A0A087XZM5_POEFO Loading...

Histone acetyltransferase

AlphaFold DB , UniProt , Accession A0A087XZM5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 792 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	29.7	Very low	23.9	Very low	245 Å²	245	139.3 Å²	139.3	100%	1.207	83%	0.834	S	S	*	*				0	137.7	0	-59.2	173.5	-177.5	0	0	106.7
2	A	26.1	Very low	24.1	Very low	81 Å²	81	138.8 Å²	138.8	67%	0.669	84%	0.836	S	S	*	*			cis	169.2	153	-9.5	0	0	0	0	0	104.7
3	D	24.9	Very low	23.8	Very low	141 Å²	141	135.1 Å²	135.1	75%	0.754	83%	0.83	S	S	*	*			cis	-154.3	156.3	-17.9	-88.4	-34.9	0	0	0	105.7
4	S	22.7	Very low	23.7	Very low	107 Å²	107	136 Å²	136	75%	0.748	84%	0.835	S	S	*	*			cis	85.1	64.6	36.6	-51.9	0	0	0	0	115.6
5	V	25.8	Very low	23.5	Very low	145 Å²	145	132.1 Å²	132.1	88%	0.879	83%	0.832	S	S	*	*			trans	-142.5	138.4	157.9	-172.4	0	0	0	0	108.6
6	G	23.2	Very low	23.3	Very low	61 Å²	61	130.5 Å²	130.5	63%	0.629	84%	0.835	S	S	*	*			cis	132.5	56.1	-0.8	0	0	0	0	0	113.5
7	I	23.6	Very low	23.3	Very low	172 Å²	172	128.8 Å²	128.8	88%	0.882	84%	0.836	S	S	*	*			trans	-87.5	123.9	-179.2	-61.6	178.2	0	0	0	110.6
8	Q	21.1	Very low	23.2	Very low	182 Å²	182	125.9 Å²	125.9	85%	0.85	83%	0.833	S	S	*	*			trans	-76.5	143.8	179.6	-64.6	169.2	-40.3	0	0	112.1
9	Q	23.1	Very low	23.2	Very low	204 Å²	204	128.4 Å²	128.4	95%	0.953	84%	0.837	S	S	*	*			trans	-106.8	129	152.2	-74.6	-170.5	-8.2	0	0	108.7
10	G	20.6	Very low	23.1	Very low	73 Å²	73	128.5 Å²	128.5	75%	0.753	83%	0.834	S	S	*	*			trans	-121.8	135	172.9	0	0	0	0	0	110.8
11	S	22.1	Very low	23.1	Very low	121 Å²	121	127.9 Å²	127.9	85%	0.846	83%	0.831	S	S	*	*			trans	-67.4	156.4	167.5	-49.2	0	0	0	0	110.4
12	P	26.5	Very low	22.7	Very low	133 Å²	133	121 Å²	121	86%	0.864	81%	0.812	S	S	*	*				-136.2	-167.5	90.6	34.4	-18.9	0	0	0	113.2
13	A	19.8	Very low	22.5	Very low	91 Å²	91	121.5 Å²	121.5	75%	0.752	82%	0.816	S	S	*	*			trans	-116	-171.8	-158.5	0	0	0	0	0	115
14	V	22	Very low	22.5	Very low	148 Å²	148	121 Å²	121	90%	0.897	82%	0.821	S	S	*	*			trans	94.8	98.6	164.6	-169.1	0	0	0	0	117.6
15	G	20.4	Very low	22.5	Very low	77 Å²	77	118.7 Å²	118.7	79%	0.794	81%	0.814	S	S	*	*				102.6	104.7	116.5	0	0	0	0	0	120.4
16	A	21.3	Very low	22.9	Very low	107 Å²	107	116.8 Å²	116.8	88%	0.884	81%	0.813	S	S	*	*			trans	-161.3	140.9	140.3	0	0	0	0	0	110.7
17	A	22.4	Very low	22.9	Very low	102 Å²	102	117.3 Å²	117.3	84%	0.843	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-77.9	137.9	-173.5	0	0	0	0	0	113.7
18	G	22.1	Very low	23.1	Very low	76 Å²	76	112.7 Å²	112.7	78%	0.784	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-74.4	131.2	167	0	0	0	0	0	111.7	V20	G18-V20 PolarHBondContact O-N 3.16Å
19	L	22.7	Very low	23.2	Very low	174 Å²	174	108.9 Å²	108.9	91%	0.911	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-74.3	124.8	-179	-80.5	163.8	0	0	0	112.1
20	V	22.1	Very low	23.3	Very low	129 Å²	129	109.3 Å²	109.3	78%	0.782	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-70.9	130.5	175.7	179.7	0	0	0	0	110.3	G18 A22	G18-V20 PolarHBondContact O-N 3.16Å; V20-A22 PolarHBondContact O-N 3.13Å
21	P	23.3	Very low	23.6	Very low	117 Å²	117	108.8 Å²	108.8	76%	0.76	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-64.3	127.6	170.9	-18.6	31.5	0	0	0	110.9
22	A	20.6	Very low	23.9	Very low	100 Å²	100	106.8 Å²	106.8	83%	0.826	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-62.9	137.1	-177.4	0	0	0	0	0	112.4	V20	V20-A22 PolarHBondContact O-N 3.13Å
23	A	22.6	Very low	24	Very low	91 Å²	91	103.5 Å²	103.5	75%	0.752	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-66.2	142.2	-179.3	0	0	0	0	0	112.3	G25	A23-G25 PolarHBondContact O-N 3.14Å
24	P	25.1	Very low	24.9	Very low	131 Å²	131	100.9 Å²	100.9	85%	0.851	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-67.7	124	176	27.5	-33.4	0	0	0	111.2	A26	P24-A26 PolarHBondContact O-N 3Å
25	G	22.3	Very low	25.6	Very low	59 Å²	59	97 Å²	97	61%	0.608	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-65.4	122	-174.2	0	0	0	0	0	113.9	A23 A27 K297	A23-G25 PolarHBondContact O-N 3.14Å; G25-A27 PolarHBondContact O-N 3.41Å; G25-K297 PolarHBondContact O-NZ 3.02Å
26	A	33.5	Very low	26.6	Very low	104 Å²	104	96 Å²	96	86%	0.86	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-55.7	127.7	-174.7	0	0	0	0	0	113.7	P24	P24-A26 PolarHBondContact O-N 3Å
27	A	23.3	Very low	28.4	Very low	73 Å²	73	91.5 Å²	91.5	60%	0.603	69%	0.685	S	S	*	*			trans	-161.1	117.7	153.8	0	0	0	0	0	111.7	G25	G25-A27 PolarHBondContact O-N 3.41Å
28	G	28	Very low	30.2	Very low	75 Å²	75	88.2 Å²	88.2	77%	0.773	66%	0.656	S	S	*	*			trans	79.3	45.4	131.6	0	0	0	0	0	121.3
29	T	23.4	Very low	32.4	Very low	101 Å²	101	87.9 Å²	87.9	62%	0.62	65%	0.645	S	S	*	*			trans	-135.2	130.4	154.3	35.9	0	0	0	0	111.7	G31 S32	T29-G31 PolarHBondContact O-N 3.48Å; T29-S32 PolarHBondContact O-OG 2.96Å
30	E	26	Very low	34.8	Very low	213 Å²	213	88.4 Å²	88.4	100%	0.995	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	40.3	-169.8	-68	171.8	151.5	0	0	113.4
31	G	25.7	Very low	37.3	Very low	62 Å²	62	82.8 Å²	82.8	64%	0.639	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	-3.6	165	0	0	0	0	0	113.6	T29 G33	T29-G31 PolarHBondContact O-N 3.48Å; G31-G33 VanDerWaalsContact C-N 3.27Å; G31-G33 PolarHBondContact O-N 3.24Å; G31-G33 VanDerWaalsContact O-N 3.15Å
32	S	29	Very low	39.9	Very low	79 Å²	79	80 Å²	80	55%	0.552	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	8.3	-166.1	60.9	0	0	0	0	116.3	T29 A34 A35 G36	T29-S32 PolarHBondContact O-OG 2.96Å; S32-A34 VanDerWaalsContact C-N 3.28Å; S32-A34 PolarHBondContact O-N 3.49Å; S32-A35 PolarHBondContact O-N 2.99Å; S32-A35 VanDerWaalsContact O-N 3.14Å; S32-G36 PolarHBondContact O-N 3.02Å
33	G	29.2	Very low	42.7	Very low	64 Å²	64	78 Å²	78	66%	0.66	57%	0.571	S	S	*	*	H	α-helix	trans	-58.7	-35.9	179.9	0	0	0	0	0	113.9	G31 G37	G31-G33 VanDerWaalsContact C-N 3.27Å; G31-G33 PolarHBondContact O-N 3.24Å; G31-G33 VanDerWaalsContact O-N 3.15Å; G33-G37 PolarHBondContact O-N 3.12Å; G33-G37 VanDerWaalsContact O-N 3.15Å
34	A	37.8	Very low	45.5	Very low	36 Å²	36	78.6 Å²	78.6	30%	0.298	56%	0.557	S	S	.	*	H	α-helix	trans	-68.7	-39.5	175.9	0	0	0	0	0	112.7	S32 G37 S38	S32-A34 VanDerWaalsContact C-N 3.28Å; S32-A34 PolarHBondContact O-N 3.49Å; A34-G37 PolarHBondContact O-N 2.74Å; A34-S38 WeakPolarHBondContact O-CB 3.28Å; A34-S38 PolarHBondContact O-N 3.07Å
35	A	37.6	Very low	48.2	Very low	68 Å²	68	72.6 Å²	72.6	56%	0.562	52%	0.517	S	S	*	.	H	α-helix	trans	-67.4	-46.1	-177.6	0	0	0	0	0	112.3	S32 G37 S38 A39	S32-A35 PolarHBondContact O-N 2.99Å; S32-A35 VanDerWaalsContact O-N 3.14Å; A35-G37 VanDerWaalsContact C-N 3.28Å; A35-G37 PolarHBondContact O-N 3.17Å; A35-S38 PolarHBondContact O-N 3.41Å; A35-A39 PolarHBondContact O-N 2.88Å
36	G	41.5	Very low	51.1	Low	54 Å²	54	72.5 Å²	72.5	56%	0.557	51%	0.511	S	S	*	.	H	α-helix	trans	-66.1	-30.3	173.4	0	0	0	0	0	113	S32	S32-G36 PolarHBondContact O-N 3.02Å
37	G	57.3	Low	53.5	Low	14 Å²	14	73.9 Å²	73.9	14%	0.144	50%	0.499	C	S	.	.	H	α-helix	trans	-63.1	-54.9	169.4	0	0	0	0	0	112.3	G33 A34 A35 A39 R40 I41	G33-G37 PolarHBondContact O-N 3.12Å; G33-G37 VanDerWaalsContact O-N 3.15Å; A34-G37 PolarHBondContact O-N 2.74Å; A35-G37 VanDerWaalsContact C-N 3.28Å; A35-G37 PolarHBondContact O-N 3.17Å; G37-A39 PolarHBondContact O-N 3.48Å; G37-R40 CarbonylContact O-C 3.59Å; G37-R40 WeakPolarHBondContact O-CA 3.43Å; G37-R40 WeakPolarHBondContact O-CB 3.48Å; G37-R40 PolarHBondContact O-N 2.92Å; G37-I41 WeakPolarHBondContact O-CG1 3.35Å; G37-I41 PolarHBondContact O-N 3.3Å
38	S	62.2	Low	56.2	Low	33 Å²	33	71.8 Å²	71.8	23%	0.231	48%	0.478	C	S	.	.	H	α-helix	trans	-52	-50.8	-176.8	-171.6	0	0	0	0	112.7	A34 A35 R40 I41 A42 Q257	A34-S38 WeakPolarHBondContact O-CB 3.28Å; A34-S38 PolarHBondContact O-N 3.07Å; A35-S38 PolarHBondContact O-N 3.41Å; S38-R40 VanDerWaalsContact C-N 3.26Å; S38-R40 PolarHBondContact O-N 2.97Å; S38-I41 WeakPolarHBondContact O-CB 3.39Å; S38-I41 PolarHBondContact O-N 2.82Å; S38-A42 PolarHBondContact O-N 2.97Å; S38-Q257 PolarHBondContact OG-O 2.88Å
39	A	67.2	Low	58.8	Low	68 Å²	68	73 Å²	73	56%	0.562	46%	0.459	S	S	*	.	H	α-helix	trans	-59.1	-36.8	177.6	0	0	0	0	0	112.8	A35 G37 A42 A43	A35-A39 PolarHBondContact O-N 2.88Å; G37-A39 PolarHBondContact O-N 3.48Å; A39-A42 PolarHBondContact O-N 2.85Å; A39-A43 PolarHBondContact O-N 2.9Å; A39-A43 VanDerWaalsContact O-N 3.08Å
40	R	72.9	Confident	61.6	Low	185 Å²	185	72.9 Å²	72.9	70%	0.698	46%	0.462	S	S	*	.	H	α-helix	trans	-72.9	-31.4	176.7	-165.2	177.9	-175.4	-170	2.1	112.6	G37 S38 K44	G37-R40 CarbonylContact O-C 3.59Å; G37-R40 WeakPolarHBondContact O-CA 3.43Å; G37-R40 WeakPolarHBondContact O-CB 3.48Å; G37-R40 PolarHBondContact O-N 2.92Å; S38-R40 VanDerWaalsContact C-N 3.26Å; S38-R40 PolarHBondContact O-N 2.97Å; R40-K44 WeakPolarHBondContact O-CG 3.47Å; R40-K44 PolarHBondContact O-N 3.38Å; R40-K44 VanDerWaalsContact O-N 3.14Å
41	I	75.7	Confident	64.4	Low	11 Å²	11	63.8 Å²	63.8	6%	0.056	42%	0.423	C	S	.	.	H	α-helix	trans	-68.5	-46.8	171.3	-56.4	160.6	0	0	0	109.8	G37 S38 A43 K44 K45 Y136 F258	G37-I41 WeakPolarHBondContact O-CG1 3.35Å; G37-I41 PolarHBondContact O-N 3.3Å; S38-I41 WeakPolarHBondContact O-CB 3.39Å; S38-I41 PolarHBondContact O-N 2.82Å; I41-A43 VanDerWaalsContact C-N 3.31Å; I41-A43 PolarHBondContact O-N 2.94Å; I41-K44 CarbonylContact O-C 3.57Å; I41-K44 WeakPolarHBondContact O-CB 3.34Å; I41-K44 PolarHBondContact O-N 3.2Å; I41-K44 VanDerWaalsContact O-N 3.09Å; I41-K45 HydrophobicContact CG2-CD 4Å; I41-K45 HydrophobicContact CG2-CG 4.22Å; I41-K45 WeakPolarHBondContact O-CG 3.46Å; I41-K45 PolarHBondContact O-N 3.47Å; I41-Y136 HydrophobicContact CD1-CD1 3.35Å; I41-Y136 HydrophobicContact CD1-CD2 3.5Å; I41-Y136 VanDerWaalsContact CD1-CD2 3.5Å; I41-Y136 HydrophobicContact CD1-CE1 3.66Å; I41-Y136 HydrophobicContact CD1-CE2 3.81Å; I41-Y136 HydrophobicContact CD1-CG 3.24Å; I41-Y136 HydrophobicContact CG1-CD1 4.48Å; I41-Y136 HydrophobicContact CG1-CD2 3.82Å; I41-Y136 HydrophobicContact CG1-CE2 4.27Å; I41-Y136 HydrophobicContact CG1-CG 3.93Å; I41-F258 HydrophobicContact CD1-CB 4.4Å
42	A	76.7	Confident	67.2	Low	58 Å²	58	65.3 Å²	65.3	48%	0.479	42%	0.421	S	S	.	.	H	α-helix	trans	-57.9	-43.6	179.2	0	0	0	0	0	111.7	S38 A39 K45 A46	S38-A42 PolarHBondContact O-N 2.97Å; A39-A42 PolarHBondContact O-N 2.85Å; A42-K45 PolarHBondContact O-N 2.85Å; A42-A46 PolarHBondContact O-N 2.84Å
43	A	80.3	Confident	69.7	Low	60 Å²	60	65 Å²	65	50%	0.496	41%	0.408	S	S	.	.	H	α-helix	trans	-61	-44.9	172.6	0	0	0	0	0	112.8	A39 I41 K45 A46 Q47	A39-A43 PolarHBondContact O-N 2.9Å; A39-A43 VanDerWaalsContact O-N 3.08Å; I41-A43 VanDerWaalsContact C-N 3.31Å; I41-A43 PolarHBondContact O-N 2.94Å; A43-K45 PolarHBondContact O-N 2.93Å; A43-A46 PolarHBondContact O-N 3.45Å; A43-Q47 WeakPolarHBondContact O-CB 3.48Å; A43-Q47 PolarHBondContact O-N 2.93Å
44	K	81.6	Confident	72.4	Confident	102 Å²	102	65 Å²	65	44%	0.443	40%	0.396	S	S	.	.	H	α-helix	trans	-62.4	-40.1	174.2	-80.1	-175.2	169.7	-165.9	0	112.8	R40 I41 Q47 L48 L132	R40-K44 WeakPolarHBondContact O-CG 3.47Å; R40-K44 PolarHBondContact O-N 3.38Å; R40-K44 VanDerWaalsContact O-N 3.14Å; I41-K44 CarbonylContact O-C 3.57Å; I41-K44 WeakPolarHBondContact O-CB 3.34Å; I41-K44 PolarHBondContact O-N 3.2Å; I41-K44 VanDerWaalsContact O-N 3.09Å; K44-Q47 PolarHBondContact O-N 3.44Å; K44-L48 WeakPolarHBondContact O-CB 3.49Å; K44-L48 PolarHBondContact O-N 3.36Å; K44-L132 HydrophobicContact CB-CD2 4.46Å
45	K	81.6	Confident	74.6	Confident	5 Å²	5	68.5 Å²	68.5	2%	0.022	41%	0.405	C	S	.	.	H	α-helix	trans	-61.3	-45.4	175.8	-78.6	177.4	177.1	176.9	0	110.5	I41 A42 A43 L48 R49 G129 L132 D133 D260	I41-K45 HydrophobicContact CG2-CD 4Å; I41-K45 HydrophobicContact CG2-CG 4.22Å; I41-K45 WeakPolarHBondContact O-CG 3.46Å; I41-K45 PolarHBondContact O-N 3.47Å; A42-K45 PolarHBondContact O-N 2.85Å; A43-K45 PolarHBondContact O-N 2.93Å; K45-L48 PolarHBondContact O-N 2.77Å; K45-R49 WeakPolarHBondContact O-CB 3.17Å; K45-R49 WeakPolarHBondContact O-CD 3.29Å; K45-R49 WeakPolarHBondContact O-CG 3.46Å; K45-R49 PolarHBondContact O-N 3.26Å; K45-G129 WeakPolarHBondContact CE-O 3.33Å; K45-L132 HydrophobicContact CB-CD1 4.2Å; K45-L132 HydrophobicContact CG-CB 4.21Å; K45-L132 HydrophobicContact CG-CD1 3.5Å; K45-D133 WeakPolarHBondContact CE-OD1 3.35Å; K45-D133 IonicContact NZ-OD1 2.69Å; K45-D133 PolarHBondContact NZ-OD1 3.07Å; K45-D133 IonicContact NZ-OD2 2.67Å; K45-D133 PolarHBondContact NZ-OD2 3.31Å; K45-D260 IonicContact NZ-OD1 3.16Å; K45-D260 PolarHBondContact NZ-OD1 3.47Å; K45-D260 IonicContact NZ-OD2 2.69Å
46	A	82.7	Confident	76.9	Confident	57 Å²	57	65.5 Å²	65.5	47%	0.471	38%	0.379	S	S	.	.	H	α-helix	trans	-59.5	-49.7	173.9	0	0	0	0	0	112.1	A42 A43 L48 R49 S50	A42-A46 PolarHBondContact O-N 2.84Å; A43-A46 PolarHBondContact O-N 3.45Å; A46-L48 VanDerWaalsContact C-N 3.33Å; A46-L48 PolarHBondContact O-N 3.06Å; A46-R49 PolarHBondContact O-N 2.82Å; A46-S50 PolarHBondContact O-N 3.28Å; A46-S50 PolarHBondContact O-OG 3.23Å
47	Q	83.8	Confident	79	Confident	133 Å²	133	63.5 Å²	63.5	62%	0.621	36%	0.356	S	S	*	.	H	α-helix	trans	-61.8	-35	-179	-169.7	-177.8	22	0	0	113.8	A43 K44 S50 S51	A43-Q47 WeakPolarHBondContact O-CB 3.48Å; A43-Q47 PolarHBondContact O-N 2.93Å; K44-Q47 PolarHBondContact O-N 3.44Å; Q47-S50 PolarHBondContact O-OG 3.48Å; Q47-S50 VanDerWaalsContact O-OG 3.12Å; Q47-S51 PolarHBondContact O-N 2.85Å; Q47-S51 PolarHBondContact O-OG 3.06Å
48	L	79.9	Confident	80.4	Confident	30 Å²	30	66.2 Å²	66.2	16%	0.157	36%	0.364	C	S	.	.	H	α-helix	trans	-81.6	-32.8	176.8	-83.5	159.3	0	0	0	112.8	K44 K45 A46 S50 S51 L132	K44-L48 WeakPolarHBondContact O-CB 3.49Å; K44-L48 PolarHBondContact O-N 3.36Å; K45-L48 PolarHBondContact O-N 2.77Å; A46-L48 VanDerWaalsContact C-N 3.33Å; A46-L48 PolarHBondContact O-N 3.06Å; L48-S50 PolarHBondContact O-N 3.45Å; L48-S51 WeakPolarHBondContact O-CB 3.44Å; L48-S51 PolarHBondContact O-N 2.89Å; L48-L132 HydrophobicContact CB-CD1 4.41Å; L48-L132 HydrophobicContact CD1-CD1 3.76Å; L48-L132 HydrophobicContact CD1-CD2 3.78Å; L48-L132 HydrophobicContact CD1-CG 4.16Å
49	R	82.3	Confident	81.6	Confident	99 Å²	99	67.2 Å²	67.2	37%	0.374	36%	0.364	S	S	.	.	H	α-helix	trans	-61.5	-33.6	169.8	-72.2	169.4	-175.4	162.9	5	111.6	K45 A46 K56 N125 D260	K45-R49 WeakPolarHBondContact O-CB 3.17Å; K45-R49 WeakPolarHBondContact O-CD 3.29Å; K45-R49 WeakPolarHBondContact O-CG 3.46Å; K45-R49 PolarHBondContact O-N 3.26Å; A46-R49 PolarHBondContact O-N 2.82Å; R49-K56 WeakPolarHBondContact O-CE 3.46Å; R49-K56 PolarHBondContact O-NZ 2.91Å; R49-N125 WeakPolarHBondContact CA-OD1 3.47Å; R49-N125 HydrophobicContact CG-CB 4.05Å; R49-D260 IonicContact NH2-OD2 2.67Å; R49-D260 PolarHBondContact NH2-OD2 3.27Å
50	S	82	Confident	82.5	Confident	99 Å²	99	64 Å²	64	69%	0.692	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	7.7	175.4	71.3	0	0	0	0	115.4	A46 Q47 L48	A46-S50 PolarHBondContact O-N 3.28Å; A46-S50 PolarHBondContact O-OG 3.23Å; Q47-S50 PolarHBondContact O-OG 3.48Å; Q47-S50 VanDerWaalsContact O-OG 3.12Å; L48-S50 PolarHBondContact O-N 3.45Å
51	S	84.4	Confident	83.1	Confident	23 Å²	23	55.2 Å²	55.2	16%	0.161	31%	0.305	C	S	.	.	S	Bend	trans	-85.4	154	177.8	-71.2	0	0	0	0	112.2	Q47 L48 K56	Q47-S51 PolarHBondContact O-N 2.85Å; Q47-S51 PolarHBondContact O-OG 3.06Å; L48-S51 WeakPolarHBondContact O-CB 3.44Å; L48-S51 PolarHBondContact O-N 2.89Å; S51-K56 WeakPolarHBondContact O-CE 3.33Å
52	P	85.4	Confident	83.7	Confident	93 Å²	93	57.4 Å²	57.4	60%	0.604	32%	0.319	S	S	*	.			trans	-60.8	146.6	177.9	-24.8	35.1	0	0	0	113.9	P54 K55 K56	P52-P54 VanDerWaalsContact C-CD 3.49Å; P52-K55 WeakPolarHBondContact O-CB 3.41Å; P52-K55 PolarHBondContact O-N 2.83Å; P52-K56 PolarHBondContact O-N 3.49Å
53	R	82.6	Confident	84.1	Confident	74 Å²	74	56.3 Å²	56.3	28%	0.279	30%	0.302	S	S	.	.	H	α-helix	trans	-50.1	-41.4	-175.9	-167	173.5	176.5	95.9	-8.1	114.8	K55 K56 L57 L116 E117 V119 E121 M124	R53-K55 VanDerWaalsContact C-N 3.3Å; R53-K55 PolarHBondContact O-N 2.62Å; R53-K56 WeakPolarHBondContact O-CA 3.5Å; R53-K56 VanDerWaalsContact O-CB 3.31Å; R53-K56 WeakPolarHBondContact O-CB 3.33Å; R53-K56 PolarHBondContact O-N 2.88Å; R53-L57 HydrophobicContact CG-CD1 4.48Å; R53-L57 WeakPolarHBondContact O-CG 3.41Å; R53-L57 PolarHBondContact O-N 2.77Å; R53-L116 PolarHBondContact NH2-O 3.02Å; R53-E117 PolarHBondContact NH2-O 2.87Å; R53-V119 PolarHBondContact NH1-O 3.37Å; R53-V119 VanDerWaalsContact NH1-O 3.14Å; R53-V119 PolarHBondContact NH2-O 3.35Å; R53-E121 WeakPolarHBondContact CD-OE1 3.5Å; R53-E121 IonicContact CZ-OE1 2.68Å; R53-E121 IonicContact NE-OE1 3.76Å; R53-E121 IonicContact NH1-OE1 3.22Å; R53-E121 PolarHBondContact NH1-OE1 2.94Å; R53-M124 HydrophobicContact CG-CE 4.15Å; R53-M124 HydrophobicContact CG-SD 4.01Å; R53-M124 VanDerWaalsContact CZ-CE 3.46Å
54	P	84.1	Confident	84.4	Confident	64 Å²	64	53.5 Å²	53.5	42%	0.416	28%	0.279	S	S	.	.	H	α-helix	trans	-58.9	-37.8	175.3	-25.9	35.9	0	0	0	113.9	P52 K56 L57 E58 V96	P52-P54 VanDerWaalsContact C-CD 3.49Å; P54-K56 VanDerWaalsContact C-N 3.34Å; P54-L57 PolarHBondContact O-N 3.35Å; P54-E58 PolarHBondContact O-N 3.11Å; P54-V96 HydrophobicContact CB-CB 3.95Å; P54-V96 HydrophobicContact CB-CG2 4.38Å
55	K	84	Confident	84.6	Confident	108 Å²	108	49.6 Å²	49.6	47%	0.47	27%	0.265	S	S	.	.	H	α-helix	trans	-73.8	-24.7	176.9	-168.6	169.3	-173.7	168.2	0	112.8	P52 R53 K59 V96	P52-K55 WeakPolarHBondContact O-CB 3.41Å; P52-K55 PolarHBondContact O-N 2.83Å; R53-K55 VanDerWaalsContact C-N 3.3Å; R53-K55 PolarHBondContact O-N 2.62Å; K55-K59 PolarHBondContact O-N 3.41Å; K55-V96 HydrophobicContact CB-CG2 4.49Å
56	K	86.9	Confident	84.9	Confident	5 Å²	5	49.7 Å²	49.7	2%	0.022	27%	0.266	C	S	.	.	H	α-helix	trans	-68.6	-47	167.6	-58.6	-168.5	-179.9	-171.3	0	110.7	R49 S51 P52 R53 P54 K59 L60 E121 M124 N125 L128	R49-K56 WeakPolarHBondContact O-CE 3.46Å; R49-K56 PolarHBondContact O-NZ 2.91Å; S51-K56 WeakPolarHBondContact O-CE 3.33Å; P52-K56 PolarHBondContact O-N 3.49Å; R53-K56 WeakPolarHBondContact O-CA 3.5Å; R53-K56 VanDerWaalsContact O-CB 3.31Å; R53-K56 WeakPolarHBondContact O-CB 3.33Å; R53-K56 PolarHBondContact O-N 2.88Å; P54-K56 VanDerWaalsContact C-N 3.34Å; K56-K59 PolarHBondContact O-N 2.91Å; K56-L60 WeakPolarHBondContact O-CG 3.31Å; K56-L60 PolarHBondContact O-N 3.18Å; K56-L60 VanDerWaalsContact O-N 3.07Å; K56-E121 IonicContact NZ-OE2 3.4Å; K56-E121 PolarHBondContact NZ-OE2 2.67Å; K56-M124 HydrophobicContact CB-CG 4.13Å; K56-M124 HydrophobicContact CB-SD 3.51Å; K56-M124 VanDerWaalsContact CB-SD 3.51Å; K56-M124 HydrophobicContact CD-CG 4.13Å; K56-M124 HydrophobicContact CD-SD 3.67Å; K56-M124 HydrophobicContact CG-SD 4.21Å; K56-N125 PolarHBondContact NZ-OD1 3.05Å; K56-L128 HydrophobicContact CB-CD1 3.86Å; K56-L128 HydrophobicContact CD-CD1 3.75Å; K56-L128 HydrophobicContact CG-CD1 3.69Å
57	L	86.4	Confident	85	Confident	13 Å²	13	52.8 Å²	52.8	7%	0.068	27%	0.269	C	S	.	.	H	α-helix	trans	-62.8	-46.5	179.8	-65.8	171.9	0	0	0	112.1	R53 P54 K59 L60 G61 V113 L116 M124	R53-L57 HydrophobicContact CG-CD1 4.48Å; R53-L57 WeakPolarHBondContact O-CG 3.41Å; R53-L57 PolarHBondContact O-N 2.77Å; P54-L57 PolarHBondContact O-N 3.35Å; L57-K59 VanDerWaalsContact C-N 3.31Å; L57-K59 PolarHBondContact O-N 3.2Å; L57-L60 PolarHBondContact O-N 3.29Å; L57-G61 PolarHBondContact O-N 3.39Å; L57-V113 HydrophobicContact CB-CB 4.47Å; L57-V113 HydrophobicContact CB-CG1 4.39Å; L57-V113 HydrophobicContact CB-CG2 4.4Å; L57-V113 HydrophobicContact CD2-CB 4.23Å; L57-L116 HydrophobicContact CD2-CB 3.63Å; L57-L116 HydrophobicContact CD2-CD1 4.36Å; L57-M124 HydrophobicContact CD2-CE 3.64Å; L57-M124 HydrophobicContact CG-CE 4.34Å
58	E	86.6	Confident	85	Confident	70 Å²	70	47.1 Å²	47.1	33%	0.327	25%	0.245	S	C	.	.	H	α-helix	trans	-48.2	-52.3	172.1	-175.8	-165.3	-177.1	0	0	111.8	P54 L60 G61 W77 V96	P54-E58 PolarHBondContact O-N 3.11Å; E58-L60 VanDerWaalsContact C-N 3.33Å; E58-L60 PolarHBondContact O-N 3.41Å; E58-G61 PolarHBondContact O-N 2.92Å; E58-W77 HydrophobicContact CG-CZ3 4.41Å; E58-V96 HydrophobicContact CB-CG1 3.92Å; E58-V96 HydrophobicContact CB-CG2 4.14Å; E58-V96 HydrophobicContact CG-CG1 4.38Å; E58-V96 HydrophobicContact CG-CG2 4.47Å; E58-V96 WeakPolarHBondContact OE2-CG2 3.48Å
59	K	86.7	Confident	84.4	Confident	54 Å²	54	54.9 Å²	54.9	24%	0.235	28%	0.28	C	S	.	.	H	α-helix	trans	-69.3	-28.5	-175.9	-171.1	57.6	168.7	175.1	0	113.2	K55 K56 L57 L128 V131 E135	K55-K59 PolarHBondContact O-N 3.41Å; K56-K59 PolarHBondContact O-N 2.91Å; L57-K59 VanDerWaalsContact C-N 3.31Å; L57-K59 PolarHBondContact O-N 3.2Å; K59-L128 HydrophobicContact CB-CD2 4.09Å; K59-L128 HydrophobicContact CG-CD2 4.03Å; K59-V131 HydrophobicContact CD-CG1 4.35Å; K59-V131 HydrophobicContact CG-CG1 4.23Å; K59-E135 WeakPolarHBondContact CE-OE1 3.18Å; K59-E135 IonicContact NZ-OE1 3.81Å; K59-E135 PolarHBondContact NZ-OE1 3.04Å; K59-E135 IonicContact NZ-OE2 2.75Å; K59-E135 PolarHBondContact NZ-OE2 3.15Å
60	L	86.3	Confident	83.5	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-82.6	-32.9	174.9	-69.1	173.1	0	0	0	112.7	K56 L57 E58 V62 Y63 S64 L116 M124 L127 L128 V131	K56-L60 WeakPolarHBondContact O-CG 3.31Å; K56-L60 PolarHBondContact O-N 3.18Å; K56-L60 VanDerWaalsContact O-N 3.07Å; L57-L60 PolarHBondContact O-N 3.29Å; E58-L60 VanDerWaalsContact C-N 3.33Å; E58-L60 PolarHBondContact O-N 3.41Å; L60-V62 PolarHBondContact O-N 3.25Å; L60-Y63 PolarHBondContact O-N 2.97Å; L60-S64 PolarHBondContact O-N 2.92Å; L60-S64 PolarHBondContact O-OG 3.33Å; L60-L116 HydrophobicContact CB-CD1 3.63Å; L60-L116 HydrophobicContact CD1-CD1 3.92Å; L60-L116 HydrophobicContact CG-CD1 4.39Å; L60-M124 HydrophobicContact CD1-CG 3.65Å; L60-L127 HydrophobicContact CD1-CB 4.42Å; L60-L127 HydrophobicContact CD2-CB 3.67Å; L60-L128 HydrophobicContact CD1-CD2 4.46Å; L60-L128 HydrophobicContact CD1-CG 4.33Å; L60-L128 HydrophobicContact CD2-CD2 4.03Å; L60-L128 HydrophobicContact CD2-CG 4.2Å; L60-L128 HydrophobicContact CG-CD2 3.91Å; L60-L128 HydrophobicContact CG-CG 4.24Å; L60-V131 HydrophobicContact CD2-CG2 3.96Å
61	G	85.4	Confident	83.1	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-57.3	-35.3	178.7	0	0	0	0	0	112.9	L57 E58 Y63 S64 W77	L57-G61 PolarHBondContact O-N 3.39Å; E58-G61 PolarHBondContact O-N 2.92Å; G61-Y63 PolarHBondContact O-N 2.9Å; G61-Y63 VanDerWaalsContact O-N 3.1Å; G61-S64 PolarHBondContact O-N 3Å; G61-S64 VanDerWaalsContact O-N 3.17Å; G61-W77 WeakPolarHBondContact O-CB 3.28Å; G61-W77 PolarHBondContact O-N 3.5Å
62	V	87.6	Confident	83.1	Confident	58 Å²	58	54.3 Å²	54.3	35%	0.352	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-23.5	174.6	178	0	0	0	0	113.5	L60 G76 W77	L60-V62 PolarHBondContact O-N 3.25Å; V62-G76 WeakPolarHBondContact O-CA 3.36Å; V62-W77 WeakPolarHBondContact CA-O 3.48Å; V62-W77 HydrophobicContact CG2-CE3 4.04Å; V62-W77 HydrophobicContact CG2-CZ3 4.49Å
63	Y	85.2	Confident	83.1	Confident	34 Å²	34	58.8 Å²	58.8	13%	0.133	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	5	-177.9	-61.7	-89.3	0	0	0	113.4	L60 G61 V131 V134 E135 I164 L165	L60-Y63 PolarHBondContact O-N 2.97Å; G61-Y63 PolarHBondContact O-N 2.9Å; G61-Y63 VanDerWaalsContact O-N 3.1Å; Y63-V131 HydrophobicContact CD2-CB 4.42Å; Y63-V131 HydrophobicContact CD2-CG1 3.93Å; Y63-V131 HydrophobicContact CD2-CG2 3.63Å; Y63-V131 HydrophobicContact CE2-CB 4.35Å; Y63-V131 HydrophobicContact CE2-CG1 3.48Å; Y63-V131 VanDerWaalsContact CE2-CG1 3.48Å; Y63-V131 HydrophobicContact CE2-CG2 4.04Å; Y63-V131 HydrophobicContact CG-CG2 4.08Å; Y63-V134 HydrophobicContact CE1-CG1 3.82Å; Y63-E135 WeakPolarHBondContact OH-CG 3.35Å; Y63-E135 PolarHBondContact OH-OE1 2.95Å; Y63-I164 HydrophobicContact CD1-CD1 4.29Å; Y63-I164 HydrophobicContact CG-CD1 4.3Å; Y63-L165 WeakPolarHBondContact O-CD2 3.32Å
64	S	86.1	Confident	83.3	Confident	2 Å²	2	56 Å²	56	1%	0.014	31%	0.309	C	S	.	.	S	Bend	trans	-104.7	147.2	-174.9	-68.2	0	0	0	0	112.7	L60 G61 N75 G76 H112 H115	L60-S64 PolarHBondContact O-N 2.92Å; L60-S64 PolarHBondContact O-OG 3.33Å; G61-S64 PolarHBondContact O-N 3Å; G61-S64 VanDerWaalsContact O-N 3.17Å; S64-N75 CarbonylContact O-C 3.41Å; S64-G76 VanDerWaalsContact O-CA 3.29Å; S64-G76 WeakPolarHBondContact O-CA 3.45Å; S64-G76 PolarHBondContact O-N 3.3Å; S64-H112 WeakPolarHBondContact CB-O 3.35Å; S64-H115 WeakPolarHBondContact CB-CE1 3.37Å; S64-H115 WeakPolarHBondContact CB-NE2 3.34Å; S64-H115 PolarHBondContact OG-NE2 2.88Å
65	S	86.3	Confident	83.3	Confident	19 Å²	19	57 Å²	57	13%	0.133	31%	0.311	C	S	.	.			trans	-74.7	137.5	175.3	66	0	0	0	0	111.7	K67 C74 H115	S65-K67 VanDerWaalsContact OG-CE 3.26Å; S65-K67 WeakPolarHBondContact OG-CE 3.48Å; S65-K67 PolarHBondContact OG-NZ 2.93Å; S65-C74 CarbonylContact C-O 3.46Å; S65-C74 VanDerWaalsContact CA-O 3.27Å; S65-C74 WeakPolarHBondContact CA-O 3.35Å; S65-H115 PolarHBondContact O-CE1 3.12Å
66	C	88	Confident	83.4	Confident	8 Å²	8	52.3 Å²	52.3	5%	0.054	29%	0.293	C	S	.	.			trans	-63.4	140.3	170.1	-173.2	0	0	0	0	111.3	C72 C74 H107 D111	C66-C72 HydrophobicContact CB-CB 4.43Å; C66-C74 HydrophobicContact CB-CB 3.82Å; C66-C74 PolarHBondContact N-O 3.13Å; C66-H107 PolarHBondContact SG-ND1 3.2Å; C66-H107 VanDerWaalsContact SG-ND1 3.37Å; C66-D111 CarbonylContact C-O 3.56Å; C66-D111 WeakPolarHBondContact CA-O 3.49Å
67	K	85.2	Confident	83.4	Confident	121 Å²	121	52.6 Å²	52.6	53%	0.526	29%	0.294	S	S	.	.			trans	-120.1	10.7	-180	-57.4	-56.5	-169.8	-163.6	0	113.5	S65 D111	S65-K67 VanDerWaalsContact OG-CE 3.26Å; S65-K67 WeakPolarHBondContact OG-CE 3.48Å; S65-K67 PolarHBondContact OG-NZ 2.93Å; K67-D111 PolarHBondContact N-O 2.69Å
68	A	83.3	Confident	83.3	Confident	15 Å²	15	57.7 Å²	57.7	12%	0.124	32%	0.316	C	S	.	.			trans	-56.8	156.8	173.7	0	0	0	0	0	111.9	H107 D111	A68-H107 HydrophobicContact CB-CB 4Å; A68-H107 VanDerWaalsContact CB-ND1 3.34Å; A68-H107 WeakPolarHBondContact CB-ND1 3.48Å; A68-D111 HydrophobicContact CB-CB 3.99Å
69	E	67.1	Low	83	Confident	192 Å²	192	56.1 Å²	56.1	90%	0.897	31%	0.312	S	S	*	.	S	Bend	trans	-66.1	146.5	-179.5	-59.6	-169.4	153.2	0	0	112.5
70	G	63.5	Low	82.2	Confident	66 Å²	66	58.2 Å²	58.2	68%	0.68	32%	0.323	S	S	*	.	S	Bend	trans	82.7	156.3	-164.9	0	0	0	0	0	112.7	C72	G70-C72 PolarHBondContact O-N 2.95Å
71	A	74.8	Confident	81.2	Confident	103 Å²	103	64.5 Å²	64.5	85%	0.851	36%	0.357	S	S	*	.			trans	-76.8	60.9	-166.4	0	0	0	0	0	114.6
72	C	84.5	Confident	79.7	Confident	40 Å²	40	68.9 Å²	68.9	27%	0.27	39%	0.385	S	S	.	.			trans	-64.7	131.6	180	-167.1	0	0	0	0	112.1	C66 G70	C66-C72 HydrophobicContact CB-CB 4.43Å; G70-C72 PolarHBondContact O-N 2.95Å
73	K	84.6	Confident	78	Confident	188 Å²	188	71.2 Å²	71.2	82%	0.817	40%	0.402	S	S	*	.			trans	-104.9	19.5	178.3	-60.5	-177.9	-177.3	176.4	0	113.2	N75	K73-N75 PolarHBondContact O-ND2 3.19Å
74	C	87	Confident	75.9	Confident	14 Å²	14	74.5 Å²	74.5	10%	0.095	43%	0.427	C	S	.	.			trans	-74.2	126.9	179.6	-172.2	0	0	0	0	111	S65 C66 G76 C105 H112	S65-C74 CarbonylContact C-O 3.46Å; S65-C74 VanDerWaalsContact CA-O 3.27Å; S65-C74 WeakPolarHBondContact CA-O 3.35Å; C66-C74 HydrophobicContact CB-CB 3.82Å; C66-C74 PolarHBondContact N-O 3.13Å; C74-G76 PolarHBondContact SG-O 3.37Å; C74-G76 VanDerWaalsContact SG-O 3.42Å; C74-C105 HydrophobicContact CB-CB 3.91Å; C74-H112 PolarHBondContact SG-NE2 3.11Å
75	N	84.1	Confident	73.5	Confident	87 Å²	87	80.9 Å²	80.9	47%	0.465	47%	0.466	S	S	.	.			trans	-115.2	30.8	-175.9	-66.4	-56.2	0	0	0	112.7	S64 K73 L165	S64-N75 CarbonylContact O-C 3.41Å; K73-N75 PolarHBondContact O-ND2 3.19Å; N75-L165 HydrophobicContact CB-CD2 4.23Å
76	G	86.3	Confident	71.3	Confident	9 Å²	9	85 Å²	85	9%	0.093	49%	0.492	C	S	.	.	S	Bend	trans	161.1	125.3	177.5	0	0	0	0	0	112.7	V62 S64 C74	V62-G76 WeakPolarHBondContact O-CA 3.36Å; S64-G76 VanDerWaalsContact O-CA 3.29Å; S64-G76 WeakPolarHBondContact O-CA 3.45Å; S64-G76 PolarHBondContact O-N 3.3Å; C74-G76 PolarHBondContact SG-O 3.37Å; C74-G76 VanDerWaalsContact SG-O 3.42Å
77	W	86.8	Confident	68.9	Low	10 Å²	10	90 Å²	90	4%	0.038	53%	0.525	C	S	.	.			trans	-62.6	147.7	173.8	178.2	91.8	0	0	0	111.2	E58 G61 V62 S79 E100 C102 L109 H112	E58-W77 HydrophobicContact CG-CZ3 4.41Å; G61-W77 WeakPolarHBondContact O-CB 3.28Å; G61-W77 PolarHBondContact O-N 3.5Å; V62-W77 WeakPolarHBondContact CA-O 3.48Å; V62-W77 HydrophobicContact CG2-CE3 4.04Å; V62-W77 HydrophobicContact CG2-CZ3 4.49Å; W77-S79 VanDerWaalsContact CH2-CB 3.48Å; W77-E100 HydrophobicContact CZ2-CB 4.04Å; W77-E100 HydrophobicContact CZ2-CG 4.05Å; W77-E100 PolarHBondContact NE1-O 2.92Å; W77-C102 HydrophobicContact CG-CB 4.37Å; W77-L109 HydrophobicContact CB-CD1 4.21Å; W77-L109 HydrophobicContact CD2-CD1 3.81Å; W77-L109 HydrophobicContact CE3-CD1 4.23Å; W77-L109 HydrophobicContact CG-CD1 3.8Å; W77-L109 HydrophobicContact CZ2-CB 4.4Å; W77-L109 HydrophobicContact CZ2-CD2 4.45Å; W77-H112 HydrophobicContact CB-CB 4.08Å; W77-H112 PolarHBondContact N-CD2 3.23Å
78	K	84.4	Confident	66.5	Low	121 Å²	121	93 Å²	93	53%	0.526	54%	0.54	S	S	.	.			trans	-137.9	121.2	172.7	-59.6	-176.7	-162.6	140.3	0	109.1	C102 R103 S104	K78-C102 PolarHBondContact N-SG 3.31Å; K78-C102 VanDerWaalsContact N-SG 3.43Å; K78-R103 HydrophobicContact CB-CB 4.25Å; K78-R103 PolarHBondContact O-N 3.07Å; K78-S104 VanDerWaalsContact CD-OG 3.28Å; K78-S104 WeakPolarHBondContact CD-OG 3.29Å; K78-S104 VanDerWaalsContact CE-OG 3.26Å; K78-S104 WeakPolarHBondContact CE-OG 3.5Å; K78-S104 PolarHBondContact NZ-OG 2.89Å
79	S	79.8	Confident	64.1	Low	36 Å²	36	98.1 Å²	98.1	25%	0.252	57%	0.57	S	S	.	*			trans	-54.4	150.5	171	-179.9	0	0	0	0	111.5	W77 N81 E100	W77-S79 VanDerWaalsContact CH2-CB 3.48Å; S79-N81 PolarHBondContact OG-N 2.84Å; S79-N81 VanDerWaalsContact OG-N 3.1Å; S79-E100 WeakPolarHBondContact CA-OE1 3.36Å; S79-E100 VanDerWaalsContact CB-OE1 3.3Å; S79-E100 WeakPolarHBondContact CB-OE1 3.27Å; S79-E100 PolarHBondContact OG-OE1 2.84Å
80	Q	70.2	Confident	62.4	Low	99 Å²	99	95.7 Å²	95.7	46%	0.463	56%	0.564	S	S	.	*	S	Bend	trans	-78.5	-24.8	172.2	-53	-156	-6	0	0	112.2	P82 E100 P101	Q80-P82 WeakPolarHBondContact O-CD 3.5Å; Q80-E100 PolarHBondContact N-OE1 2.98Å; Q80-P101 VanDerWaalsContact CG-O 3.28Å; Q80-P101 WeakPolarHBondContact CG-O 3.5Å; Q80-P101 PolarHBondContact NE2-O 3.12Å
81	N	64.3	Low	61.2	Low	133 Å²	133	101.6 Å²	101.6	71%	0.711	57%	0.574	S	S	*	*	S	Bend	trans	-107.3	82.1	-177.6	-67.6	-35.4	0	0	0	110.6	S79	S79-N81 PolarHBondContact OG-N 2.84Å; S79-N81 VanDerWaalsContact OG-N 3.1Å
82	P	54.8	Low	59.3	Low	91 Å²	91	105.4 Å²	105.4	59%	0.591	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-62.9	136.9	175.6	27.8	-34.8	0	0	0	110.3	Q80	Q80-P82 WeakPolarHBondContact O-CD 3.5Å
83	P	51.4	Low	57.5	Low	108 Å²	108	109.1 Å²	109.1	70%	0.701	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-62.3	143.3	176	26.2	-34.2	0	0	0	110.5
84	P	42.1	Very low	55.6	Low	102 Å²	102	106.8 Å²	106.8	66%	0.662	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-61.7	144.8	-179.1	25.7	-34.3	0	0	0	111.3	P86	P84-P86 CarbonylContact O-C 3.59Å
85	T	34.5	Very low	54	Low	137 Å²	137	112.8 Å²	112.8	84%	0.84	63%	0.633	S	S	*	*	S	Bend	trans	-106.7	126.1	176.5	-43.7	0	0	0	0	108.3
86	P	40.5	Very low	53	Low	105 Å²	105	110.3 Å²	110.3	68%	0.682	62%	0.621	S	S	*	*	S	Bend	cis	-77.6	156.5	3.5	33.7	-36.7	0	0	0	113.7	P84 Q88	P84-P86 CarbonylContact O-C 3.59Å; P86-Q88 PolarHBondContact O-N 3.42Å
87	P	38.5	Very low	52.6	Low	113 Å²	113	113.9 Å²	113.9	73%	0.734	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-68.6	119.4	177.6	28.7	-34.4	0	0	0	111
88	Q	33.1	Very low	52.2	Low	183 Å²	183	115.9 Å²	115.9	86%	0.855	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-69.5	150.8	169.2	-72.2	-177.3	-24	0	0	111	P86	P86-Q88 PolarHBondContact O-N 3.42Å
89	T	33.7	Very low	52	Low	123 Å²	123	116.8 Å²	116.8	76%	0.755	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-81.8	143.8	170.9	40.8	0	0	0	0	111.3
90	D	31	Very low	52.2	Low	142 Å²	142	117.4 Å²	117.4	76%	0.759	65%	0.654	S	S	*	*	S	Bend	trans	79.5	132.8	163.8	-58.2	-51.8	0	0	0	120.2
91	Q	38.1	Very low	52.9	Low	189 Å²	189	115.1 Å²	115.1	88%	0.883	65%	0.648	S	S	*	*			trans	49.8	80.1	153	-59.7	-177.2	13.1	0	0	119.1
92	Q	35.5	Very low	54.1	Low	183 Å²	183	108.8 Å²	108.8	86%	0.855	61%	0.614	S	S	*	*			trans	-128.7	138.9	145.7	-73.2	-171.3	-10.9	0	0	111.3
93	S	46.2	Very low	55.6	Low	118 Å²	118	113.4 Å²	113.4	83%	0.825	62%	0.62	S	S	*	*			trans	-98.3	94.7	-174.9	53.8	0	0	0	0	111.4
94	N	44.8	Very low	57.3	Low	139 Å²	139	110.9 Å²	110.9	74%	0.743	61%	0.605	S	S	*	*			trans	-98.8	112.2	172.3	-71.9	6.8	0	0	0	110.6	V96	N94-V96 PolarHBondContact O-N 2.7Å
95	T	54.4	Low	59.5	Low	140 Å²	140	107.3 Å²	107.3	86%	0.859	58%	0.582	S	S	*	*			trans	-65.9	114.9	155.9	25.9	0	0	0	0	108.4	N97	T95-N97 PolarHBondContact O-N 3.47Å
96	V	62.8	Low	61.9	Low	35 Å²	35	105.3 Å²	105.3	21%	0.212	57%	0.573	C	S	.	*			trans	-62.3	119.2	178.3	176.2	0	0	0	0	109.4	P54 K55 E58 N94 L109	P54-V96 HydrophobicContact CB-CB 3.95Å; P54-V96 HydrophobicContact CB-CG2 4.38Å; K55-V96 HydrophobicContact CB-CG2 4.49Å; E58-V96 HydrophobicContact CB-CG1 3.92Å; E58-V96 HydrophobicContact CB-CG2 4.14Å; E58-V96 HydrophobicContact CG-CG1 4.38Å; E58-V96 HydrophobicContact CG-CG2 4.47Å; E58-V96 WeakPolarHBondContact OE2-CG2 3.48Å; N94-V96 PolarHBondContact O-N 2.7Å; V96-L109 HydrophobicContact CG1-CD2 3.79Å
97	N	77.3	Confident	64.2	Low	84 Å²	84	103.2 Å²	103.2	45%	0.449	55%	0.554	S	S	.	*			trans	-94.4	111.5	177.7	-172.4	-16.7	0	0	0	110.4	T95 Q99 E100	T95-N97 PolarHBondContact O-N 3.47Å; N97-Q99 PolarHBondContact O-N 2.72Å; N97-Q99 WeakPolarHBondContact OD1-CB 3.39Å; N97-Q99 PolarHBondContact OD1-N 3.49Å; N97-Q99 PolarHBondContact OD1-OE1 3.2Å; N97-E100 PolarHBondContact O-N 2.9Å
98	L	77.8	Confident	66.6	Low	53 Å²	53	99.9 Å²	99.9	28%	0.277	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-18.4	178.5	-66.4	175.9	0	0	0	113.3	E100 T108 L109 G110 V113	L98-E100 VanDerWaalsContact C-N 3.34Å; L98-T108 WeakPolarHBondContact O-CB 3.47Å; L98-L109 HydrophobicContact CD2-CD2 4.08Å; L98-L109 HydrophobicContact CD2-CG 4.14Å; L98-L109 WeakPolarHBondContact O-CB 3.24Å; L98-L109 PolarHBondContact O-N 3.38Å; L98-G110 PolarHBondContact O-N 2.81Å; L98-V113 HydrophobicContact CD2-CG2 4.19Å
99	Q	80.6	Confident	69.2	Low	139 Å²	139	91.2 Å²	91.2	65%	0.65	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-1.2	174.5	-64.4	94.7	39.2	0	0	114.2	N97 P101	N97-Q99 PolarHBondContact O-N 2.72Å; N97-Q99 WeakPolarHBondContact OD1-CB 3.39Å; N97-Q99 PolarHBondContact OD1-N 3.49Å; N97-Q99 PolarHBondContact OD1-OE1 3.2Å; Q99-P101 VanDerWaalsContact O-CD 3.28Å; Q99-P101 WeakPolarHBondContact O-CD 3.38Å
100	E	84.6	Confident	71.6	Confident	49 Å²	49	86 Å²	86	23%	0.229	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-64.9	119.5	-178.4	-169.9	-172.9	152.9	0	0	112.1	W77 S79 Q80 N97 L98 T108 L109	W77-E100 HydrophobicContact CZ2-CB 4.04Å; W77-E100 HydrophobicContact CZ2-CG 4.05Å; W77-E100 PolarHBondContact NE1-O 2.92Å; S79-E100 WeakPolarHBondContact CA-OE1 3.36Å; S79-E100 VanDerWaalsContact CB-OE1 3.3Å; S79-E100 WeakPolarHBondContact CB-OE1 3.27Å; S79-E100 PolarHBondContact OG-OE1 2.84Å; Q80-E100 PolarHBondContact N-OE1 2.98Å; N97-E100 PolarHBondContact O-N 2.9Å; L98-E100 VanDerWaalsContact C-N 3.34Å; E100-T108 CarbonylContact O-C 3.59Å; E100-L109 PolarHBondContact O-N 2.87Å
101	P	85.6	Confident	74.3	Confident	52 Å²	52	81.2 Å²	81.2	34%	0.338	44%	0.437	S	S	.	.	B	Isolated β-bridge	trans	-76.9	127.3	-173.5	24.7	-27.3	0	0	0	113.3	Q80 Q99 R103 S106	Q80-P101 VanDerWaalsContact CG-O 3.28Å; Q80-P101 WeakPolarHBondContact CG-O 3.5Å; Q80-P101 PolarHBondContact NE2-O 3.12Å; Q99-P101 VanDerWaalsContact O-CD 3.28Å; Q99-P101 WeakPolarHBondContact O-CD 3.38Å; P101-R103 PolarHBondContact O-N 3.24Å; P101-S106 WeakPolarHBondContact CB-O 3.42Å
102	C	87.8	Confident	76.5	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-60.8	125	-178	177.9	0	0	0	0	112.6	W77 K78 S104 C105 S106 H107	W77-C102 HydrophobicContact CG-CB 4.37Å; K78-C102 PolarHBondContact N-SG 3.31Å; K78-C102 VanDerWaalsContact N-SG 3.43Å; C102-S104 PolarHBondContact O-N 3.46Å; C102-S104 PolarHBondContact SG-N 3.29Å; C102-S104 VanDerWaalsContact SG-N 3.38Å; C102-C105 PolarHBondContact O-N 2.94Å; C102-S106 WeakPolarHBondContact O-CA 3.46Å; C102-S106 PolarHBondContact O-N 2.9Å; C102-H107 WeakPolarHBondContact CB-O 3.44Å; C102-H107 PolarHBondContact N-O 2.76Å
103	R	87.9	Confident	79.1	Confident	187 Å²	187	63.5 Å²	63.5	71%	0.706	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-16.7	176.3	-177.3	174.2	172.5	-166.8	-0.9	114.7	K78 P101	K78-R103 HydrophobicContact CB-CB 4.25Å; K78-R103 PolarHBondContact O-N 3.07Å; P101-R103 PolarHBondContact O-N 3.24Å
104	S	86.2	Confident	81	Confident	55 Å²	55	60.7 Å²	60.7	39%	0.385	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-17.8	-177.8	-46.1	0	0	0	0	115	K78 C102	K78-S104 VanDerWaalsContact CD-OG 3.28Å; K78-S104 WeakPolarHBondContact CD-OG 3.29Å; K78-S104 VanDerWaalsContact CE-OG 3.26Å; K78-S104 WeakPolarHBondContact CE-OG 3.5Å; K78-S104 PolarHBondContact NZ-OG 2.89Å; C102-S104 PolarHBondContact O-N 3.46Å; C102-S104 PolarHBondContact SG-N 3.29Å; C102-S104 VanDerWaalsContact SG-N 3.38Å
105	C	87.8	Confident	82.8	Confident	27 Å²	27	56.8 Å²	56.8	18%	0.182	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-154.1	8.4	-175.4	68.2	0	0	0	0	114.9	C74 C102 H107 H112	C74-C105 HydrophobicContact CB-CB 3.91Å; C102-C105 PolarHBondContact O-N 2.94Å; C105-H107 PolarHBondContact O-CD2 3.46Å; C105-H107 PolarHBondContact O-N 3.01Å; C105-H112 VanDerWaalsContact SG-CE1 3.58Å
106	S	86.8	Confident	84.2	Confident	95 Å²	95	50.2 Å²	50.2	66%	0.664	27%	0.268	S	S	*	.	S	Bend	trans	60.7	-16.5	-179.6	-54.3	0	0	0	0	117.4	P101 C102	P101-S106 WeakPolarHBondContact CB-O 3.42Å; C102-S106 WeakPolarHBondContact O-CA 3.46Å; C102-S106 PolarHBondContact O-N 2.9Å
107	H	88.3	Confident	85.1	Confident	61 Å²	61	52.9 Å²	52.9	28%	0.282	28%	0.278	S	S	.	.			trans	-65.9	153.3	173.4	-51	152.4	0	0	0	112.3	C66 A68 C102 C105 D111	C66-H107 PolarHBondContact SG-ND1 3.2Å; C66-H107 VanDerWaalsContact SG-ND1 3.37Å; A68-H107 HydrophobicContact CB-CB 4Å; A68-H107 VanDerWaalsContact CB-ND1 3.34Å; A68-H107 WeakPolarHBondContact CB-ND1 3.48Å; C102-H107 WeakPolarHBondContact CB-O 3.44Å; C102-H107 PolarHBondContact N-O 2.76Å; C105-H107 PolarHBondContact O-CD2 3.46Å; C105-H107 PolarHBondContact O-N 3.01Å; H107-D111 HydrophobicContact CB-CB 4.05Å
108	T	89.2	Confident	85.3	Confident	44 Å²	44	56.7 Å²	56.7	27%	0.27	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-67.9	167.1	-170.4	69.6	0	0	0	0	113.4	L98 E100 G110 D111 H112	L98-T108 WeakPolarHBondContact O-CB 3.47Å; E100-T108 CarbonylContact O-C 3.59Å; T108-G110 VanDerWaalsContact C-N 3.26Å; T108-G110 PolarHBondContact OG1-N 2.98Å; T108-D111 WeakPolarHBondContact CA-OD2 3.18Å; T108-D111 WeakPolarHBondContact CB-OD2 3.25Å; T108-D111 PolarHBondContact N-OD2 2.96Å; T108-D111 PolarHBondContact O-N 3.16Å; T108-D111 VanDerWaalsContact OG1-CG 3.26Å; T108-D111 PolarHBondContact OG1-N 2.86Å; T108-D111 PolarHBondContact OG1-OD2 3.03Å; T108-H112 PolarHBondContact O-ND1 3.37Å
109	L	85.9	Confident	85.7	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.005	29%	0.293	C	S	.	.	S	Bend	trans	-60.5	-38.7	166.5	175.1	58.6	0	0	0	110.9	W77 V96 L98 E100 D111 H112 V113	W77-L109 HydrophobicContact CB-CD1 4.21Å; W77-L109 HydrophobicContact CD2-CD1 3.81Å; W77-L109 HydrophobicContact CE3-CD1 4.23Å; W77-L109 HydrophobicContact CG-CD1 3.8Å; W77-L109 HydrophobicContact CZ2-CB 4.4Å; W77-L109 HydrophobicContact CZ2-CD2 4.45Å; V96-L109 HydrophobicContact CG1-CD2 3.79Å; L98-L109 HydrophobicContact CD2-CD2 4.08Å; L98-L109 HydrophobicContact CD2-CG 4.14Å; L98-L109 WeakPolarHBondContact O-CB 3.24Å; L98-L109 PolarHBondContact O-N 3.38Å; E100-L109 PolarHBondContact O-N 2.87Å; L109-D111 VanDerWaalsContact C-N 3.34Å; L109-D111 PolarHBondContact O-N 2.82Å; L109-H112 WeakPolarHBondContact O-CA 3.41Å; L109-H112 WeakPolarHBondContact O-CB 3.28Å; L109-H112 PolarHBondContact O-N 3.27Å; L109-V113 HydrophobicContact CD1-CG1 3.95Å; L109-V113 WeakPolarHBondContact O-CG2 3.03Å; L109-V113 PolarHBondContact O-N 3.14Å
110	G	84.9	Confident	86.1	Confident	12 Å²	12	51.9 Å²	51.9	12%	0.124	28%	0.284	C	S	.	.	H	α-helix	trans	-48.4	-52.2	172.1	0	0	0	0	0	112.4	L98 T108 H112 V113 T114	L98-G110 PolarHBondContact O-N 2.81Å; T108-G110 VanDerWaalsContact C-N 3.26Å; T108-G110 PolarHBondContact OG1-N 2.98Å; G110-H112 PolarHBondContact O-N 3.46Å; G110-V113 CarbonylContact O-C 3.58Å; G110-V113 PolarHBondContact O-N 2.82Å; G110-T114 WeakPolarHBondContact O-CG2 3.27Å; G110-T114 PolarHBondContact O-N 3.14Å
111	D	86.9	Confident	86.1	Confident	43 Å²	43	53.2 Å²	53.2	23%	0.23	29%	0.29	C	S	.	.	H	α-helix	trans	-58.7	-17.3	177.9	-61.5	-62.2	0	0	0	114.4	C66 K67 A68 H107 T108 L109	C66-D111 CarbonylContact C-O 3.56Å; C66-D111 WeakPolarHBondContact CA-O 3.49Å; K67-D111 PolarHBondContact N-O 2.69Å; A68-D111 HydrophobicContact CB-CB 3.99Å; H107-D111 HydrophobicContact CB-CB 4.05Å; T108-D111 WeakPolarHBondContact CA-OD2 3.18Å; T108-D111 WeakPolarHBondContact CB-OD2 3.25Å; T108-D111 PolarHBondContact N-OD2 2.96Å; T108-D111 PolarHBondContact O-N 3.16Å; T108-D111 VanDerWaalsContact OG1-CG 3.26Å; T108-D111 PolarHBondContact OG1-N 2.86Å; T108-D111 PolarHBondContact OG1-OD2 3.03Å; L109-D111 VanDerWaalsContact C-N 3.34Å; L109-D111 PolarHBondContact O-N 2.82Å
112	H	86.1	Confident	86.2	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-99.4	-7.4	176.3	-63.6	72.7	0	0	0	113.1	S64 C74 W77 C105 T108 L109 G110 H115	S64-H112 WeakPolarHBondContact CB-O 3.35Å; C74-H112 PolarHBondContact SG-NE2 3.11Å; W77-H112 HydrophobicContact CB-CB 4.08Å; W77-H112 PolarHBondContact N-CD2 3.23Å; C105-H112 VanDerWaalsContact SG-CE1 3.58Å; T108-H112 PolarHBondContact O-ND1 3.37Å; L109-H112 WeakPolarHBondContact O-CA 3.41Å; L109-H112 WeakPolarHBondContact O-CB 3.28Å; L109-H112 PolarHBondContact O-N 3.27Å; G110-H112 PolarHBondContact O-N 3.46Å; H112-H115 PolarHBondContact O-CE1 3.06Å
113	V	88.4	Confident	86.1	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-129.5	0.9	-175.7	-53.3	0	0	0	0	115	L57 L98 L109 G110 H115 L116 E117	L57-V113 HydrophobicContact CB-CB 4.47Å; L57-V113 HydrophobicContact CB-CG1 4.39Å; L57-V113 HydrophobicContact CB-CG2 4.4Å; L57-V113 HydrophobicContact CD2-CB 4.23Å; L98-V113 HydrophobicContact CD2-CG2 4.19Å; L109-V113 HydrophobicContact CD1-CG1 3.95Å; L109-V113 WeakPolarHBondContact O-CG2 3.03Å; L109-V113 PolarHBondContact O-N 3.14Å; G110-V113 CarbonylContact O-C 3.58Å; G110-V113 PolarHBondContact O-N 2.82Å; V113-H115 VanDerWaalsContact C-N 3.26Å; V113-H115 PolarHBondContact O-N 3.16Å; V113-L116 HydrophobicContact CB-CD1 4.34Å; V113-L116 HydrophobicContact CG1-CD1 4.43Å; V113-L116 WeakPolarHBondContact O-CA 3.49Å; V113-L116 VanDerWaalsContact O-CB 3.32Å; V113-L116 WeakPolarHBondContact O-CB 3.41Å; V113-L116 PolarHBondContact O-N 3.08Å; V113-E117 PolarHBondContact O-N 2.84Å
114	T	86.7	Confident	86	Confident	59 Å²	59	51.9 Å²	51.9	36%	0.362	29%	0.287	S	S	.	.	H	α-helix	trans	-47.4	-44.9	176.5	50	0	0	0	0	113.3	G110 L116 E117	G110-T114 WeakPolarHBondContact O-CG2 3.27Å; G110-T114 PolarHBondContact O-N 3.14Å; T114-L116 PolarHBondContact O-N 3.07Å; T114-L116 VanDerWaalsContact O-N 3.1Å; T114-E117 PolarHBondContact O-N 2.99Å
115	H	83.6	Confident	86.1	Confident	57 Å²	57	51 Å²	51	26%	0.264	28%	0.279	S	S	.	.	H	α-helix	trans	-68.2	-4.8	177.3	59.8	-85.5	0	0	0	114.7	S64 S65 H112 V113 V119	S64-H115 WeakPolarHBondContact CB-CE1 3.37Å; S64-H115 WeakPolarHBondContact CB-NE2 3.34Å; S64-H115 PolarHBondContact OG-NE2 2.88Å; S65-H115 PolarHBondContact O-CE1 3.12Å; H112-H115 PolarHBondContact O-CE1 3.06Å; V113-H115 VanDerWaalsContact C-N 3.26Å; V113-H115 PolarHBondContact O-N 3.16Å; H115-V119 WeakPolarHBondContact O-CG2 3.1Å
116	L	83.6	Confident	86.2	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-106.9	-12.7	176.6	-55.5	174.9	0	0	0	113	R53 L57 L60 V113 T114 N118 V119 L127 M167	R53-L116 PolarHBondContact NH2-O 3.02Å; L57-L116 HydrophobicContact CD2-CB 3.63Å; L57-L116 HydrophobicContact CD2-CD1 4.36Å; L60-L116 HydrophobicContact CB-CD1 3.63Å; L60-L116 HydrophobicContact CD1-CD1 3.92Å; L60-L116 HydrophobicContact CG-CD1 4.39Å; V113-L116 HydrophobicContact CB-CD1 4.34Å; V113-L116 HydrophobicContact CG1-CD1 4.43Å; V113-L116 WeakPolarHBondContact O-CA 3.49Å; V113-L116 VanDerWaalsContact O-CB 3.32Å; V113-L116 WeakPolarHBondContact O-CB 3.41Å; V113-L116 PolarHBondContact O-N 3.08Å; T114-L116 PolarHBondContact O-N 3.07Å; T114-L116 VanDerWaalsContact O-N 3.1Å; L116-N118 VanDerWaalsContact C-N 3.33Å; L116-N118 PolarHBondContact O-N 3.33Å; L116-V119 HydrophobicContact CD2-CG2 4.5Å; L116-V119 PolarHBondContact O-N 3.12Å; L116-L127 HydrophobicContact CD2-CD1 3.93Å; L116-M167 HydrophobicContact CD2-CE 4.04Å; L116-M167 HydrophobicContact CD2-SD 4.37Å
117	E	80.2	Confident	86.2	Confident	91 Å²	91	48.2 Å²	48.2	43%	0.425	25%	0.25	S	C	.	.	H	α-helix	trans	-62.9	-38.5	-175	-67.3	-172.7	146.1	0	0	112.5	R53 V113 T114	R53-E117 PolarHBondContact NH2-O 2.87Å; V113-E117 PolarHBondContact O-N 2.84Å; T114-E117 PolarHBondContact O-N 2.99Å
118	N	82.5	Confident	86.2	Confident	164 Å²	164	45.4 Å²	45.4	88%	0.877	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.1	9.1	179.3	-66.3	-44	0	0	0	114	L116	L116-N118 VanDerWaalsContact C-N 3.33Å; L116-N118 PolarHBondContact O-N 3.33Å
119	V	86.3	Confident	86.1	Confident	24 Å²	24	43.4 Å²	43.4	15%	0.145	23%	0.225	C	C	.	.	S	Bend	trans	-84.9	142.5	-176.4	174.7	0	0	0	0	111.6	R53 H115 L116 E123 M167	R53-V119 PolarHBondContact NH1-O 3.37Å; R53-V119 VanDerWaalsContact NH1-O 3.14Å; R53-V119 PolarHBondContact NH2-O 3.35Å; H115-V119 WeakPolarHBondContact O-CG2 3.1Å; L116-V119 HydrophobicContact CD2-CG2 4.5Å; L116-V119 PolarHBondContact O-N 3.12Å; V119-E123 HydrophobicContact CG1-CB 3.64Å; V119-E123 HydrophobicContact CG1-CG 3.49Å; V119-E123 VanDerWaalsContact CG1-CG 3.49Å; V119-M167 HydrophobicContact CG2-CE 3.85Å
120	S	88.6	Confident	86.3	Confident	67 Å²	67	43.4 Å²	43.4	47%	0.469	23%	0.225	S	C	.	.			trans	-62.1	150.9	179.4	71.5	0	0	0	0	112.3	E122 E123 M124	S120-E122 PolarHBondContact O-N 2.91Å; S120-E123 PolarHBondContact O-N 2.89Å; S120-E123 WeakPolarHBondContact OG-CB 3.21Å; S120-E123 PolarHBondContact OG-N 3.27Å; S120-M124 WeakPolarHBondContact O-CB 3.41Å; S120-M124 PolarHBondContact O-N 3.25Å
121	E	85.3	Confident	86.5	Confident	77 Å²	77	42.9 Å²	42.9	36%	0.36	22%	0.219	S	C	.	.	H	α-helix	trans	-59.9	-31.8	176.8	-78.4	-67.5	135.8	0	0	112.3	R53 K56 N125	R53-E121 WeakPolarHBondContact CD-OE1 3.5Å; R53-E121 IonicContact CZ-OE1 2.68Å; R53-E121 IonicContact NE-OE1 3.76Å; R53-E121 IonicContact NH1-OE1 3.22Å; R53-E121 PolarHBondContact NH1-OE1 2.94Å; K56-E121 IonicContact NZ-OE2 3.4Å; K56-E121 PolarHBondContact NZ-OE2 2.67Å; E121-N125 WeakPolarHBondContact O-CB 3.47Å; E121-N125 PolarHBondContact O-N 2.94Å; E121-N125 PolarHBondContact O-ND2 3.33Å
122	E	86.2	Confident	86.5	Confident	163 Å²	163	41.4 Å²	41.4	76%	0.762	21%	0.211	S	C	*	.	H	α-helix	trans	-63.9	-48	175.7	-61.9	-174.2	163.9	0	0	112.3	S120 N125 R126	S120-E122 PolarHBondContact O-N 2.91Å; E122-N125 CarbonylContact O-C 3.5Å; E122-N125 WeakPolarHBondContact O-CB 3.48Å; E122-N125 PolarHBondContact O-N 3.06Å; E122-R126 PolarHBondContact O-N 2.89Å
123	E	86.5	Confident	86.7	Confident	48 Å²	48	41.4 Å²	41.4	22%	0.224	21%	0.211	C	C	.	.	H	α-helix	trans	-70.1	-37.5	179.8	176.8	56.9	-161.6	0	0	111.2	V119 S120 N125 R126 L127	V119-E123 HydrophobicContact CG1-CB 3.64Å; V119-E123 HydrophobicContact CG1-CG 3.49Å; V119-E123 VanDerWaalsContact CG1-CG 3.49Å; S120-E123 PolarHBondContact O-N 2.89Å; S120-E123 WeakPolarHBondContact OG-CB 3.21Å; S120-E123 PolarHBondContact OG-N 3.27Å; E123-N125 VanDerWaalsContact C-N 3.34Å; E123-N125 PolarHBondContact O-N 3.11Å; E123-R126 WeakPolarHBondContact O-CB 3.24Å; E123-R126 PolarHBondContact O-N 2.97Å; E123-R126 IonicContact OE1-CZ 3.73Å; E123-R126 IonicContact OE1-NE 3.42Å; E123-R126 PolarHBondContact OE1-NE 3.09Å; E123-R126 IonicContact OE1-NH2 3.5Å; E123-R126 PolarHBondContact OE1-NH2 3.37Å; E123-R126 IonicContact OE2-CZ 3.82Å; E123-R126 IonicContact OE2-NE 3.31Å; E123-R126 PolarHBondContact OE2-NE 2.89Å; E123-R126 IonicContact OE2-NH2 2.61Å; E123-L127 WeakPolarHBondContact O-CG 3.5Å; E123-L127 PolarHBondContact O-N 2.78Å
124	M	86.2	Confident	86.8	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.5	-42	170.5	-168	176.3	-70.7	0	0	111.7	R53 K56 L57 L60 S120 R126 L127 L128	R53-M124 HydrophobicContact CG-CE 4.15Å; R53-M124 HydrophobicContact CG-SD 4.01Å; R53-M124 VanDerWaalsContact CZ-CE 3.46Å; K56-M124 HydrophobicContact CB-CG 4.13Å; K56-M124 HydrophobicContact CB-SD 3.51Å; K56-M124 VanDerWaalsContact CB-SD 3.51Å; K56-M124 HydrophobicContact CD-CG 4.13Å; K56-M124 HydrophobicContact CD-SD 3.67Å; K56-M124 HydrophobicContact CG-SD 4.21Å; L57-M124 HydrophobicContact CD2-CE 3.64Å; L57-M124 HydrophobicContact CG-CE 4.34Å; L60-M124 HydrophobicContact CD1-CG 3.65Å; S120-M124 WeakPolarHBondContact O-CB 3.41Å; S120-M124 PolarHBondContact O-N 3.25Å; M124-R126 VanDerWaalsContact C-N 3.32Å; M124-R126 PolarHBondContact O-N 3.44Å; M124-L127 PolarHBondContact O-N 3.16Å; M124-L128 WeakPolarHBondContact O-CB 3.35Å; M124-L128 WeakPolarHBondContact O-CG 3.49Å; M124-L128 PolarHBondContact O-N 2.9Å
125	N	88.3	Confident	86.9	Confident	38 Å²	38	41.4 Å²	41.4	20%	0.203	21%	0.207	C	C	.	.	H	α-helix	trans	-66.9	-29.5	174.8	-75	-29.3	0	0	0	113	R49 K56 E121 E122 E123 G129	R49-N125 WeakPolarHBondContact CA-OD1 3.47Å; R49-N125 HydrophobicContact CG-CB 4.05Å; K56-N125 PolarHBondContact NZ-OD1 3.05Å; E121-N125 WeakPolarHBondContact O-CB 3.47Å; E121-N125 PolarHBondContact O-N 2.94Å; E121-N125 PolarHBondContact O-ND2 3.33Å; E122-N125 CarbonylContact O-C 3.5Å; E122-N125 WeakPolarHBondContact O-CB 3.48Å; E122-N125 PolarHBondContact O-N 3.06Å; E123-N125 VanDerWaalsContact C-N 3.34Å; E123-N125 PolarHBondContact O-N 3.11Å; N125-G129 PolarHBondContact O-N 3.04Å
126	R	89.3	Confident	87.1	Confident	59 Å²	59	40.7 Å²	40.7	22%	0.223	20%	0.203	C	C	.	.	H	α-helix	trans	-67.3	-52.2	171.3	-172.1	-174.3	72.9	90.9	-6.3	110.9	E122 E123 M124 L128 G129 I130 M167 G168	E122-R126 PolarHBondContact O-N 2.89Å; E123-R126 WeakPolarHBondContact O-CB 3.24Å; E123-R126 PolarHBondContact O-N 2.97Å; E123-R126 IonicContact OE1-CZ 3.73Å; E123-R126 IonicContact OE1-NE 3.42Å; E123-R126 PolarHBondContact OE1-NE 3.09Å; E123-R126 IonicContact OE1-NH2 3.5Å; E123-R126 PolarHBondContact OE1-NH2 3.37Å; E123-R126 IonicContact OE2-CZ 3.82Å; E123-R126 IonicContact OE2-NE 3.31Å; E123-R126 PolarHBondContact OE2-NE 2.89Å; E123-R126 IonicContact OE2-NH2 2.61Å; M124-R126 VanDerWaalsContact C-N 3.32Å; M124-R126 PolarHBondContact O-N 3.44Å; R126-L128 VanDerWaalsContact C-N 3.3Å; R126-L128 PolarHBondContact O-N 3.35Å; R126-G129 WeakPolarHBondContact O-CA 3.44Å; R126-G129 PolarHBondContact O-N 3.16Å; R126-I130 PolarHBondContact O-N 2.95Å; R126-I130 VanDerWaalsContact O-N 3.13Å; R126-M167 PolarHBondContact NH2-O 3.4Å; R126-G168 PolarHBondContact NH1-O 3.36Å; R126-G168 PolarHBondContact NH2-O 3.04Å
127	L	87.8	Confident	87.4	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-60.6	-38.4	179.6	-66	169.7	0	0	0	112	L60 L116 E123 M124 G129 I130 V131 M167	L60-L127 HydrophobicContact CD1-CB 4.42Å; L60-L127 HydrophobicContact CD2-CB 3.67Å; L116-L127 HydrophobicContact CD2-CD1 3.93Å; E123-L127 WeakPolarHBondContact O-CG 3.5Å; E123-L127 PolarHBondContact O-N 2.78Å; M124-L127 PolarHBondContact O-N 3.16Å; L127-G129 VanDerWaalsContact C-N 3.33Å; L127-G129 PolarHBondContact O-N 2.88Å; L127-I130 HydrophobicContact CD2-CD1 4.43Å; L127-I130 PolarHBondContact O-N 3.2Å; L127-V131 PolarHBondContact O-N 2.98Å; L127-M167 HydrophobicContact CD1-CE 4.17Å; L127-M167 HydrophobicContact CD1-CG 4.49Å
128	L	87.6	Confident	87.8	Confident	3 Å²	3	42 Å²	42	2%	0.016	21%	0.205	C	C	.	.	H	α-helix	trans	-63.8	-34.6	172.1	-74.7	171.1	0	0	0	113.4	K56 K59 L60 M124 R126 I130 V131 L132	K56-L128 HydrophobicContact CB-CD1 3.86Å; K56-L128 HydrophobicContact CD-CD1 3.75Å; K56-L128 HydrophobicContact CG-CD1 3.69Å; K59-L128 HydrophobicContact CB-CD2 4.09Å; K59-L128 HydrophobicContact CG-CD2 4.03Å; L60-L128 HydrophobicContact CD1-CD2 4.46Å; L60-L128 HydrophobicContact CD1-CG 4.33Å; L60-L128 HydrophobicContact CD2-CD2 4.03Å; L60-L128 HydrophobicContact CD2-CG 4.2Å; L60-L128 HydrophobicContact CG-CD2 3.91Å; L60-L128 HydrophobicContact CG-CG 4.24Å; M124-L128 WeakPolarHBondContact O-CB 3.35Å; M124-L128 WeakPolarHBondContact O-CG 3.49Å; M124-L128 PolarHBondContact O-N 2.9Å; R126-L128 VanDerWaalsContact C-N 3.3Å; R126-L128 PolarHBondContact O-N 3.35Å; L128-I130 VanDerWaalsContact C-N 3.34Å; L128-V131 PolarHBondContact O-N 3.29Å; L128-L132 PolarHBondContact O-N 3.04Å; L128-L132 VanDerWaalsContact O-N 3.14Å
129	G	88.1	Confident	88.1	Confident	2 Å²	2	37.1 Å²	37.1	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-59.1	-46.8	171.3	0	0	0	0	0	111.5	K45 N125 R126 L127 L132 D133	K45-G129 WeakPolarHBondContact CE-O 3.33Å; N125-G129 PolarHBondContact O-N 3.04Å; R126-G129 WeakPolarHBondContact O-CA 3.44Å; R126-G129 PolarHBondContact O-N 3.16Å; L127-G129 VanDerWaalsContact C-N 3.33Å; L127-G129 PolarHBondContact O-N 2.88Å; G129-L132 PolarHBondContact O-N 3.27Å; G129-D133 PolarHBondContact O-N 3.32Å; G129-D133 VanDerWaalsContact O-N 3.08Å
130	I	89.1	Confident	88.2	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-64.9	-41.8	178.5	-55.3	168.6	0	0	0	111.1	R126 L127 L128 L132 D133 V134 L160 I164 S261	R126-I130 PolarHBondContact O-N 2.95Å; R126-I130 VanDerWaalsContact O-N 3.13Å; L127-I130 HydrophobicContact CD2-CD1 4.43Å; L127-I130 PolarHBondContact O-N 3.2Å; L128-I130 VanDerWaalsContact C-N 3.34Å; I130-L132 VanDerWaalsContact C-N 3.33Å; I130-L132 PolarHBondContact O-N 2.88Å; I130-D133 PolarHBondContact O-N 3.5Å; I130-V134 HydrophobicContact CG2-CG2 4.4Å; I130-V134 WeakPolarHBondContact O-CG2 3.46Å; I130-V134 PolarHBondContact O-N 3.01Å; I130-L160 HydrophobicContact CG2-CB 3.78Å; I130-L160 HydrophobicContact CG2-CD1 4.37Å; I130-L160 HydrophobicContact CG2-CD2 4.15Å; I130-L160 HydrophobicContact CG2-CG 4.32Å; I130-I164 HydrophobicContact CB-CD1 4.39Å; I130-I164 HydrophobicContact CB-CG1 4.02Å; I130-I164 HydrophobicContact CG2-CD1 3.86Å; I130-I164 HydrophobicContact CG2-CG1 3.58Å; I130-S261 WeakPolarHBondContact CA-OG 3.31Å; I130-S261 WeakPolarHBondContact CG1-OG 3.27Å; I130-S261 PolarHBondContact N-OG 3.17Å
131	V	88.6	Confident	88.3	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-57.8	-44.1	175.4	164	0	0	0	0	111.9	K59 L60 Y63 L127 L128 D133 V134 E135 I164	K59-V131 HydrophobicContact CD-CG1 4.35Å; K59-V131 HydrophobicContact CG-CG1 4.23Å; L60-V131 HydrophobicContact CD2-CG2 3.96Å; Y63-V131 HydrophobicContact CD2-CB 4.42Å; Y63-V131 HydrophobicContact CD2-CG1 3.93Å; Y63-V131 HydrophobicContact CD2-CG2 3.63Å; Y63-V131 HydrophobicContact CE2-CB 4.35Å; Y63-V131 HydrophobicContact CE2-CG1 3.48Å; Y63-V131 VanDerWaalsContact CE2-CG1 3.48Å; Y63-V131 HydrophobicContact CE2-CG2 4.04Å; Y63-V131 HydrophobicContact CG-CG2 4.08Å; L127-V131 PolarHBondContact O-N 2.98Å; L128-V131 PolarHBondContact O-N 3.29Å; V131-D133 VanDerWaalsContact C-N 3.31Å; V131-D133 PolarHBondContact O-N 2.96Å; V131-V134 PolarHBondContact O-N 3.47Å; V131-E135 WeakPolarHBondContact O-CG 3.4Å; V131-E135 PolarHBondContact O-N 3.29Å; V131-I164 HydrophobicContact CG2-CD1 3.7Å; V131-I164 HydrophobicContact CG2-CG1 4.43Å
132	L	88.4	Confident	88.3	Confident	12 Å²	12	36.4 Å²	36.4	6%	0.063	17%	0.171	C	C	.	.	H	α-helix	trans	-68.6	-31.5	178.5	-72.9	165.3	0	0	0	112.6	K44 K45 L48 L128 G129 I130 Y136	K44-L132 HydrophobicContact CB-CD2 4.46Å; K45-L132 HydrophobicContact CB-CD1 4.2Å; K45-L132 HydrophobicContact CG-CB 4.21Å; K45-L132 HydrophobicContact CG-CD1 3.5Å; L48-L132 HydrophobicContact CB-CD1 4.41Å; L48-L132 HydrophobicContact CD1-CD1 3.76Å; L48-L132 HydrophobicContact CD1-CD2 3.78Å; L48-L132 HydrophobicContact CD1-CG 4.16Å; L128-L132 PolarHBondContact O-N 3.04Å; L128-L132 VanDerWaalsContact O-N 3.14Å; G129-L132 PolarHBondContact O-N 3.27Å; I130-L132 VanDerWaalsContact C-N 3.33Å; I130-L132 PolarHBondContact O-N 2.88Å; L132-Y136 PolarHBondContact O-N 2.82Å
133	D	90.1	Very high	88.4	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-71.7	-36.3	172.9	-72.4	-24.7	0	0	0	112.6	K45 G129 I130 V131 Y136 L137 L160 C259 S261	K45-D133 WeakPolarHBondContact CE-OD1 3.35Å; K45-D133 IonicContact NZ-OD1 2.69Å; K45-D133 PolarHBondContact NZ-OD1 3.07Å; K45-D133 IonicContact NZ-OD2 2.67Å; K45-D133 PolarHBondContact NZ-OD2 3.31Å; G129-D133 PolarHBondContact O-N 3.32Å; G129-D133 VanDerWaalsContact O-N 3.08Å; I130-D133 PolarHBondContact O-N 3.5Å; V131-D133 VanDerWaalsContact C-N 3.31Å; V131-D133 PolarHBondContact O-N 2.96Å; D133-Y136 PolarHBondContact O-N 2.94Å; D133-L137 VanDerWaalsContact O-CB 3.28Å; D133-L137 WeakPolarHBondContact O-CB 3.47Å; D133-L137 WeakPolarHBondContact O-CG 3.39Å; D133-L137 PolarHBondContact O-N 3.48Å; D133-L160 HydrophobicContact CB-CD1 3.58Å; D133-C259 HydrophobicContact CB-CB 3.95Å; D133-C259 VanDerWaalsContact CG-CA 3.49Å; D133-C259 VanDerWaalsContact CG-CB 3.49Å; D133-C259 VanDerWaalsContact CG-SG 3.55Å; D133-C259 WeakPolarHBondContact OD1-CA 3.33Å; D133-C259 PolarHBondContact OD1-SG 2.7Å; D133-C259 VanDerWaalsContact OD1-SG 3.37Å; D133-C259 WeakPolarHBondContact OD2-CA 3.41Å; D133-S261 WeakPolarHBondContact OD2-CB 3.35Å; D133-S261 PolarHBondContact OD2-N 2.77Å; D133-S261 PolarHBondContact OD2-OG 3.4Å
134	V	90.1	Very high	88.5	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.012	17%	0.169	C	C	.	.	H	α-helix	trans	-61.9	-44.6	170.8	169.4	0	0	0	0	110.9	Y63 I130 V131 Y138 F157 L160 I164	Y63-V134 HydrophobicContact CE1-CG1 3.82Å; I130-V134 HydrophobicContact CG2-CG2 4.4Å; I130-V134 WeakPolarHBondContact O-CG2 3.46Å; I130-V134 PolarHBondContact O-N 3.01Å; V131-V134 PolarHBondContact O-N 3.47Å; V134-Y138 VanDerWaalsContact O-CB 3.24Å; V134-Y138 WeakPolarHBondContact O-CB 3.42Å; V134-Y138 PolarHBondContact O-N 3.08Å; V134-F157 HydrophobicContact CG1-CD2 3.84Å; V134-F157 HydrophobicContact CG1-CE2 3.57Å; V134-L160 HydrophobicContact CG2-CB 3.44Å; V134-L160 VanDerWaalsContact CG2-CB 3.44Å; V134-L160 HydrophobicContact CG2-CD1 4.3Å; V134-I164 HydrophobicContact CG2-CD1 3.94Å
135	E	87.8	Confident	88.7	Confident	57 Å²	57	44.3 Å²	44.3	27%	0.266	21%	0.205	S	C	.	.	H	α-helix	trans	-67.8	-36.3	178.7	-72.3	178.8	-179.1	0	0	112.6	K59 Y63 V131 T139	K59-E135 WeakPolarHBondContact CE-OE1 3.18Å; K59-E135 IonicContact NZ-OE1 3.81Å; K59-E135 PolarHBondContact NZ-OE1 3.04Å; K59-E135 IonicContact NZ-OE2 2.75Å; K59-E135 PolarHBondContact NZ-OE2 3.15Å; Y63-E135 WeakPolarHBondContact OH-CG 3.35Å; Y63-E135 PolarHBondContact OH-OE1 2.95Å; V131-E135 WeakPolarHBondContact O-CG 3.4Å; V131-E135 PolarHBondContact O-N 3.29Å; E135-T139 PolarHBondContact O-N 2.87Å; E135-T139 PolarHBondContact O-OG1 3.48Å
136	Y	88.9	Confident	88.7	Confident	43 Å²	43	43.4 Å²	43.4	17%	0.169	20%	0.201	C	C	.	.	H	α-helix	trans	-72.7	-47.2	174.3	-170.9	-107.6	0	0	0	112.4	I41 L132 D133 Y138 T139 C140 F258	I41-Y136 HydrophobicContact CD1-CD1 3.35Å; I41-Y136 HydrophobicContact CD1-CD2 3.5Å; I41-Y136 VanDerWaalsContact CD1-CD2 3.5Å; I41-Y136 HydrophobicContact CD1-CE1 3.66Å; I41-Y136 HydrophobicContact CD1-CE2 3.81Å; I41-Y136 HydrophobicContact CD1-CG 3.24Å; I41-Y136 HydrophobicContact CG1-CD1 4.48Å; I41-Y136 HydrophobicContact CG1-CD2 3.82Å; I41-Y136 HydrophobicContact CG1-CE2 4.27Å; I41-Y136 HydrophobicContact CG1-CG 3.93Å; L132-Y136 PolarHBondContact O-N 2.82Å; D133-Y136 PolarHBondContact O-N 2.94Å; Y136-Y138 VanDerWaalsContact C-N 3.28Å; Y136-Y138 PolarHBondContact O-N 3.21Å; Y136-T139 CarbonylContact O-C 3.59Å; Y136-T139 WeakPolarHBondContact O-CA 3.41Å; Y136-T139 VanDerWaalsContact O-CB 3.26Å; Y136-T139 WeakPolarHBondContact O-CB 3.21Å; Y136-T139 PolarHBondContact O-N 2.81Å; Y136-C140 WeakPolarHBondContact CE1-SG 3.22Å; Y136-C140 PolarHBondContact O-N 3.06Å; Y136-C140 PolarHBondContact O-SG 2.95Å; Y136-F258 AromaticContact CD1-CD2 3.61Å; Y136-F258 HydrophobicContact CD1-CD2 3.61Å; Y136-F258 AromaticContact CD1-CE2 3.88Å; Y136-F258 HydrophobicContact CD1-CE2 3.88Å; Y136-F258 AromaticContact CE1-CD2 3.42Å; Y136-F258 HydrophobicContact CE1-CD2 3.42Å; Y136-F258 VanDerWaalsContact CE1-CD2 3.42Å; Y136-F258 AromaticContact CE1-CE2 3.67Å; Y136-F258 HydrophobicContact CE1-CE2 3.67Å; Y136-F258 HydrophobicContact CE1-CG 4.08Å; Y136-F258 HydrophobicContact CE1-CZ 4.5Å
137	L	90.1	Very high	88.6	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.8	-37.2	176.2	-81.9	165.3	0	0	0	112.1	D133 T139 C140 V141 Y153 L156 F157 L160 V255 F258	D133-L137 VanDerWaalsContact O-CB 3.28Å; D133-L137 WeakPolarHBondContact O-CB 3.47Å; D133-L137 WeakPolarHBondContact O-CG 3.39Å; D133-L137 PolarHBondContact O-N 3.48Å; L137-T139 VanDerWaalsContact C-N 3.29Å; L137-T139 PolarHBondContact O-N 3.33Å; L137-C140 WeakPolarHBondContact O-CB 3.28Å; L137-C140 PolarHBondContact O-N 2.89Å; L137-V141 WeakPolarHBondContact O-CG2 3.44Å; L137-V141 PolarHBondContact O-N 2.95Å; L137-Y153 HydrophobicContact CD2-CD1 4.16Å; L137-Y153 HydrophobicContact CD2-CG 4.35Å; L137-L156 HydrophobicContact CD1-CB 4.12Å; L137-F157 HydrophobicContact CB-CB 4.44Å; L137-L160 HydrophobicContact CD1-CD1 3.78Å; L137-V255 HydrophobicContact CD1-CG1 4.29Å; L137-V255 HydrophobicContact CD2-CG1 3.8Å; L137-V255 HydrophobicContact CG-CG1 4.46Å; L137-F258 HydrophobicContact CD2-CE2 4.36Å
138	Y	88.1	Confident	88.6	Confident	119 Å²	119	44.8 Å²	44.8	47%	0.467	22%	0.222	S	C	.	.	H	α-helix	trans	-58.9	-42.2	171.3	-175.9	-92.6	0	0	0	111.8	V134 Y136 V141 H142 F157	V134-Y138 VanDerWaalsContact O-CB 3.24Å; V134-Y138 WeakPolarHBondContact O-CB 3.42Å; V134-Y138 PolarHBondContact O-N 3.08Å; Y136-Y138 VanDerWaalsContact C-N 3.28Å; Y136-Y138 PolarHBondContact O-N 3.21Å; Y138-V141 PolarHBondContact O-N 3.15Å; Y138-H142 AromaticContact CD1-ND1 3.86Å; Y138-H142 AromaticContact CD2-CE1 3.96Å; Y138-H142 AromaticContact CE1-CE1 3.57Å; Y138-H142 AromaticContact CE1-ND1 3.68Å; Y138-H142 AromaticContact CE2-CE1 3.44Å; Y138-H142 VanDerWaalsContact CE2-CE1 3.44Å; Y138-H142 WeakPolarHBondContact CE2-CE1 3.47Å; Y138-H142 AromaticContact CZ-CE1 3.21Å; Y138-H142 AromaticContact CZ-ND1 3.81Å; Y138-H142 AromaticContact CZ-NE2 3.9Å; Y138-H142 PolarHBondContact O-N 3.12Å; Y138-H142 PolarHBondContact O-ND1 3.41Å; Y138-H142 PolarHBondContact OH-CE1 3.19Å; Y138-F157 HydrophobicContact CD2-CD2 4.43Å; Y138-F157 AromaticContact CD2-CE2 3.71Å; Y138-F157 HydrophobicContact CD2-CE2 3.71Å; Y138-F157 AromaticContact CD2-CZ 3.86Å; Y138-F157 HydrophobicContact CD2-CZ 3.86Å; Y138-F157 HydrophobicContact CG-CE2 4.26Å
139	T	88.7	Confident	88.8	Confident	62 Å²	62	44.7 Å²	44.7	38%	0.38	22%	0.221	S	C	.	.	H	α-helix	trans	-64.7	-39.7	174.7	-53.8	0	0	0	0	111.6	E135 Y136 L137 H142 K143	E135-T139 PolarHBondContact O-N 2.87Å; E135-T139 PolarHBondContact O-OG1 3.48Å; Y136-T139 CarbonylContact O-C 3.59Å; Y136-T139 WeakPolarHBondContact O-CA 3.41Å; Y136-T139 VanDerWaalsContact O-CB 3.26Å; Y136-T139 WeakPolarHBondContact O-CB 3.21Å; Y136-T139 PolarHBondContact O-N 2.81Å; L137-T139 VanDerWaalsContact C-N 3.29Å; L137-T139 PolarHBondContact O-N 3.33Å; T139-H142 PolarHBondContact O-N 2.98Å; T139-K143 HydrophobicContact CG2-CD 4.32Å; T139-K143 WeakPolarHBondContact O-CG 3.47Å; T139-K143 PolarHBondContact O-N 3.48Å
140	C	88.8	Confident	88.9	Confident	18 Å²	18	48.3 Å²	48.3	12%	0.122	24%	0.237	C	C	.	.	H	α-helix	trans	-63.3	-47.9	174.3	-66.4	0	0	0	0	111.8	Y136 L137 H142 K143 E144 Y153	Y136-C140 WeakPolarHBondContact CE1-SG 3.22Å; Y136-C140 PolarHBondContact O-N 3.06Å; Y136-C140 PolarHBondContact O-SG 2.95Å; L137-C140 WeakPolarHBondContact O-CB 3.28Å; L137-C140 PolarHBondContact O-N 2.89Å; C140-H142 PolarHBondContact O-N 2.86Å; C140-H142 VanDerWaalsContact O-N 3.16Å; C140-K143 CarbonylContact O-C 3.54Å; C140-K143 PolarHBondContact O-N 3.22Å; C140-E144 VanDerWaalsContact O-CB 3.31Å; C140-E144 WeakPolarHBondContact O-CB 3.26Å; C140-E144 PolarHBondContact O-N 3.38Å; C140-Y153 HydrophobicContact CB-CD2 3.86Å; C140-Y153 HydrophobicContact CB-CE2 4Å
141	V	89.8	Confident	89	Confident	14 Å²	14	54 Å²	54	9%	0.085	26%	0.263	C	S	.	.	H	α-helix	trans	-55.3	-34.9	177.2	170	0	0	0	0	112.3	L137 Y138 K150 F154	L137-V141 WeakPolarHBondContact O-CG2 3.44Å; L137-V141 PolarHBondContact O-N 2.95Å; Y138-V141 PolarHBondContact O-N 3.15Å; V141-K150 HydrophobicContact CG1-CG 4.34Å; V141-K150 WeakPolarHBondContact O-CE 3.47Å; V141-K150 PolarHBondContact O-NZ 3.12Å; V141-F154 HydrophobicContact CG2-CB 4.21Å
142	H	85.3	Confident	89.1	Confident	120 Å²	120	54.5 Å²	54.5	56%	0.556	27%	0.266	S	S	*	.	H	α-helix	trans	-80.4	-24.6	178.5	-74.1	78	0	0	0	113.9	Y138 T139 C140	Y138-H142 AromaticContact CD1-ND1 3.86Å; Y138-H142 AromaticContact CD2-CE1 3.96Å; Y138-H142 AromaticContact CE1-CE1 3.57Å; Y138-H142 AromaticContact CE1-ND1 3.68Å; Y138-H142 AromaticContact CE2-CE1 3.44Å; Y138-H142 VanDerWaalsContact CE2-CE1 3.44Å; Y138-H142 WeakPolarHBondContact CE2-CE1 3.47Å; Y138-H142 AromaticContact CZ-CE1 3.21Å; Y138-H142 AromaticContact CZ-ND1 3.81Å; Y138-H142 AromaticContact CZ-NE2 3.9Å; Y138-H142 PolarHBondContact O-N 3.12Å; Y138-H142 PolarHBondContact O-ND1 3.41Å; Y138-H142 PolarHBondContact OH-CE1 3.19Å; T139-H142 PolarHBondContact O-N 2.98Å; C140-H142 PolarHBondContact O-N 2.86Å; C140-H142 VanDerWaalsContact O-N 3.16Å
143	K	88.5	Confident	89.3	Confident	168 Å²	168	55.1 Å²	55.1	73%	0.73	27%	0.268	S	S	*	.	H	α-helix	trans	-92.4	-19.8	176.8	-70.1	-175.9	176.7	-167.2	0	114.2	T139 C140	T139-K143 HydrophobicContact CG2-CD 4.32Å; T139-K143 WeakPolarHBondContact O-CG 3.47Å; T139-K143 PolarHBondContact O-N 3.48Å; C140-K143 CarbonylContact O-C 3.54Å; C140-K143 PolarHBondContact O-N 3.22Å
144	E	90.1	Very high	89.2	Confident	47 Å²	47	59.8 Å²	59.8	22%	0.22	29%	0.288	C	S	.	.			trans	-75.1	127.3	-175.7	-170.9	54.7	-98.1	0	0	111.4	C140 D146 T149 K150 Y153	C140-E144 VanDerWaalsContact O-CB 3.31Å; C140-E144 WeakPolarHBondContact O-CB 3.26Å; C140-E144 PolarHBondContact O-N 3.38Å; E144-D146 PolarHBondContact OE1-N 2.86Å; E144-T149 HydrophobicContact CG-CG2 3.87Å; E144-T149 WeakPolarHBondContact OE2-CG2 3.45Å; E144-K150 HydrophobicContact CB-CB 4.26Å; E144-K150 HydrophobicContact CB-CG 4.42Å; E144-K150 HydrophobicContact CG-CB 3.99Å; E144-K150 PolarHBondContact O-NZ 3Å; E144-Y153 HydrophobicContact CB-CD2 4.14Å; E144-Y153 HydrophobicContact CB-CE2 4.12Å; E144-Y153 HydrophobicContact CG-CD2 4.18Å; E144-Y153 HydrophobicContact CG-CE2 3.96Å; E144-Y153 VanDerWaalsContact OE2-CE2 3.31Å; E144-Y153 WeakPolarHBondContact OE2-CE2 3.5Å
145	E	88.8	Confident	89.2	Confident	163 Å²	163	62.2 Å²	62.2	76%	0.762	31%	0.305	S	S	*	.			trans	-94.5	-31.1	178.9	-65.4	-172.7	167	0	0	111.6	A147	E145-A147 PolarHBondContact O-N 2.82Å
146	D	88.1	Confident	89.3	Confident	19 Å²	19	59.7 Å²	59.7	10%	0.102	29%	0.294	C	S	.	.			trans	-75.6	123.5	179.9	-172.3	-73	0	0	0	111.7	E144 D148 T149 K150 T226 S228	E144-D146 PolarHBondContact OE1-N 2.86Å; D146-D148 VanDerWaalsContact C-N 3.34Å; D146-D148 PolarHBondContact O-N 2.86Å; D146-D148 WeakPolarHBondContact OD1-CB 3.41Å; D146-D148 PolarHBondContact OD1-N 2.74Å; D146-T149 PolarHBondContact O-N 3.09Å; D146-T149 PolarHBondContact OD1-N 3.23Å; D146-T149 VanDerWaalsContact OD1-N 3.17Å; D146-K150 WeakPolarHBondContact O-CB 3.1Å; D146-K150 PolarHBondContact O-N 2.99Å; D146-T226 HydrophobicContact CB-CG2 4.1Å; D146-T226 WeakPolarHBondContact OD2-CB 3.33Å; D146-T226 PolarHBondContact OD2-OG1 3.19Å; D146-S228 WeakPolarHBondContact OD2-CB 3.37Å; D146-S228 PolarHBondContact OD2-OG 3.17Å
147	A	88.1	Confident	89.4	Confident	68 Å²	68	58.9 Å²	58.9	56%	0.562	29%	0.291	S	S	*	.	H	α-helix	trans	-63.7	-34.9	-175.1	0	0	0	0	0	113.7	E145 Q151	E145-A147 PolarHBondContact O-N 2.82Å; A147-Q151 WeakPolarHBondContact O-CB 3.41Å; A147-Q151 PolarHBondContact O-N 3.06Å
148	D	87.9	Confident	89.3	Confident	22 Å²	22	64 Å²	64	12%	0.118	31%	0.313	C	S	.	.	H	α-helix	trans	-73.3	-46.4	-179.4	-74.1	-8.5	0	0	0	109.9	D146 K150 Q151 V152 P227 K243	D146-D148 VanDerWaalsContact C-N 3.34Å; D146-D148 PolarHBondContact O-N 2.86Å; D146-D148 WeakPolarHBondContact OD1-CB 3.41Å; D146-D148 PolarHBondContact OD1-N 2.74Å; D148-K150 PolarHBondContact O-N 3.34Å; D148-Q151 PolarHBondContact O-N 2.75Å; D148-V152 WeakPolarHBondContact O-CG2 3.49Å; D148-V152 PolarHBondContact O-N 2.81Å; D148-V152 VanDerWaalsContact O-N 3.16Å; D148-P227 HydrophobicContact CB-CG 4.28Å; D148-P227 WeakPolarHBondContact OD2-CB 3.36Å; D148-K243 VanDerWaalsContact CG-CE 3.48Å; D148-K243 WeakPolarHBondContact OD1-CE 3.24Å; D148-K243 IonicContact OD1-NZ 2.65Å; D148-K243 PolarHBondContact OD1-NZ 2.95Å; D148-K243 VanDerWaalsContact OD2-CD 3.27Å; D148-K243 WeakPolarHBondContact OD2-CD 3.43Å; D148-K243 VanDerWaalsContact OD2-CE 3.25Å; D148-K243 WeakPolarHBondContact OD2-CE 3.47Å; D148-K243 IonicContact OD2-NZ 3.91Å; D148-K243 PolarHBondContact OD2-NZ 2.85Å; D148-K243 VanDerWaalsContact OD2-NZ 3.11Å
149	T	90.9	Very high	89.4	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.012	30%	0.297	C	S	.	.	H	α-helix	trans	-60.5	-44.2	174.8	-52.9	0	0	0	0	111.6	E144 D146 Q151 V152 Y153 Y246 L250	E144-T149 HydrophobicContact CG-CG2 3.87Å; E144-T149 WeakPolarHBondContact OE2-CG2 3.45Å; D146-T149 PolarHBondContact O-N 3.09Å; D146-T149 PolarHBondContact OD1-N 3.23Å; D146-T149 VanDerWaalsContact OD1-N 3.17Å; T149-Q151 PolarHBondContact O-N 3.14Å; T149-V152 PolarHBondContact O-N 3.48Å; T149-Y153 HydrophobicContact CG2-CD2 4.19Å; T149-Y153 HydrophobicContact CG2-CE1 3.96Å; T149-Y153 HydrophobicContact CG2-CE2 3.57Å; T149-Y153 VanDerWaalsContact CG2-CZ 3.42Å; T149-Y153 WeakPolarHBondContact CG2-OH 3.37Å; T149-Y153 PolarHBondContact O-N 3.15Å; T149-Y246 WeakPolarHBondContact OG1-CE1 3.36Å; T149-Y246 PolarHBondContact OG1-OH 2.83Å; T149-L250 HydrophobicContact CG2-CD1 4.02Å
150	K	91.3	Very high	89.4	Confident	78 Å²	78	56.4 Å²	56.4	34%	0.339	28%	0.278	S	S	.	.	H	α-helix	trans	-62.4	-39	178	-165.7	-178.9	-161.7	111.6	0	112.3	V141 E144 D146 D148 F154	V141-K150 HydrophobicContact CG1-CG 4.34Å; V141-K150 WeakPolarHBondContact O-CE 3.47Å; V141-K150 PolarHBondContact O-NZ 3.12Å; E144-K150 HydrophobicContact CB-CB 4.26Å; E144-K150 HydrophobicContact CB-CG 4.42Å; E144-K150 HydrophobicContact CG-CB 3.99Å; E144-K150 PolarHBondContact O-NZ 3Å; D146-K150 WeakPolarHBondContact O-CB 3.1Å; D146-K150 PolarHBondContact O-N 2.99Å; D148-K150 PolarHBondContact O-N 3.34Å; K150-F154 WeakPolarHBondContact O-CB 3.32Å; K150-F154 PolarHBondContact O-N 3.34Å
151	Q	90.6	Very high	89.3	Confident	120 Å²	120	60.7 Å²	60.7	56%	0.561	29%	0.292	S	S	*	.	H	α-helix	trans	-63.4	-39.6	174.9	-172.8	179.2	10	0	0	111.9	A147 D148 T149 S155	A147-Q151 WeakPolarHBondContact O-CB 3.41Å; A147-Q151 PolarHBondContact O-N 3.06Å; D148-Q151 PolarHBondContact O-N 2.75Å; T149-Q151 PolarHBondContact O-N 3.14Å; Q151-S155 WeakPolarHBondContact O-CB 3.3Å; Q151-S155 PolarHBondContact O-N 3.04Å; Q151-S155 VanDerWaalsContact O-N 3.1Å; Q151-S155 PolarHBondContact O-OG 2.96Å
152	V	90.6	Very high	89.1	Confident	11 Å²	11	64 Å²	64	7%	0.067	31%	0.305	C	S	.	.	H	α-helix	trans	-67.8	-50.8	175.7	177.9	0	0	0	0	111.2	D148 T149 F154 S155 L156 T247 L250	D148-V152 WeakPolarHBondContact O-CG2 3.49Å; D148-V152 PolarHBondContact O-N 2.81Å; D148-V152 VanDerWaalsContact O-N 3.16Å; T149-V152 PolarHBondContact O-N 3.48Å; V152-F154 VanDerWaalsContact C-N 3.31Å; V152-F154 PolarHBondContact O-N 3.2Å; V152-S155 WeakPolarHBondContact O-CA 3.4Å; V152-S155 WeakPolarHBondContact O-CB 3.07Å; V152-S155 PolarHBondContact O-N 3.23Å; V152-L156 HydrophobicContact CG1-CD1 4.07Å; V152-L156 HydrophobicContact CG1-CG 4.44Å; V152-L156 WeakPolarHBondContact O-CG 3.31Å; V152-L156 PolarHBondContact O-N 3.18Å; V152-T247 HydrophobicContact CG2-CG2 3.8Å; V152-L250 HydrophobicContact CB-CD1 3.9Å; V152-L250 HydrophobicContact CG1-CB 3.82Å; V152-L250 HydrophobicContact CG1-CD1 3.97Å; V152-L250 HydrophobicContact CG2-CD1 4.1Å
153	Y	92.4	Very high	89.2	Confident	25 Å²	25	58.6 Å²	58.6	10%	0.098	28%	0.281	C	S	.	.	H	α-helix	trans	-57.9	-41.1	177.2	-65.7	-20.2	0	0	0	112.6	L137 C140 E144 T149 S155 L156 F157 L250 V255	L137-Y153 HydrophobicContact CD2-CD1 4.16Å; L137-Y153 HydrophobicContact CD2-CG 4.35Å; C140-Y153 HydrophobicContact CB-CD2 3.86Å; C140-Y153 HydrophobicContact CB-CE2 4Å; E144-Y153 HydrophobicContact CB-CD2 4.14Å; E144-Y153 HydrophobicContact CB-CE2 4.12Å; E144-Y153 HydrophobicContact CG-CD2 4.18Å; E144-Y153 HydrophobicContact CG-CE2 3.96Å; E144-Y153 VanDerWaalsContact OE2-CE2 3.31Å; E144-Y153 WeakPolarHBondContact OE2-CE2 3.5Å; T149-Y153 HydrophobicContact CG2-CD2 4.19Å; T149-Y153 HydrophobicContact CG2-CE1 3.96Å; T149-Y153 HydrophobicContact CG2-CE2 3.57Å; T149-Y153 VanDerWaalsContact CG2-CZ 3.42Å; T149-Y153 WeakPolarHBondContact CG2-OH 3.37Å; T149-Y153 PolarHBondContact O-N 3.15Å; Y153-S155 VanDerWaalsContact C-N 3.28Å; Y153-S155 PolarHBondContact O-N 3.46Å; Y153-L156 PolarHBondContact O-N 2.78Å; Y153-F157 WeakPolarHBondContact O-CB 3.48Å; Y153-F157 PolarHBondContact O-N 3.42Å; Y153-L250 HydrophobicContact CE1-CD2 4.31Å; Y153-V255 HydrophobicContact CD1-CG2 3.94Å; Y153-V255 HydrophobicContact CE1-CG2 3.69Å
154	F	89.2	Confident	89	Confident	98 Å²	98	50.8 Å²	50.8	43%	0.43	25%	0.247	S	C	.	.	H	α-helix	trans	-66.6	-30.6	176.4	-176.6	-114.3	0	0	0	112.5	V141 K150 V152 F157 K158	V141-F154 HydrophobicContact CG2-CB 4.21Å; K150-F154 WeakPolarHBondContact O-CB 3.32Å; K150-F154 PolarHBondContact O-N 3.34Å; V152-F154 VanDerWaalsContact C-N 3.31Å; V152-F154 PolarHBondContact O-N 3.2Å; F154-F157 HydrophobicContact CD2-CD1 4.05Å; F154-F157 HydrophobicContact CE2-CD1 4.11Å; F154-F157 HydrophobicContact CE2-CE1 4.32Å; F154-K158 HydrophobicContact CD1-CD 4.29Å; F154-K158 HydrophobicContact CE1-CD 3.82Å; F154-K158 HydrophobicContact CE1-CG 4.42Å; F154-K158 HydrophobicContact CZ-CD 4.1Å; F154-K158 HydrophobicContact CZ-CG 4.34Å; F154-K158 WeakPolarHBondContact O-CE 3.47Å; F154-K158 WeakPolarHBondContact O-CG 3.23Å; F154-K158 PolarHBondContact O-N 3.45Å; F154-K158 VanDerWaalsContact O-N 3.09Å
155	S	89.6	Confident	88.7	Confident	53 Å²	53	51.4 Å²	51.4	37%	0.371	25%	0.252	S	S	.	.	H	α-helix	trans	-73	-41.2	175.7	-58.8	0	0	0	0	111.9	Q151 V152 Y153 K158 L159	Q151-S155 WeakPolarHBondContact O-CB 3.3Å; Q151-S155 PolarHBondContact O-N 3.04Å; Q151-S155 VanDerWaalsContact O-N 3.1Å; Q151-S155 PolarHBondContact O-OG 2.96Å; V152-S155 WeakPolarHBondContact O-CA 3.4Å; V152-S155 WeakPolarHBondContact O-CB 3.07Å; V152-S155 PolarHBondContact O-N 3.23Å; Y153-S155 VanDerWaalsContact C-N 3.28Å; Y153-S155 PolarHBondContact O-N 3.46Å; S155-K158 PolarHBondContact O-N 3.17Å; S155-L159 PolarHBondContact O-N 2.8Å
156	L	90.4	Very high	88.4	Confident	3 Å²	3	50 Å²	50	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-64.9	-41.8	172.4	-65.4	173.1	0	0	0	112	L137 V152 Y153 K158 L159 L160 L172 V255 L262	L137-L156 HydrophobicContact CD1-CB 4.12Å; V152-L156 HydrophobicContact CG1-CD1 4.07Å; V152-L156 HydrophobicContact CG1-CG 4.44Å; V152-L156 WeakPolarHBondContact O-CG 3.31Å; V152-L156 PolarHBondContact O-N 3.18Å; Y153-L156 PolarHBondContact O-N 2.78Å; L156-K158 PolarHBondContact O-N 2.94Å; L156-L159 PolarHBondContact O-N 2.86Å; L156-L159 VanDerWaalsContact O-N 3.17Å; L156-L160 WeakPolarHBondContact O-CG 3.37Å; L156-L160 PolarHBondContact O-N 2.92Å; L156-L172 HydrophobicContact CD2-CD2 3.79Å; L156-V255 HydrophobicContact CD1-CB 3.9Å; L156-V255 HydrophobicContact CD1-CG1 3.89Å; L156-V255 HydrophobicContact CD1-CG2 3.75Å; L156-L262 HydrophobicContact CD1-CD1 4.43Å; L156-L262 HydrophobicContact CD2-CD1 4.16Å
157	F	89.9	Confident	88	Confident	27 Å²	27	52 Å²	52	12%	0.118	26%	0.255	C	S	.	.	H	α-helix	trans	-56	-46.2	172.4	166.7	-95.3	0	0	0	112.1	V134 L137 Y138 Y153 F154 R161	V134-F157 HydrophobicContact CG1-CD2 3.84Å; V134-F157 HydrophobicContact CG1-CE2 3.57Å; L137-F157 HydrophobicContact CB-CB 4.44Å; Y138-F157 HydrophobicContact CD2-CD2 4.43Å; Y138-F157 AromaticContact CD2-CE2 3.71Å; Y138-F157 HydrophobicContact CD2-CE2 3.71Å; Y138-F157 AromaticContact CD2-CZ 3.86Å; Y138-F157 HydrophobicContact CD2-CZ 3.86Å; Y138-F157 HydrophobicContact CG-CE2 4.26Å; Y153-F157 WeakPolarHBondContact O-CB 3.48Å; Y153-F157 PolarHBondContact O-N 3.42Å; F154-F157 HydrophobicContact CD2-CD1 4.05Å; F154-F157 HydrophobicContact CE2-CD1 4.11Å; F154-F157 HydrophobicContact CE2-CE1 4.32Å; F157-R161 WeakPolarHBondContact O-CB 3.4Å; F157-R161 PolarHBondContact O-N 3.36Å
158	K	88.1	Confident	87.5	Confident	106 Å²	106	50 Å²	50	46%	0.461	24%	0.241	S	C	.	.	H	α-helix	trans	-62.2	-43.3	174.2	-74.4	179.4	-64.1	173.9	0	112.1	F154 S155 L156 R161 K162	F154-K158 HydrophobicContact CD1-CD 4.29Å; F154-K158 HydrophobicContact CE1-CD 3.82Å; F154-K158 HydrophobicContact CE1-CG 4.42Å; F154-K158 HydrophobicContact CZ-CD 4.1Å; F154-K158 HydrophobicContact CZ-CG 4.34Å; F154-K158 WeakPolarHBondContact O-CE 3.47Å; F154-K158 WeakPolarHBondContact O-CG 3.23Å; F154-K158 PolarHBondContact O-N 3.45Å; F154-K158 VanDerWaalsContact O-N 3.09Å; S155-K158 PolarHBondContact O-N 3.17Å; L156-K158 PolarHBondContact O-N 2.94Å; K158-R161 PolarHBondContact O-N 3.15Å; K158-K162 WeakPolarHBondContact O-CB 3.4Å; K158-K162 PolarHBondContact O-N 3.12Å
159	L	89.7	Confident	87	Confident	23 Å²	23	56.9 Å²	56.9	12%	0.12	27%	0.269	C	S	.	.	H	α-helix	trans	-62	-49.3	178.7	175.3	61	0	0	0	111.8	S155 L156 R161 K162 S163 P170 M171 L172	S155-L159 PolarHBondContact O-N 2.8Å; L156-L159 PolarHBondContact O-N 2.86Å; L156-L159 VanDerWaalsContact O-N 3.17Å; L159-R161 VanDerWaalsContact C-N 3.34Å; L159-R161 PolarHBondContact O-N 2.81Å; L159-K162 PolarHBondContact O-N 2.98Å; L159-S163 WeakPolarHBondContact O-CB 3.38Å; L159-S163 PolarHBondContact O-N 2.9Å; L159-S163 PolarHBondContact O-OG 2.94Å; L159-P170 HydrophobicContact CG-CB 4.32Å; L159-M171 WeakPolarHBondContact CD1-O 3.46Å; L159-L172 HydrophobicContact CD2-CD2 3.77Å; L159-L172 HydrophobicContact CD2-CG 3.98Å
160	L	89.1	Confident	86.5	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62.9	-40.8	178.3	-67	-165.8	0	0	0	111.7	I130 D133 V134 L137 L156 S163 I164 P170 L262	I130-L160 HydrophobicContact CG2-CB 3.78Å; I130-L160 HydrophobicContact CG2-CD1 4.37Å; I130-L160 HydrophobicContact CG2-CD2 4.15Å; I130-L160 HydrophobicContact CG2-CG 4.32Å; D133-L160 HydrophobicContact CB-CD1 3.58Å; V134-L160 HydrophobicContact CG2-CB 3.44Å; V134-L160 VanDerWaalsContact CG2-CB 3.44Å; V134-L160 HydrophobicContact CG2-CD1 4.3Å; L137-L160 HydrophobicContact CD1-CD1 3.78Å; L156-L160 WeakPolarHBondContact O-CG 3.37Å; L156-L160 PolarHBondContact O-N 2.92Å; L160-S163 WeakPolarHBondContact O-CB 3.49Å; L160-S163 PolarHBondContact O-N 3.08Å; L160-S163 VanDerWaalsContact O-N 3.17Å; L160-I164 WeakPolarHBondContact O-CG1 3.49Å; L160-I164 PolarHBondContact O-N 2.88Å; L160-P170 HydrophobicContact CD2-CB 3.52Å; L160-P170 HydrophobicContact CD2-CG 3.79Å; L160-L262 HydrophobicContact CD2-CD2 3.71Å; L160-L262 HydrophobicContact CD2-CG 4.12Å
161	R	86.3	Confident	85.6	Confident	108 Å²	108	60.4 Å²	60.4	41%	0.408	29%	0.289	S	S	.	.	H	α-helix	trans	-64.5	-42.1	175.7	-172.4	178.9	177.6	-159.8	-2	112.8	F157 K158 L159 S163 I164 L165	F157-R161 WeakPolarHBondContact O-CB 3.4Å; F157-R161 PolarHBondContact O-N 3.36Å; K158-R161 PolarHBondContact O-N 3.15Å; L159-R161 VanDerWaalsContact C-N 3.34Å; L159-R161 PolarHBondContact O-N 2.81Å; R161-S163 VanDerWaalsContact C-N 3.29Å; R161-S163 PolarHBondContact O-N 3.42Å; R161-I164 PolarHBondContact O-N 2.56Å; R161-L165 HydrophobicContact CG-CD1 4.46Å; R161-L165 PolarHBondContact O-N 3.09Å
162	K	86.8	Confident	84.9	Confident	84 Å²	84	56.9 Å²	56.9	37%	0.365	27%	0.274	S	S	.	.	H	α-helix	trans	-57.9	-43	170.5	176.3	-178.2	174.9	-175.9	0	110.7	K158 L159 I164 L165 Q166 E173	K158-K162 WeakPolarHBondContact O-CB 3.4Å; K158-K162 PolarHBondContact O-N 3.12Å; L159-K162 PolarHBondContact O-N 2.98Å; K162-I164 PolarHBondContact O-N 3.35Å; K162-L165 PolarHBondContact O-N 2.92Å; K162-Q166 VanDerWaalsContact CG-OE1 3.29Å; K162-Q166 WeakPolarHBondContact O-CB 2.91Å; K162-Q166 WeakPolarHBondContact O-CG 3.44Å; K162-Q166 PolarHBondContact O-N 2.93Å; K162-E173 IonicContact NZ-OE1 3.1Å; K162-E173 PolarHBondContact NZ-OE1 3.11Å; K162-E173 IonicContact NZ-OE2 2.76Å
163	S	86.8	Confident	83.4	Confident	6 Å²	6	64.1 Å²	64.1	4%	0.042	31%	0.307	C	S	.	.	H	α-helix	trans	-64.3	-38.3	-179.8	-52.3	0	0	0	0	112.9	L159 L160 R161 M167 G168 P170	L159-S163 WeakPolarHBondContact O-CB 3.38Å; L159-S163 PolarHBondContact O-N 2.9Å; L159-S163 PolarHBondContact O-OG 2.94Å; L160-S163 WeakPolarHBondContact O-CB 3.49Å; L160-S163 PolarHBondContact O-N 3.08Å; L160-S163 VanDerWaalsContact O-N 3.17Å; R161-S163 VanDerWaalsContact C-N 3.29Å; R161-S163 PolarHBondContact O-N 3.42Å; S163-M167 CarbonylContact O-C 3.28Å; S163-M167 WeakPolarHBondContact O-CA 3.18Å; S163-M167 PolarHBondContact O-N 2.82Å; S163-G168 PolarHBondContact O-N 3.36Å; S163-P170 WeakPolarHBondContact OG-CA 3.45Å; S163-P170 WeakPolarHBondContact OG-CB 3.4Å
164	I	85.3	Confident	81.8	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.021	32%	0.323	C	S	.	.	H	α-helix	trans	-64.3	-50.9	173.5	-60.8	158.7	0	0	0	110.4	Y63 I130 V131 V134 L160 R161 K162 Q166 M167	Y63-I164 HydrophobicContact CD1-CD1 4.29Å; Y63-I164 HydrophobicContact CG-CD1 4.3Å; I130-I164 HydrophobicContact CB-CD1 4.39Å; I130-I164 HydrophobicContact CB-CG1 4.02Å; I130-I164 HydrophobicContact CG2-CD1 3.86Å; I130-I164 HydrophobicContact CG2-CG1 3.58Å; V131-I164 HydrophobicContact CG2-CD1 3.7Å; V131-I164 HydrophobicContact CG2-CG1 4.43Å; V134-I164 HydrophobicContact CG2-CD1 3.94Å; L160-I164 WeakPolarHBondContact O-CG1 3.49Å; L160-I164 PolarHBondContact O-N 2.88Å; R161-I164 PolarHBondContact O-N 2.56Å; K162-I164 PolarHBondContact O-N 3.35Å; I164-Q166 PolarHBondContact O-N 3.46Å; I164-M167 PolarHBondContact O-N 3.32Å
165	L	82.8	Confident	80	Confident	60 Å²	60	70.5 Å²	70.5	31%	0.314	35%	0.348	S	S	.	.	H	α-helix	trans	-60.6	-27.3	-178.7	-76.2	165.1	0	0	0	113.7	Y63 N75 R161 K162	Y63-L165 WeakPolarHBondContact O-CD2 3.32Å; N75-L165 HydrophobicContact CB-CD2 4.23Å; R161-L165 HydrophobicContact CG-CD1 4.46Å; R161-L165 PolarHBondContact O-N 3.09Å; K162-L165 PolarHBondContact O-N 2.92Å
166	Q	83.2	Confident	78.8	Confident	134 Å²	134	73.4 Å²	73.4	63%	0.626	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	1	177.9	-64.1	-175.1	-50	0	0	113.4	K162 I164 G168	K162-Q166 VanDerWaalsContact CG-OE1 3.29Å; K162-Q166 WeakPolarHBondContact O-CB 2.91Å; K162-Q166 WeakPolarHBondContact O-CG 3.44Å; K162-Q166 PolarHBondContact O-N 2.93Å; I164-Q166 PolarHBondContact O-N 3.46Å; Q166-G168 PolarHBondContact O-N 3.22Å
167	M	79.8	Confident	78.1	Confident	61 Å²	61	77.7 Å²	77.7	30%	0.3	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	19.6	-167.2	-61.5	177.1	69.3	0	0	114.4	L116 V119 R126 L127 S163 I164	L116-M167 HydrophobicContact CD2-CE 4.04Å; L116-M167 HydrophobicContact CD2-SD 4.37Å; V119-M167 HydrophobicContact CG2-CE 3.85Å; R126-M167 PolarHBondContact NH2-O 3.4Å; L127-M167 HydrophobicContact CD1-CE 4.17Å; L127-M167 HydrophobicContact CD1-CG 4.49Å; S163-M167 CarbonylContact O-C 3.28Å; S163-M167 WeakPolarHBondContact O-CA 3.18Å; S163-M167 PolarHBondContact O-N 2.82Å; I164-M167 PolarHBondContact O-N 3.32Å
168	G	78.1	Confident	77.9	Confident	26 Å²	26	77.3 Å²	77.3	27%	0.268	39%	0.386	S	S	.	.			trans	-75.6	166.9	-175.8	0	0	0	0	0	113.6	R126 S163 Q166	R126-G168 PolarHBondContact NH1-O 3.36Å; R126-G168 PolarHBondContact NH2-O 3.04Å; S163-G168 PolarHBondContact O-N 3.36Å; Q166-G168 PolarHBondContact O-N 3.22Å
169	K	77.4	Confident	77.9	Confident	166 Å²	166	75.4 Å²	75.4	72%	0.722	39%	0.385	S	S	*	.			trans	-81.1	136.4	158.9	-70.8	-179.5	179.3	177	0	108.4	M171	K169-M171 PolarHBondContact O-N 3.49Å
170	P	79.5	Confident	77.8	Confident	8 Å²	8	76 Å²	76	5%	0.052	39%	0.386	C	S	.	.			trans	-72.5	98	-177.9	29.6	-34.8	0	0	0	110.7	L159 L160 S163 S261 L262	L159-P170 HydrophobicContact CG-CB 4.32Å; L160-P170 HydrophobicContact CD2-CB 3.52Å; L160-P170 HydrophobicContact CD2-CG 3.79Å; S163-P170 WeakPolarHBondContact OG-CA 3.45Å; S163-P170 WeakPolarHBondContact OG-CB 3.4Å; P170-S261 WeakPolarHBondContact CG-O 3.45Å; P170-L262 HydrophobicContact CB-CD2 4.11Å; P170-L262 HydrophobicContact CG-CD2 4.26Å
171	M	72.2	Confident	77.9	Confident	146 Å²	146	78 Å²	78	72%	0.719	40%	0.396	S	S	*	.			trans	-97.4	130.8	172.7	-66.2	-175.6	67.4	0	0	109.8	L159 K169 E173	L159-M171 WeakPolarHBondContact CD1-O 3.46Å; K169-M171 PolarHBondContact O-N 3.49Å; M171-E173 PolarHBondContact O-N 2.62Å
172	L	75.5	Confident	78	Confident	45 Å²	45	79.9 Å²	79.9	24%	0.236	41%	0.407	C	S	.	.			trans	-72.3	117	174.3	-78.4	157	0	0	0	109.4	L156 L159 A174 C251 Y252	L156-L172 HydrophobicContact CD2-CD2 3.79Å; L159-L172 HydrophobicContact CD2-CD2 3.77Å; L159-L172 HydrophobicContact CD2-CG 3.98Å; L172-A174 PolarHBondContact O-N 2.99Å; L172-C251 HydrophobicContact CD1-CB 3.86Å; L172-C251 HydrophobicContact CD2-CB 4.38Å; L172-Y252 HydrophobicContact CB-CE1 4.46Å; L172-Y252 HydrophobicContact CD1-CD1 3.99Å; L172-Y252 HydrophobicContact CD1-CD2 4.46Å; L172-Y252 HydrophobicContact CD1-CE1 3.52Å; L172-Y252 HydrophobicContact CD1-CE2 4.03Å; L172-Y252 HydrophobicContact CD1-CG 4.45Å
173	E	59.2	Low	78.2	Confident	164 Å²	164	76.7 Å²	76.7	77%	0.766	40%	0.395	S	S	*	.			trans	-69.4	76.1	170.6	-70	166.2	-151.3	0	0	109	K162 M171	K162-E173 IonicContact NZ-OE1 3.1Å; K162-E173 PolarHBondContact NZ-OE1 3.11Å; K162-E173 IonicContact NZ-OE2 2.76Å; M171-E173 PolarHBondContact O-N 2.62Å
174	A	58.2	Low	78.6	Confident	52 Å²	52	77.5 Å²	77.5	43%	0.43	40%	0.4	S	S	.	.			trans	-115.3	139.4	-175.1	0	0	0	0	0	111.5	L172 E176 Y252	L172-A174 PolarHBondContact O-N 2.99Å; A174-E176 VanDerWaalsContact C-N 3.28Å; A174-E176 PolarHBondContact O-N 3.23Å; A174-Y252 WeakPolarHBondContact CB-OH 3.36Å
175	Q	52.9	Low	79	Confident	204 Å²	204	77.4 Å²	77.4	95%	0.953	40%	0.4	S	S	*	.	S	Bend	trans	-73.4	-19	-177.1	-165.4	169.5	2.2	0	0	113.4
176	E	64.1	Low	79.5	Confident	114 Å²	114	77.6 Å²	77.6	53%	0.533	40%	0.399	S	S	.	.	S	Bend	trans	-136.6	135.5	170.2	-67.4	-180	167.8	0	0	108.6	A174 R248	A174-E176 VanDerWaalsContact C-N 3.28Å; A174-E176 PolarHBondContact O-N 3.23Å; E176-R248 IonicContact OE2-CZ 2.72Å; E176-R248 IonicContact OE2-NH1 3.98Å; E176-R248 IonicContact OE2-NH2 3.72Å; E176-R248 PolarHBondContact OE2-NH2 3.37Å
177	S	76.2	Confident	79.9	Confident	94 Å²	94	75.4 Å²	75.4	66%	0.657	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-96.9	154.7	174.4	50.6	0	0	0	0	111.5
178	P	84.8	Confident	80.6	Confident	18 Å²	18	72.5 Å²	72.5	12%	0.117	38%	0.375	C	S	.	.	S	Bend	trans	-65.1	148.8	174.3	26.1	-34	0	0	0	111.8	F180 Y252 Y265 I270	P178-F180 HydrophobicContact CB-CE1 4.35Å; P178-F180 HydrophobicContact CB-CE2 4.02Å; P178-F180 HydrophobicContact CB-CZ 3.93Å; P178-F180 HydrophobicContact CG-CZ 4.37Å; P178-Y252 HydrophobicContact CG-CD1 4.01Å; P178-Y252 HydrophobicContact CG-CE1 4.08Å; P178-Y252 HydrophobicContact CG-CG 4.49Å; P178-Y265 HydrophobicContact CG-CD1 4.25Å; P178-Y265 HydrophobicContact CG-CD2 4.15Å; P178-Y265 HydrophobicContact CG-CE1 3.97Å; P178-Y265 HydrophobicContact CG-CE2 3.86Å; P178-Y265 HydrophobicContact CG-CG 4.33Å; P178-I270 HydrophobicContact CB-CB 3.8Å; P178-I270 HydrophobicContact CB-CD1 4.2Å; P178-I270 HydrophobicContact CB-CG2 3.68Å
179	P	87.4	Confident	81.3	Confident	67 Å²	67	71.2 Å²	71.2	44%	0.435	36%	0.362	S	S	.	.	P	Polyproline II helix	cis	-81.1	141.5	4.6	33.1	-35.9	0	0	0	113.4
180	F	89.1	Confident	82	Confident	34 Å²	34	65.3 Å²	65.3	15%	0.149	34%	0.338	C	S	.	.			trans	-85.9	-15.7	-174.9	-53.8	-62.3	0	0	0	114.4	P178 R248 Y252 I270 F271	P178-F180 HydrophobicContact CB-CE1 4.35Å; P178-F180 HydrophobicContact CB-CE2 4.02Å; P178-F180 HydrophobicContact CB-CZ 3.93Å; P178-F180 HydrophobicContact CG-CZ 4.37Å; F180-R248 HydrophobicContact CD2-CB 4.33Å; F180-R248 HydrophobicContact CD2-CG 4.48Å; F180-R248 HydrophobicContact CE1-CG 4.16Å; F180-R248 HydrophobicContact CE2-CB 3.77Å; F180-R248 HydrophobicContact CE2-CG 4.02Å; F180-R248 HydrophobicContact CZ-CB 4.03Å; F180-R248 HydrophobicContact CZ-CG 3.86Å; F180-Y252 HydrophobicContact CE2-CD2 4.18Å; F180-Y252 AromaticContact CZ-CD2 3.68Å; F180-Y252 HydrophobicContact CZ-CD2 3.68Å; F180-Y252 AromaticContact CZ-CE2 3.73Å; F180-Y252 HydrophobicContact CZ-CE2 3.73Å; F180-Y252 HydrophobicContact CZ-CG 4.42Å; F180-I270 HydrophobicContact CD2-CB 4.36Å; F180-I270 HydrophobicContact CD2-CD1 4.23Å; F180-I270 HydrophobicContact CD2-CG1 4.16Å; F180-I270 HydrophobicContact CE2-CD1 3.7Å; F180-I270 HydrophobicContact CE2-CG1 4.15Å; F180-I270 PolarHBondContact N-O 3.27Å; F180-F271 HydrophobicContact CD2-CD1 4.04Å; F180-F271 AromaticContact CD2-CE1 3.66Å; F180-F271 HydrophobicContact CD2-CE1 3.66Å; F180-F271 AromaticContact CD2-CZ 3.96Å; F180-F271 HydrophobicContact CD2-CZ 3.96Å; F180-F271 HydrophobicContact CE2-CE1 4.22Å; F180-F271 HydrophobicContact CE2-CZ 4.09Å
181	E	89.9	Confident	82.6	Confident	44 Å²	44	65.1 Å²	65.1	21%	0.206	34%	0.337	C	S	.	.	S	Bend	trans	-153.8	141	-176	-170.6	175.3	-168.1	0	0	109.9	G272 R273 T274	E181-G272 VanDerWaalsContact CD-C 3.49Å; E181-G272 WeakPolarHBondContact OE2-CA 3.1Å; E181-G272 PolarHBondContact OE2-N 3.44Å; E181-R273 VanDerWaalsContact CD-N 3.28Å; E181-R273 PolarHBondContact OE1-N 3.17Å; E181-R273 PolarHBondContact OE2-N 3.06Å; E181-T274 VanDerWaalsContact CD-N 3.31Å; E181-T274 VanDerWaalsContact OE1-CB 3.24Å; E181-T274 WeakPolarHBondContact OE1-CB 3.41Å; E181-T274 PolarHBondContact OE1-N 2.65Å; E181-T274 PolarHBondContact OE1-OG1 2.86Å; E181-T274 WeakPolarHBondContact OE2-CB 3.38Å; E181-T274 PolarHBondContact OE2-N 3.41Å
182	K	88.9	Confident	83.7	Confident	146 Å²	146	58.1 Å²	58.1	64%	0.635	30%	0.302	S	S	*	.	S	Bend	trans	-137.3	132.7	177.4	-72	-174.8	-179.7	179.1	0	110.9	Q331	K182-Q331 PolarHBondContact O-NE2 2.82Å
183	P	91.5	Very high	84.4	Confident	18 Å²	18	56.1 Å²	56.1	12%	0.117	29%	0.292	C	S	.	.	S	Bend	cis	-68.9	152.3	0.4	28	-33.9	0	0	0	113.4	Q187 G272 W329	P183-Q187 HydrophobicContact CB-CB 4.01Å; P183-Q187 HydrophobicContact CB-CG 4Å; P183-G272 WeakPolarHBondContact O-CA 3.32Å; P183-W329 WeakPolarHBondContact CD-O 3.48Å; P183-W329 HydrophobicContact CG-CE3 4.36Å; P183-W329 VanDerWaalsContact CG-O 3.25Å; P183-W329 WeakPolarHBondContact CG-O 3.12Å
184	S	94.1	Very high	85.9	Confident	22 Å²	22	52.4 Å²	52.4	15%	0.154	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-72.1	167.8	178.1	66.7	0	0	0	0	111.8	E186 Q187 G188 T268 Q269 F271	S184-E186 VanDerWaalsContact C-N 3.28Å; S184-E186 PolarHBondContact O-N 2.83Å; S184-Q187 PolarHBondContact O-N 3.47Å; S184-Q187 PolarHBondContact OG-N 2.91Å; S184-G188 PolarHBondContact O-N 3.1Å; S184-T268 WeakPolarHBondContact CB-O 3.48Å; S184-Q269 VanDerWaalsContact CB-O 3.31Å; S184-Q269 WeakPolarHBondContact CB-O 3.47Å; S184-F271 CarbonylContact C-O 3.48Å; S184-F271 WeakPolarHBondContact CA-O 3.44Å
185	I	94.6	Very high	87.4	Confident	2 Å²	2	55 Å²	55	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-59.8	-40.7	175.1	-67.8	165.7	0	0	0	110.8	G188 V189 L216 I219 T268 F271 G272 L276	I185-G188 PolarHBondContact O-N 3.06Å; I185-V189 HydrophobicContact CG2-CG2 4.34Å; I185-V189 WeakPolarHBondContact O-CB 3.47Å; I185-V189 VanDerWaalsContact O-CG2 3.29Å; I185-V189 WeakPolarHBondContact O-CG2 3.28Å; I185-V189 PolarHBondContact O-N 3.23Å; I185-L216 HydrophobicContact CG2-CD2 3.93Å; I185-I219 HydrophobicContact CG2-CD1 3.98Å; I185-T268 HydrophobicContact CG2-CG2 4.17Å; I185-T268 PolarHBondContact N-O 2.72Å; I185-F271 HydrophobicContact CD1-CB 4.11Å; I185-F271 WeakPolarHBondContact CG1-O 3.26Å; I185-F271 PolarHBondContact N-O 2.94Å; I185-G272 VanDerWaalsContact CG1-O 3.23Å; I185-G272 WeakPolarHBondContact CG1-O 3.28Å; I185-L276 HydrophobicContact CD1-CB 4.16Å; I185-L276 HydrophobicContact CD1-CD1 4.39Å; I185-L276 HydrophobicContact CG1-CB 4.11Å; I185-L276 HydrophobicContact CG1-CD2 4.34Å; I185-L276 HydrophobicContact CG2-CD1 4.42Å; I185-L276 HydrophobicContact CG2-CD2 4.17Å
186	E	93.6	Very high	89	Confident	65 Å²	65	47.7 Å²	47.7	30%	0.304	24%	0.239	S	C	.	.	H	α-helix	trans	-59	-48.2	174.4	178	163.4	-159.6	0	0	111.5	S184 V189 N190 L216 T268 Q269	S184-E186 VanDerWaalsContact C-N 3.28Å; S184-E186 PolarHBondContact O-N 2.83Å; E186-V189 PolarHBondContact O-N 2.9Å; E186-N190 WeakPolarHBondContact O-CB 3.48Å; E186-N190 VanDerWaalsContact O-CG 3.24Å; E186-N190 PolarHBondContact O-N 3.29Å; E186-N190 PolarHBondContact O-ND2 3.31Å; E186-N190 VanDerWaalsContact O-ND2 3.14Å; E186-L216 HydrophobicContact CB-CD1 4.48Å; E186-L216 HydrophobicContact CB-CD2 4.39Å; E186-L216 HydrophobicContact CG-CD1 4.18Å; E186-T268 WeakPolarHBondContact CB-O 3.48Å; E186-T268 PolarHBondContact N-O 2.97Å; E186-Q269 WeakPolarHBondContact OE2-CG 3.2Å; E186-Q269 PolarHBondContact OE2-NE2 2.76Å; E186-Q269 VanDerWaalsContact OE2-NE2 3.14Å
187	Q	91.8	Very high	90.3	Very high	87 Å²	87	43.1 Å²	43.1	41%	0.407	22%	0.217	S	C	.	.	H	α-helix	trans	-66.2	-42.8	178.4	-170.6	62.7	45.1	0	0	112	P183 S184 V189 N190 N191	P183-Q187 HydrophobicContact CB-CB 4.01Å; P183-Q187 HydrophobicContact CB-CG 4Å; S184-Q187 PolarHBondContact O-N 3.47Å; S184-Q187 PolarHBondContact OG-N 2.91Å; Q187-V189 PolarHBondContact O-N 3.12Å; Q187-N190 PolarHBondContact O-N 2.97Å; Q187-N191 PolarHBondContact NE2-OD1 2.93Å; Q187-N191 WeakPolarHBondContact O-CB 3.5Å; Q187-N191 PolarHBondContact O-N 3.3Å; Q187-N191 PolarHBondContact O-OD1 3.15Å
188	G	92.9	Very high	90.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.4	-39.4	177.3	0	0	0	0	0	113	S184 I185 F192	S184-G188 PolarHBondContact O-N 3.1Å; I185-G188 PolarHBondContact O-N 3.06Å; G188-F192 WeakPolarHBondContact O-CB 3.48Å; G188-F192 PolarHBondContact O-N 3.2Å
189	V	93.4	Very high	90.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-69.7	-38.5	174.3	170.8	0	0	0	0	111.6	I185 E186 Q187 F192 V193 A212 F215 L216 L317	I185-V189 HydrophobicContact CG2-CG2 4.34Å; I185-V189 WeakPolarHBondContact O-CB 3.47Å; I185-V189 VanDerWaalsContact O-CG2 3.29Å; I185-V189 WeakPolarHBondContact O-CG2 3.28Å; I185-V189 PolarHBondContact O-N 3.23Å; E186-V189 PolarHBondContact O-N 2.9Å; Q187-V189 PolarHBondContact O-N 3.12Å; V189-F192 WeakPolarHBondContact O-CB 3.5Å; V189-F192 PolarHBondContact O-N 2.88Å; V189-V193 WeakPolarHBondContact O-CG2 2.99Å; V189-V193 PolarHBondContact O-N 3Å; V189-A212 HydrophobicContact CG1-CB 3.88Å; V189-F215 HydrophobicContact CG2-CD1 4.14Å; V189-F215 HydrophobicContact CG2-CE1 3.95Å; V189-L216 HydrophobicContact CB-CD1 4.36Å; V189-L216 HydrophobicContact CB-CD2 4.01Å; V189-L216 HydrophobicContact CB-CG 4.36Å; V189-L216 HydrophobicContact CG1-CD1 4.09Å; V189-L216 HydrophobicContact CG1-CD2 4.3Å; V189-L216 HydrophobicContact CG1-CG 4.12Å; V189-L216 HydrophobicContact CG2-CD2 3.96Å; V189-L317 HydrophobicContact CG2-CD2 4.26Å
190	N	92.3	Very high	90.8	Very high	41 Å²	41	46 Å²	46	22%	0.219	22%	0.22	C	C	.	.	H	α-helix	trans	-64.7	-43.7	173.8	-72.9	-31.3	0	0	0	111.6	E186 Q187 F192 V193 Q194	E186-N190 WeakPolarHBondContact O-CB 3.48Å; E186-N190 VanDerWaalsContact O-CG 3.24Å; E186-N190 PolarHBondContact O-N 3.29Å; E186-N190 PolarHBondContact O-ND2 3.31Å; E186-N190 VanDerWaalsContact O-ND2 3.14Å; Q187-N190 PolarHBondContact O-N 2.97Å; N190-F192 VanDerWaalsContact C-N 3.34Å; N190-F192 PolarHBondContact O-N 3.21Å; N190-V193 PolarHBondContact O-N 3.22Å; N190-Q194 WeakPolarHBondContact O-CG 3.46Å; N190-Q194 PolarHBondContact O-N 3.44Å; N190-Q194 VanDerWaalsContact O-N 3.09Å
191	N	92.7	Very high	90.8	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-59.8	-42.3	173.3	-69.5	-3.5	0	0	0	111.1	Q187 Q194 Y195 I328 F333	Q187-N191 PolarHBondContact NE2-OD1 2.93Å; Q187-N191 WeakPolarHBondContact O-CB 3.5Å; Q187-N191 PolarHBondContact O-N 3.3Å; Q187-N191 PolarHBondContact O-OD1 3.15Å; N191-Q194 PolarHBondContact O-N 2.82Å; N191-Y195 VanDerWaalsContact O-CB 3.23Å; N191-Y195 WeakPolarHBondContact O-CB 3.33Å; N191-Y195 PolarHBondContact O-N 3.27Å; N191-I328 HydrophobicContact CB-CB 3.86Å; N191-I328 HydrophobicContact CB-CG2 4.46Å; N191-I328 PolarHBondContact ND2-O 3.12Å; N191-F333 HydrophobicContact CB-CD1 3.84Å; N191-F333 HydrophobicContact CB-CD2 4.28Å; N191-F333 HydrophobicContact CB-CE1 3.83Å; N191-F333 HydrophobicContact CB-CE2 4.27Å; N191-F333 HydrophobicContact CB-CG 4.08Å; N191-F333 HydrophobicContact CB-CZ 4.05Å; N191-F333 WeakPolarHBondContact O-CZ 3.49Å; N191-F333 WeakPolarHBondContact OD1-CD1 3.48Å
192	F	93.6	Very high	90.6	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.9	-44.5	173.8	169.7	-104.9	0	0	0	113.3	G188 V189 N190 Q194 Y195 K196 F197 F313 M316 L317 E320 I328	G188-F192 WeakPolarHBondContact O-CB 3.48Å; G188-F192 PolarHBondContact O-N 3.2Å; V189-F192 WeakPolarHBondContact O-CB 3.5Å; V189-F192 PolarHBondContact O-N 2.88Å; N190-F192 VanDerWaalsContact C-N 3.34Å; N190-F192 PolarHBondContact O-N 3.21Å; F192-Q194 VanDerWaalsContact C-N 3.31Å; F192-Q194 PolarHBondContact O-N 3.43Å; F192-Y195 PolarHBondContact O-N 2.9Å; F192-K196 HydrophobicContact CD2-CG 3.86Å; F192-K196 HydrophobicContact CE2-CB 4.42Å; F192-K196 HydrophobicContact CE2-CG 3.69Å; F192-K196 HydrophobicContact CZ-CG 4.46Å; F192-K196 PolarHBondContact O-N 3.29Å; F192-F197 HydrophobicContact CD1-CE2 4.44Å; F192-F197 AromaticContact CE1-CE2 3.78Å; F192-F197 HydrophobicContact CE1-CE2 3.78Å; F192-F197 AromaticContact CZ-CE2 3.88Å; F192-F197 HydrophobicContact CZ-CE2 3.88Å; F192-F197 HydrophobicContact CZ-CZ 4.41Å; F192-F313 HydrophobicContact CD1-CE2 4.21Å; F192-F313 HydrophobicContact CD1-CZ 4.38Å; F192-F313 AromaticContact CE1-CD2 4Å; F192-F313 HydrophobicContact CE1-CD2 4Å; F192-F313 AromaticContact CE1-CE2 3.68Å; F192-F313 HydrophobicContact CE1-CE2 3.68Å; F192-F313 HydrophobicContact CE1-CZ 4.03Å; F192-M316 HydrophobicContact CE2-CB 4.13Å; F192-M316 WeakPolarHBondContact CE2-O 3.37Å; F192-M316 HydrophobicContact CZ-CB 3.82Å; F192-L317 HydrophobicContact CB-CD1 4.23Å; F192-L317 HydrophobicContact CD1-CB 4.49Å; F192-L317 HydrophobicContact CD1-CD1 3.9Å; F192-L317 HydrophobicContact CD2-CD1 4.02Å; F192-L317 HydrophobicContact CE1-CB 3.91Å; F192-L317 HydrophobicContact CE1-CD1 4.19Å; F192-L317 HydrophobicContact CE1-CG 4.48Å; F192-L317 HydrophobicContact CE2-CB 4.18Å; F192-L317 HydrophobicContact CE2-CD1 4.32Å; F192-L317 HydrophobicContact CG-CD1 3.8Å; F192-L317 HydrophobicContact CZ-CB 3.75Å; F192-L317 HydrophobicContact CZ-CD1 4.4Å; F192-E320 HydrophobicContact CD2-CB 4.32Å; F192-E320 HydrophobicContact CD2-CG 3.97Å; F192-E320 HydrophobicContact CE2-CG 4.08Å; F192-I328 HydrophobicContact CB-CD1 3.84Å; F192-I328 HydrophobicContact CB-CG2 4.37Å; F192-I328 HydrophobicContact CD2-CD1 4.48Å
193	V	91.9	Very high	90.3	Very high	3 Å²	3	51.6 Å²	51.6	2%	0.018	26%	0.263	C	S	.	.	H	α-helix	trans	-61.6	-41.8	177.1	173	0	0	0	0	111	V189 N190 F197 I208 M209 A212 F313	V189-V193 WeakPolarHBondContact O-CG2 2.99Å; V189-V193 PolarHBondContact O-N 3Å; N190-V193 PolarHBondContact O-N 3.22Å; V193-F197 WeakPolarHBondContact O-CA 3.38Å; V193-F197 WeakPolarHBondContact O-CB 3.06Å; V193-F197 PolarHBondContact O-N 3.04Å; V193-F197 VanDerWaalsContact O-N 3.08Å; V193-I208 HydrophobicContact CG1-CG2 4.24Å; V193-I208 HydrophobicContact CG2-CG2 4.23Å; V193-M209 HydrophobicContact CG1-CE 3.81Å; V193-A212 HydrophobicContact CG2-CB 3.65Å; V193-F313 HydrophobicContact CG2-CE2 4.4Å
194	Q	89	Confident	89.9	Confident	85 Å²	85	55.7 Å²	55.7	40%	0.397	28%	0.281	S	S	.	.	H	α-helix	trans	-68	-44.9	175.6	-65.2	178.2	21	0	0	112.2	N190 N191 F192 S198 F333 V335	N190-Q194 WeakPolarHBondContact O-CG 3.46Å; N190-Q194 PolarHBondContact O-N 3.44Å; N190-Q194 VanDerWaalsContact O-N 3.09Å; N191-Q194 PolarHBondContact O-N 2.82Å; F192-Q194 VanDerWaalsContact C-N 3.31Å; F192-Q194 PolarHBondContact O-N 3.43Å; Q194-S198 WeakPolarHBondContact O-CB 3.44Å; Q194-S198 PolarHBondContact O-N 2.95Å; Q194-S198 PolarHBondContact O-OG 3.19Å; Q194-F333 HydrophobicContact CB-CE1 4.29Å; Q194-V335 HydrophobicContact CB-CG2 4.37Å
195	Y	89.8	Confident	89.5	Confident	106 Å²	106	60.3 Å²	60.3	42%	0.416	30%	0.295	S	S	.	.	H	α-helix	trans	-65.1	-46.1	-176.8	-178.4	-130.9	0	0	0	112.7	N191 F192 P327 I328	N191-Y195 VanDerWaalsContact O-CB 3.23Å; N191-Y195 WeakPolarHBondContact O-CB 3.33Å; N191-Y195 PolarHBondContact O-N 3.27Å; F192-Y195 PolarHBondContact O-N 2.9Å; Y195-P327 HydrophobicContact CD1-CG 4.28Å; Y195-P327 HydrophobicContact CD2-CG 4.36Å; Y195-P327 HydrophobicContact CE1-CG 3.84Å; Y195-P327 HydrophobicContact CE2-CG 3.94Å; Y195-I328 HydrophobicContact CD1-CG2 3.8Å; Y195-I328 HydrophobicContact CG-CG2 4.21Å
196	K	88.4	Confident	89.1	Confident	52 Å²	52	64.9 Å²	64.9	23%	0.226	32%	0.316	C	S	.	.	H	α-helix	trans	-93.5	-23.7	-174.5	-63.7	-62.5	-172.3	-179.4	0	114.8	F192 H199 M316 E320	F192-K196 HydrophobicContact CD2-CG 3.86Å; F192-K196 HydrophobicContact CE2-CB 4.42Å; F192-K196 HydrophobicContact CE2-CG 3.69Å; F192-K196 HydrophobicContact CZ-CG 4.46Å; F192-K196 PolarHBondContact O-N 3.29Å; K196-H199 PolarHBondContact O-CE1 3.2Å; K196-H199 PolarHBondContact O-ND1 3.3Å; K196-M316 HydrophobicContact CB-CE 4.11Å; K196-M316 HydrophobicContact CD-CE 4.41Å; K196-M316 HydrophobicContact CG-CE 4.3Å; K196-E320 WeakPolarHBondContact CE-OE1 3.48Å; K196-E320 IonicContact NZ-OE1 3.96Å; K196-E320 PolarHBondContact NZ-OE1 2.88Å
197	F	89.7	Confident	88.8	Confident	17 Å²	17	63.7 Å²	63.7	8%	0.075	31%	0.314	C	S	.	.	H	α-helix	trans	-131	10.9	-168.3	-51	-79.7	0	0	0	114.9	F192 V193 H199 L200 I208 F313 M316	F192-F197 HydrophobicContact CD1-CE2 4.44Å; F192-F197 AromaticContact CE1-CE2 3.78Å; F192-F197 HydrophobicContact CE1-CE2 3.78Å; F192-F197 AromaticContact CZ-CE2 3.88Å; F192-F197 HydrophobicContact CZ-CE2 3.88Å; F192-F197 HydrophobicContact CZ-CZ 4.41Å; V193-F197 WeakPolarHBondContact O-CA 3.38Å; V193-F197 WeakPolarHBondContact O-CB 3.06Å; V193-F197 PolarHBondContact O-N 3.04Å; V193-F197 VanDerWaalsContact O-N 3.08Å; F197-H199 PolarHBondContact O-N 2.8Å; F197-L200 HydrophobicContact CB-CD1 4.15Å; F197-L200 HydrophobicContact CB-CG 4.38Å; F197-L200 HydrophobicContact CD1-CD1 3.72Å; F197-L200 HydrophobicContact CD1-CG 4.43Å; F197-L200 HydrophobicContact CG-CD1 4.39Å; F197-L200 PolarHBondContact O-N 3.29Å; F197-I208 HydrophobicContact CB-CG2 4.31Å; F197-I208 HydrophobicContact CD1-CD1 4.42Å; F197-I208 HydrophobicContact CD1-CG1 4.25Å; F197-I208 HydrophobicContact CD1-CG2 4.49Å; F197-I208 HydrophobicContact CD2-CG2 3.67Å; F197-I208 HydrophobicContact CE1-CD1 4.28Å; F197-I208 HydrophobicContact CE2-CG2 4.02Å; F197-I208 HydrophobicContact CG-CG1 4.35Å; F197-I208 HydrophobicContact CG-CG2 3.91Å; F197-F313 HydrophobicContact CE2-CD2 4.48Å; F197-M316 HydrophobicContact CE1-CE 3.82Å; F197-M316 HydrophobicContact CE1-SD 4.16Å; F197-M316 HydrophobicContact CE2-CE 4.38Å; F197-M316 HydrophobicContact CZ-CE 3.54Å; F197-M316 HydrophobicContact CZ-SD 3.82Å
198	S	86.1	Confident	88.6	Confident	55 Å²	55	60.2 Å²	60.2	39%	0.385	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-37.7	172.5	40.4	0	0	0	0	113.5	Q194 L200 R205	Q194-S198 WeakPolarHBondContact O-CB 3.44Å; Q194-S198 PolarHBondContact O-N 2.95Å; Q194-S198 PolarHBondContact O-OG 3.19Å; S198-L200 VanDerWaalsContact C-N 3.29Å; S198-L200 PolarHBondContact O-N 3.04Å; S198-R205 PolarHBondContact O-NH1 3.33Å
199	H	86.6	Confident	88.3	Confident	146 Å²	146	62.7 Å²	62.7	68%	0.676	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-8.7	-178.8	69.1	-97.4	0	0	0	114.8	K196 F197	K196-H199 PolarHBondContact O-CE1 3.2Å; K196-H199 PolarHBondContact O-ND1 3.3Å; F197-H199 PolarHBondContact O-N 2.8Å
200	L	87.4	Confident	88.1	Confident	39 Å²	39	67.1 Å²	67.1	20%	0.204	33%	0.33	C	S	.	.	S	Bend	trans	-78.2	151.7	-178.7	-69.5	-170.6	0	0	0	112.7	F197 S198 E204 I208	F197-L200 HydrophobicContact CB-CD1 4.15Å; F197-L200 HydrophobicContact CB-CG 4.38Å; F197-L200 HydrophobicContact CD1-CD1 3.72Å; F197-L200 HydrophobicContact CD1-CG 4.43Å; F197-L200 HydrophobicContact CG-CD1 4.39Å; F197-L200 PolarHBondContact O-N 3.29Å; S198-L200 VanDerWaalsContact C-N 3.29Å; S198-L200 PolarHBondContact O-N 3.04Å; L200-E204 HydrophobicContact CB-CB 4.25Å; L200-E204 HydrophobicContact CD1-CB 4.21Å; L200-I208 HydrophobicContact CD1-CG1 4.36Å
201	P	88.7	Confident	87.9	Confident	79 Å²	79	65.3 Å²	65.3	51%	0.513	32%	0.321	S	S	.	.			trans	-52.9	147.6	171.9	-25.5	34.6	0	0	0	112.5	K203 E204 R205	P201-K203 VanDerWaalsContact C-N 3.27Å; P201-K203 PolarHBondContact O-N 3.29Å; P201-K203 VanDerWaalsContact O-N 3.09Å; P201-E204 PolarHBondContact O-N 3.25Å; P201-R205 PolarHBondContact O-N 3.49Å
202	S	85.6	Confident	87.9	Confident	92 Å²	92	65.1 Å²	65.1	64%	0.643	32%	0.32	S	S	*	.	H	α-helix	trans	-50	-41.8	-173.4	55.3	0	0	0	0	114.3	Q206	S202-Q206 VanDerWaalsContact O-CB 3.31Å; S202-Q206 WeakPolarHBondContact O-CB 3.48Å; S202-Q206 PolarHBondContact O-N 2.82Å
203	K	83.1	Confident	87.8	Confident	170 Å²	170	71.5 Å²	71.5	74%	0.739	35%	0.347	S	S	*	.	H	α-helix	trans	-65.9	-39.2	177.8	-173.2	176.9	-180	179.4	0	113	P201 T207	P201-K203 VanDerWaalsContact C-N 3.27Å; P201-K203 PolarHBondContact O-N 3.29Å; P201-K203 VanDerWaalsContact O-N 3.09Å; K203-T207 WeakPolarHBondContact O-CB 3.25Å; K203-T207 PolarHBondContact O-N 3.5Å; K203-T207 VanDerWaalsContact O-N 3.09Å; K203-T207 PolarHBondContact O-OG1 3.49Å
204	E	83.1	Confident	87.6	Confident	104 Å²	104	73.9 Å²	73.9	49%	0.486	36%	0.359	S	S	.	.	H	α-helix	trans	-75.3	-40.3	177.5	-66.9	-178.3	-164.3	0	0	111	L200 P201 Q206 T207 I208	L200-E204 HydrophobicContact CB-CB 4.25Å; L200-E204 HydrophobicContact CD1-CB 4.21Å; P201-E204 PolarHBondContact O-N 3.25Å; E204-Q206 VanDerWaalsContact C-N 3.34Å; E204-Q206 PolarHBondContact O-N 2.84Å; E204-T207 CarbonylContact O-C 3.58Å; E204-T207 WeakPolarHBondContact O-CA 3.28Å; E204-T207 VanDerWaalsContact O-CB 3.28Å; E204-T207 WeakPolarHBondContact O-CB 3.48Å; E204-T207 PolarHBondContact O-N 2.9Å; E204-T207 VanDerWaalsContact O-N 3.07Å; E204-I208 WeakPolarHBondContact O-CG1 3.47Å; E204-I208 PolarHBondContact O-N 3.36Å
205	R	84.7	Confident	87.7	Confident	119 Å²	119	69.8 Å²	69.8	45%	0.449	34%	0.34	S	S	.	.	H	α-helix	trans	-61.6	-40.8	174.6	-165.8	173.9	70.8	-160.1	5.4	112.1	S198 P201 I208 M209	S198-R205 PolarHBondContact O-NH1 3.33Å; P201-R205 PolarHBondContact O-N 3.49Å; R205-I208 PolarHBondContact O-N 3.21Å; R205-M209 WeakPolarHBondContact O-CB 3.42Å; R205-M209 PolarHBondContact O-N 2.78Å
206	Q	87.2	Confident	87.9	Confident	98 Å²	98	65.3 Å²	65.3	46%	0.458	32%	0.323	S	S	.	.	H	α-helix	trans	-61	-43.1	170.4	175.1	59.3	25.7	0	0	111.7	S202 E204 I208 M209 E210	S202-Q206 VanDerWaalsContact O-CB 3.31Å; S202-Q206 WeakPolarHBondContact O-CB 3.48Å; S202-Q206 PolarHBondContact O-N 2.82Å; E204-Q206 VanDerWaalsContact C-N 3.34Å; E204-Q206 PolarHBondContact O-N 2.84Å; Q206-I208 PolarHBondContact O-N 2.64Å; Q206-M209 WeakPolarHBondContact O-CB 3.16Å; Q206-M209 PolarHBondContact O-N 3.26Å; Q206-E210 PolarHBondContact NE2-OE1 3.06Å; Q206-E210 PolarHBondContact O-N 2.95Å
207	T	85.8	Confident	88	Confident	41 Å²	41	67 Å²	67	25%	0.252	33%	0.334	S	S	.	.	H	α-helix	trans	-62	-40	177.4	-61.5	0	0	0	0	112.4	K203 E204 E210 L211 L305	K203-T207 WeakPolarHBondContact O-CB 3.25Å; K203-T207 PolarHBondContact O-N 3.5Å; K203-T207 VanDerWaalsContact O-N 3.09Å; K203-T207 PolarHBondContact O-OG1 3.49Å; E204-T207 CarbonylContact O-C 3.58Å; E204-T207 WeakPolarHBondContact O-CA 3.28Å; E204-T207 VanDerWaalsContact O-CB 3.28Å; E204-T207 WeakPolarHBondContact O-CB 3.48Å; E204-T207 PolarHBondContact O-N 2.9Å; E204-T207 VanDerWaalsContact O-N 3.07Å; T207-E210 PolarHBondContact O-N 3.23Å; T207-L211 PolarHBondContact O-N 3.09Å; T207-L305 HydrophobicContact CG2-CD1 3.23Å; T207-L305 HydrophobicContact CG2-CD2 3.8Å; T207-L305 HydrophobicContact CG2-CG 4.16Å
208	I	87.9	Confident	88	Confident	13 Å²	13	69.2 Å²	69.2	7%	0.067	35%	0.345	C	S	.	.	H	α-helix	trans	-69.3	-38.5	173.4	-64.1	-67.4	0	0	0	111.4	V193 F197 L200 E204 R205 Q206 E210 L211 A212 F313	V193-I208 HydrophobicContact CG1-CG2 4.24Å; V193-I208 HydrophobicContact CG2-CG2 4.23Å; F197-I208 HydrophobicContact CB-CG2 4.31Å; F197-I208 HydrophobicContact CD1-CD1 4.42Å; F197-I208 HydrophobicContact CD1-CG1 4.25Å; F197-I208 HydrophobicContact CD1-CG2 4.49Å; F197-I208 HydrophobicContact CD2-CG2 3.67Å; F197-I208 HydrophobicContact CE1-CD1 4.28Å; F197-I208 HydrophobicContact CE2-CG2 4.02Å; F197-I208 HydrophobicContact CG-CG1 4.35Å; F197-I208 HydrophobicContact CG-CG2 3.91Å; L200-I208 HydrophobicContact CD1-CG1 4.36Å; E204-I208 WeakPolarHBondContact O-CG1 3.47Å; E204-I208 PolarHBondContact O-N 3.36Å; R205-I208 PolarHBondContact O-N 3.21Å; Q206-I208 PolarHBondContact O-N 2.64Å; I208-E210 VanDerWaalsContact C-N 3.29Å; I208-E210 PolarHBondContact O-N 3.05Å; I208-L211 PolarHBondContact O-N 3.37Å; I208-A212 PolarHBondContact O-N 3.46Å; I208-F313 HydrophobicContact CG2-CD2 4.13Å; I208-F313 HydrophobicContact CG2-CE2 4.06Å
209	M	88.3	Confident	88.2	Confident	53 Å²	53	67 Å²	67	26%	0.261	33%	0.329	S	S	.	.	H	α-helix	trans	-61.1	-37	174.5	-172	64	70.1	0	0	112	V193 R205 Q206 A212 K213	V193-M209 HydrophobicContact CG1-CE 3.81Å; R205-M209 WeakPolarHBondContact O-CB 3.42Å; R205-M209 PolarHBondContact O-N 2.78Å; Q206-M209 WeakPolarHBondContact O-CB 3.16Å; Q206-M209 PolarHBondContact O-N 3.26Å; M209-A212 PolarHBondContact O-N 3.39Å; M209-K213 WeakPolarHBondContact O-CG 3.01Å; M209-K213 PolarHBondContact O-N 3.25Å
210	E	88.4	Confident	88.4	Confident	92 Å²	92	60.3 Å²	60.3	43%	0.43	30%	0.298	S	S	.	.	H	α-helix	trans	-68.5	-38.9	173.7	-74.8	174.5	-146.2	0	0	112.6	Q206 T207 I208 K213 M214	Q206-E210 PolarHBondContact NE2-OE1 3.06Å; Q206-E210 PolarHBondContact O-N 2.95Å; T207-E210 PolarHBondContact O-N 3.23Å; I208-E210 VanDerWaalsContact C-N 3.29Å; I208-E210 PolarHBondContact O-N 3.05Å; E210-K213 PolarHBondContact O-N 2.82Å; E210-M214 WeakPolarHBondContact O-CB 3.22Å; E210-M214 PolarHBondContact O-N 3.1Å
211	L	88.9	Confident	88.4	Confident	3 Å²	3	64 Å²	64	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-64.4	-38.6	171.6	-73.8	179.6	0	0	0	112.5	T207 I208 M214 F215 L305 I306 H309 F310	T207-L211 PolarHBondContact O-N 3.09Å; I208-L211 PolarHBondContact O-N 3.37Å; L211-M214 HydrophobicContact CD2-CE 3.74Å; L211-M214 PolarHBondContact O-N 3.34Å; L211-F215 WeakPolarHBondContact O-CB 3.45Å; L211-F215 PolarHBondContact O-N 3.1Å; L211-L305 HydrophobicContact CD1-CD1 3.93Å; L211-L305 HydrophobicContact CD1-CG 4.34Å; L211-L305 HydrophobicContact CD2-CD2 4.27Å; L211-L305 HydrophobicContact CD2-CG 4.1Å; L211-L305 HydrophobicContact CG-CD1 4.3Å; L211-L305 HydrophobicContact CG-CD2 4.35Å; L211-L305 HydrophobicContact CG-CG 4.29Å; L211-I306 HydrophobicContact CD2-CG1 4.48Å; L211-H309 HydrophobicContact CD1-CB 3.88Å; L211-F310 HydrophobicContact CD2-CB 4.09Å; L211-F310 HydrophobicContact CD2-CD2 3.97Å; L211-F310 HydrophobicContact CD2-CG 4.3Å
212	A	91.5	Very high	88.4	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65.1	-46.2	175.6	0	0	0	0	0	111.9	V189 V193 I208 M209 M214 F215 L216 F313	V189-A212 HydrophobicContact CG1-CB 3.88Å; V193-A212 HydrophobicContact CG2-CB 3.65Å; I208-A212 PolarHBondContact O-N 3.46Å; M209-A212 PolarHBondContact O-N 3.39Å; A212-M214 VanDerWaalsContact C-N 3.34Å; A212-M214 PolarHBondContact O-N 3.01Å; A212-F215 WeakPolarHBondContact O-CB 3.49Å; A212-F215 PolarHBondContact O-N 3.36Å; A212-L216 WeakPolarHBondContact O-CG 3.5Å; A212-L216 PolarHBondContact O-N 2.66Å; A212-F313 HydrophobicContact CB-CE2 4.16Å; A212-F313 HydrophobicContact CB-CZ 3.86Å
213	K	91.1	Very high	88.5	Confident	135 Å²	135	61.5 Å²	61.5	59%	0.587	28%	0.28	S	S	*	.	H	α-helix	trans	-62	-39.6	173.8	-73.8	177.7	177.3	-175.2	0	112.3	M209 E210 N217	M209-K213 WeakPolarHBondContact O-CG 3.01Å; M209-K213 PolarHBondContact O-N 3.25Å; E210-K213 PolarHBondContact O-N 2.82Å; K213-N217 VanDerWaalsContact O-CB 3.28Å; K213-N217 WeakPolarHBondContact O-CB 3.08Å; K213-N217 PolarHBondContact O-N 3.02Å
214	M	88.3	Confident	88.9	Confident	52 Å²	52	54 Å²	54	26%	0.256	25%	0.248	S	C	.	.	H	α-helix	trans	-61.1	-45.5	173.4	-174.9	-174.7	73.9	0	0	111.3	E210 L211 A212 N217 Q218 I306 F310	E210-M214 WeakPolarHBondContact O-CB 3.22Å; E210-M214 PolarHBondContact O-N 3.1Å; L211-M214 HydrophobicContact CD2-CE 3.74Å; L211-M214 PolarHBondContact O-N 3.34Å; A212-M214 VanDerWaalsContact C-N 3.34Å; A212-M214 PolarHBondContact O-N 3.01Å; M214-N217 PolarHBondContact O-N 3.07Å; M214-Q218 VanDerWaalsContact O-CG 3.31Å; M214-Q218 WeakPolarHBondContact O-CG 3.48Å; M214-Q218 PolarHBondContact O-N 3Å; M214-I306 HydrophobicContact CE-CG1 4.29Å; M214-I306 HydrophobicContact SD-CD1 4Å; M214-I306 HydrophobicContact SD-CG1 4.28Å; M214-F310 HydrophobicContact CE-CD1 4Å; M214-F310 HydrophobicContact CE-CD2 3.7Å; M214-F310 HydrophobicContact CE-CE1 3.82Å; M214-F310 HydrophobicContact CE-CE2 3.51Å; M214-F310 HydrophobicContact CE-CG 3.94Å; M214-F310 HydrophobicContact CE-CZ 3.57Å
215	F	91.4	Very high	89.2	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.5	-47.2	178.4	175.3	-106.6	0	0	0	112.8	V189 L211 A212 Q218 I219 F280 M283 L287 F310 F313 L314 L317	V189-F215 HydrophobicContact CG2-CD1 4.14Å; V189-F215 HydrophobicContact CG2-CE1 3.95Å; L211-F215 WeakPolarHBondContact O-CB 3.45Å; L211-F215 PolarHBondContact O-N 3.1Å; A212-F215 WeakPolarHBondContact O-CB 3.49Å; A212-F215 PolarHBondContact O-N 3.36Å; F215-Q218 PolarHBondContact O-N 3.08Å; F215-I219 HydrophobicContact CD1-CD1 3.88Å; F215-I219 HydrophobicContact CE1-CD1 3.43Å; F215-I219 VanDerWaalsContact CE1-CD1 3.43Å; F215-I219 HydrophobicContact CE2-CD1 4.23Å; F215-I219 HydrophobicContact CG-CD1 4.45Å; F215-I219 HydrophobicContact CZ-CD1 3.63Å; F215-I219 HydrophobicContact CZ-CG1 4.48Å; F215-I219 PolarHBondContact O-N 2.69Å; F215-I219 VanDerWaalsContact O-N 3.14Å; F215-F280 HydrophobicContact CE2-CE2 4.18Å; F215-F280 HydrophobicContact CZ-CD2 4.16Å; F215-F280 AromaticContact CZ-CE2 3.6Å; F215-F280 HydrophobicContact CZ-CE2 3.6Å; F215-M283 HydrophobicContact CE2-CE 3.65Å; F215-M283 HydrophobicContact CE2-SD 4.29Å; F215-M283 HydrophobicContact CZ-CE 3.61Å; F215-L287 HydrophobicContact CD2-CD1 4.06Å; F215-L287 HydrophobicContact CE2-CD1 4.17Å; F215-F310 HydrophobicContact CB-CE2 4.34Å; F215-F313 HydrophobicContact CB-CE1 4.18Å; F215-F313 HydrophobicContact CD1-CE1 4.48Å; F215-F313 HydrophobicContact CG-CE1 4.27Å; F215-L314 HydrophobicContact CD2-CD2 3.6Å; F215-L314 HydrophobicContact CE2-CD2 3.55Å; F215-L317 HydrophobicContact CD1-CD2 4.01Å; F215-L317 HydrophobicContact CE1-CD2 3.46Å; F215-L317 VanDerWaalsContact CE1-CD2 3.46Å; F215-L317 HydrophobicContact CZ-CD2 3.78Å
216	L	93	Very high	89.4	Confident	12 Å²	12	45.2 Å²	45.2	6%	0.063	21%	0.213	C	C	.	.	H	α-helix	trans	-61.2	-45	176.4	-70	171.2	0	0	0	111.8	I185 E186 V189 A212 Q218 I219 N220 T268	I185-L216 HydrophobicContact CG2-CD2 3.93Å; E186-L216 HydrophobicContact CB-CD1 4.48Å; E186-L216 HydrophobicContact CB-CD2 4.39Å; E186-L216 HydrophobicContact CG-CD1 4.18Å; V189-L216 HydrophobicContact CB-CD1 4.36Å; V189-L216 HydrophobicContact CB-CD2 4.01Å; V189-L216 HydrophobicContact CB-CG 4.36Å; V189-L216 HydrophobicContact CG1-CD1 4.09Å; V189-L216 HydrophobicContact CG1-CD2 4.3Å; V189-L216 HydrophobicContact CG1-CG 4.12Å; V189-L216 HydrophobicContact CG2-CD2 3.96Å; A212-L216 WeakPolarHBondContact O-CG 3.5Å; A212-L216 PolarHBondContact O-N 2.66Å; L216-Q218 VanDerWaalsContact C-N 3.3Å; L216-Q218 PolarHBondContact O-N 3Å; L216-I219 WeakPolarHBondContact O-CB 3.46Å; L216-I219 PolarHBondContact O-N 2.88Å; L216-I219 VanDerWaalsContact O-N 3.16Å; L216-N220 PolarHBondContact O-N 3.08Å; L216-T268 HydrophobicContact CB-CG2 4.09Å; L216-T268 HydrophobicContact CD2-CG2 3.57Å; L216-T268 HydrophobicContact CG-CG2 4.46Å; L216-T268 WeakPolarHBondContact O-CG2 3.36Å
217	N	91.5	Very high	89.5	Confident	86 Å²	86	40.6 Å²	40.6	46%	0.46	19%	0.191	S	C	.	.	H	α-helix	trans	-60.4	-39.5	176.2	-173.8	41.5	0	0	0	112	K213 M214 I219 N220 Y221	K213-N217 VanDerWaalsContact O-CB 3.28Å; K213-N217 WeakPolarHBondContact O-CB 3.08Å; K213-N217 PolarHBondContact O-N 3.02Å; M214-N217 PolarHBondContact O-N 3.07Å; N217-I219 PolarHBondContact O-N 2.93Å; N217-N220 PolarHBondContact O-N 3.39Å; N217-Y221 WeakPolarHBondContact O-CD2 3.5Å; N217-Y221 WeakPolarHBondContact OD1-CE2 3.3Å
218	Q	89.2	Confident	89.5	Confident	65 Å²	65	40.7 Å²	40.7	30%	0.304	19%	0.194	S	C	.	.	H	α-helix	trans	-62.3	-42.7	175	-69.7	-66.5	-19.5	0	0	112	M214 F215 L216 N220 Y221 W222 L287	M214-Q218 VanDerWaalsContact O-CG 3.31Å; M214-Q218 WeakPolarHBondContact O-CG 3.48Å; M214-Q218 PolarHBondContact O-N 3Å; F215-Q218 PolarHBondContact O-N 3.08Å; L216-Q218 VanDerWaalsContact C-N 3.3Å; L216-Q218 PolarHBondContact O-N 3Å; Q218-N220 PolarHBondContact O-N 3Å; Q218-Y221 PolarHBondContact O-N 3.02Å; Q218-W222 VanDerWaalsContact O-CB 3.26Å; Q218-W222 WeakPolarHBondContact O-CB 3.24Å; Q218-W222 PolarHBondContact O-N 3.19Å; Q218-L287 HydrophobicContact CB-CD2 3.86Å; Q218-L287 HydrophobicContact CG-CD2 3.86Å
219	I	90.5	Very high	89.4	Confident	7 Å²	7	44.7 Å²	44.7	4%	0.036	21%	0.212	C	C	.	.	H	α-helix	trans	-57.8	-35.9	176.3	-69.8	158.1	0	0	0	112.3	I185 F215 L216 N217 Y221 T267 T268 L276 M283	I185-I219 HydrophobicContact CG2-CD1 3.98Å; F215-I219 HydrophobicContact CD1-CD1 3.88Å; F215-I219 HydrophobicContact CE1-CD1 3.43Å; F215-I219 VanDerWaalsContact CE1-CD1 3.43Å; F215-I219 HydrophobicContact CE2-CD1 4.23Å; F215-I219 HydrophobicContact CG-CD1 4.45Å; F215-I219 HydrophobicContact CZ-CD1 3.63Å; F215-I219 HydrophobicContact CZ-CG1 4.48Å; F215-I219 PolarHBondContact O-N 2.69Å; F215-I219 VanDerWaalsContact O-N 3.14Å; L216-I219 WeakPolarHBondContact O-CB 3.46Å; L216-I219 PolarHBondContact O-N 2.88Å; L216-I219 VanDerWaalsContact O-N 3.16Å; N217-I219 PolarHBondContact O-N 2.93Å; I219-Y221 VanDerWaalsContact C-N 3.31Å; I219-Y221 PolarHBondContact O-N 3.18Å; I219-T267 HydrophobicContact CG2-CG2 3.8Å; I219-T268 HydrophobicContact CB-CG2 3.78Å; I219-T268 HydrophobicContact CD1-CG2 4.31Å; I219-T268 HydrophobicContact CG2-CG2 3.64Å; I219-L276 HydrophobicContact CD1-CD1 4.37Å; I219-M283 HydrophobicContact CD1-CE 4.15Å; I219-M283 HydrophobicContact CD1-SD 4.24Å; I219-M283 HydrophobicContact CG1-CE 3.94Å; I219-M283 HydrophobicContact CG1-SD 3.41Å; I219-M283 WeakPolarHBondContact CG1-SD 3.17Å
220	N	90.6	Very high	89.1	Confident	6 Å²	6	43 Å²	43	3%	0.032	20%	0.203	C	C	.	.	H	α-helix	trans	-73	-18	-178.6	-73.3	-21.9	0	0	0	114.5	L216 N217 Q218 Q257 E266 T267 T268	L216-N220 PolarHBondContact O-N 3.08Å; N217-N220 PolarHBondContact O-N 3.39Å; Q218-N220 PolarHBondContact O-N 3Å; N220-Q257 PolarHBondContact O-NE2 3.16Å; N220-E266 VanDerWaalsContact ND2-CD 3.27Å; N220-E266 PolarHBondContact ND2-OE2 3.3Å; N220-T267 WeakPolarHBondContact OD1-CB 3.3Å; N220-T267 PolarHBondContact OD1-N 3.46Å; N220-T268 PolarHBondContact ND2-OG1 3.38Å; N220-T268 WeakPolarHBondContact OD1-CG2 3.18Å; N220-T268 PolarHBondContact OD1-N 2.98Å; N220-T268 PolarHBondContact OD1-OG1 3.22Å
221	Y	87.4	Confident	88.7	Confident	118 Å²	118	45.2 Å²	45.2	46%	0.463	21%	0.208	S	C	.	.	H	α-helix	trans	-115	-7.3	175.8	-65.1	-77.8	0	0	0	113.9	N217 Q218 I219 Q223 Q257 R264	N217-Y221 WeakPolarHBondContact O-CD2 3.5Å; N217-Y221 WeakPolarHBondContact OD1-CE2 3.3Å; Q218-Y221 PolarHBondContact O-N 3.02Å; I219-Y221 VanDerWaalsContact C-N 3.31Å; I219-Y221 PolarHBondContact O-N 3.18Å; Y221-Q223 PolarHBondContact O-NE2 3.24Å; Y221-Q257 VanDerWaalsContact CD1-OE1 3.3Å; Y221-R264 PolarHBondContact OH-NH2 2.75Å
222	W	87.8	Confident	88.3	Confident	28 Å²	28	53 Å²	53	11%	0.106	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-65.7	143.3	178.2	-175	65	0	0	0	112	Q218 L224 W249 V279 V282 M283	Q218-W222 VanDerWaalsContact O-CB 3.26Å; Q218-W222 WeakPolarHBondContact O-CB 3.24Å; Q218-W222 PolarHBondContact O-N 3.19Å; W222-L224 HydrophobicContact CE3-CD1 3.54Å; W222-L224 HydrophobicContact CE3-CG 4.28Å; W222-L224 HydrophobicContact CZ3-CB 4.4Å; W222-L224 HydrophobicContact CZ3-CD1 3.52Å; W222-L224 HydrophobicContact CZ3-CG 3.76Å; W222-W249 WeakPolarHBondContact O-CZ2 3.27Å; W222-V279 HydrophobicContact CH2-CB 3.75Å; W222-V279 HydrophobicContact CH2-CG1 4.15Å; W222-V279 HydrophobicContact CH2-CG2 4.46Å; W222-V279 HydrophobicContact CZ3-CB 3.57Å; W222-V279 HydrophobicContact CZ3-CG1 3.86Å; W222-V279 HydrophobicContact CZ3-CG2 3.85Å; W222-V282 HydrophobicContact CZ2-CG1 4.33Å; W222-M283 HydrophobicContact CD2-CG 4.48Å; W222-M283 HydrophobicContact CZ2-CB 4.28Å
223	Q	88.9	Confident	87.6	Confident	90 Å²	90	59.8 Å²	59.8	42%	0.421	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-96.9	117.9	179.1	-59.4	-60.9	-55.9	0	0	109.4	Y221 N254	Y221-Q223 PolarHBondContact O-NE2 3.24Å; Q223-N254 PolarHBondContact NE2-ND2 2.76Å; Q223-N254 PolarHBondContact OE1-ND2 2.83Å
224	L	90.6	Very high	86.8	Confident	11 Å²	11	55.8 Å²	55.8	6%	0.058	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-66.5	141.4	176	-88.1	60.8	0	0	0	110.5	W222 Y242 Y246 W249 L275 V279	W222-L224 HydrophobicContact CE3-CD1 3.54Å; W222-L224 HydrophobicContact CE3-CG 4.28Å; W222-L224 HydrophobicContact CZ3-CB 4.4Å; W222-L224 HydrophobicContact CZ3-CD1 3.52Å; W222-L224 HydrophobicContact CZ3-CG 3.76Å; L224-Y242 HydrophobicContact CD2-CE2 4.34Å; L224-Y246 HydrophobicContact CB-CD2 3.81Å; L224-Y246 HydrophobicContact CB-CE2 3.76Å; L224-Y246 HydrophobicContact CD2-CD2 4.18Å; L224-W249 HydrophobicContact CB-CD2 4.25Å; L224-W249 HydrophobicContact CB-CE3 3.96Å; L224-W249 HydrophobicContact CB-CH2 4.07Å; L224-W249 HydrophobicContact CB-CZ2 4.35Å; L224-W249 HydrophobicContact CB-CZ3 3.87Å; L224-W249 HydrophobicContact CD1-CD2 3.92Å; L224-W249 HydrophobicContact CD1-CE3 4.5Å; L224-W249 HydrophobicContact CD1-CG 4.17Å; L224-W249 HydrophobicContact CD1-CZ2 4.01Å; L224-W249 HydrophobicContact CD2-CB 4.07Å; L224-W249 HydrophobicContact CD2-CD2 3.88Å; L224-W249 HydrophobicContact CD2-CE3 4.08Å; L224-W249 HydrophobicContact CD2-CG 3.87Å; L224-W249 HydrophobicContact CG-CD2 4.23Å; L224-W249 HydrophobicContact CG-CE3 4.4Å; L224-L275 HydrophobicContact CD2-CD1 4.05Å; L224-V279 HydrophobicContact CG-CG1 4.42Å
225	E	89.7	Confident	85.5	Confident	26 Å²	26	58.5 Å²	58.5	12%	0.121	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-62.3	143.1	169.4	-66.1	-177.6	141.7	0	0	110.3	Q229 R233 Y242 Y246 V282	E225-Q229 HydrophobicContact CB-CB 4.28Å; E225-R233 IonicContact OE1-CZ 3.14Å; E225-R233 IonicContact OE1-NH1 2.67Å; E225-R233 PolarHBondContact OE1-NH1 2.69Å; E225-R233 IonicContact OE1-NH2 3.57Å; E225-R233 PolarHBondContact OE1-NH2 3.01Å; E225-R233 IonicContact OE2-CZ 3.2Å; E225-R233 IonicContact OE2-NH1 2.94Å; E225-R233 PolarHBondContact OE2-NH1 3.19Å; E225-R233 IonicContact OE2-NH2 2.69Å; E225-Y242 WeakPolarHBondContact O-CE1 3.41Å; E225-Y242 PolarHBondContact O-OH 2.85Å; E225-Y246 WeakPolarHBondContact O-CE2 3.48Å; E225-V282 HydrophobicContact CG-CG1 4.32Å; E225-V282 WeakPolarHBondContact OE1-CG1 3.48Å
226	T	90.3	Very high	83.9	Confident	13 Å²	13	64 Å²	64	8%	0.08	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-68.1	156.8	-179.3	83.4	0	0	0	0	111.1	D146 S228 Q229 R230	D146-T226 HydrophobicContact CB-CG2 4.1Å; D146-T226 WeakPolarHBondContact OD2-CB 3.33Å; D146-T226 PolarHBondContact OD2-OG1 3.19Å; T226-S228 PolarHBondContact O-N 2.63Å; T226-S228 WeakPolarHBondContact OG1-CB 3.46Å; T226-S228 PolarHBondContact OG1-N 3.16Å; T226-Q229 HydrophobicContact CG2-CG 4.46Å; T226-Q229 WeakPolarHBondContact O-CB 3.46Å; T226-Q229 PolarHBondContact O-N 2.7Å; T226-Q229 WeakPolarHBondContact OG1-CG 3.44Å; T226-Q229 PolarHBondContact OG1-N 3.44Å; T226-R230 PolarHBondContact O-N 2.88Å
227	P	87.6	Confident	82.6	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.006	33%	0.33	C	S	.	.	H	α-helix	trans	-56.8	-32.9	175	-24.9	35.2	0	0	0	112.4	D148 R231 K243 Y246	D148-P227 HydrophobicContact CB-CG 4.28Å; D148-P227 WeakPolarHBondContact OD2-CB 3.36Å; P227-R231 VanDerWaalsContact O-CB 3.28Å; P227-R231 WeakPolarHBondContact O-CB 3.37Å; P227-R231 PolarHBondContact O-N 3.38Å; P227-K243 HydrophobicContact CB-CB 4.34Å; P227-K243 HydrophobicContact CG-CB 4.25Å; P227-K243 HydrophobicContact CG-CG 4.25Å; P227-Y246 HydrophobicContact CG-CD1 3.76Å; P227-Y246 HydrophobicContact CG-CE1 4.36Å; P227-Y246 HydrophobicContact CG-CG 3.97Å
228	S	85.6	Confident	81.6	Confident	44 Å²	44	66.9 Å²	66.9	31%	0.308	33%	0.332	S	S	.	.	H	α-helix	trans	-62.3	-47	172.4	-46	0	0	0	0	112.1	D146 T226 R231 Q232	D146-S228 WeakPolarHBondContact OD2-CB 3.37Å; D146-S228 PolarHBondContact OD2-OG 3.17Å; T226-S228 PolarHBondContact O-N 2.63Å; T226-S228 WeakPolarHBondContact OG1-CB 3.46Å; T226-S228 PolarHBondContact OG1-N 3.16Å; S228-R231 PolarHBondContact O-N 2.89Å; S228-Q232 WeakPolarHBondContact O-CG 3.4Å; S228-Q232 PolarHBondContact O-N 3.18Å
229	Q	85.6	Confident	81	Confident	97 Å²	97	64.7 Å²	64.7	45%	0.453	32%	0.323	S	S	.	.	H	α-helix	trans	-65.5	-43.5	178.3	-68	169.1	-6.3	0	0	111.9	E225 T226 Q232 R233	E225-Q229 HydrophobicContact CB-CB 4.28Å; T226-Q229 HydrophobicContact CG2-CG 4.46Å; T226-Q229 WeakPolarHBondContact O-CB 3.46Å; T226-Q229 PolarHBondContact O-N 2.7Å; T226-Q229 WeakPolarHBondContact OG1-CG 3.44Å; T226-Q229 PolarHBondContact OG1-N 3.44Å; Q229-Q232 PolarHBondContact O-N 3.01Å; Q229-R233 PolarHBondContact O-N 3.1Å
230	R	82.3	Confident	80.6	Confident	18 Å²	18	69.5 Å²	69.5	7%	0.068	35%	0.352	C	S	.	.	H	α-helix	trans	-64.1	-42.6	177.3	-174.2	176.8	179.9	168.2	-5.1	111.8	T226 Q232 R233 V234 D237 Y242 S278	T226-R230 PolarHBondContact O-N 2.88Å; R230-Q232 PolarHBondContact O-N 3.44Å; R230-R233 PolarHBondContact O-N 2.96Å; R230-V234 PolarHBondContact O-N 2.88Å; R230-D237 IonicContact CZ-OD2 2.66Å; R230-D237 VanDerWaalsContact CZ-OD2 3.24Å; R230-D237 IonicContact NE-OD2 3.42Å; R230-D237 PolarHBondContact NE-OD2 2.91Å; R230-D237 VanDerWaalsContact NE-OD2 3.08Å; R230-D237 VanDerWaalsContact NH2-CG 3.32Å; R230-D237 IonicContact NH2-OD1 3.81Å; R230-D237 PolarHBondContact NH2-OD1 3.42Å; R230-D237 IonicContact NH2-OD2 3.17Å; R230-D237 PolarHBondContact NH2-OD2 3.47Å; R230-Y242 HydrophobicContact CB-CD1 4.24Å; R230-Y242 HydrophobicContact CB-CE1 4.11Å; R230-Y242 VanDerWaalsContact CD-CD1 3.4Å; R230-Y242 HydrophobicContact CG-CD1 4.44Å; R230-S278 PolarHBondContact NH1-O 3.03Å; R230-S278 PolarHBondContact NH1-OG 2.89Å; R230-S278 PolarHBondContact NH2-OG 3.43Å
231	R	81.6	Confident	80.3	Confident	138 Å²	138	70.1 Å²	70.1	52%	0.521	36%	0.36	S	S	.	.	H	α-helix	trans	-56.9	-33.1	177.9	-169.5	-168.7	-57	-96.8	3.2	112.6	P227 S228	P227-R231 VanDerWaalsContact O-CB 3.28Å; P227-R231 WeakPolarHBondContact O-CB 3.37Å; P227-R231 PolarHBondContact O-N 3.38Å; S228-R231 PolarHBondContact O-N 2.89Å
232	Q	80.1	Confident	80.4	Confident	167 Å²	167	64.7 Å²	64.7	78%	0.78	34%	0.339	S	S	*	.	H	α-helix	trans	-72.9	-27.1	174.9	-67.3	175	8.6	0	0	113.4	S228 Q229 R230	S228-Q232 WeakPolarHBondContact O-CG 3.4Å; S228-Q232 PolarHBondContact O-N 3.18Å; Q229-Q232 PolarHBondContact O-N 3.01Å; R230-Q232 PolarHBondContact O-N 3.44Å
233	R	77.3	Confident	80.5	Confident	141 Å²	141	66.6 Å²	66.6	53%	0.532	35%	0.348	S	S	.	.	H	α-helix	trans	-89.5	-41.3	179.5	-173.4	-178.9	-66.4	140.5	8.4	113.2	E225 Q229 R230	E225-R233 IonicContact OE1-CZ 3.14Å; E225-R233 IonicContact OE1-NH1 2.67Å; E225-R233 PolarHBondContact OE1-NH1 2.69Å; E225-R233 IonicContact OE1-NH2 3.57Å; E225-R233 PolarHBondContact OE1-NH2 3.01Å; E225-R233 IonicContact OE2-CZ 3.2Å; E225-R233 IonicContact OE2-NH1 2.94Å; E225-R233 PolarHBondContact OE2-NH1 3.19Å; E225-R233 IonicContact OE2-NH2 2.69Å; Q229-R233 PolarHBondContact O-N 3.1Å; R230-R233 PolarHBondContact O-N 2.96Å
234	V	73.4	Confident	80.5	Confident	52 Å²	52	65.4 Å²	65.4	32%	0.315	35%	0.346	S	S	.	.			trans	-134.4	90.1	-175.7	-158.8	0	0	0	0	110	R230 S236 D237	R230-V234 PolarHBondContact O-N 2.88Å; V234-S236 VanDerWaalsContact C-N 3.27Å; V234-S236 PolarHBondContact O-N 3.29Å; V234-D237 HydrophobicContact CB-CB 4.06Å; V234-D237 HydrophobicContact CG1-CB 3.71Å
235	P	61.5	Low	80.5	Confident	109 Å²	109	65.8 Å²	65.8	71%	0.708	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-15.6	-176.9	-21.9	34.9	0	0	0	115.2
236	S	57.2	Low	80.6	Confident	116 Å²	116	65 Å²	65	81%	0.811	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	20.8	-171.2	64.8	0	0	0	0	114.2	V234	V234-S236 VanDerWaalsContact C-N 3.27Å; V234-S236 PolarHBondContact O-N 3.29Å
237	D	64.9	Low	80.7	Confident	64 Å²	64	66.8 Å²	66.8	34%	0.342	36%	0.355	S	S	.	.	S	Bend	trans	-111.4	169.8	-170.7	-165.6	-1.2	0	0	0	110.6	R230 V234 V239	R230-D237 IonicContact CZ-OD2 2.66Å; R230-D237 VanDerWaalsContact CZ-OD2 3.24Å; R230-D237 IonicContact NE-OD2 3.42Å; R230-D237 PolarHBondContact NE-OD2 2.91Å; R230-D237 VanDerWaalsContact NE-OD2 3.08Å; R230-D237 VanDerWaalsContact NH2-CG 3.32Å; R230-D237 IonicContact NH2-OD1 3.81Å; R230-D237 PolarHBondContact NH2-OD1 3.42Å; R230-D237 IonicContact NH2-OD2 3.17Å; R230-D237 PolarHBondContact NH2-OD2 3.47Å; V234-D237 HydrophobicContact CB-CB 4.06Å; V234-D237 HydrophobicContact CG1-CB 3.71Å; D237-V239 VanDerWaalsContact C-N 3.26Å; D237-V239 PolarHBondContact O-N 3.01Å
238	D	72.3	Confident	80.9	Confident	94 Å²	94	69.4 Å²	69.4	50%	0.503	37%	0.365	S	S	.	.			trans	-75.2	78.7	177.3	-178.1	18.1	0	0	0	111.8	V240 G241 Y242	D238-V240 PolarHBondContact O-N 3.49Å; D238-V240 PolarHBondContact OD1-N 3.38Å; D238-V240 VanDerWaalsContact OD1-N 3.1Å; D238-G241 VanDerWaalsContact CG-N 3.3Å; D238-G241 PolarHBondContact OD1-N 2.82Å; D238-G241 VanDerWaalsContact OD2-CA 3.23Å; D238-G241 WeakPolarHBondContact OD2-CA 3.36Å; D238-G241 PolarHBondContact OD2-N 3.19Å; D238-Y242 WeakPolarHBondContact O-CB 3.38Å; D238-Y242 PolarHBondContact O-N 3.13Å
239	V	75.1	Confident	81.2	Confident	18 Å²	18	67.4 Å²	67.4	11%	0.109	35%	0.351	C	S	.	.	H	α-helix	trans	-64.7	-24.4	175	-177.6	0	0	0	0	111.5	D237 K243	D237-V239 VanDerWaalsContact C-N 3.26Å; D237-V239 PolarHBondContact O-N 3.01Å; V239-K243 VanDerWaalsContact O-CB 3.27Å; V239-K243 WeakPolarHBondContact O-CB 3.47Å; V239-K243 PolarHBondContact O-N 2.98Å
240	V	82.4	Confident	81.5	Confident	109 Å²	109	62.9 Å²	62.9	66%	0.661	33%	0.33	S	S	*	.	H	α-helix	trans	-78.4	-55.1	-178	-177.8	0	0	0	0	110.2	D238 Y242 K243 V244	D238-V240 PolarHBondContact O-N 3.49Å; D238-V240 PolarHBondContact OD1-N 3.38Å; D238-V240 VanDerWaalsContact OD1-N 3.1Å; V240-Y242 VanDerWaalsContact C-N 3.26Å; V240-Y242 PolarHBondContact O-N 3.18Å; V240-K243 PolarHBondContact O-N 3.44Å; V240-K243 VanDerWaalsContact O-N 3.1Å; V240-V244 WeakPolarHBondContact O-CG2 3.45Å; V240-V244 PolarHBondContact O-N 3.39Å
241	G	84.9	Confident	82	Confident	19 Å²	19	62.7 Å²	62.7	20%	0.196	33%	0.331	C	S	.	.	H	α-helix	trans	-62	-32.5	174	0	0	0	0	0	112.4	D238 N245	D238-G241 VanDerWaalsContact CG-N 3.3Å; D238-G241 PolarHBondContact OD1-N 2.82Å; D238-G241 VanDerWaalsContact OD2-CA 3.23Å; D238-G241 WeakPolarHBondContact OD2-CA 3.36Å; D238-G241 PolarHBondContact OD2-N 3.19Å; G241-N245 PolarHBondContact O-N 3.45Å; G241-N245 VanDerWaalsContact O-N 3.08Å; G241-N245 PolarHBondContact O-ND2 3.35Å
242	Y	89.3	Confident	82.4	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-66.6	-44.8	169.8	-172.3	-120.7	0	0	0	112.9	L224 E225 R230 D238 V240 V244 N245 Y246 L275 V279	L224-Y242 HydrophobicContact CD2-CE2 4.34Å; E225-Y242 WeakPolarHBondContact O-CE1 3.41Å; E225-Y242 PolarHBondContact O-OH 2.85Å; R230-Y242 HydrophobicContact CB-CD1 4.24Å; R230-Y242 HydrophobicContact CB-CE1 4.11Å; R230-Y242 VanDerWaalsContact CD-CD1 3.4Å; R230-Y242 HydrophobicContact CG-CD1 4.44Å; D238-Y242 WeakPolarHBondContact O-CB 3.38Å; D238-Y242 PolarHBondContact O-N 3.13Å; V240-Y242 VanDerWaalsContact C-N 3.26Å; V240-Y242 PolarHBondContact O-N 3.18Å; Y242-V244 VanDerWaalsContact C-N 3.29Å; Y242-V244 PolarHBondContact O-N 2.82Å; Y242-N245 PolarHBondContact O-N 3.24Å; Y242-N245 VanDerWaalsContact O-N 3.17Å; Y242-Y246 WeakPolarHBondContact O-CB 3.48Å; Y242-Y246 PolarHBondContact O-N 3.42Å; Y242-L275 HydrophobicContact CE2-CD1 4.13Å; Y242-V279 HydrophobicContact CE2-CG1 3.98Å
243	K	89.2	Confident	82.9	Confident	67 Å²	67	49.2 Å²	49.2	29%	0.291	27%	0.273	S	S	.	.	H	α-helix	trans	-60.3	-38.2	177.9	178.1	171.6	176.7	161.6	0	112.3	D148 P227 V239 V240 Y246 T247	D148-K243 VanDerWaalsContact CG-CE 3.48Å; D148-K243 WeakPolarHBondContact OD1-CE 3.24Å; D148-K243 IonicContact OD1-NZ 2.65Å; D148-K243 PolarHBondContact OD1-NZ 2.95Å; D148-K243 VanDerWaalsContact OD2-CD 3.27Å; D148-K243 WeakPolarHBondContact OD2-CD 3.43Å; D148-K243 VanDerWaalsContact OD2-CE 3.25Å; D148-K243 WeakPolarHBondContact OD2-CE 3.47Å; D148-K243 IonicContact OD2-NZ 3.91Å; D148-K243 PolarHBondContact OD2-NZ 2.85Å; D148-K243 VanDerWaalsContact OD2-NZ 3.11Å; P227-K243 HydrophobicContact CB-CB 4.34Å; P227-K243 HydrophobicContact CG-CB 4.25Å; P227-K243 HydrophobicContact CG-CG 4.25Å; V239-K243 VanDerWaalsContact O-CB 3.27Å; V239-K243 WeakPolarHBondContact O-CB 3.47Å; V239-K243 PolarHBondContact O-N 2.98Å; V240-K243 PolarHBondContact O-N 3.44Å; V240-K243 VanDerWaalsContact O-N 3.1Å; K243-Y246 PolarHBondContact O-N 3Å; K243-T247 WeakPolarHBondContact O-CB 3.26Å; K243-T247 PolarHBondContact O-N 3.19Å; K243-T247 PolarHBondContact O-OG1 3.31Å
244	V	89.9	Confident	83.6	Confident	65 Å²	65	42.7 Å²	42.7	39%	0.394	25%	0.249	S	C	.	.	H	α-helix	trans	-62	-49.4	173.5	172.4	0	0	0	0	110.7	V240 Y242 Y246 T247 R248	V240-V244 WeakPolarHBondContact O-CG2 3.45Å; V240-V244 PolarHBondContact O-N 3.39Å; Y242-V244 VanDerWaalsContact C-N 3.29Å; Y242-V244 PolarHBondContact O-N 2.82Å; V244-Y246 PolarHBondContact O-N 2.99Å; V244-T247 PolarHBondContact O-N 3.4Å; V244-R248 WeakPolarHBondContact O-CG 3.43Å; V244-R248 PolarHBondContact O-N 3.1Å
245	N	90.8	Very high	84.4	Confident	20 Å²	20	40.2 Å²	40.2	11%	0.107	23%	0.234	C	C	.	.	H	α-helix	trans	-67.9	-32.9	179.1	-73.5	-55	0	0	0	113.4	G241 Y242 R248 W249 F271 L275	G241-N245 PolarHBondContact O-N 3.45Å; G241-N245 VanDerWaalsContact O-N 3.08Å; G241-N245 PolarHBondContact O-ND2 3.35Å; Y242-N245 PolarHBondContact O-N 3.24Å; Y242-N245 VanDerWaalsContact O-N 3.17Å; N245-R248 PolarHBondContact O-N 2.86Å; N245-W249 WeakPolarHBondContact O-CB 3.46Å; N245-W249 PolarHBondContact O-N 2.83Å; N245-F271 HydrophobicContact CB-CE1 4.18Å; N245-F271 WeakPolarHBondContact OD1-CE1 3.23Å; N245-L275 HydrophobicContact CB-CD1 4.3Å
246	Y	92.2	Very high	85.8	Confident	10 Å²	10	35.3 Å²	35.3	4%	0.039	20%	0.202	C	C	.	.	H	α-helix	trans	-64.3	-46.2	172.9	-174.4	-98.9	0	0	0	111.6	T149 L224 E225 P227 Y242 K243 V244 R248 W249 L250	T149-Y246 WeakPolarHBondContact OG1-CE1 3.36Å; T149-Y246 PolarHBondContact OG1-OH 2.83Å; L224-Y246 HydrophobicContact CB-CD2 3.81Å; L224-Y246 HydrophobicContact CB-CE2 3.76Å; L224-Y246 HydrophobicContact CD2-CD2 4.18Å; E225-Y246 WeakPolarHBondContact O-CE2 3.48Å; P227-Y246 HydrophobicContact CG-CD1 3.76Å; P227-Y246 HydrophobicContact CG-CE1 4.36Å; P227-Y246 HydrophobicContact CG-CG 3.97Å; Y242-Y246 WeakPolarHBondContact O-CB 3.48Å; Y242-Y246 PolarHBondContact O-N 3.42Å; K243-Y246 PolarHBondContact O-N 3Å; V244-Y246 PolarHBondContact O-N 2.99Å; Y246-R248 PolarHBondContact O-N 3.38Å; Y246-W249 HydrophobicContact CD2-CE3 4.17Å; Y246-W249 HydrophobicContact CD2-CZ3 4.36Å; Y246-W249 HydrophobicContact CE2-CE3 4.01Å; Y246-W249 AromaticContact CE2-CZ3 3.74Å; Y246-W249 HydrophobicContact CE2-CZ3 3.74Å; Y246-W249 PolarHBondContact O-N 3.29Å; Y246-L250 HydrophobicContact CD1-CD1 3.98Å; Y246-L250 HydrophobicContact CD1-CG 4.39Å; Y246-L250 HydrophobicContact CE1-CD1 3.49Å; Y246-L250 VanDerWaalsContact CE1-CD1 3.49Å; Y246-L250 HydrophobicContact CE1-CG 4.03Å; Y246-L250 PolarHBondContact O-N 2.99Å
247	T	91.2	Very high	87.2	Confident	49 Å²	49	32 Å²	32	30%	0.301	17%	0.174	S	C	.	.	H	α-helix	trans	-59.8	-44.4	173.5	-60.9	0	0	0	0	111.6	V152 K243 V244 L250 C251	V152-T247 HydrophobicContact CG2-CG2 3.8Å; K243-T247 WeakPolarHBondContact O-CB 3.26Å; K243-T247 PolarHBondContact O-N 3.19Å; K243-T247 PolarHBondContact O-OG1 3.31Å; V244-T247 PolarHBondContact O-N 3.4Å; T247-L250 PolarHBondContact O-N 3.42Å; T247-C251 WeakPolarHBondContact O-CB 3.42Å; T247-C251 PolarHBondContact O-N 3.39Å; T247-C251 PolarHBondContact O-SG 2.93Å; T247-C251 VanDerWaalsContact O-SG 3.37Å
248	R	91.3	Very high	88.2	Confident	56 Å²	56	29.7 Å²	29.7	21%	0.211	16%	0.161	C	C	.	.	H	α-helix	trans	-58.7	-47.8	174.6	-73.1	169.5	179	-168.5	-7	111.5	E176 F180 V244 N245 Y246 L250 C251 Y252 F271	E176-R248 IonicContact OE2-CZ 2.72Å; E176-R248 IonicContact OE2-NH1 3.98Å; E176-R248 IonicContact OE2-NH2 3.72Å; E176-R248 PolarHBondContact OE2-NH2 3.37Å; F180-R248 HydrophobicContact CD2-CB 4.33Å; F180-R248 HydrophobicContact CD2-CG 4.48Å; F180-R248 HydrophobicContact CE1-CG 4.16Å; F180-R248 HydrophobicContact CE2-CB 3.77Å; F180-R248 HydrophobicContact CE2-CG 4.02Å; F180-R248 HydrophobicContact CZ-CB 4.03Å; F180-R248 HydrophobicContact CZ-CG 3.86Å; V244-R248 WeakPolarHBondContact O-CG 3.43Å; V244-R248 PolarHBondContact O-N 3.1Å; N245-R248 PolarHBondContact O-N 2.86Å; Y246-R248 PolarHBondContact O-N 3.38Å; R248-L250 PolarHBondContact O-N 3.07Å; R248-C251 PolarHBondContact O-N 3.04Å; R248-Y252 WeakPolarHBondContact O-CD2 3.31Å; R248-Y252 PolarHBondContact O-N 2.92Å; R248-F271 HydrophobicContact CB-CE1 3.99Å; R248-F271 HydrophobicContact CB-CZ 3.7Å
249	W	93.6	Very high	88.9	Confident	3 Å²	3	25.2 Å²	25.2	1%	0.011	14%	0.137	C	C	.	.	H	α-helix	trans	-63.4	-40.5	179	168.1	81.7	0	0	0	112	W222 L224 N245 Y246 C253 N254 F271	W222-W249 WeakPolarHBondContact O-CZ2 3.27Å; L224-W249 HydrophobicContact CB-CD2 4.25Å; L224-W249 HydrophobicContact CB-CE3 3.96Å; L224-W249 HydrophobicContact CB-CH2 4.07Å; L224-W249 HydrophobicContact CB-CZ2 4.35Å; L224-W249 HydrophobicContact CB-CZ3 3.87Å; L224-W249 HydrophobicContact CD1-CD2 3.92Å; L224-W249 HydrophobicContact CD1-CE3 4.5Å; L224-W249 HydrophobicContact CD1-CG 4.17Å; L224-W249 HydrophobicContact CD1-CZ2 4.01Å; L224-W249 HydrophobicContact CD2-CB 4.07Å; L224-W249 HydrophobicContact CD2-CD2 3.88Å; L224-W249 HydrophobicContact CD2-CE3 4.08Å; L224-W249 HydrophobicContact CD2-CG 3.87Å; L224-W249 HydrophobicContact CG-CD2 4.23Å; L224-W249 HydrophobicContact CG-CE3 4.4Å; N245-W249 WeakPolarHBondContact O-CB 3.46Å; N245-W249 PolarHBondContact O-N 2.83Å; Y246-W249 HydrophobicContact CD2-CE3 4.17Å; Y246-W249 HydrophobicContact CD2-CZ3 4.36Å; Y246-W249 HydrophobicContact CE2-CE3 4.01Å; Y246-W249 AromaticContact CE2-CZ3 3.74Å; Y246-W249 HydrophobicContact CE2-CZ3 3.74Å; Y246-W249 PolarHBondContact O-N 3.29Å; W249-C253 HydrophobicContact CG-CB 4.3Å; W249-C253 CarbonylContact O-C 3.47Å; W249-C253 WeakPolarHBondContact O-CA 3.27Å; W249-C253 VanDerWaalsContact O-CB 3.31Å; W249-C253 WeakPolarHBondContact O-CB 3.25Å; W249-C253 PolarHBondContact O-N 3.12Å; W249-N254 HydrophobicContact CD2-CB 4.12Å; W249-N254 HydrophobicContact CE3-CB 4.23Å; W249-N254 HydrophobicContact CH2-CB 3.93Å; W249-N254 WeakPolarHBondContact CH2-ND2 3.47Å; W249-N254 HydrophobicContact CZ2-CB 3.78Å; W249-N254 WeakPolarHBondContact CZ2-ND2 3.42Å; W249-N254 HydrophobicContact CZ3-CB 4.13Å; W249-N254 PolarHBondContact O-N 3.17Å; W249-F271 HydrophobicContact CB-CE2 4Å; W249-F271 HydrophobicContact CB-CZ 4Å
250	L	92.2	Very high	89.5	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.01	16%	0.155	C	C	.	.	I	π-helix	trans	-59.1	-51.3	173.6	-77.7	-179.9	0	0	0	111.8	T149 V152 Y153 Y246 T247 R248 N254 V255	T149-L250 HydrophobicContact CG2-CD1 4.02Å; V152-L250 HydrophobicContact CB-CD1 3.9Å; V152-L250 HydrophobicContact CG1-CB 3.82Å; V152-L250 HydrophobicContact CG1-CD1 3.97Å; V152-L250 HydrophobicContact CG2-CD1 4.1Å; Y153-L250 HydrophobicContact CE1-CD2 4.31Å; Y246-L250 HydrophobicContact CD1-CD1 3.98Å; Y246-L250 HydrophobicContact CD1-CG 4.39Å; Y246-L250 HydrophobicContact CE1-CD1 3.49Å; Y246-L250 VanDerWaalsContact CE1-CD1 3.49Å; Y246-L250 HydrophobicContact CE1-CG 4.03Å; Y246-L250 PolarHBondContact O-N 2.99Å; T247-L250 PolarHBondContact O-N 3.42Å; R248-L250 PolarHBondContact O-N 3.07Å; L250-N254 HydrophobicContact CD2-CB 4.09Å; L250-V255 WeakPolarHBondContact O-CB 3.46Å; L250-V255 WeakPolarHBondContact O-CG2 3.48Å; L250-V255 PolarHBondContact O-N 3.2Å
251	C	91	Very high	89.7	Confident	14 Å²	14	24.8 Å²	24.8	10%	0.095	13%	0.132	C	C	.	.	I	π-helix	trans	-67.5	-39.8	-175.3	-71	0	0	0	0	114.4	L172 T247 R248 P256	L172-C251 HydrophobicContact CD1-CB 3.86Å; L172-C251 HydrophobicContact CD2-CB 4.38Å; T247-C251 WeakPolarHBondContact O-CB 3.42Å; T247-C251 PolarHBondContact O-N 3.39Å; T247-C251 PolarHBondContact O-SG 2.93Å; T247-C251 VanDerWaalsContact O-SG 3.37Å; R248-C251 PolarHBondContact O-N 3.04Å; C251-P256 WeakPolarHBondContact O-CD 3.48Å; C251-P256 VanDerWaalsContact O-CG 3.3Å; C251-P256 WeakPolarHBondContact O-CG 3.38Å
252	Y	90.2	Very high	89.9	Confident	21 Å²	21	24.2 Å²	24.2	8%	0.082	13%	0.125	C	C	.	.	I	π-helix	trans	-107.6	-20.8	-170.9	-65.6	-79.8	0	0	0	114.6	L172 A174 P178 F180 R248 Y265	L172-Y252 HydrophobicContact CB-CE1 4.46Å; L172-Y252 HydrophobicContact CD1-CD1 3.99Å; L172-Y252 HydrophobicContact CD1-CD2 4.46Å; L172-Y252 HydrophobicContact CD1-CE1 3.52Å; L172-Y252 HydrophobicContact CD1-CE2 4.03Å; L172-Y252 HydrophobicContact CD1-CG 4.45Å; A174-Y252 WeakPolarHBondContact CB-OH 3.36Å; P178-Y252 HydrophobicContact CG-CD1 4.01Å; P178-Y252 HydrophobicContact CG-CE1 4.08Å; P178-Y252 HydrophobicContact CG-CG 4.49Å; F180-Y252 HydrophobicContact CE2-CD2 4.18Å; F180-Y252 AromaticContact CZ-CD2 3.68Å; F180-Y252 HydrophobicContact CZ-CD2 3.68Å; F180-Y252 AromaticContact CZ-CE2 3.73Å; F180-Y252 HydrophobicContact CZ-CE2 3.73Å; F180-Y252 HydrophobicContact CZ-CG 4.42Å; R248-Y252 WeakPolarHBondContact O-CD2 3.31Å; R248-Y252 PolarHBondContact O-N 2.92Å; Y252-Y265 AromaticContact CD1-CD2 3.82Å; Y252-Y265 HydrophobicContact CD1-CD2 3.82Å; Y252-Y265 AromaticContact CD1-CE2 3.83Å; Y252-Y265 HydrophobicContact CD1-CE2 3.83Å; Y252-Y265 HydrophobicContact CE1-CE2 4.44Å; Y252-Y265 HydrophobicContact CG-CD2 4.41Å; Y252-Y265 PolarHBondContact O-N 3.12Å
253	C	90.9	Very high	89.8	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.14	C	C	.	.	I	π-helix	trans	-119.7	-43.3	-174.7	-62	0	0	0	0	114.4	W249 Q257 Y265 I270	W249-C253 HydrophobicContact CG-CB 4.3Å; W249-C253 CarbonylContact O-C 3.47Å; W249-C253 WeakPolarHBondContact O-CA 3.27Å; W249-C253 VanDerWaalsContact O-CB 3.31Å; W249-C253 WeakPolarHBondContact O-CB 3.25Å; W249-C253 PolarHBondContact O-N 3.12Å; C253-Q257 WeakPolarHBondContact O-CG 3.15Å; C253-Q257 PolarHBondContact O-NE2 2.88Å; C253-Y265 PolarHBondContact SG-O 2.78Å; C253-I270 WeakPolarHBondContact SG-CD1 3.07Å
254	N	92.1	Very high	89.8	Confident	5 Å²	5	28.1 Å²	28.1	3%	0.027	14%	0.144	C	C	.	.	I	π-helix	trans	-89.4	-56.2	-171.7	-173.4	-83.2	0	0	0	113.6	Q223 W249 L250 Q257	Q223-N254 PolarHBondContact NE2-ND2 2.76Å; Q223-N254 PolarHBondContact OE1-ND2 2.83Å; W249-N254 HydrophobicContact CD2-CB 4.12Å; W249-N254 HydrophobicContact CE3-CB 4.23Å; W249-N254 HydrophobicContact CH2-CB 3.93Å; W249-N254 WeakPolarHBondContact CH2-ND2 3.47Å; W249-N254 HydrophobicContact CZ2-CB 3.78Å; W249-N254 WeakPolarHBondContact CZ2-ND2 3.42Å; W249-N254 HydrophobicContact CZ3-CB 4.13Å; W249-N254 PolarHBondContact O-N 3.17Å; L250-N254 HydrophobicContact CD2-CB 4.09Å; N254-Q257 WeakPolarHBondContact O-CB 3.45Å; N254-Q257 VanDerWaalsContact O-CG 3.29Å; N254-Q257 WeakPolarHBondContact O-CG 3.15Å; N254-Q257 PolarHBondContact O-N 2.91Å
255	V	90.3	Very high	89.9	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-63.9	-37.6	-179.7	-177.8	0	0	0	0	111.5	L137 Y153 L156 L250 Q257 F258 C259 L262	L137-V255 HydrophobicContact CD1-CG1 4.29Å; L137-V255 HydrophobicContact CD2-CG1 3.8Å; L137-V255 HydrophobicContact CG-CG1 4.46Å; Y153-V255 HydrophobicContact CD1-CG2 3.94Å; Y153-V255 HydrophobicContact CE1-CG2 3.69Å; L156-V255 HydrophobicContact CD1-CB 3.9Å; L156-V255 HydrophobicContact CD1-CG1 3.89Å; L156-V255 HydrophobicContact CD1-CG2 3.75Å; L250-V255 WeakPolarHBondContact O-CB 3.46Å; L250-V255 WeakPolarHBondContact O-CG2 3.48Å; L250-V255 PolarHBondContact O-N 3.2Å; V255-Q257 PolarHBondContact O-N 3.06Å; V255-F258 HydrophobicContact CB-CE2 4.42Å; V255-F258 HydrophobicContact CB-CZ 4.12Å; V255-F258 HydrophobicContact CG1-CE2 3.8Å; V255-F258 HydrophobicContact CG1-CZ 3.99Å; V255-F258 HydrophobicContact CG2-CZ 3.96Å; V255-F258 PolarHBondContact O-N 2.9Å; V255-F258 VanDerWaalsContact O-N 3.1Å; V255-C259 HydrophobicContact CG1-CB 4.11Å; V255-C259 PolarHBondContact O-N 3.48Å; V255-L262 HydrophobicContact CB-CD1 4.45Å; V255-L262 HydrophobicContact CG1-CD1 3.85Å
256	P	90.9	Very high	90	Very high	6 Å²	6	31.5 Å²	31.5	4%	0.039	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-64.1	-0.3	170.2	-23.7	35.8	0	0	0	116.3	C251 L262 P263 R264	C251-P256 WeakPolarHBondContact O-CD 3.48Å; C251-P256 VanDerWaalsContact O-CG 3.3Å; C251-P256 WeakPolarHBondContact O-CG 3.38Å; P256-L262 HydrophobicContact CB-CB 4.31Å; P256-L262 HydrophobicContact CG-CB 3.89Å; P256-P263 WeakPolarHBondContact CG-O 3.43Å; P256-R264 HydrophobicContact CB-CB 3.62Å; P256-R264 HydrophobicContact CB-CG 4.13Å
257	Q	87.1	Confident	90	Very high	47 Å²	47	31.1 Å²	31.1	22%	0.22	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-83.1	-15.9	169.6	-47	-157.5	2.7	0	0	113.3	S38 N220 Y221 C253 N254 V255	S38-Q257 PolarHBondContact OG-O 2.88Å; N220-Q257 PolarHBondContact O-NE2 3.16Å; Y221-Q257 VanDerWaalsContact CD1-OE1 3.3Å; C253-Q257 WeakPolarHBondContact O-CG 3.15Å; C253-Q257 PolarHBondContact O-NE2 2.88Å; N254-Q257 WeakPolarHBondContact O-CB 3.45Å; N254-Q257 VanDerWaalsContact O-CG 3.29Å; N254-Q257 WeakPolarHBondContact O-CG 3.15Å; N254-Q257 PolarHBondContact O-N 2.91Å; V255-Q257 PolarHBondContact O-N 3.06Å
258	F	85.9	Confident	90.1	Very high	15 Å²	15	28.9 Å²	28.9	7%	0.066	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.4	-23.2	178.2	53.4	-98.8	0	0	0	113.3	I41 Y136 L137 V255	I41-F258 HydrophobicContact CD1-CB 4.4Å; Y136-F258 AromaticContact CD1-CD2 3.61Å; Y136-F258 HydrophobicContact CD1-CD2 3.61Å; Y136-F258 AromaticContact CD1-CE2 3.88Å; Y136-F258 HydrophobicContact CD1-CE2 3.88Å; Y136-F258 AromaticContact CE1-CD2 3.42Å; Y136-F258 HydrophobicContact CE1-CD2 3.42Å; Y136-F258 VanDerWaalsContact CE1-CD2 3.42Å; Y136-F258 AromaticContact CE1-CE2 3.67Å; Y136-F258 HydrophobicContact CE1-CE2 3.67Å; Y136-F258 HydrophobicContact CE1-CG 4.08Å; Y136-F258 HydrophobicContact CE1-CZ 4.5Å; L137-F258 HydrophobicContact CD2-CE2 4.36Å; V255-F258 HydrophobicContact CB-CE2 4.42Å; V255-F258 HydrophobicContact CB-CZ 4.12Å; V255-F258 HydrophobicContact CG1-CE2 3.8Å; V255-F258 HydrophobicContact CG1-CZ 3.99Å; V255-F258 HydrophobicContact CG2-CZ 3.96Å; V255-F258 PolarHBondContact O-N 2.9Å; V255-F258 VanDerWaalsContact O-N 3.1Å
259	C	87.1	Confident	90.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.146	C	C	.	.			trans	-103.6	82.6	169.6	-66.1	0	0	0	0	111.8	D133 V255 S261 L262	D133-C259 HydrophobicContact CB-CB 3.95Å; D133-C259 VanDerWaalsContact CG-CA 3.49Å; D133-C259 VanDerWaalsContact CG-CB 3.49Å; D133-C259 VanDerWaalsContact CG-SG 3.55Å; D133-C259 WeakPolarHBondContact OD1-CA 3.33Å; D133-C259 PolarHBondContact OD1-SG 2.7Å; D133-C259 VanDerWaalsContact OD1-SG 3.37Å; D133-C259 WeakPolarHBondContact OD2-CA 3.41Å; V255-C259 HydrophobicContact CG1-CB 4.11Å; V255-C259 PolarHBondContact O-N 3.48Å; C259-S261 PolarHBondContact O-N 3.08Å; C259-L262 HydrophobicContact CB-CD1 4.33Å; C259-L262 PolarHBondContact O-N 3.36Å
260	D	86.6	Confident	90.2	Very high	93 Å²	93	30.6 Å²	30.6	50%	0.497	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-13	178.7	73	-3.4	0	0	0	114.7	K45 R49 L262	K45-D260 IonicContact NZ-OD1 3.16Å; K45-D260 PolarHBondContact NZ-OD1 3.47Å; K45-D260 IonicContact NZ-OD2 2.69Å; R49-D260 IonicContact NH2-OD2 2.67Å; R49-D260 PolarHBondContact NH2-OD2 3.27Å; D260-L262 VanDerWaalsContact C-N 3.29Å; D260-L262 PolarHBondContact O-N 3.47Å
261	S	87.7	Confident	90.3	Very high	24 Å²	24	30.5 Å²	30.5	17%	0.168	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-22.5	172.2	-58.3	0	0	0	0	114.4	I130 D133 P170 C259	I130-S261 WeakPolarHBondContact CA-OG 3.31Å; I130-S261 WeakPolarHBondContact CG1-OG 3.27Å; I130-S261 PolarHBondContact N-OG 3.17Å; D133-S261 WeakPolarHBondContact OD2-CB 3.35Å; D133-S261 PolarHBondContact OD2-N 2.77Å; D133-S261 PolarHBondContact OD2-OG 3.4Å; P170-S261 WeakPolarHBondContact CG-O 3.45Å; C259-S261 PolarHBondContact O-N 3.08Å
262	L	88.4	Confident	90.4	Very high	8 Å²	8	29.8 Å²	29.8	4%	0.042	14%	0.142	C	C	.	.	S	Bend	trans	-95.3	147.2	-177.5	-70.3	170.6	0	0	0	111.6	L156 L160 P170 V255 P256 C259 D260 R264	L156-L262 HydrophobicContact CD1-CD1 4.43Å; L156-L262 HydrophobicContact CD2-CD1 4.16Å; L160-L262 HydrophobicContact CD2-CD2 3.71Å; L160-L262 HydrophobicContact CD2-CG 4.12Å; P170-L262 HydrophobicContact CB-CD2 4.11Å; P170-L262 HydrophobicContact CG-CD2 4.26Å; V255-L262 HydrophobicContact CB-CD1 4.45Å; V255-L262 HydrophobicContact CG1-CD1 3.85Å; P256-L262 HydrophobicContact CB-CB 4.31Å; P256-L262 HydrophobicContact CG-CB 3.89Å; C259-L262 HydrophobicContact CB-CD1 4.33Å; C259-L262 PolarHBondContact O-N 3.36Å; D260-L262 VanDerWaalsContact C-N 3.29Å; D260-L262 PolarHBondContact O-N 3.47Å; L262-R264 PolarHBondContact O-N 3.49Å; L262-R264 VanDerWaalsContact O-N 3.08Å
263	P	87.4	Confident	90.5	Very high	53 Å²	53	30.7 Å²	30.7	34%	0.344	15%	0.145	S	C	.	.			trans	-57.8	112.6	173.3	-25.8	36.1	0	0	0	112.5	P256 Y265	P256-P263 WeakPolarHBondContact CG-O 3.43Å; P263-Y265 HydrophobicContact CB-CD2 4.49Å; P263-Y265 HydrophobicContact CB-CE2 3.78Å
264	R	89.9	Confident	90.5	Very high	99 Å²	99	34.5 Å²	34.5	37%	0.374	17%	0.169	S	C	.	.			trans	-87.6	132.5	176.4	178.6	-177.3	162.3	117.6	2.5	111.2	Y221 P256 L262	Y221-R264 PolarHBondContact OH-NH2 2.75Å; P256-R264 HydrophobicContact CB-CB 3.62Å; P256-R264 HydrophobicContact CB-CG 4.13Å; L262-R264 PolarHBondContact O-N 3.49Å; L262-R264 VanDerWaalsContact O-N 3.08Å
265	Y	91.3	Very high	90.4	Very high	97 Å²	97	34.4 Å²	34.4	38%	0.38	17%	0.168	S	C	.	.			trans	-129.7	154.4	171.1	-65	-93	0	0	0	111	P178 Y252 C253 P263 I270	P178-Y265 HydrophobicContact CG-CD1 4.25Å; P178-Y265 HydrophobicContact CG-CD2 4.15Å; P178-Y265 HydrophobicContact CG-CE1 3.97Å; P178-Y265 HydrophobicContact CG-CE2 3.86Å; P178-Y265 HydrophobicContact CG-CG 4.33Å; Y252-Y265 AromaticContact CD1-CD2 3.82Å; Y252-Y265 HydrophobicContact CD1-CD2 3.82Å; Y252-Y265 AromaticContact CD1-CE2 3.83Å; Y252-Y265 HydrophobicContact CD1-CE2 3.83Å; Y252-Y265 HydrophobicContact CE1-CE2 4.44Å; Y252-Y265 HydrophobicContact CG-CD2 4.41Å; Y252-Y265 PolarHBondContact O-N 3.12Å; C253-Y265 PolarHBondContact SG-O 2.78Å; P263-Y265 HydrophobicContact CB-CD2 4.49Å; P263-Y265 HydrophobicContact CB-CE2 3.78Å; Y265-I270 HydrophobicContact CD1-CG2 3.87Å; Y265-I270 HydrophobicContact CG-CG2 4.03Å
266	E	92.3	Very high	90.5	Very high	59 Å²	59	34.5 Å²	34.5	28%	0.276	17%	0.169	S	C	.	.			trans	-84.3	134.9	175.7	-59.9	-141.7	131.6	0	0	112	N220 T268 Q269 I270	N220-E266 VanDerWaalsContact ND2-CD 3.27Å; N220-E266 PolarHBondContact ND2-OE2 3.3Å; E266-T268 PolarHBondContact O-N 2.96Å; E266-Q269 HydrophobicContact CB-CB 4.28Å; E266-Q269 HydrophobicContact CB-CG 4.09Å; E266-Q269 PolarHBondContact O-N 3.01Å; E266-I270 PolarHBondContact O-N 2.91Å
267	T	93.6	Very high	90.5	Very high	3 Å²	3	38 Å²	38	2%	0.018	18%	0.181	C	C	.	.	H	α-helix	trans	-54.1	-40.2	178.3	-48.6	0	0	0	0	111.4	I219 N220 Q269 F271 L275	I219-T267 HydrophobicContact CG2-CG2 3.8Å; N220-T267 WeakPolarHBondContact OD1-CB 3.3Å; N220-T267 PolarHBondContact OD1-N 3.46Å; T267-Q269 PolarHBondContact O-N 3.35Å; T267-F271 HydrophobicContact CG2-CD2 3.99Å; T267-F271 HydrophobicContact CG2-CE2 4.49Å; T267-F271 PolarHBondContact O-N 2.96Å; T267-L275 HydrophobicContact CG2-CD2 4.18Å
268	T	93.3	Very high	90.5	Very high	2 Å²	2	37 Å²	37	1%	0.012	18%	0.18	C	C	.	.	H	α-helix	trans	-70.3	-16.4	-179	53.2	0	0	0	0	114.5	S184 I185 E186 L216 I219 N220 E266	S184-T268 WeakPolarHBondContact CB-O 3.48Å; I185-T268 HydrophobicContact CG2-CG2 4.17Å; I185-T268 PolarHBondContact N-O 2.72Å; E186-T268 WeakPolarHBondContact CB-O 3.48Å; E186-T268 PolarHBondContact N-O 2.97Å; L216-T268 HydrophobicContact CB-CG2 4.09Å; L216-T268 HydrophobicContact CD2-CG2 3.57Å; L216-T268 HydrophobicContact CG-CG2 4.46Å; L216-T268 WeakPolarHBondContact O-CG2 3.36Å; I219-T268 HydrophobicContact CB-CG2 3.78Å; I219-T268 HydrophobicContact CD1-CG2 4.31Å; I219-T268 HydrophobicContact CG2-CG2 3.64Å; N220-T268 PolarHBondContact ND2-OG1 3.38Å; N220-T268 WeakPolarHBondContact OD1-CG2 3.18Å; N220-T268 PolarHBondContact OD1-N 2.98Å; N220-T268 PolarHBondContact OD1-OG1 3.22Å; E266-T268 PolarHBondContact O-N 2.96Å
269	Q	92.7	Very high	90.7	Very high	88 Å²	88	36.8 Å²	36.8	41%	0.411	18%	0.179	S	C	.	.	H	α-helix	trans	-99.8	-36.5	-175.2	-70.4	175.8	-8	0	0	112.8	S184 E186 E266 T267	S184-Q269 VanDerWaalsContact CB-O 3.31Å; S184-Q269 WeakPolarHBondContact CB-O 3.47Å; E186-Q269 WeakPolarHBondContact OE2-CG 3.2Å; E186-Q269 PolarHBondContact OE2-NE2 2.76Å; E186-Q269 VanDerWaalsContact OE2-NE2 3.14Å; E266-Q269 HydrophobicContact CB-CB 4.28Å; E266-Q269 HydrophobicContact CB-CG 4.09Å; E266-Q269 PolarHBondContact O-N 3.01Å; T267-Q269 PolarHBondContact O-N 3.35Å
270	I	92.8	Very high	90.9	Very high	6 Å²	6	36.8 Å²	36.8	3%	0.031	18%	0.179	C	C	.	.	H	α-helix	trans	-96.7	-13.9	-174.8	74.5	178.6	0	0	0	114.4	P178 F180 C253 Y265 E266	P178-I270 HydrophobicContact CB-CB 3.8Å; P178-I270 HydrophobicContact CB-CD1 4.2Å; P178-I270 HydrophobicContact CB-CG2 3.68Å; F180-I270 HydrophobicContact CD2-CB 4.36Å; F180-I270 HydrophobicContact CD2-CD1 4.23Å; F180-I270 HydrophobicContact CD2-CG1 4.16Å; F180-I270 HydrophobicContact CE2-CD1 3.7Å; F180-I270 HydrophobicContact CE2-CG1 4.15Å; F180-I270 PolarHBondContact N-O 3.27Å; C253-I270 WeakPolarHBondContact SG-CD1 3.07Å; Y265-I270 HydrophobicContact CD1-CG2 3.87Å; Y265-I270 HydrophobicContact CG-CG2 4.03Å; E266-I270 PolarHBondContact O-N 2.91Å
271	F	94.6	Very high	91	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.177	C	C	.	.			trans	-114.8	158.3	173.3	-62.5	-79.1	0	0	0	110.8	F180 S184 I185 N245 R248 W249 T267 L275	F180-F271 HydrophobicContact CD2-CD1 4.04Å; F180-F271 AromaticContact CD2-CE1 3.66Å; F180-F271 HydrophobicContact CD2-CE1 3.66Å; F180-F271 AromaticContact CD2-CZ 3.96Å; F180-F271 HydrophobicContact CD2-CZ 3.96Å; F180-F271 HydrophobicContact CE2-CE1 4.22Å; F180-F271 HydrophobicContact CE2-CZ 4.09Å; S184-F271 CarbonylContact C-O 3.48Å; S184-F271 WeakPolarHBondContact CA-O 3.44Å; I185-F271 HydrophobicContact CD1-CB 4.11Å; I185-F271 WeakPolarHBondContact CG1-O 3.26Å; I185-F271 PolarHBondContact N-O 2.94Å; N245-F271 HydrophobicContact CB-CE1 4.18Å; N245-F271 WeakPolarHBondContact OD1-CE1 3.23Å; R248-F271 HydrophobicContact CB-CE1 3.99Å; R248-F271 HydrophobicContact CB-CZ 3.7Å; W249-F271 HydrophobicContact CB-CE2 4Å; W249-F271 HydrophobicContact CB-CZ 4Å; T267-F271 HydrophobicContact CG2-CD2 3.99Å; T267-F271 HydrophobicContact CG2-CE2 4.49Å; T267-F271 PolarHBondContact O-N 2.96Å; F271-L275 HydrophobicContact CB-CB 3.94Å; F271-L275 HydrophobicContact CB-CD2 3.73Å; F271-L275 HydrophobicContact CB-CG 4.45Å; F271-L275 HydrophobicContact CD1-CB 4.08Å; F271-L275 HydrophobicContact CD1-CD2 3.72Å; F271-L275 HydrophobicContact CD1-CG 4.49Å; F271-L275 HydrophobicContact CD2-CD2 3.52Å; F271-L275 HydrophobicContact CE1-CD2 4.15Å; F271-L275 HydrophobicContact CE2-CD2 3.98Å; F271-L275 HydrophobicContact CG-CB 4.16Å; F271-L275 HydrophobicContact CG-CD2 3.38Å; F271-L275 HydrophobicContact CG-CG 4.4Å; F271-L275 HydrophobicContact CZ-CD2 4.26Å
272	G	92.5	Very high	91.1	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-127.2	-141.4	-179.6	0	0	0	0	0	112.3	E181 P183 I185 T274 L276	E181-G272 VanDerWaalsContact CD-C 3.49Å; E181-G272 WeakPolarHBondContact OE2-CA 3.1Å; E181-G272 PolarHBondContact OE2-N 3.44Å; P183-G272 WeakPolarHBondContact O-CA 3.32Å; I185-G272 VanDerWaalsContact CG1-O 3.23Å; I185-G272 WeakPolarHBondContact CG1-O 3.28Å; G272-T274 VanDerWaalsContact C-N 3.31Å; G272-T274 PolarHBondContact O-N 3.01Å; G272-L276 PolarHBondContact O-N 3.38Å
273	R	92.8	Very high	91.1	Very high	39 Å²	39	35.2 Å²	35.2	15%	0.147	17%	0.173	C	C	.	.	H	α-helix	trans	-57.7	-38.5	-173.6	-166.3	-176.3	-177.6	165.7	6.9	113.8	E181 L276 R277 V321 S323 W329	E181-R273 VanDerWaalsContact CD-N 3.28Å; E181-R273 PolarHBondContact OE1-N 3.17Å; E181-R273 PolarHBondContact OE2-N 3.06Å; R273-L276 PolarHBondContact O-N 2.94Å; R273-R277 HydrophobicContact CG-CG 4.26Å; R273-R277 WeakPolarHBondContact O-CG 3.28Å; R273-R277 PolarHBondContact O-N 2.98Å; R273-V321 PolarHBondContact NE-O 2.78Å; R273-V321 VanDerWaalsContact NE-O 3.12Å; R273-V321 PolarHBondContact NH2-O 3.38Å; R273-S323 PolarHBondContact NH2-O 3.37Å; R273-W329 HydrophobicContact CB-CD2 3.78Å; R273-W329 HydrophobicContact CB-CE3 3.64Å; R273-W329 HydrophobicContact CB-CG 4.3Å; R273-W329 HydrophobicContact CB-CZ3 4.04Å; R273-W329 HydrophobicContact CG-CD2 3.7Å; R273-W329 HydrophobicContact CG-CE3 4.09Å; R273-W329 HydrophobicContact CG-CG 4Å; R273-W329 HydrophobicContact CG-CZ2 4.32Å
274	T	90.7	Very high	91.2	Very high	80 Å²	80	35.8 Å²	35.8	49%	0.491	17%	0.168	S	C	.	.	H	α-helix	trans	-71.5	-43.4	-168.8	-59.1	0	0	0	0	111.6	E181 G272 L276 S278	E181-T274 VanDerWaalsContact CD-N 3.31Å; E181-T274 VanDerWaalsContact OE1-CB 3.24Å; E181-T274 WeakPolarHBondContact OE1-CB 3.41Å; E181-T274 PolarHBondContact OE1-N 2.65Å; E181-T274 PolarHBondContact OE1-OG1 2.86Å; E181-T274 WeakPolarHBondContact OE2-CB 3.38Å; E181-T274 PolarHBondContact OE2-N 3.41Å; G272-T274 VanDerWaalsContact C-N 3.31Å; G272-T274 PolarHBondContact O-N 3.01Å; T274-L276 VanDerWaalsContact C-N 3.34Å; T274-S278 WeakPolarHBondContact O-CB 3.37Å; T274-S278 PolarHBondContact O-N 3.32Å; T274-S278 PolarHBondContact O-OG 2.61Å
275	L	90.9	Very high	91.2	Very high	4 Å²	4	39 Å²	39	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-65.9	-39.9	169.9	-179.7	59.6	0	0	0	111	L224 Y242 N245 T267 F271 S278 V279	L224-L275 HydrophobicContact CD2-CD1 4.05Å; Y242-L275 HydrophobicContact CE2-CD1 4.13Å; N245-L275 HydrophobicContact CB-CD1 4.3Å; T267-L275 HydrophobicContact CG2-CD2 4.18Å; F271-L275 HydrophobicContact CB-CB 3.94Å; F271-L275 HydrophobicContact CB-CD2 3.73Å; F271-L275 HydrophobicContact CB-CG 4.45Å; F271-L275 HydrophobicContact CD1-CB 4.08Å; F271-L275 HydrophobicContact CD1-CD2 3.72Å; F271-L275 HydrophobicContact CD1-CG 4.49Å; F271-L275 HydrophobicContact CD2-CD2 3.52Å; F271-L275 HydrophobicContact CE1-CD2 4.15Å; F271-L275 HydrophobicContact CE2-CD2 3.98Å; F271-L275 HydrophobicContact CG-CB 4.16Å; F271-L275 HydrophobicContact CG-CD2 3.38Å; F271-L275 HydrophobicContact CG-CG 4.4Å; F271-L275 HydrophobicContact CZ-CD2 4.26Å; L275-S278 WeakPolarHBondContact O-CA 3.48Å; L275-S278 WeakPolarHBondContact O-CB 3.44Å; L275-S278 PolarHBondContact O-N 3.09Å; L275-S278 VanDerWaalsContact O-N 3.13Å; L275-V279 HydrophobicContact CD1-CG1 3.99Å; L275-V279 WeakPolarHBondContact O-CG2 3.33Å; L275-V279 PolarHBondContact O-N 3.45Å
276	L	91.9	Very high	91	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-63.5	-50.1	-177.4	-166.9	60.5	0	0	0	111.8	I185 I219 G272 R273 T274 S278 V279 F280 M283 V321 W329	I185-L276 HydrophobicContact CD1-CB 4.16Å; I185-L276 HydrophobicContact CD1-CD1 4.39Å; I185-L276 HydrophobicContact CG1-CB 4.11Å; I185-L276 HydrophobicContact CG1-CD2 4.34Å; I185-L276 HydrophobicContact CG2-CD1 4.42Å; I185-L276 HydrophobicContact CG2-CD2 4.17Å; I219-L276 HydrophobicContact CD1-CD1 4.37Å; G272-L276 PolarHBondContact O-N 3.38Å; R273-L276 PolarHBondContact O-N 2.94Å; T274-L276 VanDerWaalsContact C-N 3.34Å; L276-S278 PolarHBondContact O-N 3.43Å; L276-S278 VanDerWaalsContact O-N 3.16Å; L276-V279 PolarHBondContact O-N 2.85Å; L276-F280 HydrophobicContact CD1-CD2 3.9Å; L276-F280 HydrophobicContact CD2-CD2 4.49Å; L276-F280 HydrophobicContact CG-CD2 4.02Å; L276-F280 VanDerWaalsContact O-CB 3.27Å; L276-F280 WeakPolarHBondContact O-CB 3.41Å; L276-F280 PolarHBondContact O-N 2.83Å; L276-M283 HydrophobicContact CD1-CE 3.91Å; L276-V321 HydrophobicContact CD2-CG2 3.62Å; L276-V321 HydrophobicContact CG-CG1 4.39Å; L276-V321 HydrophobicContact CG-CG2 4.08Å; L276-W329 HydrophobicContact CD2-CH2 3.66Å; L276-W329 HydrophobicContact CD2-CZ2 3.98Å
277	R	90.7	Very high	90.8	Very high	80 Å²	80	36 Å²	36	30%	0.302	17%	0.174	S	C	.	.	H	α-helix	trans	-53	-35.4	172.5	-75.5	179.4	119.2	-162	-1	112.4	R273 V279 V321 Y322 H324	R273-R277 HydrophobicContact CG-CG 4.26Å; R273-R277 WeakPolarHBondContact O-CG 3.28Å; R273-R277 PolarHBondContact O-N 2.98Å; R277-V279 VanDerWaalsContact C-N 3.33Å; R277-V279 PolarHBondContact O-N 3.17Å; R277-V321 HydrophobicContact CB-CG1 4.35Å; R277-V321 HydrophobicContact CG-CG1 3.68Å; R277-V321 WeakPolarHBondContact CG-O 3.18Å; R277-V321 PolarHBondContact NE-O 2.97Å; R277-Y322 HydrophobicContact CB-CD1 4.47Å; R277-Y322 HydrophobicContact CB-CE1 3.99Å; R277-Y322 HydrophobicContact CG-CD1 4.18Å; R277-Y322 HydrophobicContact CG-CE1 4.17Å; R277-Y322 PolarHBondContact NH2-O 2.99Å; R277-Y322 WeakPolarHBondContact O-CE1 3.03Å; R277-Y322 PolarHBondContact O-OH 3.35Å; R277-H324 PolarHBondContact NH2-CD2 2.92Å; R277-H324 PolarHBondContact NH2-NE2 3.37Å
278	S	88.4	Confident	90.5	Very high	27 Å²	27	38.4 Å²	38.4	19%	0.189	19%	0.187	C	C	.	.	H	α-helix	trans	-68.2	-23.4	178.4	-96.4	0	0	0	0	114.9	R230 T274 L275 L276	R230-S278 PolarHBondContact NH1-O 3.03Å; R230-S278 PolarHBondContact NH1-OG 2.89Å; R230-S278 PolarHBondContact NH2-OG 3.43Å; T274-S278 WeakPolarHBondContact O-CB 3.37Å; T274-S278 PolarHBondContact O-N 3.32Å; T274-S278 PolarHBondContact O-OG 2.61Å; L275-S278 WeakPolarHBondContact O-CA 3.48Å; L275-S278 WeakPolarHBondContact O-CB 3.44Å; L275-S278 PolarHBondContact O-N 3.09Å; L275-S278 VanDerWaalsContact O-N 3.13Å; L276-S278 PolarHBondContact O-N 3.43Å; L276-S278 VanDerWaalsContact O-N 3.16Å
279	V	90	Very high	90.2	Very high	9 Å²	9	41.5 Å²	41.5	6%	0.055	20%	0.201	C	C	.	.	H	α-helix	trans	-127.4	-14.4	-171.6	-54	0	0	0	0	114.9	W222 L224 Y242 L275 L276 R277 T281 V282 M283	W222-V279 HydrophobicContact CH2-CB 3.75Å; W222-V279 HydrophobicContact CH2-CG1 4.15Å; W222-V279 HydrophobicContact CH2-CG2 4.46Å; W222-V279 HydrophobicContact CZ3-CB 3.57Å; W222-V279 HydrophobicContact CZ3-CG1 3.86Å; W222-V279 HydrophobicContact CZ3-CG2 3.85Å; L224-V279 HydrophobicContact CG-CG1 4.42Å; Y242-V279 HydrophobicContact CE2-CG1 3.98Å; L275-V279 HydrophobicContact CD1-CG1 3.99Å; L275-V279 WeakPolarHBondContact O-CG2 3.33Å; L275-V279 PolarHBondContact O-N 3.45Å; L276-V279 PolarHBondContact O-N 2.85Å; R277-V279 VanDerWaalsContact C-N 3.33Å; R277-V279 PolarHBondContact O-N 3.17Å; V279-T281 PolarHBondContact O-N 3.01Å; V279-V282 PolarHBondContact O-N 3.16Å; V279-M283 WeakPolarHBondContact O-CB 3.46Å; V279-M283 PolarHBondContact O-N 3.43Å
280	F	91.1	Very high	89.8	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.9	-47.7	-166.7	-167.6	-85.3	0	0	0	113.9	F215 L276 V282 M283 R284 L314 L317 E318 V321 Y322	F215-F280 HydrophobicContact CE2-CE2 4.18Å; F215-F280 HydrophobicContact CZ-CD2 4.16Å; F215-F280 AromaticContact CZ-CE2 3.6Å; F215-F280 HydrophobicContact CZ-CE2 3.6Å; L276-F280 HydrophobicContact CD1-CD2 3.9Å; L276-F280 HydrophobicContact CD2-CD2 4.49Å; L276-F280 HydrophobicContact CG-CD2 4.02Å; L276-F280 VanDerWaalsContact O-CB 3.27Å; L276-F280 WeakPolarHBondContact O-CB 3.41Å; L276-F280 PolarHBondContact O-N 2.83Å; F280-V282 VanDerWaalsContact C-N 3.32Å; F280-V282 PolarHBondContact O-N 3.34Å; F280-M283 HydrophobicContact CD2-CE 4.09Å; F280-M283 PolarHBondContact O-N 3.18Å; F280-R284 HydrophobicContact CD1-CB 4.34Å; F280-R284 HydrophobicContact CE1-CB 4.21Å; F280-R284 WeakPolarHBondContact O-CB 3.47Å; F280-R284 PolarHBondContact O-N 2.94Å; F280-L314 WeakPolarHBondContact CE1-O 3.26Å; F280-L314 HydrophobicContact CZ-CD2 4.39Å; F280-L314 VanDerWaalsContact CZ-O 3.32Å; F280-L314 WeakPolarHBondContact CZ-O 3.38Å; F280-L317 HydrophobicContact CE2-CB 4.37Å; F280-L317 HydrophobicContact CE2-CD2 3.79Å; F280-L317 HydrophobicContact CE2-CG 3.75Å; F280-L317 HydrophobicContact CZ-CB 4.03Å; F280-L317 HydrophobicContact CZ-CD2 4.17Å; F280-L317 HydrophobicContact CZ-CG 3.93Å; F280-E318 HydrophobicContact CD1-CB 4.11Å; F280-E318 HydrophobicContact CD1-CG 3.74Å; F280-E318 HydrophobicContact CE1-CB 3.53Å; F280-E318 HydrophobicContact CE1-CG 3.66Å; F280-E318 HydrophobicContact CZ-CB 4.3Å; F280-V321 HydrophobicContact CB-CG1 4.32Å; F280-V321 HydrophobicContact CD2-CG2 4.06Å; F280-V321 HydrophobicContact CE2-CG2 4.19Å; F280-V321 HydrophobicContact CG-CG1 4.44Å; F280-Y322 HydrophobicContact CB-CE2 4.35Å; F280-Y322 HydrophobicContact CD1-CE2 4.48Å
281	T	88.2	Confident	89.2	Confident	73 Å²	73	41.3 Å²	41.3	45%	0.448	20%	0.203	S	C	.	.	H	α-helix	trans	-60.6	-40.2	-179.3	47.6	0	0	0	0	112.7	V279 K285 Y322	V279-T281 PolarHBondContact O-N 3.01Å; T281-K285 WeakPolarHBondContact O-CB 3.45Å; T281-K285 PolarHBondContact O-N 2.92Å; T281-Y322 HydrophobicContact CG2-CE2 4.07Å
282	V	89.2	Confident	88.7	Confident	19 Å²	19	48.2 Å²	48.2	12%	0.115	23%	0.229	C	C	.	.	H	α-helix	trans	-68.4	-51.5	178.1	-173	0	0	0	0	110.2	W222 E225 V279 F280 K285 Q286	W222-V282 HydrophobicContact CZ2-CG1 4.33Å; E225-V282 HydrophobicContact CG-CG1 4.32Å; E225-V282 WeakPolarHBondContact OE1-CG1 3.48Å; V279-V282 PolarHBondContact O-N 3.16Å; F280-V282 VanDerWaalsContact C-N 3.32Å; F280-V282 PolarHBondContact O-N 3.34Å; V282-K285 WeakPolarHBondContact O-CB 3.37Å; V282-K285 PolarHBondContact O-N 3.44Å; V282-Q286 WeakPolarHBondContact O-CG 3.49Å; V282-Q286 PolarHBondContact O-N 2.9Å
283	M	89.1	Confident	88.3	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-60	-47.3	178.7	176.9	179.3	55.7	0	0	111.4	F215 I219 W222 L276 V279 F280 K285 Q286 L287	F215-M283 HydrophobicContact CE2-CE 3.65Å; F215-M283 HydrophobicContact CE2-SD 4.29Å; F215-M283 HydrophobicContact CZ-CE 3.61Å; I219-M283 HydrophobicContact CD1-CE 4.15Å; I219-M283 HydrophobicContact CD1-SD 4.24Å; I219-M283 HydrophobicContact CG1-CE 3.94Å; I219-M283 HydrophobicContact CG1-SD 3.41Å; I219-M283 WeakPolarHBondContact CG1-SD 3.17Å; W222-M283 HydrophobicContact CD2-CG 4.48Å; W222-M283 HydrophobicContact CZ2-CB 4.28Å; L276-M283 HydrophobicContact CD1-CE 3.91Å; V279-M283 WeakPolarHBondContact O-CB 3.46Å; V279-M283 PolarHBondContact O-N 3.43Å; F280-M283 HydrophobicContact CD2-CE 4.09Å; F280-M283 PolarHBondContact O-N 3.18Å; M283-K285 VanDerWaalsContact C-N 3.29Å; M283-K285 PolarHBondContact O-N 2.95Å; M283-Q286 PolarHBondContact O-N 3.22Å; M283-Q286 VanDerWaalsContact O-N 3.12Å; M283-L287 HydrophobicContact CG-CD1 3.64Å; M283-L287 HydrophobicContact CG-CG 4.02Å; M283-L287 WeakPolarHBondContact O-CB 3.5Å; M283-L287 VanDerWaalsContact O-CG 3.3Å; M283-L287 WeakPolarHBondContact O-CG 3.42Å; M283-L287 PolarHBondContact O-N 3.26Å; M283-L287 HydrophobicContact SD-CD1 4.29Å
284	R	89.9	Confident	87.7	Confident	64 Å²	64	55.2 Å²	55.2	24%	0.242	26%	0.263	C	S	.	.	H	α-helix	trans	-54.7	-44.6	175.7	173.7	168.1	174.9	-104.4	4.1	111.4	F280 L288 L314 S315 E318	F280-R284 HydrophobicContact CD1-CB 4.34Å; F280-R284 HydrophobicContact CE1-CB 4.21Å; F280-R284 WeakPolarHBondContact O-CB 3.47Å; F280-R284 PolarHBondContact O-N 2.94Å; R284-L288 HydrophobicContact CG-CD1 3.98Å; R284-L288 WeakPolarHBondContact O-CB 3.34Å; R284-L288 VanDerWaalsContact O-CG 3.23Å; R284-L288 WeakPolarHBondContact O-CG 3.34Å; R284-L288 PolarHBondContact O-N 2.76Å; R284-L288 VanDerWaalsContact O-N 3.09Å; R284-L314 HydrophobicContact CG-CB 4.22Å; R284-L314 HydrophobicContact CG-CD1 4.28Å; R284-S315 PolarHBondContact NH2-OG 3.43Å; R284-E318 WeakPolarHBondContact CD-OE2 3.49Å; R284-E318 IonicContact CZ-OE2 3.39Å; R284-E318 IonicContact NE-OE2 2.63Å; R284-E318 PolarHBondContact NE-OE2 3.21Å; R284-E318 IonicContact NH1-OE1 2.66Å; R284-E318 PolarHBondContact NH1-OE1 3.42Å; R284-E318 IonicContact NH1-OE2 3.24Å; R284-E318 PolarHBondContact NH1-OE2 2.72Å; R284-E318 IonicContact NH2-OE2 3.08Å
285	K	88.7	Confident	87.2	Confident	166 Å²	166	54.9 Å²	54.9	72%	0.722	26%	0.255	S	S	*	.	H	α-helix	trans	-64.2	-43.4	176.6	-173.8	179.3	-179	179.3	0	112.4	T281 V282 M283 E289	T281-K285 WeakPolarHBondContact O-CB 3.45Å; T281-K285 PolarHBondContact O-N 2.92Å; V282-K285 WeakPolarHBondContact O-CB 3.37Å; V282-K285 PolarHBondContact O-N 3.44Å; M283-K285 VanDerWaalsContact C-N 3.29Å; M283-K285 PolarHBondContact O-N 2.95Å; K285-E289 WeakPolarHBondContact O-CB 3.47Å; K285-E289 PolarHBondContact O-N 2.87Å
286	Q	87.9	Confident	86.5	Confident	83 Å²	83	59.7 Å²	59.7	39%	0.388	28%	0.281	S	S	.	.	H	α-helix	trans	-69	-44.6	179	-69	-178.7	9.4	0	0	112.1	V282 M283 L288 E289 Q290	V282-Q286 WeakPolarHBondContact O-CG 3.49Å; V282-Q286 PolarHBondContact O-N 2.9Å; M283-Q286 PolarHBondContact O-N 3.22Å; M283-Q286 VanDerWaalsContact O-N 3.12Å; Q286-L288 PolarHBondContact O-N 3.29Å; Q286-E289 PolarHBondContact O-N 2.97Å; Q286-Q290 WeakPolarHBondContact O-CB 3.46Å; Q286-Q290 PolarHBondContact O-N 2.9Å
287	L	86.8	Confident	86	Confident	11 Å²	11	65.1 Å²	65.1	6%	0.058	30%	0.304	C	S	.	.	H	α-helix	trans	-61.6	-41.9	177.9	-71.5	175.8	0	0	0	112.4	F215 Q218 M283 Q290 A291 F310	F215-L287 HydrophobicContact CD2-CD1 4.06Å; F215-L287 HydrophobicContact CE2-CD1 4.17Å; Q218-L287 HydrophobicContact CB-CD2 3.86Å; Q218-L287 HydrophobicContact CG-CD2 3.86Å; M283-L287 HydrophobicContact CG-CD1 3.64Å; M283-L287 HydrophobicContact CG-CG 4.02Å; M283-L287 WeakPolarHBondContact O-CB 3.5Å; M283-L287 VanDerWaalsContact O-CG 3.3Å; M283-L287 WeakPolarHBondContact O-CG 3.42Å; M283-L287 PolarHBondContact O-N 3.26Å; M283-L287 HydrophobicContact SD-CD1 4.29Å; L287-Q290 PolarHBondContact O-N 3.33Å; L287-A291 WeakPolarHBondContact O-CB 3.36Å; L287-A291 PolarHBondContact O-N 2.87Å; L287-F310 HydrophobicContact CB-CE1 4.34Å; L287-F310 HydrophobicContact CD1-CZ 4.35Å
288	L	87.4	Confident	85.3	Confident	54 Å²	54	63.7 Å²	63.7	28%	0.283	30%	0.302	S	S	.	.	H	α-helix	trans	-68.2	-34.5	176.4	-70.9	172.2	0	0	0	112.3	R284 Q286 R292 P311 L314	R284-L288 HydrophobicContact CG-CD1 3.98Å; R284-L288 WeakPolarHBondContact O-CB 3.34Å; R284-L288 VanDerWaalsContact O-CG 3.23Å; R284-L288 WeakPolarHBondContact O-CG 3.34Å; R284-L288 PolarHBondContact O-N 2.76Å; R284-L288 VanDerWaalsContact O-N 3.09Å; Q286-L288 PolarHBondContact O-N 3.29Å; L288-R292 WeakPolarHBondContact O-CB 3.41Å; L288-R292 PolarHBondContact O-N 2.74Å; L288-R292 VanDerWaalsContact O-N 3.14Å; L288-P311 HydrophobicContact CD2-CB 4.01Å; L288-P311 HydrophobicContact CD2-CG 3.86Å; L288-L314 HydrophobicContact CD2-CD1 4.04Å; L288-L314 HydrophobicContact CG-CD1 4.05Å
289	E	87.4	Confident	84.9	Confident	67 Å²	67	65.8 Å²	65.8	31%	0.313	32%	0.315	S	S	.	.	H	α-helix	trans	-69.6	-45.5	174	-176.5	58.8	-133	0	0	111.6	K285 Q286 R292 Q293	K285-E289 WeakPolarHBondContact O-CB 3.47Å; K285-E289 PolarHBondContact O-N 2.87Å; Q286-E289 PolarHBondContact O-N 2.97Å; E289-R292 WeakPolarHBondContact O-CB 3.48Å; E289-R292 PolarHBondContact O-N 2.97Å; E289-R292 VanDerWaalsContact O-N 3.16Å; E289-R292 IonicContact OE1-CZ 3.22Å; E289-R292 IonicContact OE1-NE 2.91Å; E289-R292 PolarHBondContact OE1-NE 3.38Å; E289-R292 IonicContact OE1-NH2 2.88Å; E289-R292 PolarHBondContact OE1-NH2 2.8Å; E289-R292 IonicContact OE2-CZ 3.58Å; E289-R292 IonicContact OE2-NE 2.78Å; E289-R292 PolarHBondContact OE2-NE 3.43Å; E289-R292 IonicContact OE2-NH1 2.7Å; E289-R292 IonicContact OE2-NH2 2.69Å; E289-R292 PolarHBondContact OE2-NH2 2.8Å; E289-Q293 WeakPolarHBondContact O-CG 3.48Å; E289-Q293 PolarHBondContact O-N 3.23Å; E289-Q293 PolarHBondContact OE1-NE2 3.42Å
290	Q	84.3	Confident	84.1	Confident	74 Å²	74	70 Å²	70	35%	0.346	34%	0.343	S	S	.	.	H	α-helix	trans	-62	-46.8	176.4	-174.1	179.2	1.9	0	0	111.4	Q286 L287 R292 Q293 E294	Q286-Q290 WeakPolarHBondContact O-CB 3.46Å; Q286-Q290 PolarHBondContact O-N 2.9Å; L287-Q290 PolarHBondContact O-N 3.33Å; Q290-R292 PolarHBondContact O-N 2.91Å; Q290-Q293 PolarHBondContact O-N 3.34Å; Q290-E294 HydrophobicContact CG-CG 4.31Å; Q290-E294 VanDerWaalsContact CG-OE1 3.28Å; Q290-E294 WeakPolarHBondContact CG-OE1 3.49Å; Q290-E294 PolarHBondContact NE2-OE1 3.42Å; Q290-E294 PolarHBondContact O-N 2.82Å
291	A	81.8	Confident	83.2	Confident	16 Å²	16	77.8 Å²	77.8	13%	0.132	38%	0.379	C	S	.	.	H	α-helix	trans	-58.2	-32.9	175	0	0	0	0	0	112.6	L287 K295 I306	L287-A291 WeakPolarHBondContact O-CB 3.36Å; L287-A291 PolarHBondContact O-N 2.87Å; A291-K295 WeakPolarHBondContact O-CB 3.46Å; A291-K295 PolarHBondContact O-N 3.37Å; A291-I306 HydrophobicContact CB-CG2 3.76Å
292	R	82.9	Confident	82.5	Confident	144 Å²	144	79.9 Å²	79.9	54%	0.543	38%	0.382	S	S	.	.	H	α-helix	trans	-73.2	-33.2	174.8	-172.1	-178.2	74.6	163.4	4.7	113	L288 E289 Q290 K295	L288-R292 WeakPolarHBondContact O-CB 3.41Å; L288-R292 PolarHBondContact O-N 2.74Å; L288-R292 VanDerWaalsContact O-N 3.14Å; E289-R292 WeakPolarHBondContact O-CB 3.48Å; E289-R292 PolarHBondContact O-N 2.97Å; E289-R292 VanDerWaalsContact O-N 3.16Å; E289-R292 IonicContact OE1-CZ 3.22Å; E289-R292 IonicContact OE1-NE 2.91Å; E289-R292 PolarHBondContact OE1-NE 3.38Å; E289-R292 IonicContact OE1-NH2 2.88Å; E289-R292 PolarHBondContact OE1-NH2 2.8Å; E289-R292 IonicContact OE2-CZ 3.58Å; E289-R292 IonicContact OE2-NE 2.78Å; E289-R292 PolarHBondContact OE2-NE 3.43Å; E289-R292 IonicContact OE2-NH1 2.7Å; E289-R292 IonicContact OE2-NH2 2.69Å; E289-R292 PolarHBondContact OE2-NH2 2.8Å; Q290-R292 PolarHBondContact O-N 2.91Å; R292-K295 VanDerWaalsContact O-CD 3.31Å; R292-K295 WeakPolarHBondContact O-CD 3.32Å; R292-K295 WeakPolarHBondContact O-CG 3.35Å
293	Q	84.3	Confident	82	Confident	118 Å²	118	82.6 Å²	82.6	55%	0.551	39%	0.39	S	S	*	.	H	α-helix	trans	-79.1	-39.4	177.8	-68.6	176.9	19.9	0	0	112	E289 Q290	E289-Q293 WeakPolarHBondContact O-CG 3.48Å; E289-Q293 PolarHBondContact O-N 3.23Å; E289-Q293 PolarHBondContact OE1-NE2 3.42Å; Q290-Q293 PolarHBondContact O-N 3.34Å
294	E	80.9	Confident	81.3	Confident	68 Å²	68	86.7 Å²	86.7	32%	0.318	42%	0.415	S	S	.	.	H	α-helix	trans	-87.3	-2.7	-178.7	-65.4	-173.4	-152	0	0	114.2	Q290 D296 K297 L298	Q290-E294 HydrophobicContact CG-CG 4.31Å; Q290-E294 VanDerWaalsContact CG-OE1 3.28Å; Q290-E294 WeakPolarHBondContact CG-OE1 3.49Å; Q290-E294 PolarHBondContact NE2-OE1 3.42Å; Q290-E294 PolarHBondContact O-N 2.82Å; E294-D296 PolarHBondContact O-N 2.85Å; E294-K297 HydrophobicContact CG-CD 4.48Å; E294-K297 WeakPolarHBondContact O-CB 3.49Å; E294-K297 PolarHBondContact O-N 3.46Å; E294-L298 PolarHBondContact O-N 2.97Å
295	K	78.7	Confident	80.4	Confident	73 Å²	73	85.1 Å²	85.1	32%	0.317	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.4	-31.5	-179.4	76.2	-175	-179.7	-170.6	0	114.7	A291 R292 R303 L307	A291-K295 WeakPolarHBondContact O-CB 3.46Å; A291-K295 PolarHBondContact O-N 3.37Å; R292-K295 VanDerWaalsContact O-CD 3.31Å; R292-K295 WeakPolarHBondContact O-CD 3.32Å; R292-K295 WeakPolarHBondContact O-CG 3.35Å; K295-R303 WeakPolarHBondContact O-CD 3.49Å; K295-R303 WeakPolarHBondContact O-CG 3.34Å; K295-R303 PolarHBondContact O-NH1 3.44Å; K295-L307 HydrophobicContact CB-CD1 4.43Å
296	D	77.4	Confident	79.9	Confident	106 Å²	106	78.1 Å²	78.1	57%	0.567	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-9	-176.7	-60.7	-53.8	0	0	0	113.4	E294 R303	E294-D296 PolarHBondContact O-N 2.85Å; D296-R303 IonicContact OD1-CZ 2.72Å; D296-R303 IonicContact OD1-NH1 2.97Å; D296-R303 PolarHBondContact OD1-NH1 2.79Å; D296-R303 IonicContact OD1-NH2 2.74Å; D296-R303 PolarHBondContact OD1-NH2 2.79Å
297	K	82	Confident	79.4	Confident	115 Å²	115	78 Å²	78	50%	0.5	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-21.1	167.2	-62.2	-176.7	177.1	-176.7	0	112.8	G25 E294	G25-K297 PolarHBondContact O-NZ 3.02Å; E294-K297 HydrophobicContact CG-CD 4.48Å; E294-K297 WeakPolarHBondContact O-CB 3.49Å; E294-K297 PolarHBondContact O-N 3.46Å
298	L	74.1	Confident	79.1	Confident	50 Å²	50	80.9 Å²	80.9	26%	0.262	40%	0.402	S	S	.	.	S	Bend	trans	-83.1	140.6	-172.4	-71.9	166.2	0	0	0	112.5	E294 R303 I306	E294-L298 PolarHBondContact O-N 2.97Å; L298-R303 HydrophobicContact CB-CB 4.23Å; L298-I306 HydrophobicContact CD1-CD1 3.86Å; L298-I306 HydrophobicContact CD2-CD1 4.37Å
299	P	80	Confident	78.8	Confident	71 Å²	71	82.9 Å²	82.9	46%	0.461	41%	0.409	S	S	.	.			trans	-54	145.2	170.4	-26.1	34.8	0	0	0	112.1	E301 K302 R303	P299-E301 VanDerWaalsContact C-N 3.27Å; P299-E301 PolarHBondContact O-N 3.38Å; P299-E301 VanDerWaalsContact O-N 3.15Å; P299-K302 PolarHBondContact O-N 3.29Å; P299-K302 VanDerWaalsContact O-N 3.09Å; P299-R303 WeakPolarHBondContact O-CB 3.34Å; P299-R303 PolarHBondContact O-N 3.16Å
300	P	73.9	Confident	78.8	Confident	97 Å²	97	79.9 Å²	79.9	63%	0.63	40%	0.395	S	S	*	.	H	α-helix	trans	-59.7	-33.2	-168.5	21.9	-33.5	0	0	0	114.1	T304	P300-T304 PolarHBondContact O-N 2.69Å; P300-T304 PolarHBondContact O-OG1 2.66Å
301	E	71.7	Confident	79.1	Confident	163 Å²	163	78.3 Å²	78.3	76%	0.762	39%	0.392	S	S	*	.	H	α-helix	trans	-63.5	-54.7	175	-62.1	169.7	177.5	0	0	111	P299 R303 T304 L305	P299-E301 VanDerWaalsContact C-N 3.27Å; P299-E301 PolarHBondContact O-N 3.38Å; P299-E301 VanDerWaalsContact O-N 3.15Å; E301-R303 PolarHBondContact O-N 3.4Å; E301-T304 PolarHBondContact O-N 3.23Å; E301-L305 PolarHBondContact O-N 3.18Å; E301-L305 VanDerWaalsContact O-N 3.15Å
302	K	73.3	Confident	79.4	Confident	118 Å²	118	84.5 Å²	84.5	51%	0.513	42%	0.416	S	S	.	.	H	α-helix	trans	-65.3	-36.7	178	-65.6	-168.7	175.4	-172.1	0	112.3	P299 T304 L305 I306	P299-K302 PolarHBondContact O-N 3.29Å; P299-K302 VanDerWaalsContact O-N 3.09Å; K302-T304 VanDerWaalsContact C-N 3.35Å; K302-T304 PolarHBondContact O-N 2.84Å; K302-L305 PolarHBondContact O-N 2.81Å; K302-I306 HydrophobicContact CB-CD1 4.47Å; K302-I306 WeakPolarHBondContact O-CB 3.33Å; K302-I306 WeakPolarHBondContact O-CD1 3.38Å; K302-I306 VanDerWaalsContact O-CG1 3.26Å; K302-I306 WeakPolarHBondContact O-CG1 3.31Å; K302-I306 PolarHBondContact O-N 2.63Å
303	R	78.8	Confident	79.8	Confident	75 Å²	75	77.8 Å²	77.8	28%	0.283	39%	0.39	S	S	.	.	H	α-helix	trans	-58.1	-45.6	173.7	178.6	-168.9	-176.7	122.8	-0.9	111.6	K295 D296 L298 P299 E301 L307	K295-R303 WeakPolarHBondContact O-CD 3.49Å; K295-R303 WeakPolarHBondContact O-CG 3.34Å; K295-R303 PolarHBondContact O-NH1 3.44Å; D296-R303 IonicContact OD1-CZ 2.72Å; D296-R303 IonicContact OD1-NH1 2.97Å; D296-R303 PolarHBondContact OD1-NH1 2.79Å; D296-R303 IonicContact OD1-NH2 2.74Å; D296-R303 PolarHBondContact OD1-NH2 2.79Å; L298-R303 HydrophobicContact CB-CB 4.23Å; P299-R303 WeakPolarHBondContact O-CB 3.34Å; P299-R303 PolarHBondContact O-N 3.16Å; E301-R303 PolarHBondContact O-N 3.4Å; R303-L307 HydrophobicContact CG-CD1 3.92Å; R303-L307 WeakPolarHBondContact O-CB 3.47Å; R303-L307 VanDerWaalsContact O-CG 3.29Å; R303-L307 WeakPolarHBondContact O-CG 3.33Å; R303-L307 PolarHBondContact O-N 3.45Å
304	T	74.3	Confident	80.2	Confident	87 Å²	87	72.1 Å²	72.1	53%	0.534	36%	0.364	S	S	.	.	H	α-helix	trans	-63.6	-50	179	-55.5	0	0	0	0	110	P300 E301 K302 I306 L307 T308	P300-T304 PolarHBondContact O-N 2.69Å; P300-T304 PolarHBondContact O-OG1 2.66Å; E301-T304 PolarHBondContact O-N 3.23Å; K302-T304 VanDerWaalsContact C-N 3.35Å; K302-T304 PolarHBondContact O-N 2.84Å; T304-I306 PolarHBondContact O-N 3.12Å; T304-L307 PolarHBondContact O-N 3.3Å; T304-T308 PolarHBondContact O-N 2.99Å; T304-T308 VanDerWaalsContact O-N 3.13Å; T304-T308 PolarHBondContact O-OG1 2.85Å
305	L	72.9	Confident	80.7	Confident	32 Å²	32	70.6 Å²	70.6	17%	0.168	36%	0.361	C	S	.	.	H	α-helix	trans	-54.4	-49.3	177.3	176.3	60.6	0	0	0	113.1	T207 L211 E301 K302 H309 F310	T207-L305 HydrophobicContact CG2-CD1 3.23Å; T207-L305 HydrophobicContact CG2-CD2 3.8Å; T207-L305 HydrophobicContact CG2-CG 4.16Å; L211-L305 HydrophobicContact CD1-CD1 3.93Å; L211-L305 HydrophobicContact CD1-CG 4.34Å; L211-L305 HydrophobicContact CD2-CD2 4.27Å; L211-L305 HydrophobicContact CD2-CG 4.1Å; L211-L305 HydrophobicContact CG-CD1 4.3Å; L211-L305 HydrophobicContact CG-CD2 4.35Å; L211-L305 HydrophobicContact CG-CG 4.29Å; E301-L305 PolarHBondContact O-N 3.18Å; E301-L305 VanDerWaalsContact O-N 3.15Å; K302-L305 PolarHBondContact O-N 2.81Å; L305-H309 HydrophobicContact CD1-CB 3.91Å; L305-H309 PolarHBondContact O-N 3.3Å; L305-F310 PolarHBondContact O-N 3.31Å
306	I	77.8	Confident	81.3	Confident	19 Å²	19	70 Å²	70	10%	0.097	36%	0.359	C	S	.	.	H	α-helix	trans	-70.9	-31.2	-176.3	-70	165.9	0	0	0	111.9	L211 M214 A291 L298 K302 T304 F310	L211-I306 HydrophobicContact CD2-CG1 4.48Å; M214-I306 HydrophobicContact CE-CG1 4.29Å; M214-I306 HydrophobicContact SD-CD1 4Å; M214-I306 HydrophobicContact SD-CG1 4.28Å; A291-I306 HydrophobicContact CB-CG2 3.76Å; L298-I306 HydrophobicContact CD1-CD1 3.86Å; L298-I306 HydrophobicContact CD2-CD1 4.37Å; K302-I306 HydrophobicContact CB-CD1 4.47Å; K302-I306 WeakPolarHBondContact O-CB 3.33Å; K302-I306 WeakPolarHBondContact O-CD1 3.38Å; K302-I306 VanDerWaalsContact O-CG1 3.26Å; K302-I306 WeakPolarHBondContact O-CG1 3.31Å; K302-I306 PolarHBondContact O-N 2.63Å; T304-I306 PolarHBondContact O-N 3.12Å; I306-F310 HydrophobicContact CG2-CD1 4.43Å; I306-F310 WeakPolarHBondContact O-CB 3.27Å
307	L	77	Confident	82.1	Confident	79 Å²	79	64.9 Å²	64.9	41%	0.414	33%	0.332	S	S	.	.	H	α-helix	trans	-81.8	-25	178.8	-68.8	175.5	0	0	0	113.9	K295 R303 T304	K295-L307 HydrophobicContact CB-CD1 4.43Å; R303-L307 HydrophobicContact CG-CD1 3.92Å; R303-L307 WeakPolarHBondContact O-CB 3.47Å; R303-L307 VanDerWaalsContact O-CG 3.29Å; R303-L307 WeakPolarHBondContact O-CG 3.33Å; R303-L307 PolarHBondContact O-N 3.45Å; T304-L307 PolarHBondContact O-N 3.3Å
308	T	80.1	Confident	82.6	Confident	73 Å²	73	61.2 Å²	61.2	45%	0.448	32%	0.317	S	S	.	.	H	α-helix	trans	-110.1	-37.5	-174.9	62.3	0	0	0	0	115	T304	T304-T308 PolarHBondContact O-N 2.99Å; T304-T308 VanDerWaalsContact O-N 3.13Å; T304-T308 PolarHBondContact O-OG1 2.85Å
309	H	81.7	Confident	83.5	Confident	95 Å²	95	64.6 Å²	64.6	44%	0.44	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-39.7	-176.8	-62.6	-99.8	0	0	0	112.6	L211 L305 K312 F313	L211-H309 HydrophobicContact CD1-CB 3.88Å; L305-H309 HydrophobicContact CD1-CB 3.91Å; L305-H309 PolarHBondContact O-N 3.3Å; H309-K312 WeakPolarHBondContact O-CB 3.32Å; H309-K312 PolarHBondContact O-N 3.01Å; H309-F313 PolarHBondContact O-N 3.22Å
310	F	87.3	Confident	84.1	Confident	4 Å²	4	62 Å²	62	2%	0.018	31%	0.313	C	S	.	.	H	α-helix	trans	-59.7	-38.6	-176.8	-168.8	-130.6	0	0	0	114.3	L211 M214 F215 L287 L305 I306 K312 F313 L314	L211-F310 HydrophobicContact CD2-CB 4.09Å; L211-F310 HydrophobicContact CD2-CD2 3.97Å; L211-F310 HydrophobicContact CD2-CG 4.3Å; M214-F310 HydrophobicContact CE-CD1 4Å; M214-F310 HydrophobicContact CE-CD2 3.7Å; M214-F310 HydrophobicContact CE-CE1 3.82Å; M214-F310 HydrophobicContact CE-CE2 3.51Å; M214-F310 HydrophobicContact CE-CG 3.94Å; M214-F310 HydrophobicContact CE-CZ 3.57Å; F215-F310 HydrophobicContact CB-CE2 4.34Å; L287-F310 HydrophobicContact CB-CE1 4.34Å; L287-F310 HydrophobicContact CD1-CZ 4.35Å; L305-F310 PolarHBondContact O-N 3.31Å; I306-F310 HydrophobicContact CG2-CD1 4.43Å; I306-F310 WeakPolarHBondContact O-CB 3.27Å; F310-K312 VanDerWaalsContact C-N 3.31Å; F310-K312 PolarHBondContact O-N 3.23Å; F310-F313 HydrophobicContact CD2-CD1 4.21Å; F310-F313 HydrophobicContact CE2-CD1 4.3Å; F310-F313 PolarHBondContact O-N 3.42Å; F310-L314 HydrophobicContact CD1-CD1 3.98Å; F310-L314 HydrophobicContact CD2-CD1 4.39Å; F310-L314 HydrophobicContact CD2-CG 4.17Å; F310-L314 HydrophobicContact CE1-CD1 3.69Å; F310-L314 HydrophobicContact CE1-CG 4.4Å; F310-L314 HydrophobicContact CE2-CD1 4.12Å; F310-L314 HydrophobicContact CE2-CD2 4.02Å; F310-L314 HydrophobicContact CE2-CG 3.93Å; F310-L314 HydrophobicContact CG-CD1 4.33Å; F310-L314 HydrophobicContact CZ-CD1 3.76Å; F310-L314 HydrophobicContact CZ-CD2 4.1Å; F310-L314 HydrophobicContact CZ-CG 4.06Å; F310-L314 WeakPolarHBondContact O-CB 3.43Å; F310-L314 WeakPolarHBondContact O-CG 3.24Å; F310-L314 PolarHBondContact O-N 2.84Å
311	P	90.1	Very high	84.9	Confident	41 Å²	41	57.3 Å²	57.3	27%	0.266	28%	0.283	S	S	.	.	H	α-helix	trans	-64.9	-33.2	174.3	-20.4	33.2	0	0	0	113	L288 S315	L288-P311 HydrophobicContact CD2-CB 4.01Å; L288-P311 HydrophobicContact CD2-CG 3.86Å; P311-S315 WeakPolarHBondContact O-CB 3.19Å; P311-S315 PolarHBondContact O-N 2.66Å; P311-S315 PolarHBondContact O-OG 3.26Å
312	K	88.1	Confident	85.8	Confident	146 Å²	146	53.1 Å²	53.1	64%	0.635	26%	0.261	S	S	*	.	H	α-helix	trans	-70.8	-48.6	175	-63	-174.6	178.5	-173.8	0	110.9	H309 F310 L314 S315 M316	H309-K312 WeakPolarHBondContact O-CB 3.32Å; H309-K312 PolarHBondContact O-N 3.01Å; F310-K312 VanDerWaalsContact C-N 3.31Å; F310-K312 PolarHBondContact O-N 3.23Å; K312-L314 VanDerWaalsContact C-N 3.34Å; K312-L314 PolarHBondContact O-N 2.98Å; K312-S315 PolarHBondContact O-N 3.32Å; K312-M316 WeakPolarHBondContact O-CG 3.24Å; K312-M316 PolarHBondContact O-N 3.16Å
313	F	91	Very high	86.6	Confident	3 Å²	3	49.5 Å²	49.5	1%	0.013	25%	0.25	C	S	.	.	H	α-helix	trans	-52	-50.3	174.8	176.2	-87.5	0	0	0	111.6	F192 V193 F197 I208 A212 F215 H309 F310 S315 M316 L317	F192-F313 HydrophobicContact CD1-CE2 4.21Å; F192-F313 HydrophobicContact CD1-CZ 4.38Å; F192-F313 AromaticContact CE1-CD2 4Å; F192-F313 HydrophobicContact CE1-CD2 4Å; F192-F313 AromaticContact CE1-CE2 3.68Å; F192-F313 HydrophobicContact CE1-CE2 3.68Å; F192-F313 HydrophobicContact CE1-CZ 4.03Å; V193-F313 HydrophobicContact CG2-CE2 4.4Å; F197-F313 HydrophobicContact CE2-CD2 4.48Å; I208-F313 HydrophobicContact CG2-CD2 4.13Å; I208-F313 HydrophobicContact CG2-CE2 4.06Å; A212-F313 HydrophobicContact CB-CE2 4.16Å; A212-F313 HydrophobicContact CB-CZ 3.86Å; F215-F313 HydrophobicContact CB-CE1 4.18Å; F215-F313 HydrophobicContact CD1-CE1 4.48Å; F215-F313 HydrophobicContact CG-CE1 4.27Å; H309-F313 PolarHBondContact O-N 3.22Å; F310-F313 HydrophobicContact CD2-CD1 4.21Å; F310-F313 HydrophobicContact CE2-CD1 4.3Å; F310-F313 PolarHBondContact O-N 3.42Å; F313-S315 VanDerWaalsContact C-N 3.29Å; F313-S315 PolarHBondContact O-N 3.28Å; F313-M316 PolarHBondContact O-N 3.13Å; F313-L317 HydrophobicContact CE1-CD2 4.12Å; F313-L317 WeakPolarHBondContact O-CB 3.32Å; F313-L317 PolarHBondContact O-N 2.88Å
314	L	92.3	Very high	86.6	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-30.3	178.3	-72	175.1	0	0	0	113.3	F215 F280 R284 L288 F310 K312 E318	F215-L314 HydrophobicContact CD2-CD2 3.6Å; F215-L314 HydrophobicContact CE2-CD2 3.55Å; F280-L314 WeakPolarHBondContact CE1-O 3.26Å; F280-L314 HydrophobicContact CZ-CD2 4.39Å; F280-L314 VanDerWaalsContact CZ-O 3.32Å; F280-L314 WeakPolarHBondContact CZ-O 3.38Å; R284-L314 HydrophobicContact CG-CB 4.22Å; R284-L314 HydrophobicContact CG-CD1 4.28Å; L288-L314 HydrophobicContact CD2-CD1 4.04Å; L288-L314 HydrophobicContact CG-CD1 4.05Å; F310-L314 HydrophobicContact CD1-CD1 3.98Å; F310-L314 HydrophobicContact CD2-CD1 4.39Å; F310-L314 HydrophobicContact CD2-CG 4.17Å; F310-L314 HydrophobicContact CE1-CD1 3.69Å; F310-L314 HydrophobicContact CE1-CG 4.4Å; F310-L314 HydrophobicContact CE2-CD1 4.12Å; F310-L314 HydrophobicContact CE2-CD2 4.02Å; F310-L314 HydrophobicContact CE2-CG 3.93Å; F310-L314 HydrophobicContact CG-CD1 4.33Å; F310-L314 HydrophobicContact CZ-CD1 3.76Å; F310-L314 HydrophobicContact CZ-CD2 4.1Å; F310-L314 HydrophobicContact CZ-CG 4.06Å; F310-L314 WeakPolarHBondContact O-CB 3.43Å; F310-L314 WeakPolarHBondContact O-CG 3.24Å; F310-L314 PolarHBondContact O-N 2.84Å; K312-L314 VanDerWaalsContact C-N 3.34Å; K312-L314 PolarHBondContact O-N 2.98Å; L314-E318 WeakPolarHBondContact O-CB 3.1Å; L314-E318 PolarHBondContact O-N 3.48Å; L314-E318 VanDerWaalsContact O-N 3.11Å
315	S	92.2	Very high	87	Confident	35 Å²	35	54.5 Å²	54.5	25%	0.245	28%	0.282	C	S	.	.	H	α-helix	trans	-78.3	-44	179.2	-51.4	0	0	0	0	111.5	R284 P311 K312 F313 L317 E318 E319	R284-S315 PolarHBondContact NH2-OG 3.43Å; P311-S315 WeakPolarHBondContact O-CB 3.19Å; P311-S315 PolarHBondContact O-N 2.66Å; P311-S315 PolarHBondContact O-OG 3.26Å; K312-S315 PolarHBondContact O-N 3.32Å; F313-S315 VanDerWaalsContact C-N 3.29Å; F313-S315 PolarHBondContact O-N 3.28Å; S315-L317 VanDerWaalsContact C-N 3.26Å; S315-L317 PolarHBondContact O-N 3.35Å; S315-E318 VanDerWaalsContact O-CB 3.28Å; S315-E318 WeakPolarHBondContact O-CB 3.34Å; S315-E318 PolarHBondContact O-N 2.86Å; S315-E318 VanDerWaalsContact O-N 3.11Å; S315-E319 PolarHBondContact O-N 3Å
316	M	91.8	Very high	87.8	Confident	60 Å²	60	53.4 Å²	53.4	30%	0.296	28%	0.277	S	S	.	.	H	α-helix	trans	-62.5	-33.2	173.3	-68.2	173.2	67.9	0	0	112.2	F192 K196 F197 K312 F313	F192-M316 HydrophobicContact CE2-CB 4.13Å; F192-M316 WeakPolarHBondContact CE2-O 3.37Å; F192-M316 HydrophobicContact CZ-CB 3.82Å; K196-M316 HydrophobicContact CB-CE 4.11Å; K196-M316 HydrophobicContact CD-CE 4.41Å; K196-M316 HydrophobicContact CG-CE 4.3Å; F197-M316 HydrophobicContact CE1-CE 3.82Å; F197-M316 HydrophobicContact CE1-SD 4.16Å; F197-M316 HydrophobicContact CE2-CE 4.38Å; F197-M316 HydrophobicContact CZ-CE 3.54Å; F197-M316 HydrophobicContact CZ-SD 3.82Å; K312-M316 WeakPolarHBondContact O-CG 3.24Å; K312-M316 PolarHBondContact O-N 3.16Å; F313-M316 PolarHBondContact O-N 3.13Å
317	L	93.2	Very high	88.3	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-74.1	-31.8	174.4	-176.8	57.6	0	0	0	112	V189 F192 F215 F280 F313 S315 E320 V321	V189-L317 HydrophobicContact CG2-CD2 4.26Å; F192-L317 HydrophobicContact CB-CD1 4.23Å; F192-L317 HydrophobicContact CD1-CB 4.49Å; F192-L317 HydrophobicContact CD1-CD1 3.9Å; F192-L317 HydrophobicContact CD2-CD1 4.02Å; F192-L317 HydrophobicContact CE1-CB 3.91Å; F192-L317 HydrophobicContact CE1-CD1 4.19Å; F192-L317 HydrophobicContact CE1-CG 4.48Å; F192-L317 HydrophobicContact CE2-CB 4.18Å; F192-L317 HydrophobicContact CE2-CD1 4.32Å; F192-L317 HydrophobicContact CG-CD1 3.8Å; F192-L317 HydrophobicContact CZ-CB 3.75Å; F192-L317 HydrophobicContact CZ-CD1 4.4Å; F215-L317 HydrophobicContact CD1-CD2 4.01Å; F215-L317 HydrophobicContact CE1-CD2 3.46Å; F215-L317 VanDerWaalsContact CE1-CD2 3.46Å; F215-L317 HydrophobicContact CZ-CD2 3.78Å; F280-L317 HydrophobicContact CE2-CB 4.37Å; F280-L317 HydrophobicContact CE2-CD2 3.79Å; F280-L317 HydrophobicContact CE2-CG 3.75Å; F280-L317 HydrophobicContact CZ-CB 4.03Å; F280-L317 HydrophobicContact CZ-CD2 4.17Å; F280-L317 HydrophobicContact CZ-CG 3.93Å; F313-L317 HydrophobicContact CE1-CD2 4.12Å; F313-L317 WeakPolarHBondContact O-CB 3.32Å; F313-L317 PolarHBondContact O-N 2.88Å; S315-L317 VanDerWaalsContact C-N 3.26Å; S315-L317 PolarHBondContact O-N 3.35Å; L317-E320 PolarHBondContact O-N 3.25Å; L317-V321 HydrophobicContact CD1-CG2 4.18Å; L317-V321 HydrophobicContact CG-CG2 4.23Å; L317-V321 WeakPolarHBondContact O-CB 3.34Å; L317-V321 WeakPolarHBondContact O-CG2 3.2Å; L317-V321 PolarHBondContact O-N 3.4Å
318	E	93.5	Very high	88.9	Confident	37 Å²	37	50.8 Å²	50.8	17%	0.173	27%	0.266	C	S	.	.	H	α-helix	trans	-60.6	-45.2	174.8	-156.6	160.5	-142.2	0	0	111.4	F280 R284 L314 S315 E320 V321 Y322	F280-E318 HydrophobicContact CD1-CB 4.11Å; F280-E318 HydrophobicContact CD1-CG 3.74Å; F280-E318 HydrophobicContact CE1-CB 3.53Å; F280-E318 HydrophobicContact CE1-CG 3.66Å; F280-E318 HydrophobicContact CZ-CB 4.3Å; R284-E318 WeakPolarHBondContact CD-OE2 3.49Å; R284-E318 IonicContact CZ-OE2 3.39Å; R284-E318 IonicContact NE-OE2 2.63Å; R284-E318 PolarHBondContact NE-OE2 3.21Å; R284-E318 IonicContact NH1-OE1 2.66Å; R284-E318 PolarHBondContact NH1-OE1 3.42Å; R284-E318 IonicContact NH1-OE2 3.24Å; R284-E318 PolarHBondContact NH1-OE2 2.72Å; R284-E318 IonicContact NH2-OE2 3.08Å; L314-E318 WeakPolarHBondContact O-CB 3.1Å; L314-E318 PolarHBondContact O-N 3.48Å; L314-E318 VanDerWaalsContact O-N 3.11Å; S315-E318 VanDerWaalsContact O-CB 3.28Å; S315-E318 WeakPolarHBondContact O-CB 3.34Å; S315-E318 PolarHBondContact O-N 2.86Å; S315-E318 VanDerWaalsContact O-N 3.11Å; E318-E320 PolarHBondContact O-N 2.85Å; E318-V321 PolarHBondContact O-N 3.33Å; E318-Y322 HydrophobicContact CG-CD2 3.84Å; E318-Y322 HydrophobicContact CG-CE2 3.86Å; E318-Y322 VanDerWaalsContact O-CD2 3.3Å; E318-Y322 WeakPolarHBondContact O-CD2 3.08Å; E318-Y322 PolarHBondContact O-N 2.61Å
319	E	91.8	Very high	89.4	Confident	122 Å²	122	48.4 Å²	48.4	57%	0.57	25%	0.249	S	C	*	.	H	α-helix	trans	-55.3	-49.3	175.7	-69.1	167	-165.7	0	0	111.4	S315 Y322 S323	S315-E319 PolarHBondContact O-N 3Å; E319-Y322 PolarHBondContact O-N 3.32Å; E319-S323 WeakPolarHBondContact O-CA 3.47Å; E319-S323 WeakPolarHBondContact O-CB 3.43Å; E319-S323 PolarHBondContact O-N 3.48Å
320	E	92.6	Very high	89.6	Confident	15 Å²	15	46.7 Å²	46.7	7%	0.07	25%	0.248	C	C	.	.	H	α-helix	trans	-75.1	-27.1	-179.2	-60	-62.5	154.1	0	0	113.5	F192 K196 L317 E318 S326 I328 W329	F192-E320 HydrophobicContact CD2-CB 4.32Å; F192-E320 HydrophobicContact CD2-CG 3.97Å; F192-E320 HydrophobicContact CE2-CG 4.08Å; K196-E320 WeakPolarHBondContact CE-OE1 3.48Å; K196-E320 IonicContact NZ-OE1 3.96Å; K196-E320 PolarHBondContact NZ-OE1 2.88Å; L317-E320 PolarHBondContact O-N 3.25Å; E318-E320 PolarHBondContact O-N 2.85Å; E320-S326 VanDerWaalsContact O-CB 3.29Å; E320-S326 WeakPolarHBondContact O-CB 3.3Å; E320-S326 PolarHBondContact O-OG 3.21Å; E320-S326 WeakPolarHBondContact OE2-CB 3.28Å; E320-S326 PolarHBondContact OE2-OG 3.09Å; E320-I328 HydrophobicContact CB-CD1 3.67Å; E320-W329 PolarHBondContact O-NE1 2.8Å
321	V	92.1	Very high	89.1	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-66.8	-44.5	171.7	164.9	0	0	0	0	110.7	R273 L276 R277 F280 L317 E318 W329	R273-V321 PolarHBondContact NE-O 2.78Å; R273-V321 VanDerWaalsContact NE-O 3.12Å; R273-V321 PolarHBondContact NH2-O 3.38Å; L276-V321 HydrophobicContact CD2-CG2 3.62Å; L276-V321 HydrophobicContact CG-CG1 4.39Å; L276-V321 HydrophobicContact CG-CG2 4.08Å; R277-V321 HydrophobicContact CB-CG1 4.35Å; R277-V321 HydrophobicContact CG-CG1 3.68Å; R277-V321 WeakPolarHBondContact CG-O 3.18Å; R277-V321 PolarHBondContact NE-O 2.97Å; F280-V321 HydrophobicContact CB-CG1 4.32Å; F280-V321 HydrophobicContact CD2-CG2 4.06Å; F280-V321 HydrophobicContact CE2-CG2 4.19Å; F280-V321 HydrophobicContact CG-CG1 4.44Å; L317-V321 HydrophobicContact CD1-CG2 4.18Å; L317-V321 HydrophobicContact CG-CG2 4.23Å; L317-V321 WeakPolarHBondContact O-CB 3.34Å; L317-V321 WeakPolarHBondContact O-CG2 3.2Å; L317-V321 PolarHBondContact O-N 3.4Å; E318-V321 PolarHBondContact O-N 3.33Å; V321-W329 HydrophobicContact CG2-CZ2 4.01Å
322	Y	91.3	Very high	88.5	Confident	74 Å²	74	58.2 Å²	58.2	29%	0.29	30%	0.303	S	S	.	.	H	α-helix	trans	-91.2	-24.5	-176.2	-68.7	-70.6	0	0	0	114.8	R277 F280 T281 E318 E319 H324	R277-Y322 HydrophobicContact CB-CD1 4.47Å; R277-Y322 HydrophobicContact CB-CE1 3.99Å; R277-Y322 HydrophobicContact CG-CD1 4.18Å; R277-Y322 HydrophobicContact CG-CE1 4.17Å; R277-Y322 PolarHBondContact NH2-O 2.99Å; R277-Y322 WeakPolarHBondContact O-CE1 3.03Å; R277-Y322 PolarHBondContact O-OH 3.35Å; F280-Y322 HydrophobicContact CB-CE2 4.35Å; F280-Y322 HydrophobicContact CD1-CE2 4.48Å; T281-Y322 HydrophobicContact CG2-CE2 4.07Å; E318-Y322 HydrophobicContact CG-CD2 3.84Å; E318-Y322 HydrophobicContact CG-CE2 3.86Å; E318-Y322 VanDerWaalsContact O-CD2 3.3Å; E318-Y322 WeakPolarHBondContact O-CD2 3.08Å; E318-Y322 PolarHBondContact O-N 2.61Å; E319-Y322 PolarHBondContact O-N 3.32Å; Y322-H324 PolarHBondContact O-N 2.88Å
323	S	89.6	Confident	88.1	Confident	43 Å²	43	53 Å²	53	30%	0.301	28%	0.28	S	S	.	.			trans	-68.8	120.1	-178	177	0	0	0	0	113.6	R273 E319 S325 S326	R273-S323 PolarHBondContact NH2-O 3.37Å; E319-S323 WeakPolarHBondContact O-CA 3.47Å; E319-S323 WeakPolarHBondContact O-CB 3.43Å; E319-S323 PolarHBondContact O-N 3.48Å; S323-S325 PolarHBondContact O-N 3.32Å; S323-S325 VanDerWaalsContact O-N 3.16Å; S323-S325 PolarHBondContact OG-OG 3.03Å; S323-S326 WeakPolarHBondContact O-CB 3.33Å; S323-S326 PolarHBondContact O-N 2.97Å
324	H	79	Confident	86.9	Confident	160 Å²	160	59.6 Å²	59.6	74%	0.741	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.4	-178.3	-63.6	104.6	0	0	0	114.1	R277 Y322	R277-H324 PolarHBondContact NH2-CD2 2.92Å; R277-H324 PolarHBondContact NH2-NE2 3.37Å; Y322-H324 PolarHBondContact O-N 2.88Å
325	S	82.4	Confident	85.2	Confident	107 Å²	107	64.4 Å²	64.4	75%	0.748	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	8.4	179.3	54.8	0	0	0	0	114.8	S323 P327	S323-S325 PolarHBondContact O-N 3.32Å; S323-S325 VanDerWaalsContact O-N 3.16Å; S323-S325 PolarHBondContact OG-OG 3.03Å; S325-P327 WeakPolarHBondContact O-CD 3.24Å
326	S	88.6	Confident	83.2	Confident	9 Å²	9	65.9 Å²	65.9	6%	0.063	36%	0.364	C	S	.	.			trans	-66.5	121.8	-177.2	-179.1	0	0	0	0	112.8	E320 S323 I328	E320-S326 VanDerWaalsContact O-CB 3.29Å; E320-S326 WeakPolarHBondContact O-CB 3.3Å; E320-S326 PolarHBondContact O-OG 3.21Å; E320-S326 WeakPolarHBondContact OE2-CB 3.28Å; E320-S326 PolarHBondContact OE2-OG 3.09Å; S323-S326 WeakPolarHBondContact O-CB 3.33Å; S323-S326 PolarHBondContact O-N 2.97Å; S326-I328 VanDerWaalsContact C-N 3.31Å; S326-I328 PolarHBondContact O-N 2.98Å; S326-I328 WeakPolarHBondContact OG-CG1 3.45Å
327	P	88.3	Confident	80.5	Confident	42 Å²	42	67.1 Å²	67.1	27%	0.273	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-76.8	-14	-176.1	31.7	-36.3	0	0	0	113.7	Y195 S325 W329 S330 F333	Y195-P327 HydrophobicContact CD1-CG 4.28Å; Y195-P327 HydrophobicContact CD2-CG 4.36Å; Y195-P327 HydrophobicContact CE1-CG 3.84Å; Y195-P327 HydrophobicContact CE2-CG 3.94Å; S325-P327 WeakPolarHBondContact O-CD 3.24Å; P327-W329 PolarHBondContact O-N 3.18Å; P327-W329 VanDerWaalsContact O-N 3.12Å; P327-S330 WeakPolarHBondContact O-CB 3.43Å; P327-S330 PolarHBondContact O-N 3.46Å; P327-S330 VanDerWaalsContact O-N 3.13Å; P327-S330 PolarHBondContact O-OG 2.85Å; P327-F333 WeakPolarHBondContact O-CD2 3.46Å
328	I	90.8	Very high	77.7	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-66.5	-17.6	-174.4	76.3	177.5	0	0	0	112.8	N191 F192 Y195 E320 S326	N191-I328 HydrophobicContact CB-CB 3.86Å; N191-I328 HydrophobicContact CB-CG2 4.46Å; N191-I328 PolarHBondContact ND2-O 3.12Å; F192-I328 HydrophobicContact CB-CD1 3.84Å; F192-I328 HydrophobicContact CB-CG2 4.37Å; F192-I328 HydrophobicContact CD2-CD1 4.48Å; Y195-I328 HydrophobicContact CD1-CG2 3.8Å; Y195-I328 HydrophobicContact CG-CG2 4.21Å; E320-I328 HydrophobicContact CB-CD1 3.67Å; S326-I328 VanDerWaalsContact C-N 3.31Å; S326-I328 PolarHBondContact O-N 2.98Å; S326-I328 WeakPolarHBondContact OG-CG1 3.45Å
329	W	90.4	Very high	75	Confident	24 Å²	24	76 Å²	76	9%	0.091	46%	0.46	C	S	.	.	G	3₁₀ helix	trans	-98.7	2.7	-179.7	-56	105.8	0	0	0	113.6	P183 R273 L276 E320 V321 P327	P183-W329 WeakPolarHBondContact CD-O 3.48Å; P183-W329 HydrophobicContact CG-CE3 4.36Å; P183-W329 VanDerWaalsContact CG-O 3.25Å; P183-W329 WeakPolarHBondContact CG-O 3.12Å; R273-W329 HydrophobicContact CB-CD2 3.78Å; R273-W329 HydrophobicContact CB-CE3 3.64Å; R273-W329 HydrophobicContact CB-CG 4.3Å; R273-W329 HydrophobicContact CB-CZ3 4.04Å; R273-W329 HydrophobicContact CG-CD2 3.7Å; R273-W329 HydrophobicContact CG-CE3 4.09Å; R273-W329 HydrophobicContact CG-CG 4Å; R273-W329 HydrophobicContact CG-CZ2 4.32Å; L276-W329 HydrophobicContact CD2-CH2 3.66Å; L276-W329 HydrophobicContact CD2-CZ2 3.98Å; E320-W329 PolarHBondContact O-NE1 2.8Å; V321-W329 HydrophobicContact CG2-CZ2 4.01Å; P327-W329 PolarHBondContact O-N 3.18Å; P327-W329 VanDerWaalsContact O-N 3.12Å
330	S	85	Confident	72	Confident	59 Å²	59	72.6 Å²	72.6	41%	0.413	46%	0.458	S	S	.	.			trans	-72.1	145.9	170	-60.4	0	0	0	0	110.6	P327	P327-S330 WeakPolarHBondContact O-CB 3.43Å; P327-S330 PolarHBondContact O-N 3.46Å; P327-S330 VanDerWaalsContact O-N 3.13Å; P327-S330 PolarHBondContact O-OG 2.85Å
331	Q	78	Confident	69.1	Low	142 Å²	142	81.4 Å²	81.4	66%	0.664	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-38.6	172.7	-65.6	-173.5	9.5	0	0	110.6	K182 F333	K182-Q331 PolarHBondContact O-NE2 2.82Å; Q331-F333 PolarHBondContact O-N 3.3Å; Q331-F333 VanDerWaalsContact O-N 3.08Å
332	D	76.5	Confident	66.1	Low	145 Å²	145	88.5 Å²	88.5	78%	0.775	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	43.6	177.6	-45.4	-76	0	0	0	113.2	L334	D332-L334 PolarHBondContact O-N 3.36Å
333	F	80.3	Confident	63.1	Low	37 Å²	37	90.4 Å²	90.4	16%	0.162	56%	0.557	C	S	.	*			trans	-69.5	96	-179.5	179.1	-99.2	0	0	0	111.5	N191 Q194 P327 Q331 V335	N191-F333 HydrophobicContact CB-CD1 3.84Å; N191-F333 HydrophobicContact CB-CD2 4.28Å; N191-F333 HydrophobicContact CB-CE1 3.83Å; N191-F333 HydrophobicContact CB-CE2 4.27Å; N191-F333 HydrophobicContact CB-CG 4.08Å; N191-F333 HydrophobicContact CB-CZ 4.05Å; N191-F333 WeakPolarHBondContact O-CZ 3.49Å; N191-F333 WeakPolarHBondContact OD1-CD1 3.48Å; Q194-F333 HydrophobicContact CB-CE1 4.29Å; P327-F333 WeakPolarHBondContact O-CD2 3.46Å; Q331-F333 PolarHBondContact O-N 3.3Å; Q331-F333 VanDerWaalsContact O-N 3.08Å; F333-V335 HydrophobicContact CD1-CG2 4.44Å; F333-V335 HydrophobicContact CE1-CG2 3.66Å; F333-V335 HydrophobicContact CZ-CG2 4.09Å
334	L	66	Low	60.5	Low	140 Å²	140	95 Å²	95	73%	0.733	58%	0.582	S	S	*	*			trans	-104.8	119.7	178.3	-68.3	175.5	0	0	0	112	D332 G336	D332-L334 PolarHBondContact O-N 3.36Å; L334-G336 VanDerWaalsContact C-N 3.29Å; L334-G336 PolarHBondContact O-N 2.88Å
335	V	55.3	Low	58	Low	101 Å²	101	94.8 Å²	94.8	61%	0.612	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	79.5	173.3	-174.4	0	0	0	0	109.8	Q194 F333	Q194-V335 HydrophobicContact CB-CG2 4.37Å; F333-V335 HydrophobicContact CD1-CG2 4.44Å; F333-V335 HydrophobicContact CE1-CG2 3.66Å; F333-V335 HydrophobicContact CZ-CG2 4.09Å
336	G	50.4	Low	55.4	Low	66 Å²	66	95 Å²	95	68%	0.68	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	176.8	-14.7	176.4	0	0	0	0	0	117.2	L334 T338	L334-G336 VanDerWaalsContact C-N 3.29Å; L334-G336 PolarHBondContact O-N 2.88Å; G336-T338 VanDerWaalsContact C-N 3.34Å; G336-T338 PolarHBondContact O-N 3.48Å
337	A	34.8	Very low	52.5	Low	87 Å²	87	101.7 Å²	101.7	72%	0.719	62%	0.618	S	S	*	*	S	Bend	trans	-86.2	41.3	-166.4	0	0	0	0	0	116.7
338	T	34.9	Very low	49.9	Very low	131 Å²	131	107 Å²	107	80%	0.804	64%	0.643	S	S	*	*			trans	-158.6	75.1	156.7	27	0	0	0	0	110.7	G336 G340	G336-T338 VanDerWaalsContact C-N 3.34Å; G336-T338 PolarHBondContact O-N 3.48Å; T338-G340 PolarHBondContact O-N 3.17Å
339	G	36.6	Very low	46.7	Very low	93 Å²	93	112.7 Å²	112.7	96%	0.959	68%	0.683	S	S	*	*			trans	-75.2	61.6	158.3	0	0	0	0	0	110.6
340	G	28.8	Very low	43.6	Very low	50 Å²	50	115.7 Å²	115.7	52%	0.515	71%	0.713	S	S	.	*	S	Bend	trans	-149.9	136.5	-172.1	0	0	0	0	0	111.3	T338 I342	T338-G340 PolarHBondContact O-N 3.17Å; G340-I342 PolarHBondContact O-N 2.88Å
341	Q	32.6	Very low	40.9	Very low	199 Å²	199	118.8 Å²	118.8	93%	0.93	73%	0.732	S	S	*	*			trans	-60	128	-167.9	-63.7	170.3	-9.6	0	0	113.1
342	I	29.5	Very low	38.4	Very low	150 Å²	150	117.9 Å²	117.9	77%	0.769	74%	0.738	S	S	*	*			trans	-105.4	127.3	157.8	-61.4	-179.7	0	0	0	107	G340 V344	G340-I342 PolarHBondContact O-N 2.88Å; I342-V344 PolarHBondContact O-N 3.41Å
343	P	26.8	Very low	36.2	Very low	114 Å²	114	117.7 Å²	117.7	74%	0.74	74%	0.742	S	S	*	*			trans	-65	123.3	-174.1	-23.4	34.1	0	0	0	113.3	H345	P343-H345 PolarHBondContact O-N 3.33Å
344	V	36	Very low	33.5	Very low	138 Å²	138	120.5 Å²	120.5	84%	0.836	77%	0.772	S	S	*	*			trans	-82.2	97.3	166.3	177.8	0	0	0	0	108.3	I342	I342-V344 PolarHBondContact O-N 3.41Å
345	H	26.6	Very low	31.5	Very low	157 Å²	157	125.1 Å²	125.1	73%	0.727	78%	0.779	S	S	*	*			trans	-141.3	113.5	168.2	-106.9	-81.4	0	0	0	114.1	P343	P343-H345 PolarHBondContact O-N 3.33Å
346	T	27.3	Very low	30.4	Very low	110 Å²	110	125.3 Å²	125.3	68%	0.675	78%	0.783	S	S	*	*			trans	52.3	100.2	147.3	48.1	0	0	0	0	120.2
347	V	27.7	Very low	29	Very low	150 Å²	150	130 Å²	130	91%	0.909	79%	0.79	S	S	*	*	S	Bend	trans	-128.7	47.6	145.7	-163.2	0	0	0	0	110.9
348	I	33.3	Very low	28.4	Very low	155 Å²	155	134.9 Å²	134.9	80%	0.795	79%	0.792	S	S	*	*			trans	-142.2	104.1	160.3	-53.9	-179.9	0	0	0	108.8
349	S	24	Very low	27.8	Very low	118 Å²	118	140 Å²	140	83%	0.825	80%	0.798	S	S	*	*			trans	-170.7	145.6	155.2	-83.2	0	0	0	0	109
350	A	25.7	Very low	27	Very low	88 Å²	88	140 Å²	140	73%	0.727	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-85.8	151.8	178.7	0	0	0	0	0	111.4
351	P	27.4	Very low	26.7	Very low	124 Å²	124	144.3 Å²	144.3	81%	0.805	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-71.6	129	171.9	29.6	-33.2	0	0	0	110.7
352	P	26.5	Very low	26.2	Very low	122 Å²	122	140.1 Å²	140.1	79%	0.792	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-78.1	164.8	172.3	33	-34.6	0	0	0	112
353	V	30.4	Very low	26.1	Very low	142 Å²	142	138.3 Å²	138.3	86%	0.861	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-72.5	134.4	179.5	178.4	0	0	0	0	111.2
354	A	23.6	Very low	25.8	Very low	96 Å²	96	140.7 Å²	140.7	79%	0.793	79%	0.793	S	S	*	*			trans	-121.5	135.9	161.6	0	0	0	0	0	110
355	R	23	Very low	25.2	Very low	237 Å²	237	139.1 Å²	139.1	89%	0.894	79%	0.789	S	S	*	*			trans	-125.3	164.9	173	-107	-161.1	170.6	-173.5	-1.8	109.6
356	P	32.9	Very low	25.2	Very low	105 Å²	105	136.7 Å²	136.7	68%	0.682	78%	0.784	S	S	*	*			trans	-94.5	163.9	-132.8	36.3	-39.4	0	0	0	114.6
357	I	21.2	Very low	25	Very low	164 Å²	164	137.3 Å²	137.3	84%	0.841	78%	0.784	S	S	*	*			trans	-119.3	142.4	157.4	-68.1	-178.9	0	0	0	108.4
358	Y	21.7	Very low	24.9	Very low	190 Å²	190	137.9 Å²	137.9	75%	0.745	78%	0.776	S	S	*	*			trans	-74.3	157.2	-176.1	-67.8	-109.6	0	0	0	112
359	Y	22	Very low	24.4	Very low	238 Å²	238	135.9 Å²	135.9	93%	0.933	78%	0.776	S	S	*	*				-147.4	142	118	-108.1	-74.5	0	0	0	110.2
360	S	20.7	Very low	24.4	Very low	92 Å²	92	137.4 Å²	137.4	64%	0.643	78%	0.781	S	S	*	*			trans	-102	144.2	-176.8	-55.7	0	0	0	0	111.2
361	T	21.6	Very low	24.3	Very low	142 Å²	142	139.7 Å²	139.7	87%	0.871	79%	0.79	S	S	*	*			trans	-162.6	126.3	136.8	26.5	0	0	0	0	111.2
362	S	21.3	Very low	24.1	Very low	111 Å²	111	136.4 Å²	136.4	78%	0.776	78%	0.779	S	S	*	*			trans	-119.5	163.7	146.9	-50	0	0	0	0	106.1
363	P	28.1	Very low	23.9	Very low	111 Å²	111	136.6 Å²	136.6	72%	0.721	78%	0.783	S	S	*	*				-153.8	148.3	85.6	36.5	-16.9	0	0	0	117.6
364	M	21.5	Very low	23.7	Very low	164 Å²	164	136 Å²	136	81%	0.808	78%	0.779	S	S	*	*			trans	67.4	158.1	141.9	-63.1	-178.8	85.5	0	0	118	V366	M364-V366 HydrophobicContact CE-CG2 4.12Å
365	S	23.3	Very low	23.8	Very low	105 Å²	105	136.6 Å²	136.6	73%	0.734	78%	0.778	S	S	*	*			cis	-144.4	147.1	30.7	-44.5	0	0	0	0	113
366	V	25.9	Very low	24.3	Very low	106 Å²	106	131.7 Å²	131.7	64%	0.642	78%	0.776	S	S	*	*				62.1	124.7	101.8	177	0	0	0	0	113.5	M364	M364-V366 HydrophobicContact CE-CG2 4.12Å
367	D	23.1	Very low	23.8	Very low	123 Å²	123	131.1 Å²	131.1	66%	0.658	78%	0.781	S	S	*	*			cis	-158.6	149.5	-3.2	-116	-8.6	0	0	0	108.9
368	Q	24.7	Very low	24	Very low	162 Å²	162	135.3 Å²	135.3	76%	0.757	79%	0.786	S	S	*	*				80.8	114	70.3	-165.4	-162.9	136.1	0	0	115.9
369	S	24.2	Very low	24	Very low	113 Å²	113	135.7 Å²	135.7	79%	0.79	79%	0.792	S	S	*	*				177	141.9	128.3	42.1	0	0	0	0	112.2
370	T	24.2	Very low	25.2	Very low	151 Å²	151	129.9 Å²	129.9	93%	0.926	78%	0.783	S	S	*	*			trans	-144.5	142	171	30.4	0	0	0	0	110.3
371	C	22.9	Very low	25.2	Very low	135 Å²	135	130 Å²	130	91%	0.912	79%	0.789	S	S	*	*			trans	-157.8	145.5	174.7	-173	0	0	0	0	108.1
372	G	22.3	Very low	25.3	Very low	56 Å²	56	128.1 Å²	128.1	58%	0.577	78%	0.782	S	S	*	*			cis	150.1	98.9	-6.7	0	0	0	0	0	111.7
373	S	24.2	Very low	25.4	Very low	125 Å²	125	128.7 Å²	128.7	87%	0.874	78%	0.781	S	S	*	*			trans	62.8	176.2	-179.5	-60.9	0	0	0	0	113
374	V	25.4	Very low	25.2	Very low	130 Å²	130	130 Å²	130	79%	0.788	78%	0.781	S	S	*	*			cis	-145.9	149.3	27.1	170.2	0	0	0	0	111.4
375	S	26.2	Very low	25.2	Very low	109 Å²	109	130.2 Å²	130.2	76%	0.762	78%	0.78	S	S	*	*			trans	-99.4	155	168.5	-52.3	0	0	0	0	111.5
376	P	32.2	Very low	25.1	Very low	133 Å²	133	130.5 Å²	130.5	86%	0.864	78%	0.782	S	S	*	*				-141.5	172.5	120.6	35.3	-20.8	0	0	0	114.4
377	A	23.5	Very low	25	Very low	93 Å²	93	132.6 Å²	132.6	77%	0.769	79%	0.789	S	S	*	*			trans	-112.9	166.1	-172.6	0	0	0	0	0	113.7
378	R	23.9	Very low	25.8	Very low	252 Å²	252	132 Å²	132	95%	0.951	79%	0.793	S	S	*	*			trans	-160.4	164	146.6	-110.7	166.3	-170.5	-165.6	1.5	113.2
379	K	22.7	Very low	25.8	Very low	199 Å²	199	131.1 Å²	131.1	87%	0.865	80%	0.798	S	S	*	*			trans	-154.5	173.3	-174.8	-100.4	-170.5	-178.7	-175.9	0	106.4
380	P	46.8	Very low	25.9	Very low	115 Å²	115	129.1 Å²	129.1	75%	0.747	79%	0.794	S	S	*	*			cis	-135	-145.5	-23.4	38.5	-17.3	0	0	0	111.3
381	A	21.7	Very low	25.9	Very low	95 Å²	95	129 Å²	129	79%	0.785	78%	0.783	S	S	*	*			trans	77	152.4	160.8	0	0	0	0	0	118.3
382	S	22.2	Very low	25.9	Very low	102 Å²	102	129.8 Å²	129.8	71%	0.713	77%	0.772	S	S	*	*			cis	-161.9	136.3	-15.4	42.4	0	0	0	0	110.6
383	V	24.4	Very low	25.9	Very low	124 Å²	124	137.9 Å²	137.9	75%	0.752	78%	0.784	S	S	*	*				58.8	121.8	100.7	-165.3	0	0	0	0	117.4
384	L	24.1	Very low	25.9	Very low	138 Å²	138	142 Å²	142	72%	0.723	79%	0.787	S	S	*	*			trans	167.1	124.2	130.4	-104.9	92.7	0	0	0	108.2
385	E	21.6	Very low	25.8	Very low	169 Å²	169	140.9 Å²	140.9	79%	0.79	79%	0.792	S	S	*	*				76.7	149.1	87	-71.6	-177.3	-163.4	0	0	114.7
386	S	21.7	Very low	25.7	Very low	110 Å²	110	141.4 Å²	141.4	77%	0.769	80%	0.795	S	S	*	*			cis	-148.8	165.8	8.7	62.9	0	0	0	0	114.5
387	N	22.8	Very low	25.3	Very low	150 Å²	150	143.3 Å²	143.3	80%	0.802	79%	0.792	S	S	*	*			trans	-85.5	-168.3	163.8	-94.3	-25.3	0	0	0	110.8
388	P	39.9	Very low	25.3	Very low	112 Å²	112	145 Å²	145	73%	0.727	80%	0.795	S	S	*	*			cis	-118.6	-152.1	-3	20.6	7	0	0	0	111.9
389	V	26.1	Very low	25.4	Very low	143 Å²	143	140.5 Å²	140.5	87%	0.867	79%	0.789	S	S	*	*			cis	-154.8	-171.7	15.1	-140.6	0	0	0	0	110.1
390	G	24.9	Very low	25.5	Very low	70 Å²	70	139.2 Å²	139.2	72%	0.722	79%	0.786	S	S	*	*			trans	147.3	12.4	146	0	0	0	0	0	124.7
391	E	24.2	Very low	24.6	Very low	148 Å²	148	142.8 Å²	142.8	69%	0.692	79%	0.792	S	S	*	*			trans	39.6	137.4	162.4	-68.1	-148.6	116.7	0	0	125
392	K	22.6	Very low	24.7	Very low	153 Å²	153	143.8 Å²	143.8	67%	0.665	78%	0.781	S	S	*	*			trans	64.3	125.2	145.8	-68.4	161	-172.7	152.6	0	117.7
393	R	23.7	Very low	24.9	Very low	225 Å²	225	147.2 Å²	147.2	85%	0.849	79%	0.786	S	S	*	*			cis	-170.7	155.6	33	-116.6	163.3	179.2	170.1	-0.9	111.7
394	K	22.6	Very low	25	Very low	211 Å²	211	146.7 Å²	146.7	92%	0.917	79%	0.788	S	S	*	*			trans	54.4	109.6	160.3	-73.7	-170.9	171.8	-173.5	0	119.4
395	A	23.8	Very low	25.6	Very low	108 Å²	108	147.3 Å²	147.3	89%	0.893	78%	0.784	S	S	*	*			trans	-125.7	145.1	139.4	0	0	0	0	0	108.2
396	S	23.7	Very low	26.2	Very low	120 Å²	120	149.6 Å²	149.6	84%	0.839	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-98	162	178.9	48.5	0	0	0	0	112.2
397	E	23.7	Very low	26.8	Very low	172 Å²	172	150.1 Å²	150.1	80%	0.804	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-59.6	142.3	-169.4	-56	169.1	129.5	0	0	114.9
398	P	25.3	Very low	27.3	Very low	128 Å²	128	154.1 Å²	154.1	83%	0.831	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-80.4	126.6	145.4	5.9	13	0	0	0	109.2
399	L	24.8	Very low	27.1	Very low	158 Å²	158	153.5 Å²	153.5	83%	0.827	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-66.7	151.9	-177.3	-75.8	154.5	0	0	0	113.4	H401	L399-H401 PolarHBondContact O-N 3.21Å
400	H	26.1	Very low	27.4	Very low	173 Å²	173	154.2 Å²	154.2	80%	0.801	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-50.2	131.2	167.9	-103.5	-112.4	0	0	0	111.8
401	H	26.2	Very low	28.6	Very low	189 Å²	189	154.3 Å²	154.3	88%	0.875	79%	0.79	S	S	*	*			trans	-110.7	111.9	155.3	-122.8	-71.8	0	0	0	108.5	L399 E403	L399-H401 PolarHBondContact O-N 3.21Å; H401-E403 PolarHBondContact O-N 3.45Å
402	E	24.2	Very low	30.2	Very low	116 Å²	116	152.4 Å²	152.4	54%	0.542	78%	0.784	S	S	.	*			trans	-59.7	120.4	-178.8	-94.3	-84.7	106.7	0	0	111.3	S404 K405	E402-S404 PolarHBondContact O-N 2.71Å; E402-K405 VanDerWaalsContact CD-NZ 3.26Å; E402-K405 IonicContact OE1-NZ 2.74Å; E402-K405 PolarHBondContact OE1-NZ 3.19Å; E402-K405 IonicContact OE2-NZ 3.52Å; E402-K405 PolarHBondContact OE2-NZ 3.31Å
403	E	26.1	Very low	32.1	Very low	174 Å²	174	149 Å²	149	81%	0.813	77%	0.772	S	S	*	*			trans	-58.5	112.5	157.7	-74.7	-162.4	130.6	0	0	108.4	H401 K405	H401-E403 PolarHBondContact O-N 3.45Å; E403-K405 VanDerWaalsContact C-N 3.3Å; E403-K405 PolarHBondContact O-N 3Å
404	S	27.9	Very low	34.5	Very low	113 Å²	113	142 Å²	142	79%	0.79	76%	0.756	S	S	*	*			trans	-69.2	87.1	-177.6	-69.8	0	0	0	0	111	E402 R406	E402-S404 PolarHBondContact O-N 2.71Å; S404-R406 PolarHBondContact O-N 3.01Å
405	K	36.7	Very low	36.5	Very low	151 Å²	151	137.8 Å²	137.8	66%	0.657	74%	0.741	S	S	*	*			trans	-48.3	110.3	177.9	-67.8	148.3	-165.3	138	0	109.8	E402 E403	E402-K405 VanDerWaalsContact CD-NZ 3.26Å; E402-K405 IonicContact OE1-NZ 2.74Å; E402-K405 PolarHBondContact OE1-NZ 3.19Å; E402-K405 IonicContact OE2-NZ 3.52Å; E402-K405 PolarHBondContact OE2-NZ 3.31Å; E403-K405 VanDerWaalsContact C-N 3.3Å; E403-K405 PolarHBondContact O-N 3Å
406	R	32.9	Very low	38.7	Very low	218 Å²	218	138.6 Å²	138.6	82%	0.823	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-56.1	133.8	173.1	-66.4	-178	-178.2	174.5	2	108.9	S404 R408	S404-R406 PolarHBondContact O-N 3.01Å; R406-R408 PolarHBondContact O-N 3.47Å; R406-R408 VanDerWaalsContact O-N 3.12Å
407	P	34.2	Very low	40.8	Very low	121 Å²	121	135.3 Å²	135.3	79%	0.786	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-58.3	119.1	174.1	-23.5	33.6	0	0	0	110.1	V409	P407-V409 PolarHBondContact O-N 2.85Å
408	R	33.7	Very low	43	Very low	234 Å²	234	129.2 Å²	129.2	88%	0.883	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-63	127.6	173.1	-70.2	-177.9	177.8	174.8	-1.3	108.5	R406	R406-R408 PolarHBondContact O-N 3.47Å; R406-R408 VanDerWaalsContact O-N 3.12Å
409	V	35.7	Very low	45.2	Very low	99 Å²	99	127.4 Å²	127.4	60%	0.6	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-88.4	129.5	-178.3	180	0	0	0	0	108.1	P407 G411 D412	P407-V409 PolarHBondContact O-N 2.85Å; V409-G411 PolarHBondContact O-N 2.77Å; V409-D412 PolarHBondContact N-OD2 3.46Å; V409-D412 VanDerWaalsContact O-CG 3.32Å; V409-D412 PolarHBondContact O-N 2.73Å; V409-D412 VanDerWaalsContact O-N 3.11Å
410	V	32.3	Very low	47.3	Very low	158 Å²	158	124.1 Å²	124.1	96%	0.958	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	98.6	178.3	-179.4	0	0	0	0	108.8
411	G	51.3	Low	49.3	Very low	72 Å²	72	116.1 Å²	116.1	74%	0.742	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	140	-7.8	-172.7	0	0	0	0	0	115	V409 I413	V409-G411 PolarHBondContact O-N 2.77Å; G411-I413 PolarHBondContact O-N 3.3Å
412	D	56.3	Low	51.2	Low	107 Å²	107	110.1 Å²	110.1	57%	0.572	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-55.9	133.1	177	-69.9	-32.6	0	0	0	112.2	V409	V409-D412 PolarHBondContact N-OD2 3.46Å; V409-D412 VanDerWaalsContact O-CG 3.32Å; V409-D412 PolarHBondContact O-N 2.73Å; V409-D412 VanDerWaalsContact O-N 3.11Å
413	I	62.3	Low	53.4	Low	81 Å²	81	107.7 Å²	107.7	42%	0.415	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-77.3	132.5	178.4	-62.5	143.8	0	0	0	108.5	G411 M415 L417 I418 L635	G411-I413 PolarHBondContact O-N 3.3Å; I413-M415 PolarHBondContact O-N 2.84Å; I413-L417 HydrophobicContact CG2-CD2 4.13Å; I413-L417 HydrophobicContact CG2-CG 4.44Å; I413-I418 HydrophobicContact CB-CD1 4.38Å; I413-I418 HydrophobicContact CB-CG1 4.49Å; I413-I418 HydrophobicContact CG2-CD1 4.32Å; I413-I418 HydrophobicContact CG2-CG1 3.9Å; I413-L635 HydrophobicContact CD1-CD1 3.82Å; I413-L635 HydrophobicContact CG2-CD1 4.16Å; I413-L635 HydrophobicContact CG2-CD2 4.34Å
414	P	74.4	Confident	55.3	Low	78 Å²	78	102.5 Å²	102.5	51%	0.506	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-55.5	133.8	178.9	-26.9	35.2	0	0	0	112.5	D416 L417 I418	P414-D416 PolarHBondContact O-N 2.83Å; P414-L417 HydrophobicContact CB-CB 4.41Å; P414-L417 WeakPolarHBondContact O-CB 3.27Å; P414-L417 PolarHBondContact O-N 3.46Å; P414-I418 PolarHBondContact O-N 3.31Å
415	M	65.6	Low	57	Low	124 Å²	124	99 Å²	99	61%	0.611	53%	0.528	S	S	*	.	H	α-helix	trans	-57	-34.6	179.1	-77.5	-67.1	-66.1	0	0	112	I413 L417 I418 N419	I413-M415 PolarHBondContact O-N 2.84Å; M415-L417 VanDerWaalsContact C-N 3.32Å; M415-L417 PolarHBondContact O-N 2.85Å; M415-I418 WeakPolarHBondContact O-CB 3.48Å; M415-I418 PolarHBondContact O-N 3.23Å; M415-I418 VanDerWaalsContact O-N 3.12Å; M415-I418 HydrophobicContact SD-CD1 4.23Å; M415-N419 WeakPolarHBondContact O-CB 3.41Å; M415-N419 PolarHBondContact O-N 3.17Å; M415-N419 PolarHBondContact O-ND2 3.04Å
416	D	68.7	Low	58.1	Low	124 Å²	124	96.1 Å²	96.1	66%	0.663	53%	0.526	S	S	*	.	H	α-helix	trans	-63.9	-37.9	178.9	-44.9	-65.6	0	0	0	112	P414 N419 E420	P414-D416 PolarHBondContact O-N 2.83Å; D416-N419 PolarHBondContact O-N 3.14Å; D416-E420 WeakPolarHBondContact O-CB 3.34Å; D416-E420 PolarHBondContact O-N 2.77Å
417	L	68.4	Low	59.1	Low	52 Å²	52	89.3 Å²	89.3	27%	0.272	51%	0.507	S	S	.	.	H	α-helix	trans	-71.8	-31.1	174.5	179.2	59.7	0	0	0	111.8	I413 P414 M415 E420 V421 L635 R638	I413-L417 HydrophobicContact CG2-CD2 4.13Å; I413-L417 HydrophobicContact CG2-CG 4.44Å; P414-L417 HydrophobicContact CB-CB 4.41Å; P414-L417 WeakPolarHBondContact O-CB 3.27Å; P414-L417 PolarHBondContact O-N 3.46Å; M415-L417 VanDerWaalsContact C-N 3.32Å; M415-L417 PolarHBondContact O-N 2.85Å; L417-E420 WeakPolarHBondContact CD1-OE2 3.35Å; L417-V421 HydrophobicContact CD1-CG2 4.35Å; L417-V421 WeakPolarHBondContact O-CB 3.23Å; L417-V421 VanDerWaalsContact O-CG2 3.24Å; L417-V421 WeakPolarHBondContact O-CG2 3.2Å; L417-V421 PolarHBondContact O-N 3.01Å; L417-V421 VanDerWaalsContact O-N 3.1Å; L417-L635 HydrophobicContact CD1-CD2 4.44Å; L417-L635 HydrophobicContact CD2-CD2 3.92Å; L417-L635 HydrophobicContact CG-CD2 3.87Å; L417-R638 VanDerWaalsContact CD1-NH1 3.3Å
418	I	69.3	Low	59.8	Low	43 Å²	43	88.9 Å²	88.9	22%	0.221	50%	0.504	C	S	.	.	H	α-helix	trans	-68.3	-43.4	171.4	-60.9	174.3	0	0	0	109.9	I413 P414 M415 V421 M422 I631	I413-I418 HydrophobicContact CB-CD1 4.38Å; I413-I418 HydrophobicContact CB-CG1 4.49Å; I413-I418 HydrophobicContact CG2-CD1 4.32Å; I413-I418 HydrophobicContact CG2-CG1 3.9Å; P414-I418 PolarHBondContact O-N 3.31Å; M415-I418 WeakPolarHBondContact O-CB 3.48Å; M415-I418 PolarHBondContact O-N 3.23Å; M415-I418 VanDerWaalsContact O-N 3.12Å; M415-I418 HydrophobicContact SD-CD1 4.23Å; I418-V421 PolarHBondContact O-N 3.38Å; I418-M422 HydrophobicContact CG2-CG 4.38Å; I418-M422 VanDerWaalsContact O-CB 3.3Å; I418-M422 WeakPolarHBondContact O-CB 3.48Å; I418-M422 VanDerWaalsContact O-CG 3.24Å; I418-M422 WeakPolarHBondContact O-CG 3.43Å; I418-M422 PolarHBondContact O-N 2.9Å; I418-I631 HydrophobicContact CG2-CG2 4.48Å
419	N	71.6	Confident	60.4	Low	91 Å²	91	82.1 Å²	82.1	49%	0.487	50%	0.498	S	S	.	.	H	α-helix	trans	-64.2	-43.9	178.1	-67.5	-23.1	0	0	0	111.7	M415 D416 M422 A423	M415-N419 WeakPolarHBondContact O-CB 3.41Å; M415-N419 PolarHBondContact O-N 3.17Å; M415-N419 PolarHBondContact O-ND2 3.04Å; D416-N419 PolarHBondContact O-N 3.14Å; N419-M422 PolarHBondContact O-N 2.89Å; N419-A423 PolarHBondContact O-N 3.35Å
420	E	69.3	Low	60.8	Low	89 Å²	89	80.6 Å²	80.6	42%	0.416	49%	0.489	S	S	.	.	H	α-helix	trans	-58.7	-49.8	174	-169.6	-157.7	166.6	0	0	111.3	D416 L417 M422 A423 T424 R638	D416-E420 WeakPolarHBondContact O-CB 3.34Å; D416-E420 PolarHBondContact O-N 2.77Å; L417-E420 WeakPolarHBondContact CD1-OE2 3.35Å; E420-M422 VanDerWaalsContact C-N 3.32Å; E420-M422 PolarHBondContact O-N 3.41Å; E420-A423 WeakPolarHBondContact O-CB 3.44Å; E420-A423 PolarHBondContact O-N 2.86Å; E420-T424 PolarHBondContact O-N 3.21Å; E420-T424 PolarHBondContact O-OG1 2.94Å; E420-R638 IonicContact OE1-CZ 2.81Å; E420-R638 VanDerWaalsContact OE1-CZ 3.31Å; E420-R638 IonicContact OE1-NH1 3.69Å; E420-R638 PolarHBondContact OE1-NH1 3.3Å; E420-R638 IonicContact OE1-NH2 3.11Å; E420-R638 PolarHBondContact OE1-NH2 3.09Å; E420-R638 IonicContact OE2-CZ 3.62Å; E420-R638 IonicContact OE2-NH1 2.64Å; E420-R638 PolarHBondContact OE2-NH1 3.01Å; E420-R638 IonicContact OE2-NH2 2.62Å; E420-R638 PolarHBondContact OE2-NH2 3.49Å
421	V	67.9	Low	61.4	Low	4 Å²	4	78.7 Å²	78.7	2%	0.024	47%	0.472	C	S	.	.	H	α-helix	trans	-64.1	-36.4	178	167.6	0	0	0	0	111.8	L417 I418 T424 I425 I631 K634 L635	L417-V421 HydrophobicContact CD1-CG2 4.35Å; L417-V421 WeakPolarHBondContact O-CB 3.23Å; L417-V421 VanDerWaalsContact O-CG2 3.24Å; L417-V421 WeakPolarHBondContact O-CG2 3.2Å; L417-V421 PolarHBondContact O-N 3.01Å; L417-V421 VanDerWaalsContact O-N 3.1Å; I418-V421 PolarHBondContact O-N 3.38Å; V421-T424 CarbonylContact O-C 3.52Å; V421-T424 PolarHBondContact O-N 2.91Å; V421-I425 HydrophobicContact CG1-CD1 3.88Å; V421-I425 VanDerWaalsContact O-CG1 3.27Å; V421-I425 WeakPolarHBondContact O-CG1 3.39Å; V421-I425 PolarHBondContact O-N 3.39Å; V421-I631 HydrophobicContact CG1-CB 4.47Å; V421-I631 HydrophobicContact CG1-CG2 4.16Å; V421-K634 HydrophobicContact CG1-CB 3.8Å; V421-K634 HydrophobicContact CG1-CD 4.19Å; V421-L635 HydrophobicContact CG2-CD2 4.11Å
422	M	67	Low	60.6	Low	64 Å²	64	79.2 Å²	79.2	32%	0.315	46%	0.463	S	S	.	.	H	α-helix	trans	-66.1	-39.9	174.5	-81.3	-73.3	-74	0	0	112.3	I418 N419 E420 T424 I425 S426 I631	I418-M422 HydrophobicContact CG2-CG 4.38Å; I418-M422 VanDerWaalsContact O-CB 3.3Å; I418-M422 WeakPolarHBondContact O-CB 3.48Å; I418-M422 VanDerWaalsContact O-CG 3.24Å; I418-M422 WeakPolarHBondContact O-CG 3.43Å; I418-M422 PolarHBondContact O-N 2.9Å; N419-M422 PolarHBondContact O-N 2.89Å; E420-M422 VanDerWaalsContact C-N 3.32Å; E420-M422 PolarHBondContact O-N 3.41Å; M422-T424 VanDerWaalsContact C-N 3.34Å; M422-I425 PolarHBondContact O-N 3.19Å; M422-I425 VanDerWaalsContact O-N 3.12Å; M422-S426 WeakPolarHBondContact O-CB 3.49Å; M422-S426 PolarHBondContact O-N 3.15Å; M422-S426 PolarHBondContact O-OG 3.14Å; M422-I631 HydrophobicContact CG-CD1 4.06Å; M422-I631 HydrophobicContact CG-CG1 4.3Å; M422-I631 HydrophobicContact SD-CD1 3.58Å; M422-I631 VanDerWaalsContact SD-CD1 3.58Å; M422-I631 HydrophobicContact SD-CG1 3.9Å
423	A	69.4	Low	59.7	Low	64 Å²	64	82.3 Å²	82.3	53%	0.529	47%	0.473	S	S	.	.	H	α-helix	trans	-60	-45.3	170.9	0	0	0	0	0	110.5	N419 E420 I425 S426	N419-A423 PolarHBondContact O-N 3.35Å; E420-A423 WeakPolarHBondContact O-CB 3.44Å; E420-A423 PolarHBondContact O-N 2.86Å; A423-I425 PolarHBondContact O-N 2.76Å; A423-S426 PolarHBondContact O-N 3.27Å; A423-S426 VanDerWaalsContact O-N 3.1Å
424	T	66.3	Low	58.3	Low	66 Å²	66	84.4 Å²	84.4	41%	0.405	49%	0.49	S	S	.	.	H	α-helix	trans	-68.8	-12.1	175.5	-15	0	0	0	0	114.3	E420 V421 M422 K634	E420-T424 PolarHBondContact O-N 3.21Å; E420-T424 PolarHBondContact O-OG1 2.94Å; V421-T424 CarbonylContact O-C 3.52Å; V421-T424 PolarHBondContact O-N 2.91Å; M422-T424 VanDerWaalsContact C-N 3.34Å; T424-K634 PolarHBondContact O-NZ 3.33Å
425	I	64	Low	56.4	Low	40 Å²	40	84.2 Å²	84.2	21%	0.205	49%	0.491	C	S	.	.	H	α-helix	trans	-91.3	-23.4	173	-71.2	164.4	0	0	0	111	V421 M422 A423 E630 I631 K634	V421-I425 HydrophobicContact CG1-CD1 3.88Å; V421-I425 VanDerWaalsContact O-CG1 3.27Å; V421-I425 WeakPolarHBondContact O-CG1 3.39Å; V421-I425 PolarHBondContact O-N 3.39Å; M422-I425 PolarHBondContact O-N 3.19Å; M422-I425 VanDerWaalsContact O-N 3.12Å; A423-I425 PolarHBondContact O-N 2.76Å; I425-E630 HydrophobicContact CD1-CB 4.38Å; I425-I631 HydrophobicContact CD1-CG1 3.81Å; I425-K634 HydrophobicContact CD1-CD 4.17Å; I425-K634 HydrophobicContact CG1-CD 3.75Å
426	S	60.1	Low	55	Low	89 Å²	89	85.4 Å²	85.4	62%	0.622	50%	0.499	S	S	*	.	H	α-helix	trans	-88.8	-9	-173.9	-54	0	0	0	0	113.7	M422 A423 P428	M422-S426 WeakPolarHBondContact O-CB 3.49Å; M422-S426 PolarHBondContact O-N 3.15Å; M422-S426 PolarHBondContact O-OG 3.14Å; A423-S426 PolarHBondContact O-N 3.27Å; A423-S426 VanDerWaalsContact O-N 3.1Å; S426-P428 WeakPolarHBondContact O-CD 3.31Å
427	D	52.8	Low	53.4	Low	76 Å²	76	87.1 Å²	87.1	41%	0.406	51%	0.507	S	S	.	.			trans	-79.1	113.2	175.8	-176.1	-11.3	0	0	0	111.5	A429 T430	D427-A429 PolarHBondContact O-N 3.43Å; D427-A429 WeakPolarHBondContact OD1-CB 3.37Å; D427-A429 PolarHBondContact OD1-N 3.15Å; D427-T430 HydrophobicContact CB-CG2 4.29Å; D427-T430 PolarHBondContact O-N 3Å; D427-T430 PolarHBondContact O-OG1 3.29Å; D427-T430 VanDerWaalsContact O-OG1 3.06Å
428	P	50.4	Low	51.9	Low	111 Å²	111	89 Å²	89	72%	0.721	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-60.2	-25.3	-178.3	-22.7	34.5	0	0	0	114.4	S426 T430	S426-P428 WeakPolarHBondContact O-CD 3.31Å; P428-T430 PolarHBondContact O-N 3Å
429	A	44.5	Very low	50	Low	92 Å²	92	91.3 Å²	91.3	76%	0.76	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-73.7	-7.9	-174.4	0	0	0	0	0	114	D427	D427-A429 PolarHBondContact O-N 3.43Å; D427-A429 WeakPolarHBondContact OD1-CB 3.37Å; D427-A429 PolarHBondContact OD1-N 3.15Å
430	T	46	Very low	48.5	Very low	68 Å²	68	95.6 Å²	95.6	42%	0.417	57%	0.567	S	S	.	*	G	3₁₀ helix	trans	-109.3	5.7	-168.6	67.1	0	0	0	0	115.3	D427 P428 P432	D427-T430 HydrophobicContact CB-CG2 4.29Å; D427-T430 PolarHBondContact O-N 3Å; D427-T430 PolarHBondContact O-OG1 3.29Å; D427-T430 VanDerWaalsContact O-OG1 3.06Å; P428-T430 PolarHBondContact O-N 3Å; T430-P432 VanDerWaalsContact O-CD 3.31Å; T430-P432 WeakPolarHBondContact O-CD 3.5Å
431	I	43.9	Very low	47.6	Very low	117 Å²	117	95.4 Å²	95.4	60%	0.6	58%	0.576	S	S	*	*			trans	-87.8	114.4	-178	-54.3	176.7	0	0	0	110.3
432	P	35.4	Very low	47.1	Very low	84 Å²	84	96.6 Å²	96.6	55%	0.545	59%	0.585	S	S	.	*			trans	-75.4	133.2	175.2	-13.1	30.7	0	0	0	110.9	T430 T434 S435	T430-P432 VanDerWaalsContact O-CD 3.31Å; T430-P432 WeakPolarHBondContact O-CD 3.5Å; P432-T434 PolarHBondContact O-N 3.47Å; P432-S435 PolarHBondContact O-N 2.79Å; P432-S435 VanDerWaalsContact O-N 3.07Å
433	E	35.7	Very low	47	Very low	171 Å²	171	102.4 Å²	102.4	80%	0.799	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-57.8	-23.2	-177.2	-61.6	-175.6	121	0	0	113.8	S435 L436	E433-S435 PolarHBondContact O-N 3.1Å; E433-L436 WeakPolarHBondContact O-CB 3.35Å; E433-L436 WeakPolarHBondContact O-CG 3.4Å; E433-L436 PolarHBondContact O-N 2.98Å; E433-L436 VanDerWaalsContact O-N 3.08Å
434	T	34	Very low	47.1	Very low	126 Å²	126	99.4 Å²	99.4	77%	0.773	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-60.1	-12.9	175.2	50.4	0	0	0	0	114.4	P432 L436	P432-T434 PolarHBondContact O-N 3.47Å; T434-L436 VanDerWaalsContact C-N 3.33Å
435	S	33.5	Very low	47.6	Very low	73 Å²	73	100.1 Å²	100.1	51%	0.51	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-75.9	-16	174.7	-153.7	0	0	0	0	114	P432 E433 L437 S438	P432-S435 PolarHBondContact O-N 2.79Å; P432-S435 VanDerWaalsContact O-N 3.07Å; E433-S435 PolarHBondContact O-N 3.1Å; S435-L437 PolarHBondContact O-N 3.26Å; S435-S438 PolarHBondContact O-N 2.86Å
436	L	36.6	Very low	48.4	Very low	150 Å²	150	101 Å²	101	79%	0.785	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-66	-17.1	-178.7	-70.6	166.5	0	0	0	113.9	E433 T434 S438	E433-L436 WeakPolarHBondContact O-CB 3.35Å; E433-L436 WeakPolarHBondContact O-CG 3.4Å; E433-L436 PolarHBondContact O-N 2.98Å; E433-L436 VanDerWaalsContact O-N 3.08Å; T434-L436 VanDerWaalsContact C-N 3.33Å; L436-S438 VanDerWaalsContact C-N 3.35Å
437	L	35.3	Very low	49.6	Very low	160 Å²	160	96.9 Å²	96.9	84%	0.838	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-92.6	16.5	177.6	-65.4	176.3	0	0	0	114	S435 A439	S435-L437 PolarHBondContact O-N 3.26Å; L437-A439 PolarHBondContact O-N 3.41Å
438	S	36.8	Very low	51.1	Low	90 Å²	90	94 Å²	94	63%	0.629	55%	0.546	S	S	*	.			trans	-72.5	74.6	168.9	-155.1	0	0	0	0	110.8	S435 L436 H440	S435-S438 PolarHBondContact O-N 2.86Å; L436-S438 VanDerWaalsContact C-N 3.35Å; S438-H440 PolarHBondContact O-N 2.77Å
439	A	30.5	Very low	52.7	Low	92 Å²	92	92.3 Å²	92.3	76%	0.76	53%	0.53	S	S	*	.			trans	-71.8	42	-175.8	0	0	0	0	0	114.2	L437	L437-A439 PolarHBondContact O-N 3.41Å
440	H	39	Very low	54.8	Low	181 Å²	181	90.2 Å²	90.2	84%	0.838	51%	0.505	S	S	*	.			trans	-129.2	62.5	160.3	-80.6	42.9	0	0	0	107.1	S438	S438-H440 PolarHBondContact O-N 2.77Å
441	S	49.7	Very low	56.8	Low	86 Å²	86	89.6 Å²	89.6	60%	0.601	50%	0.497	S	S	*	.			trans	-50.4	143.5	157.8	47.4	0	0	0	0	108.7	R443 E445	S441-R443 PolarHBondContact O-N 2.98Å; S441-E445 VanDerWaalsContact CA-OE2 3.22Å; S441-E445 WeakPolarHBondContact CA-OE2 3.13Å; S441-E445 VanDerWaalsContact CB-OE2 3.25Å; S441-E445 WeakPolarHBondContact CB-OE2 3.41Å
442	A	59.3	Low	58.8	Low	28 Å²	28	92.2 Å²	92.2	23%	0.231	50%	0.499	C	S	.	.			trans	-63.9	143.5	-176.1	0	0	0	0	0	109.5	D444 E445 S622	A442-D444 WeakPolarHBondContact CB-OD1 3.3Å; A442-D444 PolarHBondContact O-N 2.95Å; A442-E445 HydrophobicContact CB-CB 4.16Å; A442-E445 PolarHBondContact N-OE2 3.06Å; A442-E445 WeakPolarHBondContact O-CB 3.36Å; A442-E445 PolarHBondContact O-N 2.61Å; A442-S622 WeakPolarHBondContact CB-OG 3.33Å
443	R	64.1	Low	61.3	Low	187 Å²	187	96.8 Å²	96.8	71%	0.706	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-12.5	-173.8	-74.8	-173	178.7	138.5	2.5	114	S441 G546	S441-R443 PolarHBondContact O-N 2.98Å; R443-G546 WeakPolarHBondContact O-CA 3.49Å
444	D	71.4	Confident	63.8	Low	1 Å²	1	91.4 Å²	91.4	1%	0.005	50%	0.496	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	0.1	175.9	59.5	1.6	0	0	0	113.4	A442 A446 A447 R448 T549 H550 N553 S622	A442-D444 WeakPolarHBondContact CB-OD1 3.3Å; A442-D444 PolarHBondContact O-N 2.95Å; D444-A446 PolarHBondContact O-N 3.22Å; D444-A447 PolarHBondContact O-N 3.02Å; D444-R448 VanDerWaalsContact CG-NH1 3.25Å; D444-R448 VanDerWaalsContact O-CB 3.32Å; D444-R448 WeakPolarHBondContact O-CB 3.46Å; D444-R448 PolarHBondContact O-N 3.3Å; D444-R448 IonicContact OD1-CZ 2.7Å; D444-R448 IonicContact OD1-NH1 2.72Å; D444-R448 PolarHBondContact OD1-NH1 3.17Å; D444-R448 IonicContact OD1-NH2 3.47Å; D444-R448 PolarHBondContact OD1-NH2 3.11Å; D444-R448 IonicContact OD2-CZ 3.42Å; D444-R448 IonicContact OD2-NH1 3.2Å; D444-R448 IonicContact OD2-NH2 3.85Å; D444-R448 PolarHBondContact OD2-NH2 2.86Å; D444-T549 HydrophobicContact CB-CG2 4.33Å; D444-H550 HydrophobicContact CB-CB 4.23Å; D444-N553 PolarHBondContact OD2-ND2 2.77Å; D444-S622 WeakPolarHBondContact OD1-CB 3.39Å; D444-S622 PolarHBondContact OD1-OG 2.61Å; D444-S622 PolarHBondContact OD2-OG 2.79Å; D444-S622 VanDerWaalsContact OD2-OG 3.09Å
445	E	77.6	Confident	66.4	Low	80 Å²	80	87.6 Å²	87.6	37%	0.374	47%	0.472	S	S	.	.	H	α-helix	trans	-67.6	-38.4	-171.6	-166	161.5	-164.5	0	0	113	S441 A442 L449	S441-E445 VanDerWaalsContact CA-OE2 3.22Å; S441-E445 WeakPolarHBondContact CA-OE2 3.13Å; S441-E445 VanDerWaalsContact CB-OE2 3.25Å; S441-E445 WeakPolarHBondContact CB-OE2 3.41Å; A442-E445 HydrophobicContact CB-CB 4.16Å; A442-E445 PolarHBondContact N-OE2 3.06Å; A442-E445 WeakPolarHBondContact O-CB 3.36Å; A442-E445 PolarHBondContact O-N 2.61Å; E445-L449 WeakPolarHBondContact O-CB 3.48Å; E445-L449 PolarHBondContact O-N 3.3Å
446	A	80.6	Confident	69.3	Low	60 Å²	60	84.3 Å²	84.3	50%	0.496	45%	0.449	S	S	.	.	H	α-helix	trans	-64.3	-49.1	172.9	0	0	0	0	0	111.7	D444 R448 L449 E450	D444-A446 PolarHBondContact O-N 3.22Å; A446-R448 PolarHBondContact O-N 2.61Å; A446-L449 WeakPolarHBondContact O-CB 3.39Å; A446-L449 PolarHBondContact O-N 3.4Å; A446-E450 PolarHBondContact O-N 3.46Å
447	A	84	Confident	71.9	Confident	1 Å²	1	81 Å²	81	1%	0.008	43%	0.43	C	S	.	.	H	α-helix	trans	-61	-43	177.7	0	0	0	0	0	112.1	D444 L449 E450 E451 I456 Y547 H550	D444-A447 PolarHBondContact O-N 3.02Å; A447-L449 PolarHBondContact O-N 2.52Å; A447-E450 PolarHBondContact O-N 3Å; A447-E451 WeakPolarHBondContact O-CB 3.1Å; A447-E451 PolarHBondContact O-N 3.11Å; A447-I456 HydrophobicContact CB-CD1 4.28Å; A447-I456 WeakPolarHBondContact O-CD1 3.2Å; A447-Y547 HydrophobicContact CB-CD1 3.71Å; A447-Y547 HydrophobicContact CB-CE1 4.21Å; A447-H550 HydrophobicContact CB-CB 3.89Å
448	R	84.5	Confident	74.7	Confident	17 Å²	17	75 Å²	75	6%	0.064	40%	0.397	C	S	.	.	H	α-helix	trans	-63.9	-26.3	173.9	-171.1	-169.5	-71.3	98.3	-2.2	112.9	D444 A446 R452 T619	D444-R448 VanDerWaalsContact CG-NH1 3.25Å; D444-R448 VanDerWaalsContact O-CB 3.32Å; D444-R448 WeakPolarHBondContact O-CB 3.46Å; D444-R448 PolarHBondContact O-N 3.3Å; D444-R448 IonicContact OD1-CZ 2.7Å; D444-R448 IonicContact OD1-NH1 2.72Å; D444-R448 PolarHBondContact OD1-NH1 3.17Å; D444-R448 IonicContact OD1-NH2 3.47Å; D444-R448 PolarHBondContact OD1-NH2 3.11Å; D444-R448 IonicContact OD2-CZ 3.42Å; D444-R448 IonicContact OD2-NH1 3.2Å; D444-R448 IonicContact OD2-NH2 3.85Å; D444-R448 PolarHBondContact OD2-NH2 2.86Å; A446-R448 PolarHBondContact O-N 2.61Å; R448-R452 WeakPolarHBondContact O-CG 3.32Å; R448-R452 PolarHBondContact O-N 3.28Å; R448-R452 PolarHBondContact O-NE 2.87Å; R448-T619 VanDerWaalsContact CZ-O 3.28Å; R448-T619 PolarHBondContact NE-O 3.1Å; R448-T619 PolarHBondContact NH2-O 3.18Å
449	L	84.3	Confident	77.4	Confident	75 Å²	75	73.6 Å²	73.6	39%	0.393	38%	0.38	S	S	.	.	H	α-helix	trans	-80.2	-38.1	174	-174.5	62.3	0	0	0	111.8	E445 A446 A447 R453	E445-L449 WeakPolarHBondContact O-CB 3.48Å; E445-L449 PolarHBondContact O-N 3.3Å; A446-L449 WeakPolarHBondContact O-CB 3.39Å; A446-L449 PolarHBondContact O-N 3.4Å; A447-L449 PolarHBondContact O-N 2.52Å; L449-R453 VanDerWaalsContact O-CG 3.27Å; L449-R453 WeakPolarHBondContact O-CG 3.28Å; L449-R453 PolarHBondContact O-N 2.83Å
450	E	87.8	Confident	80.4	Confident	48 Å²	48	71.7 Å²	71.7	22%	0.224	36%	0.359	C	S	.	.	H	α-helix	trans	-65.3	-40	173.2	-72.2	-169	178.9	0	0	112.4	A446 A447 R453 G454 V455 I456 K512 Y547	A446-E450 PolarHBondContact O-N 3.46Å; A447-E450 PolarHBondContact O-N 3Å; E450-R453 CarbonylContact O-C 3.47Å; E450-R453 WeakPolarHBondContact O-CB 3.48Å; E450-R453 PolarHBondContact O-N 2.92Å; E450-R453 VanDerWaalsContact O-N 3.11Å; E450-G454 PolarHBondContact O-N 3.05Å; E450-V455 HydrophobicContact CB-CB 4.13Å; E450-V455 HydrophobicContact CB-CG1 4.43Å; E450-V455 PolarHBondContact O-N 3.35Å; E450-I456 HydrophobicContact CB-CD1 4.33Å; E450-I456 HydrophobicContact CB-CG1 4.23Å; E450-I456 HydrophobicContact CB-CG2 4.29Å; E450-K512 IonicContact OE1-NZ 3.7Å; E450-K512 PolarHBondContact OE1-NZ 3.3Å; E450-K512 IonicContact OE2-NZ 2.79Å; E450-K512 PolarHBondContact OE2-NZ 3.31Å; E450-Y547 WeakPolarHBondContact OE2-CE1 3.48Å; E450-Y547 PolarHBondContact OE2-OH 3.23Å; E450-Y547 VanDerWaalsContact OE2-OH 3.12Å
451	E	88.9	Confident	82.9	Confident	54 Å²	54	63.6 Å²	63.6	25%	0.252	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-47.4	175.1	179	175.9	-136.3	0	0	111.4	A447 R453 G454 I456 F458 H550 H554	A447-E451 WeakPolarHBondContact O-CB 3.1Å; A447-E451 PolarHBondContact O-N 3.11Å; E451-R453 PolarHBondContact O-N 3.47Å; E451-R453 VanDerWaalsContact O-N 3.13Å; E451-G454 PolarHBondContact O-N 3.21Å; E451-I456 HydrophobicContact CB-CD1 4.18Å; E451-I456 HydrophobicContact CB-CG1 3.81Å; E451-F458 VanDerWaalsContact OE1-CD2 3.29Å; E451-F458 WeakPolarHBondContact OE1-CD2 3.45Å; E451-H550 IonicContact OE2-CD2 2.67Å; E451-H550 IonicContact OE2-CE1 2.61Å; E451-H550 PolarHBondContact OE2-CE1 3.11Å; E451-H550 IonicContact OE2-NE2 2.91Å; E451-H550 PolarHBondContact OE2-NE2 2.89Å; E451-H554 IonicContact OE1-CD2 3.54Å; E451-H554 IonicContact OE1-CE1 3.57Å; E451-H554 PolarHBondContact OE1-CE1 3.36Å; E451-H554 IonicContact OE1-NE2 3.36Å; E451-H554 PolarHBondContact OE1-NE2 3.37Å; E451-H554 IonicContact OE2-NE2 2.64Å; E451-H554 PolarHBondContact OE2-NE2 2.97Å
452	R	86.9	Confident	84.8	Confident	173 Å²	173	60.8 Å²	60.8	65%	0.653	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-9.2	175.3	-72.4	-179	-65.8	179.7	5.5	114.1	R448	R448-R452 WeakPolarHBondContact O-CG 3.32Å; R448-R452 PolarHBondContact O-N 3.28Å; R448-R452 PolarHBondContact O-NE 2.87Å
453	R	87.9	Confident	86	Confident	179 Å²	179	61.3 Å²	61.3	68%	0.675	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-0.8	170.8	-72.2	171.6	174.7	-170.7	-2.5	113	L449 E450 E451 V455	L449-R453 VanDerWaalsContact O-CG 3.27Å; L449-R453 WeakPolarHBondContact O-CG 3.28Å; L449-R453 PolarHBondContact O-N 2.83Å; E450-R453 CarbonylContact O-C 3.47Å; E450-R453 WeakPolarHBondContact O-CB 3.48Å; E450-R453 PolarHBondContact O-N 2.92Å; E450-R453 VanDerWaalsContact O-N 3.11Å; E451-R453 PolarHBondContact O-N 3.47Å; E451-R453 VanDerWaalsContact O-N 3.13Å; R453-V455 HydrophobicContact CB-CG2 4Å; R453-V455 PolarHBondContact O-N 2.65Å
454	G	87.1	Confident	86.8	Confident	58 Å²	58	54.9 Å²	54.9	60%	0.598	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	13.6	-175.7	0	0	0	0	0	114.7	E450 E451	E450-G454 PolarHBondContact O-N 3.05Å; E451-G454 PolarHBondContact O-N 3.21Å
455	V	89.8	Confident	87	Confident	46 Å²	46	61.1 Å²	61.1	28%	0.279	32%	0.322	S	S	.	.	S	Bend	trans	-77.8	-30.1	-179.6	174.9	0	0	0	0	111.3	E450 R453 K512 D513	E450-V455 HydrophobicContact CB-CB 4.13Å; E450-V455 HydrophobicContact CB-CG1 4.43Å; E450-V455 PolarHBondContact O-N 3.35Å; R453-V455 HydrophobicContact CB-CG2 4Å; R453-V455 PolarHBondContact O-N 2.65Å; V455-K512 HydrophobicContact CG1-CD 4.39Å; V455-K512 HydrophobicContact CG1-CG 4.29Å; V455-K512 WeakPolarHBondContact O-CA 3.35Å; V455-D513 PolarHBondContact O-N 3.31Å
456	I	92.6	Very high	86.7	Confident	5 Å²	5	64.6 Å²	64.6	3%	0.026	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	144.6	174.6	69.1	176.8	0	0	0	112	A447 E450 E451 F458 L510 I511 K512 Y547	A447-I456 HydrophobicContact CB-CD1 4.28Å; A447-I456 WeakPolarHBondContact O-CD1 3.2Å; E450-I456 HydrophobicContact CB-CD1 4.33Å; E450-I456 HydrophobicContact CB-CG1 4.23Å; E450-I456 HydrophobicContact CB-CG2 4.29Å; E451-I456 HydrophobicContact CB-CD1 4.18Å; E451-I456 HydrophobicContact CB-CG1 3.81Å; I456-F458 HydrophobicContact CD1-CE2 3.98Å; I456-F458 HydrophobicContact CD1-CZ 4.28Å; I456-F458 HydrophobicContact CG1-CE2 4.38Å; I456-L510 HydrophobicContact CB-CD1 3.92Å; I456-L510 HydrophobicContact CD1-CD1 4.09Å; I456-L510 HydrophobicContact CG1-CD1 4.39Å; I456-L510 HydrophobicContact CG2-CD1 4.47Å; I456-I511 CarbonylContact C-O 3.54Å; I456-I511 WeakPolarHBondContact CA-O 3.48Å; I456-I511 WeakPolarHBondContact CB-O 3.3Å; I456-K512 HydrophobicContact CG2-CB 3.89Å; I456-K512 HydrophobicContact CG2-CD 3.84Å; I456-K512 HydrophobicContact CG2-CG 3.93Å; I456-Y547 HydrophobicContact CD1-CD1 4Å; I456-Y547 HydrophobicContact CD1-CE1 4.06Å; I456-Y547 HydrophobicContact CG2-CE1 4.18Å
457	E	92.6	Very high	86.2	Confident	80 Å²	80	68.8 Å²	68.8	37%	0.374	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	146.5	176.7	-58	178.8	174.1	0	0	110.6	H459 R472 I511	E457-H459 IonicContact OE2-CD2 3.94Å; E457-H459 IonicContact OE2-CE1 3.46Å; E457-H459 IonicContact OE2-NE2 2.74Å; E457-H459 PolarHBondContact OE2-NE2 3.29Å; E457-R472 IonicContact OE2-NH2 3.3Å; E457-I511 HydrophobicContact CB-CB 4.38Å; E457-I511 PolarHBondContact N-O 3.25Å; E457-I511 PolarHBondContact O-N 3.38Å
458	F	93.4	Very high	85.5	Confident	34 Å²	34	78.5 Å²	78.5	15%	0.149	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	121.6	173.9	-69.9	-87.6	0	0	0	110.6	E451 I456 L508 S509 L510 H550 L551 H554	E451-F458 VanDerWaalsContact OE1-CD2 3.29Å; E451-F458 WeakPolarHBondContact OE1-CD2 3.45Å; I456-F458 HydrophobicContact CD1-CE2 3.98Å; I456-F458 HydrophobicContact CD1-CZ 4.28Å; I456-F458 HydrophobicContact CG1-CE2 4.38Å; F458-L508 HydrophobicContact CB-CD1 4.34Å; F458-S509 WeakPolarHBondContact CA-O 3.29Å; F458-L510 HydrophobicContact CD1-CB 4.35Å; F458-L510 HydrophobicContact CD1-CD1 4.19Å; F458-L510 HydrophobicContact CE1-CB 4.13Å; F458-L510 HydrophobicContact CE1-CD1 3.72Å; F458-L510 HydrophobicContact CE1-CD2 4.45Å; F458-L510 HydrophobicContact CE1-CG 4.3Å; F458-L510 HydrophobicContact CE2-CD1 4.12Å; F458-L510 HydrophobicContact CZ-CD1 3.69Å; F458-H550 AromaticContact CE2-CD2 3.56Å; F458-H550 AromaticContact CE2-NE2 3.94Å; F458-H550 HydrophobicContact CZ-CB 4.4Å; F458-H550 AromaticContact CZ-CD2 3.54Å; F458-L551 HydrophobicContact CD1-CD1 3.91Å; F458-L551 HydrophobicContact CE1-CB 3.98Å; F458-L551 HydrophobicContact CE1-CD1 3.78Å; F458-H554 HydrophobicContact CD1-CB 4.42Å; F458-H554 AromaticContact CD1-CD2 3.94Å; F458-H554 AromaticContact CD2-CD2 3.48Å; F458-H554 VanDerWaalsContact CD2-CD2 3.48Å; F458-H554 WeakPolarHBondContact CD2-CD2 3.19Å; F458-H554 AromaticContact CD2-NE2 3.42Å; F458-H554 WeakPolarHBondContact CD2-NE2 3.06Å; F458-H554 AromaticContact CE1-CD2 3.91Å; F458-H554 AromaticContact CE2-CD2 3.46Å; F458-H554 VanDerWaalsContact CE2-CD2 3.46Å; F458-H554 WeakPolarHBondContact CE2-CD2 3.08Å; F458-H554 AromaticContact CE2-NE2 3.55Å; F458-H554 AromaticContact CG-CD2 3.72Å; F458-H554 AromaticContact CZ-CD2 3.67Å
459	H	92.9	Very high	84.6	Confident	60 Å²	60	82.1 Å²	82.1	28%	0.278	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	124.2	179.4	-64.2	-97.5	0	0	0	111.3	E457 I461 W476 S509	E457-H459 IonicContact OE2-CD2 3.94Å; E457-H459 IonicContact OE2-CE1 3.46Å; E457-H459 IonicContact OE2-NE2 2.74Å; E457-H459 PolarHBondContact OE2-NE2 3.29Å; H459-I461 HydrophobicContact CB-CG2 4.08Å; H459-I461 PolarHBondContact O-N 3.4Å; H459-W476 HydrophobicContact CB-CZ3 4.29Å; H459-S509 PolarHBondContact N-O 2.96Å; H459-S509 PolarHBondContact O-N 3.32Å; H459-S509 PolarHBondContact O-OG 2.9Å
460	V	93.5	Very high	84.3	Confident	52 Å²	52	83 Å²	83	32%	0.315	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	113.1	168.5	179.3	0	0	0	0	108.7	K506 L508 F522 Y558	V460-K506 HydrophobicContact CG1-CB 4.2Å; V460-K506 HydrophobicContact CG1-CD 4.13Å; V460-L508 HydrophobicContact CG2-CB 4.35Å; V460-L508 HydrophobicContact CG2-CD1 3.58Å; V460-F522 HydrophobicContact CG1-CZ 4.1Å; V460-Y558 HydrophobicContact CB-CE2 4.21Å; V460-Y558 HydrophobicContact CG1-CE2 4.01Å; V460-Y558 HydrophobicContact CG2-CD2 3.8Å; V460-Y558 HydrophobicContact CG2-CE2 3.9Å; V460-Y558 HydrophobicContact CG2-CG 4.25Å
461	I	92.6	Very high	84.1	Confident	12 Å²	12	89 Å²	89	6%	0.062	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	160.2	-178.2	63.3	175.6	0	0	0	111.3	H459 I473 W476 L477 L480 K506 T507	H459-I461 HydrophobicContact CB-CG2 4.08Å; H459-I461 PolarHBondContact O-N 3.4Å; I461-I473 HydrophobicContact CB-CG2 4.1Å; I461-I473 HydrophobicContact CD1-CG2 4.44Å; I461-I473 HydrophobicContact CG2-CG1 4.39Å; I461-I473 HydrophobicContact CG2-CG2 4.42Å; I461-W476 HydrophobicContact CD1-CB 3.57Å; I461-W476 HydrophobicContact CD1-CE3 4.3Å; I461-W476 HydrophobicContact CG2-CE3 4.18Å; I461-W476 HydrophobicContact CG2-CZ3 4.45Å; I461-L477 HydrophobicContact CD1-CD2 3.88Å; I461-L477 HydrophobicContact CD1-CG 4.02Å; I461-L477 HydrophobicContact CG1-CD2 3.96Å; I461-L480 HydrophobicContact CD1-CD1 3.93Å; I461-L480 HydrophobicContact CG1-CD1 4.36Å; I461-K506 CarbonylContact O-C 3.59Å; I461-K506 WeakPolarHBondContact O-CA 3.44Å; I461-T507 PolarHBondContact N-O 3.44Å; I461-T507 PolarHBondContact O-N 3.38Å
462	G	88.8	Confident	84	Confident	26 Å²	26	92.7 Å²	92.7	27%	0.268	46%	0.462	S	S	.	.			trans	-161.2	163.5	176.2	0	0	0	0	0	110
463	N	85.8	Confident	84	Confident	39 Å²	39	87 Å²	87	21%	0.209	44%	0.444	C	S	.	.			trans	-75.5	142.8	174.9	-168.1	18.2	0	0	0	110.4	L477 F501 P503	N463-L477 HydrophobicContact CB-CD1 4.4Å; N463-F501 WeakPolarHBondContact CB-O 3.39Å; N463-F501 PolarHBondContact ND2-O 2.82Å; N463-P503 WeakPolarHBondContact O-CA 3.3Å
464	S	80.3	Confident	84	Confident	52 Å²	52	82.1 Å²	82.1	36%	0.364	43%	0.431	S	S	.	.			trans	-134.3	120.5	177.6	-177.8	0	0	0	0	109.5	N466	S464-N466 VanDerWaalsContact C-N 3.32Å
465	L	75.6	Confident	84.1	Confident	133 Å²	133	86 Å²	86	70%	0.696	44%	0.435	S	S	*	.	S	Bend	trans	-82.7	-13.7	177.6	-55.7	178.7	0	0	0	112.3	P503	L465-P503 HydrophobicContact CD1-CG 3.94Å; L465-P503 HydrophobicContact CD2-CG 4.42Å; L465-P503 HydrophobicContact CG-CG 3.8Å
466	N	70	Confident	84.3	Confident	153 Å²	153	84.8 Å²	84.8	82%	0.818	43%	0.426	S	S	*	.	S	Bend	trans	-99.5	1.5	-169.7	-61.6	12	0	0	0	113.1	S464	S464-N466 VanDerWaalsContact C-N 3.32Å
467	Q	70.9	Confident	84.3	Confident	148 Å²	148	84.6 Å²	84.6	69%	0.692	43%	0.425	S	S	*	.	S	Bend	trans	-137.1	152.4	-178.9	-67.5	-178.7	-7.1	0	0	109.9
468	K	68.6	Low	84.3	Confident	204 Å²	204	84 Å²	84	89%	0.887	43%	0.426	S	S	*	.			trans	-58.8	125.7	174.1	-74.6	-177.7	176.6	177.5	0	109.1	N470	K468-N470 PolarHBondContact O-N 2.89Å; K468-N470 VanDerWaalsContact O-N 3.13Å
469	P	65.6	Low	84.3	Confident	94 Å²	94	83.3 Å²	83.3	61%	0.61	43%	0.429	S	S	*	.			trans	-65.5	117.3	-171.5	24.2	-33.8	0	0	0	110.9	K471	P469-K471 PolarHBondContact O-N 2.97Å; P469-K471 VanDerWaalsContact O-N 3.16Å
470	N	79.6	Confident	84.3	Confident	92 Å²	92	80.5 Å²	80.5	49%	0.492	42%	0.416	S	S	.	.			trans	-64.7	115.5	174.4	179.7	-19.6	0	0	0	109.1	K468 R472 I473 L474	K468-N470 PolarHBondContact O-N 2.89Å; K468-N470 VanDerWaalsContact O-N 3.13Å; N470-R472 PolarHBondContact O-N 3.5Å; N470-R472 VanDerWaalsContact O-N 3.14Å; N470-R472 WeakPolarHBondContact OD1-CB 3.45Å; N470-R472 PolarHBondContact OD1-N 2.86Å; N470-I473 HydrophobicContact CB-CB 4.22Å; N470-I473 HydrophobicContact CB-CD1 4.04Å; N470-I473 HydrophobicContact CB-CG1 4.12Å; N470-I473 PolarHBondContact O-N 3.17Å; N470-L474 PolarHBondContact O-N 2.88Å
471	K	83.4	Confident	84.4	Confident	175 Å²	175	79 Å²	79	76%	0.761	41%	0.405	S	S	*	.	H	α-helix	trans	-52.4	-37.8	-177.7	-66	-175.5	178.1	-177.8	0	112.6	P469 L474 M475	P469-K471 PolarHBondContact O-N 2.97Å; P469-K471 VanDerWaalsContact O-N 3.16Å; K471-L474 PolarHBondContact O-N 3.02Å; K471-M475 WeakPolarHBondContact O-CB 3.46Å; K471-M475 VanDerWaalsContact O-CG 3.28Å; K471-M475 WeakPolarHBondContact O-CG 3.35Å; K471-M475 PolarHBondContact O-N 2.89Å
472	R	86.4	Confident	84.4	Confident	132 Å²	132	81 Å²	81	50%	0.498	42%	0.416	S	S	.	.	H	α-helix	trans	-65.1	-44	178.5	-168.5	175	-178.6	-161.5	-8	111.4	E457 N470 M475 W476	E457-R472 IonicContact OE2-NH2 3.3Å; N470-R472 PolarHBondContact O-N 3.5Å; N470-R472 VanDerWaalsContact O-N 3.14Å; N470-R472 WeakPolarHBondContact OD1-CB 3.45Å; N470-R472 PolarHBondContact OD1-N 2.86Å; R472-M475 PolarHBondContact O-N 3.04Å; R472-W476 HydrophobicContact CG-CD2 4.16Å; R472-W476 HydrophobicContact CG-CE3 4.44Å; R472-W476 HydrophobicContact CG-CH2 3.99Å; R472-W476 HydrophobicContact CG-CZ2 3.63Å; R472-W476 HydrophobicContact CG-CZ3 4.35Å; R472-W476 PolarHBondContact O-N 3.1Å
473	I	86.9	Confident	84.7	Confident	54 Å²	54	80.4 Å²	80.4	28%	0.277	41%	0.407	S	S	.	.	H	α-helix	trans	-65.2	-43.3	176.1	-65.9	179	0	0	0	110.9	I461 N470 M475 W476 L477	I461-I473 HydrophobicContact CB-CG2 4.1Å; I461-I473 HydrophobicContact CD1-CG2 4.44Å; I461-I473 HydrophobicContact CG2-CG1 4.39Å; I461-I473 HydrophobicContact CG2-CG2 4.42Å; N470-I473 HydrophobicContact CB-CB 4.22Å; N470-I473 HydrophobicContact CB-CD1 4.04Å; N470-I473 HydrophobicContact CB-CG1 4.12Å; N470-I473 PolarHBondContact O-N 3.17Å; I473-M475 PolarHBondContact O-N 2.99Å; I473-W476 HydrophobicContact CG1-CE3 4.39Å; I473-W476 PolarHBondContact O-N 3.05Å; I473-W476 VanDerWaalsContact O-N 3.17Å; I473-L477 HydrophobicContact CG2-CD1 4.19Å; I473-L477 HydrophobicContact CG2-CG 4.45Å; I473-L477 WeakPolarHBondContact O-CG 3.45Å; I473-L477 PolarHBondContact O-N 3Å
474	L	87.7	Confident	85.1	Confident	76 Å²	76	78.5 Å²	78.5	40%	0.398	40%	0.397	S	S	.	.	H	α-helix	trans	-63.8	-42.6	179.2	-164.6	74.5	0	0	0	111.7	N470 K471 W476 L477 V478 F501	N470-L474 PolarHBondContact O-N 2.88Å; K471-L474 PolarHBondContact O-N 3.02Å; L474-W476 VanDerWaalsContact C-N 3.29Å; L474-W476 PolarHBondContact O-N 3.46Å; L474-L477 PolarHBondContact O-N 3.24Å; L474-V478 WeakPolarHBondContact O-CG2 3.47Å; L474-V478 PolarHBondContact O-N 2.8Å; L474-F501 HydrophobicContact CD1-CD1 4.46Å; L474-F501 HydrophobicContact CD1-CE1 3.89Å
475	M	89.5	Confident	85.7	Confident	138 Å²	138	77.4 Å²	77.4	68%	0.68	39%	0.389	S	S	*	.	H	α-helix	trans	-59.6	-38.7	172.8	-73.5	174.2	69.4	0	0	112.2	K471 R472 I473 V478 G479	K471-M475 WeakPolarHBondContact O-CB 3.46Å; K471-M475 VanDerWaalsContact O-CG 3.28Å; K471-M475 WeakPolarHBondContact O-CG 3.35Å; K471-M475 PolarHBondContact O-N 2.89Å; R472-M475 PolarHBondContact O-N 3.04Å; I473-M475 PolarHBondContact O-N 2.99Å; M475-V478 PolarHBondContact O-N 3.03Å; M475-G479 PolarHBondContact O-N 2.86Å
476	W	93.2	Very high	86.4	Confident	22 Å²	22	77.6 Å²	77.6	8%	0.083	39%	0.387	C	S	.	.	H	α-helix	trans	-69.5	-39.5	176.3	-64.8	-25.2	0	0	0	113.1	H459 I461 R472 I473 L474 G479 L480 I511 V516	H459-W476 HydrophobicContact CB-CZ3 4.29Å; I461-W476 HydrophobicContact CD1-CB 3.57Å; I461-W476 HydrophobicContact CD1-CE3 4.3Å; I461-W476 HydrophobicContact CG2-CE3 4.18Å; I461-W476 HydrophobicContact CG2-CZ3 4.45Å; R472-W476 HydrophobicContact CG-CD2 4.16Å; R472-W476 HydrophobicContact CG-CE3 4.44Å; R472-W476 HydrophobicContact CG-CH2 3.99Å; R472-W476 HydrophobicContact CG-CZ2 3.63Å; R472-W476 HydrophobicContact CG-CZ3 4.35Å; R472-W476 PolarHBondContact O-N 3.1Å; I473-W476 HydrophobicContact CG1-CE3 4.39Å; I473-W476 PolarHBondContact O-N 3.05Å; I473-W476 VanDerWaalsContact O-N 3.17Å; L474-W476 VanDerWaalsContact C-N 3.29Å; L474-W476 PolarHBondContact O-N 3.46Å; W476-G479 PolarHBondContact O-N 3.23Å; W476-L480 WeakPolarHBondContact O-CB 3.46Å; W476-L480 WeakPolarHBondContact O-CD1 3.34Å; W476-L480 WeakPolarHBondContact O-CG 3.49Å; W476-L480 PolarHBondContact O-N 2.84Å; W476-I511 HydrophobicContact CD2-CD1 3.67Å; W476-I511 HydrophobicContact CE3-CD1 4.03Å; W476-I511 HydrophobicContact CG-CD1 4.24Å; W476-I511 HydrophobicContact CH2-CD1 3.6Å; W476-I511 HydrophobicContact CZ2-CD1 3.2Å; W476-I511 HydrophobicContact CZ3-CD1 4.02Å; W476-V516 HydrophobicContact CB-CG2 4.06Å; W476-V516 HydrophobicContact CG-CG2 4.24Å
477	L	92.5	Very high	87.4	Confident	1 Å²	1	72.6 Å²	72.6	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-63.7	-39.8	173.2	-68.9	173	0	0	0	111.9	I461 N463 I473 L474 L480 Q481 V500 F501	I461-L477 HydrophobicContact CD1-CD2 3.88Å; I461-L477 HydrophobicContact CD1-CG 4.02Å; I461-L477 HydrophobicContact CG1-CD2 3.96Å; N463-L477 HydrophobicContact CB-CD1 4.4Å; I473-L477 HydrophobicContact CG2-CD1 4.19Å; I473-L477 HydrophobicContact CG2-CG 4.45Å; I473-L477 WeakPolarHBondContact O-CG 3.45Å; I473-L477 PolarHBondContact O-N 3Å; L474-L477 PolarHBondContact O-N 3.24Å; L477-L480 HydrophobicContact CD2-CD1 4.36Å; L477-L480 PolarHBondContact O-N 3.03Å; L477-Q481 WeakPolarHBondContact O-CB 3.21Å; L477-Q481 PolarHBondContact O-N 3Å; L477-V500 HydrophobicContact CB-CG1 4.34Å; L477-V500 HydrophobicContact CD2-CG1 4.04Å; L477-F501 HydrophobicContact CB-CD1 4.25Å; L477-F501 HydrophobicContact CB-CE1 3.49Å; L477-F501 VanDerWaalsContact CB-CE1 3.49Å; L477-F501 HydrophobicContact CB-CZ 3.71Å; L477-F501 HydrophobicContact CD1-CD1 4.12Å; L477-F501 HydrophobicContact CD1-CE1 4.04Å; L477-F501 HydrophobicContact CG-CE1 4.41Å
478	V	92.8	Very high	88.2	Confident	66 Å²	66	67 Å²	67	40%	0.4	33%	0.333	S	S	.	.	H	α-helix	trans	-65	-40.1	171.9	173.3	0	0	0	0	111.4	L474 M475 Q481 N482 F501	L474-V478 WeakPolarHBondContact O-CG2 3.47Å; L474-V478 PolarHBondContact O-N 2.8Å; M475-V478 PolarHBondContact O-N 3.03Å; V478-Q481 PolarHBondContact O-N 2.88Å; V478-N482 PolarHBondContact O-N 3Å; V478-N482 PolarHBondContact O-ND2 3.04Å; V478-F501 HydrophobicContact CG2-CZ 3.83Å
479	G	93.3	Very high	88.9	Confident	21 Å²	21	62.8 Å²	62.8	22%	0.216	33%	0.327	C	S	.	.	H	α-helix	trans	-59.5	-49.5	173.7	0	0	0	0	0	112.1	M475 W476 N482 V483	M475-G479 PolarHBondContact O-N 2.86Å; W476-G479 PolarHBondContact O-N 3.23Å; G479-N482 PolarHBondContact O-N 3.16Å; G479-V483 WeakPolarHBondContact O-CG2 3.49Å; G479-V483 PolarHBondContact O-N 3.14Å
480	L	94.1	Very high	89.7	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-60.5	-45.9	176.3	-75.2	161.2	0	0	0	112.6	I461 W476 L477 N482 V483 F484 T507 V516 G518	I461-L480 HydrophobicContact CD1-CD1 3.93Å; I461-L480 HydrophobicContact CG1-CD1 4.36Å; W476-L480 WeakPolarHBondContact O-CB 3.46Å; W476-L480 WeakPolarHBondContact O-CD1 3.34Å; W476-L480 WeakPolarHBondContact O-CG 3.49Å; W476-L480 PolarHBondContact O-N 2.84Å; L477-L480 HydrophobicContact CD2-CD1 4.36Å; L477-L480 PolarHBondContact O-N 3.03Å; L480-N482 VanDerWaalsContact C-N 3.27Å; L480-N482 PolarHBondContact O-N 3.37Å; L480-V483 PolarHBondContact O-N 2.91Å; L480-V483 VanDerWaalsContact O-N 3.12Å; L480-F484 HydrophobicContact CB-CD2 4.36Å; L480-F484 HydrophobicContact CB-CE2 4.02Å; L480-F484 HydrophobicContact CD2-CE2 4.29Å; L480-F484 HydrophobicContact CD2-CZ 4.33Å; L480-F484 WeakPolarHBondContact O-CD2 3.48Å; L480-F484 WeakPolarHBondContact O-CG 3.45Å; L480-F484 PolarHBondContact O-N 2.67Å; L480-T507 HydrophobicContact CD1-CG2 3.41Å; L480-T507 VanDerWaalsContact CD1-CG2 3.41Å; L480-T507 HydrophobicContact CD2-CG2 3.79Å; L480-T507 HydrophobicContact CG-CG2 4.13Å; L480-V516 HydrophobicContact CD2-CG1 3.77Å; L480-V516 HydrophobicContact CG-CG1 3.85Å; L480-G518 WeakPolarHBondContact CD2-O 3.26Å
481	Q	94.8	Very high	90	Very high	21 Å²	21	62.1 Å²	62.1	10%	0.098	31%	0.307	C	S	.	.	H	α-helix	trans	-58.3	-40	176.8	177	-94.9	16.1	0	0	111.4	L477 V478 S485 K493 I496 T497 V500 F501	L477-Q481 WeakPolarHBondContact O-CB 3.21Å; L477-Q481 PolarHBondContact O-N 3Å; V478-Q481 PolarHBondContact O-N 2.88Å; Q481-S485 WeakPolarHBondContact O-CB 3.28Å; Q481-S485 PolarHBondContact O-N 3.32Å; Q481-K493 VanDerWaalsContact NE2-CE 3.34Å; Q481-I496 HydrophobicContact CG-CG2 4.28Å; Q481-T497 WeakPolarHBondContact CG-OG1 3.49Å; Q481-T497 PolarHBondContact NE2-OG1 2.78Å; Q481-V500 HydrophobicContact CB-CG1 4.31Å; Q481-F501 HydrophobicContact CB-CE2 4.22Å; Q481-F501 HydrophobicContact CG-CE2 4.4Å
482	N	93.1	Very high	90.4	Very high	53 Å²	53	57.4 Å²	57.4	28%	0.283	29%	0.294	S	S	.	.	H	α-helix	trans	-68.8	-42.6	173.5	-76.2	-68	0	0	0	112	V478 G479 L480 S485 H486	V478-N482 PolarHBondContact O-N 3Å; V478-N482 PolarHBondContact O-ND2 3.04Å; G479-N482 PolarHBondContact O-N 3.16Å; L480-N482 VanDerWaalsContact C-N 3.27Å; L480-N482 PolarHBondContact O-N 3.37Å; N482-S485 PolarHBondContact O-N 3.45Å; N482-H486 PolarHBondContact O-N 3.17Å; N482-H486 PolarHBondContact O-ND1 3.21Å
483	V	93.6	Very high	90.6	Very high	14 Å²	14	55.1 Å²	55.1	9%	0.085	29%	0.287	C	S	.	.	H	α-helix	trans	-59.8	-49.1	176.3	173.8	0	0	0	0	111.1	G479 L480 S485 H486 Q487 V516 A537 T539	G479-V483 WeakPolarHBondContact O-CG2 3.49Å; G479-V483 PolarHBondContact O-N 3.14Å; L480-V483 PolarHBondContact O-N 2.91Å; L480-V483 VanDerWaalsContact O-N 3.12Å; V483-S485 PolarHBondContact O-N 2.97Å; V483-H486 PolarHBondContact O-N 3.4Å; V483-Q487 HydrophobicContact CG1-CG 4.21Å; V483-Q487 WeakPolarHBondContact O-CB 3.32Å; V483-Q487 VanDerWaalsContact O-CG 3.25Å; V483-Q487 WeakPolarHBondContact O-CG 3.25Å; V483-Q487 PolarHBondContact O-N 2.63Å; V483-V516 HydrophobicContact CG2-CG1 4.27Å; V483-A537 HydrophobicContact CG1-CB 4.33Å; V483-T539 HydrophobicContact CB-CG2 4.45Å; V483-T539 HydrophobicContact CG1-CG2 3.99Å; V483-T539 HydrophobicContact CG2-CG2 3.64Å
484	F	94.9	Very high	90.8	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60.3	-44.6	175.8	-64.4	-49.5	0	0	0	111.5	L480 H486 Q487 L488 I496 V500 T507 G519 C521 F535 A537	L480-F484 HydrophobicContact CB-CD2 4.36Å; L480-F484 HydrophobicContact CB-CE2 4.02Å; L480-F484 HydrophobicContact CD2-CE2 4.29Å; L480-F484 HydrophobicContact CD2-CZ 4.33Å; L480-F484 WeakPolarHBondContact O-CD2 3.48Å; L480-F484 WeakPolarHBondContact O-CG 3.45Å; L480-F484 PolarHBondContact O-N 2.67Å; F484-H486 VanDerWaalsContact C-N 3.25Å; F484-H486 PolarHBondContact O-N 3.13Å; F484-Q487 PolarHBondContact O-N 3.08Å; F484-L488 HydrophobicContact CB-CD1 4.46Å; F484-L488 HydrophobicContact CD1-CD1 4.29Å; F484-L488 WeakPolarHBondContact O-CB 3.18Å; F484-L488 PolarHBondContact O-N 3.47Å; F484-I496 HydrophobicContact CB-CD1 4.27Å; F484-I496 HydrophobicContact CB-CG2 3.7Å; F484-I496 HydrophobicContact CD2-CG2 4.38Å; F484-I496 HydrophobicContact CG-CG2 4.49Å; F484-V500 HydrophobicContact CD2-CG2 3.79Å; F484-V500 HydrophobicContact CE2-CG2 4.01Å; F484-T507 HydrophobicContact CE2-CG2 4.18Å; F484-T507 HydrophobicContact CZ-CG2 4.13Å; F484-G519 WeakPolarHBondContact CE1-O 3.3Å; F484-C521 HydrophobicContact CE2-CB 4.07Å; F484-C521 HydrophobicContact CZ-CB 4.07Å; F484-F535 HydrophobicContact CD1-CB 3.6Å; F484-F535 HydrophobicContact CD1-CG 4.39Å; F484-F535 HydrophobicContact CD2-CB 4.35Å; F484-F535 HydrophobicContact CD2-CD2 4.19Å; F484-F535 HydrophobicContact CE1-CB 3.55Å; F484-F535 HydrophobicContact CE2-CB 4.3Å; F484-F535 HydrophobicContact CE2-CD2 4.44Å; F484-F535 HydrophobicContact CG-CB 4.03Å; F484-F535 HydrophobicContact CG-CD2 4.37Å; F484-F535 HydrophobicContact CG-CG 4.38Å; F484-F535 HydrophobicContact CZ-CB 3.93Å; F484-A537 HydrophobicContact CD1-CB 3.66Å; F484-A537 HydrophobicContact CE1-CB 3.95Å
485	S	93.6	Very high	91	Very high	28 Å²	28	57.6 Å²	57.6	20%	0.196	29%	0.294	C	S	.	.	H	α-helix	trans	-64.6	-22.4	-179.8	-175.6	0	0	0	0	114.6	Q481 N482 V483	Q481-S485 WeakPolarHBondContact O-CB 3.28Å; Q481-S485 PolarHBondContact O-N 3.32Å; N482-S485 PolarHBondContact O-N 3.45Å; V483-S485 PolarHBondContact O-N 2.97Å
486	H	90.1	Very high	91.2	Very high	138 Å²	138	51 Å²	51	64%	0.639	26%	0.262	S	S	*	.	H	α-helix	trans	-94.9	-28.9	174.8	-69.9	83.7	0	0	0	113	N482 V483 F484	N482-H486 PolarHBondContact O-N 3.17Å; N482-H486 PolarHBondContact O-ND1 3.21Å; V483-H486 PolarHBondContact O-N 3.4Å; F484-H486 VanDerWaalsContact C-N 3.25Å; F484-H486 PolarHBondContact O-N 3.13Å
487	Q	90.1	Very high	91.2	Very high	48 Å²	48	52 Å²	52	22%	0.224	27%	0.271	C	S	.	.	H	α-helix	trans	-93.2	-16.6	-176.8	-60.1	-60.8	-52.8	0	0	113.6	V483 F484 P489 A537 V538 S540	V483-Q487 HydrophobicContact CG1-CG 4.21Å; V483-Q487 WeakPolarHBondContact O-CB 3.32Å; V483-Q487 VanDerWaalsContact O-CG 3.25Å; V483-Q487 WeakPolarHBondContact O-CG 3.25Å; V483-Q487 PolarHBondContact O-N 2.63Å; F484-Q487 PolarHBondContact O-N 3.08Å; Q487-P489 VanDerWaalsContact C-CD 3.46Å; Q487-P489 WeakPolarHBondContact O-CD 3.5Å; Q487-A537 HydrophobicContact CB-CB 3.84Å; Q487-A537 HydrophobicContact CG-CB 4.26Å; Q487-V538 PolarHBondContact OE1-O 3.3Å; Q487-S540 PolarHBondContact NE2-OG 3.45Å; Q487-S540 PolarHBondContact OE1-OG 2.98Å; Q487-S540 VanDerWaalsContact OE1-OG 3.09Å
488	L	89.3	Confident	91.2	Very high	30 Å²	30	59.4 Å²	59.4	16%	0.157	30%	0.298	C	S	.	.			trans	-121.7	66.5	-179.7	-57.4	175.8	0	0	0	110.9	F484 R490 M491 F535	F484-L488 HydrophobicContact CB-CD1 4.46Å; F484-L488 HydrophobicContact CD1-CD1 4.29Å; F484-L488 WeakPolarHBondContact O-CB 3.18Å; F484-L488 PolarHBondContact O-N 3.47Å; L488-R490 PolarHBondContact O-N 2.95Å; L488-R490 VanDerWaalsContact O-N 3.07Å; L488-M491 HydrophobicContact CB-CB 4.23Å; L488-M491 HydrophobicContact CB-CG 4.12Å; L488-M491 WeakPolarHBondContact O-CB 3.49Å; L488-M491 PolarHBondContact O-N 2.71Å; L488-F535 HydrophobicContact CD1-CB 3.98Å; L488-F535 HydrophobicContact CD1-CD1 3.7Å; L488-F535 HydrophobicContact CD1-CG 4.13Å
489	P	81.4	Confident	91.2	Very high	116 Å²	116	56.5 Å²	56.5	75%	0.753	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-15.1	-171.8	27.2	-36.5	0	0	0	114.9	Q487 M491	Q487-P489 VanDerWaalsContact C-CD 3.46Å; Q487-P489 WeakPolarHBondContact O-CD 3.5Å; P489-M491 VanDerWaalsContact C-N 3.29Å
490	R	84	Confident	91.2	Very high	138 Å²	138	55.6 Å²	55.6	52%	0.521	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-9.8	172.1	-66.1	-176	178.5	179.6	0.9	113.3	L488	L488-R490 PolarHBondContact O-N 2.95Å; L488-R490 VanDerWaalsContact O-N 3.07Å
491	M	86.4	Confident	91.2	Very high	34 Å²	34	57.8 Å²	57.8	17%	0.167	28%	0.28	C	S	.	.	S	Bend	trans	-106.2	119.1	-177.2	-64.4	-69.1	171.4	0	0	110.7	L488 P489 I496 F535 Y602	L488-M491 HydrophobicContact CB-CB 4.23Å; L488-M491 HydrophobicContact CB-CG 4.12Å; L488-M491 WeakPolarHBondContact O-CB 3.49Å; L488-M491 PolarHBondContact O-N 2.71Å; P489-M491 VanDerWaalsContact C-N 3.29Å; M491-I496 HydrophobicContact CB-CD1 3.88Å; M491-I496 HydrophobicContact CB-CG1 3.94Å; M491-I496 WeakPolarHBondContact O-CD1 3.33Å; M491-F535 HydrophobicContact CG-CE1 4.37Å; M491-F535 HydrophobicContact SD-CE1 4.49Å; M491-Y602 HydrophobicContact CE-CD1 3.69Å; M491-Y602 HydrophobicContact CE-CE1 3.94Å; M491-Y602 HydrophobicContact CE-CG 4.45Å; M491-Y602 HydrophobicContact SD-CD1 4.17Å; M491-Y602 HydrophobicContact SD-CE1 4.03Å
492	P	90.4	Very high	91	Very high	75 Å²	75	58.8 Å²	58.8	49%	0.487	29%	0.286	S	S	.	.			trans	-57.9	141.4	179.5	-26.8	35.2	0	0	0	113.2	E494 Y495 I496	P492-E494 PolarHBondContact O-N 3.38Å; P492-Y495 WeakPolarHBondContact O-CA 3.19Å; P492-Y495 WeakPolarHBondContact O-CB 3.36Å; P492-Y495 PolarHBondContact O-N 3.37Å; P492-I496 WeakPolarHBondContact O-CG1 3.23Å; P492-I496 PolarHBondContact O-N 2.86Å
493	K	90.4	Very high	90.9	Very high	84 Å²	84	59.4 Å²	59.4	37%	0.365	29%	0.293	S	S	.	.	H	α-helix	trans	-61.7	-34.7	-176.1	-174.4	168.8	-174.8	167	0	111.9	Q481 I496 T497	Q481-K493 VanDerWaalsContact NE2-CE 3.34Å; K493-I496 PolarHBondContact O-N 2.42Å; K493-T497 VanDerWaalsContact O-CB 3.31Å; K493-T497 WeakPolarHBondContact O-CB 3.29Å; K493-T497 PolarHBondContact O-N 3.46Å; K493-T497 PolarHBondContact O-OG1 3.05Å
494	E	91.6	Very high	90.8	Very high	137 Å²	137	65.8 Å²	65.8	64%	0.64	32%	0.32	S	S	*	.	H	α-helix	trans	-66.6	-40.6	177.2	-58	61.9	-129.2	0	0	110.2	P492 T497 R498	P492-E494 PolarHBondContact O-N 3.38Å; E494-T497 PolarHBondContact O-N 3.17Å; E494-R498 WeakPolarHBondContact O-CB 3.28Å; E494-R498 PolarHBondContact O-N 3.44Å
495	Y	91.9	Very high	90.7	Very high	46 Å²	46	66 Å²	66	18%	0.18	32%	0.321	C	S	.	.	H	α-helix	trans	-67	-46.6	176.6	-177	-91.8	0	0	0	111.5	P492 R498 L499 F535 K600 Y602	P492-Y495 WeakPolarHBondContact O-CA 3.19Å; P492-Y495 WeakPolarHBondContact O-CB 3.36Å; P492-Y495 PolarHBondContact O-N 3.37Å; Y495-R498 PolarHBondContact O-N 3.31Å; Y495-L499 HydrophobicContact CD1-CD1 4.32Å; Y495-L499 HydrophobicContact CE1-CD1 3.59Å; Y495-L499 HydrophobicContact CE1-CG 4.49Å; Y495-L499 HydrophobicContact CE2-CD1 4.43Å; Y495-L499 PolarHBondContact O-N 3.27Å; Y495-F535 HydrophobicContact CD1-CE1 4.48Å; Y495-F535 HydrophobicContact CD1-CZ 4.06Å; Y495-F535 HydrophobicContact CE1-CE1 4.3Å; Y495-F535 HydrophobicContact CE1-CZ 4.03Å; Y495-K600 WeakPolarHBondContact OH-CD 3.43Å; Y495-K600 PolarHBondContact OH-NZ 2.81Å; Y495-Y602 AromaticContact CE1-CE1 3.95Å; Y495-Y602 HydrophobicContact CE1-CE1 3.95Å; Y495-Y602 AromaticContact CZ-CE1 3.99Å; Y495-Y602 PolarHBondContact OH-OH 2.94Å
496	I	93.1	Very high	90.7	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-57.9	-50.4	174.1	-65	170.1	0	0	0	110.1	Q481 F484 M491 P492 K493 R498 L499 V500 F535	Q481-I496 HydrophobicContact CG-CG2 4.28Å; F484-I496 HydrophobicContact CB-CD1 4.27Å; F484-I496 HydrophobicContact CB-CG2 3.7Å; F484-I496 HydrophobicContact CD2-CG2 4.38Å; F484-I496 HydrophobicContact CG-CG2 4.49Å; M491-I496 HydrophobicContact CB-CD1 3.88Å; M491-I496 HydrophobicContact CB-CG1 3.94Å; M491-I496 WeakPolarHBondContact O-CD1 3.33Å; P492-I496 WeakPolarHBondContact O-CG1 3.23Å; P492-I496 PolarHBondContact O-N 2.86Å; K493-I496 PolarHBondContact O-N 2.42Å; I496-R498 PolarHBondContact O-N 3.35Å; I496-L499 PolarHBondContact O-N 2.82Å; I496-V500 HydrophobicContact CG2-CG2 4.01Å; I496-V500 WeakPolarHBondContact O-CG2 3.45Å; I496-V500 PolarHBondContact O-N 2.94Å; I496-F535 HydrophobicContact CB-CE2 4.25Å; I496-F535 HydrophobicContact CB-CZ 4.23Å; I496-F535 HydrophobicContact CG1-CE1 4.21Å; I496-F535 HydrophobicContact CG1-CE2 4.27Å; I496-F535 HydrophobicContact CG1-CZ 3.86Å; I496-F535 HydrophobicContact CG2-CE2 4.09Å
497	T	93.7	Very high	91	Very high	43 Å²	43	62.4 Å²	62.4	26%	0.264	30%	0.3	S	S	.	.	H	α-helix	trans	-57.5	-48	-179.9	-54.1	0	0	0	0	110.8	Q481 K493 E494 L499 V500 F501	Q481-T497 WeakPolarHBondContact CG-OG1 3.49Å; Q481-T497 PolarHBondContact NE2-OG1 2.78Å; K493-T497 VanDerWaalsContact O-CB 3.31Å; K493-T497 WeakPolarHBondContact O-CB 3.29Å; K493-T497 PolarHBondContact O-N 3.46Å; K493-T497 PolarHBondContact O-OG1 3.05Å; E494-T497 PolarHBondContact O-N 3.17Å; T497-L499 PolarHBondContact O-N 3.35Å; T497-V500 PolarHBondContact O-N 2.98Å; T497-F501 HydrophobicContact CG2-CD2 3.79Å; T497-F501 HydrophobicContact CG2-CE2 4.1Å; T497-F501 WeakPolarHBondContact O-CD2 3.48Å; T497-F501 PolarHBondContact O-N 3.14Å; T497-F501 VanDerWaalsContact O-N 3.11Å
498	R	93	Very high	91.3	Very high	156 Å²	156	60.4 Å²	60.4	59%	0.589	29%	0.291	S	S	*	.	H	α-helix	trans	-56.7	-35.6	179.5	-176.3	176.8	61.5	159	-4	113.1	E494 Y495 I496 D502	E494-R498 WeakPolarHBondContact O-CB 3.28Å; E494-R498 PolarHBondContact O-N 3.44Å; Y495-R498 PolarHBondContact O-N 3.31Å; I496-R498 PolarHBondContact O-N 3.35Å; R498-D502 WeakPolarHBondContact O-CB 3.33Å; R498-D502 PolarHBondContact O-N 3.07Å
499	L	93	Very high	91.6	Very high	5 Å²	5	59 Å²	59	3%	0.026	28%	0.284	C	S	.	.	H	α-helix	trans	-89.7	-35.5	-178.7	-55.7	-174.7	0	0	0	113.6	Y495 I496 T497 F501 D502 H505 V534 F535	Y495-L499 HydrophobicContact CD1-CD1 4.32Å; Y495-L499 HydrophobicContact CE1-CD1 3.59Å; Y495-L499 HydrophobicContact CE1-CG 4.49Å; Y495-L499 HydrophobicContact CE2-CD1 4.43Å; Y495-L499 PolarHBondContact O-N 3.27Å; I496-L499 PolarHBondContact O-N 2.82Å; T497-L499 PolarHBondContact O-N 3.35Å; L499-F501 PolarHBondContact O-N 3.33Å; L499-D502 PolarHBondContact O-N 3.41Å; L499-H505 WeakPolarHBondContact O-CB 3.36Å; L499-V534 HydrophobicContact CD1-CG1 3.66Å; L499-F535 HydrophobicContact CB-CE2 4.11Å; L499-F535 HydrophobicContact CD1-CE2 4.46Å; L499-F535 HydrophobicContact CD1-CZ 4.14Å
500	V	93.8	Very high	92.2	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-64.5	-29.6	175.5	173.2	0	0	0	0	111.7	L477 Q481 F484 I496 T497 F535	L477-V500 HydrophobicContact CB-CG1 4.34Å; L477-V500 HydrophobicContact CD2-CG1 4.04Å; Q481-V500 HydrophobicContact CB-CG1 4.31Å; F484-V500 HydrophobicContact CD2-CG2 3.79Å; F484-V500 HydrophobicContact CE2-CG2 4.01Å; I496-V500 HydrophobicContact CG2-CG2 4.01Å; I496-V500 WeakPolarHBondContact O-CG2 3.45Å; I496-V500 PolarHBondContact O-N 2.94Å; T497-V500 PolarHBondContact O-N 2.98Å; V500-F535 HydrophobicContact CG2-CD2 4.25Å; V500-F535 HydrophobicContact CG2-CE2 4.28Å
501	F	92.7	Very high	92.7	Very high	45 Å²	45	47 Å²	47	20%	0.197	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	5.5	177.2	-66.4	-82.7	0	0	0	114.5	N463 L474 L477 V478 Q481 T497 L499 P503	N463-F501 WeakPolarHBondContact CB-O 3.39Å; N463-F501 PolarHBondContact ND2-O 2.82Å; L474-F501 HydrophobicContact CD1-CD1 4.46Å; L474-F501 HydrophobicContact CD1-CE1 3.89Å; L477-F501 HydrophobicContact CB-CD1 4.25Å; L477-F501 HydrophobicContact CB-CE1 3.49Å; L477-F501 VanDerWaalsContact CB-CE1 3.49Å; L477-F501 HydrophobicContact CB-CZ 3.71Å; L477-F501 HydrophobicContact CD1-CD1 4.12Å; L477-F501 HydrophobicContact CD1-CE1 4.04Å; L477-F501 HydrophobicContact CG-CE1 4.41Å; V478-F501 HydrophobicContact CG2-CZ 3.83Å; Q481-F501 HydrophobicContact CB-CE2 4.22Å; Q481-F501 HydrophobicContact CG-CE2 4.4Å; T497-F501 HydrophobicContact CG2-CD2 3.79Å; T497-F501 HydrophobicContact CG2-CE2 4.1Å; T497-F501 WeakPolarHBondContact O-CD2 3.48Å; T497-F501 PolarHBondContact O-N 3.14Å; T497-F501 VanDerWaalsContact O-N 3.11Å; L499-F501 PolarHBondContact O-N 3.33Å; F501-P503 WeakPolarHBondContact O-CD 3.32Å
502	D	92	Very high	92.9	Very high	42 Å²	42	46.9 Å²	46.9	23%	0.225	22%	0.222	C	C	.	.			trans	-76	122.2	172.3	174.6	-0.8	0	0	0	109.9	R498 L499 K504 H505	R498-D502 WeakPolarHBondContact O-CB 3.33Å; R498-D502 PolarHBondContact O-N 3.07Å; L499-D502 PolarHBondContact O-N 3.41Å; D502-K504 PolarHBondContact O-N 3.17Å; D502-K504 WeakPolarHBondContact OD1-CB 3.39Å; D502-K504 WeakPolarHBondContact OD1-CG 3.41Å; D502-K504 PolarHBondContact OD1-N 3.27Å; D502-H505 WeakPolarHBondContact CB-ND1 3.47Å; D502-H505 VanDerWaalsContact CG-ND1 3.34Å; D502-H505 PolarHBondContact O-N 2.87Å; D502-H505 IonicContact OD2-CE1 2.95Å; D502-H505 PolarHBondContact OD2-CE1 3.38Å; D502-H505 IonicContact OD2-ND1 3.67Å; D502-H505 PolarHBondContact OD2-ND1 2.97Å
503	P	89.9	Confident	92.8	Very high	67 Å²	67	49.2 Å²	49.2	44%	0.435	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-15.1	178.1	-24.6	34.7	0	0	0	115.6	N463 L465 F501 H505	N463-P503 WeakPolarHBondContact O-CA 3.3Å; L465-P503 HydrophobicContact CD1-CG 3.94Å; L465-P503 HydrophobicContact CD2-CG 4.42Å; L465-P503 HydrophobicContact CG-CG 3.8Å; F501-P503 WeakPolarHBondContact O-CD 3.32Å; P503-H505 VanDerWaalsContact C-N 3.31Å
504	K	90.6	Very high	92.5	Very high	148 Å²	148	47.9 Å²	47.9	64%	0.643	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-13.1	174.1	-61.9	174.1	-177.4	174.7	0	113.2	D502	D502-K504 PolarHBondContact O-N 3.17Å; D502-K504 WeakPolarHBondContact OD1-CB 3.39Å; D502-K504 WeakPolarHBondContact OD1-CG 3.41Å; D502-K504 PolarHBondContact OD1-N 3.27Å
505	H	93.5	Very high	92.4	Very high	5 Å²	5	50.7 Å²	50.7	2%	0.023	25%	0.245	C	C	.	.			trans	-104.5	148.7	178.5	-64.4	74.5	0	0	0	110.6	L499 D502 P503 F522	L499-H505 WeakPolarHBondContact O-CB 3.36Å; D502-H505 WeakPolarHBondContact CB-ND1 3.47Å; D502-H505 VanDerWaalsContact CG-ND1 3.34Å; D502-H505 PolarHBondContact O-N 2.87Å; D502-H505 IonicContact OD2-CE1 2.95Å; D502-H505 PolarHBondContact OD2-CE1 3.38Å; D502-H505 IonicContact OD2-ND1 3.67Å; D502-H505 PolarHBondContact OD2-ND1 2.97Å; P503-H505 VanDerWaalsContact C-N 3.31Å; H505-F522 WeakPolarHBondContact CA-O 3.35Å
506	K	94.6	Very high	92.5	Very high	88 Å²	88	49.6 Å²	49.6	38%	0.383	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	145.9	171.1	-72.2	178.6	173.1	179.8	0	108.5	V460 I461 C521 F522 M524 Y558	V460-K506 HydrophobicContact CG1-CB 4.2Å; V460-K506 HydrophobicContact CG1-CD 4.13Å; I461-K506 CarbonylContact O-C 3.59Å; I461-K506 WeakPolarHBondContact O-CA 3.44Å; K506-C521 WeakPolarHBondContact O-CA 2.99Å; K506-F522 HydrophobicContact CB-CD2 4.41Å; K506-F522 HydrophobicContact CB-CE1 3.98Å; K506-F522 HydrophobicContact CB-CE2 3.82Å; K506-F522 HydrophobicContact CB-CZ 3.59Å; K506-F522 HydrophobicContact CD-CE2 4.34Å; K506-F522 HydrophobicContact CD-CZ 4.35Å; K506-F522 PolarHBondContact N-O 3.06Å; K506-F522 VanDerWaalsContact O-CD1 3.24Å; K506-F522 WeakPolarHBondContact O-CD1 3.09Å; K506-F522 PolarHBondContact O-N 2.84Å; K506-F522 VanDerWaalsContact O-O 3.08Å; K506-M524 HydrophobicContact CD-SD 4.38Å; K506-Y558 WeakPolarHBondContact CD-OH 3.5Å; K506-Y558 PolarHBondContact NZ-OH 3.2Å
507	T	95.9	Very high	92.5	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.012	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	120.5	173	-54.7	0	0	0	0	109.9	I461 L480 F484 S509 I520 C521	I461-T507 PolarHBondContact N-O 3.44Å; I461-T507 PolarHBondContact O-N 3.38Å; L480-T507 HydrophobicContact CD1-CG2 3.41Å; L480-T507 VanDerWaalsContact CD1-CG2 3.41Å; L480-T507 HydrophobicContact CD2-CG2 3.79Å; L480-T507 HydrophobicContact CG-CG2 4.13Å; F484-T507 HydrophobicContact CE2-CG2 4.18Å; F484-T507 HydrophobicContact CZ-CG2 4.13Å; T507-S509 PolarHBondContact O-N 3.47Å; T507-I520 CarbonylContact C-O 3.58Å; T507-I520 VanDerWaalsContact CA-O 3.28Å; T507-I520 WeakPolarHBondContact CA-O 3.41Å; T507-I520 WeakPolarHBondContact CG2-O 3.47Å; T507-C521 HydrophobicContact CG2-CB 4.33Å
508	L	96.6	Very high	92.5	Very high	6 Å²	6	48.4 Å²	48.4	3%	0.031	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	108.8	164	177.2	64.9	0	0	0	107.1	F458 V460 G519 I520 F522 L551 H554 L555	F458-L508 HydrophobicContact CB-CD1 4.34Å; V460-L508 HydrophobicContact CG2-CB 4.35Å; V460-L508 HydrophobicContact CG2-CD1 3.58Å; L508-G519 CarbonylContact O-C 3.52Å; L508-G519 WeakPolarHBondContact O-CA 3.4Å; L508-I520 PolarHBondContact N-O 3.14Å; L508-I520 PolarHBondContact O-N 3.32Å; L508-F522 HydrophobicContact CB-CE1 4.18Å; L508-L551 HydrophobicContact CB-CD1 4.44Å; L508-L551 HydrophobicContact CD2-CD1 3.62Å; L508-L551 HydrophobicContact CD2-CG 4.4Å; L508-L551 VanDerWaalsContact CD2-O 3.28Å; L508-L551 WeakPolarHBondContact CD2-O 3.5Å; L508-L551 HydrophobicContact CG-CD1 3.63Å; L508-H554 HydrophobicContact CD2-CB 4.09Å; L508-L555 HydrophobicContact CB-CD1 4.18Å; L508-L555 HydrophobicContact CD2-CB 3.87Å; L508-L555 HydrophobicContact CD2-CD1 4.07Å
509	S	95.1	Very high	92.6	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	141.1	178.7	66.9	0	0	0	0	111	F458 H459 T507	F458-S509 WeakPolarHBondContact CA-O 3.29Å; H459-S509 PolarHBondContact N-O 2.96Å; H459-S509 PolarHBondContact O-N 3.32Å; H459-S509 PolarHBondContact O-OG 2.9Å; T507-S509 PolarHBondContact O-N 3.47Å
510	L	95.1	Very high	92.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	124.4	167.6	168.6	62.2	0	0	0	109.1	I456 F458 I517 G518 Y547 L551	I456-L510 HydrophobicContact CB-CD1 3.92Å; I456-L510 HydrophobicContact CD1-CD1 4.09Å; I456-L510 HydrophobicContact CG1-CD1 4.39Å; I456-L510 HydrophobicContact CG2-CD1 4.47Å; F458-L510 HydrophobicContact CD1-CB 4.35Å; F458-L510 HydrophobicContact CD1-CD1 4.19Å; F458-L510 HydrophobicContact CE1-CB 4.13Å; F458-L510 HydrophobicContact CE1-CD1 3.72Å; F458-L510 HydrophobicContact CE1-CD2 4.45Å; F458-L510 HydrophobicContact CE1-CG 4.3Å; F458-L510 HydrophobicContact CE2-CD1 4.12Å; F458-L510 HydrophobicContact CZ-CD1 3.69Å; L510-I517 HydrophobicContact CD2-CD1 3.82Å; L510-I517 HydrophobicContact CD2-CG1 3.86Å; L510-I517 HydrophobicContact CG-CD1 3.96Å; L510-I517 HydrophobicContact CG-CG1 3.67Å; L510-I517 PolarHBondContact O-N 2.87Å; L510-G518 PolarHBondContact N-O 3.19Å; L510-G518 PolarHBondContact O-N 2.86Å; L510-Y547 HydrophobicContact CD2-CD1 4.05Å; L510-Y547 HydrophobicContact CD2-CG 3.91Å; L510-L551 HydrophobicContact CB-CD1 4.21Å
511	I	93.6	Very high	93	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.01	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	137.1	-173.6	-47	-173.3	0	0	0	108.3	I456 E457 W476 R515	I456-I511 CarbonylContact C-O 3.54Å; I456-I511 WeakPolarHBondContact CA-O 3.48Å; I456-I511 WeakPolarHBondContact CB-O 3.3Å; E457-I511 HydrophobicContact CB-CB 4.38Å; E457-I511 PolarHBondContact N-O 3.25Å; E457-I511 PolarHBondContact O-N 3.38Å; W476-I511 HydrophobicContact CD2-CD1 3.67Å; W476-I511 HydrophobicContact CE3-CD1 4.03Å; W476-I511 HydrophobicContact CG-CD1 4.24Å; W476-I511 HydrophobicContact CH2-CD1 3.6Å; W476-I511 HydrophobicContact CZ2-CD1 3.2Å; W476-I511 HydrophobicContact CZ3-CD1 4.02Å; I511-R515 CarbonylContact C-O 3.57Å; I511-R515 VanDerWaalsContact CA-O 3.29Å; I511-R515 WeakPolarHBondContact CA-O 3.41Å; I511-R515 WeakPolarHBondContact CG2-O 3.34Å
512	K	90.9	Very high	93.2	Very high	32 Å²	32	38.5 Å²	38.5	14%	0.139	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	129.5	174	179.8	160.5	-176.2	159.7	0	108.8	E450 V455 I456 G514 R515 I517 Y547	E450-K512 IonicContact OE1-NZ 3.7Å; E450-K512 PolarHBondContact OE1-NZ 3.3Å; E450-K512 IonicContact OE2-NZ 2.79Å; E450-K512 PolarHBondContact OE2-NZ 3.31Å; V455-K512 HydrophobicContact CG1-CD 4.39Å; V455-K512 HydrophobicContact CG1-CG 4.29Å; V455-K512 WeakPolarHBondContact O-CA 3.35Å; I456-K512 HydrophobicContact CG2-CB 3.89Å; I456-K512 HydrophobicContact CG2-CD 3.84Å; I456-K512 HydrophobicContact CG2-CG 3.93Å; K512-G514 PolarHBondContact O-N 3.13Å; K512-G514 VanDerWaalsContact O-N 3.12Å; K512-R515 PolarHBondContact N-O 2.96Å; K512-R515 PolarHBondContact O-N 3Å; K512-I517 HydrophobicContact CB-CD1 3.7Å; K512-I517 HydrophobicContact CB-CG1 4.08Å; K512-I517 HydrophobicContact CB-CG2 4Å; K512-I517 HydrophobicContact CD-CD1 4.09Å; K512-Y547 PolarHBondContact NZ-OH 3.12Å
513	D	87.4	Confident	93.3	Very high	124 Å²	124	39.6 Å²	39.6	66%	0.663	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.7	40.4	-178.8	-51	-50.4	0	0	0	112.9	V455 R515	V455-D513 PolarHBondContact O-N 3.31Å; D513-R515 PolarHBondContact O-N 3.41Å
514	G	83.7	Confident	93.5	Very high	55 Å²	55	38.4 Å²	38.4	57%	0.567	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.7	-7	-176.7	0	0	0	0	0	116.3	K512	K512-G514 PolarHBondContact O-N 3.13Å; K512-G514 VanDerWaalsContact O-N 3.12Å
515	R	90.1	Very high	93.6	Very high	197 Å²	197	31.9 Å²	31.9	74%	0.743	16%	0.157	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.5	143.7	-178.5	-59.1	-177.7	-179.2	-161.8	-0.5	111.7	I511 K512 D513 I517	I511-R515 CarbonylContact C-O 3.57Å; I511-R515 VanDerWaalsContact CA-O 3.29Å; I511-R515 WeakPolarHBondContact CA-O 3.41Å; I511-R515 WeakPolarHBondContact CG2-O 3.34Å; K512-R515 PolarHBondContact N-O 2.96Å; K512-R515 PolarHBondContact O-N 3Å; D513-R515 PolarHBondContact O-N 3.41Å; R515-I517 PolarHBondContact O-N 2.64Å
516	V	93.6	Very high	93.4	Very high	23 Å²	23	36.2 Å²	36.2	14%	0.139	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	123.8	171.8	173.9	0	0	0	0	109.1	W476 L480 V483	W476-V516 HydrophobicContact CB-CG2 4.06Å; W476-V516 HydrophobicContact CG-CG2 4.24Å; L480-V516 HydrophobicContact CD2-CG1 3.77Å; L480-V516 HydrophobicContact CG-CG1 3.85Å; V483-V516 HydrophobicContact CG2-CG1 4.27Å
517	I	93.1	Very high	93.2	Very high	18 Å²	18	37.2 Å²	37.2	9%	0.092	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	-10.8	175.8	62.4	163.3	0	0	0	113.6	L510 K512 R515 T539 E542 Y547	L510-I517 HydrophobicContact CD2-CD1 3.82Å; L510-I517 HydrophobicContact CD2-CG1 3.86Å; L510-I517 HydrophobicContact CG-CD1 3.96Å; L510-I517 HydrophobicContact CG-CG1 3.67Å; L510-I517 PolarHBondContact O-N 2.87Å; K512-I517 HydrophobicContact CB-CD1 3.7Å; K512-I517 HydrophobicContact CB-CG1 4.08Å; K512-I517 HydrophobicContact CB-CG2 4Å; K512-I517 HydrophobicContact CD-CD1 4.09Å; R515-I517 PolarHBondContact O-N 2.64Å; I517-T539 WeakPolarHBondContact O-CG2 3.46Å; I517-T539 PolarHBondContact O-N 2.89Å; I517-T539 PolarHBondContact O-OG1 3.39Å; I517-E542 HydrophobicContact CB-CG 4.22Å; I517-E542 HydrophobicContact CD1-CB 4.36Å; I517-E542 HydrophobicContact CD1-CG 4.06Å; I517-E542 HydrophobicContact CG2-CG 4.36Å; I517-Y547 HydrophobicContact CD1-CD2 4.43Å; I517-Y547 HydrophobicContact CD1-CE1 4.42Å; I517-Y547 HydrophobicContact CD1-CE2 4.27Å
518	G	94.4	Very high	92.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.7	176.8	176.7	0	0	0	0	0	113.3	L480 L510 A537	L480-G518 WeakPolarHBondContact CD2-O 3.26Å; L510-G518 PolarHBondContact N-O 3.19Å; L510-G518 PolarHBondContact O-N 2.86Å; G518-A537 CarbonylContact C-O 3.51Å; G518-A537 VanDerWaalsContact CA-O 3.24Å; G518-A537 WeakPolarHBondContact CA-O 3.21Å
519	G	96.1	Very high	92.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.7	170.6	173.7	0	0	0	0	0	114.8	F484 L508 A537	F484-G519 WeakPolarHBondContact CE1-O 3.3Å; L508-G519 CarbonylContact O-C 3.52Å; L508-G519 WeakPolarHBondContact O-CA 3.4Å; G519-A537 PolarHBondContact N-O 3.24Å; G519-A537 PolarHBondContact O-N 2.92Å
520	I	97.6	Very high	92.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	116	172.5	-59.2	176.6	0	0	0	108.8	T507 L508 F522 I533 F535 C536 L551 M552 L555	T507-I520 CarbonylContact C-O 3.58Å; T507-I520 VanDerWaalsContact CA-O 3.28Å; T507-I520 WeakPolarHBondContact CA-O 3.41Å; T507-I520 WeakPolarHBondContact CG2-O 3.47Å; L508-I520 PolarHBondContact N-O 3.14Å; L508-I520 PolarHBondContact O-N 3.32Å; I520-F522 WeakPolarHBondContact O-CD1 3.34Å; I520-I533 HydrophobicContact CG2-CG1 4.46Å; I520-I533 HydrophobicContact CG2-CG2 3.78Å; I520-F535 CarbonylContact C-O 3.57Å; I520-F535 VanDerWaalsContact CA-O 3.27Å; I520-F535 WeakPolarHBondContact CA-O 3.29Å; I520-C536 HydrophobicContact CG1-CB 4.1Å; I520-C536 HydrophobicContact CG2-CB 4.47Å; I520-L551 HydrophobicContact CD1-CD2 4.21Å; I520-L551 HydrophobicContact CD1-CG 3.86Å; I520-L551 HydrophobicContact CG1-CD2 3.82Å; I520-L551 HydrophobicContact CG1-CG 3.89Å; I520-M552 HydrophobicContact CD1-CE 3.85Å; I520-L555 HydrophobicContact CB-CD1 4.49Å; I520-L555 HydrophobicContact CD1-CB 4.44Å; I520-L555 HydrophobicContact CD1-CD2 3.94Å; I520-L555 HydrophobicContact CG2-CD1 4.36Å; I520-L555 HydrophobicContact CG2-CD2 3.92Å
521	C	96.5	Very high	92.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	128.5	171.4	-176.1	0	0	0	0	109.2	F484 K506 T507 V534 F535	F484-C521 HydrophobicContact CE2-CB 4.07Å; F484-C521 HydrophobicContact CZ-CB 4.07Å; K506-C521 WeakPolarHBondContact O-CA 2.99Å; T507-C521 HydrophobicContact CG2-CB 4.33Å; C521-V534 PolarHBondContact O-N 3.45Å; C521-F535 HydrophobicContact CB-CB 4.04Å; C521-F535 HydrophobicContact CB-CD2 3.88Å; C521-F535 HydrophobicContact CB-CG 4.39Å; C521-F535 PolarHBondContact N-O 3.46Å; C521-F535 PolarHBondContact O-N 3.44Å; C521-F535 VanDerWaalsContact O-N 3.16Å
522	F	96.3	Very high	92.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	160.3	-173	66.6	-89.7	0	0	0	112.2	V460 H505 K506 L508 I520 M524 T531 E532 L555 Y558 H559	V460-F522 HydrophobicContact CG1-CZ 4.1Å; H505-F522 WeakPolarHBondContact CA-O 3.35Å; K506-F522 HydrophobicContact CB-CD2 4.41Å; K506-F522 HydrophobicContact CB-CE1 3.98Å; K506-F522 HydrophobicContact CB-CE2 3.82Å; K506-F522 HydrophobicContact CB-CZ 3.59Å; K506-F522 HydrophobicContact CD-CE2 4.34Å; K506-F522 HydrophobicContact CD-CZ 4.35Å; K506-F522 PolarHBondContact N-O 3.06Å; K506-F522 VanDerWaalsContact O-CD1 3.24Å; K506-F522 WeakPolarHBondContact O-CD1 3.09Å; K506-F522 PolarHBondContact O-N 2.84Å; K506-F522 VanDerWaalsContact O-O 3.08Å; L508-F522 HydrophobicContact CB-CE1 4.18Å; I520-F522 WeakPolarHBondContact O-CD1 3.34Å; F522-M524 HydrophobicContact CD2-CG 3.97Å; F522-M524 HydrophobicContact CE2-CG 3.8Å; F522-M524 HydrophobicContact CE2-SD 3.95Å; F522-T531 HydrophobicContact CB-CG2 3.81Å; F522-T531 HydrophobicContact CD2-CG2 3.81Å; F522-T531 HydrophobicContact CG-CG2 4.21Å; F522-E532 CarbonylContact C-O 3.55Å; F522-E532 WeakPolarHBondContact CA-O 3.35Å; F522-E532 WeakPolarHBondContact CB-O 3.21Å; F522-L555 HydrophobicContact CD1-CD1 3.58Å; F522-L555 HydrophobicContact CE1-CD1 3.64Å; F522-L555 HydrophobicContact CG-CD1 4.22Å; F522-L555 HydrophobicContact CZ-CD1 4.32Å; F522-Y558 AromaticContact CE2-CE1 3.83Å; F522-Y558 HydrophobicContact CE2-CE1 3.83Å; F522-Y558 HydrophobicContact CZ-CD1 4.18Å; F522-Y558 AromaticContact CZ-CE1 3.65Å; F522-Y558 HydrophobicContact CZ-CE1 3.65Å; F522-H559 AromaticContact CD2-CE1 3.51Å; F522-H559 AromaticContact CD2-NE2 3.46Å; F522-H559 WeakPolarHBondContact CD2-NE2 3.39Å; F522-H559 AromaticContact CE2-CE1 3.35Å; F522-H559 WeakPolarHBondContact CE2-CE1 3.44Å; F522-H559 AromaticContact CE2-NE2 3.35Å; F522-H559 VanDerWaalsContact CE2-NE2 3.35Å; F522-H559 WeakPolarHBondContact CE2-NE2 3.48Å; F522-H559 AromaticContact CZ-CE1 3.81Å
523	R	95.1	Very high	92.8	Very high	65 Å²	65	38.5 Å²	38.5	25%	0.245	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	117.9	178.7	-179.5	172.9	175	-145.2	-5.2	110.3	F525 T531 E532	R523-F525 HydrophobicContact CB-CE2 4.27Å; R523-F525 HydrophobicContact CG-CD2 4.45Å; R523-F525 HydrophobicContact CG-CE2 3.83Å; R523-F525 HydrophobicContact CG-CZ 4.01Å; R523-F525 WeakPolarHBondContact O-CD2 3.26Å; R523-T531 CarbonylContact O-C 3.52Å; R523-T531 WeakPolarHBondContact O-CA 3.38Å; R523-E532 HydrophobicContact CB-CB 4.39Å; R523-E532 PolarHBondContact N-O 3.21Å; R523-E532 PolarHBondContact O-N 3.41Å
524	M	92.8	Very high	93.1	Very high	42 Å²	42	33.3 Å²	33.3	21%	0.207	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	138.4	-178.7	-59.9	170.2	77.8	0	0	110.3	K506 F522 Y558 H562 I564	K506-M524 HydrophobicContact CD-SD 4.38Å; F522-M524 HydrophobicContact CD2-CG 3.97Å; F522-M524 HydrophobicContact CE2-CG 3.8Å; F522-M524 HydrophobicContact CE2-SD 3.95Å; M524-Y558 HydrophobicContact CE-CE1 4.26Å; M524-Y558 HydrophobicContact SD-CE1 4Å; M524-H562 HydrophobicContact CE-CB 3.71Å; M524-I564 HydrophobicContact CB-CD1 3.93Å; M524-I564 HydrophobicContact CE-CD1 3.73Å; M524-I564 HydrophobicContact CG-CD1 4.34Å
525	F	93.4	Very high	93.7	Very high	11 Å²	11	30.9 Å²	30.9	5%	0.048	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	76.2	173	-66.2	-91	0	0	0	109.6	R523 S527 Q528 G529 F530 E532 Y598	R523-F525 HydrophobicContact CB-CE2 4.27Å; R523-F525 HydrophobicContact CG-CD2 4.45Å; R523-F525 HydrophobicContact CG-CE2 3.83Å; R523-F525 HydrophobicContact CG-CZ 4.01Å; R523-F525 WeakPolarHBondContact O-CD2 3.26Å; F525-S527 PolarHBondContact O-N 2.89Å; F525-Q528 HydrophobicContact CB-CB 4.18Å; F525-Q528 PolarHBondContact O-N 3.39Å; F525-Q528 VanDerWaalsContact O-N 3.15Å; F525-G529 PolarHBondContact O-N 2.9Å; F525-F530 CarbonylContact C-O 3.53Å; F525-F530 WeakPolarHBondContact CA-O 3.28Å; F525-F530 HydrophobicContact CB-CD1 4.07Å; F525-F530 HydrophobicContact CB-CE1 3.85Å; F525-F530 HydrophobicContact CB-CZ 4.14Å; F525-F530 WeakPolarHBondContact CB-O 3.44Å; F525-F530 HydrophobicContact CD1-CZ 4.44Å; F525-F530 HydrophobicContact CD2-CD2 4.21Å; F525-F530 HydrophobicContact CD2-CE1 4.12Å; F525-F530 AromaticContact CD2-CE2 3.56Å; F525-F530 HydrophobicContact CD2-CE2 3.56Å; F525-F530 AromaticContact CD2-CZ 3.51Å; F525-F530 HydrophobicContact CD2-CZ 3.51Å; F525-F530 AromaticContact CE2-CE2 3.91Å; F525-F530 HydrophobicContact CE2-CE2 3.91Å; F525-F530 AromaticContact CE2-CZ 3.89Å; F525-F530 HydrophobicContact CE2-CZ 3.89Å; F525-F530 HydrophobicContact CG-CE1 4Å; F525-F530 HydrophobicContact CG-CE2 4.27Å; F525-F530 AromaticContact CG-CZ 3.8Å; F525-F530 HydrophobicContact CG-CZ 3.8Å; F525-F530 HydrophobicContact CZ-CZ 4.48Å; F525-F530 PolarHBondContact N-O 3.22Å; F525-F530 PolarHBondContact O-N 3.22Å; F525-E532 HydrophobicContact CD2-CB 4.47Å; F525-E532 HydrophobicContact CE2-CB 3.82Å; F525-Y598 AromaticContact CD1-CD1 3.91Å; F525-Y598 HydrophobicContact CD1-CD1 3.91Å; F525-Y598 AromaticContact CE1-CD1 3.82Å; F525-Y598 HydrophobicContact CE1-CD1 3.82Å; F525-Y598 HydrophobicContact CE1-CG 4.39Å; F525-Y598 WeakPolarHBondContact CZ-O 3.35Å
526	P	90.1	Very high	93.9	Very high	96 Å²	96	23 Å²	23	62%	0.623	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-42.4	-170.1	-23.7	33.7	0	0	0	113.5	Q528 G529 I564	P526-Q528 VanDerWaalsContact C-N 3.29Å; P526-Q528 PolarHBondContact O-N 3.21Å; P526-G529 PolarHBondContact O-N 3.39Å; P526-G529 VanDerWaalsContact O-N 3.12Å; P526-I564 HydrophobicContact CB-CD1 4.36Å; P526-I564 HydrophobicContact CG-CD1 4.18Å
527	S	88.9	Confident	93.9	Very high	109 Å²	109	22.3 Å²	22.3	76%	0.762	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-21.3	-179.8	41.1	0	0	0	0	114.1	F525	F525-S527 PolarHBondContact O-N 2.89Å
528	Q	88.8	Confident	93.9	Very high	35 Å²	35	22.1 Å²	22.1	16%	0.164	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-16.8	171.3	-66.6	73.4	21.8	0	0	112.3	F525 P526 F530 K594 Y598	F525-Q528 HydrophobicContact CB-CB 4.18Å; F525-Q528 PolarHBondContact O-N 3.39Å; F525-Q528 VanDerWaalsContact O-N 3.15Å; P526-Q528 VanDerWaalsContact C-N 3.29Å; P526-Q528 PolarHBondContact O-N 3.21Å; Q528-F530 HydrophobicContact CB-CD1 3.61Å; Q528-F530 HydrophobicContact CB-CE1 3.63Å; Q528-F530 HydrophobicContact CG-CE1 4.24Å; Q528-K594 WeakPolarHBondContact CG-O 3.45Å; Q528-Y598 HydrophobicContact CG-CD1 4.49Å; Q528-Y598 HydrophobicContact CG-CE1 4.28Å; Q528-Y598 HydrophobicContact CG-CE2 4.49Å; Q528-Y598 PolarHBondContact NE2-OH 2.94Å
529	G	89.6	Confident	93.7	Very high	25 Å²	25	23.8 Å²	23.8	26%	0.258	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	26.3	177.7	0	0	0	0	0	114.8	F525 P526 N566	F525-G529 PolarHBondContact O-N 2.9Å; P526-G529 PolarHBondContact O-N 3.39Å; P526-G529 VanDerWaalsContact O-N 3.12Å; G529-N566 WeakPolarHBondContact O-CB 3.44Å; G529-N566 PolarHBondContact O-ND2 3.02Å
530	F	94.5	Very high	93.1	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	167.4	176.9	82.2	-85	0	0	0	113.5	F525 Q528 E532 I564 N566 L568 K594	F525-F530 CarbonylContact C-O 3.53Å; F525-F530 WeakPolarHBondContact CA-O 3.28Å; F525-F530 HydrophobicContact CB-CD1 4.07Å; F525-F530 HydrophobicContact CB-CE1 3.85Å; F525-F530 HydrophobicContact CB-CZ 4.14Å; F525-F530 WeakPolarHBondContact CB-O 3.44Å; F525-F530 HydrophobicContact CD1-CZ 4.44Å; F525-F530 HydrophobicContact CD2-CD2 4.21Å; F525-F530 HydrophobicContact CD2-CE1 4.12Å; F525-F530 AromaticContact CD2-CE2 3.56Å; F525-F530 HydrophobicContact CD2-CE2 3.56Å; F525-F530 AromaticContact CD2-CZ 3.51Å; F525-F530 HydrophobicContact CD2-CZ 3.51Å; F525-F530 AromaticContact CE2-CE2 3.91Å; F525-F530 HydrophobicContact CE2-CE2 3.91Å; F525-F530 AromaticContact CE2-CZ 3.89Å; F525-F530 HydrophobicContact CE2-CZ 3.89Å; F525-F530 HydrophobicContact CG-CE1 4Å; F525-F530 HydrophobicContact CG-CE2 4.27Å; F525-F530 AromaticContact CG-CZ 3.8Å; F525-F530 HydrophobicContact CG-CZ 3.8Å; F525-F530 HydrophobicContact CZ-CZ 4.48Å; F525-F530 PolarHBondContact N-O 3.22Å; F525-F530 PolarHBondContact O-N 3.22Å; Q528-F530 HydrophobicContact CB-CD1 3.61Å; Q528-F530 HydrophobicContact CB-CE1 3.63Å; Q528-F530 HydrophobicContact CG-CE1 4.24Å; F530-E532 HydrophobicContact CE2-CB 4.37Å; F530-I564 VanDerWaalsContact C-CG2 3.43Å; F530-N566 CarbonylContact C-O 3.54Å; F530-N566 VanDerWaalsContact CA-O 3.23Å; F530-N566 WeakPolarHBondContact CA-O 3.39Å; F530-N566 HydrophobicContact CB-CB 3.89Å; F530-L568 HydrophobicContact CD2-CB 4.22Å; F530-L568 HydrophobicContact CD2-CD1 3.73Å; F530-L568 HydrophobicContact CD2-CG 4.04Å; F530-L568 HydrophobicContact CE2-CD1 4Å; F530-L568 HydrophobicContact CG-CD1 4.15Å; F530-K594 WeakPolarHBondContact CE1-O 3.33Å
531	T	95.6	Very high	92.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	133.2	168.7	-73.4	0	0	0	0	109.8	F522 R523 H559 N566 F567 L568	F522-T531 HydrophobicContact CB-CG2 3.81Å; F522-T531 HydrophobicContact CD2-CG2 3.81Å; F522-T531 HydrophobicContact CG-CG2 4.21Å; R523-T531 CarbonylContact O-C 3.52Å; R523-T531 WeakPolarHBondContact O-CA 3.38Å; T531-H559 PolarHBondContact OG1-CD2 2.76Å; T531-H559 PolarHBondContact OG1-NE2 2.69Å; T531-H559 VanDerWaalsContact OG1-NE2 3.14Å; T531-N566 PolarHBondContact N-O 3.04Å; T531-F567 HydrophobicContact CG2-CD1 4.42Å; T531-F567 WeakPolarHBondContact O-CA 3.4Å; T531-L568 PolarHBondContact O-N 3.39Å
532	E	95.6	Very high	91.5	Very high	3 Å²	3	34.9 Å²	34.9	1%	0.014	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	123.9	167.2	174.6	-178.3	-148.4	0	0	108.9	F522 R523 F525 F530 V534 L568 I599 K600	F522-E532 CarbonylContact C-O 3.55Å; F522-E532 WeakPolarHBondContact CA-O 3.35Å; F522-E532 WeakPolarHBondContact CB-O 3.21Å; R523-E532 HydrophobicContact CB-CB 4.39Å; R523-E532 PolarHBondContact N-O 3.21Å; R523-E532 PolarHBondContact O-N 3.41Å; F525-E532 HydrophobicContact CD2-CB 4.47Å; F525-E532 HydrophobicContact CE2-CB 3.82Å; F530-E532 HydrophobicContact CE2-CB 4.37Å; E532-V534 HydrophobicContact CG-CG2 3.75Å; E532-L568 CarbonylContact C-O 3.58Å; E532-L568 WeakPolarHBondContact CA-O 3.34Å; E532-I599 HydrophobicContact CG-CD1 4.29Å; E532-I599 HydrophobicContact CG-CG1 3.95Å; E532-I599 WeakPolarHBondContact OE1-CG1 3.45Å; E532-K600 PolarHBondContact OE1-N 2.92Å
533	I	96.1	Very high	90.4	Very high	5 Å²	5	39.1 Å²	39.1	3%	0.026	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	121.4	164	-65.2	174	0	0	0	107.3	I520 C536 M552 L555 F567 L568 T569 F584	I520-I533 HydrophobicContact CG2-CG1 4.46Å; I520-I533 HydrophobicContact CG2-CG2 3.78Å; I533-C536 HydrophobicContact CG2-CB 4.41Å; I533-M552 HydrophobicContact CD1-CE 4.2Å; I533-L555 HydrophobicContact CD1-CD2 3.74Å; I533-L555 HydrophobicContact CG1-CD2 4.24Å; I533-F567 HydrophobicContact CD1-CB 4.34Å; I533-F567 HydrophobicContact CD1-CD2 4.05Å; I533-F567 HydrophobicContact CD1-CG 4.23Å; I533-L568 PolarHBondContact N-O 3.23Å; I533-T569 PolarHBondContact O-OG1 3.35Å; I533-F584 HydrophobicContact CD1-CE1 4.34Å; I533-F584 HydrophobicContact CD1-CZ 3.79Å
534	V	94	Very high	89.2	Confident	16 Å²	16	43.4 Å²	43.4	10%	0.097	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-48.2	-172.9	179	0	0	0	0	110.9	L499 C521 E532	L499-V534 HydrophobicContact CD1-CG1 3.66Å; C521-V534 PolarHBondContact O-N 3.45Å; E532-V534 HydrophobicContact CG-CG2 3.75Å
535	F	94.9	Very high	88.5	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.018	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	142.1	176.7	-52.2	-52.4	0	0	0	110.2	F484 L488 M491 Y495 I496 L499 V500 I520 C521	F484-F535 HydrophobicContact CD1-CB 3.6Å; F484-F535 HydrophobicContact CD1-CG 4.39Å; F484-F535 HydrophobicContact CD2-CB 4.35Å; F484-F535 HydrophobicContact CD2-CD2 4.19Å; F484-F535 HydrophobicContact CE1-CB 3.55Å; F484-F535 HydrophobicContact CE2-CB 4.3Å; F484-F535 HydrophobicContact CE2-CD2 4.44Å; F484-F535 HydrophobicContact CG-CB 4.03Å; F484-F535 HydrophobicContact CG-CD2 4.37Å; F484-F535 HydrophobicContact CG-CG 4.38Å; F484-F535 HydrophobicContact CZ-CB 3.93Å; L488-F535 HydrophobicContact CD1-CB 3.98Å; L488-F535 HydrophobicContact CD1-CD1 3.7Å; L488-F535 HydrophobicContact CD1-CG 4.13Å; M491-F535 HydrophobicContact CG-CE1 4.37Å; M491-F535 HydrophobicContact SD-CE1 4.49Å; Y495-F535 HydrophobicContact CD1-CE1 4.48Å; Y495-F535 HydrophobicContact CD1-CZ 4.06Å; Y495-F535 HydrophobicContact CE1-CE1 4.3Å; Y495-F535 HydrophobicContact CE1-CZ 4.03Å; I496-F535 HydrophobicContact CB-CE2 4.25Å; I496-F535 HydrophobicContact CB-CZ 4.23Å; I496-F535 HydrophobicContact CG1-CE1 4.21Å; I496-F535 HydrophobicContact CG1-CE2 4.27Å; I496-F535 HydrophobicContact CG1-CZ 3.86Å; I496-F535 HydrophobicContact CG2-CE2 4.09Å; L499-F535 HydrophobicContact CB-CE2 4.11Å; L499-F535 HydrophobicContact CD1-CE2 4.46Å; L499-F535 HydrophobicContact CD1-CZ 4.14Å; V500-F535 HydrophobicContact CG2-CD2 4.25Å; V500-F535 HydrophobicContact CG2-CE2 4.28Å; I520-F535 CarbonylContact C-O 3.57Å; I520-F535 VanDerWaalsContact CA-O 3.27Å; I520-F535 WeakPolarHBondContact CA-O 3.29Å; C521-F535 HydrophobicContact CB-CB 4.04Å; C521-F535 HydrophobicContact CB-CD2 3.88Å; C521-F535 HydrophobicContact CB-CG 4.39Å; C521-F535 PolarHBondContact N-O 3.46Å; C521-F535 PolarHBondContact O-N 3.44Å; C521-F535 VanDerWaalsContact O-N 3.16Å
536	C	94.6	Very high	88.1	Confident	32 Å²	32	46.3 Å²	46.3	22%	0.216	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	111.2	175.2	171.1	0	0	0	0	108.7	I520 I533 F579	I520-C536 HydrophobicContact CG1-CB 4.1Å; I520-C536 HydrophobicContact CG2-CB 4.47Å; I533-C536 HydrophobicContact CG2-CB 4.41Å; C536-F579 HydrophobicContact CB-CZ 4.21Å
537	A	93.6	Very high	88	Confident	7 Å²	7	41.9 Å²	41.9	6%	0.058	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	151.9	-176	0	0	0	0	0	113.1	V483 F484 Q487 G518 G519	V483-A537 HydrophobicContact CG1-CB 4.33Å; F484-A537 HydrophobicContact CD1-CB 3.66Å; F484-A537 HydrophobicContact CE1-CB 3.95Å; Q487-A537 HydrophobicContact CB-CB 3.84Å; Q487-A537 HydrophobicContact CG-CB 4.26Å; G518-A537 CarbonylContact C-O 3.51Å; G518-A537 VanDerWaalsContact CA-O 3.24Å; G518-A537 WeakPolarHBondContact CA-O 3.21Å; G519-A537 PolarHBondContact N-O 3.24Å; G519-A537 PolarHBondContact O-N 2.92Å
538	V	92.7	Very high	88.1	Confident	15 Å²	15	37.5 Å²	37.5	9%	0.091	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	140	169.5	-179.7	0	0	0	0	107.1	Q487 E542 Q543 L551	Q487-V538 PolarHBondContact OE1-O 3.3Å; V538-E542 HydrophobicContact CG1-CB 3.94Å; V538-Q543 HydrophobicContact CB-CG 4.31Å; V538-Q543 PolarHBondContact O-NE2 3.5Å; V538-L551 HydrophobicContact CG2-CD2 4.42Å
539	T	90.3	Very high	88.2	Confident	35 Å²	35	37.4 Å²	37.4	22%	0.215	22%	0.22	C	C	.	.			trans	-54.1	137.3	176.3	49	0	0	0	0	111.6	V483 I517 N541 E542 Q543	V483-T539 HydrophobicContact CB-CG2 4.45Å; V483-T539 HydrophobicContact CG1-CG2 3.99Å; V483-T539 HydrophobicContact CG2-CG2 3.64Å; I517-T539 WeakPolarHBondContact O-CG2 3.46Å; I517-T539 PolarHBondContact O-N 2.89Å; I517-T539 PolarHBondContact O-OG1 3.39Å; T539-N541 PolarHBondContact O-N 3.21Å; T539-N541 VanDerWaalsContact O-N 3.11Å; T539-E542 CarbonylContact O-C 3.4Å; T539-E542 WeakPolarHBondContact O-CA 3.47Å; T539-E542 PolarHBondContact O-N 2.92Å; T539-Q543 PolarHBondContact O-N 3.14Å; T539-Q543 VanDerWaalsContact O-N 3.16Å
540	S	83.7	Confident	88.3	Confident	66 Å²	66	36.3 Å²	36.3	46%	0.462	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-53.4	-38	-170.6	-48.1	0	0	0	0	113.8	Q487 E542 Q543	Q487-S540 PolarHBondContact NE2-OG 3.45Å; Q487-S540 PolarHBondContact OE1-OG 2.98Å; Q487-S540 VanDerWaalsContact OE1-OG 3.09Å; S540-E542 PolarHBondContact O-N 3.16Å; S540-Q543 WeakPolarHBondContact O-CB 3.36Å; S540-Q543 PolarHBondContact O-N 3.06Å
541	N	80.8	Confident	88.2	Confident	138 Å²	138	36.3 Å²	36.3	74%	0.738	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-66.4	-22	179.4	-58	8.7	0	0	0	113.4	T539 K545	T539-N541 PolarHBondContact O-N 3.21Å; T539-N541 VanDerWaalsContact O-N 3.11Å; N541-K545 WeakPolarHBondContact O-CE 3.43Å; N541-K545 PolarHBondContact O-NZ 3.47Å
542	E	80.8	Confident	88.2	Confident	29 Å²	29	36.3 Å²	36.3	14%	0.136	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-106.2	-0.4	178	-62.5	-49.2	116.2	0	0	112.9	I517 V538 T539 S540 K545 Y547	I517-E542 HydrophobicContact CB-CG 4.22Å; I517-E542 HydrophobicContact CD1-CB 4.36Å; I517-E542 HydrophobicContact CD1-CG 4.06Å; I517-E542 HydrophobicContact CG2-CG 4.36Å; V538-E542 HydrophobicContact CG1-CB 3.94Å; T539-E542 CarbonylContact O-C 3.4Å; T539-E542 WeakPolarHBondContact O-CA 3.47Å; T539-E542 PolarHBondContact O-N 2.92Å; S540-E542 PolarHBondContact O-N 3.16Å; E542-K545 IonicContact OE1-NZ 2.95Å; E542-K545 PolarHBondContact OE1-NZ 3.37Å; E542-K545 VanDerWaalsContact OE2-CD 3.28Å; E542-K545 WeakPolarHBondContact OE2-CD 3.31Å; E542-K545 IonicContact OE2-NZ 2.69Å; E542-K545 PolarHBondContact OE2-NZ 3.23Å; E542-Y547 HydrophobicContact CB-CD2 3.99Å; E542-Y547 HydrophobicContact CB-CE2 3.73Å; E542-Y547 HydrophobicContact CG-CE2 4.25Å; E542-Y547 VanDerWaalsContact O-CD2 3.26Å; E542-Y547 WeakPolarHBondContact O-CD2 3.38Å; E542-Y547 VanDerWaalsContact OE2-CE2 3.22Å; E542-Y547 WeakPolarHBondContact OE2-CE2 3.28Å; E542-Y547 PolarHBondContact OE2-OH 3.27Å
543	Q	73.1	Confident	88.1	Confident	89 Å²	89	36.5 Å²	36.5	42%	0.416	21%	0.209	S	C	.	.	S	Bend	trans	-66	162.8	172.2	-69.4	-178.7	17.7	0	0	111.6	V538 T539 S540 K545	V538-Q543 HydrophobicContact CB-CG 4.31Å; V538-Q543 PolarHBondContact O-NE2 3.5Å; T539-Q543 PolarHBondContact O-N 3.14Å; T539-Q543 VanDerWaalsContact O-N 3.16Å; S540-Q543 WeakPolarHBondContact O-CB 3.36Å; S540-Q543 PolarHBondContact O-N 3.06Å; Q543-K545 PolarHBondContact O-N 2.98Å
544	V	69.4	Low	88	Confident	155 Å²	155	38 Å²	38	94%	0.939	22%	0.217	S	C	*	.	S	Bend	trans	65.3	-27.4	-175.9	-167.4	0	0	0	0	115.1	G546	V544-G546 PolarHBondContact O-N 2.93Å
545	K	78.6	Confident	88	Confident	102 Å²	102	37.3 Å²	37.3	44%	0.443	21%	0.212	S	C	.	.	S	Bend	trans	-65.2	-0.2	177	-61.1	178.9	-172.8	172.7	0	115.7	N541 E542 Q543 Y547	N541-K545 WeakPolarHBondContact O-CE 3.43Å; N541-K545 PolarHBondContact O-NZ 3.47Å; E542-K545 IonicContact OE1-NZ 2.95Å; E542-K545 PolarHBondContact OE1-NZ 3.37Å; E542-K545 VanDerWaalsContact OE2-CD 3.28Å; E542-K545 WeakPolarHBondContact OE2-CD 3.31Å; E542-K545 IonicContact OE2-NZ 2.69Å; E542-K545 PolarHBondContact OE2-NZ 3.23Å; Q543-K545 PolarHBondContact O-N 2.98Å; K545-Y547 HydrophobicContact CB-CD2 4.03Å; K545-Y547 HydrophobicContact CB-CE2 3.66Å; K545-Y547 HydrophobicContact CD-CE2 3.95Å; K545-Y547 HydrophobicContact CG-CE2 4.44Å
546	G	83.8	Confident	88	Confident	11 Å²	11	37.6 Å²	37.6	11%	0.113	21%	0.213	C	C	.	.	S	Bend	trans	105.1	-20.8	170.6	0	0	0	0	0	116.8	R443 V544 G548 T549 H550	R443-G546 WeakPolarHBondContact O-CA 3.49Å; V544-G546 PolarHBondContact O-N 2.93Å; G546-G548 VanDerWaalsContact C-N 3.25Å; G546-G548 PolarHBondContact O-N 3.26Å; G546-T549 PolarHBondContact O-N 3.08Å; G546-H550 PolarHBondContact O-N 3.06Å
547	Y	89.4	Confident	87.9	Confident	4 Å²	4	37.7 Å²	37.7	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-56.5	-33.2	-169.1	-51.4	-76.8	0	0	0	114.7	A447 E450 I456 L510 K512 I517 E542 K545 T549 H550 L551	A447-Y547 HydrophobicContact CB-CD1 3.71Å; A447-Y547 HydrophobicContact CB-CE1 4.21Å; E450-Y547 WeakPolarHBondContact OE2-CE1 3.48Å; E450-Y547 PolarHBondContact OE2-OH 3.23Å; E450-Y547 VanDerWaalsContact OE2-OH 3.12Å; I456-Y547 HydrophobicContact CD1-CD1 4Å; I456-Y547 HydrophobicContact CD1-CE1 4.06Å; I456-Y547 HydrophobicContact CG2-CE1 4.18Å; L510-Y547 HydrophobicContact CD2-CD1 4.05Å; L510-Y547 HydrophobicContact CD2-CG 3.91Å; K512-Y547 PolarHBondContact NZ-OH 3.12Å; I517-Y547 HydrophobicContact CD1-CD2 4.43Å; I517-Y547 HydrophobicContact CD1-CE1 4.42Å; I517-Y547 HydrophobicContact CD1-CE2 4.27Å; E542-Y547 HydrophobicContact CB-CD2 3.99Å; E542-Y547 HydrophobicContact CB-CE2 3.73Å; E542-Y547 HydrophobicContact CG-CE2 4.25Å; E542-Y547 VanDerWaalsContact O-CD2 3.26Å; E542-Y547 WeakPolarHBondContact O-CD2 3.38Å; E542-Y547 VanDerWaalsContact OE2-CE2 3.22Å; E542-Y547 WeakPolarHBondContact OE2-CE2 3.28Å; E542-Y547 PolarHBondContact OE2-OH 3.27Å; K545-Y547 HydrophobicContact CB-CD2 4.03Å; K545-Y547 HydrophobicContact CB-CE2 3.66Å; K545-Y547 HydrophobicContact CD-CE2 3.95Å; K545-Y547 HydrophobicContact CG-CE2 4.44Å; Y547-T549 VanDerWaalsContact C-N 3.33Å; Y547-T549 PolarHBondContact O-N 3.24Å; Y547-H550 PolarHBondContact O-N 2.99Å; Y547-H550 VanDerWaalsContact O-N 3.16Å; Y547-L551 WeakPolarHBondContact O-CB 3.47Å; Y547-L551 PolarHBondContact O-N 2.93Å
548	G	90.5	Very high	88	Confident	16 Å²	16	39.3 Å²	39.3	17%	0.165	22%	0.215	C	C	.	.	H	α-helix	trans	-58.9	-41.8	176.6	0	0	0	0	0	113.1	G546 M552 Y578	G546-G548 VanDerWaalsContact C-N 3.25Å; G546-G548 PolarHBondContact O-N 3.26Å; G548-M552 WeakPolarHBondContact O-CB 3.47Å; G548-M552 PolarHBondContact O-N 3.31Å; G548-Y578 PolarHBondContact O-OH 3.06Å
549	T	90.8	Very high	88.1	Confident	34 Å²	34	38.6 Å²	38.6	21%	0.209	21%	0.211	C	C	.	.	H	α-helix	trans	-65.7	-42.9	174	-56.6	0	0	0	0	111.2	D444 G546 Y547 M552 N553 Q582	D444-T549 HydrophobicContact CB-CG2 4.33Å; G546-T549 PolarHBondContact O-N 3.08Å; Y547-T549 VanDerWaalsContact C-N 3.33Å; Y547-T549 PolarHBondContact O-N 3.24Å; T549-M552 PolarHBondContact O-N 3.27Å; T549-N553 VanDerWaalsContact O-CG 3.24Å; T549-N553 PolarHBondContact O-N 2.8Å; T549-N553 PolarHBondContact O-ND2 2.75Å; T549-Q582 PolarHBondContact OG1-NE2 3.13Å; T549-Q582 VanDerWaalsContact OG1-NE2 3.12Å
550	H	91.2	Very high	88.2	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-66.6	-41.9	-178.8	-157.6	41.1	0	0	0	112.2	D444 A447 E451 F458 G546 Y547 M552 N553 H554	D444-H550 HydrophobicContact CB-CB 4.23Å; A447-H550 HydrophobicContact CB-CB 3.89Å; E451-H550 IonicContact OE2-CD2 2.67Å; E451-H550 IonicContact OE2-CE1 2.61Å; E451-H550 PolarHBondContact OE2-CE1 3.11Å; E451-H550 IonicContact OE2-NE2 2.91Å; E451-H550 PolarHBondContact OE2-NE2 2.89Å; F458-H550 AromaticContact CE2-CD2 3.56Å; F458-H550 AromaticContact CE2-NE2 3.94Å; F458-H550 HydrophobicContact CZ-CB 4.4Å; F458-H550 AromaticContact CZ-CD2 3.54Å; G546-H550 PolarHBondContact O-N 3.06Å; Y547-H550 PolarHBondContact O-N 2.99Å; Y547-H550 VanDerWaalsContact O-N 3.16Å; H550-M552 PolarHBondContact O-N 3.29Å; H550-N553 WeakPolarHBondContact O-CB 3.4Å; H550-N553 PolarHBondContact O-N 2.65Å; H550-H554 AromaticContact CE1-NE2 3.96Å; H550-H554 AromaticContact NE2-CD2 3.97Å; H550-H554 AromaticContact NE2-NE2 3.69Å; H550-H554 PolarHBondContact O-CD2 3.2Å; H550-H554 PolarHBondContact O-N 3.29Å
551	L	93.2	Very high	88.6	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.2	-41.3	171.9	-179.7	65.2	0	0	0	112.3	F458 L508 L510 I520 V538 Y547 L555	F458-L551 HydrophobicContact CD1-CD1 3.91Å; F458-L551 HydrophobicContact CE1-CB 3.98Å; F458-L551 HydrophobicContact CE1-CD1 3.78Å; L508-L551 HydrophobicContact CB-CD1 4.44Å; L508-L551 HydrophobicContact CD2-CD1 3.62Å; L508-L551 HydrophobicContact CD2-CG 4.4Å; L508-L551 VanDerWaalsContact CD2-O 3.28Å; L508-L551 WeakPolarHBondContact CD2-O 3.5Å; L508-L551 HydrophobicContact CG-CD1 3.63Å; L510-L551 HydrophobicContact CB-CD1 4.21Å; I520-L551 HydrophobicContact CD1-CD2 4.21Å; I520-L551 HydrophobicContact CD1-CG 3.86Å; I520-L551 HydrophobicContact CG1-CD2 3.82Å; I520-L551 HydrophobicContact CG1-CG 3.89Å; V538-L551 HydrophobicContact CG2-CD2 4.42Å; Y547-L551 WeakPolarHBondContact O-CB 3.47Å; Y547-L551 PolarHBondContact O-N 2.93Å; L551-L555 WeakPolarHBondContact O-CB 3.44Å; L551-L555 PolarHBondContact O-N 3.03Å
552	M	94.8	Very high	89.1	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-68.9	-36.4	173.8	-177.6	60.8	66.6	0	0	112.4	I520 I533 G548 T549 H550 L555 K556 F567 Y578 F579 Q582 F584	I520-M552 HydrophobicContact CD1-CE 3.85Å; I533-M552 HydrophobicContact CD1-CE 4.2Å; G548-M552 WeakPolarHBondContact O-CB 3.47Å; G548-M552 PolarHBondContact O-N 3.31Å; T549-M552 PolarHBondContact O-N 3.27Å; H550-M552 PolarHBondContact O-N 3.29Å; M552-L555 HydrophobicContact CE-CD2 4.47Å; M552-L555 WeakPolarHBondContact O-CB 3.35Å; M552-L555 PolarHBondContact O-N 3.18Å; M552-L555 HydrophobicContact SD-CD2 3.98Å; M552-K556 VanDerWaalsContact O-CG 3.31Å; M552-K556 WeakPolarHBondContact O-CG 3.5Å; M552-K556 PolarHBondContact O-N 3.19Å; M552-F567 HydrophobicContact SD-CE2 4.37Å; M552-Y578 HydrophobicContact CE-CE1 4.29Å; M552-F579 HydrophobicContact CE-CD1 4.49Å; M552-F579 HydrophobicContact CE-CE1 4.06Å; M552-Q582 HydrophobicContact CB-CG 4.37Å; M552-Q582 HydrophobicContact CG-CB 3.91Å; M552-Q582 HydrophobicContact CG-CG 3.87Å; M552-F584 HydrophobicContact CE-CE2 4.22Å; M552-F584 HydrophobicContact CE-CZ 4.47Å; M552-F584 HydrophobicContact SD-CE2 4.15Å
553	N	93.3	Very high	89.6	Confident	7 Å²	7	47 Å²	47	4%	0.037	24%	0.235	C	C	.	.	H	α-helix	trans	-65	-44.8	175.4	-72.1	-17.3	0	0	0	111.3	D444 T549 H550 L555 K556 E557 Y618	D444-N553 PolarHBondContact OD2-ND2 2.77Å; T549-N553 VanDerWaalsContact O-CG 3.24Å; T549-N553 PolarHBondContact O-N 2.8Å; T549-N553 PolarHBondContact O-ND2 2.75Å; H550-N553 WeakPolarHBondContact O-CB 3.4Å; H550-N553 PolarHBondContact O-N 2.65Å; N553-L555 VanDerWaalsContact C-N 3.35Å; N553-L555 PolarHBondContact O-N 3.31Å; N553-K556 PolarHBondContact O-N 2.96Å; N553-E557 WeakPolarHBondContact O-CB 3.34Å; N553-E557 PolarHBondContact O-N 3Å; N553-Y618 WeakPolarHBondContact CB-O 3.48Å; N553-Y618 VanDerWaalsContact CG-O 3.23Å; N553-Y618 PolarHBondContact ND2-O 2.81Å
554	H	93.9	Very high	90.5	Very high	38 Å²	38	43 Å²	43	18%	0.176	22%	0.216	C	C	.	.	H	α-helix	trans	-61	-39	171.4	-86.1	-66.1	0	0	0	113.1	E451 F458 L508 H550 K556 E557 Y558	E451-H554 IonicContact OE1-CD2 3.54Å; E451-H554 IonicContact OE1-CE1 3.57Å; E451-H554 PolarHBondContact OE1-CE1 3.36Å; E451-H554 IonicContact OE1-NE2 3.36Å; E451-H554 PolarHBondContact OE1-NE2 3.37Å; E451-H554 IonicContact OE2-NE2 2.64Å; E451-H554 PolarHBondContact OE2-NE2 2.97Å; F458-H554 HydrophobicContact CD1-CB 4.42Å; F458-H554 AromaticContact CD1-CD2 3.94Å; F458-H554 AromaticContact CD2-CD2 3.48Å; F458-H554 VanDerWaalsContact CD2-CD2 3.48Å; F458-H554 WeakPolarHBondContact CD2-CD2 3.19Å; F458-H554 AromaticContact CD2-NE2 3.42Å; F458-H554 WeakPolarHBondContact CD2-NE2 3.06Å; F458-H554 AromaticContact CE1-CD2 3.91Å; F458-H554 AromaticContact CE2-CD2 3.46Å; F458-H554 VanDerWaalsContact CE2-CD2 3.46Å; F458-H554 WeakPolarHBondContact CE2-CD2 3.08Å; F458-H554 AromaticContact CE2-NE2 3.55Å; F458-H554 AromaticContact CG-CD2 3.72Å; F458-H554 AromaticContact CZ-CD2 3.67Å; L508-H554 HydrophobicContact CD2-CB 4.09Å; H550-H554 AromaticContact CE1-NE2 3.96Å; H550-H554 AromaticContact NE2-CD2 3.97Å; H550-H554 AromaticContact NE2-NE2 3.69Å; H550-H554 PolarHBondContact O-CD2 3.2Å; H550-H554 PolarHBondContact O-N 3.29Å; H554-K556 PolarHBondContact O-N 3.41Å; H554-E557 PolarHBondContact O-N 3.19Å; H554-Y558 WeakPolarHBondContact O-CB 3.45Å; H554-Y558 PolarHBondContact O-N 2.81Å
555	L	95.6	Very high	91.7	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-61.2	-42.7	175.3	-170.6	77.6	0	0	0	112.1	L508 I520 F522 I533 L551 M552 N553 H559 F567	L508-L555 HydrophobicContact CB-CD1 4.18Å; L508-L555 HydrophobicContact CD2-CB 3.87Å; L508-L555 HydrophobicContact CD2-CD1 4.07Å; I520-L555 HydrophobicContact CB-CD1 4.49Å; I520-L555 HydrophobicContact CD1-CB 4.44Å; I520-L555 HydrophobicContact CD1-CD2 3.94Å; I520-L555 HydrophobicContact CG2-CD1 4.36Å; I520-L555 HydrophobicContact CG2-CD2 3.92Å; F522-L555 HydrophobicContact CD1-CD1 3.58Å; F522-L555 HydrophobicContact CE1-CD1 3.64Å; F522-L555 HydrophobicContact CG-CD1 4.22Å; F522-L555 HydrophobicContact CZ-CD1 4.32Å; I533-L555 HydrophobicContact CD1-CD2 3.74Å; I533-L555 HydrophobicContact CG1-CD2 4.24Å; L551-L555 WeakPolarHBondContact O-CB 3.44Å; L551-L555 PolarHBondContact O-N 3.03Å; M552-L555 HydrophobicContact CE-CD2 4.47Å; M552-L555 WeakPolarHBondContact O-CB 3.35Å; M552-L555 PolarHBondContact O-N 3.18Å; M552-L555 HydrophobicContact SD-CD2 3.98Å; N553-L555 VanDerWaalsContact C-N 3.35Å; N553-L555 PolarHBondContact O-N 3.31Å; L555-H559 PolarHBondContact O-N 3.42Å; L555-H559 VanDerWaalsContact O-N 3.15Å; L555-H559 PolarHBondContact O-ND1 2.66Å; L555-F567 HydrophobicContact CD2-CE2 3.9Å; L555-F567 HydrophobicContact CD2-CZ 4.02Å; L555-F567 HydrophobicContact CG-CE2 4.27Å; L555-F567 HydrophobicContact CG-CZ 4.01Å
556	K	95.1	Very high	92.5	Very high	9 Å²	9	35.3 Å²	35.3	4%	0.039	17%	0.174	C	C	.	.	H	α-helix	trans	-64.6	-47.9	176.8	-68.7	171.2	179	170.2	0	111.2	M552 N553 H554 Y558 H559 I560 F567 Q582 L612 Y618	M552-K556 VanDerWaalsContact O-CG 3.31Å; M552-K556 WeakPolarHBondContact O-CG 3.5Å; M552-K556 PolarHBondContact O-N 3.19Å; N553-K556 PolarHBondContact O-N 2.96Å; H554-K556 PolarHBondContact O-N 3.41Å; K556-Y558 VanDerWaalsContact C-N 3.32Å; K556-Y558 PolarHBondContact O-N 3.1Å; K556-H559 PolarHBondContact O-N 2.92Å; K556-H559 VanDerWaalsContact O-N 3.08Å; K556-I560 VanDerWaalsContact O-CG1 3.32Å; K556-I560 WeakPolarHBondContact O-CG1 3.44Å; K556-I560 PolarHBondContact O-N 2.85Å; K556-F567 HydrophobicContact CG-CE2 3.75Å; K556-F567 HydrophobicContact CG-CZ 4.37Å; K556-Q582 PolarHBondContact NZ-O 3.37Å; K556-L612 HydrophobicContact CB-CD1 4.16Å; K556-L612 HydrophobicContact CB-CD2 4.34Å; K556-L612 HydrophobicContact CD-CD2 3.97Å; K556-L612 HydrophobicContact CG-CD1 4.19Å; K556-L612 HydrophobicContact CG-CD2 3.68Å; K556-Y618 HydrophobicContact CB-CD2 3.9Å; K556-Y618 HydrophobicContact CB-CE2 4.49Å; K556-Y618 HydrophobicContact CB-CG 3.96Å; K556-Y618 HydrophobicContact CD-CD1 3.48Å; K556-Y618 VanDerWaalsContact CD-CD1 3.48Å; K556-Y618 HydrophobicContact CD-CD2 4.16Å; K556-Y618 HydrophobicContact CD-CE1 3.78Å; K556-Y618 HydrophobicContact CD-CE2 4.43Å; K556-Y618 HydrophobicContact CD-CG 3.68Å; K556-Y618 HydrophobicContact CG-CG 4.49Å
557	E	92.4	Very high	93.1	Very high	34 Å²	34	34.8 Å²	34.8	16%	0.159	17%	0.169	C	C	.	.	H	α-helix	trans	-56.9	-43.4	178.8	-168.3	64.3	-146.5	0	0	111.9	N553 H554 K561 Y618 T619	N553-E557 WeakPolarHBondContact O-CB 3.34Å; N553-E557 PolarHBondContact O-N 3Å; H554-E557 PolarHBondContact O-N 3.19Å; E557-K561 WeakPolarHBondContact O-CD 3.1Å; E557-K561 WeakPolarHBondContact O-CG 3.25Å; E557-K561 PolarHBondContact O-N 2.93Å; E557-K561 WeakPolarHBondContact OE1-CE 2.92Å; E557-K561 IonicContact OE1-NZ 3.68Å; E557-K561 PolarHBondContact OE1-NZ 3.38Å; E557-Y618 PolarHBondContact OE2-N 3.48Å; E557-T619 HydrophobicContact CB-CG2 4.25Å; E557-T619 HydrophobicContact CG-CG2 4.18Å
558	Y	94.3	Very high	93.4	Very high	41 Å²	41	34.6 Å²	34.6	16%	0.161	17%	0.168	C	C	.	.	H	α-helix	trans	-63.9	-40.4	173.6	169	-86.9	0	0	0	112.8	V460 K506 F522 M524 H554 K556 K561 H562	V460-Y558 HydrophobicContact CB-CE2 4.21Å; V460-Y558 HydrophobicContact CG1-CE2 4.01Å; V460-Y558 HydrophobicContact CG2-CD2 3.8Å; V460-Y558 HydrophobicContact CG2-CE2 3.9Å; V460-Y558 HydrophobicContact CG2-CG 4.25Å; K506-Y558 WeakPolarHBondContact CD-OH 3.5Å; K506-Y558 PolarHBondContact NZ-OH 3.2Å; F522-Y558 AromaticContact CE2-CE1 3.83Å; F522-Y558 HydrophobicContact CE2-CE1 3.83Å; F522-Y558 HydrophobicContact CZ-CD1 4.18Å; F522-Y558 AromaticContact CZ-CE1 3.65Å; F522-Y558 HydrophobicContact CZ-CE1 3.65Å; M524-Y558 HydrophobicContact CE-CE1 4.26Å; M524-Y558 HydrophobicContact SD-CE1 4Å; H554-Y558 WeakPolarHBondContact O-CB 3.45Å; H554-Y558 PolarHBondContact O-N 2.81Å; K556-Y558 VanDerWaalsContact C-N 3.32Å; K556-Y558 PolarHBondContact O-N 3.1Å; Y558-K561 PolarHBondContact O-N 2.86Å; Y558-H562 AromaticContact CD1-CD2 3.99Å; Y558-H562 AromaticContact CD2-NE2 3.99Å; Y558-H562 AromaticContact CE1-CD2 3.58Å; Y558-H562 AromaticContact CE2-CD2 3.61Å; Y558-H562 AromaticContact CE2-NE2 3.34Å; Y558-H562 VanDerWaalsContact CE2-NE2 3.34Å; Y558-H562 WeakPolarHBondContact CE2-NE2 3.48Å; Y558-H562 AromaticContact CZ-CD2 3.37Å; Y558-H562 AromaticContact CZ-NE2 3.41Å; Y558-H562 PolarHBondContact O-CD2 3.26Å; Y558-H562 VanDerWaalsContact O-CD2 3.23Å; Y558-H562 PolarHBondContact O-N 3.19Å
559	H	94.6	Very high	93.6	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-77.1	-30.8	-178.5	-77.2	93.7	0	0	0	114	F522 T531 L555 K556 K561 H562 E563 I564 F567 L612	F522-H559 AromaticContact CD2-CE1 3.51Å; F522-H559 AromaticContact CD2-NE2 3.46Å; F522-H559 WeakPolarHBondContact CD2-NE2 3.39Å; F522-H559 AromaticContact CE2-CE1 3.35Å; F522-H559 WeakPolarHBondContact CE2-CE1 3.44Å; F522-H559 AromaticContact CE2-NE2 3.35Å; F522-H559 VanDerWaalsContact CE2-NE2 3.35Å; F522-H559 WeakPolarHBondContact CE2-NE2 3.48Å; F522-H559 AromaticContact CZ-CE1 3.81Å; T531-H559 PolarHBondContact OG1-CD2 2.76Å; T531-H559 PolarHBondContact OG1-NE2 2.69Å; T531-H559 VanDerWaalsContact OG1-NE2 3.14Å; L555-H559 PolarHBondContact O-N 3.42Å; L555-H559 VanDerWaalsContact O-N 3.15Å; L555-H559 PolarHBondContact O-ND1 2.66Å; K556-H559 PolarHBondContact O-N 2.92Å; K556-H559 VanDerWaalsContact O-N 3.08Å; H559-K561 VanDerWaalsContact C-N 3.32Å; H559-H562 CarbonylContact O-C 3.6Å; H559-H562 VanDerWaalsContact O-C 3.28Å; H559-H562 WeakPolarHBondContact O-CA 3.44Å; H559-H562 PolarHBondContact O-N 2.89Å; H559-E563 PolarHBondContact O-N 2.77Å; H559-E563 VanDerWaalsContact O-N 3.08Å; H559-I564 PolarHBondContact O-N 3.37Å; H559-F567 HydrophobicContact CB-CE1 3.69Å; H559-F567 HydrophobicContact CB-CZ 3.84Å; H559-F567 AromaticContact CD2-CE1 3.91Å; H559-F567 AromaticContact CG-CE1 3.43Å; H559-F567 VanDerWaalsContact CG-CE1 3.43Å; H559-F567 AromaticContact CG-CZ 3.73Å; H559-F567 AromaticContact ND1-CE1 3.54Å; H559-F567 AromaticContact ND1-CZ 3.5Å; H559-L612 HydrophobicContact CB-CD1 4.35Å
560	I	93	Very high	93.7	Very high	30 Å²	30	34.8 Å²	34.8	15%	0.154	16%	0.16	C	C	.	.	H	α-helix	trans	-62.6	-41.6	170.5	-69	161.6	0	0	0	110.1	K556 H562 E563 L565 L612 P614 Y618	K556-I560 VanDerWaalsContact O-CG1 3.32Å; K556-I560 WeakPolarHBondContact O-CG1 3.44Å; K556-I560 PolarHBondContact O-N 2.85Å; I560-H562 PolarHBondContact O-N 3.49Å; I560-H562 VanDerWaalsContact O-N 3.16Å; I560-E563 PolarHBondContact O-N 3.09Å; I560-E563 VanDerWaalsContact O-N 3.07Å; I560-L565 HydrophobicContact CG1-CD2 4.07Å; I560-L612 HydrophobicContact CD1-CB 4.46Å; I560-L612 HydrophobicContact CG1-CB 4.31Å; I560-L612 HydrophobicContact CG1-CD1 4.18Å; I560-P614 HydrophobicContact CG2-CB 4.08Å; I560-Y618 HydrophobicContact CD1-CD2 3.63Å; I560-Y618 HydrophobicContact CD1-CE2 3.61Å
561	K	91.3	Very high	93.7	Very high	143 Å²	143	34.8 Å²	34.8	62%	0.622	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-8.3	172.8	-69.4	167.4	-173.8	169.3	0	114.5	E557 Y558 H559	E557-K561 WeakPolarHBondContact O-CD 3.1Å; E557-K561 WeakPolarHBondContact O-CG 3.25Å; E557-K561 PolarHBondContact O-N 2.93Å; E557-K561 WeakPolarHBondContact OE1-CE 2.92Å; E557-K561 IonicContact OE1-NZ 3.68Å; E557-K561 PolarHBondContact OE1-NZ 3.38Å; Y558-K561 PolarHBondContact O-N 2.86Å; H559-K561 VanDerWaalsContact C-N 3.32Å
562	H	91.6	Very high	93.5	Very high	94 Å²	94	36.4 Å²	36.4	44%	0.435	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.5	17.3	173.8	-71.9	-53.6	0	0	0	112.6	M524 Y558 H559 I560 I564	M524-H562 HydrophobicContact CE-CB 3.71Å; Y558-H562 AromaticContact CD1-CD2 3.99Å; Y558-H562 AromaticContact CD2-NE2 3.99Å; Y558-H562 AromaticContact CE1-CD2 3.58Å; Y558-H562 AromaticContact CE2-CD2 3.61Å; Y558-H562 AromaticContact CE2-NE2 3.34Å; Y558-H562 VanDerWaalsContact CE2-NE2 3.34Å; Y558-H562 WeakPolarHBondContact CE2-NE2 3.48Å; Y558-H562 AromaticContact CZ-CD2 3.37Å; Y558-H562 AromaticContact CZ-NE2 3.41Å; Y558-H562 PolarHBondContact O-CD2 3.26Å; Y558-H562 VanDerWaalsContact O-CD2 3.23Å; Y558-H562 PolarHBondContact O-N 3.19Å; H559-H562 CarbonylContact O-C 3.6Å; H559-H562 VanDerWaalsContact O-C 3.28Å; H559-H562 WeakPolarHBondContact O-CA 3.44Å; H559-H562 PolarHBondContact O-N 2.89Å; I560-H562 PolarHBondContact O-N 3.49Å; I560-H562 VanDerWaalsContact O-N 3.16Å; H562-I564 PolarHBondContact O-N 3.07Å
563	E	91.4	Very high	92.9	Very high	178 Å²	178	42.5 Å²	42.5	83%	0.832	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.3	11.4	174.6	-53.2	-174.9	154.3	0	0	115.8	H559 I560 L565	H559-E563 PolarHBondContact O-N 2.77Å; H559-E563 VanDerWaalsContact O-N 3.08Å; I560-E563 PolarHBondContact O-N 3.09Å; I560-E563 VanDerWaalsContact O-N 3.07Å; E563-L565 PolarHBondContact O-N 3Å
564	I	93.1	Very high	92.5	Very high	5 Å²	5	50.2 Å²	50.2	3%	0.026	23%	0.228	C	C	.	.			trans	-94.5	101.3	176.8	-59	-175.3	0	0	0	109.8	M524 P526 F530 H559 H562	M524-I564 HydrophobicContact CB-CD1 3.93Å; M524-I564 HydrophobicContact CE-CD1 3.73Å; M524-I564 HydrophobicContact CG-CD1 4.34Å; P526-I564 HydrophobicContact CB-CD1 4.36Å; P526-I564 HydrophobicContact CG-CD1 4.18Å; F530-I564 VanDerWaalsContact C-CG2 3.43Å; H559-I564 PolarHBondContact O-N 3.37Å; H562-I564 PolarHBondContact O-N 3.07Å
565	L	93.2	Very high	92.1	Very high	56 Å²	56	49.8 Å²	49.8	29%	0.293	23%	0.231	S	C	.	.			trans	-93.5	1.9	-175.4	-57.9	-179.6	0	0	0	115	I560 E563 E611 L612 P614	I560-L565 HydrophobicContact CG1-CD2 4.07Å; E563-L565 PolarHBondContact O-N 3Å; L565-E611 CarbonylContact O-C 3.55Å; L565-E611 WeakPolarHBondContact O-CA 3.36Å; L565-L612 HydrophobicContact CB-CB 4.43Å; L565-L612 HydrophobicContact CD2-CB 4.21Å; L565-L612 PolarHBondContact O-N 3.49Å; L565-P614 HydrophobicContact CD1-CG 4.23Å; L565-P614 HydrophobicContact CD2-CB 4.29Å; L565-P614 HydrophobicContact CD2-CG 4.5Å
566	N	95.5	Very high	91.8	Very high	40 Å²	40	50.6 Å²	50.6	21%	0.214	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	128.6	-179.8	-58.1	-83.1	0	0	0	111.9	G529 F530 T531 V590 C610	G529-N566 WeakPolarHBondContact O-CB 3.44Å; G529-N566 PolarHBondContact O-ND2 3.02Å; F530-N566 CarbonylContact C-O 3.54Å; F530-N566 VanDerWaalsContact CA-O 3.23Å; F530-N566 WeakPolarHBondContact CA-O 3.39Å; F530-N566 HydrophobicContact CB-CB 3.89Å; T531-N566 PolarHBondContact N-O 3.04Å; N566-V590 HydrophobicContact CB-CG2 3.9Å; N566-V590 WeakPolarHBondContact OD1-CG2 3.29Å; N566-C610 WeakPolarHBondContact CA-O 3.33Å
567	F	96.6	Very high	91.6	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	137.6	167	-65.4	-20.3	0	0	0	110.5	T531 I533 M552 L555 K556 H559 F584 G609 C610 L612	T531-F567 HydrophobicContact CG2-CD1 4.42Å; T531-F567 WeakPolarHBondContact O-CA 3.4Å; I533-F567 HydrophobicContact CD1-CB 4.34Å; I533-F567 HydrophobicContact CD1-CD2 4.05Å; I533-F567 HydrophobicContact CD1-CG 4.23Å; M552-F567 HydrophobicContact SD-CE2 4.37Å; L555-F567 HydrophobicContact CD2-CE2 3.9Å; L555-F567 HydrophobicContact CD2-CZ 4.02Å; L555-F567 HydrophobicContact CG-CE2 4.27Å; L555-F567 HydrophobicContact CG-CZ 4.01Å; K556-F567 HydrophobicContact CG-CE2 3.75Å; K556-F567 HydrophobicContact CG-CZ 4.37Å; H559-F567 HydrophobicContact CB-CE1 3.69Å; H559-F567 HydrophobicContact CB-CZ 3.84Å; H559-F567 AromaticContact CD2-CE1 3.91Å; H559-F567 AromaticContact CG-CE1 3.43Å; H559-F567 VanDerWaalsContact CG-CE1 3.43Å; H559-F567 AromaticContact CG-CZ 3.73Å; H559-F567 AromaticContact ND1-CE1 3.54Å; H559-F567 AromaticContact ND1-CZ 3.5Å; F567-F584 HydrophobicContact CB-CE1 3.76Å; F567-F584 HydrophobicContact CB-CZ 3.79Å; F567-F584 HydrophobicContact CD2-CE2 4.49Å; F567-F584 AromaticContact CD2-CZ 3.83Å; F567-F584 HydrophobicContact CD2-CZ 3.83Å; F567-F584 HydrophobicContact CG-CZ 4.31Å; F567-G609 CarbonylContact O-C 3.54Å; F567-G609 VanDerWaalsContact O-CA 3.28Å; F567-G609 WeakPolarHBondContact O-CA 3.39Å; F567-C610 HydrophobicContact CB-CB 4.27Å; F567-C610 PolarHBondContact N-O 3.46Å; F567-C610 PolarHBondContact O-N 3.37Å; F567-L612 HydrophobicContact CD2-CD2 4.27Å; F567-L612 HydrophobicContact CE1-CD1 4.05Å; F567-L612 HydrophobicContact CE2-CD1 4.03Å; F567-L612 HydrophobicContact CE2-CD2 4.22Å; F567-L612 HydrophobicContact CZ-CD1 3.76Å
568	L	95.9	Very high	91.5	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	140	167.2	-62.5	178.4	0	0	0	108.7	F530 T531 E532 I533 I588 Y595 I599 M608	F530-L568 HydrophobicContact CD2-CB 4.22Å; F530-L568 HydrophobicContact CD2-CD1 3.73Å; F530-L568 HydrophobicContact CD2-CG 4.04Å; F530-L568 HydrophobicContact CE2-CD1 4Å; F530-L568 HydrophobicContact CG-CD1 4.15Å; T531-L568 PolarHBondContact O-N 3.39Å; E532-L568 CarbonylContact C-O 3.58Å; E532-L568 WeakPolarHBondContact CA-O 3.34Å; I533-L568 PolarHBondContact N-O 3.23Å; L568-I588 HydrophobicContact CD2-CG2 3.77Å; L568-Y595 VanDerWaalsContact CD1-CB 3.41Å; L568-Y595 HydrophobicContact CD1-CD1 3.75Å; L568-Y595 HydrophobicContact CD1-CD2 4.14Å; L568-Y595 HydrophobicContact CD1-CE1 4.5Å; L568-Y595 HydrophobicContact CD1-CG 3.53Å; L568-I599 HydrophobicContact CB-CD1 3.81Å; L568-M608 WeakPolarHBondContact CA-O 3.31Å
569	T	94.9	Very high	91.5	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.012	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	141.4	177.5	-166	0	0	0	0	109	I533 A571 F579 F584 M608	I533-T569 PolarHBondContact O-OG1 3.35Å; T569-A571 HydrophobicContact CG2-CB 4.44Å; T569-F579 HydrophobicContact CG2-CD1 3.95Å; T569-F579 HydrophobicContact CG2-CD2 4.38Å; T569-F579 HydrophobicContact CG2-CE1 3.88Å; T569-F579 HydrophobicContact CG2-CE2 4.31Å; T569-F579 HydrophobicContact CG2-CG 4.2Å; T569-F579 HydrophobicContact CG2-CZ 4.06Å; T569-F584 HydrophobicContact CG2-CD1 3.78Å; T569-F584 HydrophobicContact CG2-CE1 3.76Å; T569-M608 HydrophobicContact CG2-CB 4.07Å; T569-M608 PolarHBondContact N-O 2.97Å; T569-M608 PolarHBondContact O-N 3.36Å
570	Y	93.1	Very high	91.5	Very high	51 Å²	51	57.1 Å²	57.1	20%	0.2	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	135.7	154.1	-85.2	-82.4	0	0	0	108	I599 K600 D601 Y602 A605 L607	Y570-I599 HydrophobicContact CD2-CD1 4.14Å; Y570-I599 HydrophobicContact CD2-CG1 4.25Å; Y570-I599 HydrophobicContact CE2-CD1 4.28Å; Y570-I599 HydrophobicContact CE2-CG1 4.26Å; Y570-I599 HydrophobicContact CE2-CG2 4.37Å; Y570-K600 WeakPolarHBondContact CD2-O 3.45Å; Y570-K600 WeakPolarHBondContact CE2-O 3.5Å; Y570-D601 HydrophobicContact CE2-CB 4.42Å; Y570-D601 WeakPolarHBondContact CE2-OD1 3.49Å; Y570-D601 VanDerWaalsContact CZ-OD1 3.27Å; Y570-D601 PolarHBondContact OH-OD1 3.25Å; Y570-Y602 AromaticContact CD2-CD2 3.89Å; Y570-Y602 HydrophobicContact CD2-CD2 3.89Å; Y570-Y602 HydrophobicContact CD2-CE2 4.5Å; Y570-Y602 AromaticContact CG-CD2 3.88Å; Y570-Y602 HydrophobicContact CG-CD2 3.88Å; Y570-A605 HydrophobicContact CD1-CB 3.85Å; Y570-A605 HydrophobicContact CG-CB 4.34Å; Y570-L607 HydrophobicContact CD1-CB 4.11Å; Y570-L607 HydrophobicContact CD2-CD1 3.92Å; Y570-L607 HydrophobicContact CE1-CB 3.64Å; Y570-L607 HydrophobicContact CE1-CD1 4.4Å; Y570-L607 HydrophobicContact CE2-CB 4.43Å; Y570-L607 HydrophobicContact CE2-CD1 3.7Å; Y570-L607 HydrophobicContact CG-CD1 4.39Å
571	A	91.1	Very high	91.3	Very high	2 Å²	2	62.6 Å²	62.6	2%	0.017	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	121.1	-176.9	0	0	0	0	0	110.4	T569 I576 F579 T606 M608	T569-A571 HydrophobicContact CG2-CB 4.44Å; A571-I576 HydrophobicContact CB-CG1 4.18Å; A571-F579 HydrophobicContact CB-CD2 3.65Å; A571-F579 HydrophobicContact CB-CE2 3.99Å; A571-T606 PolarHBondContact N-O 3.08Å; A571-T606 PolarHBondContact O-N 3.5Å; A571-M608 HydrophobicContact CB-CG 4.4Å; A571-M608 HydrophobicContact CB-SD 4.14Å
572	D	88.5	Confident	91.4	Very high	34 Å²	34	56.3 Å²	56.3	18%	0.182	27%	0.268	C	S	.	.			trans	-56.6	153.3	166.8	-66.2	-11.4	0	0	0	110.6	Y574 A575 I576	D572-Y574 VanDerWaalsContact C-N 3.29Å; D572-Y574 PolarHBondContact O-N 3.31Å; D572-A575 HydrophobicContact CB-CB 4.48Å; D572-A575 CarbonylContact O-C 3.38Å; D572-A575 WeakPolarHBondContact O-CA 3.38Å; D572-A575 WeakPolarHBondContact O-CB 3.44Å; D572-A575 PolarHBondContact O-N 3.35Å; D572-I576 PolarHBondContact O-N 3.5Å
573	E	83.8	Confident	91.4	Very high	127 Å²	127	54.2 Å²	54.2	59%	0.593	27%	0.272	S	S	*	.	H	α-helix	trans	-53	-44.9	-174.9	-62	174.8	127.4	0	0	112.6	A575 I576	E573-A575 VanDerWaalsContact C-N 3.26Å; E573-A575 PolarHBondContact O-N 3Å; E573-I576 PolarHBondContact O-N 2.96Å
574	Y	83.8	Confident	91.6	Very high	169 Å²	169	46.1 Å²	46.1	66%	0.663	23%	0.234	S	C	*	.	H	α-helix	trans	-61	-31.3	174.7	-49.9	-70.8	0	0	0	113.4	D572	D572-Y574 VanDerWaalsContact C-N 3.29Å; D572-Y574 PolarHBondContact O-N 3.31Å
575	A	86.3	Confident	91.7	Very high	29 Å²	29	48.5 Å²	48.5	24%	0.24	25%	0.251	C	S	.	.	H	α-helix	trans	-85.6	-23.1	-178.7	0	0	0	0	0	113.5	D572 E573 G577 Y578 F579	D572-A575 HydrophobicContact CB-CB 4.48Å; D572-A575 CarbonylContact O-C 3.38Å; D572-A575 WeakPolarHBondContact O-CA 3.38Å; D572-A575 WeakPolarHBondContact O-CB 3.44Å; D572-A575 PolarHBondContact O-N 3.35Å; E573-A575 VanDerWaalsContact C-N 3.26Å; E573-A575 PolarHBondContact O-N 3Å; A575-G577 PolarHBondContact O-N 2.97Å; A575-Y578 WeakPolarHBondContact O-CA 3.38Å; A575-Y578 WeakPolarHBondContact O-CB 3.33Å; A575-Y578 PolarHBondContact O-N 2.95Å; A575-F579 HydrophobicContact CB-CD2 4.02Å; A575-F579 HydrophobicContact CB-CE2 4.01Å; A575-F579 WeakPolarHBondContact O-CD2 3.46Å; A575-F579 PolarHBondContact O-N 3.22Å
576	I	89.4	Confident	91.6	Very high	19 Å²	19	51.4 Å²	51.4	10%	0.097	26%	0.261	C	S	.	.	H	α-helix	trans	-52.9	-40.9	175.8	-65	173.9	0	0	0	110.7	A571 D572 E573 Y578 F579 K580 T606 M608	A571-I576 HydrophobicContact CB-CG1 4.18Å; D572-I576 PolarHBondContact O-N 3.5Å; E573-I576 PolarHBondContact O-N 2.96Å; I576-Y578 PolarHBondContact O-N 3.36Å; I576-F579 PolarHBondContact O-N 3.29Å; I576-K580 HydrophobicContact CG2-CD 4.01Å; I576-K580 HydrophobicContact CG2-CG 4.24Å; I576-K580 WeakPolarHBondContact O-CB 3.48Å; I576-K580 WeakPolarHBondContact O-CG 3.37Å; I576-K580 PolarHBondContact O-N 3.35Å; I576-T606 HydrophobicContact CD1-CG2 4.33Å; I576-T606 WeakPolarHBondContact CD1-OG1 3.48Å; I576-M608 HydrophobicContact CB-SD 4.31Å; I576-M608 HydrophobicContact CG1-SD 4.1Å; I576-M608 HydrophobicContact CG2-SD 4.02Å
577	G	89.5	Confident	91.4	Very high	34 Å²	34	55.2 Å²	55.2	35%	0.351	28%	0.282	S	S	.	.	H	α-helix	trans	-67.4	-16.4	177.7	0	0	0	0	0	114.8	A575 K581	A575-G577 PolarHBondContact O-N 2.97Å; G577-K581 WeakPolarHBondContact O-CD 3.34Å; G577-K581 WeakPolarHBondContact O-CE 3.4Å; G577-K581 WeakPolarHBondContact O-CG 3.29Å; G577-K581 PolarHBondContact O-NZ 3.36Å
578	Y	91.4	Very high	91.1	Very high	53 Å²	53	56.9 Å²	56.9	21%	0.208	29%	0.29	C	S	.	.	H	α-helix	trans	-89.5	-53.5	169.6	162.5	-100.2	0	0	0	110.6	G548 M552 A575 I576 K580 K581 Q582	G548-Y578 PolarHBondContact O-OH 3.06Å; M552-Y578 HydrophobicContact CE-CE1 4.29Å; A575-Y578 WeakPolarHBondContact O-CA 3.38Å; A575-Y578 WeakPolarHBondContact O-CB 3.33Å; A575-Y578 PolarHBondContact O-N 2.95Å; I576-Y578 PolarHBondContact O-N 3.36Å; Y578-K580 VanDerWaalsContact C-N 3.31Å; Y578-K580 PolarHBondContact O-N 3.29Å; Y578-K581 WeakPolarHBondContact O-CA 3.31Å; Y578-K581 WeakPolarHBondContact O-CB 3.4Å; Y578-K581 PolarHBondContact O-N 2.97Å; Y578-Q582 HydrophobicContact CD1-CG 4.48Å; Y578-Q582 HydrophobicContact CD2-CG 4.29Å; Y578-Q582 HydrophobicContact CE1-CG 4.12Å; Y578-Q582 HydrophobicContact CE2-CG 3.9Å; Y578-Q582 PolarHBondContact O-N 3.3Å
579	F	94.6	Very high	90.7	Very high	9 Å²	9	63.6 Å²	63.6	4%	0.039	32%	0.319	C	S	.	.	H	α-helix	trans	-58.4	-39.3	-177.3	-78.1	-70.5	0	0	0	112.8	C536 M552 T569 A571 A575 I576 K581 Q582 G583 F584 M608	C536-F579 HydrophobicContact CB-CZ 4.21Å; M552-F579 HydrophobicContact CE-CD1 4.49Å; M552-F579 HydrophobicContact CE-CE1 4.06Å; T569-F579 HydrophobicContact CG2-CD1 3.95Å; T569-F579 HydrophobicContact CG2-CD2 4.38Å; T569-F579 HydrophobicContact CG2-CE1 3.88Å; T569-F579 HydrophobicContact CG2-CE2 4.31Å; T569-F579 HydrophobicContact CG2-CG 4.2Å; T569-F579 HydrophobicContact CG2-CZ 4.06Å; A571-F579 HydrophobicContact CB-CD2 3.65Å; A571-F579 HydrophobicContact CB-CE2 3.99Å; A575-F579 HydrophobicContact CB-CD2 4.02Å; A575-F579 HydrophobicContact CB-CE2 4.01Å; A575-F579 WeakPolarHBondContact O-CD2 3.46Å; A575-F579 PolarHBondContact O-N 3.22Å; I576-F579 PolarHBondContact O-N 3.29Å; F579-K581 VanDerWaalsContact C-N 3.28Å; F579-K581 PolarHBondContact O-N 3.33Å; F579-Q582 CarbonylContact O-C 3.55Å; F579-Q582 WeakPolarHBondContact O-CA 3.29Å; F579-Q582 PolarHBondContact O-N 3.42Å; F579-G583 PolarHBondContact O-N 2.94Å; F579-F584 HydrophobicContact CB-CB 3.96Å; F579-F584 HydrophobicContact CB-CD2 4.24Å; F579-F584 HydrophobicContact CB-CG 4.06Å; F579-F584 HydrophobicContact CD1-CD1 4.16Å; F579-F584 AromaticContact CD1-CD2 3.81Å; F579-F584 HydrophobicContact CD1-CD2 3.81Å; F579-F584 HydrophobicContact CD1-CE1 4.15Å; F579-F584 AromaticContact CD1-CE2 3.81Å; F579-F584 HydrophobicContact CD1-CE2 3.81Å; F579-F584 AromaticContact CD1-CG 3.99Å; F579-F584 HydrophobicContact CD1-CG 3.99Å; F579-F584 AromaticContact CD1-CZ 3.99Å; F579-F584 HydrophobicContact CD1-CZ 3.99Å; F579-F584 HydrophobicContact CE1-CE1 4.48Å; F579-F584 HydrophobicContact CE1-CE2 4.39Å; F579-F584 HydrophobicContact CE1-CZ 4.24Å; F579-F584 HydrophobicContact CG-CG 4.47Å; F579-F584 WeakPolarHBondContact O-CB 3.38Å; F579-F584 WeakPolarHBondContact O-CD2 3.41Å; F579-F584 PolarHBondContact O-N 3.08Å; F579-M608 HydrophobicContact CB-SD 4.18Å
580	K	93.5	Very high	90.4	Very high	125 Å²	125	64.2 Å²	64.2	54%	0.543	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-54.7	-40.6	171.1	-76.1	-179.8	176.7	175.2	0	113.3	I576 Y578 Q582 G583 F584 M608	I576-K580 HydrophobicContact CG2-CD 4.01Å; I576-K580 HydrophobicContact CG2-CG 4.24Å; I576-K580 WeakPolarHBondContact O-CB 3.48Å; I576-K580 WeakPolarHBondContact O-CG 3.37Å; I576-K580 PolarHBondContact O-N 3.35Å; Y578-K580 VanDerWaalsContact C-N 3.31Å; Y578-K580 PolarHBondContact O-N 3.29Å; K580-Q582 VanDerWaalsContact C-N 3.26Å; K580-Q582 PolarHBondContact O-N 3.06Å; K580-G583 PolarHBondContact O-N 2.92Å; K580-F584 WeakPolarHBondContact CA-O 3.48Å; K580-M608 HydrophobicContact CG-CE 3.9Å
581	K	90.1	Very high	90.2	Very high	144 Å²	144	65.5 Å²	65.5	63%	0.626	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-71.8	-22.2	178.7	-63.1	167.3	-173.7	138.3	0	112.3	G577 Y578 F579 G583	G577-K581 WeakPolarHBondContact O-CD 3.34Å; G577-K581 WeakPolarHBondContact O-CE 3.4Å; G577-K581 WeakPolarHBondContact O-CG 3.29Å; G577-K581 PolarHBondContact O-NZ 3.36Å; Y578-K581 WeakPolarHBondContact O-CA 3.31Å; Y578-K581 WeakPolarHBondContact O-CB 3.4Å; Y578-K581 PolarHBondContact O-N 2.97Å; F579-K581 VanDerWaalsContact C-N 3.28Å; F579-K581 PolarHBondContact O-N 3.33Å; K581-G583 VanDerWaalsContact C-N 3.34Å
582	Q	91.9	Very high	90.1	Very high	12 Å²	12	72.7 Å²	72.7	6%	0.056	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-87.1	-0.2	174.8	-55.4	-53.5	-22.3	0	0	113.5	T549 M552 K556 Y578 F579 K580 F584	T549-Q582 PolarHBondContact OG1-NE2 3.13Å; T549-Q582 VanDerWaalsContact OG1-NE2 3.12Å; M552-Q582 HydrophobicContact CB-CG 4.37Å; M552-Q582 HydrophobicContact CG-CB 3.91Å; M552-Q582 HydrophobicContact CG-CG 3.87Å; K556-Q582 PolarHBondContact NZ-O 3.37Å; Y578-Q582 HydrophobicContact CD1-CG 4.48Å; Y578-Q582 HydrophobicContact CD2-CG 4.29Å; Y578-Q582 HydrophobicContact CE1-CG 4.12Å; Y578-Q582 HydrophobicContact CE2-CG 3.9Å; Y578-Q582 PolarHBondContact O-N 3.3Å; F579-Q582 CarbonylContact O-C 3.55Å; F579-Q582 WeakPolarHBondContact O-CA 3.29Å; F579-Q582 PolarHBondContact O-N 3.42Å; K580-Q582 VanDerWaalsContact C-N 3.26Å; K580-Q582 PolarHBondContact O-N 3.06Å; Q582-F584 HydrophobicContact CB-CD2 4.06Å; Q582-F584 HydrophobicContact CB-CE2 4.19Å
583	G	91.8	Very high	90.1	Very high	50 Å²	50	75.6 Å²	75.6	52%	0.515	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.6	14.1	179.2	0	0	0	0	0	115.3	F579 K580 K581 C610	F579-G583 PolarHBondContact O-N 2.94Å; K580-G583 PolarHBondContact O-N 2.92Å; K581-G583 VanDerWaalsContact C-N 3.34Å; G583-C610 VanDerWaalsContact C-SG 3.58Å; G583-C610 PolarHBondContact O-SG 3.42Å
584	F	95.9	Very high	90.3	Very high	7 Å²	7	74.6 Å²	74.6	3%	0.031	39%	0.391	C	S	.	.			trans	-85.3	140.9	174.5	-68.4	-113.3	0	0	0	111.4	I533 M552 F567 T569 F579 K580 Q582 M608 G609 C610	I533-F584 HydrophobicContact CD1-CE1 4.34Å; I533-F584 HydrophobicContact CD1-CZ 3.79Å; M552-F584 HydrophobicContact CE-CE2 4.22Å; M552-F584 HydrophobicContact CE-CZ 4.47Å; M552-F584 HydrophobicContact SD-CE2 4.15Å; F567-F584 HydrophobicContact CB-CE1 3.76Å; F567-F584 HydrophobicContact CB-CZ 3.79Å; F567-F584 HydrophobicContact CD2-CE2 4.49Å; F567-F584 AromaticContact CD2-CZ 3.83Å; F567-F584 HydrophobicContact CD2-CZ 3.83Å; F567-F584 HydrophobicContact CG-CZ 4.31Å; T569-F584 HydrophobicContact CG2-CD1 3.78Å; T569-F584 HydrophobicContact CG2-CE1 3.76Å; F579-F584 HydrophobicContact CB-CB 3.96Å; F579-F584 HydrophobicContact CB-CD2 4.24Å; F579-F584 HydrophobicContact CB-CG 4.06Å; F579-F584 HydrophobicContact CD1-CD1 4.16Å; F579-F584 AromaticContact CD1-CD2 3.81Å; F579-F584 HydrophobicContact CD1-CD2 3.81Å; F579-F584 HydrophobicContact CD1-CE1 4.15Å; F579-F584 AromaticContact CD1-CE2 3.81Å; F579-F584 HydrophobicContact CD1-CE2 3.81Å; F579-F584 AromaticContact CD1-CG 3.99Å; F579-F584 HydrophobicContact CD1-CG 3.99Å; F579-F584 AromaticContact CD1-CZ 3.99Å; F579-F584 HydrophobicContact CD1-CZ 3.99Å; F579-F584 HydrophobicContact CE1-CE1 4.48Å; F579-F584 HydrophobicContact CE1-CE2 4.39Å; F579-F584 HydrophobicContact CE1-CZ 4.24Å; F579-F584 HydrophobicContact CG-CG 4.47Å; F579-F584 WeakPolarHBondContact O-CB 3.38Å; F579-F584 WeakPolarHBondContact O-CD2 3.41Å; F579-F584 PolarHBondContact O-N 3.08Å; K580-F584 WeakPolarHBondContact CA-O 3.48Å; Q582-F584 HydrophobicContact CB-CD2 4.06Å; Q582-F584 HydrophobicContact CB-CE2 4.19Å; F584-M608 HydrophobicContact CB-CB 4.22Å; F584-M608 HydrophobicContact CB-CE 3.9Å; F584-M608 HydrophobicContact CD1-CB 4.33Å; F584-M608 WeakPolarHBondContact O-CE 3.41Å; F584-G609 CarbonylContact C-O 3.58Å; F584-G609 VanDerWaalsContact CA-O 3.26Å; F584-G609 WeakPolarHBondContact CA-O 3.46Å; F584-C610 HydrophobicContact CB-CB 4.32Å; F584-C610 HydrophobicContact CD1-CB 3.64Å; F584-C610 HydrophobicContact CD2-CB 3.65Å; F584-C610 HydrophobicContact CE1-CB 3.73Å; F584-C610 HydrophobicContact CE2-CB 3.74Å; F584-C610 HydrophobicContact CG-CB 3.59Å; F584-C610 HydrophobicContact CZ-CB 3.78Å
585	S	94.3	Very high	90.6	Very high	55 Å²	55	67.4 Å²	67.4	39%	0.385	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-116.3	162.9	175.8	-170.5	0	0	0	0	111.6	D587 M608 G609	S585-D587 VanDerWaalsContact C-N 3.32Å; S585-D587 WeakPolarHBondContact CB-O 3.38Å; S585-D587 WeakPolarHBondContact OG-CB 3.2Å; S585-D587 PolarHBondContact OG-N 2.95Å; S585-M608 CarbonylContact O-C 3.57Å; S585-M608 VanDerWaalsContact O-CA 3.24Å; S585-M608 WeakPolarHBondContact O-CA 3.42Å; S585-M608 WeakPolarHBondContact O-CB 3.23Å; S585-G609 PolarHBondContact N-O 3.18Å; S585-G609 PolarHBondContact O-N 3.14Å
586	K	92	Very high	90.7	Very high	118 Å²	118	70.5 Å²	70.5	51%	0.513	38%	0.378	S	S	.	.	S	Bend	trans	-81.4	-15.9	162.3	-62	-155.7	-173.1	-145.2	0	111.9	T606	K586-T606 HydrophobicContact CD-CG2 3.62Å; K586-T606 VanDerWaalsContact CE-CG2 3.49Å; K586-T606 HydrophobicContact CG-CG2 3.88Å; K586-T606 VanDerWaalsContact NZ-CG2 3.33Å; K586-T606 PolarHBondContact NZ-OG1 3.33Å
587	D	90.7	Very high	90.5	Very high	120 Å²	120	73.3 Å²	73.3	64%	0.642	41%	0.412	S	S	*	.	S	Bend	trans	-82.6	120.5	169.9	179.8	32.8	0	0	0	109.2	S585	S585-D587 VanDerWaalsContact C-N 3.32Å; S585-D587 WeakPolarHBondContact CB-O 3.38Å; S585-D587 WeakPolarHBondContact OG-CB 3.2Å; S585-D587 PolarHBondContact OG-N 2.95Å
588	I	91	Very high	90.3	Very high	35 Å²	35	76.7 Å²	76.7	18%	0.179	42%	0.415	C	S	.	.			trans	-119.2	106.4	-168.8	-59.4	172.8	0	0	0	108.6	L568 V590 Y595 L607	L568-I588 HydrophobicContact CD2-CG2 3.77Å; I588-V590 VanDerWaalsContact C-N 3.26Å; I588-V590 HydrophobicContact CG2-CB 4.09Å; I588-V590 PolarHBondContact O-N 2.8Å; I588-Y595 HydrophobicContact CG2-CE1 4.14Å; I588-L607 HydrophobicContact CD1-CB 4.36Å; I588-L607 HydrophobicContact CD1-CD2 3.55Å; I588-L607 HydrophobicContact CD1-CG 3.57Å
589	K	86.9	Confident	90.1	Very high	141 Å²	141	74.6 Å²	74.6	61%	0.613	41%	0.407	S	S	*	.			trans	-68	-22.5	179	-61.5	-177.1	179	-178.6	0	113.9	P591 E611	K589-P591 WeakPolarHBondContact O-CD 3.39Å; K589-E611 WeakPolarHBondContact CE-OE2 3.35Å; K589-E611 IonicContact NZ-OE1 3.29Å; K589-E611 IonicContact NZ-OE2 2.75Å; K589-E611 PolarHBondContact NZ-OE2 2.9Å
590	V	88.6	Confident	89.6	Confident	15 Å²	15	77.4 Å²	77.4	9%	0.091	42%	0.419	C	S	.	.	S	Bend	trans	-69.4	123.7	178.7	-174.1	0	0	0	0	109.1	N566 I588 K592 K594 Y595	N566-V590 HydrophobicContact CB-CG2 3.9Å; N566-V590 WeakPolarHBondContact OD1-CG2 3.29Å; I588-V590 VanDerWaalsContact C-N 3.26Å; I588-V590 HydrophobicContact CG2-CB 4.09Å; I588-V590 PolarHBondContact O-N 2.8Å; V590-K592 PolarHBondContact O-N 3.32Å; V590-K594 HydrophobicContact CG1-CB 4Å; V590-K594 HydrophobicContact CG1-CD 4.3Å; V590-Y595 HydrophobicContact CB-CD1 4.35Å; V590-Y595 HydrophobicContact CG1-CD1 4.05Å; V590-Y595 WeakPolarHBondContact O-CE1 3.49Å
591	P	89.8	Confident	88.9	Confident	78 Å²	78	77.2 Å²	77.2	51%	0.506	42%	0.424	S	S	.	.			trans	-60	136.6	178.6	-25.4	34.9	0	0	0	112.3	K589 A593 K594	K589-P591 WeakPolarHBondContact O-CD 3.39Å; P591-A593 PolarHBondContact O-N 2.83Å; P591-A593 VanDerWaalsContact O-N 3.09Å; P591-K594 WeakPolarHBondContact O-CB 3.43Å; P591-K594 PolarHBondContact O-N 3.28Å
592	K	88.4	Confident	88.4	Confident	153 Å²	153	72.3 Å²	72.3	67%	0.665	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-49.9	-40.7	-176.2	-64.2	-168.6	176.4	-175.7	0	113.7	V590 K594 Y595 V596	V590-K592 PolarHBondContact O-N 3.32Å; K592-K594 PolarHBondContact O-N 3.08Å; K592-K594 VanDerWaalsContact O-N 3.08Å; K592-Y595 HydrophobicContact CB-CE1 4.46Å; K592-Y595 HydrophobicContact CG-CE1 4.37Å; K592-Y595 PolarHBondContact O-N 3.44Å; K592-Y595 VanDerWaalsContact O-N 3.09Å; K592-V596 HydrophobicContact CB-CG2 4.13Å; K592-V596 WeakPolarHBondContact O-CB 3.47Å; K592-V596 WeakPolarHBondContact O-CG2 3.33Å; K592-V596 PolarHBondContact O-N 3.25Å
593	A	88.7	Confident	87.5	Confident	95 Å²	95	81.4 Å²	81.4	79%	0.785	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-60.2	-16.6	178.8	0	0	0	0	0	114.9	P591	P591-A593 PolarHBondContact O-N 2.83Å; P591-A593 VanDerWaalsContact O-N 3.09Å
594	K	88.8	Confident	86.6	Confident	105 Å²	105	81.6 Å²	81.6	46%	0.457	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-83.7	-21.1	175.5	-68.3	-163.5	171	-162.9	0	114.3	Q528 F530 V590 P591 K592	Q528-K594 WeakPolarHBondContact CG-O 3.45Å; F530-K594 WeakPolarHBondContact CE1-O 3.33Å; V590-K594 HydrophobicContact CG1-CB 4Å; V590-K594 HydrophobicContact CG1-CD 4.3Å; P591-K594 WeakPolarHBondContact O-CB 3.43Å; P591-K594 PolarHBondContact O-N 3.28Å; K592-K594 PolarHBondContact O-N 3.08Å; K592-K594 VanDerWaalsContact O-N 3.08Å
595	Y	89.6	Confident	86.1	Confident	19 Å²	19	82.1 Å²	82.1	8%	0.075	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.7	-26	-170.6	71.1	-105.6	0	0	0	115	L568 I588 V590 K592 G597 Y598 I599 L607	L568-Y595 VanDerWaalsContact CD1-CB 3.41Å; L568-Y595 HydrophobicContact CD1-CD1 3.75Å; L568-Y595 HydrophobicContact CD1-CD2 4.14Å; L568-Y595 HydrophobicContact CD1-CE1 4.5Å; L568-Y595 HydrophobicContact CD1-CG 3.53Å; I588-Y595 HydrophobicContact CG2-CE1 4.14Å; V590-Y595 HydrophobicContact CB-CD1 4.35Å; V590-Y595 HydrophobicContact CG1-CD1 4.05Å; V590-Y595 WeakPolarHBondContact O-CE1 3.49Å; K592-Y595 HydrophobicContact CB-CE1 4.46Å; K592-Y595 HydrophobicContact CG-CE1 4.37Å; K592-Y595 PolarHBondContact O-N 3.44Å; K592-Y595 VanDerWaalsContact O-N 3.09Å; Y595-G597 PolarHBondContact O-N 3.09Å; Y595-Y598 WeakPolarHBondContact O-CB 3.5Å; Y595-Y598 PolarHBondContact O-N 2.98Å; Y595-I599 HydrophobicContact CD2-CG2 3.96Å; Y595-I599 WeakPolarHBondContact O-CG2 3.32Å; Y595-I599 PolarHBondContact O-N 3.34Å; Y595-I599 VanDerWaalsContact O-N 3.12Å; Y595-L607 HydrophobicContact CD2-CD2 4.45Å; Y595-L607 HydrophobicContact CE2-CD2 3.54Å
596	V	87.6	Confident	86	Confident	93 Å²	93	80.9 Å²	80.9	56%	0.564	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	129.4	175.4	171.1	0	0	0	0	109.5	K592 Y598	K592-V596 HydrophobicContact CB-CG2 4.13Å; K592-V596 WeakPolarHBondContact O-CB 3.47Å; K592-V596 WeakPolarHBondContact O-CG2 3.33Å; K592-V596 PolarHBondContact O-N 3.25Å; V596-Y598 VanDerWaalsContact C-N 3.27Å; V596-Y598 PolarHBondContact O-N 3.47Å
597	G	84.5	Confident	86	Confident	78 Å²	78	76.7 Å²	76.7	80%	0.804	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	-9.1	-174.2	0	0	0	0	0	115.5	Y595	Y595-G597 PolarHBondContact O-N 3.09Å
598	Y	85.8	Confident	86.2	Confident	105 Å²	105	71 Å²	71	41%	0.412	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-44	174.6	-69.8	-93.1	0	0	0	112.3	F525 Q528 Y595 V596	F525-Y598 AromaticContact CD1-CD1 3.91Å; F525-Y598 HydrophobicContact CD1-CD1 3.91Å; F525-Y598 AromaticContact CE1-CD1 3.82Å; F525-Y598 HydrophobicContact CE1-CD1 3.82Å; F525-Y598 HydrophobicContact CE1-CG 4.39Å; F525-Y598 WeakPolarHBondContact CZ-O 3.35Å; Q528-Y598 HydrophobicContact CG-CD1 4.49Å; Q528-Y598 HydrophobicContact CG-CE1 4.28Å; Q528-Y598 HydrophobicContact CG-CE2 4.49Å; Q528-Y598 PolarHBondContact NE2-OH 2.94Å; Y595-Y598 WeakPolarHBondContact O-CB 3.5Å; Y595-Y598 PolarHBondContact O-N 2.98Å; V596-Y598 VanDerWaalsContact C-N 3.27Å; V596-Y598 PolarHBondContact O-N 3.47Å
599	I	87.9	Confident	86.4	Confident	10 Å²	10	69.7 Å²	69.7	5%	0.051	39%	0.391	C	S	.	.	S	Bend	trans	-79.7	152.9	169.8	-163.2	161.8	0	0	0	110.2	E532 L568 Y570 Y595 L607	E532-I599 HydrophobicContact CG-CD1 4.29Å; E532-I599 HydrophobicContact CG-CG1 3.95Å; E532-I599 WeakPolarHBondContact OE1-CG1 3.45Å; L568-I599 HydrophobicContact CB-CD1 3.81Å; Y570-I599 HydrophobicContact CD2-CD1 4.14Å; Y570-I599 HydrophobicContact CD2-CG1 4.25Å; Y570-I599 HydrophobicContact CE2-CD1 4.28Å; Y570-I599 HydrophobicContact CE2-CG1 4.26Å; Y570-I599 HydrophobicContact CE2-CG2 4.37Å; Y595-I599 HydrophobicContact CD2-CG2 3.96Å; Y595-I599 WeakPolarHBondContact O-CG2 3.32Å; Y595-I599 PolarHBondContact O-N 3.34Å; Y595-I599 VanDerWaalsContact O-N 3.12Å; I599-L607 HydrophobicContact CD1-CD1 3.76Å
600	K	83.2	Confident	86.9	Confident	67 Å²	67	63.6 Å²	63.6	29%	0.291	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-91.7	136.1	170.6	-68.7	176.5	-178.2	163.6	0	111.9	Y495 E532 Y570 Y602	Y495-K600 WeakPolarHBondContact OH-CD 3.43Å; Y495-K600 PolarHBondContact OH-NZ 2.81Å; E532-K600 PolarHBondContact OE1-N 2.92Å; Y570-K600 WeakPolarHBondContact CD2-O 3.45Å; Y570-K600 WeakPolarHBondContact CE2-O 3.5Å; K600-Y602 HydrophobicContact CB-CD2 4.48Å; K600-Y602 HydrophobicContact CB-CE2 3.83Å; K600-Y602 WeakPolarHBondContact O-CD2 3.31Å; K600-Y602 VanDerWaalsContact O-CE2 3.3Å; K600-Y602 WeakPolarHBondContact O-CE2 3.48Å
601	D	79.8	Confident	87.1	Confident	122 Å²	122	68 Å²	68	65%	0.652	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-82.7	136.3	172	-57.2	-33.7	0	0	0	110.4	Y570	Y570-D601 HydrophobicContact CE2-CB 4.42Å; Y570-D601 WeakPolarHBondContact CE2-OD1 3.49Å; Y570-D601 VanDerWaalsContact CZ-OD1 3.27Å; Y570-D601 PolarHBondContact OH-OD1 3.25Å
602	Y	80	Confident	87.3	Confident	40 Å²	40	64.5 Å²	64.5	16%	0.157	36%	0.362	C	S	.	.			trans	-121.9	127.3	-179.8	-65.2	-94.4	0	0	0	110	M491 Y495 Y570 K600 G604 A605	M491-Y602 HydrophobicContact CE-CD1 3.69Å; M491-Y602 HydrophobicContact CE-CE1 3.94Å; M491-Y602 HydrophobicContact CE-CG 4.45Å; M491-Y602 HydrophobicContact SD-CD1 4.17Å; M491-Y602 HydrophobicContact SD-CE1 4.03Å; Y495-Y602 AromaticContact CE1-CE1 3.95Å; Y495-Y602 HydrophobicContact CE1-CE1 3.95Å; Y495-Y602 AromaticContact CZ-CE1 3.99Å; Y495-Y602 PolarHBondContact OH-OH 2.94Å; Y570-Y602 AromaticContact CD2-CD2 3.89Å; Y570-Y602 HydrophobicContact CD2-CD2 3.89Å; Y570-Y602 HydrophobicContact CD2-CE2 4.5Å; Y570-Y602 AromaticContact CG-CD2 3.88Å; Y570-Y602 HydrophobicContact CG-CD2 3.88Å; K600-Y602 HydrophobicContact CB-CD2 4.48Å; K600-Y602 HydrophobicContact CB-CE2 3.83Å; K600-Y602 WeakPolarHBondContact O-CD2 3.31Å; K600-Y602 VanDerWaalsContact O-CE2 3.3Å; K600-Y602 WeakPolarHBondContact O-CE2 3.48Å; Y602-G604 PolarHBondContact O-N 3.2Å; Y602-A605 PolarHBondContact O-N 3.41Å
603	E	71.7	Confident	87.4	Confident	204 Å²	204	60.6 Å²	60.6	95%	0.953	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	132.9	-179.2	-169.4	171.6	-164	0	0	111.2	A605	E603-A605 VanDerWaalsContact C-N 3.26Å; E603-A605 PolarHBondContact O-N 3.14Å
604	G	73.3	Confident	87.5	Confident	53 Å²	53	59.9 Å²	59.9	55%	0.546	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	-1.3	-176	0	0	0	0	0	115.9	Y602	Y602-G604 PolarHBondContact O-N 3.2Å
605	A	86.1	Confident	87.4	Confident	19 Å²	19	59.3 Å²	59.3	16%	0.157	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-97.9	147.4	177.6	0	0	0	0	0	112.7	Y570 Y602 E603	Y570-A605 HydrophobicContact CD1-CB 3.85Å; Y570-A605 HydrophobicContact CG-CB 4.34Å; Y602-A605 PolarHBondContact O-N 3.41Å; E603-A605 VanDerWaalsContact C-N 3.26Å; E603-A605 PolarHBondContact O-N 3.14Å
606	T	90.8	Very high	87.3	Confident	29 Å²	29	60.7 Å²	60.7	18%	0.178	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	126.6	171.3	-72.7	0	0	0	0	110.3	A571 I576 K586 M608	A571-T606 PolarHBondContact N-O 3.08Å; A571-T606 PolarHBondContact O-N 3.5Å; I576-T606 HydrophobicContact CD1-CG2 4.33Å; I576-T606 WeakPolarHBondContact CD1-OG1 3.48Å; K586-T606 HydrophobicContact CD-CG2 3.62Å; K586-T606 VanDerWaalsContact CE-CG2 3.49Å; K586-T606 HydrophobicContact CG-CG2 3.88Å; K586-T606 VanDerWaalsContact NZ-CG2 3.33Å; K586-T606 PolarHBondContact NZ-OG1 3.33Å; T606-M608 HydrophobicContact CG2-CG 3.74Å; T606-M608 HydrophobicContact CG2-SD 4.49Å; T606-M608 PolarHBondContact O-N 2.89Å
607	L	93.6	Very high	87.4	Confident	29 Å²	29	58.7 Å²	58.7	15%	0.152	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	130.1	165.6	-174.8	66.6	0	0	0	110.6	Y570 I588 Y595 I599	Y570-L607 HydrophobicContact CD1-CB 4.11Å; Y570-L607 HydrophobicContact CD2-CD1 3.92Å; Y570-L607 HydrophobicContact CE1-CB 3.64Å; Y570-L607 HydrophobicContact CE1-CD1 4.4Å; Y570-L607 HydrophobicContact CE2-CB 4.43Å; Y570-L607 HydrophobicContact CE2-CD1 3.7Å; Y570-L607 HydrophobicContact CG-CD1 4.39Å; I588-L607 HydrophobicContact CD1-CB 4.36Å; I588-L607 HydrophobicContact CD1-CD2 3.55Å; I588-L607 HydrophobicContact CD1-CG 3.57Å; Y595-L607 HydrophobicContact CD2-CD2 4.45Å; Y595-L607 HydrophobicContact CE2-CD2 3.54Å; I599-L607 HydrophobicContact CD1-CD1 3.76Å
608	M	95	Very high	87.6	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	145.4	178.5	-61.7	-165.7	66.8	0	0	111.4	L568 T569 A571 I576 F579 K580 F584 S585 T606	L568-M608 WeakPolarHBondContact CA-O 3.31Å; T569-M608 HydrophobicContact CG2-CB 4.07Å; T569-M608 PolarHBondContact N-O 2.97Å; T569-M608 PolarHBondContact O-N 3.36Å; A571-M608 HydrophobicContact CB-CG 4.4Å; A571-M608 HydrophobicContact CB-SD 4.14Å; I576-M608 HydrophobicContact CB-SD 4.31Å; I576-M608 HydrophobicContact CG1-SD 4.1Å; I576-M608 HydrophobicContact CG2-SD 4.02Å; F579-M608 HydrophobicContact CB-SD 4.18Å; K580-M608 HydrophobicContact CG-CE 3.9Å; F584-M608 HydrophobicContact CB-CB 4.22Å; F584-M608 HydrophobicContact CB-CE 3.9Å; F584-M608 HydrophobicContact CD1-CB 4.33Å; F584-M608 WeakPolarHBondContact O-CE 3.41Å; S585-M608 CarbonylContact O-C 3.57Å; S585-M608 VanDerWaalsContact O-CA 3.24Å; S585-M608 WeakPolarHBondContact O-CA 3.42Å; S585-M608 WeakPolarHBondContact O-CB 3.23Å; T606-M608 HydrophobicContact CG2-CG 3.74Å; T606-M608 HydrophobicContact CG2-SD 4.49Å; T606-M608 PolarHBondContact O-N 2.89Å
609	G	95.1	Very high	87.7	Confident	9 Å²	9	52.6 Å²	52.6	9%	0.093	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	148	179.4	0	0	0	0	0	113.4	F567 F584 S585	F567-G609 CarbonylContact O-C 3.54Å; F567-G609 VanDerWaalsContact O-CA 3.28Å; F567-G609 WeakPolarHBondContact O-CA 3.39Å; F584-G609 CarbonylContact C-O 3.58Å; F584-G609 VanDerWaalsContact CA-O 3.26Å; F584-G609 WeakPolarHBondContact CA-O 3.46Å; S585-G609 PolarHBondContact N-O 3.18Å; S585-G609 PolarHBondContact O-N 3.14Å
610	C	96.1	Very high	87.6	Confident	12 Å²	12	57.2 Å²	57.2	8%	0.081	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	136.2	172.8	-171.6	0	0	0	0	110.1	N566 F567 G583 F584	N566-C610 WeakPolarHBondContact CA-O 3.33Å; F567-C610 HydrophobicContact CB-CB 4.27Å; F567-C610 PolarHBondContact N-O 3.46Å; F567-C610 PolarHBondContact O-N 3.37Å; G583-C610 VanDerWaalsContact C-SG 3.58Å; G583-C610 PolarHBondContact O-SG 3.42Å; F584-C610 HydrophobicContact CB-CB 4.32Å; F584-C610 HydrophobicContact CD1-CB 3.64Å; F584-C610 HydrophobicContact CD2-CB 3.65Å; F584-C610 HydrophobicContact CE1-CB 3.73Å; F584-C610 HydrophobicContact CE2-CB 3.74Å; F584-C610 HydrophobicContact CG-CB 3.59Å; F584-C610 HydrophobicContact CZ-CB 3.78Å
611	E	94.5	Very high	87.7	Confident	107 Å²	107	58 Å²	58	50%	0.5	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.7	175.8	-179.5	-175.1	-135.7	0	0	108.2	L565 K589	L565-E611 CarbonylContact O-C 3.55Å; L565-E611 WeakPolarHBondContact O-CA 3.36Å; K589-E611 WeakPolarHBondContact CE-OE2 3.35Å; K589-E611 IonicContact NZ-OE1 3.29Å; K589-E611 IonicContact NZ-OE2 2.75Å; K589-E611 PolarHBondContact NZ-OE2 2.9Å
612	L	93.1	Very high	87.9	Confident	6 Å²	6	53.5 Å²	53.5	3%	0.031	30%	0.301	C	S	.	.			trans	-96	137.7	-176.8	-53	-173	0	0	0	110.6	K556 H559 I560 L565 F567	K556-L612 HydrophobicContact CB-CD1 4.16Å; K556-L612 HydrophobicContact CB-CD2 4.34Å; K556-L612 HydrophobicContact CD-CD2 3.97Å; K556-L612 HydrophobicContact CG-CD1 4.19Å; K556-L612 HydrophobicContact CG-CD2 3.68Å; H559-L612 HydrophobicContact CB-CD1 4.35Å; I560-L612 HydrophobicContact CD1-CB 4.46Å; I560-L612 HydrophobicContact CG1-CB 4.31Å; I560-L612 HydrophobicContact CG1-CD1 4.18Å; L565-L612 HydrophobicContact CB-CB 4.43Å; L565-L612 HydrophobicContact CD2-CB 4.21Å; L565-L612 PolarHBondContact O-N 3.49Å; F567-L612 HydrophobicContact CD2-CD2 4.27Å; F567-L612 HydrophobicContact CE1-CD1 4.05Å; F567-L612 HydrophobicContact CE2-CD1 4.03Å; F567-L612 HydrophobicContact CE2-CD2 4.22Å; F567-L612 HydrophobicContact CZ-CD1 3.76Å
613	N	90.8	Very high	88.1	Confident	71 Å²	71	54.1 Å²	54.1	38%	0.38	31%	0.309	S	S	.	.			trans	-97.6	114.1	174.2	-175.5	-20.7	0	0	0	109.5	S615 I616 Y618	N613-S615 PolarHBondContact O-N 2.99Å; N613-S615 VanDerWaalsContact O-N 3.15Å; N613-S615 VanDerWaalsContact OD1-CB 3.32Å; N613-S615 WeakPolarHBondContact OD1-CB 3.42Å; N613-S615 PolarHBondContact OD1-N 3.4Å; N613-S615 PolarHBondContact OD1-OG 3.43Å; N613-I616 HydrophobicContact CB-CD1 3.9Å; N613-I616 HydrophobicContact CB-CG1 4.07Å; N613-I616 PolarHBondContact O-N 2.91Å; N613-Y618 PolarHBondContact N-OH 2.96Å; N613-Y618 VanDerWaalsContact N-OH 3.12Å
614	P	90	Very high	88.7	Confident	79 Å²	79	46.9 Å²	46.9	51%	0.513	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-11.9	-178.3	28.5	-35.4	0	0	0	113.7	I560 L565 I616	I560-P614 HydrophobicContact CG2-CB 4.08Å; L565-P614 HydrophobicContact CD1-CG 4.23Å; L565-P614 HydrophobicContact CD2-CB 4.29Å; L565-P614 HydrophobicContact CD2-CG 4.5Å; P614-I616 VanDerWaalsContact C-N 3.26Å; P614-I616 PolarHBondContact O-N 3.15Å
615	S	87.9	Confident	89.3	Confident	94 Å²	94	48 Å²	48	66%	0.657	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	4.6	174.3	-52.7	0	0	0	0	113.9	N613	N613-S615 PolarHBondContact O-N 2.99Å; N613-S615 VanDerWaalsContact O-N 3.15Å; N613-S615 VanDerWaalsContact OD1-CB 3.32Å; N613-S615 WeakPolarHBondContact OD1-CB 3.42Å; N613-S615 PolarHBondContact OD1-N 3.4Å; N613-S615 PolarHBondContact OD1-OG 3.43Å
616	I	87.2	Confident	89.1	Confident	47 Å²	47	52.6 Å²	52.6	24%	0.241	29%	0.285	C	S	.	.	S	Bend	trans	-120.7	113.5	-176.2	-58.3	-177.4	0	0	0	109.8	N613 P614 Y618 F621	N613-I616 HydrophobicContact CB-CD1 3.9Å; N613-I616 HydrophobicContact CB-CG1 4.07Å; N613-I616 PolarHBondContact O-N 2.91Å; P614-I616 VanDerWaalsContact C-N 3.26Å; P614-I616 PolarHBondContact O-N 3.15Å; I616-Y618 HydrophobicContact CB-CD2 4.46Å; I616-Y618 HydrophobicContact CB-CE2 4.03Å; I616-Y618 HydrophobicContact CG2-CD1 4.35Å; I616-Y618 HydrophobicContact CG2-CD2 4.35Å; I616-Y618 HydrophobicContact CG2-CE1 4.26Å; I616-Y618 HydrophobicContact CG2-CE2 4.24Å; I616-Y618 HydrophobicContact CG2-CG 4.42Å; I616-Y618 WeakPolarHBondContact O-CD2 3.41Å; I616-Y618 WeakPolarHBondContact O-CE2 3.42Å; I616-Y618 PolarHBondContact O-N 3.39Å; I616-F621 HydrophobicContact CG2-CD2 3.69Å; I616-F621 HydrophobicContact CG2-CE2 4.35Å
617	P	88.3	Confident	88.7	Confident	51 Å²	51	56.3 Å²	56.3	33%	0.331	30%	0.299	S	S	.	.			trans	-74.3	105.3	169.3	30.3	-32.3	0	0	0	108.8	T619 E620 F621 I624	P617-T619 VanDerWaalsContact C-N 3.27Å; P617-T619 PolarHBondContact O-N 3.48Å; P617-E620 PolarHBondContact O-N 3.26Å; P617-F621 PolarHBondContact O-N 3.09Å; P617-F621 VanDerWaalsContact O-N 3.15Å; P617-I624 HydrophobicContact CG-CD1 3.55Å
618	Y	89.4	Confident	88.3	Confident	24 Å²	24	59.6 Å²	59.6	9%	0.094	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-25.4	-168.6	-78.5	-88.1	0	0	0	112.6	N553 K556 E557 I560 N613 I616 E620 F621	N553-Y618 WeakPolarHBondContact CB-O 3.48Å; N553-Y618 VanDerWaalsContact CG-O 3.23Å; N553-Y618 PolarHBondContact ND2-O 2.81Å; K556-Y618 HydrophobicContact CB-CD2 3.9Å; K556-Y618 HydrophobicContact CB-CE2 4.49Å; K556-Y618 HydrophobicContact CB-CG 3.96Å; K556-Y618 HydrophobicContact CD-CD1 3.48Å; K556-Y618 VanDerWaalsContact CD-CD1 3.48Å; K556-Y618 HydrophobicContact CD-CD2 4.16Å; K556-Y618 HydrophobicContact CD-CE1 3.78Å; K556-Y618 HydrophobicContact CD-CE2 4.43Å; K556-Y618 HydrophobicContact CD-CG 3.68Å; K556-Y618 HydrophobicContact CG-CG 4.49Å; E557-Y618 PolarHBondContact OE2-N 3.48Å; I560-Y618 HydrophobicContact CD1-CD2 3.63Å; I560-Y618 HydrophobicContact CD1-CE2 3.61Å; N613-Y618 PolarHBondContact N-OH 2.96Å; N613-Y618 VanDerWaalsContact N-OH 3.12Å; I616-Y618 HydrophobicContact CB-CD2 4.46Å; I616-Y618 HydrophobicContact CB-CE2 4.03Å; I616-Y618 HydrophobicContact CG2-CD1 4.35Å; I616-Y618 HydrophobicContact CG2-CD2 4.35Å; I616-Y618 HydrophobicContact CG2-CE1 4.26Å; I616-Y618 HydrophobicContact CG2-CE2 4.24Å; I616-Y618 HydrophobicContact CG2-CG 4.42Å; I616-Y618 WeakPolarHBondContact O-CD2 3.41Å; I616-Y618 WeakPolarHBondContact O-CE2 3.42Å; I616-Y618 PolarHBondContact O-N 3.39Å; Y618-E620 VanDerWaalsContact C-N 3.29Å; Y618-E620 PolarHBondContact O-N 3.06Å; Y618-F621 WeakPolarHBondContact O-CB 3.42Å; Y618-F621 PolarHBondContact O-N 3.15Å
619	T	87.8	Confident	87.8	Confident	31 Å²	31	66.9 Å²	66.9	19%	0.19	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-24	174.9	53.6	0	0	0	0	113.5	R448 E557 P617	R448-T619 VanDerWaalsContact CZ-O 3.28Å; R448-T619 PolarHBondContact NE-O 3.1Å; R448-T619 PolarHBondContact NH2-O 3.18Å; E557-T619 HydrophobicContact CB-CG2 4.25Å; E557-T619 HydrophobicContact CG-CG2 4.18Å; P617-T619 VanDerWaalsContact C-N 3.27Å; P617-T619 PolarHBondContact O-N 3.48Å
620	E	85.6	Confident	87.2	Confident	108 Å²	108	69.5 Å²	69.5	51%	0.505	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-3.6	177.1	-68	-158.9	-175.5	0	0	114.3	P617 Y618 S622 V623 I624	P617-E620 PolarHBondContact O-N 3.26Å; Y618-E620 VanDerWaalsContact C-N 3.29Å; Y618-E620 PolarHBondContact O-N 3.06Å; E620-S622 VanDerWaalsContact C-N 3.28Å; E620-S622 PolarHBondContact O-N 2.83Å; E620-V623 WeakPolarHBondContact O-CA 3.28Å; E620-V623 WeakPolarHBondContact O-CB 3.26Å; E620-V623 PolarHBondContact O-N 3.47Å; E620-I624 HydrophobicContact CB-CD1 4.18Å; E620-I624 HydrophobicContact CB-CG1 4.47Å; E620-I624 PolarHBondContact O-N 3.46Å; E620-I624 VanDerWaalsContact O-N 3.14Å
621	F	86.1	Confident	86.6	Confident	82 Å²	82	70.1 Å²	70.1	36%	0.36	36%	0.357	S	S	.	.	H	α-helix	trans	-41.7	-49.6	-174.3	-179.3	-106.3	0	0	0	114.3	I616 P617 Y618 V623 I624 I625	I616-F621 HydrophobicContact CG2-CD2 3.69Å; I616-F621 HydrophobicContact CG2-CE2 4.35Å; P617-F621 PolarHBondContact O-N 3.09Å; P617-F621 VanDerWaalsContact O-N 3.15Å; Y618-F621 WeakPolarHBondContact O-CB 3.42Å; Y618-F621 PolarHBondContact O-N 3.15Å; F621-V623 VanDerWaalsContact C-N 3.3Å; F621-V623 PolarHBondContact O-N 3.33Å; F621-I624 PolarHBondContact O-N 3.26Å; F621-I625 HydrophobicContact CD1-CG1 4.3Å; F621-I625 HydrophobicContact CD2-CG1 4.21Å; F621-I625 HydrophobicContact CE1-CG1 3.93Å; F621-I625 HydrophobicContact CE2-CD1 3.9Å; F621-I625 HydrophobicContact CE2-CG1 3.85Å; F621-I625 HydrophobicContact CG-CG1 4.43Å; F621-I625 HydrophobicContact CZ-CD1 3.93Å; F621-I625 HydrophobicContact CZ-CG1 3.7Å; F621-I625 WeakPolarHBondContact O-CG1 3.21Å; F621-I625 PolarHBondContact O-N 3.27Å
622	S	83	Confident	86.2	Confident	28 Å²	28	69.5 Å²	69.5	20%	0.196	36%	0.356	C	S	.	.	H	α-helix	trans	-56.6	-39.1	178.3	-64.3	0	0	0	0	114.2	A442 D444 E620 K626	A442-S622 WeakPolarHBondContact CB-OG 3.33Å; D444-S622 WeakPolarHBondContact OD1-CB 3.39Å; D444-S622 PolarHBondContact OD1-OG 2.61Å; D444-S622 PolarHBondContact OD2-OG 2.79Å; D444-S622 VanDerWaalsContact OD2-OG 3.09Å; E620-S622 VanDerWaalsContact C-N 3.28Å; E620-S622 PolarHBondContact O-N 2.83Å; S622-K626 WeakPolarHBondContact O-CB 3.48Å; S622-K626 PolarHBondContact O-N 2.88Å; S622-K626 VanDerWaalsContact O-N 3.15Å
623	V	83.9	Confident	85.7	Confident	54 Å²	54	74.8 Å²	74.8	33%	0.327	38%	0.379	S	S	.	.	H	α-helix	trans	-74.6	-39.1	-179.9	-179.1	0	0	0	0	110.3	E620 F621 K626 K627	E620-V623 WeakPolarHBondContact O-CA 3.28Å; E620-V623 WeakPolarHBondContact O-CB 3.26Å; E620-V623 PolarHBondContact O-N 3.47Å; F621-V623 VanDerWaalsContact C-N 3.3Å; F621-V623 PolarHBondContact O-N 3.33Å; V623-K626 PolarHBondContact O-N 3.25Å; V623-K627 WeakPolarHBondContact O-CG 3.45Å; V623-K627 PolarHBondContact O-N 3.37Å
624	I	85.7	Confident	85.3	Confident	52 Å²	52	74.4 Å²	74.4	27%	0.267	37%	0.374	S	S	.	.	H	α-helix	trans	-64.4	-46.8	177.1	-65.7	170.7	0	0	0	110.6	P617 E620 F621 K626 K627 Q628	P617-I624 HydrophobicContact CG-CD1 3.55Å; E620-I624 HydrophobicContact CB-CD1 4.18Å; E620-I624 HydrophobicContact CB-CG1 4.47Å; E620-I624 PolarHBondContact O-N 3.46Å; E620-I624 VanDerWaalsContact O-N 3.14Å; F621-I624 PolarHBondContact O-N 3.26Å; I624-K626 VanDerWaalsContact C-N 3.3Å; I624-K626 PolarHBondContact O-N 2.78Å; I624-K627 PolarHBondContact O-N 2.8Å; I624-Q628 HydrophobicContact CG2-CG 4.42Å; I624-Q628 WeakPolarHBondContact O-CB 3.49Å; I624-Q628 WeakPolarHBondContact O-CG 3.38Å; I624-Q628 PolarHBondContact O-N 2.96Å
625	I	85.6	Confident	85	Confident	75 Å²	75	71.9 Å²	71.9	39%	0.385	36%	0.356	S	S	.	.	H	α-helix	trans	-61.9	-37.3	176	-64.5	-60.9	0	0	0	111.4	F621 K629	F621-I625 HydrophobicContact CD1-CG1 4.3Å; F621-I625 HydrophobicContact CD2-CG1 4.21Å; F621-I625 HydrophobicContact CE1-CG1 3.93Å; F621-I625 HydrophobicContact CE2-CD1 3.9Å; F621-I625 HydrophobicContact CE2-CG1 3.85Å; F621-I625 HydrophobicContact CG-CG1 4.43Å; F621-I625 HydrophobicContact CZ-CD1 3.93Å; F621-I625 HydrophobicContact CZ-CG1 3.7Å; F621-I625 WeakPolarHBondContact O-CG1 3.21Å; F621-I625 PolarHBondContact O-N 3.27Å; I625-K629 WeakPolarHBondContact O-CB 3.47Å; I625-K629 PolarHBondContact O-N 2.68Å
626	K	81.8	Confident	84.7	Confident	116 Å²	116	71.5 Å²	71.5	50%	0.504	35%	0.346	S	S	.	.	H	α-helix	trans	-62.4	-51.7	174.2	-175.8	177.7	176.3	-178.6	0	111.4	S622 V623 I624 Q628 K629 E630	S622-K626 WeakPolarHBondContact O-CB 3.48Å; S622-K626 PolarHBondContact O-N 2.88Å; S622-K626 VanDerWaalsContact O-N 3.15Å; V623-K626 PolarHBondContact O-N 3.25Å; I624-K626 VanDerWaalsContact C-N 3.3Å; I624-K626 PolarHBondContact O-N 2.78Å; K626-Q628 PolarHBondContact O-N 3.14Å; K626-K629 WeakPolarHBondContact O-CB 3.48Å; K626-K629 PolarHBondContact O-N 3.22Å; K626-E630 WeakPolarHBondContact CE-OE1 3.47Å; K626-E630 WeakPolarHBondContact CG-OE1 3.35Å; K626-E630 WeakPolarHBondContact O-CG 3.15Å; K626-E630 PolarHBondContact O-N 2.72Å
627	K	82.7	Confident	84.5	Confident	108 Å²	108	73.2 Å²	73.2	47%	0.47	35%	0.353	S	S	.	.	H	α-helix	trans	-57.8	-46.3	176.3	-72.8	-179.8	176.5	-178.4	0	112	V623 I624 K629 E630 I631	V623-K627 WeakPolarHBondContact O-CG 3.45Å; V623-K627 PolarHBondContact O-N 3.37Å; I624-K627 PolarHBondContact O-N 2.8Å; K627-K629 VanDerWaalsContact C-N 3.33Å; K627-K629 PolarHBondContact O-N 2.98Å; K627-E630 PolarHBondContact O-N 2.73Å; K627-E630 VanDerWaalsContact O-N 3.13Å; K627-I631 VanDerWaalsContact O-CG1 3.3Å; K627-I631 WeakPolarHBondContact O-CG1 3.45Å; K627-I631 PolarHBondContact O-N 3.1Å
628	Q	85.3	Confident	84	Confident	98 Å²	98	76 Å²	76	46%	0.458	36%	0.357	S	S	.	.	H	α-helix	trans	-58.1	-43.2	176.2	-74.6	176.5	-4.7	0	0	112.2	I624 K626 E630 I631 I632	I624-Q628 HydrophobicContact CG2-CG 4.42Å; I624-Q628 WeakPolarHBondContact O-CB 3.49Å; I624-Q628 WeakPolarHBondContact O-CG 3.38Å; I624-Q628 PolarHBondContact O-N 2.96Å; K626-Q628 PolarHBondContact O-N 3.14Å; Q628-E630 VanDerWaalsContact C-N 3.34Å; Q628-E630 PolarHBondContact O-N 2.63Å; Q628-I631 PolarHBondContact O-N 3.05Å; Q628-I632 WeakPolarHBondContact O-CB 3.11Å; Q628-I632 VanDerWaalsContact O-CG1 3.28Å; Q628-I632 WeakPolarHBondContact O-CG1 3.16Å; Q628-I632 PolarHBondContact O-N 2.86Å
629	K	84.3	Confident	83.5	Confident	153 Å²	153	81.2 Å²	81.2	67%	0.665	38%	0.38	S	S	*	.	H	α-helix	trans	-64.8	-36.6	176.1	-174.4	-178.4	176.8	-173	0	112.4	I625 K626 K627 K633	I625-K629 WeakPolarHBondContact O-CB 3.47Å; I625-K629 PolarHBondContact O-N 2.68Å; K626-K629 WeakPolarHBondContact O-CB 3.48Å; K626-K629 PolarHBondContact O-N 3.22Å; K627-K629 VanDerWaalsContact C-N 3.33Å; K627-K629 PolarHBondContact O-N 2.98Å; K629-K633 WeakPolarHBondContact O-CB 3.48Å; K629-K633 PolarHBondContact O-N 3.39Å
630	E	82.4	Confident	82.9	Confident	64 Å²	64	84 Å²	84	30%	0.299	39%	0.39	S	S	.	.	H	α-helix	trans	-70.2	-41.6	177.3	-73.5	163.3	-179.9	0	0	112.2	I425 K626 K627 Q628 K633 K634	I425-E630 HydrophobicContact CD1-CB 4.38Å; K626-E630 WeakPolarHBondContact CE-OE1 3.47Å; K626-E630 WeakPolarHBondContact CG-OE1 3.35Å; K626-E630 WeakPolarHBondContact O-CG 3.15Å; K626-E630 PolarHBondContact O-N 2.72Å; K627-E630 PolarHBondContact O-N 2.73Å; K627-E630 VanDerWaalsContact O-N 3.13Å; Q628-E630 VanDerWaalsContact C-N 3.34Å; Q628-E630 PolarHBondContact O-N 2.63Å; E630-K633 PolarHBondContact O-N 3.22Å; E630-K634 PolarHBondContact O-N 2.86Å
631	I	84.1	Confident	82.2	Confident	24 Å²	24	82.4 Å²	82.4	12%	0.123	40%	0.396	C	S	.	.	H	α-helix	trans	-58.1	-52.1	170.8	-62.9	161.4	0	0	0	110	I418 V421 M422 I425 K627 Q628 K633 K634 L635	I418-I631 HydrophobicContact CG2-CG2 4.48Å; V421-I631 HydrophobicContact CG1-CB 4.47Å; V421-I631 HydrophobicContact CG1-CG2 4.16Å; M422-I631 HydrophobicContact CG-CD1 4.06Å; M422-I631 HydrophobicContact CG-CG1 4.3Å; M422-I631 HydrophobicContact SD-CD1 3.58Å; M422-I631 VanDerWaalsContact SD-CD1 3.58Å; M422-I631 HydrophobicContact SD-CG1 3.9Å; I425-I631 HydrophobicContact CD1-CG1 3.81Å; K627-I631 VanDerWaalsContact O-CG1 3.3Å; K627-I631 WeakPolarHBondContact O-CG1 3.45Å; K627-I631 PolarHBondContact O-N 3.1Å; Q628-I631 PolarHBondContact O-N 3.05Å; I631-K633 VanDerWaalsContact C-N 3.28Å; I631-K633 PolarHBondContact O-N 3.26Å; I631-K634 PolarHBondContact O-N 3.38Å; I631-L635 HydrophobicContact CG2-CD1 3.86Å; I631-L635 HydrophobicContact CG2-CG 4.38Å; I631-L635 WeakPolarHBondContact O-CG 3.43Å; I631-L635 PolarHBondContact O-N 2.88Å
632	I	85.6	Confident	81.4	Confident	94 Å²	94	85.5 Å²	85.5	48%	0.482	41%	0.412	S	S	.	.	H	α-helix	trans	-59.7	-39.2	178.9	-69.5	166.5	0	0	0	111	Q628 L635 I636	Q628-I632 WeakPolarHBondContact O-CB 3.11Å; Q628-I632 VanDerWaalsContact O-CG1 3.28Å; Q628-I632 WeakPolarHBondContact O-CG1 3.16Å; Q628-I632 PolarHBondContact O-N 2.86Å; I632-L635 PolarHBondContact O-N 3.18Å; I632-I636 HydrophobicContact CG2-CD1 3.76Å; I632-I636 HydrophobicContact CG2-CG1 4.42Å; I632-I636 WeakPolarHBondContact O-CB 3.48Å; I632-I636 VanDerWaalsContact O-CG1 3.25Å; I632-I636 WeakPolarHBondContact O-CG1 3.37Å; I632-I636 PolarHBondContact O-N 3.26Å
633	K	83.1	Confident	80.5	Confident	118 Å²	118	88.8 Å²	88.8	51%	0.513	43%	0.426	S	S	.	.	H	α-helix	trans	-62.4	-49.3	175.5	-176.5	174.8	178	-72.7	0	111.7	K629 E630 I631 L635 I636 E637	K629-K633 WeakPolarHBondContact O-CB 3.48Å; K629-K633 PolarHBondContact O-N 3.39Å; E630-K633 PolarHBondContact O-N 3.22Å; I631-K633 VanDerWaalsContact C-N 3.28Å; I631-K633 PolarHBondContact O-N 3.26Å; K633-L635 VanDerWaalsContact C-N 3.33Å; K633-L635 PolarHBondContact O-N 2.95Å; K633-I636 PolarHBondContact O-N 3.18Å; K633-E637 WeakPolarHBondContact CE-OE1 3.17Å; K633-E637 IonicContact NZ-OE1 3.34Å; K633-E637 PolarHBondContact NZ-OE1 3.12Å; K633-E637 IonicContact NZ-OE2 2.68Å; K633-E637 VanDerWaalsContact O-CG 3.32Å; K633-E637 WeakPolarHBondContact O-CG 3.46Å; K633-E637 PolarHBondContact O-N 3.11Å
634	K	82.2	Confident	79.6	Confident	62 Å²	62	95.4 Å²	95.4	27%	0.27	45%	0.445	S	S	.	.	H	α-helix	trans	-63.1	-37	177.1	-73.6	-163.1	179	-169	0	112.6	V421 T424 I425 E630 I631 E637 R638	V421-K634 HydrophobicContact CG1-CB 3.8Å; V421-K634 HydrophobicContact CG1-CD 4.19Å; T424-K634 PolarHBondContact O-NZ 3.33Å; I425-K634 HydrophobicContact CD1-CD 4.17Å; I425-K634 HydrophobicContact CG1-CD 3.75Å; E630-K634 PolarHBondContact O-N 2.86Å; I631-K634 PolarHBondContact O-N 3.38Å; K634-E637 PolarHBondContact O-N 3.39Å; K634-R638 WeakPolarHBondContact O-CB 3.41Å; K634-R638 PolarHBondContact O-N 3.25Å
635	L	83.3	Confident	78.7	Confident	27 Å²	27	98 Å²	98	14%	0.141	46%	0.455	C	S	.	.	H	α-helix	trans	-65.5	-41.3	173.7	-69.6	171.6	0	0	0	112.3	I413 L417 V421 I631 I632 K633 K639	I413-L635 HydrophobicContact CD1-CD1 3.82Å; I413-L635 HydrophobicContact CG2-CD1 4.16Å; I413-L635 HydrophobicContact CG2-CD2 4.34Å; L417-L635 HydrophobicContact CD1-CD2 4.44Å; L417-L635 HydrophobicContact CD2-CD2 3.92Å; L417-L635 HydrophobicContact CG-CD2 3.87Å; V421-L635 HydrophobicContact CG2-CD2 4.11Å; I631-L635 HydrophobicContact CG2-CD1 3.86Å; I631-L635 HydrophobicContact CG2-CG 4.38Å; I631-L635 WeakPolarHBondContact O-CG 3.43Å; I631-L635 PolarHBondContact O-N 2.88Å; I632-L635 PolarHBondContact O-N 3.18Å; K633-L635 VanDerWaalsContact C-N 3.33Å; K633-L635 PolarHBondContact O-N 2.95Å; L635-K639 VanDerWaalsContact O-CB 3.32Å; L635-K639 WeakPolarHBondContact O-CB 3.45Å; L635-K639 PolarHBondContact O-N 3.32Å
636	I	82.4	Confident	77.9	Confident	86 Å²	86	101.1 Å²	101.1	44%	0.441	48%	0.476	S	S	.	.	H	α-helix	trans	-63.7	-42.7	173.1	-71.7	167.1	0	0	0	110.5	I632 K633 K639 Q640	I632-I636 HydrophobicContact CG2-CD1 3.76Å; I632-I636 HydrophobicContact CG2-CG1 4.42Å; I632-I636 WeakPolarHBondContact O-CB 3.48Å; I632-I636 VanDerWaalsContact O-CG1 3.25Å; I632-I636 WeakPolarHBondContact O-CG1 3.37Å; I632-I636 PolarHBondContact O-N 3.26Å; K633-I636 PolarHBondContact O-N 3.18Å; I636-K639 PolarHBondContact O-N 2.76Å; I636-Q640 HydrophobicContact CG2-CG 4.24Å; I636-Q640 WeakPolarHBondContact O-CB 3.27Å; I636-Q640 VanDerWaalsContact O-CG 3.3Å; I636-Q640 WeakPolarHBondContact O-CG 3Å; I636-Q640 PolarHBondContact O-N 3.41Å
637	E	82.1	Confident	77.5	Confident	83 Å²	83	99.2 Å²	99.2	39%	0.388	47%	0.467	S	S	.	.	H	α-helix	trans	-63.7	-46.5	178.4	-74.2	164.6	167	0	0	111.8	K633 K634 K639 Q640 A641	K633-E637 WeakPolarHBondContact CE-OE1 3.17Å; K633-E637 IonicContact NZ-OE1 3.34Å; K633-E637 PolarHBondContact NZ-OE1 3.12Å; K633-E637 IonicContact NZ-OE2 2.68Å; K633-E637 VanDerWaalsContact O-CG 3.32Å; K633-E637 WeakPolarHBondContact O-CG 3.46Å; K633-E637 PolarHBondContact O-N 3.11Å; K634-E637 PolarHBondContact O-N 3.39Å; E637-K639 VanDerWaalsContact C-N 3.32Å; E637-K639 PolarHBondContact O-N 3.31Å; E637-Q640 PolarHBondContact O-N 2.71Å; E637-A641 PolarHBondContact O-N 3.17Å
638	R	78.4	Confident	77.1	Confident	109 Å²	109	99.6 Å²	99.6	41%	0.411	48%	0.48	S	S	.	.	H	α-helix	trans	-62.1	-38.6	176.3	-160	172.7	-167.3	167.3	4.8	111.9	L417 E420 K634 Q642	L417-R638 VanDerWaalsContact CD1-NH1 3.3Å; E420-R638 IonicContact OE1-CZ 2.81Å; E420-R638 VanDerWaalsContact OE1-CZ 3.31Å; E420-R638 IonicContact OE1-NH1 3.69Å; E420-R638 PolarHBondContact OE1-NH1 3.3Å; E420-R638 IonicContact OE1-NH2 3.11Å; E420-R638 PolarHBondContact OE1-NH2 3.09Å; E420-R638 IonicContact OE2-CZ 3.62Å; E420-R638 IonicContact OE2-NH1 2.64Å; E420-R638 PolarHBondContact OE2-NH1 3.01Å; E420-R638 IonicContact OE2-NH2 2.62Å; E420-R638 PolarHBondContact OE2-NH2 3.49Å; K634-R638 WeakPolarHBondContact O-CB 3.41Å; K634-R638 PolarHBondContact O-N 3.25Å; R638-Q642 PolarHBondContact O-N 3.44Å
639	K	78	Confident	76.6	Confident	133 Å²	133	98.5 Å²	98.5	58%	0.578	50%	0.495	S	S	*	.	H	α-helix	trans	-73.1	-33.9	174.4	-170.3	166.3	-176.8	170.2	0	112.9	L635 I636 E637 Q642 I643	L635-K639 VanDerWaalsContact O-CB 3.32Å; L635-K639 WeakPolarHBondContact O-CB 3.45Å; L635-K639 PolarHBondContact O-N 3.32Å; I636-K639 PolarHBondContact O-N 2.76Å; E637-K639 VanDerWaalsContact C-N 3.32Å; E637-K639 PolarHBondContact O-N 3.31Å; K639-Q642 PolarHBondContact O-N 2.87Å; K639-I643 HydrophobicContact CG-CD1 3.88Å; K639-I643 VanDerWaalsContact O-CG1 3.28Å; K639-I643 WeakPolarHBondContact O-CG1 3.04Å; K639-I643 PolarHBondContact O-N 3.23Å
640	Q	74.8	Confident	76.3	Confident	89 Å²	89	94.5 Å²	94.5	42%	0.416	48%	0.481	S	S	.	.	H	α-helix	trans	-67.7	-36.5	172.9	-79.6	-174.6	22.3	0	0	111.8	I636 E637 Q642 I643 R644	I636-Q640 HydrophobicContact CG2-CG 4.24Å; I636-Q640 WeakPolarHBondContact O-CB 3.27Å; I636-Q640 VanDerWaalsContact O-CG 3.3Å; I636-Q640 WeakPolarHBondContact O-CG 3Å; I636-Q640 PolarHBondContact O-N 3.41Å; E637-Q640 PolarHBondContact O-N 2.71Å; Q640-Q642 VanDerWaalsContact C-N 3.31Å; Q640-Q642 PolarHBondContact O-N 3.07Å; Q640-I643 PolarHBondContact O-N 3.41Å; Q640-R644 WeakPolarHBondContact O-CB 3.44Å; Q640-R644 VanDerWaalsContact O-CG 3.29Å; Q640-R644 WeakPolarHBondContact O-CG 3.28Å; Q640-R644 PolarHBondContact O-N 2.89Å
641	A	72.6	Confident	75.7	Confident	75 Å²	75	95.4 Å²	95.4	62%	0.62	49%	0.494	S	S	*	.	H	α-helix	trans	-59.9	-41.5	173.3	0	0	0	0	0	111.8	E637	E637-A641 PolarHBondContact O-N 3.17Å
642	Q	67.5	Low	74.8	Confident	148 Å²	148	95.9 Å²	95.9	69%	0.692	50%	0.499	S	S	*	.	H	α-helix	trans	-65.7	-36.5	173.3	-66.6	169.8	-18	0	0	112.9	R638 K639 Q640	R638-Q642 PolarHBondContact O-N 3.44Å; K639-Q642 PolarHBondContact O-N 2.87Å; Q640-Q642 VanDerWaalsContact C-N 3.31Å; Q640-Q642 PolarHBondContact O-N 3.07Å
643	I	65.8	Low	74	Confident	96 Å²	96	96 Å²	96	49%	0.492	50%	0.497	S	S	.	.	H	α-helix	trans	-83.3	-23.1	-176.4	-68.6	169.1	0	0	0	112.9	K639 Q640 K645	K639-I643 HydrophobicContact CG-CD1 3.88Å; K639-I643 VanDerWaalsContact O-CG1 3.28Å; K639-I643 WeakPolarHBondContact O-CG1 3.04Å; K639-I643 PolarHBondContact O-N 3.23Å; Q640-I643 PolarHBondContact O-N 3.41Å; I643-K645 PolarHBondContact O-N 3.18Å
644	R	64.6	Low	73.3	Confident	193 Å²	193	99.5 Å²	99.5	73%	0.728	51%	0.512	S	S	*	.			trans	-71.9	21.4	179.7	-82.2	-177.3	-179.3	-160.3	3.6	115	Q640 V646	Q640-R644 WeakPolarHBondContact O-CB 3.44Å; Q640-R644 VanDerWaalsContact O-CG 3.29Å; Q640-R644 WeakPolarHBondContact O-CG 3.28Å; Q640-R644 PolarHBondContact O-N 2.89Å; R644-V646 PolarHBondContact O-N 2.93Å
645	K	67.2	Low	72.3	Confident	108 Å²	108	102.5 Å²	102.5	47%	0.47	53%	0.531	S	S	.	.			trans	-62.5	114.2	167.8	-180	173.1	164.8	-167.3	0	108.9	I643 Y647 E670	I643-K645 PolarHBondContact O-N 3.18Å; K645-Y647 HydrophobicContact CB-CE2 4.17Å; K645-Y647 HydrophobicContact CD-CE1 3.99Å; K645-Y647 HydrophobicContact CG-CE1 4.21Å; K645-Y647 HydrophobicContact CG-CE2 4.17Å; K645-Y647 WeakPolarHBondContact O-CD2 3.45Å; K645-Y647 WeakPolarHBondContact O-CE2 3.37Å; K645-E670 VanDerWaalsContact NZ-CD 3.27Å; K645-E670 IonicContact NZ-OE1 3.74Å; K645-E670 PolarHBondContact NZ-OE1 2.93Å; K645-E670 VanDerWaalsContact NZ-OE1 3.1Å; K645-E670 IonicContact NZ-OE2 2.84Å; K645-E670 PolarHBondContact NZ-OE2 3.09Å
646	V	69.3	Low	71.1	Confident	139 Å²	139	104 Å²	104	84%	0.842	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-78.4	124.1	175.8	-179.9	0	0	0	0	108.6	R644	R644-V646 PolarHBondContact O-N 2.93Å
647	Y	72.2	Confident	70	Confident	76 Å²	76	103.1 Å²	103.1	30%	0.298	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-95.8	145.7	177.8	-62.9	-89.6	0	0	0	110.5	K645 P666 G667 E670	K645-Y647 HydrophobicContact CB-CE2 4.17Å; K645-Y647 HydrophobicContact CD-CE1 3.99Å; K645-Y647 HydrophobicContact CG-CE1 4.21Å; K645-Y647 HydrophobicContact CG-CE2 4.17Å; K645-Y647 WeakPolarHBondContact O-CD2 3.45Å; K645-Y647 WeakPolarHBondContact O-CE2 3.37Å; Y647-P666 HydrophobicContact CD1-CB 4.19Å; Y647-G667 VanDerWaalsContact CE2-CA 3.41Å; Y647-E670 WeakPolarHBondContact CE1-OE1 3.42Å; Y647-E670 PolarHBondContact OH-OE2 2.92Å
648	P	73.9	Confident	69.1	Low	117 Å²	117	110.1 Å²	110.1	76%	0.76	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-63.8	154.8	173.3	28.2	-35.1	0	0	0	111.5
649	G	75.1	Confident	68.6	Low	75 Å²	75	113 Å²	113	77%	0.773	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-61.3	142.1	178.6	0	0	0	0	0	112.9	S651	G649-S651 PolarHBondContact O-N 3.4Å
650	L	77.4	Confident	68.4	Low	69 Å²	69	108.7 Å²	108.7	36%	0.361	58%	0.575	S	S	.	*			trans	-67.3	112.1	-176.7	-65.5	163.7	0	0	0	110.8	F653 I660 I665	L650-F653 HydrophobicContact CB-CD2 3.92Å; L650-F653 HydrophobicContact CB-CE2 3.88Å; L650-F653 HydrophobicContact CD1-CE2 3.94Å; L650-I660 HydrophobicContact CD1-CD1 3.97Å; L650-I660 HydrophobicContact CD2-CD1 4.38Å; L650-I665 HydrophobicContact CD1-CD1 4.44Å; L650-I665 HydrophobicContact CD1-CG1 4.22Å
651	S	70.9	Confident	68.2	Low	83 Å²	83	108.3 Å²	108.3	58%	0.58	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-68.8	-37.1	-175.5	49.1	0	0	0	0	113.8	G649 F653 K654	G649-S651 PolarHBondContact O-N 3.4Å; S651-F653 PolarHBondContact O-N 2.73Å; S651-K654 WeakPolarHBondContact O-CB 3.41Å; S651-K654 WeakPolarHBondContact O-CG 3.16Å; S651-K654 PolarHBondContact O-N 3.45Å
652	C	64.6	Low	68.1	Low	33 Å²	33	108.9 Å²	108.9	22%	0.223	57%	0.572	C	S	.	*	G	3₁₀ helix	trans	-53.3	-22.5	-171.7	55.3	0	0	0	0	116.1	K654 D655 V657	C652-K654 VanDerWaalsContact C-N 3.28Å; C652-K654 PolarHBondContact O-N 3.46Å; C652-D655 WeakPolarHBondContact CA-OD2 3.31Å; C652-D655 PolarHBondContact O-N 2.93Å; C652-V657 WeakPolarHBondContact O-CB 3.43Å
653	F	69.6	Low	68.3	Low	98 Å²	98	105.7 Å²	105.7	43%	0.43	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-73.1	-18.9	175.6	-65.5	-75.5	0	0	0	113.3	L650 S651 D655 V657 I660	L650-F653 HydrophobicContact CB-CD2 3.92Å; L650-F653 HydrophobicContact CB-CE2 3.88Å; L650-F653 HydrophobicContact CD1-CE2 3.94Å; S651-F653 PolarHBondContact O-N 2.73Å; F653-D655 VanDerWaalsContact C-N 3.32Å; F653-V657 WeakPolarHBondContact CD1-O 3.38Å; F653-I660 HydrophobicContact CE2-CD1 4.09Å; F653-I660 HydrophobicContact CZ-CD1 4.09Å; F653-I660 HydrophobicContact CZ-CG1 4.04Å; F653-I660 HydrophobicContact CZ-CG2 4.47Å
654	K	68.6	Low	68.6	Low	191 Å²	191	103.3 Å²	103.3	83%	0.83	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-30.8	172.5	-62.9	-174.5	177.7	-174.3	0	111.6	S651 C652 G656	S651-K654 WeakPolarHBondContact O-CB 3.41Å; S651-K654 WeakPolarHBondContact O-CG 3.16Å; S651-K654 PolarHBondContact O-N 3.45Å; C652-K654 VanDerWaalsContact C-N 3.28Å; C652-K654 PolarHBondContact O-N 3.46Å; K654-G656 PolarHBondContact O-N 3.09Å; K654-G656 VanDerWaalsContact O-N 3.15Å
655	D	60.7	Low	69.2	Low	125 Å²	125	96.3 Å²	96.3	67%	0.668	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	21.1	-177.6	-44	-57	0	0	0	112.5	C652 F653 V657	C652-D655 WeakPolarHBondContact CA-OD2 3.31Å; C652-D655 PolarHBondContact O-N 2.93Å; F653-D655 VanDerWaalsContact C-N 3.32Å; D655-V657 VanDerWaalsContact C-N 3.28Å; D655-V657 PolarHBondContact O-N 3.27Å
656	G	57	Low	69.4	Low	59 Å²	59	93.3 Å²	93.3	61%	0.608	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	-5.8	177.5	0	0	0	0	0	116.1	K654 R658	K654-G656 PolarHBondContact O-N 3.09Å; K654-G656 VanDerWaalsContact O-N 3.15Å; G656-R658 PolarHBondContact O-N 3.39Å
657	V	59.6	Low	69.5	Low	67 Å²	67	87.3 Å²	87.3	41%	0.406	48%	0.483	S	S	.	.			trans	-69.6	114.2	-179.6	-176.2	0	0	0	0	110.4	C652 F653 D655 Q659 I660	C652-V657 WeakPolarHBondContact O-CB 3.43Å; F653-V657 WeakPolarHBondContact CD1-O 3.38Å; D655-V657 VanDerWaalsContact C-N 3.28Å; D655-V657 PolarHBondContact O-N 3.27Å; V657-Q659 VanDerWaalsContact CG1-O 3.27Å; V657-Q659 WeakPolarHBondContact CG1-O 3.45Å; V657-I660 HydrophobicContact CG1-CG2 4.13Å
658	R	64	Low	69.6	Low	230 Å²	230	86 Å²	86	87%	0.868	48%	0.481	S	S	*	.			trans	-81.8	-19.1	-174.9	-65.6	-172.6	179	-168.7	-0.6	115.3	G656	G656-R658 PolarHBondContact O-N 3.39Å
659	Q	67.3	Low	69.4	Low	170 Å²	170	87.4 Å²	87.4	79%	0.794	47%	0.471	S	S	*	.			trans	-148.4	143.4	-176.9	-64.6	-176.4	-0.6	0	0	110.3	V657	V657-Q659 VanDerWaalsContact CG1-O 3.27Å; V657-Q659 WeakPolarHBondContact CG1-O 3.45Å
660	I	73.4	Confident	69.1	Low	41 Å²	41	89 Å²	89	21%	0.21	46%	0.459	C	S	.	.			trans	-130.5	151.8	172.2	65.4	177.5	0	0	0	110.2	L650 F653 V657 I665	L650-I660 HydrophobicContact CD1-CD1 3.97Å; L650-I660 HydrophobicContact CD2-CD1 4.38Å; F653-I660 HydrophobicContact CE2-CD1 4.09Å; F653-I660 HydrophobicContact CZ-CD1 4.09Å; F653-I660 HydrophobicContact CZ-CG1 4.04Å; F653-I660 HydrophobicContact CZ-CG2 4.47Å; V657-I660 HydrophobicContact CG1-CG2 4.13Å; I660-I665 HydrophobicContact CD1-CD1 4.45Å; I660-I665 HydrophobicContact CD1-CG1 3.87Å; I660-I665 HydrophobicContact CG1-CG1 4.48Å
661	P	69.9	Low	68.7	Low	82 Å²	82	89.8 Å²	89.8	53%	0.532	47%	0.466	S	S	.	.			trans	-60.4	142	171.6	-21.6	33.5	0	0	0	111.3	E663 S664	P661-E663 WeakPolarHBondContact CB-OE2 3.48Å; P661-E663 PolarHBondContact O-N 2.98Å; P661-S664 WeakPolarHBondContact O-CB 3.36Å; P661-S664 PolarHBondContact O-N 3.26Å; P661-S664 PolarHBondContact O-OG 2.97Å
662	I	71.2	Confident	68.3	Low	87 Å²	87	88.6 Å²	88.6	45%	0.446	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-64	-31.9	-178.7	-63.2	175.3	0	0	0	110.3	S664 I665 I668 W673	I662-S664 PolarHBondContact O-N 3.26Å; I662-I665 WeakPolarHBondContact O-CB 3.35Å; I662-I665 PolarHBondContact O-N 2.74Å; I662-I668 HydrophobicContact CG2-CD1 3.65Å; I662-I668 HydrophobicContact CG2-CG2 4.15Å; I662-W673 HydrophobicContact CB-CH2 4.03Å; I662-W673 HydrophobicContact CB-CZ3 3.95Å; I662-W673 HydrophobicContact CD1-CH2 4.42Å; I662-W673 HydrophobicContact CG2-CE3 4.12Å; I662-W673 HydrophobicContact CG2-CH2 3.58Å; I662-W673 HydrophobicContact CG2-CZ2 4.23Å; I662-W673 HydrophobicContact CG2-CZ3 3.53Å
663	E	71.5	Confident	68.1	Low	81 Å²	81	92 Å²	92	38%	0.379	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-64.4	-20.2	175.1	-56.7	75.8	-167.7	0	0	113.4	P661 W673 P675	P661-E663 WeakPolarHBondContact CB-OE2 3.48Å; P661-E663 PolarHBondContact O-N 2.98Å; E663-W673 HydrophobicContact CG-CZ3 4.17Å; E663-P675 WeakPolarHBondContact OE1-CG 3.5Å
664	S	71.7	Confident	67.5	Low	45 Å²	45	95.8 Å²	95.8	32%	0.315	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-81.5	-21.2	179	74	0	0	0	0	113.2	P661 I662 P666 R669	P661-S664 WeakPolarHBondContact O-CB 3.36Å; P661-S664 PolarHBondContact O-N 3.26Å; P661-S664 PolarHBondContact O-OG 2.97Å; I662-S664 PolarHBondContact O-N 3.26Å; S664-P666 WeakPolarHBondContact O-CD 3.42Å; S664-R669 PolarHBondContact O-NH1 2.88Å
665	I	78.6	Confident	66.8	Low	46 Å²	46	90.2 Å²	90.2	24%	0.236	48%	0.475	C	S	.	.	S	Bend	trans	-68.6	119.1	-176.4	-62.4	175.4	0	0	0	109.1	L650 I660 I662 G667 I668 R669	L650-I665 HydrophobicContact CD1-CD1 4.44Å; L650-I665 HydrophobicContact CD1-CG1 4.22Å; I660-I665 HydrophobicContact CD1-CD1 4.45Å; I660-I665 HydrophobicContact CD1-CG1 3.87Å; I660-I665 HydrophobicContact CG1-CG1 4.48Å; I662-I665 WeakPolarHBondContact O-CB 3.35Å; I662-I665 PolarHBondContact O-N 2.74Å; I665-G667 PolarHBondContact O-N 3.18Å; I665-I668 HydrophobicContact CB-CB 4.21Å; I665-I668 HydrophobicContact CB-CD1 4.07Å; I665-I668 HydrophobicContact CB-CG1 4.14Å; I665-I668 HydrophobicContact CD1-CD1 3.97Å; I665-I668 HydrophobicContact CG2-CB 4.41Å; I665-I668 HydrophobicContact CG2-CD1 4.09Å; I665-I668 HydrophobicContact CG2-CG1 3.95Å; I665-I668 PolarHBondContact O-N 2.62Å; I665-R669 PolarHBondContact O-N 3.19Å
666	P	71.1	Confident	66.1	Low	45 Å²	45	88.6 Å²	88.6	29%	0.292	48%	0.479	S	S	.	.	H	α-helix	trans	-53.4	-49.3	-170.5	-30	35.8	0	0	0	114.1	Y647 S664 I668 R669 E670	Y647-P666 HydrophobicContact CD1-CB 4.19Å; S664-P666 WeakPolarHBondContact O-CD 3.42Å; P666-I668 VanDerWaalsContact C-N 3.26Å; P666-I668 PolarHBondContact O-N 2.67Å; P666-R669 PolarHBondContact O-N 2.97Å; P666-E670 WeakPolarHBondContact O-CB 3.38Å; P666-E670 WeakPolarHBondContact O-CG 3.5Å; P666-E670 PolarHBondContact O-N 2.75Å
667	G	71	Confident	65.5	Low	13 Å²	13	89 Å²	89	13%	0.134	48%	0.483	C	S	.	.	H	α-helix	trans	-67.4	-20.5	179.8	0	0	0	0	0	115.1	Y647 I665 T671	Y647-G667 VanDerWaalsContact CE2-CA 3.41Å; I665-G667 PolarHBondContact O-N 3.18Å; G667-T671 VanDerWaalsContact O-CG2 3.27Å; G667-T671 WeakPolarHBondContact O-CG2 3.34Å
668	I	74	Confident	64.6	Low	49 Å²	49	94.5 Å²	94.5	25%	0.251	50%	0.501	S	S	.	.	H	α-helix	trans	-83.1	-45.1	173.5	-62.1	-177.3	0	0	0	109.3	I662 I665 P666 E670 T671 W673	I662-I668 HydrophobicContact CG2-CD1 3.65Å; I662-I668 HydrophobicContact CG2-CG2 4.15Å; I665-I668 HydrophobicContact CB-CB 4.21Å; I665-I668 HydrophobicContact CB-CD1 4.07Å; I665-I668 HydrophobicContact CB-CG1 4.14Å; I665-I668 HydrophobicContact CD1-CD1 3.97Å; I665-I668 HydrophobicContact CG2-CB 4.41Å; I665-I668 HydrophobicContact CG2-CD1 4.09Å; I665-I668 HydrophobicContact CG2-CG1 3.95Å; I665-I668 PolarHBondContact O-N 2.62Å; P666-I668 VanDerWaalsContact C-N 3.26Å; P666-I668 PolarHBondContact O-N 2.67Å; I668-E670 VanDerWaalsContact C-N 3.33Å; I668-E670 PolarHBondContact O-N 3.43Å; I668-T671 PolarHBondContact O-N 2.77Å; I668-T671 VanDerWaalsContact O-N 3.11Å; I668-T671 PolarHBondContact O-OG1 3.2Å; I668-W673 HydrophobicContact CG2-CB 3.61Å; I668-W673 HydrophobicContact CG2-CD2 3.72Å; I668-W673 HydrophobicContact CG2-CE3 3.63Å; I668-W673 HydrophobicContact CG2-CG 3.75Å; I668-W673 HydrophobicContact CG2-CZ3 4.49Å
669	R	70.4	Confident	63.4	Low	146 Å²	146	86.9 Å²	86.9	55%	0.551	50%	0.495	S	S	*	.	H	α-helix	trans	-57	-43.6	175	-171	171.6	66.3	-131.1	3.2	112.3	S664 I665 P666 T671 G672	S664-R669 PolarHBondContact O-NH1 2.88Å; I665-R669 PolarHBondContact O-N 3.19Å; P666-R669 PolarHBondContact O-N 2.97Å; R669-T671 VanDerWaalsContact C-N 3.31Å; R669-T671 PolarHBondContact O-N 3.2Å; R669-G672 PolarHBondContact O-N 3.29Å
670	E	69.1	Low	62.5	Low	110 Å²	110	89.1 Å²	89.1	51%	0.514	50%	0.501	S	S	.	.	H	α-helix	trans	-67.4	-25.3	177.5	-74	-173.5	-138.4	0	0	113.7	K645 Y647 P666 I668 G672	K645-E670 VanDerWaalsContact NZ-CD 3.27Å; K645-E670 IonicContact NZ-OE1 3.74Å; K645-E670 PolarHBondContact NZ-OE1 2.93Å; K645-E670 VanDerWaalsContact NZ-OE1 3.1Å; K645-E670 IonicContact NZ-OE2 2.84Å; K645-E670 PolarHBondContact NZ-OE2 3.09Å; Y647-E670 WeakPolarHBondContact CE1-OE1 3.42Å; Y647-E670 PolarHBondContact OH-OE2 2.92Å; P666-E670 WeakPolarHBondContact O-CB 3.38Å; P666-E670 WeakPolarHBondContact O-CG 3.5Å; P666-E670 PolarHBondContact O-N 2.75Å; I668-E670 VanDerWaalsContact C-N 3.33Å; I668-E670 PolarHBondContact O-N 3.43Å; E670-G672 PolarHBondContact O-N 2.62Å
671	T	67.4	Low	60.9	Low	84 Å²	84	91.6 Å²	91.6	52%	0.515	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-1.3	173.6	61.6	0	0	0	0	114	G667 I668 R669 W673	G667-T671 VanDerWaalsContact O-CG2 3.27Å; G667-T671 WeakPolarHBondContact O-CG2 3.34Å; I668-T671 PolarHBondContact O-N 2.77Å; I668-T671 VanDerWaalsContact O-N 3.11Å; I668-T671 PolarHBondContact O-OG1 3.2Å; R669-T671 VanDerWaalsContact C-N 3.31Å; R669-T671 PolarHBondContact O-N 3.2Å; T671-W673 PolarHBondContact O-N 3.5Å
672	G	62.8	Low	59.6	Low	58 Å²	58	96.2 Å²	96.2	60%	0.598	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	16.3	-173.5	0	0	0	0	0	113.4	R669 E670 K674	R669-G672 PolarHBondContact O-N 3.29Å; E670-G672 PolarHBondContact O-N 2.62Å; G672-K674 PolarHBondContact O-N 3.05Å
673	W	61.2	Low	58.7	Low	104 Å²	104	94.9 Å²	94.9	39%	0.394	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-62.3	117.9	177.9	-175.7	93.6	0	0	0	109.9	I662 E663 I668 T671 P675	I662-W673 HydrophobicContact CB-CH2 4.03Å; I662-W673 HydrophobicContact CB-CZ3 3.95Å; I662-W673 HydrophobicContact CD1-CH2 4.42Å; I662-W673 HydrophobicContact CG2-CE3 4.12Å; I662-W673 HydrophobicContact CG2-CH2 3.58Å; I662-W673 HydrophobicContact CG2-CZ2 4.23Å; I662-W673 HydrophobicContact CG2-CZ3 3.53Å; E663-W673 HydrophobicContact CG-CZ3 4.17Å; I668-W673 HydrophobicContact CG2-CB 3.61Å; I668-W673 HydrophobicContact CG2-CD2 3.72Å; I668-W673 HydrophobicContact CG2-CE3 3.63Å; I668-W673 HydrophobicContact CG2-CG 3.75Å; I668-W673 HydrophobicContact CG2-CZ3 4.49Å; T671-W673 PolarHBondContact O-N 3.5Å; W673-P675 HydrophobicContact CH2-CB 3.87Å; W673-P675 HydrophobicContact CZ3-CB 4.03Å
674	K	56.1	Low	58.6	Low	178 Å²	178	94.8 Å²	94.8	77%	0.774	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-99.8	144.8	163.2	-63.6	-179.5	-179.4	-179	0	107.1	G672 A676	G672-K674 PolarHBondContact O-N 3.05Å; K674-A676 PolarHBondContact O-N 3.29Å
675	P	54.8	Low	58.8	Low	75 Å²	75	97 Å²	97	49%	0.487	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-53.2	131.3	174	22.5	-33.6	0	0	0	109.5	E663 W673 G677	E663-P675 WeakPolarHBondContact OE1-CG 3.5Å; W673-P675 HydrophobicContact CH2-CB 3.87Å; W673-P675 HydrophobicContact CZ3-CB 4.03Å; P675-G677 VanDerWaalsContact C-N 3.28Å; P675-G677 PolarHBondContact O-N 3Å
676	A	45.9	Very low	58.9	Low	90 Å²	90	98.7 Å²	98.7	74%	0.744	55%	0.547	S	S	*	.			trans	-68.8	84.2	-171.1	0	0	0	0	0	111.2	K674 K678	K674-A676 PolarHBondContact O-N 3.29Å; A676-K678 PolarHBondContact O-N 3.27Å
677	G	43.5	Very low	59.4	Low	68 Å²	68	101.1 Å²	101.1	70%	0.701	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-54	120.5	174.3	0	0	0	0	0	109.8	P675	P675-G677 VanDerWaalsContact C-N 3.28Å; P675-G677 PolarHBondContact O-N 3Å
678	K	41.1	Very low	60.1	Low	183 Å²	183	101.9 Å²	101.9	80%	0.796	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-59.6	141.8	172.7	-62.6	-159.1	171.9	-150.5	0	108.5	A676	A676-K678 PolarHBondContact O-N 3.27Å
679	G	39.9	Very low	60.9	Low	70 Å²	70	102.3 Å²	102.3	72%	0.722	56%	0.555	S	S	*	*	S	Bend	trans	-57	145.4	-155.1	0	0	0	0	0	115.5	E681	G679-E681 PolarHBondContact O-N 2.78Å
680	K	47.5	Very low	61.9	Low	216 Å²	216	98 Å²	98	94%	0.939	55%	0.547	S	S	*	.	S	Bend	trans	28.4	74.9	165.7	-72.9	-170.6	173.1	-175	0	116.1
681	E	40.3	Very low	62.9	Low	93 Å²	93	94.4 Å²	94.4	44%	0.435	53%	0.532	S	S	.	.			trans	-149	69.4	152.9	-131.8	-175.8	-160.7	0	0	112.1	G679 K683 R745	G679-E681 PolarHBondContact O-N 2.78Å; E681-K683 HydrophobicContact CG-CD 4.15Å; E681-K683 HydrophobicContact CG-CG 4.18Å; E681-K683 PolarHBondContact O-N 2.98Å; E681-K683 WeakPolarHBondContact OE1-CE 3.36Å; E681-K683 IonicContact OE1-NZ 2.63Å; E681-K683 PolarHBondContact OE1-NZ 3.12Å; E681-K683 IonicContact OE2-NZ 3.16Å; E681-R745 IonicContact OE2-NH1 3.47Å; E681-R745 PolarHBondContact OE2-NH1 2.88Å
682	L	42.5	Very low	64.2	Low	179 Å²	179	90.4 Å²	90.4	94%	0.937	51%	0.508	S	S	*	.			trans	-74.7	68.4	156.4	-83.9	168.6	0	0	0	108.8
683	K	52.3	Low	65.7	Low	59 Å²	59	93.4 Å²	93.4	26%	0.257	50%	0.504	S	S	.	.			trans	-67.1	126.1	147.7	-77.9	168.4	173.2	158.6	0	105.4	E681 G788	E681-K683 HydrophobicContact CG-CD 4.15Å; E681-K683 HydrophobicContact CG-CG 4.18Å; E681-K683 PolarHBondContact O-N 2.98Å; E681-K683 WeakPolarHBondContact OE1-CE 3.36Å; E681-K683 IonicContact OE1-NZ 2.63Å; E681-K683 PolarHBondContact OE1-NZ 3.12Å; E681-K683 IonicContact OE2-NZ 3.16Å; K683-G788 PolarHBondContact NZ-O 2.79Å
684	D	70.2	Confident	67.3	Low	80 Å²	80	92 Å²	92	43%	0.428	51%	0.507	S	S	.	.			trans	-51.4	139	-178.7	146	47.9	0	0	0	110.5	D686 Q687 L688	D684-D686 PolarHBondContact O-N 3.14Å; D684-D686 VanDerWaalsContact O-N 3.12Å; D684-D686 PolarHBondContact OD1-N 3.05Å; D684-Q687 HydrophobicContact CB-CB 3.95Å; D684-Q687 CarbonylContact O-C 3.55Å; D684-Q687 WeakPolarHBondContact O-CA 3.48Å; D684-Q687 WeakPolarHBondContact O-CB 3.32Å; D684-Q687 PolarHBondContact O-N 2.96Å; D684-Q687 PolarHBondContact OD2-N 3.33Å; D684-L688 PolarHBondContact O-N 3.25Å
685	P	74.6	Confident	69.1	Low	91 Å²	91	83.7 Å²	83.7	59%	0.591	47%	0.471	S	S	*	.	H	α-helix	trans	-49.1	-33.4	175.9	-30.5	36.8	0	0	0	115	Y689	P685-Y689 WeakPolarHBondContact O-CB 3.38Å; P685-Y689 PolarHBondContact O-N 3.06Å
686	D	80.2	Confident	71.1	Confident	81 Å²	81	80.5 Å²	80.5	43%	0.433	45%	0.45	S	S	.	.	H	α-helix	trans	-78.8	-33.9	174.4	-81.5	-50.7	0	0	0	113.2	D684 Y689 S690 R740	D684-D686 PolarHBondContact O-N 3.14Å; D684-D686 VanDerWaalsContact O-N 3.12Å; D684-D686 PolarHBondContact OD1-N 3.05Å; D686-Y689 PolarHBondContact O-N 3.01Å; D686-S690 WeakPolarHBondContact O-CB 3.37Å; D686-S690 PolarHBondContact O-N 2.69Å; D686-S690 PolarHBondContact O-OG 3.4Å; D686-R740 IonicContact OD1-CZ 3.56Å; D686-R740 IonicContact OD1-NH1 3.56Å; D686-R740 PolarHBondContact OD1-NH1 3.47Å; D686-R740 IonicContact OD1-NH2 2.66Å; D686-R740 PolarHBondContact OD1-NH2 3.38Å
687	Q	82.6	Confident	73.4	Confident	97 Å²	97	80.7 Å²	80.7	45%	0.453	44%	0.436	S	S	.	.	H	α-helix	trans	-62.4	-39.9	166.4	-167.2	-178.3	46.3	0	0	112.8	D684 S690 T691	D684-Q687 HydrophobicContact CB-CB 3.95Å; D684-Q687 CarbonylContact O-C 3.55Å; D684-Q687 WeakPolarHBondContact O-CA 3.48Å; D684-Q687 WeakPolarHBondContact O-CB 3.32Å; D684-Q687 PolarHBondContact O-N 2.96Å; D684-Q687 PolarHBondContact OD2-N 3.33Å; Q687-S690 WeakPolarHBondContact CA-OG 3.41Å; Q687-S690 PolarHBondContact O-OG 2.92Å; Q687-T691 WeakPolarHBondContact O-CB 3.18Å; Q687-T691 PolarHBondContact O-N 3.38Å; Q687-T691 PolarHBondContact O-OG1 3.12Å
688	L	85.7	Confident	75.9	Confident	28 Å²	28	81.5 Å²	81.5	15%	0.147	42%	0.421	C	S	.	.	H	α-helix	trans	-66.4	-46.9	173.9	177.9	61.9	0	0	0	110.8	D684 S690 T691 L692 L789	D684-L688 PolarHBondContact O-N 3.25Å; L688-S690 PolarHBondContact O-N 3.38Å; L688-T691 PolarHBondContact O-N 2.95Å; L688-L692 HydrophobicContact CD1-CD1 4.07Å; L688-L692 HydrophobicContact CD1-CG 4.03Å; L688-L692 HydrophobicContact CG-CD1 4.13Å; L688-L692 HydrophobicContact CG-CG 4.43Å; L688-L692 WeakPolarHBondContact O-CG 3.32Å; L688-L692 PolarHBondContact O-N 3.02Å; L688-L789 HydrophobicContact CD1-CD2 4.44Å
689	Y	90.6	Very high	78.5	Confident	59 Å²	59	72.8 Å²	72.8	23%	0.231	38%	0.383	C	S	.	.	H	α-helix	trans	-59.3	-46.7	177.8	170	-109.4	0	0	0	112.3	P685 D686 L692 K693 L737	P685-Y689 WeakPolarHBondContact O-CB 3.38Å; P685-Y689 PolarHBondContact O-N 3.06Å; D686-Y689 PolarHBondContact O-N 3.01Å; Y689-L692 PolarHBondContact O-N 3.03Å; Y689-K693 VanDerWaalsContact O-CB 3.29Å; Y689-K693 WeakPolarHBondContact O-CB 3.3Å; Y689-K693 PolarHBondContact O-N 2.69Å; Y689-L737 HydrophobicContact CD2-CD1 3.75Å; Y689-L737 HydrophobicContact CD2-CG 4.12Å; Y689-L737 HydrophobicContact CE2-CD1 4.05Å; Y689-L737 HydrophobicContact CE2-CG 3.88Å; Y689-L737 WeakPolarHBondContact CE2-O 3.12Å
690	S	90.8	Very high	81.2	Confident	55 Å²	55	71.9 Å²	71.9	39%	0.385	36%	0.359	S	S	.	.	H	α-helix	trans	-64	-41	176.1	54.4	0	0	0	0	112.3	D686 Q687 L688 K693 T694	D686-S690 WeakPolarHBondContact O-CB 3.37Å; D686-S690 PolarHBondContact O-N 2.69Å; D686-S690 PolarHBondContact O-OG 3.4Å; Q687-S690 WeakPolarHBondContact CA-OG 3.41Å; Q687-S690 PolarHBondContact O-OG 2.92Å; L688-S690 PolarHBondContact O-N 3.38Å; S690-K693 WeakPolarHBondContact O-CB 3.44Å; S690-K693 PolarHBondContact O-N 3.1Å; S690-T694 PolarHBondContact O-N 2.9Å; S690-T694 PolarHBondContact O-OG1 3.5Å
691	T	91.5	Very high	83.5	Confident	35 Å²	35	67 Å²	67	22%	0.215	34%	0.343	C	S	.	.	H	α-helix	trans	-60.3	-48.5	174.6	-57.4	0	0	0	0	111.8	Q687 L688 K693 T694 I695 A787 L789	Q687-T691 WeakPolarHBondContact O-CB 3.18Å; Q687-T691 PolarHBondContact O-N 3.38Å; Q687-T691 PolarHBondContact O-OG1 3.12Å; L688-T691 PolarHBondContact O-N 2.95Å; T691-K693 VanDerWaalsContact C-N 3.33Å; T691-K693 PolarHBondContact O-N 3.04Å; T691-T694 PolarHBondContact O-N 3.16Å; T691-I695 HydrophobicContact CG2-CD1 4.09Å; T691-I695 WeakPolarHBondContact O-CG1 3.34Å; T691-I695 PolarHBondContact O-N 3.49Å; T691-A787 HydrophobicContact CG2-CB 3.87Å; T691-L789 HydrophobicContact CG2-CD1 3.85Å
692	L	93.4	Very high	86.1	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-66.2	-34.3	178.3	-66.5	-179.2	0	0	0	112.2	L688 Y689 I695 L696 L737 F748 L789	L688-L692 HydrophobicContact CD1-CD1 4.07Å; L688-L692 HydrophobicContact CD1-CG 4.03Å; L688-L692 HydrophobicContact CG-CD1 4.13Å; L688-L692 HydrophobicContact CG-CG 4.43Å; L688-L692 WeakPolarHBondContact O-CG 3.32Å; L688-L692 PolarHBondContact O-N 3.02Å; Y689-L692 PolarHBondContact O-N 3.03Å; L692-I695 PolarHBondContact O-N 2.69Å; L692-L696 WeakPolarHBondContact O-CB 3.36Å; L692-L696 PolarHBondContact O-N 3Å; L692-L737 HydrophobicContact CB-CD1 3.94Å; L692-F748 HydrophobicContact CB-CD2 4.28Å; L692-F748 HydrophobicContact CB-CE2 4.37Å; L692-F748 HydrophobicContact CD1-CB 4.1Å; L692-F748 HydrophobicContact CD1-CD2 4.32Å; L692-F748 HydrophobicContact CD1-CG 4.32Å; L692-F748 HydrophobicContact CD2-CB 4.06Å; L692-F748 HydrophobicContact CD2-CD1 3.91Å; L692-F748 HydrophobicContact CD2-CD2 4.27Å; L692-F748 HydrophobicContact CD2-CE1 4.43Å; L692-F748 HydrophobicContact CD2-CG 3.82Å; L692-F748 HydrophobicContact CG-CG 4.49Å; L692-L789 HydrophobicContact CD2-CD1 4.12Å
693	K	94.5	Very high	88.6	Confident	121 Å²	121	63.5 Å²	63.5	53%	0.526	32%	0.322	S	S	.	.	H	α-helix	trans	-62.6	-45.5	173.7	-174.1	-174.9	176	-169.5	0	111.8	Y689 S690 T691 L696 Q697 L737	Y689-K693 VanDerWaalsContact O-CB 3.29Å; Y689-K693 WeakPolarHBondContact O-CB 3.3Å; Y689-K693 PolarHBondContact O-N 2.69Å; S690-K693 WeakPolarHBondContact O-CB 3.44Å; S690-K693 PolarHBondContact O-N 3.1Å; T691-K693 VanDerWaalsContact C-N 3.33Å; T691-K693 PolarHBondContact O-N 3.04Å; K693-L696 PolarHBondContact O-N 2.91Å; K693-Q697 WeakPolarHBondContact O-CB 3.24Å; K693-Q697 PolarHBondContact O-N 3.44Å; K693-L737 HydrophobicContact CB-CD2 3.94Å; K693-L737 HydrophobicContact CG-CD2 4.48Å
694	T	94.7	Very high	90.6	Very high	73 Å²	73	61.9 Å²	61.9	45%	0.448	32%	0.316	S	S	.	.	H	α-helix	trans	-63.5	-44.5	176.1	-62.8	0	0	0	0	111.7	S690 T691 Q697 H698	S690-T694 PolarHBondContact O-N 2.9Å; S690-T694 PolarHBondContact O-OG1 3.5Å; T691-T694 PolarHBondContact O-N 3.16Å; T694-Q697 PolarHBondContact O-N 3.41Å; T694-H698 VanDerWaalsContact CG2-CE1 3.41Å; T694-H698 WeakPolarHBondContact CG2-CE1 3.36Å; T694-H698 PolarHBondContact O-N 3.3Å; T694-H698 PolarHBondContact O-ND1 3.01Å
695	I	95.3	Very high	91.8	Very high	5 Å²	5	58.1 Å²	58.1	3%	0.026	30%	0.296	C	S	.	.	H	α-helix	trans	-61.8	-45.8	175.7	-66.1	166.8	0	0	0	111	T691 L692 Q697 H698 V699 F748 F780 I784 A787 L789	T691-I695 HydrophobicContact CG2-CD1 4.09Å; T691-I695 WeakPolarHBondContact O-CG1 3.34Å; T691-I695 PolarHBondContact O-N 3.49Å; L692-I695 PolarHBondContact O-N 2.69Å; I695-Q697 VanDerWaalsContact C-N 3.33Å; I695-Q697 PolarHBondContact O-N 3.16Å; I695-H698 PolarHBondContact O-N 3.38Å; I695-V699 WeakPolarHBondContact O-CG2 3.41Å; I695-V699 PolarHBondContact O-N 3.3Å; I695-F748 HydrophobicContact CG2-CE1 4.06Å; I695-F748 HydrophobicContact CG2-CZ 4.46Å; I695-F780 HydrophobicContact CG2-CD2 3.98Å; I695-F780 HydrophobicContact CG2-CE2 3.97Å; I695-I784 HydrophobicContact CD1-CG1 4.43Å; I695-A787 HydrophobicContact CD1-CB 3.83Å; I695-L789 HydrophobicContact CD1-CD1 3.88Å
696	L	95.7	Very high	92.8	Very high	7 Å²	7	60.6 Å²	60.6	4%	0.037	29%	0.294	C	S	.	.	H	α-helix	trans	-62.5	-40	178.9	-172	59.4	0	0	0	111.9	L692 K693 V699 K700 L730 M733 L737 F748 M752	L692-L696 WeakPolarHBondContact O-CB 3.36Å; L692-L696 PolarHBondContact O-N 3Å; K693-L696 PolarHBondContact O-N 2.91Å; L696-V699 PolarHBondContact O-N 3.48Å; L696-K700 HydrophobicContact CD1-CD 4.42Å; L696-K700 HydrophobicContact CG-CD 4.14Å; L696-K700 WeakPolarHBondContact O-CB 3.39Å; L696-K700 VanDerWaalsContact O-CG 3.32Å; L696-K700 WeakPolarHBondContact O-CG 3.29Å; L696-K700 PolarHBondContact O-N 2.88Å; L696-L730 HydrophobicContact CD1-CD2 3.93Å; L696-M733 HydrophobicContact CD1-CB 4.19Å; L696-M733 HydrophobicContact CD2-CB 4.43Å; L696-L737 HydrophobicContact CB-CD2 4.41Å; L696-L737 HydrophobicContact CD2-CB 4.44Å; L696-L737 HydrophobicContact CD2-CD2 3.91Å; L696-F748 HydrophobicContact CB-CE2 4.07Å; L696-F748 HydrophobicContact CB-CZ 3.84Å; L696-F748 HydrophobicContact CD1-CE2 4.3Å; L696-F748 HydrophobicContact CD1-CZ 4.06Å; L696-F748 HydrophobicContact CD2-CE2 4.4Å; L696-F748 HydrophobicContact CG-CE2 4.49Å; L696-F748 HydrophobicContact CG-CZ 4.43Å; L696-M752 HydrophobicContact CD1-CE 3.96Å
697	Q	95.4	Very high	93.4	Very high	95 Å²	95	57.9 Å²	57.9	44%	0.444	28%	0.281	S	S	.	.	H	α-helix	trans	-66.4	-41.7	176.8	-166	64.9	53.8	0	0	111.9	K693 T694 I695 V699 K700 N701	K693-Q697 WeakPolarHBondContact O-CB 3.24Å; K693-Q697 PolarHBondContact O-N 3.44Å; T694-Q697 PolarHBondContact O-N 3.41Å; I695-Q697 VanDerWaalsContact C-N 3.33Å; I695-Q697 PolarHBondContact O-N 3.16Å; Q697-V699 VanDerWaalsContact C-N 3.35Å; Q697-V699 PolarHBondContact O-N 2.85Å; Q697-K700 PolarHBondContact O-N 2.9Å; Q697-N701 PolarHBondContact NE2-OD1 3Å; Q697-N701 WeakPolarHBondContact O-CB 3.38Å; Q697-N701 VanDerWaalsContact O-CG 3.23Å; Q697-N701 PolarHBondContact O-N 2.92Å; Q697-N701 PolarHBondContact O-OD1 3.16Å
698	H	95.6	Very high	94.1	Very high	85 Å²	85	53.8 Å²	53.8	39%	0.394	26%	0.262	S	S	.	.	H	α-helix	trans	-61.1	-41.9	174	-68.5	152.3	0	0	0	112.2	T694 I695 N701 H702 F779	T694-H698 VanDerWaalsContact CG2-CE1 3.41Å; T694-H698 WeakPolarHBondContact CG2-CE1 3.36Å; T694-H698 PolarHBondContact O-N 3.3Å; T694-H698 PolarHBondContact O-ND1 3.01Å; I695-H698 PolarHBondContact O-N 3.38Å; H698-N701 PolarHBondContact O-N 3.32Å; H698-H702 PolarHBondContact O-N 3.18Å; H698-F779 HydrophobicContact CB-CE1 4.19Å; H698-F779 HydrophobicContact CB-CZ 4.3Å; H698-F779 WeakPolarHBondContact O-CE1 3.49Å
699	V	95.9	Very high	94.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.7	-44.5	175.9	171.2	0	0	0	0	111	I695 L696 Q697 N701 H702 A705 L730 M752 L776 F779 F780	I695-V699 WeakPolarHBondContact O-CG2 3.41Å; I695-V699 PolarHBondContact O-N 3.3Å; L696-V699 PolarHBondContact O-N 3.48Å; Q697-V699 VanDerWaalsContact C-N 3.35Å; Q697-V699 PolarHBondContact O-N 2.85Å; V699-N701 VanDerWaalsContact C-N 3.33Å; V699-N701 PolarHBondContact O-N 3.15Å; V699-H702 WeakPolarHBondContact O-CB 3.5Å; V699-H702 PolarHBondContact O-N 3.33Å; V699-A705 WeakPolarHBondContact O-CB 3.41Å; V699-L730 HydrophobicContact CG1-CD1 4.09Å; V699-L730 HydrophobicContact CG1-CD2 3.8Å; V699-M752 HydrophobicContact CB-CE 4.34Å; V699-M752 HydrophobicContact CG1-CE 4.01Å; V699-M752 HydrophobicContact CG1-SD 4.01Å; V699-M752 HydrophobicContact CG2-CE 4.23Å; V699-L776 HydrophobicContact CG1-CD1 4.02Å; V699-L776 HydrophobicContact CG1-CD2 4.04Å; V699-L776 HydrophobicContact CG1-CG 4.07Å; V699-F779 HydrophobicContact CG2-CD1 4.49Å; V699-F780 HydrophobicContact CG2-CB 4.21Å; V699-F780 HydrophobicContact CG2-CD2 4.19Å
700	K	96	Very high	94.6	Very high	50 Å²	50	57.6 Å²	57.6	22%	0.217	28%	0.282	C	S	.	.	H	α-helix	trans	-68	-27.5	178.4	-71.4	177.7	74.2	177.6	0	114.2	L696 Q697 H702 M709 L730 S734	L696-K700 HydrophobicContact CD1-CD 4.42Å; L696-K700 HydrophobicContact CG-CD 4.14Å; L696-K700 WeakPolarHBondContact O-CB 3.39Å; L696-K700 VanDerWaalsContact O-CG 3.32Å; L696-K700 WeakPolarHBondContact O-CG 3.29Å; L696-K700 PolarHBondContact O-N 2.88Å; Q697-K700 PolarHBondContact O-N 2.9Å; K700-H702 VanDerWaalsContact C-N 3.34Å; K700-M709 HydrophobicContact CB-CE 4.32Å; K700-M709 HydrophobicContact CB-SD 4.01Å; K700-M709 HydrophobicContact CG-SD 4.04Å; K700-L730 HydrophobicContact CD-CB 4.21Å; K700-L730 HydrophobicContact CG-CB 3.88Å; K700-L730 HydrophobicContact CG-CD1 3.93Å; K700-L730 HydrophobicContact CG-CG 4.36Å; K700-S734 PolarHBondContact NZ-OG 2.88Å
701	N	95.2	Very high	94.8	Very high	114 Å²	114	57.7 Å²	57.7	61%	0.61	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-6	177.2	-71.1	13.4	0	0	0	113.2	Q697 H698 V699	Q697-N701 PolarHBondContact NE2-OD1 3Å; Q697-N701 WeakPolarHBondContact O-CB 3.38Å; Q697-N701 VanDerWaalsContact O-CG 3.23Å; Q697-N701 PolarHBondContact O-N 2.92Å; Q697-N701 PolarHBondContact O-OD1 3.16Å; H698-N701 PolarHBondContact O-N 3.32Å; V699-N701 VanDerWaalsContact C-N 3.33Å; V699-N701 PolarHBondContact O-N 3.15Å
702	H	96.4	Very high	94.8	Very high	37 Å²	37	58 Å²	58	17%	0.171	28%	0.282	C	S	.	.	S	Bend	trans	-74.6	134.8	-179.5	-174.4	-86.3	0	0	0	110.8	H698 V699 K700 N704 A705 L776 F779	H698-H702 PolarHBondContact O-N 3.18Å; V699-H702 WeakPolarHBondContact O-CB 3.5Å; V699-H702 PolarHBondContact O-N 3.33Å; K700-H702 VanDerWaalsContact C-N 3.34Å; H702-N704 PolarHBondContact ND1-N 3.02Å; H702-N704 PolarHBondContact O-N 3.46Å; H702-A705 WeakPolarHBondContact O-CB 3.4Å; H702-A705 PolarHBondContact O-N 2.98Å; H702-L776 HydrophobicContact CB-CD1 3.59Å; H702-F779 HydrophobicContact CB-CD1 4.32Å; H702-F779 HydrophobicContact CB-CE1 4.23Å; H702-F779 AromaticContact CD2-CD1 3.85Å; H702-F779 AromaticContact CD2-CD2 3.69Å; H702-F779 AromaticContact CD2-CE2 3.96Å; H702-F779 AromaticContact CD2-CG 3.63Å
703	Q	94.3	Very high	94.6	Very high	161 Å²	161	62.5 Å²	62.5	75%	0.752	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-49.3	-36.6	-175.7	52.2	171.9	91.8	0	0	114.6	A705	Q703-A705 VanDerWaalsContact C-N 3.31Å; Q703-A705 PolarHBondContact O-N 3.31Å
704	N	94.8	Very high	94.1	Very high	26 Å²	26	64.3 Å²	64.3	14%	0.139	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-90.3	15.8	-178.5	-57.9	-9.4	0	0	0	113.7	H702 C772 I775	H702-N704 PolarHBondContact ND1-N 3.02Å; H702-N704 PolarHBondContact O-N 3.46Å; N704-C772 HydrophobicContact CB-CB 4.08Å; N704-I775 VanDerWaalsContact ND2-CD1 3.31Å; N704-I775 WeakPolarHBondContact ND2-CD1 3.27Å; N704-I775 WeakPolarHBondContact ND2-CG2 3.41Å
705	A	95.5	Very high	93.6	Very high	1 Å²	1	66.8 Å²	66.8	1%	0.008	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-85.3	-15.9	178.7	0	0	0	0	0	114.2	V699 H702 Q703 P707 F708 M709 L730 L776	V699-A705 WeakPolarHBondContact O-CB 3.41Å; H702-A705 WeakPolarHBondContact O-CB 3.4Å; H702-A705 PolarHBondContact O-N 2.98Å; Q703-A705 VanDerWaalsContact C-N 3.31Å; Q703-A705 PolarHBondContact O-N 3.31Å; A705-P707 VanDerWaalsContact C-N 3.32Å; A705-P707 WeakPolarHBondContact O-CD 3.49Å; A705-P707 VanDerWaalsContact O-N 3.11Å; A705-F708 PolarHBondContact O-N 2.67Å; A705-M709 HydrophobicContact CB-SD 4.47Å; A705-M709 WeakPolarHBondContact O-CG 3.44Å; A705-M709 PolarHBondContact O-N 3.37Å; A705-L730 HydrophobicContact CB-CD1 4.21Å; A705-L776 HydrophobicContact CB-CD1 4.42Å; A705-L776 HydrophobicContact CB-CD2 3.95Å
706	W	93.9	Very high	93	Very high	142 Å²	142	72.4 Å²	72.4	54%	0.538	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-48.7	-37.7	-174.4	69.1	-96.4	0	0	0	115.7	F708 Y769	W706-F708 PolarHBondContact O-N 3.49Å; W706-Y769 HydrophobicContact CH2-CD1 4.23Å; W706-Y769 AromaticContact CH2-CE1 3.48Å; W706-Y769 HydrophobicContact CH2-CE1 3.48Å; W706-Y769 VanDerWaalsContact CH2-CE1 3.48Å; W706-Y769 AromaticContact CH2-CZ 3.86Å; W706-Y769 HydrophobicContact CZ2-CE1 4.45Å; W706-Y769 AromaticContact CZ3-CE1 3.7Å; W706-Y769 HydrophobicContact CZ3-CE1 3.7Å
707	P	93.8	Very high	92.5	Very high	24 Å²	24	72.4 Å²	72.4	16%	0.156	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-73.1	-13.1	-179.5	-11.7	27.7	0	0	0	114.2	A705 Y769 C772	A705-P707 VanDerWaalsContact C-N 3.32Å; A705-P707 WeakPolarHBondContact O-CD 3.49Å; A705-P707 VanDerWaalsContact O-N 3.11Å; P707-Y769 HydrophobicContact CB-CD1 3.68Å; P707-Y769 HydrophobicContact CB-CE1 3.94Å; P707-Y769 HydrophobicContact CG-CD1 4Å; P707-Y769 HydrophobicContact CG-CE1 4.33Å; P707-C772 HydrophobicContact CG-CB 4.11Å
708	F	96.8	Very high	92.1	Very high	12 Å²	12	72.8 Å²	72.8	5%	0.053	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-113.1	4.1	-171.3	-44.7	-60	0	0	0	112.2	A705 W706 E710 L730 I755 C759 C772 A773 L776	A705-F708 PolarHBondContact O-N 2.67Å; W706-F708 PolarHBondContact O-N 3.49Å; F708-E710 VanDerWaalsContact C-N 3.34Å; F708-E710 PolarHBondContact O-N 2.87Å; F708-L730 HydrophobicContact CB-CD1 3.94Å; F708-L730 HydrophobicContact CB-CG 4.09Å; F708-L730 VanDerWaalsContact O-CB 3.26Å; F708-L730 WeakPolarHBondContact O-CB 3.33Å; F708-L730 VanDerWaalsContact O-CG 3.29Å; F708-L730 WeakPolarHBondContact O-CG 3.4Å; F708-L730 PolarHBondContact O-N 2.84Å; F708-I755 HydrophobicContact CB-CG2 3.72Å; F708-I755 HydrophobicContact CD1-CG2 3.37Å; F708-I755 HydrophobicContact CD2-CG2 4.43Å; F708-I755 HydrophobicContact CE1-CG2 4.13Å; F708-I755 HydrophobicContact CG-CG2 3.56Å; F708-C759 HydrophobicContact CE1-CB 3.87Å; F708-C759 HydrophobicContact CZ-CB 4.43Å; F708-C772 HydrophobicContact CE2-CB 4.04Å; F708-C772 HydrophobicContact CZ-CB 4.22Å; F708-A773 HydrophobicContact CZ-CB 3.89Å; F708-L776 HydrophobicContact CD2-CD2 3.58Å; F708-L776 HydrophobicContact CE2-CD2 4.01Å
709	M	94.1	Very high	91.7	Very high	71 Å²	71	70.3 Å²	70.3	35%	0.35	36%	0.36	S	S	.	.	S	Bend	trans	-71	-26.8	-173.8	-72.8	-66.5	-87.8	0	0	113.7	K700 A705 L730 K731	K700-M709 HydrophobicContact CB-CE 4.32Å; K700-M709 HydrophobicContact CB-SD 4.01Å; K700-M709 HydrophobicContact CG-SD 4.04Å; A705-M709 HydrophobicContact CB-SD 4.47Å; A705-M709 WeakPolarHBondContact O-CG 3.44Å; A705-M709 PolarHBondContact O-N 3.37Å; M709-L730 HydrophobicContact SD-CD1 4.18Å; M709-K731 VanDerWaalsContact O-CB 3.27Å; M709-K731 WeakPolarHBondContact O-CB 3.47Å; M709-K731 PolarHBondContact O-N 2.84Å
710	E	93.7	Very high	91.5	Very high	96 Å²	96	71 Å²	71	45%	0.449	36%	0.363	S	S	.	.	S	Bend	trans	-140.1	164.7	180	-64.9	-144.1	122.7	0	0	111.3	F708 V712 K731	F708-E710 VanDerWaalsContact C-N 3.34Å; F708-E710 PolarHBondContact O-N 2.87Å; E710-V712 PolarHBondContact O-N 2.94Å; E710-K731 HydrophobicContact CG-CD 4.07Å; E710-K731 VanDerWaalsContact OE1-CD 3.3Å; E710-K731 WeakPolarHBondContact OE1-CD 3.44Å; E710-K731 WeakPolarHBondContact OE1-CE 3.12Å; E710-K731 IonicContact OE1-NZ 3.38Å; E710-K731 PolarHBondContact OE1-NZ 3.14Å
711	P	93.4	Very high	91.2	Very high	57 Å²	57	73.2 Å²	73.2	37%	0.37	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-59	133.5	171.9	-20.9	30.4	0	0	0	112.6	K713 D729	P711-K713 PolarHBondContact O-N 3.29Å; P711-D729 WeakPolarHBondContact CG-OD2 3.4Å
712	V	91.8	Very high	90.9	Very high	40 Å²	40	76.1 Å²	76.1	24%	0.242	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-58.7	122.5	-179.1	179.9	0	0	0	0	111.4	E710 A717 Y720 Y721	E710-V712 PolarHBondContact O-N 2.94Å; V712-A717 HydrophobicContact CG1-CB 3.44Å; V712-A717 VanDerWaalsContact CG1-CB 3.44Å; V712-Y720 HydrophobicContact CB-CD1 4.11Å; V712-Y720 HydrophobicContact CB-CE1 3.98Å; V712-Y720 HydrophobicContact CB-CG 4.47Å; V712-Y720 HydrophobicContact CG1-CD1 4.12Å; V712-Y720 HydrophobicContact CG1-CD2 4.13Å; V712-Y720 HydrophobicContact CG1-CE1 4.38Å; V712-Y720 HydrophobicContact CG1-CE2 4.38Å; V712-Y720 HydrophobicContact CG1-CG 4Å; V712-Y720 HydrophobicContact CG2-CE1 4.07Å; V712-Y720 HydrophobicContact CG2-CE2 4.2Å; V712-Y721 VanDerWaalsContact O-CE2 3.31Å; V712-Y721 WeakPolarHBondContact O-CE2 3.24Å; V712-Y721 PolarHBondContact O-OH 2.99Å
713	K	89.2	Confident	90.5	Very high	95 Å²	95	77.6 Å²	77.6	41%	0.413	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-77.8	141.3	-178.6	-52.2	-172.9	-153.9	75.9	0	111.4	P711 T715 E716 A717	P711-K713 PolarHBondContact O-N 3.29Å; K713-T715 PolarHBondContact O-N 3.35Å; K713-T715 VanDerWaalsContact O-N 3.13Å; K713-E716 HydrophobicContact CB-CB 4.31Å; K713-E716 HydrophobicContact CB-CG 4.15Å; K713-E716 WeakPolarHBondContact CB-OE2 3.27Å; K713-E716 WeakPolarHBondContact CD-OE1 3.26Å; K713-E716 VanDerWaalsContact CG-OE2 3.26Å; K713-E716 WeakPolarHBondContact CG-OE2 3.43Å; K713-E716 IonicContact NZ-OE1 2.73Å; K713-E716 PolarHBondContact NZ-OE1 3.16Å; K713-E716 IonicContact NZ-OE2 2.77Å; K713-E716 PolarHBondContact NZ-OE2 2.92Å; K713-E716 PolarHBondContact O-N 3.16Å; K713-A717 PolarHBondContact O-N 3.16Å; K713-A717 VanDerWaalsContact O-N 3.1Å
714	K	83.7	Confident	90.4	Very high	159 Å²	159	70 Å²	70	69%	0.691	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-24.7	177.2	-66.7	-176.6	179.8	-179.5	0	113.8	Y721	K714-Y721 HydrophobicContact CG-CD2 3.76Å; K714-Y721 HydrophobicContact CG-CE2 3.77Å
715	T	85.6	Confident	90.1	Very high	125 Å²	125	79 Å²	79	77%	0.767	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-22.5	175.6	48.3	0	0	0	0	113.4	K713	K713-T715 PolarHBondContact O-N 3.35Å; K713-T715 VanDerWaalsContact O-N 3.13Å
716	E	82	Confident	89.8	Confident	123 Å²	123	86 Å²	86	58%	0.575	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-24.7	-176.1	-69.1	163.4	179.3	0	0	111.6	K713	K713-E716 HydrophobicContact CB-CB 4.31Å; K713-E716 HydrophobicContact CB-CG 4.15Å; K713-E716 WeakPolarHBondContact CB-OE2 3.27Å; K713-E716 WeakPolarHBondContact CD-OE1 3.26Å; K713-E716 VanDerWaalsContact CG-OE2 3.26Å; K713-E716 WeakPolarHBondContact CG-OE2 3.43Å; K713-E716 IonicContact NZ-OE1 2.73Å; K713-E716 PolarHBondContact NZ-OE1 3.16Å; K713-E716 IonicContact NZ-OE2 2.77Å; K713-E716 PolarHBondContact NZ-OE2 2.92Å; K713-E716 PolarHBondContact O-N 3.16Å
717	A	84.7	Confident	89.7	Confident	8 Å²	8	81.9 Å²	81.9	7%	0.066	41%	0.411	C	S	.	.	S	Bend	trans	-135.8	89.4	178.1	0	0	0	0	0	111.7	V712 K713 G719 Y720 Y762	V712-A717 HydrophobicContact CG1-CB 3.44Å; V712-A717 VanDerWaalsContact CG1-CB 3.44Å; K713-A717 PolarHBondContact O-N 3.16Å; K713-A717 VanDerWaalsContact O-N 3.1Å; A717-G719 PolarHBondContact O-N 3.43Å; A717-Y720 HydrophobicContact CB-CD2 4.18Å; A717-Y720 HydrophobicContact CB-CG 4.18Å; A717-Y720 VanDerWaalsContact O-CB 3.31Å; A717-Y720 WeakPolarHBondContact O-CB 3.5Å; A717-Y720 PolarHBondContact O-N 3.47Å; A717-Y762 WeakPolarHBondContact CA-OH 3.34Å; A717-Y762 HydrophobicContact CB-CE1 3.95Å
718	P	88.7	Confident	89.8	Confident	102 Å²	102	81.4 Å²	81.4	66%	0.662	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	127.6	179.4	-25.5	35.5	0	0	0	112.6	Y720 Y762	P718-Y720 PolarHBondContact O-N 3.4Å; P718-Y762 PolarHBondContact O-OH 3.22Å
719	G	87.2	Confident	89.8	Confident	33 Å²	33	81.1 Å²	81.1	34%	0.34	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	-1.5	179.7	0	0	0	0	0	115.7	A717 Y721 Q722 V723	A717-G719 PolarHBondContact O-N 3.43Å; G719-Y721 VanDerWaalsContact C-N 3.28Å; G719-Y721 PolarHBondContact O-N 2.85Å; G719-Y721 VanDerWaalsContact O-N 3.12Å; G719-Q722 WeakPolarHBondContact O-CA 3.38Å; G719-Q722 WeakPolarHBondContact O-CB 3.37Å; G719-Q722 PolarHBondContact O-N 3.45Å; G719-V723 PolarHBondContact O-N 3.44Å
720	Y	90.8	Very high	89.9	Confident	15 Å²	15	77.8 Å²	77.8	6%	0.059	39%	0.389	C	S	.	.	H	α-helix	trans	-47.8	-46.7	-177.6	-176.5	-94.3	0	0	0	113.9	V712 A717 P718 Q722 V723 I724 P727 Y762	V712-Y720 HydrophobicContact CB-CD1 4.11Å; V712-Y720 HydrophobicContact CB-CE1 3.98Å; V712-Y720 HydrophobicContact CB-CG 4.47Å; V712-Y720 HydrophobicContact CG1-CD1 4.12Å; V712-Y720 HydrophobicContact CG1-CD2 4.13Å; V712-Y720 HydrophobicContact CG1-CE1 4.38Å; V712-Y720 HydrophobicContact CG1-CE2 4.38Å; V712-Y720 HydrophobicContact CG1-CG 4Å; V712-Y720 HydrophobicContact CG2-CE1 4.07Å; V712-Y720 HydrophobicContact CG2-CE2 4.2Å; A717-Y720 HydrophobicContact CB-CD2 4.18Å; A717-Y720 HydrophobicContact CB-CG 4.18Å; A717-Y720 VanDerWaalsContact O-CB 3.31Å; A717-Y720 WeakPolarHBondContact O-CB 3.5Å; A717-Y720 PolarHBondContact O-N 3.47Å; P718-Y720 PolarHBondContact O-N 3.4Å; Y720-Q722 VanDerWaalsContact C-N 3.25Å; Y720-Q722 PolarHBondContact O-N 3.29Å; Y720-V723 PolarHBondContact O-N 3.32Å; Y720-I724 HydrophobicContact CD1-CB 4.34Å; Y720-I724 HydrophobicContact CD2-CG1 4.11Å; Y720-I724 HydrophobicContact CE1-CB 3.97Å; Y720-I724 HydrophobicContact CE1-CG1 4.19Å; Y720-I724 HydrophobicContact CE1-CG2 4.06Å; Y720-I724 HydrophobicContact CE2-CB 4.42Å; Y720-I724 HydrophobicContact CE2-CG1 3.73Å; Y720-I724 HydrophobicContact CG-CG1 4.49Å; Y720-I724 WeakPolarHBondContact O-CB 3.23Å; Y720-I724 PolarHBondContact O-N 3.12Å; Y720-P727 HydrophobicContact CE1-CB 4.37Å; Y720-Y762 AromaticContact CD2-CD1 3.73Å; Y720-Y762 HydrophobicContact CD2-CD1 3.73Å; Y720-Y762 AromaticContact CD2-CD2 3.65Å; Y720-Y762 HydrophobicContact CD2-CD2 3.65Å; Y720-Y762 HydrophobicContact CD2-CE1 4.06Å; Y720-Y762 AromaticContact CD2-CE2 3.97Å; Y720-Y762 HydrophobicContact CD2-CE2 3.97Å; Y720-Y762 AromaticContact CD2-CG 3.53Å; Y720-Y762 HydrophobicContact CD2-CG 3.53Å; Y720-Y762 HydrophobicContact CE2-CD1 4.18Å; Y720-Y762 HydrophobicContact CE2-CD2 4.44Å; Y720-Y762 AromaticContact CE2-CG 3.96Å; Y720-Y762 HydrophobicContact CE2-CG 3.96Å; Y720-Y762 HydrophobicContact CG-CD2 4.39Å; Y720-Y762 HydrophobicContact CG-CE2 4.45Å
721	Y	89.6	Confident	90	Very high	97 Å²	97	77 Å²	77	38%	0.38	39%	0.385	S	S	.	.	H	α-helix	trans	-76.4	-3.6	-179.4	-68.7	-90.9	0	0	0	114.9	V712 K714 G719 P727	V712-Y721 VanDerWaalsContact O-CE2 3.31Å; V712-Y721 WeakPolarHBondContact O-CE2 3.24Å; V712-Y721 PolarHBondContact O-OH 2.99Å; K714-Y721 HydrophobicContact CG-CD2 3.76Å; K714-Y721 HydrophobicContact CG-CE2 3.77Å; G719-Y721 VanDerWaalsContact C-N 3.28Å; G719-Y721 PolarHBondContact O-N 2.85Å; G719-Y721 VanDerWaalsContact O-N 3.12Å; Y721-P727 HydrophobicContact CD1-CG 4.32Å; Y721-P727 HydrophobicContact CE1-CB 4.18Å; Y721-P727 HydrophobicContact CE1-CG 3.92Å
722	Q	88.9	Confident	90	Very high	175 Å²	175	76 Å²	76	82%	0.818	38%	0.378	S	S	*	.	H	α-helix	trans	-91.4	-33.2	170.9	-60	174.1	-10.9	0	0	110.8	G719 Y720	G719-Q722 WeakPolarHBondContact O-CA 3.38Å; G719-Q722 WeakPolarHBondContact O-CB 3.37Å; G719-Q722 PolarHBondContact O-N 3.45Å; Y720-Q722 VanDerWaalsContact C-N 3.25Å; Y720-Q722 PolarHBondContact O-N 3.29Å
723	V	87.6	Confident	90.2	Very high	67 Å²	67	74.1 Å²	74.1	41%	0.406	37%	0.366	S	S	.	.	H	α-helix	trans	-81.7	-57.2	174.9	-174.6	0	0	0	0	110.4	G719 Y720 R725 E761 Y762	G719-V723 PolarHBondContact O-N 3.44Å; Y720-V723 PolarHBondContact O-N 3.32Å; V723-R725 PolarHBondContact O-N 2.97Å; V723-E761 HydrophobicContact CG1-CG 4.41Å; V723-Y762 HydrophobicContact CB-CD2 4.45Å; V723-Y762 HydrophobicContact CG2-CD2 4.47Å
724	I	92.8	Very high	90.5	Very high	2 Å²	2	70.5 Å²	70.5	1%	0.01	35%	0.353	C	S	.	.			trans	-86.3	101.8	-172	-57.2	-53.9	0	0	0	111	Y720 F726 N758 E761	Y720-I724 HydrophobicContact CD1-CB 4.34Å; Y720-I724 HydrophobicContact CD2-CG1 4.11Å; Y720-I724 HydrophobicContact CE1-CB 3.97Å; Y720-I724 HydrophobicContact CE1-CG1 4.19Å; Y720-I724 HydrophobicContact CE1-CG2 4.06Å; Y720-I724 HydrophobicContact CE2-CB 4.42Å; Y720-I724 HydrophobicContact CE2-CG1 3.73Å; Y720-I724 HydrophobicContact CG-CG1 4.49Å; Y720-I724 WeakPolarHBondContact O-CB 3.23Å; Y720-I724 PolarHBondContact O-N 3.12Å; I724-F726 VanDerWaalsContact C-N 3.33Å; I724-F726 PolarHBondContact O-N 3.36Å; I724-N758 HydrophobicContact CD1-CB 4.19Å; I724-N758 WeakPolarHBondContact CD1-O 3.33Å; I724-N758 HydrophobicContact CG1-CB 4.46Å; I724-N758 HydrophobicContact CG2-CB 3.85Å; I724-N758 VanDerWaalsContact CG2-CG 3.46Å; I724-N758 VanDerWaalsContact CG2-ND2 3.35Å; I724-N758 WeakPolarHBondContact CG2-ND2 3.47Å; I724-E761 HydrophobicContact CD1-CB 3.82Å; I724-E761 HydrophobicContact CD1-CG 3.79Å
725	R	87.8	Confident	91	Very high	216 Å²	216	67.9 Å²	67.9	82%	0.815	34%	0.343	S	S	*	.	S	Bend	trans	-68.9	-26.3	-176.9	-57.9	-179.6	-174.3	-175.6	1	114.4	V723	V723-R725 PolarHBondContact O-N 2.97Å
726	F	89.2	Confident	91.3	Very high	147 Å²	147	65.4 Å²	65.4	65%	0.645	32%	0.32	S	S	*	.	S	Bend	trans	-136.6	73.3	-172.5	-63.1	-64.9	0	0	0	110.9	I724 R754 N758	I724-F726 VanDerWaalsContact C-N 3.33Å; I724-F726 PolarHBondContact O-N 3.36Å; F726-R754 WeakPolarHBondContact O-CD 3.36Å; F726-N758 PolarHBondContact O-ND2 2.62Å
727	P	91.6	Very high	91.8	Very high	56 Å²	56	60 Å²	60	36%	0.364	29%	0.294	S	S	.	.			trans	-56.5	147	177.8	25.2	-35.9	0	0	0	112	Y720 Y721	Y720-P727 HydrophobicContact CE1-CB 4.37Å; Y721-P727 HydrophobicContact CD1-CG 4.32Å; Y721-P727 HydrophobicContact CE1-CB 4.18Å; Y721-P727 HydrophobicContact CE1-CG 3.92Å
728	M	96.8	Very high	92.1	Very high	13 Å²	13	67 Å²	67	6%	0.064	32%	0.323	C	S	.	.			trans	-156.4	147.3	178.5	-170.9	49.7	52.6	0	0	110	T732 M733 D751 R754 I755	M728-T732 HydrophobicContact CE-CG2 3.9Å; M728-T732 HydrophobicContact SD-CG2 3.74Å; M728-M733 HydrophobicContact CG-CG 4.34Å; M728-M733 HydrophobicContact SD-CG 3.83Å; M728-D751 HydrophobicContact CG-CB 4.1Å; M728-D751 WeakPolarHBondContact CG-O 3.27Å; M728-D751 HydrophobicContact SD-CB 4.16Å; M728-R754 HydrophobicContact CB-CB 4.35Å; M728-R754 HydrophobicContact CB-CG 4.5Å; M728-I755 HydrophobicContact CB-CG1 4.07Å; M728-I755 HydrophobicContact CG-CD1 4.38Å; M728-I755 HydrophobicContact CG-CG1 3.79Å
729	D	96.7	Very high	92.1	Very high	7 Å²	7	66.1 Å²	66.1	4%	0.037	32%	0.32	C	S	.	.			trans	-158.5	166.4	-173.8	66.3	89.5	0	0	0	110.9	P711 K731 T732 M733	P711-D729 WeakPolarHBondContact CG-OD2 3.4Å; D729-K731 VanDerWaalsContact C-N 3.31Å; D729-K731 PolarHBondContact O-N 3.22Å; D729-K731 WeakPolarHBondContact OD1-CA 3.36Å; D729-K731 VanDerWaalsContact OD1-CB 3.28Å; D729-K731 WeakPolarHBondContact OD1-CB 3.32Å; D729-K731 PolarHBondContact OD1-N 2.68Å; D729-T732 PolarHBondContact O-N 3.05Å; D729-T732 PolarHBondContact OD1-N 3.21Å; D729-T732 PolarHBondContact OD1-OG1 3.47Å; D729-T732 WeakPolarHBondContact OD2-CB 3.36Å; D729-T732 PolarHBondContact OD2-OG1 3.04Å; D729-M733 WeakPolarHBondContact O-CG 3.3Å; D729-M733 PolarHBondContact O-N 3.34Å
730	L	96.6	Very high	92.1	Very high	1 Å²	1	70.1 Å²	70.1	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-73.7	-16.8	-173.6	-60.6	171.5	0	0	0	113.8	L696 V699 K700 A705 F708 M709 S734 M752 I755	L696-L730 HydrophobicContact CD1-CD2 3.93Å; V699-L730 HydrophobicContact CG1-CD1 4.09Å; V699-L730 HydrophobicContact CG1-CD2 3.8Å; K700-L730 HydrophobicContact CD-CB 4.21Å; K700-L730 HydrophobicContact CG-CB 3.88Å; K700-L730 HydrophobicContact CG-CD1 3.93Å; K700-L730 HydrophobicContact CG-CG 4.36Å; A705-L730 HydrophobicContact CB-CD1 4.21Å; F708-L730 HydrophobicContact CB-CD1 3.94Å; F708-L730 HydrophobicContact CB-CG 4.09Å; F708-L730 VanDerWaalsContact O-CB 3.26Å; F708-L730 WeakPolarHBondContact O-CB 3.33Å; F708-L730 VanDerWaalsContact O-CG 3.29Å; F708-L730 WeakPolarHBondContact O-CG 3.4Å; F708-L730 PolarHBondContact O-N 2.84Å; M709-L730 HydrophobicContact SD-CD1 4.18Å; L730-S734 WeakPolarHBondContact O-CB 3.37Å; L730-S734 PolarHBondContact O-N 3.34Å; L730-S734 PolarHBondContact O-OG 2.69Å; L730-M752 HydrophobicContact CD2-CE 3.91Å; L730-M752 HydrophobicContact CD2-SD 3.89Å; L730-I755 HydrophobicContact CD2-CD1 3.69Å; L730-I755 HydrophobicContact CG-CD1 4.05Å
731	K	94.9	Very high	91.9	Very high	80 Å²	80	74.5 Å²	74.5	35%	0.348	34%	0.342	S	S	.	.	H	α-helix	trans	-80.2	-47.9	172.7	171.5	179.2	-177.5	-180	0	110.2	M709 E710 D729 M733 S734 E735	M709-K731 VanDerWaalsContact O-CB 3.27Å; M709-K731 WeakPolarHBondContact O-CB 3.47Å; M709-K731 PolarHBondContact O-N 2.84Å; E710-K731 HydrophobicContact CG-CD 4.07Å; E710-K731 VanDerWaalsContact OE1-CD 3.3Å; E710-K731 WeakPolarHBondContact OE1-CD 3.44Å; E710-K731 WeakPolarHBondContact OE1-CE 3.12Å; E710-K731 IonicContact OE1-NZ 3.38Å; E710-K731 PolarHBondContact OE1-NZ 3.14Å; D729-K731 VanDerWaalsContact C-N 3.31Å; D729-K731 PolarHBondContact O-N 3.22Å; D729-K731 WeakPolarHBondContact OD1-CA 3.36Å; D729-K731 VanDerWaalsContact OD1-CB 3.28Å; D729-K731 WeakPolarHBondContact OD1-CB 3.32Å; D729-K731 PolarHBondContact OD1-N 2.68Å; K731-M733 VanDerWaalsContact C-N 3.29Å; K731-M733 PolarHBondContact O-N 3.38Å; K731-S734 WeakPolarHBondContact O-CA 3.26Å; K731-S734 VanDerWaalsContact O-CB 3.27Å; K731-S734 WeakPolarHBondContact O-CB 3.41Å; K731-S734 PolarHBondContact O-N 2.92Å; K731-E735 WeakPolarHBondContact CG-OE1 3.38Å; K731-E735 PolarHBondContact O-N 3.35Å
732	T	93.9	Very high	91.8	Very high	36 Å²	36	70.3 Å²	70.3	22%	0.221	33%	0.325	C	S	.	.	H	α-helix	trans	-55.4	-42.7	168.9	-62.1	0	0	0	0	111.4	M728 D729 E735 R736	M728-T732 HydrophobicContact CE-CG2 3.9Å; M728-T732 HydrophobicContact SD-CG2 3.74Å; D729-T732 PolarHBondContact O-N 3.05Å; D729-T732 PolarHBondContact OD1-N 3.21Å; D729-T732 PolarHBondContact OD1-OG1 3.47Å; D729-T732 WeakPolarHBondContact OD2-CB 3.36Å; D729-T732 PolarHBondContact OD2-OG1 3.04Å; T732-E735 PolarHBondContact O-N 3.22Å; T732-R736 WeakPolarHBondContact O-CB 3.46Å; T732-R736 WeakPolarHBondContact O-CG 3.5Å; T732-R736 PolarHBondContact O-N 3.41Å
733	M	96.5	Very high	91.6	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-65.7	-34.4	172.4	-70.5	-163.1	71.1	0	0	113.2	L696 M728 D729 K731 E735 L737 Y742 F748 D751 M752 I755	L696-M733 HydrophobicContact CD1-CB 4.19Å; L696-M733 HydrophobicContact CD2-CB 4.43Å; M728-M733 HydrophobicContact CG-CG 4.34Å; M728-M733 HydrophobicContact SD-CG 3.83Å; D729-M733 WeakPolarHBondContact O-CG 3.3Å; D729-M733 PolarHBondContact O-N 3.34Å; K731-M733 VanDerWaalsContact C-N 3.29Å; K731-M733 PolarHBondContact O-N 3.38Å; M733-E735 VanDerWaalsContact C-N 3.34Å; M733-L737 VanDerWaalsContact O-CB 3.3Å; M733-L737 WeakPolarHBondContact O-CB 3.39Å; M733-L737 PolarHBondContact O-N 2.86Å; M733-Y742 HydrophobicContact CE-CE2 4.34Å; M733-F748 HydrophobicContact CE-CD1 4.23Å; M733-F748 HydrophobicContact CE-CD2 3.62Å; M733-F748 HydrophobicContact CE-CE1 4.22Å; M733-F748 HydrophobicContact CE-CE2 3.62Å; M733-F748 HydrophobicContact CE-CG 3.94Å; M733-F748 HydrophobicContact CE-CZ 3.93Å; M733-F748 WeakPolarHBondContact CE-O 3.44Å; M733-D751 HydrophobicContact CE-CB 3.86Å; M733-D751 HydrophobicContact CG-CB 4.15Å; M733-D751 HydrophobicContact SD-CB 3.99Å; M733-M752 HydrophobicContact CE-CB 4.1Å; M733-M752 HydrophobicContact CE-CE 3.99Å; M733-M752 HydrophobicContact SD-CB 4.13Å; M733-M752 HydrophobicContact SD-CE 3.87Å; M733-M752 HydrophobicContact SD-SD 4.2Å; M733-I755 HydrophobicContact CG-CD1 4.43Å; M733-I755 HydrophobicContact SD-CD1 3.78Å
734	S	95.5	Very high	91.3	Very high	19 Å²	19	66.8 Å²	66.8	13%	0.133	32%	0.316	C	S	.	.	H	α-helix	trans	-65	-38.7	175	-60.5	0	0	0	0	111.8	K700 L730 K731 K738	K700-S734 PolarHBondContact NZ-OG 2.88Å; L730-S734 WeakPolarHBondContact O-CB 3.37Å; L730-S734 PolarHBondContact O-N 3.34Å; L730-S734 PolarHBondContact O-OG 2.69Å; K731-S734 WeakPolarHBondContact O-CA 3.26Å; K731-S734 VanDerWaalsContact O-CB 3.27Å; K731-S734 WeakPolarHBondContact O-CB 3.41Å; K731-S734 PolarHBondContact O-N 2.92Å; S734-K738 WeakPolarHBondContact O-CG 3.46Å; S734-K738 PolarHBondContact O-N 2.95Å; S734-K738 VanDerWaalsContact O-N 3.12Å
735	E	93.1	Very high	90.8	Very high	104 Å²	104	69.7 Å²	69.7	49%	0.486	33%	0.327	S	S	.	.	H	α-helix	trans	-72.8	-45.8	179.1	-70.6	164.7	-162.1	0	0	111.6	K731 T732 M733 L737 K738 S739	K731-E735 WeakPolarHBondContact CG-OE1 3.38Å; K731-E735 PolarHBondContact O-N 3.35Å; T732-E735 PolarHBondContact O-N 3.22Å; M733-E735 VanDerWaalsContact C-N 3.34Å; E735-L737 VanDerWaalsContact C-N 3.27Å; E735-L737 PolarHBondContact O-N 3.42Å; E735-K738 WeakPolarHBondContact O-CB 3.38Å; E735-K738 PolarHBondContact O-N 3.46Å; E735-S739 PolarHBondContact O-N 2.89Å; E735-S739 PolarHBondContact O-OG 3.34Å
736	R	92.9	Very high	90.7	Very high	73 Å²	73	65.5 Å²	65.5	28%	0.275	32%	0.315	S	S	.	.	H	α-helix	trans	-57.9	-37.9	171.8	-75	176.7	177.6	-151	-5.4	112.7	T732 S739 R740 Y741 Y742 D751	T732-R736 WeakPolarHBondContact O-CB 3.46Å; T732-R736 WeakPolarHBondContact O-CG 3.5Å; T732-R736 PolarHBondContact O-N 3.41Å; R736-S739 WeakPolarHBondContact CA-OG 3.49Å; R736-S739 PolarHBondContact O-OG 3.3Å; R736-R740 PolarHBondContact O-N 2.98Å; R736-Y741 HydrophobicContact CB-CD1 3.99Å; R736-Y741 HydrophobicContact CB-CG 4.33Å; R736-Y741 HydrophobicContact CG-CD1 4.12Å; R736-Y741 HydrophobicContact CG-CG 4.41Å; R736-Y741 VanDerWaalsContact O-CB 3.24Å; R736-Y741 WeakPolarHBondContact O-CB 3.35Å; R736-Y741 PolarHBondContact O-N 3.31Å; R736-Y742 HydrophobicContact CB-CD2 4.36Å; R736-Y742 HydrophobicContact CB-CE2 3.54Å; R736-Y742 WeakPolarHBondContact CB-OH 3.35Å; R736-Y742 VanDerWaalsContact CD-OH 3.3Å; R736-Y742 WeakPolarHBondContact CD-OH 3.37Å; R736-D751 WeakPolarHBondContact CD-OD2 3.16Å; R736-D751 IonicContact CZ-OD2 2.65Å; R736-D751 IonicContact NE-OD2 2.61Å; R736-D751 VanDerWaalsContact NH1-CG 3.35Å; R736-D751 IonicContact NH1-OD1 2.63Å; R736-D751 PolarHBondContact NH1-OD1 3.08Å; R736-D751 IonicContact NH1-OD2 2.84Å; R736-D751 PolarHBondContact NH1-OD2 3.38Å
737	L	91.4	Very high	90.6	Very high	9 Å²	9	61.4 Å²	61.4	5%	0.047	30%	0.299	C	S	.	.	H	α-helix	trans	-66.7	-47.4	175.7	-175.7	62.4	0	0	0	111.3	Y689 L692 K693 L696 M733 E735 S739 R740 Y742	Y689-L737 HydrophobicContact CD2-CD1 3.75Å; Y689-L737 HydrophobicContact CD2-CG 4.12Å; Y689-L737 HydrophobicContact CE2-CD1 4.05Å; Y689-L737 HydrophobicContact CE2-CG 3.88Å; Y689-L737 WeakPolarHBondContact CE2-O 3.12Å; L692-L737 HydrophobicContact CB-CD1 3.94Å; K693-L737 HydrophobicContact CB-CD2 3.94Å; K693-L737 HydrophobicContact CG-CD2 4.48Å; L696-L737 HydrophobicContact CB-CD2 4.41Å; L696-L737 HydrophobicContact CD2-CB 4.44Å; L696-L737 HydrophobicContact CD2-CD2 3.91Å; M733-L737 VanDerWaalsContact O-CB 3.3Å; M733-L737 WeakPolarHBondContact O-CB 3.39Å; M733-L737 PolarHBondContact O-N 2.86Å; E735-L737 VanDerWaalsContact C-N 3.27Å; E735-L737 PolarHBondContact O-N 3.42Å; L737-S739 VanDerWaalsContact C-N 3.29Å; L737-S739 PolarHBondContact O-N 3Å; L737-R740 PolarHBondContact O-N 3.43Å; L737-Y742 HydrophobicContact CB-CD2 3.86Å; L737-Y742 HydrophobicContact CB-CE2 4.1Å; L737-Y742 HydrophobicContact CD1-CD2 3.93Å; L737-Y742 HydrophobicContact CG-CD2 4.49Å
738	K	90.8	Very high	90.6	Very high	154 Å²	154	58.8 Å²	58.8	67%	0.67	28%	0.282	S	S	*	.	H	α-helix	trans	-56.5	-40.6	175.8	-74.3	173.2	-179.8	-178.5	0	112.4	S734 E735 R740	S734-K738 WeakPolarHBondContact O-CG 3.46Å; S734-K738 PolarHBondContact O-N 2.95Å; S734-K738 VanDerWaalsContact O-N 3.12Å; E735-K738 WeakPolarHBondContact O-CB 3.38Å; E735-K738 PolarHBondContact O-N 3.46Å; K738-R740 PolarHBondContact O-N 3.35Å
739	S	89.1	Confident	90.4	Very high	85 Å²	85	59.9 Å²	59.9	59%	0.594	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	11.3	178	65.2	0	0	0	0	114.7	E735 R736 L737 Y741	E735-S739 PolarHBondContact O-N 2.89Å; E735-S739 PolarHBondContact O-OG 3.34Å; R736-S739 WeakPolarHBondContact CA-OG 3.49Å; R736-S739 PolarHBondContact O-OG 3.3Å; L737-S739 VanDerWaalsContact C-N 3.29Å; L737-S739 PolarHBondContact O-N 3Å; S739-Y741 PolarHBondContact O-N 3.43Å; S739-Y741 VanDerWaalsContact O-N 3.14Å
740	R	87.9	Confident	90.2	Very high	117 Å²	117	61.8 Å²	61.8	44%	0.442	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	18.5	-179.9	-55.8	-65	-165.7	134.8	4.6	114.8	D686 R736 L737 K738 Y742	D686-R740 IonicContact OD1-CZ 3.56Å; D686-R740 IonicContact OD1-NH1 3.56Å; D686-R740 PolarHBondContact OD1-NH1 3.47Å; D686-R740 IonicContact OD1-NH2 2.66Å; D686-R740 PolarHBondContact OD1-NH2 3.38Å; R736-R740 PolarHBondContact O-N 2.98Å; L737-R740 PolarHBondContact O-N 3.43Å; K738-R740 PolarHBondContact O-N 3.35Å; R740-Y742 PolarHBondContact O-N 2.97Å
741	Y	86.7	Confident	90	Very high	107 Å²	107	61.9 Å²	61.9	42%	0.42	31%	0.305	S	S	.	.			trans	-58	-32.9	178.6	175.4	-100.2	0	0	0	113.1	R736 S739 T743	R736-Y741 HydrophobicContact CB-CD1 3.99Å; R736-Y741 HydrophobicContact CB-CG 4.33Å; R736-Y741 HydrophobicContact CG-CD1 4.12Å; R736-Y741 HydrophobicContact CG-CG 4.41Å; R736-Y741 VanDerWaalsContact O-CB 3.24Å; R736-Y741 WeakPolarHBondContact O-CB 3.35Å; R736-Y741 PolarHBondContact O-N 3.31Å; S739-Y741 PolarHBondContact O-N 3.43Å; S739-Y741 VanDerWaalsContact O-N 3.14Å; Y741-T743 PolarHBondContact O-N 3.15Å
742	Y	88.1	Confident	90	Very high	9 Å²	9	58.1 Å²	58.1	4%	0.035	29%	0.288	C	S	.	.			trans	-80.6	60.9	179.6	-60	-55.4	0	0	0	113.4	M733 R736 L737 R740 T744 L747 F748 D751	M733-Y742 HydrophobicContact CE-CE2 4.34Å; R736-Y742 HydrophobicContact CB-CD2 4.36Å; R736-Y742 HydrophobicContact CB-CE2 3.54Å; R736-Y742 WeakPolarHBondContact CB-OH 3.35Å; R736-Y742 VanDerWaalsContact CD-OH 3.3Å; R736-Y742 WeakPolarHBondContact CD-OH 3.37Å; L737-Y742 HydrophobicContact CB-CD2 3.86Å; L737-Y742 HydrophobicContact CB-CE2 4.1Å; L737-Y742 HydrophobicContact CD1-CD2 3.93Å; L737-Y742 HydrophobicContact CG-CD2 4.49Å; R740-Y742 PolarHBondContact O-N 2.97Å; Y742-T744 PolarHBondContact O-N 3.23Å; Y742-T744 VanDerWaalsContact O-N 3.16Å; Y742-L747 HydrophobicContact CD1-CB 3.76Å; Y742-L747 HydrophobicContact CE1-CB 4.38Å; Y742-F748 HydrophobicContact CD1-CB 3.93Å; Y742-F748 HydrophobicContact CD1-CD2 4.45Å; Y742-F748 VanDerWaalsContact CD1-N 3.33Å; Y742-F748 AromaticContact CD2-CD2 3.71Å; Y742-F748 HydrophobicContact CD2-CD2 3.71Å; Y742-F748 HydrophobicContact CD2-CE2 4.5Å; Y742-F748 HydrophobicContact CE1-CB 4.39Å; Y742-F748 AromaticContact CE2-CD2 3.89Å; Y742-F748 HydrophobicContact CE2-CD2 3.89Å; Y742-F748 HydrophobicContact CE2-CE2 4.48Å; Y742-F748 HydrophobicContact CG-CB 4.04Å; Y742-F748 HydrophobicContact CG-CD2 4.02Å; Y742-D751 HydrophobicContact CE1-CB 4.27Å; Y742-D751 VanDerWaalsContact CE1-OD2 3.26Å; Y742-D751 WeakPolarHBondContact CE1-OD2 3.34Å; Y742-D751 PolarHBondContact OH-OD2 3.11Å
743	T	83.3	Confident	90.1	Very high	102 Å²	102	60.5 Å²	60.5	63%	0.626	30%	0.297	S	S	*	.			trans	-63.1	-14.7	175.2	58.6	0	0	0	0	114	Y741	Y741-T743 PolarHBondContact O-N 3.15Å
744	T	81	Confident	90	Very high	65 Å²	65	63.7 Å²	63.7	40%	0.399	31%	0.309	S	S	.	.	S	Bend	trans	-140.8	149.6	172.4	72.2	0	0	0	0	111.5	Y742 K746 L747	Y742-T744 PolarHBondContact O-N 3.23Å; Y742-T744 VanDerWaalsContact O-N 3.16Å; T744-K746 PolarHBondContact O-N 3.31Å; T744-L747 PolarHBondContact O-N 3.26Å; T744-L747 VanDerWaalsContact O-N 3.1Å
745	R	83.7	Confident	90.1	Very high	64 Å²	64	63 Å²	63	24%	0.242	30%	0.304	C	S	.	.	H	α-helix	trans	-53.2	-28.7	176.8	73.9	-162.9	-158.1	-160.9	10.8	113.9	E681 F748 M749 L789	E681-R745 IonicContact OE2-NH1 3.47Å; E681-R745 PolarHBondContact OE2-NH1 2.88Å; R745-F748 PolarHBondContact O-N 2.7Å; R745-M749 VanDerWaalsContact O-CG 3.3Å; R745-M749 WeakPolarHBondContact O-CG 3.49Å; R745-M749 PolarHBondContact O-N 3.18Å; R745-L789 HydrophobicContact CB-CD1 4.49Å; R745-L789 HydrophobicContact CB-CD2 4.37Å; R745-L789 WeakPolarHBondContact CD-O 3.43Å; R745-L789 PolarHBondContact NE-O 2.87Å; R745-L789 PolarHBondContact NH2-O 3.11Å
746	K	85.8	Confident	90.2	Very high	128 Å²	128	58.1 Å²	58.1	56%	0.557	28%	0.281	S	S	*	.	H	α-helix	trans	-69.5	-36.8	179.9	-65	-177.9	-179.8	179.2	0	113.9	T744 F748 M749 A750	T744-K746 PolarHBondContact O-N 3.31Å; K746-F748 VanDerWaalsContact C-N 3.31Å; K746-M749 PolarHBondContact O-N 2.74Å; K746-A750 VanDerWaalsContact O-CB 3.32Å; K746-A750 WeakPolarHBondContact O-CB 3.5Å; K746-A750 PolarHBondContact O-N 2.62Å
747	L	86.7	Confident	90.3	Very high	61 Å²	61	57.6 Å²	57.6	32%	0.319	29%	0.286	S	S	.	.	H	α-helix	trans	-65.4	-40.8	178.1	-67.3	170.5	0	0	0	110.2	Y742 T744 A750 D751	Y742-L747 HydrophobicContact CD1-CB 3.76Å; Y742-L747 HydrophobicContact CE1-CB 4.38Å; T744-L747 PolarHBondContact O-N 3.26Å; T744-L747 VanDerWaalsContact O-N 3.1Å; L747-A750 PolarHBondContact O-N 3.28Å; L747-D751 PolarHBondContact O-N 3.45Å; L747-D751 VanDerWaalsContact O-N 3.16Å
748	F	92.1	Very high	90.5	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-64.7	-46.2	174.7	-172	-88.3	0	0	0	111.8	L692 I695 L696 M733 Y742 R745 K746 A750 D751 M752 F780	L692-F748 HydrophobicContact CB-CD2 4.28Å; L692-F748 HydrophobicContact CB-CE2 4.37Å; L692-F748 HydrophobicContact CD1-CB 4.1Å; L692-F748 HydrophobicContact CD1-CD2 4.32Å; L692-F748 HydrophobicContact CD1-CG 4.32Å; L692-F748 HydrophobicContact CD2-CB 4.06Å; L692-F748 HydrophobicContact CD2-CD1 3.91Å; L692-F748 HydrophobicContact CD2-CD2 4.27Å; L692-F748 HydrophobicContact CD2-CE1 4.43Å; L692-F748 HydrophobicContact CD2-CG 3.82Å; L692-F748 HydrophobicContact CG-CG 4.49Å; I695-F748 HydrophobicContact CG2-CE1 4.06Å; I695-F748 HydrophobicContact CG2-CZ 4.46Å; L696-F748 HydrophobicContact CB-CE2 4.07Å; L696-F748 HydrophobicContact CB-CZ 3.84Å; L696-F748 HydrophobicContact CD1-CE2 4.3Å; L696-F748 HydrophobicContact CD1-CZ 4.06Å; L696-F748 HydrophobicContact CD2-CE2 4.4Å; L696-F748 HydrophobicContact CG-CE2 4.49Å; L696-F748 HydrophobicContact CG-CZ 4.43Å; M733-F748 HydrophobicContact CE-CD1 4.23Å; M733-F748 HydrophobicContact CE-CD2 3.62Å; M733-F748 HydrophobicContact CE-CE1 4.22Å; M733-F748 HydrophobicContact CE-CE2 3.62Å; M733-F748 HydrophobicContact CE-CG 3.94Å; M733-F748 HydrophobicContact CE-CZ 3.93Å; M733-F748 WeakPolarHBondContact CE-O 3.44Å; Y742-F748 HydrophobicContact CD1-CB 3.93Å; Y742-F748 HydrophobicContact CD1-CD2 4.45Å; Y742-F748 VanDerWaalsContact CD1-N 3.33Å; Y742-F748 AromaticContact CD2-CD2 3.71Å; Y742-F748 HydrophobicContact CD2-CD2 3.71Å; Y742-F748 HydrophobicContact CD2-CE2 4.5Å; Y742-F748 HydrophobicContact CE1-CB 4.39Å; Y742-F748 AromaticContact CE2-CD2 3.89Å; Y742-F748 HydrophobicContact CE2-CD2 3.89Å; Y742-F748 HydrophobicContact CE2-CE2 4.48Å; Y742-F748 HydrophobicContact CG-CB 4.04Å; Y742-F748 HydrophobicContact CG-CD2 4.02Å; R745-F748 PolarHBondContact O-N 2.7Å; K746-F748 VanDerWaalsContact C-N 3.31Å; F748-A750 VanDerWaalsContact C-N 3.35Å; F748-A750 PolarHBondContact O-N 3.43Å; F748-D751 PolarHBondContact O-N 3.21Å; F748-M752 HydrophobicContact CE1-CE 3.83Å; F748-M752 HydrophobicContact CZ-CE 3.83Å; F748-M752 WeakPolarHBondContact O-CB 3.35Å; F748-M752 PolarHBondContact O-N 3.16Å; F748-F780 HydrophobicContact CD1-CE2 4.2Å; F748-F780 HydrophobicContact CD1-CZ 4.4Å; F748-F780 AromaticContact CE1-CE2 3.83Å; F748-F780 HydrophobicContact CE1-CE2 3.83Å; F748-F780 HydrophobicContact CE1-CZ 4.43Å
749	M	92.1	Very high	90.7	Very high	37 Å²	37	50.5 Å²	50.5	18%	0.182	26%	0.255	C	S	.	.	H	α-helix	trans	-58.8	-42.9	174.6	-71.9	174.6	73.1	0	0	112.8	R745 K746 M752 Q753 F780 Y781 I784 I790	R745-M749 VanDerWaalsContact O-CG 3.3Å; R745-M749 WeakPolarHBondContact O-CG 3.49Å; R745-M749 PolarHBondContact O-N 3.18Å; K746-M749 PolarHBondContact O-N 2.74Å; M749-M752 PolarHBondContact O-N 3.27Å; M749-Q753 VanDerWaalsContact O-CB 3.26Å; M749-Q753 WeakPolarHBondContact O-CB 3.37Å; M749-Q753 PolarHBondContact O-N 3.35Å; M749-F780 HydrophobicContact CG-CZ 4.07Å; M749-Y781 HydrophobicContact CE-CE1 4.24Å; M749-I784 HydrophobicContact CE-CD1 4.47Å; M749-I784 HydrophobicContact CG-CD1 3.38Å; M749-I784 HydrophobicContact SD-CD1 3.72Å; M749-I790 HydrophobicContact CE-CD1 3.64Å; M749-I790 HydrophobicContact CE-CG1 4.21Å; M749-I790 HydrophobicContact SD-CD1 4.49Å
750	A	92	Very high	91	Very high	46 Å²	46	49.1 Å²	49.1	38%	0.38	24%	0.237	S	C	.	.	H	α-helix	trans	-68.6	-35.1	-177.3	0	0	0	0	0	113	K746 L747 F748 R754	K746-A750 VanDerWaalsContact O-CB 3.32Å; K746-A750 WeakPolarHBondContact O-CB 3.5Å; K746-A750 PolarHBondContact O-N 2.62Å; L747-A750 PolarHBondContact O-N 3.28Å; F748-A750 VanDerWaalsContact C-N 3.35Å; F748-A750 PolarHBondContact O-N 3.43Å; A750-R754 WeakPolarHBondContact O-CB 3.3Å; A750-R754 PolarHBondContact O-N 3.1Å; A750-R754 PolarHBondContact O-NH2 3.35Å
751	D	93.4	Very high	91.3	Very high	4 Å²	4	49 Å²	49	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-71.8	-44.9	172.2	-78.7	-6.6	0	0	0	111.2	M728 M733 R736 Y742 L747 F748 Q753 R754 I755	M728-D751 HydrophobicContact CG-CB 4.1Å; M728-D751 WeakPolarHBondContact CG-O 3.27Å; M728-D751 HydrophobicContact SD-CB 4.16Å; M733-D751 HydrophobicContact CE-CB 3.86Å; M733-D751 HydrophobicContact CG-CB 4.15Å; M733-D751 HydrophobicContact SD-CB 3.99Å; R736-D751 WeakPolarHBondContact CD-OD2 3.16Å; R736-D751 IonicContact CZ-OD2 2.65Å; R736-D751 IonicContact NE-OD2 2.61Å; R736-D751 VanDerWaalsContact NH1-CG 3.35Å; R736-D751 IonicContact NH1-OD1 2.63Å; R736-D751 PolarHBondContact NH1-OD1 3.08Å; R736-D751 IonicContact NH1-OD2 2.84Å; R736-D751 PolarHBondContact NH1-OD2 3.38Å; Y742-D751 HydrophobicContact CE1-CB 4.27Å; Y742-D751 VanDerWaalsContact CE1-OD2 3.26Å; Y742-D751 WeakPolarHBondContact CE1-OD2 3.34Å; Y742-D751 PolarHBondContact OH-OD2 3.11Å; L747-D751 PolarHBondContact O-N 3.45Å; L747-D751 VanDerWaalsContact O-N 3.16Å; F748-D751 PolarHBondContact O-N 3.21Å; D751-Q753 PolarHBondContact O-N 2.97Å; D751-R754 WeakPolarHBondContact O-CB 3.48Å; D751-R754 PolarHBondContact O-N 2.98Å; D751-R754 VanDerWaalsContact O-N 3.12Å; D751-R754 IonicContact OD1-CZ 3.28Å; D751-R754 IonicContact OD1-NH1 3.32Å; D751-R754 PolarHBondContact OD1-NH1 2.94Å; D751-R754 IonicContact OD1-NH2 2.91Å; D751-R754 PolarHBondContact OD1-NH2 3.47Å; D751-R754 VanDerWaalsContact OD1-NH2 3.16Å; D751-I755 PolarHBondContact O-N 3.42Å
752	M	95	Very high	91.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.8	-45.9	178.2	-170.9	66	71.2	0	0	112.1	L696 V699 L730 M733 F748 M749 R754 I755 F756 F780	L696-M752 HydrophobicContact CD1-CE 3.96Å; V699-M752 HydrophobicContact CB-CE 4.34Å; V699-M752 HydrophobicContact CG1-CE 4.01Å; V699-M752 HydrophobicContact CG1-SD 4.01Å; V699-M752 HydrophobicContact CG2-CE 4.23Å; L730-M752 HydrophobicContact CD2-CE 3.91Å; L730-M752 HydrophobicContact CD2-SD 3.89Å; M733-M752 HydrophobicContact CE-CB 4.1Å; M733-M752 HydrophobicContact CE-CE 3.99Å; M733-M752 HydrophobicContact SD-CB 4.13Å; M733-M752 HydrophobicContact SD-CE 3.87Å; M733-M752 HydrophobicContact SD-SD 4.2Å; F748-M752 HydrophobicContact CE1-CE 3.83Å; F748-M752 HydrophobicContact CZ-CE 3.83Å; F748-M752 WeakPolarHBondContact O-CB 3.35Å; F748-M752 PolarHBondContact O-N 3.16Å; M749-M752 PolarHBondContact O-N 3.27Å; M752-R754 PolarHBondContact O-N 3.34Å; M752-I755 WeakPolarHBondContact O-CB 3.39Å; M752-I755 PolarHBondContact O-N 3.28Å; M752-I755 HydrophobicContact SD-CD1 4.25Å; M752-F756 HydrophobicContact CG-CE2 3.73Å; M752-F756 HydrophobicContact CG-CZ 3.92Å; M752-F756 WeakPolarHBondContact O-CD2 3.32Å; M752-F756 WeakPolarHBondContact O-CE2 3.31Å; M752-F756 HydrophobicContact SD-CE2 4.32Å; M752-F756 HydrophobicContact SD-CZ 3.91Å; M752-F780 HydrophobicContact CB-CD1 4.43Å; M752-F780 HydrophobicContact CB-CE1 3.97Å; M752-F780 HydrophobicContact CB-CE2 4.43Å; M752-F780 HydrophobicContact CB-CZ 3.97Å; M752-F780 HydrophobicContact CE-CD2 4.41Å; M752-F780 HydrophobicContact CG-CD1 3.62Å; M752-F780 HydrophobicContact CG-CD2 3.92Å; M752-F780 HydrophobicContact CG-CE1 3.65Å; M752-F780 HydrophobicContact CG-CE2 3.97Å; M752-F780 HydrophobicContact CG-CG 3.75Å; M752-F780 HydrophobicContact CG-CZ 3.82Å
753	Q	94.7	Very high	91.8	Very high	86 Å²	86	48.6 Å²	48.6	40%	0.402	24%	0.242	S	C	.	.	H	α-helix	trans	-64.1	-29.6	176.8	-169.6	174.9	17	0	0	112.1	M749 D751 F756 T757	M749-Q753 VanDerWaalsContact O-CB 3.26Å; M749-Q753 WeakPolarHBondContact O-CB 3.37Å; M749-Q753 PolarHBondContact O-N 3.35Å; D751-Q753 PolarHBondContact O-N 2.97Å; Q753-F756 PolarHBondContact O-N 2.94Å; Q753-T757 PolarHBondContact O-N 3.19Å; Q753-T757 PolarHBondContact O-OG1 3.06Å
754	R	95.7	Very high	92.1	Very high	68 Å²	68	46.4 Å²	46.4	26%	0.257	24%	0.235	S	C	.	.	H	α-helix	trans	-67.6	-35	176.3	-161.1	176.6	-47.9	102.8	11.7	112.3	F726 M728 A750 D751 M752 F756 T757 N758	F726-R754 WeakPolarHBondContact O-CD 3.36Å; M728-R754 HydrophobicContact CB-CB 4.35Å; M728-R754 HydrophobicContact CB-CG 4.5Å; A750-R754 WeakPolarHBondContact O-CB 3.3Å; A750-R754 PolarHBondContact O-N 3.1Å; A750-R754 PolarHBondContact O-NH2 3.35Å; D751-R754 WeakPolarHBondContact O-CB 3.48Å; D751-R754 PolarHBondContact O-N 2.98Å; D751-R754 VanDerWaalsContact O-N 3.12Å; D751-R754 IonicContact OD1-CZ 3.28Å; D751-R754 IonicContact OD1-NH1 3.32Å; D751-R754 PolarHBondContact OD1-NH1 2.94Å; D751-R754 IonicContact OD1-NH2 2.91Å; D751-R754 PolarHBondContact OD1-NH2 3.47Å; D751-R754 VanDerWaalsContact OD1-NH2 3.16Å; M752-R754 PolarHBondContact O-N 3.34Å; R754-F756 VanDerWaalsContact C-N 3.33Å; R754-F756 PolarHBondContact O-N 3.42Å; R754-T757 PolarHBondContact O-N 3.44Å; R754-N758 WeakPolarHBondContact CG-OD1 3.48Å; R754-N758 VanDerWaalsContact O-CB 3.23Å; R754-N758 WeakPolarHBondContact O-CB 3.23Å; R754-N758 PolarHBondContact O-N 3.12Å; R754-N758 PolarHBondContact O-OD1 2.9Å
755	I	95.9	Very high	92.5	Very high	5 Å²	5	46.7 Å²	46.7	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-54.9	-50.9	172.8	-59	179.8	0	0	0	110.1	F708 M728 L730 M733 D751 M752 C759	F708-I755 HydrophobicContact CB-CG2 3.72Å; F708-I755 HydrophobicContact CD1-CG2 3.37Å; F708-I755 HydrophobicContact CD2-CG2 4.43Å; F708-I755 HydrophobicContact CE1-CG2 4.13Å; F708-I755 HydrophobicContact CG-CG2 3.56Å; M728-I755 HydrophobicContact CB-CG1 4.07Å; M728-I755 HydrophobicContact CG-CD1 4.38Å; M728-I755 HydrophobicContact CG-CG1 3.79Å; L730-I755 HydrophobicContact CD2-CD1 3.69Å; L730-I755 HydrophobicContact CG-CD1 4.05Å; M733-I755 HydrophobicContact CG-CD1 4.43Å; M733-I755 HydrophobicContact SD-CD1 3.78Å; D751-I755 PolarHBondContact O-N 3.42Å; M752-I755 WeakPolarHBondContact O-CB 3.39Å; M752-I755 PolarHBondContact O-N 3.28Å; M752-I755 HydrophobicContact SD-CD1 4.25Å; I755-C759 WeakPolarHBondContact O-CB 3.39Å; I755-C759 PolarHBondContact O-N 3.14Å; I755-C759 VanDerWaalsContact O-N 3.1Å
756	F	95.9	Very high	92.8	Very high	1 Å²	1	50.2 Å²	50.2	0%	0.004	26%	0.257	C	S	.	.	H	α-helix	trans	-69.8	-42.1	-177.6	-48.1	-47.2	0	0	0	112.6	M752 Q753 R754 C759 R760 A773 L776 E777 F780	M752-F756 HydrophobicContact CG-CE2 3.73Å; M752-F756 HydrophobicContact CG-CZ 3.92Å; M752-F756 WeakPolarHBondContact O-CD2 3.32Å; M752-F756 WeakPolarHBondContact O-CE2 3.31Å; M752-F756 HydrophobicContact SD-CE2 4.32Å; M752-F756 HydrophobicContact SD-CZ 3.91Å; Q753-F756 PolarHBondContact O-N 2.94Å; R754-F756 VanDerWaalsContact C-N 3.33Å; R754-F756 PolarHBondContact O-N 3.42Å; F756-C759 PolarHBondContact O-N 3.45Å; F756-R760 WeakPolarHBondContact O-CG 3.38Å; F756-R760 PolarHBondContact O-N 3Å; F756-R760 VanDerWaalsContact O-N 3.08Å; F756-R760 PolarHBondContact O-NE 3.02Å; F756-A773 HydrophobicContact CB-CB 4.36Å; F756-A773 HydrophobicContact CD1-CB 4.22Å; F756-L776 HydrophobicContact CE1-CB 3.88Å; F756-L776 HydrophobicContact CE1-CD2 4.03Å; F756-L776 HydrophobicContact CE1-CG 3.94Å; F756-L776 HydrophobicContact CZ-CB 4.38Å; F756-L776 HydrophobicContact CZ-CG 4.21Å; F756-E777 HydrophobicContact CB-CB 4.4Å; F756-E777 HydrophobicContact CD1-CB 4.23Å; F756-E777 HydrophobicContact CD2-CB 3.45Å; F756-E777 VanDerWaalsContact CD2-CB 3.45Å; F756-E777 HydrophobicContact CD2-CG 3.47Å; F756-E777 VanDerWaalsContact CD2-CG 3.47Å; F756-E777 WeakPolarHBondContact CD2-OE1 3.42Å; F756-E777 HydrophobicContact CE1-CB 4.4Å; F756-E777 VanDerWaalsContact CE2-CA 3.47Å; F756-E777 HydrophobicContact CE2-CB 3.65Å; F756-E777 HydrophobicContact CE2-CG 3.83Å; F756-E777 HydrophobicContact CG-CB 3.77Å; F756-E777 HydrophobicContact CG-CG 4.15Å; F756-E777 HydrophobicContact CZ-CB 4.14Å; F756-F780 HydrophobicContact CE2-CB 4.46Å; F756-F780 HydrophobicContact CE2-CD1 4.16Å; F756-F780 HydrophobicContact CZ-CB 4.42Å
757	T	95	Very high	93.1	Very high	61 Å²	61	45.4 Å²	45.4	37%	0.374	24%	0.24	S	C	.	.	H	α-helix	trans	-65.4	-47	177.9	-61.8	0	0	0	0	111.9	Q753 R754 C759 R760 E761	Q753-T757 PolarHBondContact O-N 3.19Å; Q753-T757 PolarHBondContact O-OG1 3.06Å; R754-T757 PolarHBondContact O-N 3.44Å; T757-C759 VanDerWaalsContact C-N 3.26Å; T757-C759 PolarHBondContact O-N 3.43Å; T757-R760 PolarHBondContact O-N 2.93Å; T757-R760 VanDerWaalsContact O-N 3.11Å; T757-E761 WeakPolarHBondContact O-CB 3.35Å; T757-E761 PolarHBondContact O-N 3.4Å
758	N	95.3	Very high	93.4	Very high	8 Å²	8	47.7 Å²	47.7	4%	0.043	25%	0.249	C	C	.	.	H	α-helix	trans	-59.1	-38.4	175.8	-66.9	0.6	0	0	0	111.8	I724 F726 R754 E761 Y762	I724-N758 HydrophobicContact CD1-CB 4.19Å; I724-N758 WeakPolarHBondContact CD1-O 3.33Å; I724-N758 HydrophobicContact CG1-CB 4.46Å; I724-N758 HydrophobicContact CG2-CB 3.85Å; I724-N758 VanDerWaalsContact CG2-CG 3.46Å; I724-N758 VanDerWaalsContact CG2-ND2 3.35Å; I724-N758 WeakPolarHBondContact CG2-ND2 3.47Å; F726-N758 PolarHBondContact O-ND2 2.62Å; R754-N758 WeakPolarHBondContact CG-OD1 3.48Å; R754-N758 VanDerWaalsContact O-CB 3.23Å; R754-N758 WeakPolarHBondContact O-CB 3.23Å; R754-N758 PolarHBondContact O-N 3.12Å; R754-N758 PolarHBondContact O-OD1 2.9Å; N758-E761 PolarHBondContact O-N 2.94Å; N758-Y762 PolarHBondContact O-N 2.8Å
759	C	94.8	Very high	93.4	Very high	6 Å²	6	52.6 Å²	52.6	4%	0.041	27%	0.268	C	S	.	.	H	α-helix	trans	-62.5	-43.6	176.4	-172.6	0	0	0	0	111.6	F708 I755 F756 T757 N763 Y769 A773	F708-C759 HydrophobicContact CE1-CB 3.87Å; F708-C759 HydrophobicContact CZ-CB 4.43Å; I755-C759 WeakPolarHBondContact O-CB 3.39Å; I755-C759 PolarHBondContact O-N 3.14Å; I755-C759 VanDerWaalsContact O-N 3.1Å; F756-C759 PolarHBondContact O-N 3.45Å; T757-C759 VanDerWaalsContact C-N 3.26Å; T757-C759 PolarHBondContact O-N 3.43Å; C759-N763 WeakPolarHBondContact O-CB 3.41Å; C759-N763 PolarHBondContact O-N 2.93Å; C759-N763 PolarHBondContact O-ND2 3Å; C759-Y769 VanDerWaalsContact SG-C 3.55Å; C759-Y769 PolarHBondContact SG-O 2.92Å; C759-A773 HydrophobicContact CB-CB 3.95Å
760	R	95.4	Very high	93.5	Very high	57 Å²	57	53.6 Å²	53.6	22%	0.215	27%	0.27	C	S	.	.	H	α-helix	trans	-74.4	-25	178.8	-68.5	-175.3	-77.1	-119.5	0.2	114.5	F756 T757 Y770 N774 E777	F756-R760 WeakPolarHBondContact O-CG 3.38Å; F756-R760 PolarHBondContact O-N 3Å; F756-R760 VanDerWaalsContact O-N 3.08Å; F756-R760 PolarHBondContact O-NE 3.02Å; T757-R760 PolarHBondContact O-N 2.93Å; T757-R760 VanDerWaalsContact O-N 3.11Å; R760-Y770 HydrophobicContact CB-CD2 3.92Å; R760-Y770 HydrophobicContact CB-CE2 3.47Å; R760-Y770 VanDerWaalsContact CB-CE2 3.47Å; R760-Y770 HydrophobicContact CG-CD1 4.48Å; R760-Y770 HydrophobicContact CG-CD2 3.67Å; R760-Y770 HydrophobicContact CG-CE1 4.27Å; R760-Y770 HydrophobicContact CG-CE2 3.42Å; R760-Y770 VanDerWaalsContact CG-CE2 3.42Å; R760-Y770 HydrophobicContact CG-CG 4.19Å; R760-N774 WeakPolarHBondContact CD-OD1 3.36Å; R760-N774 PolarHBondContact NH1-OD1 3.32Å; R760-E777 IonicContact CZ-OE1 2.74Å; R760-E777 IonicContact CZ-OE2 3.39Å; R760-E777 IonicContact NH1-OE1 2.66Å; R760-E777 IonicContact NH1-OE2 3.72Å; R760-E777 PolarHBondContact NH1-OE2 3.16Å; R760-E777 IonicContact NH2-OE1 3.26Å; R760-E777 PolarHBondContact NH2-OE1 3.05Å; R760-E777 IonicContact NH2-OE2 3.96Å; R760-E777 PolarHBondContact NH2-OE2 3.27Å
761	E	94	Very high	93.5	Very high	115 Å²	115	55.4 Å²	55.4	54%	0.537	27%	0.27	S	S	.	.	H	α-helix	trans	-77.8	-30.1	176.7	-177.4	173.3	-161.3	0	0	112	V723 I724 T757 N758	V723-E761 HydrophobicContact CG1-CG 4.41Å; I724-E761 HydrophobicContact CD1-CB 3.82Å; I724-E761 HydrophobicContact CD1-CG 3.79Å; T757-E761 WeakPolarHBondContact O-CB 3.35Å; T757-E761 PolarHBondContact O-N 3.4Å; N758-E761 PolarHBondContact O-N 2.94Å
762	Y	93.2	Very high	93.6	Very high	70 Å²	70	55.5 Å²	55.5	28%	0.275	27%	0.27	S	S	.	.	H	α-helix	trans	-96.5	-34	179.7	-179.3	-95.5	0	0	0	114.7	A717 P718 Y720 V723 N758	A717-Y762 WeakPolarHBondContact CA-OH 3.34Å; A717-Y762 HydrophobicContact CB-CE1 3.95Å; P718-Y762 PolarHBondContact O-OH 3.22Å; Y720-Y762 AromaticContact CD2-CD1 3.73Å; Y720-Y762 HydrophobicContact CD2-CD1 3.73Å; Y720-Y762 AromaticContact CD2-CD2 3.65Å; Y720-Y762 HydrophobicContact CD2-CD2 3.65Å; Y720-Y762 HydrophobicContact CD2-CE1 4.06Å; Y720-Y762 AromaticContact CD2-CE2 3.97Å; Y720-Y762 HydrophobicContact CD2-CE2 3.97Å; Y720-Y762 AromaticContact CD2-CG 3.53Å; Y720-Y762 HydrophobicContact CD2-CG 3.53Å; Y720-Y762 HydrophobicContact CE2-CD1 4.18Å; Y720-Y762 HydrophobicContact CE2-CD2 4.44Å; Y720-Y762 AromaticContact CE2-CG 3.96Å; Y720-Y762 HydrophobicContact CE2-CG 3.96Å; Y720-Y762 HydrophobicContact CG-CD2 4.39Å; Y720-Y762 HydrophobicContact CG-CE2 4.45Å; V723-Y762 HydrophobicContact CB-CD2 4.45Å; V723-Y762 HydrophobicContact CG2-CD2 4.47Å; N758-Y762 PolarHBondContact O-N 2.8Å
763	N	91.9	Very high	93.6	Very high	36 Å²	36	55.5 Å²	55.5	19%	0.193	27%	0.27	C	S	.	.	S	Bend	trans	-104.9	146.4	-174.3	-57.6	-86.5	0	0	0	112.5	C759 S767 Y770	C759-N763 WeakPolarHBondContact O-CB 3.41Å; C759-N763 PolarHBondContact O-N 2.93Å; C759-N763 PolarHBondContact O-ND2 3Å; N763-S767 WeakPolarHBondContact CB-OG 3.21Å; N763-Y770 WeakPolarHBondContact O-CD2 3.34Å
764	A	90	Very high	93.6	Very high	57 Å²	57	53.8 Å²	53.8	47%	0.471	26%	0.264	S	S	.	.			trans	-64.6	148.7	174.4	0	0	0	0	0	112.6	E766 S767 Y770	A764-E766 PolarHBondContact O-N 3.28Å; A764-E766 VanDerWaalsContact O-N 3.11Å; A764-S767 VanDerWaalsContact O-CB 3.3Å; A764-S767 WeakPolarHBondContact O-CB 3.45Å; A764-S767 PolarHBondContact O-N 3.43Å; A764-S767 PolarHBondContact O-OG 3.29Å; A764-Y770 WeakPolarHBondContact O-CB 3.28Å
765	P	89.5	Confident	93.5	Very high	70 Å²	70	54.3 Å²	54.3	46%	0.455	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-29.9	-177.9	-27.2	35.4	0	0	0	115.6	S767 Y770	P765-S767 VanDerWaalsContact C-N 3.29Å; P765-S767 PolarHBondContact O-N 3.23Å; P765-Y770 HydrophobicContact CB-CD1 4.27Å; P765-Y770 HydrophobicContact CB-CE1 4.04Å; P765-Y770 HydrophobicContact CB-CE2 4.38Å; P765-Y770 HydrophobicContact CG-CE2 4.24Å; P765-Y770 WeakPolarHBondContact O-CD1 3.26Å
766	E	90	Very high	93.5	Very high	138 Å²	138	54 Å²	54	65%	0.645	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-14.2	-176.5	-60.8	65.4	-140	0	0	112.7	A764 K771	A764-E766 PolarHBondContact O-N 3.28Å; A764-E766 VanDerWaalsContact O-N 3.11Å; E766-K771 WeakPolarHBondContact O-CE 3.42Å; E766-K771 PolarHBondContact O-NZ 2.7Å
767	S	93.5	Very high	93.5	Very high	28 Å²	28	55.4 Å²	55.4	20%	0.196	28%	0.276	C	S	.	.	S	Bend	trans	-73.4	149.5	-174.9	69.1	0	0	0	0	113.4	N763 A764 P765 Y769 Y770 K771	N763-S767 WeakPolarHBondContact CB-OG 3.21Å; A764-S767 VanDerWaalsContact O-CB 3.3Å; A764-S767 WeakPolarHBondContact O-CB 3.45Å; A764-S767 PolarHBondContact O-N 3.43Å; A764-S767 PolarHBondContact O-OG 3.29Å; P765-S767 VanDerWaalsContact C-N 3.29Å; P765-S767 PolarHBondContact O-N 3.23Å; S767-Y769 PolarHBondContact O-N 3Å; S767-Y770 PolarHBondContact O-N 3.46Å; S767-Y770 VanDerWaalsContact O-N 3.16Å; S767-Y770 WeakPolarHBondContact OG-CB 3.36Å; S767-Y770 PolarHBondContact OG-N 2.83Å; S767-K771 WeakPolarHBondContact O-CG 3.3Å; S767-K771 PolarHBondContact O-N 2.86Å
768	E	91.4	Very high	93.5	Very high	109 Å²	109	60 Å²	60	51%	0.509	29%	0.291	S	S	.	.	H	α-helix	trans	-59.3	-32.5	173.2	-65.6	-49.8	123.1	0	0	112.5	K771 C772	E768-K771 PolarHBondContact O-N 3.25Å; E768-K771 WeakPolarHBondContact OE1-CD 3.28Å; E768-K771 IonicContact OE1-NZ 3.16Å; E768-K771 PolarHBondContact OE1-NZ 3.2Å; E768-C772 VanDerWaalsContact O-CB 3.28Å; E768-C772 WeakPolarHBondContact O-CB 3.46Å; E768-C772 PolarHBondContact O-N 3.06Å; E768-C772 PolarHBondContact O-SG 3.41Å
769	Y	91.8	Very high	93.4	Very high	102 Å²	102	62.1 Å²	62.1	40%	0.4	30%	0.3	S	S	.	.	H	α-helix	trans	-60	-47.5	174	-62.6	-69.8	0	0	0	112.4	W706 P707 C759 S767 C772 A773	W706-Y769 HydrophobicContact CH2-CD1 4.23Å; W706-Y769 AromaticContact CH2-CE1 3.48Å; W706-Y769 HydrophobicContact CH2-CE1 3.48Å; W706-Y769 VanDerWaalsContact CH2-CE1 3.48Å; W706-Y769 AromaticContact CH2-CZ 3.86Å; W706-Y769 HydrophobicContact CZ2-CE1 4.45Å; W706-Y769 AromaticContact CZ3-CE1 3.7Å; W706-Y769 HydrophobicContact CZ3-CE1 3.7Å; P707-Y769 HydrophobicContact CB-CD1 3.68Å; P707-Y769 HydrophobicContact CB-CE1 3.94Å; P707-Y769 HydrophobicContact CG-CD1 4Å; P707-Y769 HydrophobicContact CG-CE1 4.33Å; C759-Y769 VanDerWaalsContact SG-C 3.55Å; C759-Y769 PolarHBondContact SG-O 2.92Å; S767-Y769 PolarHBondContact O-N 3Å; Y769-C772 PolarHBondContact O-N 3.19Å; Y769-A773 PolarHBondContact O-N 2.6Å
770	Y	94.2	Very high	93.4	Very high	58 Å²	58	61.9 Å²	61.9	23%	0.227	30%	0.298	C	S	.	.	H	α-helix	trans	-67.4	-40.3	178.6	-163.1	-79.6	0	0	0	111.5	R760 N763 A764 P765 S767 A773 N774	R760-Y770 HydrophobicContact CB-CD2 3.92Å; R760-Y770 HydrophobicContact CB-CE2 3.47Å; R760-Y770 VanDerWaalsContact CB-CE2 3.47Å; R760-Y770 HydrophobicContact CG-CD1 4.48Å; R760-Y770 HydrophobicContact CG-CD2 3.67Å; R760-Y770 HydrophobicContact CG-CE1 4.27Å; R760-Y770 HydrophobicContact CG-CE2 3.42Å; R760-Y770 VanDerWaalsContact CG-CE2 3.42Å; R760-Y770 HydrophobicContact CG-CG 4.19Å; N763-Y770 WeakPolarHBondContact O-CD2 3.34Å; A764-Y770 WeakPolarHBondContact O-CB 3.28Å; P765-Y770 HydrophobicContact CB-CD1 4.27Å; P765-Y770 HydrophobicContact CB-CE1 4.04Å; P765-Y770 HydrophobicContact CB-CE2 4.38Å; P765-Y770 HydrophobicContact CG-CE2 4.24Å; P765-Y770 WeakPolarHBondContact O-CD1 3.26Å; S767-Y770 PolarHBondContact O-N 3.46Å; S767-Y770 VanDerWaalsContact O-N 3.16Å; S767-Y770 WeakPolarHBondContact OG-CB 3.36Å; S767-Y770 PolarHBondContact OG-N 2.83Å; Y770-A773 PolarHBondContact O-N 3.43Å; Y770-N774 WeakPolarHBondContact CD1-ND2 3.46Å; Y770-N774 WeakPolarHBondContact CE1-ND2 3.27Å; Y770-N774 PolarHBondContact O-N 2.91Å; Y770-N774 VanDerWaalsContact O-N 3.14Å; Y770-N774 PolarHBondContact O-ND2 3.24Å; Y770-N774 VanDerWaalsContact O-ND2 3.11Å
771	K	93.4	Very high	93.3	Very high	85 Å²	85	62.8 Å²	62.8	37%	0.37	30%	0.302	S	S	.	.	H	α-helix	trans	-60.9	-47.4	172.5	-65.6	169.2	-161.2	161.9	0	111.6	E766 S767 E768 A773 N774 I775	E766-K771 WeakPolarHBondContact O-CE 3.42Å; E766-K771 PolarHBondContact O-NZ 2.7Å; S767-K771 WeakPolarHBondContact O-CG 3.3Å; S767-K771 PolarHBondContact O-N 2.86Å; E768-K771 PolarHBondContact O-N 3.25Å; E768-K771 WeakPolarHBondContact OE1-CD 3.28Å; E768-K771 IonicContact OE1-NZ 3.16Å; E768-K771 PolarHBondContact OE1-NZ 3.2Å; K771-A773 PolarHBondContact O-N 2.81Å; K771-N774 PolarHBondContact O-N 3.37Å; K771-I775 WeakPolarHBondContact O-CG1 3.29Å; K771-I775 PolarHBondContact O-N 2.94Å
772	C	94.5	Very high	93.2	Very high	6 Å²	6	61 Å²	61	4%	0.041	30%	0.299	C	S	.	.	H	α-helix	trans	-58.3	-45.7	177.4	-73.7	0	0	0	0	111.8	N704 P707 F708 E768 Y769 N774 I775 L776	N704-C772 HydrophobicContact CB-CB 4.08Å; P707-C772 HydrophobicContact CG-CB 4.11Å; F708-C772 HydrophobicContact CE2-CB 4.04Å; F708-C772 HydrophobicContact CZ-CB 4.22Å; E768-C772 VanDerWaalsContact O-CB 3.28Å; E768-C772 WeakPolarHBondContact O-CB 3.46Å; E768-C772 PolarHBondContact O-N 3.06Å; E768-C772 PolarHBondContact O-SG 3.41Å; Y769-C772 PolarHBondContact O-N 3.19Å; C772-N774 PolarHBondContact O-N 3.46Å; C772-I775 PolarHBondContact O-N 3.11Å; C772-L776 VanDerWaalsContact O-CB 3.27Å; C772-L776 WeakPolarHBondContact O-CB 3.02Å; C772-L776 PolarHBondContact O-N 3.47Å
773	A	95.4	Very high	93.1	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58.2	-47.8	176.7	0	0	0	0	0	112.2	F708 F756 C759 Y769 Y770 K771 I775 L776 E777	F708-A773 HydrophobicContact CZ-CB 3.89Å; F756-A773 HydrophobicContact CB-CB 4.36Å; F756-A773 HydrophobicContact CD1-CB 4.22Å; C759-A773 HydrophobicContact CB-CB 3.95Å; Y769-A773 PolarHBondContact O-N 2.6Å; Y770-A773 PolarHBondContact O-N 3.43Å; K771-A773 PolarHBondContact O-N 2.81Å; A773-I775 PolarHBondContact O-N 3.47Å; A773-L776 PolarHBondContact O-N 2.79Å; A773-E777 VanDerWaalsContact O-CB 3.23Å; A773-E777 WeakPolarHBondContact O-CB 3.48Å; A773-E777 PolarHBondContact O-N 3.39Å
774	N	94.3	Very high	92.9	Very high	50 Å²	50	58.2 Å²	58.2	27%	0.267	29%	0.286	S	S	.	.	H	α-helix	trans	-67.9	-33.5	-178	-66.8	-32.9	0	0	0	113.5	R760 Y770 K771 C772 K778	R760-N774 WeakPolarHBondContact CD-OD1 3.36Å; R760-N774 PolarHBondContact NH1-OD1 3.32Å; Y770-N774 WeakPolarHBondContact CD1-ND2 3.46Å; Y770-N774 WeakPolarHBondContact CE1-ND2 3.27Å; Y770-N774 PolarHBondContact O-N 2.91Å; Y770-N774 VanDerWaalsContact O-N 3.14Å; Y770-N774 PolarHBondContact O-ND2 3.24Å; Y770-N774 VanDerWaalsContact O-ND2 3.11Å; K771-N774 PolarHBondContact O-N 3.37Å; C772-N774 PolarHBondContact O-N 3.46Å; N774-K778 WeakPolarHBondContact O-CG 3.12Å; N774-K778 PolarHBondContact O-N 3.11Å
775	I	94.8	Very high	92.8	Very high	78 Å²	78	60.3 Å²	60.3	40%	0.4	29%	0.285	S	S	.	.	H	α-helix	trans	-74	-44.6	176.4	-62.9	164.9	0	0	0	110	N704 K771 C772 A773 K778 F779	N704-I775 VanDerWaalsContact ND2-CD1 3.31Å; N704-I775 WeakPolarHBondContact ND2-CD1 3.27Å; N704-I775 WeakPolarHBondContact ND2-CG2 3.41Å; K771-I775 WeakPolarHBondContact O-CG1 3.29Å; K771-I775 PolarHBondContact O-N 2.94Å; C772-I775 PolarHBondContact O-N 3.11Å; A773-I775 PolarHBondContact O-N 3.47Å; I775-K778 PolarHBondContact O-N 2.66Å; I775-F779 PolarHBondContact O-N 2.93Å
776	L	95.3	Very high	92.6	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-69.6	-33.3	-178.5	-165.7	62.4	0	0	0	112.5	V699 H702 A705 F708 F756 C772 A773 F779 F780	V699-L776 HydrophobicContact CG1-CD1 4.02Å; V699-L776 HydrophobicContact CG1-CD2 4.04Å; V699-L776 HydrophobicContact CG1-CG 4.07Å; H702-L776 HydrophobicContact CB-CD1 3.59Å; A705-L776 HydrophobicContact CB-CD1 4.42Å; A705-L776 HydrophobicContact CB-CD2 3.95Å; F708-L776 HydrophobicContact CD2-CD2 3.58Å; F708-L776 HydrophobicContact CE2-CD2 4.01Å; F756-L776 HydrophobicContact CE1-CB 3.88Å; F756-L776 HydrophobicContact CE1-CD2 4.03Å; F756-L776 HydrophobicContact CE1-CG 3.94Å; F756-L776 HydrophobicContact CZ-CB 4.38Å; F756-L776 HydrophobicContact CZ-CG 4.21Å; C772-L776 VanDerWaalsContact O-CB 3.27Å; C772-L776 WeakPolarHBondContact O-CB 3.02Å; C772-L776 PolarHBondContact O-N 3.47Å; A773-L776 PolarHBondContact O-N 2.79Å; L776-F779 HydrophobicContact CD1-CD1 4.28Å; L776-F779 PolarHBondContact O-N 3.47Å; L776-F780 WeakPolarHBondContact O-CB 3.31Å; L776-F780 PolarHBondContact O-N 3.42Å
777	E	95.7	Very high	92.3	Very high	30 Å²	30	57.7 Å²	57.7	14%	0.14	27%	0.272	C	S	.	.	H	α-helix	trans	-63	-46.1	172.2	-173.2	172.2	-119.6	0	0	111.7	F756 R760 A773 F780 Y781	F756-E777 HydrophobicContact CB-CB 4.4Å; F756-E777 HydrophobicContact CD1-CB 4.23Å; F756-E777 HydrophobicContact CD2-CB 3.45Å; F756-E777 VanDerWaalsContact CD2-CB 3.45Å; F756-E777 HydrophobicContact CD2-CG 3.47Å; F756-E777 VanDerWaalsContact CD2-CG 3.47Å; F756-E777 WeakPolarHBondContact CD2-OE1 3.42Å; F756-E777 HydrophobicContact CE1-CB 4.4Å; F756-E777 VanDerWaalsContact CE2-CA 3.47Å; F756-E777 HydrophobicContact CE2-CB 3.65Å; F756-E777 HydrophobicContact CE2-CG 3.83Å; F756-E777 HydrophobicContact CG-CB 3.77Å; F756-E777 HydrophobicContact CG-CG 4.15Å; F756-E777 HydrophobicContact CZ-CB 4.14Å; R760-E777 IonicContact CZ-OE1 2.74Å; R760-E777 IonicContact CZ-OE2 3.39Å; R760-E777 IonicContact NH1-OE1 2.66Å; R760-E777 IonicContact NH1-OE2 3.72Å; R760-E777 PolarHBondContact NH1-OE2 3.16Å; R760-E777 IonicContact NH2-OE1 3.26Å; R760-E777 PolarHBondContact NH2-OE1 3.05Å; R760-E777 IonicContact NH2-OE2 3.96Å; R760-E777 PolarHBondContact NH2-OE2 3.27Å; A773-E777 VanDerWaalsContact O-CB 3.23Å; A773-E777 WeakPolarHBondContact O-CB 3.48Å; A773-E777 PolarHBondContact O-N 3.39Å; E777-F780 PolarHBondContact O-N 2.83Å; E777-Y781 HydrophobicContact CG-CD2 3.74Å; E777-Y781 HydrophobicContact CG-CE2 3.6Å; E777-Y781 VanDerWaalsContact O-CD2 3.24Å; E777-Y781 WeakPolarHBondContact O-CD2 3.45Å; E777-Y781 PolarHBondContact O-N 3.43Å
778	K	94.3	Very high	91.7	Very high	157 Å²	157	58 Å²	58	68%	0.683	28%	0.279	S	S	*	.	H	α-helix	trans	-60.1	-46.3	174.3	-73.9	175.8	-179	-179.2	0	111.5	N774 I775 F780 Y781 T782	N774-K778 WeakPolarHBondContact O-CG 3.12Å; N774-K778 PolarHBondContact O-N 3.11Å; I775-K778 PolarHBondContact O-N 2.66Å; K778-F780 PolarHBondContact O-N 2.87Å; K778-Y781 PolarHBondContact O-N 2.82Å; K778-T782 PolarHBondContact O-N 3.34Å; K778-T782 PolarHBondContact O-OG1 2.85Å
779	F	94.8	Very high	91	Very high	53 Å²	53	52.9 Å²	52.9	23%	0.232	26%	0.255	C	S	.	.	H	α-helix	trans	-60.2	-44.4	177.1	178.1	-98.9	0	0	0	112.1	H698 V699 H702 I775 L776 T782 K783	H698-F779 HydrophobicContact CB-CE1 4.19Å; H698-F779 HydrophobicContact CB-CZ 4.3Å; H698-F779 WeakPolarHBondContact O-CE1 3.49Å; V699-F779 HydrophobicContact CG2-CD1 4.49Å; H702-F779 HydrophobicContact CB-CD1 4.32Å; H702-F779 HydrophobicContact CB-CE1 4.23Å; H702-F779 AromaticContact CD2-CD1 3.85Å; H702-F779 AromaticContact CD2-CD2 3.69Å; H702-F779 AromaticContact CD2-CE2 3.96Å; H702-F779 AromaticContact CD2-CG 3.63Å; I775-F779 PolarHBondContact O-N 2.93Å; L776-F779 HydrophobicContact CD1-CD1 4.28Å; L776-F779 PolarHBondContact O-N 3.47Å; F779-T782 PolarHBondContact O-N 3.48Å; F779-K783 HydrophobicContact CD1-CG 4.35Å; F779-K783 HydrophobicContact CE1-CG 3.95Å; F779-K783 HydrophobicContact CE2-CG 4.24Å; F779-K783 HydrophobicContact CZ-CD 4.26Å; F779-K783 HydrophobicContact CZ-CG 3.9Å; F779-K783 WeakPolarHBondContact O-CG 3.21Å; F779-K783 PolarHBondContact O-N 3.31Å
780	F	94.9	Very high	90.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59.8	-47.1	174.6	167.3	-115.5	0	0	0	112.1	I695 V699 F748 M749 M752 F756 L776 E777 K778 T782 K783 I784	I695-F780 HydrophobicContact CG2-CD2 3.98Å; I695-F780 HydrophobicContact CG2-CE2 3.97Å; V699-F780 HydrophobicContact CG2-CB 4.21Å; V699-F780 HydrophobicContact CG2-CD2 4.19Å; F748-F780 HydrophobicContact CD1-CE2 4.2Å; F748-F780 HydrophobicContact CD1-CZ 4.4Å; F748-F780 AromaticContact CE1-CE2 3.83Å; F748-F780 HydrophobicContact CE1-CE2 3.83Å; F748-F780 HydrophobicContact CE1-CZ 4.43Å; M749-F780 HydrophobicContact CG-CZ 4.07Å; M752-F780 HydrophobicContact CB-CD1 4.43Å; M752-F780 HydrophobicContact CB-CE1 3.97Å; M752-F780 HydrophobicContact CB-CE2 4.43Å; M752-F780 HydrophobicContact CB-CZ 3.97Å; M752-F780 HydrophobicContact CE-CD2 4.41Å; M752-F780 HydrophobicContact CG-CD1 3.62Å; M752-F780 HydrophobicContact CG-CD2 3.92Å; M752-F780 HydrophobicContact CG-CE1 3.65Å; M752-F780 HydrophobicContact CG-CE2 3.97Å; M752-F780 HydrophobicContact CG-CG 3.75Å; M752-F780 HydrophobicContact CG-CZ 3.82Å; F756-F780 HydrophobicContact CE2-CB 4.46Å; F756-F780 HydrophobicContact CE2-CD1 4.16Å; F756-F780 HydrophobicContact CZ-CB 4.42Å; L776-F780 WeakPolarHBondContact O-CB 3.31Å; L776-F780 PolarHBondContact O-N 3.42Å; E777-F780 PolarHBondContact O-N 2.83Å; K778-F780 PolarHBondContact O-N 2.87Å; F780-T782 VanDerWaalsContact C-N 3.3Å; F780-T782 PolarHBondContact O-N 2.87Å; F780-K783 PolarHBondContact O-N 2.86Å; F780-K783 VanDerWaalsContact O-N 3.16Å; F780-I784 HydrophobicContact CE2-CB 4.21Å; F780-I784 HydrophobicContact CE2-CD1 3.97Å; F780-I784 HydrophobicContact CZ-CB 4.49Å; F780-I784 HydrophobicContact CZ-CD1 3.71Å; F780-I784 WeakPolarHBondContact O-CG2 3.3Å; F780-I784 PolarHBondContact O-N 2.65Å
781	Y	92.4	Very high	88.5	Confident	77 Å²	77	55.9 Å²	55.9	30%	0.302	28%	0.277	S	S	.	.	H	α-helix	trans	-63.4	-33	178.1	-84.3	-64	0	0	0	113.2	M749 E777 K778 I784 K785 I790	M749-Y781 HydrophobicContact CE-CE1 4.24Å; E777-Y781 HydrophobicContact CG-CD2 3.74Å; E777-Y781 HydrophobicContact CG-CE2 3.6Å; E777-Y781 VanDerWaalsContact O-CD2 3.24Å; E777-Y781 WeakPolarHBondContact O-CD2 3.45Å; E777-Y781 PolarHBondContact O-N 3.43Å; K778-Y781 PolarHBondContact O-N 2.82Å; Y781-I784 HydrophobicContact CD1-CG2 4.27Å; Y781-I784 WeakPolarHBondContact O-CG2 3.34Å; Y781-K785 WeakPolarHBondContact O-CB 3.31Å; Y781-K785 PolarHBondContact O-N 3.12Å; Y781-I790 HydrophobicContact CD1-CD1 3.93Å; Y781-I790 HydrophobicContact CE1-CD1 4.1Å
782	T	92.4	Very high	85.9	Confident	76 Å²	76	63.6 Å²	63.6	47%	0.466	31%	0.31	S	S	.	.	H	α-helix	trans	-64.7	-51.2	169.7	-58.9	0	0	0	0	111.1	K778 F779 F780 I784 K785 E786	K778-T782 PolarHBondContact O-N 3.34Å; K778-T782 PolarHBondContact O-OG1 2.85Å; F779-T782 PolarHBondContact O-N 3.48Å; F780-T782 VanDerWaalsContact C-N 3.3Å; F780-T782 PolarHBondContact O-N 2.87Å; T782-I784 PolarHBondContact O-N 3.31Å; T782-K785 PolarHBondContact O-N 3.22Å; T782-K785 VanDerWaalsContact O-N 3.12Å; T782-E786 WeakPolarHBondContact CG2-OE1 3.47Å; T782-E786 WeakPolarHBondContact O-CG 3.48Å; T782-E786 PolarHBondContact O-N 3.37Å
783	K	91	Very high	85.5	Confident	48 Å²	48	66.5 Å²	66.5	21%	0.209	32%	0.323	C	S	.	.	H	α-helix	trans	-65.6	-34	-176.1	-68.3	-71.6	159.7	-133.3	0	113.9	F779 F780 E786 A787	F779-K783 HydrophobicContact CD1-CG 4.35Å; F779-K783 HydrophobicContact CE1-CG 3.95Å; F779-K783 HydrophobicContact CE2-CG 4.24Å; F779-K783 HydrophobicContact CZ-CD 4.26Å; F779-K783 HydrophobicContact CZ-CG 3.9Å; F779-K783 WeakPolarHBondContact O-CG 3.21Å; F779-K783 PolarHBondContact O-N 3.31Å; F780-K783 PolarHBondContact O-N 2.86Å; F780-K783 VanDerWaalsContact O-N 3.16Å; K783-E786 WeakPolarHBondContact CD-OE2 3.47Å; K783-E786 IonicContact NZ-OE1 2.69Å; K783-E786 PolarHBondContact NZ-OE1 3.03Å; K783-E786 IonicContact NZ-OE2 2.7Å; K783-E786 PolarHBondContact NZ-OE2 3.33Å; K783-A787 WeakPolarHBondContact O-CB 3.26Å; K783-A787 PolarHBondContact O-N 3.48Å; K783-A787 VanDerWaalsContact O-N 3.16Å
784	I	87.6	Confident	85	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-76.1	-24.6	175	-161.7	167	0	0	0	112.8	I695 M749 F780 Y781 T782 L789 I790	I695-I784 HydrophobicContact CD1-CG1 4.43Å; M749-I784 HydrophobicContact CE-CD1 4.47Å; M749-I784 HydrophobicContact CG-CD1 3.38Å; M749-I784 HydrophobicContact SD-CD1 3.72Å; F780-I784 HydrophobicContact CE2-CB 4.21Å; F780-I784 HydrophobicContact CE2-CD1 3.97Å; F780-I784 HydrophobicContact CZ-CB 4.49Å; F780-I784 HydrophobicContact CZ-CD1 3.71Å; F780-I784 WeakPolarHBondContact O-CG2 3.3Å; F780-I784 PolarHBondContact O-N 2.65Å; Y781-I784 HydrophobicContact CD1-CG2 4.27Å; Y781-I784 WeakPolarHBondContact O-CG2 3.34Å; T782-I784 PolarHBondContact O-N 3.31Å; I784-L789 HydrophobicContact CD1-CB 4.32Å; I784-L789 HydrophobicContact CG1-CB 3.56Å; I784-L789 HydrophobicContact CG1-CD1 4.17Å; I784-L789 HydrophobicContact CG1-CG 4.49Å; I784-L789 WeakPolarHBondContact O-CB 3.37Å; I784-L789 PolarHBondContact O-N 3.13Å; I784-I790 HydrophobicContact CG1-CG1 4.4Å; I784-I790 HydrophobicContact CG2-CD1 3.57Å; I784-I790 HydrophobicContact CG2-CG1 4.09Å
785	K	87	Confident	84.4	Confident	101 Å²	101	71.1 Å²	71.1	44%	0.439	35%	0.345	S	S	.	.	H	α-helix	trans	-75.9	-41.8	171.3	-170.5	163.6	-171.2	161.2	0	111.8	Y781 T782 A787 G788 K792	Y781-K785 WeakPolarHBondContact O-CB 3.31Å; Y781-K785 PolarHBondContact O-N 3.12Å; T782-K785 PolarHBondContact O-N 3.22Å; T782-K785 VanDerWaalsContact O-N 3.12Å; K785-A787 VanDerWaalsContact C-N 3.28Å; K785-A787 PolarHBondContact O-N 3.26Å; K785-G788 PolarHBondContact O-N 3.1Å; K785-K792 PolarHBondContact NZ-OXT 2.63Å
786	E	86.8	Confident	83.8	Confident	122 Å²	122	70.6 Å²	70.6	57%	0.57	34%	0.341	S	S	*	.	H	α-helix	trans	-55.3	-42	170.2	-73.1	171.8	-156.8	0	0	112	T782 K783 G788	T782-E786 WeakPolarHBondContact CG2-OE1 3.47Å; T782-E786 WeakPolarHBondContact O-CG 3.48Å; T782-E786 PolarHBondContact O-N 3.37Å; K783-E786 WeakPolarHBondContact CD-OE2 3.47Å; K783-E786 IonicContact NZ-OE1 2.69Å; K783-E786 PolarHBondContact NZ-OE1 3.03Å; K783-E786 IonicContact NZ-OE2 2.7Å; K783-E786 PolarHBondContact NZ-OE2 3.33Å; E786-G788 PolarHBondContact O-N 2.94Å; E786-G788 VanDerWaalsContact O-N 3.14Å
787	A	82.9	Confident	83.1	Confident	31 Å²	31	75.1 Å²	75.1	26%	0.256	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	0.8	177.3	0	0	0	0	0	114.9	T691 I695 K783 K785 L789	T691-A787 HydrophobicContact CG2-CB 3.87Å; I695-A787 HydrophobicContact CD1-CB 3.83Å; K783-A787 WeakPolarHBondContact O-CB 3.26Å; K783-A787 PolarHBondContact O-N 3.48Å; K783-A787 VanDerWaalsContact O-N 3.16Å; K785-A787 VanDerWaalsContact C-N 3.28Å; K785-A787 PolarHBondContact O-N 3.26Å; A787-L789 VanDerWaalsContact C-N 3.26Å; A787-L789 HydrophobicContact CB-CD1 4.14Å; A787-L789 HydrophobicContact CB-CG 4.09Å; A787-L789 PolarHBondContact O-N 2.84Å
788	G	79.9	Confident	82.3	Confident	34 Å²	34	78.1 Å²	78.1	35%	0.351	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.7	33.8	-176.5	0	0	0	0	0	113.1	K683 K785 E786	K683-G788 PolarHBondContact NZ-O 2.79Å; K785-G788 PolarHBondContact O-N 3.1Å; E786-G788 PolarHBondContact O-N 2.94Å; E786-G788 VanDerWaalsContact O-N 3.14Å
789	L	77.9	Confident	81.4	Confident	2 Å²	2	72.4 Å²	72.4	1%	0.01	36%	0.356	C	S	.	.			trans	-103.1	3.2	179.2	-66.6	179.3	0	0	0	112.7	L688 T691 L692 I695 R745 I784 A787	L688-L789 HydrophobicContact CD1-CD2 4.44Å; T691-L789 HydrophobicContact CG2-CD1 3.85Å; L692-L789 HydrophobicContact CD2-CD1 4.12Å; I695-L789 HydrophobicContact CD1-CD1 3.88Å; R745-L789 HydrophobicContact CB-CD1 4.49Å; R745-L789 HydrophobicContact CB-CD2 4.37Å; R745-L789 WeakPolarHBondContact CD-O 3.43Å; R745-L789 PolarHBondContact NE-O 2.87Å; R745-L789 PolarHBondContact NH2-O 3.11Å; I784-L789 HydrophobicContact CD1-CB 4.32Å; I784-L789 HydrophobicContact CG1-CB 3.56Å; I784-L789 HydrophobicContact CG1-CD1 4.17Å; I784-L789 HydrophobicContact CG1-CG 4.49Å; I784-L789 WeakPolarHBondContact O-CB 3.37Å; I784-L789 PolarHBondContact O-N 3.13Å; A787-L789 VanDerWaalsContact C-N 3.26Å; A787-L789 HydrophobicContact CB-CD1 4.14Å; A787-L789 HydrophobicContact CB-CG 4.09Å; A787-L789 PolarHBondContact O-N 2.84Å
790	I	74.8	Confident	80.4	Confident	60 Å²	60	73.9 Å²	73.9	31%	0.308	37%	0.365	S	S	.	.	S	Bend	trans	-136.7	144.1	165.5	-54	-176.8	0	0	0	107.5	M749 Y781 I784	M749-I790 HydrophobicContact CE-CD1 3.64Å; M749-I790 HydrophobicContact CE-CG1 4.21Å; M749-I790 HydrophobicContact SD-CD1 4.49Å; Y781-I790 HydrophobicContact CD1-CD1 3.93Å; Y781-I790 HydrophobicContact CE1-CD1 4.1Å; I784-I790 HydrophobicContact CG1-CG1 4.4Å; I784-I790 HydrophobicContact CG2-CD1 3.57Å; I784-I790 HydrophobicContact CG2-CG1 4.09Å
791	E	57.9	Low	79.2	Confident	164 Å²	164	80.1 Å²	80.1	77%	0.766	40%	0.396	S	S	*	.			trans	-71	170.1	175.9	-74.2	161.4	-140.8	0	0	111.8
792	K	39.7	Very low	78	Confident	246 Å²	246	80.4 Å²	80.4	100%	1.07	40%	0.404	S	S	*	.			trans	-73.8	0	-162.7	-116.4	-173.4	-179	-176.5	0	114.7	K785	K785-K792 PolarHBondContact NZ-OXT 2.63Å

Retrieved 792 of 792 residues in 485.5 ms (Link to these results)

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