A0A077ZEB2_TRITR Loading...

Myosin, light chain 12

AlphaFold DB , UniProt , Accession A0A077ZEB2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 662 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	39.3	Very low	38.1	Very low	241 Å²	241	159.9 Å²	159.9	100%	1.187	83%	0.834	S	S	*	*				0	141.7	0	-67.2	-172.5	174.1	0	0	107.4
2	D	33.5	Very low	38.1	Very low	151 Å²	151	156.6 Å²	156.6	81%	0.807	82%	0.818	S	S	*	*			trans	-101.1	159.1	-151.3	-69.8	-83.4	0	0	0	115.7
3	S	30.3	Very low	38.2	Very low	103 Å²	103	154.2 Å²	154.2	72%	0.72	82%	0.823	S	S	*	*			trans	57.6	104.2	147.3	60.6	0	0	0	0	120.4
4	S	35.4	Very low	38.3	Very low	105 Å²	105	158.4 Å²	158.4	73%	0.734	83%	0.83	S	S	*	*				93.9	166.3	113.6	80.8	0	0	0	0	121.1
5	L	38.7	Very low	38.4	Very low	174 Å²	174	155.5 Å²	155.5	91%	0.911	83%	0.829	S	S	*	*			trans	74.3	113.8	176.6	-54.6	175.6	0	0	0	116.6
6	G	40.7	Very low	38.4	Very low	82 Å²	82	152.7 Å²	152.7	85%	0.845	83%	0.825	S	S	*	*			trans	-170.1	93.9	-178.8	0	0	0	0	0	112.4
7	K	46	Very low	38.2	Very low	210 Å²	210	149.4 Å²	149.4	91%	0.913	82%	0.816	S	S	*	*			trans	-63.7	154.4	-161.6	-65.6	166.6	176	172.4	0	117.5
8	R	37.5	Very low	38.3	Very low	236 Å²	236	152.6 Å²	152.6	89%	0.891	82%	0.821	S	S	*	*			trans	-50	162.2	154.1	-76.3	-173.6	173.6	-172.1	-0.4	112.6
9	V	38.9	Very low	38.2	Very low	107 Å²	107	152.8 Å²	152.8	65%	0.648	82%	0.822	S	S	*	*			cis	-175.4	162.8	-1.1	130.3	0	0	0	0	110.3
10	K	39.9	Very low	38.3	Very low	187 Å²	187	155.1 Å²	155.1	81%	0.813	82%	0.824	S	S	*	*			trans	65.9	157	170.2	-80.3	163.7	-179.5	-178.4	0	113.6
11	K	39.4	Very low	38.3	Very low	163 Å²	163	155.5 Å²	155.5	71%	0.709	83%	0.827	S	S	*	*			cis	-179.7	166.5	-13.7	-106.8	-175.6	141.4	-131.1	0	103.7
12	D	37.4	Very low	38.5	Very low	120 Å²	120	151.2 Å²	151.2	64%	0.642	81%	0.807	S	S	*	*			cis	-152.6	149.1	-8.4	-93.5	-46.2	0	0	0	105.9
13	S	39.8	Very low	38.8	Very low	126 Å²	126	153.7 Å²	153.7	88%	0.881	81%	0.81	S	S	*	*			trans	-172.1	167	149.7	46.3	0	0	0	0	110.7
14	K	38.8	Very low	39.1	Very low	212 Å²	212	158.8 Å²	158.8	92%	0.922	82%	0.82	S	S	*	*			trans	-129.2	139.1	-164.8	-60.1	170.9	-178.7	169.6	0	113.6
15	S	40.3	Very low	39.1	Very low	116 Å²	116	158.4 Å²	158.4	81%	0.811	82%	0.822	S	S	*	*			trans	-160.7	125.8	140.9	48.2	0	0	0	0	108
16	S	39.4	Very low	39.2	Very low	110 Å²	110	159.9 Å²	159.9	77%	0.769	82%	0.822	S	S	*	*				55.6	127.5	95.3	-167.8	0	0	0	0	115
17	S	34.3	Very low	38.8	Very low	96 Å²	96	167.3 Å²	167.3	67%	0.671	82%	0.824	S	S	*	*			cis	-170.4	149.6	-17.2	47	0	0	0	0	109.4
18	K	40.2	Very low	38.4	Very low	208 Å²	208	163 Å²	163	90%	0.904	82%	0.818	S	S	*	*			trans	170.7	137	143.5	-96.2	159.2	-175.4	174.6	0	113.8
19	N	36.2	Very low	38.4	Very low	156 Å²	156	161.9 Å²	161.9	83%	0.834	82%	0.819	S	S	*	*			trans	-45.4	134.4	-175.1	-59.3	-23.9	0	0	0	117.8
20	K	40.6	Very low	38.2	Very low	199 Å²	199	167.4 Å²	167.4	87%	0.865	83%	0.828	S	S	*	*			trans	-139	109.4	141.8	-76.3	-168.2	176.8	175.8	0	110.5	I22	K20-I22 PolarHBondContact O-N 2.65Å
21	N	38.5	Very low	38	Very low	164 Å²	164	166.3 Å²	166.3	88%	0.877	83%	0.826	S	S	*	*			trans	-74.2	115.6	175.5	-90.9	-33.7	0	0	0	110.8
22	I	41.8	Very low	38	Very low	151 Å²	151	165.8 Å²	165.8	77%	0.774	82%	0.824	S	S	*	*			trans	-109.5	99	171.6	-59.5	178.7	0	0	0	108.6	K20 K24	K20-I22 PolarHBondContact O-N 2.65Å; I22-K24 PolarHBondContact O-N 3.49Å
23	K	40.9	Very low	37.9	Very low	202 Å²	202	165.9 Å²	165.9	88%	0.878	83%	0.825	S	S	*	*			trans	-68.1	123.9	170.9	-79	-173.9	174.1	-179	0	109.5	A25	K23-A25 PolarHBondContact O-N 3.36Å
24	K	35.5	Very low	37.6	Very low	211 Å²	211	169 Å²	169	92%	0.917	82%	0.817	S	S	*	*			trans	-69.6	105.5	174.5	-67.5	177.5	180	175.3	0	110.1	I22	I22-K24 PolarHBondContact O-N 3.49Å
25	A	36.3	Very low	37.4	Very low	96 Å²	96	165.5 Å²	165.5	79%	0.793	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-80.9	134.6	166.4	0	0	0	0	0	110.4	K23	K23-A25 PolarHBondContact O-N 3.36Å
26	K	39.9	Very low	37	Very low	206 Å²	206	168.1 Å²	168.1	90%	0.896	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-66.6	132.6	172.1	-70.1	178.3	177.1	177.2	0	109.1
27	R	34.2	Very low	36.6	Very low	238 Å²	238	169.6 Å²	169.6	90%	0.898	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-66.8	130.5	165.6	-80.4	-179.5	169.2	167.1	-3.8	108.8
28	P	36.3	Very low	36.6	Very low	120 Å²	120	169.4 Å²	169.4	78%	0.779	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-59.4	151.5	167.1	-22.9	34.4	0	0	0	111.5
29	K	38	Very low	36	Very low	212 Å²	212	162.7 Å²	162.7	92%	0.922	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-61.6	150.5	164.5	-95.6	-174.6	172.2	-174.7	0	109.1
30	R	34.6	Very low	35.7	Very low	222 Å²	222	158.8 Å²	158.8	84%	0.838	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-70.9	139.7	-175.4	-84.7	175.8	160.7	163.6	-8.9	111.8	K32	R30-K32 PolarHBondContact O-N 3.22Å
31	E	36.3	Very low	35	Very low	164 Å²	164	150.7 Å²	150.7	77%	0.766	73%	0.731	S	S	*	*	S	Bend	trans	-72.4	49.9	177	-168.7	169.1	-155.3	0	0	112.3
32	K	39	Very low	34.5	Very low	153 Å²	153	143.3 Å²	143.3	67%	0.665	69%	0.692	S	S	*	*			trans	-90.1	-30.4	-169.5	-132.4	-167.2	171.9	-132	0	113.6	R30 R34	R30-K32 PolarHBondContact O-N 3.22Å; K32-R34 VanDerWaalsContact C-N 3.32Å; K32-R34 PolarHBondContact O-N 3.26Å
33	D	36	Very low	34.2	Very low	122 Å²	122	141.2 Å²	141.2	65%	0.652	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-85.2	-5.9	-162.9	-41.2	-25.8	0	0	0	112.9
34	R	33.6	Very low	33.8	Very low	191 Å²	191	131.9 Å²	131.9	72%	0.721	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-75.8	-22.7	179.5	-97.5	-178	163.3	-175.6	-10.6	114.6	K32 E36	K32-R34 VanDerWaalsContact C-N 3.32Å; K32-R34 PolarHBondContact O-N 3.26Å; R34-E36 VanDerWaalsContact C-N 3.32Å; R34-E36 PolarHBondContact O-N 3.13Å
35	N	33.1	Very low	33.7	Very low	139 Å²	139	125.7 Å²	125.7	74%	0.743	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-83.7	-5.3	-175.3	-73.1	5	0	0	0	114
36	E	33.2	Very low	33.8	Very low	170 Å²	170	124.8 Å²	124.8	79%	0.794	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-13.3	-177.8	-67.8	172.6	-173.7	0	0	112.4	R34	R34-E36 VanDerWaalsContact C-N 3.32Å; R34-E36 PolarHBondContact O-N 3.13Å
37	L	31	Very low	33.6	Very low	141 Å²	141	115.5 Å²	115.5	74%	0.738	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-29.8	-179.3	-82.1	155.8	0	0	0	114.3	P39	L37-P39 WeakPolarHBondContact O-CD 3.09Å
38	N	32.5	Very low	33.6	Very low	93 Å²	93	108.3 Å²	108.3	50%	0.497	54%	0.535	S	S	.	.	S	Bend	trans	-109.7	100.4	177.6	-79	10.9	0	0	0	110.1
39	P	28.6	Very low	33.6	Very low	67 Å²	67	105 Å²	105	44%	0.435	51%	0.509	S	S	.	.			trans	-60.8	157.2	168.1	25.2	-32.2	0	0	0	110.5	L37 G41 P82	L37-P39 WeakPolarHBondContact O-CD 3.09Å; P39-G41 VanDerWaalsContact C-N 3.27Å; P39-G41 PolarHBondContact O-N 3.12Å; P39-P82 HydrophobicContact CB-CB 3.87Å; P39-P82 HydrophobicContact CG-CB 3.35Å; P39-P82 HydrophobicContact CG-CG 3.62Å
40	P	29	Very low	33.3	Very low	74 Å²	74	103.4 Å²	103.4	48%	0.481	50%	0.497	S	S	.	.	S	Bend	trans	-74.2	72.2	-165.9	30.6	-37.3	0	0	0	113.6	A542 L543	P40-A542 HydrophobicContact CB-CB 3.91Å; P40-A542 HydrophobicContact CG-CB 3.76Å; P40-L543 WeakPolarHBondContact O-CD1 3.32Å; P40-L543 VanDerWaalsContact O-CG 3.29Å; P40-L543 WeakPolarHBondContact O-CG 3.13Å
41	G	25.9	Very low	33	Very low	28 Å²	28	96.3 Å²	96.3	29%	0.289	48%	0.482	S	S	.	.			trans	-85.8	149.8	172.7	0	0	0	0	0	113.2	P39 N528	P39-G41 VanDerWaalsContact C-N 3.27Å; P39-G41 PolarHBondContact O-N 3.12Å; G41-N528 PolarHBondContact O-ND2 3.03Å; G41-N528 VanDerWaalsContact O-ND2 3.15Å
42	L	29.2	Very low	32.7	Very low	10 Å²	10	98.2 Å²	98.2	5%	0.052	49%	0.491	C	S	.	.			trans	-112.6	93.9	160.7	-173.2	89.2	0	0	0	106.3	L77 V535 L543 V550	L42-L77 HydrophobicContact CB-CD2 4.38Å; L42-L77 HydrophobicContact CD2-CD1 4.41Å; L42-V535 HydrophobicContact CD1-CG1 4.44Å; L42-V535 HydrophobicContact CD1-CG2 4.03Å; L42-L543 HydrophobicContact CB-CD1 3.65Å; L42-L543 HydrophobicContact CB-CD2 3.86Å; L42-L543 HydrophobicContact CB-CG 4.28Å; L42-L543 VanDerWaalsContact N-CD2 3.29Å; L42-V550 HydrophobicContact CD1-CG2 4.28Å; L42-V550 HydrophobicContact CD2-CG2 4.01Å
43	Y	34.5	Very low	32.2	Very low	106 Å²	106	95.6 Å²	95.6	42%	0.416	49%	0.492	S	S	.	.			trans	-97.9	152.8	158.3	54.6	-76	0	0	0	108.5	E45 C527	Y43-E45 HydrophobicContact CD2-CB 4.21Å; Y43-E45 HydrophobicContact CE2-CB 4.49Å; Y43-C527 HydrophobicContact CD1-CB 4.16Å; Y43-C527 WeakPolarHBondContact CD2-SG 3.41Å; Y43-C527 HydrophobicContact CE1-CB 4.14Å; Y43-C527 VanDerWaalsContact CE1-SG 3.52Å; Y43-C527 WeakPolarHBondContact CE2-SG 3.31Å; Y43-C527 HydrophobicContact CG-CB 4.48Å; Y43-C527 VanDerWaalsContact CG-SG 3.54Å; Y43-C527 WeakPolarHBondContact O-CB 3.45Å; Y43-C527 PolarHBondContact O-N 3.3Å; Y43-C527 PolarHBondContact O-SG 3.03Å
44	I	33.2	Very low	31.8	Very low	7 Å²	7	96.9 Å²	96.9	4%	0.036	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	105.4	161.2	-71.6	170.2	0	0	0	104.8	I46 W74 V524 T525 C553	I44-I46 HydrophobicContact CG2-CG1 4.3Å; I44-I46 PolarHBondContact O-N 2.98Å; I44-W74 HydrophobicContact CB-CH2 3.8Å; I44-W74 HydrophobicContact CB-CZ3 3.86Å; I44-W74 HydrophobicContact CD1-CH2 3.81Å; I44-W74 HydrophobicContact CD1-CZ3 4.39Å; I44-W74 HydrophobicContact CG1-CH2 4.27Å; I44-W74 HydrophobicContact CG1-CZ3 4.46Å; I44-W74 HydrophobicContact CG2-CH2 4.3Å; I44-V524 HydrophobicContact CG2-CB 4.49Å; I44-V524 HydrophobicContact CG2-CG1 3.63Å; I44-T525 WeakPolarHBondContact CA-O 3.23Å; I44-C553 HydrophobicContact CD1-CB 3.74Å
45	E	34.1	Very low	31.4	Very low	81 Å²	81	94 Å²	94	38%	0.379	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	109.2	178.5	-161.6	-164.4	133.6	0	0	108.7	Y43 S47 T525	Y43-E45 HydrophobicContact CD2-CB 4.21Å; Y43-E45 HydrophobicContact CE2-CB 4.49Å; E45-S47 WeakPolarHBondContact OE1-CB 3.36Å; E45-S47 PolarHBondContact OE1-OG 3.12Å; E45-T525 PolarHBondContact N-O 3.39Å; E45-T525 PolarHBondContact O-N 3.35Å
46	I	38.2	Very low	31.1	Very low	76 Å²	76	93.7 Å²	93.7	39%	0.39	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	85.2	164.4	-53.8	177.7	0	0	0	106.2	I44 P48 T523 V524	I44-I46 HydrophobicContact CG2-CG1 4.3Å; I44-I46 PolarHBondContact O-N 2.98Å; I46-P48 VanDerWaalsContact O-CD 3.24Å; I46-P48 WeakPolarHBondContact O-CD 3.42Å; I46-T523 WeakPolarHBondContact CA-O 3.48Å; I46-V524 HydrophobicContact CG1-CG2 4.48Å
47	S	35.6	Very low	31	Very low	12 Å²	12	89.6 Å²	89.6	8%	0.084	48%	0.479	C	S	.	.			trans	-61.1	108.6	-175.4	-44.5	0	0	0	0	109.4	E45 R497	E45-S47 WeakPolarHBondContact OE1-CB 3.36Å; E45-S47 PolarHBondContact OE1-OG 3.12Å; S47-R497 PolarHBondContact O-NH1 3.08Å
48	P	34.2	Very low	31.1	Very low	86 Å²	86	87.4 Å²	87.4	56%	0.558	47%	0.467	S	S	*	.			trans	-68.2	162.8	-151.1	22.7	-33.9	0	0	0	114.2	I46 R497	I46-P48 VanDerWaalsContact O-CD 3.24Å; I46-P48 WeakPolarHBondContact O-CD 3.42Å; P48-R497 PolarHBondContact O-NH2 3.44Å
49	H	35.5	Very low	31	Very low	50 Å²	50	84.9 Å²	84.9	23%	0.231	46%	0.456	C	S	.	.			trans	-81.9	159.3	158.8	-51.8	-79.7	0	0	0	108.8	E518 T519	H49-E518 PolarHBondContact ND1-O 3.05Å; H49-T519 HydrophobicContact CB-CG2 4.43Å; H49-T519 PolarHBondContact CE1-O 2.99Å
50	W	31	Very low	31.5	Very low	179 Å²	179	84.9 Å²	84.9	68%	0.678	46%	0.455	S	S	*	.	S	Bend	trans	98.3	163.6	177	-49.9	1	0	0	0	115.6
51	S	29.7	Very low	31.9	Very low	74 Å²	74	86 Å²	86	52%	0.517	46%	0.456	S	S	.	.			trans	-81.6	155	-161.1	50.8	0	0	0	0	114.9	S53	S51-S53 PolarHBondContact O-N 3.4Å; S51-S53 PolarHBondContact OG-OG 2.72Å
52	Q	28.6	Very low	32.8	Very low	203 Å²	203	88.9 Å²	88.9	95%	0.949	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	16.5	-177.9	-63.9	176.8	-66.6	0	0	115.9
53	S	29.2	Very low	33.6	Very low	99 Å²	99	92 Å²	92	69%	0.692	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-17.3	-179.7	54.4	0	0	0	0	114.1	S51	S51-S53 PolarHBondContact O-N 3.4Å; S51-S53 PolarHBondContact OG-OG 2.72Å
54	Q	27.2	Very low	34	Very low	148 Å²	148	87.4 Å²	87.4	69%	0.692	47%	0.466	S	S	*	.	S	Bend	trans	-142	121.6	166	-77.2	-173.3	-21.3	0	0	108.7	K56	Q54-K56 VanDerWaalsContact C-N 3.27Å; Q54-K56 PolarHBondContact O-N 3.15Å
55	V	26.1	Very low	34.4	Very low	132 Å²	132	92.1 Å²	92.1	80%	0.8	49%	0.491	S	S	*	.			trans	-74	88.5	167.4	-176.3	0	0	0	0	107.5	C57	V55-C57 PolarHBondContact O-N 3.13Å
56	K	26.9	Very low	35.2	Very low	132 Å²	132	95.2 Å²	95.2	57%	0.574	51%	0.505	S	S	*	.			trans	-68.7	84.7	159.2	-77.4	-164.3	173	-168.9	0	108.2	Q54	Q54-K56 VanDerWaalsContact C-N 3.27Å; Q54-K56 PolarHBondContact O-N 3.15Å
57	C	29.8	Very low	35.8	Very low	84 Å²	84	97.2 Å²	97.2	57%	0.568	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-51.4	158.3	153.2	-70.4	0	0	0	0	109.1	V55	V55-C57 PolarHBondContact O-N 3.13Å
58	L	33.8	Very low	36.1	Very low	94 Å²	94	99.2 Å²	99.2	49%	0.492	54%	0.535	S	S	.	.	S	Bend	trans	-50.6	134.8	153.2	-76.6	134	0	0	0	107.4	T60	L58-T60 PolarHBondContact O-N 3.44Å
59	P	31.4	Very low	36.7	Very low	40 Å²	40	97.9 Å²	97.9	26%	0.26	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-50	131.3	-167.1	17.3	-31	0	0	0	110	E63 A64 L69	P59-E63 HydrophobicContact CB-CB 3.6Å; P59-A64 HydrophobicContact CB-CB 4.37Å; P59-A64 HydrophobicContact CG-CB 4.42Å; P59-L69 HydrophobicContact CG-CD1 4.36Å
60	T	38.7	Very low	36.9	Very low	68 Å²	68	98.1 Å²	98.1	42%	0.417	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-52.1	158.2	175	56.5	0	0	0	0	109.8	L58 T62 E63 A64	L58-T60 PolarHBondContact O-N 3.44Å; T60-T62 CarbonylContact O-C 3.55Å; T60-T62 PolarHBondContact O-N 3.28Å; T60-E63 VanDerWaalsContact CB-OE2 3.31Å; T60-E63 WeakPolarHBondContact CB-OE2 3.43Å; T60-E63 WeakPolarHBondContact CG2-OE2 3.41Å; T60-E63 PolarHBondContact N-OE2 3.08Å; T60-E63 PolarHBondContact O-N 3.26Å; T60-E63 WeakPolarHBondContact OG1-CG 3.47Å; T60-E63 PolarHBondContact OG1-N 3.24Å; T60-E63 PolarHBondContact OG1-OE2 3.3Å; T60-A64 WeakPolarHBondContact O-CB 3.21Å; T60-A64 PolarHBondContact O-N 2.81Å
61	L	38	Very low	37.2	Very low	98 Å²	98	95.9 Å²	95.9	51%	0.513	53%	0.526	S	S	.	.	H	α-helix	trans	-52.3	-34.7	179.4	-175.3	63.5	0	0	0	111.5	L65 A79	L61-L65 HydrophobicContact CG-CD1 4.17Å; L61-L65 WeakPolarHBondContact O-CB 3.24Å; L61-L65 WeakPolarHBondContact O-CD1 3.17Å; L61-L65 WeakPolarHBondContact O-CG 3.47Å; L61-L65 PolarHBondContact O-N 3.44Å; L61-A79 HydrophobicContact CD1-CB 4.36Å
62	T	43.9	Very low	37.7	Very low	87 Å²	87	94.7 Å²	94.7	53%	0.534	52%	0.516	S	S	.	.	H	α-helix	trans	-59.4	-60.8	170.5	-29.2	0	0	0	0	112.2	T60 A64 L65 E66	T60-T62 CarbonylContact O-C 3.55Å; T60-T62 PolarHBondContact O-N 3.28Å; T62-A64 VanDerWaalsContact C-N 3.25Å; T62-A64 PolarHBondContact O-N 3.08Å; T62-L65 WeakPolarHBondContact O-CB 3.29Å; T62-L65 PolarHBondContact O-N 3.12Å; T62-E66 WeakPolarHBondContact O-CG 3.4Å; T62-E66 PolarHBondContact O-N 3.01Å
63	E	47	Very low	38.2	Very low	77 Å²	77	86.5 Å²	86.5	36%	0.36	48%	0.479	S	S	.	.	H	α-helix	trans	-59.7	-33.9	179.4	-69.5	163	107.1	0	0	112.8	P59 T60 Q67	P59-E63 HydrophobicContact CB-CB 3.6Å; T60-E63 VanDerWaalsContact CB-OE2 3.31Å; T60-E63 WeakPolarHBondContact CB-OE2 3.43Å; T60-E63 WeakPolarHBondContact CG2-OE2 3.41Å; T60-E63 PolarHBondContact N-OE2 3.08Å; T60-E63 PolarHBondContact O-N 3.26Å; T60-E63 WeakPolarHBondContact OG1-CG 3.47Å; T60-E63 PolarHBondContact OG1-N 3.24Å; T60-E63 PolarHBondContact OG1-OE2 3.3Å; E63-Q67 VanDerWaalsContact O-CB 3.25Å; E63-Q67 WeakPolarHBondContact O-CB 3.46Å; E63-Q67 WeakPolarHBondContact O-CG 3.39Å; E63-Q67 PolarHBondContact O-N 2.67Å
64	A	41.7	Very low	38.7	Very low	8 Å²	8	84.7 Å²	84.7	7%	0.066	46%	0.456	C	S	.	.	H	α-helix	trans	-72.4	-30.4	177.8	0	0	0	0	0	112.7	P59 T60 T62 L69	P59-A64 HydrophobicContact CB-CB 4.37Å; P59-A64 HydrophobicContact CG-CB 4.42Å; T60-A64 WeakPolarHBondContact O-CB 3.21Å; T60-A64 PolarHBondContact O-N 2.81Å; T62-A64 VanDerWaalsContact C-N 3.25Å; T62-A64 PolarHBondContact O-N 3.08Å; A64-L69 WeakPolarHBondContact O-CB 3.49Å; A64-L69 PolarHBondContact O-N 3.32Å
65	L	42.3	Very low	39.1	Very low	106 Å²	106	78.1 Å²	78.1	56%	0.555	43%	0.429	S	S	*	.	H	α-helix	trans	-73.6	-47.2	170.1	-72.5	165.1	0	0	0	110.7	L61 T62 Q67 G68 P70	L61-L65 HydrophobicContact CG-CD1 4.17Å; L61-L65 WeakPolarHBondContact O-CB 3.24Å; L61-L65 WeakPolarHBondContact O-CD1 3.17Å; L61-L65 WeakPolarHBondContact O-CG 3.47Å; L61-L65 PolarHBondContact O-N 3.44Å; T62-L65 WeakPolarHBondContact O-CB 3.29Å; T62-L65 PolarHBondContact O-N 3.12Å; L65-Q67 VanDerWaalsContact C-N 3.32Å; L65-Q67 PolarHBondContact O-N 3.2Å; L65-G68 PolarHBondContact O-N 3.43Å; L65-G68 VanDerWaalsContact O-N 3.11Å; L65-P70 HydrophobicContact CD2-CB 4.36Å; L65-P70 HydrophobicContact CD2-CG 4.27Å
66	E	51.6	Low	39.9	Very low	146 Å²	146	76.4 Å²	76.4	68%	0.682	41%	0.408	S	S	*	.	H	α-helix	trans	-59.5	-37.9	178.2	-71.3	168.5	177.4	0	0	112.9	T62 G68	T62-E66 WeakPolarHBondContact O-CG 3.4Å; T62-E66 PolarHBondContact O-N 3.01Å; E66-G68 VanDerWaalsContact C-N 3.3Å; E66-G68 PolarHBondContact O-N 3.09Å
67	Q	50.6	Low	40.4	Very low	119 Å²	119	71.5 Å²	71.5	56%	0.556	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	2.6	178.5	-67.5	171.7	33.1	0	0	114	E63 L65 L69	E63-Q67 VanDerWaalsContact O-CB 3.25Å; E63-Q67 WeakPolarHBondContact O-CB 3.46Å; E63-Q67 WeakPolarHBondContact O-CG 3.39Å; E63-Q67 PolarHBondContact O-N 2.67Å; L65-Q67 VanDerWaalsContact C-N 3.32Å; L65-Q67 PolarHBondContact O-N 3.2Å; Q67-L69 VanDerWaalsContact C-N 3.28Å; Q67-L69 HydrophobicContact CB-CD1 3.95Å; Q67-L69 HydrophobicContact CB-CG 3.96Å; Q67-L69 PolarHBondContact O-N 2.68Å
68	G	41.4	Very low	40.8	Very low	53 Å²	53	71.5 Å²	71.5	55%	0.546	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.6	26.3	-179.1	0	0	0	0	0	114.1	L65 E66 P70	L65-G68 PolarHBondContact O-N 3.43Å; L65-G68 VanDerWaalsContact O-N 3.11Å; E66-G68 VanDerWaalsContact C-N 3.3Å; E66-G68 PolarHBondContact O-N 3.09Å; G68-P70 WeakPolarHBondContact O-CD 3.48Å
69	L	45.7	Very low	41	Very low	59 Å²	59	69.8 Å²	69.8	31%	0.309	38%	0.379	S	S	.	.			trans	-88.1	0.3	-179.4	-63.2	173.3	0	0	0	117.6	P59 A64 Q67 E71 T72	P59-L69 HydrophobicContact CG-CD1 4.36Å; A64-L69 WeakPolarHBondContact O-CB 3.49Å; A64-L69 PolarHBondContact O-N 3.32Å; Q67-L69 VanDerWaalsContact C-N 3.28Å; Q67-L69 HydrophobicContact CB-CD1 3.95Å; Q67-L69 HydrophobicContact CB-CG 3.96Å; Q67-L69 PolarHBondContact O-N 2.68Å; L69-E71 PolarHBondContact O-N 3.14Å; L69-E71 VanDerWaalsContact O-N 3.07Å; L69-T72 HydrophobicContact CD2-CG2 4.21Å; L69-T72 WeakPolarHBondContact O-CB 3.38Å; L69-T72 PolarHBondContact O-N 3.34Å; L69-T72 PolarHBondContact O-OG1 3.3Å
70	P	40.3	Very low	41.2	Very low	55 Å²	55	73.4 Å²	73.4	36%	0.357	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-1.2	-174.9	34.4	-36.9	0	0	0	113.8	L65 G68 R76	L65-P70 HydrophobicContact CD2-CB 4.36Å; L65-P70 HydrophobicContact CD2-CG 4.27Å; G68-P70 WeakPolarHBondContact O-CD 3.48Å; P70-R76 WeakPolarHBondContact O-CG 3.34Å; P70-R76 PolarHBondContact O-NE 3.06Å; P70-R76 PolarHBondContact O-NH2 2.94Å
71	E	37.3	Very low	41.1	Very low	132 Å²	132	80.3 Å²	80.3	62%	0.617	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-20.9	167.4	-71.1	-96	93.6	0	0	112.8	L69 R76	L69-E71 PolarHBondContact O-N 3.14Å; L69-E71 VanDerWaalsContact O-N 3.07Å; E71-R76 IonicContact OE1-NH2 3.82Å; E71-R76 PolarHBondContact OE1-NH2 3.42Å; E71-R76 VanDerWaalsContact OE1-NH2 3.11Å
72	T	39.4	Very low	40.9	Very low	49 Å²	49	80.1 Å²	80.1	30%	0.301	42%	0.418	S	S	.	.	S	Bend	trans	-76.9	151.8	-178.9	66.9	0	0	0	0	112.4	L69 W74 G75 R76	L69-T72 HydrophobicContact CD2-CG2 4.21Å; L69-T72 WeakPolarHBondContact O-CB 3.38Å; L69-T72 PolarHBondContact O-N 3.34Å; L69-T72 PolarHBondContact O-OG1 3.3Å; T72-W74 PolarHBondContact O-N 3.25Å; T72-G75 PolarHBondContact O-N 2.76Å; T72-G75 PolarHBondContact OG1-N 3.06Å; T72-R76 WeakPolarHBondContact O-CG 3.39Å; T72-R76 PolarHBondContact O-N 3.18Å
73	I	39.6	Very low	40.6	Very low	31 Å²	31	84.7 Å²	84.7	16%	0.159	43%	0.431	C	S	.	.	H	α-helix	trans	-57.1	-37.5	170.1	-68.4	175.7	0	0	0	110.2	R76 L77 I336	I73-R76 PolarHBondContact O-N 2.89Å; I73-L77 HydrophobicContact CG2-CD1 3.71Å; I73-L77 HydrophobicContact CG2-CG 4.21Å; I73-L77 WeakPolarHBondContact O-CB 3.47Å; I73-L77 WeakPolarHBondContact O-CG 3.45Å; I73-L77 PolarHBondContact O-N 3.39Å; I73-I336 HydrophobicContact CG1-CD1 3.9Å; I73-I336 HydrophobicContact CG1-CG1 4.38Å
74	W	40.3	Very low	39.8	Very low	60 Å²	60	88.6 Å²	88.6	23%	0.227	45%	0.449	C	S	.	.	H	α-helix	trans	-61.8	-53.5	178.9	-54.7	112.3	0	0	0	113	I44 T72 R76 L77 H78 C553	I44-W74 HydrophobicContact CB-CH2 3.8Å; I44-W74 HydrophobicContact CB-CZ3 3.86Å; I44-W74 HydrophobicContact CD1-CH2 3.81Å; I44-W74 HydrophobicContact CD1-CZ3 4.39Å; I44-W74 HydrophobicContact CG1-CH2 4.27Å; I44-W74 HydrophobicContact CG1-CZ3 4.46Å; I44-W74 HydrophobicContact CG2-CH2 4.3Å; T72-W74 PolarHBondContact O-N 3.25Å; W74-R76 PolarHBondContact O-N 3.1Å; W74-L77 PolarHBondContact O-N 3.23Å; W74-H78 PolarHBondContact O-CD2 2.69Å; W74-H78 PolarHBondContact O-N 3.25Å; W74-C553 HydrophobicContact CH2-CB 4.34Å; W74-C553 HydrophobicContact CZ2-CB 4.24Å
75	G	35.8	Very low	39.2	Very low	11 Å²	11	94.5 Å²	94.5	11%	0.113	49%	0.487	C	S	.	.	H	α-helix	trans	-58.9	-35.3	176.5	0	0	0	0	0	112.8	T72 A79	T72-G75 PolarHBondContact O-N 2.76Å; T72-G75 PolarHBondContact OG1-N 3.06Å; G75-A79 PolarHBondContact O-N 2.84Å; G75-A79 VanDerWaalsContact O-N 3.15Å
76	R	41.7	Very low	38.5	Very low	96 Å²	96	96.3 Å²	96.3	36%	0.362	50%	0.497	S	S	.	.	H	α-helix	trans	-75.7	-32.9	178	-66.3	176.9	-177.8	178	2.1	113.4	P70 E71 T72 I73 W74	P70-R76 WeakPolarHBondContact O-CG 3.34Å; P70-R76 PolarHBondContact O-NE 3.06Å; P70-R76 PolarHBondContact O-NH2 2.94Å; E71-R76 IonicContact OE1-NH2 3.82Å; E71-R76 PolarHBondContact OE1-NH2 3.42Å; E71-R76 VanDerWaalsContact OE1-NH2 3.11Å; T72-R76 WeakPolarHBondContact O-CG 3.39Å; T72-R76 PolarHBondContact O-N 3.18Å; I73-R76 PolarHBondContact O-N 2.89Å; W74-R76 PolarHBondContact O-N 3.1Å
77	L	37.8	Very low	37.3	Very low	28 Å²	28	95.7 Å²	95.7	15%	0.147	50%	0.497	C	S	.	.	H	α-helix	trans	-68.8	-38.1	171.8	-75.3	168.9	0	0	0	111.7	L42 I73 W74 L80 L543	L42-L77 HydrophobicContact CB-CD2 4.38Å; L42-L77 HydrophobicContact CD2-CD1 4.41Å; I73-L77 HydrophobicContact CG2-CD1 3.71Å; I73-L77 HydrophobicContact CG2-CG 4.21Å; I73-L77 WeakPolarHBondContact O-CB 3.47Å; I73-L77 WeakPolarHBondContact O-CG 3.45Å; I73-L77 PolarHBondContact O-N 3.39Å; W74-L77 PolarHBondContact O-N 3.23Å; L77-L80 PolarHBondContact O-N 3.15Å; L77-L543 HydrophobicContact CD2-CD2 4.1Å
78	H	39.6	Very low	36	Very low	85 Å²	85	98.5 Å²	98.5	39%	0.394	52%	0.516	S	S	.	.	H	α-helix	trans	-72.9	-23.9	176.2	-81.3	-78.2	0	0	0	114.3	W74 L80	W74-H78 PolarHBondContact O-CD2 2.69Å; W74-H78 PolarHBondContact O-N 3.25Å; H78-L80 PolarHBondContact O-N 3.37Å
79	A	38	Very low	35.3	Very low	58 Å²	58	103.7 Å²	103.7	48%	0.479	53%	0.525	S	S	.	.	H	α-helix	trans	-66	-25.5	171.4	0	0	0	0	0	112.8	L61 G75 R81	L61-A79 HydrophobicContact CD1-CB 4.36Å; G75-A79 PolarHBondContact O-N 2.84Å; G75-A79 VanDerWaalsContact O-N 3.15Å; A79-R81 PolarHBondContact O-N 2.9Å
80	L	35.1	Very low	34.4	Very low	115 Å²	115	107 Å²	107	60%	0.602	54%	0.543	S	S	*	.			trans	-79.1	65.5	174.2	-66.2	172.8	0	0	0	111.4	L77 H78	L77-L80 PolarHBondContact O-N 3.15Å; H78-L80 PolarHBondContact O-N 3.37Å
81	R	36	Very low	33.6	Very low	214 Å²	214	114.3 Å²	114.3	81%	0.808	57%	0.569	S	S	*	*			trans	-57.4	132.4	160.1	-85.5	-165	-179.3	-170.2	3.2	108.7	A79 K83	A79-R81 PolarHBondContact O-N 2.9Å; R81-K83 VanDerWaalsContact C-N 3.32Å; R81-K83 PolarHBondContact O-N 3.44Å
82	P	34.9	Very low	33.1	Very low	94 Å²	94	115.3 Å²	115.3	61%	0.61	57%	0.574	S	S	*	*			trans	-70	94.7	161.4	30.5	-31.9	0	0	0	108.3	P39	P39-P82 HydrophobicContact CB-CB 3.87Å; P39-P82 HydrophobicContact CG-CB 3.35Å; P39-P82 HydrophobicContact CG-CG 3.62Å
83	K	36.1	Very low	32.4	Very low	182 Å²	182	121.7 Å²	121.7	79%	0.791	60%	0.6	S	S	*	*			trans	-67.7	153.5	158.9	-75.1	-169	170.6	-171.4	0	109.1	R81	R81-K83 VanDerWaalsContact C-N 3.32Å; R81-K83 PolarHBondContact O-N 3.44Å
84	E	30.7	Very low	31.7	Very low	159 Å²	159	127.5 Å²	127.5	74%	0.743	63%	0.63	S	S	*	*			trans	-56.4	154	-171.4	-69.6	107.7	141	0	0	113.8	D86	E84-D86 PolarHBondContact O-N 3.28Å
85	P	28.4	Very low	31.1	Very low	133 Å²	133	133.7 Å²	133.7	86%	0.864	66%	0.662	S	S	*	*	S	Bend	trans	-77.4	51.5	-178.6	35.2	-38.4	0	0	0	112.7
86	D	27.9	Very low	30.7	Very low	144 Å²	144	140.2 Å²	140.2	77%	0.77	69%	0.692	S	S	*	*			trans	-143	175.8	179.6	-111.9	-46.9	0	0	0	111.9	E84	E84-D86 PolarHBondContact O-N 3.28Å
87	L	26.1	Very low	30.3	Very low	132 Å²	132	141.3 Å²	141.3	69%	0.691	71%	0.705	S	S	*	*			trans	66.6	63.7	-174.5	-57.9	-179.4	0	0	0	114.8	Q89	L87-Q89 PolarHBondContact O-N 3.42Å
88	L	25	Very low	30.2	Very low	179 Å²	179	149.1 Å²	149.1	94%	0.937	74%	0.741	S	S	*	*			trans	-69.6	48	151.1	-135.5	172.8	0	0	0	111.2
89	Q	25.1	Very low	30.3	Very low	161 Å²	161	151.8 Å²	151.8	75%	0.752	76%	0.758	S	S	*	*			trans	-167.7	110.6	-179.5	-104.7	163.8	29.6	0	0	109.5	L87	L87-Q89 PolarHBondContact O-N 3.42Å
90	L	26.3	Very low	30.2	Very low	130 Å²	130	156.2 Å²	156.2	68%	0.681	77%	0.774	S	S	*	*			trans	177	98	146.2	-99.1	157.9	0	0	0	108.8
91	F	23.6	Very low	30.3	Very low	207 Å²	207	156.3 Å²	156.3	91%	0.908	78%	0.781	S	S	*	*			trans	-71.9	136.9	152.4	-73.3	-107	0	0	0	106.7
92	H	27.4	Very low	30.1	Very low	154 Å²	154	150 Å²	150	71%	0.713	78%	0.775	S	S	*	*			trans	-133.3	131.8	158.1	-94.2	-52.3	0	0	0	108.5
93	E	24.3	Very low	29.9	Very low	182 Å²	182	151.5 Å²	151.5	85%	0.85	79%	0.785	S	S	*	*			trans	-62.7	148	165.2	-68.4	128.1	141.1	0	0	109.9
94	I	26.4	Very low	29.7	Very low	154 Å²	154	152.6 Å²	152.6	79%	0.79	79%	0.79	S	S	*	*			trans	-117.5	102.8	167.5	-61.9	177.3	0	0	0	104.9
95	E	26.7	Very low	29.9	Very low	190 Å²	190	154.3 Å²	154.3	89%	0.888	80%	0.795	S	S	*	*			trans	-60.6	139.5	166.5	-65.2	-179.9	128	0	0	108.7
96	I	27.5	Very low	30	Very low	148 Å²	148	153.6 Å²	153.6	76%	0.759	79%	0.79	S	S	*	*			trans	-107.6	116.7	178.4	-60.5	177	0	0	0	106.5	E98	I96-E98 PolarHBondContact O-N 3.21Å
97	D	32.7	Very low	30.4	Very low	119 Å²	119	151.6 Å²	151.6	64%	0.636	78%	0.778	S	S	*	*			trans	-61.2	127.6	173.2	-168.9	-24.5	0	0	0	109.8	N99	D97-N99 VanDerWaalsContact C-N 3.26Å; D97-N99 PolarHBondContact O-N 3.35Å; D97-N99 WeakPolarHBondContact OD1-CB 3.18Å; D97-N99 PolarHBondContact OD1-N 3.2Å; D97-N99 PolarHBondContact OD1-ND2 3.05Å
98	E	36.6	Very low	30.8	Very low	192 Å²	192	149.4 Å²	149.4	90%	0.897	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-3.6	-172.3	-60.6	-165.6	124	0	0	113.7	I96	I96-E98 PolarHBondContact O-N 3.21Å
99	N	42.1	Very low	31.2	Very low	140 Å²	140	143.3 Å²	143.3	75%	0.749	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-6.9	-162.7	-65.2	-79.4	0	0	0	117	D97	D97-N99 VanDerWaalsContact C-N 3.26Å; D97-N99 PolarHBondContact O-N 3.35Å; D97-N99 WeakPolarHBondContact OD1-CB 3.18Å; D97-N99 PolarHBondContact OD1-N 3.2Å; D97-N99 PolarHBondContact OD1-ND2 3.05Å
100	D	36.1	Very low	31.5	Very low	151 Å²	151	138.3 Å²	138.3	81%	0.807	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-103.3	118.8	-166.7	-155.9	16.6	0	0	0	114.3
101	P	35.7	Very low	31.8	Very low	117 Å²	117	139.8 Å²	139.8	76%	0.76	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-78.9	127.8	-171.5	29.4	-35.3	0	0	0	114.9
102	A	32.3	Very low	32.2	Very low	83 Å²	83	136.8 Å²	136.8	69%	0.686	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-71.5	141	-165.8	0	0	0	0	0	117.1
103	P	31.3	Very low	32.3	Very low	124 Å²	124	132.3 Å²	132.3	81%	0.805	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-80.8	147.6	176.4	32.1	-35.5	0	0	0	114.4	K105	P103-K105 PolarHBondContact O-N 3.23Å
104	K	32.2	Very low	32.6	Very low	206 Å²	206	130.3 Å²	130.3	90%	0.896	67%	0.669	S	S	*	*	S	Bend	trans	-85.6	82.7	-170.8	-61.7	169.8	-179.1	171.6	0	113.8
105	K	34.2	Very low	32.9	Very low	195 Å²	195	126.4 Å²	126.4	85%	0.848	65%	0.649	S	S	*	*	S	Bend	trans	-161.3	173.1	165.9	-111.8	145.2	-169.9	177.1	0	112.7	P103	P103-K105 PolarHBondContact O-N 3.23Å
106	P	31	Very low	32.9	Very low	117 Å²	117	119.5 Å²	119.5	76%	0.76	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-71.4	146.5	-145.1	26.3	-36	0	0	0	116.5
107	I	34.9	Very low	33.1	Very low	103 Å²	103	115.3 Å²	115.3	53%	0.528	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-68.5	123.6	-170.2	-57	171.5	0	0	0	112	R111	I107-R111 HydrophobicContact CG2-CB 3.71Å; I107-R111 HydrophobicContact CG2-CG 4.34Å
108	P	36.1	Very low	32.7	Very low	86 Å²	86	117.3 Å²	117.3	56%	0.558	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-63.7	150.9	174.5	-23.8	34.7	0	0	0	113.9	N110 R111 R112	P108-N110 PolarHBondContact O-N 2.68Å; P108-N110 VanDerWaalsContact O-N 3.13Å; P108-R111 PolarHBondContact O-N 2.93Å; P108-R112 PolarHBondContact O-N 2.92Å
109	F	32.9	Very low	32.3	Very low	50 Å²	50	112.8 Å²	112.8	22%	0.219	59%	0.592	C	S	.	*	H	α-helix	trans	-54.6	-32	176.7	-178.8	-89.6	0	0	0	113.4	R111 R112 L113 I157	F109-R111 PolarHBondContact O-N 3.48Å; F109-R112 PolarHBondContact O-N 3.24Å; F109-L113 HydrophobicContact CD1-CD1 4.23Å; F109-L113 HydrophobicContact CE1-CD1 3.44Å; F109-L113 VanDerWaalsContact CE1-CD1 3.44Å; F109-L113 HydrophobicContact CZ-CD1 3.95Å; F109-L113 PolarHBondContact O-N 3.2Å; F109-I157 HydrophobicContact CE2-CD1 3.9Å; F109-I157 HydrophobicContact CZ-CD1 4.06Å
110	N	31.6	Very low	31.6	Very low	57 Å²	57	113.1 Å²	113.1	31%	0.305	59%	0.593	S	S	.	*	H	α-helix	trans	-64	-39.4	177.7	-66.2	-4.1	0	0	0	112	P108 L113 M114 A229 N230	P108-N110 PolarHBondContact O-N 2.68Å; P108-N110 VanDerWaalsContact O-N 3.13Å; N110-L113 PolarHBondContact O-N 2.89Å; N110-L113 VanDerWaalsContact O-N 3.15Å; N110-M114 WeakPolarHBondContact O-CG 3.4Å; N110-M114 PolarHBondContact O-N 2.74Å; N110-A229 VanDerWaalsContact OD1-CB 3.3Å; N110-A229 WeakPolarHBondContact OD1-CB 3.44Å; N110-N230 PolarHBondContact ND2-OD1 3.15Å
111	R	32.9	Very low	31.2	Very low	161 Å²	161	113.9 Å²	113.9	61%	0.608	59%	0.588	S	S	*	*	H	α-helix	trans	-63.9	-49.1	176	-153.6	175.8	-168.9	148.4	6.8	109.4	I107 P108 F109 L113 M114 D115	I107-R111 HydrophobicContact CG2-CB 3.71Å; I107-R111 HydrophobicContact CG2-CG 4.34Å; P108-R111 PolarHBondContact O-N 2.93Å; F109-R111 PolarHBondContact O-N 3.48Å; R111-L113 PolarHBondContact O-N 3.39Å; R111-M114 CarbonylContact O-C 3.59Å; R111-M114 PolarHBondContact O-N 3.09Å; R111-D115 WeakPolarHBondContact O-CB 3.32Å; R111-D115 PolarHBondContact O-N 3.31Å
112	R	30.4	Very low	30.8	Very low	144 Å²	144	116.3 Å²	116.3	54%	0.543	59%	0.59	S	S	.	*	H	α-helix	trans	-54.7	-23.7	173.2	-70.2	-172.4	-179.8	173.5	1.7	115.1	P108 F109 D115 M116	P108-R112 PolarHBondContact O-N 2.92Å; F109-R112 PolarHBondContact O-N 3.24Å; R112-D115 PolarHBondContact N-OD2 2.82Å; R112-M116 WeakPolarHBondContact O-CG 3.18Å
113	L	30.5	Very low	30.7	Very low	60 Å²	60	116.5 Å²	116.5	31%	0.314	59%	0.591	S	S	.	*	H	α-helix	trans	-91.9	-31.2	179.7	-151	146.9	0	0	0	112	F109 N110 R111 M116	F109-L113 HydrophobicContact CD1-CD1 4.23Å; F109-L113 HydrophobicContact CE1-CD1 3.44Å; F109-L113 VanDerWaalsContact CE1-CD1 3.44Å; F109-L113 HydrophobicContact CZ-CD1 3.95Å; F109-L113 PolarHBondContact O-N 3.2Å; N110-L113 PolarHBondContact O-N 2.89Å; N110-L113 VanDerWaalsContact O-N 3.15Å; R111-L113 PolarHBondContact O-N 3.39Å; L113-M116 HydrophobicContact CG-CE 4.17Å
114	M	29.8	Very low	30.5	Very low	139 Å²	139	118.9 Å²	118.9	69%	0.685	60%	0.597	S	S	*	*	H	α-helix	trans	-72.7	-42.1	168.2	-64.8	-65.3	-162.6	0	0	112	N110 R111 M116 S117	N110-M114 WeakPolarHBondContact O-CG 3.4Å; N110-M114 PolarHBondContact O-N 2.74Å; R111-M114 CarbonylContact O-C 3.59Å; R111-M114 PolarHBondContact O-N 3.09Å; M114-M116 PolarHBondContact O-N 3.45Å; M114-S117 WeakPolarHBondContact O-CB 3.4Å; M114-S117 PolarHBondContact O-N 2.95Å; M114-S117 PolarHBondContact O-OG 3.18Å
115	D	32.6	Very low	30.4	Very low	72 Å²	72	113.6 Å²	113.6	39%	0.385	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-57.5	-21.7	177.9	-62.2	-28.1	0	0	0	112.1	R111 R112 S117 F118	R111-D115 WeakPolarHBondContact O-CB 3.32Å; R111-D115 PolarHBondContact O-N 3.31Å; R112-D115 PolarHBondContact N-OD2 2.82Å; D115-S117 PolarHBondContact O-N 3.23Å; D115-S117 VanDerWaalsContact O-N 3.11Å; D115-F118 PolarHBondContact O-N 3.29Å; D115-F118 VanDerWaalsContact O-N 3.16Å
116	M	28.5	Very low	30.2	Very low	45 Å²	45	108.8 Å²	108.8	22%	0.222	58%	0.582	C	S	.	*	G	3₁₀ helix	trans	-66.2	-5.7	173	-50.8	-159.7	-45.8	0	0	114	R112 L113 M114 Y161 H276	R112-M116 WeakPolarHBondContact O-CG 3.18Å; L113-M116 HydrophobicContact CG-CE 4.17Å; M114-M116 PolarHBondContact O-N 3.45Å; M116-Y161 WeakPolarHBondContact CB-OH 3.39Å; M116-Y161 WeakPolarHBondContact CG-OH 3.47Å; M116-Y161 HydrophobicContact SD-CE2 3.75Å; M116-Y161 PolarHBondContact SD-OH 3.42Å; M116-Y161 VanDerWaalsContact SD-OH 3.37Å; M116-H276 HydrophobicContact CE-CB 3.7Å
117	S	30.1	Very low	30.1	Very low	60 Å²	60	110.6 Å²	110.6	42%	0.42	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-92.3	-9	173.9	64.4	0	0	0	0	114.1	M114 D115	M114-S117 WeakPolarHBondContact O-CB 3.4Å; M114-S117 PolarHBondContact O-N 2.95Å; M114-S117 PolarHBondContact O-OG 3.18Å; D115-S117 PolarHBondContact O-N 3.23Å; D115-S117 VanDerWaalsContact O-N 3.11Å
118	F	25.6	Very low	29.8	Very low	161 Å²	161	113.6 Å²	113.6	71%	0.706	60%	0.597	S	S	*	*			trans	-92.2	125	175.5	-80.6	-88.9	0	0	0	111.7	D115	D115-F118 PolarHBondContact O-N 3.29Å; D115-F118 VanDerWaalsContact O-N 3.16Å
119	P	27.3	Very low	29.6	Very low	97 Å²	97	118 Å²	118	63%	0.63	61%	0.61	S	S	*	*			trans	-72.9	-177.3	152	35.2	-33.4	0	0	0	109.5
120	I	28.5	Very low	29.5	Very low	148 Å²	148	122.1 Å²	122.1	76%	0.759	63%	0.633	S	S	*	*			trans	77	128.6	174.7	-51.5	161.5	0	0	0	111.8
121	K	27.8	Very low	29.3	Very low	166 Å²	166	127.4 Å²	127.4	72%	0.722	66%	0.656	S	S	*	*			cis	-155.1	168.3	-8.8	-109.6	168.5	-175.3	-174.1	0	108.6
122	E	27.4	Very low	29.3	Very low	168 Å²	168	126.1 Å²	126.1	79%	0.785	65%	0.651	S	S	*	*			trans	48.8	96	152.1	-69.8	153.5	-132.4	0	0	119.7
123	A	29	Very low	29.2	Very low	87 Å²	87	124.6 Å²	124.6	72%	0.719	66%	0.658	S	S	*	*			trans	-152.7	112.4	154.1	0	0	0	0	0	111	C125	A123-C125 VanDerWaalsContact C-N 3.28Å; A123-C125 PolarHBondContact O-N 3.02Å
124	N	27.5	Very low	29.1	Very low	174 Å²	174	127 Å²	127	93%	0.93	68%	0.681	S	S	*	*			trans	-81.3	60.6	-174.3	-73.1	-20.8	0	0	0	113.5
125	C	30.8	Very low	29.1	Very low	95 Å²	95	125.8 Å²	125.8	64%	0.642	68%	0.68	S	S	*	*			trans	-102.5	43.1	175.8	-63.1	0	0	0	0	112.3	A123	A123-C125 VanDerWaalsContact C-N 3.28Å; A123-C125 PolarHBondContact O-N 3.02Å
126	A	28	Very low	28.8	Very low	95 Å²	95	125.6 Å²	125.6	79%	0.785	70%	0.695	S	S	*	*	S	Bend	trans	-74.2	-27.7	-173.1	0	0	0	0	0	114.4
127	D	30.6	Very low	28.8	Very low	154 Å²	154	132.5 Å²	132.5	82%	0.824	72%	0.724	S	S	*	*			trans	-113.3	5.7	-169.1	-72.6	-63.4	0	0	0	115.1	H129	D127-H129 PolarHBondContact O-N 3.41Å
128	E	28.5	Very low	28.5	Very low	166 Å²	166	142 Å²	142	78%	0.776	75%	0.751	S	S	*	*			trans	-70.3	96.6	176	-78	-155.1	152.1	0	0	111.8	L130	E128-L130 VanDerWaalsContact C-N 3.29Å; E128-L130 PolarHBondContact O-N 3.46Å
129	H	31.6	Very low	28.6	Very low	180 Å²	180	139.9 Å²	139.9	83%	0.833	75%	0.751	S	S	*	*			trans	-75.5	73	-173.8	-152.9	-74.2	0	0	0	112.2	D127 E131	D127-H129 PolarHBondContact O-N 3.41Å; H129-E131 PolarHBondContact O-N 3.09Å
130	L	30.5	Very low	28.4	Very low	135 Å²	135	143.6 Å²	143.6	71%	0.707	76%	0.76	S	S	*	*			trans	-33.4	103	-176.9	-94.1	159.4	0	0	0	115	E128 W132	E128-L130 VanDerWaalsContact C-N 3.29Å; E128-L130 PolarHBondContact O-N 3.46Å; L130-W132 VanDerWaalsContact O-CD1 3.3Å; L130-W132 PolarHBondContact O-N 3.14Å
131	E	28	Very low	28.3	Very low	169 Å²	169	142.7 Å²	142.7	79%	0.79	76%	0.764	S	S	*	*			trans	-71.2	97.4	176	-76.9	-142.9	131	0	0	112.1	H129 T133	H129-E131 PolarHBondContact O-N 3.09Å; E131-T133 PolarHBondContact O-N 3.41Å
132	W	33	Very low	28.1	Very low	133 Å²	133	139.1 Å²	139.1	50%	0.504	76%	0.76	S	S	.	*			trans	-73.1	77.4	165.1	-67.8	88.2	0	0	0	110.3	L130 S134 M155 Q320	L130-W132 VanDerWaalsContact O-CD1 3.3Å; L130-W132 PolarHBondContact O-N 3.14Å; W132-S134 PolarHBondContact O-N 3.34Å; W132-S134 VanDerWaalsContact O-N 3.16Å; W132-M155 HydrophobicContact CH2-CE 3.93Å; W132-M155 HydrophobicContact CZ3-CE 3.76Å; W132-Q320 VanDerWaalsContact CE2-OE1 3.31Å; W132-Q320 HydrophobicContact CH2-CB 4.21Å; W132-Q320 HydrophobicContact CZ2-CB 4.16Å
133	T	27.2	Very low	27.9	Very low	112 Å²	112	138.4 Å²	138.4	69%	0.687	77%	0.767	S	S	*	*			trans	-47.4	119.4	179.6	41	0	0	0	0	111.8	E131 V135	E131-T133 PolarHBondContact O-N 3.41Å; T133-V135 PolarHBondContact O-N 3.14Å
134	S	28.6	Very low	27.9	Very low	112 Å²	112	139.8 Å²	139.8	78%	0.783	77%	0.766	S	S	*	*			trans	-68.9	125.4	-171.6	76.1	0	0	0	0	111.2	W132 G136	W132-S134 PolarHBondContact O-N 3.34Å; W132-S134 VanDerWaalsContact O-N 3.16Å; S134-G136 PolarHBondContact O-N 3.49Å
135	V	29.1	Very low	28.2	Very low	112 Å²	112	137.2 Å²	137.2	68%	0.679	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	59.6	-175.3	-166.9	0	0	0	0	110.9	T133	T133-V135 PolarHBondContact O-N 3.14Å
136	G	27.5	Very low	28.6	Very low	68 Å²	68	137 Å²	137	70%	0.701	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	-26.3	-177.6	0	0	0	0	0	115.1	S134	S134-G136 PolarHBondContact O-N 3.49Å
137	K	28	Very low	29.7	Very low	191 Å²	191	135.6 Å²	135.6	83%	0.83	73%	0.728	S	S	*	*	S	Bend	trans	-92.6	134.7	-179.3	-68.5	-176.5	178.7	178.7	0	111.4	V139	K137-V139 VanDerWaalsContact C-N 3.33Å; K137-V139 PolarHBondContact O-N 2.73Å
138	R	24.8	Very low	31.4	Very low	258 Å²	258	129 Å²	129	97%	0.974	70%	0.696	S	S	*	*			trans	-76.4	80.5	172.6	-70.1	-174.3	-177	-178.5	2.2	110.3
139	V	26.3	Very low	33.4	Very low	118 Å²	118	121.1 Å²	121.1	72%	0.715	66%	0.659	S	S	*	*			trans	-74.9	126.9	167.8	-175.7	0	0	0	0	107.9	K137	K137-V139 VanDerWaalsContact C-N 3.33Å; K137-V139 PolarHBondContact O-N 2.73Å
140	Q	24.1	Very low	35.3	Very low	174 Å²	174	114.4 Å²	114.4	81%	0.813	63%	0.63	S	S	*	*			trans	-65.9	140.9	167.8	-71.9	-175.9	-10.3	0	0	108.4	S142	Q140-S142 PolarHBondContact O-N 3.08Å
141	P	26.1	Very low	37.2	Very low	129 Å²	129	111.6 Å²	111.6	84%	0.838	62%	0.618	S	S	*	*			trans	-65.6	104.1	-178.8	27.3	-33.8	0	0	0	110.2
142	S	23.7	Very low	39.7	Very low	92 Å²	92	103.6 Å²	103.6	64%	0.643	58%	0.581	S	S	*	*			trans	-62.7	149.3	159.9	45.7	0	0	0	0	109.2	Q140 V144	Q140-S142 PolarHBondContact O-N 3.08Å; S142-V144 PolarHBondContact O-N 2.93Å
143	V	24	Very low	42.1	Very low	153 Å²	153	97.9 Å²	97.9	93%	0.927	56%	0.56	S	S	*	*			trans	-71	101.1	-174.3	-178.4	0	0	0	0	109.9
144	V	27.3	Very low	44.4	Very low	116 Å²	116	95.5 Å²	95.5	70%	0.703	54%	0.543	S	S	*	.			trans	-128.3	137.6	169	-175.8	0	0	0	0	107.1	S142	S142-V144 PolarHBondContact O-N 2.93Å
145	T	33.6	Very low	46.9	Very low	120 Å²	120	92.4 Å²	92.4	74%	0.736	52%	0.517	S	S	*	.			trans	-67.1	136.8	-163	38.6	0	0	0	0	114.2	N147	T145-N147 PolarHBondContact O-N 3.08Å
146	D	40.3	Very low	49.5	Very low	89 Å²	89	87.2 Å²	87.2	48%	0.476	49%	0.485	S	S	.	.			trans	-62.8	95.9	-178.1	-83.3	-73	0	0	0	112.6	Q329 Y331	D146-Q329 PolarHBondContact OD1-NE2 3.29Å; D146-Y331 WeakPolarHBondContact O-CD2 3.49Å
147	N	51.9	Low	52.1	Low	67 Å²	67	85.5 Å²	85.5	36%	0.358	46%	0.46	S	S	.	.			trans	-135.7	33.9	176.8	-120.9	-33.7	0	0	0	113.2	T145 L149 N150 V151	T145-N147 PolarHBondContact O-N 3.08Å; N147-L149 PolarHBondContact O-N 3.44Å; N147-L149 VanDerWaalsContact O-N 3.11Å; N147-N150 PolarHBondContact O-N 2.98Å; N147-N150 PolarHBondContact OD1-ND2 2.89Å; N147-V151 PolarHBondContact O-N 3.47Å
148	G	65.2	Low	54.6	Low	14 Å²	14	83.3 Å²	83.3	14%	0.144	45%	0.45	C	S	.	.	H	α-helix	trans	-62.4	-18.4	-171.3	0	0	0	0	0	116.1	M152 I326	G148-M152 PolarHBondContact O-N 3.42Å; G148-I326 VanDerWaalsContact O-CG2 3.29Å; G148-I326 WeakPolarHBondContact O-CG2 3.43Å
149	L	71.4	Confident	57.3	Low	1 Å²	1	71.4 Å²	71.4	1%	0.005	41%	0.407	C	S	.	.	H	α-helix	trans	-72.7	-50.2	172.2	-179	69	0	0	0	112	N147 V151 M152 L153 D235 L238 L239 L242 V328	N147-L149 PolarHBondContact O-N 3.44Å; N147-L149 VanDerWaalsContact O-N 3.11Å; L149-V151 VanDerWaalsContact C-N 3.27Å; L149-V151 PolarHBondContact O-N 3.4Å; L149-M152 HydrophobicContact CD1-CE 3.9Å; L149-M152 WeakPolarHBondContact O-CA 3.16Å; L149-M152 VanDerWaalsContact O-CB 3.3Å; L149-M152 WeakPolarHBondContact O-CB 3.3Å; L149-M152 PolarHBondContact O-N 3.24Å; L149-L153 HydrophobicContact CG-CD1 4.19Å; L149-L153 WeakPolarHBondContact O-CG 3.41Å; L149-L153 PolarHBondContact O-N 3.47Å; L149-D235 HydrophobicContact CD2-CB 3.81Å; L149-D235 WeakPolarHBondContact CD2-O 3.17Å; L149-L238 HydrophobicContact CD2-CB 4.02Å; L149-L239 HydrophobicContact CD1-CD1 4.32Å; L149-L239 HydrophobicContact CD2-CB 4.27Å; L149-L242 HydrophobicContact CD1-CD1 4.2Å; L149-V328 HydrophobicContact CB-CG1 4.26Å; L149-V328 HydrophobicContact CD1-CG1 4.05Å
150	N	70.1	Confident	60	Low	40 Å²	40	65.8 Å²	65.8	21%	0.214	37%	0.373	C	S	.	.	H	α-helix	trans	-61.9	-39.3	-179.4	-70.6	-54.3	0	0	0	110.9	N147 M152 L153 D154 D235	N147-N150 PolarHBondContact O-N 2.98Å; N147-N150 PolarHBondContact OD1-ND2 2.89Å; N150-M152 VanDerWaalsContact C-N 3.32Å; N150-M152 PolarHBondContact O-N 3.17Å; N150-L153 PolarHBondContact O-N 3.13Å; N150-D154 PolarHBondContact O-N 2.98Å; N150-D235 PolarHBondContact ND2-OD2 3.41Å
151	V	70.7	Confident	62.6	Low	76 Å²	76	61.1 Å²	61.1	46%	0.461	35%	0.348	S	S	.	.	H	α-helix	trans	-58.9	-40.8	170.2	178.6	0	0	0	0	111.8	N147 L149 M155	N147-V151 PolarHBondContact O-N 3.47Å; L149-V151 VanDerWaalsContact C-N 3.27Å; L149-V151 PolarHBondContact O-N 3.4Å; V151-M155 HydrophobicContact CG1-CG 4.32Å; V151-M155 HydrophobicContact CG1-SD 4Å; V151-M155 VanDerWaalsContact O-CB 3.23Å; V151-M155 WeakPolarHBondContact O-CB 3.46Å; V151-M155 WeakPolarHBondContact O-CG 3.34Å; V151-M155 PolarHBondContact O-N 3.3Å
152	M	81	Confident	65.2	Low	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-64.3	-40.3	176.2	-171.3	-177.4	76.4	0	0	112.7	G148 L149 N150 S156 L242 A283 K286 M287 F321 I326 V328	G148-M152 PolarHBondContact O-N 3.42Å; L149-M152 HydrophobicContact CD1-CE 3.9Å; L149-M152 WeakPolarHBondContact O-CA 3.16Å; L149-M152 VanDerWaalsContact O-CB 3.3Å; L149-M152 WeakPolarHBondContact O-CB 3.3Å; L149-M152 PolarHBondContact O-N 3.24Å; N150-M152 VanDerWaalsContact C-N 3.32Å; N150-M152 PolarHBondContact O-N 3.17Å; M152-S156 WeakPolarHBondContact O-CB 3.33Å; M152-S156 PolarHBondContact O-N 3.38Å; M152-L242 HydrophobicContact CE-CD1 3.87Å; M152-A283 HydrophobicContact CE-CB 4.21Å; M152-K286 HydrophobicContact CG-CG 4.06Å; M152-K286 HydrophobicContact SD-CB 4.05Å; M152-K286 HydrophobicContact SD-CG 3.64Å; M152-M287 HydrophobicContact CE-CG 3.89Å; M152-M287 HydrophobicContact CE-SD 4.23Å; M152-M287 HydrophobicContact SD-CG 4.17Å; M152-M287 HydrophobicContact SD-SD 4.13Å; M152-F321 HydrophobicContact CG-CE2 4.41Å; M152-F321 HydrophobicContact CG-CZ 4.19Å; M152-I326 HydrophobicContact CB-CD1 4.1Å; M152-I326 HydrophobicContact CB-CG2 4.22Å; M152-I326 HydrophobicContact CG-CD1 4.12Å; M152-V328 HydrophobicContact CB-CG2 4.34Å; M152-V328 HydrophobicContact SD-CG2 3.75Å
153	L	82.4	Confident	67.9	Low	13 Å²	13	54.1 Å²	54.1	7%	0.068	30%	0.298	C	S	.	.	H	α-helix	trans	-70.5	-49.2	-179.7	-65.7	173.4	0	0	0	111.4	L149 N150 M155 S156 I157 L238 L242 A283	L149-L153 HydrophobicContact CG-CD1 4.19Å; L149-L153 WeakPolarHBondContact O-CG 3.41Å; L149-L153 PolarHBondContact O-N 3.47Å; N150-L153 PolarHBondContact O-N 3.13Å; L153-M155 VanDerWaalsContact C-N 3.29Å; L153-M155 PolarHBondContact O-N 3.22Å; L153-S156 PolarHBondContact O-N 3.14Å; L153-S156 PolarHBondContact O-OG 2.82Å; L153-S156 VanDerWaalsContact O-OG 3.13Å; L153-I157 WeakPolarHBondContact O-CG1 3.36Å; L153-I157 PolarHBondContact O-N 3.42Å; L153-L238 HydrophobicContact CD1-CD1 4.12Å; L153-L242 HydrophobicContact CD2-CD1 4.18Å; L153-A283 HydrophobicContact CD2-CB 4.27Å
154	D	76.8	Confident	70.4	Confident	62 Å²	62	47.3 Å²	47.3	33%	0.332	26%	0.256	S	S	.	.	H	α-helix	trans	-59.6	-40.6	175.5	-82.9	-5.3	0	0	0	111.3	N150 I157 K158	N150-D154 PolarHBondContact O-N 2.98Å; D154-I157 PolarHBondContact O-N 3.26Å; D154-K158 WeakPolarHBondContact O-CB 3.33Å; D154-K158 WeakPolarHBondContact O-CG 3.24Å; D154-K158 PolarHBondContact O-N 3.02Å
155	M	80.3	Confident	72.5	Confident	48 Å²	48	49.2 Å²	49.2	24%	0.236	26%	0.257	C	S	.	.	H	α-helix	trans	-68.5	-30.5	175	-72.1	-173.7	81.1	0	0	113.2	W132 V151 L153 A159 F321 I326	W132-M155 HydrophobicContact CH2-CE 3.93Å; W132-M155 HydrophobicContact CZ3-CE 3.76Å; V151-M155 HydrophobicContact CG1-CG 4.32Å; V151-M155 HydrophobicContact CG1-SD 4Å; V151-M155 VanDerWaalsContact O-CB 3.23Å; V151-M155 WeakPolarHBondContact O-CB 3.46Å; V151-M155 WeakPolarHBondContact O-CG 3.34Å; V151-M155 PolarHBondContact O-N 3.3Å; L153-M155 VanDerWaalsContact C-N 3.29Å; L153-M155 PolarHBondContact O-N 3.22Å; M155-A159 VanDerWaalsContact O-CB 3.23Å; M155-A159 WeakPolarHBondContact O-CB 3.38Å; M155-A159 PolarHBondContact O-N 2.8Å; M155-F321 HydrophobicContact CB-CD2 3.73Å; M155-F321 HydrophobicContact CB-CE2 3.76Å; M155-I326 HydrophobicContact SD-CD1 3.75Å; M155-I326 HydrophobicContact SD-CG1 4.41Å
156	S	85	Confident	74.1	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.014	25%	0.254	C	S	.	.	H	α-helix	trans	-75.7	-34.1	176.7	86.1	0	0	0	0	112	M152 L153 A160 S279	M152-S156 WeakPolarHBondContact O-CB 3.33Å; M152-S156 PolarHBondContact O-N 3.38Å; L153-S156 PolarHBondContact O-N 3.14Å; L153-S156 PolarHBondContact O-OG 2.82Å; L153-S156 VanDerWaalsContact O-OG 3.13Å; S156-A160 WeakPolarHBondContact O-CB 3.41Å; S156-A160 PolarHBondContact O-N 3.01Å; S156-S279 WeakPolarHBondContact CB-O 3.43Å; S156-S279 PolarHBondContact OG-O 3.41Å
157	I	81.6	Confident	75	Confident	33 Å²	33	46 Å²	46	17%	0.169	24%	0.242	C	C	.	.	H	α-helix	trans	-63.9	-51.9	170.8	-66.2	166.4	0	0	0	110.1	F109 L153 D154 A159 A160 Y161	F109-I157 HydrophobicContact CE2-CD1 3.9Å; F109-I157 HydrophobicContact CZ-CD1 4.06Å; L153-I157 WeakPolarHBondContact O-CG1 3.36Å; L153-I157 PolarHBondContact O-N 3.42Å; D154-I157 PolarHBondContact O-N 3.26Å; I157-A159 VanDerWaalsContact C-N 3.33Å; I157-A159 PolarHBondContact O-N 2.96Å; I157-A160 WeakPolarHBondContact O-CB 3.14Å; I157-A160 PolarHBondContact O-N 3.11Å; I157-A160 VanDerWaalsContact O-N 3.14Å; I157-Y161 HydrophobicContact CG2-CD2 3.86Å; I157-Y161 HydrophobicContact CG2-CE2 3.95Å; I157-Y161 PolarHBondContact O-N 3.23Å
158	K	79.7	Confident	75	Confident	145 Å²	145	47.6 Å²	47.6	63%	0.63	26%	0.264	S	S	*	.	H	α-helix	trans	-56.6	-45.5	176.1	-73	179.6	179.9	-171	0	111.9	D154 A160 Y161 S162	D154-K158 WeakPolarHBondContact O-CB 3.33Å; D154-K158 WeakPolarHBondContact O-CG 3.24Å; D154-K158 PolarHBondContact O-N 3.02Å; K158-A160 VanDerWaalsContact C-N 3.33Å; K158-A160 PolarHBondContact O-N 2.97Å; K158-Y161 PolarHBondContact O-N 3.45Å; K158-S162 PolarHBondContact O-N 3.37Å; K158-S162 PolarHBondContact O-OG 2.66Å
159	A	80.9	Confident	74.3	Confident	7 Å²	7	53.5 Å²	53.5	6%	0.058	29%	0.292	C	S	.	.	H	α-helix	trans	-64.5	-34.5	178.1	0	0	0	0	0	113.5	M155 I157 F163 L282 F321	M155-A159 VanDerWaalsContact O-CB 3.23Å; M155-A159 WeakPolarHBondContact O-CB 3.38Å; M155-A159 PolarHBondContact O-N 2.8Å; I157-A159 VanDerWaalsContact C-N 3.33Å; I157-A159 PolarHBondContact O-N 2.96Å; A159-F163 WeakPolarHBondContact O-CB 3.1Å; A159-F163 PolarHBondContact O-N 3.31Å; A159-F163 VanDerWaalsContact O-N 3.1Å; A159-L282 HydrophobicContact CB-CD1 3.96Å; A159-F321 HydrophobicContact CB-CB 3.56Å; A159-F321 HydrophobicContact CB-CD1 4.49Å; A159-F321 HydrophobicContact CB-CD2 4.48Å; A159-F321 HydrophobicContact CB-CG 3.93Å
160	A	83.1	Confident	72.9	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-67.4	-46.3	174.5	0	0	0	0	0	111.8	S156 I157 K158 F163 R164 V275 L278 L282	S156-A160 WeakPolarHBondContact O-CB 3.41Å; S156-A160 PolarHBondContact O-N 3.01Å; I157-A160 WeakPolarHBondContact O-CB 3.14Å; I157-A160 PolarHBondContact O-N 3.11Å; I157-A160 VanDerWaalsContact O-N 3.14Å; K158-A160 VanDerWaalsContact C-N 3.33Å; K158-A160 PolarHBondContact O-N 2.97Å; A160-F163 PolarHBondContact O-N 2.83Å; A160-R164 WeakPolarHBondContact O-CG 3.39Å; A160-R164 PolarHBondContact O-N 3.25Å; A160-V275 HydrophobicContact CB-CG1 4.21Å; A160-L278 HydrophobicContact CB-CB 4.13Å; A160-L278 HydrophobicContact CB-CD2 3.77Å; A160-L278 HydrophobicContact CB-CG 3.75Å; A160-L282 HydrophobicContact CB-CD1 4.32Å
161	Y	79.5	Confident	71.6	Confident	77 Å²	77	57.1 Å²	57.1	30%	0.302	32%	0.318	S	S	.	.	H	α-helix	trans	-61.3	-54.2	176.1	-90.9	-72.4	0	0	0	112.5	M116 I157 K158 F163 R164 Q165 V275	M116-Y161 WeakPolarHBondContact CB-OH 3.39Å; M116-Y161 WeakPolarHBondContact CG-OH 3.47Å; M116-Y161 HydrophobicContact SD-CE2 3.75Å; M116-Y161 PolarHBondContact SD-OH 3.42Å; M116-Y161 VanDerWaalsContact SD-OH 3.37Å; I157-Y161 HydrophobicContact CG2-CD2 3.86Å; I157-Y161 HydrophobicContact CG2-CE2 3.95Å; I157-Y161 PolarHBondContact O-N 3.23Å; K158-Y161 PolarHBondContact O-N 3.45Å; Y161-F163 PolarHBondContact O-N 2.87Å; Y161-R164 PolarHBondContact O-N 2.77Å; Y161-Q165 PolarHBondContact O-N 2.93Å; Y161-V275 HydrophobicContact CD1-CG1 4.33Å; Y161-V275 HydrophobicContact CD1-CG2 4.48Å; Y161-V275 HydrophobicContact CD2-CG1 3.73Å; Y161-V275 HydrophobicContact CE1-CG1 4.21Å; Y161-V275 HydrophobicContact CE1-CG2 4.46Å; Y161-V275 HydrophobicContact CE2-CG1 3.59Å; Y161-V275 HydrophobicContact CG-CG1 4.11Å
162	S	80.5	Confident	70.2	Confident	40 Å²	40	63.4 Å²	63.4	28%	0.28	34%	0.339	S	S	.	.	H	α-helix	trans	-62.9	-30.6	-179.9	-56	0	0	0	0	112.4	K158 V166	K158-S162 PolarHBondContact O-N 3.37Å; K158-S162 PolarHBondContact O-OG 2.66Å; S162-V166 WeakPolarHBondContact O-CB 3.45Å; S162-V166 VanDerWaalsContact O-CG2 3.29Å; S162-V166 WeakPolarHBondContact O-CG2 3.31Å; S162-V166 PolarHBondContact O-N 3.24Å
163	F	81.6	Confident	68.1	Low	33 Å²	33	69.3 Å²	69.3	15%	0.145	37%	0.365	C	S	.	.	H	α-helix	trans	-70.4	-35.8	173.1	-175.5	-99.7	0	0	0	112.9	A159 A160 Y161 S167 L270 L278 V318	A159-F163 WeakPolarHBondContact O-CB 3.1Å; A159-F163 PolarHBondContact O-N 3.31Å; A159-F163 VanDerWaalsContact O-N 3.1Å; A160-F163 PolarHBondContact O-N 2.83Å; Y161-F163 PolarHBondContact O-N 2.87Å; F163-S167 PolarHBondContact O-N 3.05Å; F163-S167 VanDerWaalsContact O-N 3.11Å; F163-L270 HydrophobicContact CE1-CB 4.31Å; F163-L270 WeakPolarHBondContact CE1-O 3.44Å; F163-L270 HydrophobicContact CZ-CB 4.47Å; F163-L278 HydrophobicContact CD1-CD2 4.24Å; F163-V318 HydrophobicContact CB-CG2 3.79Å; F163-V318 HydrophobicContact CD1-CG2 4.25Å; F163-V318 HydrophobicContact CD2-CB 4.42Å; F163-V318 HydrophobicContact CD2-CG2 3.62Å; F163-V318 HydrophobicContact CE2-CG2 4.27Å; F163-V318 HydrophobicContact CG-CG2 3.61Å
164	R	75.8	Confident	65.9	Low	10 Å²	10	70.5 Å²	70.5	4%	0.038	38%	0.375	C	S	.	.	H	α-helix	trans	-69.9	-40	174.4	-74.7	-84.4	171.5	-83.5	-2.2	112.1	A160 Y161 V166 S167 L270 N271 L273 V275 L278	A160-R164 WeakPolarHBondContact O-CG 3.39Å; A160-R164 PolarHBondContact O-N 3.25Å; Y161-R164 PolarHBondContact O-N 2.77Å; R164-V166 VanDerWaalsContact C-N 3.3Å; R164-V166 PolarHBondContact O-N 3.32Å; R164-S167 WeakPolarHBondContact O-CB 3.43Å; R164-S167 PolarHBondContact O-N 2.88Å; R164-L270 VanDerWaalsContact CZ-O 3.28Å; R164-L270 PolarHBondContact NH1-O 2.86Å; R164-L270 PolarHBondContact NH2-O 3.06Å; R164-N271 PolarHBondContact NH1-O 2.95Å; R164-N271 PolarHBondContact NH2-O 3.12Å; R164-L273 PolarHBondContact NE-O 3.21Å; R164-L273 PolarHBondContact NH2-O 3Å; R164-V275 HydrophobicContact CB-CG2 4.5Å; R164-V275 HydrophobicContact CG-CG2 3.91Å; R164-L278 HydrophobicContact CG-CD2 4.34Å
165	Q	72.1	Confident	63.7	Low	156 Å²	156	74.4 Å²	74.4	73%	0.729	40%	0.395	S	S	*	.	H	α-helix	trans	-62.6	-33.3	173.9	-71.9	172.5	-30.6	0	0	113.3	Y161	Y161-Q165 PolarHBondContact O-N 2.93Å
166	V	65.9	Low	61.4	Low	112 Å²	112	75.6 Å²	75.6	68%	0.679	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-2.1	178.4	178.3	0	0	0	0	112.3	S162 R164	S162-V166 WeakPolarHBondContact O-CB 3.45Å; S162-V166 VanDerWaalsContact O-CG2 3.29Å; S162-V166 WeakPolarHBondContact O-CG2 3.31Å; S162-V166 PolarHBondContact O-N 3.24Å; R164-V166 VanDerWaalsContact C-N 3.3Å; R164-V166 PolarHBondContact O-N 3.32Å
167	S	59.6	Low	59	Low	30 Å²	30	79 Å²	79	21%	0.21	43%	0.429	C	S	.	.	S	Bend	trans	-81	123.9	175.6	-174.9	0	0	0	0	110.6	F163 R164 N169	F163-S167 PolarHBondContact O-N 3.05Å; F163-S167 VanDerWaalsContact O-N 3.11Å; R164-S167 WeakPolarHBondContact O-CB 3.43Å; R164-S167 PolarHBondContact O-N 2.88Å; S167-N169 PolarHBondContact O-N 2.93Å; S167-N169 VanDerWaalsContact O-N 3.1Å; S167-N169 PolarHBondContact OG-O 2.92Å
168	A	51.8	Low	56.9	Low	100 Å²	100	78.2 Å²	78.2	83%	0.826	43%	0.426	S	S	*	.	S	Bend	trans	-56.5	-30	-179.5	0	0	0	0	0	113.7
169	N	49.9	Very low	54.8	Low	138 Å²	138	74.1 Å²	74.1	74%	0.738	42%	0.416	S	S	*	.	S	Bend	trans	-120.1	107.1	167.5	-66.4	-17.8	0	0	0	108.1	S167	S167-N169 PolarHBondContact O-N 2.93Å; S167-N169 VanDerWaalsContact O-N 3.1Å; S167-N169 PolarHBondContact OG-O 2.92Å
170	P	42.6	Very low	52.9	Low	82 Å²	82	76.1 Å²	76.1	53%	0.532	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-75.9	134	163.1	30	-31.4	0	0	0	109.2
171	P	42.8	Very low	50.8	Low	36 Å²	36	79.9 Å²	79.9	23%	0.234	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-62.1	139.2	169.2	27.4	-33	0	0	0	109.5	F173	P171-F173 PolarHBondContact O-N 2.91Å
172	K	41.7	Very low	48.9	Very low	208 Å²	208	79.7 Å²	79.7	90%	0.904	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-62.5	123	168.4	-71.4	-174.3	177.1	-176.8	0	107.9
173	F	36.2	Very low	46.9	Very low	123 Å²	123	81 Å²	81	54%	0.539	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-60.4	135.8	175.7	-63.8	-90.2	0	0	0	109.9	P171 V275	P171-F173 PolarHBondContact O-N 2.91Å; F173-V275 HydrophobicContact CE1-CB 4.31Å; F173-V275 HydrophobicContact CE1-CG2 3.68Å; F173-V275 HydrophobicContact CZ-CG2 4.09Å
174	S	35.8	Very low	45	Very low	39 Å²	39	85.4 Å²	85.4	27%	0.273	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-103.5	144	166.1	68	0	0	0	0	109.3	S176 E274	S174-S176 PolarHBondContact O-N 2.99Å; S174-E274 PolarHBondContact N-OE1 3.42Å; S174-E274 PolarHBondContact OG-OE1 3.17Å
175	N	30.3	Very low	43.4	Very low	143 Å²	143	88.8 Å²	88.8	77%	0.765	50%	0.502	S	S	*	.	S	Bend	trans	-79.1	7.2	176.5	-70.8	11.3	0	0	0	112.2
176	S	33.2	Very low	42.2	Very low	73 Å²	73	81.5 Å²	81.5	51%	0.51	47%	0.468	S	S	.	.			trans	-110.6	107.3	-175.3	47.1	0	0	0	0	112.1	S174 S178	S174-S176 PolarHBondContact O-N 2.99Å; S176-S178 VanDerWaalsContact C-N 3.31Å; S176-S178 PolarHBondContact O-N 2.91Å
177	V	34.3	Very low	41	Very low	73 Å²	73	77.3 Å²	77.3	44%	0.442	45%	0.445	S	S	.	.			trans	-66	93.2	165.7	-176.6	0	0	0	0	108.3	C179	V177-C179 PolarHBondContact O-N 3.32Å; V177-C179 PolarHBondContact O-SG 3Å; V177-C179 VanDerWaalsContact O-SG 3.36Å
178	S	36.7	Very low	40.2	Very low	17 Å²	17	83.5 Å²	83.5	12%	0.119	47%	0.469	C	S	.	.			trans	-73.1	96.6	-176.4	45.5	0	0	0	0	111.7	S176 N180 W195 Q219	S176-S178 VanDerWaalsContact C-N 3.31Å; S176-S178 PolarHBondContact O-N 2.91Å; S178-N180 PolarHBondContact O-N 2.78Å; S178-W195 VanDerWaalsContact OG-CZ2 3.24Å; S178-W195 WeakPolarHBondContact OG-CZ2 3.18Å; S178-Q219 PolarHBondContact O-NE2 3.38Å
179	C	37.2	Very low	39.8	Very low	60 Å²	60	83.4 Å²	83.4	41%	0.405	45%	0.454	S	S	.	.			trans	-82	37.6	-178	-66.3	0	0	0	0	113.7	V177 L181	V177-C179 PolarHBondContact O-N 3.32Å; V177-C179 PolarHBondContact O-SG 3Å; V177-C179 VanDerWaalsContact O-SG 3.36Å; C179-L181 PolarHBondContact O-N 2.62Å
180	N	41.1	Very low	39.6	Very low	48 Å²	48	80.9 Å²	80.9	26%	0.257	46%	0.46	S	S	.	.			trans	-66.5	78.9	177.2	-68.2	15.6	0	0	0	110.2	S178 Q219	S178-N180 PolarHBondContact O-N 2.78Å; N180-Q219 PolarHBondContact O-NE2 3.11Å; N180-Q219 VanDerWaalsContact O-NE2 3.1Å; N180-Q219 PolarHBondContact O-OE1 3.38Å
181	L	37.9	Very low	40	Very low	79 Å²	79	83.4 Å²	83.4	41%	0.414	47%	0.47	S	S	.	.			trans	-78.3	-21.1	-172.5	-88.3	166.8	0	0	0	113.6	C179 R220 L223	C179-L181 PolarHBondContact O-N 2.62Å; L181-R220 HydrophobicContact CD2-CG 3.95Å; L181-L223 HydrophobicContact CD1-CD1 3.81Å; L181-L223 HydrophobicContact CD2-CD1 3.7Å; L181-L223 HydrophobicContact CG-CD1 3.9Å
182	N	40	Very low	40.6	Very low	73 Å²	73	82.3 Å²	82.3	39%	0.39	46%	0.464	S	S	.	.	S	Bend	trans	-87.4	141.8	-177	-155.2	7.5	0	0	0	109.8	N184 D185	N182-N184 PolarHBondContact O-N 3.36Å; N182-D185 HydrophobicContact CB-CB 4.22Å; N182-D185 VanDerWaalsContact CB-OD1 3.3Å; N182-D185 WeakPolarHBondContact CB-OD1 3.22Å; N182-D185 WeakPolarHBondContact CB-OD2 3.23Å; N182-D185 PolarHBondContact ND2-OD1 3.03Å
183	S	39.1	Very low	41.6	Very low	68 Å²	68	74.8 Å²	74.8	48%	0.476	44%	0.436	S	S	.	.	S	Bend	trans	-69.8	-12.1	173.2	48.4	0	0	0	0	113.6
184	N	40.1	Very low	43	Very low	125 Å²	125	75.3 Å²	75.3	67%	0.668	44%	0.444	S	S	*	.	S	Bend	trans	-100.2	-24	-170.8	-55.9	5.3	0	0	0	111.9	N182 W186	N182-N184 PolarHBondContact O-N 3.36Å; N184-W186 PolarHBondContact O-N 3.18Å
185	D	43.4	Very low	44.3	Very low	82 Å²	82	75.1 Å²	75.1	44%	0.439	44%	0.437	S	S	.	.			trans	-74.4	-2.9	175.8	-47.9	-8.2	0	0	0	111.9	N182 A187	N182-D185 HydrophobicContact CB-CB 4.22Å; N182-D185 VanDerWaalsContact CB-OD1 3.3Å; N182-D185 WeakPolarHBondContact CB-OD1 3.22Å; N182-D185 WeakPolarHBondContact CB-OD2 3.23Å; N182-D185 PolarHBondContact ND2-OD1 3.03Å; D185-A187 PolarHBondContact O-N 3.07Å
186	W	46.9	Very low	46.1	Very low	3 Å²	3	68.4 Å²	68.4	1%	0.011	40%	0.401	C	S	.	.	S	Bend	trans	-69.8	71.3	166.4	-81.5	73.4	0	0	0	109.8	N184 F188 E196 R200 I212 H215	N184-W186 PolarHBondContact O-N 3.18Å; W186-F188 WeakPolarHBondContact O-CD2 3.46Å; W186-F188 WeakPolarHBondContact O-CE2 2.85Å; W186-F188 PolarHBondContact O-N 3.36Å; W186-E196 HydrophobicContact CD2-CG 4.49Å; W186-E196 HydrophobicContact CE3-CG 3.79Å; W186-E196 HydrophobicContact CH2-CG 4.04Å; W186-E196 HydrophobicContact CZ3-CG 3.51Å; W186-R200 VanDerWaalsContact CB-NH2 3.34Å; W186-R200 HydrophobicContact CZ3-CG 4.36Å; W186-R200 PolarHBondContact O-NH2 3.34Å; W186-I212 HydrophobicContact CD2-CD1 4.08Å; W186-I212 HydrophobicContact CD2-CG1 3.68Å; W186-I212 HydrophobicContact CD2-CG2 4.32Å; W186-I212 HydrophobicContact CE3-CD1 4.07Å; W186-I212 HydrophobicContact CE3-CG1 3.63Å; W186-I212 HydrophobicContact CG-CD1 4.3Å; W186-I212 HydrophobicContact CG-CG1 4.31Å; W186-I212 HydrophobicContact CG-CG2 4.45Å; W186-I212 HydrophobicContact CH2-CG1 4.02Å; W186-I212 HydrophobicContact CZ2-CB 4.3Å; W186-I212 HydrophobicContact CZ2-CG1 4.02Å; W186-I212 HydrophobicContact CZ2-CG2 4.35Å; W186-I212 HydrophobicContact CZ3-CG1 3.83Å; W186-H215 HydrophobicContact CH2-CB 4.28Å; W186-H215 HydrophobicContact CZ2-CB 3.89Å; W186-H215 AromaticContact CZ2-CG 3.92Å; W186-H215 AromaticContact CZ2-ND1 3.45Å; W186-H215 WeakPolarHBondContact CZ2-ND1 3.31Å
187	A	39.6	Very low	47.9	Very low	23 Å²	23	67.1 Å²	67.1	19%	0.19	39%	0.39	C	S	.	.			trans	-43.2	125.9	176.6	0	0	0	0	0	112.5	D185 D189 A192 R200	D185-A187 PolarHBondContact O-N 3.07Å; A187-D189 WeakPolarHBondContact CB-OD1 3.34Å; A187-A192 HydrophobicContact CB-CB 4.43Å; A187-R200 PolarHBondContact O-NH1 2.8Å; A187-R200 PolarHBondContact O-NH2 2.92Å
188	F	43.1	Very low	49.8	Very low	161 Å²	161	66.9 Å²	66.9	71%	0.706	39%	0.386	S	S	*	.	S	Bend	trans	-97.3	-17.7	174.3	-80.6	-96.4	0	0	0	111.8	W186 R200	W186-F188 WeakPolarHBondContact O-CD2 3.46Å; W186-F188 WeakPolarHBondContact O-CE2 2.85Å; W186-F188 PolarHBondContact O-N 3.36Å; F188-R200 VanDerWaalsContact CD1-NH1 3.29Å; F188-R200 VanDerWaalsContact CE1-NH1 3.35Å
189	D	43.6	Very low	51.9	Low	97 Å²	97	66.1 Å²	66.1	52%	0.519	38%	0.381	S	S	.	.	S	Bend	trans	-66.2	155.5	158.2	53.8	-60.7	0	0	0	111.6	A187 N191	A187-D189 WeakPolarHBondContact CB-OD1 3.34Å; D189-N191 PolarHBondContact O-N 3.15Å; D189-N191 PolarHBondContact OD2-ND2 2.9Å; D189-N191 VanDerWaalsContact OD2-ND2 3.1Å
190	G	46.7	Very low	53.7	Low	85 Å²	85	64.9 Å²	64.9	88%	0.876	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	12.1	-164.7	0	0	0	0	0	117.3
191	N	51.1	Low	55.6	Low	136 Å²	136	69 Å²	69	73%	0.727	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-3.7	-179.2	-61	-46.1	0	0	0	113.5	D189	D189-N191 PolarHBondContact O-N 3.15Å; D189-N191 PolarHBondContact OD2-ND2 2.9Å; D189-N191 VanDerWaalsContact OD2-ND2 3.1Å
192	A	55.5	Low	57.7	Low	13 Å²	13	67.5 Å²	67.5	11%	0.107	38%	0.381	C	S	.	.	S	Bend	trans	-59.8	137.8	176.9	0	0	0	0	0	111.8	A187	A187-A192 HydrophobicContact CB-CB 4.43Å
193	P	61	Low	59.8	Low	50 Å²	50	64.8 Å²	64.8	33%	0.325	37%	0.367	S	S	.	.			trans	-54.3	142	176.6	-26.9	35.1	0	0	0	112.3	W195 E196 T197	P193-W195 HydrophobicContact CB-CG 4.49Å; P193-W195 PolarHBondContact O-N 3.11Å; P193-E196 WeakPolarHBondContact O-CA 3.48Å; P193-E196 VanDerWaalsContact O-CB 3.31Å; P193-E196 WeakPolarHBondContact O-CB 3.25Å; P193-E196 PolarHBondContact O-N 3.12Å; P193-T197 PolarHBondContact O-N 2.88Å; P193-T197 VanDerWaalsContact O-N 3.11Å
194	L	66	Low	62	Low	134 Å²	134	67.6 Å²	67.6	70%	0.702	37%	0.371	S	S	*	.	H	α-helix	trans	-52.7	-37.4	-173.7	-178.4	64	0	0	0	113.7	E196 L198	L194-E196 VanDerWaalsContact C-N 3.32Å; L194-E196 PolarHBondContact O-N 3.02Å; L194-L198 HydrophobicContact CD1-CD1 4.42Å; L194-L198 HydrophobicContact CD1-CG 4.47Å; L194-L198 HydrophobicContact CG-CD1 4.08Å; L194-L198 WeakPolarHBondContact O-CB 3.39Å; L194-L198 WeakPolarHBondContact O-CD1 3.24Å; L194-L198 VanDerWaalsContact O-CG 3.22Å; L194-L198 WeakPolarHBondContact O-CG 2.96Å; L194-L198 PolarHBondContact O-N 3Å
195	W	64	Low	64	Low	35 Å²	35	73 Å²	73	13%	0.133	38%	0.382	C	S	.	.	H	α-helix	trans	-66.2	-33.2	176.9	67.1	-99.4	0	0	0	112.6	S178 P193 M199 H215	S178-W195 VanDerWaalsContact OG-CZ2 3.24Å; S178-W195 WeakPolarHBondContact OG-CZ2 3.18Å; P193-W195 HydrophobicContact CB-CG 4.49Å; P193-W195 PolarHBondContact O-N 3.11Å; W195-M199 HydrophobicContact CE3-CG 4.48Å; W195-M199 HydrophobicContact CE3-SD 3.69Å; W195-M199 HydrophobicContact CZ3-SD 3.68Å; W195-M199 WeakPolarHBondContact O-CB 3.34Å; W195-M199 WeakPolarHBondContact O-CG 3.24Å; W195-M199 PolarHBondContact O-N 3Å; W195-H215 AromaticContact CH2-CE1 3.67Å
196	E	66.8	Low	66	Low	2 Å²	2	74.4 Å²	74.4	1%	0.009	39%	0.394	C	S	.	.	H	α-helix	trans	-74.6	-41.8	179.5	-159.2	-159.6	109.9	0	0	110.6	W186 P193 L194 M199 R200	W186-E196 HydrophobicContact CD2-CG 4.49Å; W186-E196 HydrophobicContact CE3-CG 3.79Å; W186-E196 HydrophobicContact CH2-CG 4.04Å; W186-E196 HydrophobicContact CZ3-CG 3.51Å; P193-E196 WeakPolarHBondContact O-CA 3.48Å; P193-E196 VanDerWaalsContact O-CB 3.31Å; P193-E196 WeakPolarHBondContact O-CB 3.25Å; P193-E196 PolarHBondContact O-N 3.12Å; L194-E196 VanDerWaalsContact C-N 3.32Å; L194-E196 PolarHBondContact O-N 3.02Å; E196-M199 WeakPolarHBondContact O-CB 3.46Å; E196-M199 PolarHBondContact O-N 3.05Å; E196-R200 VanDerWaalsContact O-CG 3.31Å; E196-R200 WeakPolarHBondContact O-CG 3.31Å; E196-R200 PolarHBondContact O-N 3.33Å; E196-R200 IonicContact OE1-CZ 2.73Å; E196-R200 IonicContact OE1-NE 3.77Å; E196-R200 PolarHBondContact OE1-NE 3.08Å; E196-R200 IonicContact OE1-NH2 3.46Å; E196-R200 PolarHBondContact OE1-NH2 3.13Å
197	T	70.9	Confident	67.8	Low	45 Å²	45	74.4 Å²	74.4	28%	0.276	39%	0.394	S	S	.	.	H	α-helix	trans	-58.2	-50.6	171.6	-57.8	0	0	0	0	110.8	P193 M199 R200 E201	P193-T197 PolarHBondContact O-N 2.88Å; P193-T197 VanDerWaalsContact O-N 3.11Å; T197-M199 VanDerWaalsContact C-N 3.3Å; T197-M199 PolarHBondContact O-N 2.99Å; T197-R200 WeakPolarHBondContact O-CB 3.5Å; T197-R200 PolarHBondContact O-N 3.41Å; T197-R200 VanDerWaalsContact O-N 3.12Å; T197-E201 WeakPolarHBondContact O-CG 3.38Å; T197-E201 PolarHBondContact O-N 3.05Å
198	L	76.2	Confident	69.9	Low	69 Å²	69	74.2 Å²	74.2	36%	0.361	39%	0.39	S	S	.	.	H	α-helix	trans	-60.1	-37	174.8	-70.2	168.7	0	0	0	112.5	L194 S202	L194-L198 HydrophobicContact CD1-CD1 4.42Å; L194-L198 HydrophobicContact CD1-CG 4.47Å; L194-L198 HydrophobicContact CG-CD1 4.08Å; L194-L198 WeakPolarHBondContact O-CB 3.39Å; L194-L198 WeakPolarHBondContact O-CD1 3.24Å; L194-L198 VanDerWaalsContact O-CG 3.22Å; L194-L198 WeakPolarHBondContact O-CG 2.96Å; L194-L198 PolarHBondContact O-N 3Å; L198-S202 WeakPolarHBondContact O-CB 3.26Å; L198-S202 PolarHBondContact O-N 3.36Å; L198-S202 PolarHBondContact O-OG 3.03Å
199	M	79.2	Confident	71.9	Confident	0 Å²	0	71 Å²	71	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-60.9	-48	172.7	-86.5	-174.1	68	0	0	111.8	W195 E196 T197 S202 L211 S268 L269 H272 L273	W195-M199 HydrophobicContact CE3-CG 4.48Å; W195-M199 HydrophobicContact CE3-SD 3.69Å; W195-M199 HydrophobicContact CZ3-SD 3.68Å; W195-M199 WeakPolarHBondContact O-CB 3.34Å; W195-M199 WeakPolarHBondContact O-CG 3.24Å; W195-M199 PolarHBondContact O-N 3Å; E196-M199 WeakPolarHBondContact O-CB 3.46Å; E196-M199 PolarHBondContact O-N 3.05Å; T197-M199 VanDerWaalsContact C-N 3.3Å; T197-M199 PolarHBondContact O-N 2.99Å; M199-S202 PolarHBondContact O-N 3.16Å; M199-S202 PolarHBondContact O-OG 3.39Å; M199-L211 HydrophobicContact CB-CD2 4.18Å; M199-L211 HydrophobicContact CE-CD1 3.68Å; M199-L211 HydrophobicContact CE-CD2 4.46Å; M199-L211 HydrophobicContact CE-CG 4.11Å; M199-L211 VanDerWaalsContact O-CD2 3.3Å; M199-L211 WeakPolarHBondContact O-CD2 3.46Å; M199-S268 PolarHBondContact O-OG 3.36Å; M199-L269 HydrophobicContact CE-CD2 3.68Å; M199-L269 HydrophobicContact CE-CG 4.47Å; M199-H272 HydrophobicContact CG-CB 3.28Å; M199-H272 HydrophobicContact SD-CB 4.04Å; M199-L273 HydrophobicContact CE-CD2 4.35Å; M199-L273 HydrophobicContact SD-CD2 4.33Å
200	R	75.8	Confident	74	Confident	34 Å²	34	67 Å²	67	13%	0.128	36%	0.362	C	S	.	.	H	α-helix	trans	-61.2	-46.9	177.3	-66.5	159.9	176.9	-114.5	7.3	111.9	W186 A187 F188 E196 T197 S202 V203	W186-R200 VanDerWaalsContact CB-NH2 3.34Å; W186-R200 HydrophobicContact CZ3-CG 4.36Å; W186-R200 PolarHBondContact O-NH2 3.34Å; A187-R200 PolarHBondContact O-NH1 2.8Å; A187-R200 PolarHBondContact O-NH2 2.92Å; F188-R200 VanDerWaalsContact CD1-NH1 3.29Å; F188-R200 VanDerWaalsContact CE1-NH1 3.35Å; E196-R200 VanDerWaalsContact O-CG 3.31Å; E196-R200 WeakPolarHBondContact O-CG 3.31Å; E196-R200 PolarHBondContact O-N 3.33Å; E196-R200 IonicContact OE1-CZ 2.73Å; E196-R200 IonicContact OE1-NE 3.77Å; E196-R200 PolarHBondContact OE1-NE 3.08Å; E196-R200 IonicContact OE1-NH2 3.46Å; E196-R200 PolarHBondContact OE1-NH2 3.13Å; T197-R200 WeakPolarHBondContact O-CB 3.5Å; T197-R200 PolarHBondContact O-N 3.41Å; T197-R200 VanDerWaalsContact O-N 3.12Å; R200-S202 VanDerWaalsContact C-N 3.29Å; R200-S202 PolarHBondContact O-N 2.92Å; R200-V203 WeakPolarHBondContact O-CG2 3.32Å; R200-V203 PolarHBondContact O-N 3.36Å
201	E	81.6	Confident	76	Confident	136 Å²	136	62.9 Å²	62.9	64%	0.636	32%	0.32	S	S	*	.	H	α-helix	trans	-63.8	-31.6	-179.6	-71.2	173.9	167.2	0	0	113.1	T197 V203	T197-E201 WeakPolarHBondContact O-CG 3.38Å; T197-E201 PolarHBondContact O-N 3.05Å; E201-V203 PolarHBondContact O-N 3.49Å
202	S	80.7	Confident	77.6	Confident	46 Å²	46	57.4 Å²	57.4	32%	0.322	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-7.2	179.6	73.1	0	0	0	0	115.1	L198 M199 R200 S268	L198-S202 WeakPolarHBondContact O-CB 3.26Å; L198-S202 PolarHBondContact O-N 3.36Å; L198-S202 PolarHBondContact O-OG 3.03Å; M199-S202 PolarHBondContact O-N 3.16Å; M199-S202 PolarHBondContact O-OG 3.39Å; R200-S202 VanDerWaalsContact C-N 3.29Å; R200-S202 PolarHBondContact O-N 2.92Å; S202-S268 WeakPolarHBondContact OG-CB 3.32Å; S202-S268 PolarHBondContact OG-OG 3.18Å
203	V	84	Confident	79.2	Confident	16 Å²	16	61 Å²	61	10%	0.097	30%	0.304	C	S	.	.	S	Bend	trans	-125.6	165.7	-179	-56.5	0	0	0	0	112.4	R200 E201 D207 V208 L211 R264 V265	R200-V203 WeakPolarHBondContact O-CG2 3.32Å; R200-V203 PolarHBondContact O-N 3.36Å; E201-V203 PolarHBondContact O-N 3.49Å; V203-D207 HydrophobicContact CB-CB 4.23Å; V203-D207 HydrophobicContact CG2-CB 4.47Å; V203-V208 HydrophobicContact CG2-CG2 3.86Å; V203-L211 HydrophobicContact CG1-CD2 4.18Å; V203-L211 HydrophobicContact CG2-CD2 3.81Å; V203-R264 HydrophobicContact CG1-CB 4.36Å; V203-V265 HydrophobicContact CG1-CG2 4.27Å
204	K	86.1	Confident	80.6	Confident	128 Å²	128	58.7 Å²	58.7	56%	0.557	29%	0.289	S	S	*	.			trans	-74.7	151	171.9	-66.4	-167	171.9	-161.3	0	109.9	T206 D207 V208	K204-T206 PolarHBondContact O-N 3.19Å; K204-D207 WeakPolarHBondContact CB-OD2 3.35Å; K204-D207 PolarHBondContact N-OD2 3.12Å; K204-D207 WeakPolarHBondContact O-CA 3.38Å; K204-D207 WeakPolarHBondContact O-CB 3.43Å; K204-D207 PolarHBondContact O-N 3.37Å; K204-V208 PolarHBondContact O-N 2.9Å
205	R	82.7	Confident	81.7	Confident	239 Å²	239	52.4 Å²	52.4	90%	0.902	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-31.2	174.6	-167	172.7	-177.2	166.3	1.7	113.5	D207	R205-D207 VanDerWaalsContact C-N 3.29Å; R205-D207 PolarHBondContact O-N 2.83Å
206	T	83.8	Confident	82.7	Confident	111 Å²	111	51.5 Å²	51.5	68%	0.681	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-22.9	174.3	55	0	0	0	0	114.7	K204	K204-T206 PolarHBondContact O-N 3.19Å
207	D	86.3	Confident	83.8	Confident	3 Å²	3	52 Å²	52	2%	0.016	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-10.4	-173.1	-46.5	-34.4	0	0	0	112.3	V203 K204 R205 T209 L210 L211 S261 R264 V265	V203-D207 HydrophobicContact CB-CB 4.23Å; V203-D207 HydrophobicContact CG2-CB 4.47Å; K204-D207 WeakPolarHBondContact CB-OD2 3.35Å; K204-D207 PolarHBondContact N-OD2 3.12Å; K204-D207 WeakPolarHBondContact O-CA 3.38Å; K204-D207 WeakPolarHBondContact O-CB 3.43Å; K204-D207 PolarHBondContact O-N 3.37Å; R205-D207 VanDerWaalsContact C-N 3.29Å; R205-D207 PolarHBondContact O-N 2.83Å; D207-T209 VanDerWaalsContact C-N 3.27Å; D207-T209 PolarHBondContact O-N 3.4Å; D207-L210 WeakPolarHBondContact O-CA 3.5Å; D207-L210 WeakPolarHBondContact O-CB 3.31Å; D207-L210 PolarHBondContact O-N 2.87Å; D207-L211 PolarHBondContact O-N 2.95Å; D207-S261 WeakPolarHBondContact OD1-CB 3.46Å; D207-S261 PolarHBondContact OD1-OG 2.84Å; D207-R264 VanDerWaalsContact CG-NH2 3.33Å; D207-R264 IonicContact OD1-NH2 3.12Å; D207-R264 PolarHBondContact OD1-NH2 3.16Å; D207-R264 VanDerWaalsContact OD1-NH2 3.12Å; D207-R264 IonicContact OD2-CZ 3.13Å; D207-R264 IonicContact OD2-NE 2.68Å; D207-R264 PolarHBondContact OD2-NE 3.17Å; D207-R264 IonicContact OD2-NH2 2.74Å; D207-R264 PolarHBondContact OD2-NH2 3.39Å; D207-V265 HydrophobicContact CB-CG2 4.18Å
208	V	83.7	Confident	84.8	Confident	19 Å²	19	49.9 Å²	49.9	12%	0.115	24%	0.244	C	C	.	.	H	α-helix	trans	-56.8	-41	-179.5	176	0	0	0	0	111.1	V203 K204 L210 L211 I212	V203-V208 HydrophobicContact CG2-CG2 3.86Å; K204-V208 PolarHBondContact O-N 2.9Å; V208-L210 PolarHBondContact O-N 3.46Å; V208-L211 WeakPolarHBondContact O-CB 3.44Å; V208-L211 PolarHBondContact O-N 3.19Å; V208-I212 HydrophobicContact CG1-CD1 3.88Å; V208-I212 HydrophobicContact CG1-CG1 4.28Å; V208-I212 WeakPolarHBondContact O-CG1 3.41Å; V208-I212 PolarHBondContact O-N 3.2Å
209	T	84.9	Confident	85.1	Confident	93 Å²	93	47 Å²	47	57%	0.571	23%	0.228	S	C	*	.	H	α-helix	trans	-61.7	-30.4	176.1	-43.5	0	0	0	0	113	D207 K213	D207-T209 VanDerWaalsContact C-N 3.27Å; D207-T209 PolarHBondContact O-N 3.4Å; T209-K213 WeakPolarHBondContact O-CD 3.45Å; T209-K213 VanDerWaalsContact O-CG 3.24Å; T209-K213 WeakPolarHBondContact O-CG 3.48Å; T209-K213 PolarHBondContact O-N 2.92Å
210	L	87.7	Confident	85.3	Confident	12 Å²	12	54.2 Å²	54.2	6%	0.063	26%	0.256	C	S	.	.	H	α-helix	trans	-75.1	-43.1	172.1	178	65.3	0	0	0	110.7	D207 V208 I212 K213 C214 E252 C256 V262 V265	D207-L210 WeakPolarHBondContact O-CA 3.5Å; D207-L210 WeakPolarHBondContact O-CB 3.31Å; D207-L210 PolarHBondContact O-N 2.87Å; V208-L210 PolarHBondContact O-N 3.46Å; L210-I212 PolarHBondContact O-N 2.6Å; L210-K213 PolarHBondContact O-N 3.34Å; L210-C214 WeakPolarHBondContact O-CB 3.18Å; L210-C214 PolarHBondContact O-N 2.78Å; L210-C214 PolarHBondContact O-SG 3.16Å; L210-C214 VanDerWaalsContact O-SG 3.34Å; L210-E252 HydrophobicContact CD1-CB 4.18Å; L210-C256 VanDerWaalsContact CD1-SG 3.59Å; L210-C256 VanDerWaalsContact CD2-SG 3.5Å; L210-V262 HydrophobicContact CD2-CG2 4.29Å; L210-V265 HydrophobicContact CB-CG2 4.16Å; L210-V265 HydrophobicContact CD2-CB 4.06Å; L210-V265 HydrophobicContact CD2-CG1 4.38Å; L210-V265 HydrophobicContact CD2-CG2 3.81Å; L210-V265 HydrophobicContact CG-CB 4.38Å; L210-V265 HydrophobicContact CG-CG1 4.25Å; L210-V265 HydrophobicContact CG-CG2 4.02Å
211	L	88.5	Confident	85.9	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-56.4	-50.9	179.3	-173.8	61.9	0	0	0	111.7	M199 V203 D207 V208 K213 C214 H215 V265 L269	M199-L211 HydrophobicContact CB-CD2 4.18Å; M199-L211 HydrophobicContact CE-CD1 3.68Å; M199-L211 HydrophobicContact CE-CD2 4.46Å; M199-L211 HydrophobicContact CE-CG 4.11Å; M199-L211 VanDerWaalsContact O-CD2 3.3Å; M199-L211 WeakPolarHBondContact O-CD2 3.46Å; V203-L211 HydrophobicContact CG1-CD2 4.18Å; V203-L211 HydrophobicContact CG2-CD2 3.81Å; D207-L211 PolarHBondContact O-N 2.95Å; V208-L211 WeakPolarHBondContact O-CB 3.44Å; V208-L211 PolarHBondContact O-N 3.19Å; L211-K213 PolarHBondContact O-N 3.18Å; L211-C214 PolarHBondContact O-N 2.97Å; L211-H215 WeakPolarHBondContact O-CB 3.24Å; L211-H215 PolarHBondContact O-N 3.3Å; L211-V265 HydrophobicContact CB-CG1 4.48Å; L211-V265 HydrophobicContact CB-CG2 4.02Å; L211-V265 HydrophobicContact CD1-CB 4.44Å; L211-V265 HydrophobicContact CD1-CG1 3.89Å; L211-V265 HydrophobicContact CD1-CG2 4.36Å; L211-L269 HydrophobicContact CD1-CD2 4.22Å; L211-L269 HydrophobicContact CD1-CG 4.08Å
212	I	84.5	Confident	85.8	Confident	21 Å²	21	46.8 Å²	46.8	11%	0.108	22%	0.223	C	C	.	.	H	α-helix	trans	-56	-52.3	176.8	-65.5	172.3	0	0	0	110.2	W186 V208 L210 C214 H215 N216	W186-I212 HydrophobicContact CD2-CD1 4.08Å; W186-I212 HydrophobicContact CD2-CG1 3.68Å; W186-I212 HydrophobicContact CD2-CG2 4.32Å; W186-I212 HydrophobicContact CE3-CD1 4.07Å; W186-I212 HydrophobicContact CE3-CG1 3.63Å; W186-I212 HydrophobicContact CG-CD1 4.3Å; W186-I212 HydrophobicContact CG-CG1 4.31Å; W186-I212 HydrophobicContact CG-CG2 4.45Å; W186-I212 HydrophobicContact CH2-CG1 4.02Å; W186-I212 HydrophobicContact CZ2-CB 4.3Å; W186-I212 HydrophobicContact CZ2-CG1 4.02Å; W186-I212 HydrophobicContact CZ2-CG2 4.35Å; W186-I212 HydrophobicContact CZ3-CG1 3.83Å; V208-I212 HydrophobicContact CG1-CD1 3.88Å; V208-I212 HydrophobicContact CG1-CG1 4.28Å; V208-I212 WeakPolarHBondContact O-CG1 3.41Å; V208-I212 PolarHBondContact O-N 3.2Å; L210-I212 PolarHBondContact O-N 2.6Å; I212-C214 VanDerWaalsContact C-N 3.35Å; I212-C214 PolarHBondContact O-N 3.08Å; I212-H215 PolarHBondContact O-N 3.3Å; I212-H215 VanDerWaalsContact O-N 3.17Å; I212-N216 VanDerWaalsContact O-CG 3.24Å; I212-N216 PolarHBondContact O-N 2.91Å; I212-N216 PolarHBondContact O-OD1 2.92Å
213	K	88.5	Confident	85.4	Confident	89 Å²	89	46.9 Å²	46.9	39%	0.387	22%	0.22	S	C	.	.	H	α-helix	trans	-59	-43.1	179.2	-74.1	171.4	166	-167.6	0	113.1	T209 L210 L211 V217 E252	T209-K213 WeakPolarHBondContact O-CD 3.45Å; T209-K213 VanDerWaalsContact O-CG 3.24Å; T209-K213 WeakPolarHBondContact O-CG 3.48Å; T209-K213 PolarHBondContact O-N 2.92Å; L210-K213 PolarHBondContact O-N 3.34Å; L211-K213 PolarHBondContact O-N 3.18Å; K213-V217 WeakPolarHBondContact O-CG2 3.31Å; K213-V217 PolarHBondContact O-N 2.74Å; K213-E252 HydrophobicContact CB-CG 4.31Å; K213-E252 HydrophobicContact CD-CG 4.22Å; K213-E252 VanDerWaalsContact CD-OE2 3.32Å; K213-E252 WeakPolarHBondContact CD-OE2 3.33Å; K213-E252 WeakPolarHBondContact CE-OE2 3.37Å; K213-E252 IonicContact NZ-OE2 2.66Å; K213-E252 PolarHBondContact NZ-OE2 3.19Å
214	C	90.3	Very high	85	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.007	23%	0.229	C	C	.	.	H	α-helix	trans	-65.6	-40.6	177	-70.8	0	0	0	0	111.6	L210 L211 I212 V217 V218 M249 W253 V265 L269	L210-C214 WeakPolarHBondContact O-CB 3.18Å; L210-C214 PolarHBondContact O-N 2.78Å; L210-C214 PolarHBondContact O-SG 3.16Å; L210-C214 VanDerWaalsContact O-SG 3.34Å; L211-C214 PolarHBondContact O-N 2.97Å; I212-C214 VanDerWaalsContact C-N 3.35Å; I212-C214 PolarHBondContact O-N 3.08Å; C214-V217 PolarHBondContact O-N 2.99Å; C214-V218 PolarHBondContact O-N 2.83Å; C214-M249 HydrophobicContact CB-CE 4.23Å; C214-M249 HydrophobicContact CB-SD 3.77Å; C214-M249 WeakPolarHBondContact O-CE 3.48Å; C214-M249 PolarHBondContact SG-SD 3.24Å; C214-W253 PolarHBondContact SG-NE1 3.43Å; C214-W253 VanDerWaalsContact SG-NE1 3.38Å; C214-V265 HydrophobicContact CB-CG1 4.16Å; C214-L269 HydrophobicContact CB-CD1 3.78Å
215	H	89	Confident	84.4	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-63	-47.1	175.5	-172.6	-120	0	0	0	111.9	W186 W195 L211 I212 V217 V218 Q219	W186-H215 HydrophobicContact CH2-CB 4.28Å; W186-H215 HydrophobicContact CZ2-CB 3.89Å; W186-H215 AromaticContact CZ2-CG 3.92Å; W186-H215 AromaticContact CZ2-ND1 3.45Å; W186-H215 WeakPolarHBondContact CZ2-ND1 3.31Å; W195-H215 AromaticContact CH2-CE1 3.67Å; L211-H215 WeakPolarHBondContact O-CB 3.24Å; L211-H215 PolarHBondContact O-N 3.3Å; I212-H215 PolarHBondContact O-N 3.3Å; I212-H215 VanDerWaalsContact O-N 3.17Å; H215-V217 PolarHBondContact O-N 2.82Å; H215-V217 VanDerWaalsContact O-N 3.15Å; H215-V218 CarbonylContact O-C 3.53Å; H215-V218 WeakPolarHBondContact O-CA 3.37Å; H215-V218 WeakPolarHBondContact O-CB 3.34Å; H215-V218 PolarHBondContact O-N 2.91Å; H215-Q219 PolarHBondContact CE1-NE2 3.04Å; H215-Q219 PolarHBondContact CE1-OE1 2.82Å; H215-Q219 VanDerWaalsContact ND1-CD 3.32Å; H215-Q219 PolarHBondContact ND1-OE1 3.04Å; H215-Q219 VanDerWaalsContact ND1-OE1 3.14Å; H215-Q219 PolarHBondContact O-N 3.11Å
216	N	86.5	Confident	83.7	Confident	17 Å²	17	37 Å²	37	9%	0.091	19%	0.187	C	C	.	.	H	α-helix	trans	-61.8	-27.1	179.6	-64.9	20.1	0	0	0	112.2	I212 Q219 R220	I212-N216 VanDerWaalsContact O-CG 3.24Å; I212-N216 PolarHBondContact O-N 2.91Å; I212-N216 PolarHBondContact O-OD1 2.92Å; N216-Q219 PolarHBondContact OD1-OE1 3.07Å; N216-R220 VanDerWaalsContact O-CB 3.3Å; N216-R220 WeakPolarHBondContact O-CB 3.37Å; N216-R220 WeakPolarHBondContact O-CD 3.45Å; N216-R220 WeakPolarHBondContact O-CG 3.47Å; N216-R220 PolarHBondContact O-N 2.88Å; N216-R220 VanDerWaalsContact O-N 3.14Å
217	V	89.8	Confident	82.8	Confident	12 Å²	12	37 Å²	37	7%	0.073	19%	0.187	C	C	.	.	H	α-helix	trans	-72.1	-37.6	170.3	174.1	0	0	0	0	111.9	K213 C214 H215 Q221 S245 I248 M249 I284	K213-V217 WeakPolarHBondContact O-CG2 3.31Å; K213-V217 PolarHBondContact O-N 2.74Å; C214-V217 PolarHBondContact O-N 2.99Å; H215-V217 PolarHBondContact O-N 2.82Å; H215-V217 VanDerWaalsContact O-N 3.15Å; V217-Q221 PolarHBondContact O-N 2.84Å; V217-S245 WeakPolarHBondContact CG1-O 3.37Å; V217-I248 HydrophobicContact CG2-CB 4.29Å; V217-I248 HydrophobicContact CG2-CG2 3.6Å; V217-M249 HydrophobicContact CB-CE 4.09Å; V217-M249 HydrophobicContact CG1-CB 4.33Å; V217-M249 HydrophobicContact CG1-CE 3.99Å; V217-I284 HydrophobicContact CG1-CD1 4.47Å
218	V	90.2	Very high	81.7	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-67.2	-51	174.8	177.5	0	0	0	0	110.7	C214 H215 R220 Q221 V222 M249 Q277 T280 Y281 I284	C214-V218 PolarHBondContact O-N 2.83Å; H215-V218 CarbonylContact O-C 3.53Å; H215-V218 WeakPolarHBondContact O-CA 3.37Å; H215-V218 WeakPolarHBondContact O-CB 3.34Å; H215-V218 PolarHBondContact O-N 2.91Å; V218-R220 VanDerWaalsContact C-N 3.35Å; V218-R220 PolarHBondContact O-N 3.43Å; V218-Q221 CarbonylContact O-C 3.52Å; V218-Q221 WeakPolarHBondContact O-CA 3.22Å; V218-Q221 WeakPolarHBondContact O-CB 3.43Å; V218-Q221 PolarHBondContact O-N 3.11Å; V218-V222 HydrophobicContact CG1-CG2 4.4Å; V218-V222 WeakPolarHBondContact O-CG2 3.43Å; V218-V222 PolarHBondContact O-N 2.88Å; V218-M249 HydrophobicContact CG2-CE 4.03Å; V218-Q277 HydrophobicContact CG1-CB 4.05Å; V218-Q277 WeakPolarHBondContact CG1-O 3.22Å; V218-T280 HydrophobicContact CG1-CG2 4.47Å; V218-Y281 HydrophobicContact CG2-CD2 3.69Å; V218-Y281 HydrophobicContact CG2-CG 4.19Å; V218-I284 HydrophobicContact CG2-CD1 4.27Å
219	Q	83.2	Confident	80.5	Confident	8 Å²	8	36.9 Å²	36.9	4%	0.037	19%	0.188	C	C	.	.	H	α-helix	trans	-56.6	-45.7	177.4	-72.7	169.3	-58.9	0	0	112	S178 N180 H215 N216 Q221 V222 L223	S178-Q219 PolarHBondContact O-NE2 3.38Å; N180-Q219 PolarHBondContact O-NE2 3.11Å; N180-Q219 VanDerWaalsContact O-NE2 3.1Å; N180-Q219 PolarHBondContact O-OE1 3.38Å; H215-Q219 PolarHBondContact CE1-NE2 3.04Å; H215-Q219 PolarHBondContact CE1-OE1 2.82Å; H215-Q219 VanDerWaalsContact ND1-CD 3.32Å; H215-Q219 PolarHBondContact ND1-OE1 3.04Å; H215-Q219 VanDerWaalsContact ND1-OE1 3.14Å; H215-Q219 PolarHBondContact O-N 3.11Å; N216-Q219 PolarHBondContact OD1-OE1 3.07Å; Q219-Q221 VanDerWaalsContact C-N 3.25Å; Q219-Q221 PolarHBondContact O-N 2.96Å; Q219-V222 PolarHBondContact O-N 3.35Å; Q219-V222 VanDerWaalsContact O-N 3.14Å; Q219-L223 WeakPolarHBondContact O-CG 3.47Å; Q219-L223 PolarHBondContact O-N 2.99Å
220	R	83	Confident	78.8	Confident	153 Å²	153	39.3 Å²	39.3	58%	0.577	20%	0.197	S	C	*	.	H	α-helix	trans	-60.6	-34.2	176.1	-75.6	171.3	-177.1	-169.3	-1	112.5	L181 N216 V218 F224	L181-R220 HydrophobicContact CD2-CG 3.95Å; N216-R220 VanDerWaalsContact O-CB 3.3Å; N216-R220 WeakPolarHBondContact O-CB 3.37Å; N216-R220 WeakPolarHBondContact O-CD 3.45Å; N216-R220 WeakPolarHBondContact O-CG 3.47Å; N216-R220 PolarHBondContact O-N 2.88Å; N216-R220 VanDerWaalsContact O-N 3.14Å; V218-R220 VanDerWaalsContact C-N 3.35Å; V218-R220 PolarHBondContact O-N 3.43Å; R220-F224 WeakPolarHBondContact O-CB 3.41Å; R220-F224 PolarHBondContact O-N 2.75Å
221	Q	88	Confident	76.8	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.009	21%	0.209	C	C	.	.	H	α-helix	trans	-74.4	-37.8	173.8	-171.1	63.3	52.2	0	0	112.5	V217 V218 Q219 F224 N225 G241 L242 S245 T280 I284	V217-Q221 PolarHBondContact O-N 2.84Å; V218-Q221 CarbonylContact O-C 3.52Å; V218-Q221 WeakPolarHBondContact O-CA 3.22Å; V218-Q221 WeakPolarHBondContact O-CB 3.43Å; V218-Q221 PolarHBondContact O-N 3.11Å; Q219-Q221 VanDerWaalsContact C-N 3.25Å; Q219-Q221 PolarHBondContact O-N 2.96Å; Q221-F224 PolarHBondContact O-N 3.23Å; Q221-N225 PolarHBondContact NE2-OD1 3.19Å; Q221-N225 WeakPolarHBondContact O-CB 3.44Å; Q221-N225 PolarHBondContact O-N 2.94Å; Q221-N225 PolarHBondContact O-ND2 3.03Å; Q221-N225 PolarHBondContact O-OD1 3.25Å; Q221-N225 VanDerWaalsContact O-OD1 3.1Å; Q221-G241 PolarHBondContact OE1-O 3.34Å; Q221-L242 HydrophobicContact CG-CD2 3.87Å; Q221-S245 VanDerWaalsContact OE1-CB 3.29Å; Q221-S245 PolarHBondContact OE1-OG 3.44Å; Q221-T280 HydrophobicContact CB-CG2 3.68Å; Q221-T280 HydrophobicContact CG-CG2 3.5Å; Q221-T280 VanDerWaalsContact CG-CG2 3.5Å; Q221-I284 HydrophobicContact CB-CD1 3.9Å; Q221-I284 HydrophobicContact CG-CD1 4.13Å; Q221-I284 HydrophobicContact CG-CG1 4.36Å
222	V	80.6	Confident	74.5	Confident	11 Å²	11	44.7 Å²	44.7	7%	0.067	22%	0.223	C	C	.	.	H	α-helix	trans	-59.9	-50.1	174	172	0	0	0	0	110.1	V218 Q219 F224 N225 L226 T280	V218-V222 HydrophobicContact CG1-CG2 4.4Å; V218-V222 WeakPolarHBondContact O-CG2 3.43Å; V218-V222 PolarHBondContact O-N 2.88Å; Q219-V222 PolarHBondContact O-N 3.35Å; Q219-V222 VanDerWaalsContact O-N 3.14Å; V222-F224 PolarHBondContact O-N 3.48Å; V222-N225 WeakPolarHBondContact O-CB 3.27Å; V222-N225 PolarHBondContact O-N 3.41Å; V222-N225 VanDerWaalsContact O-N 3.12Å; V222-L226 HydrophobicContact CG1-CD1 4.33Å; V222-L226 WeakPolarHBondContact O-CG 3.5Å; V222-L226 PolarHBondContact O-N 2.85Å; V222-T280 HydrophobicContact CG2-CG2 3.95Å
223	L	73	Confident	72.9	Confident	49 Å²	49	44.1 Å²	44.1	26%	0.257	22%	0.22	S	C	.	.	H	α-helix	trans	-60.6	-43	176.1	-73.5	162.8	0	0	0	112.2	L181 Q219 N225 L226 V227	L181-L223 HydrophobicContact CD1-CD1 3.81Å; L181-L223 HydrophobicContact CD2-CD1 3.7Å; L181-L223 HydrophobicContact CG-CD1 3.9Å; Q219-L223 WeakPolarHBondContact O-CG 3.47Å; Q219-L223 PolarHBondContact O-N 2.99Å; L223-N225 VanDerWaalsContact C-N 3.32Å; L223-N225 PolarHBondContact O-N 2.9Å; L223-L226 PolarHBondContact O-N 2.77Å; L223-V227 WeakPolarHBondContact O-CG2 3.47Å; L223-V227 PolarHBondContact O-N 3.35Å
224	F	75.3	Confident	71.5	Confident	67 Å²	67	42 Å²	42	29%	0.294	21%	0.209	S	C	.	.	H	α-helix	trans	-62.1	-38.4	173.9	-178.6	-84.8	0	0	0	112.3	R220 Q221 V222 L226 V227 A228 L237	R220-F224 WeakPolarHBondContact O-CB 3.41Å; R220-F224 PolarHBondContact O-N 2.75Å; Q221-F224 PolarHBondContact O-N 3.23Å; V222-F224 PolarHBondContact O-N 3.48Å; F224-L226 VanDerWaalsContact C-N 3.32Å; F224-L226 PolarHBondContact O-N 2.75Å; F224-V227 PolarHBondContact O-N 2.95Å; F224-A228 HydrophobicContact CE1-CB 4.23Å; F224-A228 WeakPolarHBondContact O-CB 3.15Å; F224-A228 PolarHBondContact O-N 2.85Å; F224-L237 HydrophobicContact CE1-CB 4.41Å; F224-L237 WeakPolarHBondContact CE1-O 3.4Å; F224-L237 HydrophobicContact CE2-CD2 4.47Å; F224-L237 HydrophobicContact CZ-CB 4.12Å; F224-L237 HydrophobicContact CZ-CD2 3.9Å; F224-L237 WeakPolarHBondContact CZ-O 3.48Å
225	N	73	Confident	70.2	Confident	27 Å²	27	43 Å²	43	14%	0.144	22%	0.215	C	C	.	.	H	α-helix	trans	-64.7	-36.9	176.5	-65.6	-13.1	0	0	0	111.9	Q221 V222 L223 A229 L238	Q221-N225 PolarHBondContact NE2-OD1 3.19Å; Q221-N225 WeakPolarHBondContact O-CB 3.44Å; Q221-N225 PolarHBondContact O-N 2.94Å; Q221-N225 PolarHBondContact O-ND2 3.03Å; Q221-N225 PolarHBondContact O-OD1 3.25Å; Q221-N225 VanDerWaalsContact O-OD1 3.1Å; V222-N225 WeakPolarHBondContact O-CB 3.27Å; V222-N225 PolarHBondContact O-N 3.41Å; V222-N225 VanDerWaalsContact O-N 3.12Å; L223-N225 VanDerWaalsContact C-N 3.32Å; L223-N225 PolarHBondContact O-N 2.9Å; N225-A229 PolarHBondContact O-N 3.22Å; N225-L238 HydrophobicContact CB-CD2 3.99Å; N225-L238 VanDerWaalsContact OD1-CD2 3.24Å; N225-L238 WeakPolarHBondContact OD1-CD2 3.3Å
226	L	67.6	Low	68.7	Low	80 Å²	80	44.6 Å²	44.6	42%	0.419	22%	0.223	S	C	.	.	H	α-helix	trans	-68.7	-49.8	175.6	-67.7	169.3	0	0	0	111.2	V222 L223 F224 A228 A229	V222-L226 HydrophobicContact CG1-CD1 4.33Å; V222-L226 WeakPolarHBondContact O-CG 3.5Å; V222-L226 PolarHBondContact O-N 2.85Å; L223-L226 PolarHBondContact O-N 2.77Å; F224-L226 VanDerWaalsContact C-N 3.32Å; F224-L226 PolarHBondContact O-N 2.75Å; L226-A228 VanDerWaalsContact C-N 3.34Å; L226-A228 PolarHBondContact O-N 2.92Å; L226-A229 WeakPolarHBondContact O-CB 3.28Å; L226-A229 PolarHBondContact O-N 2.93Å; L226-A229 VanDerWaalsContact O-N 3.09Å
227	V	64.4	Low	67.6	Low	112 Å²	112	44.9 Å²	44.9	68%	0.679	23%	0.225	S	C	*	.	H	α-helix	trans	-61.2	-41.8	177.1	172.9	0	0	0	0	111.5	L223 F224 A229 T231	L223-V227 WeakPolarHBondContact O-CG2 3.47Å; L223-V227 PolarHBondContact O-N 3.35Å; F224-V227 PolarHBondContact O-N 2.95Å; V227-A229 PolarHBondContact O-N 3.35Å; V227-T231 WeakPolarHBondContact O-CG2 3.38Å
228	A	63.2	Low	66.9	Low	3 Å²	3	44.4 Å²	44.4	3%	0.025	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-69.6	-12.7	177.7	0	0	0	0	0	113.7	F224 L226 N230 T231 R234 L237 L238	F224-A228 HydrophobicContact CE1-CB 4.23Å; F224-A228 WeakPolarHBondContact O-CB 3.15Å; F224-A228 PolarHBondContact O-N 2.85Å; L226-A228 VanDerWaalsContact C-N 3.34Å; L226-A228 PolarHBondContact O-N 2.92Å; A228-N230 VanDerWaalsContact C-N 3.26Å; A228-N230 PolarHBondContact O-N 3.24Å; A228-T231 WeakPolarHBondContact CA-OG1 3.35Å; A228-T231 PolarHBondContact O-N 3.1Å; A228-T231 VanDerWaalsContact O-N 3.13Å; A228-T231 PolarHBondContact O-OG1 2.72Å; A228-R234 WeakPolarHBondContact O-CG 3.43Å; A228-L237 HydrophobicContact CB-CB 4.4Å; A228-L238 HydrophobicContact CB-CD2 4.16Å; A228-L238 HydrophobicContact CB-CG 4.46Å
229	A	59.5	Low	66.3	Low	16 Å²	16	44.5 Å²	44.5	13%	0.132	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-60.6	-32.9	-171.1	0	0	0	0	0	114.4	N110 N225 L226 V227 R234	N110-A229 VanDerWaalsContact OD1-CB 3.3Å; N110-A229 WeakPolarHBondContact OD1-CB 3.44Å; N225-A229 PolarHBondContact O-N 3.22Å; L226-A229 WeakPolarHBondContact O-CB 3.28Å; L226-A229 PolarHBondContact O-N 2.93Å; L226-A229 VanDerWaalsContact O-N 3.09Å; V227-A229 PolarHBondContact O-N 3.35Å; A229-R234 WeakPolarHBondContact O-CD 3.39Å
230	N	48.8	Very low	65.7	Low	144 Å²	144	47.3 Å²	47.3	77%	0.77	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-106.6	16.1	-178.6	-59.9	-9.3	0	0	0	112.3	N110 A228	N110-N230 PolarHBondContact ND2-OD1 3.15Å; A228-N230 VanDerWaalsContact C-N 3.26Å; A228-N230 PolarHBondContact O-N 3.24Å
231	T	46.1	Very low	65.6	Low	50 Å²	50	40.3 Å²	40.3	31%	0.307	21%	0.211	S	C	.	.	S	Bend	trans	-96.1	147	-175.1	61.7	0	0	0	0	113.4	V227 A228 R234 L237	V227-T231 WeakPolarHBondContact O-CG2 3.38Å; A228-T231 WeakPolarHBondContact CA-OG1 3.35Å; A228-T231 PolarHBondContact O-N 3.1Å; A228-T231 VanDerWaalsContact O-N 3.13Å; A228-T231 PolarHBondContact O-OG1 2.72Å; T231-R234 WeakPolarHBondContact O-CB 3.43Å; T231-R234 PolarHBondContact O-N 3.43Å; T231-L237 HydrophobicContact CG2-CD1 4.31Å; T231-L237 VanDerWaalsContact OG1-CD1 3.22Å; T231-L237 WeakPolarHBondContact OG1-CD1 3.34Å
232	Y	40.7	Very low	65.5	Low	76 Å²	76	40.2 Å²	40.2	30%	0.298	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	142.1	169.2	-173.3	-109.6	0	0	0	110.7	R234 C333	Y232-R234 PolarHBondContact O-N 2.83Å; Y232-C333 HydrophobicContact CE2-CB 4.41Å; Y232-C333 WeakPolarHBondContact OH-CB 3.27Å
233	N	49.9	Very low	65.6	Low	8 Å²	8	43.4 Å²	43.4	4%	0.043	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	33.7	-169.8	-84.5	-47.5	0	0	0	114	D235 L236 L237 C333 N544	N233-D235 PolarHBondContact O-N 2.85Å; N233-L236 HydrophobicContact CB-CB 4.27Å; N233-L236 WeakPolarHBondContact O-CB 3.49Å; N233-L236 PolarHBondContact O-N 2.96Å; N233-L237 PolarHBondContact O-N 2.87Å; N233-L237 VanDerWaalsContact O-N 3.1Å; N233-C333 VanDerWaalsContact OD1-CB 3.32Å; N233-C333 WeakPolarHBondContact OD1-CB 3.41Å; N233-C333 PolarHBondContact OD1-N 3.32Å; N233-C333 PolarHBondContact OD1-SG 2.94Å; N233-C333 VanDerWaalsContact OD1-SG 3.36Å; N233-N544 HydrophobicContact CB-CB 4.35Å; N233-N544 PolarHBondContact ND2-O 3.09Å
234	R	58.4	Low	66.1	Low	44 Å²	44	48 Å²	48	17%	0.166	24%	0.242	C	C	.	.	H	α-helix	trans	-35.9	-48.3	172.6	172	174.1	-178.4	-108.6	0.9	113.7	A228 A229 T231 Y232 L236 L237 L238	A228-R234 WeakPolarHBondContact O-CG 3.43Å; A229-R234 WeakPolarHBondContact O-CD 3.39Å; T231-R234 WeakPolarHBondContact O-CB 3.43Å; T231-R234 PolarHBondContact O-N 3.43Å; Y232-R234 PolarHBondContact O-N 2.83Å; R234-L236 PolarHBondContact O-N 3.13Å; R234-L237 WeakPolarHBondContact O-CB 3.48Å; R234-L237 PolarHBondContact O-N 2.95Å; R234-L238 HydrophobicContact CG-CD1 3.71Å; R234-L238 HydrophobicContact CG-CG 4.1Å; R234-L238 WeakPolarHBondContact O-CB 3.44Å; R234-L238 VanDerWaalsContact O-CG 3.25Å; R234-L238 WeakPolarHBondContact O-CG 3.49Å; R234-L238 PolarHBondContact O-N 3.15Å
235	D	63.1	Low	66.8	Low	24 Å²	24	45.4 Å²	45.4	13%	0.128	23%	0.232	C	C	.	.	H	α-helix	trans	-67.9	-36.1	-176.1	-71.4	12.1	0	0	0	113	L149 N150 N233 L239	L149-D235 HydrophobicContact CD2-CB 3.81Å; L149-D235 WeakPolarHBondContact CD2-O 3.17Å; N150-D235 PolarHBondContact ND2-OD2 3.41Å; N233-D235 PolarHBondContact O-N 2.85Å; D235-L239 VanDerWaalsContact O-CB 3.27Å; D235-L239 WeakPolarHBondContact O-CB 3.48Å; D235-L239 PolarHBondContact O-N 3.3Å
236	L	59.3	Low	67.5	Low	33 Å²	33	44.3 Å²	44.3	17%	0.173	23%	0.226	C	C	.	.	H	α-helix	trans	-66.6	-43.2	172.4	-178.8	62.9	0	0	0	110.7	N233 R234 L239 E240 P330	N233-L236 HydrophobicContact CB-CB 4.27Å; N233-L236 WeakPolarHBondContact O-CB 3.49Å; N233-L236 PolarHBondContact O-N 2.96Å; R234-L236 PolarHBondContact O-N 3.13Å; L236-L239 PolarHBondContact O-N 2.95Å; L236-E240 PolarHBondContact O-N 2.99Å; L236-P330 HydrophobicContact CD1-CB 3.85Å; L236-P330 HydrophobicContact CD1-CG 4.32Å
237	L	62.9	Low	68.3	Low	23 Å²	23	49.4 Å²	49.4	12%	0.12	24%	0.24	C	C	.	.	H	α-helix	trans	-60.2	-52.9	175.5	-88.5	165.8	0	0	0	111.6	F224 A228 T231 N233 R234 L239 E240 G241 N544	F224-L237 HydrophobicContact CE1-CB 4.41Å; F224-L237 WeakPolarHBondContact CE1-O 3.4Å; F224-L237 HydrophobicContact CE2-CD2 4.47Å; F224-L237 HydrophobicContact CZ-CB 4.12Å; F224-L237 HydrophobicContact CZ-CD2 3.9Å; F224-L237 WeakPolarHBondContact CZ-O 3.48Å; A228-L237 HydrophobicContact CB-CB 4.4Å; T231-L237 HydrophobicContact CG2-CD1 4.31Å; T231-L237 VanDerWaalsContact OG1-CD1 3.22Å; T231-L237 WeakPolarHBondContact OG1-CD1 3.34Å; N233-L237 PolarHBondContact O-N 2.87Å; N233-L237 VanDerWaalsContact O-N 3.1Å; R234-L237 WeakPolarHBondContact O-CB 3.48Å; R234-L237 PolarHBondContact O-N 2.95Å; L237-L239 VanDerWaalsContact C-N 3.26Å; L237-L239 PolarHBondContact O-N 2.76Å; L237-E240 PolarHBondContact O-N 3.03Å; L237-G241 PolarHBondContact O-N 3.46Å; L237-N544 WeakPolarHBondContact CD1-OD1 3.43Å; L237-N544 VanDerWaalsContact CD2-OD1 3.28Å; L237-N544 WeakPolarHBondContact CD2-OD1 3.41Å; L237-N544 VanDerWaalsContact CG-OD1 3.28Å; L237-N544 WeakPolarHBondContact CG-OD1 3.31Å
238	L	74.7	Confident	69.4	Low	3 Å²	3	47.3 Å²	47.3	2%	0.016	22%	0.224	C	C	.	.	H	α-helix	trans	-53.9	-43.1	175.2	-72.4	176	0	0	0	111.2	L149 L153 N225 A228 R234 L242	L149-L238 HydrophobicContact CD2-CB 4.02Å; L153-L238 HydrophobicContact CD1-CD1 4.12Å; N225-L238 HydrophobicContact CB-CD2 3.99Å; N225-L238 VanDerWaalsContact OD1-CD2 3.24Å; N225-L238 WeakPolarHBondContact OD1-CD2 3.3Å; A228-L238 HydrophobicContact CB-CD2 4.16Å; A228-L238 HydrophobicContact CB-CG 4.46Å; R234-L238 HydrophobicContact CG-CD1 3.71Å; R234-L238 HydrophobicContact CG-CG 4.1Å; R234-L238 WeakPolarHBondContact O-CB 3.44Å; R234-L238 VanDerWaalsContact O-CG 3.25Å; R234-L238 WeakPolarHBondContact O-CG 3.49Å; R234-L238 PolarHBondContact O-N 3.15Å; L238-L242 VanDerWaalsContact O-CB 3.31Å; L238-L242 WeakPolarHBondContact O-CB 3.42Å; L238-L242 WeakPolarHBondContact O-CD1 3.29Å; L238-L242 WeakPolarHBondContact O-CG 3.47Å; L238-L242 PolarHBondContact O-N 3.3Å
239	L	77.2	Confident	70.6	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-65	-45.8	177.5	-179.5	61.2	0	0	0	112.9	L149 D235 L236 L237 L242 K243 M287 V328 P330	L149-L239 HydrophobicContact CD1-CD1 4.32Å; L149-L239 HydrophobicContact CD2-CB 4.27Å; D235-L239 VanDerWaalsContact O-CB 3.27Å; D235-L239 WeakPolarHBondContact O-CB 3.48Å; D235-L239 PolarHBondContact O-N 3.3Å; L236-L239 PolarHBondContact O-N 2.95Å; L237-L239 VanDerWaalsContact C-N 3.26Å; L237-L239 PolarHBondContact O-N 2.76Å; L239-L242 PolarHBondContact O-N 2.89Å; L239-K243 HydrophobicContact CG-CD 4.27Å; L239-K243 WeakPolarHBondContact O-CB 3.44Å; L239-K243 VanDerWaalsContact O-CG 3.27Å; L239-K243 WeakPolarHBondContact O-CG 3.46Å; L239-K243 PolarHBondContact O-N 3.42Å; L239-M287 HydrophobicContact CD1-CE 3.51Å; L239-M287 HydrophobicContact CD1-SD 4.26Å; L239-V328 HydrophobicContact CD1-CG1 3.54Å; L239-V328 HydrophobicContact CD2-CG1 4.5Å; L239-P330 HydrophobicContact CD2-CB 3.69Å; L239-P330 HydrophobicContact CD2-CG 3.98Å
240	E	72	Confident	71.8	Confident	66 Å²	66	51.4 Å²	51.4	31%	0.308	24%	0.235	S	C	.	.	H	α-helix	trans	-69.8	-37.2	178.1	-68.4	-50.1	138.9	0	0	112.5	L236 L237 K243 K244 F541	L236-E240 PolarHBondContact O-N 2.99Å; L237-E240 PolarHBondContact O-N 3.03Å; E240-K243 PolarHBondContact O-N 3.19Å; E240-K243 WeakPolarHBondContact OE1-CD 3.24Å; E240-K243 IonicContact OE1-NZ 3.21Å; E240-K243 PolarHBondContact OE1-NZ 3.1Å; E240-K243 VanDerWaalsContact OE2-CD 3.23Å; E240-K243 WeakPolarHBondContact OE2-CD 3.32Å; E240-K243 IonicContact OE2-NZ 2.66Å; E240-K244 VanDerWaalsContact O-CB 3.29Å; E240-K244 WeakPolarHBondContact O-CB 3.48Å; E240-K244 PolarHBondContact O-N 2.88Å; E240-F541 HydrophobicContact CB-CE2 4.35Å
241	G	80	Confident	73.4	Confident	6 Å²	6	48.7 Å²	48.7	6%	0.062	22%	0.22	C	C	.	.	H	α-helix	trans	-55.5	-54.6	168.9	0	0	0	0	0	111	Q221 L237 K243 K244 S245	Q221-G241 PolarHBondContact OE1-O 3.34Å; L237-G241 PolarHBondContact O-N 3.46Å; G241-K243 VanDerWaalsContact C-N 3.35Å; G241-K243 PolarHBondContact O-N 3.37Å; G241-K244 WeakPolarHBondContact O-CB 3.35Å; G241-K244 PolarHBondContact O-N 3.5Å; G241-K244 VanDerWaalsContact O-N 3.09Å; G241-S245 WeakPolarHBondContact O-CB 3.3Å; G241-S245 PolarHBondContact O-N 3.36Å; G241-S245 PolarHBondContact O-OG 2.99Å
242	L	86.7	Confident	75.2	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-61	-38.4	178.6	-74.4	166.3	0	0	0	112.9	L149 M152 L153 Q221 L238 L239 A246 A283 I284 M287	L149-L242 HydrophobicContact CD1-CD1 4.2Å; M152-L242 HydrophobicContact CE-CD1 3.87Å; L153-L242 HydrophobicContact CD2-CD1 4.18Å; Q221-L242 HydrophobicContact CG-CD2 3.87Å; L238-L242 VanDerWaalsContact O-CB 3.31Å; L238-L242 WeakPolarHBondContact O-CB 3.42Å; L238-L242 WeakPolarHBondContact O-CD1 3.29Å; L238-L242 WeakPolarHBondContact O-CG 3.47Å; L238-L242 PolarHBondContact O-N 3.3Å; L239-L242 PolarHBondContact O-N 2.89Å; L242-A246 WeakPolarHBondContact O-CB 3.36Å; L242-A246 PolarHBondContact O-N 3.31Å; L242-A283 HydrophobicContact CD1-CB 4.44Å; L242-A283 HydrophobicContact CD2-CB 3.85Å; L242-I284 HydrophobicContact CD2-CG1 3.97Å; L242-M287 HydrophobicContact CB-CG 4.17Å
243	K	81.5	Confident	77.3	Confident	78 Å²	78	44.6 Å²	44.6	34%	0.339	20%	0.2	S	C	.	.	H	α-helix	trans	-61	-46.2	172	-75.9	165.8	178.7	172.7	0	111.6	L239 E240 G241 R247 M287	L239-K243 HydrophobicContact CG-CD 4.27Å; L239-K243 WeakPolarHBondContact O-CB 3.44Å; L239-K243 VanDerWaalsContact O-CG 3.27Å; L239-K243 WeakPolarHBondContact O-CG 3.46Å; L239-K243 PolarHBondContact O-N 3.42Å; E240-K243 PolarHBondContact O-N 3.19Å; E240-K243 WeakPolarHBondContact OE1-CD 3.24Å; E240-K243 IonicContact OE1-NZ 3.21Å; E240-K243 PolarHBondContact OE1-NZ 3.1Å; E240-K243 VanDerWaalsContact OE2-CD 3.23Å; E240-K243 WeakPolarHBondContact OE2-CD 3.32Å; E240-K243 IonicContact OE2-NZ 2.66Å; G241-K243 VanDerWaalsContact C-N 3.35Å; G241-K243 PolarHBondContact O-N 3.37Å; K243-R247 WeakPolarHBondContact O-CB 3.47Å; K243-R247 PolarHBondContact O-N 3.02Å; K243-M287 HydrophobicContact CG-CE 3.48Å; K243-M287 VanDerWaalsContact CG-CE 3.48Å
244	K	84.7	Confident	78.5	Confident	146 Å²	146	49.5 Å²	49.5	64%	0.635	23%	0.226	S	C	*	.	H	α-helix	trans	-63.9	-48.3	179.7	-173.8	177.7	179.9	-179.2	0	110.8	E240 G241 R247 I248	E240-K244 VanDerWaalsContact O-CB 3.29Å; E240-K244 WeakPolarHBondContact O-CB 3.48Å; E240-K244 PolarHBondContact O-N 2.88Å; G241-K244 WeakPolarHBondContact O-CB 3.35Å; G241-K244 PolarHBondContact O-N 3.5Å; G241-K244 VanDerWaalsContact O-N 3.09Å; K244-R247 WeakPolarHBondContact O-CB 3.23Å; K244-R247 PolarHBondContact O-N 3.26Å; K244-I248 HydrophobicContact CG-CD1 4.16Å; K244-I248 WeakPolarHBondContact O-CG1 3.43Å; K244-I248 PolarHBondContact O-N 3.06Å
245	S	89.6	Confident	79.4	Confident	12 Å²	12	53.6 Å²	53.6	8%	0.084	25%	0.245	C	C	.	.	H	α-helix	trans	-64.9	-41.2	177.5	-62.2	0	0	0	0	112.4	V217 Q221 G241 R247 I248 M249	V217-S245 WeakPolarHBondContact CG1-O 3.37Å; Q221-S245 VanDerWaalsContact OE1-CB 3.29Å; Q221-S245 PolarHBondContact OE1-OG 3.44Å; G241-S245 WeakPolarHBondContact O-CB 3.3Å; G241-S245 PolarHBondContact O-N 3.36Å; G241-S245 PolarHBondContact O-OG 2.99Å; S245-R247 VanDerWaalsContact C-N 3.34Å; S245-R247 PolarHBondContact O-N 3.22Å; S245-I248 PolarHBondContact O-N 3.44Å; S245-M249 VanDerWaalsContact O-CB 3.31Å; S245-M249 WeakPolarHBondContact O-CB 3.42Å; S245-M249 PolarHBondContact O-N 3.27Å
246	A	87.6	Confident	79.8	Confident	3 Å²	3	54.3 Å²	54.3	3%	0.025	25%	0.252	C	S	.	.	H	α-helix	trans	-62	-38.2	172.2	0	0	0	0	0	112.7	L242 R250 I284 M287 M288	L242-A246 WeakPolarHBondContact O-CB 3.36Å; L242-A246 PolarHBondContact O-N 3.31Å; A246-R250 VanDerWaalsContact O-CB 3.26Å; A246-R250 WeakPolarHBondContact O-CB 3.42Å; A246-R250 PolarHBondContact O-N 3.5Å; A246-I284 HydrophobicContact CB-CG2 4.32Å; A246-M287 HydrophobicContact CB-CB 3.82Å; A246-M288 HydrophobicContact CB-CG 3.79Å
247	R	83.5	Confident	79.6	Confident	188 Å²	188	61.7 Å²	61.7	71%	0.709	29%	0.29	S	S	*	.	H	α-helix	trans	-66.5	-41.1	174.4	-173.7	176.9	179.8	177.9	-0.5	112.1	K243 K244 S245 L251	K243-R247 WeakPolarHBondContact O-CB 3.47Å; K243-R247 PolarHBondContact O-N 3.02Å; K244-R247 WeakPolarHBondContact O-CB 3.23Å; K244-R247 PolarHBondContact O-N 3.26Å; S245-R247 VanDerWaalsContact C-N 3.34Å; S245-R247 PolarHBondContact O-N 3.22Å; R247-L251 HydrophobicContact CG-CD1 4.24Å; R247-L251 VanDerWaalsContact O-CG 3.29Å; R247-L251 WeakPolarHBondContact O-CG 3.31Å; R247-L251 PolarHBondContact O-N 3.46Å
248	I	87.8	Confident	79.9	Confident	68 Å²	68	62.8 Å²	62.8	35%	0.349	30%	0.3	S	S	.	.	H	α-helix	trans	-69.5	-46.9	178.3	-62.2	162.2	0	0	0	110.7	V217 K244 S245 R250 L251 E252	V217-I248 HydrophobicContact CG2-CB 4.29Å; V217-I248 HydrophobicContact CG2-CG2 3.6Å; K244-I248 HydrophobicContact CG-CD1 4.16Å; K244-I248 WeakPolarHBondContact O-CG1 3.43Å; K244-I248 PolarHBondContact O-N 3.06Å; S245-I248 PolarHBondContact O-N 3.44Å; I248-R250 VanDerWaalsContact C-N 3.26Å; I248-R250 PolarHBondContact O-N 3.45Å; I248-L251 PolarHBondContact O-N 2.9Å; I248-L251 VanDerWaalsContact O-N 3.07Å; I248-E252 PolarHBondContact O-N 3.15Å
249	M	89.1	Confident	79.7	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-52.8	-46	174.4	-175.5	69.7	71.1	0	0	111.1	C214 V217 V218 S245 E252 W253 Y281 I284 M288	C214-M249 HydrophobicContact CB-CE 4.23Å; C214-M249 HydrophobicContact CB-SD 3.77Å; C214-M249 WeakPolarHBondContact O-CE 3.48Å; C214-M249 PolarHBondContact SG-SD 3.24Å; V217-M249 HydrophobicContact CB-CE 4.09Å; V217-M249 HydrophobicContact CG1-CB 4.33Å; V217-M249 HydrophobicContact CG1-CE 3.99Å; V218-M249 HydrophobicContact CG2-CE 4.03Å; S245-M249 VanDerWaalsContact O-CB 3.31Å; S245-M249 WeakPolarHBondContact O-CB 3.42Å; S245-M249 PolarHBondContact O-N 3.27Å; M249-E252 PolarHBondContact O-N 3.04Å; M249-W253 HydrophobicContact CG-CZ2 4.41Å; M249-W253 PolarHBondContact O-N 3.39Å; M249-W253 VanDerWaalsContact O-N 3.11Å; M249-W253 HydrophobicContact SD-CZ2 4.46Å; M249-Y281 HydrophobicContact CE-CD2 3.96Å; M249-Y281 HydrophobicContact CE-CE2 3.86Å; M249-Y281 HydrophobicContact SD-CE2 4.33Å; M249-I284 HydrophobicContact CB-CG2 3.98Å; M249-I284 HydrophobicContact CE-CG2 4.19Å; M249-I284 HydrophobicContact CG-CG2 4.18Å; M249-M288 HydrophobicContact CB-SD 4.17Å; M249-M288 HydrophobicContact CG-CE 4.2Å; M249-M288 HydrophobicContact CG-SD 3.74Å
250	R	83.8	Confident	79.7	Confident	105 Å²	105	68.4 Å²	68.4	40%	0.396	34%	0.336	S	S	.	.	H	α-helix	trans	-61.3	-45.1	175.9	-170.2	169.4	-176.5	141.2	4.7	112.8	A246 I248 E252 W253 D254 M288	A246-R250 VanDerWaalsContact O-CB 3.26Å; A246-R250 WeakPolarHBondContact O-CB 3.42Å; A246-R250 PolarHBondContact O-N 3.5Å; I248-R250 VanDerWaalsContact C-N 3.26Å; I248-R250 PolarHBondContact O-N 3.45Å; R250-E252 VanDerWaalsContact C-N 3.32Å; R250-E252 PolarHBondContact O-N 3.48Å; R250-W253 PolarHBondContact O-N 3.41Å; R250-D254 WeakPolarHBondContact CG-OD2 3.38Å; R250-D254 IonicContact NE-OD2 2.68Å; R250-D254 WeakPolarHBondContact O-CB 3.28Å; R250-D254 VanDerWaalsContact O-CG 3.25Å; R250-D254 PolarHBondContact O-N 3.35Å; R250-M288 HydrophobicContact CB-CE 3.87Å; R250-M288 HydrophobicContact CG-CE 4.3Å; R250-M288 PolarHBondContact NH1-O 3.44Å; R250-M288 VanDerWaalsContact NH1-O 3.11Å
251	L	83.5	Confident	80.2	Confident	86 Å²	86	66 Å²	66	45%	0.45	33%	0.327	S	S	.	.	H	α-helix	trans	-65.7	-30.3	179.6	-74.4	167.9	0	0	0	113.4	R247 I248 K255	R247-L251 HydrophobicContact CG-CD1 4.24Å; R247-L251 VanDerWaalsContact O-CG 3.29Å; R247-L251 WeakPolarHBondContact O-CG 3.31Å; R247-L251 PolarHBondContact O-N 3.46Å; I248-L251 PolarHBondContact O-N 2.9Å; I248-L251 VanDerWaalsContact O-N 3.07Å; L251-K255 WeakPolarHBondContact O-CD 3.32Å; L251-K255 WeakPolarHBondContact O-CE 3.44Å; L251-K255 WeakPolarHBondContact O-CG 3.46Å; L251-K255 PolarHBondContact O-N 2.86Å
252	E	84.2	Confident	80.4	Confident	26 Å²	26	66.2 Å²	66.2	12%	0.121	33%	0.326	C	S	.	.	H	α-helix	trans	-78.1	-30.6	172.8	-61.7	-50.7	132.9	0	0	112.7	L210 K213 I248 M249 R250 K255 C256	L210-E252 HydrophobicContact CD1-CB 4.18Å; K213-E252 HydrophobicContact CB-CG 4.31Å; K213-E252 HydrophobicContact CD-CG 4.22Å; K213-E252 VanDerWaalsContact CD-OE2 3.32Å; K213-E252 WeakPolarHBondContact CD-OE2 3.33Å; K213-E252 WeakPolarHBondContact CE-OE2 3.37Å; K213-E252 IonicContact NZ-OE2 2.66Å; K213-E252 PolarHBondContact NZ-OE2 3.19Å; I248-E252 PolarHBondContact O-N 3.15Å; M249-E252 PolarHBondContact O-N 3.04Å; R250-E252 VanDerWaalsContact C-N 3.32Å; R250-E252 PolarHBondContact O-N 3.48Å; E252-K255 IonicContact OE1-NZ 3.64Å; E252-K255 PolarHBondContact OE1-NZ 2.78Å; E252-K255 WeakPolarHBondContact OE2-CD 3.43Å; E252-K255 IonicContact OE2-NZ 3.62Å; E252-K255 PolarHBondContact OE2-NZ 2.76Å; E252-C256 PolarHBondContact O-SG 2.92Å; E252-C256 VanDerWaalsContact O-SG 3.36Å
253	W	83.9	Confident	80.2	Confident	14 Å²	14	71.3 Å²	71.3	5%	0.053	35%	0.346	C	S	.	.	H	α-helix	trans	-70.5	-42.8	171.4	-71.4	11.7	0	0	0	112.8	C214 M249 R250 K255 C256 V262 L285 M288 F290 L300	C214-W253 PolarHBondContact SG-NE1 3.43Å; C214-W253 VanDerWaalsContact SG-NE1 3.38Å; M249-W253 HydrophobicContact CG-CZ2 4.41Å; M249-W253 PolarHBondContact O-N 3.39Å; M249-W253 VanDerWaalsContact O-N 3.11Å; M249-W253 HydrophobicContact SD-CZ2 4.46Å; R250-W253 PolarHBondContact O-N 3.41Å; W253-K255 PolarHBondContact O-N 3.2Å; W253-C256 WeakPolarHBondContact O-CB 3.4Å; W253-C256 PolarHBondContact O-N 3.32Å; W253-V262 HydrophobicContact CB-CG1 4.43Å; W253-V262 HydrophobicContact CB-CG2 4.2Å; W253-V262 HydrophobicContact CD2-CG1 3.55Å; W253-V262 HydrophobicContact CE3-CG1 3.74Å; W253-V262 HydrophobicContact CG-CG1 3.89Å; W253-V262 HydrophobicContact CG-CG2 4.3Å; W253-V262 HydrophobicContact CH2-CG1 4.44Å; W253-V262 HydrophobicContact CZ2-CG1 4.28Å; W253-V262 HydrophobicContact CZ3-CG1 4.22Å; W253-L285 HydrophobicContact CH2-CD2 3.38Å; W253-L285 HydrophobicContact CZ2-CD2 3.89Å; W253-L285 HydrophobicContact CZ3-CD2 4.26Å; W253-M288 HydrophobicContact CD2-CE 4.03Å; W253-M288 HydrophobicContact CE3-CE 3.46Å; W253-M288 VanDerWaalsContact CE3-CE 3.46Å; W253-M288 HydrophobicContact CH2-CE 4.23Å; W253-M288 HydrophobicContact CH2-SD 4.44Å; W253-M288 HydrophobicContact CZ3-CE 3.54Å; W253-M288 HydrophobicContact CZ3-SD 4.26Å; W253-F290 HydrophobicContact CZ3-CE1 4.13Å; W253-F290 HydrophobicContact CZ3-CZ 4.09Å; W253-L300 HydrophobicContact CE3-CD2 4.44Å; W253-L300 HydrophobicContact CH2-CD2 3.54Å; W253-L300 HydrophobicContact CZ3-CD2 3.44Å; W253-L300 VanDerWaalsContact CZ3-CD2 3.44Å
254	D	76.3	Confident	80.4	Confident	111 Å²	111	71.2 Å²	71.2	59%	0.594	34%	0.343	S	S	*	.	H	α-helix	trans	-67	-17.9	179.7	-69.5	-17.5	0	0	0	111.8	R250 C256	R250-D254 WeakPolarHBondContact CG-OD2 3.38Å; R250-D254 IonicContact NE-OD2 2.68Å; R250-D254 WeakPolarHBondContact O-CB 3.28Å; R250-D254 VanDerWaalsContact O-CG 3.25Å; R250-D254 PolarHBondContact O-N 3.35Å; D254-C256 VanDerWaalsContact C-N 3.34Å
255	K	77.2	Confident	80.5	Confident	131 Å²	131	64.2 Å²	64.2	57%	0.57	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-11.5	170.3	-75.2	167.1	-167.4	177.2	0	114.1	L251 E252 W253	L251-K255 WeakPolarHBondContact O-CD 3.32Å; L251-K255 WeakPolarHBondContact O-CE 3.44Å; L251-K255 WeakPolarHBondContact O-CG 3.46Å; L251-K255 PolarHBondContact O-N 2.86Å; E252-K255 IonicContact OE1-NZ 3.64Å; E252-K255 PolarHBondContact OE1-NZ 2.78Å; E252-K255 WeakPolarHBondContact OE2-CD 3.43Å; E252-K255 IonicContact OE2-NZ 3.62Å; E252-K255 PolarHBondContact OE2-NZ 2.76Å; W253-K255 PolarHBondContact O-N 3.2Å
256	C	71.4	Confident	80.4	Confident	39 Å²	39	63.7 Å²	63.7	26%	0.264	31%	0.309	S	S	.	.			trans	-88.5	117	-173.7	-68.5	0	0	0	0	112.6	L210 E252 W253 D254 S258 V262	L210-C256 VanDerWaalsContact CD1-SG 3.59Å; L210-C256 VanDerWaalsContact CD2-SG 3.5Å; E252-C256 PolarHBondContact O-SG 2.92Å; E252-C256 VanDerWaalsContact O-SG 3.36Å; W253-C256 WeakPolarHBondContact O-CB 3.4Å; W253-C256 PolarHBondContact O-N 3.32Å; D254-C256 VanDerWaalsContact C-N 3.34Å; C256-S258 PolarHBondContact O-N 3.48Å; C256-V262 HydrophobicContact CB-CG2 3.96Å
257	L	54.6	Low	80.3	Confident	188 Å²	188	70 Å²	70	98%	0.984	34%	0.336	S	S	*	.	S	Bend	trans	-57.5	-16.9	177	-61.1	174.9	0	0	0	114.5
258	S	69.5	Low	80.5	Confident	46 Å²	46	61.1 Å²	61.1	32%	0.322	30%	0.303	S	S	.	.			trans	-131.8	126.6	176.5	104.5	0	0	0	0	113.2	C256 G260 S261	C256-S258 PolarHBondContact O-N 3.48Å; S258-G260 PolarHBondContact O-N 2.8Å; S258-G260 PolarHBondContact OG-N 3.02Å; S258-S261 WeakPolarHBondContact O-CB 3.3Å; S258-S261 PolarHBondContact O-N 3.3Å; S258-S261 PolarHBondContact OG-N 3.08Å; S258-S261 PolarHBondContact OG-OG 2.83Å
259	L	69.7	Low	80.6	Confident	94 Å²	94	57.9 Å²	57.9	49%	0.492	29%	0.286	S	S	.	.	H	α-helix	trans	-59.3	-24.7	168	-69.5	158.6	0	0	0	111.8	S261 V262 R263 Q299	L259-S261 VanDerWaalsContact C-N 3.33Å; L259-S261 PolarHBondContact O-N 3.02Å; L259-V262 PolarHBondContact O-N 3.26Å; L259-R263 WeakPolarHBondContact O-CB 3.42Å; L259-R263 PolarHBondContact O-N 3.16Å; L259-Q299 HydrophobicContact CD2-CG 4.42Å
260	G	78.3	Confident	80.5	Confident	28 Å²	28	58 Å²	58	29%	0.289	29%	0.287	S	S	.	.	H	α-helix	trans	-64.7	-33.7	173.4	0	0	0	0	0	113.5	S258 R264	S258-G260 PolarHBondContact O-N 2.8Å; S258-G260 PolarHBondContact OG-N 3.02Å; G260-R264 WeakPolarHBondContact O-CG 3.43Å; G260-R264 VanDerWaalsContact O-CZ 3.31Å; G260-R264 PolarHBondContact O-N 3.11Å; G260-R264 VanDerWaalsContact O-N 3.08Å; G260-R264 PolarHBondContact O-NH1 3.07Å
261	S	81.3	Confident	80.4	Confident	17 Å²	17	55.7 Å²	55.7	12%	0.119	28%	0.282	C	S	.	.	H	α-helix	trans	-69.9	-48.1	175.1	-61.4	0	0	0	0	110.9	D207 S258 L259 R263 R264 V265	D207-S261 WeakPolarHBondContact OD1-CB 3.46Å; D207-S261 PolarHBondContact OD1-OG 2.84Å; S258-S261 WeakPolarHBondContact O-CB 3.3Å; S258-S261 PolarHBondContact O-N 3.3Å; S258-S261 PolarHBondContact OG-N 3.08Å; S258-S261 PolarHBondContact OG-OG 2.83Å; L259-S261 VanDerWaalsContact C-N 3.33Å; L259-S261 PolarHBondContact O-N 3.02Å; S261-R263 VanDerWaalsContact C-N 3.28Å; S261-R263 PolarHBondContact O-N 3.5Å; S261-R264 PolarHBondContact O-N 3.17Å; S261-R264 VanDerWaalsContact O-N 3.17Å; S261-R264 PolarHBondContact OG-NH2 2.91Å; S261-V265 PolarHBondContact O-N 2.85Å
262	V	83.5	Confident	80.3	Confident	9 Å²	9	53.3 Å²	53.3	6%	0.055	27%	0.269	C	S	.	.	H	α-helix	trans	-56.2	-43.5	174.2	179.6	0	0	0	0	110.9	L210 W253 C256 L259 V265 N266	L210-V262 HydrophobicContact CD2-CG2 4.29Å; W253-V262 HydrophobicContact CB-CG1 4.43Å; W253-V262 HydrophobicContact CB-CG2 4.2Å; W253-V262 HydrophobicContact CD2-CG1 3.55Å; W253-V262 HydrophobicContact CE3-CG1 3.74Å; W253-V262 HydrophobicContact CG-CG1 3.89Å; W253-V262 HydrophobicContact CG-CG2 4.3Å; W253-V262 HydrophobicContact CH2-CG1 4.44Å; W253-V262 HydrophobicContact CZ2-CG1 4.28Å; W253-V262 HydrophobicContact CZ3-CG1 4.22Å; C256-V262 HydrophobicContact CB-CG2 3.96Å; L259-V262 PolarHBondContact O-N 3.26Å; V262-V265 PolarHBondContact O-N 2.83Å; V262-N266 VanDerWaalsContact O-CB 3.29Å; V262-N266 WeakPolarHBondContact O-CB 3.37Å; V262-N266 PolarHBondContact O-N 3.01Å
263	R	82.8	Confident	80.3	Confident	109 Å²	109	52 Å²	52	41%	0.411	26%	0.263	S	S	.	.	H	α-helix	trans	-64.2	-40.3	177.5	-173.4	175.4	173.9	-165	1.3	113.4	L259 S261 K267 Q299 F301 G302	L259-R263 WeakPolarHBondContact O-CB 3.42Å; L259-R263 PolarHBondContact O-N 3.16Å; S261-R263 VanDerWaalsContact C-N 3.28Å; S261-R263 PolarHBondContact O-N 3.5Å; R263-K267 PolarHBondContact O-N 3.28Å; R263-Q299 WeakPolarHBondContact CB-O 3.39Å; R263-Q299 WeakPolarHBondContact CG-O 3.37Å; R263-F301 VanDerWaalsContact CZ-O 3.25Å; R263-F301 PolarHBondContact NE-O 3.33Å; R263-F301 VanDerWaalsContact NE-O 3.1Å; R263-F301 PolarHBondContact NH2-O 3.32Å; R263-G302 PolarHBondContact NH1-O 3.38Å; R263-G302 PolarHBondContact NH2-O 2.91Å
264	R	85.3	Confident	79.9	Confident	75 Å²	75	52.2 Å²	52.2	28%	0.283	26%	0.264	S	S	.	.	H	α-helix	trans	-67.8	-44.6	176.7	-74.5	-175.9	-59.2	-88.9	-0.9	111.3	V203 D207 G260 S261 K267 S268	V203-R264 HydrophobicContact CG1-CB 4.36Å; D207-R264 VanDerWaalsContact CG-NH2 3.33Å; D207-R264 IonicContact OD1-NH2 3.12Å; D207-R264 PolarHBondContact OD1-NH2 3.16Å; D207-R264 VanDerWaalsContact OD1-NH2 3.12Å; D207-R264 IonicContact OD2-CZ 3.13Å; D207-R264 IonicContact OD2-NE 2.68Å; D207-R264 PolarHBondContact OD2-NE 3.17Å; D207-R264 IonicContact OD2-NH2 2.74Å; D207-R264 PolarHBondContact OD2-NH2 3.39Å; G260-R264 WeakPolarHBondContact O-CG 3.43Å; G260-R264 VanDerWaalsContact O-CZ 3.31Å; G260-R264 PolarHBondContact O-N 3.11Å; G260-R264 VanDerWaalsContact O-N 3.08Å; G260-R264 PolarHBondContact O-NH1 3.07Å; S261-R264 PolarHBondContact O-N 3.17Å; S261-R264 VanDerWaalsContact O-N 3.17Å; S261-R264 PolarHBondContact OG-NH2 2.91Å; R264-K267 PolarHBondContact O-N 3.22Å; R264-S268 PolarHBondContact O-N 3.44Å
265	V	87.4	Confident	80	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.7	-42.9	175.3	167.9	0	0	0	0	112	V203 D207 L210 L211 C214 S261 V262 K267 S268 L269	V203-V265 HydrophobicContact CG1-CG2 4.27Å; D207-V265 HydrophobicContact CB-CG2 4.18Å; L210-V265 HydrophobicContact CB-CG2 4.16Å; L210-V265 HydrophobicContact CD2-CB 4.06Å; L210-V265 HydrophobicContact CD2-CG1 4.38Å; L210-V265 HydrophobicContact CD2-CG2 3.81Å; L210-V265 HydrophobicContact CG-CB 4.38Å; L210-V265 HydrophobicContact CG-CG1 4.25Å; L210-V265 HydrophobicContact CG-CG2 4.02Å; L211-V265 HydrophobicContact CB-CG1 4.48Å; L211-V265 HydrophobicContact CB-CG2 4.02Å; L211-V265 HydrophobicContact CD1-CB 4.44Å; L211-V265 HydrophobicContact CD1-CG1 3.89Å; L211-V265 HydrophobicContact CD1-CG2 4.36Å; C214-V265 HydrophobicContact CB-CG1 4.16Å; S261-V265 PolarHBondContact O-N 2.85Å; V262-V265 PolarHBondContact O-N 2.83Å; V265-K267 PolarHBondContact O-N 3.25Å; V265-S268 WeakPolarHBondContact O-CB 3.48Å; V265-S268 PolarHBondContact O-N 3.22Å; V265-L269 HydrophobicContact CG1-CD1 3.67Å; V265-L269 HydrophobicContact CG1-CG 4.34Å; V265-L269 WeakPolarHBondContact O-CG 3.33Å; V265-L269 PolarHBondContact O-N 3.22Å
266	N	88.4	Confident	79.9	Confident	1 Å²	1	42 Å²	42	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-59.2	-43.9	172.7	175.1	74.7	0	0	0	111.9	V262 S268 L270 Y281 L300	V262-N266 VanDerWaalsContact O-CB 3.29Å; V262-N266 WeakPolarHBondContact O-CB 3.37Å; V262-N266 PolarHBondContact O-N 3.01Å; N266-S268 PolarHBondContact O-N 2.85Å; N266-L270 WeakPolarHBondContact O-CB 3.21Å; N266-L270 VanDerWaalsContact O-CG 3.23Å; N266-L270 WeakPolarHBondContact O-CG 3.41Å; N266-L270 PolarHBondContact O-N 3.16Å; N266-Y281 PolarHBondContact OD1-OH 3.27Å; N266-Y281 VanDerWaalsContact OD1-OH 3.11Å; N266-L300 PolarHBondContact ND2-O 2.95Å
267	K	85.6	Confident	80.5	Confident	134 Å²	134	40.4 Å²	40.4	58%	0.583	20%	0.204	S	C	*	.	H	α-helix	trans	-62	-42.8	175.3	-170.4	-169.4	173.7	-163.5	0	111.7	R263 R264 V265 L270 N271	R263-K267 PolarHBondContact O-N 3.28Å; R264-K267 PolarHBondContact O-N 3.22Å; V265-K267 PolarHBondContact O-N 3.25Å; K267-L270 PolarHBondContact O-N 3.21Å; K267-N271 VanDerWaalsContact O-CB 3.26Å; K267-N271 WeakPolarHBondContact O-CB 3.39Å; K267-N271 VanDerWaalsContact O-CG 3.29Å; K267-N271 PolarHBondContact O-N 2.83Å; K267-N271 PolarHBondContact O-OD1 2.85Å
268	S	87.2	Confident	82.1	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.014	16%	0.157	C	C	.	.	H	α-helix	trans	-58.8	-54.6	177.1	-176.1	0	0	0	0	111.6	M199 S202 R264 V265 N266 L270 N271 H272	M199-S268 PolarHBondContact O-OG 3.36Å; S202-S268 WeakPolarHBondContact OG-CB 3.32Å; S202-S268 PolarHBondContact OG-OG 3.18Å; R264-S268 PolarHBondContact O-N 3.44Å; V265-S268 WeakPolarHBondContact O-CB 3.48Å; V265-S268 PolarHBondContact O-N 3.22Å; N266-S268 PolarHBondContact O-N 2.85Å; S268-L270 PolarHBondContact O-N 3.23Å; S268-N271 PolarHBondContact O-N 2.77Å; S268-N271 VanDerWaalsContact O-N 3.1Å; S268-H272 PolarHBondContact O-CD2 3.4Å; S268-H272 VanDerWaalsContact O-CD2 3.23Å; S268-H272 PolarHBondContact O-N 2.75Å
269	L	89	Confident	83	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-58.5	-45.8	178.9	-67.2	163.1	0	0	0	111.6	M199 L211 C214 V265 N271 L273 Y281	M199-L269 HydrophobicContact CE-CD2 3.68Å; M199-L269 HydrophobicContact CE-CG 4.47Å; L211-L269 HydrophobicContact CD1-CD2 4.22Å; L211-L269 HydrophobicContact CD1-CG 4.08Å; C214-L269 HydrophobicContact CB-CD1 3.78Å; V265-L269 HydrophobicContact CG1-CD1 3.67Å; V265-L269 HydrophobicContact CG1-CG 4.34Å; V265-L269 WeakPolarHBondContact O-CG 3.33Å; V265-L269 PolarHBondContact O-N 3.22Å; L269-N271 VanDerWaalsContact C-N 3.33Å; L269-N271 PolarHBondContact O-N 3.37Å; L269-L273 HydrophobicContact CB-CD1 3.91Å; L269-L273 HydrophobicContact CB-CG 4.29Å; L269-L273 HydrophobicContact CD2-CD1 3.97Å; L269-L273 HydrophobicContact CD2-CD2 4Å; L269-L273 HydrophobicContact CD2-CG 4.12Å; L269-L273 VanDerWaalsContact O-CB 3.31Å; L269-L273 WeakPolarHBondContact O-CB 3.3Å; L269-L273 WeakPolarHBondContact O-CD1 3.45Å; L269-L273 WeakPolarHBondContact O-CG 3.32Å; L269-L273 PolarHBondContact O-N 3.02Å; L269-Y281 HydrophobicContact CB-CD1 4.21Å; L269-Y281 HydrophobicContact CB-CE1 3.76Å; L269-Y281 HydrophobicContact CB-CE2 4.48Å; L269-Y281 HydrophobicContact CD1-CD2 4.48Å; L269-Y281 HydrophobicContact CD1-CE1 4.38Å; L269-Y281 HydrophobicContact CD1-CE2 3.72Å
270	L	86.8	Confident	83.9	Confident	4 Å²	4	25.8 Å²	25.8	2%	0.021	13%	0.125	C	C	.	.	H	α-helix	trans	-63.3	-36.9	176.4	-69.8	176	0	0	0	112.7	F163 R164 N266 K267 S268 L278 Y281 L282 F301 V318	F163-L270 HydrophobicContact CE1-CB 4.31Å; F163-L270 WeakPolarHBondContact CE1-O 3.44Å; F163-L270 HydrophobicContact CZ-CB 4.47Å; R164-L270 VanDerWaalsContact CZ-O 3.28Å; R164-L270 PolarHBondContact NH1-O 2.86Å; R164-L270 PolarHBondContact NH2-O 3.06Å; N266-L270 WeakPolarHBondContact O-CB 3.21Å; N266-L270 VanDerWaalsContact O-CG 3.23Å; N266-L270 WeakPolarHBondContact O-CG 3.41Å; N266-L270 PolarHBondContact O-N 3.16Å; K267-L270 PolarHBondContact O-N 3.21Å; S268-L270 PolarHBondContact O-N 3.23Å; L270-L278 HydrophobicContact CD2-CD1 3.78Å; L270-Y281 HydrophobicContact CD2-CD1 4.19Å; L270-Y281 HydrophobicContact CD2-CE1 3.98Å; L270-Y281 HydrophobicContact CG-CE1 4.19Å; L270-L282 HydrophobicContact CD2-CD2 3.91Å; L270-F301 HydrophobicContact CD1-CE1 3.51Å; L270-F301 HydrophobicContact CD1-CZ 3.58Å; L270-V318 HydrophobicContact CD2-CG1 4.16Å; L270-V318 HydrophobicContact CD2-CG2 4.41Å
271	N	82.4	Confident	84.7	Confident	55 Å²	55	24.5 Å²	24.5	29%	0.294	11%	0.111	S	C	.	.	H	α-helix	trans	-76.4	-39.4	-177.4	-82.1	17.3	0	0	0	113.7	R164 K267 S268 L269	R164-N271 PolarHBondContact NH1-O 2.95Å; R164-N271 PolarHBondContact NH2-O 3.12Å; K267-N271 VanDerWaalsContact O-CB 3.26Å; K267-N271 WeakPolarHBondContact O-CB 3.39Å; K267-N271 VanDerWaalsContact O-CG 3.29Å; K267-N271 PolarHBondContact O-N 2.83Å; K267-N271 PolarHBondContact O-OD1 2.85Å; S268-N271 PolarHBondContact O-N 2.77Å; S268-N271 VanDerWaalsContact O-N 3.1Å; L269-N271 VanDerWaalsContact C-N 3.33Å; L269-N271 PolarHBondContact O-N 3.37Å
272	H	82.6	Confident	85.2	Confident	36 Å²	36	23.7 Å²	23.7	17%	0.167	11%	0.106	C	C	.	.	H	α-helix	trans	-115.9	-19.8	-161.2	-59.8	-75.1	0	0	0	115.9	M199 S268	M199-H272 HydrophobicContact CG-CB 3.28Å; M199-H272 HydrophobicContact SD-CB 4.04Å; S268-H272 PolarHBondContact O-CD2 3.4Å; S268-H272 VanDerWaalsContact O-CD2 3.23Å; S268-H272 PolarHBondContact O-N 2.75Å
273	L	82.7	Confident	85.5	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	10%	0.103	C	C	.	.	S	Bend	trans	-59.1	144.1	175.8	-69.8	176.5	0	0	0	111.8	R164 M199 L269 Q277 L278 Y281	R164-L273 PolarHBondContact NE-O 3.21Å; R164-L273 PolarHBondContact NH2-O 3Å; M199-L273 HydrophobicContact CE-CD2 4.35Å; M199-L273 HydrophobicContact SD-CD2 4.33Å; L269-L273 HydrophobicContact CB-CD1 3.91Å; L269-L273 HydrophobicContact CB-CG 4.29Å; L269-L273 HydrophobicContact CD2-CD1 3.97Å; L269-L273 HydrophobicContact CD2-CD2 4Å; L269-L273 HydrophobicContact CD2-CG 4.12Å; L269-L273 VanDerWaalsContact O-CB 3.31Å; L269-L273 WeakPolarHBondContact O-CB 3.3Å; L269-L273 WeakPolarHBondContact O-CD1 3.45Å; L269-L273 WeakPolarHBondContact O-CG 3.32Å; L269-L273 PolarHBondContact O-N 3.02Å; L273-Q277 HydrophobicContact CB-CB 4.05Å; L273-Q277 HydrophobicContact CD1-CB 4.49Å; L273-Q277 HydrophobicContact CD2-CB 4.09Å; L273-Q277 VanDerWaalsContact CD2-OE1 3.28Å; L273-Q277 HydrophobicContact CG-CB 4.43Å; L273-L278 HydrophobicContact CB-CB 4.18Å; L273-Y281 HydrophobicContact CD1-CD1 4.15Å; L273-Y281 HydrophobicContact CD1-CG 4.04Å
274	E	76.8	Confident	85.9	Confident	17 Å²	17	18 Å²	18	8%	0.079	8%	0.083	C	C	.	.			trans	-65.8	159.9	170.1	-65	-163.2	144.4	0	0	111.5	S174 H276 Q277 L278	S174-E274 PolarHBondContact N-OE1 3.42Å; S174-E274 PolarHBondContact OG-OE1 3.17Å; E274-H276 VanDerWaalsContact C-N 3.27Å; E274-H276 PolarHBondContact O-N 3.12Å; E274-H276 VanDerWaalsContact O-N 3.17Å; E274-H276 IonicContact OE2-CE1 2.91Å; E274-H276 PolarHBondContact OE2-CE1 3.29Å; E274-H276 IonicContact OE2-ND1 2.66Å; E274-Q277 HydrophobicContact CB-CG 4.47Å; E274-Q277 PolarHBondContact O-N 3.48Å; E274-L278 WeakPolarHBondContact O-CB 3.5Å; E274-L278 PolarHBondContact O-N 2.64Å
275	V	76.8	Confident	86.1	Confident	5 Å²	5	14.5 Å²	14.5	3%	0.03	7%	0.07	C	C	.	.	H	α-helix	trans	-55.7	-39.2	-172.6	170	0	0	0	0	113	A160 Y161 R164 F173 L278 S279	A160-V275 HydrophobicContact CB-CG1 4.21Å; Y161-V275 HydrophobicContact CD1-CG1 4.33Å; Y161-V275 HydrophobicContact CD1-CG2 4.48Å; Y161-V275 HydrophobicContact CD2-CG1 3.73Å; Y161-V275 HydrophobicContact CE1-CG1 4.21Å; Y161-V275 HydrophobicContact CE1-CG2 4.46Å; Y161-V275 HydrophobicContact CE2-CG1 3.59Å; Y161-V275 HydrophobicContact CG-CG1 4.11Å; R164-V275 HydrophobicContact CB-CG2 4.5Å; R164-V275 HydrophobicContact CG-CG2 3.91Å; F173-V275 HydrophobicContact CE1-CB 4.31Å; F173-V275 HydrophobicContact CE1-CG2 3.68Å; F173-V275 HydrophobicContact CZ-CG2 4.09Å; V275-L278 PolarHBondContact O-N 3.03Å; V275-S279 WeakPolarHBondContact O-CB 3.36Å; V275-S279 PolarHBondContact O-N 2.89Å; V275-S279 PolarHBondContact O-OG 2.8Å
276	H	76.1	Confident	86	Confident	24 Å²	24	15.9 Å²	15.9	11%	0.111	8%	0.076	C	C	.	.	H	α-helix	trans	-70.5	-33.8	179.6	75.9	-97.5	0	0	0	113	M116 E274 S279 T280	M116-H276 HydrophobicContact CE-CB 3.7Å; E274-H276 VanDerWaalsContact C-N 3.27Å; E274-H276 PolarHBondContact O-N 3.12Å; E274-H276 VanDerWaalsContact O-N 3.17Å; E274-H276 IonicContact OE2-CE1 2.91Å; E274-H276 PolarHBondContact OE2-CE1 3.29Å; E274-H276 IonicContact OE2-ND1 2.66Å; H276-S279 PolarHBondContact O-OG 3.33Å; H276-S279 VanDerWaalsContact O-OG 3.12Å; H276-T280 WeakPolarHBondContact O-CB 3.41Å; H276-T280 PolarHBondContact O-N 3.28Å; H276-T280 PolarHBondContact O-OG1 3.47Å
277	Q	84.1	Confident	85.8	Confident	4 Å²	4	16.7 Å²	16.7	2%	0.019	8%	0.08	C	C	.	.	H	α-helix	trans	-75.5	-40.5	174	-57.5	179.2	-15.2	0	0	110.6	V218 L273 E274 T280 Y281	V218-Q277 HydrophobicContact CG1-CB 4.05Å; V218-Q277 WeakPolarHBondContact CG1-O 3.22Å; L273-Q277 HydrophobicContact CB-CB 4.05Å; L273-Q277 HydrophobicContact CD1-CB 4.49Å; L273-Q277 HydrophobicContact CD2-CB 4.09Å; L273-Q277 VanDerWaalsContact CD2-OE1 3.28Å; L273-Q277 HydrophobicContact CG-CB 4.43Å; E274-Q277 HydrophobicContact CB-CG 4.47Å; E274-Q277 PolarHBondContact O-N 3.48Å; Q277-T280 PolarHBondContact O-N 3.43Å; Q277-Y281 WeakPolarHBondContact O-CB 3.36Å; Q277-Y281 PolarHBondContact O-N 2.89Å
278	L	88.2	Confident	85.6	Confident	0 Å²	0	10.8 Å²	10.8	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-63.4	-48	177.5	178.7	60.4	0	0	0	111.1	A160 F163 R164 L270 L273 E274 V275 T280 Y281 L282	A160-L278 HydrophobicContact CB-CB 4.13Å; A160-L278 HydrophobicContact CB-CD2 3.77Å; A160-L278 HydrophobicContact CB-CG 3.75Å; F163-L278 HydrophobicContact CD1-CD2 4.24Å; R164-L278 HydrophobicContact CG-CD2 4.34Å; L270-L278 HydrophobicContact CD2-CD1 3.78Å; L273-L278 HydrophobicContact CB-CB 4.18Å; E274-L278 WeakPolarHBondContact O-CB 3.5Å; E274-L278 PolarHBondContact O-N 2.64Å; V275-L278 PolarHBondContact O-N 3.03Å; L278-T280 VanDerWaalsContact C-N 3.26Å; L278-T280 PolarHBondContact O-N 3.28Å; L278-Y281 HydrophobicContact CD1-CD1 4.39Å; L278-Y281 WeakPolarHBondContact O-CB 3.46Å; L278-Y281 PolarHBondContact O-N 3.05Å; L278-Y281 VanDerWaalsContact O-N 3.16Å; L278-L282 HydrophobicContact CD1-CD2 4.43Å; L278-L282 HydrophobicContact CD1-CG 4.21Å; L278-L282 HydrophobicContact CG-CD1 4.44Å; L278-L282 HydrophobicContact CG-CG 4.43Å; L278-L282 WeakPolarHBondContact O-CB 2.78Å; L278-L282 VanDerWaalsContact O-CG 3.28Å; L278-L282 WeakPolarHBondContact O-CG 3.48Å; L278-L282 PolarHBondContact O-N 3.44Å
279	S	87.8	Confident	84.7	Confident	10 Å²	10	18.9 Å²	18.9	7%	0.07	9%	0.085	C	C	.	.	H	α-helix	trans	-61.1	-37.1	177.6	66.5	0	0	0	0	112.1	S156 V275 H276 A283	S156-S279 WeakPolarHBondContact CB-O 3.43Å; S156-S279 PolarHBondContact OG-O 3.41Å; V275-S279 WeakPolarHBondContact O-CB 3.36Å; V275-S279 PolarHBondContact O-N 2.89Å; V275-S279 PolarHBondContact O-OG 2.8Å; H276-S279 PolarHBondContact O-OG 3.33Å; H276-S279 VanDerWaalsContact O-OG 3.12Å; S279-A283 PolarHBondContact O-N 3.33Å
280	T	89.4	Confident	83.6	Confident	12 Å²	12	21 Å²	21	7%	0.074	9%	0.094	C	C	.	.	H	α-helix	trans	-66.7	-44.8	173	-59.8	0	0	0	0	111.7	V218 Q221 V222 H276 Q277 L278 L282 A283 I284	V218-T280 HydrophobicContact CG1-CG2 4.47Å; Q221-T280 HydrophobicContact CB-CG2 3.68Å; Q221-T280 HydrophobicContact CG-CG2 3.5Å; Q221-T280 VanDerWaalsContact CG-CG2 3.5Å; V222-T280 HydrophobicContact CG2-CG2 3.95Å; H276-T280 WeakPolarHBondContact O-CB 3.41Å; H276-T280 PolarHBondContact O-N 3.28Å; H276-T280 PolarHBondContact O-OG1 3.47Å; Q277-T280 PolarHBondContact O-N 3.43Å; L278-T280 VanDerWaalsContact C-N 3.26Å; L278-T280 PolarHBondContact O-N 3.28Å; T280-L282 PolarHBondContact O-N 2.92Å; T280-A283 WeakPolarHBondContact O-CB 3.3Å; T280-A283 PolarHBondContact O-N 2.86Å; T280-I284 HydrophobicContact CG2-CD1 4.22Å; T280-I284 WeakPolarHBondContact O-CG1 3.49Å; T280-I284 PolarHBondContact O-N 3.12Å
281	Y	93.8	Very high	81.9	Confident	0 Å²	0	31 Å²	31	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.7	-43.2	174.4	177.9	-119.9	0	0	0	111.9	V218 M249 N266 L269 L270 L273 Q277 L278 A283 I284 L285	V218-Y281 HydrophobicContact CG2-CD2 3.69Å; V218-Y281 HydrophobicContact CG2-CG 4.19Å; M249-Y281 HydrophobicContact CE-CD2 3.96Å; M249-Y281 HydrophobicContact CE-CE2 3.86Å; M249-Y281 HydrophobicContact SD-CE2 4.33Å; N266-Y281 PolarHBondContact OD1-OH 3.27Å; N266-Y281 VanDerWaalsContact OD1-OH 3.11Å; L269-Y281 HydrophobicContact CB-CD1 4.21Å; L269-Y281 HydrophobicContact CB-CE1 3.76Å; L269-Y281 HydrophobicContact CB-CE2 4.48Å; L269-Y281 HydrophobicContact CD1-CD2 4.48Å; L269-Y281 HydrophobicContact CD1-CE1 4.38Å; L269-Y281 HydrophobicContact CD1-CE2 3.72Å; L270-Y281 HydrophobicContact CD2-CD1 4.19Å; L270-Y281 HydrophobicContact CD2-CE1 3.98Å; L270-Y281 HydrophobicContact CG-CE1 4.19Å; L273-Y281 HydrophobicContact CD1-CD1 4.15Å; L273-Y281 HydrophobicContact CD1-CG 4.04Å; Q277-Y281 WeakPolarHBondContact O-CB 3.36Å; Q277-Y281 PolarHBondContact O-N 2.89Å; L278-Y281 HydrophobicContact CD1-CD1 4.39Å; L278-Y281 WeakPolarHBondContact O-CB 3.46Å; L278-Y281 PolarHBondContact O-N 3.05Å; L278-Y281 VanDerWaalsContact O-N 3.16Å; Y281-A283 PolarHBondContact O-N 2.87Å; Y281-I284 WeakPolarHBondContact O-CB 3.43Å; Y281-I284 PolarHBondContact O-N 2.97Å; Y281-L285 HydrophobicContact CD1-CD1 4.19Å; Y281-L285 HydrophobicContact CD2-CG 4.42Å; Y281-L285 HydrophobicContact CE1-CD1 3.7Å; Y281-L285 HydrophobicContact CE1-CG 4.2Å; Y281-L285 HydrophobicContact CE2-CD1 4.46Å; Y281-L285 HydrophobicContact CE2-CD2 3.98Å; Y281-L285 HydrophobicContact CE2-CG 4.1Å; Y281-L285 WeakPolarHBondContact O-CG 3.49Å; Y281-L285 PolarHBondContact O-N 2.98Å
282	L	91.7	Very high	80.8	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.8	-41.8	174.8	-68.3	-173.9	0	0	0	111.8	A159 A160 L270 L278 T280 L285 K286 V318 F321	A159-L282 HydrophobicContact CB-CD1 3.96Å; A160-L282 HydrophobicContact CB-CD1 4.32Å; L270-L282 HydrophobicContact CD2-CD2 3.91Å; L278-L282 HydrophobicContact CD1-CD2 4.43Å; L278-L282 HydrophobicContact CD1-CG 4.21Å; L278-L282 HydrophobicContact CG-CD1 4.44Å; L278-L282 HydrophobicContact CG-CG 4.43Å; L278-L282 WeakPolarHBondContact O-CB 2.78Å; L278-L282 VanDerWaalsContact O-CG 3.28Å; L278-L282 WeakPolarHBondContact O-CG 3.48Å; L278-L282 PolarHBondContact O-N 3.44Å; T280-L282 PolarHBondContact O-N 2.92Å; L282-L285 HydrophobicContact CD2-CD1 4.38Å; L282-L285 PolarHBondContact O-N 2.94Å; L282-K286 WeakPolarHBondContact O-CB 3.46Å; L282-K286 PolarHBondContact O-N 3.07Å; L282-V318 HydrophobicContact CD1-CG2 4.08Å; L282-V318 HydrophobicContact CD2-CB 4.41Å; L282-V318 HydrophobicContact CD2-CG1 3.54Å; L282-V318 HydrophobicContact CD2-CG2 4.15Å; L282-F321 HydrophobicContact CB-CD1 4.15Å; L282-F321 HydrophobicContact CB-CE1 3.83Å; L282-F321 HydrophobicContact CD1-CD1 4.49Å; L282-F321 WeakPolarHBondContact O-CE1 3.24Å
283	A	90.4	Very high	79.7	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.5	-40.5	174	0	0	0	0	0	112.3	M152 L153 L242 S279 T280 Y281 K286 M287	M152-A283 HydrophobicContact CE-CB 4.21Å; L153-A283 HydrophobicContact CD2-CB 4.27Å; L242-A283 HydrophobicContact CD1-CB 4.44Å; L242-A283 HydrophobicContact CD2-CB 3.85Å; S279-A283 PolarHBondContact O-N 3.33Å; T280-A283 WeakPolarHBondContact O-CB 3.3Å; T280-A283 PolarHBondContact O-N 2.86Å; Y281-A283 PolarHBondContact O-N 2.87Å; A283-K286 WeakPolarHBondContact O-CB 3.36Å; A283-K286 PolarHBondContact O-N 2.68Å; A283-M287 WeakPolarHBondContact O-CG 3.23Å; A283-M287 PolarHBondContact O-N 3.04Å; A283-M287 VanDerWaalsContact O-N 3.08Å
284	I	91.4	Very high	78.7	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61	-50.5	172.8	-68.6	165.8	0	0	0	110.5	V217 V218 Q221 L242 A246 M249 T280 Y281 K286 M287 M288	V217-I284 HydrophobicContact CG1-CD1 4.47Å; V218-I284 HydrophobicContact CG2-CD1 4.27Å; Q221-I284 HydrophobicContact CB-CD1 3.9Å; Q221-I284 HydrophobicContact CG-CD1 4.13Å; Q221-I284 HydrophobicContact CG-CG1 4.36Å; L242-I284 HydrophobicContact CD2-CG1 3.97Å; A246-I284 HydrophobicContact CB-CG2 4.32Å; M249-I284 HydrophobicContact CB-CG2 3.98Å; M249-I284 HydrophobicContact CE-CG2 4.19Å; M249-I284 HydrophobicContact CG-CG2 4.18Å; T280-I284 HydrophobicContact CG2-CD1 4.22Å; T280-I284 WeakPolarHBondContact O-CG1 3.49Å; T280-I284 PolarHBondContact O-N 3.12Å; Y281-I284 WeakPolarHBondContact O-CB 3.43Å; Y281-I284 PolarHBondContact O-N 2.97Å; I284-K286 VanDerWaalsContact C-N 3.29Å; I284-K286 PolarHBondContact O-N 3.06Å; I284-M287 PolarHBondContact O-N 3.29Å; I284-M287 VanDerWaalsContact O-N 3.08Å; I284-M288 WeakPolarHBondContact O-CG 3.31Å; I284-M288 PolarHBondContact O-N 3.34Å; I284-M288 VanDerWaalsContact O-N 3.1Å
285	L	89.1	Confident	78.2	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.9	-40.5	176.9	-69.8	-172.7	0	0	0	112.2	W253 Y281 L282 M287 M288 F290 L322	W253-L285 HydrophobicContact CH2-CD2 3.38Å; W253-L285 HydrophobicContact CZ2-CD2 3.89Å; W253-L285 HydrophobicContact CZ3-CD2 4.26Å; Y281-L285 HydrophobicContact CD1-CD1 4.19Å; Y281-L285 HydrophobicContact CD2-CG 4.42Å; Y281-L285 HydrophobicContact CE1-CD1 3.7Å; Y281-L285 HydrophobicContact CE1-CG 4.2Å; Y281-L285 HydrophobicContact CE2-CD1 4.46Å; Y281-L285 HydrophobicContact CE2-CD2 3.98Å; Y281-L285 HydrophobicContact CE2-CG 4.1Å; Y281-L285 WeakPolarHBondContact O-CG 3.49Å; Y281-L285 PolarHBondContact O-N 2.98Å; L282-L285 HydrophobicContact CD2-CD1 4.38Å; L282-L285 PolarHBondContact O-N 2.94Å; L285-M287 VanDerWaalsContact C-N 3.3Å; L285-M287 PolarHBondContact O-N 3.17Å; L285-M288 HydrophobicContact CD2-SD 3.81Å; L285-M288 PolarHBondContact O-N 3.48Å; L285-F290 HydrophobicContact CB-CE2 4.48Å; L285-F290 HydrophobicContact CD2-CZ 4.39Å; L285-F290 WeakPolarHBondContact O-CE2 3.27Å; L285-L322 HydrophobicContact CB-CD2 3.71Å; L285-L322 HydrophobicContact CD1-CD1 4.37Å
286	K	85.9	Confident	77.7	Confident	29 Å²	29	42 Å²	42	13%	0.126	19%	0.194	C	C	.	.	H	α-helix	trans	-59.9	-42.6	176	-166.4	71.6	179.7	-177.2	0	111.4	M152 L282 A283 I284 M288 R289 F321 L322 S324	M152-K286 HydrophobicContact CG-CG 4.06Å; M152-K286 HydrophobicContact SD-CB 4.05Å; M152-K286 HydrophobicContact SD-CG 3.64Å; L282-K286 WeakPolarHBondContact O-CB 3.46Å; L282-K286 PolarHBondContact O-N 3.07Å; A283-K286 WeakPolarHBondContact O-CB 3.36Å; A283-K286 PolarHBondContact O-N 2.68Å; I284-K286 VanDerWaalsContact C-N 3.29Å; I284-K286 PolarHBondContact O-N 3.06Å; K286-M288 VanDerWaalsContact C-N 3.34Å; K286-M288 PolarHBondContact O-N 2.86Å; K286-R289 PolarHBondContact O-N 3.13Å; K286-F321 HydrophobicContact CB-CE1 4Å; K286-F321 HydrophobicContact CB-CZ 4.01Å; K286-F321 HydrophobicContact CD-CE1 4.07Å; K286-F321 HydrophobicContact CD-CZ 4Å; K286-F321 HydrophobicContact CG-CE1 4.31Å; K286-F321 HydrophobicContact CG-CZ 3.99Å; K286-F321 PolarHBondContact NZ-O 3.05Å; K286-L322 PolarHBondContact NZ-O 3.18Å; K286-S324 PolarHBondContact NZ-O 3.14Å; K286-S324 PolarHBondContact NZ-OG 2.86Å
287	M	85	Confident	77.2	Confident	18 Å²	18	41.6 Å²	41.6	9%	0.089	19%	0.193	C	C	.	.	H	α-helix	trans	-76.2	-14.9	-178.7	-72.6	-62.8	-67	0	0	114.6	M152 L239 L242 K243 A246 A283 I284 L285 R289	M152-M287 HydrophobicContact CE-CG 3.89Å; M152-M287 HydrophobicContact CE-SD 4.23Å; M152-M287 HydrophobicContact SD-CG 4.17Å; M152-M287 HydrophobicContact SD-SD 4.13Å; L239-M287 HydrophobicContact CD1-CE 3.51Å; L239-M287 HydrophobicContact CD1-SD 4.26Å; L242-M287 HydrophobicContact CB-CG 4.17Å; K243-M287 HydrophobicContact CG-CE 3.48Å; K243-M287 VanDerWaalsContact CG-CE 3.48Å; A246-M287 HydrophobicContact CB-CB 3.82Å; A283-M287 WeakPolarHBondContact O-CG 3.23Å; A283-M287 PolarHBondContact O-N 3.04Å; A283-M287 VanDerWaalsContact O-N 3.08Å; I284-M287 PolarHBondContact O-N 3.29Å; I284-M287 VanDerWaalsContact O-N 3.08Å; L285-M287 VanDerWaalsContact C-N 3.3Å; L285-M287 PolarHBondContact O-N 3.17Å; M287-R289 PolarHBondContact O-N 3.07Å
288	M	80.4	Confident	76.4	Confident	10 Å²	10	47.1 Å²	47.1	5%	0.049	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-13	172.7	-69.7	171.9	71	0	0	114	A246 M249 R250 W253 I284 L285 K286 F290	A246-M288 HydrophobicContact CB-CG 3.79Å; M249-M288 HydrophobicContact CB-SD 4.17Å; M249-M288 HydrophobicContact CG-CE 4.2Å; M249-M288 HydrophobicContact CG-SD 3.74Å; R250-M288 HydrophobicContact CB-CE 3.87Å; R250-M288 HydrophobicContact CG-CE 4.3Å; R250-M288 PolarHBondContact NH1-O 3.44Å; R250-M288 VanDerWaalsContact NH1-O 3.11Å; W253-M288 HydrophobicContact CD2-CE 4.03Å; W253-M288 HydrophobicContact CE3-CE 3.46Å; W253-M288 VanDerWaalsContact CE3-CE 3.46Å; W253-M288 HydrophobicContact CH2-CE 4.23Å; W253-M288 HydrophobicContact CH2-SD 4.44Å; W253-M288 HydrophobicContact CZ3-CE 3.54Å; W253-M288 HydrophobicContact CZ3-SD 4.26Å; I284-M288 WeakPolarHBondContact O-CG 3.31Å; I284-M288 PolarHBondContact O-N 3.34Å; I284-M288 VanDerWaalsContact O-N 3.1Å; L285-M288 HydrophobicContact CD2-SD 3.81Å; L285-M288 PolarHBondContact O-N 3.48Å; K286-M288 VanDerWaalsContact C-N 3.34Å; K286-M288 PolarHBondContact O-N 2.86Å; M288-F290 HydrophobicContact CB-CE1 4.11Å; M288-F290 HydrophobicContact CB-CE2 4.34Å; M288-F290 HydrophobicContact CB-CZ 3.87Å; M288-F290 HydrophobicContact CE-CE1 4.14Å; M288-F290 HydrophobicContact CE-CZ 4.19Å; M288-F290 HydrophobicContact SD-CZ 4.12Å
289	R	68.7	Low	75.3	Confident	172 Å²	172	50 Å²	50	65%	0.649	23%	0.23	S	C	*	.			trans	47.4	67.5	175.1	-68.1	-177.8	177	-169.2	-1.6	113	K286 M287 K291	K286-R289 PolarHBondContact O-N 3.13Å; M287-R289 PolarHBondContact O-N 3.07Å; R289-K291 PolarHBondContact O-N 3.43Å
290	F	65.3	Low	74.7	Confident	46 Å²	46	49.6 Å²	49.6	20%	0.202	23%	0.228	C	C	.	.			trans	-59.1	119.2	172.9	-54.2	-66.3	0	0	0	110.4	W253 L285 M288 D292 F295 V296 L300	W253-F290 HydrophobicContact CZ3-CE1 4.13Å; W253-F290 HydrophobicContact CZ3-CZ 4.09Å; L285-F290 HydrophobicContact CB-CE2 4.48Å; L285-F290 HydrophobicContact CD2-CZ 4.39Å; L285-F290 WeakPolarHBondContact O-CE2 3.27Å; M288-F290 HydrophobicContact CB-CE1 4.11Å; M288-F290 HydrophobicContact CB-CE2 4.34Å; M288-F290 HydrophobicContact CB-CZ 3.87Å; M288-F290 HydrophobicContact CE-CE1 4.14Å; M288-F290 HydrophobicContact CE-CZ 4.19Å; M288-F290 HydrophobicContact SD-CZ 4.12Å; F290-D292 PolarHBondContact O-N 3Å; F290-F295 HydrophobicContact CB-CD1 4.35Å; F290-F295 AromaticContact CD1-CD1 3.33Å; F290-F295 HydrophobicContact CD1-CD1 3.33Å; F290-F295 AromaticContact CD1-CE1 3.46Å; F290-F295 HydrophobicContact CD1-CE1 3.46Å; F290-F295 VanDerWaalsContact CD1-CE1 3.46Å; F290-F295 HydrophobicContact CD1-CG 4.22Å; F290-F295 HydrophobicContact CD1-CZ 4.41Å; F290-F295 AromaticContact CE1-CD1 3.82Å; F290-F295 HydrophobicContact CE1-CD1 3.82Å; F290-F295 AromaticContact CE1-CE1 3.49Å; F290-F295 HydrophobicContact CE1-CE1 3.49Å; F290-F295 VanDerWaalsContact CE1-CE1 3.49Å; F290-F295 HydrophobicContact CE1-CZ 4.44Å; F290-F295 AromaticContact CG-CD1 3.94Å; F290-F295 HydrophobicContact CG-CD1 3.94Å; F290-F295 HydrophobicContact CG-CE1 4.45Å; F290-F295 HydrophobicContact CZ-CE1 4.48Å; F290-V296 HydrophobicContact CB-CG2 4.31Å; F290-V296 HydrophobicContact CD2-CG2 3.8Å; F290-V296 HydrophobicContact CE2-CG2 4.5Å; F290-V296 HydrophobicContact CG-CG2 4.2Å; F290-L300 HydrophobicContact CE1-CD1 4.41Å; F290-L300 HydrophobicContact CE2-CD1 3.9Å; F290-L300 HydrophobicContact CZ-CD1 3.82Å
291	K	52.3	Low	73.9	Confident	213 Å²	213	50.5 Å²	50.5	93%	0.926	23%	0.231	S	C	*	.	S	Bend	trans	-66.5	-21.9	-176.8	-72	-172.3	176.2	-176.4	0	113.7	R289	R289-K291 PolarHBondContact O-N 3.43Å
292	D	57.7	Low	72.6	Confident	78 Å²	78	50.9 Å²	50.9	42%	0.417	24%	0.235	S	C	.	.			trans	-128.9	129.6	-176.1	179.2	9.3	0	0	0	109.6	F290 Q294 F295	F290-D292 PolarHBondContact O-N 3Å; D292-Q294 PolarHBondContact O-N 2.82Å; D292-Q294 WeakPolarHBondContact OD1-CB 3.41Å; D292-Q294 WeakPolarHBondContact OD1-CG 3.43Å; D292-Q294 PolarHBondContact OD1-N 3.14Å; D292-Q294 WeakPolarHBondContact OD2-CB 3.23Å; D292-F295 HydrophobicContact CB-CB 4.48Å; D292-F295 VanDerWaalsContact O-CB 3.24Å; D292-F295 WeakPolarHBondContact O-CB 3.38Å; D292-F295 PolarHBondContact O-N 3.23Å
293	V	61.1	Low	71.5	Confident	87 Å²	87	53.1 Å²	53.1	53%	0.527	24%	0.243	S	C	.	.	H	α-helix	trans	-62.8	-30.1	174.4	-179.3	0	0	0	0	110.7	F295 V296 D297 R323	V293-F295 PolarHBondContact O-N 2.92Å; V293-V296 PolarHBondContact O-N 3.26Å; V293-D297 PolarHBondContact O-N 3Å; V293-R323 HydrophobicContact CG1-CG 4.15Å
294	Q	61.6	Low	70.1	Confident	100 Å²	100	61.3 Å²	61.3	47%	0.467	28%	0.279	S	S	.	.	H	α-helix	trans	-68.3	-19.8	174.8	-47.8	-177.4	39.4	0	0	112.6	D292 D297 K298	D292-Q294 PolarHBondContact O-N 2.82Å; D292-Q294 WeakPolarHBondContact OD1-CB 3.41Å; D292-Q294 WeakPolarHBondContact OD1-CG 3.43Å; D292-Q294 PolarHBondContact OD1-N 3.14Å; D292-Q294 WeakPolarHBondContact OD2-CB 3.23Å; Q294-D297 PolarHBondContact O-N 2.88Å; Q294-K298 HydrophobicContact CB-CD 4.13Å; Q294-K298 HydrophobicContact CB-CG 4.5Å; Q294-K298 WeakPolarHBondContact O-CB 3.42Å; Q294-K298 WeakPolarHBondContact O-CG 3.38Å; Q294-K298 PolarHBondContact O-N 2.59Å; Q294-K298 VanDerWaalsContact OE1-CE 3.31Å
295	F	66.3	Low	68.2	Low	70 Å²	70	65.6 Å²	65.6	31%	0.307	31%	0.314	S	S	.	.	H	α-helix	trans	-64.1	-45.7	173.6	-174.6	-82.8	0	0	0	110.9	F290 D292 V293 Q299 L300	F290-F295 HydrophobicContact CB-CD1 4.35Å; F290-F295 AromaticContact CD1-CD1 3.33Å; F290-F295 HydrophobicContact CD1-CD1 3.33Å; F290-F295 AromaticContact CD1-CE1 3.46Å; F290-F295 HydrophobicContact CD1-CE1 3.46Å; F290-F295 VanDerWaalsContact CD1-CE1 3.46Å; F290-F295 HydrophobicContact CD1-CG 4.22Å; F290-F295 HydrophobicContact CD1-CZ 4.41Å; F290-F295 AromaticContact CE1-CD1 3.82Å; F290-F295 HydrophobicContact CE1-CD1 3.82Å; F290-F295 AromaticContact CE1-CE1 3.49Å; F290-F295 HydrophobicContact CE1-CE1 3.49Å; F290-F295 VanDerWaalsContact CE1-CE1 3.49Å; F290-F295 HydrophobicContact CE1-CZ 4.44Å; F290-F295 AromaticContact CG-CD1 3.94Å; F290-F295 HydrophobicContact CG-CD1 3.94Å; F290-F295 HydrophobicContact CG-CE1 4.45Å; F290-F295 HydrophobicContact CZ-CE1 4.48Å; D292-F295 HydrophobicContact CB-CB 4.48Å; D292-F295 VanDerWaalsContact O-CB 3.24Å; D292-F295 WeakPolarHBondContact O-CB 3.38Å; D292-F295 PolarHBondContact O-N 3.23Å; V293-F295 PolarHBondContact O-N 2.92Å; F295-Q299 HydrophobicContact CD1-CB 4.32Å; F295-Q299 HydrophobicContact CD2-CB 4.33Å; F295-Q299 HydrophobicContact CD2-CG 3.71Å; F295-Q299 HydrophobicContact CE1-CB 4.17Å; F295-Q299 HydrophobicContact CE2-CB 4.19Å; F295-Q299 HydrophobicContact CE2-CG 3.79Å; F295-Q299 HydrophobicContact CG-CB 4.39Å; F295-Q299 HydrophobicContact CG-CG 4.08Å; F295-Q299 HydrophobicContact CZ-CB 4.1Å; F295-Q299 HydrophobicContact CZ-CG 4.23Å; F295-Q299 WeakPolarHBondContact O-CA 3.47Å; F295-Q299 VanDerWaalsContact O-CB 3.26Å; F295-Q299 WeakPolarHBondContact O-CB 3.42Å; F295-Q299 PolarHBondContact O-N 3.29Å; F295-L300 HydrophobicContact CD1-CG 4.38Å; F295-L300 HydrophobicContact CE1-CD2 3.98Å; F295-L300 HydrophobicContact CE1-CG 4.21Å; F295-L300 PolarHBondContact O-N 2.94Å
296	V	65.9	Low	66.6	Low	8 Å²	8	68 Å²	68	5%	0.048	33%	0.331	C	S	.	.	I	π-helix	trans	-58.7	-52.6	175.2	-179.9	0	0	0	0	109.5	F290 V293 K298 L300 F301 L322	F290-V296 HydrophobicContact CB-CG2 4.31Å; F290-V296 HydrophobicContact CD2-CG2 3.8Å; F290-V296 HydrophobicContact CE2-CG2 4.5Å; F290-V296 HydrophobicContact CG-CG2 4.2Å; V293-V296 PolarHBondContact O-N 3.26Å; V296-K298 PolarHBondContact O-N 3.01Å; V296-L300 HydrophobicContact CG1-CD1 4.44Å; V296-L300 HydrophobicContact CG2-CD1 4.41Å; V296-L300 WeakPolarHBondContact O-CB 3.42Å; V296-L300 PolarHBondContact O-N 3.47Å; V296-F301 HydrophobicContact CG1-CD2 3.92Å; V296-F301 HydrophobicContact CG1-CE2 3.89Å; V296-F301 WeakPolarHBondContact O-CD2 3.26Å; V296-F301 PolarHBondContact O-N 2.85Å; V296-F301 VanDerWaalsContact O-N 3.13Å; V296-L322 HydrophobicContact CG1-CB 4.46Å; V296-L322 HydrophobicContact CG1-CD1 4.05Å
297	D	65.7	Low	65.1	Low	16 Å²	16	75.6 Å²	75.6	9%	0.086	36%	0.364	C	S	.	.	I	π-helix	trans	-62.4	-43.1	-178.4	-87.1	45.3	0	0	0	114.7	V293 Q294 G302 W303 K313 R323	V293-D297 PolarHBondContact O-N 3Å; Q294-D297 PolarHBondContact O-N 2.88Å; D297-G302 CarbonylContact O-C 3.56Å; D297-G302 VanDerWaalsContact O-CA 3.25Å; D297-G302 WeakPolarHBondContact O-CA 3.27Å; D297-G302 PolarHBondContact O-N 3.48Å; D297-W303 PolarHBondContact O-N 3.35Å; D297-K313 WeakPolarHBondContact OD2-CD 3.33Å; D297-K313 IonicContact OD2-NZ 3.13Å; D297-K313 PolarHBondContact OD2-NZ 2.91Å; D297-R323 IonicContact OD1-CZ 3.58Å; D297-R323 IonicContact OD1-NE 3.76Å; D297-R323 IonicContact OD1-NH2 2.7Å; D297-R323 PolarHBondContact OD1-NH2 3.13Å; D297-R323 IonicContact OD2-NH2 3.05Å; D297-R323 PolarHBondContact OD2-NH2 2.85Å
298	K	66.1	Low	63.8	Low	120 Å²	120	83.3 Å²	83.3	52%	0.522	40%	0.397	S	S	.	.	I	π-helix	trans	-97.6	-27.2	-169.7	-66.5	177.3	171.4	172.4	0	114.3	Q294 V296 G302	Q294-K298 HydrophobicContact CB-CD 4.13Å; Q294-K298 HydrophobicContact CB-CG 4.5Å; Q294-K298 WeakPolarHBondContact O-CB 3.42Å; Q294-K298 WeakPolarHBondContact O-CG 3.38Å; Q294-K298 PolarHBondContact O-N 2.59Å; Q294-K298 VanDerWaalsContact OE1-CE 3.31Å; V296-K298 PolarHBondContact O-N 3.01Å; K298-G302 WeakPolarHBondContact O-CA 3.14Å
299	Q	66.1	Low	62.8	Low	60 Å²	60	84.7 Å²	84.7	28%	0.28	40%	0.404	S	S	.	.	I	π-helix	trans	-103.7	-48.2	-178.1	-49.7	-61.9	5.2	0	0	111.9	L259 R263 F295	L259-Q299 HydrophobicContact CD2-CG 4.42Å; R263-Q299 WeakPolarHBondContact CB-O 3.39Å; R263-Q299 WeakPolarHBondContact CG-O 3.37Å; F295-Q299 HydrophobicContact CD1-CB 4.32Å; F295-Q299 HydrophobicContact CD2-CB 4.33Å; F295-Q299 HydrophobicContact CD2-CG 3.71Å; F295-Q299 HydrophobicContact CE1-CB 4.17Å; F295-Q299 HydrophobicContact CE2-CB 4.19Å; F295-Q299 HydrophobicContact CE2-CG 3.79Å; F295-Q299 HydrophobicContact CG-CB 4.39Å; F295-Q299 HydrophobicContact CG-CG 4.08Å; F295-Q299 HydrophobicContact CZ-CB 4.1Å; F295-Q299 HydrophobicContact CZ-CG 4.23Å; F295-Q299 WeakPolarHBondContact O-CA 3.47Å; F295-Q299 VanDerWaalsContact O-CB 3.26Å; F295-Q299 WeakPolarHBondContact O-CB 3.42Å; F295-Q299 PolarHBondContact O-N 3.29Å
300	L	74	Confident	62.2	Low	3 Å²	3	82.6 Å²	82.6	2%	0.016	40%	0.4	C	S	.	.	I	π-helix	trans	-77.6	-51	-176.7	-53.5	-174.6	0	0	0	112.1	W253 N266 F290 F295 V296	W253-L300 HydrophobicContact CE3-CD2 4.44Å; W253-L300 HydrophobicContact CH2-CD2 3.54Å; W253-L300 HydrophobicContact CZ3-CD2 3.44Å; W253-L300 VanDerWaalsContact CZ3-CD2 3.44Å; N266-L300 PolarHBondContact ND2-O 2.95Å; F290-L300 HydrophobicContact CE1-CD1 4.41Å; F290-L300 HydrophobicContact CE2-CD1 3.9Å; F290-L300 HydrophobicContact CZ-CD1 3.82Å; F295-L300 HydrophobicContact CD1-CG 4.38Å; F295-L300 HydrophobicContact CE1-CD2 3.98Å; F295-L300 HydrophobicContact CE1-CG 4.21Å; F295-L300 PolarHBondContact O-N 2.94Å; V296-L300 HydrophobicContact CG1-CD1 4.44Å; V296-L300 HydrophobicContact CG2-CD1 4.41Å; V296-L300 WeakPolarHBondContact O-CB 3.42Å; V296-L300 PolarHBondContact O-N 3.47Å
301	F	73.7	Confident	61.8	Low	30 Å²	30	88.8 Å²	88.8	13%	0.132	43%	0.427	C	S	.	.	S	Bend	trans	-94.2	-29.8	177.3	-64.2	-83.6	0	0	0	111.9	R263 L270 V296 W303 V318 V319 L322	R263-F301 VanDerWaalsContact CZ-O 3.25Å; R263-F301 PolarHBondContact NE-O 3.33Å; R263-F301 VanDerWaalsContact NE-O 3.1Å; R263-F301 PolarHBondContact NH2-O 3.32Å; L270-F301 HydrophobicContact CD1-CE1 3.51Å; L270-F301 HydrophobicContact CD1-CZ 3.58Å; V296-F301 HydrophobicContact CG1-CD2 3.92Å; V296-F301 HydrophobicContact CG1-CE2 3.89Å; V296-F301 WeakPolarHBondContact O-CD2 3.26Å; V296-F301 PolarHBondContact O-N 2.85Å; V296-F301 VanDerWaalsContact O-N 3.13Å; F301-W303 HydrophobicContact CB-CD2 3.78Å; F301-W303 HydrophobicContact CB-CE3 3.51Å; F301-W303 HydrophobicContact CB-CG 4.44Å; F301-W303 HydrophobicContact CB-CH2 4.34Å; F301-W303 HydrophobicContact CB-CZ3 3.84Å; F301-W303 HydrophobicContact CD1-CH2 4.18Å; F301-W303 HydrophobicContact CD1-CZ2 4.43Å; F301-W303 HydrophobicContact CD1-CZ3 4.37Å; F301-W303 HydrophobicContact CD2-CZ3 4.41Å; F301-W303 HydrophobicContact CG-CE3 4.13Å; F301-W303 HydrophobicContact CG-CH2 4.2Å; F301-W303 AromaticContact CG-CZ3 3.92Å; F301-W303 HydrophobicContact CG-CZ3 3.92Å; F301-W303 PolarHBondContact O-N 2.81Å; F301-V318 HydrophobicContact CZ-CB 4.46Å; F301-V318 HydrophobicContact CZ-CG1 3.7Å; F301-V319 HydrophobicContact CD1-CG2 4.28Å; F301-V319 HydrophobicContact CD2-CG2 3.67Å; F301-V319 HydrophobicContact CE1-CG2 4.03Å; F301-V319 HydrophobicContact CE2-CG2 3.42Å; F301-V319 VanDerWaalsContact CE2-CG2 3.42Å; F301-V319 HydrophobicContact CG-CG2 4.13Å; F301-V319 HydrophobicContact CZ-CG2 3.63Å; F301-L322 HydrophobicContact CE2-CD1 4.17Å
302	G	65.7	Low	62.1	Low	8 Å²	8	80.8 Å²	80.8	8%	0.082	40%	0.4	C	S	.	.			trans	55.4	34.8	179.4	0	0	0	0	0	115.4	R263 D297 K298	R263-G302 PolarHBondContact NH1-O 3.38Å; R263-G302 PolarHBondContact NH2-O 2.91Å; D297-G302 CarbonylContact O-C 3.56Å; D297-G302 VanDerWaalsContact O-CA 3.25Å; D297-G302 WeakPolarHBondContact O-CA 3.27Å; D297-G302 PolarHBondContact O-N 3.48Å; K298-G302 WeakPolarHBondContact O-CA 3.14Å
303	W	68.7	Low	62.1	Low	47 Å²	47	78.1 Å²	78.1	18%	0.178	39%	0.385	C	S	.	.			trans	-70.7	127.3	168.1	-71.9	-51.5	0	0	0	110.1	D297 F301 D309 A312 K313 C316 V319	D297-W303 PolarHBondContact O-N 3.35Å; F301-W303 HydrophobicContact CB-CD2 3.78Å; F301-W303 HydrophobicContact CB-CE3 3.51Å; F301-W303 HydrophobicContact CB-CG 4.44Å; F301-W303 HydrophobicContact CB-CH2 4.34Å; F301-W303 HydrophobicContact CB-CZ3 3.84Å; F301-W303 HydrophobicContact CD1-CH2 4.18Å; F301-W303 HydrophobicContact CD1-CZ2 4.43Å; F301-W303 HydrophobicContact CD1-CZ3 4.37Å; F301-W303 HydrophobicContact CD2-CZ3 4.41Å; F301-W303 HydrophobicContact CG-CE3 4.13Å; F301-W303 HydrophobicContact CG-CH2 4.2Å; F301-W303 AromaticContact CG-CZ3 3.92Å; F301-W303 HydrophobicContact CG-CZ3 3.92Å; F301-W303 PolarHBondContact O-N 2.81Å; W303-D309 VanDerWaalsContact CA-OD2 3.3Å; W303-D309 WeakPolarHBondContact CA-OD2 3.11Å; W303-D309 HydrophobicContact CB-CB 4.02Å; W303-D309 HydrophobicContact CG-CB 4.24Å; W303-A312 HydrophobicContact CZ2-CB 4.42Å; W303-K313 HydrophobicContact CB-CG 4.45Å; W303-K313 HydrophobicContact CD2-CG 3.77Å; W303-K313 HydrophobicContact CE3-CB 4.34Å; W303-K313 HydrophobicContact CE3-CD 4.39Å; W303-K313 HydrophobicContact CE3-CG 3.32Å; W303-K313 HydrophobicContact CG-CG 4.31Å; W303-K313 HydrophobicContact CH2-CG 4.31Å; W303-K313 HydrophobicContact CZ3-CB 4.15Å; W303-K313 HydrophobicContact CZ3-CG 3.61Å; W303-K313 PolarHBondContact O-NZ 3.11Å; W303-C316 HydrophobicContact CH2-CB 3.88Å; W303-C316 HydrophobicContact CZ2-CB 4.48Å; W303-V319 HydrophobicContact CH2-CB 4.48Å; W303-V319 HydrophobicContact CH2-CG2 3.83Å; W303-V319 HydrophobicContact CZ3-CB 4.37Å; W303-V319 HydrophobicContact CZ3-CG1 4.2Å; W303-V319 HydrophobicContact CZ3-CG2 3.74Å
304	K	60.8	Low	61.9	Low	173 Å²	173	78.6 Å²	78.6	75%	0.752	39%	0.388	S	S	*	.			trans	-77.9	-172.4	175.9	-65.8	-174.9	177.2	-177.7	0	109.7	S306 D309	K304-S306 PolarHBondContact O-N 2.84Å; K304-S306 VanDerWaalsContact O-N 3.14Å; K304-D309 PolarHBondContact N-OD2 3.47Å
305	A	51.5	Low	62.1	Low	90 Å²	90	82.2 Å²	82.2	74%	0.744	40%	0.402	S	S	*	.	S	Bend	trans	-76.2	8.9	-177.6	0	0	0	0	0	114.8
306	S	55.7	Low	62.5	Low	50 Å²	50	79.6 Å²	79.6	35%	0.35	39%	0.393	S	S	.	.			trans	-55.3	142.3	-174.3	166.3	0	0	0	0	113.6	K304 K308 D309 K310	K304-S306 PolarHBondContact O-N 2.84Å; K304-S306 VanDerWaalsContact O-N 3.14Å; S306-K308 PolarHBondContact O-N 3.41Å; S306-K308 PolarHBondContact OG-N 3.04Å; S306-K308 VanDerWaalsContact OG-N 3.14Å; S306-D309 PolarHBondContact O-N 2.87Å; S306-K310 WeakPolarHBondContact O-CG 3.37Å; S306-K310 PolarHBondContact O-N 3.33Å
307	K	54.7	Low	63.2	Low	189 Å²	189	80 Å²	80	82%	0.822	40%	0.395	S	S	*	.	H	α-helix	trans	-60.6	-32.7	172.4	-73.4	-175	178.6	178.9	0	112.1
308	K	58.8	Low	64.1	Low	179 Å²	179	79.2 Å²	79.2	78%	0.778	39%	0.391	S	S	*	.	H	α-helix	trans	-67.8	-48.7	174.3	-67.7	-173.2	176.2	-176.8	0	110.5	S306 K310 K311 A312	S306-K308 PolarHBondContact O-N 3.41Å; S306-K308 PolarHBondContact OG-N 3.04Å; S306-K308 VanDerWaalsContact OG-N 3.14Å; K308-K310 PolarHBondContact O-N 2.72Å; K308-K311 PolarHBondContact O-N 3.15Å; K308-K311 VanDerWaalsContact O-N 3.14Å; K308-A312 PolarHBondContact O-N 3.42Å
309	D	58.5	Low	64.6	Low	39 Å²	39	73.5 Å²	73.5	21%	0.209	37%	0.366	C	S	.	.	H	α-helix	trans	-57.9	-35.7	176.7	-65.7	17.9	0	0	0	112	W303 K304 S306 K311 A312 K313	W303-D309 VanDerWaalsContact CA-OD2 3.3Å; W303-D309 WeakPolarHBondContact CA-OD2 3.11Å; W303-D309 HydrophobicContact CB-CB 4.02Å; W303-D309 HydrophobicContact CG-CB 4.24Å; K304-D309 PolarHBondContact N-OD2 3.47Å; S306-D309 PolarHBondContact O-N 2.87Å; D309-K311 PolarHBondContact O-N 2.79Å; D309-A312 PolarHBondContact O-N 3Å; D309-K313 WeakPolarHBondContact O-CB 3.32Å; D309-K313 WeakPolarHBondContact O-CG 3.42Å; D309-K313 PolarHBondContact O-N 3.31Å
310	K	56.9	Low	65.2	Low	128 Å²	128	73 Å²	73	56%	0.557	36%	0.364	S	S	*	.	H	α-helix	trans	-59.5	-40.3	176.5	-75.4	-175.5	-178.4	-173.5	0	113.6	S306 K308	S306-K310 WeakPolarHBondContact O-CG 3.37Å; S306-K310 PolarHBondContact O-N 3.33Å; K308-K310 PolarHBondContact O-N 2.72Å
311	K	55.3	Low	65.7	Low	176 Å²	176	72.9 Å²	72.9	77%	0.765	36%	0.363	S	S	*	.	H	α-helix	trans	-70.4	-39.4	175.9	-71.9	-168.6	173.9	-172.4	0	111.7	K308 D309 K315	K308-K311 PolarHBondContact O-N 3.15Å; K308-K311 VanDerWaalsContact O-N 3.14Å; D309-K311 PolarHBondContact O-N 2.79Å; K311-K315 PolarHBondContact O-N 3.06Å
312	A	59.9	Low	66	Low	45 Å²	45	72.4 Å²	72.4	37%	0.372	36%	0.362	S	S	.	.	H	α-helix	trans	-66.3	-41.3	176.3	0	0	0	0	0	113.2	W303 K308 D309 V314 K315 C316	W303-A312 HydrophobicContact CZ2-CB 4.42Å; K308-A312 PolarHBondContact O-N 3.42Å; D309-A312 PolarHBondContact O-N 3Å; A312-V314 VanDerWaalsContact C-N 3.29Å; A312-V314 PolarHBondContact O-N 3.3Å; A312-K315 PolarHBondContact O-N 2.89Å; A312-C316 PolarHBondContact O-N 2.98Å
313	K	57.3	Low	66.4	Low	23 Å²	23	77 Å²	77	10%	0.1	38%	0.377	C	S	.	.	H	α-helix	trans	-53.1	-43.1	176.3	-79.3	164.8	-163.5	-79.7	0	112.8	D297 W303 D309	D297-K313 WeakPolarHBondContact OD2-CD 3.33Å; D297-K313 IonicContact OD2-NZ 3.13Å; D297-K313 PolarHBondContact OD2-NZ 2.91Å; W303-K313 HydrophobicContact CB-CG 4.45Å; W303-K313 HydrophobicContact CD2-CG 3.77Å; W303-K313 HydrophobicContact CE3-CB 4.34Å; W303-K313 HydrophobicContact CE3-CD 4.39Å; W303-K313 HydrophobicContact CE3-CG 3.32Å; W303-K313 HydrophobicContact CG-CG 4.31Å; W303-K313 HydrophobicContact CH2-CG 4.31Å; W303-K313 HydrophobicContact CZ3-CB 4.15Å; W303-K313 HydrophobicContact CZ3-CG 3.61Å; W303-K313 PolarHBondContact O-NZ 3.11Å; D309-K313 WeakPolarHBondContact O-CB 3.32Å; D309-K313 WeakPolarHBondContact O-CG 3.42Å; D309-K313 PolarHBondContact O-N 3.31Å
314	V	56.3	Low	66.7	Low	97 Å²	97	76.1 Å²	76.1	59%	0.588	38%	0.378	S	S	*	.	H	α-helix	trans	-76.4	-33.5	-174.9	175.9	0	0	0	0	112	A312 Q320	A312-V314 VanDerWaalsContact C-N 3.29Å; A312-V314 PolarHBondContact O-N 3.3Å; V314-Q320 PolarHBondContact O-NE2 3.14Å
315	K	66.4	Low	66.8	Low	175 Å²	175	78.2 Å²	78.2	76%	0.761	38%	0.381	S	S	*	.	H	α-helix	trans	-84.7	-10.8	-178.3	-71.7	-159.1	171.4	-158.3	0	115.3	K311 A312 P317	K311-K315 PolarHBondContact O-N 3.06Å; A312-K315 PolarHBondContact O-N 2.89Å; K315-P317 VanDerWaalsContact O-CD 3.27Å; K315-P317 WeakPolarHBondContact O-CD 3.28Å
316	C	75.4	Confident	67.3	Low	16 Å²	16	75.6 Å²	75.6	11%	0.108	35%	0.354	C	S	.	.			trans	-79.3	113.6	-175.9	-178.2	0	0	0	0	112.5	W303 A312 V318 V319 Q320	W303-C316 HydrophobicContact CH2-CB 3.88Å; W303-C316 HydrophobicContact CZ2-CB 4.48Å; A312-C316 PolarHBondContact O-N 2.98Å; C316-V318 VanDerWaalsContact C-N 3.34Å; C316-V318 PolarHBondContact O-N 3.08Å; C316-V319 HydrophobicContact CB-CB 4.16Å; C316-V319 HydrophobicContact CB-CG2 4.26Å; C316-V319 PolarHBondContact O-N 3.21Å; C316-Q320 PolarHBondContact O-N 3.42Å; C316-Q320 VanDerWaalsContact O-N 3.09Å
317	P	80.3	Confident	67.2	Low	15 Å²	15	77 Å²	77	10%	0.097	37%	0.368	C	S	.	.	H	α-helix	trans	-62.5	-37.1	-174.5	-24.7	36.2	0	0	0	113.5	K315 V319 Q320 F321	K315-P317 VanDerWaalsContact O-CD 3.27Å; K315-P317 WeakPolarHBondContact O-CD 3.28Å; P317-V319 PolarHBondContact O-N 2.84Å; P317-Q320 PolarHBondContact O-N 3.24Å; P317-F321 WeakPolarHBondContact O-CB 3.27Å; P317-F321 PolarHBondContact O-N 3.33Å
318	V	83.2	Confident	67.3	Low	0 Å²	0	69.1 Å²	69.1	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-57.1	-39.6	174.4	172.2	0	0	0	0	111.7	F163 L270 L282 F301 C316 L322	F163-V318 HydrophobicContact CB-CG2 3.79Å; F163-V318 HydrophobicContact CD1-CG2 4.25Å; F163-V318 HydrophobicContact CD2-CB 4.42Å; F163-V318 HydrophobicContact CD2-CG2 3.62Å; F163-V318 HydrophobicContact CE2-CG2 4.27Å; F163-V318 HydrophobicContact CG-CG2 3.61Å; L270-V318 HydrophobicContact CD2-CG1 4.16Å; L270-V318 HydrophobicContact CD2-CG2 4.41Å; L282-V318 HydrophobicContact CD1-CG2 4.08Å; L282-V318 HydrophobicContact CD2-CB 4.41Å; L282-V318 HydrophobicContact CD2-CG1 3.54Å; L282-V318 HydrophobicContact CD2-CG2 4.15Å; F301-V318 HydrophobicContact CZ-CB 4.46Å; F301-V318 HydrophobicContact CZ-CG1 3.7Å; C316-V318 VanDerWaalsContact C-N 3.34Å; C316-V318 PolarHBondContact O-N 3.08Å; V318-L322 HydrophobicContact CG1-CD1 3.95Å; V318-L322 HydrophobicContact CG1-CG 4.4Å; V318-L322 WeakPolarHBondContact O-CB 3.33Å; V318-L322 VanDerWaalsContact O-CG 3.29Å; V318-L322 WeakPolarHBondContact O-CG 3.24Å; V318-L322 PolarHBondContact O-N 2.97Å
319	V	78.5	Confident	66.5	Low	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-81.6	-33.8	-175.7	172.8	0	0	0	0	111.4	F301 W303 C316 P317 R323	F301-V319 HydrophobicContact CD1-CG2 4.28Å; F301-V319 HydrophobicContact CD2-CG2 3.67Å; F301-V319 HydrophobicContact CE1-CG2 4.03Å; F301-V319 HydrophobicContact CE2-CG2 3.42Å; F301-V319 VanDerWaalsContact CE2-CG2 3.42Å; F301-V319 HydrophobicContact CG-CG2 4.13Å; F301-V319 HydrophobicContact CZ-CG2 3.63Å; W303-V319 HydrophobicContact CH2-CB 4.48Å; W303-V319 HydrophobicContact CH2-CG2 3.83Å; W303-V319 HydrophobicContact CZ3-CB 4.37Å; W303-V319 HydrophobicContact CZ3-CG1 4.2Å; W303-V319 HydrophobicContact CZ3-CG2 3.74Å; C316-V319 HydrophobicContact CB-CB 4.16Å; C316-V319 HydrophobicContact CB-CG2 4.26Å; C316-V319 PolarHBondContact O-N 3.21Å; P317-V319 PolarHBondContact O-N 2.84Å; V319-R323 HydrophobicContact CG1-CG 4.4Å; V319-R323 VanDerWaalsContact O-CB 3.27Å; V319-R323 WeakPolarHBondContact O-CB 3.15Å; V319-R323 WeakPolarHBondContact O-CD 3.3Å; V319-R323 WeakPolarHBondContact O-CG 3.12Å; V319-R323 PolarHBondContact O-N 3Å
320	Q	78.2	Confident	65.5	Low	50 Å²	50	65.8 Å²	65.8	23%	0.234	33%	0.326	C	S	.	.	H	α-helix	trans	-57.6	-50.3	166	-65.4	172.7	-13.5	0	0	110.4	W132 V314 C316 P317 R323 S324	W132-Q320 VanDerWaalsContact CE2-OE1 3.31Å; W132-Q320 HydrophobicContact CH2-CB 4.21Å; W132-Q320 HydrophobicContact CZ2-CB 4.16Å; V314-Q320 PolarHBondContact O-NE2 3.14Å; C316-Q320 PolarHBondContact O-N 3.42Å; C316-Q320 VanDerWaalsContact O-N 3.09Å; P317-Q320 PolarHBondContact O-N 3.24Å; Q320-R323 PolarHBondContact O-N 3.35Å; Q320-S324 PolarHBondContact O-N 3.42Å
321	F	83.6	Confident	64.7	Low	1 Å²	1	65.4 Å²	65.4	0%	0.004	32%	0.322	C	S	.	.	H	α-helix	trans	-59.4	-49.3	176.7	169.7	-102.6	0	0	0	112.9	M152 M155 A159 L282 K286 P317 R323 S324 I326	M152-F321 HydrophobicContact CG-CE2 4.41Å; M152-F321 HydrophobicContact CG-CZ 4.19Å; M155-F321 HydrophobicContact CB-CD2 3.73Å; M155-F321 HydrophobicContact CB-CE2 3.76Å; A159-F321 HydrophobicContact CB-CB 3.56Å; A159-F321 HydrophobicContact CB-CD1 4.49Å; A159-F321 HydrophobicContact CB-CD2 4.48Å; A159-F321 HydrophobicContact CB-CG 3.93Å; L282-F321 HydrophobicContact CB-CD1 4.15Å; L282-F321 HydrophobicContact CB-CE1 3.83Å; L282-F321 HydrophobicContact CD1-CD1 4.49Å; L282-F321 WeakPolarHBondContact O-CE1 3.24Å; K286-F321 HydrophobicContact CB-CE1 4Å; K286-F321 HydrophobicContact CB-CZ 4.01Å; K286-F321 HydrophobicContact CD-CE1 4.07Å; K286-F321 HydrophobicContact CD-CZ 4Å; K286-F321 HydrophobicContact CG-CE1 4.31Å; K286-F321 HydrophobicContact CG-CZ 3.99Å; K286-F321 PolarHBondContact NZ-O 3.05Å; P317-F321 WeakPolarHBondContact O-CB 3.27Å; P317-F321 PolarHBondContact O-N 3.33Å; F321-R323 VanDerWaalsContact C-N 3.26Å; F321-R323 PolarHBondContact O-N 2.96Å; F321-S324 PolarHBondContact O-N 2.81Å; F321-S324 PolarHBondContact O-OG 3.24Å; F321-I326 HydrophobicContact CE2-CD1 4.26Å
322	L	80.9	Confident	63.9	Low	19 Å²	19	60.2 Å²	60.2	10%	0.099	30%	0.302	C	S	.	.	H	α-helix	trans	-62.2	-35.5	-179.9	-72.3	173.3	0	0	0	111.9	L285 K286 V296 F301 V318	L285-L322 HydrophobicContact CB-CD2 3.71Å; L285-L322 HydrophobicContact CD1-CD1 4.37Å; K286-L322 PolarHBondContact NZ-O 3.18Å; V296-L322 HydrophobicContact CG1-CB 4.46Å; V296-L322 HydrophobicContact CG1-CD1 4.05Å; F301-L322 HydrophobicContact CE2-CD1 4.17Å; V318-L322 HydrophobicContact CG1-CD1 3.95Å; V318-L322 HydrophobicContact CG1-CG 4.4Å; V318-L322 WeakPolarHBondContact O-CB 3.33Å; V318-L322 VanDerWaalsContact O-CG 3.29Å; V318-L322 WeakPolarHBondContact O-CG 3.24Å; V318-L322 PolarHBondContact O-N 2.97Å
323	R	74.2	Confident	62.8	Low	106 Å²	106	59.7 Å²	59.7	40%	0.4	30%	0.295	S	S	.	.	H	α-helix	trans	-78.9	-18.2	178.8	-71	173.3	172.9	-162.7	0.5	115.6	V293 D297 V319 Q320 F321	V293-R323 HydrophobicContact CG1-CG 4.15Å; D297-R323 IonicContact OD1-CZ 3.58Å; D297-R323 IonicContact OD1-NE 3.76Å; D297-R323 IonicContact OD1-NH2 2.7Å; D297-R323 PolarHBondContact OD1-NH2 3.13Å; D297-R323 IonicContact OD2-NH2 3.05Å; D297-R323 PolarHBondContact OD2-NH2 2.85Å; V319-R323 HydrophobicContact CG1-CG 4.4Å; V319-R323 VanDerWaalsContact O-CB 3.27Å; V319-R323 WeakPolarHBondContact O-CB 3.15Å; V319-R323 WeakPolarHBondContact O-CD 3.3Å; V319-R323 WeakPolarHBondContact O-CG 3.12Å; V319-R323 PolarHBondContact O-N 3Å; Q320-R323 PolarHBondContact O-N 3.35Å; F321-R323 VanDerWaalsContact C-N 3.26Å; F321-R323 PolarHBondContact O-N 2.96Å
324	S	74.3	Confident	61.8	Low	27 Å²	27	60.2 Å²	60.2	19%	0.189	31%	0.307	C	S	.	.	S	Bend	trans	-58.6	149.6	-177.9	71.1	0	0	0	0	112.4	K286 Q320 F321 I326	K286-S324 PolarHBondContact NZ-O 3.14Å; K286-S324 PolarHBondContact NZ-OG 2.86Å; Q320-S324 PolarHBondContact O-N 3.42Å; F321-S324 PolarHBondContact O-N 2.81Å; F321-S324 PolarHBondContact O-OG 3.24Å; S324-I326 WeakPolarHBondContact OG-CG1 3.47Å
325	R	63.8	Low	61	Low	217 Å²	217	58.5 Å²	58.5	82%	0.819	30%	0.298	S	S	*	.			trans	-92.2	104.2	174.4	-68.8	-174.9	179.5	178.2	1.7	109.4
326	I	60.7	Low	60	Low	35 Å²	35	54.5 Å²	54.5	18%	0.179	28%	0.284	C	S	.	.			trans	-116.5	118.2	176.4	-47.8	-178.3	0	0	0	108.7	G148 M152 M155 F321 S324 V328	G148-I326 VanDerWaalsContact O-CG2 3.29Å; G148-I326 WeakPolarHBondContact O-CG2 3.43Å; M152-I326 HydrophobicContact CB-CD1 4.1Å; M152-I326 HydrophobicContact CB-CG2 4.22Å; M152-I326 HydrophobicContact CG-CD1 4.12Å; M155-I326 HydrophobicContact SD-CD1 3.75Å; M155-I326 HydrophobicContact SD-CG1 4.41Å; F321-I326 HydrophobicContact CE2-CD1 4.26Å; S324-I326 WeakPolarHBondContact OG-CG1 3.47Å; I326-V328 HydrophobicContact CB-CG2 4.43Å; I326-V328 HydrophobicContact CG2-CG2 3.98Å; I326-V328 PolarHBondContact O-N 3.21Å; I326-V328 VanDerWaalsContact O-N 3.17Å
327	A	54.3	Low	58.8	Low	79 Å²	79	63 Å²	63	65%	0.653	31%	0.314	S	S	*	.			trans	-82.7	85.3	175.3	0	0	0	0	0	109.6	Q329	A327-Q329 VanDerWaalsContact C-N 3.35Å; A327-Q329 PolarHBondContact O-N 3.46Å
328	V	56.1	Low	57.8	Low	24 Å²	24	67.8 Å²	67.8	15%	0.145	35%	0.345	C	S	.	.			trans	-76.9	86.9	178.5	-170.9	0	0	0	0	109.9	L149 M152 L239 I326	L149-V328 HydrophobicContact CB-CG1 4.26Å; L149-V328 HydrophobicContact CD1-CG1 4.05Å; M152-V328 HydrophobicContact CB-CG2 4.34Å; M152-V328 HydrophobicContact SD-CG2 3.75Å; L239-V328 HydrophobicContact CD1-CG1 3.54Å; L239-V328 HydrophobicContact CD2-CG1 4.5Å; I326-V328 HydrophobicContact CB-CG2 4.43Å; I326-V328 HydrophobicContact CG2-CG2 3.98Å; I326-V328 PolarHBondContact O-N 3.21Å; I326-V328 VanDerWaalsContact O-N 3.17Å
329	Q	41.8	Very low	57.1	Low	105 Å²	105	69.4 Å²	69.4	49%	0.491	35%	0.353	S	S	.	.			trans	-88.9	143.3	158.5	-55.8	-155.4	84.2	0	0	108.9	D146 A327	D146-Q329 PolarHBondContact OD1-NE2 3.29Å; A327-Q329 VanDerWaalsContact C-N 3.35Å; A327-Q329 PolarHBondContact O-N 3.46Å
330	P	39	Very low	57	Low	43 Å²	43	72.7 Å²	72.7	28%	0.279	38%	0.376	S	S	.	.			trans	-69.8	128.8	166.4	26.9	-28.8	0	0	0	109.4	L236 L239 I332	L236-P330 HydrophobicContact CD1-CB 3.85Å; L236-P330 HydrophobicContact CD1-CG 4.32Å; L239-P330 HydrophobicContact CD2-CB 3.69Å; L239-P330 HydrophobicContact CD2-CG 3.98Å; P330-I332 HydrophobicContact CB-CG1 4.19Å; P330-I332 HydrophobicContact CG-CD1 4.5Å; P330-I332 HydrophobicContact CG-CG1 4.16Å; P330-I332 PolarHBondContact O-N 3.38Å
331	Y	39.3	Very low	57.2	Low	121 Å²	121	75 Å²	75	48%	0.475	40%	0.397	S	S	.	.			trans	-72.4	90.1	156.8	-170.4	-92.4	0	0	0	107.3	D146	D146-Y331 WeakPolarHBondContact O-CD2 3.49Å
332	I	38.7	Very low	57.4	Low	66 Å²	66	75.4 Å²	75.4	34%	0.338	40%	0.399	S	S	.	.			trans	-69.4	127.7	166.2	-58.2	173.9	0	0	0	105.6	P330 G334	P330-I332 HydrophobicContact CB-CG1 4.19Å; P330-I332 HydrophobicContact CG-CD1 4.5Å; P330-I332 HydrophobicContact CG-CG1 4.16Å; P330-I332 PolarHBondContact O-N 3.38Å; I332-G334 PolarHBondContact O-N 3.37Å
333	C	36.2	Very low	57.6	Low	34 Å²	34	76.8 Å²	76.8	23%	0.23	41%	0.41	C	S	.	.			trans	-52.7	112.5	170.2	-76.6	0	0	0	0	109.1	Y232 N233 C549	Y232-C333 HydrophobicContact CE2-CB 4.41Å; Y232-C333 WeakPolarHBondContact OH-CB 3.27Å; N233-C333 VanDerWaalsContact OD1-CB 3.32Å; N233-C333 WeakPolarHBondContact OD1-CB 3.41Å; N233-C333 PolarHBondContact OD1-N 3.32Å; N233-C333 PolarHBondContact OD1-SG 2.94Å; N233-C333 VanDerWaalsContact OD1-SG 3.36Å; C333-C549 PolarHBondContact O-SG 3.33Å
334	G	36.4	Very low	58	Low	34 Å²	34	76 Å²	76	35%	0.351	42%	0.421	S	S	.	.			trans	-61.2	171	168.8	0	0	0	0	0	110.6	I332 I336	I332-G334 PolarHBondContact O-N 3.37Å; G334-I336 PolarHBondContact O-N 3.32Å
335	P	39.8	Very low	58.6	Low	62 Å²	62	76.9 Å²	76.9	40%	0.403	42%	0.423	S	S	.	.			trans	-54.5	128.3	169.4	26.5	-35.5	0	0	0	110.3	R337 H552	P335-R337 PolarHBondContact O-N 3.13Å; P335-H552 HydrophobicContact CB-CB 4.3Å; P335-H552 VanDerWaalsContact CB-CD2 3.4Å; P335-H552 WeakPolarHBondContact CB-CD2 3.42Å; P335-H552 WeakPolarHBondContact CB-CE1 3.27Å; P335-H552 VanDerWaalsContact CB-CG 3.48Å; P335-H552 WeakPolarHBondContact CB-ND1 3.18Å; P335-H552 WeakPolarHBondContact CB-NE2 3.14Å; P335-H552 VanDerWaalsContact CG-CD2 3.49Å; P335-H552 WeakPolarHBondContact CG-CD2 3.47Å; P335-H552 WeakPolarHBondContact CG-NE2 3.45Å
336	I	45.6	Very low	59.8	Low	90 Å²	90	66.5 Å²	66.5	46%	0.462	38%	0.384	S	S	.	.	S	Bend	trans	-64.9	-23.1	-172.7	-57.6	178.8	0	0	0	111.2	I73 G334	I73-I336 HydrophobicContact CG1-CD1 3.9Å; I73-I336 HydrophobicContact CG1-CG1 4.38Å; G334-I336 PolarHBondContact O-N 3.32Å
337	R	51.2	Low	61.4	Low	196 Å²	196	65 Å²	65	74%	0.74	38%	0.376	S	S	*	.	S	Bend	trans	-132.6	138.2	178.9	-160.4	176.3	-163.8	153.8	5.8	110.3	P335 H552	P335-R337 PolarHBondContact O-N 3.13Å; R337-H552 PolarHBondContact O-CE1 2.91Å
338	P	59.3	Low	63.3	Low	115 Å²	115	61.2 Å²	61.2	75%	0.747	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-67.1	134.2	166.9	28.9	-33.7	0	0	0	110
339	I	68.4	Low	65.1	Low	34 Å²	34	60 Å²	60	17%	0.174	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-68.4	138.3	169.8	-71.4	160.8	0	0	0	109.3	V380 H552 L555 E556 V559	I339-V380 HydrophobicContact CB-CG1 4.41Å; I339-V380 HydrophobicContact CG2-CG1 3.73Å; I339-H552 WeakPolarHBondContact CD1-CE1 3.27Å; I339-H552 VanDerWaalsContact CD1-NE2 3.31Å; I339-H552 WeakPolarHBondContact CD1-NE2 3.36Å; I339-H552 WeakPolarHBondContact CG1-CE1 3.43Å; I339-L555 HydrophobicContact CD1-CB 3.85Å; I339-L555 HydrophobicContact CD1-CD2 3.8Å; I339-L555 HydrophobicContact CD1-CG 3.8Å; I339-E556 HydrophobicContact CD1-CB 3.87Å; I339-E556 HydrophobicContact CG1-CB 4.19Å; I339-E556 HydrophobicContact CG1-CG 4.29Å; I339-V559 HydrophobicContact CG2-CB 3.88Å; I339-V559 HydrophobicContact CG2-CG1 3.85Å; I339-V559 HydrophobicContact CG2-CG2 3.7Å
340	S	74.6	Confident	67.5	Low	69 Å²	69	55 Å²	55	48%	0.483	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-66.5	141.2	175.5	45	0	0	0	0	111.7
341	S	83.5	Confident	69.9	Low	97 Å²	97	53 Å²	53	68%	0.678	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-65.6	134.8	167.4	52.8	0	0	0	0	110.3
342	L	86.8	Confident	72.1	Confident	10 Å²	10	47.9 Å²	47.9	5%	0.052	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-70	160.5	172.6	-70	164	0	0	0	111.1	L346 F348 V380 A381 V559 L562	L342-L346 HydrophobicContact CD1-CD1 4.24Å; L342-L346 HydrophobicContact CD1-CD2 4.25Å; L342-F348 HydrophobicContact CD1-CE2 4.07Å; L342-F348 HydrophobicContact CD1-CZ 3.73Å; L342-V380 HydrophobicContact CD1-CG2 4.38Å; L342-V380 PolarHBondContact N-O 3.05Å; L342-A381 HydrophobicContact CB-CB 4.18Å; L342-A381 HydrophobicContact CD1-CB 4.15Å; L342-V559 HydrophobicContact CD1-CG2 4.16Å; L342-V559 HydrophobicContact CD2-CG1 4.08Å; L342-V559 HydrophobicContact CG-CG1 4.4Å; L342-V559 HydrophobicContact CG-CG2 4.26Å; L342-L562 HydrophobicContact CD1-CD1 3.64Å; L342-L562 HydrophobicContact CD2-CB 3.92Å; L342-L562 HydrophobicContact CD2-CD1 4.5Å
343	P	84.9	Confident	73.8	Confident	49 Å²	49	45.6 Å²	45.6	32%	0.318	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-50.9	140.7	177.2	-31.8	39.1	0	0	0	114.1	D345 L346 M566	P343-D345 WeakPolarHBondContact CB-OD1 3.43Å; P343-D345 PolarHBondContact O-N 3.2Å; P343-D345 VanDerWaalsContact O-N 3.13Å; P343-L346 WeakPolarHBondContact O-CB 3.4Å; P343-L346 PolarHBondContact O-N 3.29Å; P343-M566 HydrophobicContact CB-CE 3.91Å; P343-M566 HydrophobicContact CG-CE 3.75Å
344	S	83.7	Confident	75.2	Confident	90 Å²	90	45 Å²	45	63%	0.629	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-9.2	-167.9	80.6	0	0	0	0	114.8	K382	S344-K382 PolarHBondContact O-NZ 3.26Å
345	D	86.8	Confident	76.1	Confident	44 Å²	44	44 Å²	44	24%	0.235	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-17.6	171.9	72	-70	0	0	0	113.1	P343 R422 R423	P343-D345 WeakPolarHBondContact CB-OD1 3.43Å; P343-D345 PolarHBondContact O-N 3.2Å; P343-D345 VanDerWaalsContact O-N 3.13Å; D345-R422 WeakPolarHBondContact O-CB 3.26Å; D345-R422 WeakPolarHBondContact O-CG 3.39Å; D345-R423 PolarHBondContact O-N 2.77Å; D345-R423 IonicContact OD1-CZ 3.34Å; D345-R423 IonicContact OD1-NE 2.73Å; D345-R423 IonicContact OD1-NH2 3.08Å; D345-R423 PolarHBondContact OD1-NH2 3.32Å; D345-R423 IonicContact OD2-CZ 3.99Å; D345-R423 IonicContact OD2-NE 3.82Å; D345-R423 PolarHBondContact OD2-NE 2.83Å; D345-R423 IonicContact OD2-NH2 3.91Å; D345-R423 PolarHBondContact OD2-NH2 2.97Å; D345-R423 VanDerWaalsContact OD2-NH2 3.08Å
346	L	89.5	Confident	76.7	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.236	C	C	.	.			trans	-67.1	138.1	175	-174.2	147.2	0	0	0	110.3	L342 P343 F348 A381 R423 V425 M566	L342-L346 HydrophobicContact CD1-CD1 4.24Å; L342-L346 HydrophobicContact CD1-CD2 4.25Å; P343-L346 WeakPolarHBondContact O-CB 3.4Å; P343-L346 PolarHBondContact O-N 3.29Å; L346-F348 HydrophobicContact CD2-CD1 4.1Å; L346-F348 HydrophobicContact CD2-CD2 4.22Å; L346-F348 HydrophobicContact CD2-CE1 4.03Å; L346-F348 HydrophobicContact CD2-CE2 4.16Å; L346-F348 HydrophobicContact CD2-CG 4.18Å; L346-F348 HydrophobicContact CD2-CZ 4.06Å; L346-A381 HydrophobicContact CD2-CB 3.58Å; L346-R423 WeakPolarHBondContact CA-O 3.42Å; L346-V425 HydrophobicContact CD1-CG2 3.98Å; L346-V425 HydrophobicContact CG-CG2 4.21Å; L346-M566 HydrophobicContact CB-CE 3.96Å; L346-M566 HydrophobicContact CD1-CE 3.67Å; L346-M566 HydrophobicContact CD1-SD 3.93Å; L346-M566 HydrophobicContact CG-CE 4.38Å
347	L	92.7	Very high	77	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	114.3	176.4	175.1	61.2	0	0	0	110.7	L349 K384 N419 R422 R423 I424 V425	L347-L349 HydrophobicContact CD2-CD2 3.98Å; L347-L349 HydrophobicContact CG-CD2 4.05Å; L347-K384 HydrophobicContact CD1-CB 4.45Å; L347-K384 HydrophobicContact CD1-CD 4.43Å; L347-K384 HydrophobicContact CD1-CG 4.08Å; L347-K384 HydrophobicContact CD2-CD 4.33Å; L347-N419 HydrophobicContact CD2-CB 3.69Å; L347-N419 VanDerWaalsContact CD2-CG 3.43Å; L347-N419 VanDerWaalsContact CD2-OD1 3.3Å; L347-N419 WeakPolarHBondContact CD2-OD1 3.46Å; L347-R422 HydrophobicContact CB-CB 4.34Å; L347-R423 PolarHBondContact N-O 2.83Å; L347-I424 WeakPolarHBondContact O-CA 3.41Å; L347-V425 PolarHBondContact O-N 2.9Å
348	F	94.5	Very high	76.8	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	125.8	166.4	-72	-50.8	0	0	0	110.9	L342 L346 L350 L377 V380 A381 K382 V383 K384 V425 V427 I450 L562	L342-F348 HydrophobicContact CD1-CE2 4.07Å; L342-F348 HydrophobicContact CD1-CZ 3.73Å; L346-F348 HydrophobicContact CD2-CD1 4.1Å; L346-F348 HydrophobicContact CD2-CD2 4.22Å; L346-F348 HydrophobicContact CD2-CE1 4.03Å; L346-F348 HydrophobicContact CD2-CE2 4.16Å; L346-F348 HydrophobicContact CD2-CG 4.18Å; L346-F348 HydrophobicContact CD2-CZ 4.06Å; F348-L350 HydrophobicContact CB-CD2 3.81Å; F348-L350 HydrophobicContact CB-CG 4.31Å; F348-L350 HydrophobicContact CG-CD2 4.41Å; F348-L377 HydrophobicContact CD2-CB 4.28Å; F348-L377 HydrophobicContact CE2-CB 4.39Å; F348-L377 HydrophobicContact CE2-CD2 4.1Å; F348-L377 HydrophobicContact CZ-CD2 4.26Å; F348-V380 HydrophobicContact CE2-CG2 4.18Å; F348-A381 HydrophobicContact CD2-CB 3.73Å; F348-A381 HydrophobicContact CE2-CB 3.6Å; F348-K382 PolarHBondContact N-O 3.5Å; F348-V383 HydrophobicContact CB-CG1 4.05Å; F348-V383 HydrophobicContact CD2-CG1 4.17Å; F348-V383 CarbonylContact O-C 3.6Å; F348-V383 WeakPolarHBondContact O-CA 3.3Å; F348-K384 PolarHBondContact O-N 3.12Å; F348-V425 WeakPolarHBondContact CA-O 3.28Å; F348-V425 HydrophobicContact CD1-CB 3.81Å; F348-V425 HydrophobicContact CD1-CG1 3.84Å; F348-V425 HydrophobicContact CE1-CB 4.05Å; F348-V425 HydrophobicContact CE1-CG1 3.8Å; F348-V427 HydrophobicContact CB-CG2 4.47Å; F348-V427 HydrophobicContact CD1-CG2 3.54Å; F348-V427 HydrophobicContact CE1-CG2 4.06Å; F348-V427 HydrophobicContact CG-CG2 4.23Å; F348-I450 HydrophobicContact CE1-CD1 4.1Å; F348-L562 HydrophobicContact CE1-CD1 3.62Å; F348-L562 HydrophobicContact CZ-CD1 3.53Å
349	L	93.9	Very high	76.2	Confident	0 Å²	0	33 Å²	33	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	107	163.7	-62.5	-173.7	0	0	0	108.1	L347 L351 K384 V386 L412 L415 F416 I424 V425 L426 V427	L347-L349 HydrophobicContact CD2-CD2 3.98Å; L347-L349 HydrophobicContact CG-CD2 4.05Å; L349-L351 HydrophobicContact CB-CD1 4.36Å; L349-L351 WeakPolarHBondContact O-CD1 3.41Å; L349-K384 HydrophobicContact CD2-CB 3.86Å; L349-K384 HydrophobicContact CD2-CD 4.41Å; L349-V386 HydrophobicContact CB-CG2 4.1Å; L349-L412 HydrophobicContact CD1-CD2 3.89Å; L349-L415 HydrophobicContact CD1-CB 4.11Å; L349-L415 HydrophobicContact CD2-CD1 4.38Å; L349-F416 HydrophobicContact CD1-CE2 4.46Å; L349-I424 HydrophobicContact CD1-CG2 3.66Å; L349-I424 HydrophobicContact CG-CG2 3.94Å; L349-V425 PolarHBondContact N-O 3.21Å; L349-L426 HydrophobicContact CB-CD2 3.98Å; L349-L426 HydrophobicContact CD1-CD2 4.26Å; L349-V427 PolarHBondContact O-N 2.95Å
350	L	92.7	Very high	75.2	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	99.7	-173.4	-56.7	-174.7	0	0	0	110.5	F348 W352 F373 L377 V383 K384 V386 V427	F348-L350 HydrophobicContact CB-CD2 3.81Å; F348-L350 HydrophobicContact CB-CG 4.31Å; F348-L350 HydrophobicContact CG-CD2 4.41Å; L350-W352 PolarHBondContact O-N 2.97Å; L350-F373 HydrophobicContact CB-CD2 4.01Å; L350-F373 HydrophobicContact CB-CE2 4.1Å; L350-F373 HydrophobicContact CB-CG 4.34Å; L350-F373 HydrophobicContact CD1-CB 4.05Å; L350-F373 HydrophobicContact CD1-CD1 4.42Å; L350-F373 HydrophobicContact CD1-CG 4.11Å; L350-F373 HydrophobicContact CD2-CD1 4.5Å; L350-L377 HydrophobicContact CD2-CD1 3.66Å; L350-V383 HydrophobicContact CD1-CB 3.82Å; L350-V383 HydrophobicContact CD1-CG1 3.7Å; L350-V383 HydrophobicContact CD1-CG2 4.45Å; L350-V383 HydrophobicContact CG-CB 4.22Å; L350-V383 HydrophobicContact CG-CG1 4.23Å; L350-K384 PolarHBondContact N-O 3.13Å; L350-V386 PolarHBondContact O-N 3.21Å; L350-V427 HydrophobicContact CD2-CB 3.64Å; L350-V427 HydrophobicContact CD2-CG1 4.24Å; L350-V427 HydrophobicContact CD2-CG2 3.81Å
351	L	90.1	Very high	74	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	108.3	-178.9	-78.4	72.2	0	0	0	110.2	L349 V386 F408 L412 L426 V427 S432 P435 I436	L349-L351 HydrophobicContact CB-CD1 4.36Å; L349-L351 WeakPolarHBondContact O-CD1 3.41Å; L351-V386 HydrophobicContact CD1-CB 4.2Å; L351-V386 HydrophobicContact CD1-CG2 3.98Å; L351-V386 HydrophobicContact CG-CB 4.05Å; L351-V386 HydrophobicContact CG-CG1 4.46Å; L351-V386 HydrophobicContact CG-CG2 4.39Å; L351-F408 HydrophobicContact CB-CE1 3.77Å; L351-F408 HydrophobicContact CB-CE2 4.48Å; L351-F408 HydrophobicContact CB-CZ 3.7Å; L351-F408 HydrophobicContact CD2-CD1 3.67Å; L351-F408 HydrophobicContact CD2-CD2 4.4Å; L351-F408 HydrophobicContact CD2-CE1 3.73Å; L351-F408 HydrophobicContact CD2-CE2 4.37Å; L351-F408 HydrophobicContact CD2-CG 4.04Å; L351-F408 HydrophobicContact CD2-CZ 4.07Å; L351-F408 HydrophobicContact CG-CD1 3.89Å; L351-F408 HydrophobicContact CG-CE1 3.5Å; L351-F408 VanDerWaalsContact CG-CE1 3.5Å; L351-F408 HydrophobicContact CG-CZ 3.93Å; L351-L412 HydrophobicContact CD1-CD2 4.35Å; L351-L412 HydrophobicContact CD2-CD1 4.45Å; L351-L426 HydrophobicContact CD1-CD2 3.67Å; L351-V427 PolarHBondContact N-O 2.57Å; L351-S432 WeakPolarHBondContact O-CB 3.08Å; L351-S432 PolarHBondContact O-OG 3.37Å; L351-P435 HydrophobicContact CD2-CG 4.48Å; L351-I436 HydrophobicContact CB-CD1 4.48Å; L351-I436 HydrophobicContact CD1-CD1 4.41Å; L351-I436 HydrophobicContact CD1-CG1 4.49Å; L351-I436 HydrophobicContact CD2-CD1 4.26Å; L351-I436 HydrophobicContact CD2-CG1 3.74Å
352	W	85.7	Confident	72.4	Confident	14 Å²	14	35.3 Å²	35.3	5%	0.053	23%	0.227	C	C	.	.			trans	-64.1	141	-178.7	-76.7	83.7	0	0	0	112.1	L350 N354 A365 K370 F373 K374 H385 V386 I387 S432	L350-W352 PolarHBondContact O-N 2.97Å; W352-N354 PolarHBondContact O-N 3.16Å; W352-A365 HydrophobicContact CE3-CB 3.82Å; W352-A365 HydrophobicContact CZ3-CB 3.65Å; W352-K370 HydrophobicContact CH2-CG 4.29Å; W352-K370 HydrophobicContact CZ3-CG 4.13Å; W352-F373 HydrophobicContact CD2-CD2 4.05Å; W352-F373 AromaticContact CE2-CD2 3.95Å; W352-F373 HydrophobicContact CE3-CD2 4.36Å; W352-F373 HydrophobicContact CG-CD2 4.45Å; W352-F373 HydrophobicContact CH2-CB 4.01Å; W352-F373 HydrophobicContact CH2-CD2 4.39Å; W352-F373 HydrophobicContact CZ2-CB 3.91Å; W352-F373 HydrophobicContact CZ2-CD2 4.14Å; W352-K374 HydrophobicContact CH2-CD 4.07Å; W352-K374 HydrophobicContact CH2-CG 3.92Å; W352-K374 HydrophobicContact CZ2-CD 4.45Å; W352-K374 HydrophobicContact CZ2-CG 4.02Å; W352-H385 AromaticContact CE2-ND1 3.81Å; W352-H385 AromaticContact CZ2-CE1 3.99Å; W352-H385 AromaticContact CZ2-ND1 3.94Å; W352-H385 AromaticContact NE1-CG 3.42Å; W352-H385 AromaticContact NE1-ND1 3.13Å; W352-H385 PolarHBondContact NE1-ND1 3.18Å; W352-H385 VanDerWaalsContact NE1-ND1 3.13Å; W352-V386 PolarHBondContact N-O 3.23Å; W352-I387 HydrophobicContact CB-CG1 4.48Å; W352-I387 HydrophobicContact CG-CG1 4.11Å; W352-S432 WeakPolarHBondContact O-CB 3.13Å
353	P	74.3	Confident	70.8	Confident	18 Å²	18	39 Å²	39	12%	0.117	25%	0.246	C	C	.	.	S	Bend	trans	-68.6	-21	-177.7	25.8	-34.4	0	0	0	113.8	A365 W429 V431	P353-A365 HydrophobicContact CG-CB 4.34Å; P353-W429 HydrophobicContact CB-CB 4.3Å; P353-W429 WeakPolarHBondContact CB-O 3.28Å; P353-W429 HydrophobicContact CG-CB 4.38Å; P353-V431 WeakPolarHBondContact O-CG2 3.4Å
354	N	64.5	Low	69.8	Low	20 Å²	20	43.5 Å²	43.5	11%	0.107	26%	0.263	C	S	.	.			trans	-80.6	124.6	-170.9	-50.8	-10.4	0	0	0	111.4	W352 H356 P362 E364 A365 P388	W352-N354 PolarHBondContact O-N 3.16Å; N354-H356 WeakPolarHBondContact CB-NE2 3.45Å; N354-H356 PolarHBondContact ND2-NE2 3.34Å; N354-P362 PolarHBondContact ND2-O 3.23Å; N354-E364 PolarHBondContact ND2-N 3.28Å; N354-A365 PolarHBondContact ND2-N 3.45Å; N354-A365 WeakPolarHBondContact OD1-CA 3.29Å; N354-A365 PolarHBondContact OD1-N 2.77Å; N354-P388 WeakPolarHBondContact O-CG 3.48Å
355	V	55.4	Low	69.2	Low	15 Å²	15	39.5 Å²	39.5	9%	0.091	24%	0.235	C	C	.	.			trans	-96.1	103.4	158.8	-153.7	0	0	0	0	107.4	V391 Y400 F404	V355-V391 HydrophobicContact CG1-CB 4.4Å; V355-V391 HydrophobicContact CG1-CG2 3.64Å; V355-Y400 HydrophobicContact CB-CE2 3.91Å; V355-Y400 WeakPolarHBondContact CB-OH 3.5Å; V355-Y400 HydrophobicContact CG1-CE2 3.96Å; V355-Y400 HydrophobicContact CG2-CE1 4.25Å; V355-Y400 HydrophobicContact CG2-CE2 4.37Å; V355-Y400 VanDerWaalsContact CG2-OH 3.28Å; V355-Y400 WeakPolarHBondContact CG2-OH 3.21Å; V355-F404 HydrophobicContact CB-CD2 4.15Å; V355-F404 HydrophobicContact CB-CE2 4.38Å; V355-F404 HydrophobicContact CG1-CB 4.41Å; V355-F404 HydrophobicContact CG1-CD2 3.77Å; V355-F404 HydrophobicContact CG1-CE2 4.43Å; V355-F404 HydrophobicContact CG1-CG 4.42Å; V355-F404 HydrophobicContact CG2-CD2 3.37Å; V355-F404 HydrophobicContact CG2-CE2 3.35Å; V355-F404 HydrophobicContact CG2-CG 3.97Å; V355-F404 HydrophobicContact CG2-CZ 3.96Å
356	H	53.3	Low	68.9	Low	13 Å²	13	39.6 Å²	39.6	6%	0.06	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-72.6	138.5	177.5	-73.5	-67.1	0	0	0	110.4	N354 S360 N361 P362 P390 V391	N354-H356 WeakPolarHBondContact CB-NE2 3.45Å; N354-H356 PolarHBondContact ND2-NE2 3.34Å; H356-S360 WeakPolarHBondContact CB-OG 3.44Å; H356-S360 PolarHBondContact ND1-OG 3.32Å; H356-N361 PolarHBondContact CE1-O 3.28Å; H356-N361 PolarHBondContact ND1-O 2.88Å; H356-P362 VanDerWaalsContact CE1-CA 3.45Å; H356-P362 WeakPolarHBondContact CE1-CA 3.37Å; H356-P362 VanDerWaalsContact NE2-C 3.29Å; H356-P362 VanDerWaalsContact NE2-CA 3.26Å; H356-P362 WeakPolarHBondContact NE2-CA 3.4Å; H356-P362 PolarHBondContact NE2-O 3.16Å; H356-P390 HydrophobicContact CB-CB 4.38Å; H356-P390 CarbonylContact O-C 3.59Å; H356-P390 WeakPolarHBondContact O-CA 3.42Å; H356-P390 WeakPolarHBondContact O-CB 3.42Å; H356-V391 PolarHBondContact O-N 3.09Å
357	Y	52	Low	68.6	Low	84 Å²	84	46.8 Å²	46.8	33%	0.329	27%	0.268	S	S	.	.	B	Isolated β-bridge	trans	-73.1	147.7	159.7	-75.1	-63.8	0	0	0	109.1	G359 S360 V391 R393 Y400	Y357-G359 PolarHBondContact O-N 3.09Å; Y357-S360 PolarHBondContact N-OG 2.88Å; Y357-S360 WeakPolarHBondContact O-CB 3.19Å; Y357-S360 PolarHBondContact O-N 3.39Å; Y357-S360 PolarHBondContact O-OG 3.24Å; Y357-V391 WeakPolarHBondContact CA-O 3.49Å; Y357-R393 HydrophobicContact CD1-CB 4.31Å; Y357-R393 HydrophobicContact CD1-CG 3.64Å; Y357-R393 HydrophobicContact CE1-CG 4.48Å; Y357-R393 HydrophobicContact CG-CG 3.77Å; Y357-Y400 HydrophobicContact CE1-CE2 4.46Å
358	A	46.8	Very low	68.3	Low	50 Å²	50	47.1 Å²	47.1	41%	0.413	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	127	169.3	0	0	0	0	0	110.3	V391	A358-V391 PolarHBondContact N-O 2.69Å; A358-V391 VanDerWaalsContact N-O 3.13Å
359	G	45.6	Very low	68	Low	85 Å²	85	47.1 Å²	47.1	88%	0.876	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	15.8	-175.1	0	0	0	0	0	116.6	Y357	Y357-G359 PolarHBondContact O-N 3.09Å
360	S	47	Very low	67.7	Low	30 Å²	30	49.8 Å²	49.8	21%	0.21	28%	0.281	C	S	.	.	S	Bend	trans	-105	148.8	168.5	61.6	0	0	0	0	112.2	H356 Y357	H356-S360 WeakPolarHBondContact CB-OG 3.44Å; H356-S360 PolarHBondContact ND1-OG 3.32Å; Y357-S360 PolarHBondContact N-OG 2.88Å; Y357-S360 WeakPolarHBondContact O-CB 3.19Å; Y357-S360 PolarHBondContact O-N 3.39Å; Y357-S360 PolarHBondContact O-OG 3.24Å
361	N	50.9	Low	67.4	Low	137 Å²	137	52.6 Å²	52.6	73%	0.733	30%	0.296	S	S	*	.			trans	-74.6	136.8	-176.7	-95.9	-21	0	0	0	111.6	H356 D363	H356-N361 PolarHBondContact CE1-O 3.28Å; H356-N361 PolarHBondContact ND1-O 2.88Å; N361-D363 PolarHBondContact O-N 2.83Å
362	P	49.3	Very low	67.4	Low	81 Å²	81	52.6 Å²	52.6	53%	0.526	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	6.3	-168.1	27.1	-35.6	0	0	0	117	N354 H356	N354-P362 PolarHBondContact ND2-O 3.23Å; H356-P362 VanDerWaalsContact CE1-CA 3.45Å; H356-P362 WeakPolarHBondContact CE1-CA 3.37Å; H356-P362 VanDerWaalsContact NE2-C 3.29Å; H356-P362 VanDerWaalsContact NE2-CA 3.26Å; H356-P362 WeakPolarHBondContact NE2-CA 3.4Å; H356-P362 PolarHBondContact NE2-O 3.16Å
363	D	53.9	Low	67.6	Low	87 Å²	87	51.9 Å²	51.9	47%	0.465	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	24.9	-164.3	-124.7	-29.4	0	0	0	113.9	N361 A365 K370 K374	N361-D363 PolarHBondContact O-N 2.83Å; D363-A365 PolarHBondContact O-N 3.36Å; D363-K370 WeakPolarHBondContact O-CE 3.49Å; D363-K370 PolarHBondContact O-NZ 2.93Å; D363-K370 WeakPolarHBondContact OD1-CE 3.17Å; D363-K370 IonicContact OD1-NZ 3.11Å; D363-K374 IonicContact OD1-NZ 2.79Å; D363-K374 PolarHBondContact OD1-NZ 3.04Å; D363-K374 VanDerWaalsContact OD1-NZ 3.13Å; D363-K374 IonicContact OD2-NZ 2.59Å
364	E	63.3	Low	68.3	Low	144 Å²	144	56.4 Å²	56.4	67%	0.673	31%	0.311	S	S	*	.			trans	-73.6	1.1	179.2	-66.8	-176.9	173.5	0	0	114.5	N354	N354-E364 PolarHBondContact ND2-N 3.28Å
365	A	70.8	Confident	69.3	Low	5 Å²	5	64.5 Å²	64.5	4%	0.041	34%	0.34	C	S	.	.	S	Bend	trans	-67.2	139.6	179.7	0	0	0	0	0	111.1	W352 P353 N354 D363 K370	W352-A365 HydrophobicContact CE3-CB 3.82Å; W352-A365 HydrophobicContact CZ3-CB 3.65Å; P353-A365 HydrophobicContact CG-CB 4.34Å; N354-A365 PolarHBondContact ND2-N 3.45Å; N354-A365 WeakPolarHBondContact OD1-CA 3.29Å; N354-A365 PolarHBondContact OD1-N 2.77Å; D363-A365 PolarHBondContact O-N 3.36Å; A365-K370 HydrophobicContact CB-CG 4.29Å; A365-K370 WeakPolarHBondContact O-CD 3.44Å; A365-K370 WeakPolarHBondContact O-CE 3.32Å; A365-K370 PolarHBondContact O-NZ 3.07Å
366	H	80.1	Confident	70.8	Confident	46 Å²	46	65.3 Å²	65.3	21%	0.213	34%	0.343	C	S	.	.			trans	-65.5	155.5	178.5	63.7	-95.2	0	0	0	111.8	N368 C369 K370 W429 N532	H366-N368 VanDerWaalsContact C-N 3.3Å; H366-N368 PolarHBondContact O-N 3.29Å; H366-C369 PolarHBondContact CD2-N 2.93Å; H366-C369 VanDerWaalsContact CD2-N 3.29Å; H366-C369 VanDerWaalsContact CE1-CB 3.48Å; H366-C369 WeakPolarHBondContact CE1-CB 3.28Å; H366-C369 WeakPolarHBondContact NE2-CB 3.45Å; H366-C369 PolarHBondContact NE2-N 2.99Å; H366-C369 PolarHBondContact O-N 2.88Å; H366-K370 PolarHBondContact O-N 3.12Å; H366-K370 VanDerWaalsContact O-N 3.16Å; H366-W429 AromaticContact CE1-CD1 3.64Å; H366-W429 AromaticContact CE1-CD2 3.95Å; H366-W429 AromaticContact CE1-CE2 3.53Å; H366-W429 AromaticContact CE1-NE1 3.34Å; H366-W429 PolarHBondContact CE1-NE1 2.95Å; H366-W429 VanDerWaalsContact CE1-NE1 3.34Å; H366-W429 AromaticContact NE2-CD2 3.93Å; H366-W429 AromaticContact NE2-CE2 3.34Å; H366-W429 VanDerWaalsContact NE2-CE2 3.34Å; H366-W429 AromaticContact NE2-CZ2 3.4Å; H366-W429 WeakPolarHBondContact NE2-CZ2 3.42Å; H366-W429 AromaticContact NE2-NE1 3.61Å; H366-N532 WeakPolarHBondContact CB-OD1 3.49Å; H366-N532 PolarHBondContact CD2-OD1 2.91Å; H366-N532 PolarHBondContact ND1-OD1 3.07Å
367	E	84.1	Confident	72.6	Confident	152 Å²	152	64.7 Å²	64.7	71%	0.71	34%	0.34	S	S	*	.	H	α-helix	trans	-64.1	-32.4	-166.8	-164.4	166	167.7	0	0	113.5	K370 I371	E367-K370 WeakPolarHBondContact O-CB 3.35Å; E367-K370 PolarHBondContact O-N 3.48Å; E367-I371 HydrophobicContact CG-CD1 4.33Å; E367-I371 WeakPolarHBondContact O-CG1 3.39Å; E367-I371 PolarHBondContact O-N 2.84Å
368	N	85.5	Confident	74.4	Confident	8 Å²	8	63 Å²	63	4%	0.043	34%	0.34	C	S	.	.	H	α-helix	trans	-68	-45.5	178.3	-145.3	32	0	0	0	112.9	H366 K370 I371 F372 W429 N532 L533 N551	H366-N368 VanDerWaalsContact C-N 3.3Å; H366-N368 PolarHBondContact O-N 3.29Å; N368-K370 VanDerWaalsContact C-N 3.29Å; N368-K370 PolarHBondContact O-N 2.85Å; N368-I371 WeakPolarHBondContact O-CB 3.35Å; N368-I371 PolarHBondContact O-N 3.37Å; N368-I371 VanDerWaalsContact O-N 3.09Å; N368-F372 WeakPolarHBondContact O-CD2 3.48Å; N368-F372 PolarHBondContact O-N 3.42Å; N368-W429 HydrophobicContact CB-CH2 4.48Å; N368-N532 WeakPolarHBondContact CB-O 3.45Å; N368-N532 PolarHBondContact ND2-O 3.28Å; N368-L533 PolarHBondContact ND2-O 3.23Å; N368-N551 PolarHBondContact ND2-OD1 2.88Å; N368-N551 PolarHBondContact OD1-ND2 3.07Å; N368-N551 PolarHBondContact OD1-OD1 3.26Å
369	C	89	Confident	76.3	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-57.2	-41.4	170	167.3	0	0	0	0	111.7	H366 I371 F372 F373 W429	H366-C369 PolarHBondContact CD2-N 2.93Å; H366-C369 VanDerWaalsContact CD2-N 3.29Å; H366-C369 VanDerWaalsContact CE1-CB 3.48Å; H366-C369 WeakPolarHBondContact CE1-CB 3.28Å; H366-C369 WeakPolarHBondContact NE2-CB 3.45Å; H366-C369 PolarHBondContact NE2-N 2.99Å; H366-C369 PolarHBondContact O-N 2.88Å; C369-I371 PolarHBondContact O-N 2.9Å; C369-F372 PolarHBondContact O-N 2.66Å; C369-F373 WeakPolarHBondContact O-CB 3.37Å; C369-F373 PolarHBondContact O-N 2.96Å; C369-W429 HydrophobicContact CB-CD2 3.89Å; C369-W429 HydrophobicContact CB-CE3 3.68Å; C369-W429 HydrophobicContact CB-CG 4.41Å; C369-W429 HydrophobicContact CB-CZ3 4.02Å
370	K	87.1	Confident	78.3	Confident	57 Å²	57	60.7 Å²	60.7	25%	0.248	31%	0.311	C	S	.	.	H	α-helix	trans	-60.1	-42.3	172.9	-74.5	165.4	168.7	155.9	0	112.2	W352 D363 A365 H366 E367 N368 K374	W352-K370 HydrophobicContact CH2-CG 4.29Å; W352-K370 HydrophobicContact CZ3-CG 4.13Å; D363-K370 WeakPolarHBondContact O-CE 3.49Å; D363-K370 PolarHBondContact O-NZ 2.93Å; D363-K370 WeakPolarHBondContact OD1-CE 3.17Å; D363-K370 IonicContact OD1-NZ 3.11Å; A365-K370 HydrophobicContact CB-CG 4.29Å; A365-K370 WeakPolarHBondContact O-CD 3.44Å; A365-K370 WeakPolarHBondContact O-CE 3.32Å; A365-K370 PolarHBondContact O-NZ 3.07Å; H366-K370 PolarHBondContact O-N 3.12Å; H366-K370 VanDerWaalsContact O-N 3.16Å; E367-K370 WeakPolarHBondContact O-CB 3.35Å; E367-K370 PolarHBondContact O-N 3.48Å; N368-K370 VanDerWaalsContact C-N 3.29Å; N368-K370 PolarHBondContact O-N 2.85Å; K370-K374 WeakPolarHBondContact O-CA 3.36Å; K370-K374 VanDerWaalsContact O-CB 3.24Å; K370-K374 WeakPolarHBondContact O-CB 3.34Å; K370-K374 PolarHBondContact O-N 3.1Å
371	I	87.3	Confident	80.3	Confident	58 Å²	58	60 Å²	60	30%	0.297	31%	0.307	S	S	.	.	H	α-helix	trans	-62.2	-47.1	174.8	-70.2	162.9	0	0	0	110.8	E367 N368 C369 R375 L376	E367-I371 HydrophobicContact CG-CD1 4.33Å; E367-I371 WeakPolarHBondContact O-CG1 3.39Å; E367-I371 PolarHBondContact O-N 2.84Å; N368-I371 WeakPolarHBondContact O-CB 3.35Å; N368-I371 PolarHBondContact O-N 3.37Å; N368-I371 VanDerWaalsContact O-N 3.09Å; C369-I371 PolarHBondContact O-N 2.9Å; I371-R375 WeakPolarHBondContact O-CA 3.29Å; I371-R375 VanDerWaalsContact O-CB 3.32Å; I371-R375 WeakPolarHBondContact O-CB 3.33Å; I371-R375 PolarHBondContact O-N 2.94Å; I371-L376 HydrophobicContact CG2-CD1 3.79Å; I371-L376 HydrophobicContact CG2-CG 3.97Å; I371-L376 PolarHBondContact O-N 2.94Å
372	F	89.9	Confident	82.3	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.293	C	S	.	.	I	π-helix	trans	-63.1	-52.1	178.3	-88	-80.6	0	0	0	112.6	N368 C369 L376 L377 W429 M452 N551 I554	N368-F372 WeakPolarHBondContact O-CD2 3.48Å; N368-F372 PolarHBondContact O-N 3.42Å; C369-F372 PolarHBondContact O-N 2.66Å; F372-L376 HydrophobicContact CD1-CB 4.17Å; F372-L376 HydrophobicContact CD1-CD1 3.83Å; F372-L376 HydrophobicContact CD2-CD1 4.34Å; F372-L376 HydrophobicContact CE1-CD1 3.76Å; F372-L376 HydrophobicContact CE2-CD1 4.28Å; F372-L376 HydrophobicContact CG-CD1 4.12Å; F372-L376 HydrophobicContact CZ-CD1 3.99Å; F372-L376 PolarHBondContact O-N 3.49Å; F372-L377 PolarHBondContact O-N 3.42Å; F372-W429 HydrophobicContact CB-CZ3 3.99Å; F372-W429 AromaticContact CD2-CH2 3.82Å; F372-W429 HydrophobicContact CD2-CH2 3.82Å; F372-W429 AromaticContact CD2-CZ3 3.71Å; F372-W429 HydrophobicContact CD2-CZ3 3.71Å; F372-W429 HydrophobicContact CE2-CH2 4.29Å; F372-W429 HydrophobicContact CG-CZ3 4.02Å; F372-M452 HydrophobicContact CD1-CE 3.84Å; F372-M452 HydrophobicContact CD2-CE 4.13Å; F372-M452 HydrophobicContact CE1-CE 4.01Å; F372-M452 HydrophobicContact CE2-CE 4.28Å; F372-M452 HydrophobicContact CG-CE 3.91Å; F372-M452 HydrophobicContact CZ-CE 4.22Å; F372-N551 HydrophobicContact CE2-CB 4.04Å; F372-N551 HydrophobicContact CZ-CB 3.88Å; F372-N551 WeakPolarHBondContact CZ-O 3.47Å; F372-I554 HydrophobicContact CE1-CB 4.29Å; F372-I554 HydrophobicContact CE1-CG2 3.78Å; F372-I554 HydrophobicContact CZ-CB 3.86Å; F372-I554 HydrophobicContact CZ-CD1 4.21Å; F372-I554 HydrophobicContact CZ-CG2 3.6Å
373	F	90.3	Very high	84.3	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.28	C	S	.	.	I	π-helix	trans	-78.3	-36.9	-171.7	-75.5	17.3	0	0	0	113	L350 W352 C369 L377 P378 H385 V427 W429 M452	L350-F373 HydrophobicContact CB-CD2 4.01Å; L350-F373 HydrophobicContact CB-CE2 4.1Å; L350-F373 HydrophobicContact CB-CG 4.34Å; L350-F373 HydrophobicContact CD1-CB 4.05Å; L350-F373 HydrophobicContact CD1-CD1 4.42Å; L350-F373 HydrophobicContact CD1-CG 4.11Å; L350-F373 HydrophobicContact CD2-CD1 4.5Å; W352-F373 HydrophobicContact CD2-CD2 4.05Å; W352-F373 AromaticContact CE2-CD2 3.95Å; W352-F373 HydrophobicContact CE3-CD2 4.36Å; W352-F373 HydrophobicContact CG-CD2 4.45Å; W352-F373 HydrophobicContact CH2-CB 4.01Å; W352-F373 HydrophobicContact CH2-CD2 4.39Å; W352-F373 HydrophobicContact CZ2-CB 3.91Å; W352-F373 HydrophobicContact CZ2-CD2 4.14Å; C369-F373 WeakPolarHBondContact O-CB 3.37Å; C369-F373 PolarHBondContact O-N 2.96Å; F373-L377 HydrophobicContact CD1-CD1 3.9Å; F373-L377 HydrophobicContact CE1-CD1 4.15Å; F373-P378 WeakPolarHBondContact O-CD 3.4Å; F373-P378 WeakPolarHBondContact O-CG 3.4Å; F373-H385 PolarHBondContact O-CE1 3.21Å; F373-V427 HydrophobicContact CE1-CG1 4.01Å; F373-V427 HydrophobicContact CZ-CG1 4.38Å; F373-W429 HydrophobicContact CE1-CE3 4.33Å; F373-W429 HydrophobicContact CZ-CB 4.46Å; F373-M452 HydrophobicContact CE1-SD 4.24Å
374	K	88.1	Confident	86.1	Confident	112 Å²	112	55.7 Å²	55.7	49%	0.487	27%	0.273	S	S	.	.	I	π-helix	trans	-95	-9.2	-178.3	-60.5	175.7	173	172.4	0	113.9	W352 D363 K370	W352-K374 HydrophobicContact CH2-CD 4.07Å; W352-K374 HydrophobicContact CH2-CG 3.92Å; W352-K374 HydrophobicContact CZ2-CD 4.45Å; W352-K374 HydrophobicContact CZ2-CG 4.02Å; D363-K374 IonicContact OD1-NZ 2.79Å; D363-K374 PolarHBondContact OD1-NZ 3.04Å; D363-K374 VanDerWaalsContact OD1-NZ 3.13Å; D363-K374 IonicContact OD2-NZ 2.59Å; K370-K374 WeakPolarHBondContact O-CA 3.36Å; K370-K374 VanDerWaalsContact O-CB 3.24Å; K370-K374 WeakPolarHBondContact O-CB 3.34Å; K370-K374 PolarHBondContact O-N 3.1Å
375	R	85.6	Confident	87.3	Confident	191 Å²	191	52.9 Å²	52.9	72%	0.721	26%	0.26	S	S	*	.	I	π-helix	trans	-135.9	-46.5	-178.1	-175.3	179.4	176.8	-179.2	-0.6	116	I371	I371-R375 WeakPolarHBondContact O-CA 3.29Å; I371-R375 VanDerWaalsContact O-CB 3.32Å; I371-R375 WeakPolarHBondContact O-CB 3.33Å; I371-R375 PolarHBondContact O-N 2.94Å
376	L	87	Confident	88.1	Confident	31 Å²	31	52.6 Å²	52.6	16%	0.162	26%	0.258	C	S	.	.	I	π-helix	trans	-83.8	-54.9	-170.9	-61.5	177.5	0	0	0	113.8	I371 F372 A379 N551 L555	I371-L376 HydrophobicContact CG2-CD1 3.79Å; I371-L376 HydrophobicContact CG2-CG 3.97Å; I371-L376 PolarHBondContact O-N 2.94Å; F372-L376 HydrophobicContact CD1-CB 4.17Å; F372-L376 HydrophobicContact CD1-CD1 3.83Å; F372-L376 HydrophobicContact CD2-CD1 4.34Å; F372-L376 HydrophobicContact CE1-CD1 3.76Å; F372-L376 HydrophobicContact CE2-CD1 4.28Å; F372-L376 HydrophobicContact CG-CD1 4.12Å; F372-L376 HydrophobicContact CZ-CD1 3.99Å; F372-L376 PolarHBondContact O-N 3.49Å; L376-A379 WeakPolarHBondContact O-CB 3.41Å; L376-A379 PolarHBondContact O-N 2.87Å; L376-N551 HydrophobicContact CD1-CB 3.81Å; L376-L555 HydrophobicContact CB-CD1 4.28Å; L376-L555 HydrophobicContact CB-CD2 4.04Å; L376-L555 HydrophobicContact CD2-CD2 4.49Å
377	L	91.3	Very high	88	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.9	-38.6	177.4	-63.1	169.5	0	0	0	112.9	F348 L350 F372 F373 A379 V380 A381 V383 V427 L555 I558	F348-L377 HydrophobicContact CD2-CB 4.28Å; F348-L377 HydrophobicContact CE2-CB 4.39Å; F348-L377 HydrophobicContact CE2-CD2 4.1Å; F348-L377 HydrophobicContact CZ-CD2 4.26Å; L350-L377 HydrophobicContact CD2-CD1 3.66Å; F372-L377 PolarHBondContact O-N 3.42Å; F373-L377 HydrophobicContact CD1-CD1 3.9Å; F373-L377 HydrophobicContact CE1-CD1 4.15Å; L377-A379 PolarHBondContact O-N 3.25Å; L377-V380 WeakPolarHBondContact O-CG2 3.43Å; L377-V380 PolarHBondContact O-N 3.39Å; L377-A381 PolarHBondContact O-N 3.44Å; L377-V383 HydrophobicContact CB-CG1 4.4Å; L377-V427 HydrophobicContact CD1-CG1 4.04Å; L377-L555 HydrophobicContact CD2-CD1 3.8Å; L377-I558 HydrophobicContact CD2-CG2 4.37Å
378	P	90.2	Very high	87.3	Confident	50 Å²	50	47.5 Å²	47.5	33%	0.325	24%	0.236	S	C	.	.	H	α-helix	trans	-63.8	-16.5	172.5	-21.4	32.5	0	0	0	115.3	F373 V383	F373-P378 WeakPolarHBondContact O-CD 3.4Å; F373-P378 WeakPolarHBondContact O-CG 3.4Å; P378-V383 HydrophobicContact CB-CG1 4.35Å; P378-V383 HydrophobicContact CB-CG2 4.19Å; P378-V383 HydrophobicContact CG-CG1 4.05Å; P378-V383 HydrophobicContact CG-CG2 3.98Å
379	A	85.6	Confident	86.4	Confident	77 Å²	77	52.5 Å²	52.5	64%	0.636	26%	0.261	S	S	*	.	H	α-helix	trans	-82.9	-18.3	178.2	0	0	0	0	0	113	L376 L377	L376-A379 WeakPolarHBondContact O-CB 3.41Å; L376-A379 PolarHBondContact O-N 2.87Å; L377-A379 PolarHBondContact O-N 3.25Å
380	V	87.7	Confident	85.4	Confident	8 Å²	8	56.4 Å²	56.4	5%	0.048	29%	0.286	C	S	.	.	H	α-helix	trans	-111.6	-22.6	-178.3	-62.3	0	0	0	0	113.9	I339 L342 F348 L377 L555 V559	I339-V380 HydrophobicContact CB-CG1 4.41Å; I339-V380 HydrophobicContact CG2-CG1 3.73Å; L342-V380 HydrophobicContact CD1-CG2 4.38Å; L342-V380 PolarHBondContact N-O 3.05Å; F348-V380 HydrophobicContact CE2-CG2 4.18Å; L377-V380 WeakPolarHBondContact O-CG2 3.43Å; L377-V380 PolarHBondContact O-N 3.39Å; V380-L555 HydrophobicContact CG1-CD2 4.04Å; V380-L555 HydrophobicContact CG1-CG 4.41Å; V380-L555 HydrophobicContact CG2-CD1 4.06Å; V380-V559 HydrophobicContact CB-CG2 4.17Å; V380-V559 HydrophobicContact CG1-CG2 4.23Å; V380-V559 HydrophobicContact CG2-CG2 4.07Å
381	A	89.6	Confident	84.4	Confident	15 Å²	15	54.2 Å²	54.2	12%	0.124	28%	0.278	C	S	.	.	S	Bend	trans	-154.4	171.4	173.6	0	0	0	0	0	113.5	L342 L346 F348 L377	L342-A381 HydrophobicContact CB-CB 4.18Å; L342-A381 HydrophobicContact CD1-CB 4.15Å; L346-A381 HydrophobicContact CD2-CB 3.58Å; F348-A381 HydrophobicContact CD2-CB 3.73Å; F348-A381 HydrophobicContact CE2-CB 3.6Å; L377-A381 PolarHBondContact O-N 3.44Å
382	K	91.9	Very high	83.4	Confident	100 Å²	100	55 Å²	55	44%	0.435	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	131.1	172.7	-66.3	168.8	-171.7	159.6	0	109.7	S344 F348	S344-K382 PolarHBondContact O-NZ 3.26Å; F348-K382 PolarHBondContact N-O 3.5Å
383	V	92.5	Very high	82.1	Confident	41 Å²	41	62.5 Å²	62.5	25%	0.248	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	150.3	178.9	-59.7	0	0	0	0	111.8	F348 L350 L377 P378	F348-V383 HydrophobicContact CB-CG1 4.05Å; F348-V383 HydrophobicContact CD2-CG1 4.17Å; F348-V383 CarbonylContact O-C 3.6Å; F348-V383 WeakPolarHBondContact O-CA 3.3Å; L350-V383 HydrophobicContact CD1-CB 3.82Å; L350-V383 HydrophobicContact CD1-CG1 3.7Å; L350-V383 HydrophobicContact CD1-CG2 4.45Å; L350-V383 HydrophobicContact CG-CB 4.22Å; L350-V383 HydrophobicContact CG-CG1 4.23Å; L377-V383 HydrophobicContact CB-CG1 4.4Å; P378-V383 HydrophobicContact CB-CG1 4.35Å; P378-V383 HydrophobicContact CB-CG2 4.19Å; P378-V383 HydrophobicContact CG-CG1 4.05Å; P378-V383 HydrophobicContact CG-CG2 3.98Å
384	K	91.6	Very high	81	Confident	75 Å²	75	69 Å²	69	33%	0.326	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	136.4	154.3	-74.2	179.4	-174.7	-179.7	0	108.7	L347 F348 L349 L350 L415 N419	L347-K384 HydrophobicContact CD1-CB 4.45Å; L347-K384 HydrophobicContact CD1-CD 4.43Å; L347-K384 HydrophobicContact CD1-CG 4.08Å; L347-K384 HydrophobicContact CD2-CD 4.33Å; F348-K384 PolarHBondContact O-N 3.12Å; L349-K384 HydrophobicContact CD2-CB 3.86Å; L349-K384 HydrophobicContact CD2-CD 4.41Å; L350-K384 PolarHBondContact N-O 3.13Å; K384-L415 HydrophobicContact CD-CD2 3.98Å; K384-N419 VanDerWaalsContact NZ-CG 3.27Å; K384-N419 PolarHBondContact NZ-ND2 3.02Å; K384-N419 PolarHBondContact NZ-OD1 3.48Å
385	H	88.7	Confident	79.9	Confident	84 Å²	84	65.4 Å²	65.4	39%	0.389	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	135.5	173.8	-65	-61.2	0	0	0	110.7	W352 F373	W352-H385 AromaticContact CE2-ND1 3.81Å; W352-H385 AromaticContact CZ2-CE1 3.99Å; W352-H385 AromaticContact CZ2-ND1 3.94Å; W352-H385 AromaticContact NE1-CG 3.42Å; W352-H385 AromaticContact NE1-ND1 3.13Å; W352-H385 PolarHBondContact NE1-ND1 3.18Å; W352-H385 VanDerWaalsContact NE1-ND1 3.13Å; F373-H385 PolarHBondContact O-CE1 3.21Å
386	V	86.1	Confident	79	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	115.4	173.4	-162.3	0	0	0	0	106.5	L349 L350 L351 W352 F408 Q411 L415	L349-V386 HydrophobicContact CB-CG2 4.1Å; L350-V386 PolarHBondContact O-N 3.21Å; L351-V386 HydrophobicContact CD1-CB 4.2Å; L351-V386 HydrophobicContact CD1-CG2 3.98Å; L351-V386 HydrophobicContact CG-CB 4.05Å; L351-V386 HydrophobicContact CG-CG1 4.46Å; L351-V386 HydrophobicContact CG-CG2 4.39Å; W352-V386 PolarHBondContact N-O 3.23Å; V386-F408 HydrophobicContact CB-CD1 4.46Å; V386-F408 HydrophobicContact CB-CE1 3.96Å; V386-F408 HydrophobicContact CG1-CD1 3.7Å; V386-F408 HydrophobicContact CG1-CE1 3.63Å; V386-Q411 HydrophobicContact CG1-CB 3.96Å; V386-L415 HydrophobicContact CB-CD1 4.46Å; V386-L415 HydrophobicContact CG1-CD1 4.1Å; V386-L415 HydrophobicContact CG2-CD1 3.61Å
387	I	78.6	Confident	77.8	Confident	86 Å²	86	68.5 Å²	68.5	44%	0.441	35%	0.353	S	S	.	.			trans	-116.6	117.7	-177.3	-60.6	174.5	0	0	0	106.2	W352 Q411	W352-I387 HydrophobicContact CB-CG1 4.48Å; W352-I387 HydrophobicContact CG-CG1 4.11Å; I387-Q411 PolarHBondContact O-NE2 2.92Å; I387-Q411 PolarHBondContact O-OE1 3.04Å; I387-Q411 VanDerWaalsContact O-OE1 3.14Å
388	P	68.9	Low	76.6	Confident	5 Å²	5	74.1 Å²	74.1	3%	0.032	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-62.9	149	-175.2	29.7	-35.3	0	0	0	110	N354 F404 F408	N354-P388 WeakPolarHBondContact O-CG 3.48Å; P388-F404 HydrophobicContact CB-CD2 4.09Å; P388-F404 HydrophobicContact CB-CE2 4.17Å; P388-F404 HydrophobicContact CG-CD2 4.37Å; P388-F404 HydrophobicContact CG-CE2 4.09Å; P388-F408 HydrophobicContact CB-CD2 4.05Å; P388-F408 HydrophobicContact CB-CE1 4.33Å; P388-F408 HydrophobicContact CB-CE2 3.91Å; P388-F408 HydrophobicContact CB-CG 4.41Å; P388-F408 HydrophobicContact CB-CZ 4.04Å; P388-F408 HydrophobicContact CG-CE2 4Å; P388-F408 HydrophobicContact CG-CZ 3.97Å
389	M	68.3	Low	75.6	Confident	112 Å²	112	75.7 Å²	75.7	55%	0.552	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-63	145.2	174.5	-63.3	-158.2	-52.2	0	0	109.9	V391 S407	M389-V391 PolarHBondContact O-N 3.29Å; M389-S407 WeakPolarHBondContact CB-OG 3.32Å; M389-S407 WeakPolarHBondContact CG-OG 3.32Å; M389-S407 PolarHBondContact N-OG 3.13Å
390	P	66.2	Low	74.7	Confident	82 Å²	82	74.3 Å²	74.3	53%	0.532	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-63.8	132.7	179.3	26	-33.7	0	0	0	110.7	H356	H356-P390 HydrophobicContact CB-CB 4.38Å; H356-P390 CarbonylContact O-C 3.59Å; H356-P390 WeakPolarHBondContact O-CA 3.42Å; H356-P390 WeakPolarHBondContact O-CB 3.42Å
391	V	66.2	Low	73.9	Confident	12 Å²	12	76.9 Å²	76.9	7%	0.073	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-83.1	139.9	176.6	178.8	0	0	0	0	108.8	V355 H356 Y357 A358 M389 R393 Y400	V355-V391 HydrophobicContact CG1-CB 4.4Å; V355-V391 HydrophobicContact CG1-CG2 3.64Å; H356-V391 PolarHBondContact O-N 3.09Å; Y357-V391 WeakPolarHBondContact CA-O 3.49Å; A358-V391 PolarHBondContact N-O 2.69Å; A358-V391 VanDerWaalsContact N-O 3.13Å; M389-V391 PolarHBondContact O-N 3.29Å; V391-R393 PolarHBondContact O-N 3.48Å; V391-Y400 HydrophobicContact CB-CD2 4.35Å; V391-Y400 HydrophobicContact CG1-CD2 4.15Å
392	D	67.3	Low	73.4	Confident	75 Å²	75	80.6 Å²	80.6	40%	0.401	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-60.7	134.2	174.3	-179.6	13.4	0	0	0	110.4	N394 S395	D392-N394 PolarHBondContact O-N 3.24Å; D392-N394 PolarHBondContact OD1-N 3.03Å; D392-N394 VanDerWaalsContact OD1-N 3.1Å; D392-N394 PolarHBondContact OD1-ND2 2.92Å; D392-N394 WeakPolarHBondContact OD2-CB 3.28Å; D392-N394 PolarHBondContact OD2-ND2 3.1Å; D392-S395 VanDerWaalsContact O-CB 3.28Å; D392-S395 WeakPolarHBondContact O-CB 3.32Å; D392-S395 PolarHBondContact O-N 2.79Å; D392-S395 PolarHBondContact O-OG 2.76Å
393	R	61.8	Low	72.7	Confident	156 Å²	156	78.2 Å²	78.2	59%	0.589	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-28.4	175	-73.1	-175	170.1	-177.9	-1	112.7	Y357 V391 S395	Y357-R393 HydrophobicContact CD1-CB 4.31Å; Y357-R393 HydrophobicContact CD1-CG 3.64Å; Y357-R393 HydrophobicContact CE1-CG 4.48Å; Y357-R393 HydrophobicContact CG-CG 3.77Å; V391-R393 PolarHBondContact O-N 3.48Å; R393-S395 VanDerWaalsContact C-N 3.3Å
394	N	67.4	Low	72	Confident	136 Å²	136	76.3 Å²	76.3	73%	0.727	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-9.3	179.6	-47.5	-55.4	0	0	0	113	D392	D392-N394 PolarHBondContact O-N 3.24Å; D392-N394 PolarHBondContact OD1-N 3.03Å; D392-N394 VanDerWaalsContact OD1-N 3.1Å; D392-N394 PolarHBondContact OD1-ND2 2.92Å; D392-N394 WeakPolarHBondContact OD2-CB 3.28Å; D392-N394 PolarHBondContact OD2-ND2 3.1Å
395	S	66.6	Low	71.5	Confident	37 Å²	37	74 Å²	74	26%	0.259	37%	0.374	S	S	.	.	S	Bend	trans	-65.2	125.9	175.4	-69.2	0	0	0	0	110.6	D392 R393	D392-S395 VanDerWaalsContact O-CB 3.28Å; D392-S395 WeakPolarHBondContact O-CB 3.32Å; D392-S395 PolarHBondContact O-N 2.79Å; D392-S395 PolarHBondContact O-OG 2.76Å; R393-S395 VanDerWaalsContact C-N 3.3Å
396	P	65.4	Low	71.2	Confident	70 Å²	70	76.2 Å²	76.2	46%	0.455	38%	0.382	S	S	.	.			trans	-65.1	145.9	179.1	28.9	-36	0	0	0	110.8	N398 L399 Y400	P396-N398 WeakPolarHBondContact CB-OD1 3.28Å; P396-N398 WeakPolarHBondContact CG-OD1 3.49Å; P396-N398 PolarHBondContact O-N 3.19Å; P396-N398 PolarHBondContact O-OD1 3.21Å; P396-L399 HydrophobicContact CG-CB 4.37Å; P396-L399 HydrophobicContact CG-CD1 3.84Å; P396-L399 HydrophobicContact CG-CG 4.05Å; P396-L399 PolarHBondContact O-N 3.4Å; P396-Y400 PolarHBondContact O-N 2.7Å
397	R	62.8	Low	71	Confident	217 Å²	217	76.7 Å²	76.7	82%	0.819	39%	0.386	S	S	*	.	H	α-helix	trans	-59.3	-20.7	-168.1	-72.4	-174.1	177.2	-176.7	-0.6	115.4
398	N	64.6	Low	71.4	Confident	119 Å²	119	72.6 Å²	72.6	64%	0.636	37%	0.365	S	S	*	.	H	α-helix	trans	-72.3	-36.7	173	60	-30.8	0	0	0	112.4	P396	P396-N398 WeakPolarHBondContact CB-OD1 3.28Å; P396-N398 WeakPolarHBondContact CG-OD1 3.49Å; P396-N398 PolarHBondContact O-N 3.19Å; P396-N398 PolarHBondContact O-OD1 3.21Å
399	L	70	Confident	72.2	Confident	83 Å²	83	73.5 Å²	73.5	44%	0.435	37%	0.369	S	S	.	.	H	α-helix	trans	-78.2	-25.1	177.1	-64.8	-177.3	0	0	0	112.8	P396 F401 V402 S403	P396-L399 HydrophobicContact CG-CB 4.37Å; P396-L399 HydrophobicContact CG-CD1 3.84Å; P396-L399 HydrophobicContact CG-CG 4.05Å; P396-L399 PolarHBondContact O-N 3.4Å; L399-F401 PolarHBondContact O-N 3.32Å; L399-V402 WeakPolarHBondContact O-CA 3.23Å; L399-V402 WeakPolarHBondContact O-CB 3.48Å; L399-V402 PolarHBondContact O-N 3.23Å; L399-S403 PolarHBondContact O-N 2.95Å; L399-S403 PolarHBondContact O-OG 3.2Å
400	Y	67.2	Low	73.1	Confident	47 Å²	47	71.8 Å²	71.8	18%	0.184	36%	0.359	C	S	.	.	H	α-helix	trans	-46.7	-52.4	178.9	171.7	-94.4	0	0	0	113.4	V355 Y357 V391 P396 V402 F404	V355-Y400 HydrophobicContact CB-CE2 3.91Å; V355-Y400 WeakPolarHBondContact CB-OH 3.5Å; V355-Y400 HydrophobicContact CG1-CE2 3.96Å; V355-Y400 HydrophobicContact CG2-CE1 4.25Å; V355-Y400 HydrophobicContact CG2-CE2 4.37Å; V355-Y400 VanDerWaalsContact CG2-OH 3.28Å; V355-Y400 WeakPolarHBondContact CG2-OH 3.21Å; Y357-Y400 HydrophobicContact CE1-CE2 4.46Å; V391-Y400 HydrophobicContact CB-CD2 4.35Å; V391-Y400 HydrophobicContact CG1-CD2 4.15Å; P396-Y400 PolarHBondContact O-N 2.7Å; Y400-V402 VanDerWaalsContact C-N 3.35Å; Y400-V402 PolarHBondContact O-N 2.99Å; Y400-F404 WeakPolarHBondContact O-CB 3.1Å; Y400-F404 PolarHBondContact O-N 2.95Å
401	F	71.4	Confident	74	Confident	63 Å²	63	70.1 Å²	70.1	28%	0.276	35%	0.345	S	S	.	.	H	α-helix	trans	-68.6	-31.7	179	-76	-76	0	0	0	113.1	L399 F404 I405 W464	L399-F401 PolarHBondContact O-N 3.32Å; F401-F404 HydrophobicContact CD1-CD1 4.37Å; F401-I405 WeakPolarHBondContact O-CB 3.47Å; F401-I405 WeakPolarHBondContact O-CD1 3.32Å; F401-I405 WeakPolarHBondContact O-CG1 3.44Å; F401-I405 PolarHBondContact O-N 3.06Å; F401-W464 HydrophobicContact CD1-CH2 4.48Å; F401-W464 HydrophobicContact CD2-CH2 4.2Å; F401-W464 HydrophobicContact CE1-CH2 4.22Å; F401-W464 HydrophobicContact CE1-CZ2 4.41Å; F401-W464 AromaticContact CE2-CH2 3.91Å; F401-W464 HydrophobicContact CE2-CH2 3.91Å; F401-W464 HydrophobicContact CE2-CZ2 4.45Å; F401-W464 HydrophobicContact CG-CH2 4.48Å; F401-W464 AromaticContact CZ-CH2 3.92Å; F401-W464 HydrophobicContact CZ-CH2 3.92Å; F401-W464 HydrophobicContact CZ-CZ2 4.09Å
402	V	78	Confident	75	Confident	92 Å²	92	69.6 Å²	69.6	56%	0.558	34%	0.341	S	S	*	.	H	α-helix	trans	-69.4	-49.2	177.9	-176.6	0	0	0	0	110.3	L399 Y400 F404 I405 K406	L399-V402 WeakPolarHBondContact O-CA 3.23Å; L399-V402 WeakPolarHBondContact O-CB 3.48Å; L399-V402 PolarHBondContact O-N 3.23Å; Y400-V402 VanDerWaalsContact C-N 3.35Å; Y400-V402 PolarHBondContact O-N 2.99Å; V402-F404 PolarHBondContact O-N 3.19Å; V402-I405 PolarHBondContact O-N 3.35Å; V402-K406 WeakPolarHBondContact O-CB 3.41Å; V402-K406 PolarHBondContact O-N 2.7Å
403	S	77.1	Confident	75.9	Confident	50 Å²	50	69.2 Å²	69.2	35%	0.35	34%	0.339	S	S	.	.	H	α-helix	trans	-63.8	-38.9	176.1	-60	0	0	0	0	112.3	L399 K406 S407	L399-S403 PolarHBondContact O-N 2.95Å; L399-S403 PolarHBondContact O-OG 3.2Å; S403-K406 PolarHBondContact O-N 3.02Å; S403-S407 VanDerWaalsContact O-CB 3.3Å; S403-S407 WeakPolarHBondContact O-CB 3.37Å; S403-S407 PolarHBondContact O-N 3.03Å
404	F	77.1	Confident	77.1	Confident	1 Å²	1	69.8 Å²	69.8	0%	0.004	34%	0.341	C	S	.	.	H	α-helix	trans	-60.8	-51	174.3	168	-116.9	0	0	0	112.3	V355 P388 Y400 F401 V402 S407 F408 V431 P435	V355-F404 HydrophobicContact CB-CD2 4.15Å; V355-F404 HydrophobicContact CB-CE2 4.38Å; V355-F404 HydrophobicContact CG1-CB 4.41Å; V355-F404 HydrophobicContact CG1-CD2 3.77Å; V355-F404 HydrophobicContact CG1-CE2 4.43Å; V355-F404 HydrophobicContact CG1-CG 4.42Å; V355-F404 HydrophobicContact CG2-CD2 3.37Å; V355-F404 HydrophobicContact CG2-CE2 3.35Å; V355-F404 HydrophobicContact CG2-CG 3.97Å; V355-F404 HydrophobicContact CG2-CZ 3.96Å; P388-F404 HydrophobicContact CB-CD2 4.09Å; P388-F404 HydrophobicContact CB-CE2 4.17Å; P388-F404 HydrophobicContact CG-CD2 4.37Å; P388-F404 HydrophobicContact CG-CE2 4.09Å; Y400-F404 WeakPolarHBondContact O-CB 3.1Å; Y400-F404 PolarHBondContact O-N 2.95Å; F401-F404 HydrophobicContact CD1-CD1 4.37Å; V402-F404 PolarHBondContact O-N 3.19Å; F404-S407 PolarHBondContact O-N 3.15Å; F404-F408 AromaticContact CD2-CD2 3.93Å; F404-F408 HydrophobicContact CD2-CD2 3.93Å; F404-F408 HydrophobicContact CD2-CE2 4.12Å; F404-F408 HydrophobicContact CE1-CD2 4.49Å; F404-F408 AromaticContact CE2-CD2 3.46Å; F404-F408 HydrophobicContact CE2-CD2 3.46Å; F404-F408 VanDerWaalsContact CE2-CD2 3.46Å; F404-F408 AromaticContact CE2-CE2 3.25Å; F404-F408 HydrophobicContact CE2-CE2 3.25Å; F404-F408 HydrophobicContact CE2-CZ 4.44Å; F404-F408 AromaticContact CZ-CD2 3.8Å; F404-F408 HydrophobicContact CZ-CD2 3.8Å; F404-F408 AromaticContact CZ-CE2 3.57Å; F404-F408 HydrophobicContact CZ-CE2 3.57Å; F404-F408 PolarHBondContact O-N 2.98Å; F404-V431 HydrophobicContact CZ-CG2 4.32Å; F404-P435 HydrophobicContact CE1-CG 4.07Å; F404-P435 HydrophobicContact CZ-CG 4.27Å
405	I	81.6	Confident	78	Confident	27 Å²	27	64.7 Å²	64.7	14%	0.138	31%	0.314	C	S	.	.	H	α-helix	trans	-63	-46.7	177.1	-68.9	165.5	0	0	0	110	F401 V402 S407 F408 M409 I434 P435	F401-I405 WeakPolarHBondContact O-CB 3.47Å; F401-I405 WeakPolarHBondContact O-CD1 3.32Å; F401-I405 WeakPolarHBondContact O-CG1 3.44Å; F401-I405 PolarHBondContact O-N 3.06Å; V402-I405 PolarHBondContact O-N 3.35Å; I405-S407 PolarHBondContact O-N 2.97Å; I405-F408 PolarHBondContact O-N 3.13Å; I405-M409 HydrophobicContact CG2-CG 4.21Å; I405-M409 VanDerWaalsContact O-CG 3.27Å; I405-M409 WeakPolarHBondContact O-CG 3.43Å; I405-M409 PolarHBondContact O-N 3.43Å; I405-I434 HydrophobicContact CD1-CG2 3.94Å; I405-I434 HydrophobicContact CG1-CG2 4.46Å; I405-P435 HydrophobicContact CG1-CB 4.23Å; I405-P435 HydrophobicContact CG2-CB 4.43Å
406	K	83.4	Confident	78.9	Confident	130 Å²	130	63.6 Å²	63.6	57%	0.565	31%	0.305	S	S	*	.	H	α-helix	trans	-57.1	-49.8	177.9	178.4	171	171.4	173.8	0	111.8	V402 S403 F408 M409 E410	V402-K406 WeakPolarHBondContact O-CB 3.41Å; V402-K406 PolarHBondContact O-N 2.7Å; S403-K406 PolarHBondContact O-N 3.02Å; K406-F408 VanDerWaalsContact C-N 3.33Å; K406-F408 PolarHBondContact O-N 2.75Å; K406-M409 PolarHBondContact O-N 2.97Å; K406-M409 VanDerWaalsContact O-N 3.15Å; K406-E410 WeakPolarHBondContact CE-OE1 3.42Å; K406-E410 HydrophobicContact CG-CG 4.41Å; K406-E410 WeakPolarHBondContact CG-OE1 3.33Å; K406-E410 IonicContact NZ-OE1 2.78Å; K406-E410 WeakPolarHBondContact O-CG 3.44Å; K406-E410 PolarHBondContact O-N 3.49Å
407	S	81.8	Confident	79.8	Confident	10 Å²	10	61.8 Å²	61.8	7%	0.07	30%	0.296	C	S	.	.	H	α-helix	trans	-61.6	-39.3	179.2	-177	0	0	0	0	112.6	M389 S403 F404 I405 Q411	M389-S407 WeakPolarHBondContact CB-OG 3.32Å; M389-S407 WeakPolarHBondContact CG-OG 3.32Å; M389-S407 PolarHBondContact N-OG 3.13Å; S403-S407 VanDerWaalsContact O-CB 3.3Å; S403-S407 WeakPolarHBondContact O-CB 3.37Å; S403-S407 PolarHBondContact O-N 3.03Å; F404-S407 PolarHBondContact O-N 3.15Å; I405-S407 PolarHBondContact O-N 2.97Å; S407-Q411 WeakPolarHBondContact O-CG 3.03Å; S407-Q411 PolarHBondContact O-N 3.43Å; S407-Q411 VanDerWaalsContact O-N 3.16Å
408	F	86.3	Confident	80.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.9	-43.4	173.7	-100.7	-49.7	0	0	0	112	L351 V386 P388 F404 I405 K406 E410 Q411 L412 P435	L351-F408 HydrophobicContact CB-CE1 3.77Å; L351-F408 HydrophobicContact CB-CE2 4.48Å; L351-F408 HydrophobicContact CB-CZ 3.7Å; L351-F408 HydrophobicContact CD2-CD1 3.67Å; L351-F408 HydrophobicContact CD2-CD2 4.4Å; L351-F408 HydrophobicContact CD2-CE1 3.73Å; L351-F408 HydrophobicContact CD2-CE2 4.37Å; L351-F408 HydrophobicContact CD2-CG 4.04Å; L351-F408 HydrophobicContact CD2-CZ 4.07Å; L351-F408 HydrophobicContact CG-CD1 3.89Å; L351-F408 HydrophobicContact CG-CE1 3.5Å; L351-F408 VanDerWaalsContact CG-CE1 3.5Å; L351-F408 HydrophobicContact CG-CZ 3.93Å; V386-F408 HydrophobicContact CB-CD1 4.46Å; V386-F408 HydrophobicContact CB-CE1 3.96Å; V386-F408 HydrophobicContact CG1-CD1 3.7Å; V386-F408 HydrophobicContact CG1-CE1 3.63Å; P388-F408 HydrophobicContact CB-CD2 4.05Å; P388-F408 HydrophobicContact CB-CE1 4.33Å; P388-F408 HydrophobicContact CB-CE2 3.91Å; P388-F408 HydrophobicContact CB-CG 4.41Å; P388-F408 HydrophobicContact CB-CZ 4.04Å; P388-F408 HydrophobicContact CG-CE2 4Å; P388-F408 HydrophobicContact CG-CZ 3.97Å; F404-F408 AromaticContact CD2-CD2 3.93Å; F404-F408 HydrophobicContact CD2-CD2 3.93Å; F404-F408 HydrophobicContact CD2-CE2 4.12Å; F404-F408 HydrophobicContact CE1-CD2 4.49Å; F404-F408 AromaticContact CE2-CD2 3.46Å; F404-F408 HydrophobicContact CE2-CD2 3.46Å; F404-F408 VanDerWaalsContact CE2-CD2 3.46Å; F404-F408 AromaticContact CE2-CE2 3.25Å; F404-F408 HydrophobicContact CE2-CE2 3.25Å; F404-F408 HydrophobicContact CE2-CZ 4.44Å; F404-F408 AromaticContact CZ-CD2 3.8Å; F404-F408 HydrophobicContact CZ-CD2 3.8Å; F404-F408 AromaticContact CZ-CE2 3.57Å; F404-F408 HydrophobicContact CZ-CE2 3.57Å; F404-F408 PolarHBondContact O-N 2.98Å; I405-F408 PolarHBondContact O-N 3.13Å; K406-F408 VanDerWaalsContact C-N 3.33Å; K406-F408 PolarHBondContact O-N 2.75Å; F408-E410 PolarHBondContact O-N 3.34Å; F408-Q411 PolarHBondContact O-N 2.71Å; F408-L412 WeakPolarHBondContact O-CG 3.41Å; F408-L412 PolarHBondContact O-N 2.94Å; F408-P435 HydrophobicContact CB-CB 3.98Å; F408-P435 HydrophobicContact CB-CG 4.23Å; F408-P435 HydrophobicContact CD2-CB 4.28Å; F408-P435 HydrophobicContact CD2-CG 3.58Å; F408-P435 HydrophobicContact CE2-CG 4.17Å; F408-P435 HydrophobicContact CG-CB 4.45Å; F408-P435 HydrophobicContact CG-CG 4.16Å
409	M	86.8	Confident	81.7	Confident	25 Å²	25	49.6 Å²	49.6	12%	0.123	25%	0.246	C	C	.	.	H	α-helix	trans	-63.4	-42	178.9	-66.8	-57.8	-73	0	0	112	I405 K406 Q411 L412 D413 H438 A439 K442 Y443	I405-M409 HydrophobicContact CG2-CG 4.21Å; I405-M409 VanDerWaalsContact O-CG 3.27Å; I405-M409 WeakPolarHBondContact O-CG 3.43Å; I405-M409 PolarHBondContact O-N 3.43Å; K406-M409 PolarHBondContact O-N 2.97Å; K406-M409 VanDerWaalsContact O-N 3.15Å; M409-Q411 VanDerWaalsContact C-N 3.33Å; M409-Q411 PolarHBondContact O-N 3.07Å; M409-L412 CarbonylContact O-C 3.5Å; M409-L412 PolarHBondContact O-N 2.97Å; M409-L412 VanDerWaalsContact O-N 3.11Å; M409-L412 HydrophobicContact SD-CD1 4.26Å; M409-D413 PolarHBondContact O-N 2.91Å; M409-H438 HydrophobicContact SD-CB 4.44Å; M409-A439 HydrophobicContact CE-CB 4.3Å; M409-A439 HydrophobicContact SD-CB 3.96Å; M409-K442 HydrophobicContact CE-CB 4.12Å; M409-K442 HydrophobicContact CE-CD 3.31Å; M409-K442 HydrophobicContact CE-CG 4.32Å; M409-Y443 HydrophobicContact CE-CE2 3.74Å; M409-Y443 PolarHBondContact O-OH 3.14Å; M409-Y443 HydrophobicContact SD-CE2 4.44Å
410	E	85.3	Confident	82.1	Confident	76 Å²	76	47.7 Å²	47.7	36%	0.355	24%	0.24	S	C	.	.	H	α-helix	trans	-61.7	-36.3	174.6	-71.7	169.8	170.9	0	0	113.1	K406 F408 R414	K406-E410 WeakPolarHBondContact CE-OE1 3.42Å; K406-E410 HydrophobicContact CG-CG 4.41Å; K406-E410 WeakPolarHBondContact CG-OE1 3.33Å; K406-E410 IonicContact NZ-OE1 2.78Å; K406-E410 WeakPolarHBondContact O-CG 3.44Å; K406-E410 PolarHBondContact O-N 3.49Å; F408-E410 PolarHBondContact O-N 3.34Å; E410-R414 WeakPolarHBondContact O-CG 3.24Å
411	Q	85.3	Confident	82.7	Confident	47 Å²	47	50.4 Å²	50.4	22%	0.22	26%	0.262	C	S	.	.	H	α-helix	trans	-71.2	-38.1	172.1	-71.8	-173.3	33.5	0	0	111.9	V386 I387 S407 F408 M409 L415	V386-Q411 HydrophobicContact CG1-CB 3.96Å; I387-Q411 PolarHBondContact O-NE2 2.92Å; I387-Q411 PolarHBondContact O-OE1 3.04Å; I387-Q411 VanDerWaalsContact O-OE1 3.14Å; S407-Q411 WeakPolarHBondContact O-CG 3.03Å; S407-Q411 PolarHBondContact O-N 3.43Å; S407-Q411 VanDerWaalsContact O-N 3.16Å; F408-Q411 PolarHBondContact O-N 2.71Å; M409-Q411 VanDerWaalsContact C-N 3.33Å; M409-Q411 PolarHBondContact O-N 3.07Å; Q411-L415 WeakPolarHBondContact O-CB 3.32Å; Q411-L415 VanDerWaalsContact O-CG 3.29Å; Q411-L415 WeakPolarHBondContact O-CG 3.46Å; Q411-L415 PolarHBondContact O-N 2.91Å
412	L	88.3	Confident	83.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.2	-46.2	176.5	-72.2	-177.5	0	0	0	111.6	L349 L351 F408 M409 R414 L415 F416 L426 A439 Y443	L349-L412 HydrophobicContact CD1-CD2 3.89Å; L351-L412 HydrophobicContact CD1-CD2 4.35Å; L351-L412 HydrophobicContact CD2-CD1 4.45Å; F408-L412 WeakPolarHBondContact O-CG 3.41Å; F408-L412 PolarHBondContact O-N 2.94Å; M409-L412 CarbonylContact O-C 3.5Å; M409-L412 PolarHBondContact O-N 2.97Å; M409-L412 VanDerWaalsContact O-N 3.11Å; M409-L412 HydrophobicContact SD-CD1 4.26Å; L412-R414 VanDerWaalsContact C-N 3.28Å; L412-R414 PolarHBondContact O-N 3.45Å; L412-L415 CarbonylContact O-C 3.52Å; L412-L415 WeakPolarHBondContact O-CA 3.27Å; L412-L415 PolarHBondContact O-N 3.44Å; L412-F416 HydrophobicContact CB-CD2 4.24Å; L412-F416 HydrophobicContact CB-CE2 4.39Å; L412-F416 HydrophobicContact CD2-CE2 4.43Å; L412-F416 WeakPolarHBondContact O-CD2 3.39Å; L412-F416 PolarHBondContact O-N 3.4Å; L412-L426 HydrophobicContact CD1-CD1 4.47Å; L412-L426 HydrophobicContact CD1-CD2 3.96Å; L412-L426 HydrophobicContact CD2-CD2 3.59Å; L412-L426 HydrophobicContact CG-CD2 4.45Å; L412-A439 HydrophobicContact CD1-CB 3.74Å; L412-Y443 HydrophobicContact CB-CE2 4.02Å; L412-Y443 HydrophobicContact CD1-CE2 4.22Å
413	D	86.6	Confident	83.7	Confident	68 Å²	68	49.4 Å²	49.4	36%	0.364	25%	0.246	S	C	.	.	H	α-helix	trans	-50.7	-48.3	176.7	-79.8	-52.8	0	0	0	111.7	M409 L415 A417 K442 Y443	M409-D413 PolarHBondContact O-N 2.91Å; D413-L415 PolarHBondContact O-N 3.19Å; D413-A417 WeakPolarHBondContact O-CB 3.48Å; D413-A417 PolarHBondContact O-N 2.99Å; D413-A417 VanDerWaalsContact O-N 3.08Å; D413-K442 IonicContact OD1-NZ 2.93Å; D413-K442 PolarHBondContact OD1-NZ 2.9Å; D413-K442 IonicContact OD2-NZ 2.62Å; D413-K442 PolarHBondContact OD2-NZ 3.38Å; D413-Y443 VanDerWaalsContact CG-OH 3.32Å; D413-Y443 WeakPolarHBondContact OD1-CE1 3.45Å; D413-Y443 PolarHBondContact OD1-OH 3.04Å; D413-Y443 VanDerWaalsContact OD1-OH 3.11Å
414	R	85.8	Confident	84.4	Confident	167 Å²	167	47.1 Å²	47.1	63%	0.63	23%	0.23	S	C	*	.	H	α-helix	trans	-63.3	-40	175.2	-63.5	174.3	-171.9	-166.4	2.4	112.7	E410 L412 L418	E410-R414 WeakPolarHBondContact O-CG 3.24Å; L412-R414 VanDerWaalsContact C-N 3.28Å; L412-R414 PolarHBondContact O-N 3.45Å; R414-L418 VanDerWaalsContact O-CB 3.3Å; R414-L418 WeakPolarHBondContact O-CB 3.24Å; R414-L418 WeakPolarHBondContact O-CD1 3.36Å; R414-L418 VanDerWaalsContact O-CG 3.24Å; R414-L418 WeakPolarHBondContact O-CG 3.44Å; R414-L418 PolarHBondContact O-N 3.37Å
415	L	87	Confident	85.2	Confident	30 Å²	30	47 Å²	47	16%	0.157	23%	0.229	C	C	.	.	H	α-helix	trans	-74.3	-34.9	-178.8	-75.4	168.3	0	0	0	113.2	L349 K384 V386 Q411 L412 D413 N419	L349-L415 HydrophobicContact CD1-CB 4.11Å; L349-L415 HydrophobicContact CD2-CD1 4.38Å; K384-L415 HydrophobicContact CD-CD2 3.98Å; V386-L415 HydrophobicContact CB-CD1 4.46Å; V386-L415 HydrophobicContact CG1-CD1 4.1Å; V386-L415 HydrophobicContact CG2-CD1 3.61Å; Q411-L415 WeakPolarHBondContact O-CB 3.32Å; Q411-L415 VanDerWaalsContact O-CG 3.29Å; Q411-L415 WeakPolarHBondContact O-CG 3.46Å; Q411-L415 PolarHBondContact O-N 2.91Å; L412-L415 CarbonylContact O-C 3.52Å; L412-L415 WeakPolarHBondContact O-CA 3.27Å; L412-L415 PolarHBondContact O-N 3.44Å; D413-L415 PolarHBondContact O-N 3.19Å; L415-N419 WeakPolarHBondContact O-CB 3.44Å; L415-N419 PolarHBondContact O-N 3.21Å; L415-N419 PolarHBondContact O-ND2 3.05Å
416	F	85.7	Confident	85.8	Confident	14 Å²	14	45.8 Å²	45.8	6%	0.061	22%	0.223	C	C	.	.	H	α-helix	trans	-66.1	-49	172	-87.9	-93.9	0	0	0	110.1	L349 L412 L418 N419 S420 I424 Y443 L446	L349-F416 HydrophobicContact CD1-CE2 4.46Å; L412-F416 HydrophobicContact CB-CD2 4.24Å; L412-F416 HydrophobicContact CB-CE2 4.39Å; L412-F416 HydrophobicContact CD2-CE2 4.43Å; L412-F416 WeakPolarHBondContact O-CD2 3.39Å; L412-F416 PolarHBondContact O-N 3.4Å; F416-L418 VanDerWaalsContact C-N 3.32Å; F416-L418 PolarHBondContact O-N 3.17Å; F416-N419 CarbonylContact O-C 3.59Å; F416-N419 PolarHBondContact O-N 3.25Å; F416-S420 PolarHBondContact O-N 3.44Å; F416-I424 HydrophobicContact CB-CD1 4.5Å; F416-I424 HydrophobicContact CD1-CD1 3.56Å; F416-I424 HydrophobicContact CE1-CB 4.22Å; F416-I424 HydrophobicContact CE1-CD1 3.83Å; F416-I424 HydrophobicContact CE1-CG2 4.07Å; F416-I424 HydrophobicContact CE2-CG2 4.32Å; F416-I424 HydrophobicContact CG-CD1 3.95Å; F416-I424 HydrophobicContact CZ-CB 4.46Å; F416-I424 HydrophobicContact CZ-CD1 4.44Å; F416-I424 HydrophobicContact CZ-CG2 3.82Å; F416-Y443 HydrophobicContact CD1-CD1 4.48Å; F416-Y443 HydrophobicContact CD1-CG 4.34Å; F416-Y443 HydrophobicContact CD2-CD1 4.34Å; F416-Y443 HydrophobicContact CD2-CD2 4.1Å; F416-Y443 HydrophobicContact CD2-CE1 4.38Å; F416-Y443 HydrophobicContact CD2-CE2 4.14Å; F416-Y443 HydrophobicContact CD2-CG 4.21Å; F416-Y443 HydrophobicContact CE1-CD2 4.42Å; F416-Y443 HydrophobicContact CE1-CG 4.05Å; F416-Y443 HydrophobicContact CE2-CD1 4.49Å; F416-Y443 AromaticContact CE2-CD2 3.54Å; F416-Y443 HydrophobicContact CE2-CD2 3.54Å; F416-Y443 AromaticContact CE2-CE2 3.85Å; F416-Y443 HydrophobicContact CE2-CE2 3.85Å; F416-Y443 AromaticContact CE2-CG 3.91Å; F416-Y443 HydrophobicContact CE2-CG 3.91Å; F416-Y443 HydrophobicContact CG-CD1 4.34Å; F416-Y443 HydrophobicContact CG-CG 4.42Å; F416-Y443 AromaticContact CZ-CD2 3.72Å; F416-Y443 HydrophobicContact CZ-CD2 3.72Å; F416-Y443 HydrophobicContact CZ-CE2 4.48Å; F416-Y443 AromaticContact CZ-CG 3.81Å; F416-Y443 HydrophobicContact CZ-CG 3.81Å; F416-L446 HydrophobicContact CZ-CB 4.49Å; F416-L446 HydrophobicContact CZ-CD1 4Å
417	A	83.1	Confident	86.4	Confident	32 Å²	32	39.6 Å²	39.6	26%	0.264	20%	0.196	S	C	.	.	H	α-helix	trans	-57.7	-41.2	176	0	0	0	0	0	112.9	D413 N419 L579	D413-A417 WeakPolarHBondContact O-CB 3.48Å; D413-A417 PolarHBondContact O-N 2.99Å; D413-A417 VanDerWaalsContact O-N 3.08Å; A417-N419 VanDerWaalsContact C-N 3.28Å; A417-N419 PolarHBondContact O-N 3.45Å; A417-L579 HydrophobicContact CB-CD1 4.15Å
418	L	84.1	Confident	86.8	Confident	70 Å²	70	39.1 Å²	39.1	37%	0.366	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-2.9	177.7	-73.1	170.8	0	0	0	114.8	R414 F416 L587 V591	R414-L418 VanDerWaalsContact O-CB 3.3Å; R414-L418 WeakPolarHBondContact O-CB 3.24Å; R414-L418 WeakPolarHBondContact O-CD1 3.36Å; R414-L418 VanDerWaalsContact O-CG 3.24Å; R414-L418 WeakPolarHBondContact O-CG 3.44Å; R414-L418 PolarHBondContact O-N 3.37Å; F416-L418 VanDerWaalsContact C-N 3.32Å; F416-L418 PolarHBondContact O-N 3.17Å; L418-L587 HydrophobicContact CD1-CD2 4.2Å; L418-L587 HydrophobicContact CD2-CD2 4.16Å; L418-L587 HydrophobicContact CG-CD2 3.94Å; L418-V591 HydrophobicContact CD1-CG2 4.24Å; L418-V591 HydrophobicContact CD2-CG2 4.48Å
419	N	83.7	Confident	87.1	Confident	10 Å²	10	39.3 Å²	39.3	5%	0.053	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142.8	27.7	-176.7	-58.5	-92.9	0	0	0	112.4	L347 K384 L415 F416 A417 T421 R422 I424	L347-N419 HydrophobicContact CD2-CB 3.69Å; L347-N419 VanDerWaalsContact CD2-CG 3.43Å; L347-N419 VanDerWaalsContact CD2-OD1 3.3Å; L347-N419 WeakPolarHBondContact CD2-OD1 3.46Å; K384-N419 VanDerWaalsContact NZ-CG 3.27Å; K384-N419 PolarHBondContact NZ-ND2 3.02Å; K384-N419 PolarHBondContact NZ-OD1 3.48Å; L415-N419 WeakPolarHBondContact O-CB 3.44Å; L415-N419 PolarHBondContact O-N 3.21Å; L415-N419 PolarHBondContact O-ND2 3.05Å; F416-N419 CarbonylContact O-C 3.59Å; F416-N419 PolarHBondContact O-N 3.25Å; A417-N419 VanDerWaalsContact C-N 3.28Å; A417-N419 PolarHBondContact O-N 3.45Å; N419-T421 PolarHBondContact O-N 2.81Å; N419-T421 VanDerWaalsContact O-N 3.08Å; N419-R422 WeakPolarHBondContact O-CB 3.26Å; N419-R422 PolarHBondContact O-N 3.1Å; N419-I424 HydrophobicContact CB-CD1 4.17Å
420	S	78.2	Confident	87.1	Confident	42 Å²	42	38.2 Å²	38.2	29%	0.294	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-23.1	-175.9	54.1	0	0	0	0	114.7	F416 R422	F416-S420 PolarHBondContact O-N 3.44Å; S420-R422 VanDerWaalsContact C-N 3.28Å; S420-R422 PolarHBondContact O-N 3.12Å
421	T	79.6	Confident	86.9	Confident	105 Å²	105	36 Å²	36	64%	0.644	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	12.2	177.2	56.6	0	0	0	0	114.4	N419 L576	N419-T421 PolarHBondContact O-N 2.81Å; N419-T421 VanDerWaalsContact O-N 3.08Å; T421-L576 HydrophobicContact CG2-CD2 4.16Å
422	R	84.7	Confident	87	Confident	88 Å²	88	33.8 Å²	33.8	33%	0.332	17%	0.17	S	C	.	.	S	Bend	trans	-127.9	146.2	-174.6	-69.3	-163.3	-174.4	-170.8	5.9	112.9	D345 L347 N419 S420 I424	D345-R422 WeakPolarHBondContact O-CB 3.26Å; D345-R422 WeakPolarHBondContact O-CG 3.39Å; L347-R422 HydrophobicContact CB-CB 4.34Å; N419-R422 WeakPolarHBondContact O-CB 3.26Å; N419-R422 PolarHBondContact O-N 3.1Å; S420-R422 VanDerWaalsContact C-N 3.28Å; S420-R422 PolarHBondContact O-N 3.12Å; R422-I424 PolarHBondContact O-N 3.32Å
423	R	87.1	Confident	87	Confident	45 Å²	45	33.8 Å²	33.8	17%	0.17	17%	0.17	C	C	.	.			trans	-72.5	95.1	168.8	-75.6	-177.5	-70.8	-176.8	0.6	109.3	D345 L346 L347 C447 M566 V571	D345-R423 PolarHBondContact O-N 2.77Å; D345-R423 IonicContact OD1-CZ 3.34Å; D345-R423 IonicContact OD1-NE 2.73Å; D345-R423 IonicContact OD1-NH2 3.08Å; D345-R423 PolarHBondContact OD1-NH2 3.32Å; D345-R423 IonicContact OD2-CZ 3.99Å; D345-R423 IonicContact OD2-NE 3.82Å; D345-R423 PolarHBondContact OD2-NE 2.83Å; D345-R423 IonicContact OD2-NH2 3.91Å; D345-R423 PolarHBondContact OD2-NH2 2.97Å; D345-R423 VanDerWaalsContact OD2-NH2 3.08Å; L346-R423 WeakPolarHBondContact CA-O 3.42Å; L347-R423 PolarHBondContact N-O 2.83Å; R423-C447 HydrophobicContact CB-CB 3.95Å; R423-C447 HydrophobicContact CG-CB 4.39Å; R423-M566 HydrophobicContact CB-SD 4.21Å; R423-M566 PolarHBondContact NH1-O 3.01Å; R423-V571 HydrophobicContact CG-CG2 4.28Å
424	I	91.6	Very high	86.8	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.01	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	133.3	-179.7	-68.9	168.5	0	0	0	109.8	L347 L349 F416 N419 R422 L446 C447	L347-I424 WeakPolarHBondContact O-CA 3.41Å; L349-I424 HydrophobicContact CD1-CG2 3.66Å; L349-I424 HydrophobicContact CG-CG2 3.94Å; F416-I424 HydrophobicContact CB-CD1 4.5Å; F416-I424 HydrophobicContact CD1-CD1 3.56Å; F416-I424 HydrophobicContact CE1-CB 4.22Å; F416-I424 HydrophobicContact CE1-CD1 3.83Å; F416-I424 HydrophobicContact CE1-CG2 4.07Å; F416-I424 HydrophobicContact CE2-CG2 4.32Å; F416-I424 HydrophobicContact CG-CD1 3.95Å; F416-I424 HydrophobicContact CZ-CB 4.46Å; F416-I424 HydrophobicContact CZ-CD1 4.44Å; F416-I424 HydrophobicContact CZ-CG2 3.82Å; N419-I424 HydrophobicContact CB-CD1 4.17Å; R422-I424 PolarHBondContact O-N 3.32Å; I424-L446 HydrophobicContact CG2-CD1 4.05Å; I424-L446 WeakPolarHBondContact O-CD1 3.37Å; I424-C447 VanDerWaalsContact O-CB 3.31Å; I424-C447 WeakPolarHBondContact O-CB 3.33Å; I424-C447 PolarHBondContact O-N 2.66Å
425	V	92.8	Very high	86.8	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	124.7	170.5	177.3	0	0	0	0	109.2	L346 L347 F348 L349 V427 C447 A448 I450 L562	L346-V425 HydrophobicContact CD1-CG2 3.98Å; L346-V425 HydrophobicContact CG-CG2 4.21Å; L347-V425 PolarHBondContact O-N 2.9Å; F348-V425 WeakPolarHBondContact CA-O 3.28Å; F348-V425 HydrophobicContact CD1-CB 3.81Å; F348-V425 HydrophobicContact CD1-CG1 3.84Å; F348-V425 HydrophobicContact CE1-CB 4.05Å; F348-V425 HydrophobicContact CE1-CG1 3.8Å; L349-V425 PolarHBondContact N-O 3.21Å; V425-V427 HydrophobicContact CG1-CG2 4.39Å; V425-C447 HydrophobicContact CG2-CB 4.26Å; V425-A448 WeakPolarHBondContact CA-O 3.17Å; V425-A448 HydrophobicContact CG1-CB 4.26Å; V425-A448 HydrophobicContact CG2-CB 4.2Å; V425-I450 HydrophobicContact CG1-CD1 4.09Å; V425-I450 HydrophobicContact CG1-CG1 4.32Å; V425-L562 HydrophobicContact CG1-CD2 4.14Å; V425-L562 HydrophobicContact CG2-CD2 3.97Å
426	L	94.9	Very high	86.9	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	127.9	177.3	-73.7	166.2	0	0	0	109.9	L349 L351 L412 I436 A439 L446 A448 A449 I450	L349-L426 HydrophobicContact CB-CD2 3.98Å; L349-L426 HydrophobicContact CD1-CD2 4.26Å; L351-L426 HydrophobicContact CD1-CD2 3.67Å; L412-L426 HydrophobicContact CD1-CD1 4.47Å; L412-L426 HydrophobicContact CD1-CD2 3.96Å; L412-L426 HydrophobicContact CD2-CD2 3.59Å; L412-L426 HydrophobicContact CG-CD2 4.45Å; L426-I436 HydrophobicContact CB-CD1 4.12Å; L426-I436 HydrophobicContact CB-CG1 4.14Å; L426-I436 HydrophobicContact CB-CG2 3.78Å; L426-I436 HydrophobicContact CD1-CG2 4.08Å; L426-A439 HydrophobicContact CD1-CB 3.61Å; L426-L446 HydrophobicContact CB-CD1 4.15Å; L426-L446 HydrophobicContact CD1-CD1 3.62Å; L426-L446 HydrophobicContact CD1-CD2 3.92Å; L426-L446 HydrophobicContact CD1-CG 4.43Å; L426-L446 HydrophobicContact CG-CD1 3.59Å; L426-A448 PolarHBondContact N-O 3.24Å; L426-A448 VanDerWaalsContact N-O 3.15Å; L426-A449 HydrophobicContact CB-CB 4.3Å; L426-A449 CarbonylContact O-C 3.4Å; L426-A449 VanDerWaalsContact O-CA 3.28Å; L426-A449 WeakPolarHBondContact O-CA 3.46Å; L426-I450 PolarHBondContact O-N 3.19Å
427	V	94.9	Very high	86.9	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	126.3	175	-169	0	0	0	0	109.5	F348 L349 L350 L351 F373 L377 V425 I436 I450 M452	F348-V427 HydrophobicContact CB-CG2 4.47Å; F348-V427 HydrophobicContact CD1-CG2 3.54Å; F348-V427 HydrophobicContact CE1-CG2 4.06Å; F348-V427 HydrophobicContact CG-CG2 4.23Å; L349-V427 PolarHBondContact O-N 2.95Å; L350-V427 HydrophobicContact CD2-CB 3.64Å; L350-V427 HydrophobicContact CD2-CG1 4.24Å; L350-V427 HydrophobicContact CD2-CG2 3.81Å; L351-V427 PolarHBondContact N-O 2.57Å; F373-V427 HydrophobicContact CE1-CG1 4.01Å; F373-V427 HydrophobicContact CZ-CG1 4.38Å; L377-V427 HydrophobicContact CD1-CG1 4.04Å; V425-V427 HydrophobicContact CG1-CG2 4.39Å; V427-I436 VanDerWaalsContact C-CD1 3.47Å; V427-I450 WeakPolarHBondContact CA-O 3.44Å; V427-I450 HydrophobicContact CG1-CB 4.17Å; V427-I450 HydrophobicContact CG1-CG2 4.26Å; V427-I450 HydrophobicContact CG2-CB 4.27Å; V427-I450 HydrophobicContact CG2-CD1 4.21Å; V427-M452 HydrophobicContact CG1-CG 4.42Å; V427-M452 HydrophobicContact CG1-SD 4.14Å
428	G	92.1	Very high	87	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	167.2	178	0	0	0	0	0	112.1	S432 C433 I436 I450 M452	G428-S432 WeakPolarHBondContact CA-OG 3.22Å; G428-C433 PolarHBondContact O-SG 3.4Å; G428-I436 VanDerWaalsContact CA-CD1 3.45Å; G428-I450 PolarHBondContact N-O 2.87Å; G428-M452 VanDerWaalsContact O-CB 3.3Å; G428-M452 WeakPolarHBondContact O-CB 3.45Å; G428-M452 WeakPolarHBondContact O-CG 3.32Å; G428-M452 PolarHBondContact O-N 3.4Å
429	W	91.5	Very high	87.1	Confident	4 Å²	4	17.6 Å²	17.6	2%	0.015	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	135.5	168.5	-153.5	-57.5	0	0	0	110.5	P353 H366 N368 C369 F372 F373 V431 S432 M452 E531 N532 L533	P353-W429 HydrophobicContact CB-CB 4.3Å; P353-W429 WeakPolarHBondContact CB-O 3.28Å; P353-W429 HydrophobicContact CG-CB 4.38Å; H366-W429 AromaticContact CE1-CD1 3.64Å; H366-W429 AromaticContact CE1-CD2 3.95Å; H366-W429 AromaticContact CE1-CE2 3.53Å; H366-W429 AromaticContact CE1-NE1 3.34Å; H366-W429 PolarHBondContact CE1-NE1 2.95Å; H366-W429 VanDerWaalsContact CE1-NE1 3.34Å; H366-W429 AromaticContact NE2-CD2 3.93Å; H366-W429 AromaticContact NE2-CE2 3.34Å; H366-W429 VanDerWaalsContact NE2-CE2 3.34Å; H366-W429 AromaticContact NE2-CZ2 3.4Å; H366-W429 WeakPolarHBondContact NE2-CZ2 3.42Å; H366-W429 AromaticContact NE2-NE1 3.61Å; N368-W429 HydrophobicContact CB-CH2 4.48Å; C369-W429 HydrophobicContact CB-CD2 3.89Å; C369-W429 HydrophobicContact CB-CE3 3.68Å; C369-W429 HydrophobicContact CB-CG 4.41Å; C369-W429 HydrophobicContact CB-CZ3 4.02Å; F372-W429 HydrophobicContact CB-CZ3 3.99Å; F372-W429 AromaticContact CD2-CH2 3.82Å; F372-W429 HydrophobicContact CD2-CH2 3.82Å; F372-W429 AromaticContact CD2-CZ3 3.71Å; F372-W429 HydrophobicContact CD2-CZ3 3.71Å; F372-W429 HydrophobicContact CE2-CH2 4.29Å; F372-W429 HydrophobicContact CG-CZ3 4.02Å; F373-W429 HydrophobicContact CE1-CE3 4.33Å; F373-W429 HydrophobicContact CZ-CB 4.46Å; W429-V431 PolarHBondContact O-N 3.05Å; W429-V431 VanDerWaalsContact O-N 3.12Å; W429-S432 PolarHBondContact N-OG 2.67Å; W429-S432 PolarHBondContact O-N 3.11Å; W429-S432 PolarHBondContact O-OG 2.9Å; W429-S432 VanDerWaalsContact O-OG 3.07Å; W429-M452 CarbonylContact C-O 3.52Å; W429-M452 VanDerWaalsContact CA-O 3.26Å; W429-M452 WeakPolarHBondContact CA-O 3.22Å; W429-M452 HydrophobicContact CB-CB 4.44Å; W429-M452 HydrophobicContact CD2-CB 3.69Å; W429-M452 HydrophobicContact CE3-CB 3.7Å; W429-M452 HydrophobicContact CE3-CE 4.07Å; W429-M452 HydrophobicContact CE3-CG 4.22Å; W429-M452 HydrophobicContact CE3-SD 3.6Å; W429-M452 HydrophobicContact CG-CB 4.04Å; W429-M452 HydrophobicContact CH2-CE 3.94Å; W429-M452 HydrophobicContact CZ3-CB 4.21Å; W429-M452 HydrophobicContact CZ3-CE 3.47Å; W429-M452 VanDerWaalsContact CZ3-CE 3.47Å; W429-M452 HydrophobicContact CZ3-SD 3.61Å; W429-E531 PolarHBondContact NE1-O 3.35Å; W429-N532 WeakPolarHBondContact CZ2-O 3.42Å; W429-L533 HydrophobicContact CH2-CB 4.1Å; W429-L533 HydrophobicContact CH2-CD1 3.74Å; W429-L533 HydrophobicContact CH2-CG 4.09Å; W429-L533 HydrophobicContact CZ2-CB 3.85Å; W429-L533 HydrophobicContact CZ2-CD1 3.68Å; W429-L533 HydrophobicContact CZ2-CG 3.63Å
430	G	87.5	Confident	87	Confident	3 Å²	3	17.4 Å²	17.4	3%	0.031	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	64.1	-116.1	169.1	0	0	0	0	0	112.2	C433 M452 D453	G430-C433 WeakPolarHBondContact O-CB 3.37Å; G430-M452 PolarHBondContact N-O 3.45Å; G430-D453 VanDerWaalsContact CA-O 3.24Å; G430-D453 WeakPolarHBondContact CA-O 3.4Å; G430-D453 PolarHBondContact N-O 3Å
431	V	80.6	Confident	87	Confident	29 Å²	29	18.9 Å²	18.9	18%	0.176	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-72.4	-25.6	177.3	-65.1	0	0	0	0	113.9	P353 F404 W429 C433 I434 P435 Q455	P353-V431 WeakPolarHBondContact O-CG2 3.4Å; F404-V431 HydrophobicContact CZ-CG2 4.32Å; W429-V431 PolarHBondContact O-N 3.05Å; W429-V431 VanDerWaalsContact O-N 3.12Å; V431-C433 PolarHBondContact O-N 3.16Å; V431-I434 WeakPolarHBondContact O-CB 3.16Å; V431-I434 PolarHBondContact O-N 2.94Å; V431-I434 VanDerWaalsContact O-N 3.1Å; V431-P435 WeakPolarHBondContact O-CD 3.44Å; V431-Q455 VanDerWaalsContact CG1-OE1 3.27Å
432	S	87	Confident	87.2	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-74	-11.5	179.5	72.3	0	0	0	0	113.2	L351 W352 G428 W429 I434 P435	L351-S432 WeakPolarHBondContact O-CB 3.08Å; L351-S432 PolarHBondContact O-OG 3.37Å; W352-S432 WeakPolarHBondContact O-CB 3.13Å; G428-S432 WeakPolarHBondContact CA-OG 3.22Å; W429-S432 PolarHBondContact N-OG 2.67Å; W429-S432 PolarHBondContact O-N 3.11Å; W429-S432 PolarHBondContact O-OG 2.9Å; W429-S432 VanDerWaalsContact O-OG 3.07Å; S432-I434 VanDerWaalsContact C-N 3.27Å; S432-I434 PolarHBondContact O-N 3.37Å; S432-P435 VanDerWaalsContact O-CD 3.3Å; S432-P435 WeakPolarHBondContact O-CD 3.43Å; S432-P435 VanDerWaalsContact O-CG 3.32Å; S432-P435 WeakPolarHBondContact O-CG 3.3Å
433	C	87.9	Confident	87	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-67.8	-23.2	167.7	-64	0	0	0	0	113.1	G428 G430 V431 I436 I437 L451 M452 Y454	G428-C433 PolarHBondContact O-SG 3.4Å; G430-C433 WeakPolarHBondContact O-CB 3.37Å; V431-C433 PolarHBondContact O-N 3.16Å; C433-I436 PolarHBondContact O-N 3.21Å; C433-I437 PolarHBondContact O-N 3.11Å; C433-I437 VanDerWaalsContact O-N 3.16Å; C433-L451 HydrophobicContact CB-CB 4.25Å; C433-L451 HydrophobicContact CB-CD2 3.88Å; C433-L451 HydrophobicContact CB-CG 4.49Å; C433-M452 PolarHBondContact SG-O 3.19Å; C433-Y454 HydrophobicContact CB-CD2 3.55Å; C433-Y454 HydrophobicContact CB-CE2 4.41Å; C433-Y454 HydrophobicContact CB-CG 4.37Å
434	I	83.4	Confident	86.5	Confident	2 Å²	2	19 Å²	19	1%	0.01	10%	0.098	C	C	.	.	H	α-helix	trans	-64.9	-52.2	178.3	-63	170.2	0	0	0	112.4	I405 V431 S432 I436 I437 H438 Y454	I405-I434 HydrophobicContact CD1-CG2 3.94Å; I405-I434 HydrophobicContact CG1-CG2 4.46Å; V431-I434 WeakPolarHBondContact O-CB 3.16Å; V431-I434 PolarHBondContact O-N 2.94Å; V431-I434 VanDerWaalsContact O-N 3.1Å; S432-I434 VanDerWaalsContact C-N 3.27Å; S432-I434 PolarHBondContact O-N 3.37Å; I434-I436 PolarHBondContact O-N 2.98Å; I434-I437 WeakPolarHBondContact O-CB 3.44Å; I434-I437 PolarHBondContact O-N 2.97Å; I434-H438 PolarHBondContact O-N 3.32Å; I434-Y454 HydrophobicContact CG1-CE2 3.94Å
435	P	85.1	Confident	85.7	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-65.8	-23.7	173.5	22.2	-31.3	0	0	0	113.2	L351 F404 I405 F408 V431 S432 H438 A439	L351-P435 HydrophobicContact CD2-CG 4.48Å; F404-P435 HydrophobicContact CE1-CG 4.07Å; F404-P435 HydrophobicContact CZ-CG 4.27Å; I405-P435 HydrophobicContact CG1-CB 4.23Å; I405-P435 HydrophobicContact CG2-CB 4.43Å; F408-P435 HydrophobicContact CB-CB 3.98Å; F408-P435 HydrophobicContact CB-CG 4.23Å; F408-P435 HydrophobicContact CD2-CB 4.28Å; F408-P435 HydrophobicContact CD2-CG 3.58Å; F408-P435 HydrophobicContact CE2-CG 4.17Å; F408-P435 HydrophobicContact CG-CB 4.45Å; F408-P435 HydrophobicContact CG-CG 4.16Å; V431-P435 WeakPolarHBondContact O-CD 3.44Å; S432-P435 VanDerWaalsContact O-CD 3.3Å; S432-P435 WeakPolarHBondContact O-CD 3.43Å; S432-P435 VanDerWaalsContact O-CG 3.32Å; S432-P435 WeakPolarHBondContact O-CG 3.3Å; P435-H438 WeakPolarHBondContact O-CB 3.08Å; P435-H438 PolarHBondContact O-N 2.79Å; P435-A439 WeakPolarHBondContact O-CB 2.99Å; P435-A439 PolarHBondContact O-N 3.48Å
436	I	89.7	Confident	85.3	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-64.8	-42.9	172	-63.9	174.3	0	0	0	110.8	L351 L426 V427 G428 C433 I434 H438 A439 V440 A449 L451	L351-I436 HydrophobicContact CB-CD1 4.48Å; L351-I436 HydrophobicContact CD1-CD1 4.41Å; L351-I436 HydrophobicContact CD1-CG1 4.49Å; L351-I436 HydrophobicContact CD2-CD1 4.26Å; L351-I436 HydrophobicContact CD2-CG1 3.74Å; L426-I436 HydrophobicContact CB-CD1 4.12Å; L426-I436 HydrophobicContact CB-CG1 4.14Å; L426-I436 HydrophobicContact CB-CG2 3.78Å; L426-I436 HydrophobicContact CD1-CG2 4.08Å; V427-I436 VanDerWaalsContact C-CD1 3.47Å; G428-I436 VanDerWaalsContact CA-CD1 3.45Å; C433-I436 PolarHBondContact O-N 3.21Å; I434-I436 PolarHBondContact O-N 2.98Å; I436-H438 VanDerWaalsContact C-N 3.26Å; I436-H438 PolarHBondContact O-N 2.91Å; I436-A439 WeakPolarHBondContact O-CA 3.25Å; I436-A439 WeakPolarHBondContact O-CB 3.38Å; I436-A439 PolarHBondContact O-N 3.21Å; I436-V440 HydrophobicContact CG2-CG2 4.08Å; I436-V440 VanDerWaalsContact O-CG2 3.24Å; I436-V440 WeakPolarHBondContact O-CG2 3.37Å; I436-V440 PolarHBondContact O-N 3.18Å; I436-A449 HydrophobicContact CG2-CB 3.63Å; I436-L451 HydrophobicContact CB-CD2 3.84Å; I436-L451 HydrophobicContact CD1-CD2 4.12Å; I436-L451 HydrophobicContact CG2-CD2 3.61Å
437	I	85.6	Confident	84.9	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-56	-41.5	174.5	-72.4	170.3	0	0	0	111.3	C433 I434 A439 T441 L451 Y454 L470	C433-I437 PolarHBondContact O-N 3.11Å; C433-I437 VanDerWaalsContact O-N 3.16Å; I434-I437 WeakPolarHBondContact O-CB 3.44Å; I434-I437 PolarHBondContact O-N 2.97Å; I437-A439 VanDerWaalsContact C-N 3.34Å; I437-T441 PolarHBondContact O-OG1 2.73Å; I437-L451 HydrophobicContact CD1-CD1 4.36Å; I437-L451 HydrophobicContact CG1-CD1 4.12Å; I437-Y454 HydrophobicContact CD1-CD2 4.13Å; I437-Y454 HydrophobicContact CD1-CE1 4.16Å; I437-Y454 HydrophobicContact CD1-CE2 3.47Å; I437-Y454 VanDerWaalsContact CD1-CE2 3.47Å; I437-Y454 VanDerWaalsContact CD1-CZ 3.49Å; I437-L470 HydrophobicContact CB-CD2 4.48Å; I437-L470 HydrophobicContact CG1-CD2 4.35Å; I437-L470 HydrophobicContact CG2-CD2 3.81Å; I437-L470 HydrophobicContact CG2-CG 3.97Å
438	H	84.2	Confident	84.6	Confident	38 Å²	38	21.2 Å²	21.2	18%	0.176	11%	0.114	C	C	.	.	H	α-helix	trans	-68.2	-28.7	173	-79.7	-139.7	0	0	0	113.9	M409 I434 P435 I436 T441 K469	M409-H438 HydrophobicContact SD-CB 4.44Å; I434-H438 PolarHBondContact O-N 3.32Å; P435-H438 WeakPolarHBondContact O-CB 3.08Å; P435-H438 PolarHBondContact O-N 2.79Å; I436-H438 VanDerWaalsContact C-N 3.26Å; I436-H438 PolarHBondContact O-N 2.91Å; H438-T441 PolarHBondContact O-OG1 2.85Å; H438-K469 PolarHBondContact CE1-NZ 3Å; H438-K469 PolarHBondContact NE2-NZ 2.95Å
439	A	86.5	Confident	84.7	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-77.7	-40.4	-179.3	0	0	0	0	0	111.9	M409 L412 L426 P435 I436 I437 T441 K442 Y443	M409-A439 HydrophobicContact CE-CB 4.3Å; M409-A439 HydrophobicContact SD-CB 3.96Å; L412-A439 HydrophobicContact CD1-CB 3.74Å; L426-A439 HydrophobicContact CD1-CB 3.61Å; P435-A439 WeakPolarHBondContact O-CB 2.99Å; P435-A439 PolarHBondContact O-N 3.48Å; I436-A439 WeakPolarHBondContact O-CA 3.25Å; I436-A439 WeakPolarHBondContact O-CB 3.38Å; I436-A439 PolarHBondContact O-N 3.21Å; I437-A439 VanDerWaalsContact C-N 3.34Å; A439-T441 PolarHBondContact O-N 3.4Å; A439-K442 PolarHBondContact O-N 3.36Å; A439-Y443 HydrophobicContact CB-CD2 3.84Å; A439-Y443 HydrophobicContact CB-CE2 3.8Å; A439-Y443 WeakPolarHBondContact O-CD2 3.45Å; A439-Y443 PolarHBondContact O-N 3.14Å
440	V	83.1	Confident	84.8	Confident	7 Å²	7	21 Å²	21	4%	0.042	11%	0.113	C	C	.	.	H	α-helix	trans	-62.2	-34.8	177.9	-167.4	0	0	0	0	111.5	I436 K442 L446 A449 F473 K475	I436-V440 HydrophobicContact CG2-CG2 4.08Å; I436-V440 VanDerWaalsContact O-CG2 3.24Å; I436-V440 WeakPolarHBondContact O-CG2 3.37Å; I436-V440 PolarHBondContact O-N 3.18Å; V440-K442 PolarHBondContact O-N 3.02Å; V440-L446 HydrophobicContact CB-CD2 3.95Å; V440-L446 HydrophobicContact CG1-CD2 3.79Å; V440-L446 HydrophobicContact CG2-CD2 3.51Å; V440-A449 HydrophobicContact CG2-CB 3.88Å; V440-F473 HydrophobicContact CB-CD2 4.41Å; V440-F473 HydrophobicContact CB-CE2 3.7Å; V440-F473 HydrophobicContact CG1-CD2 3.97Å; V440-F473 HydrophobicContact CG1-CE2 3.26Å; V440-F473 HydrophobicContact CG1-CZ 3.89Å; V440-F473 HydrophobicContact CG2-CE2 4.17Å; V440-K475 HydrophobicContact CG1-CB 3.6Å; V440-K475 HydrophobicContact CG1-CG 3.49Å; V440-K475 VanDerWaalsContact CG1-CG 3.49Å
441	T	77.5	Confident	85	Confident	73 Å²	73	20.9 Å²	20.9	45%	0.448	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	0.4	176	57.7	0	0	0	0	114.2	I437 H438 A439 K469	I437-T441 PolarHBondContact O-OG1 2.73Å; H438-T441 PolarHBondContact O-OG1 2.85Å; A439-T441 PolarHBondContact O-N 3.4Å; T441-K469 WeakPolarHBondContact CG2-O 3.36Å
442	K	83	Confident	85.6	Confident	98 Å²	98	19.5 Å²	19.5	43%	0.426	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-32.7	-178.7	-169.7	-166.1	167.8	-159.8	0	113.1	M409 D413 A439 V440	M409-K442 HydrophobicContact CE-CB 4.12Å; M409-K442 HydrophobicContact CE-CD 3.31Å; M409-K442 HydrophobicContact CE-CG 4.32Å; D413-K442 IonicContact OD1-NZ 2.93Å; D413-K442 PolarHBondContact OD1-NZ 2.9Å; D413-K442 IonicContact OD2-NZ 2.62Å; D413-K442 PolarHBondContact OD2-NZ 3.38Å; A439-K442 PolarHBondContact O-N 3.36Å; V440-K442 PolarHBondContact O-N 3.02Å
443	Y	81.6	Confident	85.7	Confident	19 Å²	19	19.5 Å²	19.5	8%	0.075	10%	0.103	C	C	.	.			trans	-111	98.8	-170.9	-55.7	-62.4	0	0	0	112.1	M409 L412 D413 F416 A439 S445 L446	M409-Y443 HydrophobicContact CE-CE2 3.74Å; M409-Y443 PolarHBondContact O-OH 3.14Å; M409-Y443 HydrophobicContact SD-CE2 4.44Å; L412-Y443 HydrophobicContact CB-CE2 4.02Å; L412-Y443 HydrophobicContact CD1-CE2 4.22Å; D413-Y443 VanDerWaalsContact CG-OH 3.32Å; D413-Y443 WeakPolarHBondContact OD1-CE1 3.45Å; D413-Y443 PolarHBondContact OD1-OH 3.04Å; D413-Y443 VanDerWaalsContact OD1-OH 3.11Å; F416-Y443 HydrophobicContact CD1-CD1 4.48Å; F416-Y443 HydrophobicContact CD1-CG 4.34Å; F416-Y443 HydrophobicContact CD2-CD1 4.34Å; F416-Y443 HydrophobicContact CD2-CD2 4.1Å; F416-Y443 HydrophobicContact CD2-CE1 4.38Å; F416-Y443 HydrophobicContact CD2-CE2 4.14Å; F416-Y443 HydrophobicContact CD2-CG 4.21Å; F416-Y443 HydrophobicContact CE1-CD2 4.42Å; F416-Y443 HydrophobicContact CE1-CG 4.05Å; F416-Y443 HydrophobicContact CE2-CD1 4.49Å; F416-Y443 AromaticContact CE2-CD2 3.54Å; F416-Y443 HydrophobicContact CE2-CD2 3.54Å; F416-Y443 AromaticContact CE2-CE2 3.85Å; F416-Y443 HydrophobicContact CE2-CE2 3.85Å; F416-Y443 AromaticContact CE2-CG 3.91Å; F416-Y443 HydrophobicContact CE2-CG 3.91Å; F416-Y443 HydrophobicContact CG-CD1 4.34Å; F416-Y443 HydrophobicContact CG-CG 4.42Å; F416-Y443 AromaticContact CZ-CD2 3.72Å; F416-Y443 HydrophobicContact CZ-CD2 3.72Å; F416-Y443 HydrophobicContact CZ-CE2 4.48Å; F416-Y443 AromaticContact CZ-CG 3.81Å; F416-Y443 HydrophobicContact CZ-CG 3.81Å; A439-Y443 HydrophobicContact CB-CD2 3.84Å; A439-Y443 HydrophobicContact CB-CE2 3.8Å; A439-Y443 WeakPolarHBondContact O-CD2 3.45Å; A439-Y443 PolarHBondContact O-N 3.14Å; Y443-S445 PolarHBondContact O-N 3.31Å; Y443-S445 VanDerWaalsContact O-N 3.14Å; Y443-L446 WeakPolarHBondContact O-CB 3.26Å; Y443-L446 PolarHBondContact O-N 3.03Å; Y443-L446 VanDerWaalsContact O-N 3.09Å
444	D	75.3	Confident	85.7	Confident	122 Å²	122	19.5 Å²	19.5	65%	0.652	10%	0.103	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-29.1	178.2	-68	-46.4	0	0	0	114.1	L446 K475	D444-L446 VanDerWaalsContact C-N 3.3Å; D444-L446 PolarHBondContact O-N 3.19Å; D444-K475 WeakPolarHBondContact O-CE 3.48Å; D444-K475 PolarHBondContact O-NZ 3.27Å; D444-K475 VanDerWaalsContact O-NZ 3.09Å; D444-K475 IonicContact OD1-NZ 2.68Å
445	S	75.6	Confident	85.7	Confident	37 Å²	37	21.3 Å²	21.3	26%	0.259	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	4.8	-179.9	50.4	0	0	0	0	114.8	Y443 C447 F575	Y443-S445 PolarHBondContact O-N 3.31Å; Y443-S445 VanDerWaalsContact O-N 3.14Å; S445-C447 PolarHBondContact O-N 3.17Å; S445-F575 WeakPolarHBondContact OG-CE1 3.42Å; S445-F575 WeakPolarHBondContact OG-CZ 3.5Å
446	L	85.1	Confident	85.6	Confident	5 Å²	5	21.3 Å²	21.3	3%	0.026	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	123.9	171.9	-174.6	72.7	0	0	0	110.7	F416 I424 L426 V440 Y443 D444 A448 A449	F416-L446 HydrophobicContact CZ-CB 4.49Å; F416-L446 HydrophobicContact CZ-CD1 4Å; I424-L446 HydrophobicContact CG2-CD1 4.05Å; I424-L446 WeakPolarHBondContact O-CD1 3.37Å; L426-L446 HydrophobicContact CB-CD1 4.15Å; L426-L446 HydrophobicContact CD1-CD1 3.62Å; L426-L446 HydrophobicContact CD1-CD2 3.92Å; L426-L446 HydrophobicContact CD1-CG 4.43Å; L426-L446 HydrophobicContact CG-CD1 3.59Å; V440-L446 HydrophobicContact CB-CD2 3.95Å; V440-L446 HydrophobicContact CG1-CD2 3.79Å; V440-L446 HydrophobicContact CG2-CD2 3.51Å; Y443-L446 WeakPolarHBondContact O-CB 3.26Å; Y443-L446 PolarHBondContact O-N 3.03Å; Y443-L446 VanDerWaalsContact O-N 3.09Å; D444-L446 VanDerWaalsContact C-N 3.3Å; D444-L446 PolarHBondContact O-N 3.19Å; L446-A448 WeakPolarHBondContact CD1-O 3.23Å; L446-A448 WeakPolarHBondContact CG-O 3.21Å; L446-A449 HydrophobicContact CD2-CB 4.18Å
447	C	86.6	Confident	85.1	Confident	7 Å²	7	22.6 Å²	22.6	5%	0.047	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	-41.4	178.6	-171.7	0	0	0	0	112.3	R423 I424 V425 S445 P476 M566	R423-C447 HydrophobicContact CB-CB 3.95Å; R423-C447 HydrophobicContact CG-CB 4.39Å; I424-C447 VanDerWaalsContact O-CB 3.31Å; I424-C447 WeakPolarHBondContact O-CB 3.33Å; I424-C447 PolarHBondContact O-N 2.66Å; V425-C447 HydrophobicContact CG2-CB 4.26Å; S445-C447 PolarHBondContact O-N 3.17Å; C447-P476 WeakPolarHBondContact O-CD 3.49Å; C447-M566 VanDerWaalsContact SG-SD 3.63Å
448	A	88.9	Confident	84.4	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	169.7	174.8	0	0	0	0	0	111.6	V425 L426 L446 P476 F561 L562 V565	V425-A448 WeakPolarHBondContact CA-O 3.17Å; V425-A448 HydrophobicContact CG1-CB 4.26Å; V425-A448 HydrophobicContact CG2-CB 4.2Å; L426-A448 PolarHBondContact N-O 3.24Å; L426-A448 VanDerWaalsContact N-O 3.15Å; L446-A448 WeakPolarHBondContact CD1-O 3.23Å; L446-A448 WeakPolarHBondContact CG-O 3.21Å; A448-P476 CarbonylContact C-O 3.47Å; A448-P476 WeakPolarHBondContact CA-O 3.49Å; A448-P476 HydrophobicContact CB-CB 4.1Å; A448-F561 HydrophobicContact CB-CE1 4.08Å; A448-F561 HydrophobicContact CB-CZ 4.46Å; A448-L562 HydrophobicContact CB-CD2 3.99Å; A448-V565 HydrophobicContact CB-CG1 4.47Å
449	A	92.1	Very high	83.7	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	148.1	165	0	0	0	0	0	112.8	L426 I436 V440 L446 P476 L477 L478	L426-A449 HydrophobicContact CB-CB 4.3Å; L426-A449 CarbonylContact O-C 3.4Å; L426-A449 VanDerWaalsContact O-CA 3.28Å; L426-A449 WeakPolarHBondContact O-CA 3.46Å; I436-A449 HydrophobicContact CG2-CB 3.63Å; V440-A449 HydrophobicContact CG2-CB 3.88Å; L446-A449 HydrophobicContact CD2-CB 4.18Å; A449-P476 PolarHBondContact N-O 3.07Å; A449-L477 HydrophobicContact CB-CD1 3.5Å; A449-L477 VanDerWaalsContact CB-CD1 3.5Å; A449-L477 CarbonylContact O-C 3.57Å; A449-L477 WeakPolarHBondContact O-CA 3.46Å; A449-L478 PolarHBondContact O-N 3.37Å
450	I	93.6	Very high	82.8	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	120.3	178.3	-59.4	166	0	0	0	108.3	F348 V425 L426 V427 G428 M452 L478 V480 I558 L562	F348-I450 HydrophobicContact CE1-CD1 4.1Å; V425-I450 HydrophobicContact CG1-CD1 4.09Å; V425-I450 HydrophobicContact CG1-CG1 4.32Å; L426-I450 PolarHBondContact O-N 3.19Å; V427-I450 WeakPolarHBondContact CA-O 3.44Å; V427-I450 HydrophobicContact CG1-CB 4.17Å; V427-I450 HydrophobicContact CG1-CG2 4.26Å; V427-I450 HydrophobicContact CG2-CB 4.27Å; V427-I450 HydrophobicContact CG2-CD1 4.21Å; G428-I450 PolarHBondContact N-O 2.87Å; I450-M452 HydrophobicContact CG2-CG 4.19Å; I450-L478 WeakPolarHBondContact CA-O 3.23Å; I450-L478 HydrophobicContact CG1-CB 4.28Å; I450-V480 HydrophobicContact CG2-CG2 4.28Å; I450-I558 HydrophobicContact CD1-CG1 4.48Å; I450-I558 HydrophobicContact CD1-CG2 3.68Å; I450-I558 HydrophobicContact CG2-CD1 4.3Å; I450-I558 HydrophobicContact CG2-CG1 4.31Å; I450-L562 HydrophobicContact CD1-CD1 4.06Å; I450-L562 HydrophobicContact CD1-CD2 4.48Å; I450-L562 HydrophobicContact CD1-CG 4.42Å
451	L	92.7	Very high	82	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	96.3	-173.8	-53.9	-175.1	0	0	0	109.9	C433 I436 I437 L477 L478 Y479 V480	C433-L451 HydrophobicContact CB-CB 4.25Å; C433-L451 HydrophobicContact CB-CD2 3.88Å; C433-L451 HydrophobicContact CB-CG 4.49Å; I436-L451 HydrophobicContact CB-CD2 3.84Å; I436-L451 HydrophobicContact CD1-CD2 4.12Å; I436-L451 HydrophobicContact CG2-CD2 3.61Å; I437-L451 HydrophobicContact CD1-CD1 4.36Å; I437-L451 HydrophobicContact CG1-CD1 4.12Å; L451-L477 HydrophobicContact CD1-CD1 3.79Å; L451-L477 HydrophobicContact CD1-CD2 4.03Å; L451-L477 HydrophobicContact CD1-CG 4.14Å; L451-L477 HydrophobicContact CD2-CD1 4.46Å; L451-L477 HydrophobicContact CG-CD1 3.86Å; L451-L477 HydrophobicContact CG-CG 4.45Å; L451-L478 PolarHBondContact N-O 2.99Å; L451-Y479 HydrophobicContact CB-CD1 4.04Å; L451-Y479 HydrophobicContact CB-CE1 4.32Å; L451-Y479 HydrophobicContact CD1-CD1 4.07Å; L451-Y479 HydrophobicContact CD1-CE1 3.51Å; L451-Y479 HydrophobicContact CG-CE1 4.48Å; L451-V480 PolarHBondContact O-N 3.48Å
452	M	93.3	Very high	81.8	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	127.1	179.4	-49.4	-173.3	79.7	0	0	109.7	F372 F373 V427 G428 W429 G430 C433 I450 Y454 V480 L533 I554 I558	F372-M452 HydrophobicContact CD1-CE 3.84Å; F372-M452 HydrophobicContact CD2-CE 4.13Å; F372-M452 HydrophobicContact CE1-CE 4.01Å; F372-M452 HydrophobicContact CE2-CE 4.28Å; F372-M452 HydrophobicContact CG-CE 3.91Å; F372-M452 HydrophobicContact CZ-CE 4.22Å; F373-M452 HydrophobicContact CE1-SD 4.24Å; V427-M452 HydrophobicContact CG1-CG 4.42Å; V427-M452 HydrophobicContact CG1-SD 4.14Å; G428-M452 VanDerWaalsContact O-CB 3.3Å; G428-M452 WeakPolarHBondContact O-CB 3.45Å; G428-M452 WeakPolarHBondContact O-CG 3.32Å; G428-M452 PolarHBondContact O-N 3.4Å; W429-M452 CarbonylContact C-O 3.52Å; W429-M452 VanDerWaalsContact CA-O 3.26Å; W429-M452 WeakPolarHBondContact CA-O 3.22Å; W429-M452 HydrophobicContact CB-CB 4.44Å; W429-M452 HydrophobicContact CD2-CB 3.69Å; W429-M452 HydrophobicContact CE3-CB 3.7Å; W429-M452 HydrophobicContact CE3-CE 4.07Å; W429-M452 HydrophobicContact CE3-CG 4.22Å; W429-M452 HydrophobicContact CE3-SD 3.6Å; W429-M452 HydrophobicContact CG-CB 4.04Å; W429-M452 HydrophobicContact CH2-CE 3.94Å; W429-M452 HydrophobicContact CZ3-CB 4.21Å; W429-M452 HydrophobicContact CZ3-CE 3.47Å; W429-M452 VanDerWaalsContact CZ3-CE 3.47Å; W429-M452 HydrophobicContact CZ3-SD 3.61Å; G430-M452 PolarHBondContact N-O 3.45Å; C433-M452 PolarHBondContact SG-O 3.19Å; I450-M452 HydrophobicContact CG2-CG 4.19Å; M452-Y454 PolarHBondContact O-N 3.09Å; M452-V480 CarbonylContact C-O 3.54Å; M452-V480 WeakPolarHBondContact CA-O 3.48Å; M452-L533 HydrophobicContact CB-CD1 4.3Å; M452-L533 HydrophobicContact CE-CD1 3.86Å; M452-I554 HydrophobicContact CE-CG2 4.25Å; M452-I558 HydrophobicContact CE-CD1 4.33Å
453	D	89.6	Confident	81.2	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	36.5	61.4	-170.1	-165.1	63.3	0	0	0	114	G430 Q455 V480 S485 E531	G430-D453 VanDerWaalsContact CA-O 3.24Å; G430-D453 WeakPolarHBondContact CA-O 3.4Å; G430-D453 PolarHBondContact N-O 3Å; D453-Q455 PolarHBondContact O-N 3.36Å; D453-Q455 VanDerWaalsContact O-N 3.12Å; D453-V480 PolarHBondContact N-O 3.14Å; D453-S485 VanDerWaalsContact CG-OG 3.29Å; D453-S485 WeakPolarHBondContact OD1-CB 3.16Å; D453-S485 PolarHBondContact OD1-OG 3.27Å; D453-S485 PolarHBondContact OD2-OG 2.83Å; D453-E531 VanDerWaalsContact CB-O 3.27Å; D453-E531 WeakPolarHBondContact CB-O 3.44Å; D453-E531 WeakPolarHBondContact OD2-CA 3.24Å; D453-E531 VanDerWaalsContact OD2-CB 3.24Å; D453-E531 WeakPolarHBondContact OD2-CB 3.43Å
454	Y	87.5	Confident	80.5	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	22%	0.215	C	C	.	.			trans	-61.7	118.9	180	171	-112.7	0	0	0	111.7	C433 I434 I437 M452 N456 H467 Y479 C488 L493	C433-Y454 HydrophobicContact CB-CD2 3.55Å; C433-Y454 HydrophobicContact CB-CE2 4.41Å; C433-Y454 HydrophobicContact CB-CG 4.37Å; I434-Y454 HydrophobicContact CG1-CE2 3.94Å; I437-Y454 HydrophobicContact CD1-CD2 4.13Å; I437-Y454 HydrophobicContact CD1-CE1 4.16Å; I437-Y454 HydrophobicContact CD1-CE2 3.47Å; I437-Y454 VanDerWaalsContact CD1-CE2 3.47Å; I437-Y454 VanDerWaalsContact CD1-CZ 3.49Å; M452-Y454 PolarHBondContact O-N 3.09Å; Y454-N456 HydrophobicContact CD1-CB 3.83Å; Y454-N456 HydrophobicContact CE1-CB 3.5Å; Y454-N456 VanDerWaalsContact CE1-CB 3.5Å; Y454-N456 PolarHBondContact O-N 2.9Å; Y454-H467 AromaticContact CE1-CE1 3.41Å; Y454-H467 VanDerWaalsContact CE1-CE1 3.41Å; Y454-H467 WeakPolarHBondContact CE1-CE1 3.27Å; Y454-H467 AromaticContact CE1-NE2 3.54Å; Y454-Y479 AromaticContact CD1-CE1 3.89Å; Y454-Y479 HydrophobicContact CD1-CE1 3.89Å; Y454-Y479 HydrophobicContact CG-CE1 4.12Å; Y454-C488 WeakPolarHBondContact O-CB 3.43Å; Y454-C488 PolarHBondContact O-SG 2.97Å; Y454-L493 HydrophobicContact CD1-CD2 4.1Å
455	Q	84.2	Confident	80.2	Confident	40 Å²	40	37.3 Å²	37.3	19%	0.187	22%	0.217	C	C	.	.			trans	-75.6	84.6	-179	-58.3	-166.3	-8.8	0	0	111.2	V431 D453 L457 W464 Y487	V431-Q455 VanDerWaalsContact CG1-OE1 3.27Å; D453-Q455 PolarHBondContact O-N 3.36Å; D453-Q455 VanDerWaalsContact O-N 3.12Å; Q455-L457 VanDerWaalsContact C-N 3.27Å; Q455-W464 PolarHBondContact O-NE1 2.98Å; Q455-Y487 CarbonylContact C-O 3.54Å; Q455-Y487 VanDerWaalsContact CA-O 3.32Å; Q455-Y487 WeakPolarHBondContact CA-O 3.23Å; Q455-Y487 HydrophobicContact CG-CG 4.27Å
456	N	81.1	Confident	79.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.211	C	C	.	.			trans	-79.2	-9.4	174.7	77.3	15.7	0	0	0	113.5	Y454 S463 W464 H467 Y487 N489 L493	Y454-N456 HydrophobicContact CD1-CB 3.83Å; Y454-N456 HydrophobicContact CE1-CB 3.5Å; Y454-N456 VanDerWaalsContact CE1-CB 3.5Å; Y454-N456 PolarHBondContact O-N 2.9Å; N456-S463 CarbonylContact O-C 3.45Å; N456-S463 VanDerWaalsContact O-CA 3.31Å; N456-S463 WeakPolarHBondContact O-CA 3.31Å; N456-W464 PolarHBondContact O-N 3.06Å; N456-H467 WeakPolarHBondContact CB-NE2 3.11Å; N456-Y487 PolarHBondContact N-O 3.44Å; N456-N489 PolarHBondContact ND2-O 3.26Å; N456-N489 PolarHBondContact OD1-N 3.37Å; N456-L493 HydrophobicContact CB-CD2 4.43Å; N456-L493 WeakPolarHBondContact ND2-CD2 3.45Å
457	L	79.2	Confident	78.6	Confident	27 Å²	27	37.1 Å²	37.1	14%	0.141	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-110.8	149.3	168.4	-51.5	-174.5	0	0	0	111.9	Q455 S463 W464 Y487 N489	Q455-L457 VanDerWaalsContact C-N 3.27Å; L457-S463 VanDerWaalsContact CD2-OG 3.23Å; L457-S463 WeakPolarHBondContact CD2-OG 3.41Å; L457-W464 PolarHBondContact O-NE1 3.35Å; L457-Y487 PolarHBondContact N-O 2.91Å; L457-N489 HydrophobicContact CD1-CB 4.33Å; L457-N489 HydrophobicContact CD2-CB 4.33Å; L457-N489 HydrophobicContact CG-CB 4.4Å
458	T	71	Confident	77.4	Confident	33 Å²	33	41.6 Å²	41.6	20%	0.202	23%	0.233	C	C	.	.			trans	-75.7	168	161.1	59.8	0	0	0	0	110.6	A460 G461 I462 W464	T458-A460 PolarHBondContact O-N 3.17Å; T458-A460 PolarHBondContact OG1-N 2.86Å; T458-G461 PolarHBondContact O-N 3.12Å; T458-I462 WeakPolarHBondContact CB-O 3.17Å; T458-I462 WeakPolarHBondContact CG2-O 3.46Å; T458-I462 PolarHBondContact N-O 2.96Å; T458-I462 WeakPolarHBondContact OG1-CB 3.22Å; T458-I462 PolarHBondContact OG1-N 3.4Å; T458-I462 PolarHBondContact OG1-O 3.13Å; T458-W464 HydrophobicContact CG2-CD2 4.1Å; T458-W464 HydrophobicContact CG2-CH2 4.41Å; T458-W464 HydrophobicContact CG2-CZ2 3.79Å
459	S	69.6	Low	76.3	Confident	117 Å²	117	46.3 Å²	46.3	82%	0.818	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-9.4	170.7	53.6	0	0	0	0	114.9
460	A	68.9	Low	75	Confident	74 Å²	74	46.4 Å²	46.4	61%	0.612	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	5.2	172	0	0	0	0	0	113.4	T458 I462	T458-A460 PolarHBondContact O-N 3.17Å; T458-A460 PolarHBondContact OG1-N 2.86Å; A460-I462 HydrophobicContact CB-CD1 4.17Å; A460-I462 HydrophobicContact CB-CG1 4.17Å; A460-I462 PolarHBondContact O-N 3.49Å; A460-I462 VanDerWaalsContact O-N 3.16Å
461	G	66.4	Low	73.1	Confident	45 Å²	45	51.3 Å²	51.3	46%	0.464	28%	0.276	S	S	.	.	S	Bend	trans	73.9	-7.4	-173.6	0	0	0	0	0	114.6	T458 S463	T458-G461 PolarHBondContact O-N 3.12Å; G461-S463 PolarHBondContact O-N 3.26Å
462	I	72.8	Confident	71.3	Confident	117 Å²	117	55.3 Å²	55.3	60%	0.6	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-67.4	125.1	174.4	-54.5	171.1	0	0	0	107.9	T458 A460	T458-I462 WeakPolarHBondContact CB-O 3.17Å; T458-I462 WeakPolarHBondContact CG2-O 3.46Å; T458-I462 PolarHBondContact N-O 2.96Å; T458-I462 WeakPolarHBondContact OG1-CB 3.22Å; T458-I462 PolarHBondContact OG1-N 3.4Å; T458-I462 PolarHBondContact OG1-O 3.13Å; A460-I462 HydrophobicContact CB-CD1 4.17Å; A460-I462 HydrophobicContact CB-CG1 4.17Å; A460-I462 PolarHBondContact O-N 3.49Å; A460-I462 VanDerWaalsContact O-N 3.16Å
463	S	70.5	Confident	70.1	Confident	41 Å²	41	55.9 Å²	55.9	29%	0.287	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-76.4	143.9	-176.7	-43.2	0	0	0	0	113.2	N456 L457 G461	N456-S463 CarbonylContact O-C 3.45Å; N456-S463 VanDerWaalsContact O-CA 3.31Å; N456-S463 WeakPolarHBondContact O-CA 3.31Å; L457-S463 VanDerWaalsContact CD2-OG 3.23Å; L457-S463 WeakPolarHBondContact CD2-OG 3.41Å; G461-S463 PolarHBondContact O-N 3.26Å
464	W	67.6	Low	68.9	Low	58 Å²	58	59.6 Å²	59.6	22%	0.22	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-71.3	145.4	173.8	-64.9	97.2	0	0	0	111.7	F401 Q455 N456 L457 T458 R492	F401-W464 HydrophobicContact CD1-CH2 4.48Å; F401-W464 HydrophobicContact CD2-CH2 4.2Å; F401-W464 HydrophobicContact CE1-CH2 4.22Å; F401-W464 HydrophobicContact CE1-CZ2 4.41Å; F401-W464 AromaticContact CE2-CH2 3.91Å; F401-W464 HydrophobicContact CE2-CH2 3.91Å; F401-W464 HydrophobicContact CE2-CZ2 4.45Å; F401-W464 HydrophobicContact CG-CH2 4.48Å; F401-W464 AromaticContact CZ-CH2 3.92Å; F401-W464 HydrophobicContact CZ-CH2 3.92Å; F401-W464 HydrophobicContact CZ-CZ2 4.09Å; Q455-W464 PolarHBondContact O-NE1 2.98Å; N456-W464 PolarHBondContact O-N 3.06Å; L457-W464 PolarHBondContact O-NE1 3.35Å; T458-W464 HydrophobicContact CG2-CD2 4.1Å; T458-W464 HydrophobicContact CG2-CH2 4.41Å; T458-W464 HydrophobicContact CG2-CZ2 3.79Å; W464-R492 PolarHBondContact O-NH2 3.37Å
465	R	67.8	Low	68.4	Low	182 Å²	182	60.7 Å²	60.7	69%	0.687	35%	0.345	S	S	*	.	S	Bend	trans	-87.4	-1.5	172.7	-69.7	-162.8	-173.5	-162.4	4.3	114	H467 E468	R465-H467 PolarHBondContact O-N 3.17Å; R465-E468 WeakPolarHBondContact CB-OE1 3.5Å; R465-E468 VanDerWaalsContact CD-OE1 3.31Å; R465-E468 WeakPolarHBondContact CD-OE1 3.41Å; R465-E468 WeakPolarHBondContact CD-OE2 3.03Å; R465-E468 WeakPolarHBondContact CG-OE1 3.3Å; R465-E468 VanDerWaalsContact O-CB 3.27Å; R465-E468 WeakPolarHBondContact O-CB 3.34Å; R465-E468 WeakPolarHBondContact O-CG 3.38Å; R465-E468 PolarHBondContact O-N 3.14Å
466	N	65.6	Low	68.3	Low	24 Å²	24	59.3 Å²	59.3	13%	0.128	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-57.3	-21	-175.8	-59.8	-27.3	0	0	0	114.1	E468 K469	N466-E468 VanDerWaalsContact C-N 3.26Å; N466-E468 PolarHBondContact O-N 3.37Å; N466-K469 WeakPolarHBondContact O-CB 3.29Å; N466-K469 PolarHBondContact O-N 3Å
467	H	62.7	Low	68.6	Low	13 Å²	13	59.4 Å²	59.4	6%	0.06	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-62.8	-27.1	171.4	-63.1	-77.2	0	0	0	114.3	Y454 N456 R465 K469 L470 V496	Y454-H467 AromaticContact CE1-CE1 3.41Å; Y454-H467 VanDerWaalsContact CE1-CE1 3.41Å; Y454-H467 WeakPolarHBondContact CE1-CE1 3.27Å; Y454-H467 AromaticContact CE1-NE2 3.54Å; N456-H467 WeakPolarHBondContact CB-NE2 3.11Å; R465-H467 PolarHBondContact O-N 3.17Å; H467-K469 PolarHBondContact O-N 2.97Å; H467-K469 VanDerWaalsContact O-N 3.11Å; H467-L470 WeakPolarHBondContact O-CB 3.13Å; H467-L470 PolarHBondContact O-N 3.37Å; H467-V496 HydrophobicContact CB-CG1 4.33Å; H467-V496 HydrophobicContact CB-CG2 3.91Å
468	E	61.3	Low	69	Low	101 Å²	101	58.4 Å²	58.4	47%	0.472	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-63.6	-13.9	176.4	-65.3	158.4	-154.9	0	0	111.6	R465 N466 E471	R465-E468 WeakPolarHBondContact CB-OE1 3.5Å; R465-E468 VanDerWaalsContact CD-OE1 3.31Å; R465-E468 WeakPolarHBondContact CD-OE1 3.41Å; R465-E468 WeakPolarHBondContact CD-OE2 3.03Å; R465-E468 WeakPolarHBondContact CG-OE1 3.3Å; R465-E468 VanDerWaalsContact O-CB 3.27Å; R465-E468 WeakPolarHBondContact O-CB 3.34Å; R465-E468 WeakPolarHBondContact O-CG 3.38Å; R465-E468 PolarHBondContact O-N 3.14Å; N466-E468 VanDerWaalsContact C-N 3.26Å; N466-E468 PolarHBondContact O-N 3.37Å; E468-E471 WeakPolarHBondContact O-CG 3.3Å
469	K	65.3	Low	69.8	Low	99 Å²	99	56.9 Å²	56.9	43%	0.43	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-87.1	-14	173.2	-56.6	-172.8	-178.4	-177	0	113.8	H438 T441 N466 H467 E471	H438-K469 PolarHBondContact CE1-NZ 3Å; H438-K469 PolarHBondContact NE2-NZ 2.95Å; T441-K469 WeakPolarHBondContact CG2-O 3.36Å; N466-K469 WeakPolarHBondContact O-CB 3.29Å; N466-K469 PolarHBondContact O-N 3Å; H467-K469 PolarHBondContact O-N 2.97Å; H467-K469 VanDerWaalsContact O-N 3.11Å; K469-E471 PolarHBondContact O-N 2.91Å
470	L	64.6	Low	70.8	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.01	29%	0.287	C	S	.	.			trans	-81.9	15.8	174.5	-59.4	166.7	0	0	0	111.5	I437 H467 F473 M500	I437-L470 HydrophobicContact CB-CD2 4.48Å; I437-L470 HydrophobicContact CG1-CD2 4.35Å; I437-L470 HydrophobicContact CG2-CD2 3.81Å; I437-L470 HydrophobicContact CG2-CG 3.97Å; H467-L470 WeakPolarHBondContact O-CB 3.13Å; H467-L470 PolarHBondContact O-N 3.37Å; L470-F473 HydrophobicContact CB-CB 4.3Å; L470-F473 HydrophobicContact CB-CD2 4.46Å; L470-F473 HydrophobicContact CD2-CD2 3.42Å; L470-F473 VanDerWaalsContact CD2-CD2 3.42Å; L470-F473 HydrophobicContact CD2-CE2 3.59Å; L470-F473 HydrophobicContact CD2-CG 4.18Å; L470-F473 HydrophobicContact CD2-CZ 4.5Å; L470-F473 WeakPolarHBondContact O-CB 3.49Å; L470-F473 PolarHBondContact O-N 2.81Å; L470-M500 HydrophobicContact CB-CE 3.23Å; L470-M500 HydrophobicContact CD1-CE 3.96Å; L470-M500 HydrophobicContact CG-CE 4.22Å
471	E	54.1	Low	71.8	Confident	103 Å²	103	47.8 Å²	47.8	48%	0.481	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	128.2	169.8	-63.3	-176.7	-175.4	0	0	108.7	E468 K469 R503	E468-E471 WeakPolarHBondContact O-CG 3.3Å; K469-E471 PolarHBondContact O-N 2.91Å; E471-R503 IonicContact OE1-CZ 2.67Å; E471-R503 VanDerWaalsContact OE1-CZ 3.28Å; E471-R503 IonicContact OE1-NH1 2.84Å; E471-R503 PolarHBondContact OE1-NH1 2.92Å; E471-R503 IonicContact OE1-NH2 3.56Å; E471-R503 PolarHBondContact OE1-NH2 2.7Å; E471-R503 IonicContact OE2-CZ 3.28Å; E471-R503 IonicContact OE2-NH1 3.23Å; E471-R503 PolarHBondContact OE2-NH1 2.96Å; E471-R503 IonicContact OE2-NH2 2.69Å
472	G	55.2	Low	72.9	Confident	85 Å²	85	45.7 Å²	45.7	88%	0.876	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.3	10.3	-171.4	0	0	0	0	0	115.3	D474	G472-D474 PolarHBondContact O-N 3.1Å
473	F	66.5	Low	73.4	Confident	12 Å²	12	42.6 Å²	42.6	5%	0.053	22%	0.219	C	C	.	.			trans	-70.7	115.5	-174.6	-176.6	-94.5	0	0	0	114	V440 L470 K475 L477 M521	V440-F473 HydrophobicContact CB-CD2 4.41Å; V440-F473 HydrophobicContact CB-CE2 3.7Å; V440-F473 HydrophobicContact CG1-CD2 3.97Å; V440-F473 HydrophobicContact CG1-CE2 3.26Å; V440-F473 HydrophobicContact CG1-CZ 3.89Å; V440-F473 HydrophobicContact CG2-CE2 4.17Å; L470-F473 HydrophobicContact CB-CB 4.3Å; L470-F473 HydrophobicContact CB-CD2 4.46Å; L470-F473 HydrophobicContact CD2-CD2 3.42Å; L470-F473 VanDerWaalsContact CD2-CD2 3.42Å; L470-F473 HydrophobicContact CD2-CE2 3.59Å; L470-F473 HydrophobicContact CD2-CG 4.18Å; L470-F473 HydrophobicContact CD2-CZ 4.5Å; L470-F473 WeakPolarHBondContact O-CB 3.49Å; L470-F473 PolarHBondContact O-N 2.81Å; F473-K475 WeakPolarHBondContact CE1-O 3.29Å; F473-K475 VanDerWaalsContact CZ-O 3.23Å; F473-K475 WeakPolarHBondContact CZ-O 3.44Å; F473-L477 HydrophobicContact CE1-CB 3.84Å; F473-L477 HydrophobicContact CE1-CD2 4.22Å; F473-L477 HydrophobicContact CE2-CD2 4.41Å; F473-L477 HydrophobicContact CZ-CB 3.68Å; F473-L477 HydrophobicContact CZ-CD1 4.11Å; F473-L477 HydrophobicContact CZ-CD2 3.8Å; F473-L477 HydrophobicContact CZ-CG 4.09Å; F473-M521 HydrophobicContact CD1-CE 4.49Å; F473-M521 HydrophobicContact CE1-CE 4.39Å
474	D	66	Low	74.1	Confident	79 Å²	79	44.6 Å²	44.6	42%	0.422	22%	0.224	S	C	.	.			trans	-103.9	-32.7	-179.3	74.4	-40.6	0	0	0	114.4	G472 N520	G472-D474 PolarHBondContact O-N 3.1Å; D474-N520 PolarHBondContact O-ND2 2.88Å
475	K	76.7	Confident	75	Confident	23 Å²	23	42.4 Å²	42.4	10%	0.1	22%	0.218	C	C	.	.	S	Bend	trans	-70.7	156.4	-172.4	-42.4	-55.9	171.3	-159.8	0	112.9	V440 D444 F473	V440-K475 HydrophobicContact CG1-CB 3.6Å; V440-K475 HydrophobicContact CG1-CG 3.49Å; V440-K475 VanDerWaalsContact CG1-CG 3.49Å; D444-K475 WeakPolarHBondContact O-CE 3.48Å; D444-K475 PolarHBondContact O-NZ 3.27Å; D444-K475 VanDerWaalsContact O-NZ 3.09Å; D444-K475 IonicContact OD1-NZ 2.68Å; F473-K475 WeakPolarHBondContact CE1-O 3.29Å; F473-K475 VanDerWaalsContact CZ-O 3.23Å; F473-K475 WeakPolarHBondContact CZ-O 3.44Å
476	P	82.4	Confident	75.8	Confident	11 Å²	11	40 Å²	40	7%	0.071	21%	0.212	C	C	.	.			trans	-66.1	139.6	172.7	-27	37.4	0	0	0	115.5	C447 A448 A449 N520 F561 V565	C447-P476 WeakPolarHBondContact O-CD 3.49Å; A448-P476 CarbonylContact C-O 3.47Å; A448-P476 WeakPolarHBondContact CA-O 3.49Å; A448-P476 HydrophobicContact CB-CB 4.1Å; A449-P476 PolarHBondContact N-O 3.07Å; P476-N520 CarbonylContact C-O 3.55Å; P476-N520 WeakPolarHBondContact CA-O 3.48Å; P476-N520 HydrophobicContact CG-CB 4.47Å; P476-F561 HydrophobicContact CB-CE2 4.23Å; P476-F561 HydrophobicContact CB-CZ 3.69Å; P476-V565 HydrophobicContact CB-CB 4.47Å; P476-V565 HydrophobicContact CB-CG1 4.22Å; P476-V565 HydrophobicContact CB-CG2 3.4Å; P476-V565 VanDerWaalsContact CB-CG2 3.4Å; P476-V565 HydrophobicContact CG-CB 4.31Å; P476-V565 HydrophobicContact CG-CG1 3.77Å; P476-V565 HydrophobicContact CG-CG2 3.6Å
477	L	85.6	Confident	76.6	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	131.6	178.9	-156.8	59.3	0	0	0	111.7	A449 L451 F473 Y479 N520 M521 G522	A449-L477 HydrophobicContact CB-CD1 3.5Å; A449-L477 VanDerWaalsContact CB-CD1 3.5Å; A449-L477 CarbonylContact O-C 3.57Å; A449-L477 WeakPolarHBondContact O-CA 3.46Å; L451-L477 HydrophobicContact CD1-CD1 3.79Å; L451-L477 HydrophobicContact CD1-CD2 4.03Å; L451-L477 HydrophobicContact CD1-CG 4.14Å; L451-L477 HydrophobicContact CD2-CD1 4.46Å; L451-L477 HydrophobicContact CG-CD1 3.86Å; L451-L477 HydrophobicContact CG-CG 4.45Å; F473-L477 HydrophobicContact CE1-CB 3.84Å; F473-L477 HydrophobicContact CE1-CD2 4.22Å; F473-L477 HydrophobicContact CE2-CD2 4.41Å; F473-L477 HydrophobicContact CZ-CB 3.68Å; F473-L477 HydrophobicContact CZ-CD1 4.11Å; F473-L477 HydrophobicContact CZ-CD2 3.8Å; F473-L477 HydrophobicContact CZ-CG 4.09Å; L477-Y479 HydrophobicContact CD2-CD2 4.46Å; L477-Y479 HydrophobicContact CD2-CE1 4.49Å; L477-Y479 HydrophobicContact CD2-CE2 3.62Å; L477-Y479 WeakPolarHBondContact CD2-OH 3.27Å; L477-Y479 HydrophobicContact CG-CE2 4.22Å; L477-N520 PolarHBondContact N-O 3.17Å; L477-M521 HydrophobicContact CD2-CE 4.07Å; L477-G522 PolarHBondContact O-N 3.35Å
478	L	88	Confident	77.6	Confident	6 Å²	6	41.7 Å²	41.7	3%	0.031	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	116.7	170.1	-173.1	67.5	0	0	0	110.7	A449 I450 L451 V480 V524 I558 F561	A449-L478 PolarHBondContact O-N 3.37Å; I450-L478 WeakPolarHBondContact CA-O 3.23Å; I450-L478 HydrophobicContact CG1-CB 4.28Å; L451-L478 PolarHBondContact N-O 2.99Å; L478-V480 HydrophobicContact CD2-CG2 4.02Å; L478-V480 HydrophobicContact CG-CG2 4.07Å; L478-V524 HydrophobicContact CD1-CG2 3.83Å; L478-V524 HydrophobicContact CG-CG2 4.49Å; L478-I558 HydrophobicContact CD2-CB 4.47Å; L478-I558 HydrophobicContact CD2-CG1 3.81Å; L478-F561 HydrophobicContact CB-CD1 3.75Å; L478-F561 HydrophobicContact CB-CD2 4.22Å; L478-F561 HydrophobicContact CB-CE1 3.67Å; L478-F561 HydrophobicContact CB-CE2 4.15Å; L478-F561 HydrophobicContact CB-CG 4.03Å; L478-F561 HydrophobicContact CB-CZ 3.88Å; L478-F561 HydrophobicContact CD1-CB 4.32Å; L478-F561 HydrophobicContact CD1-CD2 4.08Å; L478-F561 HydrophobicContact CD1-CG 4.08Å; L478-F561 HydrophobicContact CD2-CB 3.97Å; L478-F561 HydrophobicContact CD2-CD1 3.92Å; L478-F561 HydrophobicContact CD2-CG 3.97Å; L478-F561 HydrophobicContact CG-CD1 4.31Å; L478-F561 HydrophobicContact CG-CG 4.26Å
479	Y	88.7	Confident	78.7	Confident	1 Å²	1	40.2 Å²	40.2	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	127.1	166.8	-69.8	-79.9	0	0	0	110	L451 Y454 L477 L493 M521 G522 T523 V524	L451-Y479 HydrophobicContact CB-CD1 4.04Å; L451-Y479 HydrophobicContact CB-CE1 4.32Å; L451-Y479 HydrophobicContact CD1-CD1 4.07Å; L451-Y479 HydrophobicContact CD1-CE1 3.51Å; L451-Y479 HydrophobicContact CG-CE1 4.48Å; Y454-Y479 AromaticContact CD1-CE1 3.89Å; Y454-Y479 HydrophobicContact CD1-CE1 3.89Å; Y454-Y479 HydrophobicContact CG-CE1 4.12Å; L477-Y479 HydrophobicContact CD2-CD2 4.46Å; L477-Y479 HydrophobicContact CD2-CE1 4.49Å; L477-Y479 HydrophobicContact CD2-CE2 3.62Å; L477-Y479 WeakPolarHBondContact CD2-OH 3.27Å; L477-Y479 HydrophobicContact CG-CE2 4.22Å; Y479-L493 HydrophobicContact CD1-CD1 3.82Å; Y479-L493 HydrophobicContact CD1-CD2 4.23Å; Y479-L493 HydrophobicContact CE1-CD1 4.38Å; Y479-L493 HydrophobicContact CE1-CD2 3.94Å; Y479-L493 HydrophobicContact CG-CD1 3.91Å; Y479-M521 HydrophobicContact CD2-CG 4.39Å; Y479-M521 HydrophobicContact CE2-CE 4.24Å; Y479-M521 HydrophobicContact CE2-CG 4.2Å; Y479-M521 HydrophobicContact CE2-SD 3.87Å; Y479-G522 PolarHBondContact N-O 2.9Å; Y479-T523 CarbonylContact O-C 3.31Å; Y479-T523 WeakPolarHBondContact O-CA 3.4Å; Y479-V524 PolarHBondContact O-N 3.27Å
480	V	91	Very high	79.3	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	106.4	172.6	-175.6	0	0	0	0	108	I450 L451 M452 D453 L478 V524 V526 L533 I554 I558	I450-V480 HydrophobicContact CG2-CG2 4.28Å; L451-V480 PolarHBondContact O-N 3.48Å; M452-V480 CarbonylContact C-O 3.54Å; M452-V480 WeakPolarHBondContact CA-O 3.48Å; D453-V480 PolarHBondContact N-O 3.14Å; L478-V480 HydrophobicContact CD2-CG2 4.02Å; L478-V480 HydrophobicContact CG-CG2 4.07Å; V480-V524 WeakPolarHBondContact CA-O 3.15Å; V480-V524 HydrophobicContact CG1-CB 4.49Å; V480-V524 HydrophobicContact CG1-CG1 4.03Å; V480-V524 HydrophobicContact CG2-CB 4.26Å; V480-V524 HydrophobicContact CG2-CG1 4.45Å; V480-V526 HydrophobicContact CG1-CG2 4.35Å; V480-L533 HydrophobicContact CB-CD1 4.41Å; V480-L533 HydrophobicContact CG1-CD1 3.64Å; V480-I554 HydrophobicContact CG1-CG2 3.73Å; V480-I558 HydrophobicContact CG2-CD1 4.45Å; V480-I558 HydrophobicContact CG2-CG1 4.33Å
481	V	89.8	Confident	79.9	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	146.1	-164	-65.8	0	0	0	0	112.7	V490 L493 T523 V524 V526 L533	V481-V490 HydrophobicContact CG2-CG1 4.41Å; V481-V490 HydrophobicContact CG2-CG2 3.94Å; V481-L493 HydrophobicContact CG1-CD1 3.85Å; V481-T523 HydrophobicContact CG2-CG2 4.35Å; V481-V524 PolarHBondContact N-O 3.11Å; V481-V526 PolarHBondContact O-N 2.85Å; V481-L533 VanDerWaalsContact C-CD2 3.48Å
482	G	87.9	Confident	80.9	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	130.1	173.4	0	0	0	0	0	111	M484 S485 A529 L533	G482-M484 PolarHBondContact O-N 2.87Å; G482-S485 WeakPolarHBondContact O-CB 3.5Å; G482-S485 PolarHBondContact O-N 2.87Å; G482-A529 CarbonylContact C-O 3.59Å; G482-A529 VanDerWaalsContact C-O 3.31Å; G482-A529 VanDerWaalsContact CA-O 3.3Å; G482-A529 WeakPolarHBondContact CA-O 3.47Å; G482-L533 VanDerWaalsContact N-CD2 3.34Å
483	E	84.4	Confident	81.8	Confident	53 Å²	53	36.1 Å²	36.1	25%	0.248	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-37.2	176.5	-177.3	-164.7	-177.7	0	0	112.5	T525 V526 C527 N528 A529	E483-T525 HydrophobicContact CB-CG2 4.24Å; E483-V526 PolarHBondContact N-O 3.15Å; E483-C527 VanDerWaalsContact OE2-CA 3.26Å; E483-C527 WeakPolarHBondContact OE2-CA 3.38Å; E483-C527 WeakPolarHBondContact OE2-CB 3.45Å; E483-N528 PolarHBondContact OE2-N 3.35Å; E483-A529 PolarHBondContact N-O 3.24Å
484	M	84.5	Confident	82.1	Confident	82 Å²	82	38.2 Å²	38.2	40%	0.404	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	22.3	-179.1	-56.2	-70.4	171.5	0	0	112.1	G482 K486 A529	G482-M484 PolarHBondContact O-N 2.87Å; M484-K486 PolarHBondContact O-N 2.95Å; M484-A529 CarbonylContact C-O 3.49Å; M484-A529 WeakPolarHBondContact CA-O 3.33Å; M484-A529 WeakPolarHBondContact CB-O 3.48Å; M484-A529 PolarHBondContact N-O 3.22Å
485	S	86.4	Confident	82.4	Confident	12 Å²	12	38.2 Å²	38.2	8%	0.084	19%	0.186	C	C	.	.			trans	-69.5	125.6	177.3	-178.6	0	0	0	0	111.6	D453 G482 Y487 C488	D453-S485 VanDerWaalsContact CG-OG 3.29Å; D453-S485 WeakPolarHBondContact OD1-CB 3.16Å; D453-S485 PolarHBondContact OD1-OG 3.27Å; D453-S485 PolarHBondContact OD2-OG 2.83Å; G482-S485 WeakPolarHBondContact O-CB 3.5Å; G482-S485 PolarHBondContact O-N 2.87Å; S485-Y487 PolarHBondContact O-N 2.97Å; S485-Y487 PolarHBondContact OG-N 3.22Å; S485-C488 PolarHBondContact OG-N 2.66Å
486	K	84.3	Confident	82	Confident	131 Å²	131	37.8 Å²	37.8	57%	0.57	19%	0.186	S	C	*	.	S	Bend	trans	-72.3	-16.7	178	-56.6	-179	-158.7	70.5	0	113.3	M484 E531	M484-K486 PolarHBondContact O-N 2.95Å; K486-E531 IonicContact NZ-OE1 3.53Å; K486-E531 PolarHBondContact NZ-OE1 2.87Å; K486-E531 IonicContact NZ-OE2 3.8Å; K486-E531 PolarHBondContact NZ-OE2 3.28Å
487	Y	83.7	Confident	81.4	Confident	69 Å²	69	39 Å²	39	27%	0.271	19%	0.189	S	C	.	.	S	Bend	trans	-112.9	-9.1	-173	-52.3	-69.1	0	0	0	112.8	Q455 N456 L457 S485 E531	Q455-Y487 CarbonylContact C-O 3.54Å; Q455-Y487 VanDerWaalsContact CA-O 3.32Å; Q455-Y487 WeakPolarHBondContact CA-O 3.23Å; Q455-Y487 HydrophobicContact CG-CG 4.27Å; N456-Y487 PolarHBondContact N-O 3.44Å; L457-Y487 PolarHBondContact N-O 2.91Å; S485-Y487 PolarHBondContact O-N 2.97Å; S485-Y487 PolarHBondContact OG-N 3.22Å; Y487-E531 HydrophobicContact CD2-CB 3.84Å; Y487-E531 HydrophobicContact CD2-CG 4.09Å; Y487-E531 HydrophobicContact CE2-CB 4.26Å; Y487-E531 HydrophobicContact CE2-CG 3.97Å
488	C	83.7	Confident	80.5	Confident	5 Å²	5	42.3 Å²	42.3	3%	0.034	21%	0.209	C	C	.	.			trans	-122.4	113.2	177.8	-162	0	0	0	0	111.4	Y454 S485	Y454-C488 WeakPolarHBondContact O-CB 3.43Å; Y454-C488 PolarHBondContact O-SG 2.97Å; S485-C488 PolarHBondContact OG-N 2.66Å
489	N	83.2	Confident	79.6	Confident	70 Å²	70	48.1 Å²	48.1	37%	0.374	23%	0.234	S	C	.	.			trans	-85.6	107.1	165	178.4	-18.6	0	0	0	108.9	N456 L457 N491 R492 L493	N456-N489 PolarHBondContact ND2-O 3.26Å; N456-N489 PolarHBondContact OD1-N 3.37Å; L457-N489 HydrophobicContact CD1-CB 4.33Å; L457-N489 HydrophobicContact CD2-CB 4.33Å; L457-N489 HydrophobicContact CG-CB 4.4Å; N489-N491 VanDerWaalsContact C-N 3.34Å; N489-N491 PolarHBondContact O-N 3.05Å; N489-N491 WeakPolarHBondContact OD1-CB 3.24Å; N489-N491 PolarHBondContact OD1-N 2.89Å; N489-N491 VanDerWaalsContact OD1-N 3.1Å; N489-R492 HydrophobicContact CB-CB 4.07Å; N489-R492 WeakPolarHBondContact O-CB 3.09Å; N489-R492 PolarHBondContact O-N 3.45Å; N489-R492 VanDerWaalsContact O-N 3.15Å; N489-R492 PolarHBondContact OD1-N 2.78Å; N489-L493 PolarHBondContact O-N 2.81Å
490	V	77.7	Confident	78.4	Confident	23 Å²	23	49.6 Å²	49.6	14%	0.139	24%	0.241	C	C	.	.	H	α-helix	trans	-60.4	-41.5	-178	-174.7	0	0	0	0	111.8	V481 R492 L493 L494 T525	V481-V490 HydrophobicContact CG2-CG1 4.41Å; V481-V490 HydrophobicContact CG2-CG2 3.94Å; V490-R492 PolarHBondContact O-N 3.35Å; V490-L493 WeakPolarHBondContact O-CA 3.3Å; V490-L493 WeakPolarHBondContact O-CB 3.33Å; V490-L493 PolarHBondContact O-N 3.16Å; V490-L494 PolarHBondContact O-N 3.48Å; V490-L494 VanDerWaalsContact O-N 3.17Å; V490-T525 HydrophobicContact CG1-CG2 4.46Å; V490-T525 HydrophobicContact CG2-CG2 4.4Å
491	N	77.5	Confident	77.1	Confident	112 Å²	112	53.2 Å²	53.2	60%	0.599	26%	0.255	S	S	*	.	H	α-helix	trans	-59	-35.8	177.9	-60.4	-0.9	0	0	0	111.4	N489 L493 L494 D495	N489-N491 VanDerWaalsContact C-N 3.34Å; N489-N491 PolarHBondContact O-N 3.05Å; N489-N491 WeakPolarHBondContact OD1-CB 3.24Å; N489-N491 PolarHBondContact OD1-N 2.89Å; N489-N491 VanDerWaalsContact OD1-N 3.1Å; N491-L493 VanDerWaalsContact C-N 3.29Å; N491-L493 PolarHBondContact O-N 2.8Å; N491-L494 CarbonylContact O-C 3.54Å; N491-L494 WeakPolarHBondContact O-CB 3.41Å; N491-L494 PolarHBondContact O-N 3.24Å; N491-L494 VanDerWaalsContact O-N 3.16Å; N491-D495 PolarHBondContact O-N 3.48Å
492	R	75.8	Confident	75.6	Confident	67 Å²	67	56 Å²	56	25%	0.253	27%	0.274	S	S	.	.	H	α-helix	trans	-67.7	-25.7	175.1	-175.2	179.8	175.1	93.6	-5.5	113	W464 N489 V490 V496	W464-R492 PolarHBondContact O-NH2 3.37Å; N489-R492 HydrophobicContact CB-CB 4.07Å; N489-R492 WeakPolarHBondContact O-CB 3.09Å; N489-R492 PolarHBondContact O-N 3.45Å; N489-R492 VanDerWaalsContact O-N 3.15Å; N489-R492 PolarHBondContact OD1-N 2.78Å; V490-R492 PolarHBondContact O-N 3.35Å; R492-V496 VanDerWaalsContact O-CG2 3.22Å; R492-V496 WeakPolarHBondContact O-CG2 3.49Å; R492-V496 PolarHBondContact O-N 2.87Å
493	L	74.4	Confident	74.3	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-72.6	-39.1	170.8	-58.9	-176.4	0	0	0	111.1	Y454 N456 Y479 V481 N489 V490 N491 V496 R497	Y454-L493 HydrophobicContact CD1-CD2 4.1Å; N456-L493 HydrophobicContact CB-CD2 4.43Å; N456-L493 WeakPolarHBondContact ND2-CD2 3.45Å; Y479-L493 HydrophobicContact CD1-CD1 3.82Å; Y479-L493 HydrophobicContact CD1-CD2 4.23Å; Y479-L493 HydrophobicContact CE1-CD1 4.38Å; Y479-L493 HydrophobicContact CE1-CD2 3.94Å; Y479-L493 HydrophobicContact CG-CD1 3.91Å; V481-L493 HydrophobicContact CG1-CD1 3.85Å; N489-L493 PolarHBondContact O-N 2.81Å; V490-L493 WeakPolarHBondContact O-CA 3.3Å; V490-L493 WeakPolarHBondContact O-CB 3.33Å; V490-L493 PolarHBondContact O-N 3.16Å; N491-L493 VanDerWaalsContact C-N 3.29Å; N491-L493 PolarHBondContact O-N 2.8Å; L493-V496 PolarHBondContact O-N 3.22Å; L493-R497 PolarHBondContact O-N 2.95Å
494	L	72.1	Confident	72.8	Confident	55 Å²	55	61.1 Å²	61.1	29%	0.288	29%	0.294	S	S	.	.	H	α-helix	trans	-63.5	-41.9	172.6	-58	176.7	0	0	0	111.2	V490 N491 V496 R497 T498	V490-L494 PolarHBondContact O-N 3.48Å; V490-L494 VanDerWaalsContact O-N 3.17Å; N491-L494 CarbonylContact O-C 3.54Å; N491-L494 WeakPolarHBondContact O-CB 3.41Å; N491-L494 PolarHBondContact O-N 3.24Å; N491-L494 VanDerWaalsContact O-N 3.16Å; L494-V496 PolarHBondContact O-N 3.01Å; L494-R497 PolarHBondContact O-N 2.81Å; L494-T498 WeakPolarHBondContact O-CG2 3.33Å; L494-T498 PolarHBondContact O-N 3.34Å; L494-T498 PolarHBondContact O-OG1 3.1Å
495	D	72.1	Confident	71.5	Confident	79 Å²	79	62.1 Å²	62.1	42%	0.422	30%	0.298	S	S	.	.	H	α-helix	trans	-58.2	-33.5	172.3	-70.2	-27.4	0	0	0	113.2	N491 T498 K499	N491-D495 PolarHBondContact O-N 3.48Å; D495-T498 WeakPolarHBondContact CA-OG1 3.49Å; D495-T498 PolarHBondContact O-OG1 3.47Å; D495-T498 VanDerWaalsContact O-OG1 3.13Å; D495-K499 WeakPolarHBondContact O-CB 3.44Å; D495-K499 VanDerWaalsContact O-CD 3.3Å; D495-K499 WeakPolarHBondContact O-CD 3.45Å; D495-K499 WeakPolarHBondContact O-CG 3.34Å; D495-K499 PolarHBondContact O-N 3.31Å; D495-K499 VanDerWaalsContact O-N 3.14Å
496	V	69.2	Low	70.1	Confident	15 Å²	15	65.7 Å²	65.7	9%	0.091	32%	0.323	C	S	.	.	H	α-helix	trans	-75.5	-43.6	178	167.9	0	0	0	0	109.9	H467 R492 L493 L494 T498 K499 M500	H467-V496 HydrophobicContact CB-CG1 4.33Å; H467-V496 HydrophobicContact CB-CG2 3.91Å; R492-V496 VanDerWaalsContact O-CG2 3.22Å; R492-V496 WeakPolarHBondContact O-CG2 3.49Å; R492-V496 PolarHBondContact O-N 2.87Å; L493-V496 PolarHBondContact O-N 3.22Å; L494-V496 PolarHBondContact O-N 3.01Å; V496-T498 PolarHBondContact O-N 3.37Å; V496-K499 PolarHBondContact O-N 3.21Å; V496-M500 HydrophobicContact CG1-CE 3.45Å; V496-M500 VanDerWaalsContact CG1-CE 3.45Å; V496-M500 HydrophobicContact CG1-SD 4.05Å; V496-M500 WeakPolarHBondContact O-CG 3.38Å; V496-M500 PolarHBondContact O-N 3.03Å
497	R	68.6	Low	68.8	Low	35 Å²	35	66.8 Å²	66.8	13%	0.132	33%	0.328	C	S	.	.	H	α-helix	trans	-60	-42.5	174.3	-170.8	178.4	179.3	-163.2	-3.6	112	S47 P48 L493 L494 R501 M521	S47-R497 PolarHBondContact O-NH1 3.08Å; P48-R497 PolarHBondContact O-NH2 3.44Å; L493-R497 PolarHBondContact O-N 2.95Å; L494-R497 PolarHBondContact O-N 2.81Å; R497-R501 PolarHBondContact O-N 3.44Å; R497-M521 HydrophobicContact CB-SD 3.96Å; R497-M521 HydrophobicContact CG-SD 4.16Å; R497-M521 PolarHBondContact NE-O 3.08Å
498	T	67.7	Low	67.2	Low	72 Å²	72	66.8 Å²	66.8	44%	0.442	35%	0.349	S	S	.	.	H	α-helix	trans	-69.5	-41.2	177.6	54.2	0	0	0	0	112.5	L494 D495 V496 M500 R501 S502	L494-T498 WeakPolarHBondContact O-CG2 3.33Å; L494-T498 PolarHBondContact O-N 3.34Å; L494-T498 PolarHBondContact O-OG1 3.1Å; D495-T498 WeakPolarHBondContact CA-OG1 3.49Å; D495-T498 PolarHBondContact O-OG1 3.47Å; D495-T498 VanDerWaalsContact O-OG1 3.13Å; V496-T498 PolarHBondContact O-N 3.37Å; T498-M500 VanDerWaalsContact C-N 3.32Å; T498-M500 PolarHBondContact O-N 2.89Å; T498-R501 PolarHBondContact O-N 3.34Å; T498-S502 PolarHBondContact O-N 3.25Å; T498-S502 PolarHBondContact O-OG 3.42Å
499	K	68.4	Low	65.7	Low	128 Å²	128	73 Å²	73	56%	0.557	37%	0.372	S	S	*	.	H	α-helix	trans	-64	-33.4	176.2	-76.6	168.8	-173.4	168.9	0	113.6	D495 V496 S502 R503	D495-K499 WeakPolarHBondContact O-CB 3.44Å; D495-K499 VanDerWaalsContact O-CD 3.3Å; D495-K499 WeakPolarHBondContact O-CD 3.45Å; D495-K499 WeakPolarHBondContact O-CG 3.34Å; D495-K499 PolarHBondContact O-N 3.31Å; D495-K499 VanDerWaalsContact O-N 3.14Å; V496-K499 PolarHBondContact O-N 3.21Å; K499-S502 PolarHBondContact O-OG 3.1Å; K499-R503 WeakPolarHBondContact O-CG 3.35Å; K499-R503 PolarHBondContact O-N 2.98Å
500	M	63.9	Low	64.2	Low	31 Å²	31	76.3 Å²	76.3	15%	0.153	39%	0.386	C	S	.	.	H	α-helix	trans	-65.2	-51.2	172.5	-72.6	163.2	178.4	0	0	110.9	L470 V496 T498 S502 R503 I504 M521	L470-M500 HydrophobicContact CB-CE 3.23Å; L470-M500 HydrophobicContact CD1-CE 3.96Å; L470-M500 HydrophobicContact CG-CE 4.22Å; V496-M500 HydrophobicContact CG1-CE 3.45Å; V496-M500 VanDerWaalsContact CG1-CE 3.45Å; V496-M500 HydrophobicContact CG1-SD 4.05Å; V496-M500 WeakPolarHBondContact O-CG 3.38Å; V496-M500 PolarHBondContact O-N 3.03Å; T498-M500 VanDerWaalsContact C-N 3.32Å; T498-M500 PolarHBondContact O-N 2.89Å; M500-S502 PolarHBondContact O-N 3.35Å; M500-R503 PolarHBondContact O-N 3.21Å; M500-I504 WeakPolarHBondContact O-CD1 3.31Å; M500-I504 WeakPolarHBondContact O-CG1 3.13Å; M500-I504 PolarHBondContact O-N 3.28Å; M500-M521 HydrophobicContact CE-CE 3.99Å; M500-M521 HydrophobicContact SD-CE 3.38Å; M500-M521 WeakPolarHBondContact SD-CE 3.49Å; M500-M521 HydrophobicContact SD-SD 4.19Å
501	R	63.7	Low	63	Low	78 Å²	78	85.6 Å²	85.6	29%	0.294	42%	0.418	S	S	.	.	H	α-helix	trans	-54.3	-52.5	175.9	-176.2	-169.7	-85.7	142.9	-9.2	111.1	R497 T498 R503 I504 E505 M514 E518	R497-R501 PolarHBondContact O-N 3.44Å; T498-R501 PolarHBondContact O-N 3.34Å; R501-R503 VanDerWaalsContact C-N 3.3Å; R501-R503 PolarHBondContact O-N 3Å; R501-I504 PolarHBondContact O-N 2.96Å; R501-I504 VanDerWaalsContact O-N 3.12Å; R501-E505 WeakPolarHBondContact CD-OE1 3.36Å; R501-E505 VanDerWaalsContact CG-OE1 3.29Å; R501-E505 WeakPolarHBondContact CG-OE1 3.47Å; R501-E505 WeakPolarHBondContact O-CG 3.36Å; R501-E505 PolarHBondContact O-N 2.93Å; R501-E505 VanDerWaalsContact O-N 3.08Å; R501-M514 HydrophobicContact CG-CE 4.26Å; R501-E518 IonicContact CZ-OE1 3.62Å; R501-E518 IonicContact NE-OE1 3.15Å; R501-E518 PolarHBondContact NE-OE1 3.03Å; R501-E518 IonicContact NH2-OE1 2.57Å; R501-E518 PolarHBondContact NH2-OE1 2.81Å
502	S	59.2	Low	61.5	Low	58 Å²	58	83.5 Å²	83.5	41%	0.406	41%	0.413	S	S	.	.	H	α-helix	trans	-65.5	-29.1	-174.7	70.2	0	0	0	0	114	T498 K499 M500 E505 S506	T498-S502 PolarHBondContact O-N 3.25Å; T498-S502 PolarHBondContact O-OG 3.42Å; K499-S502 PolarHBondContact O-OG 3.1Å; M500-S502 PolarHBondContact O-N 3.35Å; S502-E505 WeakPolarHBondContact CA-OE2 3.28Å; S502-S506 PolarHBondContact O-N 2.7Å; S502-S506 VanDerWaalsContact O-N 3.13Å
503	R	58.9	Low	60.1	Low	123 Å²	123	85.8 Å²	85.8	46%	0.464	43%	0.426	S	S	.	.	H	α-helix	trans	-71.8	-39.2	173.5	-77.7	-158.9	-169	177.4	18.3	112.2	E471 K499 M500 R501 E505 S506 F507	E471-R503 IonicContact OE1-CZ 2.67Å; E471-R503 VanDerWaalsContact OE1-CZ 3.28Å; E471-R503 IonicContact OE1-NH1 2.84Å; E471-R503 PolarHBondContact OE1-NH1 2.92Å; E471-R503 IonicContact OE1-NH2 3.56Å; E471-R503 PolarHBondContact OE1-NH2 2.7Å; E471-R503 IonicContact OE2-CZ 3.28Å; E471-R503 IonicContact OE2-NH1 3.23Å; E471-R503 PolarHBondContact OE2-NH1 2.96Å; E471-R503 IonicContact OE2-NH2 2.69Å; K499-R503 WeakPolarHBondContact O-CG 3.35Å; K499-R503 PolarHBondContact O-N 2.98Å; M500-R503 PolarHBondContact O-N 3.21Å; R501-R503 VanDerWaalsContact C-N 3.3Å; R501-R503 PolarHBondContact O-N 3Å; R503-E505 VanDerWaalsContact C-N 3.32Å; R503-S506 WeakPolarHBondContact CA-OG 3.48Å; R503-S506 PolarHBondContact O-N 3.39Å; R503-S506 VanDerWaalsContact O-N 3.15Å; R503-S506 PolarHBondContact O-OG 3.04Å; R503-F507 WeakPolarHBondContact O-CD2 3.43Å; R503-F507 PolarHBondContact O-N 2.88Å; R503-F507 VanDerWaalsContact O-N 3.13Å
504	I	54.2	Low	58.4	Low	38 Å²	38	88 Å²	88	20%	0.195	44%	0.437	C	S	.	.	H	α-helix	trans	-64.2	-41.9	177.6	-63.6	155.6	0	0	0	110.1	M500 R501 S506 F507 M514 L517	M500-I504 WeakPolarHBondContact O-CD1 3.31Å; M500-I504 WeakPolarHBondContact O-CG1 3.13Å; M500-I504 PolarHBondContact O-N 3.28Å; R501-I504 PolarHBondContact O-N 2.96Å; R501-I504 VanDerWaalsContact O-N 3.12Å; I504-S506 VanDerWaalsContact C-N 3.33Å; I504-S506 PolarHBondContact O-N 2.84Å; I504-F507 PolarHBondContact O-N 3.3Å; I504-M514 HydrophobicContact CG2-CG 4.47Å; I504-L517 HydrophobicContact CD1-CB 4.06Å; I504-L517 HydrophobicContact CD1-CD1 3.67Å; I504-L517 HydrophobicContact CD1-CD2 3.75Å; I504-L517 HydrophobicContact CD1-CG 4.01Å
505	E	57.7	Low	56.9	Low	102 Å²	102	94.4 Å²	94.4	48%	0.477	46%	0.457	S	S	.	.	H	α-helix	trans	-56.1	-44.8	171.1	-69	165.6	177.8	0	0	111.7	R501 S502 R503 F507 G508 M514	R501-E505 WeakPolarHBondContact CD-OE1 3.36Å; R501-E505 VanDerWaalsContact CG-OE1 3.29Å; R501-E505 WeakPolarHBondContact CG-OE1 3.47Å; R501-E505 WeakPolarHBondContact O-CG 3.36Å; R501-E505 PolarHBondContact O-N 2.93Å; R501-E505 VanDerWaalsContact O-N 3.08Å; S502-E505 WeakPolarHBondContact CA-OE2 3.28Å; R503-E505 VanDerWaalsContact C-N 3.32Å; E505-F507 VanDerWaalsContact C-N 3.31Å; E505-F507 PolarHBondContact O-N 3.31Å; E505-G508 PolarHBondContact O-N 2.87Å; E505-M514 HydrophobicContact CG-CE 3.45Å; E505-M514 VanDerWaalsContact CG-CE 3.45Å; E505-M514 HydrophobicContact CG-SD 4.35Å; E505-M514 WeakPolarHBondContact OE1-CE 3.4Å
506	S	56.2	Low	55.6	Low	87 Å²	87	93.6 Å²	93.6	61%	0.608	46%	0.458	S	S	*	.	H	α-helix	trans	-70.7	-18.7	-179.4	72.1	0	0	0	0	115.4	S502 R503 I504	S502-S506 PolarHBondContact O-N 2.7Å; S502-S506 VanDerWaalsContact O-N 3.13Å; R503-S506 WeakPolarHBondContact CA-OG 3.48Å; R503-S506 PolarHBondContact O-N 3.39Å; R503-S506 VanDerWaalsContact O-N 3.15Å; R503-S506 PolarHBondContact O-OG 3.04Å; I504-S506 VanDerWaalsContact C-N 3.33Å; I504-S506 PolarHBondContact O-N 2.84Å
507	F	57.4	Low	54.4	Low	155 Å²	155	95.4 Å²	95.4	68%	0.68	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	6.4	-179	-93.5	-84.2	0	0	0	114	R503 I504 E505 Y509	R503-F507 WeakPolarHBondContact O-CD2 3.43Å; R503-F507 PolarHBondContact O-N 2.88Å; R503-F507 VanDerWaalsContact O-N 3.13Å; I504-F507 PolarHBondContact O-N 3.3Å; E505-F507 VanDerWaalsContact C-N 3.31Å; E505-F507 PolarHBondContact O-N 3.31Å; F507-Y509 HydrophobicContact CB-CD2 3.82Å; F507-Y509 HydrophobicContact CB-CE2 4.03Å; F507-Y509 PolarHBondContact O-N 3.16Å
508	G	50.1	Low	53.3	Low	69 Å²	69	95.9 Å²	95.9	71%	0.711	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	15.1	171.2	0	0	0	0	0	115.3	E505	E505-G508 PolarHBondContact O-N 2.87Å
509	Y	51.4	Low	52.4	Low	135 Å²	135	93.4 Å²	93.4	53%	0.529	46%	0.455	S	S	.	.			trans	-62.7	143.3	178	-85.8	-90.7	0	0	0	111.8	F507 Q513	F507-Y509 HydrophobicContact CB-CD2 3.82Å; F507-Y509 HydrophobicContact CB-CE2 4.03Å; F507-Y509 PolarHBondContact O-N 3.16Å; Y509-Q513 VanDerWaalsContact CD1-OE1 3.23Å
510	E	52.7	Low	52.2	Low	140 Å²	140	88.1 Å²	88.1	65%	0.654	43%	0.433	S	S	*	.			trans	-55.5	147.7	-179.7	-69.3	-168.5	156.7	0	0	113.2	S512 Q513 M514	E510-S512 WeakPolarHBondContact CB-OG 3.39Å; E510-S512 PolarHBondContact O-N 2.8Å; E510-S512 PolarHBondContact OE2-OG 2.89Å; E510-Q513 PolarHBondContact O-N 3.02Å; E510-Q513 VanDerWaalsContact O-N 3.12Å; E510-M514 PolarHBondContact O-N 3.03Å; E510-M514 VanDerWaalsContact O-N 3.12Å
511	R	51	Low	52.6	Low	217 Å²	217	87.1 Å²	87.1	82%	0.819	43%	0.428	S	S	*	.	H	α-helix	trans	-54.3	-21.5	171.3	-68.6	177.4	174.6	166.6	-2.8	113.4	R515	R511-R515 WeakPolarHBondContact O-CG 3.37Å; R511-R515 PolarHBondContact O-N 3.26Å
512	S	46.2	Very low	53.1	Low	69 Å²	69	83.6 Å²	83.6	48%	0.483	42%	0.416	S	S	.	.	H	α-helix	trans	-62.1	-56.9	173.9	58.5	0	0	0	0	111.6	E510	E510-S512 WeakPolarHBondContact CB-OG 3.39Å; E510-S512 PolarHBondContact O-N 2.8Å; E510-S512 PolarHBondContact OE2-OG 2.89Å
513	Q	47.3	Very low	54	Low	115 Å²	115	80.9 Å²	80.9	54%	0.537	40%	0.397	S	S	.	.	H	α-helix	trans	-71.5	-35.3	178.2	-66.6	-166.7	7.4	0	0	112.4	Y509 E510 R515 S516 L517	Y509-Q513 VanDerWaalsContact CD1-OE1 3.23Å; E510-Q513 PolarHBondContact O-N 3.02Å; E510-Q513 VanDerWaalsContact O-N 3.12Å; Q513-R515 VanDerWaalsContact C-N 3.28Å; Q513-R515 PolarHBondContact O-N 2.66Å; Q513-S516 WeakPolarHBondContact O-CA 3.43Å; Q513-S516 VanDerWaalsContact O-CB 3.24Å; Q513-S516 WeakPolarHBondContact O-CB 3.45Å; Q513-S516 PolarHBondContact O-N 2.88Å; Q513-L517 PolarHBondContact O-N 2.66Å
514	M	38.7	Very low	55.2	Low	47 Å²	47	75.2 Å²	75.2	23%	0.232	38%	0.376	C	S	.	.	H	α-helix	trans	-56.8	-42.5	178.4	-168.2	-179.6	176.2	0	0	111.8	R501 I504 E505 E510 S516 L517 E518	R501-M514 HydrophobicContact CG-CE 4.26Å; I504-M514 HydrophobicContact CG2-CG 4.47Å; E505-M514 HydrophobicContact CG-CE 3.45Å; E505-M514 VanDerWaalsContact CG-CE 3.45Å; E505-M514 HydrophobicContact CG-SD 4.35Å; E505-M514 WeakPolarHBondContact OE1-CE 3.4Å; E510-M514 PolarHBondContact O-N 3.03Å; E510-M514 VanDerWaalsContact O-N 3.12Å; M514-S516 VanDerWaalsContact C-N 3.27Å; M514-S516 PolarHBondContact O-N 3.1Å; M514-L517 PolarHBondContact O-N 3.22Å; M514-E518 WeakPolarHBondContact O-CG 3.41Å; M514-E518 PolarHBondContact O-N 3.24Å; M514-E518 VanDerWaalsContact O-N 3.08Å
515	R	41.5	Very low	56.4	Low	190 Å²	190	73.9 Å²	73.9	72%	0.717	37%	0.369	S	S	*	.	H	α-helix	trans	-61	-30.8	173.8	-77	177.4	175.8	-178.4	0.5	113.9	R511 Q513 T519	R511-R515 WeakPolarHBondContact O-CG 3.37Å; R511-R515 PolarHBondContact O-N 3.26Å; Q513-R515 VanDerWaalsContact C-N 3.28Å; Q513-R515 PolarHBondContact O-N 2.66Å; R515-T519 WeakPolarHBondContact O-CG2 3.37Å; R515-T519 PolarHBondContact O-OG1 2.91Å; R515-T519 VanDerWaalsContact O-OG1 3.14Å
516	S	43	Very low	57.6	Low	62 Å²	62	69 Å²	69	43%	0.434	35%	0.347	S	S	.	.	H	α-helix	trans	-67.1	-52.1	175.8	-171.4	0	0	0	0	110.1	Q513 M514 E518 T519 N520	Q513-S516 WeakPolarHBondContact O-CA 3.43Å; Q513-S516 VanDerWaalsContact O-CB 3.24Å; Q513-S516 WeakPolarHBondContact O-CB 3.45Å; Q513-S516 PolarHBondContact O-N 2.88Å; M514-S516 VanDerWaalsContact C-N 3.27Å; M514-S516 PolarHBondContact O-N 3.1Å; S516-E518 PolarHBondContact O-N 3.11Å; S516-T519 PolarHBondContact O-N 2.93Å; S516-T519 PolarHBondContact O-OG1 3.42Å; S516-N520 PolarHBondContact O-N 3.48Å; S516-N520 PolarHBondContact O-ND2 3.48Å; S516-N520 PolarHBondContact O-OD1 3.3Å; S516-N520 VanDerWaalsContact O-OD1 3.09Å
517	L	44.1	Very low	58.4	Low	52 Å²	52	64.9 Å²	64.9	27%	0.272	32%	0.318	S	S	.	.	H	α-helix	trans	-72.9	-30.6	-172.4	-134.5	150.4	0	0	0	113	I504 Q513 M514 T519 N520	I504-L517 HydrophobicContact CD1-CB 4.06Å; I504-L517 HydrophobicContact CD1-CD1 3.67Å; I504-L517 HydrophobicContact CD1-CD2 3.75Å; I504-L517 HydrophobicContact CD1-CG 4.01Å; Q513-L517 PolarHBondContact O-N 2.66Å; M514-L517 PolarHBondContact O-N 3.22Å; L517-T519 PolarHBondContact O-N 3.48Å; L517-N520 PolarHBondContact O-N 2.89Å
518	E	45.7	Very low	59.3	Low	46 Å²	46	59 Å²	59	22%	0.215	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-26.3	168	-73.7	-151.3	119.6	0	0	114	H49 R501 M514 S516	H49-E518 PolarHBondContact ND1-O 3.05Å; R501-E518 IonicContact CZ-OE1 3.62Å; R501-E518 IonicContact NE-OE1 3.15Å; R501-E518 PolarHBondContact NE-OE1 3.03Å; R501-E518 IonicContact NH2-OE1 2.57Å; R501-E518 PolarHBondContact NH2-OE1 2.81Å; M514-E518 WeakPolarHBondContact O-CG 3.41Å; M514-E518 PolarHBondContact O-N 3.24Å; M514-E518 VanDerWaalsContact O-N 3.08Å; S516-E518 PolarHBondContact O-N 3.11Å
519	T	48.9	Very low	61	Low	20 Å²	20	55.8 Å²	55.8	12%	0.123	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-6.4	-178.3	52.6	0	0	0	0	114.6	H49 R515 S516 L517 R568	H49-T519 HydrophobicContact CB-CG2 4.43Å; H49-T519 PolarHBondContact CE1-O 2.99Å; R515-T519 WeakPolarHBondContact O-CG2 3.37Å; R515-T519 PolarHBondContact O-OG1 2.91Å; R515-T519 VanDerWaalsContact O-OG1 3.14Å; S516-T519 PolarHBondContact O-N 2.93Å; S516-T519 PolarHBondContact O-OG1 3.42Å; L517-T519 PolarHBondContact O-N 3.48Å; T519-R568 PolarHBondContact OG1-NH1 3.33Å
520	N	64.2	Low	62.8	Low	16 Å²	16	50.6 Å²	50.6	9%	0.086	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	-28.1	-171.6	-65.4	-10.1	0	0	0	112.9	D474 P476 L477 S516 L517	D474-N520 PolarHBondContact O-ND2 2.88Å; P476-N520 CarbonylContact C-O 3.55Å; P476-N520 WeakPolarHBondContact CA-O 3.48Å; P476-N520 HydrophobicContact CG-CB 4.47Å; L477-N520 PolarHBondContact N-O 3.17Å; S516-N520 PolarHBondContact O-N 3.48Å; S516-N520 PolarHBondContact O-ND2 3.48Å; S516-N520 PolarHBondContact O-OD1 3.3Å; S516-N520 VanDerWaalsContact O-OD1 3.09Å; L517-N520 PolarHBondContact O-N 2.89Å
521	M	71.8	Confident	64.5	Low	10 Å²	10	45.2 Å²	45.2	5%	0.049	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	115.7	176.2	-171.2	172.5	-65.6	0	0	112.8	F473 L477 Y479 R497 M500	F473-M521 HydrophobicContact CD1-CE 4.49Å; F473-M521 HydrophobicContact CE1-CE 4.39Å; L477-M521 HydrophobicContact CD2-CE 4.07Å; Y479-M521 HydrophobicContact CD2-CG 4.39Å; Y479-M521 HydrophobicContact CE2-CE 4.24Å; Y479-M521 HydrophobicContact CE2-CG 4.2Å; Y479-M521 HydrophobicContact CE2-SD 3.87Å; R497-M521 HydrophobicContact CB-SD 3.96Å; R497-M521 HydrophobicContact CG-SD 4.16Å; R497-M521 PolarHBondContact NE-O 3.08Å; M500-M521 HydrophobicContact CE-CE 3.99Å; M500-M521 HydrophobicContact SD-CE 3.38Å; M500-M521 WeakPolarHBondContact SD-CE 3.49Å; M500-M521 HydrophobicContact SD-SD 4.19Å
522	G	74.4	Confident	66.3	Low	4 Å²	4	37.3 Å²	37.3	4%	0.041	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	156.4	172.3	0	0	0	0	0	113.1	L477 Y479	L477-G522 PolarHBondContact O-N 3.35Å; Y479-G522 PolarHBondContact N-O 2.9Å
523	T	79	Confident	68.4	Low	2 Å²	2	34 Å²	34	1%	0.012	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	139.8	175.8	-57.7	0	0	0	0	109.5	I46 Y479 V481	I46-T523 WeakPolarHBondContact CA-O 3.48Å; Y479-T523 CarbonylContact O-C 3.31Å; Y479-T523 WeakPolarHBondContact O-CA 3.4Å; V481-T523 HydrophobicContact CG2-CG2 4.35Å
524	V	83.2	Confident	70.3	Confident	4 Å²	4	30.5 Å²	30.5	2%	0.024	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	98.2	178.9	166.3	0	0	0	0	106.6	I44 I46 L478 Y479 V480 V481 A557	I44-V524 HydrophobicContact CG2-CB 4.49Å; I44-V524 HydrophobicContact CG2-CG1 3.63Å; I46-V524 HydrophobicContact CG1-CG2 4.48Å; L478-V524 HydrophobicContact CD1-CG2 3.83Å; L478-V524 HydrophobicContact CG-CG2 4.49Å; Y479-V524 PolarHBondContact O-N 3.27Å; V480-V524 WeakPolarHBondContact CA-O 3.15Å; V480-V524 HydrophobicContact CG1-CB 4.49Å; V480-V524 HydrophobicContact CG1-CG1 4.03Å; V480-V524 HydrophobicContact CG2-CB 4.26Å; V480-V524 HydrophobicContact CG2-CG1 4.45Å; V481-V524 PolarHBondContact N-O 3.11Å; V524-A557 HydrophobicContact CG2-CB 4.09Å
525	T	80.3	Confident	72.2	Confident	9 Å²	9	28.5 Å²	28.5	6%	0.055	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	116.3	179	-58	0	0	0	0	110	I44 E45 E483 V490	I44-T525 WeakPolarHBondContact CA-O 3.23Å; E45-T525 PolarHBondContact N-O 3.39Å; E45-T525 PolarHBondContact O-N 3.35Å; E483-T525 HydrophobicContact CB-CG2 4.24Å; V490-T525 HydrophobicContact CG1-CG2 4.46Å; V490-T525 HydrophobicContact CG2-CG2 4.4Å
526	V	82.9	Confident	73.9	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	108.8	179	-168.9	0	0	0	0	109.1	V480 V481 E483 A529 L533 V535 V550 I554	V480-V526 HydrophobicContact CG1-CG2 4.35Å; V481-V526 PolarHBondContact O-N 2.85Å; E483-V526 PolarHBondContact N-O 3.15Å; V526-A529 HydrophobicContact CB-CB 3.88Å; V526-A529 HydrophobicContact CG1-CB 3.69Å; V526-A529 VanDerWaalsContact O-CB 3.28Å; V526-A529 WeakPolarHBondContact O-CB 3.42Å; V526-A529 PolarHBondContact O-N 3.03Å; V526-L533 HydrophobicContact CG2-CD2 4.23Å; V526-V535 HydrophobicContact CG1-CG2 4.11Å; V526-V550 HydrophobicContact CG1-CG1 3.83Å; V526-I554 HydrophobicContact CG1-CD1 4.27Å; V526-I554 HydrophobicContact CG2-CD1 3.77Å; V526-I554 HydrophobicContact CG2-CG1 3.88Å
527	C	72.7	Confident	75.1	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	150.3	-174	-61.3	0	0	0	0	112.9	Y43 E483 A529	Y43-C527 HydrophobicContact CD1-CB 4.16Å; Y43-C527 WeakPolarHBondContact CD2-SG 3.41Å; Y43-C527 HydrophobicContact CE1-CB 4.14Å; Y43-C527 VanDerWaalsContact CE1-SG 3.52Å; Y43-C527 WeakPolarHBondContact CE2-SG 3.31Å; Y43-C527 HydrophobicContact CG-CB 4.48Å; Y43-C527 VanDerWaalsContact CG-SG 3.54Å; Y43-C527 WeakPolarHBondContact O-CB 3.45Å; Y43-C527 PolarHBondContact O-N 3.3Å; Y43-C527 PolarHBondContact O-SG 3.03Å; E483-C527 VanDerWaalsContact OE2-CA 3.26Å; E483-C527 WeakPolarHBondContact OE2-CA 3.38Å; E483-C527 WeakPolarHBondContact OE2-CB 3.45Å; C527-A529 PolarHBondContact O-N 3.07Å
528	N	77.3	Confident	76.1	Confident	33 Å²	33	28.8 Å²	28.8	18%	0.176	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	18.6	-171.2	-74.5	-79.6	0	0	0	114.5	G41 E483 V535 L536 A539	G41-N528 PolarHBondContact O-ND2 3.03Å; G41-N528 VanDerWaalsContact O-ND2 3.15Å; E483-N528 PolarHBondContact OE2-N 3.35Å; N528-V535 HydrophobicContact CB-CG1 4.04Å; N528-V535 WeakPolarHBondContact O-CA 3.46Å; N528-L536 WeakPolarHBondContact O-CG 3.31Å; N528-L536 PolarHBondContact O-N 2.93Å; N528-A539 HydrophobicContact CB-CB 3.6Å
529	A	85.8	Confident	76.8	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-102.8	142.4	-177.5	0	0	0	0	0	113.9	G482 E483 M484 V526 C527 S534 V535	G482-A529 CarbonylContact C-O 3.59Å; G482-A529 VanDerWaalsContact C-O 3.31Å; G482-A529 VanDerWaalsContact CA-O 3.3Å; G482-A529 WeakPolarHBondContact CA-O 3.47Å; E483-A529 PolarHBondContact N-O 3.24Å; M484-A529 CarbonylContact C-O 3.49Å; M484-A529 WeakPolarHBondContact CA-O 3.33Å; M484-A529 WeakPolarHBondContact CB-O 3.48Å; M484-A529 PolarHBondContact N-O 3.22Å; V526-A529 HydrophobicContact CB-CB 3.88Å; V526-A529 HydrophobicContact CG1-CB 3.69Å; V526-A529 VanDerWaalsContact O-CB 3.28Å; V526-A529 WeakPolarHBondContact O-CB 3.42Å; V526-A529 PolarHBondContact O-N 3.03Å; C527-A529 PolarHBondContact O-N 3.07Å; A529-S534 WeakPolarHBondContact CA-O 3.39Å; A529-V535 HydrophobicContact CB-CG2 3.95Å
530	T	89	Confident	77.3	Confident	26 Å²	26	27.2 Å²	27.2	16%	0.16	16%	0.155	C	C	.	.			trans	-82.4	179.3	177.4	56.9	0	0	0	0	112.6	N532 L533 S534 L536	T530-N532 PolarHBondContact O-N 2.96Å; T530-L533 WeakPolarHBondContact O-CA 3.42Å; T530-L533 PolarHBondContact O-N 2.71Å; T530-S534 PolarHBondContact N-O 2.81Å; T530-S534 PolarHBondContact OG1-O 3.41Å; T530-S534 VanDerWaalsContact OG1-O 3.08Å; T530-L536 HydrophobicContact CG2-CD2 4.46Å
531	E	88.2	Confident	76.9	Confident	27 Å²	27	32.5 Å²	32.5	13%	0.126	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-17.3	172	57.7	-98.7	-138.4	0	0	115.2	W429 D453 K486 Y487 L533	W429-E531 PolarHBondContact NE1-O 3.35Å; D453-E531 VanDerWaalsContact CB-O 3.27Å; D453-E531 WeakPolarHBondContact CB-O 3.44Å; D453-E531 WeakPolarHBondContact OD2-CA 3.24Å; D453-E531 VanDerWaalsContact OD2-CB 3.24Å; D453-E531 WeakPolarHBondContact OD2-CB 3.43Å; K486-E531 IonicContact NZ-OE1 3.53Å; K486-E531 PolarHBondContact NZ-OE1 2.87Å; K486-E531 IonicContact NZ-OE2 3.8Å; K486-E531 PolarHBondContact NZ-OE2 3.28Å; Y487-E531 HydrophobicContact CD2-CB 3.84Å; Y487-E531 HydrophobicContact CD2-CG 4.09Å; Y487-E531 HydrophobicContact CE2-CB 4.26Å; Y487-E531 HydrophobicContact CE2-CG 3.97Å; E531-L533 VanDerWaalsContact C-N 3.35Å
532	N	89.3	Confident	75.9	Confident	51 Å²	51	34.3 Å²	34.3	27%	0.273	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	7.7	175.5	-55.1	-66.1	0	0	0	112.8	H366 N368 W429 T530 S534	H366-N532 WeakPolarHBondContact CB-OD1 3.49Å; H366-N532 PolarHBondContact CD2-OD1 2.91Å; H366-N532 PolarHBondContact ND1-OD1 3.07Å; N368-N532 WeakPolarHBondContact CB-O 3.45Å; N368-N532 PolarHBondContact ND2-O 3.28Å; W429-N532 WeakPolarHBondContact CZ2-O 3.42Å; T530-N532 PolarHBondContact O-N 2.96Å; N532-S534 PolarHBondContact O-N 3.39Å
533	L	89.6	Confident	74.9	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.196	C	C	.	.	S	Bend	trans	51.1	19.7	-167	-57.7	178.3	0	0	0	113.9	N368 W429 M452 V480 V481 G482 V526 T530 E531 Q547 I554	N368-L533 PolarHBondContact ND2-O 3.23Å; W429-L533 HydrophobicContact CH2-CB 4.1Å; W429-L533 HydrophobicContact CH2-CD1 3.74Å; W429-L533 HydrophobicContact CH2-CG 4.09Å; W429-L533 HydrophobicContact CZ2-CB 3.85Å; W429-L533 HydrophobicContact CZ2-CD1 3.68Å; W429-L533 HydrophobicContact CZ2-CG 3.63Å; M452-L533 HydrophobicContact CB-CD1 4.3Å; M452-L533 HydrophobicContact CE-CD1 3.86Å; V480-L533 HydrophobicContact CB-CD1 4.41Å; V480-L533 HydrophobicContact CG1-CD1 3.64Å; V481-L533 VanDerWaalsContact C-CD2 3.48Å; G482-L533 VanDerWaalsContact N-CD2 3.34Å; V526-L533 HydrophobicContact CG2-CD2 4.23Å; T530-L533 WeakPolarHBondContact O-CA 3.42Å; T530-L533 PolarHBondContact O-N 2.71Å; E531-L533 VanDerWaalsContact C-N 3.35Å; L533-Q547 PolarHBondContact O-NE2 3.03Å; L533-I554 HydrophobicContact CB-CD1 4.45Å
534	S	87.1	Confident	73.5	Confident	41 Å²	41	36.7 Å²	36.7	29%	0.287	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-86.3	121.6	172.4	-60.2	0	0	0	0	109.1	A529 T530 N532	A529-S534 WeakPolarHBondContact CA-O 3.39Å; T530-S534 PolarHBondContact N-O 2.81Å; T530-S534 PolarHBondContact OG1-O 3.41Å; T530-S534 VanDerWaalsContact OG1-O 3.08Å; N532-S534 PolarHBondContact O-N 3.39Å
535	V	77.8	Confident	72.1	Confident	6 Å²	6	37.3 Å²	37.3	4%	0.036	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-75.1	141.2	177.4	178.1	0	0	0	0	109.9	L42 V526 N528 A529 A539 L540 V550	L42-V535 HydrophobicContact CD1-CG1 4.44Å; L42-V535 HydrophobicContact CD1-CG2 4.03Å; V526-V535 HydrophobicContact CG1-CG2 4.11Å; N528-V535 HydrophobicContact CB-CG1 4.04Å; N528-V535 WeakPolarHBondContact O-CA 3.46Å; A529-V535 HydrophobicContact CB-CG2 3.95Å; V535-A539 HydrophobicContact CG1-CB 3.86Å; V535-L540 HydrophobicContact CB-CD1 4.44Å; V535-L540 HydrophobicContact CB-CD2 3.79Å; V535-L540 HydrophobicContact CB-CG 3.91Å; V535-L540 HydrophobicContact CG1-CD2 3.87Å; V535-L540 HydrophobicContact CG1-CG 3.84Å; V535-V550 HydrophobicContact CG2-CB 4.49Å; V535-V550 HydrophobicContact CG2-CG1 3.85Å; V535-V550 HydrophobicContact CG2-CG2 4.14Å
536	L	76.7	Confident	71.2	Confident	74 Å²	74	37.9 Å²	37.9	39%	0.387	21%	0.214	S	C	.	.	P	Polyproline II helix	trans	-58	133.2	178.6	-69.2	170.7	0	0	0	111	N528 T530 N538 A539 L540	N528-L536 WeakPolarHBondContact O-CG 3.31Å; N528-L536 PolarHBondContact O-N 2.93Å; T530-L536 HydrophobicContact CG2-CD2 4.46Å; L536-N538 PolarHBondContact O-N 3.11Å; L536-A539 WeakPolarHBondContact O-CB 3.29Å; L536-A539 PolarHBondContact O-N 3.21Å; L536-L540 PolarHBondContact O-N 3.19Å; L536-L540 VanDerWaalsContact O-N 3.12Å
537	P	69.7	Low	71.1	Confident	96 Å²	96	39.6 Å²	39.6	62%	0.623	22%	0.222	S	C	*	.	H	α-helix	trans	-55.6	-30.8	-176.4	-30	36.2	0	0	0	114.9	F541	P537-F541 VanDerWaalsContact O-CB 3.26Å; P537-F541 WeakPolarHBondContact O-CB 3.46Å; P537-F541 PolarHBondContact O-N 3.48Å
538	N	64.1	Low	71.1	Confident	140 Å²	140	43 Å²	43	75%	0.749	25%	0.25	S	C	*	.	H	α-helix	trans	-66.3	-37.4	176.6	-66.1	2.9	0	0	0	112.1	L536 A542	L536-N538 PolarHBondContact O-N 3.11Å; N538-A542 WeakPolarHBondContact O-CB 3.41Å; N538-A542 PolarHBondContact O-N 3.41Å
539	A	60.7	Low	70.7	Confident	3 Å²	3	42 Å²	42	3%	0.025	25%	0.246	C	C	.	.	H	α-helix	trans	-71.4	-50.8	175.2	0	0	0	0	0	110	N528 V535 L536 F541 A542 L543	N528-A539 HydrophobicContact CB-CB 3.6Å; V535-A539 HydrophobicContact CG1-CB 3.86Å; L536-A539 WeakPolarHBondContact O-CB 3.29Å; L536-A539 PolarHBondContact O-N 3.21Å; A539-F541 PolarHBondContact O-N 2.83Å; A539-F541 VanDerWaalsContact O-N 3.11Å; A539-A542 PolarHBondContact O-N 3.29Å; A539-L543 HydrophobicContact CB-CD1 4.06Å; A539-L543 WeakPolarHBondContact O-CB 3.35Å; A539-L543 WeakPolarHBondContact O-CD1 3.26Å; A539-L543 PolarHBondContact O-N 3.11Å
540	L	59.4	Low	70.2	Confident	29 Å²	29	42 Å²	42	15%	0.152	25%	0.246	C	C	.	.	H	α-helix	trans	-49.1	-41.8	173.9	-69.8	178.7	0	0	0	112.4	V535 L536 N544 V545 Q547 V550	V535-L540 HydrophobicContact CB-CD1 4.44Å; V535-L540 HydrophobicContact CB-CD2 3.79Å; V535-L540 HydrophobicContact CB-CG 3.91Å; V535-L540 HydrophobicContact CG1-CD2 3.87Å; V535-L540 HydrophobicContact CG1-CG 3.84Å; L536-L540 PolarHBondContact O-N 3.19Å; L536-L540 VanDerWaalsContact O-N 3.12Å; L540-N544 PolarHBondContact O-N 2.88Å; L540-N544 VanDerWaalsContact O-N 3.14Å; L540-V545 WeakPolarHBondContact CB-O 3.4Å; L540-V545 HydrophobicContact CD2-CG2 3.93Å; L540-V545 PolarHBondContact O-N 3.03Å; L540-Q547 HydrophobicContact CD1-CB 4.28Å; L540-V550 HydrophobicContact CD2-CG2 3.9Å
541	F	55.5	Low	70	Confident	127 Å²	127	41 Å²	41	56%	0.557	24%	0.24	S	C	*	.	H	α-helix	trans	-68.9	-49.3	176.1	-176	-93.7	0	0	0	113.2	E240 P537 A539 L543 N544	E240-F541 HydrophobicContact CB-CE2 4.35Å; P537-F541 VanDerWaalsContact O-CB 3.26Å; P537-F541 WeakPolarHBondContact O-CB 3.46Å; P537-F541 PolarHBondContact O-N 3.48Å; A539-F541 PolarHBondContact O-N 2.83Å; A539-F541 VanDerWaalsContact O-N 3.11Å; F541-L543 PolarHBondContact O-N 3.17Å; F541-N544 PolarHBondContact O-N 3.36Å; F541-N544 PolarHBondContact O-OD1 3.3Å
542	A	51.9	Low	69.5	Low	49 Å²	49	40.9 Å²	40.9	41%	0.405	24%	0.239	S	C	.	.	H	α-helix	trans	-61.2	-33.7	179.3	0	0	0	0	0	112.9	P40 N538 A539	P40-A542 HydrophobicContact CB-CB 3.91Å; P40-A542 HydrophobicContact CG-CB 3.76Å; N538-A542 WeakPolarHBondContact O-CB 3.41Å; N538-A542 PolarHBondContact O-N 3.41Å; A539-A542 PolarHBondContact O-N 3.29Å
543	L	52.5	Low	68.9	Low	15 Å²	15	38.7 Å²	38.7	8%	0.079	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-5.6	-178.3	-72.8	142.4	0	0	0	113.9	P40 L42 L77 A539 F541 V545	P40-L543 WeakPolarHBondContact O-CD1 3.32Å; P40-L543 VanDerWaalsContact O-CG 3.29Å; P40-L543 WeakPolarHBondContact O-CG 3.13Å; L42-L543 HydrophobicContact CB-CD1 3.65Å; L42-L543 HydrophobicContact CB-CD2 3.86Å; L42-L543 HydrophobicContact CB-CG 4.28Å; L42-L543 VanDerWaalsContact N-CD2 3.29Å; L77-L543 HydrophobicContact CD2-CD2 4.1Å; A539-L543 HydrophobicContact CB-CD1 4.06Å; A539-L543 WeakPolarHBondContact O-CB 3.35Å; A539-L543 WeakPolarHBondContact O-CD1 3.26Å; A539-L543 PolarHBondContact O-N 3.11Å; F541-L543 PolarHBondContact O-N 3.17Å; L543-V545 VanDerWaalsContact C-N 3.28Å; L543-V545 HydrophobicContact CB-CG2 3.86Å; L543-V545 PolarHBondContact O-N 3.31Å
544	N	49.1	Very low	68.7	Low	41 Å²	41	38.7 Å²	38.7	22%	0.219	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	40.5	-176.4	-56.1	-65.2	0	0	0	113.5	N233 L237 L540 F541	N233-N544 HydrophobicContact CB-CB 4.35Å; N233-N544 PolarHBondContact ND2-O 3.09Å; L237-N544 WeakPolarHBondContact CD1-OD1 3.43Å; L237-N544 VanDerWaalsContact CD2-OD1 3.28Å; L237-N544 WeakPolarHBondContact CD2-OD1 3.41Å; L237-N544 VanDerWaalsContact CG-OD1 3.28Å; L237-N544 WeakPolarHBondContact CG-OD1 3.31Å; L540-N544 PolarHBondContact O-N 2.88Å; L540-N544 VanDerWaalsContact O-N 3.14Å; F541-N544 PolarHBondContact O-N 3.36Å; F541-N544 PolarHBondContact O-OD1 3.3Å
545	V	53.7	Low	68.8	Low	17 Å²	17	37 Å²	37	10%	0.103	22%	0.215	C	C	.	.			trans	-123.4	154.1	178.4	-66.6	0	0	0	0	111.7	L540 L543 C549 V550	L540-V545 WeakPolarHBondContact CB-O 3.4Å; L540-V545 HydrophobicContact CD2-CG2 3.93Å; L540-V545 PolarHBondContact O-N 3.03Å; L543-V545 VanDerWaalsContact C-N 3.28Å; L543-V545 HydrophobicContact CB-CG2 3.86Å; L543-V545 PolarHBondContact O-N 3.31Å; V545-C549 HydrophobicContact CB-CB 4.45Å; V545-V550 HydrophobicContact CG2-CG2 4.39Å
546	S	63.3	Low	68.9	Low	20 Å²	20	39.7 Å²	39.7	14%	0.14	23%	0.227	C	C	.	.			trans	-97.8	158.2	172.6	81.6	0	0	0	0	111.6	A548 C549 V550	S546-A548 PolarHBondContact O-N 3.06Å; S546-A548 VanDerWaalsContact O-N 3.16Å; S546-A548 PolarHBondContact OG-N 2.83Å; S546-C549 VanDerWaalsContact O-CB 3.32Å; S546-C549 WeakPolarHBondContact O-CB 3.19Å; S546-C549 PolarHBondContact O-N 2.86Å; S546-C549 PolarHBondContact OG-N 3.1Å; S546-C549 PolarHBondContact OG-SG 2.83Å; S546-V550 PolarHBondContact O-N 2.85Å; S546-V550 VanDerWaalsContact O-N 3.13Å
547	Q	79.7	Confident	69.1	Low	37 Å²	37	36.4 Å²	36.4	17%	0.173	21%	0.211	C	C	.	.	H	α-helix	trans	-57.1	-27.8	170.4	-173.8	64.3	48.6	0	0	112.3	L533 L540 V550 N551	L533-Q547 PolarHBondContact O-NE2 3.03Å; L540-Q547 HydrophobicContact CD1-CB 4.28Å; Q547-V550 PolarHBondContact O-N 2.79Å; Q547-N551 PolarHBondContact NE2-OD1 3.3Å; Q547-N551 VanDerWaalsContact O-CB 3.29Å; Q547-N551 WeakPolarHBondContact O-CB 3.29Å; Q547-N551 PolarHBondContact O-N 3.27Å; Q547-N551 PolarHBondContact O-OD1 2.87Å
548	A	73	Confident	70.1	Confident	70 Å²	70	31.8 Å²	31.8	58%	0.579	18%	0.181	S	C	*	.	H	α-helix	trans	-69	-35.2	174.8	0	0	0	0	0	112.2	S546 H552	S546-A548 PolarHBondContact O-N 3.06Å; S546-A548 VanDerWaalsContact O-N 3.16Å; S546-A548 PolarHBondContact OG-N 2.83Å; A548-H552 PolarHBondContact O-N 2.73Å; A548-H552 VanDerWaalsContact O-N 3.07Å
549	C	68.7	Low	71.1	Confident	13 Å²	13	25.3 Å²	25.3	9%	0.088	15%	0.147	C	C	.	.	H	α-helix	trans	-65	-47.6	172.5	-50.2	0	0	0	0	110.3	C333 V545 S546 N551 H552 C553	C333-C549 PolarHBondContact O-SG 3.33Å; V545-C549 HydrophobicContact CB-CB 4.45Å; S546-C549 VanDerWaalsContact O-CB 3.32Å; S546-C549 WeakPolarHBondContact O-CB 3.19Å; S546-C549 PolarHBondContact O-N 2.86Å; S546-C549 PolarHBondContact OG-N 3.1Å; S546-C549 PolarHBondContact OG-SG 2.83Å; C549-N551 PolarHBondContact O-N 2.94Å; C549-H552 WeakPolarHBondContact O-CB 3.33Å; C549-H552 PolarHBondContact O-N 3.46Å; C549-H552 VanDerWaalsContact O-N 3.17Å; C549-C553 PolarHBondContact O-N 3.49Å; C549-C553 PolarHBondContact O-SG 3.34Å
550	V	75.7	Confident	72	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.006	17%	0.17	C	C	.	.	H	α-helix	trans	-60.3	-46.7	177.3	-178.9	0	0	0	0	111.2	L42 V526 V535 L540 V545 S546 Q547 H552 C553 I554	L42-V550 HydrophobicContact CD1-CG2 4.28Å; L42-V550 HydrophobicContact CD2-CG2 4.01Å; V526-V550 HydrophobicContact CG1-CG1 3.83Å; V535-V550 HydrophobicContact CG2-CB 4.49Å; V535-V550 HydrophobicContact CG2-CG1 3.85Å; V535-V550 HydrophobicContact CG2-CG2 4.14Å; L540-V550 HydrophobicContact CD2-CG2 3.9Å; V545-V550 HydrophobicContact CG2-CG2 4.39Å; S546-V550 PolarHBondContact O-N 2.85Å; S546-V550 VanDerWaalsContact O-N 3.13Å; Q547-V550 PolarHBondContact O-N 2.79Å; V550-H552 PolarHBondContact O-N 2.93Å; V550-C553 PolarHBondContact O-N 2.98Å; V550-C553 VanDerWaalsContact O-N 3.14Å; V550-I554 HydrophobicContact CG1-CD1 4.07Å; V550-I554 WeakPolarHBondContact O-CG1 3.43Å; V550-I554 PolarHBondContact O-N 3.38Å
551	N	83.6	Confident	73.2	Confident	5 Å²	5	29.6 Å²	29.6	3%	0.027	17%	0.165	C	C	.	.	H	α-helix	trans	-60.9	-32.4	177.3	-74	-2.8	0	0	0	112.8	N368 F372 L376 Q547 C549 L555	N368-N551 PolarHBondContact ND2-OD1 2.88Å; N368-N551 PolarHBondContact OD1-ND2 3.07Å; N368-N551 PolarHBondContact OD1-OD1 3.26Å; F372-N551 HydrophobicContact CE2-CB 4.04Å; F372-N551 HydrophobicContact CZ-CB 3.88Å; F372-N551 WeakPolarHBondContact CZ-O 3.47Å; L376-N551 HydrophobicContact CD1-CB 3.81Å; Q547-N551 PolarHBondContact NE2-OD1 3.3Å; Q547-N551 VanDerWaalsContact O-CB 3.29Å; Q547-N551 WeakPolarHBondContact O-CB 3.29Å; Q547-N551 PolarHBondContact O-N 3.27Å; Q547-N551 PolarHBondContact O-OD1 2.87Å; C549-N551 PolarHBondContact O-N 2.94Å; N551-L555 PolarHBondContact O-N 3.49Å; N551-L555 VanDerWaalsContact O-N 3.08Å
552	H	78.4	Confident	74.6	Confident	24 Å²	24	23.6 Å²	23.6	11%	0.111	14%	0.139	C	C	.	.	H	α-helix	trans	-70.1	-44	173.6	-168.7	-86.4	0	0	0	111.9	P335 R337 I339 A548 C549 V550 I554 L555 E556	P335-H552 HydrophobicContact CB-CB 4.3Å; P335-H552 VanDerWaalsContact CB-CD2 3.4Å; P335-H552 WeakPolarHBondContact CB-CD2 3.42Å; P335-H552 WeakPolarHBondContact CB-CE1 3.27Å; P335-H552 VanDerWaalsContact CB-CG 3.48Å; P335-H552 WeakPolarHBondContact CB-ND1 3.18Å; P335-H552 WeakPolarHBondContact CB-NE2 3.14Å; P335-H552 VanDerWaalsContact CG-CD2 3.49Å; P335-H552 WeakPolarHBondContact CG-CD2 3.47Å; P335-H552 WeakPolarHBondContact CG-NE2 3.45Å; R337-H552 PolarHBondContact O-CE1 2.91Å; I339-H552 WeakPolarHBondContact CD1-CE1 3.27Å; I339-H552 VanDerWaalsContact CD1-NE2 3.31Å; I339-H552 WeakPolarHBondContact CD1-NE2 3.36Å; I339-H552 WeakPolarHBondContact CG1-CE1 3.43Å; A548-H552 PolarHBondContact O-N 2.73Å; A548-H552 VanDerWaalsContact O-N 3.07Å; C549-H552 WeakPolarHBondContact O-CB 3.33Å; C549-H552 PolarHBondContact O-N 3.46Å; C549-H552 VanDerWaalsContact O-N 3.17Å; V550-H552 PolarHBondContact O-N 2.93Å; H552-I554 PolarHBondContact O-N 3.33Å; H552-L555 CarbonylContact O-C 3.42Å; H552-L555 WeakPolarHBondContact O-CA 3.4Å; H552-L555 WeakPolarHBondContact O-CB 3.29Å; H552-L555 PolarHBondContact O-N 3.12Å; H552-E556 IonicContact CE1-OE2 3.58Å; H552-E556 IonicContact ND1-OE2 3.19Å; H552-E556 WeakPolarHBondContact O-CB 3.32Å; H552-E556 PolarHBondContact O-N 3.2Å
553	C	75.9	Confident	76	Confident	4 Å²	4	23.6 Å²	23.6	3%	0.027	13%	0.132	C	C	.	.	H	α-helix	trans	-60.4	-35.9	176.9	-56.8	0	0	0	0	111.5	I44 W74 C549 V550 E556 A557	I44-C553 HydrophobicContact CD1-CB 3.74Å; W74-C553 HydrophobicContact CH2-CB 4.34Å; W74-C553 HydrophobicContact CZ2-CB 4.24Å; C549-C553 PolarHBondContact O-N 3.49Å; C549-C553 PolarHBondContact O-SG 3.34Å; V550-C553 PolarHBondContact O-N 2.98Å; V550-C553 VanDerWaalsContact O-N 3.14Å; C553-E556 PolarHBondContact O-N 2.96Å; C553-A557 PolarHBondContact O-N 2.83Å
554	I	86.6	Confident	77.1	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.7	-42.9	172	-66.5	164.5	0	0	0	111.5	F372 M452 V480 V526 L533 V550 H552 E556 I558	F372-I554 HydrophobicContact CE1-CB 4.29Å; F372-I554 HydrophobicContact CE1-CG2 3.78Å; F372-I554 HydrophobicContact CZ-CB 3.86Å; F372-I554 HydrophobicContact CZ-CD1 4.21Å; F372-I554 HydrophobicContact CZ-CG2 3.6Å; M452-I554 HydrophobicContact CE-CG2 4.25Å; V480-I554 HydrophobicContact CG1-CG2 3.73Å; V526-I554 HydrophobicContact CG1-CD1 4.27Å; V526-I554 HydrophobicContact CG2-CD1 3.77Å; V526-I554 HydrophobicContact CG2-CG1 3.88Å; L533-I554 HydrophobicContact CB-CD1 4.45Å; V550-I554 HydrophobicContact CG1-CD1 4.07Å; V550-I554 WeakPolarHBondContact O-CG1 3.43Å; V550-I554 PolarHBondContact O-N 3.38Å; H552-I554 PolarHBondContact O-N 3.33Å; I554-E556 VanDerWaalsContact C-N 3.33Å; I554-I558 HydrophobicContact CG2-CD1 4Å; I554-I558 WeakPolarHBondContact O-CB 3.24Å; I554-I558 VanDerWaalsContact O-CG1 3.3Å; I554-I558 WeakPolarHBondContact O-CG1 3.37Å; I554-I558 PolarHBondContact O-N 3.21Å
555	L	88.2	Confident	78.4	Confident	7 Å²	7	25.4 Å²	25.4	4%	0.037	14%	0.141	C	C	.	.	H	α-helix	trans	-66	-36.4	176.6	-172.2	68.1	0	0	0	111.9	I339 L376 L377 V380 N551 H552 I558 V559	I339-L555 HydrophobicContact CD1-CB 3.85Å; I339-L555 HydrophobicContact CD1-CD2 3.8Å; I339-L555 HydrophobicContact CD1-CG 3.8Å; L376-L555 HydrophobicContact CB-CD1 4.28Å; L376-L555 HydrophobicContact CB-CD2 4.04Å; L376-L555 HydrophobicContact CD2-CD2 4.49Å; L377-L555 HydrophobicContact CD2-CD1 3.8Å; V380-L555 HydrophobicContact CG1-CD2 4.04Å; V380-L555 HydrophobicContact CG1-CG 4.41Å; V380-L555 HydrophobicContact CG2-CD1 4.06Å; N551-L555 PolarHBondContact O-N 3.49Å; N551-L555 VanDerWaalsContact O-N 3.08Å; H552-L555 CarbonylContact O-C 3.42Å; H552-L555 WeakPolarHBondContact O-CA 3.4Å; H552-L555 WeakPolarHBondContact O-CB 3.29Å; H552-L555 PolarHBondContact O-N 3.12Å; L555-I558 WeakPolarHBondContact O-CB 3.47Å; L555-I558 PolarHBondContact O-N 3.36Å; L555-V559 WeakPolarHBondContact O-CG2 3.32Å; L555-V559 PolarHBondContact O-N 3.43Å
556	E	81.4	Confident	79.4	Confident	61 Å²	61	25.2 Å²	25.2	29%	0.285	14%	0.139	S	C	.	.	H	α-helix	trans	-63.6	-51.1	177.2	-165	167.1	175.3	0	0	110.4	I339 H552 C553 I554 I558 V559 E560	I339-E556 HydrophobicContact CD1-CB 3.87Å; I339-E556 HydrophobicContact CG1-CB 4.19Å; I339-E556 HydrophobicContact CG1-CG 4.29Å; H552-E556 IonicContact CE1-OE2 3.58Å; H552-E556 IonicContact ND1-OE2 3.19Å; H552-E556 WeakPolarHBondContact O-CB 3.32Å; H552-E556 PolarHBondContact O-N 3.2Å; C553-E556 PolarHBondContact O-N 2.96Å; I554-E556 VanDerWaalsContact C-N 3.33Å; E556-I558 VanDerWaalsContact C-N 3.3Å; E556-I558 PolarHBondContact O-N 3.41Å; E556-V559 PolarHBondContact O-N 3.01Å; E556-V559 VanDerWaalsContact O-N 3.11Å; E556-E560 WeakPolarHBondContact O-CB 3.46Å; E556-E560 PolarHBondContact O-N 3.45Å
557	A	81	Confident	79.7	Confident	5 Å²	5	31 Å²	31	4%	0.041	17%	0.169	C	C	.	.	H	α-helix	trans	-61.5	-35	174.6	0	0	0	0	0	113.1	V524 C553 F561	V524-A557 HydrophobicContact CG2-CB 4.09Å; C553-A557 PolarHBondContact O-N 2.83Å; A557-F561 VanDerWaalsContact O-CB 3.31Å; A557-F561 WeakPolarHBondContact O-CB 3.33Å; A557-F561 PolarHBondContact O-N 2.76Å
558	I	89	Confident	78.7	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.1	-45.7	172.2	-78.3	165.6	0	0	0	111.3	L377 I450 M452 L478 V480 I554 L555 E556 L562	L377-I558 HydrophobicContact CD2-CG2 4.37Å; I450-I558 HydrophobicContact CD1-CG1 4.48Å; I450-I558 HydrophobicContact CD1-CG2 3.68Å; I450-I558 HydrophobicContact CG2-CD1 4.3Å; I450-I558 HydrophobicContact CG2-CG1 4.31Å; M452-I558 HydrophobicContact CE-CD1 4.33Å; L478-I558 HydrophobicContact CD2-CB 4.47Å; L478-I558 HydrophobicContact CD2-CG1 3.81Å; V480-I558 HydrophobicContact CG2-CD1 4.45Å; V480-I558 HydrophobicContact CG2-CG1 4.33Å; I554-I558 HydrophobicContact CG2-CD1 4Å; I554-I558 WeakPolarHBondContact O-CB 3.24Å; I554-I558 VanDerWaalsContact O-CG1 3.3Å; I554-I558 WeakPolarHBondContact O-CG1 3.37Å; I554-I558 PolarHBondContact O-N 3.21Å; L555-I558 WeakPolarHBondContact O-CB 3.47Å; L555-I558 PolarHBondContact O-N 3.36Å; E556-I558 VanDerWaalsContact C-N 3.3Å; E556-I558 PolarHBondContact O-N 3.41Å; I558-L562 HydrophobicContact CG2-CD1 4.06Å; I558-L562 WeakPolarHBondContact O-CB 3.2Å; I558-L562 VanDerWaalsContact O-CG 3.26Å; I558-L562 WeakPolarHBondContact O-CG 3.36Å; I558-L562 PolarHBondContact O-N 2.67Å
559	V	86.4	Confident	77.7	Confident	4 Å²	4	34.7 Å²	34.7	2%	0.024	17%	0.172	C	C	.	.	H	α-helix	trans	-72.5	-36.6	-179.1	168	0	0	0	0	111.6	I339 L342 V380 L555 E556 L562 N563	I339-V559 HydrophobicContact CG2-CB 3.88Å; I339-V559 HydrophobicContact CG2-CG1 3.85Å; I339-V559 HydrophobicContact CG2-CG2 3.7Å; L342-V559 HydrophobicContact CD1-CG2 4.16Å; L342-V559 HydrophobicContact CD2-CG1 4.08Å; L342-V559 HydrophobicContact CG-CG1 4.4Å; L342-V559 HydrophobicContact CG-CG2 4.26Å; V380-V559 HydrophobicContact CB-CG2 4.17Å; V380-V559 HydrophobicContact CG1-CG2 4.23Å; V380-V559 HydrophobicContact CG2-CG2 4.07Å; L555-V559 WeakPolarHBondContact O-CG2 3.32Å; L555-V559 PolarHBondContact O-N 3.43Å; E556-V559 PolarHBondContact O-N 3.01Å; E556-V559 VanDerWaalsContact O-N 3.11Å; V559-L562 PolarHBondContact O-N 3.41Å; V559-N563 WeakPolarHBondContact CG1-ND2 3.3Å; V559-N563 WeakPolarHBondContact O-CB 3.31Å; V559-N563 VanDerWaalsContact O-CG 3.22Å; V559-N563 PolarHBondContact O-N 2.84Å; V559-N563 PolarHBondContact O-ND2 3.22Å; V559-N563 VanDerWaalsContact O-ND2 3.12Å
560	E	79.4	Confident	76.5	Confident	109 Å²	109	40.2 Å²	40.2	51%	0.509	21%	0.205	S	C	.	.	H	α-helix	trans	-61.1	-51.2	173	-175.3	177	-170	0	0	111.6	E556 L562 N563 L564	E556-E560 WeakPolarHBondContact O-CB 3.46Å; E556-E560 PolarHBondContact O-N 3.45Å; E560-L562 VanDerWaalsContact C-N 3.3Å; E560-L562 PolarHBondContact O-N 3.06Å; E560-N563 PolarHBondContact O-N 3.2Å; E560-L564 HydrophobicContact CG-CD1 4.28Å; E560-L564 WeakPolarHBondContact O-CG 3.46Å; E560-L564 PolarHBondContact O-N 3.45Å
561	F	83.5	Confident	75.1	Confident	13 Å²	13	44.9 Å²	44.9	6%	0.057	23%	0.233	C	C	.	.	H	α-helix	trans	-53.9	-46.2	173.8	166.6	-100.1	0	0	0	111.8	A448 P476 L478 A557 L564 V565	A448-F561 HydrophobicContact CB-CE1 4.08Å; A448-F561 HydrophobicContact CB-CZ 4.46Å; P476-F561 HydrophobicContact CB-CE2 4.23Å; P476-F561 HydrophobicContact CB-CZ 3.69Å; L478-F561 HydrophobicContact CB-CD1 3.75Å; L478-F561 HydrophobicContact CB-CD2 4.22Å; L478-F561 HydrophobicContact CB-CE1 3.67Å; L478-F561 HydrophobicContact CB-CE2 4.15Å; L478-F561 HydrophobicContact CB-CG 4.03Å; L478-F561 HydrophobicContact CB-CZ 3.88Å; L478-F561 HydrophobicContact CD1-CB 4.32Å; L478-F561 HydrophobicContact CD1-CD2 4.08Å; L478-F561 HydrophobicContact CD1-CG 4.08Å; L478-F561 HydrophobicContact CD2-CB 3.97Å; L478-F561 HydrophobicContact CD2-CD1 3.92Å; L478-F561 HydrophobicContact CD2-CG 3.97Å; L478-F561 HydrophobicContact CG-CD1 4.31Å; L478-F561 HydrophobicContact CG-CG 4.26Å; A557-F561 VanDerWaalsContact O-CB 3.31Å; A557-F561 WeakPolarHBondContact O-CB 3.33Å; A557-F561 PolarHBondContact O-N 2.76Å; F561-L564 PolarHBondContact O-N 3.23Å; F561-V565 HydrophobicContact CD2-CG2 4.46Å; F561-V565 HydrophobicContact CE1-CG2 4.28Å; F561-V565 HydrophobicContact CE2-CG2 4.05Å; F561-V565 HydrophobicContact CZ-CG2 3.95Å; F561-V565 WeakPolarHBondContact O-CG2 3.42Å; F561-V565 PolarHBondContact O-N 3.1Å
562	L	86.5	Confident	73	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-67.3	-37.9	179.3	-71	171.1	0	0	0	112.7	L342 F348 V425 A448 I450 I558 V559 E560 V565 M566	L342-L562 HydrophobicContact CD1-CD1 3.64Å; L342-L562 HydrophobicContact CD2-CB 3.92Å; L342-L562 HydrophobicContact CD2-CD1 4.5Å; F348-L562 HydrophobicContact CE1-CD1 3.62Å; F348-L562 HydrophobicContact CZ-CD1 3.53Å; V425-L562 HydrophobicContact CG1-CD2 4.14Å; V425-L562 HydrophobicContact CG2-CD2 3.97Å; A448-L562 HydrophobicContact CB-CD2 3.99Å; I450-L562 HydrophobicContact CD1-CD1 4.06Å; I450-L562 HydrophobicContact CD1-CD2 4.48Å; I450-L562 HydrophobicContact CD1-CG 4.42Å; I558-L562 HydrophobicContact CG2-CD1 4.06Å; I558-L562 WeakPolarHBondContact O-CB 3.2Å; I558-L562 VanDerWaalsContact O-CG 3.26Å; I558-L562 WeakPolarHBondContact O-CG 3.36Å; I558-L562 PolarHBondContact O-N 2.67Å; V559-L562 PolarHBondContact O-N 3.41Å; E560-L562 VanDerWaalsContact C-N 3.3Å; E560-L562 PolarHBondContact O-N 3.06Å; L562-V565 PolarHBondContact O-N 2.93Å; L562-M566 VanDerWaalsContact O-CB 3.24Å; L562-M566 WeakPolarHBondContact O-CB 3.46Å; L562-M566 WeakPolarHBondContact O-CG 3.36Å; L562-M566 PolarHBondContact O-N 3.49Å
563	N	80.5	Confident	70.9	Confident	50 Å²	50	52.2 Å²	52.2	27%	0.267	28%	0.278	S	S	.	.	H	α-helix	trans	-64	-40.9	174.1	-70.9	-33.3	0	0	0	111.4	V559 E560 V565 M566 N567	V559-N563 WeakPolarHBondContact CG1-ND2 3.3Å; V559-N563 WeakPolarHBondContact O-CB 3.31Å; V559-N563 VanDerWaalsContact O-CG 3.22Å; V559-N563 PolarHBondContact O-N 2.84Å; V559-N563 PolarHBondContact O-ND2 3.22Å; V559-N563 VanDerWaalsContact O-ND2 3.12Å; E560-N563 PolarHBondContact O-N 3.2Å; N563-V565 VanDerWaalsContact C-N 3.3Å; N563-V565 PolarHBondContact O-N 3.39Å; N563-M566 PolarHBondContact O-N 3.38Å; N563-N567 WeakPolarHBondContact O-CB 3.38Å; N563-N567 PolarHBondContact O-N 2.93Å; N563-N567 VanDerWaalsContact O-N 3.14Å; N563-N567 PolarHBondContact O-ND2 3.11Å
564	L	75.3	Confident	69.2	Low	87 Å²	87	57.3 Å²	57.3	46%	0.455	31%	0.305	S	S	.	.	H	α-helix	trans	-62.2	-35.5	174.9	-71.2	169.5	0	0	0	112.8	E560 F561 R568	E560-L564 HydrophobicContact CG-CD1 4.28Å; E560-L564 WeakPolarHBondContact O-CG 3.46Å; E560-L564 PolarHBondContact O-N 3.45Å; F561-L564 PolarHBondContact O-N 3.23Å; L564-R568 WeakPolarHBondContact O-CD 3.35Å; L564-R568 WeakPolarHBondContact O-CG 3.44Å; L564-R568 PolarHBondContact O-NE 3.1Å
565	V	77.3	Confident	66.8	Low	6 Å²	6	61.7 Å²	61.7	4%	0.036	32%	0.324	C	S	.	.	H	α-helix	trans	-72.4	-50.3	174	166.1	0	0	0	0	111.9	A448 P476 F561 L562 N563 N567 R568 T569	A448-V565 HydrophobicContact CB-CG1 4.47Å; P476-V565 HydrophobicContact CB-CB 4.47Å; P476-V565 HydrophobicContact CB-CG1 4.22Å; P476-V565 HydrophobicContact CB-CG2 3.4Å; P476-V565 VanDerWaalsContact CB-CG2 3.4Å; P476-V565 HydrophobicContact CG-CB 4.31Å; P476-V565 HydrophobicContact CG-CG1 3.77Å; P476-V565 HydrophobicContact CG-CG2 3.6Å; F561-V565 HydrophobicContact CD2-CG2 4.46Å; F561-V565 HydrophobicContact CE1-CG2 4.28Å; F561-V565 HydrophobicContact CE2-CG2 4.05Å; F561-V565 HydrophobicContact CZ-CG2 3.95Å; F561-V565 WeakPolarHBondContact O-CG2 3.42Å; F561-V565 PolarHBondContact O-N 3.1Å; L562-V565 PolarHBondContact O-N 2.93Å; N563-V565 VanDerWaalsContact C-N 3.3Å; N563-V565 PolarHBondContact O-N 3.39Å; V565-N567 PolarHBondContact O-N 3.5Å; V565-R568 WeakPolarHBondContact O-CA 3.5Å; V565-R568 WeakPolarHBondContact O-CB 3.22Å; V565-R568 PolarHBondContact O-N 2.89Å; V565-T569 HydrophobicContact CG1-CG2 4.4Å; V565-T569 PolarHBondContact O-N 3.03Å; V565-T569 PolarHBondContact O-OG1 2.97Å
566	M	75.1	Confident	64.2	Low	13 Å²	13	67.3 Å²	67.3	6%	0.064	35%	0.354	C	S	.	.	H	α-helix	trans	-69.3	-19.5	-171.4	-65.5	-89.8	-79.2	0	0	113	P343 L346 R423 C447 L562 N563 R568	P343-M566 HydrophobicContact CB-CE 3.91Å; P343-M566 HydrophobicContact CG-CE 3.75Å; L346-M566 HydrophobicContact CB-CE 3.96Å; L346-M566 HydrophobicContact CD1-CE 3.67Å; L346-M566 HydrophobicContact CD1-SD 3.93Å; L346-M566 HydrophobicContact CG-CE 4.38Å; R423-M566 HydrophobicContact CB-SD 4.21Å; R423-M566 PolarHBondContact NH1-O 3.01Å; C447-M566 VanDerWaalsContact SG-SD 3.63Å; L562-M566 VanDerWaalsContact O-CB 3.24Å; L562-M566 WeakPolarHBondContact O-CB 3.46Å; L562-M566 WeakPolarHBondContact O-CG 3.36Å; L562-M566 PolarHBondContact O-N 3.49Å; N563-M566 PolarHBondContact O-N 3.38Å; M566-R568 VanDerWaalsContact C-N 3.26Å
567	N	68.6	Low	61.9	Low	143 Å²	143	72.3 Å²	72.3	77%	0.765	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-3.3	169.9	-70.4	-12.4	0	0	0	113.7	N563 V565	N563-N567 WeakPolarHBondContact O-CB 3.38Å; N563-N567 PolarHBondContact O-N 2.93Å; N563-N567 VanDerWaalsContact O-N 3.14Å; N563-N567 PolarHBondContact O-ND2 3.11Å; V565-N567 PolarHBondContact O-N 3.5Å
568	R	59	Low	59.8	Low	136 Å²	136	82.3 Å²	82.3	51%	0.513	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	-36.6	-179.8	-59.9	164.1	176.4	-117	8.1	112.5	T519 L564 V565 M566 T570	T519-R568 PolarHBondContact OG1-NH1 3.33Å; L564-R568 WeakPolarHBondContact O-CD 3.35Å; L564-R568 WeakPolarHBondContact O-CG 3.44Å; L564-R568 PolarHBondContact O-NE 3.1Å; V565-R568 WeakPolarHBondContact O-CA 3.5Å; V565-R568 WeakPolarHBondContact O-CB 3.22Å; V565-R568 PolarHBondContact O-N 2.89Å; M566-R568 VanDerWaalsContact C-N 3.26Å; R568-T570 PolarHBondContact O-N 2.88Å
569	T	51.3	Low	57.3	Low	47 Å²	47	86.3 Å²	86.3	29%	0.288	44%	0.437	S	S	.	.			trans	-80.9	93.8	178.1	44.1	0	0	0	0	111	V565	V565-T569 HydrophobicContact CG1-CG2 4.4Å; V565-T569 PolarHBondContact O-N 3.03Å; V565-T569 PolarHBondContact O-OG1 2.97Å
570	T	44.9	Very low	55	Low	130 Å²	130	90 Å²	90	80%	0.798	46%	0.461	S	S	*	.			trans	-55.7	137.9	159	46.8	0	0	0	0	109.2	R568 N572	R568-T570 PolarHBondContact O-N 2.88Å; T570-N572 PolarHBondContact O-N 3.34Å; T570-N572 VanDerWaalsContact O-N 3.1Å
571	V	45.4	Very low	53.6	Low	98 Å²	98	89.2 Å²	89.2	59%	0.594	47%	0.467	S	S	*	.			trans	-70.2	109.1	176	179.1	0	0	0	0	107.5	R423 P573	R423-V571 HydrophobicContact CG-CG2 4.28Å; V571-P573 VanDerWaalsContact O-CD 3.31Å; V571-P573 WeakPolarHBondContact O-CD 3.42Å
572	N	39.8	Very low	51.8	Low	99 Å²	99	94 Å²	94	53%	0.529	49%	0.493	S	S	.	.			trans	-68.4	115.6	-179.2	-175.2	-14.8	0	0	0	110	T570 D574	T570-N572 PolarHBondContact O-N 3.34Å; T570-N572 VanDerWaalsContact O-N 3.1Å; N572-D574 VanDerWaalsContact C-N 3.29Å; N572-D574 PolarHBondContact O-N 3.28Å; N572-D574 WeakPolarHBondContact OD1-CB 3.15Å; N572-D574 PolarHBondContact OD1-N 3.2Å
573	P	34.8	Very low	50.1	Low	85 Å²	85	100.1 Å²	100.1	55%	0.552	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-69.8	-23.9	-177.6	30.1	-36	0	0	0	113.2	V571 F575 L576	V571-P573 VanDerWaalsContact O-CD 3.31Å; V571-P573 WeakPolarHBondContact O-CD 3.42Å; P573-F575 PolarHBondContact O-N 3.3Å; P573-L576 WeakPolarHBondContact O-CB 3.26Å; P573-L576 WeakPolarHBondContact O-CG 3.23Å; P573-L576 PolarHBondContact O-N 3.3Å; P573-L576 VanDerWaalsContact O-N 3.15Å
574	D	38.8	Very low	48.5	Very low	110 Å²	110	100.5 Å²	100.5	59%	0.588	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-66.8	-15.8	-171.5	-60.6	-19.8	0	0	0	113.3	N572 L576 M577	N572-D574 VanDerWaalsContact C-N 3.29Å; N572-D574 PolarHBondContact O-N 3.28Å; N572-D574 WeakPolarHBondContact OD1-CB 3.15Å; N572-D574 PolarHBondContact OD1-N 3.2Å; D574-L576 PolarHBondContact O-N 3.31Å; D574-M577 PolarHBondContact O-N 3.46Å
575	F	37.1	Very low	47.4	Very low	93 Å²	93	102 Å²	102	41%	0.408	53%	0.527	S	S	.	.	G	3₁₀ helix	trans	-70.6	-9	176.9	-140.1	-91.5	0	0	0	113.5	S445 P573 M577	S445-F575 WeakPolarHBondContact OG-CE1 3.42Å; S445-F575 WeakPolarHBondContact OG-CZ 3.5Å; P573-F575 PolarHBondContact O-N 3.3Å; F575-M577 VanDerWaalsContact C-N 3.26Å; F575-M577 PolarHBondContact O-N 2.94Å
576	L	32.3	Very low	46.7	Very low	125 Å²	125	107.2 Å²	107.2	65%	0.654	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-71.5	-15.9	174.9	-67.3	171.2	0	0	0	113.8	T421 P573 D574	T421-L576 HydrophobicContact CG2-CD2 4.16Å; P573-L576 WeakPolarHBondContact O-CB 3.26Å; P573-L576 WeakPolarHBondContact O-CG 3.23Å; P573-L576 PolarHBondContact O-N 3.3Å; P573-L576 VanDerWaalsContact O-N 3.15Å; D574-L576 PolarHBondContact O-N 3.31Å
577	M	34.5	Very low	45.7	Very low	165 Å²	165	109.6 Å²	109.6	81%	0.813	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-105.3	6.3	-162.4	-76.4	-70.9	-70.9	0	0	116.6	D574 F575	D574-M577 PolarHBondContact O-N 3.46Å; F575-M577 VanDerWaalsContact C-N 3.26Å; F575-M577 PolarHBondContact O-N 2.94Å
578	R	35.9	Very low	45.2	Very low	216 Å²	216	110 Å²	110	82%	0.815	56%	0.555	S	S	*	*			trans	-124.3	25.1	-165.1	-66.5	-169.3	-179.8	176	2.4	117.7
579	L	36.8	Very low	45.5	Very low	84 Å²	84	109.1 Å²	109.1	44%	0.44	56%	0.559	S	S	.	*	S	Bend	trans	-122.3	126	170	-76.6	171.4	0	0	0	111	A417 S581 M584	A417-L579 HydrophobicContact CB-CD1 4.15Å; L579-S581 PolarHBondContact O-N 3.31Å; L579-M584 HydrophobicContact CB-CE 4.05Å; L579-M584 HydrophobicContact CD1-CE 3.83Å
580	P	38.6	Very low	46.4	Very low	82 Å²	82	110.8 Å²	110.8	53%	0.532	57%	0.569	S	S	.	*			trans	-58.2	133.2	172.2	-23.4	34.3	0	0	0	111.4	L582 E583	P580-L582 VanDerWaalsContact C-N 3.27Å; P580-L582 PolarHBondContact O-N 3.37Å; P580-E583 PolarHBondContact O-N 3.43Å
581	S	49.6	Very low	47.4	Very low	92 Å²	92	107.8 Å²	107.8	64%	0.643	55%	0.551	S	S	*	*	H	α-helix	trans	-54.8	-42	-175.8	48.9	0	0	0	0	113	L579 E583 M584 E585	L579-S581 PolarHBondContact O-N 3.31Å; S581-E583 PolarHBondContact O-N 2.99Å; S581-M584 PolarHBondContact O-N 3.19Å; S581-M584 VanDerWaalsContact O-N 3.16Å; S581-E585 PolarHBondContact O-N 2.79Å
582	L	46.7	Very low	48.4	Very low	114 Å²	114	108.5 Å²	108.5	60%	0.597	55%	0.549	S	S	*	.	H	α-helix	trans	-58.8	-42.4	-173.9	-149	78.1	0	0	0	113.3	P580 Q586	P580-L582 VanDerWaalsContact C-N 3.27Å; P580-L582 PolarHBondContact O-N 3.37Å; L582-Q586 WeakPolarHBondContact O-CG 3.24Å; L582-Q586 PolarHBondContact O-N 3.34Å; L582-Q586 VanDerWaalsContact O-N 3.12Å
583	E	50.6	Low	50.1	Low	128 Å²	128	110.7 Å²	110.7	60%	0.598	55%	0.554	S	S	*	*	H	α-helix	trans	-72.6	-36.7	178.7	-66	-167.2	146.9	0	0	111.7	P580 S581 Q586 L587	P580-E583 PolarHBondContact O-N 3.43Å; S581-E583 PolarHBondContact O-N 2.99Å; E583-Q586 PolarHBondContact O-N 2.99Å; E583-L587 PolarHBondContact O-N 3.24Å
584	M	45.5	Very low	51.8	Low	57 Å²	57	111.3 Å²	111.3	28%	0.281	55%	0.549	S	S	.	.	H	α-helix	trans	-67.7	-38	177.8	-164.4	-172.2	-63.7	0	0	111.6	L579 S581 L587 R588	L579-M584 HydrophobicContact CB-CE 4.05Å; L579-M584 HydrophobicContact CD1-CE 3.83Å; S581-M584 PolarHBondContact O-N 3.19Å; S581-M584 VanDerWaalsContact O-N 3.16Å; M584-L587 PolarHBondContact O-N 3.47Å; M584-R588 WeakPolarHBondContact O-CB 3.47Å; M584-R588 VanDerWaalsContact O-CG 3.24Å; M584-R588 WeakPolarHBondContact O-CG 3.29Å; M584-R588 PolarHBondContact O-N 2.96Å; M584-R588 PolarHBondContact SD-NH2 2.91Å
585	E	52.5	Low	53.3	Low	118 Å²	118	115 Å²	115	55%	0.551	56%	0.555	S	S	*	*	H	α-helix	trans	-64.3	-46.7	172.5	-71.9	-160.8	127.1	0	0	111.9	S581 L587 R588 L589	S581-E585 PolarHBondContact O-N 2.79Å; E585-L587 VanDerWaalsContact C-N 3.32Å; E585-L587 PolarHBondContact O-N 3.25Å; E585-R588 PolarHBondContact O-N 3.08Å; E585-L589 WeakPolarHBondContact O-CB 3.38Å; E585-L589 VanDerWaalsContact O-CG 3.31Å; E585-L589 WeakPolarHBondContact O-CG 3.44Å; E585-L589 PolarHBondContact O-N 3.17Å
586	Q	63.6	Low	54.8	Low	117 Å²	117	116.3 Å²	116.3	55%	0.547	56%	0.564	S	S	.	*	H	α-helix	trans	-59.9	-40.4	176.3	-72	-179.8	21.9	0	0	112.3	L582 E583 T590	L582-Q586 WeakPolarHBondContact O-CG 3.24Å; L582-Q586 PolarHBondContact O-N 3.34Å; L582-Q586 VanDerWaalsContact O-N 3.12Å; E583-Q586 PolarHBondContact O-N 2.99Å; Q586-T590 WeakPolarHBondContact O-CB 3.45Å; Q586-T590 PolarHBondContact O-N 2.75Å; Q586-T590 PolarHBondContact O-OG1 3.3Å
587	L	53.6	Low	56.9	Low	63 Å²	63	115.7 Å²	115.7	33%	0.33	56%	0.557	S	S	.	*	H	α-helix	trans	-66.4	-43.3	174.6	-122.1	84.5	0	0	0	112.1	L418 E583 M584 E585 T590 V591	L418-L587 HydrophobicContact CD1-CD2 4.2Å; L418-L587 HydrophobicContact CD2-CD2 4.16Å; L418-L587 HydrophobicContact CG-CD2 3.94Å; E583-L587 PolarHBondContact O-N 3.24Å; M584-L587 PolarHBondContact O-N 3.47Å; E585-L587 VanDerWaalsContact C-N 3.32Å; E585-L587 PolarHBondContact O-N 3.25Å; L587-T590 PolarHBondContact O-N 3.1Å; L587-V591 WeakPolarHBondContact O-CB 3.34Å; L587-V591 WeakPolarHBondContact O-CG2 3.35Å; L587-V591 PolarHBondContact O-N 2.94Å
588	R	58.3	Low	58.6	Low	152 Å²	152	113.2 Å²	113.2	57%	0.574	54%	0.542	S	S	*	.	H	α-helix	trans	-61.2	-46.4	176.6	-77.2	173.6	178.2	-168.2	1	111.6	M584 E585 V591 M592	M584-R588 WeakPolarHBondContact O-CB 3.47Å; M584-R588 VanDerWaalsContact O-CG 3.24Å; M584-R588 WeakPolarHBondContact O-CG 3.29Å; M584-R588 PolarHBondContact O-N 2.96Å; M584-R588 PolarHBondContact SD-NH2 2.91Å; E585-R588 PolarHBondContact O-N 3.08Å; R588-V591 PolarHBondContact O-N 3.48Å; R588-M592 WeakPolarHBondContact O-CB 3.48Å; R588-M592 WeakPolarHBondContact O-CG 3.37Å; R588-M592 PolarHBondContact O-N 2.89Å
589	L	65.6	Low	60.1	Low	117 Å²	117	107.8 Å²	107.8	61%	0.613	53%	0.529	S	S	*	.	H	α-helix	trans	-60.8	-43.8	175.7	-74	167.1	0	0	0	111.6	E585 M592 K593	E585-L589 WeakPolarHBondContact O-CB 3.38Å; E585-L589 VanDerWaalsContact O-CG 3.31Å; E585-L589 WeakPolarHBondContact O-CG 3.44Å; E585-L589 PolarHBondContact O-N 3.17Å; L589-M592 PolarHBondContact O-N 2.87Å; L589-K593 WeakPolarHBondContact O-CB 3.49Å; L589-K593 PolarHBondContact O-N 2.93Å
590	T	69.6	Low	61.7	Low	81 Å²	81	105.3 Å²	105.3	50%	0.497	52%	0.521	S	S	.	.	H	α-helix	trans	-62.4	-45.9	176.9	-56.5	0	0	0	0	111.5	Q586 L587 K593 E594	Q586-T590 WeakPolarHBondContact O-CB 3.45Å; Q586-T590 PolarHBondContact O-N 2.75Å; Q586-T590 PolarHBondContact O-OG1 3.3Å; L587-T590 PolarHBondContact O-N 3.1Å; T590-K593 PolarHBondContact O-N 3.32Å; T590-E594 PolarHBondContact O-N 3.13Å
591	V	64.8	Low	63.1	Low	68 Å²	68	105.9 Å²	105.9	41%	0.412	52%	0.516	S	S	.	.	H	α-helix	trans	-66	-38.9	177.3	171.1	0	0	0	0	111.7	L418 L587 R588 R595	L418-V591 HydrophobicContact CD1-CG2 4.24Å; L418-V591 HydrophobicContact CD2-CG2 4.48Å; L587-V591 WeakPolarHBondContact O-CB 3.34Å; L587-V591 WeakPolarHBondContact O-CG2 3.35Å; L587-V591 PolarHBondContact O-N 2.94Å; R588-V591 PolarHBondContact O-N 3.48Å; V591-R595 VanDerWaalsContact O-CB 3.27Å; V591-R595 WeakPolarHBondContact O-CB 3.42Å; V591-R595 PolarHBondContact O-N 3.43Å
592	M	66.5	Low	63.7	Low	113 Å²	113	106.2 Å²	106.2	56%	0.557	51%	0.514	S	S	*	.	H	α-helix	trans	-64.6	-41.3	173.1	-78.2	-173	69.1	0	0	112	R588 L589 R595 M596	R588-M592 WeakPolarHBondContact O-CB 3.48Å; R588-M592 WeakPolarHBondContact O-CG 3.37Å; R588-M592 PolarHBondContact O-N 2.89Å; L589-M592 PolarHBondContact O-N 2.87Å; M592-R595 PolarHBondContact O-N 3.48Å; M592-M596 PolarHBondContact O-N 2.8Å
593	K	76	Confident	64.2	Low	145 Å²	145	107 Å²	107	63%	0.63	52%	0.515	S	S	*	.	H	α-helix	trans	-61.9	-49.8	176.7	-173.3	176.9	178.6	-179.6	0	111.4	L589 T590 R595 M596 E597	L589-K593 WeakPolarHBondContact O-CB 3.49Å; L589-K593 PolarHBondContact O-N 2.93Å; T590-K593 PolarHBondContact O-N 3.32Å; K593-R595 VanDerWaalsContact C-N 3.27Å; K593-R595 PolarHBondContact O-N 3.36Å; K593-M596 PolarHBondContact O-N 3.46Å; K593-E597 WeakPolarHBondContact O-CB 3.16Å; K593-E597 PolarHBondContact O-N 2.68Å
594	E	71.5	Confident	64.5	Low	97 Å²	97	109.9 Å²	109.9	45%	0.453	52%	0.52	S	S	.	.	H	α-helix	trans	-57.1	-39.4	173.1	-86.7	-162.3	-149.1	0	0	112.7	T590 E597 K598	T590-E594 PolarHBondContact O-N 3.13Å; E594-E597 PolarHBondContact O-N 3.31Å; E594-K598 WeakPolarHBondContact O-CB 3.26Å; E594-K598 WeakPolarHBondContact O-CD 3.37Å; E594-K598 VanDerWaalsContact O-CG 3.27Å; E594-K598 WeakPolarHBondContact O-CG 3.4Å; E594-K598 PolarHBondContact O-N 2.82Å; E594-K598 IonicContact OE2-NZ 3.92Å; E594-K598 PolarHBondContact OE2-NZ 2.83Å
595	R	69.1	Low	64.7	Low	189 Å²	189	116 Å²	116	71%	0.713	54%	0.541	S	S	*	.	H	α-helix	trans	-71.2	-40.8	-178.2	-161.2	176.1	-169.2	-165.8	1.5	111.5	V591 M592 K593 L599	V591-R595 VanDerWaalsContact O-CB 3.27Å; V591-R595 WeakPolarHBondContact O-CB 3.42Å; V591-R595 PolarHBondContact O-N 3.43Å; M592-R595 PolarHBondContact O-N 3.48Å; K593-R595 VanDerWaalsContact C-N 3.27Å; K593-R595 PolarHBondContact O-N 3.36Å; R595-L599 WeakPolarHBondContact O-CB 3.45Å; R595-L599 VanDerWaalsContact O-CG 3.28Å; R595-L599 WeakPolarHBondContact O-CG 3.25Å; R595-L599 PolarHBondContact O-N 3.44Å
596	M	69.3	Low	64.4	Low	120 Å²	120	113.9 Å²	113.9	59%	0.591	54%	0.54	S	S	*	.	H	α-helix	trans	-65.3	-40.7	171.3	-76.8	-167.2	-78.2	0	0	111.9	M592 K593 L599 A600	M592-M596 PolarHBondContact O-N 2.8Å; K593-M596 PolarHBondContact O-N 3.46Å; M596-L599 PolarHBondContact O-N 3.03Å; M596-A600 WeakPolarHBondContact O-CB 3.39Å; M596-A600 PolarHBondContact O-N 3.32Å
597	E	75.2	Confident	63.4	Low	111 Å²	111	115.9 Å²	115.9	52%	0.519	55%	0.551	S	S	.	*	H	α-helix	trans	-66.1	-41.2	178.2	-173.9	167.1	-168.3	0	0	112	K593 E594 A600 Q601	K593-E597 WeakPolarHBondContact O-CB 3.16Å; K593-E597 PolarHBondContact O-N 2.68Å; E594-E597 PolarHBondContact O-N 3.31Å; E597-A600 PolarHBondContact O-N 3.05Å; E597-Q601 WeakPolarHBondContact O-CG 3.49Å; E597-Q601 PolarHBondContact O-N 2.7Å
598	K	70.1	Confident	62.7	Low	113 Å²	113	116.9 Å²	116.9	49%	0.491	56%	0.559	S	S	.	*	H	α-helix	trans	-65.2	-38.7	173	-72.6	163.3	-172.6	165.3	0	112	E594 Q601 V602	E594-K598 WeakPolarHBondContact O-CB 3.26Å; E594-K598 WeakPolarHBondContact O-CD 3.37Å; E594-K598 VanDerWaalsContact O-CG 3.27Å; E594-K598 WeakPolarHBondContact O-CG 3.4Å; E594-K598 PolarHBondContact O-N 2.82Å; E594-K598 IonicContact OE2-NZ 3.92Å; E594-K598 PolarHBondContact OE2-NZ 2.83Å; K598-Q601 PolarHBondContact O-N 3.33Å; K598-V602 WeakPolarHBondContact O-CG2 3.42Å; K598-V602 PolarHBondContact O-N 3.29Å
599	L	69.2	Low	61.7	Low	103 Å²	103	113.8 Å²	113.8	54%	0.539	56%	0.559	S	S	.	*	H	α-helix	trans	-64.3	-42.8	172.2	-75.8	166.9	0	0	0	111.8	R595 M596 V602 Q603	R595-L599 WeakPolarHBondContact O-CB 3.45Å; R595-L599 VanDerWaalsContact O-CG 3.28Å; R595-L599 WeakPolarHBondContact O-CG 3.25Å; R595-L599 PolarHBondContact O-N 3.44Å; M596-L599 PolarHBondContact O-N 3.03Å; L599-V602 PolarHBondContact O-N 2.74Å; L599-Q603 WeakPolarHBondContact O-CB 3.38Å; L599-Q603 WeakPolarHBondContact O-CG 3.45Å; L599-Q603 PolarHBondContact O-N 2.68Å
600	A	68.8	Low	60.6	Low	32 Å²	32	113.7 Å²	113.7	26%	0.264	57%	0.568	S	S	.	*	H	α-helix	trans	-65.3	-38.9	176.7	0	0	0	0	0	112.2	M596 E597 Q603 R604	M596-A600 WeakPolarHBondContact O-CB 3.39Å; M596-A600 PolarHBondContact O-N 3.32Å; E597-A600 PolarHBondContact O-N 3.05Å; A600-Q603 PolarHBondContact O-N 3.12Å; A600-R604 WeakPolarHBondContact O-CB 3.19Å; A600-R604 VanDerWaalsContact O-CG 3.24Å; A600-R604 WeakPolarHBondContact O-CG 3.39Å; A600-R604 PolarHBondContact O-N 3.44Å
601	Q	68.7	Low	59.4	Low	94 Å²	94	115.3 Å²	115.3	44%	0.439	58%	0.578	S	S	.	*	H	α-helix	trans	-61.7	-48.4	170.9	-75.6	-176.2	1	0	0	111.3	E597 K598 Q603 R604 Y605	E597-Q601 WeakPolarHBondContact O-CG 3.49Å; E597-Q601 PolarHBondContact O-N 2.7Å; K598-Q601 PolarHBondContact O-N 3.33Å; Q601-Q603 VanDerWaalsContact C-N 3.29Å; Q601-Q603 PolarHBondContact O-N 2.63Å; Q601-R604 PolarHBondContact O-N 3.46Å; Q601-Y605 WeakPolarHBondContact O-CD2 3.39Å; Q601-Y605 PolarHBondContact O-N 3.21Å
602	V	61.5	Low	58.1	Low	99 Å²	99	122.1 Å²	122.1	60%	0.6	60%	0.597	S	S	*	*	H	α-helix	trans	-61	-37.7	177.5	169.8	0	0	0	0	111.6	K598 L599 S606	K598-V602 WeakPolarHBondContact O-CG2 3.42Å; K598-V602 PolarHBondContact O-N 3.29Å; L599-V602 PolarHBondContact O-N 2.74Å; V602-S606 WeakPolarHBondContact O-CB 3.2Å; V602-S606 PolarHBondContact O-N 3.02Å
603	Q	58.8	Low	56.7	Low	130 Å²	130	127.2 Å²	127.2	61%	0.607	61%	0.61	S	S	*	*	H	α-helix	trans	-66.4	-45.5	173.1	-75.6	176.2	-18.1	0	0	112.2	L599 A600 Q601 Y605 S606 M607	L599-Q603 WeakPolarHBondContact O-CB 3.38Å; L599-Q603 WeakPolarHBondContact O-CG 3.45Å; L599-Q603 PolarHBondContact O-N 2.68Å; A600-Q603 PolarHBondContact O-N 3.12Å; Q601-Q603 VanDerWaalsContact C-N 3.29Å; Q601-Q603 PolarHBondContact O-N 2.63Å; Q603-Y605 PolarHBondContact O-N 3.22Å; Q603-S606 CarbonylContact O-C 3.56Å; Q603-S606 WeakPolarHBondContact O-CA 3.36Å; Q603-S606 WeakPolarHBondContact O-CB 3.18Å; Q603-S606 PolarHBondContact O-N 3.05Å; Q603-M607 VanDerWaalsContact O-CG 3.23Å; Q603-M607 WeakPolarHBondContact O-CG 3.48Å; Q603-M607 PolarHBondContact O-N 3.21Å
604	R	56.4	Low	54.6	Low	189 Å²	189	125.7 Å²	125.7	71%	0.713	61%	0.614	S	S	*	*	H	α-helix	trans	-57.8	-46.4	175.5	-73.3	170.5	-172.4	-172.7	3.5	111.6	A600 Q601 S606 M607	A600-R604 WeakPolarHBondContact O-CB 3.19Å; A600-R604 VanDerWaalsContact O-CG 3.24Å; A600-R604 WeakPolarHBondContact O-CG 3.39Å; A600-R604 PolarHBondContact O-N 3.44Å; Q601-R604 PolarHBondContact O-N 3.46Å; R604-S606 VanDerWaalsContact C-N 3.31Å; R604-S606 PolarHBondContact O-N 3.46Å; R604-M607 PolarHBondContact O-N 2.96Å
605	Y	49.4	Very low	53	Low	184 Å²	184	126.5 Å²	126.5	72%	0.722	63%	0.628	S	S	*	*	H	α-helix	trans	-68.2	-27.7	174.2	-71.7	-63.1	0	0	0	113.3	Q601 Q603 M607	Q601-Y605 WeakPolarHBondContact O-CD2 3.39Å; Q601-Y605 PolarHBondContact O-N 3.21Å; Q603-Y605 PolarHBondContact O-N 3.22Å; Y605-M607 VanDerWaalsContact C-N 3.28Å; Y605-M607 PolarHBondContact O-N 3.49Å
606	S	46.4	Very low	51.5	Low	75 Å²	75	124 Å²	124	52%	0.524	63%	0.634	S	S	.	*	H	α-helix	trans	-76.4	-9.4	173.5	-173.5	0	0	0	0	114	V602 Q603 R604	V602-S606 WeakPolarHBondContact O-CB 3.2Å; V602-S606 PolarHBondContact O-N 3.02Å; Q603-S606 CarbonylContact O-C 3.56Å; Q603-S606 WeakPolarHBondContact O-CA 3.36Å; Q603-S606 WeakPolarHBondContact O-CB 3.18Å; Q603-S606 PolarHBondContact O-N 3.05Å; R604-S606 VanDerWaalsContact C-N 3.31Å; R604-S606 PolarHBondContact O-N 3.46Å
607	M	42.1	Very low	49.9	Very low	159 Å²	159	124.6 Å²	124.6	78%	0.783	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-3.1	178.4	-64.9	-120.3	-63	0	0	113.7	Q603 R604 Y605 P609	Q603-M607 VanDerWaalsContact O-CG 3.23Å; Q603-M607 WeakPolarHBondContact O-CG 3.48Å; Q603-M607 PolarHBondContact O-N 3.21Å; R604-M607 PolarHBondContact O-N 2.96Å; Y605-M607 VanDerWaalsContact C-N 3.28Å; Y605-M607 PolarHBondContact O-N 3.49Å; M607-P609 WeakPolarHBondContact O-CD 3.3Å
608	V	38.3	Very low	48.1	Very low	83 Å²	83	128.4 Å²	128.4	50%	0.503	66%	0.658	S	S	.	*	S	Bend	trans	-71.3	122.5	174.6	-175.6	0	0	0	0	109.1	W612	V608-W612 HydrophobicContact CG1-CB 4.28Å
609	P	38	Very low	46.5	Very low	87 Å²	87	127.5 Å²	127.5	57%	0.565	67%	0.672	S	S	*	*			trans	-58	145.2	177.4	-26.1	36.1	0	0	0	112.5	M607 T611 W612	M607-P609 WeakPolarHBondContact O-CD 3.3Å; P609-T611 PolarHBondContact O-N 2.89Å; P609-W612 PolarHBondContact O-N 3.36Å
610	S	43.1	Very low	44.9	Very low	116 Å²	116	132.2 Å²	132.2	81%	0.811	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	1.1	-174.3	51.1	0	0	0	0	115.4
611	T	44.5	Very low	43.4	Very low	114 Å²	114	137.2 Å²	137.2	70%	0.699	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-20	177.3	47.9	0	0	0	0	114	P609 R613	P609-T611 PolarHBondContact O-N 2.89Å; T611-R613 VanDerWaalsContact C-N 3.34Å; T611-R613 PolarHBondContact O-N 2.8Å
612	W	37.7	Very low	41.9	Very low	212 Å²	212	142.6 Å²	142.6	80%	0.803	74%	0.738	S	S	*	*			trans	-90.6	34.6	-174.3	-78.6	85	0	0	0	115.2	V608 P609	V608-W612 HydrophobicContact CG1-CB 4.28Å; P609-W612 PolarHBondContact O-N 3.36Å
613	R	35.9	Very low	40.6	Very low	220 Å²	220	141.7 Å²	141.7	83%	0.83	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-90.7	126.3	168.8	-72.1	-167.2	177.9	-143.7	-1.1	110.3	T611	T611-R613 VanDerWaalsContact C-N 3.34Å; T611-R613 PolarHBondContact O-N 2.8Å
614	P	33.2	Very low	39.4	Very low	112 Å²	112	141 Å²	141	73%	0.727	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-62.3	147.8	174.4	27.2	-34.3	0	0	0	110.5	V616	P614-V616 PolarHBondContact O-N 3.14Å
615	P	36.3	Very low	38.3	Very low	115 Å²	115	138.3 Å²	138.3	75%	0.747	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-65.3	130.9	-172.5	25.5	-34.2	0	0	0	111.5	V617	P615-V617 PolarHBondContact O-N 3.24Å; P615-V617 VanDerWaalsContact O-N 3.1Å
616	V	38.5	Very low	37.7	Very low	136 Å²	136	137.9 Å²	137.9	82%	0.824	76%	0.761	S	S	*	*			trans	-64.3	113.1	170.8	177	0	0	0	0	108.3	P614 K618	P614-V616 PolarHBondContact O-N 3.14Å; V616-K618 PolarHBondContact O-N 3.14Å
617	V	35.7	Very low	37.3	Very low	133 Å²	133	138.9 Å²	138.9	81%	0.806	77%	0.774	S	S	*	*			trans	-64.5	95.2	-177.5	-178.3	0	0	0	0	110.2	P615 A619	P615-V617 PolarHBondContact O-N 3.24Å; P615-V617 VanDerWaalsContact O-N 3.1Å; V617-A619 PolarHBondContact O-N 3.25Å
618	K	36.8	Very low	37.1	Very low	190 Å²	190	136 Å²	136	83%	0.826	78%	0.776	S	S	*	*			trans	-72.4	102.8	165.1	-72.4	-177.9	178.6	176.7	0	108.3	V616 K620	V616-K618 PolarHBondContact O-N 3.14Å; K618-K620 PolarHBondContact O-N 2.98Å
619	A	37.4	Very low	37	Very low	95 Å²	95	141.3 Å²	141.3	79%	0.785	80%	0.795	S	S	*	*			trans	-62.2	100.5	170.8	0	0	0	0	0	110.2	V617	V617-A619 PolarHBondContact O-N 3.25Å
620	K	34.8	Very low	37.1	Very low	201 Å²	201	142.7 Å²	142.7	87%	0.874	81%	0.805	S	S	*	*			trans	-79.5	137.9	168.7	-80.4	-173.1	173.1	-175.5	0	109.6	K618	K618-K620 PolarHBondContact O-N 2.98Å
621	T	37	Very low	36.9	Very low	137 Å²	137	146.7 Å²	146.7	84%	0.84	81%	0.81	S	S	*	*			trans	-119.9	96.7	165.7	-53.6	0	0	0	0	109.9
622	K	37.6	Very low	36.4	Very low	208 Å²	208	148.9 Å²	148.9	90%	0.904	82%	0.818	S	S	*	*			trans	37.7	136.5	159.6	-68.6	-170.9	172.1	-173.2	0	122.1
623	G	34.4	Very low	36.5	Very low	80 Å²	80	143.9 Å²	143.9	83%	0.825	81%	0.813	S	S	*	*			trans	98.5	132.6	160.5	0	0	0	0	0	114.2
624	S	32.9	Very low	36.6	Very low	114 Å²	114	141.3 Å²	141.3	80%	0.797	81%	0.81	S	S	*	*			cis	-151.4	-173.8	-15	-156.6	0	0	0	0	110
625	L	35	Very low	36.7	Very low	133 Å²	133	143.8 Å²	143.8	70%	0.696	81%	0.812	S	S	*	*			trans	-44.6	157.9	169	-80.3	53.9	0	0	0	113.2
626	E	36.9	Very low	36.7	Very low	175 Å²	175	143.6 Å²	143.6	82%	0.818	81%	0.813	S	S	*	*			cis	-153.1	-174.7	14.3	-140	143.6	-161	0	0	114.7
627	A	36.2	Very low	36.5	Very low	96 Å²	96	140.3 Å²	140.3	79%	0.793	81%	0.807	S	S	*	*			trans	-80.3	154.1	-167.8	0	0	0	0	0	117.1
628	A	39.4	Very low	36.6	Very low	100 Å²	100	140.3 Å²	140.3	83%	0.826	81%	0.807	S	S	*	*			trans	-166.6	155.2	138.3	0	0	0	0	0	109.2
629	E	36.1	Very low	36.4	Very low	193 Å²	193	137.9 Å²	137.9	90%	0.902	80%	0.803	S	S	*	*			trans	-104.8	166.7	-173.1	-86.4	-174.1	136.7	0	0	114.2
630	P	39.7	Very low	36.5	Very low	117 Å²	117	137.7 Å²	137.7	76%	0.76	79%	0.792	S	S	*	*			trans	-103.1	167.6	-169.8	40.2	-34.6	0	0	0	114.2
631	E	38.6	Very low	36.7	Very low	199 Å²	199	135.9 Å²	135.9	93%	0.93	79%	0.787	S	S	*	*			trans	-152.3	169.5	151.4	-128	167.5	-149.7	0	0	113
632	D	35	Very low	36.8	Very low	161 Å²	161	136.9 Å²	136.9	86%	0.861	78%	0.782	S	S	*	*			trans	-97.6	-174.8	-150	-114	-12.2	0	0	0	115.1
633	P	39.6	Very low	36.8	Very low	107 Å²	107	131.7 Å²	131.7	70%	0.695	77%	0.768	S	S	*	*			trans	-116.7	175.3	-154.4	44.1	-38.5	0	0	0	116.5
634	Q	36.8	Very low	36.9	Very low	165 Å²	165	132.9 Å²	132.9	77%	0.771	76%	0.764	S	S	*	*			trans	-168.6	145.5	139	-110	169.8	9.8	0	0	114.9
635	Q	36.4	Very low	36.9	Very low	165 Å²	165	132.6 Å²	132.6	77%	0.771	76%	0.759	S	S	*	*			trans	43.9	156.7	138.8	-69.8	171	-3.9	0	0	122.8
636	S	35.4	Very low	36.7	Very low	110 Å²	110	133.8 Å²	133.8	77%	0.769	77%	0.765	S	S	*	*			cis	-173.6	147.5	-23.8	54.2	0	0	0	0	111.5
637	G	35.6	Very low	36.4	Very low	67 Å²	67	132 Å²	132	69%	0.691	76%	0.76	S	S	*	*			trans	168.1	119.2	166.4	0	0	0	0	0	110.8
638	V	36.3	Very low	35.9	Very low	133 Å²	133	134.3 Å²	134.3	81%	0.806	77%	0.765	S	S	*	*			cis	73.6	115.9	49.2	-179.2	0	0	0	0	110.3
639	N	34	Very low	35.6	Very low	139 Å²	139	134.9 Å²	134.9	74%	0.743	76%	0.758	S	S	*	*			cis	-152.6	-170.4	2.6	-119.6	6.8	0	0	0	109.5
640	T	38.9	Very low	35.1	Very low	92 Å²	92	137.5 Å²	137.5	56%	0.564	76%	0.76	S	S	*	*			cis	-153.3	-163.7	13.5	-16.2	0	0	0	0	111.7
641	E	39.9	Very low	34.7	Very low	162 Å²	162	137.8 Å²	137.8	76%	0.757	76%	0.76	S	S	*	*			trans	2.9	146.9	146.4	-72.8	121.4	-146.8	0	0	120.6
642	E	38.4	Very low	34.3	Very low	158 Å²	158	139.7 Å²	139.7	74%	0.738	76%	0.758	S	S	*	*			cis	-169.3	162.5	7.4	-99.9	-98.2	130.6	0	0	106.1
643	T	37.5	Very low	34.1	Very low	99 Å²	99	136.5 Å²	136.5	61%	0.607	76%	0.755	S	S	*	*			cis	-160.4	179	-18.7	14.3	0	0	0	0	106.8
644	S	35.8	Very low	33.5	Very low	106 Å²	106	137 Å²	137	74%	0.741	76%	0.755	S	S	*	*			cis	-146.2	166.4	-3.7	-134.5	0	0	0	0	108.8
645	P	34.3	Very low	33.1	Very low	107 Å²	107	137.2 Å²	137.2	70%	0.695	75%	0.754	S	S	*	*			trans	-101.5	163.5	-164.9	38.7	-35.4	0	0	0	115.3
646	L	29.6	Very low	32.7	Very low	159 Å²	159	138.4 Å²	138.4	83%	0.832	76%	0.759	S	S	*	*				-174.9	156.7	122	-99.9	162.2	0	0	0	114.2
647	L	30.2	Very low	32.5	Very low	136 Å²	136	138.4 Å²	138.4	71%	0.712	76%	0.757	S	S	*	*			trans	63.2	78.1	159.4	-71.6	161.6	0	0	0	120	T649	L647-T649 HydrophobicContact CD2-CG2 4.05Å
648	T	27.4	Very low	32.3	Very low	146 Å²	146	142.4 Å²	142.4	90%	0.896	76%	0.761	S	S	*	*			trans	-101.7	82	154	43.2	0	0	0	0	111.9	R650	T648-R650 PolarHBondContact O-N 3.36Å
649	T	31.3	Very low	31.8	Very low	111 Å²	111	141.1 Å²	141.1	68%	0.681	75%	0.754	S	S	*	*			trans	-82.3	95.2	179.9	31.3	0	0	0	0	113.6	L647	L647-T649 HydrophobicContact CD2-CG2 4.05Å
650	R	27.5	Very low	31.6	Very low	249 Å²	249	142.9 Å²	142.9	94%	0.94	76%	0.755	S	S	*	*			trans	-69.8	120.4	149.3	-87.1	177.3	163.7	178	-2.8	108.5	T648	T648-R650 PolarHBondContact O-N 3.36Å
651	T	30.5	Very low	31.1	Very low	122 Å²	122	145.2 Å²	145.2	75%	0.748	76%	0.764	S	S	*	*			trans	-136.8	120.1	167.9	-12.5	0	0	0	0	112
652	R	29.1	Very low	30.6	Very low	239 Å²	239	149.4 Å²	149.4	90%	0.902	79%	0.79	S	S	*	*			trans	-92.4	126.8	159.2	-78	176	167.5	175.7	-3.9	107.7	V654	R652-V654 HydrophobicContact CB-CG2 4.49Å
653	A	30.9	Very low	30.2	Very low	95 Å²	95	149 Å²	149	79%	0.785	79%	0.793	S	S	*	*			trans	-140.6	122.2	154.2	0	0	0	0	0	105.8
654	V	27.2	Very low	29.8	Very low	116 Å²	116	151.6 Å²	151.6	70%	0.703	80%	0.803	S	S	*	*			cis	75.9	101.6	29.1	-167.5	0	0	0	0	113.3	R652	R652-V654 HydrophobicContact CB-CG2 4.49Å
655	K	28.9	Very low	29.4	Very low	171 Å²	171	154.2 Å²	154.2	74%	0.743	81%	0.806	S	S	*	*			trans	30.2	106.8	153.8	-62.1	179.5	178.1	177.4	0	118
656	Q	29.2	Very low	29.2	Very low	190 Å²	190	156.9 Å²	156.9	89%	0.888	81%	0.813	S	S	*	*				-133.7	124.4	128.4	-77.8	-170	-22.1	0	0	109.4
657	P	30.6	Very low	29.1	Very low	110 Å²	110	156.8 Å²	156.8	71%	0.714	81%	0.811	S	S	*	*			trans	-77.7	137.1	152	32.9	-28.3	0	0	0	108.4	V659	P657-V659 PolarHBondContact O-N 3.14Å
658	L	30.8	Very low	29.1	Very low	150 Å²	150	158.2 Å²	158.2	79%	0.785	82%	0.818	S	S	*	*			trans	-65.8	115.7	169.7	-88.8	158	0	0	0	109.3	F660	L658-F660 HydrophobicContact CB-CD2 4.33Å; L658-F660 HydrophobicContact CB-CE2 3.97Å; L658-F660 HydrophobicContact CD1-CE2 4.35Å; L658-F660 HydrophobicContact CD2-CE2 4.32Å; L658-F660 HydrophobicContact CD2-CZ 4.47Å; L658-F660 HydrophobicContact CG-CE2 4.45Å
659	V	26.5	Very low	29.2	Very low	107 Å²	107	159.1 Å²	159.1	65%	0.648	81%	0.812	S	S	*	*			trans	-73.9	136.8	158.7	178.3	0	0	0	0	107.2	P657	P657-V659 PolarHBondContact O-N 3.14Å
660	F	29.1	Very low	29	Very low	175 Å²	175	162.8 Å²	162.8	77%	0.768	82%	0.823	S	S	*	*			trans	-125.3	126.7	157.4	-77.4	-83.7	0	0	0	105.7	L658	L658-F660 HydrophobicContact CB-CD2 4.33Å; L658-F660 HydrophobicContact CB-CE2 3.97Å; L658-F660 HydrophobicContact CD1-CE2 4.35Å; L658-F660 HydrophobicContact CD2-CE2 4.32Å; L658-F660 HydrophobicContact CD2-CZ 4.47Å; L658-F660 HydrophobicContact CG-CE2 4.45Å
661	D	28.7	Very low	29.2	Very low	141 Å²	141	155.6 Å²	155.6	75%	0.754	81%	0.813	S	S	*	*			trans	-77.8	150.1	174.2	-67.9	-62.8	0	0	0	110.8
662	L	28.5	Very low	29	Very low	251 Å²	251	158.6 Å²	158.6	100%	1.314	82%	0.819	S	S	*	*			trans	69.7	0	180	-53.6	173.8	0	0	0	115.5

Retrieved 662 of 662 residues in 159 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).