A0A087Y0C2_POEFO Loading...

Aminoacyl tRNA synthetase complex interacting multifunctional protein 2

AlphaFold DB , UniProt , Accession A0A087Y0C2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 322 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.9	Very low	55.8	Low	246 Å²	246	156.4 Å²	156.4	100%	1.212	83%	0.833	S	S	*	*				0	112.8	0	-74.8	175.3	168.9	0	0	107.4
2	S	45.8	Very low	56.3	Low	123 Å²	123	157.4 Å²	157.4	86%	0.86	84%	0.839	S	S	*	*			trans	-83.3	116.9	178.4	-177.4	0	0	0	0	108.3
3	M	51	Low	57.1	Low	176 Å²	176	154.5 Å²	154.5	87%	0.867	82%	0.822	S	S	*	*			trans	-73.8	140.7	176.8	-75.9	-141.7	-76.8	0	0	110.4	Q5	M3-Q5 PolarHBondContact O-N 3.21Å; M3-Q5 VanDerWaalsContact O-N 3.14Å
4	Y	59.5	Low	57.6	Low	231 Å²	231	158.3 Å²	158.3	91%	0.906	83%	0.827	S	S	*	*			trans	-53.6	114.7	-179.1	-71.8	-91.2	0	0	0	111.7
5	Q	55.4	Low	58.2	Low	191 Å²	191	155.9 Å²	155.9	89%	0.893	81%	0.814	S	S	*	*			trans	-87.1	111.5	169.3	-167.7	173.8	10.9	0	0	108.7	M3	M3-Q5 PolarHBondContact O-N 3.21Å; M3-Q5 VanDerWaalsContact O-N 3.14Å
6	V	64.2	Low	58.8	Low	125 Å²	125	156.4 Å²	156.4	76%	0.758	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-77.5	127.4	178.3	-177.5	0	0	0	0	108.9
7	K	57.1	Low	59.4	Low	180 Å²	180	154.1 Å²	154.1	78%	0.783	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-67.7	134.3	177.2	-75	-178.6	177.6	177.9	0	110.2	V9	K7-V9 PolarHBondContact O-N 3.22Å
8	P	59.4	Low	59.9	Low	120 Å²	120	150.1 Å²	150.1	78%	0.779	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-61.2	134.5	175.7	20	-26.4	0	0	0	110.7	S10	P8-S10 VanDerWaalsContact C-N 3.33Å; P8-S10 PolarHBondContact O-N 2.96Å
9	V	60.5	Low	60.3	Low	144 Å²	144	150.3 Å²	150.3	87%	0.873	80%	0.799	S	S	*	*	S	Bend	trans	-82.2	-9.4	-169.3	-177.7	0	0	0	0	112.7	K7	K7-V9 PolarHBondContact O-N 3.22Å
10	S	56.3	Low	60.4	Low	83 Å²	83	148.4 Å²	148.4	58%	0.58	80%	0.797	S	S	*	*			trans	-119.4	124.4	177.6	-172.2	0	0	0	0	111.2	P8	P8-S10 VanDerWaalsContact C-N 3.33Å; P8-S10 PolarHBondContact O-N 2.96Å
11	P	62	Low	60.3	Low	101 Å²	101	147.6 Å²	147.6	66%	0.656	79%	0.79	S	S	*	*			trans	-66.7	161.2	161.5	28.7	-30.9	0	0	0	110.4	I13	P11-I13 PolarHBondContact O-N 2.95Å
12	D	61.5	Low	61.2	Low	169 Å²	169	146.9 Å²	146.9	90%	0.904	78%	0.775	S	S	*	*			trans	-62	97.2	172.1	-96	-26.8	0	0	0	109.8	K14	D12-K14 PolarHBondContact O-N 2.97Å
13	I	66.9	Low	62.2	Low	119 Å²	119	150.6 Å²	150.6	61%	0.61	78%	0.776	S	S	*	*			trans	-84.1	110.9	175.1	-60.1	166	0	0	0	107.2	P11 I15	P11-I13 PolarHBondContact O-N 2.95Å; I13-I15 HydrophobicContact CB-CG1 4.39Å; I13-I15 HydrophobicContact CG2-CD1 4.4Å; I13-I15 HydrophobicContact CG2-CG1 3.68Å; I13-I15 PolarHBondContact O-N 3.46Å; I13-I15 VanDerWaalsContact O-N 3.08Å
14	K	64	Low	62.9	Low	208 Å²	208	149.9 Å²	149.9	90%	0.904	78%	0.775	S	S	*	*			trans	-72.5	98.3	168.5	-75.1	-177.2	178.4	179	0	108.8	D12	D12-K14 PolarHBondContact O-N 2.97Å
15	I	67	Low	63.1	Low	123 Å²	123	144.1 Å²	144.1	63%	0.631	77%	0.766	S	S	*	*			trans	-90.6	122.3	174.6	-55.5	172.6	0	0	0	107.6	I13 L17	I13-I15 HydrophobicContact CB-CG1 4.39Å; I13-I15 HydrophobicContact CG2-CD1 4.4Å; I13-I15 HydrophobicContact CG2-CG1 3.68Å; I13-I15 PolarHBondContact O-N 3.46Å; I13-I15 VanDerWaalsContact O-N 3.08Å; I15-L17 HydrophobicContact CG2-CD2 4.19Å; I15-L17 HydrophobicContact CG2-CG 4.41Å; I15-L17 PolarHBondContact O-N 3.16Å
16	D	67.4	Low	63.5	Low	164 Å²	164	139.7 Å²	139.7	88%	0.877	75%	0.748	S	S	*	*			trans	-78.8	110.1	173.4	-156.3	12.5	0	0	0	108.7
17	L	69.4	Low	63.5	Low	116 Å²	116	140.7 Å²	140.7	61%	0.607	75%	0.748	S	S	*	*			trans	-95.3	136	-174.2	-71.7	166.1	0	0	0	110.1	I15	I15-L17 HydrophobicContact CG2-CD2 4.19Å; I15-L17 HydrophobicContact CG2-CG 4.41Å; I15-L17 PolarHBondContact O-N 3.16Å
18	P	68.8	Low	63.4	Low	82 Å²	82	139.7 Å²	139.7	53%	0.532	75%	0.745	S	S	.	*			trans	-62.8	141	176.6	24.1	-31.2	0	0	0	111.5	C20	P18-C20 PolarHBondContact O-N 2.78Å
19	T	65.8	Low	63.1	Low	155 Å²	155	138.7 Å²	138.7	95%	0.951	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-1.3	-173.7	23.7	0	0	0	0	115.3
20	C	62.9	Low	62.5	Low	112 Å²	112	142.9 Å²	142.9	76%	0.757	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-0.8	-177.4	61.9	0	0	0	0	114.9	P18	P18-C20 PolarHBondContact O-N 2.78Å
21	M	59.4	Low	62	Low	132 Å²	132	147.2 Å²	147.2	65%	0.65	75%	0.749	S	S	*	*	S	Bend	trans	-109.8	145	178.3	-72.3	-142.9	-60.9	0	0	113.3	K23	M21-K23 PolarHBondContact O-N 3.46Å
22	Y	61.9	Low	61.1	Low	231 Å²	231	151.3 Å²	151.3	91%	0.906	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-62.3	130.9	171	-67	-87.1	0	0	0	110.5
23	K	66.7	Low	60.2	Low	201 Å²	201	150.8 Å²	150.8	87%	0.874	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-79.6	121.9	175.7	-70.6	-177	179.1	-179.8	0	109.8	M21	M21-K23 PolarHBondContact O-N 3.46Å
24	L	65.1	Low	58.8	Low	160 Å²	160	149.5 Å²	149.5	84%	0.838	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-98.7	144.3	170.9	-76.6	167.7	0	0	0	110.7
25	P	62.9	Low	57.4	Low	110 Å²	110	146.2 Å²	146.2	71%	0.714	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-60.9	140	174.3	-18.6	30.3	0	0	0	111.3	I27	P25-I27 PolarHBondContact O-N 2.98Å
26	N	63.9	Low	55.9	Low	98 Å²	98	144.9 Å²	144.9	52%	0.524	76%	0.761	S	S	.	*	P	Polyproline II helix	trans	-71	117	174.9	-173.3	-17.4	0	0	0	109.6	H28 T29	N26-H28 VanDerWaalsContact C-N 3.26Å; N26-H28 PolarHBondContact O-N 3.4Å; N26-H28 WeakPolarHBondContact OD1-CB 3.33Å; N26-H28 PolarHBondContact OD1-N 3.29Å; N26-T29 HydrophobicContact CB-CG2 4.37Å; N26-T29 PolarHBondContact O-OG1 3.07Å
27	I	64.1	Low	54.7	Low	146 Å²	146	142.6 Å²	142.6	75%	0.749	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-9.3	-179.7	58.5	169.4	0	0	0	113.5	P25	P25-I27 PolarHBondContact O-N 2.98Å
28	H	54.8	Low	53.5	Low	159 Å²	159	143.6 Å²	143.6	74%	0.736	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	-13.4	-178.2	-59	-58.6	0	0	0	113.4	N26 R30	N26-H28 VanDerWaalsContact C-N 3.26Å; N26-H28 PolarHBondContact O-N 3.4Å; N26-H28 WeakPolarHBondContact OD1-CB 3.33Å; N26-H28 PolarHBondContact OD1-N 3.29Å; H28-R30 PolarHBondContact O-N 3.4Å
29	T	54.7	Low	52.1	Low	100 Å²	100	148.7 Å²	148.7	61%	0.613	78%	0.78	S	S	*	*			trans	-79.7	71.8	171.1	45.3	0	0	0	0	109.8	N26 Q31	N26-T29 HydrophobicContact CB-CG2 4.37Å; N26-T29 PolarHBondContact O-OG1 3.07Å; T29-Q31 VanDerWaalsContact C-N 3.34Å; T29-Q31 PolarHBondContact O-N 2.95Å
30	R	47.9	Very low	50.8	Low	231 Å²	231	145.5 Å²	145.5	87%	0.872	77%	0.77	S	S	*	*			trans	-73.5	93.7	167.9	-175.2	174.8	166.6	-179	-4.6	107.8	H28 E32	H28-R30 PolarHBondContact O-N 3.4Å; R30-E32 PolarHBondContact O-N 3.29Å
31	Q	44.8	Very low	50.1	Low	174 Å²	174	148.1 Å²	148.1	81%	0.813	78%	0.775	S	S	*	*			trans	-67.5	118.8	172.3	-141.6	161.5	6.4	0	0	107.6	T29 N33	T29-Q31 VanDerWaalsContact C-N 3.34Å; T29-Q31 PolarHBondContact O-N 2.95Å; Q31-N33 PolarHBondContact O-N 3.23Å
32	E	42.5	Very low	49.2	Very low	187 Å²	187	150.9 Å²	150.9	87%	0.874	79%	0.787	S	S	*	*	S	Bend	trans	-66.5	16.1	-175.2	-69	-174.9	151.2	0	0	114.8	R30	R30-E32 PolarHBondContact O-N 3.29Å
33	N	43.1	Very low	48.6	Very low	159 Å²	159	148 Å²	148	85%	0.85	79%	0.787	S	S	*	*	S	Bend	trans	-139.3	53.9	-173.6	-120.5	35.5	0	0	0	113.2	Q31	Q31-N33 PolarHBondContact O-N 3.23Å
34	S	37.4	Very low	47.9	Very low	92 Å²	92	142 Å²	142	64%	0.643	78%	0.783	S	S	*	*			trans	-158.9	100.4	160.5	177.7	0	0	0	0	109.2	S36	S34-S36 PolarHBondContact O-N 2.97Å; S34-S36 VanDerWaalsContact O-N 3.08Å
35	C	33.8	Very low	47.4	Very low	138 Å²	138	141 Å²	141	93%	0.932	78%	0.778	S	S	*	*			trans	-74.7	90	169.1	-59.5	0	0	0	0	108.7
36	S	35.7	Very low	47.4	Very low	96 Å²	96	139.3 Å²	139.3	67%	0.671	77%	0.766	S	S	*	*			trans	-112.1	101.4	155.6	-59.4	0	0	0	0	106.5	S34 D38	S34-S36 PolarHBondContact O-N 2.97Å; S34-S36 VanDerWaalsContact O-N 3.08Å; S36-D38 PolarHBondContact O-N 2.91Å; S36-D38 VanDerWaalsContact O-N 3.09Å
37	S	43.1	Very low	48.1	Very low	115 Å²	115	139 Å²	139	80%	0.804	76%	0.764	S	S	*	*			trans	-72.4	93.7	177.7	60.9	0	0	0	0	108.9
38	D	43.5	Very low	48.9	Very low	137 Å²	137	136.9 Å²	136.9	73%	0.733	76%	0.76	S	S	*	*			trans	-131.5	120.1	161.8	-81.9	-47.4	0	0	0	109.7	S36	S36-D38 PolarHBondContact O-N 2.91Å; S36-D38 VanDerWaalsContact O-N 3.09Å
39	H	39.6	Very low	50.2	Low	189 Å²	189	131.9 Å²	131.9	88%	0.875	75%	0.745	S	S	*	*			trans	88.2	91.6	-177.8	-53.8	-71.7	0	0	0	116.8
40	A	38.8	Very low	51.4	Low	89 Å²	89	130.6 Å²	130.6	74%	0.736	74%	0.738	S	S	*	*				175.5	115.8	90.7	0	0	0	0	0	112.8
41	L	48.1	Very low	53	Low	166 Å²	166	124.6 Å²	124.6	87%	0.869	72%	0.715	S	S	*	*			trans	55.6	97.8	143.4	-53.9	175.8	0	0	0	119.4
42	Q	41.2	Very low	55.1	Low	191 Å²	191	119.2 Å²	119.2	89%	0.893	70%	0.7	S	S	*	*			trans	-173.1	124.1	131.5	-108.7	158.7	3.7	0	0	111.7
43	N	49.5	Very low	57.2	Low	169 Å²	169	114.5 Å²	114.5	90%	0.904	68%	0.681	S	S	*	*			trans	23.5	109.2	160.2	-71.8	-9.3	0	0	0	118.6
44	G	51.2	Low	59.5	Low	77 Å²	77	112.1 Å²	112.1	79%	0.794	66%	0.664	S	S	*	*			trans	164.4	106.7	161.4	0	0	0	0	0	113
45	D	55.3	Low	62	Low	137 Å²	137	112.3 Å²	112.3	73%	0.733	66%	0.661	S	S	*	*			trans	48.3	107.9	166.5	-112.3	-1.9	0	0	0	118.3	D47 R51	D45-D47 PolarHBondContact O-N 3.25Å; D45-R51 VanDerWaalsContact CG-NH2 3.26Å; D45-R51 IonicContact OD1-CZ 2.63Å; D45-R51 IonicContact OD1-NH1 3.82Å; D45-R51 IonicContact OD1-NH2 3.62Å; D45-R51 PolarHBondContact OD1-NH2 2.89Å; D45-R51 IonicContact OD2-NH2 2.65Å
46	V	62.8	Low	64.9	Low	76 Å²	76	113.3 Å²	113.3	46%	0.461	65%	0.645	S	S	.	*			trans	-56.2	126.6	167.2	-178.3	0	0	0	0	108.6	V50 R51	V46-V50 HydrophobicContact CG1-CB 3.77Å; V46-V50 HydrophobicContact CG1-CG1 3.69Å; V46-R51 HydrophobicContact CB-CG 4.23Å; V46-R51 HydrophobicContact CG1-CG 4.08Å; V46-R51 PolarHBondContact O-NE 3.33Å; V46-R51 PolarHBondContact O-NH2 2.95Å
47	D	78.1	Confident	67.6	Low	92 Å²	92	114.7 Å²	114.7	49%	0.492	64%	0.641	S	S	.	*			trans	-41.2	126.2	174.7	177.7	-5.9	0	0	0	109.9	D45 A49 V50 R51	D45-D47 PolarHBondContact O-N 3.25Å; D47-A49 PolarHBondContact O-N 3.02Å; D47-A49 WeakPolarHBondContact OD1-CB 3.47Å; D47-A49 PolarHBondContact OD1-N 2.72Å; D47-V50 HydrophobicContact CB-CB 4.31Å; D47-V50 HydrophobicContact CB-CG2 3.96Å; D47-V50 WeakPolarHBondContact O-CA 3.47Å; D47-V50 WeakPolarHBondContact O-CB 3.33Å; D47-V50 PolarHBondContact O-N 3.37Å; D47-R51 PolarHBondContact O-N 3.37Å
48	P	80.9	Confident	69.9	Low	101 Å²	101	113.6 Å²	113.6	66%	0.656	63%	0.627	S	S	*	*	H	α-helix	trans	-49	-32.5	177.7	-27.7	33.1	0	0	0	113.7	A52	P48-A52 WeakPolarHBondContact O-CB 3.42Å; P48-A52 PolarHBondContact O-N 3.24Å
49	A	82	Confident	72.4	Confident	53 Å²	53	111.3 Å²	111.3	44%	0.438	61%	0.611	S	S	.	*	H	α-helix	trans	-67	-38.7	175.9	0	0	0	0	0	112.4	D47 A52 L53	D47-A49 PolarHBondContact O-N 3.02Å; D47-A49 WeakPolarHBondContact OD1-CB 3.47Å; D47-A49 PolarHBondContact OD1-N 2.72Å; A49-A52 PolarHBondContact O-N 3.48Å; A49-L53 WeakPolarHBondContact O-CG 3.42Å; A49-L53 PolarHBondContact O-N 3.38Å
50	V	80.2	Confident	75	Confident	74 Å²	74	106.5 Å²	106.5	45%	0.448	59%	0.591	S	S	.	*	H	α-helix	trans	-71.7	-39.9	178.4	177.2	0	0	0	0	110.8	V46 D47 L53 E54	V46-V50 HydrophobicContact CG1-CB 3.77Å; V46-V50 HydrophobicContact CG1-CG1 3.69Å; D47-V50 HydrophobicContact CB-CB 4.31Å; D47-V50 HydrophobicContact CB-CG2 3.96Å; D47-V50 WeakPolarHBondContact O-CA 3.47Å; D47-V50 WeakPolarHBondContact O-CB 3.33Å; D47-V50 PolarHBondContact O-N 3.37Å; V50-L53 WeakPolarHBondContact O-CB 3.43Å; V50-L53 PolarHBondContact O-N 3.01Å; V50-E54 PolarHBondContact O-N 3.2Å
51	R	82.3	Confident	77.5	Confident	105 Å²	105	106.5 Å²	106.5	40%	0.396	58%	0.577	S	S	.	*	H	α-helix	trans	-63.7	-39.6	172	-99.3	-172.6	-80.7	-161.8	-7	112.7	D45 V46 D47 L53 E54 V55	D45-R51 VanDerWaalsContact CG-NH2 3.26Å; D45-R51 IonicContact OD1-CZ 2.63Å; D45-R51 IonicContact OD1-NH1 3.82Å; D45-R51 IonicContact OD1-NH2 3.62Å; D45-R51 PolarHBondContact OD1-NH2 2.89Å; D45-R51 IonicContact OD2-NH2 2.65Å; V46-R51 HydrophobicContact CB-CG 4.23Å; V46-R51 HydrophobicContact CG1-CG 4.08Å; V46-R51 PolarHBondContact O-NE 3.33Å; V46-R51 PolarHBondContact O-NH2 2.95Å; D47-R51 PolarHBondContact O-N 3.37Å; R51-L53 VanDerWaalsContact C-N 3.27Å; R51-L53 PolarHBondContact O-N 2.84Å; R51-E54 PolarHBondContact O-N 3.03Å; R51-V55 WeakPolarHBondContact O-CG2 3.43Å; R51-V55 PolarHBondContact O-N 3.32Å
52	A	88.1	Confident	79.8	Confident	61 Å²	61	106 Å²	106	50%	0.504	56%	0.563	S	S	.	*	H	α-helix	trans	-64.3	-34	174.9	0	0	0	0	0	112.3	P48 A49 R56	P48-A52 WeakPolarHBondContact O-CB 3.42Å; P48-A52 PolarHBondContact O-N 3.24Å; A49-A52 PolarHBondContact O-N 3.48Å; A52-R56 WeakPolarHBondContact O-CB 3.47Å; A52-R56 PolarHBondContact O-N 3.07Å; A52-R56 VanDerWaalsContact O-N 3.13Å
53	L	86.9	Confident	82.3	Confident	88 Å²	88	102.3 Å²	102.3	46%	0.461	55%	0.545	S	S	.	.	H	α-helix	trans	-69	-43.2	174	-74.8	169.4	0	0	0	112.1	A49 V50 R51 R56 Q57	A49-L53 WeakPolarHBondContact O-CG 3.42Å; A49-L53 PolarHBondContact O-N 3.38Å; V50-L53 WeakPolarHBondContact O-CB 3.43Å; V50-L53 PolarHBondContact O-N 3.01Å; R51-L53 VanDerWaalsContact C-N 3.27Å; R51-L53 PolarHBondContact O-N 2.84Å; L53-R56 PolarHBondContact O-N 2.82Å; L53-Q57 WeakPolarHBondContact O-CG 3.47Å; L53-Q57 PolarHBondContact O-N 3.13Å
54	E	90.3	Very high	84.3	Confident	109 Å²	109	98.9 Å²	98.9	51%	0.509	53%	0.526	S	S	.	.	H	α-helix	trans	-58.9	-49.9	176.3	-173.5	176.1	-162.9	0	0	111.2	V50 R51 R56 Q57 D58	V50-E54 PolarHBondContact O-N 3.2Å; R51-E54 PolarHBondContact O-N 3.03Å; E54-R56 VanDerWaalsContact C-N 3.3Å; E54-R56 PolarHBondContact O-N 2.94Å; E54-Q57 PolarHBondContact O-N 3.25Å; E54-Q57 VanDerWaalsContact O-N 3.09Å; E54-D58 PolarHBondContact O-N 3.44Å
55	V	91.1	Very high	86.3	Confident	95 Å²	95	102.3 Å²	102.3	58%	0.576	52%	0.516	S	S	*	.	H	α-helix	trans	-59.2	-40.4	176.6	172.7	0	0	0	0	111.9	R51 D58 E59	R51-V55 WeakPolarHBondContact O-CG2 3.43Å; R51-V55 PolarHBondContact O-N 3.32Å; V55-D58 PolarHBondContact O-N 3Å; V55-E59 PolarHBondContact O-N 3.36Å
56	R	93.4	Very high	88.2	Confident	159 Å²	159	101.6 Å²	101.6	60%	0.6	51%	0.508	S	S	*	.	H	α-helix	trans	-66.1	-40.1	176.8	-178.3	-179.3	-75.2	157.3	-3.4	111.7	A52 L53 E54 E59 I60	A52-R56 WeakPolarHBondContact O-CB 3.47Å; A52-R56 PolarHBondContact O-N 3.07Å; A52-R56 VanDerWaalsContact O-N 3.13Å; L53-R56 PolarHBondContact O-N 2.82Å; E54-R56 VanDerWaalsContact C-N 3.3Å; E54-R56 PolarHBondContact O-N 2.94Å; R56-E59 PolarHBondContact O-N 3.1Å; R56-I60 HydrophobicContact CG-CD1 4.03Å; R56-I60 VanDerWaalsContact O-CG1 3.29Å; R56-I60 WeakPolarHBondContact O-CG1 3.35Å; R56-I60 PolarHBondContact O-N 3.37Å
57	Q	92.3	Very high	89.6	Confident	125 Å²	125	103.1 Å²	103.1	58%	0.584	51%	0.513	S	S	*	.	H	α-helix	trans	-64.4	-42.7	177.5	-74.2	179.3	8.5	0	0	111.1	L53 E54 E59 I60 M61	L53-Q57 WeakPolarHBondContact O-CG 3.47Å; L53-Q57 PolarHBondContact O-N 3.13Å; E54-Q57 PolarHBondContact O-N 3.25Å; E54-Q57 VanDerWaalsContact O-N 3.09Å; Q57-E59 VanDerWaalsContact C-N 3.33Å; Q57-E59 PolarHBondContact O-N 2.74Å; Q57-I60 PolarHBondContact O-N 2.96Å; Q57-M61 WeakPolarHBondContact O-CG 3.34Å; Q57-M61 PolarHBondContact O-N 3.27Å
58	D	92.4	Very high	90.3	Very high	93 Å²	93	104.6 Å²	104.6	50%	0.497	52%	0.515	S	S	.	.	H	α-helix	trans	-62.2	-39.4	175.7	-76	-16.6	0	0	0	112.5	E54 V55 M61 R62	E54-D58 PolarHBondContact O-N 3.44Å; V55-D58 PolarHBondContact O-N 3Å; D58-M61 PolarHBondContact O-N 3.47Å; D58-R62 PolarHBondContact O-N 3.33Å
59	E	95.2	Very high	90.9	Very high	89 Å²	89	102.7 Å²	102.7	42%	0.416	51%	0.508	S	S	.	.	H	α-helix	trans	-66.9	-40.4	176.7	-160.3	-171.6	155.3	0	0	112	V55 R56 Q57 R62 K63	V55-E59 PolarHBondContact O-N 3.36Å; R56-E59 PolarHBondContact O-N 3.1Å; Q57-E59 VanDerWaalsContact C-N 3.33Å; Q57-E59 PolarHBondContact O-N 2.74Å; E59-R62 PolarHBondContact O-N 2.86Å; E59-K63 WeakPolarHBondContact O-CG 3.48Å; E59-K63 PolarHBondContact O-N 3.29Å; E59-K63 VanDerWaalsContact OE1-CE 3.32Å; E59-K63 WeakPolarHBondContact OE1-CE 3.39Å; E59-K63 IonicContact OE1-NZ 3.84Å; E59-K63 PolarHBondContact OE1-NZ 3.24Å
60	I	94.4	Very high	91.3	Very high	88 Å²	88	103.1 Å²	103.1	45%	0.451	51%	0.512	S	S	.	.	H	α-helix	trans	-64.1	-44.9	175.1	-69.7	166.9	0	0	0	110.4	R56 Q57 R62 K63 L64	R56-I60 HydrophobicContact CG-CD1 4.03Å; R56-I60 VanDerWaalsContact O-CG1 3.29Å; R56-I60 WeakPolarHBondContact O-CG1 3.35Å; R56-I60 PolarHBondContact O-N 3.37Å; Q57-I60 PolarHBondContact O-N 2.96Å; I60-R62 VanDerWaalsContact C-N 3.31Å; I60-R62 PolarHBondContact O-N 2.98Å; I60-K63 PolarHBondContact O-N 3.4Å; I60-L64 HydrophobicContact CG2-CD1 4.05Å; I60-L64 HydrophobicContact CG2-CG 4.38Å; I60-L64 WeakPolarHBondContact O-CG 3.46Å; I60-L64 PolarHBondContact O-N 3.42Å
61	M	92.5	Very high	91.7	Very high	89 Å²	89	103.9 Å²	103.9	44%	0.438	52%	0.516	S	S	.	.	H	α-helix	trans	-59.1	-43.4	177.5	-76.5	-66.1	-67.1	0	0	111.5	Q57 D58 L64 Y65	Q57-M61 WeakPolarHBondContact O-CG 3.34Å; Q57-M61 PolarHBondContact O-N 3.27Å; D58-M61 PolarHBondContact O-N 3.47Å; M61-L64 PolarHBondContact O-N 2.7Å; M61-Y65 HydrophobicContact CE-CE2 3.76Å; M61-Y65 WeakPolarHBondContact O-CD2 3.4Å; M61-Y65 PolarHBondContact O-N 3.1Å
62	R	94.8	Very high	91.9	Very high	154 Å²	154	103.4 Å²	103.4	58%	0.581	52%	0.518	S	S	*	.	H	α-helix	trans	-60.5	-48.1	175.7	-166.2	-176.8	-53.6	151.7	8.2	112.1	D58 E59 I60 L64 Y65 E66	D58-R62 PolarHBondContact O-N 3.33Å; E59-R62 PolarHBondContact O-N 2.86Å; I60-R62 VanDerWaalsContact C-N 3.31Å; I60-R62 PolarHBondContact O-N 2.98Å; R62-L64 VanDerWaalsContact C-N 3.28Å; R62-L64 PolarHBondContact O-N 2.73Å; R62-Y65 PolarHBondContact O-N 3.49Å; R62-E66 PolarHBondContact O-N 3.47Å
63	K	94	Very high	91.7	Very high	114 Å²	114	102.2 Å²	102.2	50%	0.496	51%	0.512	S	S	.	.	H	α-helix	trans	-60.2	-37.8	177.2	-72.9	174.2	-175.9	166.8	0	112.2	E59 I60 E66 L67	E59-K63 WeakPolarHBondContact O-CG 3.48Å; E59-K63 PolarHBondContact O-N 3.29Å; E59-K63 VanDerWaalsContact OE1-CE 3.32Å; E59-K63 WeakPolarHBondContact OE1-CE 3.39Å; E59-K63 IonicContact OE1-NZ 3.84Å; E59-K63 PolarHBondContact OE1-NZ 3.24Å; I60-K63 PolarHBondContact O-N 3.4Å; K63-E66 PolarHBondContact O-N 2.86Å; K63-L67 WeakPolarHBondContact O-CB 3.33Å; K63-L67 PolarHBondContact O-N 3.01Å
64	L	93.1	Very high	91.6	Very high	97 Å²	97	103.3 Å²	103.3	51%	0.508	52%	0.518	S	S	.	.	H	α-helix	trans	-67.9	-39.5	176.5	-72.6	175.1	0	0	0	112.3	I60 M61 R62 L67 K68	I60-L64 HydrophobicContact CG2-CD1 4.05Å; I60-L64 HydrophobicContact CG2-CG 4.38Å; I60-L64 WeakPolarHBondContact O-CG 3.46Å; I60-L64 PolarHBondContact O-N 3.42Å; M61-L64 PolarHBondContact O-N 2.7Å; R62-L64 VanDerWaalsContact C-N 3.28Å; R62-L64 PolarHBondContact O-N 2.73Å; L64-L67 PolarHBondContact O-N 3.37Å; L64-K68 VanDerWaalsContact O-CB 3.31Å; L64-K68 WeakPolarHBondContact O-CB 3.44Å; L64-K68 PolarHBondContact O-N 3.34Å
65	Y	92.9	Very high	91	Very high	150 Å²	150	100.7 Å²	100.7	59%	0.588	52%	0.515	S	S	*	.	H	α-helix	trans	-65.1	-42	174.6	-76.8	-60.1	0	0	0	112.2	M61 R62 K68 A69	M61-Y65 HydrophobicContact CE-CE2 3.76Å; M61-Y65 WeakPolarHBondContact O-CD2 3.4Å; M61-Y65 PolarHBondContact O-N 3.1Å; R62-Y65 PolarHBondContact O-N 3.49Å; Y65-K68 PolarHBondContact O-N 3.27Å; Y65-A69 PolarHBondContact O-N 2.99Å
66	E	94.4	Very high	90.3	Very high	121 Å²	121	103.2 Å²	103.2	57%	0.565	52%	0.518	S	S	*	.	H	α-helix	trans	-63.1	-45.3	175.1	-73.7	172.1	-169	0	0	111.8	R62 K63 K68 A69 A70	R62-E66 PolarHBondContact O-N 3.47Å; K63-E66 PolarHBondContact O-N 2.86Å; E66-K68 VanDerWaalsContact C-N 3.34Å; E66-K68 PolarHBondContact O-N 2.82Å; E66-A69 PolarHBondContact O-N 2.95Å; E66-A70 PolarHBondContact O-N 3.38Å
67	L	92.3	Very high	89.1	Confident	109 Å²	109	100 Å²	100	57%	0.571	52%	0.516	S	S	*	.	H	α-helix	trans	-64.3	-40.4	178.6	-169.7	67.1	0	0	0	111.6	K63 L64 A69 A70 V71	K63-L67 WeakPolarHBondContact O-CB 3.33Å; K63-L67 PolarHBondContact O-N 3.01Å; L64-L67 PolarHBondContact O-N 3.37Å; L67-A69 VanDerWaalsContact C-N 3.35Å; L67-A70 PolarHBondContact O-N 2.71Å; L67-V71 VanDerWaalsContact O-CG2 3.32Å; L67-V71 WeakPolarHBondContact O-CG2 3.37Å; L67-V71 PolarHBondContact O-N 3.43Å
68	K	93.4	Very high	87.8	Confident	122 Å²	122	99.4 Å²	99.4	53%	0.53	52%	0.521	S	S	.	.	H	α-helix	trans	-59.6	-46.3	173.8	-178.6	-178.7	172.6	-175.2	0	111.1	L64 Y65 E66 A70 V71 E72	L64-K68 VanDerWaalsContact O-CB 3.31Å; L64-K68 WeakPolarHBondContact O-CB 3.44Å; L64-K68 PolarHBondContact O-N 3.34Å; Y65-K68 PolarHBondContact O-N 3.27Å; E66-K68 VanDerWaalsContact C-N 3.34Å; E66-K68 PolarHBondContact O-N 2.82Å; K68-A70 VanDerWaalsContact C-N 3.33Å; K68-A70 PolarHBondContact O-N 2.91Å; K68-V71 PolarHBondContact O-N 3.27Å; K68-E72 WeakPolarHBondContact CE-OE1 3.38Å; K68-E72 IonicContact NZ-OE1 3.59Å; K68-E72 WeakPolarHBondContact O-CB 3.28Å; K68-E72 WeakPolarHBondContact O-CG 3.5Å; K68-E72 PolarHBondContact O-N 3.03Å
69	A	92.9	Very high	86.1	Confident	61 Å²	61	100.2 Å²	100.2	50%	0.504	53%	0.529	S	S	.	.	H	α-helix	trans	-62.6	-39.5	177.5	0	0	0	0	0	112	Y65 E66 L67 G73	Y65-A69 PolarHBondContact O-N 2.99Å; E66-A69 PolarHBondContact O-N 2.95Å; L67-A69 VanDerWaalsContact C-N 3.35Å; A69-G73 PolarHBondContact O-N 3.19Å
70	A	89.9	Confident	84	Confident	63 Å²	63	100.6 Å²	100.6	52%	0.521	54%	0.538	S	S	.	.	H	α-helix	trans	-65.2	-42.9	176.1	0	0	0	0	0	112.4	E66 L67 K68 G73 L74	E66-A70 PolarHBondContact O-N 3.38Å; L67-A70 PolarHBondContact O-N 2.71Å; K68-A70 VanDerWaalsContact C-N 3.33Å; K68-A70 PolarHBondContact O-N 2.91Å; A70-G73 PolarHBondContact O-N 3.42Å; A70-L74 WeakPolarHBondContact O-CB 3.39Å; A70-L74 PolarHBondContact O-N 3.25Å
71	V	89.2	Confident	81.8	Confident	89 Å²	89	102.4 Å²	102.4	54%	0.539	56%	0.556	S	S	.	*	H	α-helix	trans	-66.7	-42	177	171.2	0	0	0	0	111.3	L67 K68 G73 L74 A75	L67-V71 VanDerWaalsContact O-CG2 3.32Å; L67-V71 WeakPolarHBondContact O-CG2 3.37Å; L67-V71 PolarHBondContact O-N 3.43Å; K68-V71 PolarHBondContact O-N 3.27Å; V71-G73 VanDerWaalsContact C-N 3.33Å; V71-L74 PolarHBondContact O-N 3.04Å; V71-A75 WeakPolarHBondContact O-CB 3.21Å; V71-A75 PolarHBondContact O-N 3.2Å
72	E	85.5	Confident	79.2	Confident	95 Å²	95	106 Å²	106	44%	0.444	58%	0.576	S	S	.	*	H	α-helix	trans	-65.3	-36.5	174.5	-75.6	180	-175.1	0	0	112.1	K68 K76	K68-E72 WeakPolarHBondContact CE-OE1 3.38Å; K68-E72 IonicContact NZ-OE1 3.59Å; K68-E72 WeakPolarHBondContact O-CB 3.28Å; K68-E72 WeakPolarHBondContact O-CG 3.5Å; K68-E72 PolarHBondContact O-N 3.03Å; E72-K76 WeakPolarHBondContact O-CG 3.46Å; E72-K76 PolarHBondContact O-N 3.02Å
73	G	84.8	Confident	77.2	Confident	36 Å²	36	103 Å²	103	37%	0.371	58%	0.584	S	S	.	*	H	α-helix	trans	-62.8	-46.6	172.2	0	0	0	0	0	112.1	A69 A70 V71 K76 T77	A69-G73 PolarHBondContact O-N 3.19Å; A70-G73 PolarHBondContact O-N 3.42Å; V71-G73 VanDerWaalsContact C-N 3.33Å; G73-K76 PolarHBondContact O-N 3.32Å; G73-T77 PolarHBondContact O-N 2.87Å; G73-T77 VanDerWaalsContact O-N 3.13Å; G73-T77 PolarHBondContact O-OG1 2.85Å; G73-T77 VanDerWaalsContact O-OG1 3.08Å
74	L	84.4	Confident	74.9	Confident	111 Å²	111	105.1 Å²	105.1	58%	0.581	60%	0.601	S	S	*	*	H	α-helix	trans	-65.7	-39.8	178	-173.2	62.1	0	0	0	112.3	A70 V71 K76 T77 V78	A70-L74 WeakPolarHBondContact O-CB 3.39Å; A70-L74 PolarHBondContact O-N 3.25Å; V71-L74 PolarHBondContact O-N 3.04Å; L74-K76 VanDerWaalsContact C-N 3.26Å; L74-K76 PolarHBondContact O-N 3.28Å; L74-T77 VanDerWaalsContact CA-OG1 3.3Å; L74-T77 WeakPolarHBondContact CA-OG1 3.35Å; L74-T77 PolarHBondContact O-N 3.38Å; L74-T77 PolarHBondContact O-OG1 3.21Å; L74-V78 HydrophobicContact CD1-CG2 4.4Å; L74-V78 HydrophobicContact CG-CG2 4.41Å; L74-V78 VanDerWaalsContact O-CG2 3.3Å; L74-V78 WeakPolarHBondContact O-CG2 3.45Å; L74-V78 PolarHBondContact O-N 3.16Å
75	A	78.1	Confident	72.6	Confident	54 Å²	54	108.8 Å²	108.8	45%	0.446	62%	0.62	S	S	.	*	H	α-helix	trans	-61.2	-37	176	0	0	0	0	0	111.7	V71 T79	V71-A75 WeakPolarHBondContact O-CB 3.21Å; V71-A75 PolarHBondContact O-N 3.2Å; A75-T79 PolarHBondContact O-N 3.22Å; A75-T79 PolarHBondContact O-OG1 2.88Å
76	K	76.6	Confident	70	Confident	148 Å²	148	108.4 Å²	108.4	64%	0.643	63%	0.628	S	S	*	*	H	α-helix	trans	-70.2	-35.3	175.7	-73.1	172.7	-177.6	175	0	112.8	E72 G73 L74 T79	E72-K76 WeakPolarHBondContact O-CG 3.46Å; E72-K76 PolarHBondContact O-N 3.02Å; G73-K76 PolarHBondContact O-N 3.32Å; L74-K76 VanDerWaalsContact C-N 3.26Å; L74-K76 PolarHBondContact O-N 3.28Å; K76-T79 WeakPolarHBondContact CA-OG1 3.48Å; K76-T79 PolarHBondContact O-N 3.4Å; K76-T79 PolarHBondContact O-OG1 3.3Å
77	T	67.9	Low	67.9	Low	91 Å²	91	109.2 Å²	109.2	56%	0.558	64%	0.642	S	S	*	*	H	α-helix	trans	-76.1	-27.6	174	31.7	0	0	0	0	113.5	G73 L74 T79 T80	G73-T77 PolarHBondContact O-N 2.87Å; G73-T77 VanDerWaalsContact O-N 3.13Å; G73-T77 PolarHBondContact O-OG1 2.85Å; G73-T77 VanDerWaalsContact O-OG1 3.08Å; L74-T77 VanDerWaalsContact CA-OG1 3.3Å; L74-T77 WeakPolarHBondContact CA-OG1 3.35Å; L74-T77 PolarHBondContact O-N 3.38Å; L74-T77 PolarHBondContact O-OG1 3.21Å; T77-T79 VanDerWaalsContact C-N 3.29Å; T77-T80 PolarHBondContact O-OG1 3.41Å
78	V	65.6	Low	65.6	Low	114 Å²	114	108.9 Å²	108.9	69%	0.691	64%	0.644	S	S	*	*	H	α-helix	trans	-75.8	-19.4	173.4	173.2	0	0	0	0	112	L74	L74-V78 HydrophobicContact CD1-CG2 4.4Å; L74-V78 HydrophobicContact CG-CG2 4.41Å; L74-V78 VanDerWaalsContact O-CG2 3.3Å; L74-V78 WeakPolarHBondContact O-CG2 3.45Å; L74-V78 PolarHBondContact O-N 3.16Å
79	T	56.7	Low	63.2	Low	110 Å²	110	108.1 Å²	108.1	68%	0.675	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	3.7	179.3	40.6	0	0	0	0	114.9	A75 K76 T77 P81	A75-T79 PolarHBondContact O-N 3.22Å; A75-T79 PolarHBondContact O-OG1 2.88Å; K76-T79 WeakPolarHBondContact CA-OG1 3.48Å; K76-T79 PolarHBondContact O-N 3.4Å; K76-T79 PolarHBondContact O-OG1 3.3Å; T77-T79 VanDerWaalsContact C-N 3.29Å; T79-P81 WeakPolarHBondContact O-CD 3.22Å
80	T	51.2	Low	60.6	Low	96 Å²	96	111 Å²	111	59%	0.589	67%	0.666	S	S	*	*	S	Bend	trans	-77	117.8	166	47.6	0	0	0	0	109.3	T77 D82	T77-T80 PolarHBondContact O-OG1 3.41Å; T80-D82 PolarHBondContact O-N 3.05Å; T80-D82 VanDerWaalsContact O-N 3.14Å
81	P	47.8	Very low	58	Low	127 Å²	127	112.8 Å²	112.8	83%	0.825	68%	0.675	S	S	*	*			trans	-78.5	100.7	179.7	31.1	-28.8	0	0	0	108.2	T79	T79-P81 WeakPolarHBondContact O-CD 3.22Å
82	D	38.2	Very low	55.5	Low	164 Å²	164	112.7 Å²	112.7	88%	0.877	68%	0.678	S	S	*	*			trans	-81.1	135.8	159.8	-118	-21	0	0	0	108.6	T80	T80-D82 PolarHBondContact O-N 3.05Å; T80-D82 VanDerWaalsContact O-N 3.14Å
83	A	51.3	Low	53.1	Low	90 Å²	90	115.4 Å²	115.4	74%	0.744	69%	0.694	S	S	*	*	S	Bend	trans	-64.6	155.5	-171.7	0	0	0	0	0	112.9
84	D	47.6	Very low	50.9	Low	160 Å²	160	118.8 Å²	118.8	86%	0.856	71%	0.712	S	S	*	*			trans	67.5	89.2	174.7	-78.3	-13.9	0	0	0	117.4
85	L	44.7	Very low	48.6	Very low	173 Å²	173	118 Å²	118	91%	0.906	72%	0.716	S	S	*	*			trans	-145.8	124.7	141.1	-153.9	63.3	0	0	0	112.2
86	D	37.8	Very low	46.8	Very low	142 Å²	142	124.6 Å²	124.6	76%	0.759	74%	0.738	S	S	*	*			trans	-49.4	131.4	-169.4	-129.1	-30.2	0	0	0	115.4	T88	D86-T88 VanDerWaalsContact C-N 3.26Å; D86-T88 PolarHBondContact O-N 2.98Å
87	V	50.4	Low	44.7	Very low	139 Å²	139	122.8 Å²	122.8	84%	0.842	74%	0.744	S	S	*	*	S	Bend	trans	-81.5	15	-171.5	166.1	0	0	0	0	113.7
88	T	43.9	Very low	43.4	Very low	101 Å²	101	124.6 Å²	124.6	62%	0.62	76%	0.76	S	S	*	*			trans	-118.6	22.9	-158.8	-19.4	0	0	0	0	117	D86	D86-T88 VanDerWaalsContact C-N 3.26Å; D86-T88 PolarHBondContact O-N 2.98Å
89	V	43.2	Very low	42.1	Very low	106 Å²	106	123.3 Å²	123.3	64%	0.642	76%	0.756	S	S	*	*	S	Bend	trans	-130.4	-7.2	-179.5	-169.7	0	0	0	0	115.6
90	S	37	Very low	41.4	Very low	121 Å²	121	119.5 Å²	119.5	85%	0.846	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-7.2	-179.6	-57	0	0	0	0	115.4
91	S	37	Very low	41.6	Very low	102 Å²	102	119.9 Å²	119.9	71%	0.713	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	1.9	-175.6	46.3	0	0	0	0	115.1
92	S	36.3	Very low	42.1	Very low	86 Å²	86	115.5 Å²	115.5	60%	0.601	70%	0.702	S	S	*	*	S	Bend	trans	-120.4	8.1	-173.7	49.4	0	0	0	0	115.8
93	L	35.5	Very low	43.4	Very low	152 Å²	152	108.1 Å²	108.1	80%	0.796	66%	0.662	S	S	*	*	S	Bend	trans	-115.9	6.9	176.6	-87.4	146.2	0	0	0	114.9
94	S	37.6	Very low	43.8	Very low	107 Å²	107	111 Å²	111	75%	0.748	66%	0.658	S	S	*	*			trans	-102	61.3	170.8	62.4	0	0	0	0	111.2
95	S	36.1	Very low	44.1	Very low	94 Å²	94	104.8 Å²	104.8	66%	0.657	63%	0.628	S	S	*	*			trans	-102.6	109.1	166.4	31	0	0	0	0	110
96	Q	40	Very low	44.6	Very low	193 Å²	193	100.5 Å²	100.5	90%	0.902	61%	0.609	S	S	*	*			trans	79.4	75.2	152.8	-53.3	-178.6	14.9	0	0	117.8
97	S	33.3	Very low	45.9	Very low	110 Å²	110	101 Å²	101	77%	0.769	61%	0.605	S	S	*	*			trans	-118.1	114	132.1	66.2	0	0	0	0	108.3	S99	S97-S99 PolarHBondContact O-N 2.87Å
98	S	39.9	Very low	47.3	Very low	129 Å²	129	98.2 Å²	98.2	90%	0.902	59%	0.585	S	S	*	*			trans	-70.6	70.1	173.5	47.6	0	0	0	0	109.8
99	S	39.1	Very low	49.2	Very low	87 Å²	87	93.9 Å²	93.9	61%	0.608	56%	0.558	S	S	*	*			trans	-85.4	118.6	165.5	169.7	0	0	0	0	107.2	S97 D101	S97-S99 PolarHBondContact O-N 2.87Å; S99-D101 PolarHBondContact O-N 2.91Å
100	C	42.4	Very low	51.2	Low	30 Å²	30	92.3 Å²	92.3	20%	0.203	55%	0.546	C	S	.	.			trans	-56.8	128.1	172.4	66.7	0	0	0	0	110	I102 L311	C100-I102 HydrophobicContact CB-CB 4.49Å; C100-I102 HydrophobicContact CB-CD1 4.11Å; C100-I102 HydrophobicContact CB-CG1 4.2Å; C100-I102 PolarHBondContact O-N 3.31Å; C100-I102 VanDerWaalsContact O-N 3.07Å; C100-L311 HydrophobicContact CB-CD2 4.38Å
101	D	53.9	Low	53.4	Low	105 Å²	105	90.1 Å²	90.1	56%	0.561	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-72.6	5.1	-179	-88.2	-9.8	0	0	0	113.6	S99 F103 K104	S99-D101 PolarHBondContact O-N 2.91Å; D101-F103 PolarHBondContact O-N 3.47Å; D101-K104 HydrophobicContact CB-CD 4.16Å; D101-K104 WeakPolarHBondContact O-CB 3.33Å; D101-K104 PolarHBondContact O-N 2.88Å; D101-K104 WeakPolarHBondContact OD1-CE 3.25Å; D101-K104 IonicContact OD1-NZ 3.13Å; D101-K104 PolarHBondContact OD1-NZ 2.98Å; D101-K104 IonicContact OD2-NZ 3.4Å; D101-K104 PolarHBondContact OD2-NZ 3.47Å
102	I	59.7	Low	55.6	Low	35 Å²	35	89.1 Å²	89.1	18%	0.179	52%	0.522	C	S	.	.	G	3₁₀ helix	trans	-70	-32.2	-168.6	-64.8	176.1	0	0	0	112.4	C100 E276 F277	C100-I102 HydrophobicContact CB-CB 4.49Å; C100-I102 HydrophobicContact CB-CD1 4.11Å; C100-I102 HydrophobicContact CB-CG1 4.2Å; C100-I102 PolarHBondContact O-N 3.31Å; C100-I102 VanDerWaalsContact O-N 3.07Å; I102-E276 WeakPolarHBondContact CD1-OE2 3.44Å; I102-E276 WeakPolarHBondContact CG1-OE2 3.47Å; I102-F277 HydrophobicContact CD1-CB 3.46Å; I102-F277 VanDerWaalsContact CD1-CB 3.46Å
103	F	65.5	Low	57.9	Low	9 Å²	9	87.9 Å²	87.9	4%	0.039	51%	0.508	C	S	.	.	G	3₁₀ helix	trans	-96.9	17.7	-176.8	-56.1	-72	0	0	0	113.6	D101 A105 L142 H146 F220 L223 A224 F277 H313	D101-F103 PolarHBondContact O-N 3.47Å; F103-A105 PolarHBondContact O-N 3.14Å; F103-L142 HydrophobicContact CD2-CD2 4.38Å; F103-L142 HydrophobicContact CE1-CD1 4.23Å; F103-L142 HydrophobicContact CE2-CD1 4.49Å; F103-L142 HydrophobicContact CE2-CD2 3.81Å; F103-L142 HydrophobicContact CZ-CD1 3.81Å; F103-L142 HydrophobicContact CZ-CD2 3.96Å; F103-H146 WeakPolarHBondContact CB-CE1 3.5Å; F103-H146 WeakPolarHBondContact CB-NE2 3.39Å; F103-H146 AromaticContact CG-NE2 3.83Å; F103-H146 PolarHBondContact O-CE1 3.37Å; F103-H146 PolarHBondContact O-ND1 2.97Å; F103-F220 AromaticContact CE1-CE2 3.93Å; F103-F220 HydrophobicContact CE1-CE2 3.93Å; F103-F220 HydrophobicContact CE1-CZ 4.4Å; F103-L223 HydrophobicContact CD1-CB 3.9Å; F103-L223 HydrophobicContact CE1-CB 4.2Å; F103-A224 HydrophobicContact CD1-CB 4.08Å; F103-A224 HydrophobicContact CE1-CB 4.44Å; F103-F277 HydrophobicContact CZ-CD1 4.18Å; F103-F277 HydrophobicContact CZ-CE1 4.17Å; F103-H313 AromaticContact CE2-NE2 3.7Å
104	K	58.5	Low	60.1	Low	151 Å²	151	82.4 Å²	82.4	66%	0.657	49%	0.488	S	S	*	.			trans	-71.2	-7.5	178.6	-80.4	178.7	169.4	169.4	0	114.2	D101	D101-K104 HydrophobicContact CB-CD 4.16Å; D101-K104 WeakPolarHBondContact O-CB 3.33Å; D101-K104 PolarHBondContact O-N 2.88Å; D101-K104 WeakPolarHBondContact OD1-CE 3.25Å; D101-K104 IonicContact OD1-NZ 3.13Å; D101-K104 PolarHBondContact OD1-NZ 2.98Å; D101-K104 IonicContact OD2-NZ 3.4Å; D101-K104 PolarHBondContact OD2-NZ 3.47Å
105	A	54.2	Low	62	Low	28 Å²	28	86.2 Å²	86.2	23%	0.231	49%	0.491	C	S	.	.	S	Bend	trans	-78	130.4	-175.7	0	0	0	0	0	113.5	F103 P225	F103-A105 PolarHBondContact O-N 3.14Å; A105-P225 HydrophobicContact CB-CB 4.23Å; A105-P225 HydrophobicContact CB-CG 3.54Å
106	T	54.9	Low	63.6	Low	84 Å²	84	84.6 Å²	84.6	52%	0.515	48%	0.475	S	S	.	.			trans	32.4	83.7	169	30.7	0	0	0	0	116.5	N108 Y147	T106-N108 PolarHBondContact O-N 3.49Å; T106-Y147 PolarHBondContact O-OH 3.38Å
107	K	64.6	Low	64.7	Low	152 Å²	152	84 Å²	84	66%	0.661	48%	0.477	S	S	*	.			trans	-57.3	-7.3	156.6	-64.7	-175	177.4	-176.8	0	113.5	L109	K107-L109 PolarHBondContact O-N 3.43Å
108	N	79.9	Confident	66	Low	81 Å²	81	82 Å²	82	43%	0.433	47%	0.474	S	S	.	.			trans	-86.3	86.6	-179	-167.3	-21	0	0	0	110.5	T106 D110 A111	T106-N108 PolarHBondContact O-N 3.49Å; N108-D110 PolarHBondContact O-N 2.77Å; N108-D110 WeakPolarHBondContact OD1-CA 3.33Å; N108-D110 VanDerWaalsContact OD1-CB 3.26Å; N108-D110 WeakPolarHBondContact OD1-CB 3.48Å; N108-D110 PolarHBondContact OD1-N 2.99Å; N108-A111 HydrophobicContact CB-CB 4.19Å; N108-A111 WeakPolarHBondContact O-CB 3.35Å; N108-A111 PolarHBondContact O-N 3.46Å; N108-A111 VanDerWaalsContact O-N 3.14Å; N108-A111 PolarHBondContact OD1-N 3.27Å; N108-A111 VanDerWaalsContact OD1-N 3.14Å
109	L	84.5	Confident	67.6	Low	10 Å²	10	78.9 Å²	78.9	5%	0.052	46%	0.456	C	S	.	.	H	α-helix	trans	-56.8	-30.2	172.2	-83.4	167.1	0	0	0	112.3	K107 A111 L112 L113 R121 Y147 Q184 L185 L222	K107-L109 PolarHBondContact O-N 3.43Å; L109-A111 VanDerWaalsContact C-N 3.32Å; L109-A111 PolarHBondContact O-N 3.26Å; L109-L112 PolarHBondContact O-N 3.07Å; L109-L113 HydrophobicContact CD2-CD1 3.99Å; L109-L113 PolarHBondContact O-N 2.79Å; L109-R121 PolarHBondContact O-NH1 3.43Å; L109-Y147 HydrophobicContact CD1-CD1 3.66Å; L109-Y147 HydrophobicContact CD1-CE1 3.67Å; L109-Y147 HydrophobicContact CD1-CG 4.25Å; L109-Y147 HydrophobicContact CD2-CE1 4.25Å; L109-Y147 HydrophobicContact CG-CD1 4.13Å; L109-Y147 HydrophobicContact CG-CE1 3.58Å; L109-Q184 HydrophobicContact CD1-CB 3.89Å; L109-L185 HydrophobicContact CD1-CD1 4.3Å; L109-L185 HydrophobicContact CD1-CD2 3.89Å; L109-L185 HydrophobicContact CD1-CG 3.87Å; L109-L185 HydrophobicContact CD2-CD2 4.25Å; L109-L222 HydrophobicContact CD2-CD2 4.35Å
110	D	84.8	Confident	69.6	Low	72 Å²	72	76.3 Å²	76.3	39%	0.385	44%	0.435	S	S	.	.	H	α-helix	trans	-65.4	-34.8	177	-62	-51.6	0	0	0	112.5	N108 L112 G114 K115 D116 R121	N108-D110 PolarHBondContact O-N 2.77Å; N108-D110 WeakPolarHBondContact OD1-CA 3.33Å; N108-D110 VanDerWaalsContact OD1-CB 3.26Å; N108-D110 WeakPolarHBondContact OD1-CB 3.48Å; N108-D110 PolarHBondContact OD1-N 2.99Å; D110-L112 VanDerWaalsContact C-N 3.31Å; D110-G114 WeakPolarHBondContact CA-O 3.32Å; D110-G114 CarbonylContact O-C 3.15Å; D110-G114 WeakPolarHBondContact O-CA 3.49Å; D110-G114 PolarHBondContact O-N 3.24Å; D110-K115 HydrophobicContact CB-CG 4.41Å; D110-K115 WeakPolarHBondContact OD1-CA 3.08Å; D110-D116 PolarHBondContact OD1-N 3.14Å; D110-R121 IonicContact OD1-CZ 3.87Å; D110-R121 IonicContact OD1-NH2 3.71Å; D110-R121 PolarHBondContact OD1-NH2 3.14Å
111	A	83.6	Confident	71.8	Confident	76 Å²	76	75.5 Å²	75.5	63%	0.628	43%	0.428	S	S	*	.	H	α-helix	trans	-68.6	-33.4	176.2	0	0	0	0	0	111.9	N108 L109	N108-A111 HydrophobicContact CB-CB 4.19Å; N108-A111 WeakPolarHBondContact O-CB 3.35Å; N108-A111 PolarHBondContact O-N 3.46Å; N108-A111 VanDerWaalsContact O-N 3.14Å; N108-A111 PolarHBondContact OD1-N 3.27Å; N108-A111 VanDerWaalsContact OD1-N 3.14Å; L109-A111 VanDerWaalsContact C-N 3.32Å; L109-A111 PolarHBondContact O-N 3.26Å
112	L	83.8	Confident	73.5	Confident	81 Å²	81	72.7 Å²	72.7	42%	0.424	41%	0.413	S	S	.	.	H	α-helix	trans	-85.8	-44.1	-175	-173.6	67.5	0	0	0	113.4	L109 D110 K221 L222	L109-L112 PolarHBondContact O-N 3.07Å; D110-L112 VanDerWaalsContact C-N 3.31Å; L112-K221 VanDerWaalsContact CD2-O 3.29Å; L112-K221 WeakPolarHBondContact CD2-O 3.34Å; L112-L222 HydrophobicContact CD2-CD2 3.59Å
113	L	84.1	Confident	75.1	Confident	60 Å²	60	71 Å²	71	31%	0.314	40%	0.404	S	S	.	.	H	α-helix	trans	-111.3	3.4	-174.1	-47.4	171.7	0	0	0	112.8	L109 F201 L222	L109-L113 HydrophobicContact CD2-CD1 3.99Å; L109-L113 PolarHBondContact O-N 2.79Å; L113-F201 HydrophobicContact CD1-CE1 4.26Å; L113-F201 HydrophobicContact CD1-CE2 4.17Å; L113-F201 HydrophobicContact CD1-CZ 3.59Å; L113-L222 HydrophobicContact CD1-CD2 3.91Å; L113-L222 HydrophobicContact CD2-CD2 3.94Å; L113-L222 HydrophobicContact CG-CD2 4.25Å
114	G	81.8	Confident	76.6	Confident	37 Å²	37	72 Å²	72	38%	0.381	41%	0.411	S	S	.	.			trans	83	167.8	-170.2	0	0	0	0	0	112.4	D110 D116 R121	D110-G114 WeakPolarHBondContact CA-O 3.32Å; D110-G114 CarbonylContact O-C 3.15Å; D110-G114 WeakPolarHBondContact O-CA 3.49Å; D110-G114 PolarHBondContact O-N 3.24Å; G114-D116 PolarHBondContact O-N 3.45Å; G114-R121 PolarHBondContact O-NH2 2.92Å
115	K	78.1	Confident	78.4	Confident	187 Å²	187	64.8 Å²	64.8	81%	0.813	38%	0.38	S	S	*	.			trans	-66	129.4	178.7	-66.2	-176.9	-179.9	-179.3	0	110.3	D110	D110-K115 HydrophobicContact CB-CG 4.41Å; D110-K115 WeakPolarHBondContact OD1-CA 3.08Å
116	D	69.5	Low	80.5	Confident	60 Å²	60	64.3 Å²	64.3	32%	0.321	37%	0.373	S	S	.	.			trans	-84.8	139.1	161.9	78.2	56.1	0	0	0	109.2	D110 G114 G118 A119 R121	D110-D116 PolarHBondContact OD1-N 3.14Å; G114-D116 PolarHBondContact O-N 3.45Å; D116-G118 PolarHBondContact O-N 2.74Å; D116-G118 VanDerWaalsContact OD1-CA 3.26Å; D116-G118 WeakPolarHBondContact OD1-CA 3.44Å; D116-G118 PolarHBondContact OD1-N 3.47Å; D116-A119 WeakPolarHBondContact CB-O 3.23Å; D116-A119 VanDerWaalsContact CG-O 3.29Å; D116-A119 PolarHBondContact OD1-N 3.13Å; D116-R121 HydrophobicContact CB-CG 4.49Å; D116-R121 IonicContact OD2-CZ 3.38Å; D116-R121 IonicContact OD2-NE 2.67Å; D116-R121 PolarHBondContact OD2-NE 2.89Å; D116-R121 IonicContact OD2-NH2 2.71Å
117	L	61.9	Low	82.5	Confident	180 Å²	180	60.3 Å²	60.3	94%	0.942	35%	0.349	S	S	*	.	S	Bend	trans	-83.4	44.6	177.2	-64.4	169.5	0	0	0	110.1
118	G	61.9	Low	84	Confident	68 Å²	68	54.8 Å²	54.8	70%	0.701	33%	0.327	S	S	*	.	S	Bend	trans	80.3	15.3	-177.2	0	0	0	0	0	114.8	D116	D116-G118 PolarHBondContact O-N 2.74Å; D116-G118 VanDerWaalsContact OD1-CA 3.26Å; D116-G118 WeakPolarHBondContact OD1-CA 3.44Å; D116-G118 PolarHBondContact OD1-N 3.47Å
119	A	73.6	Confident	84.8	Confident	64 Å²	64	52 Å²	52	53%	0.529	31%	0.313	S	S	.	.			trans	-97.9	130.4	177.6	0	0	0	0	0	110.4	D116 R121	D116-A119 WeakPolarHBondContact CB-O 3.23Å; D116-A119 VanDerWaalsContact CG-O 3.29Å; D116-A119 PolarHBondContact OD1-N 3.13Å; A119-R121 PolarHBondContact O-N 3.2Å
120	L	79.9	Confident	85.2	Confident	33 Å²	33	55.8 Å²	55.8	17%	0.173	35%	0.346	C	S	.	.			trans	-57.9	132.9	175	-175.2	65.7	0	0	0	110.3	D122 L150 R180 F183	L120-D122 VanDerWaalsContact CD2-OD1 3.28Å; L120-D122 WeakPolarHBondContact CD2-OD1 3.47Å; L120-D122 WeakPolarHBondContact CG-OD1 3.26Å; L120-D122 PolarHBondContact O-N 3.06Å; L120-D122 VanDerWaalsContact O-N 3.13Å; L120-L150 HydrophobicContact CD2-CD2 4.3Å; L120-R180 HydrophobicContact CD2-CB 4.44Å; L120-F183 HydrophobicContact CD1-CB 3.92Å; L120-F183 VanDerWaalsContact CD1-O 3.3Å; L120-F183 WeakPolarHBondContact CD1-O 3.16Å
121	R	88.2	Confident	85.5	Confident	12 Å²	12	57.5 Å²	57.5	5%	0.045	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	92.8	178.1	-64.2	164.3	-171	-129.2	-4.5	109.1	L109 D110 G114 D116 A119 L185 G186 F201	L109-R121 PolarHBondContact O-NH1 3.43Å; D110-R121 IonicContact OD1-CZ 3.87Å; D110-R121 IonicContact OD1-NH2 3.71Å; D110-R121 PolarHBondContact OD1-NH2 3.14Å; G114-R121 PolarHBondContact O-NH2 2.92Å; D116-R121 HydrophobicContact CB-CG 4.49Å; D116-R121 IonicContact OD2-CZ 3.38Å; D116-R121 IonicContact OD2-NE 2.67Å; D116-R121 PolarHBondContact OD2-NE 2.89Å; D116-R121 IonicContact OD2-NH2 2.71Å; A119-R121 PolarHBondContact O-N 3.2Å; R121-L185 HydrophobicContact CB-CD2 3.95Å; R121-G186 PolarHBondContact O-N 3.21Å; R121-F201 HydrophobicContact CB-CE2 3.95Å; R121-F201 HydrophobicContact CB-CZ 3.9Å; R121-F201 HydrophobicContact CG-CZ 4.25Å
122	D	90.3	Very high	85.9	Confident	46 Å²	46	55.5 Å²	55.5	25%	0.246	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	123.7	-175.7	-75.3	-27.2	0	0	0	112	L120 G186 F201 S202	L120-D122 VanDerWaalsContact CD2-OD1 3.28Å; L120-D122 WeakPolarHBondContact CD2-OD1 3.47Å; L120-D122 WeakPolarHBondContact CG-OD1 3.26Å; L120-D122 PolarHBondContact O-N 3.06Å; L120-D122 VanDerWaalsContact O-N 3.13Å; D122-G186 WeakPolarHBondContact OD1-CA 3.43Å; D122-F201 WeakPolarHBondContact O-CA 3.27Å; D122-S202 PolarHBondContact O-N 2.73Å
123	I	94.1	Very high	86.4	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	112.6	168.9	-57.9	163.3	0	0	0	106.9	I125 L185 G186 F187 T188 M199 F201 L219 L222	I123-I125 HydrophobicContact CG2-CD1 3.87Å; I123-I125 HydrophobicContact CG2-CG1 3.91Å; I123-L185 HydrophobicContact CD1-CD2 4.36Å; I123-G186 WeakPolarHBondContact CB-O 2.96Å; I123-G186 PolarHBondContact N-O 2.89Å; I123-F187 HydrophobicContact CB-CD2 4.44Å; I123-F187 HydrophobicContact CD1-CD2 4.28Å; I123-F187 HydrophobicContact CG2-CD2 4.38Å; I123-T188 PolarHBondContact O-N 2.88Å; I123-M199 HydrophobicContact CG2-CG 4.01Å; I123-M199 HydrophobicContact CG2-SD 3.83Å; I123-F201 HydrophobicContact CG1-CD2 3.76Å; I123-F201 HydrophobicContact CG1-CE2 4.1Å; I123-L219 HydrophobicContact CD1-CD2 3.91Å; I123-L219 HydrophobicContact CG2-CD2 4.27Å; I123-L222 HydrophobicContact CD1-CD1 4.09Å
124	V	95.7	Very high	86.9	Confident	30 Å²	30	49 Å²	49	18%	0.182	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124	176.6	-176.2	0	0	0	0	108.8	T188 I190 M199 K200 V203	V124-T188 CarbonylContact C-O 3.57Å; V124-T188 WeakPolarHBondContact CA-O 3.37Å; V124-T188 HydrophobicContact CG1-CG2 4.45Å; V124-I190 HydrophobicContact CG1-CD1 3.81Å; V124-I190 HydrophobicContact CG1-CG1 4.34Å; V124-M199 CarbonylContact O-C 3.58Å; V124-M199 VanDerWaalsContact O-CA 3.29Å; V124-M199 WeakPolarHBondContact O-CA 3.23Å; V124-K200 PolarHBondContact N-O 2.81Å; V124-K200 PolarHBondContact O-N 3.36Å; V124-V203 HydrophobicContact CG2-CG2 4.17Å
125	I	97.8	Very high	87.5	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	125	-176.1	-59.7	175.8	0	0	0	108.7	I123 L136 F187 T188 L189 I190 L197 E198 M199 V215 L219	I123-I125 HydrophobicContact CG2-CD1 3.87Å; I123-I125 HydrophobicContact CG2-CG1 3.91Å; I125-L136 HydrophobicContact CD1-CD1 3.41Å; I125-L136 VanDerWaalsContact CD1-CD1 3.41Å; I125-L136 HydrophobicContact CD1-CD2 4.08Å; I125-L136 HydrophobicContact CD1-CG 4.33Å; I125-L136 HydrophobicContact CG2-CD2 3.96Å; I125-F187 HydrophobicContact CD1-CE1 4.35Å; I125-F187 HydrophobicContact CD1-CE2 4.07Å; I125-F187 HydrophobicContact CD1-CZ 3.77Å; I125-T188 PolarHBondContact N-O 3.45Å; I125-L189 HydrophobicContact CB-CD1 4.39Å; I125-L189 HydrophobicContact CG2-CD1 4.21Å; I125-L189 CarbonylContact O-C 3.57Å; I125-L189 WeakPolarHBondContact O-CA 3.36Å; I125-I190 PolarHBondContact O-N 3.23Å; I125-L197 HydrophobicContact CG2-CD1 4.18Å; I125-L197 HydrophobicContact CG2-CD2 3.93Å; I125-L197 HydrophobicContact CG2-CG 3.98Å; I125-E198 CarbonylContact C-O 3.54Å; I125-E198 VanDerWaalsContact CA-O 3.32Å; I125-E198 WeakPolarHBondContact CA-O 3.25Å; I125-M199 HydrophobicContact CD1-CG 4.43Å; I125-M199 HydrophobicContact CG1-CB 4.03Å; I125-M199 HydrophobicContact CG1-CG 3.8Å; I125-M199 HydrophobicContact CG1-SD 4.49Å; I125-V215 HydrophobicContact CD1-CG1 4.11Å; I125-L219 HydrophobicContact CD1-CD1 4.44Å
126	N	97.5	Very high	88.3	Confident	17 Å²	17	38.6 Å²	38.6	9%	0.091	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	126.6	168.9	-44.3	-58.1	0	0	0	109.1	I190 K192 V194 E198	N126-I190 VanDerWaalsContact CA-O 3.3Å; N126-I190 WeakPolarHBondContact CA-O 3.32Å; N126-I190 VanDerWaalsContact OD1-CB 3.29Å; N126-I190 WeakPolarHBondContact OD1-CB 3.35Å; N126-I190 WeakPolarHBondContact OD1-CD1 3.32Å; N126-K192 HydrophobicContact CB-CB 4.09Å; N126-K192 HydrophobicContact CB-CD 3.95Å; N126-V194 HydrophobicContact CB-CG1 4.34Å; N126-E198 HydrophobicContact CB-CG 3.53Å; N126-E198 WeakPolarHBondContact CB-OE1 3.25Å; N126-E198 PolarHBondContact N-O 3.28Å; N126-E198 WeakPolarHBondContact ND2-CG 3.32Å; N126-E198 PolarHBondContact ND2-OE1 3.36Å; N126-E198 PolarHBondContact O-N 2.89Å
127	A	97.6	Very high	89.5	Confident	1 Å²	1	36 Å²	36	1%	0.008	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	149.1	-179	0	0	0	0	0	110.7	P133 L189 I190 W191 K192 L197	A127-P133 HydrophobicContact CB-CG 4.04Å; A127-L189 HydrophobicContact CB-CD1 3.92Å; A127-I190 PolarHBondContact N-O 3.4Å; A127-W191 HydrophobicContact CB-CE3 4.19Å; A127-W191 HydrophobicContact CB-CZ3 3.91Å; A127-W191 WeakPolarHBondContact O-CA 3.32Å; A127-K192 CarbonylContact C-O 3.52Å; A127-K192 PolarHBondContact O-N 3.23Å; A127-L197 HydrophobicContact CB-CD1 4.2Å
128	N	96.1	Very high	91.1	Very high	36 Å²	36	27.5 Å²	27.5	19%	0.193	18%	0.184	C	C	.	.			trans	-82.6	123.1	176.7	-161.8	-40.2	0	0	0	110	A130 Q131 K192 N193 V194	N128-A130 PolarHBondContact O-N 3.28Å; N128-A130 WeakPolarHBondContact OD1-CB 3.21Å; N128-A130 PolarHBondContact OD1-N 3.49Å; N128-Q131 CarbonylContact O-C 3.59Å; N128-Q131 PolarHBondContact O-N 3.45Å; N128-Q131 VanDerWaalsContact O-O 3.13Å; N128-K192 VanDerWaalsContact CA-O 3.3Å; N128-K192 WeakPolarHBondContact CA-O 3.4Å; N128-N193 PolarHBondContact ND2-OD1 3.08Å; N128-N193 VanDerWaalsContact ND2-OD1 3.17Å; N128-V194 HydrophobicContact CB-CG2 4.47Å; N128-V194 PolarHBondContact ND2-O 2.88Å
129	P	95.3	Very high	92.7	Very high	21 Å²	21	24.3 Å²	24.3	14%	0.136	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-17.6	178.9	26	-33.5	0	0	0	113.3	Q131 V159 V162 L166 W191	P129-Q131 VanDerWaalsContact C-N 3.26Å; P129-V159 HydrophobicContact CG-CG1 3.73Å; P129-V159 HydrophobicContact CG-CG2 4.05Å; P129-V162 HydrophobicContact CB-CG1 4.45Å; P129-V162 HydrophobicContact CB-CG2 4.32Å; P129-V162 HydrophobicContact CG-CG2 4.29Å; P129-L166 HydrophobicContact CB-CD1 3.77Å; P129-W191 HydrophobicContact CB-CD2 4.18Å; P129-W191 HydrophobicContact CB-CE3 3.76Å; P129-W191 HydrophobicContact CB-CZ3 4.33Å; P129-W191 HydrophobicContact CG-CB 4.45Å; P129-W191 HydrophobicContact CG-CE3 4.44Å
130	A	93.3	Very high	93.8	Very high	90 Å²	90	21.7 Å²	21.7	74%	0.744	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-21.2	172.5	0	0	0	0	0	113.1	N128	N128-A130 PolarHBondContact O-N 3.28Å; N128-A130 WeakPolarHBondContact OD1-CB 3.21Å; N128-A130 PolarHBondContact OD1-N 3.49Å
131	Q	91.3	Very high	94.4	Very high	109 Å²	109	22 Å²	22	51%	0.509	13%	0.13	S	C	.	.	S	Bend	trans	-136.2	75.5	178.1	-169.7	176.5	2.6	0	0	109.3	N128 P129	N128-Q131 CarbonylContact O-C 3.59Å; N128-Q131 PolarHBondContact O-N 3.45Å; N128-Q131 VanDerWaalsContact O-O 3.13Å; P129-Q131 VanDerWaalsContact C-N 3.26Å
132	P	92.9	Very high	94.7	Very high	33 Å²	33	21.5 Å²	21.5	21%	0.214	13%	0.128	C	C	.	.			trans	-68.2	127.8	-174.8	26.5	-33	0	0	0	111.4	L134 L166 W191 Q290 L320	P132-L134 PolarHBondContact O-N 2.9Å; P132-L134 VanDerWaalsContact O-N 3.13Å; P132-L166 HydrophobicContact CB-CD2 3.86Å; P132-L166 HydrophobicContact CG-CD2 4.43Å; P132-W191 HydrophobicContact CB-CH2 4.05Å; P132-W191 HydrophobicContact CB-CZ3 4.4Å; P132-Q290 PolarHBondContact O-NE2 3.46Å; P132-L320 HydrophobicContact CB-CD1 3.97Å
133	P	93.8	Very high	94.9	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.013	12%	0.116	C	C	.	.			trans	-77.2	99.5	-174.8	32	-37.9	0	0	0	111.2	A127 T135 L136 L197 E212	A127-P133 HydrophobicContact CB-CG 4.04Å; P133-T135 VanDerWaalsContact C-N 3.35Å; P133-T135 PolarHBondContact O-N 3.43Å; P133-L136 HydrophobicContact CB-CB 3.84Å; P133-L136 HydrophobicContact CG-CB 3.81Å; P133-L136 HydrophobicContact CG-CD2 3.72Å; P133-L136 HydrophobicContact CG-CG 4.42Å; P133-L136 VanDerWaalsContact O-CB 3.3Å; P133-L136 WeakPolarHBondContact O-CB 3.49Å; P133-L136 PolarHBondContact O-N 3.28Å; P133-L197 HydrophobicContact CB-CD1 3.47Å; P133-L197 VanDerWaalsContact CB-CD1 3.47Å; P133-L197 HydrophobicContact CG-CD1 3.53Å; P133-E212 WeakPolarHBondContact CA-OE2 3.29Å; P133-E212 VanDerWaalsContact CB-CD 3.45Å; P133-E212 HydrophobicContact CB-CG 4.16Å; P133-E212 WeakPolarHBondContact CB-OE2 3.32Å
134	L	93.7	Very high	94.8	Very high	4 Å²	4	21.8 Å²	21.8	2%	0.021	13%	0.133	C	C	.	.	H	α-helix	trans	-66.8	-36.8	-177.1	-66.6	-170.6	0	0	0	112.8	P132 L136 L137 V138 C286 Q290 A317 L320 L321	P132-L134 PolarHBondContact O-N 2.9Å; P132-L134 VanDerWaalsContact O-N 3.13Å; L134-L136 PolarHBondContact O-N 3.13Å; L134-L137 PolarHBondContact O-N 3.38Å; L134-L137 VanDerWaalsContact O-N 3.12Å; L134-V138 PolarHBondContact O-N 3.48Å; L134-C286 HydrophobicContact CB-CB 4.05Å; L134-Q290 HydrophobicContact CD1-CG 3.41Å; L134-Q290 VanDerWaalsContact CD1-CG 3.41Å; L134-Q290 HydrophobicContact CG-CG 3.93Å; L134-A317 HydrophobicContact CB-CB 4.07Å; L134-A317 HydrophobicContact CD1-CB 4.49Å; L134-A317 HydrophobicContact CD2-CB 4.25Å; L134-A317 HydrophobicContact CG-CB 4.5Å; L134-L320 HydrophobicContact CD2-CB 3.75Å; L134-L320 HydrophobicContact CD2-CD1 4.11Å; L134-L320 HydrophobicContact CD2-CG 4.41Å; L134-L321 HydrophobicContact CD1-CD1 3.64Å; L134-L321 HydrophobicContact CD1-CD2 3.52Å; L134-L321 HydrophobicContact CD1-CG 3.54Å
135	T	95.6	Very high	94.5	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-58.1	-37.9	178.3	-41.7	0	0	0	0	110.1	P133 L137 V138 L139 E212 A216 F244 I282	P133-T135 VanDerWaalsContact C-N 3.35Å; P133-T135 PolarHBondContact O-N 3.43Å; T135-L137 VanDerWaalsContact C-N 3.35Å; T135-L137 PolarHBondContact O-N 2.94Å; T135-V138 PolarHBondContact O-N 3.39Å; T135-L139 HydrophobicContact CG2-CD1 4Å; T135-L139 WeakPolarHBondContact O-CG 3.46Å; T135-L139 PolarHBondContact O-N 2.85Å; T135-E212 WeakPolarHBondContact CB-OE1 3.31Å; T135-E212 PolarHBondContact N-OE1 3.1Å; T135-E212 PolarHBondContact OG1-OE1 3.23Å; T135-A216 HydrophobicContact CG2-CB 3.85Å; T135-F244 HydrophobicContact CG2-CZ 4.22Å; T135-F244 WeakPolarHBondContact OG1-CZ 3.41Å; T135-I282 HydrophobicContact CG2-CG2 3.86Å
136	L	95.3	Very high	94.1	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-61.2	-42.5	178.7	-174.3	68.2	0	0	0	112.3	I125 P133 L134 L139 H140 F187 L189 V215 L219	I125-L136 HydrophobicContact CD1-CD1 3.41Å; I125-L136 VanDerWaalsContact CD1-CD1 3.41Å; I125-L136 HydrophobicContact CD1-CD2 4.08Å; I125-L136 HydrophobicContact CD1-CG 4.33Å; I125-L136 HydrophobicContact CG2-CD2 3.96Å; P133-L136 HydrophobicContact CB-CB 3.84Å; P133-L136 HydrophobicContact CG-CB 3.81Å; P133-L136 HydrophobicContact CG-CD2 3.72Å; P133-L136 HydrophobicContact CG-CG 4.42Å; P133-L136 VanDerWaalsContact O-CB 3.3Å; P133-L136 WeakPolarHBondContact O-CB 3.49Å; P133-L136 PolarHBondContact O-N 3.28Å; L134-L136 PolarHBondContact O-N 3.13Å; L136-L139 PolarHBondContact O-N 2.84Å; L136-H140 VanDerWaalsContact O-CB 3.26Å; L136-H140 WeakPolarHBondContact O-CB 3.05Å; L136-H140 PolarHBondContact O-N 3.36Å; L136-F187 HydrophobicContact CD1-CE2 4.42Å; L136-F187 HydrophobicContact CD1-CZ 3.73Å; L136-F187 HydrophobicContact CD2-CZ 4.38Å; L136-F187 HydrophobicContact CG-CZ 3.99Å; L136-L189 HydrophobicContact CD2-CD1 4.02Å; L136-V215 HydrophobicContact CD1-CG1 4.22Å; L136-L219 HydrophobicContact CD1-CD1 3.39Å
137	L	93.9	Very high	93.7	Very high	6 Å²	6	27.4 Å²	27.4	3%	0.031	16%	0.156	C	C	.	.	H	α-helix	trans	-68.6	-36.9	-179.1	-61.6	-173.3	0	0	0	112.4	L134 T135 N141 C169 L170 P316 L320	L134-L137 PolarHBondContact O-N 3.38Å; L134-L137 VanDerWaalsContact O-N 3.12Å; T135-L137 VanDerWaalsContact C-N 3.35Å; T135-L137 PolarHBondContact O-N 2.94Å; L137-N141 WeakPolarHBondContact O-CB 3.48Å; L137-N141 PolarHBondContact O-N 3.26Å; L137-C169 HydrophobicContact CD1-CB 4.22Å; L137-C169 HydrophobicContact CD2-CB 4.01Å; L137-L170 HydrophobicContact CD2-CD2 3.78Å; L137-P316 HydrophobicContact CB-CB 4.31Å; L137-L320 HydrophobicContact CD1-CD1 3.29Å; L137-L320 HydrophobicContact CD1-CG 3.81Å
138	V	95.5	Very high	93.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-64.1	-48.5	174.6	-178.5	0	0	0	0	110.1	L134 T135 H140 N141 L142 I282 H313 F314 A317	L134-V138 PolarHBondContact O-N 3.48Å; T135-V138 PolarHBondContact O-N 3.39Å; V138-H140 PolarHBondContact O-N 3.24Å; V138-N141 PolarHBondContact O-N 3.3Å; V138-L142 HydrophobicContact CG1-CD1 4.27Å; V138-L142 WeakPolarHBondContact O-CG 3.35Å; V138-L142 PolarHBondContact O-N 3.1Å; V138-I282 HydrophobicContact CB-CG2 4.07Å; V138-I282 HydrophobicContact CG1-CG2 3.88Å; V138-H313 HydrophobicContact CG1-CB 4.2Å; V138-F314 HydrophobicContact CG1-CD1 4.17Å; V138-F314 HydrophobicContact CG1-CE1 4.22Å; V138-F314 HydrophobicContact CG2-CD1 3.72Å; V138-F314 HydrophobicContact CG2-CE1 4.28Å; V138-F314 HydrophobicContact CG2-CG 4.48Å; V138-A317 HydrophobicContact CG2-CB 3.77Å
139	L	96.3	Very high	93.2	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-65.8	-38.2	180	-68.6	170.4	0	0	0	112.3	T135 L136 L142 L143 A216 L219 F220 L223 L279 I282	T135-L139 HydrophobicContact CG2-CD1 4Å; T135-L139 WeakPolarHBondContact O-CG 3.46Å; T135-L139 PolarHBondContact O-N 2.85Å; L136-L139 PolarHBondContact O-N 2.84Å; L139-L142 HydrophobicContact CD2-CD1 4.45Å; L139-L142 PolarHBondContact O-N 3.07Å; L139-L143 VanDerWaalsContact O-CG 3.25Å; L139-L143 WeakPolarHBondContact O-CG 3.36Å; L139-L143 PolarHBondContact O-N 3.43Å; L139-A216 HydrophobicContact CD1-CB 3.71Å; L139-L219 HydrophobicContact CB-CB 4.24Å; L139-L219 HydrophobicContact CB-CD1 4.29Å; L139-L219 HydrophobicContact CD1-CB 4.09Å; L139-L219 HydrophobicContact CD1-CD1 4.41Å; L139-F220 HydrophobicContact CD2-CB 4.13Å; L139-F220 HydrophobicContact CD2-CD2 3.91Å; L139-L223 HydrophobicContact CD2-CD1 3.96Å; L139-L279 HydrophobicContact CD1-CD1 4.32Å; L139-L279 HydrophobicContact CD2-CD1 4.4Å; L139-I282 HydrophobicContact CD2-CD1 3.86Å
140	H	95.5	Very high	93.1	Very high	10 Å²	10	32.7 Å²	32.7	5%	0.046	17%	0.173	C	C	.	.	H	α-helix	trans	-59.6	-47.9	173	169.1	-96.4	0	0	0	111.8	L136 V138 L142 L143 C144 S151 L170 F187	L136-H140 VanDerWaalsContact O-CB 3.26Å; L136-H140 WeakPolarHBondContact O-CB 3.05Å; L136-H140 PolarHBondContact O-N 3.36Å; V138-H140 PolarHBondContact O-N 3.24Å; H140-L142 VanDerWaalsContact C-N 3.32Å; H140-L142 PolarHBondContact O-N 2.92Å; H140-L143 WeakPolarHBondContact O-CB 3.43Å; H140-L143 PolarHBondContact O-N 3.49Å; H140-L143 VanDerWaalsContact O-N 3.08Å; H140-C144 PolarHBondContact CE1-SG 3.06Å; H140-C144 PolarHBondContact NE2-SG 3.45Å; H140-C144 PolarHBondContact O-N 3.18Å; H140-C144 PolarHBondContact O-SG 2.98Å; H140-C144 VanDerWaalsContact O-SG 3.37Å; H140-S151 PolarHBondContact NE2-OG 2.82Å; H140-L170 HydrophobicContact CB-CD2 4.31Å; H140-F187 HydrophobicContact CB-CE1 4.26Å; H140-F187 HydrophobicContact CB-CE2 4.26Å; H140-F187 HydrophobicContact CB-CZ 3.89Å; H140-F187 AromaticContact CD2-CD1 3.55Å; H140-F187 AromaticContact CD2-CD2 3.97Å; H140-F187 AromaticContact CD2-CE1 3.73Å; H140-F187 AromaticContact CD2-CG 3.65Å; H140-F187 AromaticContact CD2-CZ 3.99Å
141	N	93.4	Very high	93.1	Very high	40 Å²	40	29 Å²	29	21%	0.214	14%	0.142	C	C	.	.	H	α-helix	trans	-62.2	-41.2	178.5	179.2	54.5	0	0	0	112	L137 V138 C144 Q145 P316	L137-N141 WeakPolarHBondContact O-CB 3.48Å; L137-N141 PolarHBondContact O-N 3.26Å; V138-N141 PolarHBondContact O-N 3.3Å; N141-C144 PolarHBondContact O-N 3.49Å; N141-Q145 WeakPolarHBondContact O-CG 3.28Å; N141-Q145 PolarHBondContact O-N 3.43Å; N141-P316 HydrophobicContact CB-CG 3.76Å
142	L	93.9	Very high	93.3	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.1	-45	171.3	-70.4	170.9	0	0	0	110.9	F103 V138 L139 H140 C144 Q145 H146 L223 I282 H313	F103-L142 HydrophobicContact CD2-CD2 4.38Å; F103-L142 HydrophobicContact CE1-CD1 4.23Å; F103-L142 HydrophobicContact CE2-CD1 4.49Å; F103-L142 HydrophobicContact CE2-CD2 3.81Å; F103-L142 HydrophobicContact CZ-CD1 3.81Å; F103-L142 HydrophobicContact CZ-CD2 3.96Å; V138-L142 HydrophobicContact CG1-CD1 4.27Å; V138-L142 WeakPolarHBondContact O-CG 3.35Å; V138-L142 PolarHBondContact O-N 3.1Å; L139-L142 HydrophobicContact CD2-CD1 4.45Å; L139-L142 PolarHBondContact O-N 3.07Å; H140-L142 VanDerWaalsContact C-N 3.32Å; H140-L142 PolarHBondContact O-N 2.92Å; L142-C144 VanDerWaalsContact C-N 3.28Å; L142-C144 PolarHBondContact O-N 3.22Å; L142-Q145 WeakPolarHBondContact O-CB 3.42Å; L142-Q145 PolarHBondContact O-N 3.02Å; L142-H146 PolarHBondContact O-CD2 3.39Å; L142-H146 PolarHBondContact O-N 2.81Å; L142-L223 HydrophobicContact CB-CD1 3.55Å; L142-L223 HydrophobicContact CB-CD2 3.95Å; L142-L223 HydrophobicContact CB-CG 4.42Å; L142-L223 HydrophobicContact CD1-CD1 4.08Å; L142-L223 HydrophobicContact CG-CD1 4.47Å; L142-I282 HydrophobicContact CD1-CD1 3.98Å; L142-H313 HydrophobicContact CD2-CB 4.19Å; L142-H313 WeakPolarHBondContact CD2-ND1 3.29Å
143	L	93.6	Very high	93.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.5	-39.6	177.2	-72	165.7	0	0	0	112.1	L139 H140 Q145 H146 Y147 V149 L185 F187 L219 L222 L223	L139-L143 VanDerWaalsContact O-CG 3.25Å; L139-L143 WeakPolarHBondContact O-CG 3.36Å; L139-L143 PolarHBondContact O-N 3.43Å; H140-L143 WeakPolarHBondContact O-CB 3.43Å; H140-L143 PolarHBondContact O-N 3.49Å; H140-L143 VanDerWaalsContact O-N 3.08Å; L143-Q145 VanDerWaalsContact C-N 3.26Å; L143-Q145 PolarHBondContact O-N 3.42Å; L143-H146 PolarHBondContact O-N 2.92Å; L143-H146 VanDerWaalsContact O-N 3.14Å; L143-Y147 HydrophobicContact CD2-CD2 3.81Å; L143-Y147 HydrophobicContact CD2-CE2 3.88Å; L143-Y147 PolarHBondContact O-N 2.98Å; L143-V149 HydrophobicContact CB-CG2 4.12Å; L143-L185 HydrophobicContact CD2-CD1 4.14Å; L143-F187 HydrophobicContact CD1-CD2 4.42Å; L143-F187 HydrophobicContact CD1-CE2 4.28Å; L143-L219 HydrophobicContact CD1-CB 4.38Å; L143-L219 HydrophobicContact CD1-CD2 3.92Å; L143-L222 HydrophobicContact CD2-CB 3.9Å; L143-L222 HydrophobicContact CD2-CD1 4.25Å; L143-L223 HydrophobicContact CD2-CD1 4.45Å; L143-L223 HydrophobicContact CD2-CD2 3.69Å; L143-L223 HydrophobicContact CD2-CG 3.81Å; L143-L223 HydrophobicContact CG-CD1 4.33Å; L143-L223 HydrophobicContact CG-CD2 4.02Å; L143-L223 HydrophobicContact CG-CG 4.19Å
144	C	92.3	Very high	93.5	Very high	52 Å²	52	30.1 Å²	30.1	35%	0.351	15%	0.149	S	C	.	.	H	α-helix	trans	-65.1	-26	175.6	-69.3	0	0	0	0	113.6	H140 N141 L142	H140-C144 PolarHBondContact CE1-SG 3.06Å; H140-C144 PolarHBondContact NE2-SG 3.45Å; H140-C144 PolarHBondContact O-N 3.18Å; H140-C144 PolarHBondContact O-SG 2.98Å; H140-C144 VanDerWaalsContact O-SG 3.37Å; N141-C144 PolarHBondContact O-N 3.49Å; L142-C144 VanDerWaalsContact C-N 3.28Å; L142-C144 PolarHBondContact O-N 3.22Å
145	Q	90.6	Very high	93.6	Very high	112 Å²	112	33.3 Å²	33.3	52%	0.523	17%	0.168	S	C	.	.	H	α-helix	trans	-77.2	-27.6	174.1	-67.3	173.6	3	0	0	112.1	N141 L142 L143	N141-Q145 WeakPolarHBondContact O-CG 3.28Å; N141-Q145 PolarHBondContact O-N 3.43Å; L142-Q145 WeakPolarHBondContact O-CB 3.42Å; L142-Q145 PolarHBondContact O-N 3.02Å; L143-Q145 VanDerWaalsContact C-N 3.26Å; L143-Q145 PolarHBondContact O-N 3.42Å
146	H	88.6	Confident	93.7	Very high	40 Å²	40	36.8 Å²	36.8	19%	0.185	18%	0.184	C	C	.	.	H	α-helix	trans	-98	-30.6	-175.2	-77.4	-86.5	0	0	0	114	F103 L142 L143 L223	F103-H146 WeakPolarHBondContact CB-CE1 3.5Å; F103-H146 WeakPolarHBondContact CB-NE2 3.39Å; F103-H146 AromaticContact CG-NE2 3.83Å; F103-H146 PolarHBondContact O-CE1 3.37Å; F103-H146 PolarHBondContact O-ND1 2.97Å; L142-H146 PolarHBondContact O-CD2 3.39Å; L142-H146 PolarHBondContact O-N 2.81Å; L143-H146 PolarHBondContact O-N 2.92Å; L143-H146 VanDerWaalsContact O-N 3.14Å; H146-L223 HydrophobicContact CB-CD2 4.1Å
147	Y	90	Very high	93.8	Very high	13 Å²	13	42 Å²	42	5%	0.051	22%	0.221	C	C	.	.	S	Bend	trans	-133.3	156.7	-172.3	-58	-67	0	0	0	111.8	T106 L109 L143 V149 L185 L222	T106-Y147 PolarHBondContact O-OH 3.38Å; L109-Y147 HydrophobicContact CD1-CD1 3.66Å; L109-Y147 HydrophobicContact CD1-CE1 3.67Å; L109-Y147 HydrophobicContact CD1-CG 4.25Å; L109-Y147 HydrophobicContact CD2-CE1 4.25Å; L109-Y147 HydrophobicContact CG-CD1 4.13Å; L109-Y147 HydrophobicContact CG-CE1 3.58Å; L143-Y147 HydrophobicContact CD2-CD2 3.81Å; L143-Y147 HydrophobicContact CD2-CE2 3.88Å; L143-Y147 PolarHBondContact O-N 2.98Å; Y147-V149 PolarHBondContact O-N 3.41Å; Y147-V149 VanDerWaalsContact O-N 3.1Å; Y147-L185 HydrophobicContact CD2-CD1 3.65Å; Y147-L185 HydrophobicContact CE2-CD1 4.32Å; Y147-L185 HydrophobicContact CG-CD1 3.93Å; Y147-L222 HydrophobicContact CE2-CB 4.49Å; Y147-L222 VanDerWaalsContact CE2-O 3.32Å; Y147-L222 WeakPolarHBondContact CE2-O 3.49Å; Y147-L222 PolarHBondContact OH-O 3.06Å
148	R	90.6	Very high	93.9	Very high	134 Å²	134	44.2 Å²	44.2	51%	0.506	24%	0.237	S	C	.	.			trans	-75.2	96.1	164	-66.2	175.9	-68.1	169.2	3.1	108.6	M182 F183 Q184 L185	R148-M182 WeakPolarHBondContact CD-O 3.41Å; R148-M182 PolarHBondContact NE-O 3.39Å; R148-M182 PolarHBondContact NH1-O 2.63Å; R148-F183 HydrophobicContact CB-CD1 4.23Å; R148-Q184 PolarHBondContact O-N 2.96Å; R148-L185 PolarHBondContact O-N 3.24Å
149	V	92.3	Very high	93.9	Very high	9 Å²	9	45.2 Å²	45.2	6%	0.055	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	124.1	-178.1	-174.1	0	0	0	0	110.4	L143 Y147 S151 L185 F187	L143-V149 HydrophobicContact CB-CG2 4.12Å; Y147-V149 PolarHBondContact O-N 3.41Å; Y147-V149 VanDerWaalsContact O-N 3.1Å; V149-S151 PolarHBondContact O-N 2.83Å; V149-L185 CarbonylContact C-O 3.51Å; V149-L185 WeakPolarHBondContact CA-O 3.48Å; V149-L185 HydrophobicContact CG1-CB 4.44Å; V149-L185 HydrophobicContact CG2-CB 4.29Å; V149-L185 HydrophobicContact CG2-CD1 4.37Å; V149-F187 HydrophobicContact CG1-CB 3.52Å; V149-F187 HydrophobicContact CG1-CG 4.49Å
150	L	93.2	Very high	93.7	Very high	26 Å²	26	51.1 Å²	51.1	14%	0.136	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	105.7	168.5	176.5	60.7	0	0	0	108.9	L120 H174 R180 F183 L185 F187	L120-L150 HydrophobicContact CD2-CD2 4.3Å; L150-H174 HydrophobicContact CD1-CB 4.24Å; L150-R180 HydrophobicContact CD2-CG 4.2Å; L150-F183 HydrophobicContact CB-CB 4.03Å; L150-F183 HydrophobicContact CB-CD1 3.81Å; L150-F183 HydrophobicContact CB-CD2 3.82Å; L150-F183 HydrophobicContact CB-CE1 4.17Å; L150-F183 HydrophobicContact CB-CE2 4.16Å; L150-F183 HydrophobicContact CB-CG 3.62Å; L150-F183 HydrophobicContact CB-CZ 4.33Å; L150-F183 HydrophobicContact CD1-CD2 4.36Å; L150-F183 HydrophobicContact CD1-CE1 4.44Å; L150-F183 HydrophobicContact CD1-CE2 3.88Å; L150-F183 HydrophobicContact CD1-CZ 3.94Å; L150-F183 HydrophobicContact CD2-CD2 4.25Å; L150-F183 HydrophobicContact CD2-CE2 4.43Å; L150-F183 HydrophobicContact CG-CD2 4.37Å; L150-F183 HydrophobicContact CG-CE2 4.38Å; L150-L185 PolarHBondContact N-O 2.96Å; L150-F187 PolarHBondContact O-N 3.28Å
151	S	93.8	Very high	93.5	Very high	14 Å²	14	55 Å²	55	10%	0.098	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.6	-174.7	-53.8	0	0	0	0	111.8	H140 V149 F187	H140-S151 PolarHBondContact NE2-OG 2.82Å; V149-S151 PolarHBondContact O-N 2.83Å; S151-F187 CarbonylContact C-O 3.52Å; S151-F187 WeakPolarHBondContact CA-O 3.33Å
152	T	93.8	Very high	93.5	Very high	42 Å²	42	54 Å²	54	26%	0.258	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	142	177.4	59.9	0	0	0	0	111.7	F187 T188 L189	T152-F187 PolarHBondContact N-O 3.31Å; T152-T188 WeakPolarHBondContact O-CA 3.26Å; T152-T188 WeakPolarHBondContact OG1-CB 3.15Å; T152-T188 WeakPolarHBondContact OG1-CG2 3.18Å; T152-T188 PolarHBondContact OG1-OG1 3.32Å; T152-L189 PolarHBondContact O-N 3.37Å
153	V	95.4	Very high	93.4	Very high	25 Å²	25	56.7 Å²	56.7	15%	0.152	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	127.8	175	-177.5	0	0	0	0	109	L170 L189	V153-L170 HydrophobicContact CG2-CB 4.08Å; V153-L170 HydrophobicContact CG2-CD1 3.69Å; V153-L170 HydrophobicContact CG2-CG 3.72Å; V153-L189 CarbonylContact C-O 3.58Å; V153-L189 VanDerWaalsContact CA-O 3.29Å; V153-L189 WeakPolarHBondContact CA-O 3.07Å; V153-L189 HydrophobicContact CG2-CB 4.49Å
154	H	95.6	Very high	93.3	Very high	100 Å²	100	61.8 Å²	61.8	46%	0.463	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	162.1	175.5	-59.2	-61.6	0	0	0	111	L189 I190 W191	H154-L189 PolarHBondContact N-O 3.02Å; H154-I190 HydrophobicContact CB-CG1 4.32Å; H154-I190 HydrophobicContact CB-CG2 4.45Å; H154-I190 WeakPolarHBondContact O-CA 3.49Å; H154-W191 PolarHBondContact O-N 3.28Å
155	V	97.2	Very high	93.3	Very high	70 Å²	70	63.5 Å²	63.5	42%	0.424	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.1	173.5	-176.1	0	0	0	0	107.8	V159 V162 L167	V155-V159 HydrophobicContact CG1-CB 4.32Å; V155-V162 HydrophobicContact CG1-CG2 3.77Å; V155-V162 HydrophobicContact CG2-CB 4.33Å; V155-V162 HydrophobicContact CG2-CG2 3.94Å; V155-L167 HydrophobicContact CG2-CD2 3.52Å
156	H	97.7	Very high	93.4	Very high	75 Å²	75	58.4 Å²	58.4	35%	0.347	34%	0.338	S	S	.	.			trans	-82.7	148.9	175.8	-175.3	-99.4	0	0	0	110.6	S158 V159 I190 W191 K192	H156-S158 VanDerWaalsContact ND1-CB 3.32Å; H156-S158 WeakPolarHBondContact ND1-CB 3.43Å; H156-S158 PolarHBondContact ND1-N 3.29Å; H156-S158 VanDerWaalsContact ND1-N 3.2Å; H156-S158 PolarHBondContact ND1-OG 2.95Å; H156-S158 PolarHBondContact O-N 3.18Å; H156-V159 PolarHBondContact O-N 3.31Å; H156-I190 HydrophobicContact CB-CG2 3.93Å; H156-W191 WeakPolarHBondContact CB-O 3.41Å; H156-W191 PolarHBondContact N-O 2.94Å; H156-K192 HydrophobicContact CB-CB 3.87Å; H156-K192 HydrophobicContact CB-CG 3.85Å
157	S	96.6	Very high	93.6	Very high	113 Å²	113	60.1 Å²	60.1	79%	0.79	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-19.7	-177.6	57.5	0	0	0	0	114.9	V159	S157-V159 PolarHBondContact O-N 2.9Å
158	S	96.6	Very high	93.6	Very high	52 Å²	52	63 Å²	63	36%	0.364	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-11.1	175	62.3	0	0	0	0	114.3	H156 N193	H156-S158 VanDerWaalsContact ND1-CB 3.32Å; H156-S158 WeakPolarHBondContact ND1-CB 3.43Å; H156-S158 PolarHBondContact ND1-N 3.29Å; H156-S158 VanDerWaalsContact ND1-N 3.2Å; H156-S158 PolarHBondContact ND1-OG 2.95Å; H156-S158 PolarHBondContact O-N 3.18Å; S158-N193 PolarHBondContact OG-N 3.26Å
159	V	95.6	Very high	93.7	Very high	21 Å²	21	57.5 Å²	57.5	13%	0.127	35%	0.351	C	S	.	.			trans	-118.3	126.2	178.1	-178	0	0	0	0	108.1	P129 V155 H156 S157 S161 V162 N193	P129-V159 HydrophobicContact CG-CG1 3.73Å; P129-V159 HydrophobicContact CG-CG2 4.05Å; V155-V159 HydrophobicContact CG1-CB 4.32Å; H156-V159 PolarHBondContact O-N 3.31Å; S157-V159 PolarHBondContact O-N 2.9Å; V159-S161 VanDerWaalsContact CG1-O 3.3Å; V159-S161 WeakPolarHBondContact CG1-O 3.38Å; V159-V162 HydrophobicContact CG1-CG2 3.72Å; V159-N193 HydrophobicContact CG2-CB 4.27Å
160	S	91.2	Very high	93.7	Very high	126 Å²	126	57.9 Å²	57.9	88%	0.881	35%	0.353	S	S	*	.	S	Bend	trans	-79.3	-39.2	-177.9	50.5	0	0	0	0	113.3
161	S	91.4	Very high	93.3	Very high	91 Å²	91	58.5 Å²	58.5	64%	0.636	37%	0.365	S	S	*	.			trans	-144	144.4	179.6	63.4	0	0	0	0	111.5	V159	V159-S161 VanDerWaalsContact CG1-O 3.3Å; V159-S161 WeakPolarHBondContact CG1-O 3.38Å
162	V	93.7	Very high	92.6	Very high	18 Å²	18	63.6 Å²	63.6	11%	0.109	40%	0.398	C	S	.	.			trans	-129.6	128.3	177.2	176.6	0	0	0	0	107.9	P129 V155 V159 L166 L167 W191	P129-V162 HydrophobicContact CB-CG1 4.45Å; P129-V162 HydrophobicContact CB-CG2 4.32Å; P129-V162 HydrophobicContact CG-CG2 4.29Å; V155-V162 HydrophobicContact CG1-CG2 3.77Å; V155-V162 HydrophobicContact CG2-CB 4.33Å; V155-V162 HydrophobicContact CG2-CG2 3.94Å; V159-V162 HydrophobicContact CG1-CG2 3.72Å; V162-L166 HydrophobicContact CG1-CB 3.56Å; V162-L166 HydrophobicContact CG1-CD1 4.23Å; V162-L166 HydrophobicContact CG1-CG 4.48Å; V162-L167 HydrophobicContact CB-CD2 4Å; V162-L167 HydrophobicContact CB-CG 4.34Å; V162-L167 HydrophobicContact CG1-CD2 3.86Å; V162-L167 HydrophobicContact CG1-CG 4.06Å; V162-W191 HydrophobicContact CG1-CD2 4.46Å; V162-W191 HydrophobicContact CG1-CG 3.99Å; V162-W191 HydrophobicContact CG2-CB 3.83Å; V162-W191 HydrophobicContact CG2-CG 4.19Å
163	P	92.6	Very high	91.5	Very high	57 Å²	57	70 Å²	70	37%	0.37	42%	0.422	S	S	.	.			trans	-51.7	141.9	176.4	-29.7	34.4	0	0	0	113	Q165 L166 L167	P163-Q165 HydrophobicContact CB-CG 4.01Å; P163-Q165 PolarHBondContact O-N 3.45Å; P163-Q165 VanDerWaalsContact O-N 3.15Å; P163-L166 HydrophobicContact CB-CG 4.36Å; P163-L166 HydrophobicContact CG-CD1 4.33Å; P163-L166 WeakPolarHBondContact O-CB 3.47Å; P163-L166 PolarHBondContact O-N 2.94Å; P163-L167 PolarHBondContact O-N 3.07Å
164	P	91.3	Very high	90.4	Very high	107 Å²	107	72.1 Å²	72.1	70%	0.695	43%	0.431	S	S	*	.	H	α-helix	trans	-55	-36.7	-178.7	-27.5	34.8	0	0	0	113.9	L166 L167 S168	P164-L166 VanDerWaalsContact C-N 3.26Å; P164-L166 PolarHBondContact O-N 3.41Å; P164-L167 WeakPolarHBondContact O-CB 3.14Å; P164-L167 PolarHBondContact O-N 3.05Å; P164-S168 PolarHBondContact O-N 2.81Å; P164-S168 VanDerWaalsContact O-N 3.16Å; P164-S168 PolarHBondContact O-OG 2.98Å
165	Q	91.5	Very high	88.9	Confident	89 Å²	89	70.6 Å²	70.6	42%	0.416	44%	0.435	S	S	.	.	H	α-helix	trans	-60.6	-32.2	176.3	65.1	-168.8	16.1	0	0	113.6	P163 C169 L320	P163-Q165 HydrophobicContact CB-CG 4.01Å; P163-Q165 PolarHBondContact O-N 3.45Å; P163-Q165 VanDerWaalsContact O-N 3.15Å; Q165-C169 WeakPolarHBondContact O-CB 3.28Å; Q165-C169 PolarHBondContact O-N 3Å; Q165-L320 HydrophobicContact CB-CD2 4.07Å; Q165-L320 HydrophobicContact CG-CD2 3.89Å
166	L	93.1	Very high	87	Confident	5 Å²	5	75.8 Å²	75.8	3%	0.026	46%	0.461	C	S	.	.	H	α-helix	trans	-79.3	-27.4	175.4	-65.8	-169.6	0	0	0	111.8	P129 P132 V162 P163 P164 S168 C169 W191 L320	P129-L166 HydrophobicContact CB-CD1 3.77Å; P132-L166 HydrophobicContact CB-CD2 3.86Å; P132-L166 HydrophobicContact CG-CD2 4.43Å; V162-L166 HydrophobicContact CG1-CB 3.56Å; V162-L166 HydrophobicContact CG1-CD1 4.23Å; V162-L166 HydrophobicContact CG1-CG 4.48Å; P163-L166 HydrophobicContact CB-CG 4.36Å; P163-L166 HydrophobicContact CG-CD1 4.33Å; P163-L166 WeakPolarHBondContact O-CB 3.47Å; P163-L166 PolarHBondContact O-N 2.94Å; P164-L166 VanDerWaalsContact C-N 3.26Å; P164-L166 PolarHBondContact O-N 3.41Å; L166-S168 VanDerWaalsContact C-N 3.31Å; L166-C169 PolarHBondContact O-SG 2.85Å; L166-W191 HydrophobicContact CB-CH2 4.41Å; L166-W191 HydrophobicContact CB-CZ2 3.64Å; L166-W191 HydrophobicContact CD1-CH2 4.1Å; L166-W191 HydrophobicContact CD1-CZ2 4.13Å; L166-W191 HydrophobicContact CD1-CZ3 4.35Å; L166-W191 HydrophobicContact CD2-CH2 3.9Å; L166-W191 HydrophobicContact CD2-CZ2 3.82Å; L166-W191 HydrophobicContact CG-CH2 4.37Å; L166-W191 HydrophobicContact CG-CZ2 4.07Å; L166-W191 PolarHBondContact O-NE1 2.89Å; L166-L320 HydrophobicContact CD2-CD1 3.39Å; L166-L320 HydrophobicContact CD2-CD2 3.61Å; L166-L320 HydrophobicContact CD2-CG 4.14Å
167	L	92.2	Very high	85.1	Confident	75 Å²	75	77.5 Å²	77.5	39%	0.393	48%	0.481	S	S	.	.	H	α-helix	trans	-71.6	-27.4	174.9	-63.9	176.1	0	0	0	112.6	V155 V162 P163 P164	V155-L167 HydrophobicContact CG2-CD2 3.52Å; V162-L167 HydrophobicContact CB-CD2 4Å; V162-L167 HydrophobicContact CB-CG 4.34Å; V162-L167 HydrophobicContact CG1-CD2 3.86Å; V162-L167 HydrophobicContact CG1-CG 4.06Å; P163-L167 PolarHBondContact O-N 3.07Å; P164-L167 WeakPolarHBondContact O-CB 3.14Å; P164-L167 PolarHBondContact O-N 3.05Å
168	S	91.1	Very high	83.8	Confident	73 Å²	73	78.9 Å²	78.9	51%	0.51	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	11.7	178.4	58.8	0	0	0	0	114.1	P164 L166 L170 G171	P164-S168 PolarHBondContact O-N 2.81Å; P164-S168 VanDerWaalsContact O-N 3.16Å; P164-S168 PolarHBondContact O-OG 2.98Å; L166-S168 VanDerWaalsContact C-N 3.31Å; S168-L170 PolarHBondContact O-N 3.4Å; S168-L170 VanDerWaalsContact O-N 3.15Å; S168-G171 PolarHBondContact O-N 2.84Å
169	C	92.5	Very high	82.9	Confident	19 Å²	19	78.6 Å²	78.6	13%	0.128	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-21.7	-171.5	65.1	0	0	0	0	115.1	L137 Q165 L166 L189	L137-C169 HydrophobicContact CD1-CB 4.22Å; L137-C169 HydrophobicContact CD2-CB 4.01Å; Q165-C169 WeakPolarHBondContact O-CB 3.28Å; Q165-C169 PolarHBondContact O-N 3Å; L166-C169 PolarHBondContact O-SG 2.85Å; C169-L189 VanDerWaalsContact SG-CD2 3.6Å
170	L	91.9	Very high	82.1	Confident	18 Å²	18	85.5 Å²	85.5	9%	0.094	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	9.9	176.7	-56.3	-173.3	0	0	0	113.2	L137 H140 V153 S168 F187 L189	L137-L170 HydrophobicContact CD2-CD2 3.78Å; H140-L170 HydrophobicContact CB-CD2 4.31Å; V153-L170 HydrophobicContact CG2-CB 4.08Å; V153-L170 HydrophobicContact CG2-CD1 3.69Å; V153-L170 HydrophobicContact CG2-CG 3.72Å; S168-L170 PolarHBondContact O-N 3.4Å; S168-L170 VanDerWaalsContact O-N 3.15Å; L170-F187 HydrophobicContact CD1-CD1 3.75Å; L170-F187 HydrophobicContact CD1-CE1 3.97Å; L170-F187 HydrophobicContact CD2-CE1 4.12Å; L170-L189 HydrophobicContact CD1-CB 3.86Å; L170-L189 HydrophobicContact CD2-CD2 4.47Å; L170-L189 HydrophobicContact CG-CD2 4.46Å
171	G	84.3	Confident	81.6	Confident	38 Å²	38	86.5 Å²	86.5	39%	0.392	49%	0.485	S	S	.	.			trans	92.2	-169.3	-177.6	0	0	0	0	0	113.9	S168	S168-G171 PolarHBondContact O-N 2.84Å
172	P	79.2	Confident	81.2	Confident	121 Å²	121	86.7 Å²	86.7	79%	0.786	48%	0.476	S	S	*	.	S	Bend	trans	-65	141.7	-177.4	27	-33.1	0	0	0	111	H174	P172-H174 PolarHBondContact O-N 2.67Å
173	K	71.1	Confident	81	Confident	176 Å²	176	87.2 Å²	87.2	77%	0.765	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-63.4	133.1	174.1	-66.4	-176.7	178.8	-179	0	109.4	A175	K173-A175 PolarHBondContact O-N 3.02Å
174	H	71.6	Confident	80.8	Confident	71 Å²	71	87.2 Å²	87.2	33%	0.329	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-63.6	133.2	167.1	-61.7	-77.4	0	0	0	108.6	L150 P172 Y178	L150-H174 HydrophobicContact CD1-CB 4.24Å; P172-H174 PolarHBondContact O-N 2.67Å; H174-Y178 HydrophobicContact CB-CD2 4.1Å; H174-Y178 HydrophobicContact CB-CE2 4.45Å
175	A	64.3	Low	80.8	Confident	67 Å²	67	82.1 Å²	82.1	55%	0.554	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-58	145.9	172.8	0	0	0	0	0	109.9	K173 S177 Y178	K173-A175 PolarHBondContact O-N 3.02Å; A175-S177 PolarHBondContact O-N 3.28Å; A175-Y178 WeakPolarHBondContact O-CD2 3.25Å
176	D	57.8	Low	80.9	Confident	180 Å²	180	77.9 Å²	77.9	96%	0.963	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	10.3	-171.3	-63.2	-49.2	0	0	0	115.6
177	S	58.2	Low	81	Confident	110 Å²	110	77.7 Å²	77.7	77%	0.769	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-2	-171.1	-166.1	0	0	0	0	114.7	A175	A175-S177 PolarHBondContact O-N 3.28Å
178	Y	68.2	Low	81.1	Confident	143 Å²	143	75.3 Å²	75.3	56%	0.561	41%	0.408	S	S	*	.			trans	-83.6	127.6	-178.9	-68.2	-82.6	0	0	0	112.6	H174 A175 R180 F183	H174-Y178 HydrophobicContact CB-CD2 4.1Å; H174-Y178 HydrophobicContact CB-CE2 4.45Å; A175-Y178 WeakPolarHBondContact O-CD2 3.25Å; Y178-R180 PolarHBondContact O-N 3.05Å; Y178-F183 HydrophobicContact CG-CE2 4.36Å; Y178-F183 HydrophobicContact CG-CZ 4.21Å
179	A	77.4	Confident	81.4	Confident	45 Å²	45	71.9 Å²	71.9	37%	0.372	38%	0.383	S	S	.	.			trans	-70	123.2	173.8	0	0	0	0	0	110.5	H181 M182	A179-H181 WeakPolarHBondContact CB-CE1 3.37Å; A179-H181 WeakPolarHBondContact CB-ND1 3.42Å; A179-H181 PolarHBondContact O-N 3.41Å; A179-M182 HydrophobicContact CB-CG 4.45Å; A179-M182 WeakPolarHBondContact O-CB 3.41Å; A179-M182 PolarHBondContact O-N 2.98Å
180	R	80.3	Confident	81.7	Confident	166 Å²	166	72.6 Å²	72.6	63%	0.626	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-52.8	-31.5	-175	-76.5	-176.1	165	-167.1	-6.6	114.5	L120 L150 Y178 M182 F183	L120-R180 HydrophobicContact CD2-CB 4.44Å; L150-R180 HydrophobicContact CD2-CG 4.2Å; Y178-R180 PolarHBondContact O-N 3.05Å; R180-M182 PolarHBondContact O-N 3.2Å; R180-M182 VanDerWaalsContact O-N 3.14Å; R180-F183 PolarHBondContact O-N 2.63Å; R180-F183 VanDerWaalsContact O-N 3.17Å
181	H	80	Confident	81.9	Confident	148 Å²	148	71.9 Å²	71.9	69%	0.685	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-65.2	-12.7	178.9	68.4	-99.9	0	0	0	114	A179 F183	A179-H181 WeakPolarHBondContact CB-CE1 3.37Å; A179-H181 WeakPolarHBondContact CB-ND1 3.42Å; A179-H181 PolarHBondContact O-N 3.41Å; H181-F183 VanDerWaalsContact C-N 3.3Å
182	M	84.1	Confident	82.6	Confident	94 Å²	94	72.6 Å²	72.6	46%	0.463	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-79.8	-13.9	176.7	-66.3	-63.2	-70.3	0	0	113.1	R148 A179 R180	R148-M182 WeakPolarHBondContact CD-O 3.41Å; R148-M182 PolarHBondContact NE-O 3.39Å; R148-M182 PolarHBondContact NH1-O 2.63Å; A179-M182 HydrophobicContact CB-CG 4.45Å; A179-M182 WeakPolarHBondContact O-CB 3.41Å; A179-M182 PolarHBondContact O-N 2.98Å; R180-M182 PolarHBondContact O-N 3.2Å; R180-M182 VanDerWaalsContact O-N 3.14Å
183	F	88.4	Confident	83.4	Confident	29 Å²	29	71.9 Å²	71.9	13%	0.127	36%	0.363	C	S	.	.			trans	-101.3	151.6	179.6	-61	-85	0	0	0	110.7	L120 R148 L150 Y178 R180 H181	L120-F183 HydrophobicContact CD1-CB 3.92Å; L120-F183 VanDerWaalsContact CD1-O 3.3Å; L120-F183 WeakPolarHBondContact CD1-O 3.16Å; R148-F183 HydrophobicContact CB-CD1 4.23Å; L150-F183 HydrophobicContact CB-CB 4.03Å; L150-F183 HydrophobicContact CB-CD1 3.81Å; L150-F183 HydrophobicContact CB-CD2 3.82Å; L150-F183 HydrophobicContact CB-CE1 4.17Å; L150-F183 HydrophobicContact CB-CE2 4.16Å; L150-F183 HydrophobicContact CB-CG 3.62Å; L150-F183 HydrophobicContact CB-CZ 4.33Å; L150-F183 HydrophobicContact CD1-CD2 4.36Å; L150-F183 HydrophobicContact CD1-CE1 4.44Å; L150-F183 HydrophobicContact CD1-CE2 3.88Å; L150-F183 HydrophobicContact CD1-CZ 3.94Å; L150-F183 HydrophobicContact CD2-CD2 4.25Å; L150-F183 HydrophobicContact CD2-CE2 4.43Å; L150-F183 HydrophobicContact CG-CD2 4.37Å; L150-F183 HydrophobicContact CG-CE2 4.38Å; Y178-F183 HydrophobicContact CG-CE2 4.36Å; Y178-F183 HydrophobicContact CG-CZ 4.21Å; R180-F183 PolarHBondContact O-N 2.63Å; R180-F183 VanDerWaalsContact O-N 3.17Å; H181-F183 VanDerWaalsContact C-N 3.3Å
184	Q	88.7	Confident	84.6	Confident	57 Å²	57	63.9 Å²	63.9	27%	0.266	33%	0.33	S	S	.	.	S	Bend	trans	-94.7	-31.3	178	-66.5	168.5	-78.5	0	0	111.5	L109 R148	L109-Q184 HydrophobicContact CD1-CB 3.89Å; R148-Q184 PolarHBondContact O-N 2.96Å
185	L	91.4	Very high	85.7	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	136	179.8	-66	173.2	0	0	0	109.2	L109 R121 I123 L143 Y147 R148 V149 L150	L109-L185 HydrophobicContact CD1-CD1 4.3Å; L109-L185 HydrophobicContact CD1-CD2 3.89Å; L109-L185 HydrophobicContact CD1-CG 3.87Å; L109-L185 HydrophobicContact CD2-CD2 4.25Å; R121-L185 HydrophobicContact CB-CD2 3.95Å; I123-L185 HydrophobicContact CD1-CD2 4.36Å; L143-L185 HydrophobicContact CD2-CD1 4.14Å; Y147-L185 HydrophobicContact CD2-CD1 3.65Å; Y147-L185 HydrophobicContact CE2-CD1 4.32Å; Y147-L185 HydrophobicContact CG-CD1 3.93Å; R148-L185 PolarHBondContact O-N 3.24Å; V149-L185 CarbonylContact C-O 3.51Å; V149-L185 WeakPolarHBondContact CA-O 3.48Å; V149-L185 HydrophobicContact CG1-CB 4.44Å; V149-L185 HydrophobicContact CG2-CB 4.29Å; V149-L185 HydrophobicContact CG2-CD1 4.37Å; L150-L185 PolarHBondContact N-O 2.96Å
186	G	92.8	Very high	87.2	Confident	1 Å²	1	69.9 Å²	69.9	1%	0.01	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	131.4	160.6	0	0	0	0	0	108.8	R121 D122 I123	R121-G186 PolarHBondContact O-N 3.21Å; D122-G186 WeakPolarHBondContact OD1-CA 3.43Å; I123-G186 WeakPolarHBondContact CB-O 2.96Å; I123-G186 PolarHBondContact N-O 2.89Å
187	F	95.1	Very high	89	Confident	1 Å²	1	62.1 Å²	62.1	0%	0.004	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	103.3	177.9	-166.4	-75.6	0	0	0	109.2	I123 I125 L136 H140 L143 V149 L150 S151 T152 L170 L219	I123-F187 HydrophobicContact CB-CD2 4.44Å; I123-F187 HydrophobicContact CD1-CD2 4.28Å; I123-F187 HydrophobicContact CG2-CD2 4.38Å; I125-F187 HydrophobicContact CD1-CE1 4.35Å; I125-F187 HydrophobicContact CD1-CE2 4.07Å; I125-F187 HydrophobicContact CD1-CZ 3.77Å; L136-F187 HydrophobicContact CD1-CE2 4.42Å; L136-F187 HydrophobicContact CD1-CZ 3.73Å; L136-F187 HydrophobicContact CD2-CZ 4.38Å; L136-F187 HydrophobicContact CG-CZ 3.99Å; H140-F187 HydrophobicContact CB-CE1 4.26Å; H140-F187 HydrophobicContact CB-CE2 4.26Å; H140-F187 HydrophobicContact CB-CZ 3.89Å; H140-F187 AromaticContact CD2-CD1 3.55Å; H140-F187 AromaticContact CD2-CD2 3.97Å; H140-F187 AromaticContact CD2-CE1 3.73Å; H140-F187 AromaticContact CD2-CG 3.65Å; H140-F187 AromaticContact CD2-CZ 3.99Å; L143-F187 HydrophobicContact CD1-CD2 4.42Å; L143-F187 HydrophobicContact CD1-CE2 4.28Å; V149-F187 HydrophobicContact CG1-CB 3.52Å; V149-F187 HydrophobicContact CG1-CG 4.49Å; L150-F187 PolarHBondContact O-N 3.28Å; S151-F187 CarbonylContact C-O 3.52Å; S151-F187 WeakPolarHBondContact CA-O 3.33Å; T152-F187 PolarHBondContact N-O 3.31Å; L170-F187 HydrophobicContact CD1-CD1 3.75Å; L170-F187 HydrophobicContact CD1-CE1 3.97Å; L170-F187 HydrophobicContact CD2-CE1 4.12Å; F187-L219 HydrophobicContact CE2-CD1 4.23Å; F187-L219 HydrophobicContact CE2-CD2 4.24Å
188	T	95.6	Very high	90.8	Very high	25 Å²	25	58.3 Å²	58.3	15%	0.153	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	115	-176.7	-61	0	0	0	0	110	I123 V124 I125 T152 I190	I123-T188 PolarHBondContact O-N 2.88Å; V124-T188 CarbonylContact C-O 3.57Å; V124-T188 WeakPolarHBondContact CA-O 3.37Å; V124-T188 HydrophobicContact CG1-CG2 4.45Å; I125-T188 PolarHBondContact N-O 3.45Å; T152-T188 WeakPolarHBondContact O-CA 3.26Å; T152-T188 WeakPolarHBondContact OG1-CB 3.15Å; T152-T188 WeakPolarHBondContact OG1-CG2 3.18Å; T152-T188 PolarHBondContact OG1-OG1 3.32Å; T188-I190 HydrophobicContact CG2-CD1 4.31Å; T188-I190 HydrophobicContact CG2-CG1 3.94Å
189	L	97.2	Very high	92.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	128	171.1	178.4	62	0	0	0	109.9	I125 A127 L136 T152 V153 H154 C169 L170 W191	I125-L189 HydrophobicContact CB-CD1 4.39Å; I125-L189 HydrophobicContact CG2-CD1 4.21Å; I125-L189 CarbonylContact O-C 3.57Å; I125-L189 WeakPolarHBondContact O-CA 3.36Å; A127-L189 HydrophobicContact CB-CD1 3.92Å; L136-L189 HydrophobicContact CD2-CD1 4.02Å; T152-L189 PolarHBondContact O-N 3.37Å; V153-L189 CarbonylContact C-O 3.58Å; V153-L189 VanDerWaalsContact CA-O 3.29Å; V153-L189 WeakPolarHBondContact CA-O 3.07Å; V153-L189 HydrophobicContact CG2-CB 4.49Å; H154-L189 PolarHBondContact N-O 3.02Å; C169-L189 VanDerWaalsContact SG-CD2 3.6Å; L170-L189 HydrophobicContact CD1-CB 3.86Å; L170-L189 HydrophobicContact CD2-CD2 4.47Å; L170-L189 HydrophobicContact CG-CD2 4.46Å; L189-W191 HydrophobicContact CD2-CH2 4.14Å; L189-W191 HydrophobicContact CD2-CZ2 3.6Å; L189-W191 HydrophobicContact CG-CZ2 4.44Å
190	I	97.4	Very high	92.9	Very high	35 Å²	35	53 Å²	53	18%	0.179	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	114.3	177.4	-50.3	-174.2	0	0	0	108.3	V124 I125 N126 A127 H154 H156 T188 K192	V124-I190 HydrophobicContact CG1-CD1 3.81Å; V124-I190 HydrophobicContact CG1-CG1 4.34Å; I125-I190 PolarHBondContact O-N 3.23Å; N126-I190 VanDerWaalsContact CA-O 3.3Å; N126-I190 WeakPolarHBondContact CA-O 3.32Å; N126-I190 VanDerWaalsContact OD1-CB 3.29Å; N126-I190 WeakPolarHBondContact OD1-CB 3.35Å; N126-I190 WeakPolarHBondContact OD1-CD1 3.32Å; A127-I190 PolarHBondContact N-O 3.4Å; H154-I190 HydrophobicContact CB-CG1 4.32Å; H154-I190 HydrophobicContact CB-CG2 4.45Å; H154-I190 WeakPolarHBondContact O-CA 3.49Å; H156-I190 HydrophobicContact CB-CG2 3.93Å; T188-I190 HydrophobicContact CG2-CD1 4.31Å; T188-I190 HydrophobicContact CG2-CG1 3.94Å; I190-K192 HydrophobicContact CG2-CB 4.47Å; I190-K192 PolarHBondContact O-N 3.43Å
191	W	97.9	Very high	93.3	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.008	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	111.5	170.6	-64.7	114.4	0	0	0	109.2	A127 P129 P132 H154 H156 V162 L166 L189	A127-W191 HydrophobicContact CB-CE3 4.19Å; A127-W191 HydrophobicContact CB-CZ3 3.91Å; A127-W191 WeakPolarHBondContact O-CA 3.32Å; P129-W191 HydrophobicContact CB-CD2 4.18Å; P129-W191 HydrophobicContact CB-CE3 3.76Å; P129-W191 HydrophobicContact CB-CZ3 4.33Å; P129-W191 HydrophobicContact CG-CB 4.45Å; P129-W191 HydrophobicContact CG-CE3 4.44Å; P132-W191 HydrophobicContact CB-CH2 4.05Å; P132-W191 HydrophobicContact CB-CZ3 4.4Å; H154-W191 PolarHBondContact O-N 3.28Å; H156-W191 WeakPolarHBondContact CB-O 3.41Å; H156-W191 PolarHBondContact N-O 2.94Å; V162-W191 HydrophobicContact CG1-CD2 4.46Å; V162-W191 HydrophobicContact CG1-CG 3.99Å; V162-W191 HydrophobicContact CG2-CB 3.83Å; V162-W191 HydrophobicContact CG2-CG 4.19Å; L166-W191 HydrophobicContact CB-CH2 4.41Å; L166-W191 HydrophobicContact CB-CZ2 3.64Å; L166-W191 HydrophobicContact CD1-CH2 4.1Å; L166-W191 HydrophobicContact CD1-CZ2 4.13Å; L166-W191 HydrophobicContact CD1-CZ3 4.35Å; L166-W191 HydrophobicContact CD2-CH2 3.9Å; L166-W191 HydrophobicContact CD2-CZ2 3.82Å; L166-W191 HydrophobicContact CG-CH2 4.37Å; L166-W191 HydrophobicContact CG-CZ2 4.07Å; L166-W191 PolarHBondContact O-NE1 2.89Å; L189-W191 HydrophobicContact CD2-CH2 4.14Å; L189-W191 HydrophobicContact CD2-CZ2 3.6Å; L189-W191 HydrophobicContact CG-CZ2 4.44Å
192	K	97.8	Very high	93.2	Very high	54 Å²	54	41.6 Å²	41.6	24%	0.235	21%	0.214	C	C	.	.			trans	-141.2	146.3	-172.4	-173.7	-178.6	168	-162.5	0	109.2	N126 A127 N128 H156 I190 V194 E198	N126-K192 HydrophobicContact CB-CB 4.09Å; N126-K192 HydrophobicContact CB-CD 3.95Å; A127-K192 CarbonylContact C-O 3.52Å; A127-K192 PolarHBondContact O-N 3.23Å; N128-K192 VanDerWaalsContact CA-O 3.3Å; N128-K192 WeakPolarHBondContact CA-O 3.4Å; H156-K192 HydrophobicContact CB-CB 3.87Å; H156-K192 HydrophobicContact CB-CG 3.85Å; I190-K192 HydrophobicContact CG2-CB 4.47Å; I190-K192 PolarHBondContact O-N 3.43Å; K192-V194 VanDerWaalsContact C-N 3.3Å; K192-V194 HydrophobicContact CB-CG1 4.15Å; K192-V194 HydrophobicContact CD-CG1 3.66Å; K192-V194 HydrophobicContact CG-CG1 3.79Å; K192-V194 PolarHBondContact O-N 2.67Å; K192-E198 IonicContact NZ-OE1 2.71Å; K192-E198 PolarHBondContact NZ-OE1 3.44Å
193	N	97.1	Very high	92.5	Very high	105 Å²	105	41.3 Å²	41.3	56%	0.561	22%	0.218	S	C	*	.			trans	-77.5	86.8	174.9	-171.8	16.3	0	0	0	109	N128 S158 V159	N128-N193 PolarHBondContact ND2-OD1 3.08Å; N128-N193 VanDerWaalsContact ND2-OD1 3.17Å; S158-N193 PolarHBondContact OG-N 3.26Å; V159-N193 HydrophobicContact CG2-CB 4.27Å
194	V	96.3	Very high	91.6	Very high	9 Å²	9	51.2 Å²	51.2	6%	0.055	25%	0.254	C	S	.	.			trans	-116.6	145.4	177.3	-67.4	0	0	0	0	109.6	N126 N128 K192 K196 E198	N126-V194 HydrophobicContact CB-CG1 4.34Å; N128-V194 HydrophobicContact CB-CG2 4.47Å; N128-V194 PolarHBondContact ND2-O 2.88Å; K192-V194 VanDerWaalsContact C-N 3.3Å; K192-V194 HydrophobicContact CB-CG1 4.15Å; K192-V194 HydrophobicContact CD-CG1 3.66Å; K192-V194 HydrophobicContact CG-CG1 3.79Å; K192-V194 PolarHBondContact O-N 2.67Å; V194-K196 VanDerWaalsContact C-N 3.33Å; V194-K196 WeakPolarHBondContact CB-O 3.45Å; V194-K196 WeakPolarHBondContact CG2-O 3.47Å; V194-E198 HydrophobicContact CG1-CG 4.4Å; V194-E198 WeakPolarHBondContact CG1-OE1 3.42Å
195	P	94.4	Very high	90.4	Very high	131 Å²	131	55.8 Å²	55.8	85%	0.851	28%	0.281	S	S	*	.	S	Bend	trans	-73.5	-26.7	179.5	29.3	-35	0	0	0	112.7
196	K	94.9	Very high	89.7	Confident	132 Å²	132	59.2 Å²	59.2	57%	0.574	30%	0.297	S	S	*	.	S	Bend	trans	-137.6	151.9	175.1	-67.3	-178.7	-178.7	175	0	108.8	V194 E198	V194-K196 VanDerWaalsContact C-N 3.33Å; V194-K196 WeakPolarHBondContact CB-O 3.45Å; V194-K196 WeakPolarHBondContact CG2-O 3.47Å; K196-E198 PolarHBondContact O-N 3.26Å
197	L	96.1	Very high	89.3	Confident	17 Å²	17	63.8 Å²	63.8	9%	0.089	33%	0.328	C	S	.	.			trans	-58.6	130.3	170.7	-173.7	146.2	0	0	0	109.6	I125 A127 P133 E210 G211 E212 V215	I125-L197 HydrophobicContact CG2-CD1 4.18Å; I125-L197 HydrophobicContact CG2-CD2 3.93Å; I125-L197 HydrophobicContact CG2-CG 3.98Å; A127-L197 HydrophobicContact CB-CD1 4.2Å; P133-L197 HydrophobicContact CB-CD1 3.47Å; P133-L197 VanDerWaalsContact CB-CD1 3.47Å; P133-L197 HydrophobicContact CG-CD1 3.53Å; L197-E210 CarbonylContact O-C 3.21Å; L197-E210 WeakPolarHBondContact O-CA 3.49Å; L197-G211 PolarHBondContact O-N 3.13Å; L197-E212 HydrophobicContact CD1-CB 4.49Å; L197-E212 HydrophobicContact CD1-CG 4.43Å; L197-V215 HydrophobicContact CD2-CB 3.74Å; L197-V215 HydrophobicContact CD2-CG1 3.95Å; L197-V215 HydrophobicContact CD2-CG2 3.4Å
198	E	96.3	Very high	89.1	Confident	30 Å²	30	66.5 Å²	66.5	14%	0.14	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	137.5	178.9	57.2	173.5	175	0	0	110.1	I125 N126 K192 V194 K196 I209	I125-E198 CarbonylContact C-O 3.54Å; I125-E198 VanDerWaalsContact CA-O 3.32Å; I125-E198 WeakPolarHBondContact CA-O 3.25Å; N126-E198 HydrophobicContact CB-CG 3.53Å; N126-E198 WeakPolarHBondContact CB-OE1 3.25Å; N126-E198 PolarHBondContact N-O 3.28Å; N126-E198 WeakPolarHBondContact ND2-CG 3.32Å; N126-E198 PolarHBondContact ND2-OE1 3.36Å; N126-E198 PolarHBondContact O-N 2.89Å; K192-E198 IonicContact NZ-OE1 2.71Å; K192-E198 PolarHBondContact NZ-OE1 3.44Å; V194-E198 HydrophobicContact CG1-CG 4.4Å; V194-E198 WeakPolarHBondContact CG1-OE1 3.42Å; K196-E198 PolarHBondContact O-N 3.26Å; E198-I209 CarbonylContact C-O 3.59Å; E198-I209 WeakPolarHBondContact CA-O 3.03Å
199	M	96.3	Very high	89.1	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	142.4	175.5	178.8	-172.6	76.7	0	0	110.6	I123 V124 I125 P208 I209 V215 F218	I123-M199 HydrophobicContact CG2-CG 4.01Å; I123-M199 HydrophobicContact CG2-SD 3.83Å; V124-M199 CarbonylContact O-C 3.58Å; V124-M199 VanDerWaalsContact O-CA 3.29Å; V124-M199 WeakPolarHBondContact O-CA 3.23Å; I125-M199 HydrophobicContact CD1-CG 4.43Å; I125-M199 HydrophobicContact CG1-CB 4.03Å; I125-M199 HydrophobicContact CG1-CG 3.8Å; I125-M199 HydrophobicContact CG1-SD 4.49Å; M199-P208 CarbonylContact O-C 3.57Å; M199-P208 WeakPolarHBondContact O-CA 3.47Å; M199-I209 HydrophobicContact CE-CB 4.16Å; M199-I209 HydrophobicContact CE-CD1 3.3Å; M199-I209 HydrophobicContact CE-CG1 4.21Å; M199-I209 PolarHBondContact N-O 3.45Å; M199-I209 PolarHBondContact O-N 2.71Å; M199-V215 HydrophobicContact CB-CG1 4.27Å; M199-V215 HydrophobicContact CB-CG2 3.48Å; M199-V215 VanDerWaalsContact CB-CG2 3.48Å; M199-V215 HydrophobicContact CE-CG2 4.45Å; M199-V215 HydrophobicContact CG-CG2 4.45Å; M199-V215 HydrophobicContact SD-CB 4.48Å; M199-V215 HydrophobicContact SD-CG1 3.82Å; M199-V215 HydrophobicContact SD-CG2 4.25Å; M199-F218 HydrophobicContact CE-CB 3.98Å; M199-F218 HydrophobicContact CE-CD1 3.41Å; M199-F218 VanDerWaalsContact CE-CD1 3.41Å; M199-F218 HydrophobicContact CE-CD2 4.26Å; M199-F218 HydrophobicContact CE-CE1 3.91Å; M199-F218 HydrophobicContact CE-CG 3.62Å; M199-F218 HydrophobicContact SD-CD1 3.69Å; M199-F218 HydrophobicContact SD-CE1 4.09Å; M199-F218 HydrophobicContact SD-CG 4.43Å
200	K	92.8	Very high	89	Confident	76 Å²	76	72.1 Å²	72.1	33%	0.33	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	131.7	166.1	-67.3	-179.3	175.4	-178.1	0	109.2	V124 P208	V124-K200 PolarHBondContact N-O 2.81Å; V124-K200 PolarHBondContact O-N 3.36Å; K200-P208 HydrophobicContact CG-CB 4.38Å
201	F	88.3	Confident	88.9	Confident	30 Å²	30	71.1 Å²	71.1	13%	0.132	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	128.3	171.4	-179.1	-103.7	0	0	0	109.5	L113 R121 D122 I123 M206 F218	L113-F201 HydrophobicContact CD1-CE1 4.26Å; L113-F201 HydrophobicContact CD1-CE2 4.17Å; L113-F201 HydrophobicContact CD1-CZ 3.59Å; R121-F201 HydrophobicContact CB-CE2 3.95Å; R121-F201 HydrophobicContact CB-CZ 3.9Å; R121-F201 HydrophobicContact CG-CZ 4.25Å; D122-F201 WeakPolarHBondContact O-CA 3.27Å; I123-F201 HydrophobicContact CG1-CD2 3.76Å; I123-F201 HydrophobicContact CG1-CE2 4.1Å; F201-M206 HydrophobicContact CB-SD 3.69Å; F201-M206 WeakPolarHBondContact O-CB 3.48Å; F201-F218 HydrophobicContact CB-CZ 4.16Å; F201-F218 HydrophobicContact CD1-CZ 4.4Å; F201-F218 HydrophobicContact CD2-CE1 4.2Å; F201-F218 AromaticContact CD2-CZ 3.78Å; F201-F218 HydrophobicContact CD2-CZ 3.78Å; F201-F218 HydrophobicContact CE2-CZ 4.28Å; F201-F218 AromaticContact CG-CZ 3.85Å; F201-F218 HydrophobicContact CG-CZ 3.85Å
202	S	79.4	Confident	88.8	Confident	46 Å²	46	72.4 Å²	72.4	32%	0.322	38%	0.375	S	S	.	.	S	Bend	trans	47.3	66.8	178.8	-61.1	0	0	0	0	112.3	D122 R204 N205	D122-S202 PolarHBondContact O-N 2.73Å; S202-R204 PolarHBondContact O-N 2.8Å; S202-N205 PolarHBondContact O-N 2.8Å
203	V	67.9	Low	88.8	Confident	88 Å²	88	70 Å²	70	53%	0.533	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-35.8	-22.1	-164.3	-175.3	0	0	0	0	117.8	V124	V124-V203 HydrophobicContact CG2-CG2 4.17Å
204	R	69.5	Low	88.8	Confident	236 Å²	236	68.1 Å²	68.1	89%	0.891	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-30	-179.7	-65.4	-175.8	179.4	-177.7	0	114.3	S202	S202-R204 PolarHBondContact O-N 2.8Å
205	N	64.8	Low	88.8	Confident	154 Å²	154	67.8 Å²	67.8	82%	0.824	35%	0.353	S	S	*	.	S	Bend	trans	-128.5	9.6	-160.9	-64.1	-18.2	0	0	0	115.9	S202	S202-N205 PolarHBondContact O-N 2.8Å
206	M	75.9	Confident	88.9	Confident	72 Å²	72	61.7 Å²	61.7	36%	0.355	31%	0.314	S	S	.	.			trans	-129.8	142.6	-172.8	-156.7	-172.3	-175	0	0	113.1	F201 I209	F201-M206 HydrophobicContact CB-SD 3.69Å; F201-M206 WeakPolarHBondContact O-CB 3.48Å; M206-I209 HydrophobicContact CE-CD1 3.21Å; M206-I209 HydrophobicContact CE-CG1 3.67Å; M206-I209 HydrophobicContact SD-CD1 4.22Å
207	C	84.5	Confident	89	Confident	96 Å²	96	56.9 Å²	56.9	65%	0.649	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-68.9	148.8	162.9	60.5	0	0	0	0	110.4	I209	C207-I209 PolarHBondContact O-N 3.27Å
208	P	91	Very high	88.9	Confident	58 Å²	58	58 Å²	58	38%	0.377	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-58.7	134.4	173.3	-13.1	23.3	0	0	0	111	M199 K200	M199-P208 CarbonylContact O-C 3.57Å; M199-P208 WeakPolarHBondContact O-CA 3.47Å; K200-P208 HydrophobicContact CG-CB 4.38Å
209	I	94.8	Very high	88.9	Confident	32 Å²	32	56.5 Å²	56.5	16%	0.164	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	123	167.3	-65.1	170.5	0	0	0	107.8	E198 M199 M206 C207 N214 V215	E198-I209 CarbonylContact C-O 3.59Å; E198-I209 WeakPolarHBondContact CA-O 3.03Å; M199-I209 HydrophobicContact CE-CB 4.16Å; M199-I209 HydrophobicContact CE-CD1 3.3Å; M199-I209 HydrophobicContact CE-CG1 4.21Å; M199-I209 PolarHBondContact N-O 3.45Å; M199-I209 PolarHBondContact O-N 2.71Å; M206-I209 HydrophobicContact CE-CD1 3.21Å; M206-I209 HydrophobicContact CE-CG1 3.67Å; M206-I209 HydrophobicContact SD-CD1 4.22Å; C207-I209 PolarHBondContact O-N 3.27Å; I209-N214 HydrophobicContact CG2-CB 3.57Å; I209-V215 HydrophobicContact CG2-CG2 3.99Å
210	E	96.2	Very high	88.8	Confident	111 Å²	111	56.9 Å²	56.9	52%	0.519	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	147.3	178.4	-63.4	-175.5	179	0	0	112.3	L197 N214	L197-E210 CarbonylContact O-C 3.21Å; L197-E210 WeakPolarHBondContact O-CA 3.49Å; E210-N214 PolarHBondContact O-ND2 3.37Å
211	G	95.6	Very high	88.7	Confident	14 Å²	14	58.5 Å²	58.5	14%	0.144	30%	0.298	C	S	.	.	S	Bend	trans	91.4	135.9	176	0	0	0	0	0	113.4	L197 A213 N214 V215	L197-G211 PolarHBondContact O-N 3.13Å; G211-A213 VanDerWaalsContact C-N 3.28Å; G211-A213 PolarHBondContact O-N 2.74Å; G211-N214 PolarHBondContact O-N 3.43Å; G211-V215 PolarHBondContact O-N 2.71Å
212	E	95.8	Very high	88.9	Confident	30 Å²	30	57.3 Å²	57.3	14%	0.14	29%	0.293	C	S	.	.	H	α-helix	trans	-60	-37.5	-178.8	-170.6	174.8	159	0	0	112.1	P133 T135 L197 N214 V215 A216 F244	P133-E212 WeakPolarHBondContact CA-OE2 3.29Å; P133-E212 VanDerWaalsContact CB-CD 3.45Å; P133-E212 HydrophobicContact CB-CG 4.16Å; P133-E212 WeakPolarHBondContact CB-OE2 3.32Å; T135-E212 WeakPolarHBondContact CB-OE1 3.31Å; T135-E212 PolarHBondContact N-OE1 3.1Å; T135-E212 PolarHBondContact OG1-OE1 3.23Å; L197-E212 HydrophobicContact CD1-CB 4.49Å; L197-E212 HydrophobicContact CD1-CG 4.43Å; E212-N214 PolarHBondContact O-N 2.95Å; E212-V215 PolarHBondContact O-N 2.84Å; E212-A216 WeakPolarHBondContact O-CB 3.33Å; E212-A216 PolarHBondContact O-N 3.38Å; E212-F244 HydrophobicContact CB-CD1 4.2Å; E212-F244 HydrophobicContact CB-CE1 3.73Å; E212-F244 HydrophobicContact CB-CZ 4.15Å; E212-F244 VanDerWaalsContact CD-CE1 3.4Å; E212-F244 HydrophobicContact CG-CD1 4.47Å; E212-F244 HydrophobicContact CG-CE1 3.54Å; E212-F244 HydrophobicContact CG-CZ 3.73Å
213	A	96.9	Very high	89.4	Confident	2 Å²	2	55.1 Å²	55.1	2%	0.017	28%	0.278	C	S	.	.	H	α-helix	trans	-55.8	-46.9	176.3	0	0	0	0	0	112.9	G211 A216 R217 V240 F244	G211-A213 VanDerWaalsContact C-N 3.28Å; G211-A213 PolarHBondContact O-N 2.74Å; A213-A216 PolarHBondContact O-N 3.03Å; A213-R217 WeakPolarHBondContact O-CG 3.46Å; A213-R217 PolarHBondContact O-N 3.45Å; A213-V240 HydrophobicContact CB-CG1 4.03Å; A213-F244 HydrophobicContact CB-CB 4.4Å; A213-F244 HydrophobicContact CB-CD2 3.44Å; A213-F244 VanDerWaalsContact CB-CD2 3.44Å; A213-F244 HydrophobicContact CB-CE2 3.94Å; A213-F244 HydrophobicContact CB-CG 4.04Å
214	N	96.9	Very high	90.3	Very high	66 Å²	66	51.3 Å²	51.3	35%	0.353	26%	0.255	S	S	.	.	H	α-helix	trans	-72.2	-39.6	-177.1	-64.2	-34.7	0	0	0	111.8	I209 E210 G211 E212 A216 R217 F218	I209-N214 HydrophobicContact CG2-CB 3.57Å; E210-N214 PolarHBondContact O-ND2 3.37Å; G211-N214 PolarHBondContact O-N 3.43Å; E212-N214 PolarHBondContact O-N 2.95Å; N214-A216 VanDerWaalsContact C-N 3.34Å; N214-R217 PolarHBondContact O-N 3.48Å; N214-R217 PolarHBondContact OD1-NH1 3.06Å; N214-F218 PolarHBondContact O-N 2.83Å
215	V	97.2	Very high	90.8	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.012	24%	0.239	C	C	.	.	H	α-helix	trans	-64.3	-42.2	174	172.8	0	0	0	0	110.8	I125 L136 L197 M199 I209 G211 E212 R217 F218 L219	I125-V215 HydrophobicContact CD1-CG1 4.11Å; L136-V215 HydrophobicContact CD1-CG1 4.22Å; L197-V215 HydrophobicContact CD2-CB 3.74Å; L197-V215 HydrophobicContact CD2-CG1 3.95Å; L197-V215 HydrophobicContact CD2-CG2 3.4Å; M199-V215 HydrophobicContact CB-CG1 4.27Å; M199-V215 HydrophobicContact CB-CG2 3.48Å; M199-V215 VanDerWaalsContact CB-CG2 3.48Å; M199-V215 HydrophobicContact CE-CG2 4.45Å; M199-V215 HydrophobicContact CG-CG2 4.45Å; M199-V215 HydrophobicContact SD-CB 4.48Å; M199-V215 HydrophobicContact SD-CG1 3.82Å; M199-V215 HydrophobicContact SD-CG2 4.25Å; I209-V215 HydrophobicContact CG2-CG2 3.99Å; G211-V215 PolarHBondContact O-N 2.71Å; E212-V215 PolarHBondContact O-N 2.84Å; V215-R217 PolarHBondContact O-N 3.37Å; V215-F218 PolarHBondContact O-N 2.8Å; V215-L219 HydrophobicContact CG1-CD1 3.9Å; V215-L219 HydrophobicContact CG1-CG 4.28Å; V215-L219 WeakPolarHBondContact O-CG 3.3Å; V215-L219 PolarHBondContact O-N 2.9Å
216	A	97.1	Very high	91.7	Very high	3 Å²	3	38.7 Å²	38.7	3%	0.025	21%	0.207	C	C	.	.	H	α-helix	trans	-62.1	-42.3	177.5	0	0	0	0	0	112	T135 L139 E212 A213 N214 F218 L219 F220 L279	T135-A216 HydrophobicContact CG2-CB 3.85Å; L139-A216 HydrophobicContact CD1-CB 3.71Å; E212-A216 WeakPolarHBondContact O-CB 3.33Å; E212-A216 PolarHBondContact O-N 3.38Å; A213-A216 PolarHBondContact O-N 3.03Å; N214-A216 VanDerWaalsContact C-N 3.34Å; A216-F218 PolarHBondContact O-N 3.14Å; A216-L219 PolarHBondContact O-N 3.37Å; A216-F220 VanDerWaalsContact O-CB 3.28Å; A216-F220 WeakPolarHBondContact O-CB 3.47Å; A216-F220 PolarHBondContact O-N 3.36Å; A216-L279 HydrophobicContact CB-CD1 4.1Å
217	R	96.3	Very high	92.3	Very high	31 Å²	31	37.5 Å²	37.5	12%	0.117	21%	0.205	C	C	.	.	H	α-helix	trans	-57.8	-47.4	172.3	-73.3	170.3	178.6	115.7	4.9	112.2	A213 N214 V215 K221 D237 D241 L279	A213-R217 WeakPolarHBondContact O-CG 3.46Å; A213-R217 PolarHBondContact O-N 3.45Å; N214-R217 PolarHBondContact O-N 3.48Å; N214-R217 PolarHBondContact OD1-NH1 3.06Å; V215-R217 PolarHBondContact O-N 3.37Å; R217-K221 WeakPolarHBondContact O-CG 3.38Å; R217-K221 PolarHBondContact O-N 3.36Å; R217-K221 VanDerWaalsContact O-N 3.08Å; R217-D237 WeakPolarHBondContact CD-OD1 3.28Å; R217-D237 IonicContact CZ-OD1 3.51Å; R217-D237 IonicContact NE-OD1 2.89Å; R217-D237 PolarHBondContact NE-OD1 3.12Å; R217-D237 PolarHBondContact NH2-O 3.05Å; R217-D237 IonicContact NH2-OD1 2.84Å; R217-D241 IonicContact CZ-OD1 3.68Å; R217-D241 IonicContact NH1-OD1 2.72Å; R217-D241 PolarHBondContact NH1-OD1 3.13Å; R217-D241 VanDerWaalsContact NH1-OD1 3.13Å; R217-D241 IonicContact NH2-OD1 3.81Å; R217-D241 PolarHBondContact NH2-OD1 3.33Å; R217-D241 IonicContact NH2-OD2 2.72Å; R217-D241 PolarHBondContact NH2-OD2 2.67Å; R217-L279 HydrophobicContact CB-CD2 4.23Å; R217-L279 HydrophobicContact CG-CD2 3.75Å
218	F	94.4	Very high	92.4	Very high	40 Å²	40	39 Å²	39	18%	0.175	22%	0.216	C	C	.	.	H	α-helix	trans	-60.2	-51.6	178.6	174.7	-94.4	0	0	0	111.5	M199 F201 N214 V215 A216 F220 K221 L222	M199-F218 HydrophobicContact CE-CB 3.98Å; M199-F218 HydrophobicContact CE-CD1 3.41Å; M199-F218 VanDerWaalsContact CE-CD1 3.41Å; M199-F218 HydrophobicContact CE-CD2 4.26Å; M199-F218 HydrophobicContact CE-CE1 3.91Å; M199-F218 HydrophobicContact CE-CG 3.62Å; M199-F218 HydrophobicContact SD-CD1 3.69Å; M199-F218 HydrophobicContact SD-CE1 4.09Å; M199-F218 HydrophobicContact SD-CG 4.43Å; F201-F218 HydrophobicContact CB-CZ 4.16Å; F201-F218 HydrophobicContact CD1-CZ 4.4Å; F201-F218 HydrophobicContact CD2-CE1 4.2Å; F201-F218 AromaticContact CD2-CZ 3.78Å; F201-F218 HydrophobicContact CD2-CZ 3.78Å; F201-F218 HydrophobicContact CE2-CZ 4.28Å; F201-F218 AromaticContact CG-CZ 3.85Å; F201-F218 HydrophobicContact CG-CZ 3.85Å; N214-F218 PolarHBondContact O-N 2.83Å; V215-F218 PolarHBondContact O-N 2.8Å; A216-F218 PolarHBondContact O-N 3.14Å; F218-F220 PolarHBondContact O-N 3.21Å; F218-K221 PolarHBondContact O-N 3.33Å; F218-L222 HydrophobicContact CE1-CD1 4.05Å; F218-L222 HydrophobicContact CZ-CD2 4.5Å; F218-L222 PolarHBondContact O-N 3.18Å
219	L	95.3	Very high	92.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.1	-38.8	-177.9	-64.2	175.8	0	0	0	112.2	I123 I125 L136 L139 L143 F187 V215 A216 K221 L222	I123-L219 HydrophobicContact CD1-CD2 3.91Å; I123-L219 HydrophobicContact CG2-CD2 4.27Å; I125-L219 HydrophobicContact CD1-CD1 4.44Å; L136-L219 HydrophobicContact CD1-CD1 3.39Å; L139-L219 HydrophobicContact CB-CB 4.24Å; L139-L219 HydrophobicContact CB-CD1 4.29Å; L139-L219 HydrophobicContact CD1-CB 4.09Å; L139-L219 HydrophobicContact CD1-CD1 4.41Å; L143-L219 HydrophobicContact CD1-CB 4.38Å; L143-L219 HydrophobicContact CD1-CD2 3.92Å; F187-L219 HydrophobicContact CE2-CD1 4.23Å; F187-L219 HydrophobicContact CE2-CD2 4.24Å; V215-L219 HydrophobicContact CG1-CD1 3.9Å; V215-L219 HydrophobicContact CG1-CG 4.28Å; V215-L219 WeakPolarHBondContact O-CG 3.3Å; V215-L219 PolarHBondContact O-N 2.9Å; A216-L219 PolarHBondContact O-N 3.37Å; L219-K221 VanDerWaalsContact C-N 3.35Å; L219-K221 PolarHBondContact O-N 3.01Å; L219-L222 HydrophobicContact CD2-CD1 4.42Å; L219-L222 WeakPolarHBondContact O-CB 3.43Å; L219-L222 PolarHBondContact O-N 3.3Å; L219-L222 VanDerWaalsContact O-N 3.13Å
220	F	94.3	Very high	92.5	Very high	7 Å²	7	43.3 Å²	43.3	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-66.7	-35.5	177.5	-169.7	-92.8	0	0	0	112.6	F103 L139 A216 F218 L222 L223 A224 Y226 L279 I282	F103-F220 AromaticContact CE1-CE2 3.93Å; F103-F220 HydrophobicContact CE1-CE2 3.93Å; F103-F220 HydrophobicContact CE1-CZ 4.4Å; L139-F220 HydrophobicContact CD2-CB 4.13Å; L139-F220 HydrophobicContact CD2-CD2 3.91Å; A216-F220 VanDerWaalsContact O-CB 3.28Å; A216-F220 WeakPolarHBondContact O-CB 3.47Å; A216-F220 PolarHBondContact O-N 3.36Å; F218-F220 PolarHBondContact O-N 3.21Å; F220-L222 PolarHBondContact O-N 2.92Å; F220-L223 WeakPolarHBondContact O-CB 3.39Å; F220-L223 PolarHBondContact O-N 3.29Å; F220-A224 HydrophobicContact CE1-CB 3.85Å; F220-A224 HydrophobicContact CZ-CB 3.94Å; F220-A224 PolarHBondContact O-N 3.08Å; F220-Y226 HydrophobicContact CD1-CD2 4.49Å; F220-Y226 HydrophobicContact CD1-CE2 4.34Å; F220-L279 HydrophobicContact CB-CB 4.24Å; F220-L279 HydrophobicContact CB-CD1 3.95Å; F220-L279 HydrophobicContact CB-CD2 3.99Å; F220-L279 HydrophobicContact CB-CG 4.28Å; F220-L279 HydrophobicContact CD1-CB 3.89Å; F220-L279 HydrophobicContact CD2-CB 3.94Å; F220-L279 HydrophobicContact CD2-CD1 4.11Å; F220-L279 HydrophobicContact CE1-CB 4.2Å; F220-L279 HydrophobicContact CE2-CB 4.24Å; F220-L279 HydrophobicContact CG-CB 3.75Å; F220-L279 HydrophobicContact CG-CD1 4.15Å; F220-L279 HydrophobicContact CG-CD2 4.39Å; F220-L279 HydrophobicContact CG-CG 4.3Å; F220-L279 HydrophobicContact CZ-CB 4.37Å; F220-I282 HydrophobicContact CD2-CD1 3.92Å; F220-I282 HydrophobicContact CE2-CD1 3.87Å
221	K	91.9	Very high	92.5	Very high	111 Å²	111	41.2 Å²	41.2	48%	0.483	24%	0.244	S	C	.	.	H	α-helix	trans	-62.4	-21.3	173.3	-78	-173.8	179.5	-164.5	0	113.2	L112 R217 F218 L219 L223 Y226	L112-K221 VanDerWaalsContact CD2-O 3.29Å; L112-K221 WeakPolarHBondContact CD2-O 3.34Å; R217-K221 WeakPolarHBondContact O-CG 3.38Å; R217-K221 PolarHBondContact O-N 3.36Å; R217-K221 VanDerWaalsContact O-N 3.08Å; F218-K221 PolarHBondContact O-N 3.33Å; L219-K221 VanDerWaalsContact C-N 3.35Å; L219-K221 PolarHBondContact O-N 3.01Å; K221-L223 VanDerWaalsContact C-N 3.31Å; K221-Y226 HydrophobicContact CG-CD2 3.94Å; K221-Y226 HydrophobicContact CG-CE2 4.5Å
222	L	91.3	Very high	92.4	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.021	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-18.5	171.4	-52.5	-178.5	0	0	0	112.7	L109 L112 L113 I123 L143 Y147 F218 L219 F220	L109-L222 HydrophobicContact CD2-CD2 4.35Å; L112-L222 HydrophobicContact CD2-CD2 3.59Å; L113-L222 HydrophobicContact CD1-CD2 3.91Å; L113-L222 HydrophobicContact CD2-CD2 3.94Å; L113-L222 HydrophobicContact CG-CD2 4.25Å; I123-L222 HydrophobicContact CD1-CD1 4.09Å; L143-L222 HydrophobicContact CD2-CB 3.9Å; L143-L222 HydrophobicContact CD2-CD1 4.25Å; Y147-L222 HydrophobicContact CE2-CB 4.49Å; Y147-L222 VanDerWaalsContact CE2-O 3.32Å; Y147-L222 WeakPolarHBondContact CE2-O 3.49Å; Y147-L222 PolarHBondContact OH-O 3.06Å; F218-L222 HydrophobicContact CE1-CD1 4.05Å; F218-L222 HydrophobicContact CZ-CD2 4.5Å; F218-L222 PolarHBondContact O-N 3.18Å; L219-L222 HydrophobicContact CD2-CD1 4.42Å; L219-L222 WeakPolarHBondContact O-CB 3.43Å; L219-L222 PolarHBondContact O-N 3.3Å; L219-L222 VanDerWaalsContact O-N 3.13Å; F220-L222 PolarHBondContact O-N 2.92Å
223	L	89.9	Confident	92.3	Very high	1 Å²	1	42 Å²	42	1%	0.005	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-39.3	-172.7	-70.1	167.8	0	0	0	113.4	F103 L139 L142 L143 H146 F220 K221	F103-L223 HydrophobicContact CD1-CB 3.9Å; F103-L223 HydrophobicContact CE1-CB 4.2Å; L139-L223 HydrophobicContact CD2-CD1 3.96Å; L142-L223 HydrophobicContact CB-CD1 3.55Å; L142-L223 HydrophobicContact CB-CD2 3.95Å; L142-L223 HydrophobicContact CB-CG 4.42Å; L142-L223 HydrophobicContact CD1-CD1 4.08Å; L142-L223 HydrophobicContact CG-CD1 4.47Å; L143-L223 HydrophobicContact CD2-CD1 4.45Å; L143-L223 HydrophobicContact CD2-CD2 3.69Å; L143-L223 HydrophobicContact CD2-CG 3.81Å; L143-L223 HydrophobicContact CG-CD1 4.33Å; L143-L223 HydrophobicContact CG-CD2 4.02Å; L143-L223 HydrophobicContact CG-CG 4.19Å; H146-L223 HydrophobicContact CB-CD2 4.1Å; F220-L223 WeakPolarHBondContact O-CB 3.39Å; F220-L223 PolarHBondContact O-N 3.29Å; K221-L223 VanDerWaalsContact C-N 3.31Å
224	A	86.2	Confident	92.3	Very high	7 Å²	7	46.4 Å²	46.4	6%	0.058	28%	0.276	C	S	.	.	S	Bend	trans	-141.4	150.6	-173.1	0	0	0	0	0	110.4	F103 F220 Y226	F103-A224 HydrophobicContact CD1-CB 4.08Å; F103-A224 HydrophobicContact CE1-CB 4.44Å; F220-A224 HydrophobicContact CE1-CB 3.85Å; F220-A224 HydrophobicContact CZ-CB 3.94Å; F220-A224 PolarHBondContact O-N 3.08Å; A224-Y226 PolarHBondContact O-N 2.86Å
225	P	81.8	Confident	92.3	Very high	85 Å²	85	46.8 Å²	46.8	55%	0.552	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-70.5	136.4	173.6	29.9	-18.6	0	0	0	107.5	A105	A105-P225 HydrophobicContact CB-CB 4.23Å; A105-P225 HydrophobicContact CB-CG 3.54Å
226	Y	83.4	Confident	92.3	Very high	40 Å²	40	46.8 Å²	46.8	16%	0.157	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-65.4	149.6	171.7	-129.2	-108.3	0	0	0	109.6	F220 K221 A224 S228 A233 V236 D237	F220-Y226 HydrophobicContact CD1-CD2 4.49Å; F220-Y226 HydrophobicContact CD1-CE2 4.34Å; K221-Y226 HydrophobicContact CG-CD2 3.94Å; K221-Y226 HydrophobicContact CG-CE2 4.5Å; A224-Y226 PolarHBondContact O-N 2.86Å; Y226-S228 PolarHBondContact O-N 3.37Å; Y226-A233 HydrophobicContact CD1-CB 3.73Å; Y226-A233 HydrophobicContact CE1-CB 3.97Å; Y226-V236 HydrophobicContact CE1-CB 4.42Å; Y226-V236 WeakPolarHBondContact OH-CG1 3.42Å; Y226-D237 PolarHBondContact OH-OD1 3.15Å
227	P	87.7	Confident	92.4	Very high	48 Å²	48	48.9 Å²	48.9	31%	0.312	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-50.3	131.8	177.1	-27.7	34.9	0	0	0	111.5	D229 V232 A233 V236	P227-D229 VanDerWaalsContact C-N 3.29Å; P227-V232 HydrophobicContact CB-CB 3.99Å; P227-V232 HydrophobicContact CB-CG1 3.78Å; P227-V232 HydrophobicContact CG-CG1 3.87Å; P227-A233 HydrophobicContact CB-CB 4.41Å; P227-V236 HydrophobicContact CG-CG2 4.28Å
228	S	87.6	Confident	92.5	Very high	126 Å²	126	50.5 Å²	50.5	88%	0.881	30%	0.304	S	S	*	.	S	Bend	trans	-71.7	-26.6	179.6	-51.9	0	0	0	0	112.5	Y226 P230	Y226-S228 PolarHBondContact O-N 3.37Å; S228-P230 WeakPolarHBondContact O-CD 3.46Å
229	D	92.7	Very high	92.7	Very high	86 Å²	86	49.9 Å²	49.9	46%	0.46	30%	0.301	S	S	.	.	S	Bend	trans	-72.6	117	171.3	179.8	-0.1	0	0	0	110.1	P227 A231 V232 A233	P227-D229 VanDerWaalsContact C-N 3.29Å; D229-A231 PolarHBondContact O-N 3.32Å; D229-A231 WeakPolarHBondContact OD1-CB 3.45Å; D229-A231 PolarHBondContact OD1-N 3.28Å; D229-V232 HydrophobicContact CB-CB 4.26Å; D229-V232 HydrophobicContact CB-CG2 4.09Å; D229-V232 PolarHBondContact O-N 3.47Å; D229-V232 WeakPolarHBondContact OD2-CG2 3.2Å; D229-A233 PolarHBondContact O-N 3.09Å
230	P	94.3	Very high	92.8	Very high	96 Å²	96	49.9 Å²	49.9	62%	0.623	30%	0.301	S	S	*	.	H	α-helix	trans	-57.9	-31.4	179.1	-24.3	34.7	0	0	0	114	S228 T234	S228-P230 WeakPolarHBondContact O-CD 3.46Å; P230-T234 WeakPolarHBondContact O-CB 3.48Å; P230-T234 PolarHBondContact O-N 2.78Å; P230-T234 PolarHBondContact O-OG1 3.37Å
231	A	95.3	Very high	93	Very high	67 Å²	67	52.3 Å²	52.3	55%	0.554	31%	0.314	S	S	*	.	H	α-helix	trans	-68.3	-45	179.6	0	0	0	0	0	110.9	D229 T234 L235	D229-A231 PolarHBondContact O-N 3.32Å; D229-A231 WeakPolarHBondContact OD1-CB 3.45Å; D229-A231 PolarHBondContact OD1-N 3.28Å; A231-T234 PolarHBondContact O-N 2.96Å; A231-L235 WeakPolarHBondContact O-CB 3.38Å; A231-L235 PolarHBondContact O-N 3.42Å
232	V	93.4	Very high	93.2	Very high	46 Å²	46	48.1 Å²	48.1	28%	0.279	30%	0.298	S	S	.	.	H	α-helix	trans	-68.2	-42.2	176.5	-179	0	0	0	0	110.8	P227 D229 T234 L235 V236	P227-V232 HydrophobicContact CB-CB 3.99Å; P227-V232 HydrophobicContact CB-CG1 3.78Å; P227-V232 HydrophobicContact CG-CG1 3.87Å; D229-V232 HydrophobicContact CB-CB 4.26Å; D229-V232 HydrophobicContact CB-CG2 4.09Å; D229-V232 PolarHBondContact O-N 3.47Å; D229-V232 WeakPolarHBondContact OD2-CG2 3.2Å; V232-T234 VanDerWaalsContact C-N 3.32Å; V232-T234 PolarHBondContact O-N 2.81Å; V232-L235 WeakPolarHBondContact O-CB 3.42Å; V232-L235 PolarHBondContact O-N 2.82Å; V232-L235 VanDerWaalsContact O-N 3.16Å; V232-V236 WeakPolarHBondContact O-CG2 3.48Å; V232-V236 PolarHBondContact O-N 2.93Å
233	A	94.6	Very high	93.5	Very high	14 Å²	14	47.9 Å²	47.9	12%	0.116	30%	0.297	C	S	.	.	H	α-helix	trans	-56.8	-46.5	175.5	0	0	0	0	0	111.8	Y226 P227 D229 L235 V236 D237	Y226-A233 HydrophobicContact CD1-CB 3.73Å; Y226-A233 HydrophobicContact CE1-CB 3.97Å; P227-A233 HydrophobicContact CB-CB 4.41Å; D229-A233 PolarHBondContact O-N 3.09Å; A233-L235 VanDerWaalsContact C-N 3.32Å; A233-L235 PolarHBondContact O-N 3.49Å; A233-V236 PolarHBondContact O-N 3.47Å; A233-D237 PolarHBondContact O-N 3.13Å; A233-D237 VanDerWaalsContact O-N 3.07Å
234	T	97	Very high	93.8	Very high	94 Å²	94	48.7 Å²	48.7	58%	0.577	30%	0.3	S	S	*	.	H	α-helix	trans	-66.1	-35.6	177.8	-57.6	0	0	0	0	111.7	P230 A231 V232 D237 S238	P230-T234 WeakPolarHBondContact O-CB 3.48Å; P230-T234 PolarHBondContact O-N 2.78Å; P230-T234 PolarHBondContact O-OG1 3.37Å; A231-T234 PolarHBondContact O-N 2.96Å; V232-T234 VanDerWaalsContact C-N 3.32Å; V232-T234 PolarHBondContact O-N 2.81Å; T234-D237 PolarHBondContact O-N 3.3Å; T234-S238 WeakPolarHBondContact O-CB 3.26Å; T234-S238 PolarHBondContact O-N 3.2Å
235	L	97.1	Very high	94.1	Very high	75 Å²	75	54.9 Å²	54.9	39%	0.393	32%	0.323	S	S	.	.	H	α-helix	trans	-64	-42.8	175.2	-177.6	62.5	0	0	0	111.7	A231 V232 A233 S238 W239 C273	A231-L235 WeakPolarHBondContact O-CB 3.38Å; A231-L235 PolarHBondContact O-N 3.42Å; V232-L235 WeakPolarHBondContact O-CB 3.42Å; V232-L235 PolarHBondContact O-N 2.82Å; V232-L235 VanDerWaalsContact O-N 3.16Å; A233-L235 VanDerWaalsContact C-N 3.32Å; A233-L235 PolarHBondContact O-N 3.49Å; L235-S238 PolarHBondContact O-N 3.47Å; L235-W239 PolarHBondContact O-N 3.18Å; L235-C273 HydrophobicContact CD2-CB 4.44Å
236	V	97.5	Very high	94.8	Very high	2 Å²	2	54.7 Å²	54.7	1%	0.012	32%	0.315	C	S	.	.	H	α-helix	trans	-58.7	-50.4	174	177	0	0	0	0	109.8	Y226 P227 V232 A233 S238 W239 V240 C273 L279 A280	Y226-V236 HydrophobicContact CE1-CB 4.42Å; Y226-V236 WeakPolarHBondContact OH-CG1 3.42Å; P227-V236 HydrophobicContact CG-CG2 4.28Å; V232-V236 WeakPolarHBondContact O-CG2 3.48Å; V232-V236 PolarHBondContact O-N 2.93Å; A233-V236 PolarHBondContact O-N 3.47Å; V236-S238 VanDerWaalsContact C-N 3.31Å; V236-S238 PolarHBondContact O-N 3.21Å; V236-W239 PolarHBondContact O-N 3.39Å; V236-V240 WeakPolarHBondContact O-CG2 3.41Å; V236-V240 PolarHBondContact O-N 3.01Å; V236-C273 HydrophobicContact CG2-CB 3.76Å; V236-C273 VanDerWaalsContact CG2-SG 3.58Å; V236-L279 HydrophobicContact CG1-CB 4.15Å; V236-A280 HydrophobicContact CG1-CB 4.17Å
237	D	97.9	Very high	95.2	Very high	47 Å²	47	53 Å²	53	25%	0.251	31%	0.308	S	S	.	.	H	α-helix	trans	-60.9	-39.4	179.3	-80.1	-37.5	0	0	0	112.5	R217 Y226 A233 T234 W239 V240 D241	R217-D237 WeakPolarHBondContact CD-OD1 3.28Å; R217-D237 IonicContact CZ-OD1 3.51Å; R217-D237 IonicContact NE-OD1 2.89Å; R217-D237 PolarHBondContact NE-OD1 3.12Å; R217-D237 PolarHBondContact NH2-O 3.05Å; R217-D237 IonicContact NH2-OD1 2.84Å; Y226-D237 PolarHBondContact OH-OD1 3.15Å; A233-D237 PolarHBondContact O-N 3.13Å; A233-D237 VanDerWaalsContact O-N 3.07Å; T234-D237 PolarHBondContact O-N 3.3Å; D237-W239 PolarHBondContact O-N 3.4Å; D237-V240 WeakPolarHBondContact O-CB 3.44Å; D237-V240 PolarHBondContact O-N 2.82Å; D237-D241 PolarHBondContact O-N 3.26Å
238	S	98.2	Very high	95.4	Very high	64 Å²	64	51.2 Å²	51.2	45%	0.448	30%	0.298	S	S	.	.	H	α-helix	trans	-63.7	-39	176.9	-178.6	0	0	0	0	112.4	T234 L235 V236 T242	T234-S238 WeakPolarHBondContact O-CB 3.26Å; T234-S238 PolarHBondContact O-N 3.2Å; L235-S238 PolarHBondContact O-N 3.47Å; V236-S238 VanDerWaalsContact C-N 3.31Å; V236-S238 PolarHBondContact O-N 3.21Å; S238-T242 WeakPolarHBondContact O-CB 3.43Å; S238-T242 PolarHBondContact O-N 3.19Å; S238-T242 PolarHBondContact O-OG1 3.19Å
239	W	98.4	Very high	95.4	Very high	27 Å²	27	50.6 Å²	50.6	10%	0.102	29%	0.285	C	S	.	.	H	α-helix	trans	-68.5	-38.4	174.2	-85.4	114.5	0	0	0	112.3	L235 V236 D237 T242 A243 A261 L262 A265 L272 A280	L235-W239 PolarHBondContact O-N 3.18Å; V236-W239 PolarHBondContact O-N 3.39Å; D237-W239 PolarHBondContact O-N 3.4Å; W239-T242 HydrophobicContact CE3-CG2 4.36Å; W239-T242 HydrophobicContact CZ3-CG2 4.36Å; W239-T242 WeakPolarHBondContact O-CB 3.49Å; W239-T242 PolarHBondContact O-N 3.39Å; W239-A243 WeakPolarHBondContact O-CB 3.42Å; W239-A243 PolarHBondContact O-N 3.26Å; W239-A261 HydrophobicContact CH2-CB 3.81Å; W239-L262 HydrophobicContact CE3-CD2 4.03Å; W239-L262 HydrophobicContact CH2-CD2 3.94Å; W239-L262 HydrophobicContact CH2-CG 4.18Å; W239-L262 HydrophobicContact CZ3-CD2 3.5Å; W239-L262 HydrophobicContact CZ3-CG 3.85Å; W239-A265 HydrophobicContact CZ2-CB 3.8Å; W239-L272 HydrophobicContact CD2-CD1 4.49Å; W239-A280 HydrophobicContact CB-CB 3.52Å; W239-A280 HydrophobicContact CG-CB 4.24Å
240	V	98.3	Very high	95.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.8	-47.8	174.4	172.8	0	0	0	0	110.3	A213 V236 D237 T242 A243 F244 L279 A283	A213-V240 HydrophobicContact CB-CG1 4.03Å; V236-V240 WeakPolarHBondContact O-CG2 3.41Å; V236-V240 PolarHBondContact O-N 3.01Å; D237-V240 WeakPolarHBondContact O-CB 3.44Å; D237-V240 PolarHBondContact O-N 2.82Å; V240-T242 VanDerWaalsContact C-N 3.33Å; V240-T242 PolarHBondContact O-N 2.9Å; V240-A243 WeakPolarHBondContact O-CB 3.43Å; V240-A243 PolarHBondContact O-N 2.72Å; V240-F244 HydrophobicContact CG1-CD2 3.96Å; V240-F244 HydrophobicContact CG1-CE2 3.92Å; V240-F244 VanDerWaalsContact O-CD2 3.23Å; V240-F244 WeakPolarHBondContact O-CD2 3.27Å; V240-F244 PolarHBondContact O-N 2.81Å; V240-F244 VanDerWaalsContact O-N 3.16Å; V240-L279 HydrophobicContact CG2-CB 4.33Å; V240-L279 HydrophobicContact CG2-CD2 3.94Å; V240-L279 HydrophobicContact CG2-CG 3.72Å; V240-A283 HydrophobicContact CG2-CB 4.24Å
241	D	98.1	Very high	95.1	Very high	59 Å²	59	45.1 Å²	45.1	32%	0.316	26%	0.257	S	S	.	.	H	α-helix	trans	-63.1	-40.4	176	-72.7	-21.6	0	0	0	111.9	R217 D237 A243 F244 Y245	R217-D241 IonicContact CZ-OD1 3.68Å; R217-D241 IonicContact NH1-OD1 2.72Å; R217-D241 PolarHBondContact NH1-OD1 3.13Å; R217-D241 VanDerWaalsContact NH1-OD1 3.13Å; R217-D241 IonicContact NH2-OD1 3.81Å; R217-D241 PolarHBondContact NH2-OD1 3.33Å; R217-D241 IonicContact NH2-OD2 2.72Å; R217-D241 PolarHBondContact NH2-OD2 2.67Å; D237-D241 PolarHBondContact O-N 3.26Å; D241-A243 VanDerWaalsContact C-N 3.3Å; D241-A243 PolarHBondContact O-N 2.92Å; D241-F244 PolarHBondContact O-N 3.17Å; D241-Y245 HydrophobicContact CB-CD2 3.91Å; D241-Y245 HydrophobicContact CB-CE2 4.17Å; D241-Y245 WeakPolarHBondContact O-CB 3.26Å; D241-Y245 VanDerWaalsContact O-CD2 3.23Å; D241-Y245 WeakPolarHBondContact O-CD2 3.09Å; D241-Y245 PolarHBondContact O-N 2.78Å
242	T	97.6	Very high	94.9	Very high	22 Å²	22	45.9 Å²	45.9	14%	0.135	26%	0.263	C	S	.	.	H	α-helix	trans	-60.9	-40.3	175.8	-58.5	0	0	0	0	111.4	S238 W239 V240 Q246 L247 V258	S238-T242 WeakPolarHBondContact O-CB 3.43Å; S238-T242 PolarHBondContact O-N 3.19Å; S238-T242 PolarHBondContact O-OG1 3.19Å; W239-T242 HydrophobicContact CE3-CG2 4.36Å; W239-T242 HydrophobicContact CZ3-CG2 4.36Å; W239-T242 WeakPolarHBondContact O-CB 3.49Å; W239-T242 PolarHBondContact O-N 3.39Å; V240-T242 VanDerWaalsContact C-N 3.33Å; V240-T242 PolarHBondContact O-N 2.9Å; T242-Q246 HydrophobicContact CG2-CB 4.38Å; T242-Q246 WeakPolarHBondContact O-CA 3.47Å; T242-Q246 WeakPolarHBondContact O-CB 3.29Å; T242-Q246 PolarHBondContact O-N 3.01Å; T242-L247 PolarHBondContact O-N 3.02Å; T242-V258 HydrophobicContact CG2-CB 4.41Å; T242-V258 HydrophobicContact CG2-CG1 3.86Å; T242-V258 HydrophobicContact CG2-CG2 3.66Å
243	A	96.8	Very high	94.8	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.286	C	S	.	.	I	π-helix	trans	-61.7	-51.6	177.7	0	0	0	0	0	111.6	W239 V240 D241 L247 A248 A283 C287	W239-A243 WeakPolarHBondContact O-CB 3.42Å; W239-A243 PolarHBondContact O-N 3.26Å; V240-A243 WeakPolarHBondContact O-CB 3.43Å; V240-A243 PolarHBondContact O-N 2.72Å; D241-A243 VanDerWaalsContact C-N 3.3Å; D241-A243 PolarHBondContact O-N 2.92Å; A243-L247 VanDerWaalsContact O-CB 3.26Å; A243-L247 WeakPolarHBondContact O-CB 3.3Å; A243-L247 PolarHBondContact O-N 2.99Å; A243-A248 PolarHBondContact O-N 3.03Å; A243-A283 HydrophobicContact CB-CB 3.92Å; A243-C287 HydrophobicContact CB-CB 4.32Å
244	F	95.3	Very high	94.8	Very high	18 Å²	18	55.7 Å²	55.7	8%	0.079	30%	0.3	C	S	.	.	I	π-helix	trans	-75.8	-44.3	-175.7	-71.1	-71.5	0	0	0	112.9	T135 E212 A213 V240 D241 D249 A283	T135-F244 HydrophobicContact CG2-CZ 4.22Å; T135-F244 WeakPolarHBondContact OG1-CZ 3.41Å; E212-F244 HydrophobicContact CB-CD1 4.2Å; E212-F244 HydrophobicContact CB-CE1 3.73Å; E212-F244 HydrophobicContact CB-CZ 4.15Å; E212-F244 VanDerWaalsContact CD-CE1 3.4Å; E212-F244 HydrophobicContact CG-CD1 4.47Å; E212-F244 HydrophobicContact CG-CE1 3.54Å; E212-F244 HydrophobicContact CG-CZ 3.73Å; A213-F244 HydrophobicContact CB-CB 4.4Å; A213-F244 HydrophobicContact CB-CD2 3.44Å; A213-F244 VanDerWaalsContact CB-CD2 3.44Å; A213-F244 HydrophobicContact CB-CE2 3.94Å; A213-F244 HydrophobicContact CB-CG 4.04Å; V240-F244 HydrophobicContact CG1-CD2 3.96Å; V240-F244 HydrophobicContact CG1-CE2 3.92Å; V240-F244 VanDerWaalsContact O-CD2 3.23Å; V240-F244 WeakPolarHBondContact O-CD2 3.27Å; V240-F244 PolarHBondContact O-N 2.81Å; V240-F244 VanDerWaalsContact O-N 3.16Å; D241-F244 PolarHBondContact O-N 3.17Å; F244-D249 PolarHBondContact O-N 2.99Å; F244-A283 HydrophobicContact CE2-CB 3.87Å; F244-A283 HydrophobicContact CZ-CB 4.36Å
245	Y	94.3	Very high	94.5	Very high	137 Å²	137	55.1 Å²	55.1	54%	0.537	29%	0.288	S	S	.	.	I	π-helix	trans	-87.8	-25.9	-172.5	-61.5	-60.2	0	0	0	114.6	D241	D241-Y245 HydrophobicContact CB-CD2 3.91Å; D241-Y245 HydrophobicContact CB-CE2 4.17Å; D241-Y245 WeakPolarHBondContact O-CB 3.26Å; D241-Y245 VanDerWaalsContact O-CD2 3.23Å; D241-Y245 WeakPolarHBondContact O-CD2 3.09Å; D241-Y245 PolarHBondContact O-N 2.78Å
246	Q	94.4	Very high	94.3	Very high	81 Å²	81	53.8 Å²	53.8	38%	0.379	29%	0.288	S	S	.	.	I	π-helix	trans	-115.7	-35.5	-176.7	-60.3	179.9	38.6	0	0	113.1	T242 G250 V258	T242-Q246 HydrophobicContact CG2-CB 4.38Å; T242-Q246 WeakPolarHBondContact O-CA 3.47Å; T242-Q246 WeakPolarHBondContact O-CB 3.29Å; T242-Q246 PolarHBondContact O-N 3.01Å; Q246-G250 WeakPolarHBondContact O-CA 3.3Å; Q246-G250 PolarHBondContact O-N 3.14Å; Q246-V258 HydrophobicContact CB-CG2 3.71Å
247	L	92.5	Very high	94.1	Very high	4 Å²	4	55.4 Å²	55.4	2%	0.021	30%	0.301	C	S	.	.	I	π-helix	trans	-83.7	-50.9	-179.7	-170.2	60.8	0	0	0	111.9	T242 A243 R255 V258 C287 L288 N291	T242-L247 PolarHBondContact O-N 3.02Å; A243-L247 VanDerWaalsContact O-CB 3.26Å; A243-L247 WeakPolarHBondContact O-CB 3.3Å; A243-L247 PolarHBondContact O-N 2.99Å; L247-R255 PolarHBondContact O-NE 3.18Å; L247-V258 HydrophobicContact CB-CG1 4.23Å; L247-V258 HydrophobicContact CD1-CB 4.38Å; L247-V258 HydrophobicContact CD1-CG1 4.11Å; L247-V258 HydrophobicContact CD2-CG1 4.44Å; L247-C287 HydrophobicContact CB-CB 4.34Å; L247-C287 HydrophobicContact CD2-CB 4Å; L247-C287 HydrophobicContact CG-CB 4.2Å; L247-L288 HydrophobicContact CD1-CD1 4.41Å; L247-L288 HydrophobicContact CD2-CB 4.14Å; L247-N291 PolarHBondContact O-ND2 3.49Å
248	A	91.4	Very high	93.9	Very high	11 Å²	11	53.3 Å²	53.3	9%	0.091	29%	0.29	C	S	.	.	I	π-helix	trans	-70.5	-57	178.3	0	0	0	0	0	111.4	A243 R255 C287	A243-A248 PolarHBondContact O-N 3.03Å; A248-R255 PolarHBondContact O-NH2 3.28Å; A248-C287 HydrophobicContact CB-CB 4.17Å
249	D	88.4	Confident	93.7	Very high	113 Å²	113	52.5 Å²	52.5	60%	0.604	28%	0.28	S	S	*	.	S	Bend	trans	-97.6	-4.7	-170.8	-65.6	-22.5	0	0	0	114.5	F244	F244-D249 PolarHBondContact O-N 2.99Å
250	G	89.6	Confident	93.5	Very high	8 Å²	8	59.3 Å²	59.3	8%	0.082	31%	0.306	C	S	.	.	S	Bend	trans	-78.9	162.6	-176.1	0	0	0	0	0	114.5	Q246 R255	Q246-G250 WeakPolarHBondContact O-CA 3.3Å; Q246-G250 PolarHBondContact O-N 3.14Å; G250-R255 PolarHBondContact O-NE 3.18Å; G250-R255 PolarHBondContact O-NH2 3.37Å
251	S	91.9	Very high	93.4	Very high	59 Å²	59	61.5 Å²	61.5	41%	0.413	32%	0.324	S	S	.	.			trans	-64.9	165.5	172.9	66.9	0	0	0	0	112.8	K253 E254 R255	S251-K253 PolarHBondContact O-N 3.5Å; S251-K253 VanDerWaalsContact O-N 3.14Å; S251-E254 VanDerWaalsContact CB-OE2 3.28Å; S251-E254 WeakPolarHBondContact CB-OE2 3.45Å; S251-E254 PolarHBondContact N-OE2 3.3Å; S251-E254 PolarHBondContact O-N 3.21Å; S251-E254 VanDerWaalsContact O-N 3.1Å; S251-E254 PolarHBondContact OG-N 2.91Å; S251-E254 PolarHBondContact OG-OE2 3.14Å; S251-R255 WeakPolarHBondContact O-CG 3.47Å; S251-R255 PolarHBondContact O-N 2.96Å
252	A	90.6	Very high	93.3	Very high	83 Å²	83	58.7 Å²	58.7	69%	0.686	31%	0.309	S	S	*	.	H	α-helix	trans	-55.3	-33.9	176.1	0	0	0	0	0	113.3	A256	A252-A256 VanDerWaalsContact O-CB 3.31Å; A252-A256 WeakPolarHBondContact O-CB 3.35Å; A252-A256 PolarHBondContact O-N 3.05Å
253	K	92	Very high	93.2	Very high	178 Å²	178	59.5 Å²	59.5	77%	0.774	31%	0.312	S	S	*	.	H	α-helix	trans	-70.3	-43.1	177.6	-174	-178.3	178.3	-175.7	0	111.8	S251 A256 A257	S251-K253 PolarHBondContact O-N 3.5Å; S251-K253 VanDerWaalsContact O-N 3.14Å; K253-A256 PolarHBondContact O-N 3.17Å; K253-A257 PolarHBondContact O-N 3.1Å
254	E	93.5	Very high	93.1	Very high	87 Å²	87	62.5 Å²	62.5	41%	0.407	33%	0.334	S	S	.	.	H	α-helix	trans	-64.6	-48	176	-72.6	159.9	138.8	0	0	110.3	S251 A256 A257 V258	S251-E254 VanDerWaalsContact CB-OE2 3.28Å; S251-E254 WeakPolarHBondContact CB-OE2 3.45Å; S251-E254 PolarHBondContact N-OE2 3.3Å; S251-E254 PolarHBondContact O-N 3.21Å; S251-E254 VanDerWaalsContact O-N 3.1Å; S251-E254 PolarHBondContact OG-N 2.91Å; S251-E254 PolarHBondContact OG-OE2 3.14Å; E254-A256 VanDerWaalsContact C-N 3.33Å; E254-A256 PolarHBondContact O-N 3.23Å; E254-A257 CarbonylContact O-C 3.59Å; E254-A257 WeakPolarHBondContact O-CA 3.33Å; E254-A257 WeakPolarHBondContact O-CB 3.33Å; E254-A257 PolarHBondContact O-N 3.13Å; E254-V258 WeakPolarHBondContact O-CG2 2.95Å; E254-V258 PolarHBondContact O-N 3.03Å
255	R	91.8	Very high	93.2	Very high	82 Å²	82	62.7 Å²	62.7	31%	0.309	34%	0.338	S	S	.	.	H	α-helix	trans	-55.5	-46	175.1	-67	174.6	-173.7	-168.2	-6	112.1	L247 A248 G250 S251 A257 V258 L259 N291	L247-R255 PolarHBondContact O-NE 3.18Å; A248-R255 PolarHBondContact O-NH2 3.28Å; G250-R255 PolarHBondContact O-NE 3.18Å; G250-R255 PolarHBondContact O-NH2 3.37Å; S251-R255 WeakPolarHBondContact O-CG 3.47Å; S251-R255 PolarHBondContact O-N 2.96Å; R255-A257 VanDerWaalsContact C-N 3.3Å; R255-A257 PolarHBondContact O-N 2.84Å; R255-V258 PolarHBondContact O-N 3.49Å; R255-L259 WeakPolarHBondContact O-CG 3.45Å; R255-L259 PolarHBondContact O-N 3.47Å; R255-N291 PolarHBondContact NH1-OD1 2.99Å; R255-N291 PolarHBondContact NH2-OD1 3.35Å
256	A	91.3	Very high	93.3	Very high	48 Å²	48	56.5 Å²	56.5	40%	0.397	32%	0.315	S	S	.	.	H	α-helix	trans	-64.5	-32.4	176.2	0	0	0	0	0	113.1	A252 K253 E254 R260	A252-A256 VanDerWaalsContact O-CB 3.31Å; A252-A256 WeakPolarHBondContact O-CB 3.35Å; A252-A256 PolarHBondContact O-N 3.05Å; K253-A256 PolarHBondContact O-N 3.17Å; E254-A256 VanDerWaalsContact C-N 3.33Å; E254-A256 PolarHBondContact O-N 3.23Å; A256-R260 PolarHBondContact O-N 3.48Å; A256-R260 PolarHBondContact O-NE 2.85Å
257	A	93.7	Very high	93.3	Very high	35 Å²	35	55 Å²	55	29%	0.289	32%	0.321	S	S	.	.	H	α-helix	trans	-69.7	-44.1	173.6	0	0	0	0	0	111.9	K253 E254 R255 L259 R260 A261	K253-A257 PolarHBondContact O-N 3.1Å; E254-A257 CarbonylContact O-C 3.59Å; E254-A257 WeakPolarHBondContact O-CA 3.33Å; E254-A257 WeakPolarHBondContact O-CB 3.33Å; E254-A257 PolarHBondContact O-N 3.13Å; R255-A257 VanDerWaalsContact C-N 3.3Å; R255-A257 PolarHBondContact O-N 2.84Å; A257-L259 VanDerWaalsContact C-N 3.34Å; A257-L259 PolarHBondContact O-N 2.8Å; A257-R260 PolarHBondContact O-N 2.88Å; A257-A261 PolarHBondContact O-N 2.85Å
258	V	94.9	Very high	93.4	Very high	3 Å²	3	65.2 Å²	65.2	2%	0.018	36%	0.359	C	S	.	.	H	α-helix	trans	-61.1	-42.8	175.3	177.3	0	0	0	0	110.8	T242 Q246 L247 E254 R255 R260 A261 L262	T242-V258 HydrophobicContact CG2-CB 4.41Å; T242-V258 HydrophobicContact CG2-CG1 3.86Å; T242-V258 HydrophobicContact CG2-CG2 3.66Å; Q246-V258 HydrophobicContact CB-CG2 3.71Å; L247-V258 HydrophobicContact CB-CG1 4.23Å; L247-V258 HydrophobicContact CD1-CB 4.38Å; L247-V258 HydrophobicContact CD1-CG1 4.11Å; L247-V258 HydrophobicContact CD2-CG1 4.44Å; E254-V258 WeakPolarHBondContact O-CG2 2.95Å; E254-V258 PolarHBondContact O-N 3.03Å; R255-V258 PolarHBondContact O-N 3.49Å; V258-R260 VanDerWaalsContact C-N 3.33Å; V258-R260 PolarHBondContact O-N 2.87Å; V258-A261 WeakPolarHBondContact O-CB 3.3Å; V258-A261 PolarHBondContact O-N 3.15Å; V258-A261 VanDerWaalsContact O-N 3.1Å; V258-L262 HydrophobicContact CG1-CD1 4.03Å; V258-L262 HydrophobicContact CG1-CG 4.21Å; V258-L262 WeakPolarHBondContact O-CG 3.38Å; V258-L262 PolarHBondContact O-N 3.31Å
259	L	93.1	Very high	93.5	Very high	48 Å²	48	65.8 Å²	65.8	25%	0.251	37%	0.365	S	S	.	.	H	α-helix	trans	-60.1	-39.3	176.4	-74.5	174.9	0	0	0	113.1	R255 A257 L262 D263 L288 T297	R255-L259 WeakPolarHBondContact O-CG 3.45Å; R255-L259 PolarHBondContact O-N 3.47Å; A257-L259 VanDerWaalsContact C-N 3.34Å; A257-L259 PolarHBondContact O-N 2.8Å; L259-L262 HydrophobicContact CD2-CD1 4.27Å; L259-D263 PolarHBondContact O-N 3.47Å; L259-L288 HydrophobicContact CD2-CD1 3.77Å; L259-T297 HydrophobicContact CD2-CG2 4.14Å
260	R	94.3	Very high	93.7	Very high	170 Å²	170	63.8 Å²	63.8	64%	0.642	36%	0.359	S	S	*	.	H	α-helix	trans	-66.8	-39	173.5	-74.4	-177.7	-73.7	111.1	-6	112.1	A256 A257 V258 S264	A256-R260 PolarHBondContact O-N 3.48Å; A256-R260 PolarHBondContact O-NE 2.85Å; A257-R260 PolarHBondContact O-N 2.88Å; V258-R260 VanDerWaalsContact C-N 3.33Å; V258-R260 PolarHBondContact O-N 2.87Å; R260-S264 WeakPolarHBondContact O-CB 3.35Å; R260-S264 PolarHBondContact O-N 3.28Å
261	A	96	Very high	94	Very high	45 Å²	45	64.9 Å²	64.9	37%	0.372	36%	0.36	S	S	.	.	H	α-helix	trans	-65.8	-43.8	176.6	0	0	0	0	0	111.5	W239 A257 V258 S264 A265	W239-A261 HydrophobicContact CH2-CB 3.81Å; A257-A261 PolarHBondContact O-N 2.85Å; V258-A261 WeakPolarHBondContact O-CB 3.3Å; V258-A261 PolarHBondContact O-N 3.15Å; V258-A261 VanDerWaalsContact O-N 3.1Å; A261-S264 PolarHBondContact O-N 2.83Å; A261-A265 WeakPolarHBondContact O-CB 3.45Å; A261-A265 PolarHBondContact O-N 3.37Å
262	L	95.7	Very high	94.2	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-57.6	-50.1	174.9	-74.1	169.3	0	0	0	110.6	W239 V258 L259 S264 A265 L266 L272 C284 V301	W239-L262 HydrophobicContact CE3-CD2 4.03Å; W239-L262 HydrophobicContact CH2-CD2 3.94Å; W239-L262 HydrophobicContact CH2-CG 4.18Å; W239-L262 HydrophobicContact CZ3-CD2 3.5Å; W239-L262 HydrophobicContact CZ3-CG 3.85Å; V258-L262 HydrophobicContact CG1-CD1 4.03Å; V258-L262 HydrophobicContact CG1-CG 4.21Å; V258-L262 WeakPolarHBondContact O-CG 3.38Å; V258-L262 PolarHBondContact O-N 3.31Å; L259-L262 HydrophobicContact CD2-CD1 4.27Å; L262-S264 VanDerWaalsContact C-N 3.3Å; L262-S264 PolarHBondContact O-N 3.09Å; L262-A265 PolarHBondContact O-N 2.83Å; L262-L266 WeakPolarHBondContact O-CB 3.44Å; L262-L266 WeakPolarHBondContact O-CD1 3.45Å; L262-L266 VanDerWaalsContact O-CG 3.22Å; L262-L266 WeakPolarHBondContact O-CG 3.41Å; L262-L266 PolarHBondContact O-N 3.2Å; L262-L272 HydrophobicContact CD2-CD1 3.89Å; L262-L272 HydrophobicContact CD2-CD2 3.39Å; L262-L272 HydrophobicContact CD2-CG 4.3Å; L262-C284 HydrophobicContact CD2-CB 4.23Å; L262-V301 HydrophobicContact CB-CG2 4.04Å
263	D	95.4	Very high	94.4	Very high	39 Å²	39	59.5 Å²	59.5	21%	0.209	32%	0.317	C	S	.	.	H	α-helix	trans	-61.8	-38.1	-180	-168.4	68.9	0	0	0	112.8	L259 G267 A298 N300 V301	L259-D263 PolarHBondContact O-N 3.47Å; D263-G267 PolarHBondContact O-N 2.87Å; D263-A298 HydrophobicContact CB-CB 3.76Å; D263-A298 WeakPolarHBondContact OD1-CB 3.43Å; D263-N300 PolarHBondContact O-ND2 3.41Å; D263-N300 VanDerWaalsContact OD1-CB 3.25Å; D263-N300 WeakPolarHBondContact OD1-CB 3.32Å; D263-N300 PolarHBondContact OD1-N 3Å; D263-V301 HydrophobicContact CB-CG2 3.86Å
264	S	95.8	Very high	94.2	Very high	64 Å²	64	52.7 Å²	52.7	45%	0.448	30%	0.297	S	S	.	.	H	α-helix	trans	-67	-43	175.9	-172.9	0	0	0	0	112.5	R260 A261 L262 G267	R260-S264 WeakPolarHBondContact O-CB 3.35Å; R260-S264 PolarHBondContact O-N 3.28Å; A261-S264 PolarHBondContact O-N 2.83Å; L262-S264 VanDerWaalsContact C-N 3.3Å; L262-S264 PolarHBondContact O-N 3.09Å; S264-G267 PolarHBondContact O-N 3.33Å
265	A	96.3	Very high	94	Very high	21 Å²	21	53.4 Å²	53.4	17%	0.174	31%	0.307	C	S	.	.	H	α-helix	trans	-65.7	-46.4	178	0	0	0	0	0	111.4	W239 A261 L262 G267 R268	W239-A265 HydrophobicContact CZ2-CB 3.8Å; A261-A265 WeakPolarHBondContact O-CB 3.45Å; A261-A265 PolarHBondContact O-N 3.37Å; L262-A265 PolarHBondContact O-N 2.83Å; A265-G267 PolarHBondContact O-N 2.88Å; A265-R268 WeakPolarHBondContact O-CB 3.47Å; A265-R268 PolarHBondContact O-N 3.01Å
266	L	96.5	Very high	93.9	Very high	8 Å²	8	54.9 Å²	54.9	4%	0.042	32%	0.318	C	S	.	.	H	α-helix	trans	-71.4	-11.4	178.3	-64.5	167.9	0	0	0	113.6	L262 R268 G269 L272 N300 V301 W304	L262-L266 WeakPolarHBondContact O-CB 3.44Å; L262-L266 WeakPolarHBondContact O-CD1 3.45Å; L262-L266 VanDerWaalsContact O-CG 3.22Å; L262-L266 WeakPolarHBondContact O-CG 3.41Å; L262-L266 PolarHBondContact O-N 3.2Å; L266-R268 VanDerWaalsContact C-N 3.27Å; L266-G269 CarbonylContact C-O 3.47Å; L266-L272 HydrophobicContact CD1-CD2 4.18Å; L266-L272 HydrophobicContact CD2-CD2 3.79Å; L266-L272 HydrophobicContact CD2-CG 4.36Å; L266-L272 HydrophobicContact CG-CD2 3.8Å; L266-N300 HydrophobicContact CB-CB 3.77Å; L266-V301 HydrophobicContact CD1-CG2 4.22Å; L266-W304 HydrophobicContact CD1-CB 3.53Å; L266-W304 HydrophobicContact CD1-CD2 3.86Å; L266-W304 HydrophobicContact CD1-CE3 4.11Å; L266-W304 HydrophobicContact CD1-CG 3.62Å; L266-W304 HydrophobicContact CD2-CB 3.86Å; L266-W304 VanDerWaalsContact CD2-CD1 3.43Å; L266-W304 HydrophobicContact CD2-CD2 4.37Å; L266-W304 HydrophobicContact CD2-CG 3.62Å; L266-W304 HydrophobicContact CG-CB 4.24Å; L266-W304 HydrophobicContact CG-CG 4.26Å
267	G	95.2	Very high	94	Very high	49 Å²	49	52.9 Å²	52.9	51%	0.505	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-19.1	167.2	0	0	0	0	0	113.3	D263 S264 A265	D263-G267 PolarHBondContact O-N 2.87Å; S264-G267 PolarHBondContact O-N 3.33Å; A265-G267 PolarHBondContact O-N 2.88Å
268	R	94.3	Very high	94	Very high	219 Å²	219	51.7 Å²	51.7	83%	0.826	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-18.7	-177.7	-56.8	177.1	-170.5	-168.3	0.9	113.4	A265 L266	A265-R268 WeakPolarHBondContact O-CB 3.47Å; A265-R268 PolarHBondContact O-N 3.01Å; L266-R268 VanDerWaalsContact C-N 3.27Å
269	G	92.6	Very high	94.1	Very high	22 Å²	22	51.6 Å²	51.6	23%	0.227	29%	0.289	C	S	.	.	S	Bend	trans	-167.6	170.1	-176.4	0	0	0	0	0	112.4	L266 W271	L266-G269 CarbonylContact C-O 3.47Å; G269-W271 VanDerWaalsContact C-N 3.32Å; G269-W271 PolarHBondContact O-N 2.99Å
270	P	93.8	Very high	94.3	Very high	71 Å²	71	49.3 Å²	49.3	46%	0.461	28%	0.277	S	S	.	.	S	Bend	trans	-71.6	-23.8	-177.6	28.9	-34.9	0	0	0	113.8
271	W	96.3	Very high	94.4	Very high	32 Å²	32	41.2 Å²	41.2	12%	0.121	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-130	165	-178.6	-54.8	109.3	0	0	0	111.3	G269 C273 G274 T275 E276 F277 D281 W304 L311	G269-W271 VanDerWaalsContact C-N 3.32Å; G269-W271 PolarHBondContact O-N 2.99Å; W271-C273 VanDerWaalsContact C-N 3.28Å; W271-C273 PolarHBondContact O-N 3.26Å; W271-G274 PolarHBondContact N-O 3.33Å; W271-G274 PolarHBondContact O-N 3.44Å; W271-T275 VanDerWaalsContact CD1-C 3.5Å; W271-E276 WeakPolarHBondContact CB-O 3.29Å; W271-F277 HydrophobicContact CD2-CB 4.08Å; W271-F277 HydrophobicContact CD2-CD2 4.04Å; W271-F277 HydrophobicContact CE3-CB 4.48Å; W271-F277 AromaticContact CE3-CD2 3.59Å; W271-F277 HydrophobicContact CE3-CD2 3.59Å; W271-F277 HydrophobicContact CE3-CE2 4.37Å; W271-F277 HydrophobicContact CG-CB 4.46Å; W271-F277 AromaticContact CH2-CD2 3.79Å; W271-F277 HydrophobicContact CH2-CD2 3.79Å; W271-F277 HydrophobicContact CH2-CE2 4.41Å; W271-F277 HydrophobicContact CZ2-CB 4.2Å; W271-F277 HydrophobicContact CZ2-CD2 4.22Å; W271-F277 AromaticContact CZ3-CD2 3.46Å; W271-F277 HydrophobicContact CZ3-CD2 3.46Å; W271-F277 VanDerWaalsContact CZ3-CD2 3.46Å; W271-F277 AromaticContact CZ3-CE2 3.97Å; W271-F277 HydrophobicContact CZ3-CE2 3.97Å; W271-D281 HydrophobicContact CE3-CB 4.32Å; W271-W304 AromaticContact CE3-CD1 3.72Å; W271-W304 AromaticContact CE3-NE1 3.72Å; W271-L311 HydrophobicContact CH2-CD1 3.52Å; W271-L311 HydrophobicContact CH2-CD2 4.5Å; W271-L311 HydrophobicContact CH2-CG 4.07Å; W271-L311 HydrophobicContact CZ2-CD1 4.11Å; W271-L311 HydrophobicContact CZ3-CD1 4.26Å
272	L	96	Very high	94.5	Very high	8 Å²	8	39 Å²	39	4%	0.042	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-31.1	-169.9	-68.6	178.2	0	0	0	114.8	W239 L262 L266 A280 D281 C284 W304	W239-L272 HydrophobicContact CD2-CD1 4.49Å; L262-L272 HydrophobicContact CD2-CD1 3.89Å; L262-L272 HydrophobicContact CD2-CD2 3.39Å; L262-L272 HydrophobicContact CD2-CG 4.3Å; L266-L272 HydrophobicContact CD1-CD2 4.18Å; L266-L272 HydrophobicContact CD2-CD2 3.79Å; L266-L272 HydrophobicContact CD2-CG 4.36Å; L266-L272 HydrophobicContact CG-CD2 3.8Å; L272-A280 HydrophobicContact CB-CB 4.27Å; L272-A280 HydrophobicContact CD1-CB 4.17Å; L272-D281 WeakPolarHBondContact CG-OD1 3.3Å; L272-D281 PolarHBondContact N-OD1 3Å; L272-C284 HydrophobicContact CD1-CB 3.73Å; L272-C284 VanDerWaalsContact CD1-SG 3.58Å; L272-W304 HydrophobicContact CD1-CZ2 4.27Å
273	C	94.3	Very high	94.6	Very high	21 Å²	21	39 Å²	39	14%	0.142	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	19.6	-175.2	-60.2	0	0	0	0	113.1	L235 V236 W271	L235-C273 HydrophobicContact CD2-CB 4.44Å; V236-C273 HydrophobicContact CG2-CB 3.76Å; V236-C273 VanDerWaalsContact CG2-SG 3.58Å; W271-C273 VanDerWaalsContact C-N 3.28Å; W271-C273 PolarHBondContact O-N 3.26Å
274	G	87.4	Confident	94.6	Very high	34 Å²	34	37.2 Å²	37.2	35%	0.351	22%	0.219	S	C	.	.	B	Isolated β-bridge	trans	134.2	-138.7	176.2	0	0	0	0	0	113.5	W271	W271-G274 PolarHBondContact N-O 3.33Å; W271-G274 PolarHBondContact O-N 3.44Å
275	T	89.3	Confident	94.6	Very high	103 Å²	103	34.5 Å²	34.5	63%	0.632	20%	0.199	S	C	*	.	S	Bend	trans	-88.3	-14.1	-177	55.4	0	0	0	0	113.8	W271	W271-T275 VanDerWaalsContact CD1-C 3.5Å
276	E	89.6	Confident	94.5	Very high	113 Å²	113	33.5 Å²	33.5	53%	0.528	19%	0.191	S	C	.	.	S	Bend	trans	-109.7	143.8	-176.9	-59.3	-55.3	139.8	0	0	111.9	I102 W271	I102-E276 WeakPolarHBondContact CD1-OE2 3.44Å; I102-E276 WeakPolarHBondContact CG1-OE2 3.47Å; W271-E276 WeakPolarHBondContact CB-O 3.29Å
277	F	92.7	Very high	94.4	Very high	5 Å²	5	33.1 Å²	33.1	2%	0.022	19%	0.189	C	C	.	.			trans	-67.9	139.6	172	-179	-104.9	0	0	0	110.6	I102 F103 W271 D281 I282 L311 F314	I102-F277 HydrophobicContact CD1-CB 3.46Å; I102-F277 VanDerWaalsContact CD1-CB 3.46Å; F103-F277 HydrophobicContact CZ-CD1 4.18Å; F103-F277 HydrophobicContact CZ-CE1 4.17Å; W271-F277 HydrophobicContact CD2-CB 4.08Å; W271-F277 HydrophobicContact CD2-CD2 4.04Å; W271-F277 HydrophobicContact CE3-CB 4.48Å; W271-F277 AromaticContact CE3-CD2 3.59Å; W271-F277 HydrophobicContact CE3-CD2 3.59Å; W271-F277 HydrophobicContact CE3-CE2 4.37Å; W271-F277 HydrophobicContact CG-CB 4.46Å; W271-F277 AromaticContact CH2-CD2 3.79Å; W271-F277 HydrophobicContact CH2-CD2 3.79Å; W271-F277 HydrophobicContact CH2-CE2 4.41Å; W271-F277 HydrophobicContact CZ2-CB 4.2Å; W271-F277 HydrophobicContact CZ2-CD2 4.22Å; W271-F277 AromaticContact CZ3-CD2 3.46Å; W271-F277 HydrophobicContact CZ3-CD2 3.46Å; W271-F277 VanDerWaalsContact CZ3-CD2 3.46Å; W271-F277 AromaticContact CZ3-CE2 3.97Å; W271-F277 HydrophobicContact CZ3-CE2 3.97Å; F277-D281 HydrophobicContact CD2-CB 3.54Å; F277-D281 HydrophobicContact CE2-CB 3.4Å; F277-D281 HydrophobicContact CZ-CB 4.26Å; F277-I282 HydrophobicContact CE1-CD1 3.88Å; F277-I282 HydrophobicContact CE1-CG1 3.61Å; F277-I282 HydrophobicContact CE2-CG1 4.41Å; F277-I282 HydrophobicContact CZ-CD1 4.18Å; F277-I282 HydrophobicContact CZ-CG1 3.39Å; F277-L311 HydrophobicContact CD1-CD1 4.3Å; F277-L311 HydrophobicContact CD2-CD1 3.65Å; F277-L311 HydrophobicContact CE1-CD1 4.29Å; F277-L311 HydrophobicContact CE2-CD1 3.63Å; F277-L311 HydrophobicContact CG-CD1 3.97Å; F277-L311 HydrophobicContact CZ-CD1 3.95Å; F277-F314 HydrophobicContact CE2-CE2 4.28Å; F277-F314 HydrophobicContact CE2-CZ 4.19Å; F277-F314 HydrophobicContact CZ-CE2 4.04Å; F277-F314 AromaticContact CZ-CZ 3.86Å; F277-F314 HydrophobicContact CZ-CZ 3.86Å
278	S	94.8	Very high	94.2	Very high	11 Å²	11	31.5 Å²	31.5	8%	0.077	17%	0.168	C	C	.	.			trans	-140.5	176.2	-173	71	0	0	0	0	112.8	A280 D281 I282	S278-A280 PolarHBondContact O-N 3.08Å; S278-A280 WeakPolarHBondContact OG-CB 3.44Å; S278-A280 PolarHBondContact OG-N 3.03Å; S278-D281 PolarHBondContact N-OD2 2.89Å; S278-D281 WeakPolarHBondContact O-CB 3.44Å; S278-D281 PolarHBondContact O-N 2.89Å; S278-D281 VanDerWaalsContact O-N 3.13Å; S278-D281 PolarHBondContact OG-OD2 3.34Å; S278-I282 PolarHBondContact O-N 2.85Å
279	L	96.9	Very high	93.9	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-58.5	-31.7	172.6	-179.4	58.4	0	0	0	112.7	L139 A216 R217 F220 V236 V240 D281 I282 A283	L139-L279 HydrophobicContact CD1-CD1 4.32Å; L139-L279 HydrophobicContact CD2-CD1 4.4Å; A216-L279 HydrophobicContact CB-CD1 4.1Å; R217-L279 HydrophobicContact CB-CD2 4.23Å; R217-L279 HydrophobicContact CG-CD2 3.75Å; F220-L279 HydrophobicContact CB-CB 4.24Å; F220-L279 HydrophobicContact CB-CD1 3.95Å; F220-L279 HydrophobicContact CB-CD2 3.99Å; F220-L279 HydrophobicContact CB-CG 4.28Å; F220-L279 HydrophobicContact CD1-CB 3.89Å; F220-L279 HydrophobicContact CD2-CB 3.94Å; F220-L279 HydrophobicContact CD2-CD1 4.11Å; F220-L279 HydrophobicContact CE1-CB 4.2Å; F220-L279 HydrophobicContact CE2-CB 4.24Å; F220-L279 HydrophobicContact CG-CB 3.75Å; F220-L279 HydrophobicContact CG-CD1 4.15Å; F220-L279 HydrophobicContact CG-CD2 4.39Å; F220-L279 HydrophobicContact CG-CG 4.3Å; F220-L279 HydrophobicContact CZ-CB 4.37Å; V236-L279 HydrophobicContact CG1-CB 4.15Å; V240-L279 HydrophobicContact CG2-CB 4.33Å; V240-L279 HydrophobicContact CG2-CD2 3.94Å; V240-L279 HydrophobicContact CG2-CG 3.72Å; L279-D281 VanDerWaalsContact C-N 3.26Å; L279-D281 PolarHBondContact O-N 3.22Å; L279-I282 HydrophobicContact CD1-CB 4.47Å; L279-I282 PolarHBondContact O-N 3.35Å; L279-A283 WeakPolarHBondContact O-CB 3.44Å; L279-A283 PolarHBondContact O-N 3.01Å
280	A	97.4	Very high	93.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-57.7	-43.2	176.3	0	0	0	0	0	110.9	V236 W239 L272 S278 A283 C284	V236-A280 HydrophobicContact CG1-CB 4.17Å; W239-A280 HydrophobicContact CB-CB 3.52Å; W239-A280 HydrophobicContact CG-CB 4.24Å; L272-A280 HydrophobicContact CB-CB 4.27Å; L272-A280 HydrophobicContact CD1-CB 4.17Å; S278-A280 PolarHBondContact O-N 3.08Å; S278-A280 WeakPolarHBondContact OG-CB 3.44Å; S278-A280 PolarHBondContact OG-N 3.03Å; A280-A283 PolarHBondContact O-N 3.46Å; A280-C284 VanDerWaalsContact O-CB 3.32Å; A280-C284 WeakPolarHBondContact O-CB 3.32Å; A280-C284 PolarHBondContact O-N 2.91Å; A280-C284 PolarHBondContact O-SG 3.29Å; A280-C284 VanDerWaalsContact O-SG 3.42Å
281	D	97	Very high	92.8	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65.7	-42.5	-179.8	-56.8	-82.8	0	0	0	111.4	W271 L272 F277 S278 L279 Y285 W304	W271-D281 HydrophobicContact CE3-CB 4.32Å; L272-D281 WeakPolarHBondContact CG-OD1 3.3Å; L272-D281 PolarHBondContact N-OD1 3Å; F277-D281 HydrophobicContact CD2-CB 3.54Å; F277-D281 HydrophobicContact CE2-CB 3.4Å; F277-D281 HydrophobicContact CZ-CB 4.26Å; S278-D281 PolarHBondContact N-OD2 2.89Å; S278-D281 WeakPolarHBondContact O-CB 3.44Å; S278-D281 PolarHBondContact O-N 2.89Å; S278-D281 VanDerWaalsContact O-N 3.13Å; S278-D281 PolarHBondContact OG-OD2 3.34Å; L279-D281 VanDerWaalsContact C-N 3.26Å; L279-D281 PolarHBondContact O-N 3.22Å; D281-Y285 WeakPolarHBondContact O-CB 3.3Å; D281-Y285 PolarHBondContact O-N 3.48Å; D281-W304 HydrophobicContact CB-CZ2 4.28Å; D281-W304 WeakPolarHBondContact O-CZ2 3.41Å; D281-W304 PolarHBondContact OD1-NE1 2.91Å
282	I	96.8	Very high	91.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.6	-52.6	175.6	-58	173.8	0	0	0	110.4	T135 V138 L139 L142 F220 F277 S278 L279 Y285 C286 F314	T135-I282 HydrophobicContact CG2-CG2 3.86Å; V138-I282 HydrophobicContact CB-CG2 4.07Å; V138-I282 HydrophobicContact CG1-CG2 3.88Å; L139-I282 HydrophobicContact CD2-CD1 3.86Å; L142-I282 HydrophobicContact CD1-CD1 3.98Å; F220-I282 HydrophobicContact CD2-CD1 3.92Å; F220-I282 HydrophobicContact CE2-CD1 3.87Å; F277-I282 HydrophobicContact CE1-CD1 3.88Å; F277-I282 HydrophobicContact CE1-CG1 3.61Å; F277-I282 HydrophobicContact CE2-CG1 4.41Å; F277-I282 HydrophobicContact CZ-CD1 4.18Å; F277-I282 HydrophobicContact CZ-CG1 3.39Å; S278-I282 PolarHBondContact O-N 2.85Å; L279-I282 HydrophobicContact CD1-CB 4.47Å; L279-I282 PolarHBondContact O-N 3.35Å; I282-Y285 PolarHBondContact O-N 2.91Å; I282-C286 WeakPolarHBondContact O-CB 3.3Å; I282-C286 PolarHBondContact O-N 3.44Å; I282-C286 PolarHBondContact O-SG 3.18Å; I282-C286 VanDerWaalsContact O-SG 3.39Å; I282-F314 HydrophobicContact CB-CE1 4.47Å; I282-F314 HydrophobicContact CG1-CZ 4.34Å; I282-F314 HydrophobicContact CG2-CE1 4.19Å
283	A	97.2	Very high	89.5	Confident	0 Å²	0	29 Å²	29	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.1	-51.4	-176.4	0	0	0	0	0	111.5	V240 A243 F244 L279 A280 Y285 C286 C287	V240-A283 HydrophobicContact CG2-CB 4.24Å; A243-A283 HydrophobicContact CB-CB 3.92Å; F244-A283 HydrophobicContact CE2-CB 3.87Å; F244-A283 HydrophobicContact CZ-CB 4.36Å; L279-A283 WeakPolarHBondContact O-CB 3.44Å; L279-A283 PolarHBondContact O-N 3.01Å; A280-A283 PolarHBondContact O-N 3.46Å; A283-Y285 VanDerWaalsContact C-N 3.32Å; A283-Y285 PolarHBondContact O-N 3.36Å; A283-C286 PolarHBondContact O-N 3.01Å; A283-C287 WeakPolarHBondContact O-CB 3.32Å; A283-C287 PolarHBondContact O-N 2.92Å; A283-C287 PolarHBondContact O-SG 2.91Å
284	C	96.3	Very high	87.8	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.2	-40.1	178.6	-71.8	0	0	0	0	111.9	L262 L272 A280 L288 W304	L262-C284 HydrophobicContact CD2-CB 4.23Å; L272-C284 HydrophobicContact CD1-CB 3.73Å; L272-C284 VanDerWaalsContact CD1-SG 3.58Å; A280-C284 VanDerWaalsContact O-CB 3.32Å; A280-C284 WeakPolarHBondContact O-CB 3.32Å; A280-C284 PolarHBondContact O-N 2.91Å; A280-C284 PolarHBondContact O-SG 3.29Å; A280-C284 VanDerWaalsContact O-SG 3.42Å; C284-L288 WeakPolarHBondContact O-CB 3.17Å; C284-L288 PolarHBondContact O-N 3.18Å; C284-W304 HydrophobicContact CB-CH2 3.93Å; C284-W304 HydrophobicContact CB-CZ2 4.28Å
285	Y	95.1	Very high	86.1	Confident	8 Å²	8	34.2 Å²	34.2	3%	0.031	21%	0.214	C	C	.	.	H	α-helix	trans	-66.7	-45.6	179.9	179.8	-83.7	0	0	0	111.3	D281 I282 A283 L288 S289 W304 I305 C308 E309 F314 K318	D281-Y285 WeakPolarHBondContact O-CB 3.3Å; D281-Y285 PolarHBondContact O-N 3.48Å; I282-Y285 PolarHBondContact O-N 2.91Å; A283-Y285 VanDerWaalsContact C-N 3.32Å; A283-Y285 PolarHBondContact O-N 3.36Å; Y285-L288 PolarHBondContact O-N 3.18Å; Y285-S289 WeakPolarHBondContact CE1-OG 3.09Å; Y285-S289 WeakPolarHBondContact O-CB 3.32Å; Y285-S289 PolarHBondContact O-N 3.15Å; Y285-S289 PolarHBondContact O-OG 3.48Å; Y285-W304 HydrophobicContact CD2-CH2 4.46Å; Y285-I305 HydrophobicContact CE2-CG2 4Å; Y285-C308 HydrophobicContact CD2-CB 3.47Å; Y285-C308 VanDerWaalsContact CD2-CB 3.47Å; Y285-C308 HydrophobicContact CE2-CB 3.68Å; Y285-C308 HydrophobicContact CG-CB 4.18Å; Y285-E309 HydrophobicContact CE2-CG 4.16Å; Y285-E309 VanDerWaalsContact OH-CG 3.27Å; Y285-E309 WeakPolarHBondContact OH-CG 3.48Å; Y285-E309 PolarHBondContact OH-OE1 3.41Å; Y285-F314 HydrophobicContact CD1-CB 4.35Å; Y285-F314 AromaticContact CD1-CD1 3.12Å; Y285-F314 HydrophobicContact CD1-CD1 3.12Å; Y285-F314 HydrophobicContact CD1-CD2 4.37Å; Y285-F314 AromaticContact CD1-CE1 3.3Å; Y285-F314 HydrophobicContact CD1-CE1 3.3Å; Y285-F314 AromaticContact CD1-CG 3.71Å; Y285-F314 HydrophobicContact CD1-CG 3.71Å; Y285-F314 HydrophobicContact CD1-CZ 4.01Å; Y285-F314 HydrophobicContact CE1-CB 3.74Å; Y285-F314 AromaticContact CE1-CD1 3.44Å; Y285-F314 HydrophobicContact CE1-CD1 3.44Å; Y285-F314 VanDerWaalsContact CE1-CD1 3.44Å; Y285-F314 HydrophobicContact CE1-CD2 4.32Å; Y285-F314 HydrophobicContact CE1-CE1 4.07Å; Y285-F314 AromaticContact CE1-CG 3.57Å; Y285-F314 HydrophobicContact CE1-CG 3.57Å; Y285-F314 AromaticContact CG-CD1 3.97Å; Y285-F314 HydrophobicContact CG-CD1 3.97Å; Y285-F314 AromaticContact CG-CE1 3.71Å; Y285-F314 HydrophobicContact CG-CE1 3.71Å; Y285-F314 HydrophobicContact CG-CG 4.48Å; Y285-F314 HydrophobicContact CG-CZ 4.01Å; Y285-K318 WeakPolarHBondContact OH-CE 3.35Å
286	C	94.7	Very high	84.6	Confident	0 Å²	0	34 Å²	34	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.4	-48.5	178.3	-75.3	0	0	0	0	111.5	L134 I282 A283 L288 S289 Q290	L134-C286 HydrophobicContact CB-CB 4.05Å; I282-C286 WeakPolarHBondContact O-CB 3.3Å; I282-C286 PolarHBondContact O-N 3.44Å; I282-C286 PolarHBondContact O-SG 3.18Å; I282-C286 VanDerWaalsContact O-SG 3.39Å; A283-C286 PolarHBondContact O-N 3.01Å; C286-L288 VanDerWaalsContact C-N 3.34Å; C286-L288 PolarHBondContact O-N 3.32Å; C286-S289 PolarHBondContact O-N 3.16Å; C286-Q290 WeakPolarHBondContact O-CG 3.31Å; C286-Q290 PolarHBondContact O-N 3.25Å; C286-Q290 VanDerWaalsContact O-N 3.1Å
287	C	93.7	Very high	83.7	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.3	-35.4	178.1	-65.7	0	0	0	0	112.6	A243 L247 A248 A283 N291	A243-C287 HydrophobicContact CB-CB 4.32Å; L247-C287 HydrophobicContact CB-CB 4.34Å; L247-C287 HydrophobicContact CD2-CB 4Å; L247-C287 HydrophobicContact CG-CB 4.2Å; A248-C287 HydrophobicContact CB-CB 4.17Å; A283-C287 WeakPolarHBondContact O-CB 3.32Å; A283-C287 PolarHBondContact O-N 2.92Å; A283-C287 PolarHBondContact O-SG 2.91Å; C287-N291 PolarHBondContact O-ND2 3.06Å
288	L	91.6	Very high	83.3	Confident	15 Å²	15	31.4 Å²	31.4	8%	0.079	22%	0.219	C	C	.	.	H	α-helix	trans	-66.3	-41.1	174.9	-173.1	62.8	0	0	0	111.2	L247 L259 C284 Y285 C286 N291 V301 W304 I305	L247-L288 HydrophobicContact CD1-CD1 4.41Å; L247-L288 HydrophobicContact CD2-CB 4.14Å; L259-L288 HydrophobicContact CD2-CD1 3.77Å; C284-L288 WeakPolarHBondContact O-CB 3.17Å; C284-L288 PolarHBondContact O-N 3.18Å; Y285-L288 PolarHBondContact O-N 3.18Å; C286-L288 VanDerWaalsContact C-N 3.34Å; C286-L288 PolarHBondContact O-N 3.32Å; L288-N291 PolarHBondContact O-N 2.92Å; L288-V301 HydrophobicContact CD2-CG1 4.14Å; L288-W304 HydrophobicContact CD2-CZ3 4.22Å; L288-I305 HydrophobicContact CD2-CD1 3.84Å; L288-I305 HydrophobicContact CD2-CG1 4.26Å
289	S	88.6	Confident	83.1	Confident	33 Å²	33	34.4 Å²	34.4	23%	0.231	25%	0.245	C	C	.	.	H	α-helix	trans	-69.3	-33.7	-177.4	-58.1	0	0	0	0	112.9	Y285 C286 N291 L321	Y285-S289 WeakPolarHBondContact CE1-OG 3.09Å; Y285-S289 WeakPolarHBondContact O-CB 3.32Å; Y285-S289 PolarHBondContact O-N 3.15Å; Y285-S289 PolarHBondContact O-OG 3.48Å; C286-S289 PolarHBondContact O-N 3.16Å; S289-N291 VanDerWaalsContact C-N 3.3Å; S289-N291 PolarHBondContact O-N 3.14Å; S289-L321 VanDerWaalsContact CB-CD1 3.49Å; S289-L321 WeakPolarHBondContact O-CD2 3.4Å
290	Q	85.3	Confident	83	Confident	64 Å²	64	36 Å²	36	30%	0.299	25%	0.254	S	S	.	.	H	α-helix	trans	-64.8	-30.3	175.9	-73.7	176.7	-9.3	0	0	113.6	P132 L134 C286 G292 L321	P132-Q290 PolarHBondContact O-NE2 3.46Å; L134-Q290 HydrophobicContact CD1-CG 3.41Å; L134-Q290 VanDerWaalsContact CD1-CG 3.41Å; L134-Q290 HydrophobicContact CG-CG 3.93Å; C286-Q290 WeakPolarHBondContact O-CG 3.31Å; C286-Q290 PolarHBondContact O-N 3.25Å; C286-Q290 VanDerWaalsContact O-N 3.1Å; Q290-G292 PolarHBondContact O-N 2.93Å; Q290-L321 HydrophobicContact CG-CD2 4.37Å
291	N	78.6	Confident	82.9	Confident	51 Å²	51	36 Å²	36	27%	0.273	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-9.8	-172.3	-81.4	-57.2	0	0	0	114.8	L247 R255 C287 L288 S289	L247-N291 PolarHBondContact O-ND2 3.49Å; R255-N291 PolarHBondContact NH1-OD1 2.99Å; R255-N291 PolarHBondContact NH2-OD1 3.35Å; C287-N291 PolarHBondContact O-ND2 3.06Å; L288-N291 PolarHBondContact O-N 2.92Å; S289-N291 VanDerWaalsContact C-N 3.3Å; S289-N291 PolarHBondContact O-N 3.14Å
292	G	65.8	Low	82.6	Confident	51 Å²	51	38.8 Å²	38.8	53%	0.526	27%	0.267	S	S	.	.			trans	67.9	142.5	179.4	0	0	0	0	0	114	Q290	Q290-G292 PolarHBondContact O-N 2.93Å
293	S	57.1	Low	82.5	Confident	99 Å²	99	46 Å²	46	69%	0.692	29%	0.294	S	S	*	.			trans	73.6	91.9	178.1	-155	0	0	0	0	116.5	S295	S293-S295 VanDerWaalsContact C-N 3.31Å; S293-S295 PolarHBondContact OG-OG 3.29Å
294	T	57.7	Low	82.4	Confident	58 Å²	58	46.1 Å²	46.1	36%	0.356	29%	0.294	S	S	.	.			trans	-86.4	0.7	165.1	54.6	0	0	0	0	112.5	A296 T297 Q302 I305	T294-A296 PolarHBondContact O-N 2.92Å; T294-T297 PolarHBondContact O-N 2.92Å; T294-T297 VanDerWaalsContact O-N 3.07Å; T294-T297 PolarHBondContact O-OG1 3.25Å; T294-Q302 PolarHBondContact O-NE2 3.46Å; T294-I305 HydrophobicContact CG2-CD1 3.8Å
295	S	51.1	Low	82.3	Confident	107 Å²	107	46.8 Å²	46.8	75%	0.748	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-14.6	-165.3	75.7	0	0	0	0	115.1	S293	S293-S295 VanDerWaalsContact C-N 3.31Å; S293-S295 PolarHBondContact OG-OG 3.29Å
296	A	58.7	Low	82.2	Confident	98 Å²	98	52.3 Å²	52.3	81%	0.81	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.9	21.7	175.7	0	0	0	0	0	113.2	T294	T294-A296 PolarHBondContact O-N 2.92Å
297	T	70.2	Confident	82.2	Confident	20 Å²	20	54.3 Å²	54.3	12%	0.123	34%	0.336	C	S	.	.			trans	-82.8	143.4	177.8	58.6	0	0	0	0	111.4	L259 T294 V301 Q302	L259-T297 HydrophobicContact CD2-CG2 4.14Å; T294-T297 PolarHBondContact O-N 2.92Å; T294-T297 VanDerWaalsContact O-N 3.07Å; T294-T297 PolarHBondContact O-OG1 3.25Å; T297-V301 HydrophobicContact CG2-CG1 4.37Å; T297-Q302 VanDerWaalsContact OG1-CD 3.32Å; T297-Q302 VanDerWaalsContact OG1-CG 3.25Å; T297-Q302 WeakPolarHBondContact OG1-CG 3.37Å; T297-Q302 PolarHBondContact OG1-NE2 2.96Å
298	A	84.4	Confident	82.2	Confident	44 Å²	44	54.3 Å²	54.3	36%	0.364	34%	0.336	S	S	.	.			trans	-60.6	161.3	179	0	0	0	0	0	113.5	D263 N300 V301 Q302	D263-A298 HydrophobicContact CB-CB 3.76Å; D263-A298 WeakPolarHBondContact OD1-CB 3.43Å; A298-N300 PolarHBondContact O-N 3.41Å; A298-V301 PolarHBondContact O-N 3.44Å; A298-Q302 PolarHBondContact O-N 2.91Å
299	A	91.4	Very high	82.1	Confident	74 Å²	74	57.2 Å²	57.2	61%	0.612	35%	0.349	S	S	*	.	H	α-helix	trans	-62.8	-36.6	-165.3	0	0	0	0	0	114.1	Q302 R303	A299-Q302 PolarHBondContact O-N 3.04Å; A299-R303 PolarHBondContact O-N 3.27Å; A299-R303 VanDerWaalsContact O-N 3.1Å
300	N	95.1	Very high	82.3	Confident	34 Å²	34	62.2 Å²	62.2	18%	0.182	37%	0.373	C	S	.	.	H	α-helix	trans	-72.6	-37.2	180	-59	-45.2	0	0	0	110.7	D263 L266 A298 R303 W304	D263-N300 PolarHBondContact O-ND2 3.41Å; D263-N300 VanDerWaalsContact OD1-CB 3.25Å; D263-N300 WeakPolarHBondContact OD1-CB 3.32Å; D263-N300 PolarHBondContact OD1-N 3Å; L266-N300 HydrophobicContact CB-CB 3.77Å; A298-N300 PolarHBondContact O-N 3.41Å; N300-R303 PolarHBondContact O-N 3.43Å; N300-R303 PolarHBondContact OD1-NH1 2.88Å; N300-W304 WeakPolarHBondContact O-CB 3.33Å; N300-W304 PolarHBondContact O-N 3.43Å
301	V	93.9	Very high	82.5	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.006	37%	0.37	C	S	.	.	H	α-helix	trans	-61.8	-44.9	174.2	-176.2	0	0	0	0	110.8	L262 D263 L266 L288 T297 A298 R303 W304 I305	L262-V301 HydrophobicContact CB-CG2 4.04Å; D263-V301 HydrophobicContact CB-CG2 3.86Å; L266-V301 HydrophobicContact CD1-CG2 4.22Å; L288-V301 HydrophobicContact CD2-CG1 4.14Å; T297-V301 HydrophobicContact CG2-CG1 4.37Å; A298-V301 PolarHBondContact O-N 3.44Å; V301-R303 VanDerWaalsContact C-N 3.34Å; V301-R303 PolarHBondContact O-N 2.73Å; V301-W304 HydrophobicContact CG1-CE3 4.26Å; V301-W304 PolarHBondContact O-N 3.28Å; V301-I305 HydrophobicContact CG1-CD1 4.02Å; V301-I305 HydrophobicContact CG1-CG1 4.38Å; V301-I305 VanDerWaalsContact O-CG1 3.28Å; V301-I305 WeakPolarHBondContact O-CG1 3.36Å; V301-I305 PolarHBondContact O-N 3.43Å
302	Q	91.9	Very high	83	Confident	57 Å²	57	61.3 Å²	61.3	27%	0.266	38%	0.382	S	S	.	.	H	α-helix	trans	-60.5	-41.9	176.1	-79.3	-68.4	-23.8	0	0	112.8	T294 T297 A298 A299 K306	T294-Q302 PolarHBondContact O-NE2 3.46Å; T297-Q302 VanDerWaalsContact OG1-CD 3.32Å; T297-Q302 VanDerWaalsContact OG1-CG 3.25Å; T297-Q302 WeakPolarHBondContact OG1-CG 3.37Å; T297-Q302 PolarHBondContact OG1-NE2 2.96Å; A298-Q302 PolarHBondContact O-N 2.91Å; A299-Q302 PolarHBondContact O-N 3.04Å; Q302-K306 WeakPolarHBondContact O-CG 3.39Å; Q302-K306 PolarHBondContact O-N 3.05Å
303	R	94.4	Very high	84	Confident	151 Å²	151	59.5 Å²	59.5	57%	0.57	36%	0.36	S	S	*	.	H	α-helix	trans	-62.1	-46.9	175	-171.8	-169.5	-59.9	124.4	3.8	111	A299 N300 V301 K306 S307	A299-R303 PolarHBondContact O-N 3.27Å; A299-R303 VanDerWaalsContact O-N 3.1Å; N300-R303 PolarHBondContact O-N 3.43Å; N300-R303 PolarHBondContact OD1-NH1 2.88Å; V301-R303 VanDerWaalsContact C-N 3.34Å; V301-R303 PolarHBondContact O-N 2.73Å; R303-K306 WeakPolarHBondContact O-CB 3.35Å; R303-K306 PolarHBondContact O-N 3.45Å; R303-S307 PolarHBondContact O-N 2.95Å; R303-S307 PolarHBondContact O-OG 3.09Å
304	W	95.8	Very high	85.6	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.015	33%	0.327	C	S	.	.	H	α-helix	trans	-64.5	-40.5	179.8	167.3	82.1	0	0	0	112.9	L266 W271 L272 D281 C284 Y285 L288 N300 V301 K306 S307 C308	L266-W304 HydrophobicContact CD1-CB 3.53Å; L266-W304 HydrophobicContact CD1-CD2 3.86Å; L266-W304 HydrophobicContact CD1-CE3 4.11Å; L266-W304 HydrophobicContact CD1-CG 3.62Å; L266-W304 HydrophobicContact CD2-CB 3.86Å; L266-W304 VanDerWaalsContact CD2-CD1 3.43Å; L266-W304 HydrophobicContact CD2-CD2 4.37Å; L266-W304 HydrophobicContact CD2-CG 3.62Å; L266-W304 HydrophobicContact CG-CB 4.24Å; L266-W304 HydrophobicContact CG-CG 4.26Å; W271-W304 AromaticContact CE3-CD1 3.72Å; W271-W304 AromaticContact CE3-NE1 3.72Å; L272-W304 HydrophobicContact CD1-CZ2 4.27Å; D281-W304 HydrophobicContact CB-CZ2 4.28Å; D281-W304 WeakPolarHBondContact O-CZ2 3.41Å; D281-W304 PolarHBondContact OD1-NE1 2.91Å; C284-W304 HydrophobicContact CB-CH2 3.93Å; C284-W304 HydrophobicContact CB-CZ2 4.28Å; Y285-W304 HydrophobicContact CD2-CH2 4.46Å; L288-W304 HydrophobicContact CD2-CZ3 4.22Å; N300-W304 WeakPolarHBondContact O-CB 3.33Å; N300-W304 PolarHBondContact O-N 3.43Å; V301-W304 HydrophobicContact CG1-CE3 4.26Å; V301-W304 PolarHBondContact O-N 3.28Å; W304-K306 VanDerWaalsContact C-N 3.29Å; W304-K306 PolarHBondContact O-N 3.08Å; W304-S307 CarbonylContact O-C 3.49Å; W304-S307 WeakPolarHBondContact O-CA 3.37Å; W304-S307 WeakPolarHBondContact O-CB 3.29Å; W304-S307 PolarHBondContact O-N 3.34Å; W304-S307 VanDerWaalsContact O-N 3.07Å; W304-C308 VanDerWaalsContact CE2-SG 3.56Å; W304-C308 PolarHBondContact O-N 3.02Å; W304-C308 PolarHBondContact O-SG 3.33Å
305	I	93.3	Very high	86.9	Confident	13 Å²	13	54 Å²	54	7%	0.067	33%	0.33	C	S	.	.	H	α-helix	trans	-54.9	-48.6	172.9	-71.4	166.4	0	0	0	109.8	Y285 L288 T294 V301 S307 C308 E309	Y285-I305 HydrophobicContact CE2-CG2 4Å; L288-I305 HydrophobicContact CD2-CD1 3.84Å; L288-I305 HydrophobicContact CD2-CG1 4.26Å; T294-I305 HydrophobicContact CG2-CD1 3.8Å; V301-I305 HydrophobicContact CG1-CD1 4.02Å; V301-I305 HydrophobicContact CG1-CG1 4.38Å; V301-I305 VanDerWaalsContact O-CG1 3.28Å; V301-I305 WeakPolarHBondContact O-CG1 3.36Å; V301-I305 PolarHBondContact O-N 3.43Å; I305-S307 VanDerWaalsContact C-N 3.33Å; I305-S307 PolarHBondContact O-N 3.02Å; I305-C308 WeakPolarHBondContact O-CB 3.42Å; I305-C308 PolarHBondContact O-N 3.3Å; I305-E309 HydrophobicContact CG2-CG 4.5Å; I305-E309 VanDerWaalsContact O-CG 3.27Å; I305-E309 WeakPolarHBondContact O-CG 3.32Å; I305-E309 PolarHBondContact O-N 2.96Å
306	K	92.6	Very high	88.5	Confident	125 Å²	125	50.3 Å²	50.3	54%	0.543	30%	0.303	S	S	.	.	H	α-helix	trans	-62.1	-40.2	177.1	-67.8	178.1	-177.5	-177.7	0	112	Q302 R303 W304 E309 N310	Q302-K306 WeakPolarHBondContact O-CG 3.39Å; Q302-K306 PolarHBondContact O-N 3.05Å; R303-K306 WeakPolarHBondContact O-CB 3.35Å; R303-K306 PolarHBondContact O-N 3.45Å; W304-K306 VanDerWaalsContact C-N 3.29Å; W304-K306 PolarHBondContact O-N 3.08Å; K306-E309 PolarHBondContact O-N 3.43Å; K306-N310 WeakPolarHBondContact O-CB 3.32Å; K306-N310 PolarHBondContact O-N 2.91Å; K306-N310 PolarHBondContact O-ND2 3.13Å; K306-N310 PolarHBondContact O-OD1 3.07Å
307	S	94.4	Very high	89.6	Confident	41 Å²	41	45.8 Å²	45.8	29%	0.287	27%	0.265	S	S	.	.	H	α-helix	trans	-59.5	-46.3	173.8	-61.6	0	0	0	0	112	R303 W304 I305 E309 N310 L311	R303-S307 PolarHBondContact O-N 2.95Å; R303-S307 PolarHBondContact O-OG 3.09Å; W304-S307 CarbonylContact O-C 3.49Å; W304-S307 WeakPolarHBondContact O-CA 3.37Å; W304-S307 WeakPolarHBondContact O-CB 3.29Å; W304-S307 PolarHBondContact O-N 3.34Å; W304-S307 VanDerWaalsContact O-N 3.07Å; I305-S307 VanDerWaalsContact C-N 3.33Å; I305-S307 PolarHBondContact O-N 3.02Å; S307-E309 VanDerWaalsContact C-N 3.34Å; S307-E309 PolarHBondContact O-N 3.39Å; S307-N310 PolarHBondContact O-N 3.32Å; S307-L311 PolarHBondContact O-N 3.03Å
308	C	93.6	Very high	90.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-58.6	-44.6	174.4	-72.1	0	0	0	0	111.7	Y285 W304 I305 N310 L311 F314	Y285-C308 HydrophobicContact CD2-CB 3.47Å; Y285-C308 VanDerWaalsContact CD2-CB 3.47Å; Y285-C308 HydrophobicContact CE2-CB 3.68Å; Y285-C308 HydrophobicContact CG-CB 4.18Å; W304-C308 VanDerWaalsContact CE2-SG 3.56Å; W304-C308 PolarHBondContact O-N 3.02Å; W304-C308 PolarHBondContact O-SG 3.33Å; I305-C308 WeakPolarHBondContact O-CB 3.42Å; I305-C308 PolarHBondContact O-N 3.3Å; C308-N310 VanDerWaalsContact C-N 3.34Å; C308-N310 PolarHBondContact O-N 3.26Å; C308-L311 WeakPolarHBondContact O-CB 3.45Å; C308-L311 PolarHBondContact O-N 3.27Å; C308-F314 HydrophobicContact CB-CD2 4.13Å; C308-F314 HydrophobicContact CB-CE2 3.64Å; C308-F314 HydrophobicContact CB-CZ 4.22Å; C308-F314 VanDerWaalsContact O-CD2 3.25Å; C308-F314 WeakPolarHBondContact O-CD2 3.47Å
309	E	90.5	Very high	90	Very high	77 Å²	77	52.1 Å²	52.1	36%	0.36	29%	0.288	S	S	.	.	H	α-helix	trans	-63.6	-39.7	179.2	-69.5	-177.5	149.1	0	0	112.7	Y285 I305 K306 S307 L311 G312 K318	Y285-E309 HydrophobicContact CE2-CG 4.16Å; Y285-E309 VanDerWaalsContact OH-CG 3.27Å; Y285-E309 WeakPolarHBondContact OH-CG 3.48Å; Y285-E309 PolarHBondContact OH-OE1 3.41Å; I305-E309 HydrophobicContact CG2-CG 4.5Å; I305-E309 VanDerWaalsContact O-CG 3.27Å; I305-E309 WeakPolarHBondContact O-CG 3.32Å; I305-E309 PolarHBondContact O-N 2.96Å; K306-E309 PolarHBondContact O-N 3.43Å; S307-E309 VanDerWaalsContact C-N 3.34Å; S307-E309 PolarHBondContact O-N 3.39Å; E309-L311 PolarHBondContact O-N 3.21Å; E309-G312 PolarHBondContact O-N 3.04Å; E309-G312 VanDerWaalsContact O-N 3.09Å; E309-K318 VanDerWaalsContact CG-NZ 3.34Å; E309-K318 IonicContact OE1-NZ 3.02Å; E309-K318 PolarHBondContact OE1-NZ 2.65Å
310	N	92.3	Very high	89.3	Confident	137 Å²	137	49.6 Å²	49.6	73%	0.733	26%	0.264	S	S	*	.	H	α-helix	trans	-67	-22.2	179.2	-69.9	-17.6	0	0	0	113.2	K306 S307 C308 G312	K306-N310 WeakPolarHBondContact O-CB 3.32Å; K306-N310 PolarHBondContact O-N 2.91Å; K306-N310 PolarHBondContact O-ND2 3.13Å; K306-N310 PolarHBondContact O-OD1 3.07Å; S307-N310 PolarHBondContact O-N 3.32Å; C308-N310 VanDerWaalsContact C-N 3.34Å; C308-N310 PolarHBondContact O-N 3.26Å; N310-G312 PolarHBondContact O-N 3.09Å
311	L	89.9	Confident	88.3	Confident	46 Å²	46	51.2 Å²	51.2	24%	0.241	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.5	173.1	-66.6	177.4	0	0	0	112.8	C100 W271 F277 S307 C308 E309 H313	C100-L311 HydrophobicContact CB-CD2 4.38Å; W271-L311 HydrophobicContact CH2-CD1 3.52Å; W271-L311 HydrophobicContact CH2-CD2 4.5Å; W271-L311 HydrophobicContact CH2-CG 4.07Å; W271-L311 HydrophobicContact CZ2-CD1 4.11Å; W271-L311 HydrophobicContact CZ3-CD1 4.26Å; F277-L311 HydrophobicContact CD1-CD1 4.3Å; F277-L311 HydrophobicContact CD2-CD1 3.65Å; F277-L311 HydrophobicContact CE1-CD1 4.29Å; F277-L311 HydrophobicContact CE2-CD1 3.63Å; F277-L311 HydrophobicContact CG-CD1 3.97Å; F277-L311 HydrophobicContact CZ-CD1 3.95Å; S307-L311 PolarHBondContact O-N 3.03Å; C308-L311 WeakPolarHBondContact O-CB 3.45Å; C308-L311 PolarHBondContact O-N 3.27Å; E309-L311 PolarHBondContact O-N 3.21Å; L311-H313 PolarHBondContact O-N 3.04Å; L311-H313 VanDerWaalsContact O-N 3.15Å
312	G	88.2	Confident	86.4	Confident	50 Å²	50	62.3 Å²	62.3	52%	0.515	32%	0.321	S	S	.	.			trans	73.7	-3.1	179.3	0	0	0	0	0	115.6	E309 N310 F314	E309-G312 PolarHBondContact O-N 3.04Å; E309-G312 VanDerWaalsContact O-N 3.09Å; N310-G312 PolarHBondContact O-N 3.09Å; G312-F314 VanDerWaalsContact C-N 3.32Å; G312-F314 PolarHBondContact O-N 3.34Å
313	H	88.7	Confident	86.2	Confident	14 Å²	14	62.6 Å²	62.6	7%	0.065	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-27	-178.4	-56.6	-39.2	0	0	0	113.9	F103 V138 L142 L311	F103-H313 AromaticContact CE2-NE2 3.7Å; V138-H313 HydrophobicContact CG1-CB 4.2Å; L142-H313 HydrophobicContact CD2-CB 4.19Å; L142-H313 WeakPolarHBondContact CD2-ND1 3.29Å; L311-H313 PolarHBondContact O-N 3.04Å; L311-H313 VanDerWaalsContact O-N 3.15Å
314	F	89.9	Confident	85.7	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.009	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-0.4	-170.8	-62.1	-87.3	0	0	0	114.9	V138 F277 I282 Y285 C308 G312 A317 K318	V138-F314 HydrophobicContact CG1-CD1 4.17Å; V138-F314 HydrophobicContact CG1-CE1 4.22Å; V138-F314 HydrophobicContact CG2-CD1 3.72Å; V138-F314 HydrophobicContact CG2-CE1 4.28Å; V138-F314 HydrophobicContact CG2-CG 4.48Å; F277-F314 HydrophobicContact CE2-CE2 4.28Å; F277-F314 HydrophobicContact CE2-CZ 4.19Å; F277-F314 HydrophobicContact CZ-CE2 4.04Å; F277-F314 AromaticContact CZ-CZ 3.86Å; F277-F314 HydrophobicContact CZ-CZ 3.86Å; I282-F314 HydrophobicContact CB-CE1 4.47Å; I282-F314 HydrophobicContact CG1-CZ 4.34Å; I282-F314 HydrophobicContact CG2-CE1 4.19Å; Y285-F314 HydrophobicContact CD1-CB 4.35Å; Y285-F314 AromaticContact CD1-CD1 3.12Å; Y285-F314 HydrophobicContact CD1-CD1 3.12Å; Y285-F314 HydrophobicContact CD1-CD2 4.37Å; Y285-F314 AromaticContact CD1-CE1 3.3Å; Y285-F314 HydrophobicContact CD1-CE1 3.3Å; Y285-F314 AromaticContact CD1-CG 3.71Å; Y285-F314 HydrophobicContact CD1-CG 3.71Å; Y285-F314 HydrophobicContact CD1-CZ 4.01Å; Y285-F314 HydrophobicContact CE1-CB 3.74Å; Y285-F314 AromaticContact CE1-CD1 3.44Å; Y285-F314 HydrophobicContact CE1-CD1 3.44Å; Y285-F314 VanDerWaalsContact CE1-CD1 3.44Å; Y285-F314 HydrophobicContact CE1-CD2 4.32Å; Y285-F314 HydrophobicContact CE1-CE1 4.07Å; Y285-F314 AromaticContact CE1-CG 3.57Å; Y285-F314 HydrophobicContact CE1-CG 3.57Å; Y285-F314 AromaticContact CG-CD1 3.97Å; Y285-F314 HydrophobicContact CG-CD1 3.97Å; Y285-F314 AromaticContact CG-CE1 3.71Å; Y285-F314 HydrophobicContact CG-CE1 3.71Å; Y285-F314 HydrophobicContact CG-CG 4.48Å; Y285-F314 HydrophobicContact CG-CZ 4.01Å; C308-F314 HydrophobicContact CB-CD2 4.13Å; C308-F314 HydrophobicContact CB-CE2 3.64Å; C308-F314 HydrophobicContact CB-CZ 4.22Å; C308-F314 VanDerWaalsContact O-CD2 3.25Å; C308-F314 WeakPolarHBondContact O-CD2 3.47Å; G312-F314 VanDerWaalsContact C-N 3.32Å; G312-F314 PolarHBondContact O-N 3.34Å; F314-A317 PolarHBondContact O-N 3.02Å; F314-K318 PolarHBondContact O-N 3.44Å
315	G	84.9	Confident	85.2	Confident	40 Å²	40	60.9 Å²	60.9	41%	0.412	33%	0.327	S	S	.	.	H	α-helix	trans	-49.8	-49.4	179.3	0	0	0	0	0	114.2	A317 K318 L319	G315-A317 PolarHBondContact O-N 3.48Å; G315-K318 PolarHBondContact O-N 2.97Å; G315-L319 PolarHBondContact O-N 3.04Å
316	P	83.6	Confident	84.7	Confident	29 Å²	29	63.7 Å²	63.7	19%	0.188	34%	0.342	C	S	.	.	H	α-helix	trans	-59.7	-39.9	178.7	-26.1	35.5	0	0	0	113.9	L137 N141 K318 L319	L137-P316 HydrophobicContact CB-CB 4.31Å; N141-P316 HydrophobicContact CB-CG 3.76Å; P316-K318 VanDerWaalsContact C-N 3.34Å; P316-K318 PolarHBondContact O-N 2.92Å; P316-L319 WeakPolarHBondContact O-CB 3.48Å; P316-L319 PolarHBondContact O-N 2.98Å
317	A	83.6	Confident	84.2	Confident	2 Å²	2	59.9 Å²	59.9	2%	0.017	33%	0.329	C	S	.	.	H	α-helix	trans	-66.3	-36.4	178.3	0	0	0	0	0	112.2	L134 V138 F314 G315 L319 L320	L134-A317 HydrophobicContact CB-CB 4.07Å; L134-A317 HydrophobicContact CD1-CB 4.49Å; L134-A317 HydrophobicContact CD2-CB 4.25Å; L134-A317 HydrophobicContact CG-CB 4.5Å; V138-A317 HydrophobicContact CG2-CB 3.77Å; F314-A317 PolarHBondContact O-N 3.02Å; G315-A317 PolarHBondContact O-N 3.48Å; A317-L319 PolarHBondContact O-N 2.85Å; A317-L320 PolarHBondContact O-N 2.71Å; A317-L320 VanDerWaalsContact O-N 3.13Å
318	K	82.6	Confident	83.5	Confident	79 Å²	79	61.1 Å²	61.1	34%	0.343	33%	0.332	S	S	.	.	H	α-helix	trans	-64.5	-24.3	177.7	-70.1	-178.2	172.6	-166.9	0	113.6	Y285 E309 F314 G315 P316 L320 L321	Y285-K318 WeakPolarHBondContact OH-CE 3.35Å; E309-K318 VanDerWaalsContact CG-NZ 3.34Å; E309-K318 IonicContact OE1-NZ 3.02Å; E309-K318 PolarHBondContact OE1-NZ 2.65Å; F314-K318 PolarHBondContact O-N 3.44Å; G315-K318 PolarHBondContact O-N 2.97Å; P316-K318 VanDerWaalsContact C-N 3.34Å; P316-K318 PolarHBondContact O-N 2.92Å; K318-L320 PolarHBondContact O-N 3.08Å; K318-L321 PolarHBondContact O-N 2.84Å
319	L	78.8	Confident	82.8	Confident	119 Å²	119	65.5 Å²	65.5	62%	0.623	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-23	175.9	-64.8	174.2	0	0	0	112.6	G315 P316 A317	G315-L319 PolarHBondContact O-N 3.04Å; P316-L319 WeakPolarHBondContact O-CB 3.48Å; P316-L319 PolarHBondContact O-N 2.98Å; A317-L319 PolarHBondContact O-N 2.85Å
320	L	78.4	Confident	82.2	Confident	21 Å²	21	64.6 Å²	64.6	11%	0.11	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-5.6	-179.9	-62.8	-162.5	0	0	0	114.3	P132 L134 L137 Q165 L166 A317 K318	P132-L320 HydrophobicContact CB-CD1 3.97Å; L134-L320 HydrophobicContact CD2-CB 3.75Å; L134-L320 HydrophobicContact CD2-CD1 4.11Å; L134-L320 HydrophobicContact CD2-CG 4.41Å; L137-L320 HydrophobicContact CD1-CD1 3.29Å; L137-L320 HydrophobicContact CD1-CG 3.81Å; Q165-L320 HydrophobicContact CB-CD2 4.07Å; Q165-L320 HydrophobicContact CG-CD2 3.89Å; L166-L320 HydrophobicContact CD2-CD1 3.39Å; L166-L320 HydrophobicContact CD2-CD2 3.61Å; L166-L320 HydrophobicContact CD2-CG 4.14Å; A317-L320 PolarHBondContact O-N 2.71Å; A317-L320 VanDerWaalsContact O-N 3.13Å; K318-L320 PolarHBondContact O-N 3.08Å
321	L	72.2	Confident	81.4	Confident	67 Å²	67	58.6 Å²	58.6	35%	0.351	32%	0.324	S	S	.	.			trans	-95.5	15.6	-175.9	-77.2	170	0	0	0	113.5	L134 S289 Q290 K318	L134-L321 HydrophobicContact CD1-CD1 3.64Å; L134-L321 HydrophobicContact CD1-CD2 3.52Å; L134-L321 HydrophobicContact CD1-CG 3.54Å; S289-L321 VanDerWaalsContact CB-CD1 3.49Å; S289-L321 WeakPolarHBondContact O-CD2 3.4Å; Q290-L321 HydrophobicContact CG-CD2 4.37Å; K318-L321 PolarHBondContact O-N 2.84Å
322	K	55.5	Low	80.6	Confident	234 Å²	234	59.7 Å²	59.7	100%	1.017	33%	0.332	S	S	*	.			trans	-105.2	0	-179.2	-71.1	-172.5	180	-178.8	0	112.3

Retrieved 322 of 322 residues in 496.3 ms (Link to these results)

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