å; I118-H120 PolarHBondContact O-N 3.28Å; I118-L121 PolarHBondContact O-N 3.09Å; I118-V122 WeakPolarHBondContact O-CG2 3.27Å; I118-V122 PolarHBondContact O-N 3.47Å
119	C	84.7	Confident	83.3	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.007	22%	0.224	C	C	.	.	H	α-helix	trans	-59.8	-41.7	176.7	-67.1	0	0	0	0	112.2	R115 A116 R123 L161	R115-C119 PolarHBondContact O-N 2.93Å; R115-C119 PolarHBondContact O-SG 3.22Å; R115-C119 VanDerWaalsContact O-SG 3.38Å; A116-C119 PolarHBondContact O-N 3.14Å; A116-C119 VanDerWaalsContact O-N 3.13Å; C119-R123 VanDerWaalsContact O-CB 3.27Å; C119-R123 WeakPolarHBondContact O-CB 3.33Å; C119-R123 PolarHBondContact O-N 3.42Å; C119-L161 HydrophobicContact CB-CB 4.35Å; C119-L161 HydrophobicContact CB-CD1 4.08Å
120	H	85.9	Confident	83.8	Confident	28 Å²	28	40.7 Å²	40.7	13%	0.13	21%	0.205	C	C	.	.	H	α-helix	trans	-65.6	-42.5	175.4	-68.3	-61.6	0	0	0	112.4	F64 G68 A116 I118 R123 Q124 L161	F64-H120 HydrophobicContact CD1-CB 3.86Å; F64-H120 HydrophobicContact CE1-CB 4.05Å; F64-H120 HydrophobicContact CG-CB 4.48Å; G68-H120 WeakPolarHBondContact CA-CD2 3.47Å; G68-H120 VanDerWaalsContact CA-CG 3.47Å; G68-H120 WeakPolarHBondContact CA-NE2 3.44Å; A116-H120 VanDerWaalsContact C-CD2 3.49Å; A116-H120 PolarHBondContact O-CD2 2.78Å; A116-H120 PolarHBondContact O-N 3.17Å; I118-H120 VanDerWaalsContact C-N 3.34Å; I118-H120 PolarHBondContact O-N 3.28Å; H120-R123 PolarHBondContact O-N 3.47Å; H120-Q124 VanDerWaalsContact O-CB 3.31Å; H120-Q124 WeakPolarHBondContact O-CB 3.32Å; H120-Q124 PolarHBondContact O-N 3.38Å; H120-L161 VanDerWaalsContact CE1-CD1 3.41Å; H120-L161 WeakPolarHBondContact CE1-CD1 3.11Å
121	L	88.3	Confident	83.9	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-61.5	-44.2	176.2	177.1	64.5	0	0	0	112	C60 L61 F64 V79 L83 L99 Q117 I118 Q124 W125	C60-L121 HydrophobicContact CB-CD1 4.46Å; C60-L121 HydrophobicContact CB-CD2 4.44Å; L61-L121 HydrophobicContact CD2-CB 4.17Å; L61-L121 HydrophobicContact CD2-CD2 3.73Å; L61-L121 HydrophobicContact CG-CD2 4.3Å; F64-L121 HydrophobicContact CE2-CB 4Å; F64-L121 HydrophobicContact CE2-CD1 3.91Å; F64-L121 HydrophobicContact CZ-CB 4.23Å; F64-L121 HydrophobicContact CZ-CD1 4.18Å; V79-L121 HydrophobicContact CG1-CD1 3.72Å; L83-L121 HydrophobicContact CD1-CD1 4.09Å; L83-L121 HydrophobicContact CD2-CD1 3.95Å; L83-L121 HydrophobicContact CG-CD1 4.24Å; L99-L121 HydrophobicContact CD2-CD2 3.93Å; Q117-L121 WeakPolarHBondContact O-CB 3.31Å; Q117-L121 PolarHBondContact O-N 3.4Å; I118-L121 PolarHBondContact O-N 3.09Å; L121-Q124 PolarHBondContact O-N 2.82Å; L121-W125 PolarHBondContact O-N 3.31Å
122	V	86.3	Confident	84.1	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-69.6	-41.9	178.3	177.9	0	0	0	0	111.4	L99 I118 Q124 W125 I126 M143 L146 W147	L99-V122 HydrophobicContact CD1-CG2 3.91Å; I118-V122 WeakPolarHBondContact O-CG2 3.27Å; I118-V122 PolarHBondContact O-N 3.47Å; V122-Q124 VanDerWaalsContact C-N 3.29Å; V122-Q124 PolarHBondContact O-N 3.43Å; V122-W125 WeakPolarHBondContact O-CB 3.45Å; V122-W125 PolarHBondContact O-N 3.42Å; V122-W125 VanDerWaalsContact O-N 3.15Å; V122-I126 HydrophobicContact CG1-CD1 3.89Å; V122-I126 HydrophobicContact CG1-CG1 4.47Å; V122-I126 WeakPolarHBondContact O-CG1 3.23Å; V122-I126 PolarHBondContact O-N 3.22Å; V122-M143 HydrophobicContact CG1-CE 3.55Å; V122-M143 HydrophobicContact CG1-SD 3.67Å; V122-L146 HydrophobicContact CG2-CD2 4.28Å; V122-W147 HydrophobicContact CB-CH2 3.94Å; V122-W147 HydrophobicContact CG1-CH2 3.34Å; V122-W147 HydrophobicContact CG1-CZ2 3.58Å; V122-W147 HydrophobicContact CG1-CZ3 4.26Å
123	R	84.3	Confident	84.3	Confident	75 Å²	75	31.7 Å²	31.7	28%	0.283	17%	0.167	S	C	.	.	H	α-helix	trans	-59.4	-40.9	173.8	-173.1	179.1	-179.7	83.4	0.7	111.6	C119 H120 S127 L161 I167	C119-R123 VanDerWaalsContact O-CB 3.27Å; C119-R123 WeakPolarHBondContact O-CB 3.33Å; C119-R123 PolarHBondContact O-N 3.42Å; H120-R123 PolarHBondContact O-N 3.47Å; R123-S127 VanDerWaalsContact O-CB 3.26Å; R123-S127 WeakPolarHBondContact O-CB 3.29Å; R123-S127 PolarHBondContact O-N 2.81Å; R123-L161 WeakPolarHBondContact CD-O 3.32Å; R123-L161 PolarHBondContact NH1-O 3.33Å; R123-I167 HydrophobicContact CG-CD1 4.21Å
124	Q	85.8	Confident	83.8	Confident	64 Å²	64	35 Å²	35	30%	0.299	18%	0.18	S	C	.	.	H	α-helix	trans	-63.9	-41.3	175.3	-166.3	68.8	14.2	0	0	111.7	F64 L83 H120 L121 V122 S127 Q128	F64-Q124 HydrophobicContact CZ-CB 4.46Å; L83-Q124 HydrophobicContact CD1-CG 4.44Å; H120-Q124 VanDerWaalsContact O-CB 3.31Å; H120-Q124 WeakPolarHBondContact O-CB 3.32Å; H120-Q124 PolarHBondContact O-N 3.38Å; L121-Q124 PolarHBondContact O-N 2.82Å; V122-Q124 VanDerWaalsContact C-N 3.29Å; V122-Q124 PolarHBondContact O-N 3.43Å; Q124-S127 PolarHBondContact O-N 3.33Å; Q124-Q128 HydrophobicContact CG-CG 4.47Å; Q124-Q128 WeakPolarHBondContact O-CB 3.42Å; Q124-Q128 WeakPolarHBondContact O-CG 3.43Å; Q124-Q128 PolarHBondContact O-N 3.37Å
125	W	87.7	Confident	83.1	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.3	-49	177	-171.8	5.1	0	0	0	112.2	L83 H86 F95 V96 L121 V122 S127 Q128 F129 V132 F133 L139	L83-W125 HydrophobicContact CD1-CB 3.96Å; L83-W125 HydrophobicContact CD2-CB 3.78Å; L83-W125 HydrophobicContact CD2-CD2 3.94Å; L83-W125 HydrophobicContact CD2-CE3 4.27Å; L83-W125 HydrophobicContact CD2-CG 3.72Å; L83-W125 HydrophobicContact CG-CB 4.39Å; L83-W125 HydrophobicContact CG-CG 4.48Å; H86-W125 AromaticContact CE1-CE2 3.82Å; H86-W125 AromaticContact CE1-CZ2 3.38Å; H86-W125 WeakPolarHBondContact CE1-CZ2 3.1Å; H86-W125 AromaticContact NE2-CH2 3.86Å; H86-W125 AromaticContact NE2-CZ2 3.44Å; H86-W125 WeakPolarHBondContact NE2-CZ2 3.33Å; F95-W125 HydrophobicContact CB-CH2 4.46Å; F95-W125 HydrophobicContact CD1-CE3 4.27Å; F95-W125 AromaticContact CD1-CH2 3.85Å; F95-W125 HydrophobicContact CD1-CH2 3.85Å; F95-W125 AromaticContact CD1-CZ3 3.54Å; F95-W125 HydrophobicContact CD1-CZ3 3.54Å; F95-W125 HydrophobicContact CE1-CE3 4.32Å; F95-W125 HydrophobicContact CE1-CZ3 4.04Å; V96-W125 HydrophobicContact CG2-CH2 3.84Å; V96-W125 HydrophobicContact CG2-CZ3 3.54Å; L121-W125 PolarHBondContact O-N 3.31Å; V122-W125 WeakPolarHBondContact O-CB 3.45Å; V122-W125 PolarHBondContact O-N 3.42Å; V122-W125 VanDerWaalsContact O-N 3.15Å; W125-S127 VanDerWaalsContact C-N 3.34Å; W125-S127 PolarHBondContact O-N 3.16Å; W125-Q128 PolarHBondContact O-N 3.09Å; W125-F129 AromaticContact CD1-CD2 3.99Å; W125-F129 PolarHBondContact O-N 3.14Å; W125-V132 HydrophobicContact CZ2-CG1 4.21Å; W125-F133 AromaticContact CD1-CE2 3.95Å; W125-F133 HydrophobicContact CD2-CE2 4.35Å; W125-F133 AromaticContact CD2-CZ 3.64Å; W125-F133 HydrophobicContact CD2-CZ 3.64Å; W125-F133 AromaticContact CE2-CZ 3.72Å; W125-F133 HydrophobicContact CE3-CZ 4.07Å; W125-F133 HydrophobicContact CG-CE2 4.15Å; W125-F133 AromaticContact CG-CZ 3.84Å; W125-F133 HydrophobicContact CG-CZ 3.84Å; W125-F133 HydrophobicContact CZ2-CZ 4.23Å; W125-F133 AromaticContact NE1-CZ 3.94Å; W125-L139 HydrophobicContact CH2-CD1 4.2Å
126	I	84.1	Confident	82.5	Confident	21 Å²	21	40 Å²	40	11%	0.108	21%	0.206	C	C	.	.	H	α-helix	trans	-63.9	-41	178	-63.8	166.8	0	0	0	110.7	V122 Q128 P130 F133 W147 T164 I167	V122-I126 HydrophobicContact CG1-CD1 3.89Å; V122-I126 HydrophobicContact CG1-CG1 4.47Å; V122-I126 WeakPolarHBondContact O-CG1 3.23Å; V122-I126 PolarHBondContact O-N 3.22Å; I126-Q128 PolarHBondContact O-N 2.84Å; I126-P130 WeakPolarHBondContact O-CD 3.46Å; I126-F133 HydrophobicContact CB-CE2 4.26Å; I126-F133 HydrophobicContact CG1-CD2 4.15Å; I126-F133 HydrophobicContact CG1-CE1 4.23Å; I126-F133 HydrophobicContact CG1-CE2 3.61Å; I126-F133 HydrophobicContact CG1-CZ 3.65Å; I126-W147 HydrophobicContact CD1-CZ2 3.82Å; I126-T164 HydrophobicContact CD1-CG2 3.98Å; I126-T164 HydrophobicContact CG2-CG2 3.98Å; I126-I167 HydrophobicContact CG2-CG2 4.48Å
127	S	83.8	Confident	82.3	Confident	73 Å²	73	44.2 Å²	44.2	51%	0.51	23%	0.232	S	C	.	.	H	α-helix	trans	-71.9	-24.5	179.5	-173.6	0	0	0	0	114.5	R123 Q124 W125	R123-S127 VanDerWaalsContact O-CB 3.26Å; R123-S127 WeakPolarHBondContact O-CB 3.29Å; R123-S127 PolarHBondContact O-N 2.81Å; Q124-S127 PolarHBondContact O-N 3.33Å; W125-S127 VanDerWaalsContact C-N 3.34Å; W125-S127 PolarHBondContact O-N 3.16Å
128	Q	84.4	Confident	81.9	Confident	60 Å²	60	47.4 Å²	47.4	28%	0.28	25%	0.249	S	C	.	.	H	α-helix	trans	-96	-32.8	178.7	-72.4	-174.2	-29	0	0	113	Q124 W125 I126	Q124-Q128 HydrophobicContact CG-CG 4.47Å; Q124-Q128 WeakPolarHBondContact O-CB 3.42Å; Q124-Q128 WeakPolarHBondContact O-CG 3.43Å; Q124-Q128 PolarHBondContact O-N 3.37Å; W125-Q128 PolarHBondContact O-N 3.09Å; I126-Q128 PolarHBondContact O-N 2.84Å
129	F	85.8	Confident	81.8	Confident	18 Å²	18	47.3 Å²	47.3	8%	0.079	25%	0.248	C	C	.	.			trans	-137.2	55.6	-170.3	-50.3	-70.5	0	0	0	112.9	H80 L83 M84 W125 A131 V132 F215	H80-F129 AromaticContact CE1-CZ 3.62Å; H80-F129 AromaticContact ND1-CZ 3.83Å; H80-F129 AromaticContact NE2-CZ 3.93Å; L83-F129 HydrophobicContact CB-CD2 4.06Å; L83-F129 HydrophobicContact CB-CE2 3.75Å; M84-F129 HydrophobicContact CB-CE1 4.12Å; M84-F129 HydrophobicContact CB-CE2 4.37Å; M84-F129 HydrophobicContact CB-CZ 3.81Å; M84-F129 HydrophobicContact CG-CE1 3.99Å; M84-F129 HydrophobicContact CG-CZ 4.2Å; M84-F129 HydrophobicContact SD-CE1 4.14Å; M84-F129 HydrophobicContact SD-CZ 4.47Å; W125-F129 AromaticContact CD1-CD2 3.99Å; W125-F129 PolarHBondContact O-N 3.14Å; F129-A131 VanDerWaalsContact C-N 3.27Å; F129-A131 PolarHBondContact O-N 2.97Å; F129-V132 HydrophobicContact CB-CG2 3.79Å; F129-V132 WeakPolarHBondContact O-CB 3.13Å; F129-V132 WeakPolarHBondContact O-CG2 3.5Å; F129-V132 PolarHBondContact O-N 2.92Å; F129-V132 VanDerWaalsContact O-N 3.1Å; F129-F215 HydrophobicContact CB-CE1 4.14Å; F129-F215 HydrophobicContact CB-CZ 4.16Å; F129-F215 HydrophobicContact CD1-CD1 4.06Å; F129-F215 AromaticContact CD1-CE1 3.4Å; F129-F215 HydrophobicContact CD1-CE1 3.4Å; F129-F215 AromaticContact CD1-CZ 3.86Å; F129-F215 HydrophobicContact CD1-CZ 3.86Å; F129-F215 HydrophobicContact CE1-CD1 4.4Å; F129-F215 HydrophobicContact CE1-CE1 4.12Å; F129-F215 HydrophobicContact CG-CE1 4.05Å; F129-F215 HydrophobicContact CG-CZ 4.13Å
130	P	83.1	Confident	81.5	Confident	67 Å²	67	53.6 Å²	53.6	44%	0.435	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-58.5	-36.7	-176	23.4	-33.7	0	0	0	113.1	I126 V132 F133	I126-P130 WeakPolarHBondContact O-CD 3.46Å; P130-V132 PolarHBondContact O-N 2.85Å; P130-F133 PolarHBondContact O-N 2.98Å
131	A	79	Confident	81.4	Confident	34 Å²	34	58.1 Å²	58.1	28%	0.281	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-65	-0.1	178.2	0	0	0	0	0	115.5	F129 L216	F129-A131 VanDerWaalsContact C-N 3.27Å; F129-A131 PolarHBondContact O-N 2.97Å; A131-L216 WeakPolarHBondContact O-CD1 3.36Å
132	V	82	Confident	81	Confident	10 Å²	10	58.5 Å²	58.5	6%	0.061	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-78	-38.1	166.7	-179.3	0	0	0	0	110.7	W125 F129 P130 L139 F215 L216	W125-V132 HydrophobicContact CZ2-CG1 4.21Å; F129-V132 HydrophobicContact CB-CG2 3.79Å; F129-V132 WeakPolarHBondContact O-CB 3.13Å; F129-V132 WeakPolarHBondContact O-CG2 3.5Å; F129-V132 PolarHBondContact O-N 2.92Å; F129-V132 VanDerWaalsContact O-N 3.1Å; P130-V132 PolarHBondContact O-N 2.85Å; V132-L139 HydrophobicContact CG1-CD2 3.8Å; V132-F215 HydrophobicContact CG2-CE1 4.31Å; V132-F215 HydrophobicContact CG2-CE2 4.49Å; V132-F215 HydrophobicContact CG2-CZ 3.57Å; V132-L216 HydrophobicContact CG2-CD1 4.12Å; V132-L216 HydrophobicContact CG2-CD2 4.4Å
133	F	79.5	Confident	80.9	Confident	37 Å²	37	58.9 Å²	58.9	16%	0.162	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-80.4	-32.9	-173.8	-59.8	-82.8	0	0	0	111.9	W125 I126 P130 K135 L139 M143	W125-F133 AromaticContact CD1-CE2 3.95Å; W125-F133 HydrophobicContact CD2-CE2 4.35Å; W125-F133 AromaticContact CD2-CZ 3.64Å; W125-F133 HydrophobicContact CD2-CZ 3.64Å; W125-F133 AromaticContact CE2-CZ 3.72Å; W125-F133 HydrophobicContact CE3-CZ 4.07Å; W125-F133 HydrophobicContact CG-CE2 4.15Å; W125-F133 AromaticContact CG-CZ 3.84Å; W125-F133 HydrophobicContact CG-CZ 3.84Å; W125-F133 HydrophobicContact CZ2-CZ 4.23Å; W125-F133 AromaticContact NE1-CZ 3.94Å; I126-F133 HydrophobicContact CB-CE2 4.26Å; I126-F133 HydrophobicContact CG1-CD2 4.15Å; I126-F133 HydrophobicContact CG1-CE1 4.23Å; I126-F133 HydrophobicContact CG1-CE2 3.61Å; I126-F133 HydrophobicContact CG1-CZ 3.65Å; P130-F133 PolarHBondContact O-N 2.98Å; F133-K135 PolarHBondContact O-N 3.31Å; F133-K135 VanDerWaalsContact O-N 3.11Å; F133-L139 HydrophobicContact CD1-CD2 3.66Å; F133-L139 HydrophobicContact CD1-CG 3.98Å; F133-L139 HydrophobicContact CE1-CD1 4.32Å; F133-L139 HydrophobicContact CE1-CD2 3.87Å; F133-L139 HydrophobicContact CE1-CG 4.14Å; F133-L139 HydrophobicContact CG-CD2 4.36Å; F133-M143 HydrophobicContact CE1-CE 3.64Å; F133-M143 HydrophobicContact CZ-CE 4.27Å
134	E	72.3	Confident	80.7	Confident	157 Å²	157	57 Å²	57	73%	0.734	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-63.5	-12.9	175.5	-60.6	175.3	162.8	0	0	114.7
135	K	66.6	Low	80.6	Confident	124 Å²	124	58.2 Å²	58.2	54%	0.539	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-115.7	-5.3	-168.2	-68.4	-175.3	179.1	-179.8	0	115	F133 L216	F133-K135 PolarHBondContact O-N 3.31Å; F133-K135 VanDerWaalsContact O-N 3.11Å; K135-L216 HydrophobicContact CD-CD1 4.25Å
136	D	73.4	Confident	80.3	Confident	46 Å²	46	58.3 Å²	58.3	25%	0.246	32%	0.316	C	S	.	.			trans	-138.8	98.8	-173.5	-176	-13.1	0	0	0	110.8	L138 L139 E140	D136-L138 PolarHBondContact O-N 2.72Å; D136-L138 WeakPolarHBondContact OD1-CB 3.44Å; D136-L138 PolarHBondContact OD1-N 2.89Å; D136-L139 HydrophobicContact CB-CB 3.72Å; D136-L139 HydrophobicContact CB-CD2 4.35Å; D136-L139 VanDerWaalsContact CG-CB 3.41Å; D136-L139 WeakPolarHBondContact O-CB 3.05Å; D136-L139 PolarHBondContact O-N 3.4Å; D136-L139 PolarHBondContact OD1-N 3.42Å; D136-E140 PolarHBondContact O-N 2.9Å
137	P	77.4	Confident	80.2	Confident	99 Å²	99	59.5 Å²	59.5	64%	0.643	32%	0.319	S	S	*	.	H	α-helix	trans	-70.4	-18.1	-178.3	29.5	-35.5	0	0	0	112.9	Q141	P137-Q141 PolarHBondContact O-N 3.33Å
138	L	79.4	Confident	80.1	Confident	78 Å²	78	59.7 Å²	59.7	41%	0.408	31%	0.312	S	S	.	.	H	α-helix	trans	-84	-32.1	178.2	-171.2	61.6	0	0	0	110.8	Q93 D136 T142	Q93-L138 HydrophobicContact CG-CD2 4.37Å; Q93-L138 HydrophobicContact CG-CG 3.97Å; D136-L138 PolarHBondContact O-N 2.72Å; D136-L138 WeakPolarHBondContact OD1-CB 3.44Å; D136-L138 PolarHBondContact OD1-N 2.89Å; L138-T142 WeakPolarHBondContact O-CB 3.15Å; L138-T142 PolarHBondContact O-N 3.07Å; L138-T142 PolarHBondContact O-OG1 3.36Å
139	L	83.7	Confident	80	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61.8	-45	162.6	175.3	65.3	0	0	0	111.3	V96 W125 V132 F133 D136 T142 M143	V96-L139 HydrophobicContact CB-CD1 4.3Å; V96-L139 HydrophobicContact CG2-CD1 3.39Å; W125-L139 HydrophobicContact CH2-CD1 4.2Å; V132-L139 HydrophobicContact CG1-CD2 3.8Å; F133-L139 HydrophobicContact CD1-CD2 3.66Å; F133-L139 HydrophobicContact CD1-CG 3.98Å; F133-L139 HydrophobicContact CE1-CD1 4.32Å; F133-L139 HydrophobicContact CE1-CD2 3.87Å; F133-L139 HydrophobicContact CE1-CG 4.14Å; F133-L139 HydrophobicContact CG-CD2 4.36Å; D136-L139 HydrophobicContact CB-CB 3.72Å; D136-L139 HydrophobicContact CB-CD2 4.35Å; D136-L139 VanDerWaalsContact CG-CB 3.41Å; D136-L139 WeakPolarHBondContact O-CB 3.05Å; D136-L139 PolarHBondContact O-N 3.4Å; D136-L139 PolarHBondContact OD1-N 3.42Å; L139-T142 PolarHBondContact O-N 3.06Å; L139-M143 VanDerWaalsContact O-CB 3.28Å; L139-M143 WeakPolarHBondContact O-CB 3.49Å; L139-M143 PolarHBondContact O-N 3.47Å
140	E	79.8	Confident	79.7	Confident	134 Å²	134	58 Å²	58	63%	0.626	31%	0.306	S	S	*	.	H	α-helix	trans	-57.8	-50	176.6	-174	178	-161.4	0	0	111.5	D136 T142 M143 G144	D136-E140 PolarHBondContact O-N 2.9Å; E140-T142 PolarHBondContact O-N 3.22Å; E140-M143 PolarHBondContact O-N 2.99Å; E140-G144 PolarHBondContact O-N 3.45Å
141	Q	82.4	Confident	79.5	Confident	122 Å²	122	62.5 Å²	62.5	57%	0.57	31%	0.314	S	S	*	.	H	α-helix	trans	-57.3	-50.6	175.3	-176.4	-177.2	-0.7	0	0	112.3	P137 M143 G144 D145	P137-Q141 PolarHBondContact O-N 3.33Å; Q141-M143 PolarHBondContact O-N 3.46Å; Q141-G144 WeakPolarHBondContact O-CA 3.24Å; Q141-G144 PolarHBondContact O-N 3.47Å; Q141-D145 PolarHBondContact O-N 3.37Å
142	T	81	Confident	79.4	Confident	10 Å²	10	66.8 Å²	66.8	6%	0.061	33%	0.331	C	S	.	.	H	α-helix	trans	-66.5	-27.3	-177.1	-48.3	0	0	0	0	111.8	Q93 V96 Q97 L138 L139 E140 L146	Q93-T142 HydrophobicContact CG-CG2 4.37Å; Q93-T142 VanDerWaalsContact CG-OG1 3.25Å; Q93-T142 WeakPolarHBondContact CG-OG1 3.3Å; V96-T142 HydrophobicContact CB-CG2 4.19Å; V96-T142 HydrophobicContact CG1-CG2 3.95Å; Q97-T142 HydrophobicContact CB-CG2 4.21Å; L138-T142 WeakPolarHBondContact O-CB 3.15Å; L138-T142 PolarHBondContact O-N 3.07Å; L138-T142 PolarHBondContact O-OG1 3.36Å; L139-T142 PolarHBondContact O-N 3.06Å; E140-T142 PolarHBondContact O-N 3.22Å; T142-L146 PolarHBondContact O-N 2.83Å
143	M	82.6	Confident	78.9	Confident	8 Å²	8	69.2 Å²	69.2	4%	0.039	34%	0.344	C	S	.	.	H	α-helix	trans	-75.3	-36.5	171.8	-170.3	63.6	78.5	0	0	111.9	V96 V122 F133 L139 E140 Q141 L146 W147	V96-M143 HydrophobicContact CG1-CE 4.21Å; V96-M143 HydrophobicContact CG1-SD 4.23Å; V96-M143 HydrophobicContact CG2-CE 3.64Å; V122-M143 HydrophobicContact CG1-CE 3.55Å; V122-M143 HydrophobicContact CG1-SD 3.67Å; F133-M143 HydrophobicContact CE1-CE 3.64Å; F133-M143 HydrophobicContact CZ-CE 4.27Å; L139-M143 VanDerWaalsContact O-CB 3.28Å; L139-M143 WeakPolarHBondContact O-CB 3.49Å; L139-M143 PolarHBondContact O-N 3.47Å; E140-M143 PolarHBondContact O-N 2.99Å; Q141-M143 PolarHBondContact O-N 3.46Å; M143-L146 WeakPolarHBondContact O-CB 3.25Å; M143-L146 PolarHBondContact O-N 3.34Å; M143-L146 HydrophobicContact SD-CD2 4.01Å; M143-W147 HydrophobicContact CG-CZ2 4.4Å; M143-W147 PolarHBondContact O-N 3.31Å; M143-W147 HydrophobicContact SD-CD2 4.41Å; M143-W147 HydrophobicContact SD-CZ2 3.99Å
144	G	81.2	Confident	78	Confident	36 Å²	36	69.9 Å²	69.9	37%	0.371	36%	0.362	S	S	.	.	H	α-helix	trans	-57.8	-44.9	170.8	0	0	0	0	0	112.7	E140 Q141 L146 W147 E148	E140-G144 PolarHBondContact O-N 3.45Å; Q141-G144 WeakPolarHBondContact O-CA 3.24Å; Q141-G144 PolarHBondContact O-N 3.47Å; G144-L146 VanDerWaalsContact C-N 3.25Å; G144-L146 PolarHBondContact O-N 2.8Å; G144-W147 PolarHBondContact O-N 2.93Å; G144-E148 PolarHBondContact O-N 2.84Å
145	D	82.9	Confident	77.7	Confident	89 Å²	89	65.9 Å²	65.9	48%	0.476	34%	0.343	S	S	.	.	H	α-helix	trans	-59.6	-34.5	174.9	-71.1	-24.6	0	0	0	112.7	L100 Q141 L149	L100-D145 HydrophobicContact CD2-CB 4.22Å; Q141-D145 PolarHBondContact O-N 3.37Å; D145-L149 PolarHBondContact O-N 3.33Å
146	L	82.4	Confident	77.4	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.005	35%	0.353	C	S	.	.	H	α-helix	trans	-72	-45.8	174.7	179	61.8	0	0	0	111.6	V96 L100 Y103 V122 T142 M143 G144 E148 L149 V150	V96-L146 HydrophobicContact CG1-CD2 4.36Å; L100-L146 HydrophobicContact CB-CD1 4.41Å; L100-L146 HydrophobicContact CD1-CB 4.21Å; L100-L146 HydrophobicContact CD1-CD1 3.81Å; Y103-L146 HydrophobicContact CD2-CD1 4.47Å; Y103-L146 HydrophobicContact CG-CD1 4.19Å; V122-L146 HydrophobicContact CG2-CD2 4.28Å; T142-L146 PolarHBondContact O-N 2.83Å; M143-L146 WeakPolarHBondContact O-CB 3.25Å; M143-L146 PolarHBondContact O-N 3.34Å; M143-L146 HydrophobicContact SD-CD2 4.01Å; G144-L146 VanDerWaalsContact C-N 3.25Å; G144-L146 PolarHBondContact O-N 2.8Å; L146-E148 PolarHBondContact O-N 2.83Å; L146-L149 PolarHBondContact O-N 3.42Å; L146-V150 HydrophobicContact CD1-CG2 4.37Å; L146-V150 VanDerWaalsContact O-CG2 3.27Å; L146-V150 WeakPolarHBondContact O-CG2 3.39Å; L146-V150 PolarHBondContact O-N 2.88Å
147	W	81.6	Confident	76.8	Confident	47 Å²	47	70 Å²	70	18%	0.178	37%	0.366	C	S	.	.	H	α-helix	trans	-64.6	-38.1	178.6	-65.8	154.6	0	0	0	113.3	V122 I126 M143 G144 L149 V150 R151 I162	V122-W147 HydrophobicContact CB-CH2 3.94Å; V122-W147 HydrophobicContact CG1-CH2 3.34Å; V122-W147 HydrophobicContact CG1-CZ2 3.58Å; V122-W147 HydrophobicContact CG1-CZ3 4.26Å; I126-W147 HydrophobicContact CD1-CZ2 3.82Å; M143-W147 HydrophobicContact CG-CZ2 4.4Å; M143-W147 PolarHBondContact O-N 3.31Å; M143-W147 HydrophobicContact SD-CD2 4.41Å; M143-W147 HydrophobicContact SD-CZ2 3.99Å; G144-W147 PolarHBondContact O-N 2.93Å; W147-L149 VanDerWaalsContact C-N 3.34Å; W147-L149 PolarHBondContact O-N 3.42Å; W147-V150 HydrophobicContact CE3-CG2 4.41Å; W147-V150 PolarHBondContact O-N 3.49Å; W147-R151 VanDerWaalsContact O-CB 3.32Å; W147-R151 WeakPolarHBondContact O-CB 3.38Å; W147-R151 PolarHBondContact O-N 2.9Å; W147-I162 HydrophobicContact CB-CG2 4.44Å; W147-I162 HydrophobicContact CD2-CG1 4.35Å; W147-I162 HydrophobicContact CD2-CG2 3.71Å; W147-I162 HydrophobicContact CE3-CB 4.45Å; W147-I162 HydrophobicContact CE3-CD1 4.19Å; W147-I162 HydrophobicContact CE3-CG1 3.74Å; W147-I162 HydrophobicContact CE3-CG2 3.99Å; W147-I162 HydrophobicContact CG-CG2 3.97Å; W147-I162 HydrophobicContact CH2-CG1 4.3Å; W147-I162 HydrophobicContact CZ2-CG2 4.34Å; W147-I162 HydrophobicContact CZ3-CB 4.48Å; W147-I162 HydrophobicContact CZ3-CG1 3.72Å; W147-I162 HydrophobicContact CZ3-CG2 4.4Å
148	E	82.6	Confident	76.2	Confident	76 Å²	76	65.5 Å²	65.5	36%	0.355	34%	0.337	S	S	.	.	H	α-helix	trans	-63.8	-41	174.8	-176.3	59.8	-170.9	0	0	111.4	G144 L146 R151 L152	G144-E148 PolarHBondContact O-N 2.84Å; L146-E148 PolarHBondContact O-N 2.83Å; E148-R151 WeakPolarHBondContact O-CB 3.44Å; E148-R151 PolarHBondContact O-N 3.32Å; E148-R151 IonicContact OE1-CZ 3.31Å; E148-R151 IonicContact OE1-NE 3.14Å; E148-R151 IonicContact OE1-NH2 2.73Å; E148-R151 PolarHBondContact OE1-NH2 3.08Å; E148-R151 IonicContact OE2-CZ 3.41Å; E148-R151 IonicContact OE2-NE 2.72Å; E148-R151 PolarHBondContact OE2-NE 3.12Å; E148-R151 IonicContact OE2-NH2 3.59Å; E148-R151 PolarHBondContact OE2-NH2 3.17Å; E148-L152 HydrophobicContact CG-CD1 4.14Å; E148-L152 VanDerWaalsContact O-CG 3.28Å; E148-L152 WeakPolarHBondContact O-CG 3.46Å; E148-L152 PolarHBondContact O-N 3.37Å
149	L	81.1	Confident	75.3	Confident	43 Å²	43	64.2 Å²	64.2	23%	0.225	33%	0.334	C	S	.	.	H	α-helix	trans	-63.6	-43.5	176.1	-175.8	65.5	0	0	0	112.6	L100 Y103 K104 D145 L146 W147 R151 L152 D153	L100-L149 HydrophobicContact CD1-CD2 3.66Å; Y103-L149 HydrophobicContact CD1-CD2 3.56Å; Y103-L149 HydrophobicContact CD1-CG 4.01Å; Y103-L149 HydrophobicContact CE1-CD2 4.06Å; Y103-L149 HydrophobicContact CE1-CG 3.98Å; K104-L149 HydrophobicContact CD-CD2 4.23Å; K104-L149 HydrophobicContact CG-CD2 3.49Å; K104-L149 VanDerWaalsContact CG-CD2 3.49Å; D145-L149 PolarHBondContact O-N 3.33Å; L146-L149 PolarHBondContact O-N 3.42Å; W147-L149 VanDerWaalsContact C-N 3.34Å; W147-L149 PolarHBondContact O-N 3.42Å; L149-R151 VanDerWaalsContact C-N 3.29Å; L149-R151 PolarHBondContact O-N 3.08Å; L149-L152 PolarHBondContact O-N 3.25Å; L149-D153 PolarHBondContact O-N 2.95Å
150	V	80.2	Confident	74.2	Confident	1 Å²	1	71.3 Å²	71.3	1%	0.006	37%	0.367	C	S	.	.	H	α-helix	trans	-65.9	-34.1	176.4	-175.6	0	0	0	0	111	Y103 L146 W147 D153 H158 I162	Y103-V150 HydrophobicContact CD2-CG2 4.26Å; Y103-V150 HydrophobicContact CE1-CG2 4.15Å; Y103-V150 HydrophobicContact CE2-CG2 3.64Å; L146-V150 HydrophobicContact CD1-CG2 4.37Å; L146-V150 VanDerWaalsContact O-CG2 3.27Å; L146-V150 WeakPolarHBondContact O-CG2 3.39Å; L146-V150 PolarHBondContact O-N 2.88Å; W147-V150 HydrophobicContact CE3-CG2 4.41Å; W147-V150 PolarHBondContact O-N 3.49Å; V150-D153 PolarHBondContact O-N 3.45Å; V150-H158 HydrophobicContact CG1-CB 3.64Å; V150-I162 HydrophobicContact CB-CD1 3.8Å; V150-I162 HydrophobicContact CG1-CD1 3.47Å; V150-I162 VanDerWaalsContact CG1-CD1 3.47Å; V150-I162 HydrophobicContact CG1-CG1 4.37Å
151	R	78.8	Confident	73.3	Confident	160 Å²	160	66.8 Å²	66.8	60%	0.604	35%	0.347	S	S	*	.	H	α-helix	trans	-66.1	-38.7	174.9	-168.3	173.7	75.5	103.5	-0.2	112	W147 E148 L149 G154	W147-R151 VanDerWaalsContact O-CB 3.32Å; W147-R151 WeakPolarHBondContact O-CB 3.38Å; W147-R151 PolarHBondContact O-N 2.9Å; E148-R151 WeakPolarHBondContact O-CB 3.44Å; E148-R151 PolarHBondContact O-N 3.32Å; E148-R151 IonicContact OE1-CZ 3.31Å; E148-R151 IonicContact OE1-NE 3.14Å; E148-R151 IonicContact OE1-NH2 2.73Å; E148-R151 PolarHBondContact OE1-NH2 3.08Å; E148-R151 IonicContact OE2-CZ 3.41Å; E148-R151 IonicContact OE2-NE 2.72Å; E148-R151 PolarHBondContact OE2-NE 3.12Å; E148-R151 IonicContact OE2-NH2 3.59Å; E148-R151 PolarHBondContact OE2-NH2 3.17Å; L149-R151 VanDerWaalsContact C-N 3.29Å; L149-R151 PolarHBondContact O-N 3.08Å; R151-G154 PolarHBondContact O-N 2.73Å
152	L	77.3	Confident	72.3	Confident	124 Å²	124	62.3 Å²	62.3	65%	0.649	33%	0.327	S	S	*	.	H	α-helix	trans	-71.1	-27.5	178	-71.6	167.1	0	0	0	113.7	E148 L149 G154	E148-L152 HydrophobicContact CG-CD1 4.14Å; E148-L152 VanDerWaalsContact O-CG 3.28Å; E148-L152 WeakPolarHBondContact O-CG 3.46Å; E148-L152 PolarHBondContact O-N 3.37Å; L149-L152 PolarHBondContact O-N 3.25Å; L152-G154 PolarHBondContact O-N 2.83Å
153	D	71.4	Confident	71.1	Confident	61 Å²	61	65.4 Å²	65.4	33%	0.326	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-16.8	172.2	-93	-57.1	0	0	0	113.6	Y103 R115 L149 V150 E155	Y103-D153 WeakPolarHBondContact CE1-OD2 3.5Å; Y103-D153 PolarHBondContact OH-OD2 3.38Å; R115-D153 IonicContact CZ-OD1 3.98Å; R115-D153 IonicContact CZ-OD2 3.69Å; R115-D153 IonicContact NE-OD2 2.74Å; R115-D153 IonicContact NH1-OD1 3.64Å; R115-D153 PolarHBondContact NH1-OD1 3.48Å; R115-D153 IonicContact NH1-OD2 2.66Å; R115-D153 PolarHBondContact NH1-OD2 3.19Å; R115-D153 IonicContact NH2-OD1 3.71Å; R115-D153 PolarHBondContact NH2-OD1 3.16Å; R115-D153 IonicContact NH2-OD2 3.9Å; R115-D153 PolarHBondContact NH2-OD2 2.73Å; L149-D153 PolarHBondContact O-N 2.95Å; V150-D153 PolarHBondContact O-N 3.45Å; D153-E155 PolarHBondContact O-N 3.12Å; D153-E155 VanDerWaalsContact O-N 3.14Å
154	G	60.3	Low	69.7	Low	52 Å²	52	68.2 Å²	68.2	54%	0.536	36%	0.36	S	S	.	.			trans	70	5.7	172.9	0	0	0	0	0	116.4	R151 L152 K156	R151-G154 PolarHBondContact O-N 2.73Å; L152-G154 PolarHBondContact O-N 2.83Å; G154-K156 PolarHBondContact O-N 2.67Å; G154-K156 VanDerWaalsContact O-N 3.12Å
155	E	65.4	Low	68.3	Low	72 Å²	72	70.7 Å²	70.7	34%	0.336	37%	0.372	S	S	.	.			trans	-79.4	96.1	-173.8	-162.6	164.7	-164.5	0	0	111.1	D153 T157 H158 S159	D153-E155 PolarHBondContact O-N 3.12Å; D153-E155 VanDerWaalsContact O-N 3.14Å; E155-T157 PolarHBondContact O-N 3.25Å; E155-H158 VanDerWaalsContact CD-ND1 3.32Å; E155-H158 WeakPolarHBondContact O-CA 3.48Å; E155-H158 WeakPolarHBondContact O-CB 3.36Å; E155-H158 PolarHBondContact O-N 2.87Å; E155-H158 IonicContact OE1-CE1 2.93Å; E155-H158 IonicContact OE2-CE1 2.79Å; E155-H158 PolarHBondContact OE2-CE1 3.02Å; E155-H158 IonicContact OE2-ND1 2.81Å; E155-H158 PolarHBondContact OE2-ND1 3.49Å; E155-S159 PolarHBondContact O-N 3.18Å; E155-S159 VanDerWaalsContact O-N 3.17Å; E155-S159 PolarHBondContact O-OG 3.01Å
156	K	59.4	Low	66.5	Low	171 Å²	171	70.8 Å²	70.8	74%	0.743	38%	0.379	S	S	*	.	H	α-helix	trans	-52.5	-33.4	-167	-64.1	-178.2	179.8	179	0	115.4	G154 S159 Q160	G154-K156 PolarHBondContact O-N 2.67Å; G154-K156 VanDerWaalsContact O-N 3.12Å; K156-S159 PolarHBondContact O-N 3.33Å; K156-Q160 WeakPolarHBondContact O-CG 3.22Å; K156-Q160 PolarHBondContact O-N 3.18Å; K156-Q160 VanDerWaalsContact O-N 3.15Å
157	T	60.9	Low	64.8	Low	86 Å²	86	72.7 Å²	72.7	53%	0.528	39%	0.388	S	S	.	.	H	α-helix	trans	-64.4	-43	175.7	41.8	0	0	0	0	111.5	E155 Q160 L161	E155-T157 PolarHBondContact O-N 3.25Å; T157-Q160 PolarHBondContact O-N 2.97Å; T157-L161 WeakPolarHBondContact O-CG 3.47Å; T157-L161 PolarHBondContact O-N 3.48Å
158	H	65.8	Low	62.9	Low	5 Å²	5	76.2 Å²	76.2	2%	0.023	41%	0.411	C	S	.	.	H	α-helix	trans	-65	-43.8	173.6	-60.9	142.2	0	0	0	110.8	A116 V150 E155 Q160 L161 I162	A116-H158 WeakPolarHBondContact CA-NE2 3.28Å; A116-H158 WeakPolarHBondContact CB-NE2 3.46Å; A116-H158 PolarHBondContact N-NE2 2.92Å; A116-H158 VanDerWaalsContact N-NE2 3.18Å; V150-H158 HydrophobicContact CG1-CB 3.64Å; E155-H158 VanDerWaalsContact CD-ND1 3.32Å; E155-H158 WeakPolarHBondContact O-CA 3.48Å; E155-H158 WeakPolarHBondContact O-CB 3.36Å; E155-H158 PolarHBondContact O-N 2.87Å; E155-H158 IonicContact OE1-CE1 2.93Å; E155-H158 IonicContact OE2-CE1 2.79Å; E155-H158 PolarHBondContact OE2-CE1 3.02Å; E155-H158 IonicContact OE2-ND1 2.81Å; E155-H158 PolarHBondContact OE2-ND1 3.49Å; H158-Q160 PolarHBondContact O-N 3.2Å; H158-L161 WeakPolarHBondContact O-CB 3.18Å; H158-L161 PolarHBondContact O-N 2.78Å; H158-I162 WeakPolarHBondContact O-CG1 3.48Å; H158-I162 PolarHBondContact O-N 2.72Å
159	S	59.8	Low	60.8	Low	50 Å²	50	77.1 Å²	77.1	35%	0.35	42%	0.423	S	S	.	.	H	α-helix	trans	-56.4	-35	176.8	-45.9	0	0	0	0	113.7	E155 K156	E155-S159 PolarHBondContact O-N 3.18Å; E155-S159 VanDerWaalsContact O-N 3.17Å; E155-S159 PolarHBondContact O-OG 3.01Å; K156-S159 PolarHBondContact O-N 3.33Å
160	Q	62	Low	58.9	Low	150 Å²	150	82.3 Å²	82.3	70%	0.701	45%	0.446	S	S	*	.	H	α-helix	trans	-75.5	-25.9	176.6	-71.7	175.4	-9.5	0	0	113.5	K156 T157 H158 I162	K156-Q160 WeakPolarHBondContact O-CG 3.22Å; K156-Q160 PolarHBondContact O-N 3.18Å; K156-Q160 VanDerWaalsContact O-N 3.15Å; T157-Q160 PolarHBondContact O-N 2.97Å; H158-Q160 PolarHBondContact O-N 3.2Å; Q160-I162 VanDerWaalsContact C-N 3.33Å
161	L	60.3	Low	56.8	Low	38 Å²	38	89.4 Å²	89.4	20%	0.199	48%	0.483	C	S	.	.	H	α-helix	trans	-75.4	-23.7	174.6	-67.7	168.7	0	0	0	112.6	C119 H120 R123 T157 H158	C119-L161 HydrophobicContact CB-CB 4.35Å; C119-L161 HydrophobicContact CB-CD1 4.08Å; H120-L161 VanDerWaalsContact CE1-CD1 3.41Å; H120-L161 WeakPolarHBondContact CE1-CD1 3.11Å; R123-L161 WeakPolarHBondContact CD-O 3.32Å; R123-L161 PolarHBondContact NH1-O 3.33Å; T157-L161 WeakPolarHBondContact O-CG 3.47Å; T157-L161 PolarHBondContact O-N 3.48Å; H158-L161 WeakPolarHBondContact O-CB 3.18Å; H158-L161 PolarHBondContact O-N 2.78Å
162	I	60.3	Low	54.6	Low	29 Å²	29	89.5 Å²	89.5	15%	0.149	50%	0.496	C	S	.	.	H	α-helix	trans	-73.3	-28.9	179.4	-62.2	164	0	0	0	112.3	W147 V150 H158 Q160 T164	W147-I162 HydrophobicContact CB-CG2 4.44Å; W147-I162 HydrophobicContact CD2-CG1 4.35Å; W147-I162 HydrophobicContact CD2-CG2 3.71Å; W147-I162 HydrophobicContact CE3-CB 4.45Å; W147-I162 HydrophobicContact CE3-CD1 4.19Å; W147-I162 HydrophobicContact CE3-CG1 3.74Å; W147-I162 HydrophobicContact CE3-CG2 3.99Å; W147-I162 HydrophobicContact CG-CG2 3.97Å; W147-I162 HydrophobicContact CH2-CG1 4.3Å; W147-I162 HydrophobicContact CZ2-CG2 4.34Å; W147-I162 HydrophobicContact CZ3-CB 4.48Å; W147-I162 HydrophobicContact CZ3-CG1 3.72Å; W147-I162 HydrophobicContact CZ3-CG2 4.4Å; V150-I162 HydrophobicContact CB-CD1 3.8Å; V150-I162 HydrophobicContact CG1-CD1 3.47Å; V150-I162 VanDerWaalsContact CG1-CD1 3.47Å; V150-I162 HydrophobicContact CG1-CG1 4.37Å; H158-I162 WeakPolarHBondContact O-CG1 3.48Å; H158-I162 PolarHBondContact O-N 2.72Å; Q160-I162 VanDerWaalsContact C-N 3.33Å; I162-T164 WeakPolarHBondContact O-CG2 3.39Å; I162-T164 PolarHBondContact O-N 3.1Å
163	D	56.6	Low	52.4	Low	74 Å²	74	87 Å²	87	40%	0.396	49%	0.493	S	S	.	.			trans	-66.1	101	-169.7	-167.6	-7.6	0	0	0	112.3	S165	D163-S165 VanDerWaalsContact CG-OG 3.3Å; D163-S165 VanDerWaalsContact OD1-CB 3.23Å; D163-S165 WeakPolarHBondContact OD1-CB 3.21Å; D163-S165 PolarHBondContact OD1-N 2.93Å; D163-S165 PolarHBondContact OD1-OG 3.05Å; D163-S165 PolarHBondContact OD2-OG 3.21Å
164	T	53.5	Low	50.7	Low	67 Å²	67	89.6 Å²	89.6	41%	0.411	52%	0.516	S	S	.	.			trans	-83.3	-12.7	178.8	50.3	0	0	0	0	112.9	I126 I162 C166 I167	I126-T164 HydrophobicContact CD1-CG2 3.98Å; I126-T164 HydrophobicContact CG2-CG2 3.98Å; I162-T164 WeakPolarHBondContact O-CG2 3.39Å; I162-T164 PolarHBondContact O-N 3.1Å; T164-C166 PolarHBondContact O-N 3.21Å; T164-I167 HydrophobicContact CG2-CD1 4.39Å; T164-I167 WeakPolarHBondContact O-CB 3.15Å; T164-I167 PolarHBondContact O-N 3.46Å
165	S	52.5	Low	49.4	Very low	88 Å²	88	95.6 Å²	95.6	62%	0.615	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-59.9	-31.6	175.6	72.6	0	0	0	0	111.5	D163 I167	D163-S165 VanDerWaalsContact CG-OG 3.3Å; D163-S165 VanDerWaalsContact OD1-CB 3.23Å; D163-S165 WeakPolarHBondContact OD1-CB 3.21Å; D163-S165 PolarHBondContact OD1-N 2.93Å; D163-S165 PolarHBondContact OD1-OG 3.05Å; D163-S165 PolarHBondContact OD2-OG 3.21Å; S165-I167 VanDerWaalsContact C-N 3.31Å; S165-I167 PolarHBondContact O-N 3.27Å
166	C	43.4	Very low	47.8	Very low	91 Å²	91	96.3 Å²	96.3	62%	0.615	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-76.4	-9.5	175.9	-67.2	0	0	0	0	114.5	T164 N168	T164-C166 PolarHBondContact O-N 3.21Å; C166-N168 VanDerWaalsContact C-N 3.33Å
167	I	46.7	Very low	46.6	Very low	41 Å²	41	94.1 Å²	94.1	21%	0.21	55%	0.551	C	S	.	*	G	3₁₀ helix	trans	-93.5	10	-173.8	-59.1	-179.3	0	0	0	111.7	R123 I126 T164 S165 P169	R123-I167 HydrophobicContact CG-CD1 4.21Å; I126-I167 HydrophobicContact CG2-CG2 4.48Å; T164-I167 HydrophobicContact CG2-CD1 4.39Å; T164-I167 WeakPolarHBondContact O-CB 3.15Å; T164-I167 PolarHBondContact O-N 3.46Å; S165-I167 VanDerWaalsContact C-N 3.31Å; S165-I167 PolarHBondContact O-N 3.27Å; I167-P169 WeakPolarHBondContact O-CD 3.24Å
168	N	41.7	Very low	45.3	Very low	122 Å²	122	94.2 Å²	94.2	65%	0.652	56%	0.555	S	S	*	*			trans	-109.5	47.7	178.7	-137.6	-20.9	0	0	0	115.7	C166 H170	C166-N168 VanDerWaalsContact C-N 3.33Å; N168-H170 PolarHBondContact O-N 2.79Å
169	P	39.9	Very low	43.8	Very low	94 Å²	94	99.6 Å²	99.6	61%	0.61	59%	0.591	S	S	*	*			trans	-74.6	124.2	169.6	32.7	-31.5	0	0	0	110.8	I167	I167-P169 WeakPolarHBondContact O-CD 3.24Å
170	H	40.8	Very low	42.7	Very low	152 Å²	152	102.2 Å²	102.2	70%	0.704	61%	0.609	S	S	*	*			trans	77.4	60.9	170.5	-51.9	-72.1	0	0	0	119.4	N168	N168-H170 PolarHBondContact O-N 2.79Å
171	L	36.3	Very low	41.5	Very low	151 Å²	151	100.9 Å²	100.9	79%	0.791	61%	0.611	S	S	*	*	S	Bend	trans	-115	50.8	142	-82.2	178.9	0	0	0	112.8
172	N	33	Very low	40.3	Very low	161 Å²	161	108.6 Å²	108.6	86%	0.861	64%	0.643	S	S	*	*			trans	-165.7	44.9	152.8	-102.8	-33.4	0	0	0	112.7	S174	N172-S174 PolarHBondContact O-N 2.84Å
173	A	29.7	Very low	39.5	Very low	72 Å²	72	116.4 Å²	116.4	60%	0.595	68%	0.676	S	S	*	*			trans	-74	73.8	164.4	0	0	0	0	0	109.6	Q175	A173-Q175 PolarHBondContact O-N 2.99Å
174	S	36.2	Very low	38.9	Very low	115 Å²	115	121.9 Å²	121.9	80%	0.804	69%	0.691	S	S	*	*			trans	-60.8	103.3	167.1	-170.9	0	0	0	0	107.4	N172 A176	N172-S174 PolarHBondContact O-N 2.84Å; S174-A176 PolarHBondContact O-N 2.88Å
175	Q	34.3	Very low	39	Very low	179 Å²	179	129.1 Å²	129.1	84%	0.836	72%	0.716	S	S	*	*			trans	-60.7	114.2	-175.5	-71.2	-178.9	-7.4	0	0	108.7	A173	A173-Q175 PolarHBondContact O-N 2.99Å
176	A	30.8	Very low	39.4	Very low	86 Å²	86	126.1 Å²	126.1	71%	0.711	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-51.8	133.5	171.7	0	0	0	0	0	108.4	S174 S178	S174-A176 PolarHBondContact O-N 2.88Å; A176-S178 PolarHBondContact O-N 2.97Å; A176-S178 VanDerWaalsContact O-N 3.15Å
177	P	34.8	Very low	40.7	Very low	126 Å²	126	123.5 Å²	123.5	82%	0.818	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-57.9	124.7	-174.8	23.3	-33.2	0	0	0	109.4
178	S	32.4	Very low	42.2	Very low	87 Å²	87	121.5 Å²	121.5	61%	0.608	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-56.7	141.6	175.9	42	0	0	0	0	109.7	A176 S180	A176-S178 PolarHBondContact O-N 2.97Å; A176-S178 VanDerWaalsContact O-N 3.15Å; S178-S180 PolarHBondContact O-N 3.19Å
179	P	35	Very low	43.9	Very low	119 Å²	119	116.3 Å²	116.3	77%	0.773	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-57	128.7	-179.8	24.3	-33.8	0	0	0	108.8	V181	P179-V181 PolarHBondContact O-N 3.43Å
180	S	36.3	Very low	45.7	Very low	105 Å²	105	112 Å²	112	73%	0.734	61%	0.611	S	S	*	*			trans	-62.9	102.2	-164.2	59	0	0	0	0	112.2	S178 K182	S178-S180 PolarHBondContact O-N 3.19Å; S180-K182 PolarHBondContact O-N 3.17Å
181	V	37.3	Very low	47.3	Very low	121 Å²	121	108.7 Å²	108.7	73%	0.733	60%	0.598	S	S	*	*			trans	-52.3	136	153.9	-178.6	0	0	0	0	107.3	P179 K183	P179-V181 PolarHBondContact O-N 3.43Å; V181-K183 PolarHBondContact O-N 3.14Å
182	K	34.8	Very low	49.4	Very low	200 Å²	200	107.2 Å²	107.2	87%	0.87	59%	0.587	S	S	*	*			trans	-51.5	112.2	-173.8	-66.7	177.2	179.4	177.6	0	109.8	S180 R184	S180-K182 PolarHBondContact O-N 3.17Å; K182-R184 PolarHBondContact O-N 3.36Å
183	K	42.8	Very low	51.8	Low	193 Å²	193	99.7 Å²	99.7	84%	0.839	55%	0.547	S	S	*	.			trans	-54.5	108.2	-178.9	-66.8	179.9	-179	176.3	0	109.4	V181	V181-K183 PolarHBondContact O-N 3.14Å
184	R	45.4	Very low	54.6	Low	190 Å²	190	101.6 Å²	101.6	72%	0.717	54%	0.543	S	S	*	.			trans	-54.8	139.3	158.7	-103.7	-175.1	179.9	179.4	2.4	107	K182 V186 E197	K182-R184 PolarHBondContact O-N 3.36Å; R184-V186 HydrophobicContact CB-CG2 4.46Å; R184-V186 PolarHBondContact O-N 3.2Å; R184-E197 IonicContact NH1-OE1 3.78Å; R184-E197 PolarHBondContact NH1-OE1 3Å
185	K	54.3	Low	57.3	Low	218 Å²	218	96.9 Å²	96.9	95%	0.948	51%	0.51	S	S	*	.			trans	-64.3	109.1	164.4	-76.4	-167.9	172.9	-167.8	0	106.8
186	V	60.8	Low	60	Low	25 Å²	25	90.9 Å²	90.9	15%	0.152	48%	0.484	C	S	.	.			trans	-92.9	115.4	-177.8	167.8	0	0	0	0	107.9	R184 N395 L398	R184-V186 HydrophobicContact CB-CG2 4.46Å; R184-V186 PolarHBondContact O-N 3.2Å; V186-N395 WeakPolarHBondContact CG2-ND2 3.33Å; V186-L398 HydrophobicContact CG1-CD1 3.68Å; V186-L398 HydrophobicContact CG1-CD2 3.92Å; V186-L398 HydrophobicContact CG1-CG 3.55Å
187	S	72.1	Confident	62.8	Low	36 Å²	36	89 Å²	89	25%	0.252	46%	0.46	S	S	.	.			trans	-80.5	128.5	177.6	-167.8	0	0	0	0	109.8	I189	S187-I189 PolarHBondContact O-N 2.79Å; S187-I189 WeakPolarHBondContact OG-CB 3.31Å
188	L	78	Confident	65.5	Low	0 Å²	0	83 Å²	83	0%	0	42%	0.421	C	S	.	.			trans	-85.8	29.8	171.8	-61.1	-175	0	0	0	111.5	D397 L398 L401 I467 Y471 I487 N490	L188-D397 HydrophobicContact CD2-CB 4.19Å; L188-L398 HydrophobicContact CD2-CD2 3.95Å; L188-L401 HydrophobicContact CB-CD1 3.61Å; L188-L401 HydrophobicContact CD2-CD1 3.97Å; L188-L401 HydrophobicContact CG-CD1 4.27Å; L188-L401 WeakPolarHBondContact O-CD1 3.23Å; L188-I467 HydrophobicContact CD1-CG1 4.08Å; L188-Y471 HydrophobicContact CB-CE2 3.83Å; L188-Y471 HydrophobicContact CD1-CD2 4.46Å; L188-Y471 HydrophobicContact CD1-CE2 4.01Å; L188-Y471 HydrophobicContact CG-CE2 3.91Å; L188-Y471 PolarHBondContact N-OH 3.24Å; L188-I487 HydrophobicContact CB-CG1 4.32Å; L188-N490 PolarHBondContact O-ND2 2.99Å
189	I	77.9	Confident	68.5	Low	13 Å²	13	78.8 Å²	78.8	7%	0.067	39%	0.392	C	S	.	.			trans	-117.1	123.5	-176.5	-61.9	164.3	0	0	0	108.7	S187 D191 H192 M193 K486 I487	S187-I189 PolarHBondContact O-N 2.79Å; S187-I189 WeakPolarHBondContact OG-CB 3.31Å; I189-D191 VanDerWaalsContact C-N 3.29Å; I189-D191 PolarHBondContact O-N 3.2Å; I189-H192 HydrophobicContact CB-CB 4.45Å; I189-H192 PolarHBondContact O-N 3.4Å; I189-H192 VanDerWaalsContact O-N 3.09Å; I189-M193 PolarHBondContact O-N 3.17Å; I189-M193 VanDerWaalsContact O-N 3.08Å; I189-K486 HydrophobicContact CD1-CB 3.6Å; I189-K486 HydrophobicContact CD1-CD 3.99Å; I189-K486 HydrophobicContact CD1-CG 4.37Å; I189-K486 HydrophobicContact CG1-CB 3.79Å; I189-K486 HydrophobicContact CG2-CB 4.19Å; I189-I487 HydrophobicContact CG1-CG1 4.1Å
190	F	76.1	Confident	71.3	Confident	2 Å²	2	76 Å²	76	1%	0.009	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-40.3	-173.8	171	-92.5	0	0	0	112.7	H192 M193 M198 W246 M250 V263 K266 Y267 N490	F190-H192 VanDerWaalsContact C-N 3.3Å; F190-H192 PolarHBondContact O-N 3.15Å; F190-M193 PolarHBondContact O-N 3.45Å; F190-M198 HydrophobicContact CD2-CE 3.74Å; F190-M198 HydrophobicContact CE2-CE 3.45Å; F190-M198 VanDerWaalsContact CE2-CE 3.45Å; F190-M198 HydrophobicContact CE2-SD 4.25Å; F190-M198 HydrophobicContact CZ-CE 4.22Å; F190-W246 HydrophobicContact CD2-CH2 4.03Å; F190-W246 AromaticContact CD2-CZ2 3.71Å; F190-W246 HydrophobicContact CD2-CZ2 3.71Å; F190-W246 AromaticContact CE2-CH2 3.74Å; F190-W246 HydrophobicContact CE2-CH2 3.74Å; F190-W246 AromaticContact CE2-CZ2 3.72Å; F190-W246 HydrophobicContact CE2-CZ2 3.72Å; F190-M250 HydrophobicContact CB-CE 4.14Å; F190-M250 HydrophobicContact CD1-CE 3.58Å; F190-M250 HydrophobicContact CD2-CE 3.81Å; F190-M250 HydrophobicContact CE1-CE 3.85Å; F190-M250 HydrophobicContact CE2-CE 4.05Å; F190-M250 HydrophobicContact CG-CE 3.56Å; F190-M250 HydrophobicContact CZ-CB 4.49Å; F190-M250 HydrophobicContact CZ-CE 4.07Å; F190-V263 HydrophobicContact CE1-CG1 4.13Å; F190-V263 HydrophobicContact CE1-CG2 4.35Å; F190-V263 HydrophobicContact CZ-CG1 4.1Å; F190-K266 HydrophobicContact CE1-CD 4.41Å; F190-K266 PolarHBondContact O-NZ 3.39Å; F190-Y267 HydrophobicContact CE2-CE1 4.37Å; F190-Y267 AromaticContact CE2-CZ 3.88Å; F190-Y267 WeakPolarHBondContact CE2-OH 3.45Å; F190-Y267 HydrophobicContact CZ-CE1 4.49Å; F190-Y267 HydrophobicContact CZ-CE2 4.06Å; F190-Y267 AromaticContact CZ-CZ 3.83Å; F190-N490 HydrophobicContact CB-CB 4.2Å; F190-N490 WeakPolarHBondContact CB-OD1 3.28Å; F190-N490 PolarHBondContact N-OD1 3.32Å
191	D	74.8	Confident	74	Confident	83 Å²	83	71.5 Å²	71.5	44%	0.444	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-31	-178.6	-65.7	-56.9	0	0	0	112.3	I189 R254 K266	I189-D191 VanDerWaalsContact C-N 3.29Å; I189-D191 PolarHBondContact O-N 3.2Å; D191-R254 IonicContact OD1-CZ 2.74Å; D191-R254 IonicContact OD1-NH2 2.8Å; D191-R254 PolarHBondContact OD1-NH2 2.95Å; D191-R254 IonicContact OD2-CZ 3.64Å; D191-R254 IonicContact OD2-NH1 2.66Å; D191-R254 IonicContact OD2-NH2 3.79Å; D191-R254 PolarHBondContact OD2-NH2 3.1Å; D191-K266 PolarHBondContact O-NZ 2.93Å
192	H	80.4	Confident	76.7	Confident	120 Å²	120	65.7 Å²	65.7	56%	0.556	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-14.3	176.6	-62.3	-43.5	0	0	0	114.7	I189 F190 E194	I189-H192 HydrophobicContact CB-CB 4.45Å; I189-H192 PolarHBondContact O-N 3.4Å; I189-H192 VanDerWaalsContact O-N 3.09Å; F190-H192 VanDerWaalsContact C-N 3.3Å; F190-H192 PolarHBondContact O-N 3.15Å; H192-E194 PolarHBondContact O-N 3.4Å
193	M	83.6	Confident	79.5	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.015	26%	0.26	C	S	.	.	S	Bend	trans	-70.4	122.7	175.6	-172	-173.2	-50.3	0	0	110.7	I189 F190 M198 K266 L398 L401	I189-M193 PolarHBondContact O-N 3.17Å; I189-M193 VanDerWaalsContact O-N 3.08Å; F190-M193 PolarHBondContact O-N 3.45Å; M193-M198 HydrophobicContact CB-CE 4.41Å; M193-M198 HydrophobicContact CG-CB 4.23Å; M193-M198 HydrophobicContact CG-CE 4.32Å; M193-M198 HydrophobicContact SD-CB 3.71Å; M193-M198 HydrophobicContact SD-CE 3.75Å; M193-M198 HydrophobicContact SD-CG 3.84Å; M193-K266 WeakPolarHBondContact O-CE 3.28Å; M193-K266 PolarHBondContact O-NZ 2.89Å; M193-L398 HydrophobicContact CE-CD2 3.9Å; M193-L401 HydrophobicContact CE-CD2 4.22Å
194	E	88.8	Confident	81.9	Confident	112 Å²	112	51.1 Å²	51.1	52%	0.523	24%	0.236	S	C	.	.			trans	-73.6	153.1	-177.9	-73.2	-63.8	160.4	0	0	112.9	H192 D196 E197 M198	H192-E194 PolarHBondContact O-N 3.4Å; E194-D196 VanDerWaalsContact C-N 3.27Å; E194-D196 WeakPolarHBondContact CB-OD1 3.29Å; E194-D196 PolarHBondContact O-N 3.09Å; E194-E197 HydrophobicContact CB-CG 4.39Å; E194-E197 PolarHBondContact O-N 3.12Å; E194-M198 PolarHBondContact O-N 3.42Å
195	P	92.6	Very high	84.2	Confident	16 Å²	16	42.8 Å²	42.8	10%	0.104	21%	0.205	C	C	.	.	H	α-helix	trans	-63.4	-24.4	-176.6	-25.3	35.2	0	0	0	115.6	A199 K266 H269 V270 K273	P195-A199 VanDerWaalsContact O-CB 3.3Å; P195-A199 WeakPolarHBondContact O-CB 3.49Å; P195-A199 PolarHBondContact O-N 2.96Å; P195-K266 HydrophobicContact CG-CG 4.38Å; P195-H269 HydrophobicContact CB-CB 3.8Å; P195-H269 HydrophobicContact CG-CB 3.9Å; P195-V270 HydrophobicContact CB-CG2 3.91Å; P195-K273 HydrophobicContact CB-CG 4.49Å
196	D	91	Very high	86	Confident	54 Å²	54	32.5 Å²	32.5	29%	0.289	16%	0.16	S	C	.	.	H	α-helix	trans	-77.7	-50.2	170.7	30.8	32	0	0	0	111.6	E194 M198 A199 E200 K273	E194-D196 VanDerWaalsContact C-N 3.27Å; E194-D196 WeakPolarHBondContact CB-OD1 3.29Å; E194-D196 PolarHBondContact O-N 3.09Å; D196-M198 PolarHBondContact O-N 3.33Å; D196-A199 PolarHBondContact O-N 3.49Å; D196-E200 WeakPolarHBondContact O-CG 3.47Å; D196-E200 PolarHBondContact O-N 3.36Å; D196-K273 HydrophobicContact CB-CD 3.84Å; D196-K273 HydrophobicContact CB-CG 4.16Å; D196-K273 IonicContact OD2-NZ 3.81Å; D196-K273 PolarHBondContact OD2-NZ 3.48Å
197	E	90.1	Very high	87.6	Confident	45 Å²	45	32 Å²	32	21%	0.21	16%	0.157	C	C	.	.	H	α-helix	trans	-52.3	-44.4	175.6	-66.2	-174.1	163.3	0	0	110.4	R184 E194 E200 H201	R184-E197 IonicContact NH1-OE1 3.78Å; R184-E197 PolarHBondContact NH1-OE1 3Å; E194-E197 HydrophobicContact CB-CG 4.39Å; E194-E197 PolarHBondContact O-N 3.12Å; E197-E200 PolarHBondContact O-N 3.43Å; E197-H201 PolarHBondContact O-N 3.13Å; E197-H201 VanDerWaalsContact O-N 3.12Å; E197-H201 PolarHBondContact O-ND1 2.87Å
198	M	91.5	Very high	88.5	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.5	-44.7	174.3	-167.2	-179.2	-63.2	0	0	113.1	F190 M193 E194 D196 L202 W246 Y267 V270	F190-M198 HydrophobicContact CD2-CE 3.74Å; F190-M198 HydrophobicContact CE2-CE 3.45Å; F190-M198 VanDerWaalsContact CE2-CE 3.45Å; F190-M198 HydrophobicContact CE2-SD 4.25Å; F190-M198 HydrophobicContact CZ-CE 4.22Å; M193-M198 HydrophobicContact CB-CE 4.41Å; M193-M198 HydrophobicContact CG-CB 4.23Å; M193-M198 HydrophobicContact CG-CE 4.32Å; M193-M198 HydrophobicContact SD-CB 3.71Å; M193-M198 HydrophobicContact SD-CE 3.75Å; M193-M198 HydrophobicContact SD-CG 3.84Å; E194-M198 PolarHBondContact O-N 3.42Å; D196-M198 PolarHBondContact O-N 3.33Å; M198-L202 HydrophobicContact CG-CD1 4.06Å; M198-L202 WeakPolarHBondContact O-CB 3.26Å; M198-L202 VanDerWaalsContact O-CG 3.25Å; M198-L202 WeakPolarHBondContact O-CG 3.41Å; M198-L202 PolarHBondContact O-N 2.95Å; M198-W246 HydrophobicContact CE-CH2 4.14Å; M198-W246 HydrophobicContact CG-CH2 4.38Å; M198-W246 HydrophobicContact SD-CH2 3.74Å; M198-W246 HydrophobicContact SD-CZ3 3.97Å; M198-Y267 HydrophobicContact SD-CD1 4.44Å; M198-Y267 HydrophobicContact SD-CE1 3.93Å; M198-V270 HydrophobicContact CB-CG2 4.2Å; M198-V270 HydrophobicContact CG-CG2 4.3Å; M198-V270 HydrophobicContact SD-CG1 4.45Å; M198-V270 HydrophobicContact SD-CG2 3.67Å
199	A	94.8	Very high	89.2	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.5	-37.4	179.6	0	0	0	0	0	112.9	P195 D196 S203 V270 K273 L274 L277	P195-A199 VanDerWaalsContact O-CB 3.3Å; P195-A199 WeakPolarHBondContact O-CB 3.49Å; P195-A199 PolarHBondContact O-N 2.96Å; D196-A199 PolarHBondContact O-N 3.49Å; A199-S203 WeakPolarHBondContact O-CB 3.25Å; A199-S203 PolarHBondContact O-N 3.39Å; A199-S203 PolarHBondContact O-OG 3.43Å; A199-V270 HydrophobicContact CB-CG1 4.24Å; A199-K273 HydrophobicContact CB-CB 3.55Å; A199-L274 HydrophobicContact CB-CD2 3.88Å; A199-L274 HydrophobicContact CB-CG 3.88Å; A199-L274 WeakPolarHBondContact O-CD2 3.46Å; A199-L277 HydrophobicContact CB-CD1 4.12Å
200	E	93.7	Very high	89.9	Confident	61 Å²	61	36.7 Å²	36.7	29%	0.285	17%	0.173	S	C	.	.	H	α-helix	trans	-67.4	-47.2	176.9	-70.2	-177.8	170.5	0	0	111.5	D196 E197 S203 Y204 L277 F392	D196-E200 WeakPolarHBondContact O-CG 3.47Å; D196-E200 PolarHBondContact O-N 3.36Å; E197-E200 PolarHBondContact O-N 3.43Å; E200-S203 CarbonylContact O-C 3.56Å; E200-S203 WeakPolarHBondContact O-CB 3.32Å; E200-S203 PolarHBondContact O-N 3.47Å; E200-Y204 PolarHBondContact O-N 3.31Å; E200-L277 HydrophobicContact CG-CD1 3.91Å; E200-F392 HydrophobicContact CB-CB 4.13Å; E200-F392 HydrophobicContact CB-CD1 4.08Å; E200-F392 HydrophobicContact CB-CD2 4.07Å; E200-F392 HydrophobicContact CB-CG 3.82Å; E200-F392 VanDerWaalsContact CD-CB 3.48Å; E200-F392 HydrophobicContact CG-CB 3.87Å; E200-F392 HydrophobicContact CG-CD1 3.73Å; E200-F392 HydrophobicContact CG-CE1 4.47Å; E200-F392 HydrophobicContact CG-CG 3.78Å; E200-F392 WeakPolarHBondContact O-CE2 3.27Å
201	H	92.8	Very high	90.6	Very high	9 Å²	9	38.4 Å²	38.4	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-69.5	-38.6	-178.8	-69.2	75.3	0	0	0	112.4	E197 S203 Y204 L205 N395 L399 L402	E197-H201 PolarHBondContact O-N 3.13Å; E197-H201 VanDerWaalsContact O-N 3.12Å; E197-H201 PolarHBondContact O-ND1 2.87Å; H201-S203 VanDerWaalsContact C-N 3.33Å; H201-Y204 WeakPolarHBondContact O-CB 3.49Å; H201-Y204 PolarHBondContact O-N 3.37Å; H201-L205 WeakPolarHBondContact O-CG 3.4Å; H201-L205 PolarHBondContact O-N 2.96Å; H201-L205 VanDerWaalsContact O-N 3.08Å; H201-N395 PolarHBondContact NE2-N 2.98Å; H201-L399 HydrophobicContact CB-CD2 4.21Å; H201-L402 HydrophobicContact CB-CD1 3.5Å; H201-L402 VanDerWaalsContact CB-CD1 3.5Å
202	L	93.7	Very high	91.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.3	-39.5	170.7	-68.9	174.7	0	0	0	111.7	M198 Y204 L205 E206 M239 V243 W246 V270 T282 L402 L406	M198-L202 HydrophobicContact CG-CD1 4.06Å; M198-L202 WeakPolarHBondContact O-CB 3.26Å; M198-L202 VanDerWaalsContact O-CG 3.25Å; M198-L202 WeakPolarHBondContact O-CG 3.41Å; M198-L202 PolarHBondContact O-N 2.95Å; L202-Y204 VanDerWaalsContact C-N 3.33Å; L202-Y204 PolarHBondContact O-N 3.49Å; L202-L205 PolarHBondContact O-N 3Å; L202-E206 WeakPolarHBondContact O-CB 3.38Å; L202-E206 PolarHBondContact O-N 3.15Å; L202-M239 HydrophobicContact CD2-CE 4.2Å; L202-V243 HydrophobicContact CD2-CG2 4.08Å; L202-W246 HydrophobicContact CD1-CZ3 4.4Å; L202-V270 HydrophobicContact CD1-CG1 4.48Å; L202-T282 HydrophobicContact CB-CG2 3.96Å; L202-T282 HydrophobicContact CD1-CG2 4.31Å; L202-L402 HydrophobicContact CD2-CD1 4.48Å; L202-L402 HydrophobicContact CD2-CD2 4.43Å; L202-L406 HydrophobicContact CD2-CD1 3.79Å
203	S	94.8	Very high	91.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66.6	-33.3	175.4	-60.9	0	0	0	0	112.8	A199 E200 H201 F207 L274 N279	A199-S203 WeakPolarHBondContact O-CB 3.25Å; A199-S203 PolarHBondContact O-N 3.39Å; A199-S203 PolarHBondContact O-OG 3.43Å; E200-S203 CarbonylContact O-C 3.56Å; E200-S203 WeakPolarHBondContact O-CB 3.32Å; E200-S203 PolarHBondContact O-N 3.47Å; H201-S203 VanDerWaalsContact C-N 3.33Å; S203-F207 WeakPolarHBondContact O-CB 3.35Å; S203-F207 PolarHBondContact O-N 3.26Å; S203-L274 VanDerWaalsContact OG-CD2 3.31Å; S203-L274 WeakPolarHBondContact OG-CD2 3.28Å; S203-N279 WeakPolarHBondContact CA-ND2 3.4Å; S203-N279 WeakPolarHBondContact CB-ND2 3.25Å; S203-N279 PolarHBondContact OG-ND2 3.3Å
204	Y	93.8	Very high	92.3	Very high	87 Å²	87	34 Å²	34	34%	0.341	17%	0.168	S	C	.	.	H	α-helix	trans	-65.6	-46.9	173.5	-174.5	-90	0	0	0	111.9	E200 H201 L202 K208 F392 A394 L399	E200-Y204 PolarHBondContact O-N 3.31Å; H201-Y204 WeakPolarHBondContact O-CB 3.49Å; H201-Y204 PolarHBondContact O-N 3.37Å; L202-Y204 VanDerWaalsContact C-N 3.33Å; L202-Y204 PolarHBondContact O-N 3.49Å; Y204-K208 HydrophobicContact CE1-CD 4.49Å; Y204-K208 VanDerWaalsContact O-CB 3.22Å; Y204-K208 WeakPolarHBondContact O-CB 3.28Å; Y204-K208 PolarHBondContact O-N 3.16Å; Y204-F392 HydrophobicContact CD2-CE2 4.47Å; Y204-A394 HydrophobicContact CD1-CB 3.92Å; Y204-A394 HydrophobicContact CD2-CB 3.6Å; Y204-A394 HydrophobicContact CE1-CB 4.38Å; Y204-A394 HydrophobicContact CE2-CB 4.1Å; Y204-A394 HydrophobicContact CG-CB 3.49Å; Y204-A394 VanDerWaalsContact CG-CB 3.49Å; Y204-L399 HydrophobicContact CD1-CD1 3.54Å; Y204-L399 HydrophobicContact CD1-CD2 3.64Å; Y204-L399 HydrophobicContact CD1-CG 4.26Å; Y204-L399 HydrophobicContact CE1-CD1 3.47Å; Y204-L399 VanDerWaalsContact CE1-CD1 3.47Å; Y204-L399 HydrophobicContact CE1-CD2 4.41Å; Y204-L399 HydrophobicContact CG-CD1 4.48Å; Y204-L399 HydrophobicContact CG-CD2 4.29Å
205	L	92.1	Very high	92.4	Very high	15 Å²	15	29.6 Å²	29.6	8%	0.079	15%	0.147	C	C	.	.	H	α-helix	trans	-61.6	-47.6	177.7	-70.7	174.6	0	0	0	111.5	H201 L202 K208 N209 M239 L399 L402 L406	H201-L205 WeakPolarHBondContact O-CG 3.4Å; H201-L205 PolarHBondContact O-N 2.96Å; H201-L205 VanDerWaalsContact O-N 3.08Å; L202-L205 PolarHBondContact O-N 3Å; L205-K208 PolarHBondContact O-N 2.94Å; L205-N209 PolarHBondContact O-N 3.29Å; L205-N209 PolarHBondContact O-ND2 3.19Å; L205-M239 HydrophobicContact CB-CE 3.45Å; L205-M239 VanDerWaalsContact CB-CE 3.45Å; L205-M239 HydrophobicContact CB-SD 4.03Å; L205-M239 HydrophobicContact CD1-CE 4.06Å; L205-M239 HydrophobicContact CG-CE 4.41Å; L205-L399 HydrophobicContact CD1-CD2 4.45Å; L205-L399 HydrophobicContact CD2-CD2 3.89Å; L205-L399 HydrophobicContact CG-CD2 3.81Å; L205-L402 HydrophobicContact CD1-CB 3.93Å; L205-L406 HydrophobicContact CD1-CD1 4.11Å
206	E	93.6	Very high	92.2	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-64.1	-47.8	177.9	-177.1	58.7	-147.8	0	0	111.8	L202 K208 N209 F210 S236 M239 N281 V341	L202-E206 WeakPolarHBondContact O-CB 3.38Å; L202-E206 PolarHBondContact O-N 3.15Å; E206-K208 VanDerWaalsContact C-N 3.32Å; E206-K208 PolarHBondContact O-N 3.49Å; E206-N209 PolarHBondContact O-N 2.95Å; E206-N209 VanDerWaalsContact O-N 3.12Å; E206-F210 WeakPolarHBondContact O-CB 3.26Å; E206-F210 PolarHBondContact O-N 3.25Å; E206-S236 PolarHBondContact OE1-OG 3.46Å; E206-M239 WeakPolarHBondContact OE2-CG 3.36Å; E206-N281 HydrophobicContact CG-CB 4.23Å; E206-N281 PolarHBondContact OE1-ND2 2.92Å; E206-V341 HydrophobicContact CG-CG1 4.05Å
207	F	93.5	Very high	92.3	Very high	16 Å²	16	28 Å²	28	7%	0.07	14%	0.138	C	C	.	.	H	α-helix	trans	-63.2	-38.4	-179.9	-175.4	-107.2	0	0	0	112.3	S203 F210 C211 F339 V341 I385 C388 P390	S203-F207 WeakPolarHBondContact O-CB 3.35Å; S203-F207 PolarHBondContact O-N 3.26Å; F207-F210 HydrophobicContact CD2-CD1 4.31Å; F207-F210 HydrophobicContact CE2-CD1 4.42Å; F207-F210 PolarHBondContact O-N 3.4Å; F207-C211 VanDerWaalsContact CE1-SG 3.51Å; F207-C211 WeakPolarHBondContact CZ-SG 3.46Å; F207-C211 WeakPolarHBondContact O-CB 3.48Å; F207-C211 PolarHBondContact O-N 2.96Å; F207-C211 PolarHBondContact O-SG 3.36Å; F207-F339 HydrophobicContact CB-CE2 4.22Å; F207-F339 HydrophobicContact CB-CZ 4.28Å; F207-F339 HydrophobicContact CD1-CE2 4.04Å; F207-F339 HydrophobicContact CD2-CD2 4.42Å; F207-F339 AromaticContact CD2-CE2 3.55Å; F207-F339 HydrophobicContact CD2-CE2 3.55Å; F207-F339 HydrophobicContact CD2-CZ 4.19Å; F207-F339 HydrophobicContact CE1-CE2 4.28Å; F207-F339 HydrophobicContact CE2-CD2 4.27Å; F207-F339 AromaticContact CE2-CE2 3.82Å; F207-F339 HydrophobicContact CE2-CE2 3.82Å; F207-F339 AromaticContact CG-CE2 3.66Å; F207-F339 HydrophobicContact CG-CE2 3.66Å; F207-F339 HydrophobicContact CG-CZ 4.21Å; F207-F339 HydrophobicContact CZ-CD2 4.47Å; F207-F339 HydrophobicContact CZ-CE2 4.18Å; F207-V341 HydrophobicContact CD2-CG2 4.28Å; F207-I385 HydrophobicContact CE2-CG2 4.23Å; F207-C388 WeakPolarHBondContact CE1-O 3.19Å; F207-C388 HydrophobicContact CZ-CB 4.43Å; F207-C388 WeakPolarHBondContact CZ-O 3.33Å; F207-P390 HydrophobicContact CD1-CG 3.72Å; F207-P390 HydrophobicContact CE1-CG 3.92Å
208	K	91.9	Very high	92.4	Very high	116 Å²	116	25.9 Å²	25.9	50%	0.504	13%	0.128	S	C	.	.	H	α-helix	trans	-61.2	-44.1	172.5	-177.8	-170.7	174.5	-163.7	0	111.3	Y204 L205 E206 C211 N212	Y204-K208 HydrophobicContact CE1-CD 4.49Å; Y204-K208 VanDerWaalsContact O-CB 3.22Å; Y204-K208 WeakPolarHBondContact O-CB 3.28Å; Y204-K208 PolarHBondContact O-N 3.16Å; L205-K208 PolarHBondContact O-N 2.94Å; E206-K208 VanDerWaalsContact C-N 3.32Å; E206-K208 PolarHBondContact O-N 3.49Å; K208-C211 PolarHBondContact O-N 3.34Å; K208-N212 PolarHBondContact O-N 3.28Å; K208-N212 PolarHBondContact O-ND2 3.04Å
209	N	91.1	Very high	92.3	Very high	30 Å²	30	29.7 Å²	29.7	16%	0.16	14%	0.142	C	C	.	.	H	α-helix	trans	-66.6	-42.7	178.1	-76.5	-22.2	0	0	0	112.1	L205 E206 N212	L205-N209 PolarHBondContact O-N 3.29Å; L205-N209 PolarHBondContact O-ND2 3.19Å; E206-N209 PolarHBondContact O-N 2.95Å; E206-N209 VanDerWaalsContact O-N 3.12Å; N209-N212 WeakPolarHBondContact O-CB 3.45Å; N209-N212 PolarHBondContact O-N 3.38Å
210	F	92.7	Very high	92.1	Very high	1 Å²	1	30.7 Å²	30.7	0%	0.004	15%	0.149	C	C	.	.	H	α-helix	trans	-59.5	-46.1	173.5	172.8	-110.3	0	0	0	112.1	E206 F207 N212 V213 Y218 P342 L344 L382 I385 H386	E206-F210 WeakPolarHBondContact O-CB 3.26Å; E206-F210 PolarHBondContact O-N 3.25Å; F207-F210 HydrophobicContact CD2-CD1 4.31Å; F207-F210 HydrophobicContact CE2-CD1 4.42Å; F207-F210 PolarHBondContact O-N 3.4Å; F210-N212 PolarHBondContact O-N 2.97Å; F210-N212 VanDerWaalsContact O-N 3.15Å; F210-V213 WeakPolarHBondContact O-CB 3.09Å; F210-V213 WeakPolarHBondContact O-CG2 3.44Å; F210-V213 PolarHBondContact O-N 3.42Å; F210-Y218 WeakPolarHBondContact CE2-OH 3.44Å; F210-P342 HydrophobicContact CE2-CG 3.89Å; F210-P342 HydrophobicContact CZ-CG 3.88Å; F210-L344 HydrophobicContact CD2-CD1 4.13Å; F210-L344 HydrophobicContact CD2-CD2 4.43Å; F210-L344 HydrophobicContact CE2-CD1 3.89Å; F210-L382 HydrophobicContact CE2-CD2 4.44Å; F210-L382 HydrophobicContact CZ-CB 4.46Å; F210-L382 HydrophobicContact CZ-CD2 4.43Å; F210-I385 HydrophobicContact CE1-CB 3.94Å; F210-I385 HydrophobicContact CE1-CG2 3.84Å; F210-I385 HydrophobicContact CZ-CB 4.36Å; F210-I385 HydrophobicContact CZ-CD1 4.39Å; F210-H386 AromaticContact CE1-CD2 3.52Å; F210-H386 AromaticContact CE1-NE2 3.64Å; F210-H386 AromaticContact CZ-CD2 3.86Å; F210-H386 AromaticContact CZ-NE2 3.63Å; F210-H386 PolarHBondContact O-CE1 2.72Å
211	C	91.4	Very high	91.9	Very high	37 Å²	37	29.1 Å²	29.1	25%	0.25	14%	0.141	C	C	.	.	H	α-helix	trans	-63.1	-22.2	179.3	-69.7	0	0	0	0	114.1	F207 K208 V213 H386	F207-C211 VanDerWaalsContact CE1-SG 3.51Å; F207-C211 WeakPolarHBondContact CZ-SG 3.46Å; F207-C211 WeakPolarHBondContact O-CB 3.48Å; F207-C211 PolarHBondContact O-N 2.96Å; F207-C211 PolarHBondContact O-SG 3.36Å; K208-C211 PolarHBondContact O-N 3.34Å; C211-V213 VanDerWaalsContact C-N 3.29Å; C211-H386 WeakPolarHBondContact CA-ND1 3.44Å; C211-H386 PolarHBondContact O-ND1 3.16Å
212	N	91.2	Very high	91.7	Very high	83 Å²	83	29.1 Å²	29.1	44%	0.444	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-6.5	175.5	-64.4	-35.8	0	0	0	113.6	K208 N209 F210 A232	K208-N212 PolarHBondContact O-N 3.28Å; K208-N212 PolarHBondContact O-ND2 3.04Å; N209-N212 WeakPolarHBondContact O-CB 3.45Å; N209-N212 PolarHBondContact O-N 3.38Å; F210-N212 PolarHBondContact O-N 2.97Å; F210-N212 VanDerWaalsContact O-N 3.15Å; N212-A232 WeakPolarHBondContact O-CB 3.14Å
213	V	91.8	Very high	91.4	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.012	17%	0.169	C	C	.	.			trans	-85	113.4	-178.8	-175.9	0	0	0	0	110.4	F210 C211 D217 Y218 A232 L233 H386	F210-V213 WeakPolarHBondContact O-CB 3.09Å; F210-V213 WeakPolarHBondContact O-CG2 3.44Å; F210-V213 PolarHBondContact O-N 3.42Å; C211-V213 VanDerWaalsContact C-N 3.29Å; V213-D217 HydrophobicContact CG1-CB 4.02Å; V213-Y218 HydrophobicContact CG1-CD1 4.01Å; V213-Y218 HydrophobicContact CG1-CD2 4.45Å; V213-Y218 HydrophobicContact CG1-CE1 3.53Å; V213-Y218 HydrophobicContact CG1-CE2 4Å; V213-Y218 HydrophobicContact CG1-CG 4.44Å; V213-A232 HydrophobicContact CG2-CB 4.17Å; V213-L233 HydrophobicContact CB-CD2 4.48Å; V213-L233 HydrophobicContact CG1-CD2 3.61Å; V213-L233 HydrophobicContact CG1-CG 3.95Å; V213-L233 HydrophobicContact CG2-CD2 3.97Å; V213-H386 PolarHBondContact O-CE1 2.76Å; V213-H386 VanDerWaalsContact O-CE1 3.3Å
214	S	91.1	Very high	90.8	Very high	30 Å²	30	40.1 Å²	40.1	21%	0.21	19%	0.193	C	C	.	.			trans	-86.2	165.5	179	74.4	0	0	0	0	112.9	L216 D217 Y218	S214-L216 PolarHBondContact O-N 3Å; S214-L216 PolarHBondContact OG-N 3.1Å; S214-D217 VanDerWaalsContact CB-OD2 3.3Å; S214-D217 WeakPolarHBondContact CB-OD2 3.49Å; S214-D217 PolarHBondContact N-OD2 3.4Å; S214-D217 WeakPolarHBondContact O-CB 3.35Å; S214-D217 PolarHBondContact O-N 2.97Å; S214-D217 PolarHBondContact OG-N 3.06Å; S214-D217 PolarHBondContact OG-OD2 3.42Å; S214-Y218 PolarHBondContact O-N 3.08Å; S214-Y218 VanDerWaalsContact O-N 3.13Å
215	F	90.7	Very high	90.1	Very high	18 Å²	18	38.6 Å²	38.6	8%	0.079	20%	0.204	C	C	.	.	H	α-helix	trans	-59.2	-29.9	171.1	74.9	-83.2	0	0	0	113.2	M84 F129 V132 D217 Y218 R219 I379 L383	M84-F215 HydrophobicContact CB-CD2 4.42Å; M84-F215 HydrophobicContact CB-CE2 4.49Å; M84-F215 HydrophobicContact CG-CB 3.83Å; M84-F215 HydrophobicContact CG-CD1 4.03Å; M84-F215 HydrophobicContact CG-CD2 3.29Å; M84-F215 HydrophobicContact CG-CE1 4.43Å; M84-F215 HydrophobicContact CG-CE2 3.74Å; M84-F215 HydrophobicContact CG-CG 3.44Å; M84-F215 VanDerWaalsContact CG-CG 3.44Å; M84-F215 HydrophobicContact CG-CZ 4.27Å; M84-F215 WeakPolarHBondContact O-CD2 3.42Å; M84-F215 WeakPolarHBondContact O-CE2 3.42Å; M84-F215 HydrophobicContact SD-CB 3.79Å; M84-F215 HydrophobicContact SD-CD1 4.42Å; M84-F215 HydrophobicContact SD-CD2 4.38Å; M84-F215 HydrophobicContact SD-CG 3.96Å; F129-F215 HydrophobicContact CB-CE1 4.14Å; F129-F215 HydrophobicContact CB-CZ 4.16Å; F129-F215 HydrophobicContact CD1-CD1 4.06Å; F129-F215 AromaticContact CD1-CE1 3.4Å; F129-F215 HydrophobicContact CD1-CE1 3.4Å; F129-F215 AromaticContact CD1-CZ 3.86Å; F129-F215 HydrophobicContact CD1-CZ 3.86Å; F129-F215 HydrophobicContact CE1-CD1 4.4Å; F129-F215 HydrophobicContact CE1-CE1 4.12Å; F129-F215 HydrophobicContact CG-CE1 4.05Å; F129-F215 HydrophobicContact CG-CZ 4.13Å; V132-F215 HydrophobicContact CG2-CE1 4.31Å; V132-F215 HydrophobicContact CG2-CE2 4.49Å; V132-F215 HydrophobicContact CG2-CZ 3.57Å; F215-D217 VanDerWaalsContact C-N 3.27Å; F215-D217 PolarHBondContact O-N 3.45Å; F215-Y218 PolarHBondContact O-N 3.37Å; F215-R219 WeakPolarHBondContact O-CB 3.27Å; F215-R219 PolarHBondContact O-N 3.43Å; F215-I379 HydrophobicContact CB-CG2 4.01Å; F215-L383 HydrophobicContact CB-CD1 4.17Å
216	L	89.8	Confident	89.6	Confident	21 Å²	21	39.8 Å²	39.8	11%	0.11	21%	0.214	C	C	.	.	H	α-helix	trans	-66.7	-32.1	174.3	-63.8	173.8	0	0	0	111.5	A131 V132 K135 S214 S220	A131-L216 WeakPolarHBondContact O-CD1 3.36Å; V132-L216 HydrophobicContact CG2-CD1 4.12Å; V132-L216 HydrophobicContact CG2-CD2 4.4Å; K135-L216 HydrophobicContact CD-CD1 4.25Å; S214-L216 PolarHBondContact O-N 3Å; S214-L216 PolarHBondContact OG-N 3.1Å; L216-S220 VanDerWaalsContact O-CB 3.25Å; L216-S220 WeakPolarHBondContact O-CB 3.43Å; L216-S220 PolarHBondContact O-N 3.33Å
217	D	91.6	Very high	89	Confident	17 Å²	17	40.4 Å²	40.4	9%	0.091	22%	0.218	C	C	.	.	H	α-helix	trans	-75.8	-38.9	178.1	-56.1	-45.3	0	0	0	110.6	V213 S214 F215 S220 Y221 N230 A232	V213-D217 HydrophobicContact CG1-CB 4.02Å; S214-D217 VanDerWaalsContact CB-OD2 3.3Å; S214-D217 WeakPolarHBondContact CB-OD2 3.49Å; S214-D217 PolarHBondContact N-OD2 3.4Å; S214-D217 WeakPolarHBondContact O-CB 3.35Å; S214-D217 PolarHBondContact O-N 2.97Å; S214-D217 PolarHBondContact OG-N 3.06Å; S214-D217 PolarHBondContact OG-OD2 3.42Å; F215-D217 VanDerWaalsContact C-N 3.27Å; F215-D217 PolarHBondContact O-N 3.45Å; D217-S220 PolarHBondContact O-N 3.34Å; D217-Y221 WeakPolarHBondContact O-CB 3.4Å; D217-Y221 PolarHBondContact O-N 3.03Å; D217-N230 WeakPolarHBondContact CA-ND2 3.22Å; D217-N230 WeakPolarHBondContact CB-OD1 3.22Å; D217-N230 PolarHBondContact O-ND2 3.22Å; D217-A232 HydrophobicContact CB-CB 4.46Å
218	Y	92.7	Very high	88.2	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60.8	-45.8	168.5	-65.6	-49.3	0	0	0	111.9	F210 V213 S214 F215 Y221 V222 L233 L344 L348 I379 L382 L383	F210-Y218 WeakPolarHBondContact CE2-OH 3.44Å; V213-Y218 HydrophobicContact CG1-CD1 4.01Å; V213-Y218 HydrophobicContact CG1-CD2 4.45Å; V213-Y218 HydrophobicContact CG1-CE1 3.53Å; V213-Y218 HydrophobicContact CG1-CE2 4Å; V213-Y218 HydrophobicContact CG1-CG 4.44Å; S214-Y218 PolarHBondContact O-N 3.08Å; S214-Y218 VanDerWaalsContact O-N 3.13Å; F215-Y218 PolarHBondContact O-N 3.37Å; Y218-Y221 PolarHBondContact O-N 2.98Å; Y218-V222 VanDerWaalsContact O-CG2 3.26Å; Y218-V222 WeakPolarHBondContact O-CG2 3.46Å; Y218-V222 PolarHBondContact O-N 3.06Å; Y218-L233 HydrophobicContact CE1-CD2 4.3Å; Y218-L344 HydrophobicContact CE1-CD1 4.06Å; Y218-L348 HydrophobicContact CD1-CD2 3.65Å; Y218-L348 HydrophobicContact CE1-CD2 3.96Å; Y218-I379 HydrophobicContact CD2-CG1 4.5Å; Y218-I379 HydrophobicContact CD2-CG2 4.02Å; Y218-L382 HydrophobicContact CE1-CD1 4.21Å; Y218-L382 HydrophobicContact CE2-CB 4.44Å; Y218-L382 HydrophobicContact CE2-CD1 4.33Å; Y218-L383 HydrophobicContact CE2-CD2 4.3Å
219	R	90.7	Very high	87.6	Confident	79 Å²	79	48.7 Å²	48.7	30%	0.298	26%	0.255	S	S	.	.	H	α-helix	trans	-57.9	-50.1	173.6	175.3	178.8	163.7	-97.7	7	111.8	S87 W88 F215 Y221 V222 V223	S87-R219 PolarHBondContact O-NE 3.08Å; S87-R219 PolarHBondContact O-NH2 2.89Å; S87-R219 WeakPolarHBondContact OG-CD 3.4Å; S87-R219 PolarHBondContact OG-NE 2.75Å; W88-R219 HydrophobicContact CD2-CG 4.18Å; W88-R219 HydrophobicContact CE3-CB 3.71Å; W88-R219 HydrophobicContact CE3-CG 3.75Å; W88-R219 HydrophobicContact CH2-CB 4.21Å; W88-R219 VanDerWaalsContact CZ3-CA 3.46Å; W88-R219 HydrophobicContact CZ3-CB 3.51Å; W88-R219 HydrophobicContact CZ3-CG 4.04Å; F215-R219 WeakPolarHBondContact O-CB 3.27Å; F215-R219 PolarHBondContact O-N 3.43Å; R219-Y221 VanDerWaalsContact C-N 3.33Å; R219-Y221 PolarHBondContact O-N 3.41Å; R219-V222 PolarHBondContact O-N 3.13Å; R219-V223 HydrophobicContact CG-CG2 4.3Å; R219-V223 WeakPolarHBondContact O-CB 3.38Å; R219-V223 WeakPolarHBondContact O-CG2 3.43Å; R219-V223 PolarHBondContact O-N 3.36Å
220	S	89.9	Confident	87.4	Confident	22 Å²	22	47.3 Å²	47.3	15%	0.154	25%	0.248	C	C	.	.	H	α-helix	trans	-56.6	-47.9	-179.4	-174.6	0	0	0	0	111	L216 D217 R224	L216-S220 VanDerWaalsContact O-CB 3.25Å; L216-S220 WeakPolarHBondContact O-CB 3.43Å; L216-S220 PolarHBondContact O-N 3.33Å; D217-S220 PolarHBondContact O-N 3.34Å; S220-R224 WeakPolarHBondContact O-CB 3.49Å; S220-R224 WeakPolarHBondContact O-CD 3.3Å; S220-R224 WeakPolarHBondContact O-CG 3.39Å; S220-R224 PolarHBondContact O-N 2.8Å; S220-R224 WeakPolarHBondContact OG-CD 3.47Å; S220-R224 PolarHBondContact OG-NE 2.95Å
221	Y	89.9	Confident	87.1	Confident	28 Å²	28	50.4 Å²	50.4	11%	0.11	27%	0.268	C	S	.	.	H	α-helix	trans	-63.5	-47.1	177.9	177.3	-96.9	0	0	0	113.3	D217 Y218 R219 V223 R224 G225 S226 V227 L233 L348 I352	D217-Y221 WeakPolarHBondContact O-CB 3.4Å; D217-Y221 PolarHBondContact O-N 3.03Å; Y218-Y221 PolarHBondContact O-N 2.98Å; R219-Y221 VanDerWaalsContact C-N 3.33Å; R219-Y221 PolarHBondContact O-N 3.41Å; Y221-V223 PolarHBondContact O-N 2.76Å; Y221-R224 PolarHBondContact O-N 3.47Å; Y221-G225 WeakPolarHBondContact O-CA 3.5Å; Y221-G225 PolarHBondContact O-N 3.16Å; Y221-S226 WeakPolarHBondContact CD2-O 3.41Å; Y221-V227 HydrophobicContact CD2-CB 4.47Å; Y221-V227 HydrophobicContact CD2-CG1 3.51Å; Y221-V227 HydrophobicContact CE2-CG1 3.62Å; Y221-L233 HydrophobicContact CD2-CD1 4.22Å; Y221-L233 HydrophobicContact CG-CD1 3.91Å; Y221-L348 HydrophobicContact CD1-CB 4.3Å; Y221-L348 HydrophobicContact CD1-CD1 4.37Å; Y221-L348 HydrophobicContact CD1-CD2 3.87Å; Y221-L348 HydrophobicContact CD1-CG 4.41Å; Y221-L348 HydrophobicContact CE1-CB 3.74Å; Y221-L348 HydrophobicContact CE1-CD1 4.09Å; Y221-L348 HydrophobicContact CE1-CD2 4.17Å; Y221-L348 HydrophobicContact CE1-CG 4.23Å; Y221-I352 HydrophobicContact CD1-CD1 4.31Å; Y221-I352 HydrophobicContact CE1-CD1 3.5Å; Y221-I352 VanDerWaalsContact CE1-CD1 3.5Å; Y221-I352 HydrophobicContact CE1-CG1 4.2Å
222	V	88.7	Confident	87	Confident	9 Å²	9	49 Å²	49	6%	0.055	26%	0.259	C	S	.	.	H	α-helix	trans	-70.5	-31.8	-175.7	177.1	0	0	0	0	112.3	W88 Y218 R219 L351 I352 N355	W88-V222 HydrophobicContact CH2-CB 4.07Å; W88-V222 HydrophobicContact CH2-CG1 4.36Å; W88-V222 HydrophobicContact CH2-CG2 4.32Å; W88-V222 HydrophobicContact CZ2-CB 3.79Å; W88-V222 HydrophobicContact CZ2-CG1 3.65Å; W88-V222 HydrophobicContact CZ2-CG2 4.41Å; Y218-V222 VanDerWaalsContact O-CG2 3.26Å; Y218-V222 WeakPolarHBondContact O-CG2 3.46Å; Y218-V222 PolarHBondContact O-N 3.06Å; R219-V222 PolarHBondContact O-N 3.13Å; V222-L351 HydrophobicContact CG2-CB 3.66Å; V222-L351 HydrophobicContact CG2-CD1 4.38Å; V222-I352 HydrophobicContact CG1-CG1 4.3Å; V222-I352 HydrophobicContact CG2-CG1 4.3Å; V222-N355 HydrophobicContact CG1-CB 3.47Å; V222-N355 VanDerWaalsContact CG1-CB 3.47Å
223	V	86.1	Confident	86.9	Confident	93 Å²	93	45 Å²	45	56%	0.564	24%	0.238	S	C	*	.	H	α-helix	trans	-79.2	-34.6	176	175	0	0	0	0	112.1	R219 Y221	R219-V223 HydrophobicContact CG-CG2 4.3Å; R219-V223 WeakPolarHBondContact O-CB 3.38Å; R219-V223 WeakPolarHBondContact O-CG2 3.43Å; R219-V223 PolarHBondContact O-N 3.36Å; Y221-V223 PolarHBondContact O-N 2.76Å
224	R	83.4	Confident	86.7	Confident	137 Å²	137	47.4 Å²	47.4	52%	0.517	25%	0.249	S	C	.	.	H	α-helix	trans	-92.9	-15.1	-177.7	-63	172.5	173	-149	-4.3	114.6	S220 Y221 S226 R228 D229	S220-R224 WeakPolarHBondContact O-CB 3.49Å; S220-R224 WeakPolarHBondContact O-CD 3.3Å; S220-R224 WeakPolarHBondContact O-CG 3.39Å; S220-R224 PolarHBondContact O-N 2.8Å; S220-R224 WeakPolarHBondContact OG-CD 3.47Å; S220-R224 PolarHBondContact OG-NE 2.95Å; Y221-R224 PolarHBondContact O-N 3.47Å; R224-S226 PolarHBondContact O-N 3.22Å; R224-R228 PolarHBondContact NH1-O 2.96Å; R224-D229 IonicContact CZ-OD2 2.73Å; R224-D229 IonicContact NH1-OD2 2.67Å; R224-D229 PolarHBondContact NH1-OD2 2.87Å
225	G	79.4	Confident	86.5	Confident	56 Å²	56	51.5 Å²	51.5	58%	0.577	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	20.5	-171.4	0	0	0	0	0	114.3	Y221	Y221-G225 WeakPolarHBondContact O-CA 3.5Å; Y221-G225 PolarHBondContact O-N 3.16Å
226	S	79.6	Confident	86.4	Confident	40 Å²	40	50.6 Å²	50.6	28%	0.28	26%	0.256	S	S	.	.	S	Bend	trans	-154.3	146.3	-166	-178	0	0	0	0	112.1	Y221 R224 R228	Y221-S226 WeakPolarHBondContact CD2-O 3.41Å; R224-S226 PolarHBondContact O-N 3.22Å; S226-R228 VanDerWaalsContact C-N 3.34Å; S226-R228 PolarHBondContact OG-N 2.96Å
227	V	81.5	Confident	86.3	Confident	14 Å²	14	49.6 Å²	49.6	9%	0.085	25%	0.25	C	S	.	.			trans	-87.5	2.2	171.7	-61.7	0	0	0	0	113.4	Y221 N230 L233 V237 V447	Y221-V227 HydrophobicContact CD2-CB 4.47Å; Y221-V227 HydrophobicContact CD2-CG1 3.51Å; Y221-V227 HydrophobicContact CE2-CG1 3.62Å; V227-N230 VanDerWaalsContact O-CB 3.28Å; V227-N230 WeakPolarHBondContact O-CB 3.26Å; V227-N230 PolarHBondContact O-N 3.22Å; V227-N230 VanDerWaalsContact O-N 3.13Å; V227-L233 HydrophobicContact CB-CB 4.43Å; V227-L233 HydrophobicContact CG1-CB 3.9Å; V227-V237 HydrophobicContact CG1-CG2 4.37Å; V227-V447 HydrophobicContact CG2-CG2 3.37Å
228	R	77.3	Confident	85.9	Confident	173 Å²	173	50.5 Å²	50.5	65%	0.653	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	140.2	175.5	-68	-173.7	-179.1	-168.1	-0	111	R224 S226 N230	R224-R228 PolarHBondContact NH1-O 2.96Å; S226-R228 VanDerWaalsContact C-N 3.34Å; S226-R228 PolarHBondContact OG-N 2.96Å; R228-N230 PolarHBondContact O-N 3.04Å
229	D	78.8	Confident	85.7	Confident	133 Å²	133	51.2 Å²	51.2	71%	0.711	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	26.1	-170.6	-24.3	-50.2	0	0	0	113.4	R224	R224-D229 IonicContact CZ-OD2 2.73Å; R224-D229 IonicContact NH1-OD2 2.67Å; R224-D229 PolarHBondContact NH1-OD2 2.87Å
230	N	86.3	Confident	85.5	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	25%	0.245	C	C	.	.			trans	-126.9	76.4	178.3	-170.5	-34.2	0	0	0	110	D217 V227 R228 A232 L233 E234	D217-N230 WeakPolarHBondContact CA-ND2 3.22Å; D217-N230 WeakPolarHBondContact CB-OD1 3.22Å; D217-N230 PolarHBondContact O-ND2 3.22Å; V227-N230 VanDerWaalsContact O-CB 3.28Å; V227-N230 WeakPolarHBondContact O-CB 3.26Å; V227-N230 PolarHBondContact O-N 3.22Å; V227-N230 VanDerWaalsContact O-N 3.13Å; R228-N230 PolarHBondContact O-N 3.04Å; N230-A232 PolarHBondContact O-N 3.39Å; N230-A232 VanDerWaalsContact O-N 3.09Å; N230-L233 PolarHBondContact O-N 3.22Å; N230-L233 PolarHBondContact OD1-N 3.45Å; N230-E234 VanDerWaalsContact O-CB 3.28Å; N230-E234 WeakPolarHBondContact O-CB 3.46Å; N230-E234 PolarHBondContact O-N 3.47Å
231	P	87.4	Confident	85.4	Confident	66 Å²	66	48.5 Å²	48.5	43%	0.429	25%	0.248	S	C	.	.	H	α-helix	trans	-68	-14.4	-168.9	28.1	-36.5	0	0	0	113.6	R235	P231-R235 WeakPolarHBondContact O-CB 3.46Å; P231-R235 VanDerWaalsContact O-CG 3.25Å; P231-R235 WeakPolarHBondContact O-CG 3.27Å; P231-R235 PolarHBondContact O-N 2.84Å; P231-R235 PolarHBondContact O-NE 2.89Å; P231-R235 PolarHBondContact O-NH1 2.96Å; P231-R235 VanDerWaalsContact O-NH1 3.15Å
232	A	89.3	Confident	85.3	Confident	6 Å²	6	47.5 Å²	47.5	5%	0.05	25%	0.246	C	C	.	.	H	α-helix	trans	-75.4	-52.4	173.6	0	0	0	0	0	111.7	N212 V213 D217 N230 R235 S236	N212-A232 WeakPolarHBondContact O-CB 3.14Å; V213-A232 HydrophobicContact CG2-CB 4.17Å; D217-A232 HydrophobicContact CB-CB 4.46Å; N230-A232 PolarHBondContact O-N 3.39Å; N230-A232 VanDerWaalsContact O-N 3.09Å; A232-R235 PolarHBondContact O-N 3.32Å; A232-S236 PolarHBondContact O-N 3.36Å
233	L	89.4	Confident	85.5	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-69.3	-37.1	175.7	-73.2	177.6	0	0	0	112.2	V213 Y218 Y221 V227 N230 R235 S236 V237 L344 L348	V213-L233 HydrophobicContact CB-CD2 4.48Å; V213-L233 HydrophobicContact CG1-CD2 3.61Å; V213-L233 HydrophobicContact CG1-CG 3.95Å; V213-L233 HydrophobicContact CG2-CD2 3.97Å; Y218-L233 HydrophobicContact CE1-CD2 4.3Å; Y221-L233 HydrophobicContact CD2-CD1 4.22Å; Y221-L233 HydrophobicContact CG-CD1 3.91Å; V227-L233 HydrophobicContact CB-CB 4.43Å; V227-L233 HydrophobicContact CG1-CB 3.9Å; N230-L233 PolarHBondContact O-N 3.22Å; N230-L233 PolarHBondContact OD1-N 3.45Å; L233-R235 VanDerWaalsContact C-N 3.31Å; L233-R235 PolarHBondContact O-N 2.94Å; L233-S236 PolarHBondContact O-N 2.9Å; L233-S236 VanDerWaalsContact O-N 3.14Å; L233-V237 WeakPolarHBondContact O-CG2 3.26Å; L233-V237 PolarHBondContact O-N 3.34Å; L233-L344 HydrophobicContact CD2-CD2 3.67Å; L233-L348 HydrophobicContact CD1-CD2 4.46Å; L233-L348 HydrophobicContact CD2-CD1 4.3Å
234	E	86.7	Confident	85.7	Confident	53 Å²	53	43.3 Å²	43.3	25%	0.248	22%	0.221	C	C	.	.	H	α-helix	trans	-58.2	-42.2	176	-170.9	165.4	-139.4	0	0	111.5	N230 V237 M238 V447	N230-E234 VanDerWaalsContact O-CB 3.28Å; N230-E234 WeakPolarHBondContact O-CB 3.46Å; N230-E234 PolarHBondContact O-N 3.47Å; E234-V237 PolarHBondContact O-N 3.12Å; E234-M238 HydrophobicContact CG-SD 4.16Å; E234-M238 WeakPolarHBondContact O-CB 3.39Å; E234-M238 VanDerWaalsContact O-CG 3.3Å; E234-M238 WeakPolarHBondContact O-CG 3.49Å; E234-M238 PolarHBondContact O-N 3.37Å; E234-V447 HydrophobicContact CG-CG1 3.9Å
235	R	87.3	Confident	86	Confident	115 Å²	115	37.7 Å²	37.7	43%	0.434	20%	0.201	S	C	.	.	H	α-helix	trans	-64.6	-37	173.8	-77.9	-175.7	-118.9	106	-7.7	114	P231 A232 L233 M239	P231-R235 WeakPolarHBondContact O-CB 3.46Å; P231-R235 VanDerWaalsContact O-CG 3.25Å; P231-R235 WeakPolarHBondContact O-CG 3.27Å; P231-R235 PolarHBondContact O-N 2.84Å; P231-R235 PolarHBondContact O-NE 2.89Å; P231-R235 PolarHBondContact O-NH1 2.96Å; P231-R235 VanDerWaalsContact O-NH1 3.15Å; A232-R235 PolarHBondContact O-N 3.32Å; L233-R235 VanDerWaalsContact C-N 3.31Å; L233-R235 PolarHBondContact O-N 2.94Å; R235-M239 WeakPolarHBondContact O-CB 3.47Å; R235-M239 PolarHBondContact O-N 3.14Å
236	S	89.2	Confident	86.5	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-70	-38.4	174.5	176.3	0	0	0	0	111.9	E206 A232 L233 M239 C240	E206-S236 PolarHBondContact OE1-OG 3.46Å; A232-S236 PolarHBondContact O-N 3.36Å; L233-S236 PolarHBondContact O-N 2.9Å; L233-S236 VanDerWaalsContact O-N 3.14Å; S236-M239 PolarHBondContact O-N 3.45Å; S236-C240 WeakPolarHBondContact O-CB 3.4Å; S236-C240 PolarHBondContact O-N 3.08Å
237	V	86.3	Confident	87.1	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.8	-47.6	171.7	171.9	0	0	0	0	111.1	V227 L233 E234 M239 C240 N241 W443 G444 V447	V227-V237 HydrophobicContact CG1-CG2 4.37Å; L233-V237 WeakPolarHBondContact O-CG2 3.26Å; L233-V237 PolarHBondContact O-N 3.34Å; E234-V237 PolarHBondContact O-N 3.12Å; V237-M239 VanDerWaalsContact C-N 3.33Å; V237-M239 PolarHBondContact O-N 2.94Å; V237-C240 PolarHBondContact O-N 3.42Å; V237-N241 WeakPolarHBondContact O-CB 3.17Å; V237-N241 VanDerWaalsContact O-CG 3.3Å; V237-N241 PolarHBondContact O-N 3.49Å; V237-W443 HydrophobicContact CG2-CE3 3.92Å; V237-W443 HydrophobicContact CG2-CH2 3.76Å; V237-W443 HydrophobicContact CG2-CZ3 3.38Å; V237-G444 VanDerWaalsContact CG1-CA 3.46Å; V237-V447 HydrophobicContact CB-CG2 4.38Å; V237-V447 HydrophobicContact CG1-CB 3.85Å; V237-V447 HydrophobicContact CG1-CG1 4.26Å; V237-V447 HydrophobicContact CG1-CG2 3.68Å
238	M	84.2	Confident	87.6	Confident	36 Å²	36	32.9 Å²	32.9	18%	0.177	16%	0.158	C	C	.	.	H	α-helix	trans	-60.3	-41	177.5	-76	173.9	54.5	0	0	112	E234 N241 G242 V447 P449 L451	E234-M238 HydrophobicContact CG-SD 4.16Å; E234-M238 WeakPolarHBondContact O-CB 3.39Å; E234-M238 VanDerWaalsContact O-CG 3.3Å; E234-M238 WeakPolarHBondContact O-CG 3.49Å; E234-M238 PolarHBondContact O-N 3.37Å; M238-N241 PolarHBondContact O-N 3.44Å; M238-G242 WeakPolarHBondContact O-CA 3.45Å; M238-G242 PolarHBondContact O-N 3.25Å; M238-V447 HydrophobicContact CG-CG1 3.94Å; M238-P449 HydrophobicContact CE-CB 3.98Å; M238-L451 HydrophobicContact CE-CD2 3.96Å; M238-L451 HydrophobicContact CE-CG 3.93Å
239	M	87.6	Confident	88.1	Confident	15 Å²	15	24.7 Å²	24.7	7%	0.074	13%	0.127	C	C	.	.	H	α-helix	trans	-60.7	-47.9	174.1	-177.8	67.7	-168.1	0	0	111.9	L202 L205 E206 R235 S236 V237 G242 V243 L406	L202-M239 HydrophobicContact CD2-CE 4.2Å; L205-M239 HydrophobicContact CB-CE 3.45Å; L205-M239 VanDerWaalsContact CB-CE 3.45Å; L205-M239 HydrophobicContact CB-SD 4.03Å; L205-M239 HydrophobicContact CD1-CE 4.06Å; L205-M239 HydrophobicContact CG-CE 4.41Å; E206-M239 WeakPolarHBondContact OE2-CG 3.36Å; R235-M239 WeakPolarHBondContact O-CB 3.47Å; R235-M239 PolarHBondContact O-N 3.14Å; S236-M239 PolarHBondContact O-N 3.45Å; V237-M239 VanDerWaalsContact C-N 3.33Å; V237-M239 PolarHBondContact O-N 2.94Å; M239-G242 PolarHBondContact O-N 2.87Å; M239-V243 HydrophobicContact CE-CG2 3.84Å; M239-V243 WeakPolarHBondContact O-CG2 3.14Å; M239-V243 PolarHBondContact O-N 3.36Å; M239-L406 HydrophobicContact CE-CD1 3.68Å; M239-L406 HydrophobicContact SD-CD1 3.87Å
240	C	87.6	Confident	88.6	Confident	3 Å²	3	18.4 Å²	18.4	2%	0.02	9%	0.093	C	C	.	.	H	α-helix	trans	-62.5	-44.2	177.8	-176.7	0	0	0	0	112.3	S236 V237 S244 A285	S236-C240 WeakPolarHBondContact O-CB 3.4Å; S236-C240 PolarHBondContact O-N 3.08Å; V237-C240 PolarHBondContact O-N 3.42Å; C240-S244 WeakPolarHBondContact O-CB 3.45Å; C240-S244 PolarHBondContact O-N 3.43Å; C240-S244 VanDerWaalsContact O-N 3.14Å; C240-S244 PolarHBondContact O-OG 3.18Å; C240-A285 WeakPolarHBondContact O-CB 3.3Å
241	N	87.4	Confident	88.8	Confident	41 Å²	41	18.3 Å²	18.3	22%	0.219	9%	0.093	C	C	.	.	H	α-helix	trans	-68.1	-44.7	178	-69.8	-4.7	0	0	0	111.2	V237 M238 S244 Q245 G444	V237-N241 WeakPolarHBondContact O-CB 3.17Å; V237-N241 VanDerWaalsContact O-CG 3.3Å; V237-N241 PolarHBondContact O-N 3.49Å; M238-N241 PolarHBondContact O-N 3.44Å; N241-S244 CarbonylContact O-C 3.27Å; N241-S244 WeakPolarHBondContact O-CA 3.37Å; N241-S244 WeakPolarHBondContact O-CB 3.49Å; N241-S244 PolarHBondContact O-N 2.96Å; N241-S244 VanDerWaalsContact O-N 3.09Å; N241-Q245 PolarHBondContact O-N 2.88Å; N241-G444 PolarHBondContact ND2-O 2.92Å
242	G	88	Confident	88.9	Confident	7 Å²	7	15.4 Å²	15.4	7%	0.072	7%	0.074	C	C	.	.	H	α-helix	trans	-61.1	-44.1	178.4	0	0	0	0	0	112.5	M238 M239 S244 Q245 W246	M238-G242 WeakPolarHBondContact O-CA 3.45Å; M238-G242 PolarHBondContact O-N 3.25Å; M239-G242 PolarHBondContact O-N 2.87Å; G242-S244 VanDerWaalsContact C-N 3.31Å; G242-S244 PolarHBondContact O-N 3.34Å; G242-Q245 PolarHBondContact O-N 3.32Å; G242-W246 WeakPolarHBondContact O-CB 3.41Å; G242-W246 PolarHBondContact O-N 2.91Å
243	V	92.1	Very high	88.6	Confident	1 Å²	1	16.6 Å²	16.6	1%	0.006	8%	0.082	C	C	.	.	H	α-helix	trans	-61.2	-41.8	172	170.9	0	0	0	0	110.9	L202 M239 Q245 V247 T282 A285 V286 L406	L202-V243 HydrophobicContact CD2-CG2 4.08Å; M239-V243 HydrophobicContact CE-CG2 3.84Å; M239-V243 WeakPolarHBondContact O-CG2 3.14Å; M239-V243 PolarHBondContact O-N 3.36Å; V243-Q245 PolarHBondContact O-N 3.48Å; V243-V247 VanDerWaalsContact O-CG2 3.26Å; V243-V247 WeakPolarHBondContact O-CG2 3.42Å; V243-V247 PolarHBondContact O-N 3.05Å; V243-V247 VanDerWaalsContact O-N 3.07Å; V243-T282 HydrophobicContact CG1-CG2 4.21Å; V243-A285 HydrophobicContact CB-CB 3.96Å; V243-A285 HydrophobicContact CG1-CB 3.74Å; V243-V286 HydrophobicContact CG1-CG2 3.73Å; V243-L406 HydrophobicContact CB-CD2 4.21Å; V243-L406 HydrophobicContact CG2-CD1 4.04Å; V243-L406 HydrophobicContact CG2-CD2 3.62Å; V243-L406 HydrophobicContact CG2-CG 4.5Å
244	S	91.7	Very high	88.5	Confident	13 Å²	13	18.5 Å²	18.5	9%	0.091	9%	0.089	C	C	.	.	H	α-helix	trans	-65.2	-37.8	179.1	-54.9	0	0	0	0	112.5	C240 N241 G242 Q248 A285	C240-S244 WeakPolarHBondContact O-CB 3.45Å; C240-S244 PolarHBondContact O-N 3.43Å; C240-S244 VanDerWaalsContact O-N 3.14Å; C240-S244 PolarHBondContact O-OG 3.18Å; N241-S244 CarbonylContact O-C 3.27Å; N241-S244 WeakPolarHBondContact O-CA 3.37Å; N241-S244 WeakPolarHBondContact O-CB 3.49Å; N241-S244 PolarHBondContact O-N 2.96Å; N241-S244 VanDerWaalsContact O-N 3.09Å; G242-S244 VanDerWaalsContact C-N 3.31Å; G242-S244 PolarHBondContact O-N 3.34Å; S244-Q248 VanDerWaalsContact O-CG 3.31Å; S244-Q248 WeakPolarHBondContact O-CG 3.46Å; S244-Q248 PolarHBondContact O-NE2 3.14Å; S244-A285 WeakPolarHBondContact OG-CA 3.41Å; S244-A285 PolarHBondContact OG-O 3.48Å
245	Q	88.8	Confident	88.5	Confident	18 Å²	18	23.1 Å²	23.1	8%	0.084	11%	0.11	C	C	.	.	H	α-helix	trans	-77.1	-42.1	175.9	-69.3	-163.4	-11.4	0	0	111.9	N241 G242 V243 V247 Q248 L249 Y410 E412 I415	N241-Q245 PolarHBondContact O-N 2.88Å; G242-Q245 PolarHBondContact O-N 3.32Å; V243-Q245 PolarHBondContact O-N 3.48Å; Q245-V247 PolarHBondContact O-N 3.34Å; Q245-Q248 WeakPolarHBondContact O-CB 3.2Å; Q245-Q248 PolarHBondContact O-N 3.01Å; Q245-L249 HydrophobicContact CB-CD1 4.31Å; Q245-L249 WeakPolarHBondContact O-CB 3.33Å; Q245-L249 VanDerWaalsContact O-CG 3.29Å; Q245-L249 WeakPolarHBondContact O-CG 3.45Å; Q245-L249 PolarHBondContact O-N 3.44Å; Q245-Y410 PolarHBondContact NE2-O 2.88Å; Q245-Y410 VanDerWaalsContact OE1-N 3.07Å; Q245-Y410 PolarHBondContact OE1-O 3.45Å; Q245-E412 PolarHBondContact NE2-OE1 2.89Å; Q245-I415 HydrophobicContact CB-CD1 4.28Å; Q245-I415 HydrophobicContact CG-CD1 3.85Å
246	W	89.9	Confident	88.6	Confident	3 Å²	3	20.3 Å²	20.3	1%	0.011	11%	0.106	C	C	.	.	H	α-helix	trans	-58.6	-43.6	177.9	-179.9	67.5	0	0	0	112.2	F190 M198 L202 G242 Q248 L249 M250 Y267 L402 L406	F190-W246 HydrophobicContact CD2-CH2 4.03Å; F190-W246 AromaticContact CD2-CZ2 3.71Å; F190-W246 HydrophobicContact CD2-CZ2 3.71Å; F190-W246 AromaticContact CE2-CH2 3.74Å; F190-W246 HydrophobicContact CE2-CH2 3.74Å; F190-W246 AromaticContact CE2-CZ2 3.72Å; F190-W246 HydrophobicContact CE2-CZ2 3.72Å; M198-W246 HydrophobicContact CE-CH2 4.14Å; M198-W246 HydrophobicContact CG-CH2 4.38Å; M198-W246 HydrophobicContact SD-CH2 3.74Å; M198-W246 HydrophobicContact SD-CZ3 3.97Å; L202-W246 HydrophobicContact CD1-CZ3 4.4Å; G242-W246 WeakPolarHBondContact O-CB 3.41Å; G242-W246 PolarHBondContact O-N 2.91Å; W246-Q248 VanDerWaalsContact C-N 3.3Å; W246-Q248 PolarHBondContact O-N 3.01Å; W246-L249 PolarHBondContact O-N 3.03Å; W246-M250 HydrophobicContact CD2-CG 4.22Å; W246-M250 HydrophobicContact CG-CG 4.2Å; W246-M250 HydrophobicContact CZ2-CG 4.39Å; W246-M250 VanDerWaalsContact O-CB 3.32Å; W246-M250 WeakPolarHBondContact O-CB 3.49Å; W246-M250 VanDerWaalsContact O-CG 3.3Å; W246-M250 WeakPolarHBondContact O-CG 3.44Å; W246-M250 PolarHBondContact O-N 3.41Å; W246-Y267 HydrophobicContact CE3-CE1 4.12Å; W246-Y267 HydrophobicContact CH2-CE1 4.28Å; W246-Y267 AromaticContact CZ3-CE1 3.7Å; W246-Y267 HydrophobicContact CZ3-CE1 3.7Å; W246-Y267 AromaticContact CZ3-CZ 3.99Å; W246-Y267 WeakPolarHBondContact CZ3-OH 3.42Å; W246-L402 HydrophobicContact CH2-CD2 3.78Å; W246-L402 HydrophobicContact CZ2-CD2 4.08Å; W246-L402 HydrophobicContact CZ3-CD2 4.39Å; W246-L406 HydrophobicContact CB-CD2 3.78Å; W246-L406 HydrophobicContact CD2-CD2 4.19Å; W246-L406 HydrophobicContact CE3-CD2 4.18Å; W246-L406 HydrophobicContact CG-CD2 4.06Å
247	V	92.6	Very high	88.8	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-55.9	-43.9	172.9	167.3	0	0	0	0	111.8	V243 Q245 I251 Y267 V286 L290	V243-V247 VanDerWaalsContact O-CG2 3.26Å; V243-V247 WeakPolarHBondContact O-CG2 3.42Å; V243-V247 PolarHBondContact O-N 3.05Å; V243-V247 VanDerWaalsContact O-N 3.07Å; Q245-V247 PolarHBondContact O-N 3.34Å; V247-I251 HydrophobicContact CG1-CD1 4.24Å; V247-I251 WeakPolarHBondContact O-CD1 3.4Å; V247-I251 WeakPolarHBondContact O-CG1 3.32Å; V247-I251 PolarHBondContact O-N 3.49Å; V247-Y267 HydrophobicContact CB-CE2 4.35Å; V247-Y267 HydrophobicContact CG1-CD2 4.03Å; V247-Y267 HydrophobicContact CG1-CE2 4.29Å; V247-Y267 HydrophobicContact CG1-CG 4.23Å; V247-Y267 HydrophobicContact CG2-CD1 3.86Å; V247-Y267 HydrophobicContact CG2-CD2 4.43Å; V247-Y267 HydrophobicContact CG2-CE1 3.71Å; V247-Y267 HydrophobicContact CG2-CE2 4.28Å; V247-Y267 HydrophobicContact CG2-CG 4.22Å; V247-V286 HydrophobicContact CG2-CB 4.48Å; V247-V286 HydrophobicContact CG2-CG1 4.27Å; V247-V286 HydrophobicContact CG2-CG2 4.19Å; V247-L290 HydrophobicContact CG1-CD2 3.77Å; V247-L290 HydrophobicContact CG1-CG 3.93Å
248	Q	90.9	Very high	89.2	Confident	6 Å²	6	26.8 Å²	26.8	3%	0.028	14%	0.139	C	C	.	.	H	α-helix	trans	-67.9	-46.6	178.7	-63.7	171.8	65.6	0	0	111.5	S244 Q245 W246 I251 L252 G289 H292 S294 I295 I415	S244-Q248 VanDerWaalsContact O-CG 3.31Å; S244-Q248 WeakPolarHBondContact O-CG 3.46Å; S244-Q248 PolarHBondContact O-NE2 3.14Å; Q245-Q248 WeakPolarHBondContact O-CB 3.2Å; Q245-Q248 PolarHBondContact O-N 3.01Å; W246-Q248 VanDerWaalsContact C-N 3.3Å; W246-Q248 PolarHBondContact O-N 3.01Å; Q248-I251 PolarHBondContact O-N 3.34Å; Q248-L252 WeakPolarHBondContact O-CB 3.47Å; Q248-L252 VanDerWaalsContact O-CG 3.3Å; Q248-L252 WeakPolarHBondContact O-CG 3.4Å; Q248-L252 PolarHBondContact O-N 3.45Å; Q248-G289 WeakPolarHBondContact CG-O 3.23Å; Q248-H292 HydrophobicContact CG-CB 4.32Å; Q248-H292 PolarHBondContact OE1-ND1 3.23Å; Q248-S294 PolarHBondContact OE1-OG 3Å; Q248-I295 HydrophobicContact CB-CD1 4.06Å; Q248-I295 HydrophobicContact CB-CG1 4.14Å; Q248-I295 HydrophobicContact CG-CD1 4.31Å; Q248-I295 HydrophobicContact CG-CG1 3.83Å; Q248-I415 HydrophobicContact CB-CG2 4.03Å
249	L	88.3	Confident	89.5	Confident	2 Å²	2	29 Å²	29	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-66.6	-37.3	-177.7	-69	162.7	0	0	0	112.1	Q245 W246 I251 L252 S253 Y410 I415 L418 P492	Q245-L249 HydrophobicContact CB-CD1 4.31Å; Q245-L249 WeakPolarHBondContact O-CB 3.33Å; Q245-L249 VanDerWaalsContact O-CG 3.29Å; Q245-L249 WeakPolarHBondContact O-CG 3.45Å; Q245-L249 PolarHBondContact O-N 3.44Å; W246-L249 PolarHBondContact O-N 3.03Å; L249-I251 VanDerWaalsContact C-N 3.34Å; L249-L252 PolarHBondContact O-N 3.25Å; L249-S253 WeakPolarHBondContact O-CB 3.44Å; L249-S253 PolarHBondContact O-N 3Å; L249-Y410 HydrophobicContact CD1-CD2 3.41Å; L249-Y410 VanDerWaalsContact CD1-CD2 3.41Å; L249-Y410 HydrophobicContact CD1-CE2 3.62Å; L249-Y410 HydrophobicContact CD1-CG 4.19Å; L249-Y410 HydrophobicContact CD2-CD1 4.2Å; L249-Y410 HydrophobicContact CD2-CD2 3.94Å; L249-Y410 HydrophobicContact CD2-CE1 4.21Å; L249-Y410 HydrophobicContact CD2-CE2 3.96Å; L249-Y410 HydrophobicContact CD2-CG 4.05Å; L249-Y410 HydrophobicContact CG-CD2 4.32Å; L249-Y410 HydrophobicContact CG-CE2 4.45Å; L249-I415 HydrophobicContact CD2-CG1 4.39Å; L249-L418 HydrophobicContact CD2-CD1 4.03Å; L249-P492 HydrophobicContact CB-CB 4.04Å; L249-P492 HydrophobicContact CB-CG 4.05Å; L249-P492 HydrophobicContact CD1-CG 4.23Å; L249-P492 HydrophobicContact CD2-CB 4.46Å
250	M	89.1	Confident	89.8	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-71.8	-26	175.8	-71.9	-55.8	-67	0	0	113.4	F190 W246 S253 V263 Y267	F190-M250 HydrophobicContact CB-CE 4.14Å; F190-M250 HydrophobicContact CD1-CE 3.58Å; F190-M250 HydrophobicContact CD2-CE 3.81Å; F190-M250 HydrophobicContact CE1-CE 3.85Å; F190-M250 HydrophobicContact CE2-CE 4.05Å; F190-M250 HydrophobicContact CG-CE 3.56Å; F190-M250 HydrophobicContact CZ-CB 4.49Å; F190-M250 HydrophobicContact CZ-CE 4.07Å; W246-M250 HydrophobicContact CD2-CG 4.22Å; W246-M250 HydrophobicContact CG-CG 4.2Å; W246-M250 HydrophobicContact CZ2-CG 4.39Å; W246-M250 VanDerWaalsContact O-CB 3.32Å; W246-M250 WeakPolarHBondContact O-CB 3.49Å; W246-M250 VanDerWaalsContact O-CG 3.3Å; W246-M250 WeakPolarHBondContact O-CG 3.44Å; W246-M250 PolarHBondContact O-N 3.41Å; M250-S253 PolarHBondContact O-OG 3.3Å; M250-S253 VanDerWaalsContact O-OG 3.13Å; M250-V263 HydrophobicContact CB-CG1 4.4Å; M250-Y267 HydrophobicContact CB-CE2 3.95Å; M250-Y267 WeakPolarHBondContact CB-OH 3.37Å; M250-Y267 WeakPolarHBondContact CG-OH 3.33Å
251	I	91.3	Very high	90.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-74.9	-47.2	167.3	-67.2	164	0	0	0	109.7	V247 Q248 L249 S253 R254 R260 V263 F264 Y267 L290 I295 L298	V247-I251 HydrophobicContact CG1-CD1 4.24Å; V247-I251 WeakPolarHBondContact O-CD1 3.4Å; V247-I251 WeakPolarHBondContact O-CG1 3.32Å; V247-I251 PolarHBondContact O-N 3.49Å; Q248-I251 PolarHBondContact O-N 3.34Å; L249-I251 VanDerWaalsContact C-N 3.34Å; I251-S253 VanDerWaalsContact C-N 3.35Å; I251-S253 PolarHBondContact O-N 2.95Å; I251-R254 PolarHBondContact O-N 3.34Å; I251-R260 HydrophobicContact CG2-CB 4.16Å; I251-R260 HydrophobicContact CG2-CG 4.39Å; I251-R260 WeakPolarHBondContact O-CD 3.18Å; I251-R260 VanDerWaalsContact O-CG 3.28Å; I251-R260 WeakPolarHBondContact O-CG 3.46Å; I251-V263 HydrophobicContact CG1-CB 4.4Å; I251-V263 HydrophobicContact CG1-CG1 3.89Å; I251-F264 HydrophobicContact CD1-CB 4.3Å; I251-F264 HydrophobicContact CD1-CD2 3.88Å; I251-F264 HydrophobicContact CD1-CG 4.43Å; I251-Y267 HydrophobicContact CD1-CD2 4.39Å; I251-Y267 HydrophobicContact CG1-CD2 4.37Å; I251-L290 HydrophobicContact CD1-CD2 3.62Å; I251-I295 HydrophobicContact CB-CD1 4.22Å; I251-I295 HydrophobicContact CD1-CG2 4.25Å; I251-I295 HydrophobicContact CG2-CD1 4.12Å; I251-L298 HydrophobicContact CG2-CD1 4.35Å
252	L	88.3	Confident	90.5	Very high	5 Å²	5	32.9 Å²	32.9	3%	0.026	17%	0.166	C	C	.	.	H	α-helix	trans	-71.6	-23.6	-175.9	-70	173.9	0	0	0	114.1	Q248 L249 R254 I295 L298 I415 L418 K422	Q248-L252 WeakPolarHBondContact O-CB 3.47Å; Q248-L252 VanDerWaalsContact O-CG 3.3Å; Q248-L252 WeakPolarHBondContact O-CG 3.4Å; Q248-L252 PolarHBondContact O-N 3.45Å; L249-L252 PolarHBondContact O-N 3.25Å; L252-R254 VanDerWaalsContact C-N 3.3Å; L252-R254 PolarHBondContact O-N 2.84Å; L252-I295 HydrophobicContact CD1-CD1 4.14Å; L252-I295 HydrophobicContact CD2-CD1 4.21Å; L252-I295 HydrophobicContact CG-CD1 3.85Å; L252-L298 HydrophobicContact CD2-CD1 4Å; L252-I415 HydrophobicContact CD1-CG2 3.65Å; L252-I415 WeakPolarHBondContact CD1-O 3.47Å; L252-L418 HydrophobicContact CD1-CB 4.18Å; L252-K422 HydrophobicContact CD2-CG 4.46Å; L252-K422 WeakPolarHBondContact O-CD 3.27Å; L252-K422 WeakPolarHBondContact O-CE 3.29Å; L252-K422 PolarHBondContact O-NZ 2.9Å
253	S	84.8	Confident	90.8	Very high	31 Å²	31	32.8 Å²	32.8	22%	0.217	16%	0.164	C	C	.	.	H	α-helix	trans	-59.9	-40.7	175.6	67.7	0	0	0	0	111.3	L249 M250 I251 K422	L249-S253 WeakPolarHBondContact O-CB 3.44Å; L249-S253 PolarHBondContact O-N 3Å; M250-S253 PolarHBondContact O-OG 3.3Å; M250-S253 VanDerWaalsContact O-OG 3.13Å; I251-S253 VanDerWaalsContact C-N 3.35Å; I251-S253 PolarHBondContact O-N 2.95Å; S253-K422 PolarHBondContact O-NZ 3.06Å
254	R	86.9	Confident	91	Very high	39 Å²	39	33.4 Å²	33.4	15%	0.147	17%	0.167	C	C	.	.			trans	-66.3	141.7	-178.1	-51.4	-49.3	-165.9	-174.3	7	112.6	D191 I251 L252 Q259 R260 V263 K422	D191-R254 IonicContact OD1-CZ 2.74Å; D191-R254 IonicContact OD1-NH2 2.8Å; D191-R254 PolarHBondContact OD1-NH2 2.95Å; D191-R254 IonicContact OD2-CZ 3.64Å; D191-R254 IonicContact OD2-NH1 2.66Å; D191-R254 IonicContact OD2-NH2 3.79Å; D191-R254 PolarHBondContact OD2-NH2 3.1Å; I251-R254 PolarHBondContact O-N 3.34Å; L252-R254 VanDerWaalsContact C-N 3.3Å; L252-R254 PolarHBondContact O-N 2.84Å; R254-Q259 HydrophobicContact CB-CB 3.72Å; R254-Q259 HydrophobicContact CG-CB 4.16Å; R254-R260 HydrophobicContact CB-CG 3.99Å; R254-R260 PolarHBondContact O-NH1 3.07Å; R254-V263 HydrophobicContact CG-CG2 3.81Å; R254-K422 PolarHBondContact O-NZ 3.3Å; R254-K422 VanDerWaalsContact O-NZ 3.12Å
255	H	86.4	Confident	91.2	Very high	151 Å²	151	34 Å²	34	70%	0.699	17%	0.17	S	C	*	.	S	Bend	trans	-86.7	-42.4	-170.2	-66.3	-96.9	0	0	0	112.7	R260	H255-R260 PolarHBondContact O-NH1 3.4Å
256	T	89.8	Confident	91.5	Very high	56 Å²	56	34.5 Å²	34.5	34%	0.344	17%	0.172	S	C	.	.	S	Bend	trans	-92.2	147.2	-177.7	72	0	0	0	0	112.5	Q258 Q259 R260	T256-Q258 PolarHBondContact O-N 2.93Å; T256-Q259 PolarHBondContact O-N 3.49Å; T256-Q259 VanDerWaalsContact OG1-CG 3.26Å; T256-Q259 WeakPolarHBondContact OG1-CG 3.5Å; T256-Q259 PolarHBondContact OG1-N 3.21Å; T256-Q259 PolarHBondContact OG1-OE1 3.23Å; T256-R260 WeakPolarHBondContact O-CG 3.48Å; T256-R260 PolarHBondContact O-N 3.32Å
257	P	92.6	Very high	91.9	Very high	31 Å²	31	34.4 Å²	34.4	20%	0.201	17%	0.171	C	C	.	.	H	α-helix	trans	-53.6	-34.1	173.1	-26.2	33.9	0	0	0	113.6	R260 A261 D300 L304	P257-R260 PolarHBondContact O-N 3.18Å; P257-A261 WeakPolarHBondContact O-CB 3.47Å; P257-A261 PolarHBondContact O-N 2.82Å; P257-D300 HydrophobicContact CB-CB 4.24Å; P257-D300 HydrophobicContact CG-CB 4.12Å; P257-L304 HydrophobicContact CB-CD1 3.64Å
258	Q	94.3	Very high	92.1	Very high	105 Å²	105	34.4 Å²	34.4	49%	0.491	17%	0.171	S	C	.	.	H	α-helix	trans	-65.1	-47.5	178.4	-64.6	75	10.5	0	0	111.6	T256 R260 A261 Q262 L304	T256-Q258 PolarHBondContact O-N 2.93Å; Q258-R260 VanDerWaalsContact C-N 3.32Å; Q258-R260 PolarHBondContact O-N 2.9Å; Q258-A261 PolarHBondContact O-N 3.16Å; Q258-Q262 WeakPolarHBondContact O-CG 3.34Å; Q258-Q262 PolarHBondContact O-N 2.91Å; Q258-L304 HydrophobicContact CG-CD1 3.98Å
259	Q	91.7	Very high	92.4	Very high	81 Å²	81	37.4 Å²	37.4	38%	0.379	19%	0.185	S	C	.	.	H	α-helix	trans	-64.6	-37.7	175.6	-70.2	166.7	-20.6	0	0	111.4	R254 T256 Q262 V263	R254-Q259 HydrophobicContact CB-CB 3.72Å; R254-Q259 HydrophobicContact CG-CB 4.16Å; T256-Q259 PolarHBondContact O-N 3.49Å; T256-Q259 VanDerWaalsContact OG1-CG 3.26Å; T256-Q259 WeakPolarHBondContact OG1-CG 3.5Å; T256-Q259 PolarHBondContact OG1-N 3.21Å; T256-Q259 PolarHBondContact OG1-OE1 3.23Å; Q259-Q262 PolarHBondContact O-N 3.23Å; Q259-V263 PolarHBondContact O-N 3.06Å; Q259-V263 VanDerWaalsContact O-N 3.07Å
260	R	94.1	Very high	92.8	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.008	19%	0.185	C	C	.	.	H	α-helix	trans	-61.9	-44.2	174.1	-67.2	-161	-70.5	-88.7	6.5	111.9	I251 R254 H255 T256 P257 Q258 Q262 V263 F264 T301 K422 E423	I251-R260 HydrophobicContact CG2-CB 4.16Å; I251-R260 HydrophobicContact CG2-CG 4.39Å; I251-R260 WeakPolarHBondContact O-CD 3.18Å; I251-R260 VanDerWaalsContact O-CG 3.28Å; I251-R260 WeakPolarHBondContact O-CG 3.46Å; R254-R260 HydrophobicContact CB-CG 3.99Å; R254-R260 PolarHBondContact O-NH1 3.07Å; H255-R260 PolarHBondContact O-NH1 3.4Å; T256-R260 WeakPolarHBondContact O-CG 3.48Å; T256-R260 PolarHBondContact O-N 3.32Å; P257-R260 PolarHBondContact O-N 3.18Å; Q258-R260 VanDerWaalsContact C-N 3.32Å; Q258-R260 PolarHBondContact O-N 2.9Å; R260-Q262 VanDerWaalsContact C-N 3.33Å; R260-Q262 PolarHBondContact O-N 3.26Å; R260-V263 PolarHBondContact O-N 3.35Å; R260-F264 WeakPolarHBondContact O-CB 3.49Å; R260-F264 PolarHBondContact O-N 2.78Å; R260-T301 HydrophobicContact CB-CG2 3.54Å; R260-T301 PolarHBondContact NE-OG1 2.92Å; R260-K422 PolarHBondContact NH2-O 3.23Å; R260-E423 IonicContact CZ-OE1 3.9Å; R260-E423 IonicContact NE-OE1 3.45Å; R260-E423 VanDerWaalsContact NH2-CG 3.28Å; R260-E423 IonicContact NH2-OE1 2.78Å; R260-E423 PolarHBondContact NH2-OE1 3.48Å
261	A	95.8	Very high	93.3	Very high	7 Å²	7	37.3 Å²	37.3	6%	0.058	19%	0.185	C	C	.	.	H	α-helix	trans	-64.6	-35	177.3	0	0	0	0	0	112.5	P257 Q258 T265 T301 L304 L305	P257-A261 WeakPolarHBondContact O-CB 3.47Å; P257-A261 PolarHBondContact O-N 2.82Å; Q258-A261 PolarHBondContact O-N 3.16Å; A261-T265 VanDerWaalsContact O-CB 3.29Å; A261-T265 WeakPolarHBondContact O-CB 3.3Å; A261-T265 PolarHBondContact O-N 2.93Å; A261-T265 PolarHBondContact O-OG1 3.43Å; A261-T301 HydrophobicContact CB-CG2 4.35Å; A261-L304 HydrophobicContact CB-CB 3.88Å; A261-L305 HydrophobicContact CB-CD2 4Å
262	Q	94.1	Very high	93.6	Very high	132 Å²	132	41.1 Å²	41.1	62%	0.617	20%	0.203	S	C	*	.	H	α-helix	trans	-64.2	-48.8	172.9	-72.3	168.4	-19.2	0	0	112	Q258 Q259 R260 T265 K266	Q258-Q262 WeakPolarHBondContact O-CG 3.34Å; Q258-Q262 PolarHBondContact O-N 2.91Å; Q259-Q262 PolarHBondContact O-N 3.23Å; R260-Q262 VanDerWaalsContact C-N 3.33Å; R260-Q262 PolarHBondContact O-N 3.26Å; Q262-T265 WeakPolarHBondContact O-CB 3.41Å; Q262-T265 PolarHBondContact O-N 3.11Å; Q262-K266 PolarHBondContact O-N 2.99Å
263	V	93.8	Very high	94	Very high	6 Å²	6	44.7 Å²	44.7	4%	0.036	22%	0.218	C	C	.	.	H	α-helix	trans	-65.1	-40.8	177.7	177.3	0	0	0	0	111.6	F190 M250 I251 R254 Q259 R260 T265 K266 Y267	F190-V263 HydrophobicContact CE1-CG1 4.13Å; F190-V263 HydrophobicContact CE1-CG2 4.35Å; F190-V263 HydrophobicContact CZ-CG1 4.1Å; M250-V263 HydrophobicContact CB-CG1 4.4Å; I251-V263 HydrophobicContact CG1-CB 4.4Å; I251-V263 HydrophobicContact CG1-CG1 3.89Å; R254-V263 HydrophobicContact CG-CG2 3.81Å; Q259-V263 PolarHBondContact O-N 3.06Å; Q259-V263 VanDerWaalsContact O-N 3.07Å; R260-V263 PolarHBondContact O-N 3.35Å; V263-T265 VanDerWaalsContact C-N 3.34Å; V263-T265 PolarHBondContact O-N 2.97Å; V263-K266 WeakPolarHBondContact O-CB 3.35Å; V263-K266 PolarHBondContact O-N 3.26Å; V263-Y267 HydrophobicContact CG1-CD2 3.84Å; V263-Y267 HydrophobicContact CG1-CE2 3.64Å; V263-Y267 WeakPolarHBondContact O-CD2 3.36Å; V263-Y267 PolarHBondContact O-N 3.35Å
264	F	96.2	Very high	94.6	Very high	13 Å²	13	43.2 Å²	43.2	6%	0.057	21%	0.208	C	C	.	.	H	α-helix	trans	-58	-46.7	173.7	-168.3	-70.2	0	0	0	111.4	I251 R260 K266 Y267 I268 L290 I295 L305 I309 L313	I251-F264 HydrophobicContact CD1-CB 4.3Å; I251-F264 HydrophobicContact CD1-CD2 3.88Å; I251-F264 HydrophobicContact CD1-CG 4.43Å; R260-F264 WeakPolarHBondContact O-CB 3.49Å; R260-F264 PolarHBondContact O-N 2.78Å; F264-K266 VanDerWaalsContact C-N 3.34Å; F264-K266 PolarHBondContact O-N 3.48Å; F264-Y267 PolarHBondContact O-N 3.05Å; F264-I268 HydrophobicContact CD1-CG1 4.1Å; F264-I268 HydrophobicContact CE1-CD1 4.28Å; F264-I268 HydrophobicContact CE1-CG1 3.94Å; F264-I268 PolarHBondContact O-N 3.29Å; F264-I268 VanDerWaalsContact O-N 3.08Å; F264-L290 HydrophobicContact CD1-CD2 4.33Å; F264-L290 HydrophobicContact CD2-CD2 3.79Å; F264-L290 HydrophobicContact CE1-CD2 4.32Å; F264-L290 HydrophobicContact CE2-CB 4.27Å; F264-L290 HydrophobicContact CE2-CD2 3.78Å; F264-L290 HydrophobicContact CG-CD2 4.06Å; F264-L290 HydrophobicContact CZ-CB 4.13Å; F264-L290 HydrophobicContact CZ-CD2 4.04Å; F264-I295 HydrophobicContact CD2-CG2 3.94Å; F264-I295 HydrophobicContact CE2-CG2 3.7Å; F264-L305 HydrophobicContact CB-CD2 4Å; F264-L305 HydrophobicContact CD1-CD1 3.74Å; F264-L305 HydrophobicContact CD1-CD2 3.67Å; F264-L305 HydrophobicContact CD1-CG 4.4Å; F264-L305 HydrophobicContact CE1-CD1 3.68Å; F264-L305 HydrophobicContact CE1-CD2 4.43Å; F264-L305 HydrophobicContact CG-CD1 4.22Å; F264-L305 HydrophobicContact CG-CD2 3.96Å; F264-L305 HydrophobicContact CZ-CD1 4.09Å; F264-I309 HydrophobicContact CD1-CG2 4.46Å; F264-L313 HydrophobicContact CE1-CD2 4.11Å; F264-L313 HydrophobicContact CZ-CD2 3.76Å
265	T	96.3	Very high	95.1	Very high	25 Å²	25	45 Å²	45	15%	0.153	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-42	176.3	-62	0	0	0	0	111.5	A261 Q262 V263 Y267 I268 H269 I309	A261-T265 VanDerWaalsContact O-CB 3.29Å; A261-T265 WeakPolarHBondContact O-CB 3.3Å; A261-T265 PolarHBondContact O-N 2.93Å; A261-T265 PolarHBondContact O-OG1 3.43Å; Q262-T265 WeakPolarHBondContact O-CB 3.41Å; Q262-T265 PolarHBondContact O-N 3.11Å; V263-T265 VanDerWaalsContact C-N 3.34Å; V263-T265 PolarHBondContact O-N 2.97Å; T265-Y267 PolarHBondContact O-N 2.9Å; T265-I268 PolarHBondContact O-N 3.13Å; T265-H269 PolarHBondContact O-N 3.48Å; T265-H269 VanDerWaalsContact O-N 3.1Å; T265-I309 HydrophobicContact CG2-CD1 3.84Å; T265-I309 HydrophobicContact CG2-CG1 3.98Å
266	K	95.4	Very high	95.5	Very high	30 Å²	30	41.5 Å²	41.5	13%	0.13	21%	0.212	C	C	.	.	H	α-helix	trans	-58.6	-45.1	175.1	-167.9	170.6	-172.4	171.1	0	111.8	F190 D191 M193 P195 Q262 V263 F264 I268 H269 V270	F190-K266 HydrophobicContact CE1-CD 4.41Å; F190-K266 PolarHBondContact O-NZ 3.39Å; D191-K266 PolarHBondContact O-NZ 2.93Å; M193-K266 WeakPolarHBondContact O-CE 3.28Å; M193-K266 PolarHBondContact O-NZ 2.89Å; P195-K266 HydrophobicContact CG-CG 4.38Å; Q262-K266 PolarHBondContact O-N 2.99Å; V263-K266 WeakPolarHBondContact O-CB 3.35Å; V263-K266 PolarHBondContact O-N 3.26Å; F264-K266 VanDerWaalsContact C-N 3.34Å; F264-K266 PolarHBondContact O-N 3.48Å; K266-I268 VanDerWaalsContact C-N 3.34Å; K266-I268 PolarHBondContact O-N 3.36Å; K266-H269 WeakPolarHBondContact O-CB 3.35Å; K266-H269 PolarHBondContact O-N 3.05Å; K266-H269 VanDerWaalsContact O-N 3.16Å; K266-V270 WeakPolarHBondContact O-CG2 3.46Å; K266-V270 PolarHBondContact O-N 3.04Å
267	Y	96.5	Very high	95.8	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67.9	-27.8	176.7	-77.8	-57.9	0	0	0	114.2	F190 M198 W246 V247 M250 I251 V263 F264 T265 V270 A271	F190-Y267 HydrophobicContact CE2-CE1 4.37Å; F190-Y267 AromaticContact CE2-CZ 3.88Å; F190-Y267 WeakPolarHBondContact CE2-OH 3.45Å; F190-Y267 HydrophobicContact CZ-CE1 4.49Å; F190-Y267 HydrophobicContact CZ-CE2 4.06Å; F190-Y267 AromaticContact CZ-CZ 3.83Å; M198-Y267 HydrophobicContact SD-CD1 4.44Å; M198-Y267 HydrophobicContact SD-CE1 3.93Å; W246-Y267 HydrophobicContact CE3-CE1 4.12Å; W246-Y267 HydrophobicContact CH2-CE1 4.28Å; W246-Y267 AromaticContact CZ3-CE1 3.7Å; W246-Y267 HydrophobicContact CZ3-CE1 3.7Å; W246-Y267 AromaticContact CZ3-CZ 3.99Å; W246-Y267 WeakPolarHBondContact CZ3-OH 3.42Å; V247-Y267 HydrophobicContact CB-CE2 4.35Å; V247-Y267 HydrophobicContact CG1-CD2 4.03Å; V247-Y267 HydrophobicContact CG1-CE2 4.29Å; V247-Y267 HydrophobicContact CG1-CG 4.23Å; V247-Y267 HydrophobicContact CG2-CD1 3.86Å; V247-Y267 HydrophobicContact CG2-CD2 4.43Å; V247-Y267 HydrophobicContact CG2-CE1 3.71Å; V247-Y267 HydrophobicContact CG2-CE2 4.28Å; V247-Y267 HydrophobicContact CG2-CG 4.22Å; M250-Y267 HydrophobicContact CB-CE2 3.95Å; M250-Y267 WeakPolarHBondContact CB-OH 3.37Å; M250-Y267 WeakPolarHBondContact CG-OH 3.33Å; I251-Y267 HydrophobicContact CD1-CD2 4.39Å; I251-Y267 HydrophobicContact CG1-CD2 4.37Å; V263-Y267 HydrophobicContact CG1-CD2 3.84Å; V263-Y267 HydrophobicContact CG1-CE2 3.64Å; V263-Y267 WeakPolarHBondContact O-CD2 3.36Å; V263-Y267 PolarHBondContact O-N 3.35Å; F264-Y267 PolarHBondContact O-N 3.05Å; T265-Y267 PolarHBondContact O-N 2.9Å; Y267-V270 HydrophobicContact CD1-CG2 4.45Å; Y267-V270 PolarHBondContact O-N 3.19Å; Y267-A271 WeakPolarHBondContact O-CB 3.35Å; Y267-A271 PolarHBondContact O-N 3Å
268	I	97.6	Very high	95.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-67.1	-38.9	170.1	-69.4	-71.3	0	0	0	111.3	F264 T265 K266 A271 Q272 L290 I309 V312 L313	F264-I268 HydrophobicContact CD1-CG1 4.1Å; F264-I268 HydrophobicContact CE1-CD1 4.28Å; F264-I268 HydrophobicContact CE1-CG1 3.94Å; F264-I268 PolarHBondContact O-N 3.29Å; F264-I268 VanDerWaalsContact O-N 3.08Å; T265-I268 PolarHBondContact O-N 3.13Å; K266-I268 VanDerWaalsContact C-N 3.34Å; K266-I268 PolarHBondContact O-N 3.36Å; I268-A271 PolarHBondContact O-N 3.27Å; I268-Q272 WeakPolarHBondContact O-CG 3.4Å; I268-Q272 PolarHBondContact O-N 3.45Å; I268-L290 HydrophobicContact CD1-CD1 3.58Å; I268-L290 HydrophobicContact CG1-CD1 3.99Å; I268-I309 HydrophobicContact CB-CG2 4.03Å; I268-I309 HydrophobicContact CG1-CG2 3.79Å; I268-I309 HydrophobicContact CG2-CD1 4.09Å; I268-I309 HydrophobicContact CG2-CG2 4.07Å; I268-V312 HydrophobicContact CG2-CB 4.1Å; I268-V312 HydrophobicContact CG2-CG1 3.66Å; I268-L313 HydrophobicContact CD1-CB 3.78Å; I268-L313 HydrophobicContact CD1-CD1 3.94Å; I268-L313 HydrophobicContact CD1-CG 4.35Å
269	H	97.6	Very high	96	Very high	69 Å²	69	36 Å²	36	32%	0.319	18%	0.18	S	C	.	.	H	α-helix	trans	-65	-39.9	171.7	-58.7	156.3	0	0	0	111.9	P195 T265 K266 A271 Q272 K273	P195-H269 HydrophobicContact CB-CB 3.8Å; P195-H269 HydrophobicContact CG-CB 3.9Å; T265-H269 PolarHBondContact O-N 3.48Å; T265-H269 VanDerWaalsContact O-N 3.1Å; K266-H269 WeakPolarHBondContact O-CB 3.35Å; K266-H269 PolarHBondContact O-N 3.05Å; K266-H269 VanDerWaalsContact O-N 3.16Å; H269-A271 VanDerWaalsContact C-N 3.33Å; H269-A271 PolarHBondContact O-N 3.41Å; H269-Q272 PolarHBondContact CD2-OE1 2.81Å; H269-Q272 WeakPolarHBondContact O-CB 3.39Å; H269-Q272 PolarHBondContact O-N 2.84Å; H269-K273 WeakPolarHBondContact O-CG 3.38Å; H269-K273 PolarHBondContact O-N 3.43Å
270	V	97.1	Very high	96.3	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-44.1	172.5	175.7	0	0	0	0	110.7	P195 M198 A199 L202 K266 Y267 Q272 K273 L274	P195-V270 HydrophobicContact CB-CG2 3.91Å; M198-V270 HydrophobicContact CB-CG2 4.2Å; M198-V270 HydrophobicContact CG-CG2 4.3Å; M198-V270 HydrophobicContact SD-CG1 4.45Å; M198-V270 HydrophobicContact SD-CG2 3.67Å; A199-V270 HydrophobicContact CB-CG1 4.24Å; L202-V270 HydrophobicContact CD1-CG1 4.48Å; K266-V270 WeakPolarHBondContact O-CG2 3.46Å; K266-V270 PolarHBondContact O-N 3.04Å; Y267-V270 HydrophobicContact CD1-CG2 4.45Å; Y267-V270 PolarHBondContact O-N 3.19Å; V270-Q272 PolarHBondContact O-N 2.97Å; V270-K273 PolarHBondContact O-N 2.98Å; V270-K273 VanDerWaalsContact O-N 3.16Å; V270-L274 HydrophobicContact CG1-CD1 4Å; V270-L274 HydrophobicContact CG1-CG 4.29Å; V270-L274 WeakPolarHBondContact O-CG 3.44Å; V270-L274 PolarHBondContact O-N 3.44Å
271	A	97.8	Very high	96.4	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.4	-39.7	175.7	0	0	0	0	0	112.6	Y267 I268 H269 K273 L274 R275 L283 V286 F316	Y267-A271 WeakPolarHBondContact O-CB 3.35Å; Y267-A271 PolarHBondContact O-N 3Å; I268-A271 PolarHBondContact O-N 3.27Å; H269-A271 VanDerWaalsContact C-N 3.33Å; H269-A271 PolarHBondContact O-N 3.41Å; A271-K273 PolarHBondContact O-N 3.01Å; A271-L274 PolarHBondContact O-N 2.83Å; A271-R275 WeakPolarHBondContact O-CB 3.41Å; A271-R275 PolarHBondContact O-N 3.41Å; A271-L283 HydrophobicContact CB-CD1 3.72Å; A271-L283 WeakPolarHBondContact O-CD1 3.38Å; A271-V286 HydrophobicContact CB-CG1 4.29Å; A271-F316 HydrophobicContact CB-CD2 3.89Å; A271-F316 HydrophobicContact CB-CE2 3.55Å; A271-F316 HydrophobicContact CB-CZ 4.5Å
272	Q	98	Very high	96.4	Very high	80 Å²	80	31.9 Å²	31.9	37%	0.374	16%	0.16	S	C	.	.	H	α-helix	trans	-60.8	-42.3	171.9	-70.6	171.7	-28.5	0	0	112.5	I268 H269 V270 R275 A276 V312 F316	I268-Q272 WeakPolarHBondContact O-CG 3.4Å; I268-Q272 PolarHBondContact O-N 3.45Å; H269-Q272 PolarHBondContact CD2-OE1 2.81Å; H269-Q272 WeakPolarHBondContact O-CB 3.39Å; H269-Q272 PolarHBondContact O-N 2.84Å; V270-Q272 PolarHBondContact O-N 2.97Å; Q272-R275 PolarHBondContact O-N 3.33Å; Q272-A276 PolarHBondContact O-N 2.7Å; Q272-A276 VanDerWaalsContact O-N 3.08Å; Q272-V312 HydrophobicContact CG-CG1 3.87Å; Q272-F316 HydrophobicContact CB-CZ 4.38Å; Q272-F316 HydrophobicContact CG-CE2 4.09Å; Q272-F316 HydrophobicContact CG-CZ 3.77Å
273	K	97.3	Very high	96.5	Very high	81 Å²	81	25.6 Å²	25.6	35%	0.352	13%	0.131	S	C	.	.	H	α-helix	trans	-67.7	-44.1	177	-62.3	-71.3	-168.3	151.9	0	111.7	P195 D196 A199 H269 V270 A271 R275 A276 L277	P195-K273 HydrophobicContact CB-CG 4.49Å; D196-K273 HydrophobicContact CB-CD 3.84Å; D196-K273 HydrophobicContact CB-CG 4.16Å; D196-K273 IonicContact OD2-NZ 3.81Å; D196-K273 PolarHBondContact OD2-NZ 3.48Å; A199-K273 HydrophobicContact CB-CB 3.55Å; H269-K273 WeakPolarHBondContact O-CG 3.38Å; H269-K273 PolarHBondContact O-N 3.43Å; V270-K273 PolarHBondContact O-N 2.98Å; V270-K273 VanDerWaalsContact O-N 3.16Å; A271-K273 PolarHBondContact O-N 3.01Å; K273-R275 VanDerWaalsContact C-N 3.31Å; K273-R275 PolarHBondContact O-N 3.47Å; K273-A276 WeakPolarHBondContact O-CB 3.28Å; K273-A276 PolarHBondContact O-N 2.64Å; K273-A276 VanDerWaalsContact O-N 3.12Å; K273-L277 WeakPolarHBondContact O-CG 3.31Å; K273-L277 PolarHBondContact O-N 2.96Å
274	L	97.1	Very high	96.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-57.8	-41.3	173.2	-70.8	171.2	0	0	0	112.2	A199 S203 V270 A271 A276 L277 Q278 N279 T282 L283 V286	A199-L274 HydrophobicContact CB-CD2 3.88Å; A199-L274 HydrophobicContact CB-CG 3.88Å; A199-L274 WeakPolarHBondContact O-CD2 3.46Å; S203-L274 VanDerWaalsContact OG-CD2 3.31Å; S203-L274 WeakPolarHBondContact OG-CD2 3.28Å; V270-L274 HydrophobicContact CG1-CD1 4Å; V270-L274 HydrophobicContact CG1-CG 4.29Å; V270-L274 WeakPolarHBondContact O-CG 3.44Å; V270-L274 PolarHBondContact O-N 3.44Å; A271-L274 PolarHBondContact O-N 2.83Å; L274-A276 VanDerWaalsContact C-N 3.34Å; L274-A276 PolarHBondContact O-N 3.29Å; L274-L277 CarbonylContact O-C 3.59Å; L274-L277 PolarHBondContact O-N 2.59Å; L274-Q278 PolarHBondContact O-N 3.16Å; L274-N279 HydrophobicContact CD2-CB 4.34Å; L274-N279 PolarHBondContact O-N 2.84Å; L274-T282 HydrophobicContact CD1-CG2 3.71Å; L274-T282 HydrophobicContact CD2-CG2 4.03Å; L274-L283 HydrophobicContact CB-CB 4.26Å; L274-V286 HydrophobicContact CD1-CG2 3.93Å
275	R	96.8	Very high	96.5	Very high	76 Å²	76	24.9 Å²	24.9	29%	0.287	13%	0.127	S	C	.	.	H	α-helix	trans	-63.4	-37.3	175.5	175.6	60.5	-171.2	102	2.2	112.6	A271 Q272 K273 Q278 L283 F316	A271-R275 WeakPolarHBondContact O-CB 3.41Å; A271-R275 PolarHBondContact O-N 3.41Å; Q272-R275 PolarHBondContact O-N 3.33Å; K273-R275 VanDerWaalsContact C-N 3.31Å; K273-R275 PolarHBondContact O-N 3.47Å; R275-Q278 PolarHBondContact O-N 3.49Å; R275-L283 HydrophobicContact CB-CD2 3.88Å; R275-L283 HydrophobicContact CG-CD2 4.41Å; R275-F316 HydrophobicContact CB-CE1 4.18Å; R275-F316 HydrophobicContact CB-CZ 4.37Å; R275-F316 HydrophobicContact CG-CE1 4.11Å
276	A	95.6	Very high	96.5	Very high	77 Å²	77	23.7 Å²	23.7	64%	0.636	12%	0.12	S	C	*	.	H	α-helix	trans	-71.4	-39.1	175.4	0	0	0	0	0	112.3	Q272 K273 L274 Q278	Q272-A276 PolarHBondContact O-N 2.7Å; Q272-A276 VanDerWaalsContact O-N 3.08Å; K273-A276 WeakPolarHBondContact O-CB 3.28Å; K273-A276 PolarHBondContact O-N 2.64Å; K273-A276 VanDerWaalsContact O-N 3.12Å; L274-A276 VanDerWaalsContact C-N 3.34Å; L274-A276 PolarHBondContact O-N 3.29Å; A276-Q278 PolarHBondContact O-N 3.21Å; A276-Q278 VanDerWaalsContact O-N 3.14Å
277	L	95.2	Very high	96.5	Very high	29 Å²	29	22.3 Å²	22.3	15%	0.152	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	1.3	172.2	-67.5	175.5	0	0	0	114.1	A199 E200 K273 L274 N279 F339 P391 F392	A199-L277 HydrophobicContact CB-CD1 4.12Å; E200-L277 HydrophobicContact CG-CD1 3.91Å; K273-L277 WeakPolarHBondContact O-CG 3.31Å; K273-L277 PolarHBondContact O-N 2.96Å; L274-L277 CarbonylContact O-C 3.59Å; L274-L277 PolarHBondContact O-N 2.59Å; L277-N279 PolarHBondContact O-N 3.49Å; L277-N279 VanDerWaalsContact O-N 3.14Å; L277-F339 WeakPolarHBondContact O-CD1 3.46Å; L277-P391 HydrophobicContact CD2-CG 4.4Å; L277-F392 HydrophobicContact CD1-CD1 4.37Å; L277-F392 HydrophobicContact CD1-CE1 4.09Å; L277-F392 HydrophobicContact CD2-CD1 3.89Å; L277-F392 HydrophobicContact CD2-CE1 3.99Å
278	Q	96.3	Very high	96.2	Very high	46 Å²	46	22.8 Å²	22.8	22%	0.215	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	24.9	-176.7	-47.7	-178	35.1	0	0	113.7	L274 R275 A276 F280 C336 R337 K340 V341	L274-Q278 PolarHBondContact O-N 3.16Å; R275-Q278 PolarHBondContact O-N 3.49Å; A276-Q278 PolarHBondContact O-N 3.21Å; A276-Q278 VanDerWaalsContact O-N 3.14Å; Q278-F280 HydrophobicContact CB-CE2 4.17Å; Q278-F280 WeakPolarHBondContact O-CD2 3.48Å; Q278-F280 WeakPolarHBondContact O-CE2 3.32Å; Q278-F280 PolarHBondContact O-N 3.1Å; Q278-C336 PolarHBondContact OE1-SG 2.96Å; Q278-R337 PolarHBondContact NE2-O 3.25Å; Q278-R337 VanDerWaalsContact NE2-O 3.15Å; Q278-R337 PolarHBondContact OE1-O 3.03Å; Q278-K340 HydrophobicContact CB-CB 3.82Å; Q278-K340 WeakPolarHBondContact O-CA 3.49Å; Q278-V341 PolarHBondContact O-N 2.99Å
279	N	96.4	Very high	96	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.005	12%	0.119	C	C	.	.	B	Isolated β-bridge	trans	-89.6	98.7	173.4	177.4	-4.7	0	0	0	109.5	S203 L274 L277 N281 T282 L283 V341	S203-N279 WeakPolarHBondContact CA-ND2 3.4Å; S203-N279 WeakPolarHBondContact CB-ND2 3.25Å; S203-N279 PolarHBondContact OG-ND2 3.3Å; L274-N279 HydrophobicContact CD2-CB 4.34Å; L274-N279 PolarHBondContact O-N 2.84Å; L277-N279 PolarHBondContact O-N 3.49Å; L277-N279 VanDerWaalsContact O-N 3.14Å; N279-N281 PolarHBondContact OD1-N 3.44Å; N279-T282 VanDerWaalsContact ND2-CB 3.3Å; N279-T282 WeakPolarHBondContact ND2-CB 3.25Å; N279-T282 PolarHBondContact ND2-OG1 3.16Å; N279-T282 PolarHBondContact OD1-N 3.45Å; N279-T282 PolarHBondContact OD1-OG1 2.98Å; N279-L283 WeakPolarHBondContact O-CB 3.19Å; N279-V341 HydrophobicContact CB-CB 4.2Å; N279-V341 HydrophobicContact CB-CG2 4Å
280	F	97.1	Very high	95.8	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-85.5	-26.7	-178.7	-60.5	-90.8	0	0	0	112.9	Q278 L283 M284 Y329 V332 Y333 V341 I343	Q278-F280 HydrophobicContact CB-CE2 4.17Å; Q278-F280 WeakPolarHBondContact O-CD2 3.48Å; Q278-F280 WeakPolarHBondContact O-CE2 3.32Å; Q278-F280 PolarHBondContact O-N 3.1Å; F280-L283 HydrophobicContact CD1-CD2 4.47Å; F280-M284 WeakPolarHBondContact O-CB 3.41Å; F280-M284 PolarHBondContact O-N 3.02Å; F280-Y329 HydrophobicContact CB-CD2 4.15Å; F280-Y329 HydrophobicContact CB-CE2 3.67Å; F280-Y329 AromaticContact CD1-CD2 3.84Å; F280-Y329 HydrophobicContact CD1-CD2 3.84Å; F280-Y329 HydrophobicContact CD1-CE2 4.03Å; F280-Y329 HydrophobicContact CD2-CE2 4.24Å; F280-Y329 HydrophobicContact CE1-CD2 4.46Å; F280-Y329 HydrophobicContact CG-CD2 4.03Å; F280-Y329 AromaticContact CG-CE2 3.72Å; F280-Y329 HydrophobicContact CG-CE2 3.72Å; F280-V332 HydrophobicContact CE1-CG1 3.87Å; F280-V332 HydrophobicContact CZ-CG1 3.86Å; F280-Y333 AromaticContact CD2-CD2 3.78Å; F280-Y333 HydrophobicContact CD2-CD2 3.78Å; F280-Y333 HydrophobicContact CD2-CE2 4.4Å; F280-Y333 AromaticContact CE2-CD2 3.86Å; F280-Y333 HydrophobicContact CE2-CD2 3.86Å; F280-V341 WeakPolarHBondContact CB-O 3.41Å; F280-V341 PolarHBondContact N-O 2.94Å; F280-I343 HydrophobicContact CB-CD1 4.23Å; F280-I343 HydrophobicContact CB-CG1 3.62Å
281	N	95.4	Very high	95.6	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-69.1	-49.7	-178.8	-146.4	34.6	0	0	0	111.6	E206 N279 L283 M284 A285 V341 P342 I343 L344	E206-N281 HydrophobicContact CG-CB 4.23Å; E206-N281 PolarHBondContact OE1-ND2 2.92Å; N279-N281 PolarHBondContact OD1-N 3.44Å; N281-L283 VanDerWaalsContact C-N 3.33Å; N281-L283 PolarHBondContact O-N 2.89Å; N281-M284 WeakPolarHBondContact O-CB 3.19Å; N281-M284 PolarHBondContact O-N 3Å; N281-A285 PolarHBondContact O-N 2.91Å; N281-V341 HydrophobicContact CB-CG1 4.13Å; N281-P342 WeakPolarHBondContact CB-O 3.25Å; N281-I343 WeakPolarHBondContact OD1-CA 3.43Å; N281-L344 PolarHBondContact OD1-N 3.22Å
282	T	96.3	Very high	95.3	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.018	12%	0.117	C	C	.	.	H	α-helix	trans	-69.9	-32	176.3	-46.8	0	0	0	0	111.5	L202 V243 L274 N279 M284 A285 V286	L202-T282 HydrophobicContact CB-CG2 3.96Å; L202-T282 HydrophobicContact CD1-CG2 4.31Å; V243-T282 HydrophobicContact CG1-CG2 4.21Å; L274-T282 HydrophobicContact CD1-CG2 3.71Å; L274-T282 HydrophobicContact CD2-CG2 4.03Å; N279-T282 VanDerWaalsContact ND2-CB 3.3Å; N279-T282 WeakPolarHBondContact ND2-CB 3.25Å; N279-T282 PolarHBondContact ND2-OG1 3.16Å; N279-T282 PolarHBondContact OD1-N 3.45Å; N279-T282 PolarHBondContact OD1-OG1 2.98Å; T282-M284 VanDerWaalsContact C-N 3.31Å; T282-M284 PolarHBondContact O-N 2.9Å; T282-A285 PolarHBondContact O-N 2.85Å; T282-V286 HydrophobicContact CG2-CG2 4.43Å; T282-V286 WeakPolarHBondContact O-CG2 3.34Å; T282-V286 PolarHBondContact O-N 3.36Å
283	L	97.3	Very high	94.8	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.7	-39	171.5	177.1	61.6	0	0	0	111.8	A271 L274 R275 N279 F280 N281 T287 F316 L320	A271-L283 HydrophobicContact CB-CD1 3.72Å; A271-L283 WeakPolarHBondContact O-CD1 3.38Å; L274-L283 HydrophobicContact CB-CB 4.26Å; R275-L283 HydrophobicContact CB-CD2 3.88Å; R275-L283 HydrophobicContact CG-CD2 4.41Å; N279-L283 WeakPolarHBondContact O-CB 3.19Å; F280-L283 HydrophobicContact CD1-CD2 4.47Å; N281-L283 VanDerWaalsContact C-N 3.33Å; N281-L283 PolarHBondContact O-N 2.89Å; L283-T287 VanDerWaalsContact O-CB 3.28Å; L283-T287 WeakPolarHBondContact O-CB 3.48Å; L283-T287 PolarHBondContact O-N 2.85Å; L283-T287 PolarHBondContact O-OG1 2.65Å; L283-F316 HydrophobicContact CD1-CD2 4.35Å; L283-F316 HydrophobicContact CD1-CG 4.45Å; L283-L320 HydrophobicContact CG-CD1 4.28Å
284	M	94.6	Very high	94.4	Very high	3 Å²	3	16.5 Å²	16.5	2%	0.015	10%	0.098	C	C	.	.	H	α-helix	trans	-63.7	-43.3	172.6	-176.4	72	-179.1	0	0	111.6	F280 N281 T282 G288 L320 I343 V439 V440	F280-M284 WeakPolarHBondContact O-CB 3.41Å; F280-M284 PolarHBondContact O-N 3.02Å; N281-M284 WeakPolarHBondContact O-CB 3.19Å; N281-M284 PolarHBondContact O-N 3Å; T282-M284 VanDerWaalsContact C-N 3.31Å; T282-M284 PolarHBondContact O-N 2.9Å; M284-G288 PolarHBondContact O-N 3.49Å; M284-L320 HydrophobicContact CB-CD2 4.45Å; M284-L320 HydrophobicContact SD-CB 4.02Å; M284-L320 HydrophobicContact SD-CD1 4.23Å; M284-L320 HydrophobicContact SD-CD2 4.24Å; M284-L320 HydrophobicContact SD-CG 4.41Å; M284-I343 HydrophobicContact CB-CD1 4.29Å; M284-I343 HydrophobicContact CB-CG1 4.37Å; M284-I343 HydrophobicContact CB-CG2 4.34Å; M284-I343 HydrophobicContact CG-CG2 4.14Å; M284-I343 HydrophobicContact SD-CD1 4.43Å; M284-V439 HydrophobicContact CE-CG1 3.56Å; M284-V439 HydrophobicContact SD-CG1 3.51Å; M284-V439 VanDerWaalsContact SD-CG1 3.51Å; M284-V440 VanDerWaalsContact CE-O 3.28Å; M284-V440 WeakPolarHBondContact CE-O 3.38Å
285	A	94.3	Very high	94.3	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.008	10%	0.099	C	C	.	.	H	α-helix	trans	-62.3	-52.3	176.6	0	0	0	0	0	112.6	C240 V243 S244 N281 T282 T287 G288 G289	C240-A285 WeakPolarHBondContact O-CB 3.3Å; V243-A285 HydrophobicContact CB-CB 3.96Å; V243-A285 HydrophobicContact CG1-CB 3.74Å; S244-A285 WeakPolarHBondContact OG-CA 3.41Å; S244-A285 PolarHBondContact OG-O 3.48Å; N281-A285 PolarHBondContact O-N 2.91Å; T282-A285 PolarHBondContact O-N 2.85Å; A285-T287 PolarHBondContact O-N 3.04Å; A285-G288 PolarHBondContact O-N 2.94Å; A285-G289 PolarHBondContact O-N 3.45Å
286	V	96.4	Very high	94	Very high	1 Å²	1	16 Å²	16	1%	0.006	11%	0.105	C	C	.	.	H	α-helix	trans	-62.5	-45.1	179.6	176	0	0	0	0	111.1	V243 V247 A271 L274 T282 G288 G289 L290	V243-V286 HydrophobicContact CG1-CG2 3.73Å; V247-V286 HydrophobicContact CG2-CB 4.48Å; V247-V286 HydrophobicContact CG2-CG1 4.27Å; V247-V286 HydrophobicContact CG2-CG2 4.19Å; A271-V286 HydrophobicContact CB-CG1 4.29Å; L274-V286 HydrophobicContact CD1-CG2 3.93Å; T282-V286 HydrophobicContact CG2-CG2 4.43Å; T282-V286 WeakPolarHBondContact O-CG2 3.34Å; T282-V286 PolarHBondContact O-N 3.36Å; V286-G288 VanDerWaalsContact C-N 3.34Å; V286-G288 PolarHBondContact O-N 3.39Å; V286-G289 PolarHBondContact O-N 2.89Å; V286-L290 HydrophobicContact CG1-CD1 4.08Å; V286-L290 HydrophobicContact CG1-CG 4.48Å; V286-L290 WeakPolarHBondContact O-CG 3.46Å; V286-L290 PolarHBondContact O-N 2.74Å
287	T	95.2	Very high	93.8	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-65.6	-38.3	177.7	-49.8	0	0	0	0	111.5	L283 A285 L290 C291 L313 F316 T317 L320 V439	L283-T287 VanDerWaalsContact O-CB 3.28Å; L283-T287 WeakPolarHBondContact O-CB 3.48Å; L283-T287 PolarHBondContact O-N 2.85Å; L283-T287 PolarHBondContact O-OG1 2.65Å; A285-T287 PolarHBondContact O-N 3.04Å; T287-L290 PolarHBondContact O-N 3.12Å; T287-C291 VanDerWaalsContact O-CB 3.3Å; T287-C291 WeakPolarHBondContact O-CB 3.35Å; T287-C291 PolarHBondContact O-N 3Å; T287-C291 PolarHBondContact O-SG 3.34Å; T287-C291 VanDerWaalsContact O-SG 3.41Å; T287-L313 HydrophobicContact CG2-CD1 4.21Å; T287-F316 HydrophobicContact CG2-CB 4.16Å; T287-T317 HydrophobicContact CG2-CG2 4.1Å; T287-L320 HydrophobicContact CG2-CD1 3.91Å; T287-L320 WeakPolarHBondContact OG1-CD1 3.49Å; T287-V439 HydrophobicContact CG2-CG2 4.38Å
288	G	91.5	Very high	93.7	Very high	11 Å²	11	13 Å²	13	11%	0.113	8%	0.076	C	C	.	.	H	α-helix	trans	-60.8	-45.6	174.4	0	0	0	0	0	112.7	M284 A285 V286 C291 H292	M284-G288 PolarHBondContact O-N 3.49Å; A285-G288 PolarHBondContact O-N 2.94Å; V286-G288 VanDerWaalsContact C-N 3.34Å; V286-G288 PolarHBondContact O-N 3.39Å; G288-C291 CarbonylContact O-C 3.59Å; G288-C291 PolarHBondContact O-N 3.26Å; G288-H292 PolarHBondContact O-N 3.09Å
289	G	92.1	Very high	93.5	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-61.6	-46.2	175	0	0	0	0	0	113.1	Q248 A285 V286 C291 H292	Q248-G289 WeakPolarHBondContact CG-O 3.23Å; A285-G289 PolarHBondContact O-N 3.45Å; V286-G289 PolarHBondContact O-N 2.89Å; G289-C291 VanDerWaalsContact C-N 3.32Å; G289-C291 PolarHBondContact O-N 3.23Å; G289-H292 WeakPolarHBondContact O-CB 3.34Å; G289-H292 PolarHBondContact O-N 2.72Å
290	L	94.5	Very high	93.3	Very high	4 Å²	4	21 Å²	21	2%	0.021	11%	0.114	C	C	.	.	H	α-helix	trans	-64.6	-34.2	176.6	-67.2	174.8	0	0	0	112.9	V247 I251 F264 I268 V286 T287 H292 L313	V247-L290 HydrophobicContact CG1-CD2 3.77Å; V247-L290 HydrophobicContact CG1-CG 3.93Å; I251-L290 HydrophobicContact CD1-CD2 3.62Å; F264-L290 HydrophobicContact CD1-CD2 4.33Å; F264-L290 HydrophobicContact CD2-CD2 3.79Å; F264-L290 HydrophobicContact CE1-CD2 4.32Å; F264-L290 HydrophobicContact CE2-CB 4.27Å; F264-L290 HydrophobicContact CE2-CD2 3.78Å; F264-L290 HydrophobicContact CG-CD2 4.06Å; F264-L290 HydrophobicContact CZ-CB 4.13Å; F264-L290 HydrophobicContact CZ-CD2 4.04Å; I268-L290 HydrophobicContact CD1-CD1 3.58Å; I268-L290 HydrophobicContact CG1-CD1 3.99Å; V286-L290 HydrophobicContact CG1-CD1 4.08Å; V286-L290 HydrophobicContact CG1-CG 4.48Å; V286-L290 WeakPolarHBondContact O-CG 3.46Å; V286-L290 PolarHBondContact O-N 2.74Å; T287-L290 PolarHBondContact O-N 3.12Å; L290-H292 VanDerWaalsContact C-N 3.34Å; L290-L313 HydrophobicContact CB-CD1 4.33Å
291	C	92.8	Very high	93.1	Very high	12 Å²	12	21.2 Å²	21.2	8%	0.081	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-0.4	175.7	-71.2	0	0	0	0	114.4	T287 G288 G289 T317	T287-C291 VanDerWaalsContact O-CB 3.3Å; T287-C291 WeakPolarHBondContact O-CB 3.35Å; T287-C291 PolarHBondContact O-N 3Å; T287-C291 PolarHBondContact O-SG 3.34Å; T287-C291 VanDerWaalsContact O-SG 3.41Å; G288-C291 CarbonylContact O-C 3.59Å; G288-C291 PolarHBondContact O-N 3.26Å; G289-C291 VanDerWaalsContact C-N 3.32Å; G289-C291 PolarHBondContact O-N 3.23Å; C291-T317 WeakPolarHBondContact SG-CG2 3.45Å
292	H	90.3	Very high	93	Very high	34 Å²	34	23.5 Å²	23.5	16%	0.157	13%	0.132	C	C	.	.	S	Bend	trans	-68.2	159.2	-171.7	-168.7	-122.7	0	0	0	113.1	Q248 G288 G289 L290 S294 I295 S296 E412	Q248-H292 HydrophobicContact CG-CB 4.32Å; Q248-H292 PolarHBondContact OE1-ND1 3.23Å; G288-H292 PolarHBondContact O-N 3.09Å; G289-H292 WeakPolarHBondContact O-CB 3.34Å; G289-H292 PolarHBondContact O-N 2.72Å; L290-H292 VanDerWaalsContact C-N 3.34Å; H292-S294 VanDerWaalsContact C-N 3.26Å; H292-S294 PolarHBondContact ND1-OG 2.75Å; H292-S294 VanDerWaalsContact ND1-OG 3.16Å; H292-S294 PolarHBondContact O-N 2.99Å; H292-I295 PolarHBondContact O-N 3.48Å; H292-S296 WeakPolarHBondContact O-CB 3.45Å; H292-S296 PolarHBondContact O-N 2.84Å; H292-S296 PolarHBondContact O-OG 2.9Å; H292-E412 IonicContact CE1-OE2 3.26Å; H292-E412 PolarHBondContact CE1-OE2 3.46Å; H292-E412 IonicContact ND1-OE2 2.84Å; H292-E412 IonicContact NE2-OE2 2.79Å
293	S	88.5	Confident	92.8	Very high	48 Å²	48	29.5 Å²	29.5	34%	0.336	16%	0.164	S	C	.	.	H	α-helix	trans	-61.2	-31.9	-175.8	66.9	0	0	0	0	113.2	R297	S293-R297 VanDerWaalsContact O-CG 3.27Å; S293-R297 WeakPolarHBondContact O-CG 3.4Å
294	S	89.2	Confident	92.8	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-69.7	-30.3	174.6	59.9	0	0	0	0	112.9	Q248 H292 R297 S419	Q248-S294 PolarHBondContact OE1-OG 3Å; H292-S294 VanDerWaalsContact C-N 3.26Å; H292-S294 PolarHBondContact ND1-OG 2.75Å; H292-S294 VanDerWaalsContact ND1-OG 3.16Å; H292-S294 PolarHBondContact O-N 2.99Å; S294-R297 WeakPolarHBondContact O-CG 3.31Å; S294-S419 WeakPolarHBondContact O-CB 3.42Å; S294-S419 PolarHBondContact O-OG 3.35Å
295	I	94.1	Very high	92.8	Very high	6 Å²	6	34.1 Å²	34.1	3%	0.031	19%	0.188	C	C	.	.	H	α-helix	trans	-98	-44.9	-177.2	-53.7	-55.2	0	0	0	111.5	Q248 I251 L252 F264 H292 R297 L298	Q248-I295 HydrophobicContact CB-CD1 4.06Å; Q248-I295 HydrophobicContact CB-CG1 4.14Å; Q248-I295 HydrophobicContact CG-CD1 4.31Å; Q248-I295 HydrophobicContact CG-CG1 3.83Å; I251-I295 HydrophobicContact CB-CD1 4.22Å; I251-I295 HydrophobicContact CD1-CG2 4.25Å; I251-I295 HydrophobicContact CG2-CD1 4.12Å; L252-I295 HydrophobicContact CD1-CD1 4.14Å; L252-I295 HydrophobicContact CD2-CD1 4.21Å; L252-I295 HydrophobicContact CG-CD1 3.85Å; F264-I295 HydrophobicContact CD2-CG2 3.94Å; F264-I295 HydrophobicContact CE2-CG2 3.7Å; H292-I295 PolarHBondContact O-N 3.48Å; I295-R297 PolarHBondContact O-N 3.27Å; I295-L298 HydrophobicContact CD1-CD1 4.29Å; I295-L298 VanDerWaalsContact O-CB 3.31Å; I295-L298 WeakPolarHBondContact O-CB 3.3Å; I295-L298 WeakPolarHBondContact O-CG 3.22Å; I295-L298 PolarHBondContact O-N 3.27Å
296	S	91.6	Very high	92.8	Very high	58 Å²	58	36.9 Å²	36.9	41%	0.406	21%	0.206	S	C	.	.	H	α-helix	trans	-62.2	-17.5	-179.6	57.7	0	0	0	0	114.4	H292 K299	H292-S296 WeakPolarHBondContact O-CB 3.45Å; H292-S296 PolarHBondContact O-N 2.84Å; H292-S296 PolarHBondContact O-OG 2.9Å; S296-K299 PolarHBondContact O-NZ 3Å
297	R	91.8	Very high	92.7	Very high	42 Å²	42	41.8 Å²	41.8	16%	0.158	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-18.6	171.5	66.6	177.5	-67.2	-65.2	-7.3	114.8	S293 S294 I295 K299 S419 E423	S293-R297 VanDerWaalsContact O-CG 3.27Å; S293-R297 WeakPolarHBondContact O-CG 3.4Å; S294-R297 WeakPolarHBondContact O-CG 3.31Å; I295-R297 PolarHBondContact O-N 3.27Å; R297-K299 PolarHBondContact O-N 2.93Å; R297-S419 VanDerWaalsContact CD-OG 3.26Å; R297-S419 WeakPolarHBondContact CD-OG 3.45Å; R297-S419 WeakPolarHBondContact CG-OG 3.47Å; R297-S419 VanDerWaalsContact NH1-C 3.28Å; R297-S419 PolarHBondContact NH1-O 3.15Å; R297-S419 PolarHBondContact NH1-OG 3.42Å; R297-E423 VanDerWaalsContact CZ-O 3.31Å; R297-E423 PolarHBondContact NH1-O 2.72Å; R297-E423 PolarHBondContact NH2-O 2.96Å
298	L	92	Very high	92.7	Very high	2 Å²	2	47 Å²	47	1%	0.01	27%	0.265	C	S	.	.			trans	-74.8	92.6	-176.1	-59.7	174.6	0	0	0	110.3	I251 L252 I295 S302 S419 E423	I251-L298 HydrophobicContact CG2-CD1 4.35Å; L252-L298 HydrophobicContact CD2-CD1 4Å; I295-L298 HydrophobicContact CD1-CD1 4.29Å; I295-L298 VanDerWaalsContact O-CB 3.31Å; I295-L298 WeakPolarHBondContact O-CB 3.3Å; I295-L298 WeakPolarHBondContact O-CG 3.22Å; I295-L298 PolarHBondContact O-N 3.27Å; L298-S302 WeakPolarHBondContact O-CB 3.46Å; L298-S302 PolarHBondContact O-N 3.47Å; L298-S419 WeakPolarHBondContact CD2-OG 3.11Å; L298-E423 WeakPolarHBondContact CA-OE2 3.25Å; L298-E423 HydrophobicContact CD2-CB 3.86Å; L298-E423 HydrophobicContact CD2-CG 3.83Å
299	K	92.6	Very high	92.9	Very high	120 Å²	120	47.1 Å²	47.1	52%	0.522	26%	0.263	S	S	.	.	H	α-helix	trans	-81.8	-34.8	-174.5	-61.9	-42.8	-175	-167.6	0	112.9	S296 R297 T301 S302 N303 E423	S296-K299 PolarHBondContact O-NZ 3Å; R297-K299 PolarHBondContact O-N 2.93Å; K299-T301 VanDerWaalsContact C-N 3.31Å; K299-T301 PolarHBondContact O-N 2.75Å; K299-S302 PolarHBondContact O-N 2.86Å; K299-N303 WeakPolarHBondContact O-CB 3.46Å; K299-N303 PolarHBondContact O-N 3.26Å; K299-N303 PolarHBondContact O-ND2 3.03Å; K299-N303 VanDerWaalsContact O-ND2 3.14Å; K299-N303 PolarHBondContact O-OD1 3.21Å; K299-E423 PolarHBondContact N-OE2 2.94Å
300	D	92.2	Very high	93	Very high	95 Å²	95	50 Å²	50	51%	0.508	28%	0.281	S	S	.	.	H	α-helix	trans	-68.7	-38.7	177.7	-58.8	-27.9	0	0	0	109.8	P257 L304 E423	P257-D300 HydrophobicContact CB-CB 4.24Å; P257-D300 HydrophobicContact CG-CB 4.12Å; D300-L304 WeakPolarHBondContact O-CD1 3.44Å; D300-L304 WeakPolarHBondContact O-CG 3.28Å; D300-E423 PolarHBondContact N-OE2 2.8Å
301	T	93.6	Very high	93.1	Very high	4 Å²	4	55.4 Å²	55.4	3%	0.025	30%	0.304	C	S	.	.	H	α-helix	trans	-62.9	-49	169.1	-55.4	0	0	0	0	111.9	R260 A261 K299 N303 L304 E423	R260-T301 HydrophobicContact CB-CG2 3.54Å; R260-T301 PolarHBondContact NE-OG1 2.92Å; A261-T301 HydrophobicContact CB-CG2 4.35Å; K299-T301 VanDerWaalsContact C-N 3.31Å; K299-T301 PolarHBondContact O-N 2.75Å; T301-N303 VanDerWaalsContact C-N 3.32Å; T301-N303 PolarHBondContact O-N 3.47Å; T301-L304 PolarHBondContact O-N 3.21Å; T301-L304 VanDerWaalsContact O-N 3.15Å; T301-E423 WeakPolarHBondContact CB-OE1 3.4Å; T301-E423 PolarHBondContact N-OE1 3.44Å; T301-E423 VanDerWaalsContact N-OE1 3.1Å; T301-E423 PolarHBondContact OG1-OE1 3.41Å
302	S	92.3	Very high	93.3	Very high	50 Å²	50	55.8 Å²	55.8	35%	0.35	31%	0.306	S	S	.	.	H	α-helix	trans	-66.3	-29.8	-175.8	-175.1	0	0	0	0	113.8	L298 K299 L304 L305	L298-S302 WeakPolarHBondContact O-CB 3.46Å; L298-S302 PolarHBondContact O-N 3.47Å; K299-S302 PolarHBondContact O-N 2.86Å; S302-L304 PolarHBondContact O-N 3.26Å; S302-L305 PolarHBondContact O-N 2.59Å
303	N	93	Very high	93.5	Very high	129 Å²	129	55.5 Å²	55.5	69%	0.69	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-14.7	176.5	-69.4	-21.6	0	0	0	113.2	K299 T301	K299-N303 WeakPolarHBondContact O-CB 3.46Å; K299-N303 PolarHBondContact O-N 3.26Å; K299-N303 PolarHBondContact O-ND2 3.03Å; K299-N303 VanDerWaalsContact O-ND2 3.14Å; K299-N303 PolarHBondContact O-OD1 3.21Å; T301-N303 VanDerWaalsContact C-N 3.32Å; T301-N303 PolarHBondContact O-N 3.47Å
304	L	95.4	Very high	93.8	Very high	81 Å²	81	56.3 Å²	56.3	42%	0.424	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-0.9	178.6	-64.8	169.7	0	0	0	113.2	P257 Q258 A261 D300 T301 S302	P257-L304 HydrophobicContact CB-CD1 3.64Å; Q258-L304 HydrophobicContact CG-CD1 3.98Å; A261-L304 HydrophobicContact CB-CB 3.88Å; D300-L304 WeakPolarHBondContact O-CD1 3.44Å; D300-L304 WeakPolarHBondContact O-CG 3.28Å; T301-L304 PolarHBondContact O-N 3.21Å; T301-L304 VanDerWaalsContact O-N 3.15Å; S302-L304 PolarHBondContact O-N 3.26Å
305	L	94.6	Very high	94.2	Very high	19 Å²	19	60.6 Å²	60.6	10%	0.099	33%	0.331	C	S	.	.	S	Bend	trans	-78.5	133.5	177.3	-64.3	176.3	0	0	0	110.9	A261 F264 S302	A261-L305 HydrophobicContact CB-CD2 4Å; F264-L305 HydrophobicContact CB-CD2 4Å; F264-L305 HydrophobicContact CD1-CD1 3.74Å; F264-L305 HydrophobicContact CD1-CD2 3.67Å; F264-L305 HydrophobicContact CD1-CG 4.4Å; F264-L305 HydrophobicContact CE1-CD1 3.68Å; F264-L305 HydrophobicContact CE1-CD2 4.43Å; F264-L305 HydrophobicContact CG-CD1 4.22Å; F264-L305 HydrophobicContact CG-CD2 3.96Å; F264-L305 HydrophobicContact CZ-CD1 4.09Å; S302-L305 PolarHBondContact O-N 2.59Å
306	P	94.8	Very high	94.3	Very high	59 Å²	59	61 Å²	61	38%	0.383	33%	0.333	S	S	.	.			trans	-59	148.6	172.6	-22.1	32	0	0	0	112	D308 I309 T310	P306-D308 VanDerWaalsContact C-N 3.27Å; P306-D308 PolarHBondContact O-N 2.91Å; P306-I309 HydrophobicContact CB-CG1 4.02Å; P306-I309 HydrophobicContact CG-CG1 4.02Å; P306-I309 WeakPolarHBondContact O-CB 3.07Å; P306-I309 PolarHBondContact O-N 3.11Å; P306-I309 VanDerWaalsContact O-N 3.09Å; P306-T310 PolarHBondContact O-N 3.05Å
307	P	94.3	Very high	94.4	Very high	104 Å²	104	59.5 Å²	59.5	68%	0.675	32%	0.321	S	S	*	.	H	α-helix	trans	-60.9	-35.2	-177.4	23.8	-33.6	0	0	0	112.6	I309 T310 K311	P307-I309 VanDerWaalsContact C-N 3.33Å; P307-I309 PolarHBondContact O-N 3.32Å; P307-T310 PolarHBondContact O-N 3.3Å; P307-K311 WeakPolarHBondContact O-CB 3.45Å; P307-K311 PolarHBondContact O-N 3.03Å
308	D	95.8	Very high	94.5	Very high	109 Å²	109	63.1 Å²	63.1	58%	0.583	34%	0.34	S	S	*	.	H	α-helix	trans	-64.4	-35.5	176.8	-62.1	-55.4	0	0	0	112.8	P306 K311 V312	P306-D308 VanDerWaalsContact C-N 3.27Å; P306-D308 PolarHBondContact O-N 2.91Å; D308-K311 WeakPolarHBondContact O-CB 3.38Å; D308-K311 PolarHBondContact O-N 3.29Å; D308-V312 WeakPolarHBondContact O-CB 3.46Å; D308-V312 VanDerWaalsContact O-CG2 3.27Å; D308-V312 WeakPolarHBondContact O-CG2 3.3Å; D308-V312 PolarHBondContact O-N 3.2Å
309	I	96.1	Very high	94.7	Very high	13 Å²	13	64.1 Å²	64.1	7%	0.067	35%	0.345	C	S	.	.	H	α-helix	trans	-68.1	-42.8	177	-60.8	-56.7	0	0	0	110.2	F264 T265 I268 P306 P307 K311 V312 L313	F264-I309 HydrophobicContact CD1-CG2 4.46Å; T265-I309 HydrophobicContact CG2-CD1 3.84Å; T265-I309 HydrophobicContact CG2-CG1 3.98Å; I268-I309 HydrophobicContact CB-CG2 4.03Å; I268-I309 HydrophobicContact CG1-CG2 3.79Å; I268-I309 HydrophobicContact CG2-CD1 4.09Å; I268-I309 HydrophobicContact CG2-CG2 4.07Å; P306-I309 HydrophobicContact CB-CG1 4.02Å; P306-I309 HydrophobicContact CG-CG1 4.02Å; P306-I309 WeakPolarHBondContact O-CB 3.07Å; P306-I309 PolarHBondContact O-N 3.11Å; P306-I309 VanDerWaalsContact O-N 3.09Å; P307-I309 VanDerWaalsContact C-N 3.33Å; P307-I309 PolarHBondContact O-N 3.32Å; I309-K311 VanDerWaalsContact C-N 3.33Å; I309-K311 PolarHBondContact O-N 3.49Å; I309-V312 PolarHBondContact O-N 3.28Å; I309-L313 PolarHBondContact O-N 3.23Å
310	T	93.6	Very high	94.7	Very high	60 Å²	60	58.5 Å²	58.5	37%	0.368	32%	0.321	S	S	.	.	H	α-helix	trans	-65.2	-35.8	174.2	-57.1	0	0	0	0	112.1	P306 P307 S314	P306-T310 PolarHBondContact O-N 3.05Å; P307-T310 PolarHBondContact O-N 3.3Å; T310-S314 PolarHBondContact O-N 2.95Å; T310-S314 VanDerWaalsContact O-N 3.07Å; T310-S314 PolarHBondContact O-OG 3.15Å
311	K	96.4	Very high	94.5	Very high	118 Å²	118	54.5 Å²	54.5	51%	0.513	30%	0.3	S	S	.	.	H	α-helix	trans	-66	-49.7	174.4	-175.8	-167.9	175.9	-137.4	0	111.6	P307 D308 I309 L313 S314 E315	P307-K311 WeakPolarHBondContact O-CB 3.45Å; P307-K311 PolarHBondContact O-N 3.03Å; D308-K311 WeakPolarHBondContact O-CB 3.38Å; D308-K311 PolarHBondContact O-N 3.29Å; I309-K311 VanDerWaalsContact C-N 3.33Å; I309-K311 PolarHBondContact O-N 3.49Å; K311-L313 VanDerWaalsContact C-N 3.32Å; K311-L313 PolarHBondContact O-N 3.48Å; K311-S314 WeakPolarHBondContact O-CA 3.48Å; K311-S314 VanDerWaalsContact O-CB 3.29Å; K311-S314 WeakPolarHBondContact O-CB 3.46Å; K311-S314 PolarHBondContact O-N 2.95Å; K311-E315 WeakPolarHBondContact CE-OE1 3.41Å; K311-E315 IonicContact NZ-OE1 2.81Å; K311-E315 PolarHBondContact NZ-OE1 2.89Å; K311-E315 WeakPolarHBondContact O-CG 3.44Å; K311-E315 PolarHBondContact O-N 3.02Å
312	V	97.1	Very high	94.1	Very high	20 Å²	20	57.5 Å²	57.5	12%	0.121	32%	0.321	C	S	.	.	H	α-helix	trans	-60.8	-40.9	178.1	169	0	0	0	0	111.5	I268 Q272 D308 I309 S314 E315 F316	I268-V312 HydrophobicContact CG2-CB 4.1Å; I268-V312 HydrophobicContact CG2-CG1 3.66Å; Q272-V312 HydrophobicContact CG-CG1 3.87Å; D308-V312 WeakPolarHBondContact O-CB 3.46Å; D308-V312 VanDerWaalsContact O-CG2 3.27Å; D308-V312 WeakPolarHBondContact O-CG2 3.3Å; D308-V312 PolarHBondContact O-N 3.2Å; I309-V312 PolarHBondContact O-N 3.28Å; V312-S314 VanDerWaalsContact C-N 3.32Å; V312-S314 PolarHBondContact O-N 2.78Å; V312-E315 PolarHBondContact O-N 3.4Å; V312-F316 HydrophobicContact CG1-CD2 4Å; V312-F316 HydrophobicContact CG1-CE2 3.42Å; V312-F316 VanDerWaalsContact CG1-CE2 3.42Å; V312-F316 HydrophobicContact CG1-CZ 3.72Å; V312-F316 WeakPolarHBondContact O-CG 3.45Å; V312-F316 PolarHBondContact O-N 2.86Å
313	L	95.3	Very high	93.6	Very high	28 Å²	28	63.7 Å²	63.7	15%	0.147	34%	0.337	C	S	.	.	H	α-helix	trans	-58.1	-45.9	171.7	178.9	59.8	0	0	0	111.3	F264 I268 T287 L290 I309 K311 E315 F316 T317	F264-L313 HydrophobicContact CE1-CD2 4.11Å; F264-L313 HydrophobicContact CZ-CD2 3.76Å; I268-L313 HydrophobicContact CD1-CB 3.78Å; I268-L313 HydrophobicContact CD1-CD1 3.94Å; I268-L313 HydrophobicContact CD1-CG 4.35Å; T287-L313 HydrophobicContact CG2-CD1 4.21Å; L290-L313 HydrophobicContact CB-CD1 4.33Å; I309-L313 PolarHBondContact O-N 3.23Å; K311-L313 VanDerWaalsContact C-N 3.32Å; K311-L313 PolarHBondContact O-N 3.48Å; L313-E315 PolarHBondContact O-N 2.85Å; L313-F316 PolarHBondContact O-N 3.48Å; L313-T317 HydrophobicContact CD1-CG2 4.36Å; L313-T317 WeakPolarHBondContact O-CG2 3.48Å; L313-T317 PolarHBondContact O-N 3.45Å
314	S	95.1	Very high	93.3	Very high	65 Å²	65	62.4 Å²	62.4	46%	0.455	34%	0.338	S	S	.	.	H	α-helix	trans	-59.7	-46.5	178.3	-56.7	0	0	0	0	111.5	T310 K311 V312 F316 T317 E318	T310-S314 PolarHBondContact O-N 2.95Å; T310-S314 VanDerWaalsContact O-N 3.07Å; T310-S314 PolarHBondContact O-OG 3.15Å; K311-S314 WeakPolarHBondContact O-CA 3.48Å; K311-S314 VanDerWaalsContact O-CB 3.29Å; K311-S314 WeakPolarHBondContact O-CB 3.46Å; K311-S314 PolarHBondContact O-N 2.95Å; V312-S314 VanDerWaalsContact C-N 3.32Å; V312-S314 PolarHBondContact O-N 2.78Å; S314-F316 VanDerWaalsContact C-N 3.34Å; S314-F316 PolarHBondContact O-N 3.25Å; S314-T317 PolarHBondContact O-N 3.34Å; S314-T317 VanDerWaalsContact O-N 3.16Å; S314-T317 PolarHBondContact O-OG1 2.88Å; S314-E318 PolarHBondContact O-N 3.24Å
315	E	96.9	Very high	92.8	Very high	90 Å²	90	60.5 Å²	60.5	42%	0.421	33%	0.328	S	S	.	.	H	α-helix	trans	-57.9	-41.5	175.6	-69.6	172.8	-170.7	0	0	112.1	K311 V312 L313 E318 L319	K311-E315 WeakPolarHBondContact CE-OE1 3.41Å; K311-E315 IonicContact NZ-OE1 2.81Å; K311-E315 PolarHBondContact NZ-OE1 2.89Å; K311-E315 WeakPolarHBondContact O-CG 3.44Å; K311-E315 PolarHBondContact O-N 3.02Å; V312-E315 PolarHBondContact O-N 3.4Å; L313-E315 PolarHBondContact O-N 2.85Å; E315-E318 PolarHBondContact O-N 3.02Å; E315-L319 WeakPolarHBondContact O-CB 3.41Å; E315-L319 PolarHBondContact O-N 2.94Å
316	F	96.4	Very high	92.6	Very high	16 Å²	16	61.4 Å²	61.4	7%	0.07	33%	0.331	C	S	.	.	H	α-helix	trans	-69.2	-37.7	174.4	-64.2	-26.4	0	0	0	113.1	A271 Q272 R275 L283 T287 V312 L313 S314 E318 L319 L320	A271-F316 HydrophobicContact CB-CD2 3.89Å; A271-F316 HydrophobicContact CB-CE2 3.55Å; A271-F316 HydrophobicContact CB-CZ 4.5Å; Q272-F316 HydrophobicContact CB-CZ 4.38Å; Q272-F316 HydrophobicContact CG-CE2 4.09Å; Q272-F316 HydrophobicContact CG-CZ 3.77Å; R275-F316 HydrophobicContact CB-CE1 4.18Å; R275-F316 HydrophobicContact CB-CZ 4.37Å; R275-F316 HydrophobicContact CG-CE1 4.11Å; L283-F316 HydrophobicContact CD1-CD2 4.35Å; L283-F316 HydrophobicContact CD1-CG 4.45Å; T287-F316 HydrophobicContact CG2-CB 4.16Å; V312-F316 HydrophobicContact CG1-CD2 4Å; V312-F316 HydrophobicContact CG1-CE2 3.42Å; V312-F316 VanDerWaalsContact CG1-CE2 3.42Å; V312-F316 HydrophobicContact CG1-CZ 3.72Å; V312-F316 WeakPolarHBondContact O-CG 3.45Å; V312-F316 PolarHBondContact O-N 2.86Å; L313-F316 PolarHBondContact O-N 3.48Å; S314-F316 VanDerWaalsContact C-N 3.34Å; S314-F316 PolarHBondContact O-N 3.25Å; F316-E318 VanDerWaalsContact C-N 3.29Å; F316-E318 PolarHBondContact O-N 2.94Å; F316-L319 PolarHBondContact O-N 3.49Å; F316-L320 WeakPolarHBondContact O-CB 3.49Å; F316-L320 WeakPolarHBondContact O-CG 3.45Å; F316-L320 PolarHBondContact O-N 2.85Å
317	T	93.2	Very high	92.5	Very high	25 Å²	25	61 Å²	61	15%	0.153	33%	0.329	C	S	.	.	H	α-helix	trans	-67	-28.2	174.6	64.5	0	0	0	0	113.5	T287 C291 L313 S314 S321 P438 V439	T287-T317 HydrophobicContact CG2-CG2 4.1Å; C291-T317 WeakPolarHBondContact SG-CG2 3.45Å; L313-T317 HydrophobicContact CD1-CG2 4.36Å; L313-T317 WeakPolarHBondContact O-CG2 3.48Å; L313-T317 PolarHBondContact O-N 3.45Å; S314-T317 PolarHBondContact O-N 3.34Å; S314-T317 VanDerWaalsContact O-N 3.16Å; S314-T317 PolarHBondContact O-OG1 2.88Å; T317-S321 WeakPolarHBondContact O-CA 3.46Å; T317-S321 VanDerWaalsContact O-CB 3.3Å; T317-S321 WeakPolarHBondContact O-CB 3.35Å; T317-S321 PolarHBondContact O-N 2.97Å; T317-P438 HydrophobicContact CG2-CG 4.02Å; T317-V439 HydrophobicContact CG2-CG2 3.91Å
318	E	94.4	Very high	92.5	Very high	119 Å²	119	58.5 Å²	58.5	56%	0.556	31%	0.31	S	S	*	.	H	α-helix	trans	-77.4	-40.5	172.3	178.7	158.2	-146.8	0	0	112.3	S314 E315 F316 S321 N328	S314-E318 PolarHBondContact O-N 3.24Å; E315-E318 PolarHBondContact O-N 3.02Å; F316-E318 VanDerWaalsContact C-N 3.29Å; F316-E318 PolarHBondContact O-N 2.94Å; E318-S321 WeakPolarHBondContact O-CB 3.28Å; E318-S321 PolarHBondContact O-N 3.27Å; E318-N328 WeakPolarHBondContact CG-ND2 3.48Å; E318-N328 PolarHBondContact O-ND2 3.46Å
319	L	94.9	Very high	92.5	Very high	23 Å²	23	53.3 Å²	53.3	12%	0.12	28%	0.282	C	S	.	.	H	α-helix	trans	-59.6	-46.5	175.3	175	60.9	0	0	0	112	E315 F316 S321 N328 Y329 V332	E315-L319 WeakPolarHBondContact O-CB 3.41Å; E315-L319 PolarHBondContact O-N 2.94Å; F316-L319 PolarHBondContact O-N 3.49Å; L319-S321 VanDerWaalsContact C-N 3.32Å; L319-N328 WeakPolarHBondContact O-CB 3.41Å; L319-Y329 PolarHBondContact O-N 3.17Å; L319-Y329 VanDerWaalsContact O-N 3.07Å; L319-V332 HydrophobicContact CD1-CB 4.14Å; L319-V332 HydrophobicContact CD1-CG1 4.32Å; L319-V332 HydrophobicContact CD1-CG2 3.85Å
320	L	92.4	Very high	92.5	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.005	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	2.5	-177.5	-61	170.9	0	0	0	113.4	L283 M284 T287 F316 S322 Y326 I343 V439	L283-L320 HydrophobicContact CG-CD1 4.28Å; M284-L320 HydrophobicContact CB-CD2 4.45Å; M284-L320 HydrophobicContact SD-CB 4.02Å; M284-L320 HydrophobicContact SD-CD1 4.23Å; M284-L320 HydrophobicContact SD-CD2 4.24Å; M284-L320 HydrophobicContact SD-CG 4.41Å; T287-L320 HydrophobicContact CG2-CD1 3.91Å; T287-L320 WeakPolarHBondContact OG1-CD1 3.49Å; F316-L320 WeakPolarHBondContact O-CB 3.49Å; F316-L320 WeakPolarHBondContact O-CG 3.45Å; F316-L320 PolarHBondContact O-N 2.85Å; L320-S322 PolarHBondContact O-N 2.72Å; L320-Y326 WeakPolarHBondContact O-CD1 3.41Å; L320-Y326 WeakPolarHBondContact O-CE1 3.25Å; L320-I343 HydrophobicContact CD2-CD1 3.74Å; L320-V439 HydrophobicContact CB-CG1 4.36Å; L320-V439 HydrophobicContact CB-CG2 4.2Å; L320-V439 HydrophobicContact CD1-CG1 4.48Å
321	S	88.8	Confident	92.6	Very high	11 Å²	11	59.3 Å²	59.3	8%	0.077	30%	0.297	C	S	.	.			trans	-63.3	133.6	-173	-158	0	0	0	0	112.1	T317 E318 L319 R323 Y326	T317-S321 WeakPolarHBondContact O-CA 3.46Å; T317-S321 VanDerWaalsContact O-CB 3.3Å; T317-S321 WeakPolarHBondContact O-CB 3.35Å; T317-S321 PolarHBondContact O-N 2.97Å; E318-S321 WeakPolarHBondContact O-CB 3.28Å; E318-S321 PolarHBondContact O-N 3.27Å; L319-S321 VanDerWaalsContact C-N 3.32Å; S321-R323 PolarHBondContact O-N 3.22Å; S321-R323 VanDerWaalsContact O-N 3.08Å; S321-R323 WeakPolarHBondContact OG-CD 3.49Å; S321-R323 WeakPolarHBondContact OG-CG 3.49Å; S321-Y326 WeakPolarHBondContact O-CA 3.29Å
322	S	84.9	Confident	92.6	Very high	67 Å²	67	54.2 Å²	54.2	47%	0.469	28%	0.276	S	S	.	.			trans	-67.3	-6.3	175.6	61.3	0	0	0	0	114.3	L320 S324 N325 Y326	L320-S322 PolarHBondContact O-N 2.72Å; S322-S324 PolarHBondContact O-N 3.2Å; S322-N325 PolarHBondContact O-N 3.44Å; S322-Y326 PolarHBondContact O-N 3.25Å
323	R	81.4	Confident	92.5	Very high	181 Å²	181	53.8 Å²	53.8	68%	0.683	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-49.5	136.2	172.9	-69.2	174.5	-176.3	-171.4	4	110.9	S321 N325 Y326 S327	S321-R323 PolarHBondContact O-N 3.22Å; S321-R323 VanDerWaalsContact O-N 3.08Å; S321-R323 WeakPolarHBondContact OG-CD 3.49Å; S321-R323 WeakPolarHBondContact OG-CG 3.49Å; R323-N325 PolarHBondContact O-N 3.12Å; R323-N325 VanDerWaalsContact O-N 3.16Å; R323-Y326 PolarHBondContact O-N 3.43Å; R323-Y326 VanDerWaalsContact O-N 3.12Å; R323-S327 PolarHBondContact O-N 2.92Å
324	S	86.4	Confident	92.4	Very high	101 Å²	101	58.2 Å²	58.2	71%	0.706	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	50.3	38.4	-179.3	-57.6	0	0	0	0	114	S322	S322-S324 PolarHBondContact O-N 3.2Å
325	N	86.3	Confident	92.4	Very high	42 Å²	42	60.4 Å²	60.4	23%	0.225	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	56.5	50.6	-176.3	-159.6	48.6	0	0	0	113.2	S322 R323 R330 K349	S322-N325 PolarHBondContact O-N 3.44Å; R323-N325 PolarHBondContact O-N 3.12Å; R323-N325 VanDerWaalsContact O-N 3.16Å; N325-R330 PolarHBondContact ND2-NH2 3.08Å; N325-R330 VanDerWaalsContact ND2-NH2 3.19Å; N325-R330 WeakPolarHBondContact O-CD 3.22Å; N325-R330 PolarHBondContact O-NE 2.75Å; N325-K349 PolarHBondContact OD1-NZ 3.03Å
326	Y	91.1	Very high	92.2	Very high	38 Å²	38	57 Å²	57	15%	0.149	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	38	179.6	-57.1	-86.2	0	0	0	114.1	L320 S321 S322 R323 N328 Y329 R330 V346	L320-Y326 WeakPolarHBondContact O-CD1 3.41Å; L320-Y326 WeakPolarHBondContact O-CE1 3.25Å; S321-Y326 WeakPolarHBondContact O-CA 3.29Å; S322-Y326 PolarHBondContact O-N 3.25Å; R323-Y326 PolarHBondContact O-N 3.43Å; R323-Y326 VanDerWaalsContact O-N 3.12Å; Y326-N328 VanDerWaalsContact C-N 3.28Å; Y326-N328 PolarHBondContact O-N 3.22Å; Y326-Y329 PolarHBondContact O-N 3.05Å; Y326-R330 WeakPolarHBondContact O-CG 3.49Å; Y326-R330 PolarHBondContact O-N 3.49Å; Y326-V346 HydrophobicContact CD1-CG2 4.28Å; Y326-V346 HydrophobicContact CD2-CB 4.49Å; Y326-V346 HydrophobicContact CD2-CG1 3.94Å; Y326-V346 HydrophobicContact CD2-CG2 3.77Å; Y326-V346 HydrophobicContact CE1-CG2 4.36Å; Y326-V346 HydrophobicContact CE2-CG2 3.85Å; Y326-V346 HydrophobicContact CG-CG1 4.3Å; Y326-V346 HydrophobicContact CG-CG2 4Å
327	S	92.4	Very high	91.8	Very high	49 Å²	49	66.6 Å²	66.6	34%	0.343	32%	0.321	S	S	.	.	H	α-helix	trans	-58.1	-35.9	-174.1	60	0	0	0	0	114.1	R323 R331	R323-S327 PolarHBondContact O-N 2.92Å; S327-R331 WeakPolarHBondContact O-CB 3.34Å; S327-R331 PolarHBondContact O-N 3.15Å
328	N	94.3	Very high	91.6	Very high	52 Å²	52	68 Å²	68	28%	0.278	34%	0.341	S	S	.	.	H	α-helix	trans	-66.6	-54.4	178.9	-72.3	-10.4	0	0	0	111.1	E318 L319 Y326 R330 R331 V332	E318-N328 WeakPolarHBondContact CG-ND2 3.48Å; E318-N328 PolarHBondContact O-ND2 3.46Å; L319-N328 WeakPolarHBondContact O-CB 3.41Å; Y326-N328 VanDerWaalsContact C-N 3.28Å; Y326-N328 PolarHBondContact O-N 3.22Å; N328-R330 PolarHBondContact O-N 3.42Å; N328-R331 PolarHBondContact O-N 3.38Å; N328-V332 WeakPolarHBondContact O-CG2 3.26Å; N328-V332 PolarHBondContact O-N 3.35Å; N328-V332 VanDerWaalsContact O-N 3.17Å
329	Y	95.8	Very high	91.5	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-52.3	-51.6	171.5	158.1	-108	0	0	0	111.9	F280 L319 Y326 R331 V332 Y333 I343 V346	F280-Y329 HydrophobicContact CB-CD2 4.15Å; F280-Y329 HydrophobicContact CB-CE2 3.67Å; F280-Y329 AromaticContact CD1-CD2 3.84Å; F280-Y329 HydrophobicContact CD1-CD2 3.84Å; F280-Y329 HydrophobicContact CD1-CE2 4.03Å; F280-Y329 HydrophobicContact CD2-CE2 4.24Å; F280-Y329 HydrophobicContact CE1-CD2 4.46Å; F280-Y329 HydrophobicContact CG-CD2 4.03Å; F280-Y329 AromaticContact CG-CE2 3.72Å; F280-Y329 HydrophobicContact CG-CE2 3.72Å; L319-Y329 PolarHBondContact O-N 3.17Å; L319-Y329 VanDerWaalsContact O-N 3.07Å; Y326-Y329 PolarHBondContact O-N 3.05Å; Y329-R331 PolarHBondContact O-N 3Å; Y329-V332 PolarHBondContact O-N 2.92Å; Y329-Y333 AromaticContact CE2-CD2 3.95Å; Y329-Y333 HydrophobicContact CE2-CD2 3.95Å; Y329-Y333 HydrophobicContact CE2-CG 4.02Å; Y329-Y333 VanDerWaalsContact O-CB 3.23Å; Y329-Y333 WeakPolarHBondContact O-CB 3.5Å; Y329-Y333 PolarHBondContact O-N 3.4Å; Y329-I343 HydrophobicContact CD1-CD1 4.15Å; Y329-I343 HydrophobicContact CD2-CD1 3.6Å; Y329-I343 HydrophobicContact CD2-CG1 4.08Å; Y329-I343 HydrophobicContact CE1-CB 4.35Å; Y329-I343 HydrophobicContact CE1-CD1 4.25Å; Y329-I343 HydrophobicContact CE1-CG1 4.38Å; Y329-I343 HydrophobicContact CE2-CB 4.34Å; Y329-I343 HydrophobicContact CE2-CD1 3.72Å; Y329-I343 HydrophobicContact CE2-CG1 3.64Å; Y329-I343 HydrophobicContact CG-CD1 3.83Å; Y329-I343 PolarHBondContact OH-N 3.08Å; Y329-V346 HydrophobicContact CD1-CG1 4.22Å; Y329-V346 HydrophobicContact CE1-CB 4.1Å; Y329-V346 HydrophobicContact CE1-CG1 3.87Å; Y329-V346 HydrophobicContact CE1-CG2 4.31Å
330	R	94.9	Very high	91.4	Very high	54 Å²	54	64 Å²	64	20%	0.204	32%	0.321	C	S	.	.	H	α-helix	trans	-59.6	-43.9	-177.1	-72.2	178.7	-172.7	-82.1	1.4	112.7	N325 Y326 N328 Y333 N334 D350	N325-R330 PolarHBondContact ND2-NH2 3.08Å; N325-R330 VanDerWaalsContact ND2-NH2 3.19Å; N325-R330 WeakPolarHBondContact O-CD 3.22Å; N325-R330 PolarHBondContact O-NE 2.75Å; Y326-R330 WeakPolarHBondContact O-CG 3.49Å; Y326-R330 PolarHBondContact O-N 3.49Å; N328-R330 PolarHBondContact O-N 3.42Å; R330-Y333 PolarHBondContact O-N 2.7Å; R330-N334 WeakPolarHBondContact O-CB 3.38Å; R330-N334 PolarHBondContact O-N 3.42Å; R330-N334 VanDerWaalsContact O-N 3.09Å; R330-N334 PolarHBondContact O-ND2 3.09Å; R330-N334 PolarHBondContact O-OD1 3.14Å; R330-D350 IonicContact CZ-OD1 2.98Å; R330-D350 IonicContact CZ-OD2 2.72Å; R330-D350 IonicContact NH1-OD1 3.63Å; R330-D350 IonicContact NH1-OD2 2.72Å; R330-D350 PolarHBondContact NH1-OD2 2.74Å; R330-D350 IonicContact NH2-OD1 2.98Å; R330-D350 PolarHBondContact NH2-OD1 3.46Å; R330-D350 IonicContact NH2-OD2 2.93Å; R330-D350 PolarHBondContact NH2-OD2 2.95Å
331	R	95.6	Very high	91.6	Very high	145 Å²	145	64 Å²	64	55%	0.547	32%	0.32	S	S	.	.	H	α-helix	trans	-58	-52.8	176	179.2	175.1	69	77	-6.2	110.7	S327 N328 Y329 Y333 N334 E335	S327-R331 WeakPolarHBondContact O-CB 3.34Å; S327-R331 PolarHBondContact O-N 3.15Å; N328-R331 PolarHBondContact O-N 3.38Å; Y329-R331 PolarHBondContact O-N 3Å; R331-Y333 PolarHBondContact O-N 3.15Å; R331-N334 PolarHBondContact O-N 3.36Å; R331-E335 WeakPolarHBondContact CG-OE1 3.36Å; R331-E335 IonicContact CZ-OE1 3.75Å; R331-E335 IonicContact NH1-OE1 3.38Å; R331-E335 PolarHBondContact NH1-OE1 2.92Å; R331-E335 IonicContact NH1-OE2 3.85Å; R331-E335 PolarHBondContact NH1-OE2 3.01Å; R331-E335 WeakPolarHBondContact O-CG 3.33Å; R331-E335 PolarHBondContact O-N 3.07Å; R331-E335 VanDerWaalsContact O-N 3.13Å
332	V	96.4	Very high	91.9	Very high	11 Å²	11	63.5 Å²	63.5	7%	0.067	32%	0.317	C	S	.	.	H	α-helix	trans	-64.3	-39.3	-178.8	169.6	0	0	0	0	112.4	F280 L319 N328 Y329 N334 E335 C336	F280-V332 HydrophobicContact CE1-CG1 3.87Å; F280-V332 HydrophobicContact CZ-CG1 3.86Å; L319-V332 HydrophobicContact CD1-CB 4.14Å; L319-V332 HydrophobicContact CD1-CG1 4.32Å; L319-V332 HydrophobicContact CD1-CG2 3.85Å; N328-V332 WeakPolarHBondContact O-CG2 3.26Å; N328-V332 PolarHBondContact O-N 3.35Å; N328-V332 VanDerWaalsContact O-N 3.17Å; Y329-V332 PolarHBondContact O-N 2.92Å; V332-N334 VanDerWaalsContact C-N 3.3Å; V332-N334 PolarHBondContact O-N 3.24Å; V332-E335 PolarHBondContact O-N 3.5Å; V332-C336 PolarHBondContact O-N 3.46Å; V332-C336 VanDerWaalsContact O-N 3.12Å; V332-C336 PolarHBondContact O-SG 3.47Å; V332-C336 VanDerWaalsContact O-SG 3.4Å
333	Y	95.3	Very high	92.3	Very high	11 Å²	11	60.4 Å²	60.4	4%	0.043	30%	0.295	C	S	.	.	H	α-helix	trans	-68	-28.3	178.6	-178.6	-97.8	0	0	0	113.2	F280 Y329 R330 R331 C336 K340 P342 H347 I385	F280-Y333 AromaticContact CD2-CD2 3.78Å; F280-Y333 HydrophobicContact CD2-CD2 3.78Å; F280-Y333 HydrophobicContact CD2-CE2 4.4Å; F280-Y333 AromaticContact CE2-CD2 3.86Å; F280-Y333 HydrophobicContact CE2-CD2 3.86Å; Y329-Y333 AromaticContact CE2-CD2 3.95Å; Y329-Y333 HydrophobicContact CE2-CD2 3.95Å; Y329-Y333 HydrophobicContact CE2-CG 4.02Å; Y329-Y333 VanDerWaalsContact O-CB 3.23Å; Y329-Y333 WeakPolarHBondContact O-CB 3.5Å; Y329-Y333 PolarHBondContact O-N 3.4Å; R330-Y333 PolarHBondContact O-N 2.7Å; R331-Y333 PolarHBondContact O-N 3.15Å; Y333-C336 WeakPolarHBondContact O-CB 3.45Å; Y333-K340 HydrophobicContact CD2-CD 4.25Å; Y333-K340 HydrophobicContact CE2-CB 4.39Å; Y333-K340 HydrophobicContact CE2-CD 3.69Å; Y333-K340 HydrophobicContact CE2-CG 3.94Å; Y333-K340 PolarHBondContact O-NZ 3.44Å; Y333-P342 HydrophobicContact CE2-CB 3.94Å; Y333-H347 AromaticContact CD1-NE2 3.58Å; Y333-H347 AromaticContact CE1-NE2 3.32Å; Y333-H347 VanDerWaalsContact CE1-NE2 3.32Å; Y333-H347 WeakPolarHBondContact CE1-NE2 3.35Å; Y333-I385 WeakPolarHBondContact OH-CD1 3.36Å
334	N	93.6	Very high	92.8	Very high	122 Å²	122	51.8 Å²	51.8	65%	0.652	26%	0.262	S	S	*	.	H	α-helix	trans	-80.5	-27.9	174.2	-68.1	-4	0	0	0	112.4	R330 R331 V332 C336	R330-N334 WeakPolarHBondContact O-CB 3.38Å; R330-N334 PolarHBondContact O-N 3.42Å; R330-N334 VanDerWaalsContact O-N 3.09Å; R330-N334 PolarHBondContact O-ND2 3.09Å; R330-N334 PolarHBondContact O-OD1 3.14Å; R331-N334 PolarHBondContact O-N 3.36Å; V332-N334 VanDerWaalsContact C-N 3.3Å; V332-N334 PolarHBondContact O-N 3.24Å; N334-C336 VanDerWaalsContact C-N 3.3Å
335	E	94.9	Very high	92.9	Very high	111 Å²	111	47.3 Å²	47.3	52%	0.519	23%	0.233	S	C	.	.	H	α-helix	trans	-70.7	-26.5	170.3	-68.2	161.3	-171	0	0	111.7	R331 V332	R331-E335 WeakPolarHBondContact CG-OE1 3.36Å; R331-E335 IonicContact CZ-OE1 3.75Å; R331-E335 IonicContact NH1-OE1 3.38Å; R331-E335 PolarHBondContact NH1-OE1 2.92Å; R331-E335 IonicContact NH1-OE2 3.85Å; R331-E335 PolarHBondContact NH1-OE2 3.01Å; R331-E335 WeakPolarHBondContact O-CG 3.33Å; R331-E335 PolarHBondContact O-N 3.07Å; R331-E335 VanDerWaalsContact O-N 3.13Å; V332-E335 PolarHBondContact O-N 3.5Å
336	C	93.1	Very high	93	Very high	17 Å²	17	45.5 Å²	45.5	12%	0.115	22%	0.223	C	C	.	.			trans	-69.9	132.9	-178.4	-87.5	0	0	0	0	115.3	Q278 V332 Y333 N334 K340	Q278-C336 PolarHBondContact OE1-SG 2.96Å; V332-C336 PolarHBondContact O-N 3.46Å; V332-C336 VanDerWaalsContact O-N 3.12Å; V332-C336 PolarHBondContact O-SG 3.47Å; V332-C336 VanDerWaalsContact O-SG 3.4Å; Y333-C336 WeakPolarHBondContact O-CB 3.45Å; N334-C336 VanDerWaalsContact C-N 3.3Å; C336-K340 HydrophobicContact CB-CD 3.85Å; C336-K340 PolarHBondContact O-NZ 2.87Å
337	R	88.6	Confident	93	Very high	218 Å²	218	45 Å²	45	82%	0.823	22%	0.222	S	C	*	.			trans	-129.5	149.4	-178.7	-62.2	-179.3	-177.9	-95	-0.4	111.7	Q278	Q278-R337 PolarHBondContact NE2-O 3.25Å; Q278-R337 VanDerWaalsContact NE2-O 3.15Å; Q278-R337 PolarHBondContact OE1-O 3.03Å
338	G	88.4	Confident	92.9	Very high	56 Å²	56	42.7 Å²	42.7	58%	0.577	21%	0.206	S	C	*	.	S	Bend	trans	85	-148.4	-177.1	0	0	0	0	0	111.7	K340	G338-K340 PolarHBondContact O-N 3.43Å
339	F	91.9	Very high	92.6	Very high	22 Å²	22	43.7 Å²	43.7	10%	0.096	21%	0.208	C	C	.	.	S	Bend	trans	-58.7	126.2	172.4	175.9	-94.3	0	0	0	110.7	F207 L277 V341 P390 P391 F392	F207-F339 HydrophobicContact CB-CE2 4.22Å; F207-F339 HydrophobicContact CB-CZ 4.28Å; F207-F339 HydrophobicContact CD1-CE2 4.04Å; F207-F339 HydrophobicContact CD2-CD2 4.42Å; F207-F339 AromaticContact CD2-CE2 3.55Å; F207-F339 HydrophobicContact CD2-CE2 3.55Å; F207-F339 HydrophobicContact CD2-CZ 4.19Å; F207-F339 HydrophobicContact CE1-CE2 4.28Å; F207-F339 HydrophobicContact CE2-CD2 4.27Å; F207-F339 AromaticContact CE2-CE2 3.82Å; F207-F339 HydrophobicContact CE2-CE2 3.82Å; F207-F339 AromaticContact CG-CE2 3.66Å; F207-F339 HydrophobicContact CG-CE2 3.66Å; F207-F339 HydrophobicContact CG-CZ 4.21Å; F207-F339 HydrophobicContact CZ-CD2 4.47Å; F207-F339 HydrophobicContact CZ-CE2 4.18Å; L277-F339 WeakPolarHBondContact O-CD1 3.46Å; F339-V341 HydrophobicContact CE1-CG2 4.19Å; F339-V341 HydrophobicContact CZ-CG2 3.83Å; F339-P390 HydrophobicContact CD2-CB 4.27Å; F339-P390 HydrophobicContact CD2-CG 4.35Å; F339-P390 HydrophobicContact CE2-CB 3.97Å; F339-P390 HydrophobicContact CE2-CG 3.89Å; F339-P390 HydrophobicContact CZ-CB 4.44Å; F339-P391 HydrophobicContact CD1-CG 4.42Å; F339-F392 HydrophobicContact CE1-CE1 4.09Å; F339-F392 HydrophobicContact CE1-CZ 4.22Å; F339-F392 HydrophobicContact CZ-CE1 4.34Å; F339-F392 HydrophobicContact CZ-CZ 4.01Å
340	K	93.8	Very high	92.2	Very high	36 Å²	36	45.2 Å²	45.2	16%	0.157	22%	0.216	C	C	.	.			trans	-153.8	151.2	173.1	63.5	-173.1	-176.3	179.7	0	110	Q278 Y333 C336 G338 I385	Q278-K340 HydrophobicContact CB-CB 3.82Å; Q278-K340 WeakPolarHBondContact O-CA 3.49Å; Y333-K340 HydrophobicContact CD2-CD 4.25Å; Y333-K340 HydrophobicContact CE2-CB 4.39Å; Y333-K340 HydrophobicContact CE2-CD 3.69Å; Y333-K340 HydrophobicContact CE2-CG 3.94Å; Y333-K340 PolarHBondContact O-NZ 3.44Å; C336-K340 HydrophobicContact CB-CD 3.85Å; C336-K340 PolarHBondContact O-NZ 2.87Å; G338-K340 PolarHBondContact O-N 3.43Å; K340-I385 VanDerWaalsContact O-CG2 3.25Å; K340-I385 WeakPolarHBondContact O-CG2 3.38Å
341	V	95.1	Very high	92	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-119	116.3	176.8	-168.3	0	0	0	0	109.3	E206 F207 Q278 N279 F280 N281 F339	E206-V341 HydrophobicContact CG-CG1 4.05Å; F207-V341 HydrophobicContact CD2-CG2 4.28Å; Q278-V341 PolarHBondContact O-N 2.99Å; N279-V341 HydrophobicContact CB-CB 4.2Å; N279-V341 HydrophobicContact CB-CG2 4Å; F280-V341 WeakPolarHBondContact CB-O 3.41Å; F280-V341 PolarHBondContact N-O 2.94Å; N281-V341 HydrophobicContact CB-CG1 4.13Å; F339-V341 HydrophobicContact CE1-CG2 4.19Å; F339-V341 HydrophobicContact CZ-CG2 3.83Å
342	P	95.3	Very high	91.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.189	C	C	.	.			trans	-70	151.1	-179.9	26.2	-32	0	0	0	112.4	F210 N281 Y333 L344 L382 I385	F210-P342 HydrophobicContact CE2-CG 3.89Å; F210-P342 HydrophobicContact CZ-CG 3.88Å; N281-P342 WeakPolarHBondContact CB-O 3.25Å; Y333-P342 HydrophobicContact CE2-CB 3.94Å; P342-L344 PolarHBondContact O-N 2.83Å; P342-L382 HydrophobicContact CB-CD2 4.32Å; P342-L382 HydrophobicContact CG-CD2 3.86Å; P342-I385 HydrophobicContact CG-CD1 4.27Å
343	I	94.1	Very high	91.3	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.01	20%	0.195	C	C	.	.			trans	-70.6	97.8	164.7	-52.1	174	0	0	0	107.6	F280 N281 M284 L320 Y329 G345 V346 H347	F280-I343 HydrophobicContact CB-CD1 4.23Å; F280-I343 HydrophobicContact CB-CG1 3.62Å; N281-I343 WeakPolarHBondContact OD1-CA 3.43Å; M284-I343 HydrophobicContact CB-CD1 4.29Å; M284-I343 HydrophobicContact CB-CG1 4.37Å; M284-I343 HydrophobicContact CB-CG2 4.34Å; M284-I343 HydrophobicContact CG-CG2 4.14Å; M284-I343 HydrophobicContact SD-CD1 4.43Å; L320-I343 HydrophobicContact CD2-CD1 3.74Å; Y329-I343 HydrophobicContact CD1-CD1 4.15Å; Y329-I343 HydrophobicContact CD2-CD1 3.6Å; Y329-I343 HydrophobicContact CD2-CG1 4.08Å; Y329-I343 HydrophobicContact CE1-CB 4.35Å; Y329-I343 HydrophobicContact CE1-CD1 4.25Å; Y329-I343 HydrophobicContact CE1-CG1 4.38Å; Y329-I343 HydrophobicContact CE2-CB 4.34Å; Y329-I343 HydrophobicContact CE2-CD1 3.72Å; Y329-I343 HydrophobicContact CE2-CG1 3.64Å; Y329-I343 HydrophobicContact CG-CD1 3.83Å; Y329-I343 PolarHBondContact OH-N 3.08Å; I343-G345 VanDerWaalsContact C-N 3.35Å; I343-G345 PolarHBondContact O-N 3.39Å; I343-V346 HydrophobicContact CB-CB 4.39Å; I343-V346 HydrophobicContact CB-CG2 3.87Å; I343-V346 HydrophobicContact CG2-CG2 3.72Å; I343-V346 WeakPolarHBondContact O-CB 3.3Å; I343-V346 PolarHBondContact O-N 3.34Å; I343-H347 PolarHBondContact O-CD2 3.48Å
344	L	91.5	Very high	90.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.6	-44.4	-162.5	-169	57.1	0	0	0	112.4	F210 Y218 L233 N281 P342 V346 H347 L348 W443	F210-L344 HydrophobicContact CD2-CD1 4.13Å; F210-L344 HydrophobicContact CD2-CD2 4.43Å; F210-L344 HydrophobicContact CE2-CD1 3.89Å; Y218-L344 HydrophobicContact CE1-CD1 4.06Å; L233-L344 HydrophobicContact CD2-CD2 3.67Å; N281-L344 PolarHBondContact OD1-N 3.22Å; P342-L344 PolarHBondContact O-N 2.83Å; L344-V346 PolarHBondContact O-N 2.9Å; L344-V346 VanDerWaalsContact O-N 3.11Å; L344-H347 PolarHBondContact O-N 3.14Å; L344-L348 HydrophobicContact CG-CD1 4.02Å; L344-L348 HydrophobicContact CG-CG 4.14Å; L344-L348 WeakPolarHBondContact O-CG 3.39Å; L344-L348 PolarHBondContact O-N 3.34Å; L344-W443 HydrophobicContact CB-CH2 3.91Å; L344-W443 HydrophobicContact CB-CZ2 4.19Å; L344-W443 HydrophobicContact CD2-CH2 4.25Å; L344-W443 HydrophobicContact CG-CH2 4.37Å
345	G	87.8	Confident	90.7	Very high	8 Å²	8	34.2 Å²	34.2	8%	0.082	17%	0.174	C	C	.	.	H	α-helix	trans	-55.7	-26.4	175.8	0	0	0	0	0	115.6	I343 K349	I343-G345 VanDerWaalsContact C-N 3.35Å; I343-G345 PolarHBondContact O-N 3.39Å; G345-K349 VanDerWaalsContact O-CB 3.31Å; G345-K349 WeakPolarHBondContact O-CB 3.47Å; G345-K349 PolarHBondContact O-N 2.91Å; G345-K349 VanDerWaalsContact O-N 3.13Å
346	V	89.1	Confident	90.5	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.024	18%	0.181	C	C	.	.	H	α-helix	trans	-72	-40.8	177.2	178	0	0	0	0	110.9	Y326 Y329 I343 L344 D350	Y326-V346 HydrophobicContact CD1-CG2 4.28Å; Y326-V346 HydrophobicContact CD2-CB 4.49Å; Y326-V346 HydrophobicContact CD2-CG1 3.94Å; Y326-V346 HydrophobicContact CD2-CG2 3.77Å; Y326-V346 HydrophobicContact CE1-CG2 4.36Å; Y326-V346 HydrophobicContact CE2-CG2 3.85Å; Y326-V346 HydrophobicContact CG-CG1 4.3Å; Y326-V346 HydrophobicContact CG-CG2 4Å; Y329-V346 HydrophobicContact CD1-CG1 4.22Å; Y329-V346 HydrophobicContact CE1-CB 4.1Å; Y329-V346 HydrophobicContact CE1-CG1 3.87Å; Y329-V346 HydrophobicContact CE1-CG2 4.31Å; I343-V346 HydrophobicContact CB-CB 4.39Å; I343-V346 HydrophobicContact CB-CG2 3.87Å; I343-V346 HydrophobicContact CG2-CG2 3.72Å; I343-V346 WeakPolarHBondContact O-CB 3.3Å; I343-V346 PolarHBondContact O-N 3.34Å; L344-V346 PolarHBondContact O-N 2.9Å; L344-V346 VanDerWaalsContact O-N 3.11Å; V346-D350 VanDerWaalsContact O-CG 3.31Å; V346-D350 PolarHBondContact O-N 3.5Å; V346-D350 VanDerWaalsContact O-OD2 3.08Å
347	H	90.9	Very high	90.2	Very high	28 Å²	28	35.4 Å²	35.4	13%	0.13	18%	0.18	C	C	.	.	H	α-helix	trans	-78.2	-38.4	178	-61.2	-89	0	0	0	111.7	Y333 I343 L344 K349 D350 L351 L382	Y333-H347 AromaticContact CD1-NE2 3.58Å; Y333-H347 AromaticContact CE1-NE2 3.32Å; Y333-H347 VanDerWaalsContact CE1-NE2 3.32Å; Y333-H347 WeakPolarHBondContact CE1-NE2 3.35Å; I343-H347 PolarHBondContact O-CD2 3.48Å; L344-H347 PolarHBondContact O-N 3.14Å; H347-K349 VanDerWaalsContact C-N 3.27Å; H347-K349 PolarHBondContact O-N 3.09Å; H347-D350 WeakPolarHBondContact O-CB 3.18Å; H347-D350 PolarHBondContact O-N 2.76Å; H347-L351 WeakPolarHBondContact O-CG 3.39Å; H347-L351 PolarHBondContact O-N 3.29Å; H347-L382 HydrophobicContact CB-CD1 4.26Å; H347-L382 HydrophobicContact CB-CD2 4.33Å
348	L	90.3	Very high	90.2	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-56.3	-41.6	172.2	-71.9	179.3	0	0	0	112	Y218 Y221 L233 L344 L351 I352 W443	Y218-L348 HydrophobicContact CD1-CD2 3.65Å; Y218-L348 HydrophobicContact CE1-CD2 3.96Å; Y221-L348 HydrophobicContact CD1-CB 4.3Å; Y221-L348 HydrophobicContact CD1-CD1 4.37Å; Y221-L348 HydrophobicContact CD1-CD2 3.87Å; Y221-L348 HydrophobicContact CD1-CG 4.41Å; Y221-L348 HydrophobicContact CE1-CB 3.74Å; Y221-L348 HydrophobicContact CE1-CD1 4.09Å; Y221-L348 HydrophobicContact CE1-CD2 4.17Å; Y221-L348 HydrophobicContact CE1-CG 4.23Å; L233-L348 HydrophobicContact CD1-CD2 4.46Å; L233-L348 HydrophobicContact CD2-CD1 4.3Å; L344-L348 HydrophobicContact CG-CD1 4.02Å; L344-L348 HydrophobicContact CG-CG 4.14Å; L344-L348 WeakPolarHBondContact O-CG 3.39Å; L344-L348 PolarHBondContact O-N 3.34Å; L348-L351 PolarHBondContact O-N 3.18Å; L348-I352 PolarHBondContact O-N 3.33Å; L348-W443 HydrophobicContact CD1-CE3 3.94Å; L348-W443 HydrophobicContact CD1-CZ3 3.69Å
349	K	87.4	Confident	90.2	Very high	73 Å²	73	27.1 Å²	27.1	32%	0.317	14%	0.143	S	C	.	.	H	α-helix	trans	-62.8	-38.8	174	-177.6	-168.2	172.2	-164.7	0	112.5	C29 N325 G345 H347 S353	C29-K349 VanDerWaalsContact SG-CE 3.54Å; C29-K349 PolarHBondContact SG-NZ 3.14Å; N325-K349 PolarHBondContact OD1-NZ 3.03Å; G345-K349 VanDerWaalsContact O-CB 3.31Å; G345-K349 WeakPolarHBondContact O-CB 3.47Å; G345-K349 PolarHBondContact O-N 2.91Å; G345-K349 VanDerWaalsContact O-N 3.13Å; H347-K349 VanDerWaalsContact C-N 3.27Å; H347-K349 PolarHBondContact O-N 3.09Å; K349-S353 WeakPolarHBondContact O-CB 3.28Å; K349-S353 PolarHBondContact O-N 3.43Å; K349-S353 PolarHBondContact O-OG 3.32Å
350	D	88.7	Confident	90	Very high	31 Å²	31	28.4 Å²	28.4	17%	0.166	15%	0.151	C	C	.	.	H	α-helix	trans	-67.2	-40.6	176.4	-60	-42.3	0	0	0	111	R330 V346 H347 S353 L354	R330-D350 IonicContact CZ-OD1 2.98Å; R330-D350 IonicContact CZ-OD2 2.72Å; R330-D350 IonicContact NH1-OD1 3.63Å; R330-D350 IonicContact NH1-OD2 2.72Å; R330-D350 PolarHBondContact NH1-OD2 2.74Å; R330-D350 IonicContact NH2-OD1 2.98Å; R330-D350 PolarHBondContact NH2-OD1 3.46Å; R330-D350 IonicContact NH2-OD2 2.93Å; R330-D350 PolarHBondContact NH2-OD2 2.95Å; V346-D350 VanDerWaalsContact O-CG 3.31Å; V346-D350 PolarHBondContact O-N 3.5Å; V346-D350 VanDerWaalsContact O-OD2 3.08Å; H347-D350 WeakPolarHBondContact O-CB 3.18Å; H347-D350 PolarHBondContact O-N 2.76Å; D350-S353 PolarHBondContact O-N 2.83Å; D350-L354 WeakPolarHBondContact O-CB 3.34Å; D350-L354 PolarHBondContact O-N 3.07Å
351	L	90.3	Very high	89.8	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-61.3	-42.9	175.2	-67.2	174.5	0	0	0	112.3	V222 H347 L348 N355 L375 N378 I379	V222-L351 HydrophobicContact CG2-CB 3.66Å; V222-L351 HydrophobicContact CG2-CD1 4.38Å; H347-L351 WeakPolarHBondContact O-CG 3.39Å; H347-L351 PolarHBondContact O-N 3.29Å; L348-L351 PolarHBondContact O-N 3.18Å; L351-N355 VanDerWaalsContact O-CB 3.27Å; L351-N355 WeakPolarHBondContact O-CB 3.49Å; L351-N355 PolarHBondContact O-N 3.01Å; L351-L375 HydrophobicContact CD2-CD2 4.14Å; L351-N378 HydrophobicContact CD2-CB 3.57Å; L351-I379 HydrophobicContact CD1-CG1 4.09Å; L351-I379 HydrophobicContact CD2-CG1 4.03Å
352	I	88.3	Confident	89.3	Confident	35 Å²	35	35.1 Å²	35.1	18%	0.179	18%	0.181	C	C	.	.	H	α-helix	trans	-60.4	-51.9	171.4	-69.3	171.8	0	0	0	110.4	Y221 V222 L348 L354 N355 E356	Y221-I352 HydrophobicContact CD1-CD1 4.31Å; Y221-I352 HydrophobicContact CE1-CD1 3.5Å; Y221-I352 VanDerWaalsContact CE1-CD1 3.5Å; Y221-I352 HydrophobicContact CE1-CG1 4.2Å; V222-I352 HydrophobicContact CG1-CG1 4.3Å; V222-I352 HydrophobicContact CG2-CG1 4.3Å; L348-I352 PolarHBondContact O-N 3.33Å; I352-L354 PolarHBondContact O-N 3.13Å; I352-N355 PolarHBondContact O-N 3.45Å; I352-E356 HydrophobicContact CG2-CG 4.26Å; I352-E356 WeakPolarHBondContact O-CG 3.5Å; I352-E356 PolarHBondContact O-N 3.06Å
353	S	88.1	Confident	88.5	Confident	28 Å²	28	39 Å²	39	20%	0.196	20%	0.202	C	C	.	.	H	α-helix	trans	-59.4	-34.9	-177.1	-55	0	0	0	0	112.4	K349 D350 A357	K349-S353 WeakPolarHBondContact O-CB 3.28Å; K349-S353 PolarHBondContact O-N 3.43Å; K349-S353 PolarHBondContact O-OG 3.32Å; D350-S353 PolarHBondContact O-N 2.83Å; S353-A357 WeakPolarHBondContact O-CB 3.2Å; S353-A357 PolarHBondContact O-N 3.36Å; S353-A357 VanDerWaalsContact O-N 3.1Å
354	L	88.8	Confident	87.6	Confident	16 Å²	16	48 Å²	48	8%	0.084	24%	0.244	C	C	.	.	H	α-helix	trans	-73	-43.4	175.6	-170.1	177.3	0	0	0	111	D350 I352 E356 A357 L358 K371 H374 L375	D350-L354 WeakPolarHBondContact O-CB 3.34Å; D350-L354 PolarHBondContact O-N 3.07Å; I352-L354 PolarHBondContact O-N 3.13Å; L354-E356 VanDerWaalsContact C-N 3.33Å; L354-E356 PolarHBondContact O-N 3.31Å; L354-A357 PolarHBondContact O-N 3.48Å; L354-L358 HydrophobicContact CD2-CD1 4.12Å; L354-L358 PolarHBondContact O-N 3.42Å; L354-K371 HydrophobicContact CD2-CG 4.49Å; L354-H374 HydrophobicContact CD1-CB 3.92Å; L354-H374 HydrophobicContact CD2-CB 4.22Å; L354-H374 HydrophobicContact CG-CB 4.38Å; L354-L375 HydrophobicContact CD1-CD2 4.31Å; L354-L375 HydrophobicContact CD2-CD2 3.83Å; L354-L375 HydrophobicContact CD2-CG 3.73Å
355	N	89.3	Confident	87	Confident	32 Å²	32	55.7 Å²	55.7	17%	0.171	28%	0.28	C	S	.	.	H	α-helix	trans	-63.7	-36.1	177.5	-172.3	62.9	0	0	0	113	W88 V222 L351 I352 K371	W88-N355 PolarHBondContact NE1-OD1 3.21Å; V222-N355 HydrophobicContact CG1-CB 3.47Å; V222-N355 VanDerWaalsContact CG1-CB 3.47Å; L351-N355 VanDerWaalsContact O-CB 3.27Å; L351-N355 WeakPolarHBondContact O-CB 3.49Å; L351-N355 PolarHBondContact O-N 3.01Å; I352-N355 PolarHBondContact O-N 3.45Å; N355-K371 PolarHBondContact O-NZ 3.03Å; N355-K371 WeakPolarHBondContact OD1-CE 3.38Å; N355-K371 PolarHBondContact OD1-NZ 3.35Å
356	E	88.9	Confident	87	Confident	141 Å²	141	59.3 Å²	59.3	66%	0.659	29%	0.293	S	S	*	.	H	α-helix	trans	-75.9	-29.7	173.3	-68.6	178.6	169.3	0	0	113.1	I352 L354	I352-E356 HydrophobicContact CG2-CG 4.26Å; I352-E356 WeakPolarHBondContact O-CG 3.5Å; I352-E356 PolarHBondContact O-N 3.06Å; L354-E356 VanDerWaalsContact C-N 3.33Å; L354-E356 PolarHBondContact O-N 3.31Å
357	A	88.2	Confident	87.1	Confident	13 Å²	13	59.4 Å²	59.4	11%	0.107	29%	0.294	C	S	.	.	H	α-helix	trans	-82.6	-16.7	-175.1	0	0	0	0	0	115	P32 I35 S353 L354	P32-A357 HydrophobicContact CB-CB 4.16Å; I35-A357 HydrophobicContact CB-CB 4.09Å; I35-A357 HydrophobicContact CD1-CB 4.19Å; I35-A357 HydrophobicContact CG2-CB 3.89Å; S353-A357 WeakPolarHBondContact O-CB 3.2Å; S353-A357 PolarHBondContact O-N 3.36Å; S353-A357 VanDerWaalsContact O-N 3.1Å; L354-A357 PolarHBondContact O-N 3.48Å
358	L	87.5	Confident	87.1	Confident	20 Å²	20	58.5 Å²	58.5	11%	0.105	29%	0.29	C	S	.	.	S	Bend	trans	-126.9	131.6	-179.3	-61.9	178.2	0	0	0	110.4	L39 L354 K371	L39-L358 HydrophobicContact CD1-CD1 4.09Å; L39-L358 HydrophobicContact CD1-CD2 4.49Å; L354-L358 HydrophobicContact CD2-CD1 4.12Å; L354-L358 PolarHBondContact O-N 3.42Å; L358-K371 HydrophobicContact CB-CB 3.96Å; L358-K371 HydrophobicContact CB-CD 4.02Å; L358-K371 HydrophobicContact CB-CG 3.88Å; L358-K371 HydrophobicContact CD1-CB 4.04Å; L358-K371 HydrophobicContact CD1-CG 4.31Å; L358-K371 VanDerWaalsContact O-CD 3.31Å; L358-K371 WeakPolarHBondContact O-CD 3.4Å; L358-K371 VanDerWaalsContact O-CE 3.24Å; L358-K371 WeakPolarHBondContact O-CE 3.35Å; L358-K371 PolarHBondContact O-NZ 2.64Å
359	P	89.3	Confident	87.1	Confident	80 Å²	80	59.2 Å²	59.2	52%	0.519	29%	0.294	S	S	.	.			trans	-73	149.5	173.7	33.3	-36.1	0	0	0	110.5	Y361 N368	P359-Y361 VanDerWaalsContact C-N 3.27Å; P359-Y361 WeakPolarHBondContact CB-O 3.42Å; P359-Y361 WeakPolarHBondContact CG-O 3.02Å; P359-Y361 PolarHBondContact O-N 2.95Å; P359-N368 VanDerWaalsContact O-CB 3.22Å; P359-N368 WeakPolarHBondContact O-CB 3.39Å; P359-N368 PolarHBondContact O-ND2 2.7Å
360	D	88.3	Confident	87.2	Confident	48 Å²	48	57.8 Å²	57.8	26%	0.257	29%	0.293	S	S	.	.	S	Bend	trans	-70.4	-25.2	178.4	-63.1	-73.6	0	0	0	113.2	V89 N368 K371	V89-D360 HydrophobicContact CG1-CB 4.35Å; V89-D360 HydrophobicContact CG2-CB 4.04Å; D360-N368 WeakPolarHBondContact O-CB 3.33Å; D360-N368 PolarHBondContact O-N 3.21Å; D360-K371 WeakPolarHBondContact OD1-CD 3.45Å; D360-K371 WeakPolarHBondContact OD1-CE 3.21Å; D360-K371 IonicContact OD1-NZ 2.85Å; D360-K371 PolarHBondContact OD1-NZ 2.89Å; D360-K371 IonicContact OD2-NZ 2.98Å; D360-K371 PolarHBondContact OD2-NZ 3.45Å
361	Y	88.6	Confident	87.3	Confident	95 Å²	95	56.4 Å²	56.4	37%	0.373	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	146.2	177.6	-64.3	-91.5	0	0	0	110.1	V89 P359 K366 I367	V89-Y361 HydrophobicContact CG1-CD2 4.38Å; V89-Y361 HydrophobicContact CG1-CE1 3.99Å; V89-Y361 HydrophobicContact CG1-CE2 3.58Å; V89-Y361 VanDerWaalsContact CG1-OH 3.28Å; V89-Y361 WeakPolarHBondContact CG1-OH 3.33Å; V89-Y361 PolarHBondContact O-OH 2.97Å; P359-Y361 VanDerWaalsContact C-N 3.27Å; P359-Y361 WeakPolarHBondContact CB-O 3.42Å; P359-Y361 WeakPolarHBondContact CG-O 3.02Å; P359-Y361 PolarHBondContact O-N 2.95Å; Y361-K366 CarbonylContact C-O 3.54Å; Y361-K366 VanDerWaalsContact CA-O 3.28Å; Y361-K366 WeakPolarHBondContact CA-O 3.4Å; Y361-I367 HydrophobicContact CE1-CG1 4.09Å
362	I	84	Confident	87.3	Confident	83 Å²	83	56.6 Å²	56.6	43%	0.426	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-43	175.9	-68.3	168.9	0	0	0	110.5	A50 K366 N368	A50-I362 HydrophobicContact CB-CD1 4.15Å; I362-K366 PolarHBondContact N-O 2.95Å; I362-N368 HydrophobicContact CD1-CB 4.08Å; I362-N368 HydrophobicContact CG1-CB 3.95Å
363	D	78.9	Confident	87.5	Confident	82 Å²	82	58.3 Å²	58.3	44%	0.439	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	161.5	163.7	-52.5	-47.5	0	0	0	107.2	E365 K366	D363-E365 PolarHBondContact O-N 3.45Å; D363-K366 HydrophobicContact CB-CB 4.27Å; D363-K366 HydrophobicContact CB-CD 4.43Å; D363-K366 HydrophobicContact CB-CG 4.32Å; D363-K366 PolarHBondContact O-N 2.87Å; D363-K366 VanDerWaalsContact OD2-CD 3.3Å; D363-K366 WeakPolarHBondContact OD2-CD 3.48Å; D363-K366 WeakPolarHBondContact OD2-CE 3.37Å; D363-K366 IonicContact OD2-NZ 2.67Å; D363-K366 PolarHBondContact OD2-NZ 3.2Å
364	E	74.6	Confident	87.6	Confident	189 Å²	189	59.7 Å²	59.7	88%	0.883	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43	-36.9	-175.5	-65.1	-77.4	122.1	0	0	115.2
365	E	80.2	Confident	87.8	Confident	163 Å²	163	58.9 Å²	58.9	76%	0.762	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-1.9	-178.9	-60.5	-172.6	143.8	0	0	114.8	D363	D363-E365 PolarHBondContact O-N 3.45Å
366	K	88.3	Confident	88	Confident	83 Å²	83	58.1 Å²	58.1	36%	0.361	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	110.6	-170.1	-64.5	-170	-158.6	140.4	0	113.2	A50 A51 Y361 I362 D363	A50-K366 HydrophobicContact CB-CB 4.34Å; A50-K366 HydrophobicContact CB-CD 4.41Å; A51-K366 CarbonylContact O-C 3.55Å; A51-K366 WeakPolarHBondContact O-CA 3.4Å; Y361-K366 CarbonylContact C-O 3.54Å; Y361-K366 VanDerWaalsContact CA-O 3.28Å; Y361-K366 WeakPolarHBondContact CA-O 3.4Å; I362-K366 PolarHBondContact N-O 2.95Å; D363-K366 HydrophobicContact CB-CB 4.27Å; D363-K366 HydrophobicContact CB-CD 4.43Å; D363-K366 HydrophobicContact CB-CG 4.32Å; D363-K366 PolarHBondContact O-N 2.87Å; D363-K366 VanDerWaalsContact OD2-CD 3.3Å; D363-K366 WeakPolarHBondContact OD2-CD 3.48Å; D363-K366 WeakPolarHBondContact OD2-CE 3.37Å; D363-K366 IonicContact OD2-NZ 2.67Å; D363-K366 PolarHBondContact OD2-NZ 3.2Å
367	I	89.9	Confident	88.1	Confident	7 Å²	7	53.7 Å²	53.7	4%	0.036	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	133.5	176.9	-56.9	176.5	0	0	0	110.4	A50 A51 L53 V89 V90 Y361 L369 L372	A50-I367 WeakPolarHBondContact CA-O 3.18Å; A51-I367 PolarHBondContact N-O 3.12Å; A51-I367 WeakPolarHBondContact O-CB 3.44Å; A51-I367 PolarHBondContact O-N 3.02Å; L53-I367 HydrophobicContact CB-CD1 4.22Å; V89-I367 HydrophobicContact CB-CG2 4.49Å; V89-I367 HydrophobicContact CG1-CD1 4.37Å; V89-I367 HydrophobicContact CG1-CG1 4.04Å; V89-I367 HydrophobicContact CG1-CG2 4.17Å; V89-I367 HydrophobicContact CG2-CG2 4.37Å; V90-I367 HydrophobicContact CG2-CD1 4.09Å; Y361-I367 HydrophobicContact CE1-CG1 4.09Å; I367-L369 HydrophobicContact CG2-CD2 4.33Å; I367-L369 PolarHBondContact O-N 2.85Å; I367-L369 VanDerWaalsContact O-N 3.09Å; I367-L372 HydrophobicContact CG2-CD1 3.72Å; I367-L372 HydrophobicContact CG2-CG 4.38Å
368	N	91.3	Very high	88.3	Confident	9 Å²	9	55.3 Å²	55.3	5%	0.048	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	89.3	176.3	-173	-12	0	0	0	111.3	P359 D360 I362 S370 K371 L372	P359-N368 VanDerWaalsContact O-CB 3.22Å; P359-N368 WeakPolarHBondContact O-CB 3.39Å; P359-N368 PolarHBondContact O-ND2 2.7Å; D360-N368 WeakPolarHBondContact O-CB 3.33Å; D360-N368 PolarHBondContact O-N 3.21Å; I362-N368 HydrophobicContact CD1-CB 4.08Å; I362-N368 HydrophobicContact CG1-CB 3.95Å; N368-S370 PolarHBondContact O-N 3.35Å; N368-S370 WeakPolarHBondContact OD1-CB 3.3Å; N368-S370 PolarHBondContact OD1-N 3.08Å; N368-K371 HydrophobicContact CB-CB 4.01Å; N368-K371 WeakPolarHBondContact O-CB 3.31Å; N368-K371 PolarHBondContact O-N 2.9Å; N368-K371 VanDerWaalsContact O-N 3.11Å; N368-K371 PolarHBondContact OD1-N 3.25Å; N368-L372 PolarHBondContact O-N 3.4Å
369	L	90	Very high	88.6	Confident	15 Å²	15	54.4 Å²	54.4	8%	0.079	27%	0.274	C	S	.	.	H	α-helix	trans	-63.3	-25.9	178.6	-57.9	-175.2	0	0	0	112.5	S49 A51 L56 I367 L372 Q373	S49-L369 WeakPolarHBondContact O-CB 3.07Å; S49-L369 PolarHBondContact O-N 2.72Å; A51-L369 HydrophobicContact CB-CD1 3.79Å; A51-L369 HydrophobicContact CB-CD2 4.36Å; A51-L369 HydrophobicContact CB-CG 4.23Å; L56-L369 HydrophobicContact CD1-CD2 3.9Å; L56-L369 HydrophobicContact CD2-CD2 4.02Å; I367-L369 HydrophobicContact CG2-CD2 4.33Å; I367-L369 PolarHBondContact O-N 2.85Å; I367-L369 VanDerWaalsContact O-N 3.09Å; L369-L372 HydrophobicContact CD2-CD1 4.39Å; L369-L372 PolarHBondContact O-N 3.46Å; L369-Q373 VanDerWaalsContact O-CB 3.25Å; L369-Q373 WeakPolarHBondContact O-CB 3.48Å; L369-Q373 PolarHBondContact O-N 3.03Å
370	S	89.5	Confident	88.8	Confident	43 Å²	43	52.9 Å²	52.9	30%	0.301	26%	0.262	S	S	.	.	H	α-helix	trans	-66.1	-42.6	173.3	-174.3	0	0	0	0	111.7	N368 Q373 H374	N368-S370 PolarHBondContact O-N 3.35Å; N368-S370 WeakPolarHBondContact OD1-CB 3.3Å; N368-S370 PolarHBondContact OD1-N 3.08Å; S370-Q373 PolarHBondContact O-N 3.35Å; S370-H374 PolarHBondContact O-N 2.91Å; S370-H374 VanDerWaalsContact O-N 3.13Å; S370-H374 PolarHBondContact O-ND1 3.38Å; S370-H374 PolarHBondContact OG-CE1 3.07Å; S370-H374 PolarHBondContact OG-ND1 3.46Å
371	K	90.8	Very high	88.9	Confident	2 Å²	2	55 Å²	55	1%	0.009	27%	0.273	C	S	.	.	H	α-helix	trans	-59.3	-49.3	173.2	-176.5	179.8	-173.8	171.4	0	111.1	L354 N355 L358 D360 N368 Q373 H374 L375	L354-K371 HydrophobicContact CD2-CG 4.49Å; N355-K371 PolarHBondContact O-NZ 3.03Å; N355-K371 WeakPolarHBondContact OD1-CE 3.38Å; N355-K371 PolarHBondContact OD1-NZ 3.35Å; L358-K371 HydrophobicContact CB-CB 3.96Å; L358-K371 HydrophobicContact CB-CD 4.02Å; L358-K371 HydrophobicContact CB-CG 3.88Å; L358-K371 HydrophobicContact CD1-CB 4.04Å; L358-K371 HydrophobicContact CD1-CG 4.31Å; L358-K371 VanDerWaalsContact O-CD 3.31Å; L358-K371 WeakPolarHBondContact O-CD 3.4Å; L358-K371 VanDerWaalsContact O-CE 3.24Å; L358-K371 WeakPolarHBondContact O-CE 3.35Å; L358-K371 PolarHBondContact O-NZ 2.64Å; D360-K371 WeakPolarHBondContact OD1-CD 3.45Å; D360-K371 WeakPolarHBondContact OD1-CE 3.21Å; D360-K371 IonicContact OD1-NZ 2.85Å; D360-K371 PolarHBondContact OD1-NZ 2.89Å; D360-K371 IonicContact OD2-NZ 2.98Å; D360-K371 PolarHBondContact OD2-NZ 3.45Å; N368-K371 HydrophobicContact CB-CB 4.01Å; N368-K371 WeakPolarHBondContact O-CB 3.31Å; N368-K371 PolarHBondContact O-N 2.9Å; N368-K371 VanDerWaalsContact O-N 3.11Å; N368-K371 PolarHBondContact OD1-N 3.25Å; K371-Q373 PolarHBondContact O-N 3.3Å; K371-H374 PolarHBondContact O-N 3.35Å; K371-L375 HydrophobicContact CG-CD1 3.98Å; K371-L375 WeakPolarHBondContact O-CG 3.42Å; K371-L375 PolarHBondContact O-N 3.29Å
372	L	91	Very high	89.1	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-60.8	-42.6	179.4	-62.1	-172.3	0	0	0	112.1	M81 M85 W88 V89 I367 N368 L369 H374 L375 Y376	M81-L372 HydrophobicContact SD-CB 4.49Å; M85-L372 HydrophobicContact CB-CD2 4.27Å; W88-L372 HydrophobicContact CB-CD2 4.26Å; V89-L372 HydrophobicContact CG2-CD2 3.9Å; I367-L372 HydrophobicContact CG2-CD1 3.72Å; I367-L372 HydrophobicContact CG2-CG 4.38Å; N368-L372 PolarHBondContact O-N 3.4Å; L369-L372 HydrophobicContact CD2-CD1 4.39Å; L369-L372 PolarHBondContact O-N 3.46Å; L372-H374 PolarHBondContact O-N 3.48Å; L372-L375 PolarHBondContact O-N 3.24Å; L372-Y376 WeakPolarHBondContact O-CA 3.48Å; L372-Y376 WeakPolarHBondContact O-CB 3.39Å; L372-Y376 PolarHBondContact O-N 3.49Å
373	Q	91.5	Very high	89.5	Confident	72 Å²	72	48.6 Å²	48.6	34%	0.336	25%	0.246	S	C	.	.	H	α-helix	trans	-64.5	-37.7	179.6	-178.7	61.4	85.3	0	0	113.2	M81 L369 S370 K371 S377	M81-Q373 VanDerWaalsContact SD-CA 3.59Å; M81-Q373 HydrophobicContact SD-CB 3.98Å; L369-Q373 VanDerWaalsContact O-CB 3.25Å; L369-Q373 WeakPolarHBondContact O-CB 3.48Å; L369-Q373 PolarHBondContact O-N 3.03Å; S370-Q373 PolarHBondContact O-N 3.35Å; K371-Q373 PolarHBondContact O-N 3.3Å; Q373-S377 PolarHBondContact O-N 2.91Å; Q373-S377 VanDerWaalsContact O-N 3.1Å
374	H	90.6	Very high	90.1	Very high	56 Å²	56	47.4 Å²	47.4	26%	0.259	25%	0.248	S	C	.	.	H	α-helix	trans	-75.1	-42.3	177.5	-67.4	105.8	0	0	0	112.2	L354 S370 K371 L372 Y376 S377 N378	L354-H374 HydrophobicContact CD1-CB 3.92Å; L354-H374 HydrophobicContact CD2-CB 4.22Å; L354-H374 HydrophobicContact CG-CB 4.38Å; S370-H374 PolarHBondContact O-N 2.91Å; S370-H374 VanDerWaalsContact O-N 3.13Å; S370-H374 PolarHBondContact O-ND1 3.38Å; S370-H374 PolarHBondContact OG-CE1 3.07Å; S370-H374 PolarHBondContact OG-ND1 3.46Å; K371-H374 PolarHBondContact O-N 3.35Å; L372-H374 PolarHBondContact O-N 3.48Å; H374-Y376 VanDerWaalsContact C-N 3.34Å; H374-S377 PolarHBondContact O-N 3.1Å; H374-N378 PolarHBondContact O-N 2.89Å; H374-N378 PolarHBondContact O-ND2 2.87Å
375	L	92.4	Very high	90.9	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.8	-46.2	171.4	-74.1	170.2	0	0	0	111.1	M85 W88 L351 L354 K371 L372 S377 N378 I379	M85-L375 HydrophobicContact CE-CB 3.55Å; M85-L375 HydrophobicContact CE-CD1 4.21Å; W88-L375 HydrophobicContact CD2-CD1 3.97Å; W88-L375 HydrophobicContact CG-CD1 4.24Å; W88-L375 HydrophobicContact CH2-CD2 4.25Å; W88-L375 HydrophobicContact CZ2-CD1 3.86Å; W88-L375 HydrophobicContact CZ2-CD2 3.85Å; W88-L375 HydrophobicContact CZ2-CG 4.46Å; L351-L375 HydrophobicContact CD2-CD2 4.14Å; L354-L375 HydrophobicContact CD1-CD2 4.31Å; L354-L375 HydrophobicContact CD2-CD2 3.83Å; L354-L375 HydrophobicContact CD2-CG 3.73Å; K371-L375 HydrophobicContact CG-CD1 3.98Å; K371-L375 WeakPolarHBondContact O-CG 3.42Å; K371-L375 PolarHBondContact O-N 3.29Å; L372-L375 PolarHBondContact O-N 3.24Å; L375-S377 PolarHBondContact O-N 2.98Å; L375-N378 PolarHBondContact O-N 2.6Å; L375-I379 WeakPolarHBondContact O-CG1 3.42Å; L375-I379 PolarHBondContact O-N 3.35Å
376	Y	93.8	Very high	91.4	Very high	15 Å²	15	33.3 Å²	33.3	6%	0.059	18%	0.182	C	C	.	.	H	α-helix	trans	-53.9	-51.4	177.3	172.3	-99.4	0	0	0	111.8	Q77 H80 M81 M84 M85 L372 H374 N378 I379 N380	Q77-Y376 HydrophobicContact CG-CE1 4.08Å; H80-Y376 AromaticContact ND1-CE2 3.57Å; M81-Y376 HydrophobicContact CB-CD1 4.34Å; M81-Y376 HydrophobicContact CB-CD2 3.78Å; M81-Y376 HydrophobicContact CB-CE2 4.07Å; M81-Y376 HydrophobicContact CB-CG 3.95Å; M81-Y376 HydrophobicContact CG-CD1 4.34Å; M81-Y376 HydrophobicContact CG-CD2 3.85Å; M81-Y376 HydrophobicContact CG-CG 3.71Å; M81-Y376 HydrophobicContact SD-CG 4.35Å; M84-Y376 HydrophobicContact CE-CD2 3.61Å; M84-Y376 HydrophobicContact CE-CE2 3.88Å; M85-Y376 HydrophobicContact CG-CD2 4.15Å; L372-Y376 WeakPolarHBondContact O-CA 3.48Å; L372-Y376 WeakPolarHBondContact O-CB 3.39Å; L372-Y376 PolarHBondContact O-N 3.49Å; H374-Y376 VanDerWaalsContact C-N 3.34Å; Y376-N378 PolarHBondContact O-N 3.28Å; Y376-I379 PolarHBondContact O-N 3.05Å; Y376-N380 HydrophobicContact CE1-CB 4.34Å; Y376-N380 HydrophobicContact CE2-CB 4.29Å; Y376-N380 WeakPolarHBondContact O-CB 3.32Å; Y376-N380 PolarHBondContact O-N 3.28Å; Y376-N380 PolarHBondContact OH-OD1 2.8Å
377	S	92.4	Very high	91.3	Very high	49 Å²	49	34.7 Å²	34.7	34%	0.343	20%	0.202	S	C	.	.	H	α-helix	trans	-58.3	-51.6	-179.2	-162	0	0	0	0	110.9	Q373 H374 L375 I379 N380 D381	Q373-S377 PolarHBondContact O-N 2.91Å; Q373-S377 VanDerWaalsContact O-N 3.1Å; H374-S377 PolarHBondContact O-N 3.1Å; L375-S377 PolarHBondContact O-N 2.98Å; S377-I379 VanDerWaalsContact C-N 3.33Å; S377-I379 PolarHBondContact O-N 3.25Å; S377-N380 PolarHBondContact O-N 3.4Å; S377-D381 VanDerWaalsContact O-CB 3.32Å; S377-D381 WeakPolarHBondContact O-CB 3.41Å; S377-D381 PolarHBondContact O-N 2.85Å; S377-D381 PolarHBondContact OG-OD2 2.84Å
378	N	92.3	Very high	91.2	Very high	47 Å²	47	36.1 Å²	36.1	25%	0.251	21%	0.212	S	C	.	.	H	α-helix	trans	-62.5	-37.6	-177.2	-75.1	-93.9	0	0	0	112.8	L351 H374 L375 Y376 L382	L351-N378 HydrophobicContact CD2-CB 3.57Å; H374-N378 PolarHBondContact O-N 2.89Å; H374-N378 PolarHBondContact O-ND2 2.87Å; L375-N378 PolarHBondContact O-N 2.6Å; Y376-N378 PolarHBondContact O-N 3.28Å; N378-L382 WeakPolarHBondContact O-CG 3.42Å; N378-L382 PolarHBondContact O-N 2.88Å
379	I	94	Very high	90.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-72.7	-43.9	175.9	-68.9	170.7	0	0	0	110.9	M84 M85 W88 F215 Y218 L351 L375 Y376 S377 D381 L382 L383	M84-I379 HydrophobicContact CE-CB 4.17Å; M84-I379 HydrophobicContact CE-CG2 3.67Å; M84-I379 HydrophobicContact SD-CG2 4.35Å; M85-I379 HydrophobicContact CE-CD1 4.15Å; M85-I379 HydrophobicContact SD-CD1 4.29Å; W88-I379 HydrophobicContact CH2-CD1 3.83Å; W88-I379 HydrophobicContact CZ3-CD1 3.56Å; F215-I379 HydrophobicContact CB-CG2 4.01Å; Y218-I379 HydrophobicContact CD2-CG1 4.5Å; Y218-I379 HydrophobicContact CD2-CG2 4.02Å; L351-I379 HydrophobicContact CD1-CG1 4.09Å; L351-I379 HydrophobicContact CD2-CG1 4.03Å; L375-I379 WeakPolarHBondContact O-CG1 3.42Å; L375-I379 PolarHBondContact O-N 3.35Å; Y376-I379 PolarHBondContact O-N 3.05Å; S377-I379 VanDerWaalsContact C-N 3.33Å; S377-I379 PolarHBondContact O-N 3.25Å; I379-D381 VanDerWaalsContact C-N 3.32Å; I379-D381 PolarHBondContact O-N 3.32Å; I379-L382 WeakPolarHBondContact O-CB 3.3Å; I379-L382 PolarHBondContact O-N 3.1Å; I379-L382 VanDerWaalsContact O-N 3.16Å; I379-L383 HydrophobicContact CG2-CD1 3.78Å; I379-L383 HydrophobicContact CG2-CG 4.24Å; I379-L383 WeakPolarHBondContact O-CG 3.46Å; I379-L383 PolarHBondContact O-N 2.77Å
380	N	92.6	Very high	90.7	Very high	48 Å²	48	44.1 Å²	44.1	26%	0.257	25%	0.248	S	C	.	.	H	α-helix	trans	-63.2	-38	178.7	-171.9	94.1	0	0	0	111.7	Y376 S377 L382 L383 A384	Y376-N380 HydrophobicContact CE1-CB 4.34Å; Y376-N380 HydrophobicContact CE2-CB 4.29Å; Y376-N380 WeakPolarHBondContact O-CB 3.32Å; Y376-N380 PolarHBondContact O-N 3.28Å; Y376-N380 PolarHBondContact OH-OD1 2.8Å; S377-N380 PolarHBondContact O-N 3.4Å; N380-L382 VanDerWaalsContact C-N 3.28Å; N380-L382 PolarHBondContact O-N 2.84Å; N380-L383 PolarHBondContact O-N 3.28Å; N380-A384 VanDerWaalsContact O-CB 3.31Å; N380-A384 WeakPolarHBondContact O-CB 3.31Å; N380-A384 PolarHBondContact O-N 2.94Å
381	D	91.3	Very high	90.6	Very high	92 Å²	92	46.7 Å²	46.7	49%	0.492	26%	0.264	S	S	.	.	H	α-helix	trans	-66.9	-26.8	176.1	-66.9	-30.3	0	0	0	112.7	S377 I379 I385	S377-D381 VanDerWaalsContact O-CB 3.32Å; S377-D381 WeakPolarHBondContact O-CB 3.41Å; S377-D381 PolarHBondContact O-N 2.85Å; S377-D381 PolarHBondContact OG-OD2 2.84Å; I379-D381 VanDerWaalsContact C-N 3.32Å; I379-D381 PolarHBondContact O-N 3.32Å; D381-I385 WeakPolarHBondContact O-CG1 3.12Å
382	L	92.9	Very high	90.3	Very high	3 Å²	3	47.5 Å²	47.5	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-76.8	-49.3	169.1	-68.7	171.3	0	0	0	111.1	F210 Y218 P342 H347 N378 I379 N380 A384 I385 H386	F210-L382 HydrophobicContact CE2-CD2 4.44Å; F210-L382 HydrophobicContact CZ-CB 4.46Å; F210-L382 HydrophobicContact CZ-CD2 4.43Å; Y218-L382 HydrophobicContact CE1-CD1 4.21Å; Y218-L382 HydrophobicContact CE2-CB 4.44Å; Y218-L382 HydrophobicContact CE2-CD1 4.33Å; P342-L382 HydrophobicContact CB-CD2 4.32Å; P342-L382 HydrophobicContact CG-CD2 3.86Å; H347-L382 HydrophobicContact CB-CD1 4.26Å; H347-L382 HydrophobicContact CB-CD2 4.33Å; N378-L382 WeakPolarHBondContact O-CG 3.42Å; N378-L382 PolarHBondContact O-N 2.88Å; I379-L382 WeakPolarHBondContact O-CB 3.3Å; I379-L382 PolarHBondContact O-N 3.1Å; I379-L382 VanDerWaalsContact O-N 3.16Å; N380-L382 VanDerWaalsContact C-N 3.28Å; N380-L382 PolarHBondContact O-N 2.84Å; L382-A384 VanDerWaalsContact C-N 3.29Å; L382-A384 PolarHBondContact O-N 2.8Å; L382-I385 VanDerWaalsContact O-CB 3.28Å; L382-I385 WeakPolarHBondContact O-CB 3.47Å; L382-I385 PolarHBondContact O-N 3.05Å; L382-I385 VanDerWaalsContact O-N 3.09Å; L382-H386 PolarHBondContact O-CD2 2.56Å
383	L	92	Very high	89.9	Confident	42 Å²	42	54.2 Å²	54.2	22%	0.22	30%	0.299	C	S	.	.	H	α-helix	trans	-63.1	-33.2	-178.1	-66.4	172.6	0	0	0	112.8	M84 F215 Y218 I379 N380 I385 H386	M84-L383 HydrophobicContact CE-CD1 4.5Å; M84-L383 HydrophobicContact SD-CD1 3.83Å; F215-L383 HydrophobicContact CB-CD1 4.17Å; Y218-L383 HydrophobicContact CE2-CD2 4.3Å; I379-L383 HydrophobicContact CG2-CD1 3.78Å; I379-L383 HydrophobicContact CG2-CG 4.24Å; I379-L383 WeakPolarHBondContact O-CG 3.46Å; I379-L383 PolarHBondContact O-N 2.77Å; N380-L383 PolarHBondContact O-N 3.28Å; L383-I385 PolarHBondContact O-N 2.93Å; L383-I385 VanDerWaalsContact O-N 3.13Å; L383-H386 VanDerWaalsContact O-CB 3.26Å; L383-H386 WeakPolarHBondContact O-CB 3.29Å; L383-H386 PolarHBondContact O-N 3.07Å
384	A	91.1	Very high	89.3	Confident	57 Å²	57	52 Å²	52	47%	0.471	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-58.4	-24.9	175.3	0	0	0	0	0	113.3	N380 L382 H386	N380-A384 VanDerWaalsContact O-CB 3.31Å; N380-A384 WeakPolarHBondContact O-CB 3.31Å; N380-A384 PolarHBondContact O-N 2.94Å; L382-A384 VanDerWaalsContact C-N 3.29Å; L382-A384 PolarHBondContact O-N 2.8Å; A384-H386 VanDerWaalsContact C-N 3.3Å
385	I	90.6	Very high	89.1	Confident	12 Å²	12	51.7 Å²	51.7	6%	0.062	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-73.6	-24.5	177.5	-55.5	167.5	0	0	0	111	F207 F210 Y333 K340 P342 D381 L382 L383 S387 C388	F207-I385 HydrophobicContact CE2-CG2 4.23Å; F210-I385 HydrophobicContact CE1-CB 3.94Å; F210-I385 HydrophobicContact CE1-CG2 3.84Å; F210-I385 HydrophobicContact CZ-CB 4.36Å; F210-I385 HydrophobicContact CZ-CD1 4.39Å; Y333-I385 WeakPolarHBondContact OH-CD1 3.36Å; K340-I385 VanDerWaalsContact O-CG2 3.25Å; K340-I385 WeakPolarHBondContact O-CG2 3.38Å; P342-I385 HydrophobicContact CG-CD1 4.27Å; D381-I385 WeakPolarHBondContact O-CG1 3.12Å; L382-I385 VanDerWaalsContact O-CB 3.28Å; L382-I385 WeakPolarHBondContact O-CB 3.47Å; L382-I385 PolarHBondContact O-N 3.05Å; L382-I385 VanDerWaalsContact O-N 3.09Å; L383-I385 PolarHBondContact O-N 2.93Å; L383-I385 VanDerWaalsContact O-N 3.13Å; I385-S387 PolarHBondContact O-N 3.28Å; I385-C388 VanDerWaalsContact O-CB 3.29Å; I385-C388 WeakPolarHBondContact O-CB 3.31Å; I385-C388 PolarHBondContact O-N 2.84Å
386	H	90.7	Very high	88.8	Confident	44 Å²	44	58.8 Å²	58.8	20%	0.204	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-65.9	-22.4	-179.4	-61.3	-151.3	0	0	0	111.7	F210 C211 V213 L382 L383 A384 C388	F210-H386 AromaticContact CE1-CD2 3.52Å; F210-H386 AromaticContact CE1-NE2 3.64Å; F210-H386 AromaticContact CZ-CD2 3.86Å; F210-H386 AromaticContact CZ-NE2 3.63Å; F210-H386 PolarHBondContact O-CE1 2.72Å; C211-H386 WeakPolarHBondContact CA-ND1 3.44Å; C211-H386 PolarHBondContact O-ND1 3.16Å; V213-H386 PolarHBondContact O-CE1 2.76Å; V213-H386 VanDerWaalsContact O-CE1 3.3Å; L382-H386 PolarHBondContact O-CD2 2.56Å; L383-H386 VanDerWaalsContact O-CB 3.26Å; L383-H386 WeakPolarHBondContact O-CB 3.29Å; L383-H386 PolarHBondContact O-N 3.07Å; A384-H386 VanDerWaalsContact C-N 3.3Å; H386-C388 VanDerWaalsContact C-N 3.31Å
387	S	86.8	Confident	88.4	Confident	111 Å²	111	58.6 Å²	58.6	78%	0.776	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-80.4	-4.8	174.4	-52.8	0	0	0	0	114	I385	I385-S387 PolarHBondContact O-N 3.28Å
388	C	87.3	Confident	88	Confident	38 Å²	38	56.3 Å²	56.3	26%	0.257	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-77.2	127.5	176.9	-64.8	0	0	0	0	111.4	F207 I385 H386	F207-C388 WeakPolarHBondContact CE1-O 3.19Å; F207-C388 HydrophobicContact CZ-CB 4.43Å; F207-C388 WeakPolarHBondContact CZ-O 3.33Å; I385-C388 VanDerWaalsContact O-CB 3.29Å; I385-C388 WeakPolarHBondContact O-CB 3.31Å; I385-C388 PolarHBondContact O-N 2.84Å; H386-C388 VanDerWaalsContact C-N 3.31Å
389	K	85.1	Confident	87.8	Confident	169 Å²	169	55 Å²	55	74%	0.735	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-77	132.8	167.4	-167.4	-175.5	174	-174.7	0	109.9
390	P	87.1	Confident	87.5	Confident	23 Å²	23	57 Å²	57	15%	0.149	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-59	146.8	168.9	-23.3	33.5	0	0	0	112.3	F207 F339 F392	F207-P390 HydrophobicContact CD1-CG 3.72Å; F207-P390 HydrophobicContact CE1-CG 3.92Å; F339-P390 HydrophobicContact CD2-CB 4.27Å; F339-P390 HydrophobicContact CD2-CG 4.35Å; F339-P390 HydrophobicContact CE2-CB 3.97Å; F339-P390 HydrophobicContact CE2-CG 3.89Å; F339-P390 HydrophobicContact CZ-CB 4.44Å; P390-F392 HydrophobicContact CB-CD2 4.07Å; P390-F392 HydrophobicContact CB-CE1 4.33Å; P390-F392 HydrophobicContact CB-CE2 3.64Å; P390-F392 HydrophobicContact CB-CZ 3.78Å; P390-F392 PolarHBondContact O-N 3.35Å
391	P	87.3	Confident	87.2	Confident	97 Å²	97	54.8 Å²	54.8	63%	0.63	30%	0.298	S	S	*	.	S	Bend	trans	-79.2	-1.3	-179.1	32.1	-35.3	0	0	0	114.4	L277 F339	L277-P391 HydrophobicContact CD2-CG 4.4Å; F339-P391 HydrophobicContact CD1-CG 4.42Å
392	F	84.4	Confident	87	Confident	18 Å²	18	50.4 Å²	50.4	8%	0.079	28%	0.275	C	S	.	.	S	Bend	trans	-125.1	157.9	-175.3	45.2	-104.6	0	0	0	111.5	E200 Y204 L277 F339 P390	E200-F392 HydrophobicContact CB-CB 4.13Å; E200-F392 HydrophobicContact CB-CD1 4.08Å; E200-F392 HydrophobicContact CB-CD2 4.07Å; E200-F392 HydrophobicContact CB-CG 3.82Å; E200-F392 VanDerWaalsContact CD-CB 3.48Å; E200-F392 HydrophobicContact CG-CB 3.87Å; E200-F392 HydrophobicContact CG-CD1 3.73Å; E200-F392 HydrophobicContact CG-CE1 4.47Å; E200-F392 HydrophobicContact CG-CG 3.78Å; E200-F392 WeakPolarHBondContact O-CE2 3.27Å; Y204-F392 HydrophobicContact CD2-CE2 4.47Å; L277-F392 HydrophobicContact CD1-CD1 4.37Å; L277-F392 HydrophobicContact CD1-CE1 4.09Å; L277-F392 HydrophobicContact CD2-CD1 3.89Å; L277-F392 HydrophobicContact CD2-CE1 3.99Å; F339-F392 HydrophobicContact CE1-CE1 4.09Å; F339-F392 HydrophobicContact CE1-CZ 4.22Å; F339-F392 HydrophobicContact CZ-CE1 4.34Å; F339-F392 HydrophobicContact CZ-CZ 4.01Å; P390-F392 HydrophobicContact CB-CD2 4.07Å; P390-F392 HydrophobicContact CB-CE1 4.33Å; P390-F392 HydrophobicContact CB-CE2 3.64Å; P390-F392 HydrophobicContact CB-CZ 3.78Å; P390-F392 PolarHBondContact O-N 3.35Å
393	E	81.3	Confident	86.7	Confident	145 Å²	145	51.9 Å²	51.9	68%	0.678	28%	0.284	S	S	*	.			trans	-107.5	121.3	172.8	-64.2	-162.3	155.3	0	0	110.5
394	A	80	Confident	86.4	Confident	25 Å²	25	49.9 Å²	49.9	21%	0.207	27%	0.273	C	S	.	.			trans	-86.8	129.3	-177.5	0	0	0	0	0	112.4	Y204 K396 L399	Y204-A394 HydrophobicContact CD1-CB 3.92Å; Y204-A394 HydrophobicContact CD2-CB 3.6Å; Y204-A394 HydrophobicContact CE1-CB 4.38Å; Y204-A394 HydrophobicContact CE2-CB 4.1Å; Y204-A394 HydrophobicContact CG-CB 3.49Å; Y204-A394 VanDerWaalsContact CG-CB 3.49Å; A394-K396 PolarHBondContact O-N 3.06Å; A394-L399 HydrophobicContact CB-CD1 3.83Å; A394-L399 HydrophobicContact CB-CD2 4.1Å; A394-L399 HydrophobicContact CB-CG 4.12Å
395	N	86.3	Confident	86.1	Confident	50 Å²	50	47.1 Å²	47.1	27%	0.267	25%	0.251	S	S	.	.			trans	-75.2	121.6	172.6	-173.7	-24.9	0	0	0	110.5	V186 H201 D397 L398 L399	V186-N395 WeakPolarHBondContact CG2-ND2 3.33Å; H201-N395 PolarHBondContact NE2-N 2.98Å; N395-D397 PolarHBondContact O-N 2.93Å; N395-D397 WeakPolarHBondContact OD1-CB 3.48Å; N395-D397 PolarHBondContact OD1-N 3.05Å; N395-L398 HydrophobicContact CB-CD1 4.42Å; N395-L398 PolarHBondContact O-N 3.46Å; N395-L399 WeakPolarHBondContact O-CG 3.49Å; N395-L399 PolarHBondContact O-N 3.28Å
396	K	85.8	Confident	85.8	Confident	150 Å²	150	47.3 Å²	47.3	65%	0.652	25%	0.252	S	S	*	.	H	α-helix	trans	-55	-35.7	-179.7	-62.5	-177.5	-178.6	179.1	0	113.2	A394 L399 H400	A394-K396 PolarHBondContact O-N 3.06Å; K396-L399 WeakPolarHBondContact O-CB 3.24Å; K396-L399 PolarHBondContact O-N 2.81Å; K396-H400 PolarHBondContact O-N 3.42Å; K396-H400 PolarHBondContact O-ND1 3.09Å; K396-H400 VanDerWaalsContact O-ND1 3.15Å
397	D	85.3	Confident	85.2	Confident	10 Å²	10	46.2 Å²	46.2	5%	0.053	25%	0.247	C	C	.	.	H	α-helix	trans	-68.7	-41.1	-176.9	-54.4	-9.1	0	0	0	111.1	L188 N395 H400 L401 K469 N470	L188-D397 HydrophobicContact CD2-CB 4.19Å; N395-D397 PolarHBondContact O-N 2.93Å; N395-D397 WeakPolarHBondContact OD1-CB 3.48Å; N395-D397 PolarHBondContact OD1-N 3.05Å; D397-H400 PolarHBondContact O-N 2.61Å; D397-L401 PolarHBondContact O-N 3.17Å; D397-K469 IonicContact OD1-NZ 3.18Å; D397-K469 PolarHBondContact OD1-NZ 3.15Å; D397-K469 IonicContact OD2-NZ 2.64Å; D397-K469 PolarHBondContact OD2-NZ 2.77Å; D397-N470 PolarHBondContact OD2-ND2 2.69Å
398	L	85.1	Confident	84.6	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-70.1	-33.5	172.6	-72.4	176.5	0	0	0	112.3	V186 L188 M193 N395 L401 L402	V186-L398 HydrophobicContact CG1-CD1 3.68Å; V186-L398 HydrophobicContact CG1-CD2 3.92Å; V186-L398 HydrophobicContact CG1-CG 3.55Å; L188-L398 HydrophobicContact CD2-CD2 3.95Å; M193-L398 HydrophobicContact CE-CD2 3.9Å; N395-L398 HydrophobicContact CB-CD1 4.42Å; N395-L398 PolarHBondContact O-N 3.46Å; L398-L401 PolarHBondContact O-N 3.05Å; L398-L402 WeakPolarHBondContact O-CB 3.37Å; L398-L402 WeakPolarHBondContact O-CG 3.1Å; L398-L402 PolarHBondContact O-N 3.26Å
399	L	87.3	Confident	84	Confident	19 Å²	19	41.5 Å²	41.5	10%	0.099	21%	0.208	C	C	.	.	H	α-helix	trans	-64.7	-41.5	173.5	-67.2	177.3	0	0	0	111.8	H201 Y204 L205 A394 N395 K396 T403	H201-L399 HydrophobicContact CB-CD2 4.21Å; Y204-L399 HydrophobicContact CD1-CD1 3.54Å; Y204-L399 HydrophobicContact CD1-CD2 3.64Å; Y204-L399 HydrophobicContact CD1-CG 4.26Å; Y204-L399 HydrophobicContact CE1-CD1 3.47Å; Y204-L399 VanDerWaalsContact CE1-CD1 3.47Å; Y204-L399 HydrophobicContact CE1-CD2 4.41Å; Y204-L399 HydrophobicContact CG-CD1 4.48Å; Y204-L399 HydrophobicContact CG-CD2 4.29Å; L205-L399 HydrophobicContact CD1-CD2 4.45Å; L205-L399 HydrophobicContact CD2-CD2 3.89Å; L205-L399 HydrophobicContact CG-CD2 3.81Å; A394-L399 HydrophobicContact CB-CD1 3.83Å; A394-L399 HydrophobicContact CB-CD2 4.1Å; A394-L399 HydrophobicContact CB-CG 4.12Å; N395-L399 WeakPolarHBondContact O-CG 3.49Å; N395-L399 PolarHBondContact O-N 3.28Å; K396-L399 WeakPolarHBondContact O-CB 3.24Å; K396-L399 PolarHBondContact O-N 2.81Å; L399-T403 VanDerWaalsContact O-CB 3.31Å; L399-T403 WeakPolarHBondContact O-CB 3.3Å; L399-T403 PolarHBondContact O-N 2.93Å; L399-T403 PolarHBondContact O-OG1 2.74Å
400	H	87.7	Confident	83.5	Confident	42 Å²	42	34.8 Å²	34.8	19%	0.194	18%	0.178	C	C	.	.	H	α-helix	trans	-63.7	-43.7	176.3	-58.9	147.2	0	0	0	111.3	K396 D397 T403 L404 Q462 S466	K396-H400 PolarHBondContact O-N 3.42Å; K396-H400 PolarHBondContact O-ND1 3.09Å; K396-H400 VanDerWaalsContact O-ND1 3.15Å; D397-H400 PolarHBondContact O-N 2.61Å; H400-T403 PolarHBondContact O-N 3.17Å; H400-L404 PolarHBondContact O-N 3.28Å; H400-L404 VanDerWaalsContact O-N 3.13Å; H400-Q462 HydrophobicContact CB-CB 4.18Å; H400-Q462 PolarHBondContact ND1-O 3.26Å; H400-Q462 PolarHBondContact NE2-NE2 3.35Å; H400-Q462 VanDerWaalsContact NE2-NE2 3.17Å; H400-S466 PolarHBondContact ND1-OG 2.77Å
401	L	86.3	Confident	83.3	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-58.2	-55.4	174.8	-175	148.4	0	0	0	111.9	L188 M193 D397 L398 T403 L404 S405 M463	L188-L401 HydrophobicContact CB-CD1 3.61Å; L188-L401 HydrophobicContact CD2-CD1 3.97Å; L188-L401 HydrophobicContact CG-CD1 4.27Å; L188-L401 WeakPolarHBondContact O-CD1 3.23Å; M193-L401 HydrophobicContact CE-CD2 4.22Å; D397-L401 PolarHBondContact O-N 3.17Å; L398-L401 PolarHBondContact O-N 3.05Å; L401-T403 VanDerWaalsContact C-N 3.32Å; L401-T403 PolarHBondContact O-N 2.66Å; L401-L404 PolarHBondContact O-N 3.46Å; L401-S405 PolarHBondContact O-N 3.15Å; L401-S405 PolarHBondContact O-OG 2.92Å; L401-S405 VanDerWaalsContact O-OG 3.07Å; L401-M463 HydrophobicContact CB-CE 4.09Å; L401-M463 HydrophobicContact CB-SD 3.85Å; L401-M463 HydrophobicContact CD1-CE 3.65Å; L401-M463 HydrophobicContact CD1-SD 4.35Å; L401-M463 HydrophobicContact CG-CE 3.73Å; L401-M463 HydrophobicContact CG-SD 4.19Å
402	L	86.9	Confident	83	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.5	-35.5	-179	-72.8	169.7	0	0	0	112.3	H201 L202 L205 W246 L398 S405 L406	H201-L402 HydrophobicContact CB-CD1 3.5Å; H201-L402 VanDerWaalsContact CB-CD1 3.5Å; L202-L402 HydrophobicContact CD2-CD1 4.48Å; L202-L402 HydrophobicContact CD2-CD2 4.43Å; L205-L402 HydrophobicContact CD1-CB 3.93Å; W246-L402 HydrophobicContact CH2-CD2 3.78Å; W246-L402 HydrophobicContact CZ2-CD2 4.08Å; W246-L402 HydrophobicContact CZ3-CD2 4.39Å; L398-L402 WeakPolarHBondContact O-CB 3.37Å; L398-L402 WeakPolarHBondContact O-CG 3.1Å; L398-L402 PolarHBondContact O-N 3.26Å; L402-S405 PolarHBondContact O-N 2.84Å; L402-L406 VanDerWaalsContact O-CB 3.3Å; L402-L406 WeakPolarHBondContact O-CB 3.26Å; L402-L406 WeakPolarHBondContact O-CD1 3.3Å; L402-L406 WeakPolarHBondContact O-CG 3.45Å; L402-L406 PolarHBondContact O-N 3.45Å
403	T	87.4	Confident	82.8	Confident	33 Å²	33	40.3 Å²	40.3	20%	0.202	20%	0.2	C	C	.	.	H	α-helix	trans	-59.2	-50.9	174.9	-55.5	0	0	0	0	110.1	L399 H400 L401 S405 L406 D407	L399-T403 VanDerWaalsContact O-CB 3.31Å; L399-T403 WeakPolarHBondContact O-CB 3.3Å; L399-T403 PolarHBondContact O-N 2.93Å; L399-T403 PolarHBondContact O-OG1 2.74Å; H400-T403 PolarHBondContact O-N 3.17Å; L401-T403 VanDerWaalsContact C-N 3.32Å; L401-T403 PolarHBondContact O-N 2.66Å; T403-S405 VanDerWaalsContact C-N 3.34Å; T403-S405 PolarHBondContact O-N 3.07Å; T403-L406 PolarHBondContact O-N 3.26Å; T403-L406 VanDerWaalsContact O-N 3.11Å; T403-D407 PolarHBondContact O-N 3.06Å
404	L	85.5	Confident	83	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.8	-34.4	179.3	-162.8	71	0	0	0	112.8	H400 L401 L406 H459 V460 M463 F491 F515 M519	H400-L404 PolarHBondContact O-N 3.28Å; H400-L404 VanDerWaalsContact O-N 3.13Å; L401-L404 PolarHBondContact O-N 3.46Å; L404-L406 VanDerWaalsContact C-N 3.26Å; L404-L406 PolarHBondContact O-N 3.13Å; L404-H459 HydrophobicContact CD1-CB 3.92Å; L404-V460 HydrophobicContact CD1-CG2 3.72Å; L404-V460 HydrophobicContact CD2-CG2 4.3Å; L404-M463 HydrophobicContact CD2-CB 3.81Å; L404-M463 HydrophobicContact CD2-CG 3.78Å; L404-F491 HydrophobicContact CB-CE1 4.04Å; L404-F491 HydrophobicContact CB-CZ 4.39Å; L404-F491 HydrophobicContact CD2-CE1 3.96Å; L404-F491 HydrophobicContact CD2-CZ 4.14Å; L404-F491 HydrophobicContact CG-CE1 3.94Å; L404-F491 HydrophobicContact CG-CZ 4.48Å; L404-F515 HydrophobicContact CD2-CB 4.3Å; L404-F515 HydrophobicContact CD2-CD1 3.7Å; L404-F515 HydrophobicContact CD2-CE1 4.21Å; L404-F515 HydrophobicContact CD2-CG 3.99Å; L404-M519 HydrophobicContact CD1-CE 4.17Å; L404-M519 HydrophobicContact CD1-CG 3.85Å; L404-M519 HydrophobicContact CD1-SD 3.99Å; L404-M519 HydrophobicContact CG-CG 4.34Å; L404-M519 HydrophobicContact CG-SD 4.05Å
405	S	84	Confident	83.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-74	-10.8	175.2	-56.7	0	0	0	0	114.3	L401 L402 T403 L408 F491	L401-S405 PolarHBondContact O-N 3.15Å; L401-S405 PolarHBondContact O-OG 2.92Å; L401-S405 VanDerWaalsContact O-OG 3.07Å; L402-S405 PolarHBondContact O-N 2.84Å; T403-S405 VanDerWaalsContact C-N 3.34Å; T403-S405 PolarHBondContact O-N 3.07Å; S405-L408 WeakPolarHBondContact O-CD1 3.19Å; S405-L408 WeakPolarHBondContact O-CG 3.32Å; S405-F491 VanDerWaalsContact OG-CE1 3.23Å; S405-F491 WeakPolarHBondContact OG-CE1 3.33Å; S405-F491 VanDerWaalsContact OG-CZ 3.3Å; S405-F491 WeakPolarHBondContact OG-CZ 3.43Å
406	L	84.9	Confident	83.3	Confident	15 Å²	15	36.8 Å²	36.8	8%	0.079	18%	0.176	C	C	.	.	H	α-helix	trans	-108.1	-17.1	179.3	-67	170.9	0	0	0	113.3	L202 L205 M239 V243 W246 L402 T403 L404 L408	L202-L406 HydrophobicContact CD2-CD1 3.79Å; L205-L406 HydrophobicContact CD1-CD1 4.11Å; M239-L406 HydrophobicContact CE-CD1 3.68Å; M239-L406 HydrophobicContact SD-CD1 3.87Å; V243-L406 HydrophobicContact CB-CD2 4.21Å; V243-L406 HydrophobicContact CG2-CD1 4.04Å; V243-L406 HydrophobicContact CG2-CD2 3.62Å; V243-L406 HydrophobicContact CG2-CG 4.5Å; W246-L406 HydrophobicContact CB-CD2 3.78Å; W246-L406 HydrophobicContact CD2-CD2 4.19Å; W246-L406 HydrophobicContact CE3-CD2 4.18Å; W246-L406 HydrophobicContact CG-CD2 4.06Å; L402-L406 VanDerWaalsContact O-CB 3.3Å; L402-L406 WeakPolarHBondContact O-CB 3.26Å; L402-L406 WeakPolarHBondContact O-CD1 3.3Å; L402-L406 WeakPolarHBondContact O-CG 3.45Å; L402-L406 PolarHBondContact O-N 3.45Å; T403-L406 PolarHBondContact O-N 3.26Å; T403-L406 VanDerWaalsContact O-N 3.11Å; L404-L406 VanDerWaalsContact C-N 3.26Å; L404-L406 PolarHBondContact O-N 3.13Å; L406-L408 PolarHBondContact O-N 3.2Å; L406-L408 VanDerWaalsContact O-N 3.1Å
407	D	78.4	Confident	83.2	Confident	21 Å²	21	34.4 Å²	34.4	11%	0.112	17%	0.167	C	C	.	.	S	Bend	trans	-67.6	3	169.7	-78.5	-20.6	0	0	0	113.7	T403 L451 H459 M519	T403-D407 PolarHBondContact O-N 3.06Å; D407-L451 HydrophobicContact CB-CD1 3.49Å; D407-L451 VanDerWaalsContact CB-CD1 3.49Å; D407-L451 WeakPolarHBondContact O-CD1 3.42Å; D407-H459 IonicContact OD2-CE1 2.65Å; D407-H459 IonicContact OD2-CG 2.75Å; D407-H459 IonicContact OD2-ND1 2.66Å; D407-H459 PolarHBondContact OD2-ND1 3.23Å; D407-M519 HydrophobicContact CB-CE 3.41Å; D407-M519 VanDerWaalsContact CB-CE 3.41Å
408	L	72.9	Confident	83.3	Confident	5 Å²	5	37.1 Å²	37.1	3%	0.026	18%	0.181	C	C	.	.			trans	-74.1	129.3	-179.2	-55.1	-178.4	0	0	0	111.3	S405 L406 P492 F493 M519	S405-L408 WeakPolarHBondContact O-CD1 3.19Å; S405-L408 WeakPolarHBondContact O-CG 3.32Å; L406-L408 PolarHBondContact O-N 3.2Å; L406-L408 VanDerWaalsContact O-N 3.1Å; L408-P492 HydrophobicContact CD1-CG 3.7Å; L408-F493 HydrophobicContact CD2-CE1 3.61Å; L408-F493 HydrophobicContact CD2-CE2 4.13Å; L408-F493 HydrophobicContact CD2-CZ 3.21Å; L408-M519 HydrophobicContact CD2-CE 4.13Å; L408-M519 HydrophobicContact CD2-SD 3.81Å
409	Y	74.3	Confident	83.5	Confident	45 Å²	45	37 Å²	37	18%	0.176	18%	0.18	C	C	.	.			trans	-120.4	124	173.9	176.8	-121.3	0	0	0	112	T448 P449 C522 K524	Y409-T448 WeakPolarHBondContact OH-CG2 3.29Å; Y409-P449 VanDerWaalsContact CD2-CD 3.45Å; Y409-P449 HydrophobicContact CD2-CG 3.8Å; Y409-P449 HydrophobicContact CG-CB 4.44Å; Y409-P449 HydrophobicContact CG-CG 4.03Å; Y409-C522 WeakPolarHBondContact CB-O 3.48Å; Y409-K524 HydrophobicContact CD1-CD 4.15Å; Y409-K524 HydrophobicContact CD1-CG 4.23Å; Y409-K524 HydrophobicContact CE1-CD 4.08Å
410	Y	75.7	Confident	83.5	Confident	29 Å²	29	40.2 Å²	40.2	11%	0.114	19%	0.192	C	C	.	.			trans	-127.9	152.9	168.7	-72.2	-105.9	0	0	0	108.5	Q245 L249 E414 I415 L418 P492 C522	Q245-Y410 PolarHBondContact NE2-O 2.88Å; Q245-Y410 VanDerWaalsContact OE1-N 3.07Å; Q245-Y410 PolarHBondContact OE1-O 3.45Å; L249-Y410 HydrophobicContact CD1-CD2 3.41Å; L249-Y410 VanDerWaalsContact CD1-CD2 3.41Å; L249-Y410 HydrophobicContact CD1-CE2 3.62Å; L249-Y410 HydrophobicContact CD1-CG 4.19Å; L249-Y410 HydrophobicContact CD2-CD1 4.2Å; L249-Y410 HydrophobicContact CD2-CD2 3.94Å; L249-Y410 HydrophobicContact CD2-CE1 4.21Å; L249-Y410 HydrophobicContact CD2-CE2 3.96Å; L249-Y410 HydrophobicContact CD2-CG 4.05Å; L249-Y410 HydrophobicContact CG-CD2 4.32Å; L249-Y410 HydrophobicContact CG-CE2 4.45Å; Y410-E414 WeakPolarHBondContact CA-OE2 3.24Å; Y410-E414 HydrophobicContact CD1-CB 4.25Å; Y410-I415 HydrophobicContact CG-CG1 4.48Å; Y410-L418 HydrophobicContact CD1-CD1 4.44Å; Y410-L418 HydrophobicContact CE1-CD1 4.28Å; Y410-P492 HydrophobicContact CE2-CG 4.14Å; Y410-C522 HydrophobicContact CE2-CB 4.27Å; Y410-C522 VanDerWaalsContact CZ-SG 3.53Å; Y410-C522 PolarHBondContact OH-SG 3.2Å; Y410-C522 VanDerWaalsContact OH-SG 3.41Å
411	T	81.8	Confident	83.5	Confident	40 Å²	40	44 Å²	44	25%	0.245	21%	0.214	C	C	.	.			trans	-80.2	154.5	167.9	52.4	0	0	0	0	110.3	D413 E414 I415	T411-D413 PolarHBondContact O-N 3.44Å; T411-E414 PolarHBondContact N-OE2 3.38Å; T411-E414 PolarHBondContact O-N 3.13Å; T411-E414 VanDerWaalsContact OG1-CG 3.29Å; T411-E414 WeakPolarHBondContact OG1-CG 3.47Å; T411-E414 PolarHBondContact OG1-OE2 3.4Å; T411-I415 WeakPolarHBondContact O-CG1 3.44Å; T411-I415 PolarHBondContact O-N 3.4Å; T411-I415 VanDerWaalsContact O-N 3.08Å
412	E	81.3	Confident	83.5	Confident	90 Å²	90	46.5 Å²	46.5	42%	0.421	22%	0.224	S	C	.	.	H	α-helix	trans	-55.4	-35	176.3	-60.2	-55.3	135.4	0	0	112.1	Q245 H292 I415 Y416	Q245-E412 PolarHBondContact NE2-OE1 2.89Å; H292-E412 IonicContact CE1-OE2 3.26Å; H292-E412 PolarHBondContact CE1-OE2 3.46Å; H292-E412 IonicContact ND1-OE2 2.84Å; H292-E412 IonicContact NE2-OE2 2.79Å; E412-I415 PolarHBondContact O-N 2.72Å; E412-Y416 VanDerWaalsContact O-CB 3.24Å; E412-Y416 WeakPolarHBondContact O-CB 3.26Å; E412-Y416 PolarHBondContact O-N 3.05Å
413	D	81.1	Confident	83.5	Confident	123 Å²	123	47.1 Å²	47.1	66%	0.658	23%	0.227	S	C	*	.	H	α-helix	trans	-63.8	-43.8	174.4	-54.2	-55.9	0	0	0	112.3	T411 Y416 E417	T411-D413 PolarHBondContact O-N 3.44Å; D413-Y416 PolarHBondContact O-N 3.15Å; D413-E417 WeakPolarHBondContact O-CB 3.28Å; D413-E417 WeakPolarHBondContact O-CG 3.02Å; D413-E417 PolarHBondContact O-N 2.67Å
414	E	84.1	Confident	83.4	Confident	76 Å²	76	49.9 Å²	49.9	36%	0.355	25%	0.245	S	C	.	.	H	α-helix	trans	-65.1	-41.3	177.9	-72.2	161.1	172.3	0	0	111.6	Y410 T411 Y416 E417 L418 K524	Y410-E414 WeakPolarHBondContact CA-OE2 3.24Å; Y410-E414 HydrophobicContact CD1-CB 4.25Å; T411-E414 PolarHBondContact N-OE2 3.38Å; T411-E414 PolarHBondContact O-N 3.13Å; T411-E414 VanDerWaalsContact OG1-CG 3.29Å; T411-E414 WeakPolarHBondContact OG1-CG 3.47Å; T411-E414 PolarHBondContact OG1-OE2 3.4Å; E414-Y416 VanDerWaalsContact C-N 3.32Å; E414-E417 PolarHBondContact O-N 2.81Å; E414-L418 WeakPolarHBondContact O-CB 3.44Å; E414-L418 VanDerWaalsContact O-CG 3.28Å; E414-L418 WeakPolarHBondContact O-CG 3.13Å; E414-L418 PolarHBondContact O-N 3.42Å; E414-K524 IonicContact OE1-NZ 2.85Å; E414-K524 PolarHBondContact OE1-NZ 3.44Å; E414-K524 IonicContact OE2-NZ 2.7Å; E414-K524 PolarHBondContact OE2-NZ 3.11Å
415	I	85.3	Confident	82.9	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-67.9	-35.8	176.2	-53.2	171.7	0	0	0	110.5	Q245 Q248 L249 L252 Y410 T411 E412 S419	Q245-I415 HydrophobicContact CB-CD1 4.28Å; Q245-I415 HydrophobicContact CG-CD1 3.85Å; Q248-I415 HydrophobicContact CB-CG2 4.03Å; L249-I415 HydrophobicContact CD2-CG1 4.39Å; L252-I415 HydrophobicContact CD1-CG2 3.65Å; L252-I415 WeakPolarHBondContact CD1-O 3.47Å; Y410-I415 HydrophobicContact CG-CG1 4.48Å; T411-I415 WeakPolarHBondContact O-CG1 3.44Å; T411-I415 PolarHBondContact O-N 3.4Å; T411-I415 VanDerWaalsContact O-N 3.08Å; E412-I415 PolarHBondContact O-N 2.72Å; I415-S419 PolarHBondContact O-N 2.86Å
416	Y	87.3	Confident	81.7	Confident	71 Å²	71	60.1 Å²	60.1	28%	0.278	29%	0.294	S	S	.	.	H	α-helix	trans	-69.5	-41.5	176.3	-173.9	-88.2	0	0	0	112.3	E412 D413 E414 S419 Y420	E412-Y416 VanDerWaalsContact O-CB 3.24Å; E412-Y416 WeakPolarHBondContact O-CB 3.26Å; E412-Y416 PolarHBondContact O-N 3.05Å; D413-Y416 PolarHBondContact O-N 3.15Å; E414-Y416 VanDerWaalsContact C-N 3.32Å; Y416-S419 WeakPolarHBondContact O-CB 3.45Å; Y416-S419 PolarHBondContact O-N 3.45Å; Y416-Y420 PolarHBondContact O-N 2.78Å
417	E	85.2	Confident	80.2	Confident	99 Å²	99	65.5 Å²	65.5	46%	0.463	33%	0.33	S	S	.	.	H	α-helix	trans	-66.3	-39.9	173.6	-73.3	-55	132	0	0	112	D413 E414 S419 Y420 N421	D413-E417 WeakPolarHBondContact O-CB 3.28Å; D413-E417 WeakPolarHBondContact O-CG 3.02Å; D413-E417 PolarHBondContact O-N 2.67Å; E414-E417 PolarHBondContact O-N 2.81Å; E417-S419 VanDerWaalsContact C-N 3.25Å; E417-S419 PolarHBondContact O-N 2.76Å; E417-Y420 PolarHBondContact O-N 3.26Å; E417-Y420 VanDerWaalsContact O-N 3.13Å; E417-N421 WeakPolarHBondContact O-CB 3.44Å; E417-N421 PolarHBondContact O-N 3.04Å; E417-N421 PolarHBondContact O-ND2 2.88Å
418	L	86.4	Confident	78.6	Confident	68 Å²	68	73.9 Å²	73.9	36%	0.356	37%	0.366	S	S	.	.	H	α-helix	trans	-56.9	-40.5	170.4	-76.2	171	0	0	0	111.6	L249 L252 Y410 E414 K422	L249-L418 HydrophobicContact CD2-CD1 4.03Å; L252-L418 HydrophobicContact CD1-CB 4.18Å; Y410-L418 HydrophobicContact CD1-CD1 4.44Å; Y410-L418 HydrophobicContact CE1-CD1 4.28Å; E414-L418 WeakPolarHBondContact O-CB 3.44Å; E414-L418 VanDerWaalsContact O-CG 3.28Å; E414-L418 WeakPolarHBondContact O-CG 3.13Å; E414-L418 PolarHBondContact O-N 3.42Å; L418-K422 WeakPolarHBondContact O-CG 3.36Å; L418-K422 PolarHBondContact O-N 3.5Å
419	S	90	Very high	77.5	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-66.6	-42.8	172.9	179.8	0	0	0	0	113.2	S294 R297 L298 I415 Y416 E417 N421 K422 E423	S294-S419 WeakPolarHBondContact O-CB 3.42Å; S294-S419 PolarHBondContact O-OG 3.35Å; R297-S419 VanDerWaalsContact CD-OG 3.26Å; R297-S419 WeakPolarHBondContact CD-OG 3.45Å; R297-S419 WeakPolarHBondContact CG-OG 3.47Å; R297-S419 VanDerWaalsContact NH1-C 3.28Å; R297-S419 PolarHBondContact NH1-O 3.15Å; R297-S419 PolarHBondContact NH1-OG 3.42Å; L298-S419 WeakPolarHBondContact CD2-OG 3.11Å; I415-S419 PolarHBondContact O-N 2.86Å; Y416-S419 WeakPolarHBondContact O-CB 3.45Å; Y416-S419 PolarHBondContact O-N 3.45Å; E417-S419 VanDerWaalsContact C-N 3.25Å; E417-S419 PolarHBondContact O-N 2.76Å; S419-N421 VanDerWaalsContact C-N 3.3Å; S419-N421 PolarHBondContact O-N 3.3Å; S419-K422 PolarHBondContact O-N 3.33Å; S419-K422 VanDerWaalsContact O-N 3.09Å; S419-E423 PolarHBondContact O-N 3.23Å
420	Y	87.1	Confident	75.7	Confident	85 Å²	85	85.8 Å²	85.8	33%	0.333	43%	0.426	S	S	.	.	H	α-helix	trans	-61.9	-39.3	179.2	-166.8	-95.3	0	0	0	111.9	Y416 E417 K422 E423 P424 K425	Y416-Y420 PolarHBondContact O-N 2.78Å; E417-Y420 PolarHBondContact O-N 3.26Å; E417-Y420 VanDerWaalsContact O-N 3.13Å; Y420-K422 VanDerWaalsContact C-N 3.3Å; Y420-K422 PolarHBondContact O-N 3.21Å; Y420-E423 CarbonylContact O-C 3.5Å; Y420-E423 VanDerWaalsContact O-C 3.3Å; Y420-P424 HydrophobicContact CE1-CB 4.33Å; Y420-P424 VanDerWaalsContact O-CA 3.25Å; Y420-P424 WeakPolarHBondContact O-CA 3.24Å; Y420-P424 VanDerWaalsContact O-N 3.13Å; Y420-K425 HydrophobicContact CE2-CB 4.02Å; Y420-K425 HydrophobicContact CE2-CD 4.26Å; Y420-K425 HydrophobicContact CE2-CG 3.89Å
421	N	86.8	Confident	74.1	Confident	123 Å²	123	90 Å²	90	66%	0.658	46%	0.456	S	S	*	.	H	α-helix	trans	-68.7	-23.2	174.9	-72.2	-57.8	0	0	0	113.8	E417 S419	E417-N421 WeakPolarHBondContact O-CB 3.44Å; E417-N421 PolarHBondContact O-N 3.04Å; E417-N421 PolarHBondContact O-ND2 2.88Å; S419-N421 VanDerWaalsContact C-N 3.3Å; S419-N421 PolarHBondContact O-N 3.3Å
422	K	87.3	Confident	72.1	Confident	54 Å²	54	94 Å²	94	24%	0.235	48%	0.48	C	S	.	.	H	α-helix	trans	-89.5	-31.7	-179.8	-67.3	-84.6	171.3	146.7	0	113.5	L252 S253 R254 R260 L418 S419 Y420	L252-K422 HydrophobicContact CD2-CG 4.46Å; L252-K422 WeakPolarHBondContact O-CD 3.27Å; L252-K422 WeakPolarHBondContact O-CE 3.29Å; L252-K422 PolarHBondContact O-NZ 2.9Å; S253-K422 PolarHBondContact O-NZ 3.06Å; R254-K422 PolarHBondContact O-NZ 3.3Å; R254-K422 VanDerWaalsContact O-NZ 3.12Å; R260-K422 PolarHBondContact NH2-O 3.23Å; L418-K422 WeakPolarHBondContact O-CG 3.36Å; L418-K422 PolarHBondContact O-N 3.5Å; S419-K422 PolarHBondContact O-N 3.33Å; S419-K422 VanDerWaalsContact O-N 3.09Å; Y420-K422 VanDerWaalsContact C-N 3.3Å; Y420-K422 PolarHBondContact O-N 3.21Å
423	E	87.7	Confident	70	Confident	13 Å²	13	93.3 Å²	93.3	6%	0.061	49%	0.49	C	S	.	.	S	Bend	trans	-144.3	92.9	170.6	-66.6	-177.8	-153.3	0	0	108.9	R260 R297 L298 K299 D300 T301 S419 Y420	R260-E423 IonicContact CZ-OE1 3.9Å; R260-E423 IonicContact NE-OE1 3.45Å; R260-E423 VanDerWaalsContact NH2-CG 3.28Å; R260-E423 IonicContact NH2-OE1 2.78Å; R260-E423 PolarHBondContact NH2-OE1 3.48Å; R297-E423 VanDerWaalsContact CZ-O 3.31Å; R297-E423 PolarHBondContact NH1-O 2.72Å; R297-E423 PolarHBondContact NH2-O 2.96Å; L298-E423 WeakPolarHBondContact CA-OE2 3.25Å; L298-E423 HydrophobicContact CD2-CB 3.86Å; L298-E423 HydrophobicContact CD2-CG 3.83Å; K299-E423 PolarHBondContact N-OE2 2.94Å; D300-E423 PolarHBondContact N-OE2 2.8Å; T301-E423 WeakPolarHBondContact CB-OE1 3.4Å; T301-E423 PolarHBondContact N-OE1 3.44Å; T301-E423 VanDerWaalsContact N-OE1 3.1Å; T301-E423 PolarHBondContact OG1-OE1 3.41Å; S419-E423 PolarHBondContact O-N 3.23Å; Y420-E423 CarbonylContact O-C 3.5Å; Y420-E423 VanDerWaalsContact O-C 3.3Å
424	P	84.6	Confident	68	Low	90 Å²	90	93.7 Å²	93.7	58%	0.584	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-70.6	155.1	-179.6	27.4	-34.4	0	0	0	111.9	Y420 N426	Y420-P424 HydrophobicContact CE1-CB 4.33Å; Y420-P424 VanDerWaalsContact O-CA 3.25Å; Y420-P424 WeakPolarHBondContact O-CA 3.24Å; Y420-P424 VanDerWaalsContact O-N 3.13Å; P424-N426 PolarHBondContact O-N 2.85Å
425	K	74.7	Confident	66	Low	122 Å²	122	95.8 Å²	95.8	53%	0.53	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-68.4	118.7	179.5	-79.4	-179.6	-178.8	176	0	110.9	Y420 P427	Y420-K425 HydrophobicContact CE2-CB 4.02Å; Y420-K425 HydrophobicContact CE2-CD 4.26Å; Y420-K425 HydrophobicContact CE2-CG 3.89Å; K425-P427 WeakPolarHBondContact O-CD 3.49Å
426	N	59.3	Low	63.9	Low	93 Å²	93	103.4 Å²	103.4	50%	0.497	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-62.5	118.2	168.3	-176.6	-22.8	0	0	0	109.7	P424 K428 I429	P424-N426 PolarHBondContact O-N 2.85Å; N426-K428 PolarHBondContact O-N 3.13Å; N426-K428 PolarHBondContact OD1-N 3.41Å; N426-I429 PolarHBondContact O-N 3.48Å
427	P	52.8	Low	62	Low	128 Å²	128	101.7 Å²	101.7	83%	0.831	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-6.5	-171.6	27.2	-35.7	0	0	0	114.3	K425	K425-P427 WeakPolarHBondContact O-CD 3.49Å
428	K	45.9	Very low	60.1	Low	197 Å²	197	100.2 Å²	100.2	86%	0.857	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-1.4	177.9	-62.8	-176.7	177.9	-179.7	0	114.2	N426	N426-K428 PolarHBondContact O-N 3.13Å; N426-K428 PolarHBondContact OD1-N 3.41Å
429	I	48.9	Very low	58.5	Low	125 Å²	125	97.2 Å²	97.2	64%	0.641	53%	0.532	S	S	*	.	S	Bend	trans	-113.9	120.9	-178.1	-57.9	176.6	0	0	0	109.7	N426	N426-I429 PolarHBondContact O-N 3.48Å
430	Q	37.3	Very low	56.7	Low	176 Å²	176	99.9 Å²	99.9	82%	0.822	55%	0.547	S	S	*	.			trans	-61.1	147.5	176.9	-75.6	-171.2	-4.6	0	0	111.8	V432	Q430-V432 PolarHBondContact O-N 2.84Å
431	P	40.8	Very low	55.1	Low	116 Å²	116	96.7 Å²	96.7	75%	0.753	54%	0.539	S	S	*	.			trans	-68	106.2	-178.3	27.9	-34.5	0	0	0	111.1	A433	P431-A433 PolarHBondContact O-N 3.26Å
432	V	41.3	Very low	53.5	Low	124 Å²	124	96.7 Å²	96.7	75%	0.752	54%	0.535	S	S	*	.			trans	-56.2	129.6	160.2	-178.7	0	0	0	0	107.7	Q430	Q430-V432 PolarHBondContact O-N 2.84Å
433	A	37	Very low	51.9	Low	76 Å²	76	96.5 Å²	96.5	63%	0.628	53%	0.533	S	S	*	.			trans	-55.3	146.3	-179.5	0	0	0	0	0	111	P431 V435	P431-A433 PolarHBondContact O-N 3.26Å; A433-V435 PolarHBondContact O-N 2.93Å
434	P	38.8	Very low	50.1	Low	132 Å²	132	96 Å²	96	86%	0.857	53%	0.531	S	S	*	.			trans	-61.5	102.7	-178.6	24.9	-34	0	0	0	110.5	K436	P434-K436 PolarHBondContact O-N 2.89Å
435	V	41.7	Very low	48.7	Very low	120 Å²	120	97 Å²	97	73%	0.727	54%	0.54	S	S	*	.			trans	-69.5	114.4	174.6	-177.8	0	0	0	0	106.9	A433	A433-V435 PolarHBondContact O-N 2.93Å
436	K	41.6	Very low	47.8	Very low	159 Å²	159	94.1 Å²	94.1	69%	0.691	55%	0.545	S	S	*	.			trans	-51.9	129.2	168.6	-87.7	-157.1	164.7	-142.4	0	108.3	P434 E442	P434-K436 PolarHBondContact O-N 2.89Å; K436-E442 IonicContact NZ-OE1 3.61Å; K436-E442 PolarHBondContact NZ-OE1 3.24Å
437	P	46.2	Very low	47.7	Very low	35 Å²	35	90.7 Å²	90.7	23%	0.227	53%	0.527	C	S	.	.			trans	-54	139	177.8	-25.6	33.6	0	0	0	110.6	V439 V440	P437-V439 WeakPolarHBondContact CB-O 3.43Å; P437-V439 PolarHBondContact O-N 3.49Å; P437-V440 HydrophobicContact CB-CG2 3.84Å; P437-V440 HydrophobicContact CG-CG2 4.17Å
438	P	46	Very low	48	Very low	69 Å²	69	87.7 Å²	87.7	45%	0.448	51%	0.506	S	S	.	.	S	Bend	trans	-67.2	-16.5	-178.6	28.4	-35.6	0	0	0	112.9	T317	T317-P438 HydrophobicContact CG2-CG 4.02Å
439	V	52.5	Low	48.6	Very low	5 Å²	5	79.8 Å²	79.8	3%	0.03	48%	0.475	C	S	.	.	S	Bend	trans	-132.8	123.5	177.3	-179.5	0	0	0	0	107.2	M284 T287 T317 L320 P437	M284-V439 HydrophobicContact CE-CG1 3.56Å; M284-V439 HydrophobicContact SD-CG1 3.51Å; M284-V439 VanDerWaalsContact SD-CG1 3.51Å; T287-V439 HydrophobicContact CG2-CG2 4.38Å; T317-V439 HydrophobicContact CG2-CG2 3.91Å; L320-V439 HydrophobicContact CB-CG1 4.36Å; L320-V439 HydrophobicContact CB-CG2 4.2Å; L320-V439 HydrophobicContact CD1-CG1 4.48Å; P437-V439 WeakPolarHBondContact CB-O 3.43Å; P437-V439 PolarHBondContact O-N 3.49Å
440	V	52.7	Low	49.2	Very low	55 Å²	55	83.9 Å²	83.9	33%	0.333	48%	0.483	S	S	.	.			trans	-137.4	130.1	175.5	-175.9	0	0	0	0	108.2	M284 P437 E442	M284-V440 VanDerWaalsContact CE-O 3.28Å; M284-V440 WeakPolarHBondContact CE-O 3.38Å; P437-V440 HydrophobicContact CB-CG2 3.84Å; P437-V440 HydrophobicContact CG-CG2 4.17Å; V440-E442 HydrophobicContact CB-CB 4.35Å; V440-E442 HydrophobicContact CG1-CB 3.85Å; V440-E442 HydrophobicContact CG1-CG 3.87Å; V440-E442 PolarHBondContact O-N 3.08Å
441	A	53.8	Low	50.6	Low	18 Å²	18	76.2 Å²	76.2	15%	0.149	45%	0.447	C	S	.	.			trans	-77.5	51.5	172.4	0	0	0	0	0	111.4	W443 G444	A441-W443 PolarHBondContact O-N 3.01Å; A441-G444 PolarHBondContact O-N 3.18Å
442	E	53.6	Low	51.9	Low	123 Å²	123	74.3 Å²	74.3	58%	0.575	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-63.7	-13.8	-164.1	-136.6	168.1	-148.7	0	0	113.4	K436 V440 G444	K436-E442 IonicContact NZ-OE1 3.61Å; K436-E442 PolarHBondContact NZ-OE1 3.24Å; V440-E442 HydrophobicContact CB-CB 4.35Å; V440-E442 HydrophobicContact CG1-CB 3.85Å; V440-E442 HydrophobicContact CG1-CG 3.87Å; V440-E442 PolarHBondContact O-N 3.08Å; E442-G444 PolarHBondContact O-N 2.85Å
443	W	52.8	Low	53.4	Low	51 Å²	51	69.9 Å²	69.9	19%	0.193	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-74.8	-16.4	-179.1	73.9	-81	0	0	0	115.1	V237 L344 L348 A441	V237-W443 HydrophobicContact CG2-CE3 3.92Å; V237-W443 HydrophobicContact CG2-CH2 3.76Å; V237-W443 HydrophobicContact CG2-CZ3 3.38Å; L344-W443 HydrophobicContact CB-CH2 3.91Å; L344-W443 HydrophobicContact CB-CZ2 4.19Å; L344-W443 HydrophobicContact CD2-CH2 4.25Å; L344-W443 HydrophobicContact CG-CH2 4.37Å; L348-W443 HydrophobicContact CD1-CE3 3.94Å; L348-W443 HydrophobicContact CD1-CZ3 3.69Å; A441-W443 PolarHBondContact O-N 3.01Å
444	G	50.9	Low	55.3	Low	3 Å²	3	72.4 Å²	72.4	3%	0.031	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-98	5	178.1	0	0	0	0	0	115.1	V237 N241 A441 E442 G446 V447	V237-G444 VanDerWaalsContact CG1-CA 3.46Å; N241-G444 PolarHBondContact ND2-O 2.92Å; A441-G444 PolarHBondContact O-N 3.18Å; E442-G444 PolarHBondContact O-N 2.85Å; G444-G446 PolarHBondContact O-N 3.19Å; G444-V447 PolarHBondContact O-N 3.02Å
445	S	54.6	Low	57.3	Low	111 Å²	111	67.9 Å²	67.9	78%	0.776	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	125.8	-172.3	-173.6	0	0	0	0	112.4
446	G	54.3	Low	59.2	Low	60 Å²	60	62.4 Å²	62.4	62%	0.619	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.1	1.8	178.3	0	0	0	0	0	115.8	G444 T448	G444-G446 PolarHBondContact O-N 3.19Å; G446-T448 PolarHBondContact O-N 2.99Å
447	V	58.4	Low	61.1	Low	21 Å²	21	57.5 Å²	57.5	13%	0.127	33%	0.331	C	S	.	.			trans	-81.8	106.1	162.8	-179.7	0	0	0	0	108.5	V227 E234 V237 M238 G444	V227-V447 HydrophobicContact CG2-CG2 3.37Å; E234-V447 HydrophobicContact CG-CG1 3.9Å; V237-V447 HydrophobicContact CB-CG2 4.38Å; V237-V447 HydrophobicContact CG1-CB 3.85Å; V237-V447 HydrophobicContact CG1-CG1 4.26Å; V237-V447 HydrophobicContact CG1-CG2 3.68Å; M238-V447 HydrophobicContact CG-CG1 3.94Å; G444-V447 PolarHBondContact O-N 3.02Å
448	T	60	Low	63.1	Low	65 Å²	65	61.8 Å²	61.8	40%	0.399	35%	0.346	S	S	.	.			trans	-88.4	127.7	167.7	53	0	0	0	0	109	Y409 G446 R450	Y409-T448 WeakPolarHBondContact OH-CG2 3.29Å; G446-T448 PolarHBondContact O-N 2.99Å; T448-R450 PolarHBondContact O-N 2.98Å
449	P	58.3	Low	65.1	Low	31 Å²	31	60.1 Å²	60.1	20%	0.201	33%	0.332	C	S	.	.			trans	-51.3	115.9	173.6	-31.5	39.3	0	0	0	111.6	M238 Y409	M238-P449 HydrophobicContact CE-CB 3.98Å; Y409-P449 VanDerWaalsContact CD2-CD 3.45Å; Y409-P449 HydrophobicContact CD2-CG 3.8Å; Y409-P449 HydrophobicContact CG-CB 4.44Å; Y409-P449 HydrophobicContact CG-CG 4.03Å
450	R	60.8	Low	66.7	Low	211 Å²	211	59.9 Å²	59.9	80%	0.796	33%	0.331	S	S	*	.			trans	-111.7	59.7	167.7	-70.7	-169.6	174	-142.2	-3.5	109.2	T448 D452	T448-R450 PolarHBondContact O-N 2.98Å; R450-D452 PolarHBondContact O-N 3.49Å
451	L	66.7	Low	68.4	Low	16 Å²	16	63.3 Å²	63.3	8%	0.084	34%	0.341	C	S	.	.			trans	-61.4	119.9	166.7	-71.4	165.3	0	0	0	108	M238 D407 T455 I456	M238-L451 HydrophobicContact CE-CD2 3.96Å; M238-L451 HydrophobicContact CE-CG 3.93Å; D407-L451 HydrophobicContact CB-CD1 3.49Å; D407-L451 VanDerWaalsContact CB-CD1 3.49Å; D407-L451 WeakPolarHBondContact O-CD1 3.42Å; L451-T455 HydrophobicContact CD2-CG2 3.96Å; L451-I456 HydrophobicContact CB-CD1 3.91Å; L451-I456 HydrophobicContact CB-CG1 3.88Å; L451-I456 HydrophobicContact CD1-CD1 4.49Å; L451-I456 HydrophobicContact CD1-CG1 4.44Å
452	D	68.1	Low	70.1	Confident	75 Å²	75	65.3 Å²	65.3	40%	0.401	35%	0.347	S	S	.	.			trans	-70.6	157.8	172.9	64.2	-82.4	0	0	0	110.7	R450 D454 T455 I456	R450-D452 PolarHBondContact O-N 3.49Å; D452-D454 PolarHBondContact O-N 2.82Å; D452-D454 WeakPolarHBondContact OD2-CB 3.45Å; D452-D454 PolarHBondContact OD2-N 3.3Å; D452-D454 VanDerWaalsContact OD2-N 3.14Å; D452-T455 VanDerWaalsContact CG-OG1 3.27Å; D452-T455 PolarHBondContact O-N 2.87Å; D452-T455 VanDerWaalsContact OD1-CB 3.24Å; D452-T455 WeakPolarHBondContact OD1-CB 3.41Å; D452-T455 PolarHBondContact OD1-OG1 3.01Å; D452-T455 WeakPolarHBondContact OD2-CB 3.35Å; D452-T455 PolarHBondContact OD2-N 3.34Å; D452-T455 PolarHBondContact OD2-OG1 3.11Å; D452-I456 PolarHBondContact O-N 3.22Å; D452-I456 VanDerWaalsContact O-N 3.15Å
453	S	72.7	Confident	71.8	Confident	32 Å²	32	59.4 Å²	59.4	22%	0.224	32%	0.32	C	S	.	.	H	α-helix	trans	-65.6	-26.2	-176	-168.8	0	0	0	0	113.2	S457 Y527	S453-S457 WeakPolarHBondContact O-CB 3.08Å; S453-S457 PolarHBondContact O-N 3.39Å; S453-Y527 WeakPolarHBondContact OG-CE2 3.32Å; S453-Y527 PolarHBondContact OG-OH 3.38Å; S453-Y527 VanDerWaalsContact OG-OH 3.14Å
454	D	76.8	Confident	73.5	Confident	129 Å²	129	57 Å²	57	69%	0.69	31%	0.311	S	S	*	.	H	α-helix	trans	-77.1	-38.7	-178.3	-60.5	-40	0	0	0	110.6	D452 S457 K458	D452-D454 PolarHBondContact O-N 2.82Å; D452-D454 WeakPolarHBondContact OD2-CB 3.45Å; D452-D454 PolarHBondContact OD2-N 3.3Å; D452-D454 VanDerWaalsContact OD2-N 3.14Å; D454-S457 PolarHBondContact O-N 3.06Å; D454-K458 WeakPolarHBondContact O-CB 3.38Å; D454-K458 PolarHBondContact O-N 3.23Å
455	T	82	Confident	75.3	Confident	37 Å²	37	59.8 Å²	59.8	23%	0.227	33%	0.325	C	S	.	.	H	α-helix	trans	-60.8	-46.9	170.1	-67.3	0	0	0	0	111.4	L451 D452 K458 H459	L451-T455 HydrophobicContact CD2-CG2 3.96Å; D452-T455 VanDerWaalsContact CG-OG1 3.27Å; D452-T455 PolarHBondContact O-N 2.87Å; D452-T455 VanDerWaalsContact OD1-CB 3.24Å; D452-T455 WeakPolarHBondContact OD1-CB 3.41Å; D452-T455 PolarHBondContact OD1-OG1 3.01Å; D452-T455 WeakPolarHBondContact OD2-CB 3.35Å; D452-T455 PolarHBondContact OD2-N 3.34Å; D452-T455 PolarHBondContact OD2-OG1 3.11Å; T455-K458 WeakPolarHBondContact O-CB 3.4Å; T455-K458 PolarHBondContact O-N 3.45Å; T455-H459 VanDerWaalsContact CG2-CE1 3.43Å; T455-H459 WeakPolarHBondContact CG2-CE1 3.29Å; T455-H459 VanDerWaalsContact O-CG 3.26Å; T455-H459 PolarHBondContact O-N 2.65Å
456	I	80.1	Confident	77	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-64	-48.9	176.3	-63.8	-176.6	0	0	0	110.8	L451 D452 K458 H459 V460 M519 A523 L525	L451-I456 HydrophobicContact CB-CD1 3.91Å; L451-I456 HydrophobicContact CB-CG1 3.88Å; L451-I456 HydrophobicContact CD1-CD1 4.49Å; L451-I456 HydrophobicContact CD1-CG1 4.44Å; D452-I456 PolarHBondContact O-N 3.22Å; D452-I456 VanDerWaalsContact O-N 3.15Å; I456-K458 PolarHBondContact O-N 2.76Å; I456-H459 PolarHBondContact O-N 2.87Å; I456-H459 VanDerWaalsContact O-N 3.12Å; I456-V460 HydrophobicContact CG2-CG2 4.13Å; I456-V460 WeakPolarHBondContact O-CB 3.49Å; I456-V460 WeakPolarHBondContact O-CG2 3.43Å; I456-V460 PolarHBondContact O-N 3.32Å; I456-M519 HydrophobicContact CG2-CB 3.64Å; I456-M519 HydrophobicContact CG2-CG 4.17Å; I456-A523 HydrophobicContact CD1-CB 3.61Å; I456-L525 HydrophobicContact CD1-CD1 3.58Å
457	S	82.1	Confident	78.5	Confident	57 Å²	57	51.8 Å²	51.8	40%	0.399	26%	0.26	S	S	.	.	H	α-helix	trans	-54.4	-42.5	177.3	178.5	0	0	0	0	112	S453 D454 K461	S453-S457 WeakPolarHBondContact O-CB 3.08Å; S453-S457 PolarHBondContact O-N 3.39Å; D454-S457 PolarHBondContact O-N 3.06Å; S457-K461 WeakPolarHBondContact O-CB 3.41Å; S457-K461 PolarHBondContact O-N 3.42Å
458	K	87.7	Confident	79.9	Confident	125 Å²	125	51.6 Å²	51.6	54%	0.543	26%	0.257	S	S	.	.	H	α-helix	trans	-64	-48	174.7	177	-174.6	178.3	-176.1	0	112.7	D454 T455 I456 K461 Q462	D454-K458 WeakPolarHBondContact O-CB 3.38Å; D454-K458 PolarHBondContact O-N 3.23Å; T455-K458 WeakPolarHBondContact O-CB 3.4Å; T455-K458 PolarHBondContact O-N 3.45Å; I456-K458 PolarHBondContact O-N 2.76Å; K458-K461 PolarHBondContact O-N 3.12Å; K458-Q462 WeakPolarHBondContact O-CB 3.49Å; K458-Q462 VanDerWaalsContact O-CG 3.29Å; K458-Q462 WeakPolarHBondContact O-CG 3.5Å; K458-Q462 PolarHBondContact O-N 3.42Å
459	H	88.1	Confident	81.1	Confident	33 Å²	33	54.8 Å²	54.8	15%	0.153	27%	0.266	C	S	.	.	H	α-helix	trans	-66	-40.3	179.2	-66.1	172.7	0	0	0	111.8	L404 D407 T455 I456 Q462 M463	L404-H459 HydrophobicContact CD1-CB 3.92Å; D407-H459 IonicContact OD2-CE1 2.65Å; D407-H459 IonicContact OD2-CG 2.75Å; D407-H459 IonicContact OD2-ND1 2.66Å; D407-H459 PolarHBondContact OD2-ND1 3.23Å; T455-H459 VanDerWaalsContact CG2-CE1 3.43Å; T455-H459 WeakPolarHBondContact CG2-CE1 3.29Å; T455-H459 VanDerWaalsContact O-CG 3.26Å; T455-H459 PolarHBondContact O-N 2.65Å; I456-H459 PolarHBondContact O-N 2.87Å; I456-H459 VanDerWaalsContact O-N 3.12Å; H459-Q462 PolarHBondContact O-N 2.94Å; H459-M463 WeakPolarHBondContact O-CB 3.49Å; H459-M463 PolarHBondContact O-N 2.89Å
460	V	86.7	Confident	82.4	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.006	27%	0.269	C	S	.	.	H	α-helix	trans	-59.9	-49.6	172.3	171.7	0	0	0	0	110.7	L404 I456 Q462 M463 V464 T512 F515 M516 M519	L404-V460 HydrophobicContact CD1-CG2 3.72Å; L404-V460 HydrophobicContact CD2-CG2 4.3Å; I456-V460 HydrophobicContact CG2-CG2 4.13Å; I456-V460 WeakPolarHBondContact O-CB 3.49Å; I456-V460 WeakPolarHBondContact O-CG2 3.43Å; I456-V460 PolarHBondContact O-N 3.32Å; V460-Q462 VanDerWaalsContact C-N 3.33Å; V460-Q462 PolarHBondContact O-N 3.36Å; V460-M463 WeakPolarHBondContact O-CB 3.35Å; V460-M463 PolarHBondContact O-N 2.93Å; V460-M463 VanDerWaalsContact O-N 3.12Å; V460-V464 HydrophobicContact CG1-CG2 4.18Å; V460-V464 VanDerWaalsContact O-CG2 3.29Å; V460-V464 WeakPolarHBondContact O-CG2 3.13Å; V460-V464 PolarHBondContact O-N 3.14Å; V460-T512 HydrophobicContact CG1-CG2 4.32Å; V460-F515 HydrophobicContact CB-CB 4.4Å; V460-F515 HydrophobicContact CG1-CB 3.64Å; V460-F515 HydrophobicContact CG2-CB 3.95Å; V460-M516 HydrophobicContact CB-SD 3.93Å; V460-M516 HydrophobicContact CG1-CG 4.07Å; V460-M516 HydrophobicContact CG1-SD 4.06Å; V460-M516 HydrophobicContact CG2-SD 3.8Å; V460-M519 HydrophobicContact CG2-CG 4.18Å
461	K	88.1	Confident	83.5	Confident	126 Å²	126	47.6 Å²	47.6	55%	0.548	24%	0.239	S	C	.	.	H	α-helix	trans	-57	-45.5	176.8	-179.9	174	178.6	175.2	0	112	S457 K458 M463 V464 D465	S457-K461 WeakPolarHBondContact O-CB 3.41Å; S457-K461 PolarHBondContact O-N 3.42Å; K458-K461 PolarHBondContact O-N 3.12Å; K461-M463 VanDerWaalsContact C-N 3.31Å; K461-M463 PolarHBondContact O-N 3.38Å; K461-V464 PolarHBondContact O-N 2.9Å; K461-D465 WeakPolarHBondContact O-CB 3.35Å; K461-D465 VanDerWaalsContact O-CG 3.31Å; K461-D465 PolarHBondContact O-N 2.94Å
462	Q	90.2	Very high	84.4	Confident	60 Å²	60	48 Å²	48	28%	0.28	24%	0.241	S	C	.	.	H	α-helix	trans	-63	-35.7	177.5	-72.5	179.8	-74.4	0	0	112.7	H400 K458 H459 V460 S466	H400-Q462 HydrophobicContact CB-CB 4.18Å; H400-Q462 PolarHBondContact ND1-O 3.26Å; H400-Q462 PolarHBondContact NE2-NE2 3.35Å; H400-Q462 VanDerWaalsContact NE2-NE2 3.17Å; K458-Q462 WeakPolarHBondContact O-CB 3.49Å; K458-Q462 VanDerWaalsContact O-CG 3.29Å; K458-Q462 WeakPolarHBondContact O-CG 3.5Å; K458-Q462 PolarHBondContact O-N 3.42Å; H459-Q462 PolarHBondContact O-N 2.94Å; V460-Q462 VanDerWaalsContact C-N 3.33Å; V460-Q462 PolarHBondContact O-N 3.36Å; Q462-S466 WeakPolarHBondContact O-CB 3.36Å; Q462-S466 PolarHBondContact O-N 2.84Å; Q462-S466 VanDerWaalsContact O-N 3.11Å; Q462-S466 PolarHBondContact O-OG 3.27Å
463	M	89.3	Confident	84.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-68.8	-47	173.4	178	53.6	169.3	0	0	111.7	L401 L404 H459 V460 K461 D465 S466 I467 I487 F491 F515	L401-M463 HydrophobicContact CB-CE 4.09Å; L401-M463 HydrophobicContact CB-SD 3.85Å; L401-M463 HydrophobicContact CD1-CE 3.65Å; L401-M463 HydrophobicContact CD1-SD 4.35Å; L401-M463 HydrophobicContact CG-CE 3.73Å; L401-M463 HydrophobicContact CG-SD 4.19Å; L404-M463 HydrophobicContact CD2-CB 3.81Å; L404-M463 HydrophobicContact CD2-CG 3.78Å; H459-M463 WeakPolarHBondContact O-CB 3.49Å; H459-M463 PolarHBondContact O-N 2.89Å; V460-M463 WeakPolarHBondContact O-CB 3.35Å; V460-M463 PolarHBondContact O-N 2.93Å; V460-M463 VanDerWaalsContact O-N 3.12Å; K461-M463 VanDerWaalsContact C-N 3.31Å; K461-M463 PolarHBondContact O-N 3.38Å; M463-D465 VanDerWaalsContact C-N 3.34Å; M463-D465 PolarHBondContact O-N 3.02Å; M463-S466 CarbonylContact O-C 3.6Å; M463-S466 WeakPolarHBondContact O-CA 3.25Å; M463-S466 WeakPolarHBondContact O-CB 3.37Å; M463-S466 PolarHBondContact O-N 3.12Å; M463-I467 HydrophobicContact CE-CD1 3.79Å; M463-I467 HydrophobicContact CE-CG1 4.02Å; M463-I467 HydrophobicContact CG-CD1 4.09Å; M463-I467 WeakPolarHBondContact O-CG1 3.46Å; M463-I467 PolarHBondContact O-N 3.39Å; M463-I467 HydrophobicContact SD-CD1 4.15Å; M463-I467 HydrophobicContact SD-CG1 4.1Å; M463-I487 HydrophobicContact CE-CG2 3.73Å; M463-F491 HydrophobicContact CE-CE2 3.85Å; M463-F491 HydrophobicContact CE-CZ 3.86Å; M463-F515 HydrophobicContact CE-CZ 4.07Å; M463-F515 HydrophobicContact CG-CE2 4.17Å; M463-F515 HydrophobicContact CG-CZ 4.27Å
464	V	88.8	Confident	85.4	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-57.6	-45.9	175.7	174.7	0	0	0	0	111.3	V460 K461 S466 I467 M468 R508 I511 T512 F515	V460-V464 HydrophobicContact CG1-CG2 4.18Å; V460-V464 VanDerWaalsContact O-CG2 3.29Å; V460-V464 WeakPolarHBondContact O-CG2 3.13Å; V460-V464 PolarHBondContact O-N 3.14Å; K461-V464 PolarHBondContact O-N 2.9Å; V464-S466 PolarHBondContact O-N 2.92Å; V464-I467 PolarHBondContact O-N 2.88Å; V464-M468 PolarHBondContact O-N 3.49Å; V464-R508 HydrophobicContact CG1-CG 3.66Å; V464-I511 HydrophobicContact CG2-CG2 4.13Å; V464-T512 WeakPolarHBondContact CG2-OG1 3.49Å; V464-F515 HydrophobicContact CG2-CD2 4.45Å
465	D	88.6	Confident	85.6	Confident	62 Å²	62	57.8 Å²	57.8	33%	0.332	28%	0.284	S	S	.	.	H	α-helix	trans	-61.3	-33.2	175.1	-73.4	-28.1	0	0	0	112.1	K461 M463 K469 R508	K461-D465 WeakPolarHBondContact O-CB 3.35Å; K461-D465 VanDerWaalsContact O-CG 3.31Å; K461-D465 PolarHBondContact O-N 2.94Å; M463-D465 VanDerWaalsContact C-N 3.34Å; M463-D465 PolarHBondContact O-N 3.02Å; D465-K469 WeakPolarHBondContact O-CB 3.41Å; D465-K469 PolarHBondContact O-N 3.35Å; D465-R508 IonicContact OD1-CZ 3.21Å; D465-R508 IonicContact OD1-NH1 3.64Å; D465-R508 PolarHBondContact OD1-NH1 2.95Å; D465-R508 IonicContact OD1-NH2 2.7Å; D465-R508 PolarHBondContact OD1-NH2 2.92Å
466	S	88.9	Confident	85.5	Confident	3 Å²	3	59.1 Å²	59.1	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-76.2	-36.4	177.8	-56.9	0	0	0	0	112.7	H400 Q462 M463 V464 N470	H400-S466 PolarHBondContact ND1-OG 2.77Å; Q462-S466 WeakPolarHBondContact O-CB 3.36Å; Q462-S466 PolarHBondContact O-N 2.84Å; Q462-S466 VanDerWaalsContact O-N 3.11Å; Q462-S466 PolarHBondContact O-OG 3.27Å; M463-S466 CarbonylContact O-C 3.6Å; M463-S466 WeakPolarHBondContact O-CA 3.25Å; M463-S466 WeakPolarHBondContact O-CB 3.37Å; M463-S466 PolarHBondContact O-N 3.12Å; V464-S466 PolarHBondContact O-N 2.92Å; S466-N470 PolarHBondContact O-N 3.38Å; S466-N470 PolarHBondContact O-ND2 3.12Å
467	I	86.6	Confident	85.6	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.8	-56.2	174.7	-67.8	166.7	0	0	0	109.6	L188 M463 V464 K469 N470 Y471 I479 I487 I511 F515	L188-I467 HydrophobicContact CD1-CG1 4.08Å; M463-I467 HydrophobicContact CE-CD1 3.79Å; M463-I467 HydrophobicContact CE-CG1 4.02Å; M463-I467 HydrophobicContact CG-CD1 4.09Å; M463-I467 WeakPolarHBondContact O-CG1 3.46Å; M463-I467 PolarHBondContact O-N 3.39Å; M463-I467 HydrophobicContact SD-CD1 4.15Å; M463-I467 HydrophobicContact SD-CG1 4.1Å; V464-I467 PolarHBondContact O-N 2.88Å; I467-K469 VanDerWaalsContact C-N 3.31Å; I467-K469 PolarHBondContact O-N 3Å; I467-N470 PolarHBondContact O-N 3.14Å; I467-Y471 PolarHBondContact O-N 2.84Å; I467-I479 HydrophobicContact CG2-CD1 3.63Å; I467-I487 HydrophobicContact CD1-CG2 4.14Å; I467-I487 HydrophobicContact CG1-CD1 4.42Å; I467-I487 HydrophobicContact CG1-CG2 4.36Å; I467-I487 HydrophobicContact CG2-CD1 4.14Å; I467-I511 HydrophobicContact CD1-CG2 4.07Å; I467-F515 HydrophobicContact CD1-CE2 3.53Å; I467-F515 HydrophobicContact CD1-CZ 3.98Å
468	M	87	Confident	85.8	Confident	16 Å²	16	59.5 Å²	59.5	8%	0.079	29%	0.29	C	S	.	.	H	α-helix	trans	-58.2	-44.9	-177.5	-68.2	-51.8	-172.7	0	0	111.6	V464 N470 Y471 D472 G477 I479 R508 I511	V464-M468 PolarHBondContact O-N 3.49Å; M468-N470 PolarHBondContact O-N 3.27Å; M468-Y471 PolarHBondContact O-N 2.91Å; M468-D472 HydrophobicContact CB-CB 4.28Å; M468-D472 WeakPolarHBondContact O-CB 3.35Å; M468-D472 PolarHBondContact O-N 3.49Å; M468-D472 HydrophobicContact SD-CB 3.87Å; M468-G477 VanDerWaalsContact CE-O 3.25Å; M468-G477 WeakPolarHBondContact CE-O 3.15Å; M468-I479 HydrophobicContact CE-CG2 4.44Å; M468-I479 HydrophobicContact SD-CG2 3.73Å; M468-R508 HydrophobicContact CE-CB 3.64Å; M468-R508 HydrophobicContact CE-CG 4.23Å; M468-I511 HydrophobicContact CE-CD1 3.63Å
469	K	86.7	Confident	85.8	Confident	132 Å²	132	53.8 Å²	53.8	57%	0.574	27%	0.265	S	S	*	.	H	α-helix	trans	-56.2	-19.3	175.8	174	169.3	167.4	-85.8	0	115.6	D397 D465 I467	D397-K469 IonicContact OD1-NZ 3.18Å; D397-K469 PolarHBondContact OD1-NZ 3.15Å; D397-K469 IonicContact OD2-NZ 2.64Å; D397-K469 PolarHBondContact OD2-NZ 2.77Å; D465-K469 WeakPolarHBondContact O-CB 3.41Å; D465-K469 PolarHBondContact O-N 3.35Å; I467-K469 VanDerWaalsContact C-N 3.31Å; I467-K469 PolarHBondContact O-N 3Å
470	N	84.1	Confident	85.7	Confident	52 Å²	52	54.6 Å²	54.6	28%	0.278	27%	0.274	S	S	.	.	H	α-helix	trans	-116.2	-20.2	-178.8	-71.2	-77.8	0	0	0	114.6	D397 S466 I467 M468	D397-N470 PolarHBondContact OD2-ND2 2.69Å; S466-N470 PolarHBondContact O-N 3.38Å; S466-N470 PolarHBondContact O-ND2 3.12Å; I467-N470 PolarHBondContact O-N 3.14Å; M468-N470 PolarHBondContact O-N 3.27Å
471	Y	84.6	Confident	85.5	Confident	40 Å²	40	56.3 Å²	56.3	16%	0.157	28%	0.283	C	S	.	.	H	α-helix	trans	-124.5	-21.2	-173.3	-67.9	-96.7	0	0	0	114.6	L188 I467 M468 L473 D483 I487	L188-Y471 HydrophobicContact CB-CE2 3.83Å; L188-Y471 HydrophobicContact CD1-CD2 4.46Å; L188-Y471 HydrophobicContact CD1-CE2 4.01Å; L188-Y471 HydrophobicContact CG-CE2 3.91Å; L188-Y471 PolarHBondContact N-OH 3.24Å; I467-Y471 PolarHBondContact O-N 2.84Å; M468-Y471 PolarHBondContact O-N 2.91Å; Y471-L473 PolarHBondContact O-N 3.41Å; Y471-L473 VanDerWaalsContact O-N 3.14Å; Y471-D483 HydrophobicContact CD1-CB 4.03Å; Y471-D483 HydrophobicContact CE1-CB 4.29Å; Y471-I487 HydrophobicContact CD1-CD1 4.31Å; Y471-I487 HydrophobicContact CD2-CD1 3.9Å; Y471-I487 HydrophobicContact CE1-CD1 4.11Å; Y471-I487 HydrophobicContact CE2-CD1 3.72Å; Y471-I487 HydrophobicContact CE2-CG1 4.48Å; Y471-I487 HydrophobicContact CG-CD1 4.2Å
472	D	84.4	Confident	85.2	Confident	24 Å²	24	56 Å²	56	13%	0.128	28%	0.284	C	S	.	.			trans	-80.2	92	168.3	-179.2	-2	0	0	0	108.3	M468 N474 Q475 D476 G477 I479	M468-D472 HydrophobicContact CB-CB 4.28Å; M468-D472 WeakPolarHBondContact O-CB 3.35Å; M468-D472 PolarHBondContact O-N 3.49Å; M468-D472 HydrophobicContact SD-CB 3.87Å; D472-N474 PolarHBondContact OD1-N 3.41Å; D472-Q475 WeakPolarHBondContact OD1-CA 3.17Å; D472-Q475 PolarHBondContact OD1-N 3.09Å; D472-Q475 WeakPolarHBondContact OD2-CA 3.43Å; D472-D476 PolarHBondContact OD1-N 2.82Å; D472-D476 PolarHBondContact OD2-N 3.43Å; D472-G477 WeakPolarHBondContact OD2-CA 3.28Å; D472-G477 PolarHBondContact OD2-N 3.41Å; D472-I479 HydrophobicContact CB-CG2 4.24Å
473	L	80.5	Confident	84.9	Confident	157 Å²	157	55.7 Å²	55.7	82%	0.822	28%	0.284	S	S	*	.	S	Bend	trans	-79.6	-20.3	-174.1	-64.2	177.5	0	0	0	113	Y471	Y471-L473 PolarHBondContact O-N 3.41Å; Y471-L473 VanDerWaalsContact O-N 3.14Å
474	N	82.3	Confident	84.8	Confident	107 Å²	107	55.9 Å²	55.9	57%	0.572	29%	0.285	S	S	*	.	S	Bend	trans	-112.6	-5.4	-173.3	50.1	-57.9	0	0	0	113.7	D472 D476	D472-N474 PolarHBondContact OD1-N 3.41Å; N474-D476 VanDerWaalsContact C-N 3.34Å; N474-D476 WeakPolarHBondContact ND2-CB 3.48Å; N474-D476 PolarHBondContact ND2-OD1 3.15Å; N474-D476 PolarHBondContact ND2-OD2 3.11Å
475	Q	80.3	Confident	84.5	Confident	177 Å²	177	61.5 Å²	61.5	83%	0.827	31%	0.311	S	S	*	.	S	Bend	trans	60.8	37.4	-179.5	-57.6	-179	12.4	0	0	113.1	D472	D472-Q475 WeakPolarHBondContact OD1-CA 3.17Å; D472-Q475 PolarHBondContact OD1-N 3.09Å; D472-Q475 WeakPolarHBondContact OD2-CA 3.43Å
476	D	81.6	Confident	84.2	Confident	65 Å²	65	61.6 Å²	61.6	35%	0.348	31%	0.309	S	S	.	.	S	Bend	trans	-97	-4.8	177.4	83.1	-14.7	0	0	0	114.1	D472 N474 Y478 R502	D472-D476 PolarHBondContact OD1-N 2.82Å; D472-D476 PolarHBondContact OD2-N 3.43Å; N474-D476 VanDerWaalsContact C-N 3.34Å; N474-D476 WeakPolarHBondContact ND2-CB 3.48Å; N474-D476 PolarHBondContact ND2-OD1 3.15Å; N474-D476 PolarHBondContact ND2-OD2 3.11Å; D476-Y478 WeakPolarHBondContact O-CD2 3.48Å; D476-Y478 WeakPolarHBondContact OD1-CB 3.49Å; D476-Y478 PolarHBondContact OD1-N 3.17Å; D476-R502 IonicContact OD2-NH1 3.8Å
477	G	82.1	Confident	84	Confident	23 Å²	23	61.5 Å²	61.5	24%	0.237	31%	0.308	C	S	.	.	S	Bend	trans	87.6	6.4	-179.6	0	0	0	0	0	115.1	M468 D472 R508	M468-G477 VanDerWaalsContact CE-O 3.25Å; M468-G477 WeakPolarHBondContact CE-O 3.15Å; D472-G477 WeakPolarHBondContact OD2-CA 3.28Å; D472-G477 PolarHBondContact OD2-N 3.41Å; G477-R508 PolarHBondContact O-N 3.5Å
478	Y	85.1	Confident	83.7	Confident	46 Å²	46	62 Å²	62	18%	0.18	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	157.1	178	-61.7	-99.4	0	0	0	111.8	D476 R502 Q505 I506	D476-Y478 WeakPolarHBondContact O-CD2 3.48Å; D476-Y478 WeakPolarHBondContact OD1-CB 3.49Å; D476-Y478 PolarHBondContact OD1-N 3.17Å; Y478-R502 HydrophobicContact CE1-CG 4.48Å; Y478-R502 VanDerWaalsContact CZ-CZ 3.41Å; Y478-R502 PolarHBondContact OH-NH2 2.9Å; Y478-Q505 HydrophobicContact CD1-CB 4.18Å; Y478-I506 WeakPolarHBondContact CA-O 3.33Å
479	I	86.9	Confident	83.3	Confident	5 Å²	5	63 Å²	63	3%	0.026	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	164.6	167	65.6	179	0	0	0	110.9	I467 M468 D472 L481 F484 Q505 I506 I511	I467-I479 HydrophobicContact CG2-CD1 3.63Å; M468-I479 HydrophobicContact CE-CG2 4.44Å; M468-I479 HydrophobicContact SD-CG2 3.73Å; D472-I479 HydrophobicContact CB-CG2 4.24Å; I479-L481 PolarHBondContact O-N 2.92Å; I479-F484 HydrophobicContact CD1-CB 3.87Å; I479-F484 HydrophobicContact CD1-CD2 4.11Å; I479-F484 HydrophobicContact CD1-CG 4.37Å; I479-F484 HydrophobicContact CG1-CB 4.31Å; I479-Q505 WeakPolarHBondContact O-CA 3.08Å; I479-I506 HydrophobicContact CD1-CG2 4.32Å; I479-I506 HydrophobicContact CG1-CG2 3.65Å; I479-I506 PolarHBondContact N-O 2.81Å; I479-I506 PolarHBondContact O-N 2.66Å; I479-I511 HydrophobicContact CD1-CD1 3.55Å; I479-I511 HydrophobicContact CG1-CD1 3.87Å
480	S	86	Confident	82.8	Confident	50 Å²	50	56.7 Å²	56.7	35%	0.35	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	131.2	169.8	175.8	0	0	0	0	110.7	E482 D483 F484	S480-E482 PolarHBondContact O-N 2.65Å; S480-E482 PolarHBondContact OG-N 3.36Å; S480-D483 PolarHBondContact O-N 3.14Å; S480-F484 PolarHBondContact O-N 2.95Å
481	L	83.5	Confident	82.5	Confident	37 Å²	37	54.5 Å²	54.5	19%	0.194	28%	0.283	C	S	.	.	H	α-helix	trans	-59.9	-35.6	174.5	-177	63	0	0	0	111.5	I479 D483 F484 E485 G504 I506	I479-L481 PolarHBondContact O-N 2.92Å; L481-D483 VanDerWaalsContact C-N 3.35Å; L481-D483 PolarHBondContact O-N 2.7Å; L481-F484 HydrophobicContact CD1-CD1 4.4Å; L481-F484 PolarHBondContact O-N 2.9Å; L481-E485 WeakPolarHBondContact O-CG 3.23Å; L481-E485 PolarHBondContact O-N 3.3Å; L481-G504 WeakPolarHBondContact CB-O 3.17Å; L481-G504 PolarHBondContact N-O 3.48Å; L481-I506 HydrophobicContact CD1-CB 4.39Å; L481-I506 HydrophobicContact CD1-CG2 4.47Å
482	E	82.2	Confident	81.6	Confident	120 Å²	120	53.6 Å²	53.6	56%	0.561	28%	0.283	S	S	*	.	H	α-helix	trans	-63.7	-38.8	178.1	-161.8	-153.2	129.8	0	0	111.9	S480 K486	S480-E482 PolarHBondContact O-N 2.65Å; S480-E482 PolarHBondContact OG-N 3.36Å; E482-K486 WeakPolarHBondContact O-CD 3.49Å; E482-K486 VanDerWaalsContact O-CE 3.23Å; E482-K486 WeakPolarHBondContact O-CE 3.29Å; E482-K486 VanDerWaalsContact O-CG 3.3Å; E482-K486 WeakPolarHBondContact O-CG 3.34Å; E482-K486 PolarHBondContact O-N 2.7Å; E482-K486 WeakPolarHBondContact OE1-CE 3.49Å; E482-K486 IonicContact OE1-NZ 2.8Å; E482-K486 PolarHBondContact OE1-NZ 2.66Å
483	D	84.4	Confident	80.8	Confident	53 Å²	53	53.8 Å²	53.8	28%	0.283	28%	0.282	S	S	.	.	H	α-helix	trans	-76.3	-32.4	175.9	-72.3	-32.1	0	0	0	111.9	Y471 S480 L481 K486 I487	Y471-D483 HydrophobicContact CD1-CB 4.03Å; Y471-D483 HydrophobicContact CE1-CB 4.29Å; S480-D483 PolarHBondContact O-N 3.14Å; L481-D483 VanDerWaalsContact C-N 3.35Å; L481-D483 PolarHBondContact O-N 2.7Å; D483-K486 PolarHBondContact O-N 3.33Å; D483-K486 IonicContact OD1-NZ 3.56Å; D483-K486 PolarHBondContact OD1-NZ 2.85Å; D483-I487 WeakPolarHBondContact O-CG1 3.28Å; D483-I487 PolarHBondContact O-N 3.44Å
484	F	86.1	Confident	79.3	Confident	4 Å²	4	52 Å²	52	2%	0.018	28%	0.278	C	S	.	.	H	α-helix	trans	-63.4	-43.7	170.7	-176.6	-116.4	0	0	0	112.1	I479 S480 L481 K486 I487 A488 I506 I511 Y514 F515	I479-F484 HydrophobicContact CD1-CB 3.87Å; I479-F484 HydrophobicContact CD1-CD2 4.11Å; I479-F484 HydrophobicContact CD1-CG 4.37Å; I479-F484 HydrophobicContact CG1-CB 4.31Å; S480-F484 PolarHBondContact O-N 2.95Å; L481-F484 HydrophobicContact CD1-CD1 4.4Å; L481-F484 PolarHBondContact O-N 2.9Å; F484-K486 VanDerWaalsContact C-N 3.29Å; F484-K486 PolarHBondContact O-N 3.35Å; F484-I487 CarbonylContact O-C 3.59Å; F484-I487 PolarHBondContact O-N 2.78Å; F484-A488 HydrophobicContact CE1-CB 4.48Å; F484-A488 HydrophobicContact CZ-CB 4.49Å; F484-A488 WeakPolarHBondContact O-CB 3.3Å; F484-A488 PolarHBondContact O-N 3.04Å; F484-I506 HydrophobicContact CB-CG2 3.75Å; F484-I506 HydrophobicContact CD1-CD1 3.61Å; F484-I506 HydrophobicContact CD1-CG2 4.14Å; F484-I506 HydrophobicContact CE1-CD1 3.62Å; F484-I506 HydrophobicContact CG-CD1 4.29Å; F484-I506 HydrophobicContact CG-CG2 3.92Å; F484-I506 HydrophobicContact CZ-CD1 4.33Å; F484-I511 HydrophobicContact CD2-CD1 4.3Å; F484-I511 HydrophobicContact CD2-CG1 3.97Å; F484-I511 HydrophobicContact CD2-CG2 4.46Å; F484-I511 HydrophobicContact CE2-CB 4.31Å; F484-I511 HydrophobicContact CE2-CG1 3.86Å; F484-I511 HydrophobicContact CE2-CG2 3.76Å; F484-I511 HydrophobicContact CG-CG1 4.49Å; F484-I511 HydrophobicContact CZ-CG1 4.25Å; F484-I511 HydrophobicContact CZ-CG2 4.33Å; F484-Y514 HydrophobicContact CE1-CD1 4.38Å; F484-Y514 HydrophobicContact CE1-CD2 4.05Å; F484-Y514 HydrophobicContact CE1-CE2 4.42Å; F484-Y514 HydrophobicContact CE1-CG 4.06Å; F484-Y514 AromaticContact CZ-CD1 3.67Å; F484-Y514 HydrophobicContact CZ-CD1 3.67Å; F484-Y514 HydrophobicContact CZ-CD2 4.15Å; F484-Y514 HydrophobicContact CZ-CE1 4.16Å; F484-Y514 AromaticContact CZ-CG 3.7Å; F484-Y514 HydrophobicContact CZ-CG 3.7Å; F484-F515 HydrophobicContact CE2-CE2 4.02Å; F484-F515 HydrophobicContact CE2-CZ 4.17Å
485	E	82.9	Confident	77.9	Confident	118 Å²	118	56.8 Å²	56.8	55%	0.551	29%	0.29	S	S	*	.	H	α-helix	trans	-59.7	-38.3	177.1	-76.4	-176.2	166.2	0	0	112.2	L481 I487 A488 A489	L481-E485 WeakPolarHBondContact O-CG 3.23Å; L481-E485 PolarHBondContact O-N 3.3Å; E485-I487 VanDerWaalsContact C-N 3.33Å; E485-I487 PolarHBondContact O-N 3.23Å; E485-A488 PolarHBondContact O-N 2.8Å; E485-A489 WeakPolarHBondContact O-CB 3.4Å; E485-A489 PolarHBondContact O-N 3.33Å
486	K	82.4	Confident	76.3	Confident	65 Å²	65	49.4 Å²	49.4	28%	0.283	26%	0.257	S	S	.	.	H	α-helix	trans	-64.8	-33.9	174.3	-63.7	162.5	-154.1	162.9	0	112.8	I189 E482 D483 F484 N490	I189-K486 HydrophobicContact CD1-CB 3.6Å; I189-K486 HydrophobicContact CD1-CD 3.99Å; I189-K486 HydrophobicContact CD1-CG 4.37Å; I189-K486 HydrophobicContact CG1-CB 3.79Å; I189-K486 HydrophobicContact CG2-CB 4.19Å; E482-K486 WeakPolarHBondContact O-CD 3.49Å; E482-K486 VanDerWaalsContact O-CE 3.23Å; E482-K486 WeakPolarHBondContact O-CE 3.29Å; E482-K486 VanDerWaalsContact O-CG 3.3Å; E482-K486 WeakPolarHBondContact O-CG 3.34Å; E482-K486 PolarHBondContact O-N 2.7Å; E482-K486 WeakPolarHBondContact OE1-CE 3.49Å; E482-K486 IonicContact OE1-NZ 2.8Å; E482-K486 PolarHBondContact OE1-NZ 2.66Å; D483-K486 PolarHBondContact O-N 3.33Å; D483-K486 IonicContact OD1-NZ 3.56Å; D483-K486 PolarHBondContact OD1-NZ 2.85Å; F484-K486 VanDerWaalsContact C-N 3.29Å; F484-K486 PolarHBondContact O-N 3.35Å; K486-N490 PolarHBondContact O-OD1 3.42Å
487	I	83.6	Confident	74.6	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-77.3	-40.5	175.4	-61.8	163.9	0	0	0	110.4	L188 I189 M463 I467 Y471 D483 F484 E485 A489 N490	L188-I487 HydrophobicContact CB-CG1 4.32Å; I189-I487 HydrophobicContact CG1-CG1 4.1Å; M463-I487 HydrophobicContact CE-CG2 3.73Å; I467-I487 HydrophobicContact CD1-CG2 4.14Å; I467-I487 HydrophobicContact CG1-CD1 4.42Å; I467-I487 HydrophobicContact CG1-CG2 4.36Å; I467-I487 HydrophobicContact CG2-CD1 4.14Å; Y471-I487 HydrophobicContact CD1-CD1 4.31Å; Y471-I487 HydrophobicContact CD2-CD1 3.9Å; Y471-I487 HydrophobicContact CE1-CD1 4.11Å; Y471-I487 HydrophobicContact CE2-CD1 3.72Å; Y471-I487 HydrophobicContact CE2-CG1 4.48Å; Y471-I487 HydrophobicContact CG-CD1 4.2Å; D483-I487 WeakPolarHBondContact O-CG1 3.28Å; D483-I487 PolarHBondContact O-N 3.44Å; F484-I487 CarbonylContact O-C 3.59Å; F484-I487 PolarHBondContact O-N 2.78Å; E485-I487 VanDerWaalsContact C-N 3.33Å; E485-I487 PolarHBondContact O-N 3.23Å; I487-A489 VanDerWaalsContact C-N 3.26Å; I487-A489 PolarHBondContact O-N 3.1Å; I487-N490 VanDerWaalsContact O-CB 3.24Å; I487-N490 WeakPolarHBondContact O-CB 3.5Å; I487-N490 PolarHBondContact O-N 3.45Å; I487-N490 VanDerWaalsContact O-N 3.14Å; I487-N490 PolarHBondContact O-ND2 3.47Å
488	A	81.3	Confident	73.2	Confident	11 Å²	11	54 Å²	54	9%	0.091	28%	0.276	C	S	.	.	H	α-helix	trans	-62	-34	177.1	0	0	0	0	0	111.8	F484 E485 N490 F491 Y514	F484-A488 HydrophobicContact CE1-CB 4.48Å; F484-A488 HydrophobicContact CZ-CB 4.49Å; F484-A488 WeakPolarHBondContact O-CB 3.3Å; F484-A488 PolarHBondContact O-N 3.04Å; E485-A488 PolarHBondContact O-N 2.8Å; A488-N490 PolarHBondContact O-N 2.94Å; A488-F491 WeakPolarHBondContact O-CB 3.29Å; A488-F491 PolarHBondContact O-N 3.36Å; A488-F491 VanDerWaalsContact O-O 3.13Å; A488-Y514 HydrophobicContact CB-CE1 4.32Å
489	A	78.5	Confident	71.5	Confident	36 Å²	36	61.2 Å²	61.2	30%	0.298	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-9.8	174.5	0	0	0	0	0	115	E485 I487 F491	E485-A489 WeakPolarHBondContact O-CB 3.4Å; E485-A489 PolarHBondContact O-N 3.33Å; I487-A489 VanDerWaalsContact C-N 3.26Å; I487-A489 PolarHBondContact O-N 3.1Å; A489-F491 VanDerWaalsContact C-N 3.26Å
490	N	76.1	Confident	70.1	Confident	1 Å²	1	63 Å²	63	1%	0.005	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-12.2	170.8	-52.5	-11.8	0	0	0	113	L188 F190 K486 I487 A488	L188-N490 PolarHBondContact O-ND2 2.99Å; F190-N490 HydrophobicContact CB-CB 4.2Å; F190-N490 WeakPolarHBondContact CB-OD1 3.28Å; F190-N490 PolarHBondContact N-OD1 3.32Å; K486-N490 PolarHBondContact O-OD1 3.42Å; I487-N490 VanDerWaalsContact O-CB 3.24Å; I487-N490 WeakPolarHBondContact O-CB 3.5Å; I487-N490 PolarHBondContact O-N 3.45Å; I487-N490 VanDerWaalsContact O-N 3.14Å; I487-N490 PolarHBondContact O-ND2 3.47Å; A488-N490 PolarHBondContact O-N 2.94Å
491	F	78.1	Confident	68.8	Low	5 Å²	5	66.9 Å²	66.9	2%	0.022	34%	0.339	C	S	.	.	S	Bend	trans	-115.4	136.6	-177.6	-59.2	-96.5	0	0	0	108.1	L404 S405 M463 A488 A489 F493 F515	L404-F491 HydrophobicContact CB-CE1 4.04Å; L404-F491 HydrophobicContact CB-CZ 4.39Å; L404-F491 HydrophobicContact CD2-CE1 3.96Å; L404-F491 HydrophobicContact CD2-CZ 4.14Å; L404-F491 HydrophobicContact CG-CE1 3.94Å; L404-F491 HydrophobicContact CG-CZ 4.48Å; S405-F491 VanDerWaalsContact OG-CE1 3.23Å; S405-F491 WeakPolarHBondContact OG-CE1 3.33Å; S405-F491 VanDerWaalsContact OG-CZ 3.3Å; S405-F491 WeakPolarHBondContact OG-CZ 3.43Å; M463-F491 HydrophobicContact CE-CE2 3.85Å; M463-F491 HydrophobicContact CE-CZ 3.86Å; A488-F491 WeakPolarHBondContact O-CB 3.29Å; A488-F491 PolarHBondContact O-N 3.36Å; A488-F491 VanDerWaalsContact O-O 3.13Å; A489-F491 VanDerWaalsContact C-N 3.26Å; F491-F493 HydrophobicContact CB-CD2 4.04Å; F491-F493 HydrophobicContact CB-CE2 4.41Å; F491-F493 HydrophobicContact CB-CG 4.43Å; F491-F493 HydrophobicContact CD1-CE2 4.43Å; F491-F493 PolarHBondContact O-N 3.47Å; F491-F515 HydrophobicContact CD1-CE1 4.36Å; F491-F515 AromaticContact CD2-CE1 3.8Å; F491-F515 HydrophobicContact CD2-CE1 3.8Å; F491-F515 HydrophobicContact CD2-CZ 4.5Å; F491-F515 HydrophobicContact CE1-CE1 4.13Å; F491-F515 AromaticContact CE2-CE1 3.56Å; F491-F515 HydrophobicContact CE2-CE1 3.56Å; F491-F515 HydrophobicContact CE2-CZ 4.04Å; F491-F515 HydrophobicContact CG-CE1 4.22Å; F491-F515 HydrophobicContact CZ-CD1 4.49Å; F491-F515 AromaticContact CZ-CE1 3.74Å; F491-F515 HydrophobicContact CZ-CE1 3.74Å; F491-F515 HydrophobicContact CZ-CZ 4.4Å
492	P	65.4	Low	67.9	Low	22 Å²	22	69.9 Å²	69.9	14%	0.143	35%	0.348	C	S	.	.	S	Bend	trans	-76.9	15.8	-176.9	33.4	-36.8	0	0	0	113.5	L249 L408 Y410	L249-P492 HydrophobicContact CB-CB 4.04Å; L249-P492 HydrophobicContact CB-CG 4.05Å; L249-P492 HydrophobicContact CD1-CG 4.23Å; L249-P492 HydrophobicContact CD2-CB 4.46Å; L408-P492 HydrophobicContact CD1-CG 3.7Å; Y410-P492 HydrophobicContact CE2-CG 4.14Å
493	F	67.3	Low	67.2	Low	27 Å²	27	73.5 Å²	73.5	12%	0.118	37%	0.365	C	S	.	.			trans	-86.1	132	179.3	-48.7	-32.2	0	0	0	110.1	L408 F491 Y514 G518 M519 C522	L408-F493 HydrophobicContact CD2-CE1 3.61Å; L408-F493 HydrophobicContact CD2-CE2 4.13Å; L408-F493 HydrophobicContact CD2-CZ 3.21Å; F491-F493 HydrophobicContact CB-CD2 4.04Å; F491-F493 HydrophobicContact CB-CE2 4.41Å; F491-F493 HydrophobicContact CB-CG 4.43Å; F491-F493 HydrophobicContact CD1-CE2 4.43Å; F491-F493 PolarHBondContact O-N 3.47Å; F493-Y514 PolarHBondContact O-OH 3.35Å; F493-G518 VanDerWaalsContact CE2-CA 3.48Å; F493-G518 VanDerWaalsContact CZ-C 3.42Å; F493-G518 WeakPolarHBondContact CZ-O 3.34Å; F493-M519 HydrophobicContact CE2-SD 3.84Å; F493-M519 HydrophobicContact CZ-SD 3.72Å; F493-C522 HydrophobicContact CE1-CB 3.76Å; F493-C522 WeakPolarHBondContact CE1-SG 3.48Å; F493-C522 HydrophobicContact CZ-CB 4.21Å
494	T	49.2	Very low	66.8	Low	120 Å²	120	73 Å²	73	74%	0.736	37%	0.372	S	S	*	.			trans	-119.6	138.3	174.5	-28.7	0	0	0	0	109.8
495	Y	52.9	Low	66.6	Low	208 Å²	208	75.7 Å²	75.7	82%	0.816	39%	0.385	S	S	*	.			trans	62.3	90.9	-178.1	-72.9	-83.4	0	0	0	116.8
496	C	46.6	Very low	66.6	Low	22 Å²	22	70.4 Å²	70.4	15%	0.149	36%	0.36	C	S	.	.			trans	-142.1	35.5	157.4	-173	0	0	0	0	111.7	Y514 R517	C496-Y514 HydrophobicContact CB-CD2 3.59Å; C496-Y514 HydrophobicContact CB-CE2 3.89Å; C496-Y514 HydrophobicContact CB-CG 4.36Å; C496-R517 WeakPolarHBondContact SG-CD 3.23Å; C496-R517 PolarHBondContact SG-NH1 2.94Å; C496-R517 VanDerWaalsContact SG-NH1 3.45Å
497	T	46.2	Very low	66.7	Low	76 Å²	76	67.6 Å²	67.6	47%	0.466	35%	0.349	S	S	.	.			trans	-85.3	128.4	163.8	37.8	0	0	0	0	109
498	Q	52.1	Low	66.9	Low	108 Å²	108	71 Å²	71	51%	0.505	36%	0.362	S	S	.	.			trans	-92.3	177.3	157.2	-78.2	173.5	-119.9	0	0	108.1	T500	Q498-T500 PolarHBondContact O-N 3.33Å
499	E	49.3	Very low	66.9	Low	197 Å²	197	76.2 Å²	76.2	92%	0.921	39%	0.385	S	S	*	.			trans	-57.7	123.2	166.7	-63.9	173.8	159.4	0	0	108.2
500	T	57.2	Low	67.1	Low	44 Å²	44	76.3 Å²	76.3	27%	0.27	38%	0.379	S	S	.	.			trans	-83.8	141.9	-173	38.7	0	0	0	0	111.2	Q498 R502 E510	Q498-T500 PolarHBondContact O-N 3.33Å; T500-R502 PolarHBondContact O-N 3.36Å; T500-R502 PolarHBondContact OG1-O 2.99Å; T500-E510 WeakPolarHBondContact CA-OE1 3.42Å; T500-E510 WeakPolarHBondContact CG2-OE1 3.39Å
501	D	59.1	Low	67.6	Low	130 Å²	130	76.2 Å²	76.2	70%	0.695	38%	0.378	S	S	*	.	S	Bend	trans	-60.6	-16.1	-178.4	-79.1	-26.6	0	0	0	113.5
502	R	64.3	Low	67.9	Low	101 Å²	101	78.1 Å²	78.1	38%	0.381	39%	0.39	S	S	.	.	S	Bend	trans	-144.8	140.7	174.5	-60.6	-179.6	-173.6	171.5	6.1	110.3	D476 Y478 T500 G504 Q505	D476-R502 IonicContact OD2-NH1 3.8Å; Y478-R502 HydrophobicContact CE1-CG 4.48Å; Y478-R502 VanDerWaalsContact CZ-CZ 3.41Å; Y478-R502 PolarHBondContact OH-NH2 2.9Å; T500-R502 PolarHBondContact O-N 3.36Å; T500-R502 PolarHBondContact OG1-O 2.99Å; R502-G504 PolarHBondContact O-N 3.21Å; R502-Q505 HydrophobicContact CB-CB 4.24Å; R502-Q505 PolarHBondContact O-N 3.27Å
503	E	68.3	Low	68.7	Low	195 Å²	195	79.9 Å²	79.9	91%	0.911	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	123.2	175.6	-64.8	-173.3	166.5	0	0	111.5	Q505	E503-Q505 VanDerWaalsContact C-N 3.27Å; E503-Q505 PolarHBondContact O-N 3.37Å
504	G	75.6	Confident	69.4	Low	43 Å²	43	79.4 Å²	79.4	44%	0.443	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	1.4	174	0	0	0	0	0	116.6	L481 R502	L481-G504 WeakPolarHBondContact CB-O 3.17Å; L481-G504 PolarHBondContact N-O 3.48Å; R502-G504 PolarHBondContact O-N 3.21Å
505	Q	82.2	Confident	71.1	Confident	60 Å²	60	73.7 Å²	73.7	28%	0.28	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	158.9	171.4	-59.1	-166.2	-63.6	0	0	110.9	Y478 I479 R502 E503	Y478-Q505 HydrophobicContact CD1-CB 4.18Å; I479-Q505 WeakPolarHBondContact O-CA 3.08Å; R502-Q505 HydrophobicContact CB-CB 4.24Å; R502-Q505 PolarHBondContact O-N 3.27Å; E503-Q505 VanDerWaalsContact C-N 3.27Å; E503-Q505 PolarHBondContact O-N 3.37Å
506	I	82.7	Confident	72.5	Confident	7 Å²	7	66.4 Å²	66.4	4%	0.036	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	134.3	171.7	-170.4	178.2	0	0	0	110.4	Y478 I479 L481 F484 E510 I511	Y478-I506 WeakPolarHBondContact CA-O 3.33Å; I479-I506 HydrophobicContact CD1-CG2 4.32Å; I479-I506 HydrophobicContact CG1-CG2 3.65Å; I479-I506 PolarHBondContact N-O 2.81Å; I479-I506 PolarHBondContact O-N 2.66Å; L481-I506 HydrophobicContact CD1-CB 4.39Å; L481-I506 HydrophobicContact CD1-CG2 4.47Å; F484-I506 HydrophobicContact CB-CG2 3.75Å; F484-I506 HydrophobicContact CD1-CD1 3.61Å; F484-I506 HydrophobicContact CD1-CG2 4.14Å; F484-I506 HydrophobicContact CE1-CD1 3.62Å; F484-I506 HydrophobicContact CG-CD1 4.29Å; F484-I506 HydrophobicContact CG-CG2 3.92Å; F484-I506 HydrophobicContact CZ-CD1 4.33Å; I506-E510 HydrophobicContact CD1-CB 3.96Å; I506-E510 HydrophobicContact CG1-CB 3.51Å; I506-E510 HydrophobicContact CG1-CG 4.43Å; I506-I511 HydrophobicContact CD1-CG1 3.87Å; I506-I511 HydrophobicContact CG1-CG1 4Å; I506-I511 HydrophobicContact CG2-CD1 4.14Å; I506-I511 HydrophobicContact CG2-CG1 4.09Å
507	S	85.7	Confident	73.9	Confident	6 Å²	6	68.9 Å²	68.9	4%	0.042	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	165.8	-176.9	66.8	0	0	0	0	113.7	E509 E510 I511	S507-E509 VanDerWaalsContact C-N 3.27Å; S507-E509 PolarHBondContact O-N 3.24Å; S507-E510 WeakPolarHBondContact CB-OE2 3.29Å; S507-E510 PolarHBondContact N-OE2 2.95Å; S507-E510 PolarHBondContact O-N 3.16Å; S507-E510 WeakPolarHBondContact OG-CB 3.39Å; S507-E510 VanDerWaalsContact OG-CD 3.31Å; S507-E510 VanDerWaalsContact OG-CG 3.27Å; S507-E510 WeakPolarHBondContact OG-CG 3.46Å; S507-E510 PolarHBondContact OG-N 3.14Å; S507-E510 PolarHBondContact OG-OE2 3.42Å; S507-I511 VanDerWaalsContact O-CG1 3.29Å; S507-I511 WeakPolarHBondContact O-CG1 3.37Å; S507-I511 PolarHBondContact O-N 3.02Å
508	R	86	Confident	75.3	Confident	71 Å²	71	65.7 Å²	65.7	27%	0.268	33%	0.328	S	S	.	.	H	α-helix	trans	-55.3	-40.3	172.8	-170.4	-179.8	164.5	91.9	11.4	113.1	V464 D465 M468 G477 T512	V464-R508 HydrophobicContact CG1-CG 3.66Å; D465-R508 IonicContact OD1-CZ 3.21Å; D465-R508 IonicContact OD1-NH1 3.64Å; D465-R508 PolarHBondContact OD1-NH1 2.95Å; D465-R508 IonicContact OD1-NH2 2.7Å; D465-R508 PolarHBondContact OD1-NH2 2.92Å; M468-R508 HydrophobicContact CE-CB 3.64Å; M468-R508 HydrophobicContact CE-CG 4.23Å; G477-R508 PolarHBondContact O-N 3.5Å; R508-T512 WeakPolarHBondContact O-CB 3.38Å; R508-T512 PolarHBondContact O-N 3.22Å; R508-T512 PolarHBondContact O-OG1 2.79Å
509	E	82.6	Confident	76.5	Confident	122 Å²	122	60.6 Å²	60.6	57%	0.57	30%	0.304	S	S	*	.	H	α-helix	trans	-73.5	-38.1	-177	-73	56.6	-126	0	0	111.4	S507 T512 S513	S507-E509 VanDerWaalsContact C-N 3.27Å; S507-E509 PolarHBondContact O-N 3.24Å; E509-T512 PolarHBondContact O-N 3.21Å; E509-S513 WeakPolarHBondContact O-CB 3.37Å; E509-S513 PolarHBondContact O-N 2.99Å; E509-S513 PolarHBondContact O-OG 3.04Å
510	E	82.9	Confident	77.6	Confident	37 Å²	37	51.8 Å²	51.8	17%	0.173	27%	0.265	C	S	.	.	H	α-helix	trans	-67.1	-44.5	173.1	-70.8	164.2	115.5	0	0	111.8	T500 I506 S507 T512 S513 Y514	T500-E510 WeakPolarHBondContact CA-OE1 3.42Å; T500-E510 WeakPolarHBondContact CG2-OE1 3.39Å; I506-E510 HydrophobicContact CD1-CB 3.96Å; I506-E510 HydrophobicContact CG1-CB 3.51Å; I506-E510 HydrophobicContact CG1-CG 4.43Å; S507-E510 WeakPolarHBondContact CB-OE2 3.29Å; S507-E510 PolarHBondContact N-OE2 2.95Å; S507-E510 PolarHBondContact O-N 3.16Å; S507-E510 WeakPolarHBondContact OG-CB 3.39Å; S507-E510 VanDerWaalsContact OG-CD 3.31Å; S507-E510 VanDerWaalsContact OG-CG 3.27Å; S507-E510 WeakPolarHBondContact OG-CG 3.46Å; S507-E510 PolarHBondContact OG-N 3.14Å; S507-E510 PolarHBondContact OG-OE2 3.42Å; E510-T512 VanDerWaalsContact C-N 3.34Å; E510-T512 PolarHBondContact O-N 3.41Å; E510-S513 CarbonylContact O-C 3.5Å; E510-S513 WeakPolarHBondContact O-CB 3.25Å; E510-S513 PolarHBondContact O-N 2.7Å; E510-S513 VanDerWaalsContact O-N 3.17Å; E510-Y514 PolarHBondContact O-N 3.23Å
511	I	85.7	Confident	78.1	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-61.6	-43	174.9	-66	165	0	0	0	110.8	V464 I467 M468 I479 F484 I506 S507 S513 Y514 F515	V464-I511 HydrophobicContact CG2-CG2 4.13Å; I467-I511 HydrophobicContact CD1-CG2 4.07Å; M468-I511 HydrophobicContact CE-CD1 3.63Å; I479-I511 HydrophobicContact CD1-CD1 3.55Å; I479-I511 HydrophobicContact CG1-CD1 3.87Å; F484-I511 HydrophobicContact CD2-CD1 4.3Å; F484-I511 HydrophobicContact CD2-CG1 3.97Å; F484-I511 HydrophobicContact CD2-CG2 4.46Å; F484-I511 HydrophobicContact CE2-CB 4.31Å; F484-I511 HydrophobicContact CE2-CG1 3.86Å; F484-I511 HydrophobicContact CE2-CG2 3.76Å; F484-I511 HydrophobicContact CG-CG1 4.49Å; F484-I511 HydrophobicContact CZ-CG1 4.25Å; F484-I511 HydrophobicContact CZ-CG2 4.33Å; I506-I511 HydrophobicContact CD1-CG1 3.87Å; I506-I511 HydrophobicContact CG1-CG1 4Å; I506-I511 HydrophobicContact CG2-CD1 4.14Å; I506-I511 HydrophobicContact CG2-CG1 4.09Å; S507-I511 VanDerWaalsContact O-CG1 3.29Å; S507-I511 WeakPolarHBondContact O-CG1 3.37Å; S507-I511 PolarHBondContact O-N 3.02Å; I511-S513 VanDerWaalsContact C-N 3.3Å; I511-S513 PolarHBondContact O-N 3.32Å; I511-Y514 PolarHBondContact O-N 2.99Å; I511-F515 HydrophobicContact CG2-CD2 3.74Å; I511-F515 HydrophobicContact CG2-CE2 3.55Å; I511-F515 VanDerWaalsContact O-CD2 3.28Å; I511-F515 WeakPolarHBondContact O-CD2 3.33Å; I511-F515 PolarHBondContact O-N 3.34Å; I511-F515 VanDerWaalsContact O-N 3.1Å
512	T	85	Confident	78.5	Confident	44 Å²	44	48.6 Å²	48.6	27%	0.27	25%	0.25	S	S	.	.	H	α-helix	trans	-59.8	-44	175.2	-56.9	0	0	0	0	110.4	V460 V464 R508 E509 E510 F515 M516	V460-T512 HydrophobicContact CG1-CG2 4.32Å; V464-T512 WeakPolarHBondContact CG2-OG1 3.49Å; R508-T512 WeakPolarHBondContact O-CB 3.38Å; R508-T512 PolarHBondContact O-N 3.22Å; R508-T512 PolarHBondContact O-OG1 2.79Å; E509-T512 PolarHBondContact O-N 3.21Å; E510-T512 VanDerWaalsContact C-N 3.34Å; E510-T512 PolarHBondContact O-N 3.41Å; T512-F515 PolarHBondContact O-N 3.01Å; T512-M516 HydrophobicContact CG2-CG 4.38Å; T512-M516 WeakPolarHBondContact O-CB 3.44Å; T512-M516 VanDerWaalsContact O-CG 3.29Å; T512-M516 WeakPolarHBondContact O-CG 3.33Å; T512-M516 PolarHBondContact O-N 3.46Å
513	S	81.4	Confident	78.5	Confident	60 Å²	60	44.5 Å²	44.5	42%	0.42	24%	0.237	S	C	.	.	H	α-helix	trans	-65.5	-39.1	178.1	-61.2	0	0	0	0	112.9	E509 E510 I511 R517	E509-S513 WeakPolarHBondContact O-CB 3.37Å; E509-S513 PolarHBondContact O-N 2.99Å; E509-S513 PolarHBondContact O-OG 3.04Å; E510-S513 CarbonylContact O-C 3.5Å; E510-S513 WeakPolarHBondContact O-CB 3.25Å; E510-S513 PolarHBondContact O-N 2.7Å; E510-S513 VanDerWaalsContact O-N 3.17Å; I511-S513 VanDerWaalsContact C-N 3.3Å; I511-S513 PolarHBondContact O-N 3.32Å; S513-R517 WeakPolarHBondContact O-CB 3.38Å; S513-R517 PolarHBondContact O-N 2.81Å
514	Y	83.4	Confident	78.3	Confident	17 Å²	17	39.2 Å²	39.2	7%	0.067	21%	0.211	C	C	.	.	H	α-helix	trans	-58.1	-54.1	174.4	175.5	-82.7	0	0	0	110.9	F484 A488 F493 C496 E510 I511 R517 G518	F484-Y514 HydrophobicContact CE1-CD1 4.38Å; F484-Y514 HydrophobicContact CE1-CD2 4.05Å; F484-Y514 HydrophobicContact CE1-CE2 4.42Å; F484-Y514 HydrophobicContact CE1-CG 4.06Å; F484-Y514 AromaticContact CZ-CD1 3.67Å; F484-Y514 HydrophobicContact CZ-CD1 3.67Å; F484-Y514 HydrophobicContact CZ-CD2 4.15Å; F484-Y514 HydrophobicContact CZ-CE1 4.16Å; F484-Y514 AromaticContact CZ-CG 3.7Å; F484-Y514 HydrophobicContact CZ-CG 3.7Å; A488-Y514 HydrophobicContact CB-CE1 4.32Å; F493-Y514 PolarHBondContact O-OH 3.35Å; C496-Y514 HydrophobicContact CB-CD2 3.59Å; C496-Y514 HydrophobicContact CB-CE2 3.89Å; C496-Y514 HydrophobicContact CB-CG 4.36Å; E510-Y514 PolarHBondContact O-N 3.23Å; I511-Y514 PolarHBondContact O-N 2.99Å; Y514-R517 PolarHBondContact O-N 2.99Å; Y514-G518 PolarHBondContact O-N 3.36Å
515	F	84.6	Confident	77.2	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-68.2	-41.5	-178.3	-73.8	-60.2	0	0	0	112.2	L404 V460 M463 V464 I467 F484 F491 I511 T512 R517 G518 M519	L404-F515 HydrophobicContact CD2-CB 4.3Å; L404-F515 HydrophobicContact CD2-CD1 3.7Å; L404-F515 HydrophobicContact CD2-CE1 4.21Å; L404-F515 HydrophobicContact CD2-CG 3.99Å; V460-F515 HydrophobicContact CB-CB 4.4Å; V460-F515 HydrophobicContact CG1-CB 3.64Å; V460-F515 HydrophobicContact CG2-CB 3.95Å; M463-F515 HydrophobicContact CE-CZ 4.07Å; M463-F515 HydrophobicContact CG-CE2 4.17Å; M463-F515 HydrophobicContact CG-CZ 4.27Å; V464-F515 HydrophobicContact CG2-CD2 4.45Å; I467-F515 HydrophobicContact CD1-CE2 3.53Å; I467-F515 HydrophobicContact CD1-CZ 3.98Å; F484-F515 HydrophobicContact CE2-CE2 4.02Å; F484-F515 HydrophobicContact CE2-CZ 4.17Å; F491-F515 HydrophobicContact CD1-CE1 4.36Å; F491-F515 AromaticContact CD2-CE1 3.8Å; F491-F515 HydrophobicContact CD2-CE1 3.8Å; F491-F515 HydrophobicContact CD2-CZ 4.5Å; F491-F515 HydrophobicContact CE1-CE1 4.13Å; F491-F515 AromaticContact CE2-CE1 3.56Å; F491-F515 HydrophobicContact CE2-CE1 3.56Å; F491-F515 HydrophobicContact CE2-CZ 4.04Å; F491-F515 HydrophobicContact CG-CE1 4.22Å; F491-F515 HydrophobicContact CZ-CD1 4.49Å; F491-F515 AromaticContact CZ-CE1 3.74Å; F491-F515 HydrophobicContact CZ-CE1 3.74Å; F491-F515 HydrophobicContact CZ-CZ 4.4Å; I511-F515 HydrophobicContact CG2-CD2 3.74Å; I511-F515 HydrophobicContact CG2-CE2 3.55Å; I511-F515 VanDerWaalsContact O-CD2 3.28Å; I511-F515 WeakPolarHBondContact O-CD2 3.33Å; I511-F515 PolarHBondContact O-N 3.34Å; I511-F515 VanDerWaalsContact O-N 3.1Å; T512-F515 PolarHBondContact O-N 3.01Å; F515-R517 VanDerWaalsContact C-N 3.3Å; F515-R517 PolarHBondContact O-N 3.17Å; F515-G518 PolarHBondContact O-N 2.7Å; F515-M519 WeakPolarHBondContact O-CB 3.46Å; F515-M519 VanDerWaalsContact O-CG 3.25Å; F515-M519 WeakPolarHBondContact O-CG 3.37Å; F515-M519 PolarHBondContact O-N 2.97Å
516	M	81.3	Confident	75.4	Confident	55 Å²	55	40.4 Å²	40.4	27%	0.271	22%	0.224	S	C	.	.	H	α-helix	trans	-60.3	-37.8	175.2	-72.7	-58.4	-67.7	0	0	112.3	V460 T512 S520	V460-M516 HydrophobicContact CB-SD 3.93Å; V460-M516 HydrophobicContact CG1-CG 4.07Å; V460-M516 HydrophobicContact CG1-SD 4.06Å; V460-M516 HydrophobicContact CG2-SD 3.8Å; T512-M516 HydrophobicContact CG2-CG 4.38Å; T512-M516 WeakPolarHBondContact O-CB 3.44Å; T512-M516 VanDerWaalsContact O-CG 3.29Å; T512-M516 WeakPolarHBondContact O-CG 3.33Å; T512-M516 PolarHBondContact O-N 3.46Å; M516-S520 VanDerWaalsContact O-CB 3.23Å; M516-S520 WeakPolarHBondContact O-CB 3.33Å; M516-S520 PolarHBondContact O-N 3.04Å; M516-S520 PolarHBondContact O-OG 3.33Å
517	R	76.2	Confident	73.3	Confident	74 Å²	74	45.9 Å²	45.9	28%	0.279	25%	0.245	S	C	.	.	H	α-helix	trans	-73	-42.1	177.3	-171.3	170	-41.7	152.7	5.3	112.7	C496 S513 Y514 F515 S520 V521 F529	C496-R517 WeakPolarHBondContact SG-CD 3.23Å; C496-R517 PolarHBondContact SG-NH1 2.94Å; C496-R517 VanDerWaalsContact SG-NH1 3.45Å; S513-R517 WeakPolarHBondContact O-CB 3.38Å; S513-R517 PolarHBondContact O-N 2.81Å; Y514-R517 PolarHBondContact O-N 2.99Å; F515-R517 VanDerWaalsContact C-N 3.3Å; F515-R517 PolarHBondContact O-N 3.17Å; R517-S520 PolarHBondContact O-OG 3.46Å; R517-V521 WeakPolarHBondContact O-CG2 3.43Å; R517-V521 PolarHBondContact O-N 2.76Å; R517-F529 HydrophobicContact CB-CZ 4.18Å; R517-F529 HydrophobicContact CG-CE2 4.44Å; R517-F529 HydrophobicContact CG-CZ 3.78Å
518	G	76.1	Confident	71	Confident	9 Å²	9	51.4 Å²	51.4	9%	0.093	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-48.9	175.5	0	0	0	0	0	112.2	F493 Y514 F515 V521 C522	F493-G518 VanDerWaalsContact CE2-CA 3.48Å; F493-G518 VanDerWaalsContact CZ-C 3.42Å; F493-G518 WeakPolarHBondContact CZ-O 3.34Å; Y514-G518 PolarHBondContact O-N 3.36Å; F515-G518 PolarHBondContact O-N 2.7Å; G518-V521 PolarHBondContact O-N 2.92Å; G518-C522 PolarHBondContact O-N 3.49Å
519	M	77.2	Confident	68.8	Low	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-67.1	-36.9	179.4	-63.6	-50.8	-63.4	0	0	112.9	L404 D407 L408 I456 V460 F493 F515 V521 C522 A523	L404-M519 HydrophobicContact CD1-CE 4.17Å; L404-M519 HydrophobicContact CD1-CG 3.85Å; L404-M519 HydrophobicContact CD1-SD 3.99Å; L404-M519 HydrophobicContact CG-CG 4.34Å; L404-M519 HydrophobicContact CG-SD 4.05Å; D407-M519 HydrophobicContact CB-CE 3.41Å; D407-M519 VanDerWaalsContact CB-CE 3.41Å; L408-M519 HydrophobicContact CD2-CE 4.13Å; L408-M519 HydrophobicContact CD2-SD 3.81Å; I456-M519 HydrophobicContact CG2-CB 3.64Å; I456-M519 HydrophobicContact CG2-CG 4.17Å; V460-M519 HydrophobicContact CG2-CG 4.18Å; F493-M519 HydrophobicContact CE2-SD 3.84Å; F493-M519 HydrophobicContact CZ-SD 3.72Å; F515-M519 WeakPolarHBondContact O-CB 3.46Å; F515-M519 VanDerWaalsContact O-CG 3.25Å; F515-M519 WeakPolarHBondContact O-CG 3.37Å; F515-M519 PolarHBondContact O-N 2.97Å; M519-V521 PolarHBondContact O-N 3.45Å; M519-C522 PolarHBondContact O-N 3.06Å; M519-A523 WeakPolarHBondContact O-CB 3.48Å; M519-A523 PolarHBondContact O-N 2.83Å
520	S	71.3	Confident	66.8	Low	13 Å²	13	53.4 Å²	53.4	9%	0.091	29%	0.289	C	S	.	.	H	α-helix	trans	-68.9	-33.7	-179.8	72.2	0	0	0	0	113.1	M516 R517 K524 L525	M516-S520 VanDerWaalsContact O-CB 3.23Å; M516-S520 WeakPolarHBondContact O-CB 3.33Å; M516-S520 PolarHBondContact O-N 3.04Å; M516-S520 PolarHBondContact O-OG 3.33Å; R517-S520 PolarHBondContact O-OG 3.46Å; S520-K524 PolarHBondContact O-N 3.24Å; S520-L525 PolarHBondContact O-N 2.78Å
521	V	69.7	Low	65.2	Low	97 Å²	97	55.5 Å²	55.5	59%	0.588	30%	0.299	S	S	*	.	H	α-helix	trans	-63.9	-51.8	171.7	169.8	0	0	0	0	110.7	R517 G518 M519 K524	R517-V521 WeakPolarHBondContact O-CG2 3.43Å; R517-V521 PolarHBondContact O-N 2.76Å; G518-V521 PolarHBondContact O-N 2.92Å; M519-V521 PolarHBondContact O-N 3.45Å; V521-K524 WeakPolarHBondContact O-CA 3.21Å; V521-K524 PolarHBondContact O-N 2.95Å
522	C	66.4	Low	63.8	Low	10 Å²	10	60.1 Å²	60.1	7%	0.068	33%	0.328	C	S	.	.	H	α-helix	trans	-83.9	-28.1	-171.8	-70.7	0	0	0	0	114.4	Y409 Y410 F493 G518 M519 K524	Y409-C522 WeakPolarHBondContact CB-O 3.48Å; Y410-C522 HydrophobicContact CE2-CB 4.27Å; Y410-C522 VanDerWaalsContact CZ-SG 3.53Å; Y410-C522 PolarHBondContact OH-SG 3.2Å; Y410-C522 VanDerWaalsContact OH-SG 3.41Å; F493-C522 HydrophobicContact CE1-CB 3.76Å; F493-C522 WeakPolarHBondContact CE1-SG 3.48Å; F493-C522 HydrophobicContact CZ-CB 4.21Å; G518-C522 PolarHBondContact O-N 3.49Å; M519-C522 PolarHBondContact O-N 3.06Å; C522-K524 WeakPolarHBondContact O-CG 3.27Å; C522-K524 PolarHBondContact O-N 2.96Å; C522-K524 VanDerWaalsContact O-N 3.15Å
523	A	64.1	Low	63.1	Low	14 Å²	14	59.4 Å²	59.4	12%	0.116	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-6.2	164.7	0	0	0	0	0	112.7	I456 M519 L525	I456-A523 HydrophobicContact CD1-CB 3.61Å; M519-A523 WeakPolarHBondContact O-CB 3.48Å; M519-A523 PolarHBondContact O-N 2.83Å; A523-L525 HydrophobicContact CB-CD1 3.9Å; A523-L525 HydrophobicContact CB-CG 3.83Å; A523-L525 PolarHBondContact O-N 2.59Å; A523-L525 VanDerWaalsContact O-N 3.11Å
524	K	63.9	Low	63	Low	84 Å²	84	59.9 Å²	59.9	37%	0.365	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	31.6	-179.5	-49.6	-166.9	-171.9	-168.4	0	113.2	Y409 E414 S520 V521 C522 G526	Y409-K524 HydrophobicContact CD1-CD 4.15Å; Y409-K524 HydrophobicContact CD1-CG 4.23Å; Y409-K524 HydrophobicContact CE1-CD 4.08Å; E414-K524 IonicContact OE1-NZ 2.85Å; E414-K524 PolarHBondContact OE1-NZ 3.44Å; E414-K524 IonicContact OE2-NZ 2.7Å; E414-K524 PolarHBondContact OE2-NZ 3.11Å; S520-K524 PolarHBondContact O-N 3.24Å; V521-K524 WeakPolarHBondContact O-CA 3.21Å; V521-K524 PolarHBondContact O-N 2.95Å; C522-K524 WeakPolarHBondContact O-CG 3.27Å; C522-K524 PolarHBondContact O-N 2.96Å; C522-K524 VanDerWaalsContact O-N 3.15Å; K524-G526 PolarHBondContact O-N 3.23Å
525	L	53.6	Low	63	Low	67 Å²	67	60.6 Å²	60.6	35%	0.351	32%	0.322	S	S	.	.			trans	-71	4.7	-168.8	-86.9	174.1	0	0	0	114.8	I456 S520 A523 Y527	I456-L525 HydrophobicContact CD1-CD1 3.58Å; S520-L525 PolarHBondContact O-N 2.78Å; A523-L525 HydrophobicContact CB-CD1 3.9Å; A523-L525 HydrophobicContact CB-CG 3.83Å; A523-L525 PolarHBondContact O-N 2.59Å; A523-L525 VanDerWaalsContact O-N 3.11Å; L525-Y527 HydrophobicContact CB-CD2 4.2Å; L525-Y527 PolarHBondContact O-N 2.81Å
526	G	43.4	Very low	62.9	Low	62 Å²	62	63.8 Å²	63.8	64%	0.639	34%	0.337	S	S	*	.			trans	59.8	31.7	-179.7	0	0	0	0	0	112.5	K524 N528	K524-G526 PolarHBondContact O-N 3.23Å; G526-N528 VanDerWaalsContact C-N 3.26Å; G526-N528 PolarHBondContact O-N 3.26Å
527	Y	38.8	Very low	63.4	Low	121 Å²	121	63.6 Å²	63.6	48%	0.475	34%	0.336	S	S	.	.			trans	-67.9	86.8	179.6	-119.5	-78.6	0	0	0	109.6	S453 L525 F529	S453-Y527 WeakPolarHBondContact OG-CE2 3.32Å; S453-Y527 PolarHBondContact OG-OH 3.38Å; S453-Y527 VanDerWaalsContact OG-OH 3.14Å; L525-Y527 HydrophobicContact CB-CD2 4.2Å; L525-Y527 PolarHBondContact O-N 2.81Å; Y527-F529 PolarHBondContact O-N 3.06Å
528	N	36.6	Very low	63.8	Low	123 Å²	123	61.9 Å²	61.9	66%	0.658	33%	0.333	S	S	*	.			trans	-52.2	114.4	157.4	-71.8	-23.4	0	0	0	106.5	G526 N530	G526-N528 VanDerWaalsContact C-N 3.26Å; G526-N528 PolarHBondContact O-N 3.26Å; N528-N530 VanDerWaalsContact C-N 3.27Å; N528-N530 PolarHBondContact O-N 3.29Å
529	F	40.1	Very low	64.4	Low	106 Å²	106	64.7 Å²	64.7	47%	0.465	35%	0.349	S	S	.	.			trans	-67.3	92.5	173.8	-83.8	-89.3	0	0	0	107.8	R517 Y527 E531 T532	R517-F529 HydrophobicContact CB-CZ 4.18Å; R517-F529 HydrophobicContact CG-CE2 4.44Å; R517-F529 HydrophobicContact CG-CZ 3.78Å; Y527-F529 PolarHBondContact O-N 3.06Å; F529-E531 CarbonylContact O-C 3.6Å; F529-E531 VanDerWaalsContact O-C 3.27Å; F529-E531 PolarHBondContact O-N 3.42Å; F529-T532 PolarHBondContact O-N 2.91Å
530	N	41	Very low	64.8	Low	128 Å²	128	66.1 Å²	66.1	68%	0.684	35%	0.354	S	S	*	.	S	Bend	trans	-74.8	54.6	-177.7	-84.7	6.7	0	0	0	113	N528 T532	N528-N530 VanDerWaalsContact C-N 3.27Å; N528-N530 PolarHBondContact O-N 3.29Å; N530-T532 WeakPolarHBondContact OD1-CG2 3.42Å
531	E	49.3	Very low	65.4	Low	81 Å²	81	75.2 Å²	75.2	38%	0.379	39%	0.392	S	S	.	.	S	Bend		-108.4	76.1	119.4	-69.9	-104.7	141.2	0	0	106.6	F529 H533 C582 K584	F529-E531 CarbonylContact O-C 3.6Å; F529-E531 VanDerWaalsContact O-C 3.27Å; F529-E531 PolarHBondContact O-N 3.42Å; E531-H533 PolarHBondContact O-N 2.99Å; E531-H533 VanDerWaalsContact O-N 3.15Å; E531-C582 HydrophobicContact CB-CB 3.76Å; E531-C582 VanDerWaalsContact O-CB 3.29Å; E531-C582 WeakPolarHBondContact O-CB 3.16Å; E531-K584 IonicContact OE1-NZ 2.66Å; E531-K584 PolarHBondContact OE1-NZ 3.25Å; E531-K584 WeakPolarHBondContact OE2-CE 3.48Å; E531-K584 IonicContact OE2-NZ 2.89Å; E531-K584 PolarHBondContact OE2-NZ 3.4Å
532	T	57	Low	66	Low	98 Å²	98	80.5 Å²	80.5	60%	0.601	40%	0.402	S	S	*	.			trans	-61.9	116.6	175.8	47.2	0	0	0	0	109	F529 N530 N534	F529-T532 PolarHBondContact O-N 2.91Å; N530-T532 WeakPolarHBondContact OD1-CG2 3.42Å; T532-N534 PolarHBondContact O-N 3.31Å; T532-N534 VanDerWaalsContact O-N 3.12Å
533	H	70	Confident	67	Low	28 Å²	28	85 Å²	85	13%	0.13	43%	0.431	C	S	.	.			trans	-50	119.5	178	-73.5	-87.1	0	0	0	111.4	E531 F535 C563 C566 T580 C582	E531-H533 PolarHBondContact O-N 2.99Å; E531-H533 VanDerWaalsContact O-N 3.15Å; H533-F535 HydrophobicContact CB-CD2 3.52Å; H533-F535 HydrophobicContact CB-CE1 4.33Å; H533-F535 HydrophobicContact CB-CE2 3.26Å; H533-F535 HydrophobicContact CB-CG 4.18Å; H533-F535 HydrophobicContact CB-CZ 3.68Å; H533-F535 AromaticContact CG-CE2 3.88Å; H533-F535 AromaticContact CG-CZ 3.96Å; H533-F535 WeakPolarHBondContact O-CD2 3.29Å; H533-F535 PolarHBondContact O-N 3.45Å; H533-C563 HydrophobicContact CB-CB 4.16Å; H533-C566 VanDerWaalsContact CE1-SG 3.51Å; H533-C566 PolarHBondContact ND1-SG 3.46Å; H533-T580 PolarHBondContact NE2-O 2.88Å; H533-C582 VanDerWaalsContact CE1-CA 3.48Å; H533-C582 WeakPolarHBondContact CE1-CA 3.31Å; H533-C582 PolarHBondContact ND1-SG 3.33Å; H533-C582 PolarHBondContact NE2-N 3.33Å
534	N	79.3	Confident	67.9	Low	71 Å²	71	85.7 Å²	85.7	38%	0.38	43%	0.434	S	S	.	.			trans	-72.5	75.5	177.2	-171.9	2.5	0	0	0	110.3	T532 H536 C563 K564 D565	T532-N534 PolarHBondContact O-N 3.31Å; T532-N534 VanDerWaalsContact O-N 3.12Å; N534-H536 PolarHBondContact O-CD2 2.89Å; N534-H536 VanDerWaalsContact O-CD2 3.31Å; N534-H536 PolarHBondContact OD1-NE2 2.66Å; N534-C563 PolarHBondContact N-SG 2.82Å; N534-C563 VanDerWaalsContact N-SG 3.44Å; N534-C563 WeakPolarHBondContact O-CA 3.47Å; N534-K564 PolarHBondContact O-N 3.38Å; N534-D565 WeakPolarHBondContact CB-OD2 3.42Å; N534-D565 PolarHBondContact ND2-OD2 2.84Å
535	F	83.3	Confident	69	Low	31 Å²	31	87.1 Å²	87.1	14%	0.136	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	118.8	-173.5	-83.9	-56	0	0	0	112.7	H533 Y561 H562 C563 I568 R575 V578	H533-F535 HydrophobicContact CB-CD2 3.52Å; H533-F535 HydrophobicContact CB-CE1 4.33Å; H533-F535 HydrophobicContact CB-CE2 3.26Å; H533-F535 HydrophobicContact CB-CG 4.18Å; H533-F535 HydrophobicContact CB-CZ 3.68Å; H533-F535 AromaticContact CG-CE2 3.88Å; H533-F535 AromaticContact CG-CZ 3.96Å; H533-F535 WeakPolarHBondContact O-CD2 3.29Å; H533-F535 PolarHBondContact O-N 3.45Å; F535-Y561 HydrophobicContact CB-CD1 4.11Å; F535-Y561 HydrophobicContact CB-CG 4.42Å; F535-H562 WeakPolarHBondContact CA-O 3.39Å; F535-C563 HydrophobicContact CD1-CB 3.97Å; F535-C563 HydrophobicContact CE1-CB 3.81Å; F535-C563 HydrophobicContact CZ-CB 4.44Å; F535-I568 HydrophobicContact CE1-CG2 3.74Å; F535-I568 HydrophobicContact CZ-CG2 3.76Å; F535-R575 HydrophobicContact CB-CG 4.43Å; F535-R575 HydrophobicContact CD2-CG 3.57Å; F535-R575 HydrophobicContact CE2-CG 3.95Å; F535-R575 HydrophobicContact CG-CG 4.05Å; F535-V578 HydrophobicContact CE2-CG2 4.24Å; F535-V578 HydrophobicContact CZ-CG2 3.95Å
536	H	83.1	Confident	70.6	Confident	67 Å²	67	84 Å²	84	31%	0.31	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	130.4	173.1	-68.8	-97.6	0	0	0	109.8	N534 T538 Y561 H562 K564	N534-H536 PolarHBondContact O-CD2 2.89Å; N534-H536 VanDerWaalsContact O-CD2 3.31Å; N534-H536 PolarHBondContact OD1-NE2 2.66Å; H536-T538 PolarHBondContact O-N 3.07Å; H536-T538 PolarHBondContact O-OG1 3.26Å; H536-Y561 WeakPolarHBondContact O-CA 3.45Å; H536-H562 PolarHBondContact N-O 2.78Å; H536-H562 PolarHBondContact O-N 2.78Å; H536-K564 WeakPolarHBondContact CD2-CD 3.39Å; H536-K564 VanDerWaalsContact CD2-CE 3.47Å; H536-K564 WeakPolarHBondContact CD2-CE 3.25Å; H536-K564 PolarHBondContact CD2-NZ 3.15Å; H536-K564 PolarHBondContact CE1-NZ 3.36Å; H536-K564 PolarHBondContact ND1-NZ 3.42Å; H536-K564 PolarHBondContact NE2-NZ 3.29Å
537	E	90.4	Very high	72.3	Confident	52 Å²	52	85.5 Å²	85.5	24%	0.243	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	126.8	174.6	-166.5	178.3	-141.7	0	0	109.2	K558 Y561	E537-K558 HydrophobicContact CG-CB 3.94Å; E537-K558 HydrophobicContact CG-CD 4.34Å; E537-K558 HydrophobicContact CG-CG 4.03Å; E537-K558 VanDerWaalsContact OE2-CD 3.31Å; E537-K558 WeakPolarHBondContact OE2-CD 3.38Å; E537-K558 WeakPolarHBondContact OE2-CE 3.37Å; E537-K558 IonicContact OE2-NZ 2.66Å; E537-K558 PolarHBondContact OE2-NZ 3.12Å; E537-Y561 HydrophobicContact CB-CD1 4.06Å; E537-Y561 HydrophobicContact CB-CE1 3.7Å; E537-Y561 HydrophobicContact CG-CE1 4.28Å
538	T	86.1	Confident	74	Confident	38 Å²	38	82.2 Å²	82.2	23%	0.233	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	132.5	-162.3	-67.2	0	0	0	0	111.1	H536 Y540 Q559 G560 H562	H536-T538 PolarHBondContact O-N 3.07Å; H536-T538 PolarHBondContact O-OG1 3.26Å; T538-Y540 HydrophobicContact CG2-CD1 4.15Å; T538-Y540 HydrophobicContact CG2-CD2 4.17Å; T538-Y540 HydrophobicContact CG2-CE1 3.93Å; T538-Y540 HydrophobicContact CG2-CE2 3.97Å; T538-Y540 HydrophobicContact CG2-CG 4.28Å; T538-Y540 WeakPolarHBondContact O-CD2 3.48Å; T538-Q559 PolarHBondContact O-N 3.22Å; T538-G560 PolarHBondContact N-O 2.86Å; T538-H562 HydrophobicContact CG2-CB 4.26Å; T538-H562 WeakPolarHBondContact OG1-CB 3.31Å
539	T	88.6	Confident	75.8	Confident	68 Å²	68	79.7 Å²	79.7	42%	0.417	40%	0.401	S	S	.	.			trans	-88	107.5	167.3	-68.2	0	0	0	0	108.9	I557 K558	T539-I557 HydrophobicContact CG2-CB 4.23Å; T539-I557 HydrophobicContact CG2-CG2 3.99Å; T539-K558 PolarHBondContact OG1-N 2.81Å
540	Y	85.1	Confident	77.4	Confident	29 Å²	29	77.3 Å²	77.3	11%	0.114	41%	0.407	C	S	.	.			trans	-81.1	122	179.9	-64.2	-88.9	0	0	0	109.9	T538 R542 T544 L553 Q559 Y561 H562 N569	T538-Y540 HydrophobicContact CG2-CD1 4.15Å; T538-Y540 HydrophobicContact CG2-CD2 4.17Å; T538-Y540 HydrophobicContact CG2-CE1 3.93Å; T538-Y540 HydrophobicContact CG2-CE2 3.97Å; T538-Y540 HydrophobicContact CG2-CG 4.28Å; T538-Y540 WeakPolarHBondContact O-CD2 3.48Å; Y540-R542 PolarHBondContact O-N 2.81Å; Y540-T544 HydrophobicContact CD1-CG2 3.74Å; Y540-T544 WeakPolarHBondContact CD1-OG1 3.46Å; Y540-T544 HydrophobicContact CE1-CG2 3.83Å; Y540-T544 HydrophobicContact CG-CG2 4.29Å; Y540-L553 HydrophobicContact CD2-CD1 3.89Å; Y540-L553 HydrophobicContact CE1-CD1 4.48Å; Y540-L553 HydrophobicContact CE2-CD1 3.48Å; Y540-L553 VanDerWaalsContact CE2-CD1 3.48Å; Y540-Q559 HydrophobicContact CD2-CB 4.24Å; Y540-Q559 PolarHBondContact O-NE2 2.82Å; Y540-Y561 VanDerWaalsContact OH-C 3.31Å; Y540-Y561 PolarHBondContact OH-O 3.31Å; Y540-H562 WeakPolarHBondContact OH-CB 3.17Å; Y540-N569 HydrophobicContact CE1-CB 4.4Å; Y540-N569 WeakPolarHBondContact CE1-OD1 3.44Å; Y540-N569 PolarHBondContact OH-OD1 3.02Å
541	K	84.3	Confident	79	Confident	205 Å²	205	72.5 Å²	72.5	89%	0.891	39%	0.387	S	S	*	.	S	Bend	trans	-82.7	7.5	178.1	-60.6	-172.3	179.4	-175.1	0	113.7
542	R	82.8	Confident	80.7	Confident	207 Å²	207	71.5 Å²	71.5	78%	0.781	38%	0.381	S	S	*	.	S	Bend	trans	-145.9	152.7	-178.5	-65.1	-172.6	179.6	106.9	0.3	109.4	Y540 T544	Y540-R542 PolarHBondContact O-N 2.81Å; R542-T544 PolarHBondContact O-N 3.1Å; R542-T544 VanDerWaalsContact O-N 3.15Å; R542-T544 PolarHBondContact O-OG1 3.11Å
543	P	85.4	Confident	82.1	Confident	104 Å²	104	67 Å²	67	68%	0.675	35%	0.354	S	S	*	.			trans	-50.4	119.9	169.8	-27	36.2	0	0	0	110.7	F552	P543-F552 HydrophobicContact CB-CE2 3.66Å; P543-F552 HydrophobicContact CB-CZ 4.01Å
544	T	84.1	Confident	82.4	Confident	29 Å²	29	73 Å²	73	18%	0.178	38%	0.376	C	S	.	.			trans	-134.6	146.7	-174.6	-53	0	0	0	0	109.5	Y540 R542 F552 L553 N569	Y540-T544 HydrophobicContact CD1-CG2 3.74Å; Y540-T544 WeakPolarHBondContact CD1-OG1 3.46Å; Y540-T544 HydrophobicContact CE1-CG2 3.83Å; Y540-T544 HydrophobicContact CG-CG2 4.29Å; R542-T544 PolarHBondContact O-N 3.1Å; R542-T544 VanDerWaalsContact O-N 3.15Å; R542-T544 PolarHBondContact O-OG1 3.11Å; T544-F552 WeakPolarHBondContact O-CD2 3.42Å; T544-F552 WeakPolarHBondContact O-CE2 3.49Å; T544-L553 HydrophobicContact CG2-CD1 3.82Å; T544-L553 WeakPolarHBondContact O-CB 2.93Å; T544-L553 PolarHBondContact O-N 2.82Å; T544-N569 HydrophobicContact CG2-CB 4.26Å
545	F	86.6	Confident	82.2	Confident	114 Å²	114	71.1 Å²	71.1	50%	0.5	37%	0.372	S	S	.	.	B	Isolated β-bridge	trans	-115.7	160.6	-177.6	-63.4	-99.3	0	0	0	110.5	G550 F552	F545-G550 WeakPolarHBondContact CD1-O 3.29Å; F545-F552 HydrophobicContact CD1-CB 3.98Å; F545-F552 AromaticContact CD1-CD2 3.93Å; F545-F552 HydrophobicContact CD1-CD2 3.93Å; F545-F552 HydrophobicContact CD1-CG 4.49Å; F545-F552 HydrophobicContact CD2-CD2 4.24Å; F545-F552 HydrophobicContact CE1-CB 3.9Å; F545-F552 AromaticContact CE1-CD2 3.65Å; F545-F552 HydrophobicContact CE1-CD2 3.65Å; F545-F552 HydrophobicContact CE1-CG 4.24Å; F545-F552 AromaticContact CE2-CD2 3.97Å; F545-F552 HydrophobicContact CE2-CD2 3.97Å; F545-F552 HydrophobicContact CE2-CE2 4.33Å; F545-F552 HydrophobicContact CG-CD2 4.22Å; F545-F552 AromaticContact CZ-CD2 3.67Å; F545-F552 HydrophobicContact CZ-CD2 3.67Å; F545-F552 HydrophobicContact CZ-CE2 4.3Å
546	C	86.8	Confident	81.5	Confident	1 Å²	1	75.6 Å²	75.6	1%	0.007	40%	0.402	C	S	.	.			trans	-84.1	115.4	175.7	176.6	0	0	0	0	110	T548 C549 G550 G551 L553 N569 C570 H571 C574	C546-T548 PolarHBondContact O-N 3.49Å; C546-C549 PolarHBondContact O-N 3.27Å; C546-G550 WeakPolarHBondContact O-CA 3.42Å; C546-G550 PolarHBondContact O-N 3.49Å; C546-G551 WeakPolarHBondContact CB-O 3.49Å; C546-G551 PolarHBondContact N-O 2.78Å; C546-L553 HydrophobicContact CB-CD2 3.8Å; C546-N569 CarbonylContact C-O 3.52Å; C546-N569 WeakPolarHBondContact CA-O 3.45Å; C546-C570 VanDerWaalsContact SG-CA 3.56Å; C546-H571 VanDerWaalsContact CB-CE1 3.41Å; C546-H571 WeakPolarHBondContact CB-CE1 3.39Å; C546-H571 VanDerWaalsContact CB-ND1 3.31Å; C546-H571 WeakPolarHBondContact CB-ND1 3.47Å; C546-C574 VanDerWaalsContact SG-SG 3.67Å
547	D	80.1	Confident	81.4	Confident	94 Å²	94	76.7 Å²	76.7	50%	0.503	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-11.5	-179.7	-59.6	-49.6	0	0	0	112.8	I568 N569	D547-I568 HydrophobicContact CB-CD1 4Å; D547-I568 HydrophobicContact CB-CG1 3.52Å; D547-I568 WeakPolarHBondContact OD2-CG1 3.21Å; D547-N569 PolarHBondContact N-O 3.31Å; D547-N569 WeakPolarHBondContact OD2-CB 3.48Å; D547-N569 PolarHBondContact OD2-N 3.13Å; D547-N569 PolarHBondContact OD2-ND2 3.4Å
548	T	74.6	Confident	81.1	Confident	53 Å²	53	77.1 Å²	77.1	33%	0.325	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-24.7	179.2	-33.5	0	0	0	0	113.9	C546 C574 V578	C546-T548 PolarHBondContact O-N 3.49Å; T548-C574 HydrophobicContact CG2-CB 4.24Å; T548-V578 HydrophobicContact CG2-CG2 4.29Å
549	C	74.3	Confident	81.1	Confident	70 Å²	70	76 Å²	76	47%	0.473	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.8	-1.2	-174.1	72.5	0	0	0	0	114.9	C546 G551 H571	C546-C549 PolarHBondContact O-N 3.27Å; C549-G551 PolarHBondContact O-N 3.32Å; C549-G551 VanDerWaalsContact O-N 3.07Å; C549-G551 PolarHBondContact SG-N 3.44Å; C549-H571 VanDerWaalsContact SG-CE1 3.55Å; C549-H571 PolarHBondContact SG-ND1 3.02Å; C549-H571 VanDerWaalsContact SG-ND1 3.42Å
550	G	74.1	Confident	81.2	Confident	56 Å²	56	72.9 Å²	72.9	58%	0.577	38%	0.384	S	S	*	.			trans	70.4	-9.1	-175.4	0	0	0	0	0	115.1	F545 C546	F545-G550 WeakPolarHBondContact CD1-O 3.29Å; C546-G550 WeakPolarHBondContact O-CA 3.42Å; C546-G550 PolarHBondContact O-N 3.49Å
551	G	74.8	Confident	81.4	Confident	27 Å²	27	72.9 Å²	72.9	28%	0.278	38%	0.384	S	S	.	.			trans	-73.8	146.3	-177.2	0	0	0	0	0	113.5	C546 C549 H571	C546-G551 WeakPolarHBondContact CB-O 3.49Å; C546-G551 PolarHBondContact N-O 2.78Å; C549-G551 PolarHBondContact O-N 3.32Å; C549-G551 VanDerWaalsContact O-N 3.07Å; C549-G551 PolarHBondContact SG-N 3.44Å; G551-H571 PolarHBondContact O-CE1 3.27Å
552	F	84.1	Confident	81.6	Confident	59 Å²	59	65.9 Å²	65.9	26%	0.259	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-65	141.5	-179.8	-170.9	-113.4	0	0	0	113.1	P543 T544 F545 W554 H571	P543-F552 HydrophobicContact CB-CE2 3.66Å; P543-F552 HydrophobicContact CB-CZ 4.01Å; T544-F552 WeakPolarHBondContact O-CD2 3.42Å; T544-F552 WeakPolarHBondContact O-CE2 3.49Å; F545-F552 HydrophobicContact CD1-CB 3.98Å; F545-F552 AromaticContact CD1-CD2 3.93Å; F545-F552 HydrophobicContact CD1-CD2 3.93Å; F545-F552 HydrophobicContact CD1-CG 4.49Å; F545-F552 HydrophobicContact CD2-CD2 4.24Å; F545-F552 HydrophobicContact CE1-CB 3.9Å; F545-F552 AromaticContact CE1-CD2 3.65Å; F545-F552 HydrophobicContact CE1-CD2 3.65Å; F545-F552 HydrophobicContact CE1-CG 4.24Å; F545-F552 AromaticContact CE2-CD2 3.97Å; F545-F552 HydrophobicContact CE2-CD2 3.97Å; F545-F552 HydrophobicContact CE2-CE2 4.33Å; F545-F552 HydrophobicContact CG-CD2 4.22Å; F545-F552 AromaticContact CZ-CD2 3.67Å; F545-F552 HydrophobicContact CZ-CD2 3.67Å; F545-F552 HydrophobicContact CZ-CE2 4.3Å; F552-W554 AromaticContact CD1-CD2 3.77Å; F552-W554 HydrophobicContact CD1-CD2 3.77Å; F552-W554 AromaticContact CD1-CE2 3.78Å; F552-W554 HydrophobicContact CD1-CE3 4.2Å; F552-W554 HydrophobicContact CD1-CG 4.01Å; F552-W554 HydrophobicContact CD1-CZ2 4.23Å; F552-W554 HydrophobicContact CE1-CD2 4.39Å; F552-W554 HydrophobicContact CE1-CE3 4.4Å; F552-W554 VanDerWaalsContact O-CD1 3.3Å; F552-W554 PolarHBondContact O-N 3.37Å; F552-W554 VanDerWaalsContact O-N 3.15Å; F552-H571 PolarHBondContact O-NE2 2.83Å
553	L	85.8	Confident	81.9	Confident	5 Å²	5	56 Å²	56	3%	0.026	32%	0.317	C	S	.	.			trans	-80.7	89.6	174.8	-59.8	-173.3	0	0	0	109.9	Y540 T544 C546 Q559 N569 H571	Y540-L553 HydrophobicContact CD2-CD1 3.89Å; Y540-L553 HydrophobicContact CE1-CD1 4.48Å; Y540-L553 HydrophobicContact CE2-CD1 3.48Å; Y540-L553 VanDerWaalsContact CE2-CD1 3.48Å; T544-L553 HydrophobicContact CG2-CD1 3.82Å; T544-L553 WeakPolarHBondContact O-CB 2.93Å; T544-L553 PolarHBondContact O-N 2.82Å; C546-L553 HydrophobicContact CB-CD2 3.8Å; L553-Q559 HydrophobicContact CB-CB 3.88Å; L553-Q559 WeakPolarHBondContact O-CB 3.42Å; L553-N569 HydrophobicContact CD1-CB 4.44Å; L553-H571 VanDerWaalsContact CD2-CD2 3.47Å; L553-H571 WeakPolarHBondContact CD2-CD2 3.33Å
554	W	76.9	Confident	81.6	Confident	154 Å²	154	57.3 Å²	57.3	58%	0.583	31%	0.312	S	S	*	.			trans	-73.6	135.7	-178.5	-71.2	96.2	0	0	0	113.1	F552 Q647	F552-W554 AromaticContact CD1-CD2 3.77Å; F552-W554 HydrophobicContact CD1-CD2 3.77Å; F552-W554 AromaticContact CD1-CE2 3.78Å; F552-W554 HydrophobicContact CD1-CE3 4.2Å; F552-W554 HydrophobicContact CD1-CG 4.01Å; F552-W554 HydrophobicContact CD1-CZ2 4.23Å; F552-W554 HydrophobicContact CE1-CD2 4.39Å; F552-W554 HydrophobicContact CE1-CE3 4.4Å; F552-W554 VanDerWaalsContact O-CD1 3.3Å; F552-W554 PolarHBondContact O-N 3.37Å; F552-W554 VanDerWaalsContact O-N 3.15Å; W554-Q647 WeakPolarHBondContact O-CA 3.4Å
555	G	74.4	Confident	81.2	Confident	30 Å²	30	58.5 Å²	58.5	31%	0.309	32%	0.318	S	S	.	.	S	Bend	trans	143.5	167	172	0	0	0	0	0	113.1	Q559 T646	G555-Q559 VanDerWaalsContact C-CG 3.46Å; G555-Q559 WeakPolarHBondContact O-CG 3.43Å; G555-Q559 PolarHBondContact O-NE2 3.05Å; G555-T646 VanDerWaalsContact CA-OG1 3.23Å; G555-T646 WeakPolarHBondContact CA-OG1 3.44Å
556	V	70.3	Confident	80.8	Confident	126 Å²	126	54.2 Å²	54.2	76%	0.764	30%	0.301	S	S	*	.	S	Bend	trans	-89.6	-34.1	176.6	-175.4	0	0	0	0	111.1	Q559 T646	V556-Q559 PolarHBondContact O-NE2 2.86Å; V556-T646 PolarHBondContact N-OG1 3Å
557	I	80.4	Confident	80.7	Confident	90 Å²	90	55.5 Å²	55.5	46%	0.462	32%	0.315	S	S	.	.	S	Bend	trans	-143.3	158	175.9	59.5	173.4	0	0	0	109.8	T539 Q559 T646	T539-I557 HydrophobicContact CG2-CB 4.23Å; T539-I557 HydrophobicContact CG2-CG2 3.99Å; I557-Q559 VanDerWaalsContact C-N 3.31Å; I557-Q559 PolarHBondContact O-N 2.95Å; I557-T646 HydrophobicContact CG1-CG2 4.04Å; I557-T646 PolarHBondContact N-OG1 3.11Å; I557-T646 PolarHBondContact O-OG1 2.87Å
558	K	83.9	Confident	81	Confident	61 Å²	61	52.3 Å²	52.3	27%	0.265	30%	0.297	S	S	.	.			trans	50.9	45.4	179.6	-64.7	-179.8	160.6	-141.2	0	113.1	E537 T539 G560 D643	E537-K558 HydrophobicContact CG-CB 3.94Å; E537-K558 HydrophobicContact CG-CD 4.34Å; E537-K558 HydrophobicContact CG-CG 4.03Å; E537-K558 VanDerWaalsContact OE2-CD 3.31Å; E537-K558 WeakPolarHBondContact OE2-CD 3.38Å; E537-K558 WeakPolarHBondContact OE2-CE 3.37Å; E537-K558 IonicContact OE2-NZ 2.66Å; E537-K558 PolarHBondContact OE2-NZ 3.12Å; T539-K558 PolarHBondContact OG1-N 2.81Å; K558-G560 PolarHBondContact O-N 2.91Å; K558-D643 IonicContact NZ-OD1 2.66Å; K558-D643 PolarHBondContact NZ-OD1 3.37Å; K558-D643 IonicContact NZ-OD2 3.63Å
559	Q	86.6	Confident	81.7	Confident	14 Å²	14	51.1 Å²	51.1	7%	0.065	29%	0.289	C	S	.	.			trans	-72.3	-12.6	-173.2	-56.4	94.1	-25.2	0	0	114.4	T538 Y540 L553 G555 V556 I557	T538-Q559 PolarHBondContact O-N 3.22Å; Y540-Q559 HydrophobicContact CD2-CB 4.24Å; Y540-Q559 PolarHBondContact O-NE2 2.82Å; L553-Q559 HydrophobicContact CB-CB 3.88Å; L553-Q559 WeakPolarHBondContact O-CB 3.42Å; G555-Q559 VanDerWaalsContact C-CG 3.46Å; G555-Q559 WeakPolarHBondContact O-CG 3.43Å; G555-Q559 PolarHBondContact O-NE2 3.05Å; V556-Q559 PolarHBondContact O-NE2 2.86Å; I557-Q559 VanDerWaalsContact C-N 3.31Å; I557-Q559 PolarHBondContact O-N 2.95Å
560	G	89.1	Confident	82.5	Confident	3 Å²	3	47.8 Å²	47.8	3%	0.031	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.9	-171.5	178.2	0	0	0	0	0	112.5	T538 K558 C570	T538-G560 PolarHBondContact N-O 2.86Å; K558-G560 PolarHBondContact O-N 2.91Å; G560-C570 CarbonylContact C-O 3.57Å; G560-C570 VanDerWaalsContact CA-O 3.25Å; G560-C570 WeakPolarHBondContact CA-O 3.44Å
561	Y	90.8	Very high	83.1	Confident	28 Å²	28	45.5 Å²	45.5	11%	0.11	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	146.7	175.6	-68.3	-95.7	0	0	0	110.6	F535 H536 E537 Y540 N569 C570 R572	F535-Y561 HydrophobicContact CB-CD1 4.11Å; F535-Y561 HydrophobicContact CB-CG 4.42Å; H536-Y561 WeakPolarHBondContact O-CA 3.45Å; E537-Y561 HydrophobicContact CB-CD1 4.06Å; E537-Y561 HydrophobicContact CB-CE1 3.7Å; E537-Y561 HydrophobicContact CG-CE1 4.28Å; Y540-Y561 VanDerWaalsContact OH-C 3.31Å; Y540-Y561 PolarHBondContact OH-O 3.31Å; Y561-N569 WeakPolarHBondContact O-CA 3.41Å; Y561-C570 PolarHBondContact N-O 2.77Å; Y561-C570 PolarHBondContact O-N 2.91Å; Y561-R572 HydrophobicContact CD2-CB 4.43Å; Y561-R572 HydrophobicContact CE2-CB 3.87Å; Y561-R572 HydrophobicContact CE2-CG 3.86Å
562	H	88.6	Confident	83.4	Confident	59 Å²	59	49.9 Å²	49.9	27%	0.273	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.3	175.4	-179.7	73.4	0	0	0	109.4	F535 H536 T538 Y540 G567 I568 N569	F535-H562 WeakPolarHBondContact CA-O 3.39Å; H536-H562 PolarHBondContact N-O 2.78Å; H536-H562 PolarHBondContact O-N 2.78Å; T538-H562 HydrophobicContact CG2-CB 4.26Å; T538-H562 WeakPolarHBondContact OG1-CB 3.31Å; Y540-H562 WeakPolarHBondContact OH-CB 3.17Å; H562-G567 PolarHBondContact CE1-O 3.2Å; H562-I568 CarbonylContact C-O 3.58Å; H562-I568 WeakPolarHBondContact CA-O 3.47Å; H562-N569 PolarHBondContact ND1-OD1 3.34Å
563	C	87.8	Confident	83	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	119.3	173.7	-177.9	0	0	0	0	110.8	H533 N534 F535 D565 G567 I568 C582	H533-C563 HydrophobicContact CB-CB 4.16Å; N534-C563 PolarHBondContact N-SG 2.82Å; N534-C563 VanDerWaalsContact N-SG 3.44Å; N534-C563 WeakPolarHBondContact O-CA 3.47Å; F535-C563 HydrophobicContact CD1-CB 3.97Å; F535-C563 HydrophobicContact CE1-CB 3.81Å; F535-C563 HydrophobicContact CZ-CB 4.44Å; C563-D565 PolarHBondContact O-N 3.46Å; C563-G567 WeakPolarHBondContact O-CA 3.46Å; C563-G567 PolarHBondContact O-N 2.97Å; C563-I568 HydrophobicContact CB-CG2 3.77Å; C563-I568 PolarHBondContact N-O 3.36Å; C563-C582 PolarHBondContact SG-SG 3.33Å
564	K	78.7	Confident	82.6	Confident	130 Å²	130	52.2 Å²	52.2	57%	0.565	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.6	-180	-77.6	-179.1	177.5	155.6	0	114.9	N534 H536	N534-K564 PolarHBondContact O-N 3.38Å; H536-K564 WeakPolarHBondContact CD2-CD 3.39Å; H536-K564 VanDerWaalsContact CD2-CE 3.47Å; H536-K564 WeakPolarHBondContact CD2-CE 3.25Å; H536-K564 PolarHBondContact CD2-NZ 3.15Å; H536-K564 PolarHBondContact CE1-NZ 3.36Å; H536-K564 PolarHBondContact ND1-NZ 3.42Å; H536-K564 PolarHBondContact NE2-NZ 3.29Å
565	D	75.6	Confident	82.5	Confident	55 Å²	55	49.4 Å²	49.4	29%	0.294	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-40.6	-171.1	-65.2	-48	0	0	0	113.4	N534 C563 K584 K585	N534-D565 WeakPolarHBondContact CB-OD2 3.42Å; N534-D565 PolarHBondContact ND2-OD2 2.84Å; C563-D565 PolarHBondContact O-N 3.46Å; D565-K584 HydrophobicContact CB-CG 3.89Å; D565-K584 WeakPolarHBondContact O-CA 3.47Å; D565-K585 PolarHBondContact O-N 3.48Å
566	C	78.9	Confident	82.1	Confident	23 Å²	23	54 Å²	54	16%	0.155	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-23.6	177.7	71.2	0	0	0	0	114.5	H533 I568 Q583 K585	H533-C566 VanDerWaalsContact CE1-SG 3.51Å; H533-C566 PolarHBondContact ND1-SG 3.46Å; C566-I568 VanDerWaalsContact SG-CG2 3.56Å; C566-I568 PolarHBondContact SG-N 3.29Å; C566-Q583 VanDerWaalsContact CB-O 3.29Å; C566-Q583 WeakPolarHBondContact CB-O 3.23Å; C566-K585 WeakPolarHBondContact O-CE 3.16Å; C566-K585 PolarHBondContact O-NZ 2.66Å
567	G	84.6	Confident	81.9	Confident	28 Å²	28	53.2 Å²	53.2	29%	0.289	26%	0.259	S	S	.	.			trans	92.5	6.2	-178.5	0	0	0	0	0	116.5	H562 C563 N569	H562-G567 PolarHBondContact CE1-O 3.2Å; C563-G567 WeakPolarHBondContact O-CA 3.46Å; C563-G567 PolarHBondContact O-N 2.97Å; G567-N569 PolarHBondContact O-ND2 3.47Å
568	I	86.7	Confident	81	Confident	27 Å²	27	50 Å²	50	14%	0.138	24%	0.244	C	C	.	.			trans	-69.6	146.3	-178.8	-156.4	173.5	0	0	0	112.4	F535 D547 H562 C563 C566 V578	F535-I568 HydrophobicContact CE1-CG2 3.74Å; F535-I568 HydrophobicContact CZ-CG2 3.76Å; D547-I568 HydrophobicContact CB-CD1 4Å; D547-I568 HydrophobicContact CB-CG1 3.52Å; D547-I568 WeakPolarHBondContact OD2-CG1 3.21Å; H562-I568 CarbonylContact C-O 3.58Å; H562-I568 WeakPolarHBondContact CA-O 3.47Å; C563-I568 HydrophobicContact CB-CG2 3.77Å; C563-I568 PolarHBondContact N-O 3.36Å; C566-I568 VanDerWaalsContact SG-CG2 3.56Å; C566-I568 PolarHBondContact SG-N 3.29Å; I568-V578 HydrophobicContact CD1-CG1 4.07Å
569	N	89.6	Confident	79.5	Confident	28 Å²	28	58.6 Å²	58.6	15%	0.15	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	129.7	-170.3	-44.9	-84.8	0	0	0	109.5	Y540 T544 C546 D547 L553 Y561 H562 G567	Y540-N569 HydrophobicContact CE1-CB 4.4Å; Y540-N569 WeakPolarHBondContact CE1-OD1 3.44Å; Y540-N569 PolarHBondContact OH-OD1 3.02Å; T544-N569 HydrophobicContact CG2-CB 4.26Å; C546-N569 CarbonylContact C-O 3.52Å; C546-N569 WeakPolarHBondContact CA-O 3.45Å; D547-N569 PolarHBondContact N-O 3.31Å; D547-N569 WeakPolarHBondContact OD2-CB 3.48Å; D547-N569 PolarHBondContact OD2-N 3.13Å; D547-N569 PolarHBondContact OD2-ND2 3.4Å; L553-N569 HydrophobicContact CD1-CB 4.44Å; Y561-N569 WeakPolarHBondContact O-CA 3.41Å; H562-N569 PolarHBondContact ND1-OD1 3.34Å; G567-N569 PolarHBondContact O-ND2 3.47Å
570	C	90	Very high	78.2	Confident	0 Å²	0	62 Å²	62	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	156.2	-177	70.6	0	0	0	0	114.5	C546 G560 Y561 C574 R575 V578	C546-C570 VanDerWaalsContact SG-CA 3.56Å; G560-C570 CarbonylContact C-O 3.57Å; G560-C570 VanDerWaalsContact CA-O 3.25Å; G560-C570 WeakPolarHBondContact CA-O 3.44Å; Y561-C570 PolarHBondContact N-O 2.77Å; Y561-C570 PolarHBondContact O-N 2.91Å; C570-C574 HydrophobicContact CB-CB 4.06Å; C570-R575 VanDerWaalsContact SG-CA 3.55Å; C570-V578 HydrophobicContact CB-CG2 4.42Å
571	H	87.3	Confident	76.9	Confident	8 Å²	8	64.3 Å²	64.3	4%	0.037	32%	0.32	C	S	.	.			trans	-61.8	160.1	166.5	-61.2	113.7	0	0	0	111.4	C546 C549 G551 F552 L553 H573 C574 R575 Q647	C546-H571 VanDerWaalsContact CB-CE1 3.41Å; C546-H571 WeakPolarHBondContact CB-CE1 3.39Å; C546-H571 VanDerWaalsContact CB-ND1 3.31Å; C546-H571 WeakPolarHBondContact CB-ND1 3.47Å; C549-H571 VanDerWaalsContact SG-CE1 3.55Å; C549-H571 PolarHBondContact SG-ND1 3.02Å; C549-H571 VanDerWaalsContact SG-ND1 3.42Å; G551-H571 PolarHBondContact O-CE1 3.27Å; F552-H571 PolarHBondContact O-NE2 2.83Å; L553-H571 VanDerWaalsContact CD2-CD2 3.47Å; L553-H571 WeakPolarHBondContact CD2-CD2 3.33Å; H571-H573 VanDerWaalsContact C-N 3.26Å; H571-H573 VanDerWaalsContact CB-CE1 3.42Å; H571-H573 WeakPolarHBondContact CB-CE1 3.22Å; H571-H573 AromaticContact CE1-CE1 3.63Å; H571-H573 AromaticContact CG-CE1 3.22Å; H571-H573 AromaticContact CG-NE2 3.91Å; H571-H573 AromaticContact ND1-CE1 2.82Å; H571-H573 PolarHBondContact ND1-CE1 2.87Å; H571-H573 PolarHBondContact O-N 2.93Å; H571-C574 HydrophobicContact CB-CB 4.18Å; H571-C574 PolarHBondContact O-N 3.48Å; H571-C574 VanDerWaalsContact O-N 3.11Å; H571-R575 PolarHBondContact O-N 2.94Å; H571-R575 VanDerWaalsContact O-N 3.1Å; H571-Q647 PolarHBondContact CD2-NE2 3.22Å
572	R	82.1	Confident	76.1	Confident	119 Å²	119	63.3 Å²	63.3	45%	0.449	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-37.1	174.7	-177.3	163.2	179.1	158.4	-4.4	113.3	Y561	Y561-R572 HydrophobicContact CD2-CB 4.43Å; Y561-R572 HydrophobicContact CE2-CB 3.87Å; Y561-R572 HydrophobicContact CE2-CG 3.86Å
573	H	75.3	Confident	75.1	Confident	106 Å²	106	67.1 Å²	67.1	49%	0.491	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-21.7	177.2	55.5	59	0	0	0	114.1	H571 Q647	H571-H573 VanDerWaalsContact C-N 3.26Å; H571-H573 VanDerWaalsContact CB-CE1 3.42Å; H571-H573 WeakPolarHBondContact CB-CE1 3.22Å; H571-H573 AromaticContact CE1-CE1 3.63Å; H571-H573 AromaticContact CG-CE1 3.22Å; H571-H573 AromaticContact CG-NE2 3.91Å; H571-H573 AromaticContact ND1-CE1 2.82Å; H571-H573 PolarHBondContact ND1-CE1 2.87Å; H571-H573 PolarHBondContact O-N 2.93Å; H573-Q647 PolarHBondContact NE2-NE2 3.49Å
574	C	76.7	Confident	73.6	Confident	8 Å²	8	72.2 Å²	72.2	5%	0.054	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-21	175.4	-71.1	0	0	0	0	113.1	C546 T548 C570 H571 D576 L577 V578	C546-C574 VanDerWaalsContact SG-SG 3.67Å; T548-C574 HydrophobicContact CG2-CB 4.24Å; C570-C574 HydrophobicContact CB-CB 4.06Å; H571-C574 HydrophobicContact CB-CB 4.18Å; H571-C574 PolarHBondContact O-N 3.48Å; H571-C574 VanDerWaalsContact O-N 3.11Å; C574-D576 VanDerWaalsContact C-N 3.34Å; C574-D576 PolarHBondContact O-N 3.2Å; C574-L577 CarbonylContact O-C 3.58Å; C574-L577 WeakPolarHBondContact O-CB 3.43Å; C574-L577 PolarHBondContact O-N 2.91Å; C574-L577 WeakPolarHBondContact O-CA 3.38Å; C574-V578 WeakPolarHBondContact O-CG2 3.37Å; C574-V578 PolarHBondContact O-N 3.27Å
575	R	74.5	Confident	72.1	Confident	95 Å²	95	74 Å²	74	36%	0.358	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-47.6	-50.4	-175.3	-170	-172.3	106	146.6	9.3	113.9	F535 C570 H571 L577 V578	F535-R575 HydrophobicContact CB-CG 4.43Å; F535-R575 HydrophobicContact CD2-CG 3.57Å; F535-R575 HydrophobicContact CE2-CG 3.95Å; F535-R575 HydrophobicContact CG-CG 4.05Å; C570-R575 VanDerWaalsContact SG-CA 3.55Å; H571-R575 PolarHBondContact O-N 2.94Å; H571-R575 VanDerWaalsContact O-N 3.1Å; R575-L577 PolarHBondContact O-N 3.15Å; R575-V578 WeakPolarHBondContact O-CG2 3.47Å
576	D	67.6	Low	70.4	Confident	126 Å²	126	79.9 Å²	79.9	67%	0.674	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-89.5	7.6	-175.9	-47.7	-38.9	0	0	0	111.8	C574	C574-D576 VanDerWaalsContact C-N 3.34Å; C574-D576 PolarHBondContact O-N 3.2Å
577	L	65.2	Low	68.2	Low	110 Å²	110	88 Å²	88	58%	0.576	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-111.5	4.5	174.8	-58.7	176.2	0	0	0	112.9	C574 R575 R579	C574-L577 CarbonylContact O-C 3.58Å; C574-L577 WeakPolarHBondContact O-CB 3.43Å; C574-L577 PolarHBondContact O-N 2.91Å; C574-L577 WeakPolarHBondContact O-CA 3.38Å; R575-L577 PolarHBondContact O-N 3.15Å; L577-R579 PolarHBondContact O-N 2.85Å
578	V	61.9	Low	65.5	Low	23 Å²	23	93.5 Å²	93.5	14%	0.139	45%	0.446	C	S	.	.			trans	-70.2	100.8	178.1	179	0	0	0	0	110	F535 T548 I568 C570 C574 R575 T580	F535-V578 HydrophobicContact CE2-CG2 4.24Å; F535-V578 HydrophobicContact CZ-CG2 3.95Å; T548-V578 HydrophobicContact CG2-CG2 4.29Å; I568-V578 HydrophobicContact CD1-CG1 4.07Å; C570-V578 HydrophobicContact CB-CG2 4.42Å; C574-V578 WeakPolarHBondContact O-CG2 3.37Å; C574-V578 PolarHBondContact O-N 3.27Å; R575-V578 WeakPolarHBondContact O-CG2 3.47Å; V578-T580 WeakPolarHBondContact CG1-OG1 3.48Å
579	R	51.6	Low	63	Low	240 Å²	240	98.8 Å²	98.8	91%	0.906	48%	0.48	S	S	*	.			trans	-82.5	-14.2	-176.8	-69	177.5	-179.1	163.7	-0.2	114.7	L577	L577-R579 PolarHBondContact O-N 2.85Å
580	T	58.8	Low	60.1	Low	85 Å²	85	104 Å²	104	52%	0.521	51%	0.512	S	S	.	.	S	Bend	trans	-74.8	132.3	172.7	40.5	0	0	0	0	109.6	H533 V578	H533-T580 PolarHBondContact NE2-O 2.88Å; V578-T580 WeakPolarHBondContact CG1-OG1 3.48Å
581	G	63.6	Low	57.2	Low	52 Å²	52	107.4 Å²	107.4	54%	0.536	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-64.3	151	171.8	0	0	0	0	0	111.1
582	C	72.4	Confident	54.4	Low	8 Å²	8	113.1 Å²	113.1	5%	0.054	59%	0.589	C	S	.	*	P	Polyproline II helix	trans	-69.6	137.3	169.4	-148.9	0	0	0	0	109.4	E531 H533 C563	E531-C582 HydrophobicContact CB-CB 3.76Å; E531-C582 VanDerWaalsContact O-CB 3.29Å; E531-C582 WeakPolarHBondContact O-CB 3.16Å; H533-C582 VanDerWaalsContact CE1-CA 3.48Å; H533-C582 WeakPolarHBondContact CE1-CA 3.31Å; H533-C582 PolarHBondContact ND1-SG 3.33Å; H533-C582 PolarHBondContact NE2-N 3.33Å; C563-C582 PolarHBondContact SG-SG 3.33Å
583	Q	67.3	Low	51.8	Low	139 Å²	139	113.3 Å²	113.3	65%	0.65	61%	0.607	S	S	*	*			trans	-130.4	119.7	167.5	-72.7	-166.7	-17.1	0	0	108.8	C566 K585	C566-Q583 VanDerWaalsContact CB-O 3.29Å; C566-Q583 WeakPolarHBondContact CB-O 3.23Å; Q583-K585 PolarHBondContact O-N 2.8Å
584	K	56.8	Low	49.8	Very low	107 Å²	107	114.4 Å²	114.4	47%	0.465	62%	0.623	S	S	.	*			trans	-70.7	120.5	-178.4	-73.7	152.8	-174.6	147.7	0	110.1	E531 D565 H586	E531-K584 IonicContact OE1-NZ 2.66Å; E531-K584 PolarHBondContact OE1-NZ 3.25Å; E531-K584 WeakPolarHBondContact OE2-CE 3.48Å; E531-K584 IonicContact OE2-NZ 2.89Å; E531-K584 PolarHBondContact OE2-NZ 3.4Å; D565-K584 HydrophobicContact CB-CG 3.89Å; D565-K584 WeakPolarHBondContact O-CA 3.47Å; K584-H586 VanDerWaalsContact O-N 3.13Å; K584-H586 PolarHBondContact O-N 2.66Å
585	K	48.3	Very low	47.5	Very low	167 Å²	167	119.4 Å²	119.4	73%	0.726	66%	0.657	S	S	*	*			trans	-70.2	109.5	172.6	-69.5	-179.6	178.7	171.4	0	109.2	D565 C566 Q583 K587	D565-K585 PolarHBondContact O-N 3.48Å; C566-K585 WeakPolarHBondContact O-CE 3.16Å; C566-K585 PolarHBondContact O-NZ 2.66Å; Q583-K585 PolarHBondContact O-N 2.8Å; K585-K587 PolarHBondContact O-N 3.07Å
586	H	38.7	Very low	45.4	Very low	178 Å²	178	121 Å²	121	82%	0.824	68%	0.678	S	S	*	*			trans	-56.3	121.6	172.2	-84.4	-95.7	0	0	0	109.9	K584 N588	K584-H586 VanDerWaalsContact O-N 3.13Å; K584-H586 PolarHBondContact O-N 2.66Å; H586-N588 PolarHBondContact O-N 2.89Å
587	K	33.8	Very low	43.6	Very low	194 Å²	194	121.7 Å²	121.7	84%	0.843	69%	0.689	S	S	*	*			trans	-73.2	90.8	175.4	-79	-174.5	174.6	179.5	0	110.3	K585 T589	K585-K587 PolarHBondContact O-N 3.07Å; K587-T589 PolarHBondContact O-N 2.99Å
588	N	28.3	Very low	41.8	Very low	144 Å²	144	119.5 Å²	119.5	77%	0.77	69%	0.693	S	S	*	*			trans	-73.2	119.4	158.8	-75.9	-5.8	0	0	0	108.6	H586 T590	H586-N588 PolarHBondContact O-N 2.89Å; N588-T590 PolarHBondContact O-N 2.86Å; N588-T590 VanDerWaalsContact O-N 3.11Å
589	T	33.5	Very low	40.4	Very low	138 Å²	138	124.9 Å²	124.9	85%	0.847	73%	0.728	S	S	*	*			trans	-86.7	78.6	-168.8	-50.4	0	0	0	0	112.2	K587	K587-T589 PolarHBondContact O-N 2.99Å
590	T	28.4	Very low	39.3	Very low	136 Å²	136	121.5 Å²	121.5	83%	0.834	73%	0.729	S	S	*	*			trans	-146.8	150.5	165.1	11.6	0	0	0	0	110.6	N588	N588-T590 PolarHBondContact O-N 2.86Å; N588-T590 VanDerWaalsContact O-N 3.11Å
591	G	28.8	Very low	37.8	Very low	73 Å²	73	122.7 Å²	122.7	75%	0.753	74%	0.74	S	S	*	*			trans	-83.8	175.3	-161.3	0	0	0	0	0	117.4
592	S	28.7	Very low	36.1	Very low	128 Å²	128	131 Å²	131	90%	0.895	76%	0.756	S	S	*	*			trans	75.8	134.8	173.8	-64.7	0	0	0	0	118.2
593	C	28.1	Very low	33.9	Very low	123 Å²	123	136.2 Å²	136.2	83%	0.831	79%	0.787	S	S	*	*			trans	-81.8	153	175.2	-50	0	0	0	0	111.7
594	P	32.1	Very low	32	Very low	128 Å²	128	139.5 Å²	139.5	83%	0.831	80%	0.799	S	S	*	*			trans	-112.9	155.5	139.7	-4	24.4	0	0	0	111.7
595	C	29.3	Very low	30.4	Very low	114 Å²	114	137.5 Å²	137.5	77%	0.77	81%	0.809	S	S	*	*			trans	-106.7	156.9	172.6	-68.4	0	0	0	0	111.4
596	T	30.5	Very low	29.2	Very low	128 Å²	128	137.8 Å²	137.8	79%	0.785	82%	0.818	S	S	*	*			trans	9.2	124.6	156.1	51.8	0	0	0	0	119.2
597	P	29.6	Very low	28.4	Very low	140 Å²	140	133.6 Å²	133.6	91%	0.909	81%	0.809	S	S	*	*			trans	-71.4	146.8	166.8	31.9	-34.4	0	0	0	112
598	G	27	Very low	27.9	Very low	65 Å²	65	136 Å²	136	67%	0.67	81%	0.813	S	S	*	*			trans	-147.3	153	169.2	0	0	0	0	0	109.3
599	P	33.8	Very low	27.6	Very low	135 Å²	135	133.7 Å²	133.7	88%	0.877	81%	0.808	S	S	*	*			trans	-76.7	150.3	-162.6	29.7	-36.2	0	0	0	114.9
600	D	26.8	Very low	27.1	Very low	170 Å²	170	131.2 Å²	131.2	91%	0.909	80%	0.796	S	S	*	*			trans	-65.7	128.9	-178.7	-76.5	-68.4	0	0	0	115
601	S	27.9	Very low	27	Very low	110 Å²	110	132.6 Å²	132.6	77%	0.769	79%	0.793	S	S	*	*			trans	-161.8	100.2	144.9	-165.2	0	0	0	0	114.6
602	R	29.1	Very low	26.9	Very low	227 Å²	227	137.7 Å²	137.7	86%	0.857	80%	0.798	S	S	*	*			trans	47.2	104.2	139.3	-64.6	-177.3	173.9	-173.7	-1.9	121.9
603	T	26.2	Very low	26.8	Very low	116 Å²	116	138.2 Å²	138.2	71%	0.712	79%	0.786	S	S	*	*				84.9	118.5	113.7	-53.7	0	0	0	0	121.7
604	K	26.9	Very low	26.7	Very low	208 Å²	208	135.7 Å²	135.7	90%	0.904	77%	0.774	S	S	*	*			trans	68	148	165.1	-67.6	169.8	-179.2	-179	0	116.7
605	G	22.8	Very low	26.2	Very low	65 Å²	65	138.6 Å²	138.6	67%	0.67	77%	0.774	S	S	*	*			cis	159.2	149.4	-8.3	0	0	0	0	0	112.8
606	N	23.8	Very low	26	Very low	173 Å²	173	138.9 Å²	138.9	93%	0.925	77%	0.772	S	S	*	*			trans	65	163.9	-178.9	-65.6	13.8	0	0	0	115
607	S	21.8	Very low	25.9	Very low	91 Å²	91	141.2 Å²	141.2	64%	0.636	77%	0.771	S	S	*	*			cis	-172.9	161.1	-27.6	178.6	0	0	0	0	108.3
608	W	21.8	Very low	26.1	Very low	245 Å²	245	140.5 Å²	140.5	93%	0.928	77%	0.767	S	S	*	*			trans	64.8	160.3	171.6	-83.9	-33.7	0	0	0	117
609	S	22.3	Very low	26	Very low	94 Å²	94	145.3 Å²	145.3	66%	0.657	77%	0.772	S	S	*	*			cis	-167.1	179.9	-30.1	-142	0	0	0	0	109.9
610	S	23.9	Very low	25.5	Very low	86 Å²	86	144.4 Å²	144.4	60%	0.601	77%	0.769	S	S	*	*			trans	73.7	128.2	167.1	-64.4	0	0	0	0	115.9
611	E	24.9	Very low	25.4	Very low	165 Å²	165	142.2 Å²	142.2	77%	0.771	76%	0.757	S	S	*	*				71.7	137.1	65.1	-60.4	151.6	156.7	0	0	111.5
612	E	27.4	Very low	25.3	Very low	180 Å²	180	144.8 Å²	144.8	84%	0.841	76%	0.762	S	S	*	*			cis	-146.6	-170.2	-6.3	-120.7	-169.7	139.3	0	0	108.1
613	E	26.7	Very low	25.1	Very low	139 Å²	139	139.4 Å²	139.4	65%	0.65	76%	0.755	S	S	*	*			cis	-142.3	-154.1	15.3	-156.3	-118.2	97.8	0	0	109.7
614	A	25.4	Very low	25	Very low	70 Å²	70	140.9 Å²	140.9	58%	0.579	75%	0.754	S	S	*	*			trans	-117.8	177.1	-179.5	0	0	0	0	0	113.5
615	F	21.9	Very low	24.8	Very low	190 Å²	190	137.5 Å²	137.5	83%	0.833	74%	0.741	S	S	*	*				-170.1	153.5	124	-116	-82.6	0	0	0	110.1
616	V	26.4	Very low	24.9	Very low	120 Å²	120	139.8 Å²	139.8	73%	0.727	74%	0.738	S	S	*	*			trans	-126.2	146.7	-166.4	172.2	0	0	0	0	112.8
617	F	28.2	Very low	24.9	Very low	176 Å²	176	142 Å²	142	77%	0.772	73%	0.733	S	S	*	*			trans	-18.3	159.5	167	-73.7	-89	0	0	0	119.8
618	P	32.4	Very low	24.9	Very low	125 Å²	125	143.4 Å²	143.4	81%	0.812	74%	0.738	S	S	*	*				-114.9	157.7	107.8	-7.4	25.9	0	0	0	114.3
619	Q	25.6	Very low	25	Very low	166 Å²	166	139.9 Å²	139.9	78%	0.776	73%	0.734	S	S	*	*			trans	-96.4	161.3	167.6	-61.7	173	-69	0	0	110.6
620	S	24	Very low	25.1	Very low	117 Å²	117	141.5 Å²	141.5	82%	0.818	75%	0.745	S	S	*	*			trans	-134.2	120.6	153.4	57.5	0	0	0	0	108.7
621	N	24.7	Very low	25	Very low	124 Å²	124	143.8 Å²	143.8	66%	0.663	75%	0.751	S	S	*	*			trans	-71.6	157	169.8	-62.9	-25.5	0	0	0	109.6
622	D	24.8	Very low	24.8	Very low	164 Å²	164	145.6 Å²	145.6	88%	0.877	75%	0.75	S	S	*	*				-161.6	177.2	111.3	-106.6	-30.5	0	0	0	111.7
623	T	24.5	Very low	24.6	Very low	114 Å²	114	141.9 Å²	141.9	70%	0.699	74%	0.74	S	S	*	*			trans	-132.3	168	-147.3	-31.2	0	0	0	0	112.9
624	E	24.7	Very low	24.5	Very low	147 Å²	147	143.6 Å²	143.6	69%	0.687	75%	0.748	S	S	*	*			trans	91.2	109.7	153.9	-57	-123.2	100.8	0	0	121.2
625	Q	23.6	Very low	24.5	Very low	137 Å²	137	147.6 Å²	147.6	64%	0.64	76%	0.76	S	S	*	*				80	136.6	121.9	-66.5	-165.1	41.8	0	0	124.5
626	N	23.9	Very low	24.8	Very low	113 Å²	113	147.4 Å²	147.4	60%	0.604	76%	0.764	S	S	*	*			trans	83.8	104.8	138.9	-77.3	-33.5	0	0	0	123.8
627	R	23.2	Very low	24.7	Very low	219 Å²	219	145 Å²	145	83%	0.826	76%	0.764	S	S	*	*				78.2	120.5	115.7	-77.1	-178.6	177.3	-150.2	-1.9	122.5
628	V	23.1	Very low	24.6	Very low	121 Å²	121	143.2 Å²	143.2	73%	0.733	76%	0.762	S	S	*	*				89.5	132.6	127.6	173.4	0	0	0	0	119.7
629	M	23.3	Very low	24.2	Very low	170 Å²	170	142.4 Å²	142.4	84%	0.837	76%	0.759	S	S	*	*			trans	-15.5	138.1	165.2	-60.9	140.7	55.3	0	0	119.2
630	S	23.8	Very low	24.6	Very low	129 Å²	129	140.3 Å²	140.3	90%	0.902	76%	0.758	S	S	*	*				-156.9	178.9	117.6	23.9	0	0	0	0	110
631	D	22.2	Very low	24.7	Very low	134 Å²	134	142.7 Å²	142.7	72%	0.717	76%	0.761	S	S	*	*			trans	-134.7	176.9	-158.8	-179.2	21.5	0	0	0	110.2
632	W	21.8	Very low	25.1	Very low	202 Å²	202	141.4 Å²	141.4	77%	0.765	76%	0.762	S	S	*	*			trans	88.3	106.7	169.6	-64.5	75.7	0	0	0	121
633	T	23.1	Very low	25.5	Very low	103 Å²	103	138.7 Å²	138.7	63%	0.632	75%	0.747	S	S	*	*			trans	73.7	133.3	133.6	50.5	0	0	0	0	124
634	Q	24.9	Very low	25.9	Very low	174 Å²	174	143.4 Å²	143.4	81%	0.813	75%	0.752	S	S	*	*			trans	51	119.9	142.6	-61.2	179.9	2.4	0	0	118.3
635	N	23.8	Very low	26.8	Very low	155 Å²	155	138.5 Å²	138.5	83%	0.829	73%	0.734	S	S	*	*				-160.4	177.4	77.9	-132	-40.4	0	0	0	115.2
636	M	28	Very low	27.8	Very low	185 Å²	185	134.7 Å²	134.7	91%	0.911	72%	0.72	S	S	*	*			trans	-67.6	144.6	171.4	-77.9	-75.5	-171	0	0	112.9
637	G	24.3	Very low	29	Very low	70 Å²	70	130.8 Å²	130.8	72%	0.722	70%	0.698	S	S	*	*			trans	-155.5	118	166.6	0	0	0	0	0	110.5
638	D	26.1	Very low	30	Very low	139 Å²	139	125.2 Å²	125.2	74%	0.743	69%	0.688	S	S	*	*			trans	-73.2	142.7	177.1	-171.4	7.5	0	0	0	110.6
639	S	26	Very low	30.7	Very low	107 Å²	107	125.7 Å²	125.7	75%	0.748	69%	0.687	S	S	*	*			trans	-158.9	73.3	178.2	-78.6	0	0	0	0	110.2	L641	S639-L641 PolarHBondContact O-N 3.15Å
640	T	32.1	Very low	31.3	Very low	123 Å²	123	122.9 Å²	122.9	76%	0.755	68%	0.682	S	S	*	*			trans	-65.7	92.2	174.1	36.3	0	0	0	0	111.8
641	L	27.5	Very low	31.5	Very low	167 Å²	167	120.6 Å²	120.6	87%	0.874	68%	0.678	S	S	*	*			trans	-116	134.6	162.9	-75.7	175.3	0	0	0	110.9	S639	S639-L641 PolarHBondContact O-N 3.15Å
642	S	31.6	Very low	31.8	Very low	97 Å²	97	120.9 Å²	120.9	68%	0.678	68%	0.684	S	S	*	*			trans	-84.2	121.7	-164	61.4	0	0	0	0	113	R644	S642-R644 PolarHBondContact O-N 3.49Å
643	D	33.3	Very low	31.9	Very low	106 Å²	106	122.6 Å²	122.6	57%	0.567	69%	0.691	S	S	*	*			trans	-79.2	67.9	174	-141.8	-3.6	0	0	0	111.5	K558 S645	K558-D643 IonicContact NZ-OD1 2.66Å; K558-D643 PolarHBondContact NZ-OD1 3.37Å; K558-D643 IonicContact NZ-OD2 3.63Å; D643-S645 PolarHBondContact O-N 2.97Å
644	R	34.7	Very low	32.1	Very low	214 Å²	214	123.4 Å²	123.4	81%	0.808	70%	0.695	S	S	*	*			trans	-77	103.7	175.7	-84.9	-175.6	162.8	-173.9	-4.8	110.1	S642	S642-R644 PolarHBondContact O-N 3.49Å
645	S	43	Very low	32.4	Very low	44 Å²	44	120.8 Å²	120.8	31%	0.308	69%	0.694	S	S	.	*			trans	-59.6	149.2	162.9	-175.9	0	0	0	0	110.5	D643 Q647	D643-S645 PolarHBondContact O-N 2.97Å; S645-Q647 PolarHBondContact OG-N 3.18Å
646	T	45.2	Very low	32.4	Very low	56 Å²	56	121.7 Å²	121.7	34%	0.344	69%	0.693	S	S	.	*			trans	-100.2	8.7	177.8	69.5	0	0	0	0	113.7	G555 V556 I557	G555-T646 VanDerWaalsContact CA-OG1 3.23Å; G555-T646 WeakPolarHBondContact CA-OG1 3.44Å; V556-T646 PolarHBondContact N-OG1 3Å; I557-T646 HydrophobicContact CG1-CG2 4.04Å; I557-T646 PolarHBondContact N-OG1 3.11Å; I557-T646 PolarHBondContact O-OG1 2.87Å
647	Q	48.8	Very low	32.3	Very low	32 Å²	32	124.8 Å²	124.8	15%	0.15	70%	0.695	C	S	.	*	P	Polyproline II helix	trans	-76.2	128.2	177	-169.6	-176.9	-23.3	0	0	110.8	W554 H571 H573 S645	W554-Q647 WeakPolarHBondContact O-CA 3.4Å; H571-Q647 PolarHBondContact CD2-NE2 3.22Å; H573-Q647 PolarHBondContact NE2-NE2 3.49Å; S645-Q647 PolarHBondContact OG-N 3.18Å
648	T	44.2	Very low	32.4	Very low	101 Å²	101	129.7 Å²	129.7	62%	0.62	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-93.9	129.6	175	49.3	0	0	0	0	111.5
649	D	37.5	Very low	32.4	Very low	131 Å²	131	131.2 Å²	131.2	70%	0.701	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-73.9	142.3	178.4	-71.5	-47.4	0	0	0	113	G651	D649-G651 PolarHBondContact O-N 3.47Å
650	P	35.3	Very low	32.5	Very low	112 Å²	112	137.6 Å²	137.6	73%	0.727	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-67.9	116.2	165.9	-15.1	30.2	0	0	0	110.2
651	G	29.3	Very low	32.3	Very low	80 Å²	80	143.8 Å²	143.8	83%	0.825	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-68.9	133.5	-170.4	0	0	0	0	0	115	D649	D649-G651 PolarHBondContact O-N 3.47Å
652	V	27.6	Very low	32.3	Very low	140 Å²	140	139.4 Å²	139.4	85%	0.848	72%	0.716	S	S	*	*			trans	-125.2	128.6	165	178.3	0	0	0	0	108.2
653	W	24.5	Very low	32.1	Very low	239 Å²	239	141.1 Å²	141.1	91%	0.905	72%	0.718	S	S	*	*			trans	-108.1	110.3	-172.9	-175.5	0.3	0	0	0	112
654	T	27	Very low	31.9	Very low	119 Å²	119	143.3 Å²	143.3	73%	0.73	72%	0.724	S	S	*	*			trans	-142.2	146.5	159	42.9	0	0	0	0	110.3
655	P	29.6	Very low	31.5	Very low	119 Å²	119	139.3 Å²	139.3	77%	0.773	72%	0.719	S	S	*	*			trans	-84	153.5	-168.1	33.1	-36.7	0	0	0	115
656	E	25.1	Very low	30.8	Very low	174 Å²	174	143.6 Å²	143.6	81%	0.813	74%	0.738	S	S	*	*			trans	-68.7	151	178.1	-62.6	-171	135.9	0	0	114.4
657	R	26.6	Very low	29.7	Very low	251 Å²	251	145.9 Å²	145.9	95%	0.947	76%	0.755	S	S	*	*			trans	-116.5	146.9	148.2	-93.1	-170.8	171.3	-164.3	-0.9	109.6
658	K	25.8	Very low	28.6	Very low	173 Å²	173	151.4 Å²	151.4	75%	0.752	79%	0.79	S	S	*	*			trans	-127.1	92.6	-155.8	-173.2	175.8	-167.9	159.8	0	112.2
659	D	26.6	Very low	27.6	Very low	171 Å²	171	149.6 Å²	149.6	91%	0.914	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-92.9	125	173.6	-80.3	-41.8	0	0	0	111.9
660	R	26.7	Very low	27.1	Very low	240 Å²	240	152.3 Å²	152.3	91%	0.906	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-96	131.1	173.3	-92.4	-178	162.3	179.6	-5.5	110.6
661	R	28.7	Very low	26.5	Very low	254 Å²	254	151.4 Å²	151.4	96%	0.958	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-101.3	155.7	161.5	-88.1	-170.2	-90	-169.9	-7	111.4
662	G	26.4	Very low	26.3	Very low	75 Å²	75	153 Å²	153	77%	0.773	80%	0.801	S	S	*	*			trans	167.8	92.8	-178.2	0	0	0	0	0	108.1
663	N	27.6	Very low	27.3	Very low	132 Å²	132	151.6 Å²	151.6	71%	0.706	79%	0.794	S	S	*	*			cis	104.7	145.4	27.2	-151.6	63.4	0	0	0	111.6
664	H	29	Very low	27.4	Very low	152 Å²	152	145.8 Å²	145.8	70%	0.704	78%	0.781	S	S	*	*			trans	75.6	153	-177.7	-54.8	-89.5	0	0	0	117.9
665	L	27.9	Very low	27.4	Very low	131 Å²	131	148.9 Å²	148.9	69%	0.686	78%	0.779	S	S	*	*			cis	-170.1	153.4	-46.5	-120.2	153.3	0	0	0	111.3
666	N	26.8	Very low	27.2	Very low	134 Å²	134	154.1 Å²	154.1	72%	0.717	78%	0.784	S	S	*	*			trans	71.3	127.1	153.3	-85.5	-5.3	0	0	0	124.6
667	C	23.6	Very low	27.2	Very low	104 Å²	104	149.4 Å²	149.4	70%	0.703	77%	0.774	S	S	*	*				83	118.8	128.7	-70.1	0	0	0	0	124.8
668	V	25.2	Very low	27.1	Very low	147 Å²	147	146.8 Å²	146.8	89%	0.891	77%	0.77	S	S	*	*			trans	66.5	126.1	134.3	-177.3	0	0	0	0	120
669	G	23.7	Very low	27.2	Very low	63 Å²	63	144.9 Å²	144.9	65%	0.649	77%	0.773	S	S	*	*			trans	153.2	104.2	150.8	0	0	0	0	0	118.2
670	H	25.7	Very low	27.2	Very low	188 Å²	188	144.1 Å²	144.1	87%	0.87	77%	0.768	S	S	*	*			trans	47.5	131.2	146.1	-75.7	-85.1	0	0	0	124.6
671	A	23.9	Very low	27.8	Very low	93 Å²	93	138.1 Å²	138.1	77%	0.769	76%	0.76	S	S	*	*			trans	69.2	125.1	130.3	0	0	0	0	0	122.4
672	S	23.5	Very low	27.6	Very low	114 Å²	114	133.1 Å²	133.1	80%	0.797	75%	0.747	S	S	*	*			trans	-82.7	177.4	155.7	-121.8	0	0	0	0	111
673	P	50.3	Low	27.6	Very low	110 Å²	110	139.4 Å²	139.4	71%	0.714	75%	0.748	S	S	*	*			cis	-133.4	-171.2	-9.7	40.5	-23.3	0	0	0	112.9
674	D	26.2	Very low	27.4	Very low	117 Å²	117	138.6 Å²	138.6	63%	0.626	75%	0.752	S	S	*	*				164.6	163.2	105.2	-159.2	8.5	0	0	0	112.8
675	R	27.1	Very low	27.3	Very low	185 Å²	185	143.2 Å²	143.2	70%	0.698	76%	0.763	S	S	*	*			trans	66.2	111	156.4	-80.9	160.5	-147.8	-137.7	-0.7	121.5
676	R	25	Very low	27.1	Very low	228 Å²	228	140.9 Å²	140.9	86%	0.86	77%	0.771	S	S	*	*				50.6	146.6	109.1	-66.3	-176.9	-178.4	179.3	-1.3	119.9
677	A	25.3	Very low	27	Very low	75 Å²	75	141 Å²	141	62%	0.62	78%	0.781	S	S	*	*			cis	-178.6	160.8	-16.3	0	0	0	0	0	109.2
678	K	24.9	Very low	27.1	Very low	196 Å²	196	140.6 Å²	140.6	85%	0.852	78%	0.779	S	S	*	*			trans	67.3	162.7	169.2	-47.9	173.1	179.2	177.1	0	113.2
679	T	26.9	Very low	27.3	Very low	134 Å²	134	141.6 Å²	141.6	82%	0.822	78%	0.776	S	S	*	*			cis	-149.2	154.2	2.7	-21.7	0	0	0	0	111
680	L	27.5	Very low	27.8	Very low	155 Å²	155	143.7 Å²	143.7	81%	0.812	78%	0.778	S	S	*	*			trans	-68.3	167.7	154.4	-77.9	155	0	0	0	109.9
681	P	38.6	Very low	28	Very low	114 Å²	114	141.7 Å²	141.7	74%	0.74	78%	0.779	S	S	*	*			cis	-153.2	179.5	32.1	45.6	-24.4	0	0	0	119.8
682	H	24.9	Very low	28.2	Very low	148 Å²	148	141.7 Å²	141.7	69%	0.685	77%	0.774	S	S	*	*			trans	28.3	133.6	145.8	-88.7	-18.1	0	0	0	125.8
683	R	26.2	Very low	28.4	Very low	208 Å²	208	145.6 Å²	145.6	79%	0.785	78%	0.777	S	S	*	*			trans	63.5	136.1	133.3	-69.2	175.4	166.9	168.8	-2.2	118.3
684	S	24.3	Very low	27.5	Very low	114 Å²	114	148.7 Å²	148.7	80%	0.797	79%	0.786	S	S	*	*				-166.3	158	70.2	-71.1	0	0	0	0	116.9
685	R	26.3	Very low	27.8	Very low	249 Å²	249	151.6 Å²	151.6	94%	0.94	80%	0.796	S	S	*	*			trans	-2.9	112.9	160.7	-63.6	171.7	170.9	167	-5	119.8
686	G	23.6	Very low	28	Very low	82 Å²	82	149.8 Å²	149.8	85%	0.845	80%	0.8	S	S	*	*				70.8	137.9	98.1	0	0	0	0	0	121.9
687	C	24.2	Very low	28.2	Very low	136 Å²	136	148.5 Å²	148.5	92%	0.919	80%	0.801	S	S	*	*			trans	-156.8	-177.5	147.2	-151.8	0	0	0	0	110.5
688	S	26.8	Very low	28.6	Very low	96 Å²	96	152.9 Å²	152.9	67%	0.671	81%	0.813	S	S	*	*			trans	-142.2	170.6	-172.4	53.5	0	0	0	0	113.1
689	M	27.8	Very low	28.9	Very low	169 Å²	169	150.8 Å²	150.8	83%	0.833	81%	0.811	S	S	*	*			trans	82.4	157.9	177	-56	-68.2	-83.2	0	0	115.9
690	P	34.4	Very low	29.1	Very low	106 Å²	106	153.1 Å²	153.1	69%	0.688	81%	0.813	S	S	*	*			cis	-130.2	-174.4	-26.5	31.5	-11.8	0	0	0	113.6
691	V	31.1	Very low	29.3	Very low	147 Å²	147	154.1 Å²	154.1	89%	0.891	82%	0.818	S	S	*	*			trans	-102.9	119.5	170.9	175	0	0	0	0	110.6
692	S	27.8	Very low	29.1	Very low	93 Å²	93	157.2 Å²	157.2	65%	0.65	82%	0.822	S	S	*	*			trans	-179.4	100.6	156.7	53	0	0	0	0	111.9
693	F	28.3	Very low	29.3	Very low	196 Å²	196	157.7 Å²	157.7	86%	0.86	83%	0.829	S	S	*	*			trans	-166.1	52.1	162	-111.6	-62.9	0	0	0	113.1
694	L	30.1	Very low	29.6	Very low	175 Å²	175	156.1 Å²	156.1	92%	0.916	83%	0.83	S	S	*	*			trans	-141.7	57.5	167.9	-81.6	-179.2	0	0	0	110
695	Q	32.2	Very low	29.8	Very low	178 Å²	178	158.9 Å²	158.9	83%	0.832	83%	0.828	S	S	*	*			trans	-148.5	46.9	174	-165.5	59.9	61.1	0	0	110.3
696	D	31.1	Very low	29.9	Very low	147 Å²	147	154.7 Å²	154.7	79%	0.786	82%	0.824	S	S	*	*	S	Bend	trans	-151.6	145	169.3	-100.4	-44.3	0	0	0	108.7
697	K	30.6	Very low	30.4	Very low	200 Å²	200	158.4 Å²	158.4	87%	0.87	82%	0.817	S	S	*	*	S	Bend	trans	69.8	64.7	-170.4	-60.8	-158.3	167.9	-151.3	0	116.9
698	L	33.2	Very low	30.8	Very low	167 Å²	167	157 Å²	157	87%	0.874	81%	0.809	S	S	*	*			trans	-132.2	14.4	151.4	-121	167.9	0	0	0	113.6
699	D	30.7	Very low	31	Very low	153 Å²	153	163.7 Å²	163.7	82%	0.818	82%	0.819	S	S	*	*			trans	-113.9	65.8	179.9	-71.7	-60.1	0	0	0	111.9
700	E	32.3	Very low	31.4	Very low	183 Å²	183	164.5 Å²	164.5	86%	0.855	82%	0.821	S	S	*	*			trans	-156.1	82.6	162.8	-144.7	169.7	-143.7	0	0	111.5
701	L	31.6	Very low	32.4	Very low	175 Å²	175	164.5 Å²	164.5	92%	0.916	82%	0.821	S	S	*	*			trans	170.4	65.2	149.2	-93.3	164.5	0	0	0	110.8
702	H	32.8	Very low	32.8	Very low	179 Å²	179	168.6 Å²	168.6	83%	0.829	84%	0.838	S	S	*	*			trans	-75.2	127.5	163.5	-91.1	-51.9	0	0	0	110.3
703	L	30.9	Very low	33	Very low	159 Å²	159	172.4 Å²	172.4	83%	0.832	85%	0.847	S	S	*	*			trans	-148.3	103.9	153.9	-117.4	154.2	0	0	0	112.2
704	H	31.9	Very low	33.3	Very low	175 Å²	175	171.1 Å²	171.1	81%	0.81	85%	0.846	S	S	*	*			trans	16.3	96.5	164	-69.8	-83.6	0	0	0	120.9
705	K	29.1	Very low	33.4	Very low	172 Å²	172	170.9 Å²	170.9	75%	0.748	84%	0.842	S	S	*	*			trans	-29.3	130.7	132.4	-179.5	-174.6	-153.1	159.4	0	114.2
706	D	27	Very low	33.5	Very low	160 Å²	160	170.5 Å²	170.5	86%	0.856	84%	0.843	S	S	*	*			trans	-110.4	163.1	152.1	-156.8	-9.6	0	0	0	109.9
707	K	35.6	Very low	33.7	Very low	161 Å²	161	171.9 Å²	171.9	70%	0.7	85%	0.847	S	S	*	*			trans	-132.7	125.5	-175.8	-81.5	-177	169.7	-173.6	0	111.3
708	S	32.1	Very low	33.9	Very low	107 Å²	107	170.1 Å²	170.1	75%	0.748	85%	0.845	S	S	*	*			trans	-164.5	138.5	135.3	37.1	0	0	0	0	114.6
709	R	30.6	Very low	33.9	Very low	236 Å²	236	170.3 Å²	170.3	89%	0.891	84%	0.843	S	S	*	*			trans	63.9	99.7	144.9	-66.1	168.9	-176.9	165.2	0.1	120.8
710	E	36.5	Very low	34.2	Very low	185 Å²	185	171.6 Å²	171.6	86%	0.864	85%	0.845	S	S	*	*				-60.4	161.1	117.2	-75.8	168.3	169.5	0	0	109.9
711	P	54.7	Low	34.3	Very low	106 Å²	106	170.7 Å²	170.7	69%	0.688	84%	0.844	S	S	*	*			cis	-124.3	-170.2	26.3	46.6	-32.8	0	0	0	113
712	D	39	Very low	34.6	Very low	233 Å²	233	170.3 Å²	170.3	100%	1.246	84%	0.837	S	S	*	*			cis	-125.5	0	2	-77.8	-75.7	0	0	0	110.9

Retrieved 712 of 712 residues in 195.5 ms (Link to these results)

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